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 3fm6_1_A DATA FIRST_RESID 1 DATA SEQUENCE ATcDDGRTTA NAAccILFPI LDDIQENLFD GAQcGEEVHE SLRLTFHDAI DATA SEQUENCE GFSPTLGGGG ADGSIIAFDT IETNFPANAG IDEIVSAQKP FVAKHNISAG DATA SEQUENCE DFIQFAGAVG VSNcPGGVRI PFFLGRPDAV AASPDHLVPE PQDSVDSILA DATA SEQUENCE RMGDAGFSPV EVVWLLASHS IAAADKVDPS IPGTPFDSTP GVFDSQFFIE DATA SEQUENCE TQLKGRLFPG TADNKGEAQS PLQGEIRLQS DHLLARDPQT AcEWQSMVNN DATA SEQUENCE QPKIQNRFAA TMSKMALLGQ DKTKLIDcSD VIPTPPALVG AAHLPAGFSL DATA SEQUENCE SDVEQAcAAT PFPALTADP VARS RESID RESNAME ATOMNAME SS_SHIFT SHIFT RC_SHIFT HM_SHIFT EF_SHIFT SIGMA FORMAT %4d %4s %4s %9.3f %9.3f %9.3f %9.3f %9.3f %9.3f 1 A HA 0.000 4.339 4.320 0.032 0.000 0.244 1 A C 0.000 177.613 177.584 0.048 0.000 1.274 1 A CA 0.000 52.062 52.037 0.041 0.000 0.836 1 A CB 0.000 19.028 19.000 0.047 0.000 0.831 2 T N 4.220 118.796 114.554 0.036 0.000 2.770 2 T HA 0.477 4.964 4.350 0.025 -0.122 0.283 2 T C -0.134 174.586 174.700 0.032 0.000 0.988 2 T CA -0.641 61.474 62.100 0.025 0.000 0.957 2 T CB 0.897 69.769 68.868 0.006 0.000 0.930 2 T HN 0.046 8.304 8.240 0.030 0.000 0.443 3 c N 7.133 125.755 118.600 0.037 0.000 2.470 3 c HA 0.024 4.636 4.570 0.068 0.000 0.350 3 c C 1.304 175.401 174.090 0.013 0.000 1.341 3 c CA -0.938 55.423 56.329 0.053 0.000 2.440 3 c CB -0.156 42.423 42.510 0.115 0.000 2.295 3 c HN 0.760 9.004 8.230 0.024 0.000 0.645 4 D N 0.966 121.380 120.400 0.025 0.000 2.178 4 D HA -0.269 4.377 4.640 0.009 0.000 0.201 4 D C 0.271 176.565 176.300 -0.010 0.000 0.980 4 D CA 2.664 56.671 54.000 0.011 0.000 0.842 4 D CB -0.533 40.280 40.800 0.022 0.000 0.948 4 D HN 0.438 8.835 8.370 0.044 0.000 0.472 5 D N -4.706 115.676 120.400 -0.029 0.000 2.328 5 D HA -0.057 4.562 4.640 -0.035 0.000 0.221 5 D C 0.363 176.612 176.300 -0.085 0.000 1.072 5 D CA -0.664 53.304 54.000 -0.053 0.000 0.850 5 D CB -0.614 40.151 40.800 -0.060 0.000 0.922 5 D HN -0.112 8.221 8.370 -0.028 0.019 0.516 6 G N 0.697 109.447 108.800 -0.083 0.000 2.213 6 G HA2 -0.445 3.479 3.960 -0.060 0.000 0.236 6 G HA3 -0.445 3.468 3.960 -0.079 0.000 0.236 6 G C -0.102 174.717 174.900 -0.134 0.000 0.991 6 G CA -0.137 44.911 45.100 -0.086 0.000 0.629 6 G HN -0.181 7.896 8.290 -0.066 0.173 0.517 7 R N 0.577 120.926 120.500 -0.251 0.000 2.694 7 R HA 0.065 4.230 4.340 -0.292 0.000 0.268 7 R C -0.975 175.200 176.300 -0.208 0.000 1.061 7 R CA 0.833 56.698 56.100 -0.392 0.000 1.133 7 R CB 0.768 30.465 30.300 -1.004 0.000 1.020 7 R HN -0.251 8.093 8.270 -0.282 -0.243 0.475 8 T N -1.841 112.661 114.554 -0.086 0.000 2.912 8 T HA 0.857 5.398 4.350 0.064 -0.152 0.288 8 T C -0.467 174.350 174.700 0.196 0.000 1.030 8 T CA -2.013 60.121 62.100 0.057 0.000 1.020 8 T CB 2.653 71.539 68.868 0.029 0.000 1.056 8 T HN -0.160 8.019 8.240 -0.101 0.000 0.480 9 T N 1.883 116.543 114.554 0.176 0.000 2.885 9 T HA 0.123 4.682 4.350 0.145 -0.122 0.322 9 T C -0.928 173.819 174.700 0.078 0.000 1.387 9 T CA -1.799 60.395 62.100 0.155 0.000 1.041 9 T CB 2.619 71.596 68.868 0.182 0.000 1.287 9 T HN -0.128 8.192 8.240 0.133 0.000 0.491 10 A N 3.887 126.734 122.820 0.044 0.000 1.902 10 A HA -0.096 4.240 4.320 0.028 0.000 0.217 10 A C 0.159 177.755 177.584 0.020 0.000 1.181 10 A CA 1.977 54.029 52.037 0.024 0.000 0.623 10 A CB 0.277 19.282 19.000 0.008 0.000 0.818 10 A HN 0.183 8.617 8.150 0.037 -0.261 0.443 11 N N -1.551 117.157 118.700 0.013 0.000 2.407 11 N HA 0.169 4.917 4.740 0.013 0.000 0.277 11 N C -0.153 175.367 175.510 0.016 0.000 0.995 11 N CA -0.803 52.252 53.050 0.009 0.000 0.903 11 N CB 1.572 40.055 38.487 -0.007 0.000 1.218 11 N HN -0.505 7.879 8.380 0.008 0.000 0.487 12 A N 6.042 128.876 122.820 0.023 0.000 2.024 12 A HA -0.300 4.049 4.320 0.049 0.000 0.220 12 A C 1.490 179.088 177.584 0.023 0.000 1.164 12 A CA 2.923 54.979 52.037 0.033 0.000 0.643 12 A CB -0.240 18.777 19.000 0.030 0.000 0.806 12 A HN 0.752 8.915 8.150 0.021 0.000 0.451 13 A N -1.627 121.198 122.820 0.008 0.000 2.076 13 A HA -0.157 4.165 4.320 0.003 0.000 0.220 13 A C 2.146 179.717 177.584 -0.022 0.000 1.160 13 A CA 2.395 54.431 52.037 -0.002 0.000 0.653 13 A CB -0.908 18.089 19.000 -0.006 0.000 0.801 13 A HN 0.343 8.477 8.150 0.007 0.020 0.455 14 c N -3.568 115.011 118.600 -0.034 0.000 2.472 14 c HA -0.075 4.432 4.570 -0.105 0.000 0.278 14 c C 1.960 175.969 174.090 -0.136 0.000 1.447 14 c CA 1.224 57.496 56.329 -0.095 0.000 1.773 14 c CB -3.029 39.419 42.510 -0.102 0.000 1.793 14 c HN -0.261 7.919 8.230 -0.020 0.037 0.544 15 c N 1.061 119.656 118.600 -0.008 0.000 2.410 15 c HA -0.229 4.483 4.570 0.236 0.000 0.281 15 c C 2.143 176.269 174.090 0.060 0.000 1.318 15 c CA 4.088 60.485 56.329 0.113 0.000 1.776 15 c CB -1.926 40.675 42.510 0.152 0.000 1.942 15 c HN -0.247 7.952 8.230 0.020 0.044 0.508 16 I N -1.337 119.222 120.570 -0.018 0.000 2.567 16 I HA -0.336 3.846 4.170 0.020 0.000 0.257 16 I C 0.503 176.551 176.117 -0.114 0.000 1.184 16 I CA 2.515 63.798 61.300 -0.029 0.000 1.451 16 I CB -0.685 37.297 38.000 -0.029 0.000 1.089 16 I HN -0.833 7.339 8.210 -0.027 0.022 0.441 17 L N -0.839 120.227 121.223 -0.261 0.000 2.313 17 L HA -0.287 3.761 4.340 -0.486 0.000 0.214 17 L C 1.760 178.477 176.870 -0.255 0.000 1.119 17 L CA 2.221 56.793 54.840 -0.446 0.000 0.809 17 L CB -0.486 41.158 42.059 -0.691 0.000 0.933 17 L HN -0.370 7.543 8.230 -0.281 0.148 0.449 18 F N -0.784 119.149 119.950 -0.029 0.000 2.134 18 F HA -0.127 4.427 4.527 0.046 0.000 0.299 18 F C -0.997 174.811 175.800 0.014 0.000 1.097 18 F CA 5.397 63.407 58.000 0.016 0.000 1.264 18 F CB -3.383 35.627 39.000 0.017 0.000 1.001 18 F HN -0.534 7.729 8.300 -0.061 0.000 0.479 19 P HA -0.151 4.351 4.420 0.137 0.000 0.221 19 P C 1.198 178.508 177.300 0.015 0.000 1.150 19 P CA 2.683 65.851 63.100 0.114 0.000 0.800 19 P CB -0.494 31.282 31.700 