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 2zj9_1_A DATA FIRST_RESID 4 DATA SEQUENCE APQQINDIVH RTITPLIEQQ KIPGMAVAVI YQGKPYYFTW GYADIAKKQP DATA SEQUENCE VTQQTLFELG SVSKTFTGVL GGDAIARGEI KLSDPTTKYW PELTAKQWNG DATA SEQUENCE ITLLHLATYT AGGLPLQVPD EVKSSSDLLR FYQNWQPAWA PGTQRLYANS DATA SEQUENCE SIGLFGALAV KPSGLSFEQA MKTRVFQPLK LNHTWINVPS AEEKNYAWGY DATA SEQUENCE REGKAVHVSP RALDAEAYGV KSTIEDMARW VQSNLKPLDI NEKTLQQGIQ DATA SEQUENCE LAQSRYWQTG DMYQGLGWEM LDWPVNPDII INXXXNKIAL AARPVKPITP DATA SEQUENCE PTPAVRASWV HKTGATGGFG SYVAFIPEKE LGIVMLANKN YPNPARVAAA DATA SEQUENCE WQILNALQ 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 4 A HA 0.000 4.320 4.320 0.000 0.000 0.244 4 A C 0.000 177.455 177.584 -0.214 0.000 1.274 4 A CA 0.000 51.951 52.037 -0.144 0.000 0.836 4 A CB 0.000 18.956 19.000 -0.073 0.000 0.831 5 P HA 0.013 4.433 4.420 0.000 0.000 0.264 5 P C 0.682 177.840 177.300 -0.237 0.000 1.179 5 P CA 0.145 63.055 63.100 -0.317 0.000 0.763 5 P CB 0.564 31.984 31.700 -0.467 0.000 0.806 6 Q N 2.576 122.283 119.800 -0.155 0.000 2.096 6 Q HA -0.263 4.057 4.340 -0.034 0.000 0.204 6 Q C 1.456 177.379 176.000 -0.128 0.000 0.982 6 Q CA 2.108 57.845 55.803 -0.110 0.000 0.850 6 Q CB -0.093 28.599 28.738 -0.075 0.000 0.901 6 Q HN 0.470 8.740 8.270 0.000 0.000 0.422 7 Q N 0.084 119.780 119.800 -0.173 0.000 2.135 7 Q HA -0.095 4.225 4.340 -0.034 0.000 0.204 7 Q C 2.119 177.997 176.000 -0.204 0.000 0.981 7 Q CA 1.723 57.419 55.803 -0.178 0.000 0.856 7 Q CB -0.161 28.450 28.738 -0.212 0.000 0.902 7 Q HN 0.456 8.726 8.270 0.000 0.000 0.425 8 I N 0.112 120.515 120.570 -0.278 0.000 2.193 8 I HA -0.238 3.912 4.170 -0.034 0.000 0.240 8 I C 1.767 177.798 176.117 -0.143 0.000 1.084 8 I CA 0.928 62.099 61.300 -0.215 0.000 1.365 8 I CB -0.434 37.421 38.000 -0.241 0.000 1.064 8 I HN 0.267 8.477 8.210 0.000 0.000 0.410 9 N N 1.123 119.775 118.700 -0.081 0.000 2.036 9 N HA -0.307 4.413 4.740 -0.034 0.000 0.199 9 N C 1.609 177.086 175.510 -0.056 0.000 1.036 9 N CA 2.049 55.071 53.050 -0.047 0.000 0.870 9 N CB -0.302 38.173 38.487 -0.020 0.000 1.055 9 N HN 0.531 8.911 8.380 0.000 0.000 0.436 10 D N 0.923 121.294 120.400 -0.048 0.000 2.144 10 D HA -0.142 4.478 4.640 -0.034 0.000 0.200 10 D C 1.909 178.213 176.300 0.007 0.000 0.978 10 D CA 0.851 54.850 54.000 -0.002 0.000 0.833 10 D CB -0.307 40.485 40.800 -0.013 0.000 0.961 10 D HN 0.251 8.621 8.370 0.000 0.000 0.470 11 I N 0.504 121.047 120.570 -0.045 0.000 2.406 11 I HA -0.142 4.008 4.170 -0.034 0.000 0.249 11 I C 2.350 178.435 176.117 -0.054 0.000 1.122 11 I CA 0.573 61.848 61.300 -0.042 0.000 1.431 11 I CB -0.113 37.855 38.000 -0.052 0.000 1.087 11 I HN -0.131 8.079 8.210 0.000 0.000 0.424 12 V N 0.281 120.128 119.914 -0.113 0.000 2.295 12 V HA -0.330 3.770 4.120 -0.034 0.000 0.246 12 V C 2.530 178.607 176.094 -0.029 0.000 1.049 12 V CA 2.347 64.554 62.300 -0.154 0.000 1.024 12 V CB -1.084 30.415 31.823 -0.539 0.000 0.648 12 V HN 0.573 8.763 8.190 0.000 0.000 0.447 13 H N 0.416 119.445 119.070 -0.069 0.000 2.352 13 H HA -0.145 4.391 4.556 -0.034 0.000 0.299 13 H C 2.430 177.762 175.328 0.007 0.000 1.097 13 H CA 2.116 58.180 56.048 0.028 0.000 1.311 13 H CB -0.087 29.688 29.762 0.021 0.000 1.377 13 H HN 0.190 8.470 8.280 0.000 0.000 0.504 14 R N -1.056 119.409 120.500 -0.059 0.000 2.189 14 R HA -0.036 4.284 4.340 -0.034 0.000 0.218 14 R C 1.381 177.613 176.300 -0.114 0.000 1.074 14 R CA 1.543 57.582 56.100 -0.103 0.000 0.991 14 R CB 0.269 30.562 30.300 -0.011 0.000 0.883 14 R HN 0.390 8.660 8.270 0.000 0.000 0.457 15 T N 0.139 114.633 114.554 -0.099 0.000 3.045 15 T HA 0.107 4.437 4.350 -0.034 0.000 0.239 15 T C 1.605 176.214 174.700 -0.151 0.000 1.008 15 T CA 0.204 62.253 62.100 -0.086 0.000 1.143 15 T CB 0.225 69.071 68.868 -0.036 0.000 0.894 15 T HN -0.009 8.231 8.240 0.000 0.000 0.451 16 I N 2.128 122.570 120.570 -0.213 0.000 2.406 16 I HA -0.046 4.104 4.170 -0.034 0.000 0.249 16 I C 2.555 178.370 176.117 -0.503 0.000 1.122 16 I CA 1.252 62.306 61.300 -0.411 0.000 1.431 16 I CB -1.804 35.792 38.000 -0.674 0.000 1.087 16 I HN 0.240 8.450 8.210 0.000 0.000 0.424 17 T N 2.345 116.670 114.554 -0.382 0.000 2.652 17 T HA -0.104 4.226 4.350 -0.034 0.000 0.267 17 T C -0.250 174.298 174.700 -0.253 0.000 1.039 17 T CA 1.725 63.638 62.100 -0.312 0.000 1.153 17 T CB -1.437 67.281 68.868 -0.249 0.000 0.863 17 T HN 0.215 8.455 8.240 0.000 0.000 0.428 18 P HA -0.045 4.375 4.420 0.000 0.000 0.215 18 P C 1.673 178.877 177.300 -0.161 0.000 1.153 18 P CA 0.582 63.590 63.100 -0.153 0.000 0.853 18 P CB -0.201 31.428 31.700 -0.118 0.000 0.788 19 L N -0.656 120.449 121.223 -0.197 0.000 2.012 19 L HA -0.170 4.150 4.340 -0.034 0.000 0.210 19 L C 2.220 178.926 176.870 -0.274 0.000 1.073 19 L CA 1.828 56.542 54.840 -0.209 0.000 0.748 19 L CB -1.230 40.697 42.059 -0.220 0.000 0.891 19 L HN -0.128 8.102 8.230 0.000 0.000 0.431 20 I N -0.657 119.715 120.570 -0.331 0.000 2.226 20 I HA -0.301 3.849 4.170 -0.034 0.000 0.245 20 I C 2.530 178.531 176.117 -0.193 0.000 1.100 20 I CA 1.640 62.757 61.300 -0.305 0.000 1.374 20 I CB -0.290 37.500 38.000 -0.349 0.000 1.057 20 I HN 0.410 8.620 8.210 0.000 0.000 0.413 21 E N 0.603 120.710 120.200 -0.156 0.000 2.047 21 E HA -0.265 4.064 4.350 -0.034 0.000 0.191 21 E C 2.241 178.790 176.600 -0.085 0.000 0.987 21 E CA 1.287 57.630 56.400 -0.096 0.000 0.799 21 E CB 0.045 29.698 29.700 -0.078 0.000 0.752 21 E HN 0.470 8.830 8.360 0.000 0.000 0.449 22 Q N -0.469 119.274 119.800 -0.095 0.000 2.084 22 Q HA -0.154 4.166 4.340 -0.034 0.000 0.202 22 Q C 1.867 177.828 176.000 -0.065 0.000 0.978 22 Q CA 1.120 56.882 55.803 -0.068 0.000 0.844 22 Q CB 0.118 28.819 28.738 -0.062 0.000 0.898 22 Q HN 0.235 8.505 8.270 0.000 0.000 0.426 23 Q N 0.103 119.837 119.800 -0.110 0.000 2.319 23 Q HA 0.080 4.400 4.340 -0.034 0.000 0.202 23 Q C -0.421 175.527 176.000 -0.088 0.000 0.896 23 Q CA 0.134 55.876 55.803 -0.101 0.000 0.942 23 Q CB 0.689 29.295 28.738 -0.219 0.000 1.083 23 Q HN 0.297 8.568 8.270 0.000 0.000 0.510 24 K N 0.839 121.186 120.400 -0.087 0.000 3.148 24 K HA -0.187 4.113 4.320 -0.034 0.000 0.267 24 K C -0.430 176.132 176.600 -0.063 0.000 0.996 24 K CA 0.323 56.573 56.287 -0.061 0.000 0.737 24 K CB -2.112 30.368 32.500 -0.033 0.000 1.308 24 K HN 0.268 8.518 8.250 0.000 0.000 0.470 25 I N 1.046 121.550 120.570 -0.111 0.000 2.471 25 I HA 0.014 4.163 4.170 -0.034 0.000 0.286 25 I C -0.907 175.205 176.117 -0.010 0.000 1.079 25 I CA -2.051 59.198 61.300 -0.085 0.000 1.398 25 I CB 0.809 38.683 38.000 -0.210 0.000 1.403 25 I HN 0.018 8.228 8.210 0.000 0.000 0.530 26 P HA 0.019 4.439 4.420 0.000 0.000 0.217 26 P C 0.305 177.696 177.300 0.151 0.000 1.151 26 P CA 0.475 63.614 63.100 0.064 0.000 0.828 26 P CB 0.326 32.016 31.700 -0.017 0.000 0.788 27 G N -1.177 107.754 108.800 0.220 0.000 2.746 27 G HA2 0.663 4.603 3.960 -0.034 0.000 0.297 27 G HA3 0.663 4.603 3.960 -0.034 0.000 0.297 27 G C -1.915 173.226 174.900 0.402 0.000 1.426 27 G CA -0.331 44.958 45.100 0.315 0.000 0.989 27 G HN 0.015 8.305 8.290 0.000 0.000 0.520 28 M N 1.281 121.141 119.600 0.432 0.000 2.470 28 M HA 0.728 5.188 4.480 -0.034 0.000 0.285 28 M C -1.315 175.282 176.300 0.495 0.000 1.213 28 M CA -0.671 54.852 55.300 0.372 0.000 0.901 28 M CB 2.382 35.083 32.600 0.168 0.000 1.718 28 M HN 0.924 9.214 8.290 0.000 0.000 0.469 29 A N 3.227 126.205 122.820 0.263 0.000 2.371 29 A HA 0.857 5.157 4.320 -0.034 0.000 0.311 29 A C -1.698 176.087 177.584 0.335 0.000 1.068 29 A CA -0.598 51.632 52.037 0.322 0.000 0.744 29 A CB 1.670 20.784 19.000 0.190 0.000 1.239 29 A HN 0.596 8.746 8.150 0.000 0.000 0.435 30 V N 0.942 121.171 119.914 0.525 0.000 2.735 30 V HA 0.800 4.900 4.120 -0.034 0.000 0.310 30 V C 0.137 176.532 176.094 0.502 0.000 1.061 30 V CA -0.271 62.328 62.300 0.499 0.000 0.913 30 V CB 1.848 34.032 31.823 0.601 0.000 1.005 30 V HN 1.383 9.573 8.190 0.000 0.000 0.428 31 A N 3.832 126.885 122.820 0.388 0.000 2.343 31 A HA 0.883 5.183 4.320 -0.034 0.000 0.316 31 A C -1.039 176.704 177.584 0.264 0.000 1.104 31 A CA -0.555 51.665 52.037 0.305 0.000 0.768 31 A CB 1.698 20.856 19.000 0.263 0.000 1.213 31 A HN 0.674 8.824 8.150 0.000 0.000 0.456 32 V N 4.027 124.104 119.914 0.272 0.000 2.417 32 V HA 0.360 4.460 4.120 -0.034 0.000 0.291 32 V C -0.471 175.739 176.094 0.192 0.000 1.024 32 V CA -0.526 61.930 62.300 0.261 0.000 0.861 32 V CB 1.423 33.452 31.823 0.342 0.000 0.985 32 V HN 0.704 8.894 8.190 0.000 0.000 0.436 33 I N 5.393 126.039 120.570 0.127 0.000 2.312 33 I HA 0.374 4.524 4.170 -0.034 0.000 0.290 33 I C -0.773 175.445 176.117 0.168 0.000 1.008 33 I CA -0.419 60.917 61.300 0.060 0.000 1.226 33 I CB 0.824 38.800 38.000 -0.040 0.000 1.371 33 I HN 0.694 8.904 8.210 0.000 0.000 0.468 34 Y N 5.999 126.358 120.300 0.098 0.000 2.346 34 Y HA 0.274 4.811 4.550 -0.022 0.000 0.332 34 Y C 0.440 176.393 175.900 0.089 0.000 0.985 34 Y CA -0.615 57.555 58.100 0.116 0.000 1.112 34 Y CB 1.246 39.826 38.460 0.201 0.000 1.170 34 Y HN 0.677 8.957 8.280 0.000 0.000 0.447 35 Q N 4.571 124.072 119.800 -0.498 0.000 2.435 35 Q HA -0.274 4.046 4.340 -0.034 0.000 0.286 35 Q C 1.097 177.001 176.000 -0.162 0.000 1.229 35 Q CA 1.227 56.817 55.803 -0.354 0.000 0.884 35 Q CB -1.693 26.814 28.738 -0.385 0.000 1.245 35 Q HN 1.430 9.700 8.270 0.000 0.000 0.488 36 G N -0.594 108.125 108.800 -0.135 0.000 2.184 36 G HA2 -0.340 3.600 3.960 -0.034 0.000 0.264 36 G HA3 -0.340 3.600 3.960 -0.034 0.000 0.264 36 G C 0.033 174.862 174.900 -0.118 0.000 0.975 36 G CA 0.759 45.785 45.100 -0.123 0.000 0.642 36 G HN 0.313 8.603 8.290 0.000 0.000 0.536 37 K N 1.344 121.681 120.400 -0.104 0.000 2.164 37 K HA 0.541 4.840 4.320 -0.034 0.000 0.258 37 K C -2.634 173.703 176.600 -0.439 0.000 0.951 37 K CA -1.967 54.182 56.287 -0.231 0.000 0.844 37 K CB 2.780 35.158 32.500 -0.204 0.000 1.099 37 K HN 0.069 8.319 8.250 0.000 0.000 0.435 38 P HA 0.226 4.646 4.420 0.000 0.000 0.286 38 P C -1.494 175.056 177.300 -1.251 0.000 1.261 38 P CA -0.420 62.255 63.100 -0.708 0.000 0.821 38 P CB 0.617 31.979 31.700 -0.563 0.000 1.013 39 Y N 1.011 120.990 120.300 -0.536 0.000 2.406 39 Y HA 0.442 4.969 4.550 -0.038 0.000 0.340 39 Y C -0.186 175.276 175.900 -0.730 0.000 0.975 39 Y CA -0.646 57.108 58.100 -0.576 0.000 1.056 39 Y CB 1.826 40.147 38.460 -0.232 0.000 1.210 39 Y HN 0.272 8.552 8.280 0.000 0.000 0.448 40 Y N 2.590 122.656 120.300 -0.391 0.000 2.409 40 Y HA 0.684 5.215 4.550 -0.031 0.000 0.339 40 Y C -0.948 174.487 175.900 -0.776 0.000 1.033 40 Y CA -1.721 56.169 58.100 -0.350 0.000 1.094 40 Y CB 1.272 39.624 38.460 -0.181 0.000 1.210 40 Y HN 0.391 8.671 8.280 0.000 0.000 0.456 41 F N 0.257 120.305 119.950 0.163 0.000 2.569 41 F HA 0.656 5.163 4.527 -0.035 0.000 0.312 41 F C -0.348 175.314 175.800 -0.231 0.000 1.109 41 F CA -0.937 56.967 58.000 -0.161 0.000 0.919 41 F CB 2.525 41.399 39.000 -0.209 0.000 1.211 41 F HN 0.406 8.706 8.300 0.000 0.000 0.446 42 T N -1.408 112.946 114.554 -0.334 0.000 2.909 42 T HA 0.623 4.953 4.350 -0.034 0.000 0.299 42 T C -1.559 172.968 174.700 -0.288 0.000 1.073 42 T CA -0.760 61.292 62.100 -0.080 0.000 0.999 42 T CB 1.745 70.647 68.868 0.056 0.000 1.098 42 T HN 0.602 8.842 8.240 0.000 0.000 0.477 43 W N 0.607 121.976 121.300 0.115 0.000 3.032 43 W HA 0.522 5.161 4.660 -0.035 0.000 0.335 43 W C 0.830 177.332 176.519 -0.029 0.000 1.154 43 W CA -0.195 57.171 57.345 0.035 0.000 1.204 43 W CB 1.855 31.337 29.460 0.035 0.000 1.416 43 W HN 1.411 9.591 8.180 0.000 0.000 0.521 44 G N 1.460 110.269 108.800 0.015 0.000 2.562 44 G HA2 -0.295 3.644 3.960 -0.034 0.000 0.250 44 G HA3 -0.295 3.644 3.960 -0.034 0.000 0.250 44 G C -1.715 172.954 174.900 -0.385 0.000 1.269 44 G CA -0.310 44.616 45.100 -0.290 0.000 0.919 44 G HN 0.538 8.828 8.290 0.000 0.000 0.574 45 Y N -0.079 120.325 120.300 0.174 0.000 2.376 45 Y HA 0.600 5.130 4.550 -0.033 0.000 0.340 45 Y C 1.240 177.259 175.900 0.198 0.000 0.965 45 Y CA -0.178 58.015 58.100 0.154 0.000 1.078 45 Y CB 2.036 40.557 38.460 0.100 0.000 1.193 45 Y HN 0.851 9.131 8.280 0.000 0.000 0.452 46 A N 0.982 124.006 122.820 0.340 0.000 2.016 46 A HA -0.045 4.255 4.320 -0.034 0.000 0.217 46 A C 0.289 178.080 177.584 0.344 0.000 1.162 46 A CA 1.258 53.448 52.037 0.255 0.000 0.662 46 A CB 0.047 19.119 19.000 0.121 0.000 0.812 46 A HN 0.666 8.816 8.150 0.000 0.000 0.450 47 D N -1.034 119.581 120.400 0.358 0.000 2.542 47 D HA 0.427 5.046 4.640 -0.034 0.000 0.252 47 D C 0.583 177.015 176.300 0.220 0.000 1.222 47 D CA -0.438 53.800 54.000 0.396 0.000 0.895 47 D CB 0.970 41.953 40.800 0.305 0.000 1.207 47 D HN 0.122 8.492 8.370 0.000 0.000 0.558 48 I N 2.379 123.046 120.570 0.160 0.000 2.202 48 I HA -0.185 3.964 4.170 -0.034 0.000 0.242 48 I C 2.463 178.462 176.117 -0.198 0.000 1.091 48 I CA 1.114 62.328 61.300 -0.144 0.000 1.368 48 I CB -0.002 37.801 38.000 -0.329 0.000 1.058 48 I HN 0.462 8.672 8.210 0.000 0.000 0.410 49 A N 0.640 123.420 122.820 -0.067 0.000 1.902 49 A HA -0.196 4.104 4.320 -0.034 0.000 0.217 49 A C 2.168 179.707 177.584 -0.076 0.000 1.181 49 A CA 1.609 53.604 52.037 -0.070 0.000 0.623 49 A CB -0.373 18.613 19.000 -0.023 0.000 0.818 49 A HN 0.350 8.500 8.150 0.000 0.000 0.443 50 K N -0.699 119.683 120.400 -0.031 0.000 2.404 50 K HA 0.113 4.413 4.320 -0.034 0.000 0.194 50 K C -0.453 176.106 176.600 -0.067 0.000 1.023 50 K CA 0.028 56.304 56.287 -0.018 0.000 1.094 50 K CB 0.166 32.697 32.500 0.051 0.000 0.841 50 K HN 0.403 8.653 8.250 0.000 0.000 0.523 51 K N 1.852 122.119 120.400 -0.222 0.000 3.156 51 K HA -0.178 4.122 4.320 -0.034 0.000 0.266 51 K C -0.790 175.822 176.600 0.020 0.000 0.966 51 K CA 0.484 56.495 56.287 -0.461 0.000 0.719 51 K CB -0.967 31.291 32.500 -0.403 0.000 1.333 51 K HN 0.185 8.435 8.250 0.000 0.000 0.468 52 Q N 0.164 120.055 119.800 0.151 0.000 2.337 52 Q HA 0.232 4.552 4.340 -0.034 0.000 0.255 52 Q C -2.375 173.839 176.000 0.357 0.000 0.997 52 Q CA -2.088 53.849 55.803 0.222 0.000 0.925 52 Q CB 0.938 29.767 28.738 0.153 0.000 1.212 52 Q HN 0.096 8.366 8.270 0.000 0.000 0.436 53 P HA 0.005 4.425 4.420 0.000 0.000 0.271 53 P C -0.251 177.146 177.300 0.160 0.000 1.218 53 P CA -0.265 62.957 63.100 0.203 0.000 0.780 53 P CB 0.633 32.400 31.700 0.111 0.000 0.901 54 V N 2.740 122.747 119.914 0.155 0.000 2.599 54 V HA 0.186 4.286 4.120 -0.034 0.000 0.300 54 V C 1.038 177.218 176.094 0.142 0.000 1.034 54 V CA 0.777 63.195 62.300 0.196 0.000 1.115 54 V CB 0.081 32.105 31.823 0.334 0.000 0.934 54 V HN 0.787 8.977 8.190 0.000 0.000 0.485 55 T N 1.424 116.054 114.554 0.126 0.000 2.858 55 T HA 0.358 4.688 4.350 -0.034 0.000 0.285 55 T C 0.495 175.233 174.700 0.063 0.000 1.052 55 T CA -0.726 61.413 62.100 0.065 0.000 1.009 55 T CB 1.641 70.521 68.868 0.021 0.000 1.241 55 T HN 0.452 8.692 8.240 0.000 0.000 0.542 56 Q N -0.454 119.328 119.800 -0.030 0.000 2.437 56 Q HA -0.044 4.275 4.340 -0.034 0.000 0.210 56 Q C 1.441 177.375 176.000 -0.110 0.000 0.972 56 Q CA 1.122 56.853 55.803 -0.120 0.000 0.903 56 Q CB -0.092 28.476 28.738 -0.284 0.000 0.967 56 Q HN 0.572 8.842 8.270 0.000 0.000 0.486 57 Q N -0.846 118.908 119.800 -0.077 0.000 2.282 57 Q HA 0.087 4.407 4.340 -0.034 0.000 0.206 57 Q C -0.138 175.844 176.000 -0.029 0.000 0.878 57 Q CA 0.219 55.956 55.803 -0.110 0.000 0.944 57 Q CB 0.982 29.636 28.738 -0.139 0.000 1.100 57 Q HN 0.063 8.333 8.270 0.000 0.000 0.509 58 T N 1.322 115.899 114.554 0.039 0.000 2.902 58 T HA 0.165 4.495 4.350 -0.034 0.000 0.301 58 T C -0.028 174.690 174.700 0.030 0.000 1.012 58 T CA 0.137 62.244 62.100 0.012 0.000 1.151 58 T CB 0.233 69.098 68.868 -0.005 0.000 0.946 58 T HN 0.141 8.381 8.240 0.000 0.000 0.542 59 L N 4.008 125.198 121.223 -0.054 0.000 2.292 59 L HA 0.533 4.853 4.340 -0.034 0.000 0.284 59 L C -0.461 176.332 176.870 -0.129 0.000 1.065 59 L CA -0.533 54.284 54.840 -0.039 0.000 0.806 59 L CB 0.471 42.442 42.059 -0.146 0.000 1.175 59 L HN 0.537 8.767 8.230 0.000 0.000 0.431 60 F N 0.398 120.354 119.950 0.010 0.000 2.561 60 F HA 0.379 4.886 4.527 -0.033 0.000 0.321 60 F C 0.347 175.903 175.800 -0.406 0.000 1.065 60 F CA -0.867 57.106 58.000 -0.045 0.000 0.934 60 F CB 1.525 40.652 39.000 0.211 0.000 1.215 60 F HN 0.389 8.689 8.300 0.000 0.000 0.471 61 E N 2.302 122.009 120.200 -0.823 0.000 2.316 61 E HA 0.195 4.525 4.350 -0.034 0.000 0.275 61 E C 0.370 176.912 176.600 -0.098 0.000 1.029 61 E CA -0.077 56.030 56.400 -0.490 0.000 0.871 61 E CB 0.980 30.324 29.700 -0.594 0.000 1.022 61 E HN 0.605 8.965 8.360 0.000 0.000 0.418 62 L N 2.674 123.901 121.223 0.007 0.000 2.446 62 L HA 0.106 4.426 4.340 -0.034 0.000 0.219 62 L C 1.376 178.344 176.870 0.163 0.000 1.116 62 L CA 0.452 55.360 54.840 0.114 0.000 0.844 62 L CB -0.696 41.427 42.059 0.107 0.000 0.970 62 L HN 0.909 9.139 8.230 0.000 0.000 0.457 63 G N 0.446 109.346 108.800 0.168 0.000 2.582 63 G HA2 -0.379 3.561 3.960 -0.034 0.000 0.288 63 G HA3 -0.379 3.561 3.960 -0.034 0.000 0.288 63 G C 0.798 175.845 174.900 0.244 0.000 1.247 63 G CA 0.309 45.538 45.100 0.215 0.000 0.972 63 G HN 0.182 8.472 8.290 0.000 0.000 0.557 64 S N -0.183 115.658 115.700 0.234 0.000 2.500 64 S HA 0.002 4.452 4.470 -0.034 0.000 0.239 64 S C 2.394 177.121 174.600 0.213 0.000 0.989 64 S CA 1.365 59.718 58.200 0.256 0.000 0.951 64 S CB -0.158 63.230 63.200 0.312 0.000 0.759 64 S HN 0.779 9.089 8.310 0.000 0.000 0.523 65 V N 1.574 121.602 119.914 0.190 0.000 2.720 65 V HA -0.140 3.960 4.120 -0.034 0.000 0.256 65 V C 2.155 178.369 176.094 0.199 0.000 1.082 65 V CA 1.459 63.851 62.300 0.155 0.000 1.101 65 V CB -0.853 31.085 31.823 0.192 0.000 0.693 65 V HN 0.451 8.641 8.190 0.000 0.000 0.479 66 S N -0.144 115.699 115.700 0.239 0.000 2.419 66 S HA -0.241 4.209 4.470 -0.034 0.000 0.235 66 S C 1.916 176.686 174.600 0.283 0.000 1.019 66 S CA 1.356 59.729 58.200 0.289 0.000 0.982 66 S CB -0.287 63.017 63.200 0.173 0.000 0.789 66 S HN 0.647 8.957 8.310 0.000 0.000 0.490 67 K N 0.901 121.420 120.400 0.198 0.000 2.209 67 K HA -0.102 4.198 4.320 -0.034 0.000 0.204 67 K C 2.469 179.109 176.600 0.067 0.000 1.048 67 K CA 1.571 57.959 56.287 0.169 0.000 0.940 67 K CB -0.489 32.139 32.500 0.213 0.000 0.729 67 K HN 0.630 8.880 8.250 0.000 0.000 0.451 68 T N -1.079 113.413 114.554 -0.102 0.000 2.821 68 T HA -0.118 4.212 4.350 -0.034 0.000 0.267 68 T C 1.756 176.448 174.700 -0.015 0.000 1.046 68 T CA 0.870 62.732 62.100 -0.396 0.000 1.139 68 T CB -0.382 67.851 68.868 -1.059 0.000 0.871 68 T HN 0.032 8.272 8.240 0.000 0.000 0.454 69 F N 2.184 122.166 119.950 0.054 0.000 2.146 69 F HA 0.033 4.540 4.527 -0.033 0.000 0.298 69 F C 3.052 178.908 175.800 0.094 0.000 1.096 69 F CA 1.431 59.423 58.000 -0.013 0.000 1.275 69 F CB -1.193 37.693 39.000 -0.191 0.000 1.008 69 F HN 0.131 8.431 8.300 0.000 0.000 0.480 70 T N -0.462 114.298 114.554 0.343 0.000 2.720 70 T HA -0.174 4.155 4.350 -0.034 0.000 0.268 70 T C 2.354 177.259 174.700 0.341 0.000 1.037 70 T CA 1.497 63.817 62.100 0.367 0.000 1.144 70 T CB -1.096 67.989 68.868 0.362 0.000 0.864 70 T HN 0.455 8.695 8.240 0.000 0.000 0.444 71 G N 0.836 109.790 108.800 0.257 0.000 2.418 71 G HA2 -0.158 3.781 3.960 -0.034 0.000 0.217 71 G HA3 -0.158 3.781 3.960 -0.034 0.000 0.217 71 G C 1.706 176.763 174.900 0.261 0.000 1.158 71 G CA 0.801 46.038 45.100 0.228 0.000 0.771 71 G HN 0.441 8.731 8.290 0.000 0.000 0.545 72 V N 0.611 120.689 119.914 0.275 0.000 2.358 72 V HA -0.099 4.001 4.120 -0.034 0.000 0.246 72 V C 2.667 178.885 176.094 0.207 0.000 1.047 72 V CA 1.492 63.964 62.300 0.286 0.000 1.035 72 V CB -0.354 31.732 31.823 0.440 0.000 0.658 72 V HN 0.343 8.533 8.190 0.000 0.000 0.452 73 L N 1.451 122.773 121.223 0.165 0.000 2.012 73 L HA -0.065 4.255 4.340 -0.034 0.000 0.210 73 L C 2.361 179.260 176.870 0.050 0.000 1.073 73 L CA 2.507 57.369 54.840 0.038 0.000 0.748 73 L CB -1.361 40.646 42.059 -0.086 0.000 0.891 73 L HN 0.277 8.507 8.230 0.000 0.000 0.431 74 G N -1.176 107.715 108.800 0.152 0.000 2.440 74 G HA2 -0.236 3.704 3.960 -0.034 0.000 0.218 74 G HA3 -0.236 3.704 3.960 -0.034 0.000 0.218 74 G C 1.522 176.541 174.900 0.198 0.000 1.154 74 G CA 0.650 45.868 45.100 0.196 0.000 0.767 74 G HN 0.613 8.903 8.290 0.000 0.000 0.552 75 G N 0.645 109.568 108.800 0.204 0.000 2.421 75 G HA2 -0.247 3.693 3.960 -0.034 0.000 0.216 75 G HA3 -0.247 3.693 3.960 -0.034 0.000 0.216 75 G C 1.446 176.410 174.900 0.107 0.000 1.171 75 G CA 1.385 46.583 45.100 0.162 0.000 0.775 75 G HN 0.515 8.805 8.290 0.000 0.000 0.543 76 D N 0.541 120.992 120.400 0.085 0.000 2.123 76 D HA -0.000 4.620 4.640 -0.034 0.000 0.196 76 D C 2.657 178.969 176.300 0.019 0.000 0.992 76 D CA 1.535 55.562 54.000 0.045 0.000 0.833 76 D CB -0.266 40.551 40.800 0.028 0.000 0.954 76 D HN 0.255 8.625 8.370 0.000 0.000 0.455 77 A N -0.030 122.792 122.820 0.004 0.000 1.933 77 A HA -0.110 4.190 4.320 -0.034 0.000 0.218 77 A C 2.319 179.907 177.584 0.007 0.000 1.175 77 A CA 1.193 53.216 52.037 -0.023 0.000 0.628 77 A CB -0.762 18.190 19.000 -0.079 0.000 0.814 77 A HN 0.395 8.545 8.150 0.000 0.000 0.444 78 I N -0.224 120.371 120.570 0.042 0.000 2.179 78 I HA -0.256 3.894 4.170 -0.034 0.000 0.242 78 I C 2.922 179.069 176.117 0.049 0.000 1.088 78 I CA 1.122 62.458 61.300 0.060 0.000 1.357 78 I CB -0.311 37.746 38.000 0.095 0.000 1.051 78 I HN 0.325 8.535 8.210 0.000 0.000 0.409 79 A N 0.562 123.411 122.820 0.048 0.000 2.019 79 A HA -0.170 4.130 4.320 -0.034 0.000 0.219 79 A C 2.314 179.912 177.584 0.023 0.000 1.164 79 A CA 1.337 53.395 52.037 0.036 0.000 0.644 79 A CB -0.561 18.461 19.000 0.037 0.000 0.805 79 A HN 0.336 8.486 8.150 0.000 0.000 0.449 80 R N -1.429 119.081 120.500 0.016 0.000 2.307 80 R HA 0.111 4.431 4.340 -0.034 0.000 0.199 80 R C 1.360 177.667 176.300 0.012 0.000 1.000 80 R CA 0.545 56.649 56.100 0.007 0.000 1.023 80 R CB -0.220 30.077 30.300 -0.006 0.000 0.908 80 R HN 0.688 8.958 8.270 0.000 0.000 0.473 81 G N 1.042 109.855 108.800 0.022 0.000 2.153 81 G HA2 -0.323 3.617 3.960 -0.034 0.000 0.252 81 G HA3 -0.323 3.617 3.960 -0.034 0.000 0.252 81 G C 0.504 175.424 174.900 0.034 0.000 0.994 81 G CA 0.651 45.769 45.100 0.030 0.000 0.698 81 G HN 0.452 8.742 8.290 0.000 0.000 0.521 82 E N -0.631 119.583 120.200 0.024 0.000 2.158 82 E HA 0.224 4.554 4.350 -0.034 0.000 0.191 82 E C 1.511 178.145 176.600 0.057 0.000 0.982 82 E CA 1.163 57.578 56.400 0.025 0.000 0.823 82 E CB 0.131 29.823 29.700 -0.013 0.000 0.766 82 E HN 0.908 9.268 8.360 0.000 0.000 0.468 83 I N -2.703 117.893 120.570 0.043 0.000 3.095 83 I HA 0.491 4.641 4.170 -0.034 0.000 0.310 83 I C -1.335 174.841 176.117 0.097 0.000 1.196 83 I CA -1.270 60.076 61.300 0.076 0.000 0.985 83 I CB 2.281 40.228 38.000 -0.088 0.000 1.250 83 I HN -0.352 7.858 8.210 0.000 0.000 0.446 84 K N 2.709 123.193 120.400 0.141 0.000 2.371 84 K HA 0.519 4.819 4.320 -0.034 0.000 0.251 84 K C 0.085 176.765 176.600 0.134 0.000 0.934 84 K CA -0.788 55.572 56.287 0.120 0.000 0.798 84 K CB 2.929 35.494 32.500 0.109 0.000 1.204 84 K HN 0.601 8.851 8.250 0.000 0.000 0.427 85 L N 0.968 122.256 121.223 0.109 0.000 2.275 85 L HA -0.165 4.154 4.340 -0.034 0.000 0.215 85 L C 1.997 178.907 176.870 0.067 0.000 1.119 85 L CA 1.284 56.177 54.840 0.087 0.000 0.790 85 L CB -0.264 41.810 42.059 0.025 0.000 0.919 85 L HN 0.721 8.951 8.230 0.000 0.000 0.443 86 S N -2.534 113.210 115.700 0.074 0.000 2.561 86 S HA -0.016 4.434 4.470 -0.034 0.000 0.225 86 S C 0.548 175.211 174.600 0.105 0.000 0.977 86 S CA -0.290 57.949 58.200 0.066 0.000 0.926 86 S CB -0.446 62.790 63.200 0.060 0.000 0.769 86 S HN 0.220 8.530 8.310 0.000 0.000 0.533 87 D N 4.599 125.089 120.400 0.151 0.000 2.455 87 D HA 0.226 4.846 4.640 -0.034 0.000 0.241 87 D C -2.296 174.134 176.300 0.216 0.000 1.138 87 D CA -1.364 52.752 54.000 0.194 0.000 0.877 87 D CB 0.599 41.602 40.800 0.339 0.000 1.187 87 D HN 0.246 8.616 8.370 0.000 0.000 0.451 88 P HA 0.020 4.440 4.420 0.000 0.000 0.271 88 P C 0.639 178.093 177.300 0.256 0.000 1.218 88 P CA -0.253 62.971 63.100 0.208 0.000 0.780 88 P CB 0.732 32.523 31.700 0.153 0.000 0.901 89 T N 1.047 115.791 114.554 0.317 0.000 2.737 89 T HA -0.164 4.166 4.350 -0.034 0.000 0.269 89 T C 1.695 176.527 174.700 0.220 0.000 1.040 89 T CA 2.614 64.905 62.100 0.319 0.000 1.142 89 T CB -1.022 68.063 68.868 0.361 0.000 0.861 89 T HN 0.662 8.902 8.240 0.000 0.000 0.456 90 T N 0.193 114.835 114.554 0.146 0.000 3.007 90 T HA 0.025 4.355 4.350 -0.034 0.000 0.270 90 T C 1.750 176.452 174.700 0.003 0.000 1.107 90 T CA 0.977 63.112 62.100 0.057 0.000 1.118 90 T CB -0.191 68.710 68.868 0.056 0.000 0.889 90 T HN 0.417 8.657 8.240 0.000 0.000 0.506 91 K N 0.266 120.620 120.400 -0.076 0.000 2.097 91 K HA -0.120 4.180 4.320 -0.034 0.000 0.206 91 K C 1.499 177.816 176.600 -0.473 0.000 1.049 91 K CA 1.373 57.464 56.287 -0.327 0.000 0.933 91 K CB -0.244 31.941 32.500 -0.524 0.000 0.717 91 K HN 0.550 8.800 8.250 0.000 0.000 0.442 92 Y N -2.408 117.926 