0.128 0.000 0.787 20 I N -2.257 118.234 120.570 -0.132 0.000 2.202 20 I HA -0.454 3.357 4.170 -0.599 0.000 0.242 20 I C 1.578 177.715 176.117 0.033 0.000 1.091 20 I CA 3.841 64.973 61.300 -0.281 0.000 1.368 20 I CB -0.424 37.381 38.000 -0.326 0.000 1.058 20 I HN -0.840 7.284 8.210 -0.117 0.015 0.410 21 L N 0.202 121.528 121.223 0.172 0.000 1.990 21 L HA -0.519 3.874 4.340 0.089 0.000 0.213 21 L C 1.329 178.244 176.870 0.075 0.000 1.072 21 L CA 3.920 58.848 54.840 0.147 0.000 0.755 21 L CB -0.551 41.628 42.059 0.200 0.000 0.889 21 L HN 0.066 8.397 8.230 0.169 0.000 0.432 22 D N -2.215 118.249 120.400 0.107 0.000 2.117 22 D HA -0.343 4.347 4.640 0.082 0.000 0.197 22 D C 2.493 178.848 176.300 0.092 0.000 0.987 22 D CA 3.345 57.401 54.000 0.094 0.000 0.829 22 D CB -0.838 40.024 40.800 0.103 0.000 0.961 22 D HN -0.463 7.985 8.370 0.130 0.000 0.460 23 D N -0.079 120.397 120.400 0.127 0.000 2.097 23 D HA -0.177 4.589 4.640 0.209 0.000 0.195 23 D C 2.239 178.635 176.300 0.160 0.000 0.989 23 D CA 2.911 57.042 54.000 0.218 0.000 0.827 23 D CB 0.197 41.237 40.800 0.400 0.000 0.966 23 D HN -0.584 7.858 8.370 0.119 0.000 0.456 24 I N -3.201 117.355 120.570 -0.023 0.000 2.315 24 I HA -0.404 3.483 4.170 -0.470 0.000 0.248 24 I C 1.757 177.677 176.117 -0.327 0.000 1.117 24 I CA 3.310 64.386 61.300 -0.373 0.000 1.404 24 I CB -0.348 37.280 38.000 -0.619 0.000 1.071 24 I HN -0.336 7.867 8.210 -0.010 0.000 0.419 25 Q N -0.383 119.362 119.800 -0.091 0.000 2.096 25 Q HA -0.380 4.049 4.340 0.149 0.000 0.204 25 Q C 3.041 179.068 176.000 0.045 0.000 0.982 25 Q CA 3.302 59.131 55.803 0.043 0.000 0.850 25 Q CB -0.574 28.201 28.738 0.061 0.000 0.901 25 Q HN -0.091 8.149 8.270 -0.049 0.000 0.422 26 E N -1.038 119.186 120.200 0.040 0.000 2.051 26 E HA -0.196 4.187 4.350 0.055 0.000 0.189 26 E C 2.078 178.714 176.600 0.061 0.000 0.979 26 E CA 2.520 58.954 56.400 0.056 0.000 0.803 26 E CB 0.099 29.839 29.700 0.066 0.000 0.761 26 E HN -0.627 7.759 8.360 0.044 0.000 0.451 27 N N -3.486 115.266 118.700 0.086 0.000 2.282 27 N HA 0.022 4.837 4.740 0.125 0.000 0.185 27 N C 0.659 176.270 175.510 0.168 0.000 1.099 27 N CA 1.479 54.631 53.050 0.170 0.000 0.878 27 N CB 1.205 39.866 38.487 0.289 0.000 0.993 27 N HN -0.083 8.347 8.380 0.084 0.000 0.481 28 L N -0.906 120.239 121.223 -0.130 0.000 2.445 28 L HA 0.047 4.307 4.340 -0.133 0.000 0.207 28 L C -0.879 175.861 176.870 -0.217 0.000 1.053 28 L CA 1.854 56.475 54.840 -0.365 0.000 0.841 28 L CB 1.372 42.824 42.059 -1.012 0.000 1.074 28 L HN -0.428 7.553 8.230 -0.237 0.107 0.479 29 F N -6.515 113.396 119.950 -0.065 0.000 2.647 29 F HA 0.249 4.720 4.527 -0.093 0.000 0.300 29 F C -1.301 174.466 175.800 -0.055 0.000 1.106 29 F CA -3.128 54.822 58.000 -0.083 0.000 1.313 29 F CB 0.039 38.968 39.000 -0.118 0.000 1.007 29 F HN -0.494 7.691 8.300 -0.190 0.000 0.536 30 D N -1.464 119.004 120.400 0.112 0.000 