120.300 0.056 0.000 2.503 92 Y HA 0.043 4.573 4.550 -0.033 0.000 0.278 92 Y C 0.514 176.455 175.900 0.069 0.000 1.111 92 Y CA -0.312 57.804 58.100 0.026 0.000 1.270 92 Y CB 0.479 38.931 38.460 -0.013 0.000 1.063 92 Y HN 0.129 8.409 8.280 0.000 0.000 0.548 93 W N 2.097 123.395 121.300 -0.004 0.000 2.387 93 W HA 0.386 5.026 4.660 -0.033 0.000 0.285 93 W C -2.558 173.897 176.519 -0.107 0.000 1.011 93 W CA -3.699 53.602 57.345 -0.073 0.000 1.576 93 W CB 1.001 30.375 29.460 -0.143 0.000 1.540 93 W HN -0.081 8.099 8.180 0.000 0.000 0.383 94 P HA -0.198 4.222 4.420 0.000 0.000 0.219 94 P C 1.110 178.383 177.300 -0.045 0.000 1.146 94 P CA 1.799 64.922 63.100 0.039 0.000 0.808 94 P CB 0.522 32.249 31.700 0.045 0.000 0.779 95 E N -0.912 119.243 120.200 -0.075 0.000 2.409 95 E HA -0.059 4.270 4.350 -0.034 0.000 0.198 95 E C 1.528 177.877 176.600 -0.419 0.000 1.024 95 E CA 0.583 56.848 56.400 -0.224 0.000 0.861 95 E CB -0.814 28.766 29.700 -0.199 0.000 0.788 95 E HN 0.287 8.647 8.360 0.000 0.000 0.521 96 L N 0.537 121.420 121.223 -0.567 0.000 2.599 96 L HA 0.048 4.368 4.340 -0.034 0.000 0.230 96 L C 0.293 176.976 176.870 -0.312 0.000 1.141 96 L CA 0.048 54.482 54.840 -0.677 0.000 0.877 96 L CB -0.298 41.068 42.059 -1.156 0.000 1.009 96 L HN -0.044 8.186 8.230 0.000 0.000 0.447 97 T N 1.812 116.278 114.554 -0.147 0.000 2.778 97 T HA 0.332 4.662 4.350 -0.034 0.000 0.282 97 T C 0.228 174.948 174.700 0.032 0.000 0.983 97 T CA 0.333 62.425 62.100 -0.014 0.000 1.193 97 T CB 0.344 69.207 68.868 -0.007 0.000 0.938 97 T HN 0.422 8.662 8.240 0.000 0.000 0.523 98 A N 3.207 126.097 122.820 0.117 0.000 2.583 98 A HA 0.514 4.814 4.320 -0.034 0.000 0.292 98 A C 0.861 178.525 177.584 0.134 0.000 1.045 98 A CA -0.806 51.305 52.037 0.123 0.000 0.672 98 A CB 0.820 19.919 19.000 0.164 0.000 1.283 98 A HN 0.637 8.787 8.150 0.000 0.000 0.419 99 K N 0.242 120.686 120.400 0.074 0.000 2.103 99 K HA -0.231 4.069 4.320 -0.034 0.000 0.207 99 K C 1.920 178.539 176.600 0.032 0.000 1.048 99 K CA 2.372 58.686 56.287 0.046 0.000 0.930 99 K CB -0.125 32.381 32.500 0.011 0.000 0.716 99 K HN 0.757 9.007 8.250 0.000 0.000 0.444 100 Q N -1.517 118.288 119.800 0.008 0.000 2.369 100 Q HA -0.142 4.177 4.340 -0.034 0.000 0.206 100 Q C 0.959 176.860 176.000 -0.165 0.000 0.963 100 Q CA 1.069 56.797 55.803 -0.124 0.000 0.894 100 Q CB -0.153 28.448 28.738 -0.227 0.000 0.965 100 Q HN 0.398 8.668 8.270 0.000 0.000 0.475 101 W N 1.704 123.026 121.300 0.037 0.000 3.278 101 W HA 0.287 4.927 4.660 -0.034 0.000 0.308 101 W C -0.221 176.354 176.519 0.093 0.000 1.253 101 W CA -0.702 56.703 57.345 0.099 0.000 1.759 101 W CB 0.323 29.836 29.460 0.088 0.000 1.093 101 W HN 0.043 8.223 8.180 0.000 0.000 0.648 102 N N 0.836 119.655 118.700 0.198 0.000 2.365 102 N HA 0.136 4.855 4.740 -0.034 0.000 0.265 102 N C 1.192 176.788 175.510 0.143 0.000 1.288 102 N CA 1.103 54.241 53.050 0.146 0.000 0.869 102 N CB 0.263 38.801 38.487 0.085 0.000 1.071 102 N HN 0.260 8.640 8.380 0.000 0.000 0.480 103 G N 2.608 111.516 108.800 0.180 0.000 2.184 103 G HA2 -0.297 3.643 3.960 -0.034 0.000 0.264 103 G HA3 -0.297 3.643 3.960 -0.034 0.000 0.264 103 G C 0.192 175.269 174.900 0.295 0.000 0.975 103 G CA -0.271 44.953 45.100 0.206 0.000 0.642 103 G HN 0.590 8.880 8.290 0.000 0.000 0.536 104 I N 2.801 123.554 120.570 0.304 0.000 2.363 104 I HA 0.346 4.496 4.170 -0.034 0.000 0.292 104 I C 1.239 177.642 176.117 0.476 0.000 1.075 104 I CA 0.311 61.863 61.300 0.420 0.000 1.333 104 I CB 0.663 38.831 38.000 0.279 0.000 1.415 104 I HN 0.297 8.507 8.210 0.000 0.000 0.502 105 T N 2.871 117.730 114.554 0.508 0.000 2.936 105 T HA 0.460 4.790 4.350 -0.034 0.000 0.282 105 T C 1.226 176.056 174.700 0.215 0.000 1.003 105 T CA -0.898 61.346 62.100 0.239 0.000 1.005 105 T CB 1.545 70.427 68.868 0.024 0.000 1.097 105 T HN 0.412 8.652 8.240 0.000 0.000 0.532 106 L N 0.344 121.694 121.223 0.213 0.000 2.079 106 L HA -0.046 4.274 4.340 -0.034 0.000 0.210 106 L C 2.561 179.496 176.870 0.108 0.000 1.081 106 L CA 0.965 55.966 54.840 0.268 0.000 0.752 106 L CB -0.812 41.435 42.059 0.313 0.000 0.896 106 L HN 0.601 8.831 8.230 0.000 0.000 0.433 107 L N -0.316 120.889 121.223 -0.030 0.000 2.012 107 L HA -0.268 4.052 4.340 -0.034 0.000 0.210 107 L C 2.392 179.222 176.870 -0.067 0.000 1.073 107 L CA 1.990 56.736 54.840 -0.157 0.000 0.748 107 L CB -0.635 41.324 42.059 -0.166 0.000 0.891 107 L HN 0.240 8.470 8.230 0.000 0.000 0.431 108 H N -1.240 117.902 119.070 0.120 0.000 2.353 108 H HA -0.115 4.421 4.556 -0.033 0.000 0.300 108 H C 2.245 177.568 175.328 -0.008 0.000 1.090 108 H CA 1.571 57.676 56.048 0.095 0.000 1.327 108 H CB -0.113 29.726 29.762 0.129 0.000 1.383 108 H HN 0.311 8.591 8.280 0.000 0.000 0.508 109 L N 0.180 121.494 121.223 0.153 0.000 2.012 109 L HA -0.196 4.124 4.340 -0.034 0.000 0.210 109 L C 2.832 179.610 176.870 -0.153 0.000 1.073 109 L CA 0.925 55.813 54.840 0.082 0.000 0.748 109 L CB -0.544 41.646 42.059 0.217 0.000 0.891 109 L HN 0.351 8.581 8.230 0.000 0.000 0.431 110 A N -0.319 122.244 122.820 -0.430 0.000 2.019 110 A HA -0.175 4.125 4.320 -0.034 0.000 0.219 110 A C 2.077 179.218 177.584 -0.738 0.000 1.164 110 A CA 2.143 53.637 52.037 -0.904 0.000 0.644 110 A CB -0.674 17.407 19.000 -1.531 0.000 0.805 110 A HN 0.547 8.697 8.150 0.000 0.000 0.449 111 T N -6.925 107.319 114.554 -0.516 0.000 3.132 111 T HA 0.340 4.670 4.350 -0.034 0.000 0.274 111 T C 0.191 174.675 174.700 -0.359 0.000 1.011 111 T CA 0.239 62.082 62.100 -0.429 0.000 0.899 111 T CB -0.445 68.462 68.868 0.065 0.000 1.089 111 T HN 0.698 8.938 8.240 0.000 0.000 0.543 112 Y N 0.937 121.231 120.300 -0.009 0.000 4.272 112 Y HA -0.248 4.282 4.550 -0.034 0.000 0.232 112 Y C 1.145 177.000 175.900 -0.075 0.000 1.149 112 Y CA 0.537 58.632 58.100 -0.008 0.000 1.961 112 Y CB -3.101 35.388 38.460 0.049 0.000 1.611 112 Y HN 0.599 8.879 8.280 0.000 0.000 0.682 113 T N -4.447 110.085 114.554 -0.036 0.000 3.228 113 T HA 0.684 5.013 4.350 -0.034 0.000 0.278 113 T C 1.439 176.073 174.700 -0.109 0.000 1.014 113 T CA 0.172 62.163 62.100 -0.181 0.000 0.904 113 T CB 0.612 69.138 68.868 -0.571 0.000 1.110 113 T HN 0.492 8.732 8.240 0.000 0.000 0.541 114 A N 1.382 124.211 122.820 0.015 0.000 2.121 114 A HA 0.549 4.849 4.320 -0.034 0.000 0.218 114 A C 1.915 179.551 177.584 0.087 0.000 1.154 114 A CA 0.700 52.741 52.037 0.007 0.000 0.679 114 A CB -0.848 18.159 19.000 0.011 0.000 0.795 114 A HN 1.505 9.655 8.150 0.000 0.000 0.458 115 G N -3.086 105.838 108.800 0.207 0.000 2.189 115 G HA2 0.402 4.342 3.960 -0.034 0.000 0.113 115 G HA3 0.402 4.342 3.960 -0.034 0.000 0.113 115 G C 0.974 176.206 174.900 0.554 0.000 1.038 115 G CA 0.311 45.638 45.100 0.378 0.000 0.704 115 G HN 2.019 10.309 8.290 0.000 0.000 0.490 116 G N -0.824 108.314 108.800 0.562 0.000 2.215 116 G HA2 -0.072 3.868 3.960 -0.034 0.000 0.198 116 G HA3 -0.072 3.868 3.960 -0.034 0.000 0.198 116 G C 0.382 175.536 174.900 0.423 0.000 1.047 116 G CA -0.022 45.380 45.100 0.504 0.000 0.747 116 G HN 1.245 9.535 8.290 0.000 0.000 0.495 117 L N 0.629 121.911 121.223 0.099 0.000 2.485 117 L HA 0.241 4.561 4.340 -0.034 0.000 0.275 117 L C -1.284 175.552 176.870 -0.056 0.000 1.207 117 L CA -1.374 53.232 54.840 -0.390 0.000 0.855 117 L CB 0.467 42.272 42.059 -0.424 0.000 1.114 117 L HN 0.039 8.269 8.230 0.000 0.000 0.485 118 P HA -0.005 4.415 4.420 0.000 0.000 0.269 118 P C 0.444 177.803 177.300 0.099 0.000 1.215 118 P CA -0.526 62.641 63.100 0.112 0.000 0.780 118 P CB 0.542 32.375 31.700 0.221 0.000 0.898 119 L N -0.208 121.062 121.223 0.079 0.000 2.079 119 L HA -0.124 4.196 4.340 -0.034 0.000 0.210 119 L C 1.116 177.997 176.870 0.018 0.000 1.081 119 L CA 2.056 56.913 54.840 0.028 0.000 0.752 119 L CB -1.114 40.963 42.059 0.030 0.000 0.896 119 L HN 0.436 8.666 8.230 0.000 0.000 0.433 120 Q N -1.293 118.529 119.800 0.037 0.000 2.394 120 Q HA 0.410 4.730 4.340 -0.034 0.000 0.273 120 Q C -0.760 175.211 176.000 -0.049 0.000 1.089 120 Q CA -0.751 55.057 55.803 0.009 0.000 0.812 120 Q CB 2.554 31.286 28.738 -0.010 0.000 1.353 120 Q HN -0.191 8.079 8.270 0.000 0.000 0.438 121 V N 3.421 123.259 119.914 -0.126 0.000 2.521 121 V HA 0.130 4.230 4.120 -0.034 0.000 0.286 121 V C -2.017 173.852 176.094 -0.375 0.000 1.034 121 V CA -1.082 60.954 62.300 -0.441 0.000 1.045 121 V CB 0.299 31.935 31.823 -0.312 0.000 0.974 121 V HN 0.567 8.757 8.190 0.000 0.000 0.480 122 P HA 0.031 4.451 4.420 0.000 0.000 0.266 122 P C 0.645 177.837 177.300 -0.182 0.000 1.195 122 P CA 0.028 62.969 63.100 -0.264 0.000 0.768 122 P CB 0.492 32.040 31.700 -0.253 0.000 0.838 123 D N 2.139 122.482 120.400 -0.094 0.000 2.221 123 D HA -0.168 4.452 4.640 -0.034 0.000 0.204 123 D C 1.445 177.715 176.300 -0.051 0.000 0.982 123 D CA 1.126 55.093 54.000 -0.054 0.000 0.857 123 D CB 0.113 40.898 40.800 -0.024 0.000 0.934 123 D HN 0.556 8.926 8.370 0.000 0.000 0.475 124 E N 0.376 120.542 120.200 -0.057 0.000 2.418 124 E HA -0.047 4.283 4.350 -0.034 0.000 0.197 124 E C 0.692 177.265 176.600 -0.046 0.000 1.026 124 E CA 0.085 56.462 56.400 -0.038 0.000 0.862 124 E CB -0.032 29.654 29.700 -0.023 0.000 0.799 124 E HN 0.032 8.392 8.360 0.000 0.000 0.518 125 V N 2.176 122.037 119.914 -0.089 0.000 2.427 125 V HA 0.080 4.180 4.120 -0.034 0.000 0.268 125 V C 0.995 177.060 176.094 -0.049 0.000 1.046 125 V CA 0.273 62.524 62.300 -0.083 0.000 0.970 125 V CB 0.976 32.689 31.823 -0.184 0.000 1.001 125 V HN 0.135 8.325 8.190 0.000 0.000 0.476 126 K N 2.039 122.431 120.400 -0.014 0.000 2.550 126 K HA 0.167 4.467 4.320 -0.034 0.000 0.205 126 K C 0.769 177.374 176.600 0.009 0.000 1.429 126 K CA 0.202 56.486 56.287 -0.005 0.000 0.997 126 K CB 1.031 33.529 32.500 -0.003 0.000 1.328 126 K HN 0.711 8.961 8.250 0.000 0.000 0.546 127 S N -0.675 115.041 115.700 0.027 0.000 2.718 127 S HA 0.224 4.674 4.470 -0.034 0.000 0.300 127 S C 0.952 175.597 174.600 0.075 0.000 1.117 127 S CA -0.593 57.632 58.200 0.040 0.000 1.002 127 S CB 1.832 65.057 63.200 0.042 0.000 1.092 127 S HN -0.023 8.287 8.310 0.000 0.000 0.542 128 S N 0.607 116.354 115.700 0.079 0.000 2.382 128 S HA -0.122 4.328 4.470 -0.034 0.000 0.228 128 S C 2.018 176.752 174.600 0.224 0.000 1.027 128 S CA 1.773 60.055 58.200 0.136 0.000 0.991 128 S CB -0.869 62.379 63.200 0.079 0.000 0.823 128 S HN 0.783 9.093 8.310 0.000 0.000 0.469 129 S N 0.835 116.628 115.700 0.154 0.000 2.368 129 S HA -0.147 4.303 4.470 -0.034 0.000 0.225 129 S C 1.544 176.230 174.600 0.143 0.000 1.030 129 S CA 1.756 60.042 58.200 0.144 0.000 0.999 129 S CB -0.737 62.518 63.200 0.092 0.000 0.844 129 S HN 0.575 8.885 8.310 0.000 0.000 0.459 130 D N 0.895 121.367 120.400 0.120 0.000 2.117 130 D HA -0.075 4.545 4.640 -0.034 0.000 0.197 130 D C 1.901 178.300 176.300 0.165 0.000 0.987 130 D CA 0.859 54.923 54.000 0.107 0.000 0.829 130 D CB -0.538 40.299 40.800 0.061 0.000 0.961 130 D HN 0.329 8.699 8.370 0.000 0.000 0.460 131 L N 0.522 121.880 121.223 0.225 0.000 2.017 131 L HA -0.111 4.209 4.340 -0.034 0.000 0.208 131 L C 2.209 179.365 176.870 0.476 0.000 1.073 131 L CA 1.138 56.201 54.840 0.371 0.000 0.745 131 L CB -0.714 41.615 42.059 0.450 0.000 0.894 131 L HN 0.007 8.237 8.230 0.000 0.000 0.432 132 L N -0.239 121.232 121.223 0.414 0.000 1.990 132 L HA -0.262 4.058 4.340 -0.034 0.000 0.213 132 L C 2.690 179.566 176.870 0.011 0.000 1.072 132 L CA 1.892 56.753 54.840 0.034 0.000 0.755 132 L CB -0.631 41.457 42.059 0.049 0.000 0.889 132 L HN 0.246 8.476 8.230 0.000 0.000 0.432 133 R N -1.660 118.895 120.500 0.092 0.000 2.081 133 R HA -0.208 4.112 4.340 -0.034 0.000 0.235 133 R C 2.248 178.620 176.300 0.120 0.000 1.131 133 R CA 1.707 57.855 56.100 0.081 0.000 0.960 133 R CB -0.740 29.612 30.300 0.087 0.000 0.856 133 R HN 0.434 8.704 8.270 0.000 0.000 0.436 134 F N 0.604 120.546 119.950 -0.013 0.000 2.069 134 F HA -0.259 4.248 4.527 -0.034 0.000 0.298 134 F C 1.667 177.445 175.800 -0.037 0.000 1.113 134 F CA 1.450 59.402 58.000 -0.080 0.000 1.214 134 F CB -0.516 38.351 39.000 -0.221 0.000 0.978 134 F HN -0.070 8.230 8.300 0.000 0.000 0.474 135 Y N 0.621 120.842 120.300 -0.132 0.000 2.373 135 Y HA -0.110 4.419 4.550 -0.034 0.000 0.293 135 Y C 2.623 178.619 175.900 0.160 0.000 1.129 135 Y CA 1.465 59.500 58.100 -0.109 0.000 1.226 135 Y CB -0.900 37.472 38.460 -0.146 0.000 1.000 135 Y HN 0.241 8.521 8.280 0.000 0.000 0.549 136 Q N -0.176 119.700 119.800 0.126 0.000 2.083 136 Q HA -0.151 4.169 4.340 -0.034 