2.772 30 D HA -0.342 4.332 4.640 0.057 0.000 0.233 30 D C 0.663 176.997 176.300 0.057 0.000 1.143 30 D CA 1.067 55.108 54.000 0.068 0.000 0.700 30 D CB -1.909 38.920 40.800 0.049 0.000 1.076 30 D HN -0.376 7.992 8.370 0.083 0.053 0.430 31 G N -4.172 104.668 108.800 0.066 0.000 2.303 31 G HA2 -0.412 3.786 3.960 0.050 0.000 0.260 31 G HA3 -0.412 3.571 3.960 0.038 0.000 0.260 31 G C -0.448 174.481 174.900 0.047 0.000 1.106 31 G CA -0.023 45.107 45.100 0.050 0.000 0.900 31 G HN -0.293 8.041 8.290 0.074 0.000 0.495 32 A N -4.143 118.725 122.820 0.079 0.000 2.846 32 A HA -0.530 3.967 4.320 0.085 -0.126 0.287 32 A C -1.069 176.507 177.584 -0.013 0.000 1.469 32 A CA 1.321 53.387 52.037 0.048 0.000 0.757 32 A CB -1.236 17.777 19.000 0.022 0.000 1.033 32 A HN -0.068 8.156 8.150 0.122 0.000 0.516 33 Q N -3.515 116.277 119.800 -0.013 0.000 2.221 33 Q HA 0.141 4.445 4.340 -0.059 0.000 0.242 33 Q C -0.065 175.839 176.000 -0.159 0.000 0.940 33 Q CA -1.547 54.217 55.803 -0.064 0.000 0.896 33 Q CB 2.137 30.852 28.738 -0.039 0.000 1.226 33 Q HN -0.521 7.769 8.270 0.033 0.000 0.463 34 c N 4.725 123.233 118.600 -0.152 0.000 2.560 34 c HA 0.197 4.594 4.570 -0.289 0.000 0.506 34 c C -0.685 173.254 174.090 -0.251 0.000 1.116 34 c CA -1.380 54.830 56.329 -0.197 0.000 1.425 34 c CB -3.106 39.351 42.510 -0.087 0.000 1.543 34 c HN 0.600 8.767 8.230 -0.105 0.000 0.586 35 G N 1.940 110.510 108.800 -0.383 0.000 3.217 35 G HA2 0.282 3.988 3.960 -0.424 0.000 0.213 35 G HA3 0.282 4.088 3.960 -0.256 0.000 0.213 35 G C -1.053 173.406 174.900 -0.735 0.000 1.294 35 G CA -1.086 43.743 45.100 -0.450 0.000 0.987 35 G HN -0.846 7.199 8.290 -0.349 0.036 0.584 36 E N 1.784 121.763 120.200 -0.369 0.000 2.070 36 E HA -0.477 3.758 4.350 -0.191 0.000 0.197 36 E C 1.909 178.424 176.600 -0.141 0.000 1.004 36 E CA 3.596 59.867 56.400 -0.215 0.000 0.805 36 E CB 0.003 29.669 29.700 -0.057 0.000 0.744 36 E HN 0.631 8.858 8.360 -0.222 0.000 0.451 37 E N -2.032 118.143 120.200 -0.042 0.000 2.150 37 E HA -0.208 4.368 4.350 0.098 -0.167 0.193 37 E C 2.789 179.482 176.600 0.156 0.000 0.985 37 E CA 3.094 59.565 56.400 0.118 0.000 0.814 37 E CB -0.740 29.096 29.700 0.227 0.000 0.752 37 E HN 0.360 8.700 8.360 -0.033 0.000 0.466 38 V N 0.947 120.781 119.914 -0.134 0.000 2.295 38 V HA -0.582 3.254 4.120 -0.473 0.000 0.246 38 V C 1.587 177.636 176.094 -0.074 0.000 1.049 38 V CA 4.574 66.653 62.300 -0.368 0.000 1.024 38 V CB -0.081 31.386 31.823 -0.594 0.000 0.648 38 V HN -0.662 7.392 8.190 -0.227 0.000 0.447 39 H N -0.057 118.972 119.070 -0.070 0.000 2.321 39 H HA -0.301 4.229 4.556 -0.042 0.000 0.300 39 H C 3.035 178.365 175.328 0.004 0.000 1.087 39 H CA 3.164 59.188 56.048 -0.041 0.000 1.319 39 H CB 0.002 29.725 29.762 -0.066 0.000 1.379 39 H HN -0.435 7.644 8.280 -0.335 0.000 0.501 40 E N -0.953 119.328 120.200 0.136 0.000 2.106 40 E HA -0.411 3.990 4.350 0.084 0.000 