0.000 0.198 136 Q C 1.609 177.715 176.000 0.177 0.000 0.969 136 Q CA 1.374 57.257 55.803 0.134 0.000 0.838 136 Q CB -0.252 28.479 28.738 -0.011 0.000 0.900 136 Q HN 0.632 8.902 8.270 0.000 0.000 0.436 137 N N -0.363 118.403 118.700 0.110 0.000 2.457 137 N HA -0.091 4.629 4.740 -0.034 0.000 0.180 137 N C 0.020 175.579 175.510 0.081 0.000 1.050 137 N CA -0.302 52.793 53.050 0.075 0.000 0.906 137 N CB 0.039 38.566 38.487 0.066 0.000 0.968 137 N HN 0.195 8.575 8.380 0.000 0.000 0.445 138 W N 3.164 124.399 121.300 -0.110 0.000 2.314 138 W HA -0.048 4.593 4.660 -0.033 0.000 0.339 138 W C -0.447 176.004 176.519 -0.113 0.000 1.293 138 W CA 0.003 57.254 57.345 -0.157 0.000 1.288 138 W CB 0.471 29.793 29.460 -0.230 0.000 1.186 138 W HN -0.026 8.154 8.180 0.000 0.000 0.566 139 Q N 7.729 127.120 119.800 -0.682 0.000 2.394 139 Q HA 0.276 4.596 4.340 -0.034 0.000 0.259 139 Q C -2.046 173.228 176.000 -1.210 0.000 1.021 139 Q CA -1.952 53.367 55.803 -0.806 0.000 0.805 139 Q CB 1.013 29.507 28.738 -0.407 0.000 1.226 139 Q HN 0.316 8.586 8.270 0.000 0.000 0.476 140 P HA 0.007 4.427 4.420 0.000 0.000 0.266 140 P C 0.026 176.929 177.300 -0.661 0.000 1.195 140 P CA 0.230 62.629 63.100 -1.169 0.000 0.768 140 P CB 0.849 31.939 31.700 -1.015 0.000 0.838 141 A N 2.712 125.159 122.820 -0.621 0.000 2.030 141 A HA 0.110 4.410 4.320 -0.034 0.000 0.215 141 A C 0.108 177.081 177.584 -1.019 0.000 1.164 141 A CA 0.731 52.178 52.037 -0.983 0.000 0.697 141 A CB -0.079 17.930 19.000 -1.652 0.000 0.827 141 A HN 0.527 8.677 8.150 0.000 0.000 0.457 142 W N -2.259 118.986 121.300 -0.091 0.000 3.029 142 W HA 0.656 5.296 4.660 -0.033 0.000 0.339 142 W C 0.015 176.469 176.519 -0.108 0.000 1.198 142 W CA -1.353 55.943 57.345 -0.082 0.000 1.148 142 W CB 1.052 30.478 29.460 -0.055 0.000 1.451 142 W HN 0.158 8.338 8.180 0.000 0.000 0.564 143 A N 2.673 125.580 122.820 0.144 0.000 2.483 143 A HA 0.432 4.732 4.320 -0.034 0.000 0.238 143 A C -2.205 175.383 177.584 0.006 0.000 1.070 143 A CA -0.691 51.370 52.037 0.039 0.000 0.770 143 A CB -0.777 18.247 19.000 0.041 0.000 1.008 143 A HN 0.146 8.296 8.150 0.000 0.000 0.497 144 P HA 0.275 4.695 4.420 0.000 0.000 0.266 144 P C 0.806 177.941 177.300 -0.274 0.000 1.195 144 P CA 1.754 64.677 63.100 -0.294 0.000 0.768 144 P CB 0.541 32.017 31.700 -0.372 0.000 0.838 145 G N 1.875 110.448 108.800 -0.377 0.000 2.160 145 G HA2 -0.244 3.696 3.960 -0.034 0.000 0.244 145 G HA3 -0.244 3.696 3.960 -0.034 0.000 0.244 145 G C 0.609 175.488 174.900 -0.034 0.000 1.022 145 G CA 0.587 45.663 45.100 -0.039 0.000 0.741 145 G HN 0.687 8.977 8.290 0.000 0.000 0.508 146 T N -5.095 109.372 114.554 -0.145 0.000 2.964 146 T HA 0.445 4.774 4.350 -0.034 0.000 0.250 146 T C 0.537 175.088 174.700 -0.249 0.000 0.982 146 T CA 0.696 62.729 62.100 -0.112 0.000 0.959 146 T CB 0.691 69.536 68.868 -0.038 0.000 1.141 146 T HN 0.293 8.533 8.240 0.000 0.000 0.494 147 Q N 0.956 120.551 119.800 -0.341 0.000 2.331 147 Q HA 0.455 4.775 4.340 -0.034 0.000 0.272 147 Q C -1.422 174.357 176.000 -0.368 0.000 1.062 147 Q CA -0.504 55.006 55.803 -0.487 0.000 0.806 147 Q CB 3.348 31.484 28.738 -1.004 0.000 1.312 147 Q HN 0.356 8.626 8.270 0.000 0.000 0.431 148 R N 2.337 122.652 120.500 -0.308 0.000 2.229 148 R HA 0.488 4.808 4.340 -0.034 0.000 0.328 148 R C -1.195 175.057 176.300 -0.079 0.000 1.009 148 R CA -0.487 55.516 56.100 -0.161 0.000 0.864 148 R CB 0.429 30.663 30.300 -0.110 0.000 1.085 148 R HN 0.423 8.693 8.270 0.000 0.000 0.453 149 L N 6.151 127.401 121.223 0.045 0.000 2.427 149 L HA 0.261 4.581 4.340 -0.034 0.000 0.264 149 L C -1.399 175.522 176.870 0.086 0.000 0.989 149 L CA -0.661 54.234 54.840 0.091 0.000 0.865 149 L CB 1.044 43.227 42.059 0.206 0.000 1.209 149 L HN 0.633 8.863 8.230 0.000 0.000 0.430 150 Y N 4.840 125.015 120.300 -0.208 0.000 2.721 150 Y HA 0.389 4.919 4.550 -0.034 0.000 0.329 150 Y C 0.092 175.836 175.900 -0.259 0.000 1.211 150 Y CA 0.708 58.472 58.100 -0.561 0.000 1.512 150 Y CB 0.509 38.682 38.460 -0.478 0.000 1.249 150 Y HN 0.825 9.105 8.280 0.000 0.000 0.549 151 A N 5.613 128.105 122.820 -0.547 0.000 2.491 151 A HA 0.242 4.542 4.320 -0.034 0.000 0.293 151 A C -0.175 177.345 177.584 -0.107 0.000 1.047 151 A CA -0.927 50.985 52.037 -0.207 0.000 0.735 151 A CB 0.782 19.800 19.000 0.029 0.000 1.281 151 A HN 0.825 8.975 8.150 0.000 0.000 0.398 152 N N 1.202 119.841 118.700 -0.102 0.000 2.223 152 N HA -0.156 4.564 4.740 -0.034 0.000 0.185 152 N C 1.991 177.571 175.510 0.116 0.000 1.016 152 N CA 1.933 55.002 53.050 0.031 0.000 0.863 152 N CB -0.078 38.468 38.487 0.098 0.000 0.983 152 N HN 0.857 9.237 8.380 0.000 0.000 0.429 153 S N -1.057 114.732 115.700 0.150 0.000 2.515 153 S HA 0.046 4.496 4.470 -0.034 0.000 0.231 153 S C 2.013 176.802 174.600 0.314 0.000 0.987 153 S CA 0.868 59.239 58.200 0.285 0.000 0.936 153 S CB 0.017 63.431 63.200 0.357 0.000 0.766 153 S HN 0.186 8.496 8.310 0.000 0.000 0.528 154 S N 1.134 116.959 115.700 0.207 0.000 2.339 154 S HA 0.148 4.598 4.470 -0.034 0.000 0.213 154 S C 1.640 176.329 174.600 0.149 0.000 1.033 154 S CA 0.603 58.906 58.200 0.171 0.000 0.950 154 S CB -0.510 62.809 63.200 0.198 0.000 0.893 154 S HN 0.468 8.778 8.310 0.000 0.000 0.492 155 I N 2.068 122.726 120.570 0.146 0.000 2.493 155 I HA 0.091 4.241 4.170 -0.034 0.000 0.254 155 I C 2.022 178.227 176.117 0.147 0.000 1.160 155 I CA 1.476 62.848 61.300 0.121 0.000 1.445 155 I CB -0.918 37.155 38.000 0.122 0.000 1.086 155 I HN 0.371 8.581 8.210 0.000 0.000 0.433 156 G N 0.415 109.275 108.800 0.100 0.000 2.418 156 G HA2 -0.249 3.691 3.960 -0.034 0.000 0.217 156 G HA3 -0.249 3.691 3.960 -0.034 0.000 0.217 156 G C 1.584 176.481 174.900 -0.005 0.000 1.158 156 G CA 0.923 46.022 45.100 -0.002 0.000 0.771 156 G HN 0.426 8.716 8.290 0.000 0.000 0.545 157 L N -0.234 121.045 121.223 0.093 0.000 2.093 157 L HA 0.141 4.461 4.340 -0.034 0.000 0.208 157 L C 2.418 179.294 176.870 0.011 0.000 1.085 157 L CA 1.420 56.275 54.840 0.025 0.000 0.755 157 L CB -0.652 41.369 42.059 -0.063 0.000 0.904 157 L HN 0.243 8.473 8.230 0.000 0.000 0.435 158 F N 0.228 120.146 119.950 -0.053 0.000 2.095 158 F HA -0.078 4.428 4.527 -0.034 0.000 0.298 158 F C 2.185 177.943 175.800 -0.069 0.000 1.104 158 F CA 1.820 59.785 58.000 -0.059 0.000 1.232 158 F CB -1.039 37.929 39.000 -0.053 0.000 0.987 158 F HN 0.099 8.399 8.300 0.000 0.000 0.475 159 G N -0.245 108.477 108.800 -0.131 0.000 2.418 159 G HA2 -0.234 3.706 3.960 -0.034 0.000 0.217 159 G HA3 -0.234 3.706 3.960 -0.034 0.000 0.217 159 G C 1.826 176.600 174.900 -0.211 0.000 1.158 159 G CA 0.966 45.951 45.100 -0.193 0.000 0.771 159 G HN 0.664 8.954 8.290 0.000 0.000 0.545 160 A N 0.524 123.183 122.820 -0.268 0.000 1.902 160 A HA 0.089 4.389 4.320 -0.034 0.000 0.217 160 A C 2.437 179.876 177.584 -0.241 0.000 1.181 160 A CA 1.356 53.256 52.037 -0.229 0.000 0.623 160 A CB -0.377 18.480 19.000 -0.239 0.000 0.818 160 A HN 0.360 8.510 8.150 0.000 0.000 0.443 161 L N -1.068 119.982 121.223 -0.287 0.000 2.179 161 L HA -0.079 4.241 4.340 -0.034 0.000 0.208 161 L C 3.011 179.579 176.870 -0.503 0.000 1.096 161 L CA 0.800 55.441 54.840 -0.331 0.000 0.779 161 L CB -0.578 41.340 42.059 -0.235 0.000 0.922 161 L HN 0.418 8.648 8.230 0.000 0.000 0.443 162 A N 0.358 122.821 122.820 -0.595 0.000 2.019 162 A HA -0.144 4.156 4.320 -0.034 0.000 0.219 162 A C 2.172 179.521 177.584 -0.392 0.000 1.164 162 A CA 1.854 53.507 52.037 -0.639 0.000 0.644 162 A CB -0.687 17.773 19.000 -0.899 0.000 0.805 162 A HN 0.353 8.503 8.150 0.000 0.000 0.449 163 V N -3.644 116.109 119.914 -0.267 0.000 3.608 163 V HA 0.037 4.137 4.120 -0.034 0.000 0.269 163 V C 1.698 177.703 176.094 -0.147 0.000 1.245 163 V CA 0.924 63.120 62.300 -0.174 0.000 1.138 163 V CB -0.440 31.321 31.823 -0.103 0.000 0.841 163 V HN 0.301 8.491 8.190 0.000 0.000 0.451 164 K N 1.637 121.937 120.400 -0.168 0.000 2.020 164 K HA -0.093 4.207 4.320 -0.034 0.000 0.212 164 K C 0.210 176.783 176.600 -0.045 0.000 1.050 164 K CA 2.113 58.342 56.287 -0.096 0.000 0.929 164 K CB -1.970 30.496 32.500 -0.057 0.000 0.714 164 K HN 0.486 8.736 8.250 0.000 0.000 0.443 165 P HA -0.082 4.338 4.420 0.000 0.000 0.225 165 P C 1.403 178.689 177.300 -0.024 0.000 1.148 165 P CA 1.205 64.312 63.100 0.012 0.000 0.779 165 P CB -0.061 31.668 31.700 0.048 0.000 0.780 166 S N -1.198 114.467 115.700 -0.057 0.000 2.423 166 S HA 0.030 4.480 4.470 -0.034 0.000 0.231 166 S C 1.913 176.481 174.600 -0.054 0.000 1.014 166 S CA 1.065 59.228 58.200 -0.063 0.000 0.965 166 S CB -1.538 61.607 63.200 -0.092 0.000 0.785 166 S HN 0.284 8.594 8.310 0.000 0.000 0.495 167 G N 0.552 109.321 108.800 -0.052 0.000 2.179 167 G HA2 -0.222 3.718 3.960 -0.034 0.000 0.260 167 G HA3 -0.222 3.718 3.960 -0.034 0.000 0.260 167 G C -0.067 174.800 174.900 -0.055 0.000 0.977 167 G CA 0.520 45.593 45.100 -0.046 0.000 0.641 167 G HN 0.580 8.870 8.290 0.000 0.000 0.533 168 L N 1.171 122.352 121.223 -0.070 0.000 2.334 168 L HA 0.688 5.007 4.340 -0.034 0.000 0.270 168 L C 1.347 178.171 176.870 -0.077 0.000 1.018 168 L CA -0.483 54.310 54.840 -0.079 0.000 0.811 168 L CB 1.688 43.685 42.059 -0.104 0.000 1.271 168 L HN 0.342 8.572 8.230 0.000 0.000 0.443 169 S N -0.075 115.585 115.700 -0.068 0.000 2.608 169 S HA 0.083 4.533 4.470 -0.034 0.000 0.261 169 S C 0.827 175.400 174.600 -0.045 0.000 1.314 169 S CA -0.323 57.853 58.200 -0.040 0.000 0.992 169 S CB 0.484 63.668 63.200 -0.027 0.000 0.935 169 S HN 0.549 8.859 8.310 0.000 0.000 0.564 170 F N 1.094 120.963 119.950 -0.135 0.000 2.095 170 F HA -0.088 4.419 4.527 -0.033 0.000 0.298 170 F C 2.546 178.250 175.800 -0.159 0.000 1.104 170 F CA 2.224 60.132 58.000 -0.153 0.000 1.232 170 F CB -0.432 38.479 39.000 -0.148 0.000 0.987 170 F HN 0.943 9.243 8.300 0.000 0.000 0.475 171 E N -0.368 119.810 120.200 -0.037 0.000 2.077 171 E HA -0.321 4.009 4.350 -0.034 0.000 0.193 171 E C 2.204 178.667 176.600 -0.228 0.000 0.989 171 E CA 1.351 57.674 56.400 -0.129 0.000 0.800 171 E CB -0.286 29.421 29.700 0.011 0.000 0.746 171 E HN 0.459 8.819 8.360 0.000 0.000 0.452 172 Q N 0.540 120.242 119.800 -0.164 0.000 2.119 172 Q HA -0.088 4.232 4.340 -0.034 0.000 0.201 172 Q C 1.850 177.710 176.000 -0.233 0.000 0.972 172 Q CA 1.906 57.614 55.803 -0.159 0.000 0.847 172 Q CB -0.448 28.228 28.738 -0.102 0.000 0.903 172 Q HN 0.362 8.632 8.270 0.000 0.000 0.433 173 A N 0.014 122.659 122.820 -0.291 0.000 1.883 173 A HA -0.210 4.090 4.320 -0.034 0.000 0.217 173 A C 2.087 179.404 177.584 -0.445 0.000 1.186 173 A CA 1.920 53.760 52.037 -0.330 0.000 0.624 173 A CB -0.695 18.099 19.000 -0.343 0.000 0.822 173 A HN 0.521 8.671 8.150 0.000 0.000 0.444 174 M N 0.073 119.273 119.600 -0.667 0.000 2.080 174 M HA -0.137 4.322 4.480 -0.034 0.000 0.260 174 M C 1.873 177.615 176.300 -0.930 0.000 1.068 174 M CA 1.959 56.727 55.300 -0.888 0.000 1.109 174 M CB -0.442 31.485 32.600 -1.121 0.000 1.342 174 M HN 0.393 8.683 8.290 0.000 0.000 0.405 175 K N -0.844 119.164 120.400 -0.653 0.000 2.009 175 K HA -0.164 4.136 4.320 -0.034 0.000 0.210 175 K C 1.918 178.390 176.600 -0.214 0.000 1.049 175 K CA 2.221 58.303 56.287 -0.342 0.000 0.929 175 K CB -0.815 31.613 32.500 -0.121 0.000 0.714 175 K HN 0.632 8.882 8.250 0.000 0.000 0.440 176 T N -0.798 113.637 114.554 -0.198 0.000 2.857 176 T HA -0.050 4.280 4.350 -0.034 0.000 0.266 176 T C 1.902 176.532 174.700 -0.116 0.000 1.048 176 T CA 0.748 62.772 62.100 -0.126 0.000 1.139 176 T CB -0.053 68.748 68.868 -0.111 0.000 0.874 176 T HN 0.170 8.410 8.240 0.000 0.000 0.455 177 R N 0.003 120.406 120.500 -0.162 0.000 2.254 177 R HA 0.367 4.687 4.340 -0.034 0.000 0.193 177 R C 1.763 178.017 176.300 -0.076 0.000 0.929 177 R CA 0.272 56.304 56.100 -0.113 0.000 1.038 177 R CB 0.338 30.560 30.300 -0.129 0.000 1.009 177 R HN 0.305 8.575 8.270 0.000 0.000 0.512 178 V N -0.779 119.054 119.914 -0.134 0.000 2.950 178 V HA 0.029 4.129 4.120 -0.034 0.000 0.231 178 V C 1.494 177.665 176.094 0.128 0.000 1.205 178 V CA 0.539 62.835 62.300 -0.007 0.000 1.239 178 V CB -0.352 31.446 31.823 -0.041 0.000 1.050 178 V HN -0.026 8.164 8.190 0.000 0.000 0.498 179 F N 1.515 121.419 119.950 -0.076 0.000 2.075 179 F HA -0.141 4.365 4.527 -0.035 0.000 0.297 179 F C 2.627 178.367 175.800 -0.100 0.000 1.113 179 F CA 1.472 59.395 58.000 -0.128 0.000 1.218 179 F CB -1.247 37.600 39.000 -0.256 0.000 0.984 179 F HN 0.194 8.494 8.300 0.000 0.000 0.472 180 Q N -0.179 119.678 119.800 0.095 0.000 2.020 