0.192 40 E C 2.286 178.950 176.600 0.107 0.000 0.984 40 E CA 3.152 59.611 56.400 0.097 0.000 0.806 40 E CB -0.230 29.514 29.700 0.073 0.000 0.750 40 E HN 0.028 8.453 8.360 0.108 0.000 0.458 41 S N 0.827 116.606 115.700 0.132 0.000 2.383 41 S HA -0.265 4.288 4.470 0.138 0.000 0.227 41 S C 1.873 176.548 174.600 0.125 0.000 1.026 41 S CA 3.842 62.127 58.200 0.143 0.000 0.981 41 S CB -0.026 63.303 63.200 0.215 0.000 0.818 41 S HN -0.189 8.205 8.310 0.141 0.000 0.472 42 L N 2.007 123.298 121.223 0.115 0.000 2.056 42 L HA -0.239 4.177 4.340 0.127 0.000 0.207 42 L C 0.969 177.961 176.870 0.203 0.000 1.078 42 L CA 2.673 57.597 54.840 0.140 0.000 0.749 42 L CB -0.357 41.783 42.059 0.135 0.000 0.901 42 L HN -0.153 8.139 8.230 0.102 0.000 0.433 43 R N -0.883 119.733 120.500 0.194 0.000 2.091 43 R HA -0.410 4.143 4.340 0.354 0.000 0.238 43 R C 2.138 178.584 176.300 0.244 0.000 1.136 43 R CA 3.681 59.925 56.100 0.240 0.000 0.959 43 R CB -0.213 30.155 30.300 0.114 0.000 0.856 43 R HN -0.357 8.010 8.270 0.162 0.000 0.437 44 L N -1.860 119.455 121.223 0.153 0.000 2.083 44 L HA -0.218 4.198 4.340 0.128 0.000 0.209 44 L C 1.293 178.297 176.870 0.224 0.000 1.083 44 L CA 3.187 58.121 54.840 0.157 0.000 0.752 44 L CB -0.327 41.809 42.059 0.128 0.000 0.899 44 L HN -0.119 8.109 8.230 0.130 0.080 0.433 45 T N -0.671 114.018 114.554 0.226 0.000 2.720 45 T HA -0.431 4.039 4.350 0.199 0.000 0.268 45 T C 1.606 176.488 174.700 0.303 0.000 1.037 45 T CA 4.492 66.728 62.100 0.227 0.000 1.144 45 T CB -0.403 68.574 68.868 0.182 0.000 0.864 45 T HN -0.327 8.037 8.240 0.207 0.000 0.444 46 F N 3.402 123.472 119.950 0.200 0.000 2.128 46 F HA -0.168 4.448 4.527 0.147 0.000 0.295 46 F C 1.225 177.164 175.800 0.232 0.000 1.100 46 F CA 1.687 59.808 58.000 0.202 0.000 1.260 46 F CB -0.094 39.039 39.000 0.222 0.000 1.009 46 F HN -0.828 7.768 8.300 0.506 0.007 0.476 47 H N -2.182 116.876 119.070 -0.019 0.000 2.457 47 H HA -0.302 4.064 4.556 -0.318 0.000 0.294 47 H C 1.713 177.032 175.328 -0.016 0.000 1.064 47 H CA 3.021 58.998 56.048 -0.118 0.000 1.330 47 H CB 0.072 29.840 29.762 0.011 0.000 1.395 47 H HN -0.463 8.151 8.280 0.556 0.000 0.541 48 D N -0.803 119.701 120.400 0.175 0.000 2.091 48 D HA -0.128 4.601 4.640 0.148 0.000 0.199 48 D C 1.631 178.007 176.300 0.126 0.000 0.980 48 D CA 2.522 56.612 54.000 0.150 0.000 0.831 48 D CB 0.387 41.285 40.800 0.163 0.000 0.987 48 D HN -0.398 8.091 8.370 0.213 0.008 0.460 49 A N -0.485 122.417 122.820 0.136 0.000 1.930 49 A HA -0.208 4.290 4.320 0.123 -0.104 0.217 49 A C 1.845 179.520 177.584 0.151 0.000 1.175 49 A CA 2.797 54.921 52.037 0.144 0.000 0.627 49 A CB -0.163 18.951 19.000 0.191 0.000 0.815 49 A HN -0.490 7.756 8.150 0.160 0.000 0.443 50 I N -2.999 117.610 120.570 0.065 0.000 3.291 50 I HA -0.152 4.157 4.170 0.232 0.000 0.279 50 I C -0.126 176.044 176.117 0.089 0.000 1.294 50 I CA -0.816 60.523 61.300 0.066 0.000 1.428 50 I CB 0.168 38.020 38.000 -0.247 0.000 1.070 50 I HN -0.190 7.994 8.210 -0.043 0.000 0.478 51 G N 0.565 109.422 108.800 0.094 0.000 3.003 51 G HA2 -0.113 3.899 3.960 0.087 0.000 0.266 51 G HA3 -0.113 3.926 3.960 0.132 0.000 0.266 51 G C -2.269 172.766 174.900 0.225 0.000 0.755 51 G CA 0.162 45.339 45.100 0.128 0.000 2.061 51 G HN -0.643 7.652 8.290 0.078 0.041 0.599 52 F N 4.467 124.438 119.950 0.034 0.000 2.722 52 F HA 0.371 5.094 4.527 0.030 -0.179 0.336 52 F C -2.957 172.858 175.800 0.024 0.000 1.216 52 F CA -0.645 57.375 58.000 0.034 0.000 1.065 52 F CB 2.699 41.727 39.000 0.046 0.000 1.325 52 F HN -0.388 8.003 8.300 0.210 0.034 0.524 53 S N 8.412 123.776 115.700 -0.558 0.000 2.668 53 S HA 0.624 4.923 4.470 -0.427 -0.085 0.277 53 S C -2.034 172.264 174.600 -0.503 0.000 1.170 53 S CA -2.801 55.130 58.200 -0.448 0.000 0.994 53 S CB 2.045 65.130 63.200 -0.192 0.000 1.051 53 S HN -0.137 7.850 8.310 -0.539 0.000 0.484 54 P HA -0.111 4.100 4.420 -0.348 0.000 0.216 54 P C 0.542 177.729 177.300 -0.187 0.000 1.153 54 P CA 1.846 64.761 63.100 -0.309 0.000 0.858 54 P CB 0.390 31.969 31.700 -0.202 0.000 0.789 55 T N -2.256 112.207 114.554 -0.152 0.000 2.770 55 T HA -0.195 4.104 4.350 -0.086 0.000 0.263 55 T C 0.768 175.411 174.700 -0.096 0.000 1.039 55 T CA 2.232 64.272 62.100 -0.101 0.000 1.142 55 T CB 0.170 68.992 68.868 -0.077 0.000 0.868 55 T HN -0.219 7.917 8.240 -0.159 0.008 0.435 56 L N -1.834 119.323 121.223 -0.110 0.000 2.513 56 L HA 0.035 4.333 4.340 -0.069 0.000 0.222 56 L C 0.462 177.281 176.870 -0.085 0.000 1.096 56 L CA 0.009 54.798 54.840 -0.085 0.000 0.857 56 L CB 1.104 43.120 42.059 -0.072 0.000 1.026 56 L HN -0.638 7.510 8.230 -0.136 0.000 0.469 57 G N -1.877 106.851 108.800 -0.119 0.000 2.627 57 G HA2 -0.251 3.645 3.960 -0.107 0.000 0.214 57 G HA3 -0.251 3.671 3.960 -0.064 0.000 0.214 57 G C -1.726 173.133 174.900 -0.067 0.000 1.331 57 G CA -0.616 44.428 45.100 -0.093 0.000 0.891 57 G HN -0.239 7.954 8.290 -0.162 0.000 0.539 58 G N -1.340 107.459 108.800 -0.002 0.000 2.785 58 G HA2 -0.336 3.669 3.960 0.076 0.000 0.686 58 G HA3 -0.336 3.794 3.960 0.085 -0.119 0.686 58 G C 0.339 175.346 174.900 0.179 0.000 1.155 58 G CA -0.172 44.974 45.100 0.077 0.000 0.760 58 G HN -0.101 8.188 8.290 -0.002 0.000 0.624 59 G N 0.268 109.192 108.800 0.207 0.000 3.284 59 G HA2 0.237 4.369 3.960 0.287 0.000 0.236 59 G HA3 0.237 4.408 3.960 0.186 -0.100 0.236 59 G C -0.407 174.639 174.900 0.243 0.000 1.158 59 G CA -1.368 43.878 45.100 0.244 0.000 0.774 59 G HN 0.358 8.753 8.290 0.175 0.000 0.545 60 G N 1.188 110.161 108.800 0.288 0.000 2.531 60 G HA2 -0.466 3.825 3.960 0.197 0.000 0.274 60 G HA3 -0.466 3.629 3.960 -0.026 -0.151 0.274 60 G C -0.982 173.979 174.900 0.101 0.000 1.159 60 G CA 0.048 45.232 45.100 0.141 0.000 0.969 60 G HN -0.364 8.074 8.290 0.331 0.051 0.554 61 A N 3.755 126.599 122.820 