180 Q HA -0.154 4.166 4.340 -0.034 0.000 0.202 180 Q C -0.348 175.666 176.000 0.024 0.000 0.982 180 Q CA 1.881 57.697 55.803 0.023 0.000 0.838 180 Q CB -1.518 27.214 28.738 -0.009 0.000 0.899 180 Q HN 0.277 8.547 8.270 0.000 0.000 0.423 181 P HA -0.132 4.288 4.420 0.000 0.000 0.220 181 P C 0.650 177.983 177.300 0.054 0.000 1.148 181 P CA 1.190 64.311 63.100 0.034 0.000 0.803 181 P CB 0.048 31.768 31.700 0.033 0.000 0.782 182 L N -1.599 119.681 121.223 0.096 0.000 2.592 182 L HA 0.165 4.485 4.340 -0.034 0.000 0.227 182 L C 0.287 177.207 176.870 0.082 0.000 1.127 182 L CA -0.012 54.899 54.840 0.119 0.000 0.884 182 L CB -0.446 41.752 42.059 0.231 0.000 1.065 182 L HN -0.123 8.107 8.230 0.000 0.000 0.457 183 K N 0.712 121.137 120.400 0.041 0.000 3.117 183 K HA -0.150 4.150 4.320 -0.034 0.000 0.269 183 K C -0.205 176.376 176.600 -0.032 0.000 1.098 183 K CA 0.696 56.982 56.287 -0.002 0.000 0.785 183 K CB -2.208 30.295 32.500 0.005 0.000 1.242 183 K HN 0.340 8.590 8.250 0.000 0.000 0.491 184 L N 1.236 122.427 121.223 -0.054 0.000 2.399 184 L HA 0.141 4.461 4.340 -0.034 0.000 0.257 184 L C 1.208 177.846 176.870 -0.388 0.000 1.236 184 L CA -0.317 54.411 54.840 -0.187 0.000 1.144 184 L CB -0.035 41.895 42.059 -0.216 0.000 1.379 184 L HN 0.067 8.297 8.230 0.000 0.000 0.414 185 N N 0.004 118.490 118.700 -0.356 0.000 2.398 185 N HA -0.026 4.694 4.740 -0.034 0.000 0.188 185 N C 0.275 175.187 175.510 -0.998 0.000 1.122 185 N CA 0.530 53.235 53.050 -0.575 0.000 0.866 185 N CB 0.282 38.509 38.487 -0.432 0.000 0.970 185 N HN 0.599 8.979 8.380 0.000 0.000 0.462 186 H N -0.908 117.824 119.070 -0.565 0.000 2.587 186 H HA 0.312 4.847 4.556 -0.035 0.000 0.245 186 H C -0.635 174.150 175.328 -0.906 0.000 1.238 186 H CA -0.157 55.532 56.048 -0.598 0.000 0.963 186 H CB 0.443 30.100 29.762 -0.175 0.000 1.904 186 H HN -0.170 8.110 8.280 0.000 0.000 0.584 187 T N 0.394 114.122 114.554 -1.376 0.000 2.841 187 T HA 0.365 4.695 4.350 -0.034 0.000 0.285 187 T C -1.007 172.722 174.700 -1.619 0.000 0.991 187 T CA -0.656 60.630 62.100 -1.357 0.000 0.966 187 T CB 1.166 69.182 68.868 -1.420 0.000 0.962 187 T HN 0.294 8.534 8.240 0.000 0.000 0.438 188 W N 1.743 122.704 121.300 -0.564 0.000 3.032 188 W HA 0.587 5.229 4.660 -0.030 0.000 0.335 188 W C 0.531 176.927 176.519 -0.204 0.000 1.154 188 W CA -0.884 56.279 57.345 -0.303 0.000 1.204 188 W CB 1.133 30.430 29.460 -0.272 0.000 1.416 188 W HN 0.481 8.661 8.180 0.000 0.000 0.521 189 I N 1.110 121.808 120.570 0.214 0.000 2.628 189 I HA -0.028 4.122 4.170 -0.034 0.000 0.255 189 I C 0.452 176.603 176.117 0.058 0.000 1.119 189 I CA 0.591 61.956 61.300 0.108 0.000 1.448 189 I CB 0.040 38.115 38.000 0.126 0.000 1.133 189 I HN 0.416 8.626 8.210 0.000 0.000 0.438 190 N N 0.599 119.346 118.700 0.079 0.000 2.479 190 N HA 0.244 4.964 4.740 -0.034 0.000 0.261 190 N C -0.933 174.486 175.510 -0.152 0.000 0.979 190 N CA -0.351 52.684 53.050 -0.025 0.000 0.930 190 N CB 1.328 39.803 38.487 -0.021 0.000 1.172 190 N HN -0.208 8.172 8.380 0.000 0.000 0.499 191 V N 5.045 124.782 119.914 -0.296 0.000 2.479 191 V HA 0.230 4.330 4.120 -0.034 0.000 0.281 191 V C -1.688 174.061 176.094 -0.574 0.000 1.031 191 V CA -1.003 60.906 62.300 -0.652 0.000 1.038 191 V CB 0.212 31.701 31.823 -0.558 0.000 0.981 191 V HN 0.733 8.923 8.190 0.000 0.000 0.478 192 P HA 0.071 4.491 4.420 0.000 0.000 0.269 192 P C 1.005 178.094 177.300 -0.351 0.000 1.215 192 P CA 0.007 62.801 63.100 -0.511 0.000 0.780 192 P CB 0.576 31.913 31.700 -0.605 0.000 0.898 193 S N 1.814 117.385 115.700 -0.214 0.000 2.400 193 S HA -0.206 4.244 4.470 -0.034 0.000 0.232 193 S C 1.710 176.229 174.600 -0.134 0.000 1.025 193 S CA 1.226 59.339 58.200 -0.144 0.000 0.993 193 S CB -1.220 61.924 63.200 -0.094 0.000 0.808 193 S HN 0.475 8.785 8.310 0.000 0.000 0.478 194 A N 0.697 123.431 122.820 -0.144 0.000 2.208 194 A HA 0.191 4.491 4.320 -0.034 0.000 0.209 194 A C 1.955 179.475 177.584 -0.107 0.000 1.161 194 A CA 0.577 52.553 52.037 -0.101 0.000 0.782 194 A CB -0.152 18.802 19.000 -0.077 0.000 0.816 194 A HN 0.474 8.624 8.150 0.000 0.000 0.477 195 E N -0.163 119.924 120.200 -0.189 0.000 2.460 195 E HA -0.000 4.330 4.350 -0.034 0.000 0.200 195 E C 1.146 177.660 176.600 -0.143 0.000 1.011 195 E CA 0.143 56.439 56.400 -0.174 0.000 0.912 195 E CB -0.064 29.421 29.700 -0.359 0.000 0.953 195 E HN 0.738 9.098 8.360 0.000 0.000 0.494 196 E N 1.427 121.544 120.200 -0.138 0.000 2.209 196 E HA -0.215 4.115 4.350 -0.034 0.000 0.196 196 E C 1.844 178.418 176.600 -0.043 0.000 0.993 196 E CA 1.111 57.472 56.400 -0.066 0.000 0.819 196 E CB -0.214 29.445 29.700 -0.068 0.000 0.745 196 E HN 0.285 8.645 8.360 0.000 0.000 0.477 197 K N 0.514 120.887 120.400 -0.046 0.000 2.281 197 K HA -0.107 4.192 4.320 -0.034 0.000 0.203 197 K C 1.287 177.875 176.600 -0.020 0.000 1.046 197 K CA 1.200 57.467 56.287 -0.033 0.000 0.938 197 K CB 0.024 32.512 32.500 -0.021 0.000 0.737 197 K HN 0.000 8.250 8.250 0.000 0.000 0.458 198 N N -0.260 118.435 118.700 -0.009 0.000 2.254 198 N HA -0.047 4.673 4.740 -0.034 0.000 0.190 198 N C -0.696 174.829 175.510 0.025 0.000 1.107 198 N CA 0.045 53.095 53.050 0.001 0.000 0.869 198 N CB 0.214 38.704 38.487 0.005 0.000 0.983 198 N HN 0.158 8.538 8.380 0.000 0.000 0.487 199 Y N 3.005 123.211 120.300 -0.156 0.000 2.539 199 Y HA 0.401 4.931 4.550 -0.033 0.000 0.352 199 Y C 0.255 176.052 175.900 -0.171 0.000 1.004 199 Y CA -1.769 56.215 58.100 -0.193 0.000 1.278 199 Y CB -0.504 37.786 38.460 -0.282 0.000 1.136 199 Y HN -0.044 8.236 8.280 0.000 0.000 0.528 200 A N 6.203 129.126 122.820 0.171 0.000 2.507 200 A HA 0.027 4.327 4.320 -0.034 0.000 0.235 200 A C -0.340 177.329 177.584 0.142 0.000 1.070 200 A CA -0.277 51.816 52.037 0.092 0.000 0.768 200 A CB 0.076 19.076 19.000 0.000 0.000 1.011 200 A HN 0.903 9.053 8.150 0.000 0.000 0.502 201 W N 0.661 121.974 121.300 0.021 0.000 2.218 201 W HA 0.448 5.089 4.660 -0.033 0.000 0.326 201 W C 0.994 177.210 176.519 -0.505 0.000 1.276 201 W CA 0.165 57.318 57.345 -0.319 0.000 1.210 201 W CB 0.978 30.066 29.460 -0.622 0.000 1.143 201 W HN 0.936 9.116 8.180 0.000 0.000 0.563 202 G N 1.807 110.449 108.800 -0.263 0.000 2.448 202 G HA2 0.435 4.374 3.960 -0.034 0.000 0.285 202 G HA3 0.435 4.374 3.960 -0.034 0.000 0.285 202 G C -2.057 172.439 174.900 -0.672 0.000 1.176 202 G CA -0.470 44.164 45.100 -0.776 0.000 0.852 202 G HN 0.445 8.735 8.290 0.000 0.000 0.530 203 Y N -0.047 120.160 120.300 -0.156 0.000 2.338 203 Y HA 0.503 5.033 4.550 -0.034 0.000 0.333 203 Y C 0.488 176.366 175.900 -0.037 0.000 0.968 203 Y CA -0.808 57.246 58.100 -0.076 0.000 1.123 203 Y CB 2.116 40.544 38.460 -0.052 0.000 1.165 203 Y HN 0.464 8.744 8.280 0.000 0.000 0.452 204 R N 3.154 123.703 120.500 0.081 0.000 2.388 204 R HA 0.271 4.591 4.340 -0.034 0.000 0.314 204 R C -0.562 175.771 176.300 0.055 0.000 0.959 204 R CA -0.374 55.766 56.100 0.066 0.000 0.851 204 R CB 0.566 30.891 30.300 0.042 0.000 1.168 204 R HN 0.918 9.188 8.270 0.000 0.000 0.472 205 E N 2.841 123.076 120.200 0.058 0.000 2.238 205 E HA -0.287 4.043 4.350 -0.034 0.000 0.219 205 E C 0.556 177.174 176.600 0.030 0.000 1.275 205 E CA 0.726 57.148 56.400 0.037 0.000 0.714 205 E CB -1.161 28.553 29.700 0.023 0.000 1.154 205 E HN 1.185 9.545 8.360 0.000 0.000 0.363 206 G N -0.332 108.500 108.800 0.054 0.000 2.225 206 G HA2 -0.355 3.585 3.960 -0.034 0.000 0.254 206 G HA3 -0.355 3.585 3.960 -0.034 0.000 0.254 206 G C 0.212 175.148 174.900 0.060 0.000 0.988 206 G CA 0.599 45.726 45.100 0.045 0.000 0.625 206 G HN 0.270 8.560 8.290 0.000 0.000 0.527 207 K N 0.977 121.395 120.400 0.030 0.000 2.172 207 K HA 0.707 5.007 4.320 -0.034 0.000 0.276 207 K C 0.442 176.946 176.600 -0.161 0.000 1.013 207 K CA 0.321 56.570 56.287 -0.064 0.000 0.913 207 K CB 1.711 34.160 32.500 -0.085 0.000 1.055 207 K HN 0.560 8.810 8.250 0.000 0.000 0.461 208 A N 2.663 125.243 122.820 -0.400 0.000 2.347 208 A HA 0.446 4.746 4.320 -0.034 0.000 0.287 208 A C -0.230 176.918 177.584 -0.727 0.000 1.199 208 A CA -0.475 51.039 52.037 -0.872 0.000 0.851 208 A CB -0.346 17.787 19.000 -1.444 0.000 1.118 208 A HN 0.551 8.701 8.150 0.000 0.000 0.525 209 V N 0.977 120.663 119.914 -0.380 0.000 3.007 209 V HA 0.721 4.821 4.120 -0.034 0.000 0.311 209 V C -0.702 175.487 176.094 0.158 0.000 1.120 209 V CA -0.848 61.398 62.300 -0.090 0.000 0.980 209 V CB 1.324 33.135 31.823 -0.021 0.000 1.033 209 V HN 0.923 9.113 8.190 0.000 0.000 0.429 210 H N 0.386 119.611 119.070 0.258 0.000 2.731 210 H HA 0.684 5.220 4.556 -0.033 0.000 0.368 210 H C -0.558 174.900 175.328 0.216 0.000 1.168 210 H CA -0.991 55.200 56.048 0.238 0.000 1.181 210 H CB 2.291 32.099 29.762 0.077 0.000 1.743 210 H HN 0.779 9.059 8.280 0.000 0.000 0.547 211 V N 2.081 122.223 119.914 0.380 0.000 2.673 211 V HA -0.018 4.081 4.120 -0.034 0.000 0.303 211 V C -0.217 176.016 176.094 0.233 0.000 1.046 211 V CA 0.387 62.852 62.300 0.275 0.000 1.126 211 V CB 0.776 32.764 31.823 0.275 0.000 0.934 211 V HN 0.740 8.930 8.190 0.000 0.000 0.487 212 S N 7.715 123.531 115.700 0.193 0.000 2.562 212 S HA 0.493 4.943 4.470 -0.034 0.000 0.275 212 S C -2.372 172.322 174.600 0.156 0.000 1.281 212 S CA -0.749 57.541 58.200 0.151 0.000 1.045 212 S CB 1.184 64.451 63.200 0.111 0.000 0.962 212 S HN 0.817 9.127 8.310 0.000 0.000 0.503 213 P HA 0.379 4.799 4.420 0.000 0.000 0.271 213 P C -0.350 176.993 177.300 0.072 0.000 1.216 213 P CA -0.270 62.876 63.100 0.077 0.000 0.776 213 P CB 0.487 32.215 31.700 0.047 0.000 0.881 214 R N 1.297 121.827 120.500 0.051 0.000 2.692 214 R HA 0.629 4.949 4.340 -0.034 0.000 0.269 214 R C -1.188 175.097 176.300 -0.025 0.000 1.030 214 R CA -0.965 55.158 56.100 0.038 0.000 0.882 214 R CB 1.686 32.059 30.300 0.122 0.000 1.250 214 R HN 0.506 8.776 8.270 0.000 0.000 0.465 215 A N 2.590 125.385 122.820 -0.041 0.000 2.546 215 A HA 0.251 4.550 4.320 -0.034 0.000 0.243 215 A C 0.954 178.482 177.584 -0.094 0.000 1.063 215 A CA 0.395 52.394 52.037 -0.064 0.000 0.757 215 A CB -0.298 18.662 19.000 -0.067 0.000 0.991 215 A HN 0.911 9.061 8.150 0.000 0.000 0.503 216 L N 0.379 121.522 121.223 -0.133 0.000 4.496 216 L HA -0.314 4.006 4.340 -0.034 0.000 0.419 216 L C 1.247 177.914 176.870 -0.337 0.000 1.139 216 L CA 0.724 55.444 54.840 -0.201 0.000 0.975 216 L CB -1.972 40.032 42.059 -0.093 0.000 2.099 216 L HN 0.988 9.218 8.230 0.000 0.000 0.818 217 D N 0.626 120.793 120.400 -0.388 0.000 2.117 217 D HA -0.144 4.476 4.640 -0.034 0.000 0.197 217 D C 1.950 177.866 176.300 -0.640 0.000 0.987 217 D CA 1.529 55.069 54.000 -0.765 0.000 0.829 217 D CB -0.104 40.385 40.800 -0.519 0.000 0.961 217 D HN 0.462 8.832 8.370 0.000 0.000 0.460 218 A N 0.712 123.309 122.820 -0.371 0.000 1.908 218 A HA -0.215 4.085 4.320 -0.034 0.000 0.218 218 A C 2.124 179.534 177.584 -0.289 0.000 1.181 218 A CA 1.919 53.823 52.037 -0.221 0.000 0.627 218 A CB -0.663 18.291 19.000 -0.077 0.000 0.818 218 A HN 0.221 8.371 8.150 0.000 0.000 0.445 219 E N -0.451 119.376 120.200 -0.622 0.000 2.152 219 E HA 0.119 4.449 4.350 -0.034 0.000 0.192 219 E C 2.057 178.523 176.600 -0.225 0.000 0.983 219 E CA 1.211 57.188 56.400 -0.705 0.000 0.818 219 E CB -0.227 28.994 29.700 -0.799 0.000 0.758 219 E HN 0.595 8.955 8.360 0.000 0.000 0.467 220 A N -0.209 122.466 122.820 -0.242 0.000 1.973 220 A HA 0.062 4.362 4.320 -0.034 0.000 0.210 220 A C 0.718 178.359 177.584 0.096 0.000 1.200 220 A CA 0.707 52.716 52.037 -0.047 0.000 0.707 220 A CB -0.016 18.985 19.000 0.002 0.000 0.862 220 A HN 0.408 8.558 8.150 0.000 0.000 0.461 221 Y N -3.824 116.494 120.300 0.031 0.000 2.990 221 Y HA 0.503 5.033 4.550 -0.034 0.000 0.240 221 Y C 0.898 176.819 175.900 0.036 0.000 1.060 221 Y CA -0.563 57.568 58.100 0.052 0.000 1.167 221 Y CB -0.475 38.020 38.460 0.058 0.000 1.242 221 Y HN -0.012 8.268 8.280 0.000 0.000 0.650 222 G N 0.527 109.293 108.800 -0.058 0.000 2.880 222 G HA2 0.256 4.196 3.960 -0.034 0.000 0.209 222 G HA3 0.256 4.196 3.960 -0.034 0.000 0.209 222 G C -0.011 174.879 174.900 -0.018 0.000 1.157 222 G CA 0.311 45.378 45.100 -0.056 0.000 0.779 222 G HN 0.157 8.447 8.290 0.000 0.000 0.539 223 V N 0.477 120.372 119.914 -0.032 0.000 2.481 223 V HA 0.465 4.565 4.120 -0.034 0.000 0.286 223 V C -0.402 175.590 176.094 -0.170 0.000 1.042 223 V CA -0.630 61.582 62.300 -0.147 0.000 0.928 223 V CB 1.595 33.212 31.823 -0.343 0.000 0.986 223 V HN 0.108 8.298 8.190 0.000 0.000 0.462 224 K N 2.317 122.581 120.400 -0.227 0.000 2.270 224 K HA 0.805 5.105 4.320 -0.034 0.000 0.255 224 K C -0.576 175.873 176.600 -0.252 0.000 0.936 224 K CA -0.195 55.941 56.287 -0.251 0.000 0.809 224 K CB 2.026 34.290 32.500 -0.393 0.000 1.131 224 K HN 0.715 8.965 8.250 0.000 0.000 0.427 225 S N 0.202 115.811 115.700 -0.151 0.000 2.588 225 S HA 0.565 5.015 4.470 -0.034 0.000 0.269 225 S C -1.151 173.477 174.600 0.048 0.000 1.157 225 S CA -0.738 57.375 58.200 -0.145 0.000 0.824 225 S CB 0.961 64.037 63.200 -0.208 0.000 1.126 225 S HN 0.677 8.987 8.310 0.000 0.000 0.464 226 T N 0.418 114.992 114.554 0.034 0.000 2.881 226 T HA 0.498 4.828 4.350 -0.034 0.000 0.278 226 T C 1.335 176.111 174.700 0.126 0.000 0.982 226 T CA -0.484 61.686 62.100 0.116 0.000 0.989 226 T CB 0.715 69.590 68.868 0.011 0.000 1.058 226 T HN 0.473 8.713 8.240 0.000 0.000 0.529 227 I N 0.816 121.474 120.570 0.147 0.000 2.286 227 I HA -0.065 4.084 4.170 -0.034 0.000 0.248 227 I C 2.383 178.571 176.117 0.118 0.000 1.115 227 I CA 1.515 62.901 61.300 0.142 0.000 1.392 227 I CB -0.549 37.554 38.000 0.171 0.000 1.065 227 I HN 0.833 9.043 8.210 0.000 0.000 0.418 228 E N 0.041 120.197 120.200 -0.073 0.000 2.031 228 E HA -0.240 4.090 4.350 -0.034 0.000 0.193 228 E C 1.768 178.418 176.600 0.083 0.000 0.994 228 E CA 1.581 57.931 56.400 -0.082 0.000 0.800 228 E CB -0.241 29.314 29.700 -0.241 0.000 0.752 228 E HN 0.484 8.844 8.360 0.000 0.000 0.447 229 D N 0.132 120.559 120.400 0.044 0.000 2.144 229 D HA -0.126 4.494 4.640 -0.034 0.000 0.199 229 D C 1.862 178.257 176.300 0.159 0.000 0.984 229 D CA 0.946 54.980 54.000 0.056 0.000 0.834 229 D CB -0.035 40.727 40.800 -0.064 0.000 0.955 229 D HN 0.083 8.453 8.370 0.000 0.000 0.465 230 M N 0.278 119.988 119.600 0.183 0.000 2.175 230 M HA -0.007 4.453 4.480 -0.034 0.000 0.264 230 M C 2.256 178.736 176.300 0.299 0.000 1.063 230 M CA 0.693 56.168 55.300 0.291 0.000 1.119 230 M CB -1.033 31.722 32.600 0.259 0.000 1.377 230 M HN -0.020 8.270 8.290 0.000 0.000 0.415 231 A N 0.443 123.415 122.820 0.253 0.000 1.908 231 A HA -0.180 4.120 4.320 -0.034 0.000 0.218 231 A C 2.357 180.020 177.584 0.132 0.000 1.181 231 A CA 1.553 53.707 52.037 0.196 0.000 0.627 231 A CB -0.618 18.544 19.000 0.269 0.000 0.818 231 A HN 0.448 8.598 8.150 0.000 0.000 0.445 232 R N -1.716 118.882 120.500 0.162 0.000 2.096 232 R HA -0.171 4.149 4.340 -0.034 0.000 0.235 232 R C 2.188 178.591 176.300 0.171 0.000 1.127 232 R CA 1.381 57.556 56.100 0.126 0.000 0.968 232 R CB -0.409 29.969 30.300 0.129 0.000 0.861 232 R HN 0.881 9.151 8.270 0.000 0.000 0.440 233 W N 1.149 122.471 121.300 0.037 0.000 2.355 233 W HA -0.213 4.429 4.660 -0.030 0.000 0.309 233 W C 1.567 178.040 176.519 -0.077 0.000 1.206 233 W CA 1.212 58.571 57.345 0.024 0.000 1.284 233 W CB -0.016 29.507 29.460 0.104 0.000 1.145 233 W HN -0.123 8.057 8.180 0.000 0.000 0.502 234 V N 1.276 121.142 119.914 -0.080 0.000 2.343 234 V HA -0.343 3.756 4.120 -0.034 0.000 0.247 234 V C 2.384 178.171 176.094 -0.511 0.000 1.051 234 V CA 2.234 64.300 62.300 -0.389 0.000 1.036 234 V CB -1.113 30.607 31.823 -0.172 0.000 0.654 234 V HN 0.249 8.439 8.190 0.000 0.000 0.451 235 Q N -0.200 119.434 119.800 -0.276 0.000 2.135 235 Q HA -0.189 4.131 4.340 -0.034 0.000 0.204 235 Q C 2.502 178.318 176.000 -0.305 0.000 0.981 235 Q CA 1.992 57.641 55.803 -0.258 0.000 0.856 235 Q CB -0.244 28.411 28.738 -0.139 0.000 0.902 235 Q HN 0.621 8.891 8.270 0.000 0.000 0.425 236 S N 0.765 116.293 115.700 -0.286 0.000 2.368 236 S HA -0.073 4.377 4.470 -0.034 0.000 0.224 236 S C 1.539 175.876 174.600 -0.438 0.000 1.029 236 S CA 0.861 58.898 58.200 -0.271 0.000 0.988 236 S CB -0.163 62.946 63.200 -0.151 0.000 0.838 236 S HN 0.383 8.693 8.310 0.000 0.000 0.462 237 N N 1.185 119.454 118.700 -0.719 0.000 2.331 237 N HA 0.097 4.816 4.740 -0.034 0.000 0.180 237 N C 1.601 176.572 175.510 -0.898 0.000 1.019 237 N CA 0.584 53.099 53.050 -0.891 0.000 0.881 237 N CB -0.177 37.544 38.487 -1.277 0.000 0.972 237 N HN 0.323 8.703 8.380 0.000 0.000 0.435 238 L N 0.508 121.195 121.223 -0.894 0.000 2.093 238 L HA -0.050 4.270 4.340 -0.034 0.000 0.208 238 L C 0.505 177.179 176.870 -0.327 0.000 1.085 238 L CA 1.094 55.579 54.840 -0.591 0.000 0.755 238 L CB 0.120 41.899 42.059 -0.465 0.000 0.904 238 L HN -0.095 8.135 8.230 0.000 0.000 0.435 239 K N -0.902 119.321 120.400 -0.295 0.000 2.920 239 K HA 0.249 4.549 4.320 -0.034 0.000 0.175 239 K C -2.059 174.440 176.600 -0.168 0.000 1.099 239 K CA -1.409 54.761 56.287 -0.194 0.000 0.939 239 K CB 1.131 33.534 32.500 -0.161 0.000 1.148 239 K HN -0.150 8.100 8.250 0.000 0.000 0.613 240 P HA -0.065 4.355 4.420 0.000 0.000 0.218 240 P C 1.272 178.521 177.300 -0.084 0.000 1.149 240 P CA 0.761 63.785 63.100 -0.126 0.000 0.817 240 P CB 0.304 31.938 31.700 -0.111 0.000 0.785 241 L N -0.656 120.520 121.223 -0.079 0.000 2.265 241 L HA -0.151 4.169 4.340 -0.034 0.000 0.215 241 L C 1.504 178.341 176.870 -0.055 0.000 1.117 241 L CA 1.241 56.046 54.840 -0.059 0.000 0.782 241 L CB -0.856 41.169 42.059 -0.057 0.000 0.914 241 L HN -0.037 8.193 8.230 0.000 0.000 0.441 242 D N 0.152 120.512 120.400 -0.067 0.000 2.348 242 D HA 0.061 4.680 4.640 -0.034 0.000 0.216 242 D C 0.771 177.044 176.300 -0.045 0.000 0.970 242 D CA 0.683 54.648 54.000 -0.058 0.000 0.889 242 D CB 0.055 40.812 40.800 -0.071 0.000 0.912 242 D HN 0.253 8.623 8.370 0.000 0.000 0.524 243 I N 1.705 122.249 120.570 -0.044 0.000 2.416 243 I HA -0.005 4.145 4.170 -0.034 0.000 0.288 243 I C 1.194 177.300 176.117 -0.018 0.000 1.051 243 I CA -0.313 60.972 61.300 -0.026 0.000 1.375 243 I CB 1.138 39.125 38.000 -0.021 0.000 1.407 243 I HN -0.136 8.074 8.210 0.000 0.000 0.516 244 N N 3.422 122.116 118.700 -0.011 0.000 2.424 244 N HA -0.056 4.664 4.740 -0.034 0.000 0.178 244 N C -0.066 175.440 175.510 -0.006 0.000 1.060 244 N CA 0.165 53.209 53.050 -0.010 0.000 0.901 244 N CB 0.046 38.527 38.487 -0.011 0.000 0.979 244 N HN 0.436 8.816 8.380 0.000 0.000 0.451 245 E N 0.528 120.727 120.200 -0.001 0.000 2.070 245 E HA 0.104 4.433 4.350 -0.034 0.000 0.282 245 E C 0.613 177.214 176.600 0.002 0.000 1.104 245 E CA -0.240 56.160 56.400 0.001 0.000 0.876 245 E CB 1.458 31.162 29.700 0.007 0.000 1.055 245 E HN 0.105 8.465 8.360 0.000 0.000 0.401 246 K N 1.880 122.280 120.400 -0.001 0.000 2.032 246 K HA -0.180 4.120 4.320 -0.034 0.000 0.209 246 K C 1.772 178.376 176.600 0.006 0.000 1.048 246 K CA 2.170 58.457 56.287 0.000 0.000 0.927 246 K CB -0.416 32.083 32.500 -0.001 0.000 0.712 246 K HN 0.642 8.892 8.250 0.000 0.000 0.441 247 T N -0.965 113.594 114.554 0.008 0.000 2.915 247 T HA -0.132 4.198 4.350 -0.034 0.000 0.269 247 T C 1.734 176.449 174.700 0.025 0.000 1.071 247 T CA 1.162 63.271 62.100 0.015 0.000 1.132 247 T CB -0.255 68.619 68.868 0.010 0.000 0.878 247 T HN 0.153 8.393 8.240 0.000 0.000 0.479 248 L N 1.019 122.257 121.223 0.025 0.000 2.095 248 L HA 0.166 4.486 4.340 -0.034 0.000 0.204 248 L C 2.806 179.698 176.870 0.037 0.000 1.080 248 L CA 1.688 56.554 54.840 0.042 0.000 0.759 248 L CB -1.069 41.018 42.059 0.046 0.000 0.914 248 L HN 0.366 8.596 8.230 0.000 0.000 0.439 249 Q N -0.661 119.148 119.800 0.016 0.000 2.062 249 Q HA -0.318 4.002 4.340 -0.034 0.000 0.209 249 Q C 2.164 178.168 176.000 0.006 0.000 0.996 249 Q CA 2.615 58.416 55.803 -0.002 0.000 0.859 249 Q CB -0.221 28.510 28.738 -0.011 0.000 0.920 249 Q HN 0.671 8.941 8.270 0.000 0.000 0.415 250 Q N -0.739 119.070 119.800 0.016 0.000 2.084 250 Q HA -0.121 4.199 4.340 -0.034 0.000 0.202 250 Q C 2.089 178.119 176.000 0.050 0.000 0.978 250 Q CA 1.159 56.977 55.803 0.025 0.000 0.844 250 Q CB -0.287 28.466 28.738 0.025 0.000 0.898 250 Q HN 0.602 8.872 8.270 0.000 0.000 0.426 251 G N 1.101 109.938 108.800 0.062 0.000 2.446 251 G HA2 -0.249 3.691 3.960 -0.034 0.000 0.217 251 G HA3 -0.249 3.691 3.960 -0.034 0.000 0.217 251 G C 1.405 176.377 174.900 0.120 0.000 1.168 251 G CA 0.754 45.912 45.100 0.097 0.000 0.771 251 G HN 0.229 8.519 8.290 0.000 0.000 0.551 252 I N 0.314 120.936 120.570 0.088 0.000 2.163 252 I HA -0.242 3.908 4.170 -0.034 0.000 0.243 252 I C 3.059 179.214 176.117 0.064 0.000 1.085 252 I CA 1.330 62.672 61.300 0.069 0.000 1.347 252 I CB -0.276 37.705 38.000 -0.032 0.000 1.044 252 I HN 0.237 8.447 8.210 0.000 0.000 0.408 253 Q N 0.312 120.131 119.800 0.032 0.000 2.124 253 Q HA -0.184 4.136 4.340 -0.034 0.000 0.202 253 Q C 2.371 178.413 176.000 0.070 0.000 0.977 253 Q CA 1.341 57.158 55.803 0.024 0.000 0.850 253 Q CB -0.129 28.608 28.738 -0.002 0.000 0.901 253 Q HN 0.547 8.817 8.270 0.000 0.000 0.429 254 L N -0.135 121.156 121.223 0.113 0.000 2.093 254 L HA -0.122 4.197 4.340 -0.034 0.000 0.208 254 L C 2.447 179.488 176.870 0.286 0.000 1.085 254 L CA 0.814 55.764 54.840 0.183 0.000 0.755 254 L CB -0.506 41.665 42.059 0.187 0.000 0.904 254 L HN 0.193 8.423 8.230 0.000 0.000 0.435 255 A N -0.617 122.363 122.820 0.267 0.000 2.015 255 A HA -0.189 4.111 4.320 -0.034 0.000 0.219 255 A C 2.036 179.867 177.584 0.412 0.000 1.163 255 A CA 1.209 53.456 52.037 0.350 0.000 0.646 255 A CB -0.281 18.949 19.000 0.383 0.000 0.806 255 A HN 0.505 8.655 8.150 0.000 0.000 0.448 256 Q N 0.142 120.103 119.800 0.268 0.000 2.320 256 Q HA 0.184 4.503 4.340 -0.034 0.000 0.201 256 Q C -0.061 175.987 176.000 0.081 0.000 0.910 256 Q CA -0.300 55.597 55.803 0.157 0.000 0.946 256 Q CB 0.343 29.078 28.738 -0.005 0.000 1.062 256 Q HN 0.494 8.764 8.270 0.000 0.000 0.503 257 S N 0.920 116.669 115.700 0.081 0.000 2.593 257 S HA 0.259 4.709 4.470 -0.034 0.000 0.269 257 S C 0.095 174.582 174.600 -0.189 0.000 1.334 257 S CA -0.319 57.792 58.200 -0.149 0.000 1.015 257 S CB 0.636 63.622 63.200 -0.357 0.000 0.912 257 S HN 0.228 8.538 8.310 0.000 0.000 0.541 258 R N 1.217 121.537 120.500 -0.300 0.000 2.215 258 R HA 0.258 4.578 4.340 -0.034 0.000 0.337 258 R C -0.437 175.703 176.300 -0.268 0.000 1.010 258 R CA -0.154 55.869 56.100 -0.129 0.000 0.871 258 R CB 0.383 30.573 30.300 -0.182 0.000 1.134 258 R HN 0.679 8.949 8.270 0.000 0.000 0.477 259 Y N 0.568 120.882 120.300 0.024 0.000 2.476 259 Y HA 0.131 4.660 4.550 -0.034 0.000 0.283 259 Y C 0.100 175.699 175.900 -0.501 0.000 1.109 259 Y CA 0.326 58.279 58.100 -0.246 0.000 1.246 259 Y CB 0.553 38.880 38.460 -0.223 0.000 1.068 259 Y HN 0.459 8.739 8.280 0.000 0.000 0.552 260 W N -0.299 121.174 121.300 0.289 0.000 3.167 260 W HA 0.534 5.173 4.660 -0.034 0.000 0.324 260 W C -0.943 175.698 176.519 0.203 0.000 1.230 260 W CA -0.972 56.501 57.345 0.214 0.000 1.184 260 W CB 1.150 30.721 29.460 0.185 0.000 1.414 260 W HN -0.464 7.716 8.180 0.000 0.000 0.551 261 Q N 1.472 121.484 119.800 0.353 0.000 2.356 261 Q HA 0.685 5.005 4.340 -0.034 0.000 0.270 261 Q C -1.365 174.654 176.000 0.031 0.000 1.058 261 Q CA -0.455 55.384 55.803 0.059 0.000 0.802 261 Q CB 2.651 31.357 28.738 -0.054 0.000 1.303 261 Q HN 0.444 8.714 8.270 0.000 0.000 0.444 262 T N 2.275 116.787 114.554 -0.069 0.000 2.921 262 T HA 0.626 4.956 4.350 -0.034 0.000 0.297 262 T C 0.329 174.964 174.700 -0.108 0.000 1.013 262 T CA 0.783 62.848 62.100 -0.059 0.000 0.990 262 T CB 0.979 69.828 68.868 -0.032 0.000 1.023 262 T HN 1.024 9.264 8.240 0.000 0.000 0.447 263 G N 4.639 113.385 108.800 -0.091 0.000 2.634 263 G HA2 -0.252 3.688 3.960 -0.034 0.000 0.309 263 G HA3 -0.252 3.688 3.960 -0.034 0.000 0.309 263 G C 0.131 174.943 174.900 -0.146 0.000 1.265 263 G CA 0.699 45.742 45.100 -0.095 0.000 0.998 263 G HN 0.730 9.020 8.290 0.000 0.000 0.551 264 D N 1.495 121.813 120.400 -0.138 0.000 2.427 264 D HA 0.343 4.963 4.640 -0.034 0.000 0.224 264 D C 0.952 177.124 176.300 -0.214 0.000 1.157 264 D CA 0.397 54.304 54.000 -0.155 0.000 0.828 264 D CB 0.063 40.817 40.800 -0.077 0.000 0.974 264 D HN 0.362 8.732 8.370 0.000 0.000 0.498 265 M N -0.036 119.392 119.600 -0.286 0.000 2.602 265 M HA 0.411 4.871 4.480 -0.034 0.000 0.312 265 M C -1.100 175.000 176.300 -0.334 0.000 1.181 265 M CA -0.810 54.390 55.300 -0.166 0.000 0.910 265 M CB 2.291 34.893 32.600 0.004 0.000 1.723 265 M HN -0.212 8.078 8.290 0.000 0.000 0.459 266 Y N 0.062 120.468 120.300 0.176 0.000 2.536 266 Y HA 0.512 5.042 4.550 -0.032 0.000 0.347 266 Y C -0.370 175.688 175.900 0.262 0.000 1.000 266 Y CA -0.908 57.314 58.100 0.203 0.000 1.051 266 Y CB 1.820 40.375 38.460 0.159 0.000 1.259 266 Y HN 0.481 8.761 8.280 0.000 0.000 0.468 267 Q N 1.164 121.255 119.800 0.486 0.000 2.333 267 Q HA 0.633 4.953 4.340 -0.034 0.000 0.265 267 Q C -0.268 176.040 176.000 