0.040 0.000 2.990 61 A HA -0.009 4.376 4.320 0.108 0.000 0.282 61 A C -1.552 176.084 177.584 0.085 0.000 1.688 61 A CA -0.597 51.486 52.037 0.076 0.000 1.391 61 A CB -0.641 18.394 19.000 0.059 0.000 1.112 61 A HN -0.121 8.012 8.150 -0.029 0.000 0.588 62 D N -0.164 120.304 120.400 0.113 0.000 2.520 62 D HA 0.036 4.736 4.640 0.100 0.000 0.223 62 D C 0.176 176.551 176.300 0.125 0.000 1.186 62 D CA -1.462 52.608 54.000 0.117 0.000 0.821 62 D CB 1.503 42.383 40.800 0.132 0.000 1.072 62 D HN -0.541 7.969 8.370 0.128 -0.064 0.518 63 G N -1.037 107.843 108.800 0.134 0.000 2.162 63 G HA2 -0.484 3.607 3.960 0.133 0.000 0.260 63 G HA3 -0.484 3.598 3.960 0.105 -0.059 0.260 63 G C 1.069 176.032 174.900 0.105 0.000 0.976 63 G CA 1.175 46.347 45.100 0.120 0.000 0.655 63 G HN 0.131 8.925 8.290 0.140 -0.421 0.533 64 S N 0.451 116.251 115.700 0.166 0.000 2.400 64 S HA -0.254 4.388 4.470 0.288 0.000 0.232 64 S C 1.223 175.944 174.600 0.202 0.000 1.025 64 S CA 3.465 61.827 58.200 0.269 0.000 0.993 64 S CB -0.069 63.341 63.200 0.351 0.000 0.808 64 S HN -0.183 8.559 8.310 0.177 -0.325 0.478 65 I N 0.485 121.138 120.570 0.140 0.000 2.614 65 I HA -0.294 4.018 4.170 0.079 -0.095 0.258 65 I C 0.430 176.578 176.117 0.052 0.000 1.189 65 I CA 2.426 63.782 61.300 0.093 0.000 1.462 65 I CB -0.109 37.955 38.000 0.106 0.000 1.092 65 I HN -0.959 7.490 8.210 0.142 -0.154 0.442 66 I N -1.198 119.397 120.570 0.041 0.000 2.385 66 I HA -0.355 3.815 4.170 -0.000 0.000 0.244 66 I C 1.776 177.842 176.117 -0.084 0.000 1.089 66 I CA 3.250 64.547 61.300 -0.005 0.000 1.410 66 I CB 0.080 38.089 38.000 0.014 0.000 1.117 66 I HN -0.687 7.542 8.210 0.058 0.015 0.429 67 A N 1.143 123.861 122.820 -0.170 0.000 1.972 67 A HA -0.169 3.944 4.320 -0.345 0.000 0.219 67 A C 1.054 178.262 177.584 -0.626 0.000 1.169 67 A CA 2.675 54.445 52.037 -0.445 0.000 0.635 67 A CB 0.152 18.764 19.000 -0.647 0.000 0.810 67 A HN -0.257 7.820 8.150 -0.122 0.000 0.446 68 F N -4.133 115.813 119.950 -0.007 0.000 2.928 68 F HA 0.329 4.842 4.527 -0.024 0.000 0.337 68 F C -0.737 175.022 175.800 -0.069 0.000 1.259 68 F CA -2.436 55.547 58.000 -0.028 0.000 1.267 68 F CB -0.489 38.501 39.000 -0.016 0.000 0.986 68 F HN -0.296 7.840 8.300 -0.072 0.122 0.507 69 D N 0.445 120.859 120.400 0.024 0.000 2.149 69 D HA -0.255 4.481 4.640 -0.031 -0.114 0.198 69 D C 1.995 178.270 176.300 -0.043 0.000 0.990 69 D CA 3.453 57.441 54.000 -0.019 0.000 0.839 69 D CB -0.852 39.933 40.800 -0.024 0.000 0.948 69 D HN -0.561 7.740 8.370 -0.019 0.058 0.460 70 T N 0.658 115.205 114.554 -0.011 0.000 2.720 70 T HA -0.332 4.003 4.350 -0.025 0.000 0.268 70 T C 1.037 175.704 174.700 -0.054 0.000 1.037 70 T CA 3.357 65.447 62.100 -0.018 0.000 1.144 70 T CB -0.077 68.799 68.868 0.013 0.000 0.864 70 T HN -0.014 8.232 8.240 0.011 0.000 0.444 71 I N -0.857 119.676 120.570 -0.062 0.000 2.206 71 I HA -0.158 3.954 4.170 -0.097 0.000 