0.514 0.000 0.989 267 Q CA -0.388 55.697 55.803 0.471 0.000 0.842 267 Q CB 1.519 30.550 28.738 0.488 0.000 1.262 267 Q HN 0.890 9.160 8.270 0.000 0.000 0.451 268 G N 2.536 111.608 108.800 0.454 0.000 2.702 268 G HA2 0.515 4.455 3.960 -0.034 0.000 0.254 268 G HA3 0.515 4.455 3.960 -0.034 0.000 0.254 268 G C -0.930 174.154 174.900 0.305 0.000 1.380 268 G CA -0.858 44.534 45.100 0.486 0.000 1.042 268 G HN 0.592 8.882 8.290 0.000 0.000 0.557 269 L N 1.133 122.499 121.223 0.237 0.000 2.282 269 L HA 0.457 4.777 4.340 -0.034 0.000 0.287 269 L C 1.391 178.313 176.870 0.086 0.000 1.075 269 L CA 0.432 55.280 54.840 0.013 0.000 0.839 269 L CB 0.426 42.457 42.059 -0.047 0.000 1.219 269 L HN 1.044 9.274 8.230 0.000 0.000 0.434 270 G N 2.135 110.967 108.800 0.054 0.000 4.039 270 G HA2 -0.302 3.638 3.960 -0.034 0.000 0.220 270 G HA3 -0.302 3.638 3.960 -0.034 0.000 0.220 270 G C -0.005 174.925 174.900 0.050 0.000 1.391 270 G CA -0.203 44.915 45.100 0.030 0.000 0.920 270 G HN 0.527 8.817 8.290 0.000 0.000 0.599 271 W N 2.561 123.982 121.300 0.202 0.000 2.193 271 W HA 0.543 5.185 4.660 -0.029 0.000 0.338 271 W C 0.836 177.475 176.519 0.200 0.000 1.310 271 W CA -0.067 57.383 57.345 0.175 0.000 1.243 271 W CB 0.363 29.907 29.460 0.140 0.000 1.165 271 W HN 0.366 8.546 8.180 0.000 0.000 0.566 272 E N 1.893 122.396 120.200 0.505 0.000 2.227 272 E HA 0.653 4.982 4.350 -0.034 0.000 0.268 272 E C -0.745 176.156 176.600 0.502 0.000 0.907 272 E CA -1.091 55.574 56.400 0.442 0.000 0.786 272 E CB 1.713 31.607 29.700 0.323 0.000 1.191 272 E HN 0.206 8.566 8.360 0.000 0.000 0.411 273 M N 1.639 121.504 119.600 0.440 0.000 2.569 273 M HA 0.480 4.939 4.480 -0.034 0.000 0.279 273 M C -1.661 174.891 176.300 0.420 0.000 1.253 273 M CA -0.374 55.135 55.300 0.348 0.000 0.867 273 M CB 1.758 34.475 32.600 0.195 0.000 1.727 273 M HN 0.296 8.586 8.290 0.000 0.000 0.467 274 L N -0.072 121.362 121.223 0.352 0.000 2.376 274 L HA 0.581 4.901 4.340 -0.034 0.000 0.258 274 L C -0.817 176.233 176.870 0.301 0.000 1.013 274 L CA -0.741 54.312 54.840 0.355 0.000 0.822 274 L CB 1.758 43.936 42.059 0.199 0.000 1.388 274 L HN 0.551 8.781 8.230 0.000 0.000 0.413 275 D N 0.752 121.320 120.400 0.281 0.000 2.414 275 D HA -0.018 4.602 4.640 -0.034 0.000 0.242 275 D C -0.977 175.467 176.300 0.241 0.000 1.129 275 D CA 0.228 54.353 54.000 0.208 0.000 0.885 275 D CB 1.164 42.058 40.800 0.157 0.000 1.198 275 D HN 0.353 8.723 8.370 0.000 0.000 0.437 276 W N 4.444 125.802 121.300 0.096 0.000 2.469 276 W HA 0.274 4.918 4.660 -0.027 0.000 0.320 276 W C -2.289 174.278 176.519 0.080 0.000 1.086 276 W CA -1.855 55.560 57.345 0.116 0.000 1.211 276 W CB 1.120 30.670 29.460 0.150 0.000 1.298 276 W HN 0.228 8.408 8.180 0.000 0.000 0.525 277 P HA 0.097 4.517 4.420 0.000 0.000 0.271 277 P C -0.345 176.614 177.300 -0.569 0.000 1.218 277 P CA 0.045 62.384 63.100 -1.269 0.000 0.780 277 P CB 1.386 32.546 31.700 -0.899 0.000 0.901 278 V N -0.679 118.903 119.914 -0.553 0.000 2.837 278 V HA 0.470 4.569 4.120 -0.034 0.000 0.310 278 V C 0.266 176.125 176.094 -0.393 0.000 1.059 278 V CA -1.055 61.045 62.300 -0.332 0.000 1.004 278 V CB 1.330 32.947 31.823 -0.344 0.000 1.045 278 V HN 0.534 8.724 8.190 0.000 0.000 0.465 279 N N 3.953 122.447 118.700 -0.343 0.000 2.406 279 N HA 0.346 5.066 4.740 -0.034 0.000 0.251 279 N C -1.455 173.743 175.510 -0.520 0.000 1.069 279 N CA -2.088 50.736 53.050 -0.376 0.000 0.947 279 N CB 1.461 39.792 38.487 -0.260 0.000 1.111 279 N HN 0.580 8.960 8.380 0.000 0.000 0.497 280 P HA -0.098 4.322 4.420 0.000 0.000 0.222 280 P C 0.676 177.638 177.300 -0.562 0.000 1.147 280 P CA 0.812 63.324 63.100 -0.980 0.000 0.790 280 P CB 0.445 31.089 31.700 -1.759 0.000 0.780 281 D N 1.020 121.169 120.400 -0.419 0.000 2.149 281 D HA -0.174 4.446 4.640 -0.034 0.000 0.198 281 D C 1.892 178.065 176.300 -0.212 0.000 0.990 281 D CA 1.089 54.927 54.000 -0.269 0.000 0.839 281 D CB -0.661 40.015 40.800 -0.207 0.000 0.948 281 D HN 0.282 8.652 8.370 0.000 0.000 0.460 282 I N -1.387 119.051 120.570 -0.220 0.000 2.928 282 I HA 0.013 4.163 4.170 -0.034 0.000 0.266 282 I C 1.858 177.901 176.117 -0.123 0.000 1.234 282 I CA 0.537 61.746 61.300 -0.153 0.000 1.483 282 I CB -0.395 37.523 38.000 -0.136 0.000 1.097 282 I HN 0.151 8.361 8.210 0.000 0.000 0.455 283 I N -1.576 118.892 120.570 -0.170 0.000 3.526 283 I HA 0.193 4.343 4.170 -0.034 0.000 0.294 283 I C 2.143 178.227 176.117 -0.056 0.000 1.229 283 I CA 0.385 61.641 61.300 -0.074 0.000 1.408 283 I CB -0.233 37.689 38.000 -0.130 0.000 1.127 283 I HN 0.044 8.254 8.210 0.000 0.000 0.439 284 I N 1.644 122.133 120.570 -0.136 0.000 2.233 284 I HA -0.083 4.066 4.170 -0.034 0.000 0.243 284 I C 1.054 177.126 176.117 -0.075 0.000 1.093 284 I CA 1.047 62.284 61.300 -0.104 0.000 1.380 284 I CB -0.310 37.609 38.000 -0.135 0.000 1.067 284 I HN 0.333 8.543 8.210 0.000 0.000 0.413 290 K N 2.934 123.314 120.400 -0.035 0.000 2.404 290 K HA 0.352 4.652 4.320 -0.034 0.000 0.194 290 K C 1.278 177.857 176.600 -0.035 0.000 1.023 290 K CA 0.118 56.385 56.287 -0.034 0.000 1.094 290 K CB 0.661 33.138 32.500 -0.037 0.000 0.841 290 K HN 0.609 8.859 8.250 0.000 0.000 0.523 291 I N -0.275 120.274 120.570 -0.035 0.000 3.039 291 I HA -0.013 4.137 4.170 -0.034 0.000 0.270 291 I C 2.098 178.185 176.117 -0.050 0.000 1.150 291 I CA 0.375 61.652 61.300 -0.038 0.000 1.448 291 I CB -0.100 37.882 38.000 -0.029 0.000 1.197 291 I HN -0.077 8.133 8.210 0.000 0.000 0.450 292 A N 1.235 124.017 122.820 -0.064 0.000 1.908 292 A HA -0.117 4.182 4.320 -0.034 0.000 0.218 292 A C 1.949 179.439 177.584 -0.157 0.000 1.181 292 A CA 1.531 53.483 52.037 -0.142 0.000 0.627 292 A CB -0.635 18.259 19.000 -0.176 0.000 0.818 292 A HN 0.438 8.588 8.150 0.000 0.000 0.445 293 L N -1.342 119.833 121.223 -0.080 0.000 2.818 293 L HA 0.436 4.755 4.340 -0.034 0.000 0.243 293 L C 0.535 177.413 176.870 0.013 0.000 1.185 293 L CA -0.092 54.739 54.840 -0.016 0.000 0.988 293 L CB -0.054 42.006 42.059 0.001 0.000 1.292 293 L HN 0.370 8.600 8.230 0.000 0.000 0.519 294 A N 0.317 123.132 122.820 -0.007 0.000 2.354 294 A HA 0.827 5.127 4.320 -0.034 0.000 0.321 294 A C -0.124 177.448 177.584 -0.021 0.000 1.125 294 A CA -0.437 51.599 52.037 -0.002 0.000 0.799 294 A CB 1.178 20.168 19.000 -0.017 0.000 1.293 294 A HN 0.121 8.271 8.150 0.000 0.000 0.452 295 A N 1.978 124.785 122.820 -0.022 0.000 2.395 295 A HA 0.571 4.870 4.320 -0.034 0.000 0.286 295 A C 0.213 177.680 177.584 -0.195 0.000 1.193 295 A CA -0.130 51.832 52.037 -0.125 0.000 0.852 295 A CB -0.161 18.778 19.000 -0.101 0.000 1.118 295 A HN 0.628 8.778 8.150 0.000 0.000 0.524 296 R N 3.094 123.463 120.500 -0.217 0.000 2.686 296 R HA 0.481 4.800 4.340 -0.034 0.000 0.286 296 R C -3.083 173.076 176.300 -0.235 0.000 0.969 296 R CA -2.144 53.843 56.100 -0.188 0.000 0.898 296 R CB 2.119 32.351 30.300 -0.112 0.000 1.183 296 R HN 0.469 8.739 8.270 0.000 0.000 0.456 297 P HA 0.052 4.472 4.420 0.000 0.000 0.271 297 P C -0.231 177.007 177.300 -0.103 0.000 1.216 297 P CA -0.142 62.849 63.100 -0.182 0.000 0.776 297 P CB 0.756 32.380 31.700 -0.125 0.000 0.881 298 V N 0.014 119.882 119.914 -0.077 0.000 2.864 298 V HA 0.566 4.666 4.120 -0.034 0.000 0.314 298 V C -0.111 176.120 176.094 0.228 0.000 1.073 298 V CA -1.179 61.158 62.300 0.060 0.000 0.956 298 V CB 2.131 33.948 31.823 -0.009 0.000 1.023 298 V HN 0.427 8.617 8.190 0.000 0.000 0.435 299 K N 4.188 124.764 120.400 0.293 0.000 2.213 299 K HA 0.543 4.843 4.320 -0.034 0.000 0.270 299 K C -2.645 174.180 176.600 0.375 0.000 1.002 299 K CA -2.017 54.438 56.287 0.279 0.000 0.868 299 K CB 1.917 34.509 32.500 0.153 0.000 1.093 299 K HN 0.624 8.874 8.250 0.000 0.000 0.454 300 P HA 0.178 4.598 4.420 0.000 0.000 0.275 300 P C -0.682 176.523 177.300 -0.158 0.000 1.228 300 P CA -0.147 62.811 63.100 -0.236 0.000 0.786 300 P CB 0.894 32.435 31.700 -0.265 0.000 0.927 301 I N 2.297 122.706 120.570 -0.268 0.000 2.382 301 I HA 0.329 4.479 4.170 -0.034 0.000 0.286 301 I C 0.091 176.092 176.117 -0.193 0.000 1.002 301 I CA -0.243 60.967 61.300 -0.150 0.000 1.135 301 I CB 1.742 39.684 38.000 -0.097 0.000 1.288 301 I HN 0.318 8.528 8.210 0.000 0.000 0.448 302 T N 3.358 117.836 114.554 -0.126 0.000 2.949 302 T HA 0.571 4.901 4.350 -0.034 0.000 0.300 302 T C -2.040 172.616 174.700 -0.073 0.000 0.988 302 T CA -1.394 60.641 62.100 -0.108 0.000 0.993 302 T CB 1.248 70.065 68.868 -0.085 0.000 0.984 302 T HN 0.312 8.552 8.240 0.000 0.000 0.442 303 P HA 0.366 4.786 4.420 0.000 0.000 0.270 303 P C -2.761 174.444 177.300 -0.159 0.000 1.223 303 P CA -1.327 61.715 63.100 -0.097 0.000 0.785 303 P CB -0.460 31.194 31.700 -0.075 0.000 0.923 304 P HA 0.023 4.443 4.420 0.000 0.000 0.266 304 P C -0.291 176.822 177.300 -0.312 0.000 1.195 304 P CA 0.202 63.053 63.100 -0.414 0.000 0.768 304 P CB -0.050 31.142 31.700 -0.848 0.000 0.838 305 T N 5.623 120.007 114.554 -0.282 0.000 2.784 305 T HA 0.181 4.510 4.350 -0.034 0.000 0.291 305 T C -2.034 172.538 174.700 -0.213 0.000 0.942 305 T CA -0.737 61.235 62.100 -0.213 0.000 1.161 305 T CB -0.647 68.090 68.868 -0.218 0.000 0.885 305 T HN 0.324 8.564 8.240 0.000 0.000 0.534 306 P HA 0.127 4.547 4.420 0.000 0.000 0.267 306 P C -0.331 176.896 177.300 -0.123 0.000 1.201 306 P CA -0.385 62.639 63.100 -0.127 0.000 0.775 306 P CB 0.312 31.958 31.700 -0.090 0.000 0.854 307 A N 2.631 125.392 122.820 -0.098 0.000 2.572 307 A HA 0.039 4.338 4.320 -0.034 0.000 0.256 307 A C 0.217 177.744 177.584 -0.094 0.000 1.041 307 A CA 0.227 52.209 52.037 -0.092 0.000 0.790 307 A CB -0.883 18.075 19.000 -0.070 0.000 0.947 307 A HN 0.366 8.516 8.150 0.000 0.000 0.518 308 V N 6.083 125.931 119.914 -0.109 0.000 2.488 308 V HA 0.110 4.210 4.120 -0.034 0.000 0.277 308 V C 1.609 177.665 176.094 -0.063 0.000 1.046 308 V CA -0.383 61.864 62.300 -0.089 0.000 0.986 308 V CB 0.949 32.706 31.823 -0.110 0.000 0.989 308 V HN 1.032 9.222 8.190 0.000 0.000 0.475 309 R N 3.582 124.055 120.500 -0.046 0.000 2.092 309 R HA -0.019 4.301 4.340 -0.034 0.000 0.231 309 R C 1.275 177.562 176.300 -0.021 0.000 1.119 309 R CA 1.316 57.391 56.100 -0.041 0.000 0.970 309 R CB -0.128 30.148 30.300 -0.039 0.000 0.864 309 R HN 0.742 9.012 8.270 0.000 0.000 0.440 310 A N 1.880 124.715 122.820 0.025 0.000 3.091 310 A HA 0.270 4.570 4.320 -0.034 0.000 0.264 310 A C -0.462 177.219 177.584 0.162 0.000 1.673 310 A CA 0.007 52.112 52.037 0.113 0.000 1.362 310 A CB 0.012 19.105 19.000 0.156 0.000 1.137 310 A HN 0.036 8.186 8.150 0.000 0.000 0.617 311 S N 0.500 116.259 115.700 0.099 0.000 2.570 311 S HA 0.538 4.988 4.470 -0.034 0.000 0.286 311 S C -0.949 173.731 174.600 0.132 0.000 1.099 311 S CA -0.597 57.678 58.200 0.124 0.000 0.913 311 S CB 1.242 64.432 63.200 -0.017 0.000 1.085 311 S HN 0.690 9.000 8.310 0.000 0.000 0.480 312 W N 3.683 125.005 121.300 0.036 0.000 2.316 312 W HA 0.567 5.208 4.660 -0.031 0.000 0.308 312 W C -1.855 174.528 176.519 -0.227 0.000 1.106 312 W CA -0.505 56.801 57.345 -0.065 0.000 1.262 312 W CB 0.624 30.160 29.460 0.127 0.000 1.233 312 W HN 0.341 8.521 8.180 0.000 0.000 0.447 313 V N 7.497 126.961 119.914 -0.750 0.000 2.417 313 V HA 0.416 4.515 4.120 -0.034 0.000 0.291 313 V C -0.131 175.536 176.094 -0.711 0.000 1.024 313 V CA -0.416 61.419 62.300 -0.776 0.000 0.861 313 V CB 1.352 32.261 31.823 -1.523 0.000 0.985 313 V HN 0.670 8.860 8.190 0.000 0.000 0.436 314 H N 2.462 121.419 119.070 -0.188 0.000 2.990 314 H HA 0.924 5.460 4.556 -0.034 0.000 0.336 314 H C -1.261 174.267 175.328 0.334 0.000 1.306 314 H CA -1.259 54.780 56.048 -0.014 0.000 1.118 314 H CB 2.324 32.083 29.762 -0.005 0.000 1.856 314 H HN 0.440 8.720 8.280 0.000 0.000 0.538 315 K N 0.978 121.433 120.400 0.091 0.000 2.569 315 K HA 0.304 4.604 4.320 -0.034 0.000 0.259 315 K C -1.457 175.188 176.600 0.076 0.000 0.932 315 K CA -0.086 56.206 56.287 0.008 0.000 0.833 315 K CB 2.260 34.763 32.500 0.004 0.000 1.340 315 K HN 0.959 9.209 8.250 0.000 0.000 0.429 316 T N -0.207 114.435 114.554 0.146 0.000 2.925 316 T HA 0.904 5.233 4.350 -0.034 0.000 0.285 316 T C 0.086 174.896 174.700 0.184 0.000 1.021 316 T CA -0.515 61.754 62.100 0.282 0.000 1.042 316 T CB 1.662 70.669 68.868 0.232 0.000 1.037 316 T HN 0.621 8.861 8.240 0.000 0.000 0.481 317 G N -0.275 108.641 108.800 0.193 0.000 2.696 317 G HA2 0.795 4.735 3.960 -0.034 0.000 0.295 317 G HA3 0.795 4.735 3.960 -0.034 0.000 0.295 317 G C -1.497 173.499 174.900 0.159 0.000 1.398 317 G CA -0.638 44.570 45.100 0.180 0.000 0.920 317 G HN 1.210 9.500 8.290 0.000 0.000 0.492 318 A N 0.255 123.164 122.820 0.147 0.000 2.574 318 A HA 0.947 5.247 4.320 -0.034 0.000 0.297 318 A C 0.001 177.664 177.584 0.131 0.000 1.062 318 A CA 0.095 52.220 52.037 0.147 0.000 0.686 318 A CB 1.597 20.653 19.000 0.093 0.000 1.285 318 A HN 1.770 9.920 8.150 0.000 0.000 0.403 319 T N -1.647 113.025 114.554 0.197 0.000 2.807 319 T HA 0.641 4.971 4.350 -0.034 0.000 0.277 319 T C 1.427 176.230 174.700 0.172 0.000 1.006 319 T CA 0.163 62.352 62.100 0.147 0.000 1.006 319 T CB 0.914 69.919 68.868 0.228 0.000 1.274 319 T HN 1.556 9.796 8.240 0.000 0.000 0.569 320 G N -0.060 108.825 108.800 0.143 0.000 2.505 320 G HA2 0.048 3.988 3.960 -0.034 0.000 0.220 320 G HA3 0.048 3.988 3.960 -0.034 0.000 0.220 320 G C 1.215 176.207 174.900 0.153 0.000 1.145 320 G CA 0.782 45.956 45.100 0.123 0.000 0.761 320 G HN 1.173 9.463 8.290 0.000 0.000 0.571 321 G N -1.499 107.443 108.800 0.237 0.000 3.192 321 G HA2 0.480 4.420 3.960 -0.034 0.000 0.239 321 G HA3 0.480 4.420 3.960 -0.034 0.000 0.239 321 G C -0.347 174.539 174.900 -0.023 0.000 1.084 321 G CA -0.474 44.682 45.100 0.093 0.000 0.784 321 G HN 0.219 8.509 8.290 0.000 0.000 0.540 322 F N -0.543 119.550 119.950 0.238 0.000 2.599 322 F HA 0.698 5.205 4.527 -0.034 0.000 0.311 322 F C 0.318 176.260 175.800 0.236 0.000 1.076 322 F CA -1.050 57.128 58.000 0.296 0.000 0.937 322 F CB 2.444 41.646 39.000 0.335 0.000 1.282 322 F HN 0.019 8.319 8.300 0.000 0.000 0.460 323 G N 0.570 109.640 108.800 0.449 0.000 2.687 323 G HA2 0.583 4.523 3.960 -0.034 0.000 0.301 323 G HA3 0.583 4.523 3.960 -0.034 0.000 0.301 323 G C -1.598 173.468 174.900 0.277 0.000 1.416 323 G CA -0.776 44.471 45.100 0.246 0.000 1.005 323 G HN 0.749 9.039 8.290 0.000 0.000 0.509 324 S N 0.587 116.420 115.700 0.222 0.000 2.570 324 S HA 0.839 5.288 4.470 -0.034 0.000 0.286 324 S C -1.553 173.237 174.600 0.317 0.000 1.099 324 S CA -0.958 57.394 58.200 0.252 0.000 0.913 324 S CB 2.405 65.747 63.200 0.236 0.000 1.085 324 S HN 1.058 9.368 8.310 0.000 0.000 0.480 325 Y N 0.382 120.786 120.300 0.174 0.000 2.482 325 Y HA 0.666 5.197 4.550 -0.032 0.000 0.334 325 Y C -1.722 174.324 175.900 0.243 0.000 1.091 325 Y CA -0.872 57.347 58.100 0.199 0.000 1.027 325 Y CB 1.725 40.305 38.460 0.200 0.000 1.306 325 Y HN 0.926 9.206 8.280 0.000 0.000 0.446 326 V N 5.025 124.747 119.914 -0.319 0.000 2.686 326 V HA 0.990 5.090 4.120 -0.034 0.000 0.306 326 V C -1.592 174.247 176.094 -0.424 0.000 1.065 326 V CA 0.082 62.299 62.300 -0.140 0.000 0.894 326 V CB 1.412 33.394 31.823 0.265 0.000 1.004 326 V HN 1.220 9.410 8.190 0.000 0.000 0.424 327 A N 6.213 128.830 122.820 -0.338 0.000 2.520 327 A HA 1.002 5.302 4.320 -0.034 0.000 0.298 327 A C -1.298 176.007 177.584 -0.466 0.000 1.051 327 A CA -0.444 51.228 52.037 -0.608 0.000 0.690 327 A CB 1.631 20.097 19.000 -0.889 0.000 1.281 327 A HN 1.801 9.951 8.150 0.000 0.000 0.402 328 F N -0.684 118.833 119.950 -0.721 0.000 2.645 328 F HA 0.853 5.362 4.527 -0.031 0.000 0.310 328 F C -1.340 174.126 175.800 -0.557 0.000 1.102 328 F CA -1.294 56.363 58.000 -0.572 0.000 0.952 328 F CB 1.365 40.085 39.000 -0.466 0.000 1.326 328 F HN 0.303 8.603 8.300 0.000 0.000 0.456 329 I N 2.370 122.788 120.570 -0.254 0.000 2.466 329 I HA 0.321 4.471 4.170 -0.034 0.000 0.279 329 I C -2.161 173.867 176.117 -0.148 0.000 1.033 329 I CA -1.845 59.274 61.300 -0.302 0.000 1.123 329 I CB 1.881 39.567 38.000 -0.523 0.000 1.237 329 I HN 0.385 8.595 8.210 0.000 0.000 0.460 330 P HA -0.222 4.198 4.420 0.000 0.000 0.216 330 P C 1.331 178.572 177.300 -0.097 0.000 1.153 330 P CA 1.349 64.420 63.100 -0.049 0.000 0.858 330 P CB 0.151 31.832 31.700 -0.031 0.000 0.789 331 E N 0.590 120.731 120.200 -0.099 0.000 2.265 331 E HA -0.185 4.145 4.350 -0.034 0.000 0.196 331 E C 1.194 177.729 176.600 -0.109 0.000 0.996 331 E CA 1.117 57.466 56.400 -0.085 0.000 0.832 331 E CB -0.596 29.076 29.700 -0.046 0.000 0.756 331 E HN 0.256 8.616 8.360 0.000 0.000 0.491 332 K N 0.439 120.744 120.400 -0.158 0.000 2.358 332 K HA 0.090 4.390 4.320 -0.034 0.000 0.197 332 K C -0.357 176.139 176.600 -0.173 0.000 1.025 332 K CA 0.371 56.557 56.287 -0.168 0.000 1.104 332 K CB 0.478 32.849 32.500 -0.215 0.000 0.855 332 K HN 0.102 8.352 8.250 0.000 0.000 0.531 333 E N 0.913 121.017 120.200 -0.159 0.000 2.389 333 E HA -0.207 4.123 4.350 -0.034 0.000 0.243 333 E C -0.864 175.642 176.600 -0.156 0.000 1.154 333 E CA 0.209 56.512 56.400 -0.162 0.000 0.723 333 E CB -1.371 28.228 29.700 -0.168 0.000 1.261 333 E HN 0.122 8.482 8.360 0.000 0.000 0.390 334 L N -0.273 120.866 121.223 -0.140 0.000 2.386 334 L HA 0.830 5.150 4.340 -0.034 0.000 0.271 334 L C 0.140 176.960 176.870 -0.082 0.000 0.993 334 L CA 0.194 54.977 54.840 -0.095 0.000 0.819 334 L CB 2.065 44.055 42.059 -0.114 0.000 1.294 334 L HN 0.084 8.314 8.230 0.000 0.000 0.414 335 G N 4.010 112.792 108.800 -0.031 0.000 2.660 335 G HA2 0.638 4.578 3.960 -0.034 0.000 0.290 335 G HA3 0.638 4.578 3.960 -0.034 0.000 0.290 335 G C -2.207 172.714 174.900 0.035 0.000 1.432 335 G CA -0.479 44.608 45.100 -0.021 0.000 0.807 335 G HN 0.772 9.062 8.290 0.000 0.000 0.485 336 I N 0.018 120.616 120.570 0.046 0.000 2.692 336 I HA 0.608 4.757 4.170 -0.034 0.000 0.293 336 I C -1.290 174.913 176.117 0.144 0.000 1.200 336 I CA -0.925 60.450 61.300 0.125 0.000 1.036 336 I CB 2.277 40.378 38.000 0.168 0.000 1.258 336 I HN 0.365 8.575 8.210 0.000 0.000 0.421 337 V N 7.479 127.511 119.914 0.196 0.000 2.540 337 V HA 0.541 4.641 4.120 -0.034 0.000 0.302 337 V C -0.397 175.843 176.094 0.245 0.000 1.035 337 V CA -0.447 61.983 62.300 0.217 0.000 0.873 337 V CB 1.797 33.754 31.823 0.223 0.000 0.992 337 V HN 0.645 8.835 8.190 0.000 0.000 0.428 338 M N 6.171 125.926 119.600 0.258 0.000 2.197 338 M HA 0.621 5.081 4.480 -0.034 0.000 0.301 338 M C -1.298 175.107 176.300 0.174 0.000 0.987 338 M CA -0.135 55.311 55.300 0.244 0.000 0.921 338 M CB 1.914 34.701 32.600 0.312 0.000 1.569 338 M HN 0.380 8.670 8.290 0.000 0.000 0.431 339 L N 2.757 123.983 121.223 0.005 0.000 2.362 339 L HA 1.016 5.336 4.340 -0.034 0.000 0.275 339 L C -0.505 176.215 176.870 -0.249 0.000 0.998 339 L CA -0.746 53.956 54.840 -0.231 0.000 0.820 339 L CB 1.952 43.553 42.059 -0.764 0.000 1.270 339 L HN 0.818 9.048 8.230 0.000 0.000 0.415 340 A N 1.719 124.635 122.820 0.161 0.000 2.515 340 A HA 0.581 4.881 4.320 -0.034 0.000 0.298 340 A C -0.593 177.366 177.584 0.626 0.000 1.059 340 A CA -0.739 51.542 52.037 0.407 0.000 0.698 340 A CB 1.387 20.632 19.000 0.408 0.000 1.289 340 A HN 0.754 8.904 8.150 0.000 0.000 0.404 341 N N 1.154 120.165 118.700 0.518 0.000 2.575 341 N HA 0.173 4.893 4.740 -0.034 0.000 0.275 341 N C -0.448 175.090 175.510 0.047 0.000 1.202 341 N CA -0.120 52.947 53.050 0.027 0.000 0.945 341 N CB 0.268 38.749 38.487 -0.010 0.000 1.247 341 N HN 0.622 9.002 8.380 0.000 0.000 0.510 342 K N 0.184 120.698 120.400 0.189 0.000 2.543 342 K HA 0.219 4.519 4.320 -0.034 0.000 0.255 342 K C -1.596 175.197 176.600 0.322 0.000 0.934 342 K CA -0.699 55.714 56.287 0.209 0.000 0.810 342 K CB 1.287 33.904 32.500 0.195 0.000 1.315 342 K HN -0.038 8.212 8.250 0.000 0.000 0.433 343 N N 3.967 122.810 118.700 0.237 0.000 2.405 343 N HA 0.110 4.830 4.740 -0.034 0.000 0.260 343 N C -1.477 174.159 175.510 0.210 0.000 1.152 343 N CA 0.127 53.294 53.050 0.195 0.000 0.948 343 N CB -0.031 38.540 38.487 0.140 0.000 1.111 343 N HN 0.489 8.869 8.380 0.000 0.000 0.485 344 Y N 1.466 121.816 120.300 0.084 0.000 2.598 344 Y HA 0.774 5.303 4.550 -0.034 0.000 0.340 344 Y C -2.619 173.308 175.900 0.045 0.000 1.038 344 Y CA -2.985 55.148 58.100 0.055 0.000 1.100 344 Y CB 0.112 38.598 38.460 0.043 0.000 1.281 344 Y HN 0.312 8.592 8.280 0.000 0.000 0.488 345 P HA 0.029 4.449 4.420 0.000 0.000 0.268 345 P C 0.483 177.712 177.300 -0.119 0.000 1.205 345 P CA 0.008 63.095 63.100 -0.023 0.000 0.771 345 P CB 0.733 32.455 31.700 0.036 0.000 0.858 346 N N 3.701 122.325 118.700 -0.125 0.000 2.061 346 N HA -0.157 4.563 4.740 -0.034 0.000 0.193 346 N C -0.996 174.446 175.510 -0.113 0.000 1.030 346 N CA 1.700 54.665 53.050 -0.142 0.000 0.856 346 N CB -0.946 37.489 38.487 -0.086 0.000 1.023 346 N HN 0.313 8.693 8.380 0.000 0.000 0.424 347 P HA -0.053 4.367 4.420 0.000 0.000 0.218 347 P C 0.921 178.212 177.300 -0.015 0.000 1.148 347 P CA 1.374 64.448 63.100 -0.043 0.000 0.822 347 P CB -0.148 31.536 31.700 -0.027 0.000 0.784 348 A N -0.159 122.680 122.820 0.031 0.000 1.929 348 A HA -0.174 4.125 4.320 -0.034 0.000 0.216 348 A C 2.211 179.875 177.584 0.132 0.000 1.176 348 A CA 1.230 53.329 52.037 0.103 0.000 0.628 348 A CB -0.882 18.234 19.000 0.193 0.000 0.816 348 A HN 0.074 8.224 8.150 0.000 0.000 0.444 349 R N -0.530 120.020 120.500 0.084 0.000 2.070 349 R HA -0.089 4.230 4.340 -0.034 0.000 0.233 349 R C 2.010 178.234 176.300 -0.128 0.000 1.137 349 R CA 1.611 57.724 56.100 0.020 0.000 0.945 349 R CB -0.753 29.420 30.300 -0.211 0.000 0.845 349 R HN 0.359 8.629 8.270 0.000 0.000 0.430 350 V N 1.288 121.042 119.914 -0.266 0.000 2.407 350 V HA -0.214 3.886 4.120 -0.034 0.000 0.248 350 V C 2.483 178.615 176.094 0.063 0.000 1.055 350 V CA 1.889 64.041 62.300 -0.247 0.000 1.049 350 V CB -0.782 30.938 31.823 -0.171 0.000 0.662 350 V HN 0.425 8.615 8.190 0.000 0.000 0.455 351 A N 0.088 122.940 122.820 0.054 0.000 1.933 351 A HA -0.102 4.198 4.320 -0.034 0.000 0.218 351 A C 2.417 180.124 177.584 0.206 0.000 1.175 351 A CA 2.076 54.189 52.037 0.127 0.000 0.628 351 A CB -0.679 18.361 19.000 0.067 0.000 0.814 351 A HN 0.563 8.713 8.150 0.000 0.000 0.444 352 A N -0.168 122.747 122.820 0.158 0.000 1.873 352 A HA 0.216 4.516 4.320 -0.034 0.000 0.215 352 A C 2.517 180.239 177.584 0.229 0.000 1.186 352 A CA 1.937 54.066 52.037 0.155 0.000 0.616 352 A CB -1.041 18.023 19.000 0.106 0.000 0.823 352 A HN 1.034 9.184 8.150 0.000 0.000 0.442 353 A N -1.614 121.396 122.820 0.318 0.000 1.902 353 A HA -0.184 4.116 4.320 -0.034 0.000 0.217 353 A C 2.005 179.920 177.584 0.552 0.000 1.181 353 A CA 1.604 53.923 52.037 0.469 0.000 0.623 353 A CB -0.892 18.551 19.000 0.738 0.000 0.818 353 A HN 0.841 8.991 8.150 0.000 0.000 0.443 354 W N 0.378 121.916 121.300 0.396 0.000 2.381 354 W HA -0.177 4.465 4.660 -0.031 0.000 0.301 354 W C 2.430 179.092 176.519 0.239 0.000 1.205 354 W CA 1.915 59.454 57.345 0.324 0.000 1.285 354 W CB -0.293 29.186 29.460 0.031 0.000 1.133 354 W HN 0.504 8.684 8.180 0.000 0.000 0.521 355 Q N 0.103 120.056 119.800 0.254 0.000 2.096 355 Q HA -0.258 4.062 4.340 -0.034 0.000 0.204 355 Q C 2.024 177.988 176.000 -0.060 0.000 0.982 355 Q CA 2.515 58.345 55.803 0.045 0.000 0.850 355 Q CB -0.425 28.394 28.738 0.134 0.000 0.901 355 Q HN 0.231 8.501 8.270 0.000 0.000 0.422 356 I N 0.641 121.232 120.570 0.035 0.000 2.113 356 I HA -0.281 3.869 4.170 -0.034 0.000 0.238 356 I C 2.357 178.473 176.117 -0.002 0.000 1.070 356 I CA 1.330 62.646 61.300 0.026 0.000 1.332 356 I CB -1.162 36.889 38.000 0.085 0.000 1.044 356 I HN 0.382 8.592 8.210 0.000 0.000 0.402 357 L N 0.262 121.506 121.223 0.035 0.000 2.093 357 L HA -0.199 4.121 4.340 -0.034 0.000 0.208 357 L C 2.381 179.201 176.870 -0.084 0.000 1.085 357 L CA 1.252 56.100 54.840 0.014 0.000 0.755 357 L CB -0.796 41.329 42.059 0.109 0.000 0.904 357 L HN 0.438 8.668 8.230 0.000 0.000 0.435 358 N N 0.682 119.211 118.700 -0.286 0.000 2.166 358 N HA -0.174 4.545 4.740 -0.034 0.000 0.186 358 N C 1.829 177.239 175.510 -0.167 0.000 1.019 358 N CA 1.264 54.097 53.050 -0.362 0.000 0.856 358 N CB 0.192 37.962 38.487 -1.194 0.000 0.993 358 N HN 0.303 8.683 8.380 0.000 0.000 0.426 359 A N 0.850 123.580 122.820 -0.151 0.000 2.015 359 A HA 0.004 4.304 4.320 -0.034 0.000 0.219 359 A C 2.061 179.636 177.584 -0.016 0.000 1.163 359 A CA 0.712 52.709 52.037 -0.068 0.000 0.646 359 A CB -0.226 18.736 19.000 -0.063 0.000 0.806 359 A HN 0.336 8.486 8.150 0.000 0.000 0.448 360 L N -0.569 120.658 121.223 0.007 0.000 2.554 360 L HA 0.071 4.391 4.340 -0.034 0.000 0.225 360 L C 1.217 178.162 176.870 0.124 0.000 1.104 360 L CA -0.165 54.727 54.840 0.086 0.000 0.866 360 L CB -0.209 41.922 42.059 0.120 0.000 1.047 360 L HN 0.579 8.809 8.230 0.000 0.000 0.468 361 Q N 0.000 119.835 119.800 0.058 0.000 2.315 361 Q HA 0.000 4.320 4.340 -0.034 0.000 0.214 361 Q CA 0.000 55.833 55.803 0.050 0.000 1.022 361 Q CB 0.000 28.768 28.738 0.050 0.000 1.108 361 Q HN 0.000 8.270 8.270 0.000 0.000 0.481