0.239 71 I C 1.886 177.685 176.117 -0.531 0.000 1.078 71 I CA 1.342 62.549 61.300 -0.156 0.000 1.367 71 I CB -0.352 37.613 38.000 -0.059 0.000 1.078 71 I HN -0.757 7.450 8.210 -0.005 0.000 0.413 72 E N -0.979 118.873 120.200 -0.581 0.000 2.106 72 E HA -0.287 2.673 4.350 -2.316 0.000 0.192 72 E C 2.591 178.765 176.600 -0.709 0.000 0.984 72 E CA 3.048 58.809 56.400 -1.064 0.000 0.806 72 E CB 0.182 29.630 29.700 -0.420 0.000 0.750 72 E HN -0.187 7.987 8.360 -0.310 0.000 0.458 73 T N -3.897 110.469 114.554 -0.314 0.000 3.072 73 T HA -0.233 4.056 4.350 -0.101 0.000 0.266 73 T C 0.432 175.075 174.700 -0.096 0.000 1.127 73 T CA 2.721 64.737 62.100 -0.140 0.000 1.107 73 T CB -0.351 68.479 68.868 -0.063 0.000 0.910 73 T HN 0.019 8.110 8.240 -0.249 0.000 0.513 74 N N -0.573 118.039 118.700 -0.146 0.000 2.412 74 N HA -0.065 4.686 4.740 0.018 0.000 0.184 74 N C -0.147 175.442 175.510 0.132 0.000 1.101 74 N CA 0.295 53.340 53.050 -0.009 0.000 0.881 74 N CB 0.574 39.063 38.487 0.004 0.000 0.969 74 N HN -0.834 7.357 8.380 -0.250 0.038 0.459 75 F N 0.033 119.982 119.950 -0.002 0.000 2.572 75 F HA 0.044 4.525 4.527 -0.077 0.000 0.370 75 F C -0.358 175.443 175.800 0.000 0.000 1.103 75 F CA -2.783 55.191 58.000 -0.043 0.000 1.286 75 F CB -1.917 37.041 39.000 -0.071 0.000 1.105 75 F HN -0.652 7.436 8.300 -0.117 0.142 0.583 76 P HA -0.281 4.222 4.420 0.138 0.000 0.216 76 P C 0.315 177.714 177.300 0.165 0.000 1.150 76 P CA 2.459 65.648 63.100 0.149 0.000 0.837 76 P CB 0.011 31.791 31.700 0.134 0.000 0.786 77 A N -6.753 116.171 122.820 0.174 0.000 2.168 77 A HA -0.170 4.367 4.320 0.193 -0.101 0.215 77 A C -0.516 177.244 177.584 0.293 0.000 1.152 77 A CA 1.073 53.227 52.037 0.196 0.000 0.716 77 A CB -0.590 18.485 19.000 0.124 0.000 0.794 77 A HN 0.320 8.561 8.150 0.150 0.000 0.465 78 N N -2.880 115.986 118.700 0.276 0.000 2.276 78 N HA 0.016 4.967 4.740 0.352 0.000 0.212 78 N C -1.142 174.453 175.510 0.142 0.000 1.127 78 N CA -1.610 51.595 53.050 0.258 0.000 0.834 78 N CB 0.195 38.807 38.487 0.208 0.000 1.014 78 N HN -0.427 7.950 8.380 0.258 0.158 0.491 79 A N 0.114 123.018 122.820 0.141 0.000 2.546 79 A HA -0.026 4.343 4.320 0.081 0.000 0.243 79 A C 0.287 177.912 177.584 0.067 0.000 1.063 79 A CA 1.834 53.929 52.037 0.096 0.000 0.757 79 A CB 0.148 19.209 19.000 0.100 0.000 0.991 79 A HN -0.883 7.302 8.150 0.165 0.064 0.503 80 G N 2.531 111.358 108.800 0.045 0.000 2.205 80 G HA2 -0.417 3.559 3.960 0.027 0.000 0.261 80 G HA3 -0.417 3.560 3.960 0.029 0.000 0.261 80 G C 0.801 175.707 174.900 0.010 0.000 0.980 80 G CA 1.254 46.371 45.100 0.028 0.000 0.632 80 G HN 0.650 8.966 8.290 0.044 0.000 0.533 81 I N 1.882 122.452 120.570 0.001 0.000 3.251 81 I HA -0.203 3.951 4.170 -0.026 0.000 0.277 81 I C -0.539 175.582 176.117 0.007 0.000 1.268 81 I CA 0.164 61.454 61.300 -0.017 0.000 1.449 81 I CB 0.061 38.030 38.000 -0.052 0.000 1.083 81 I HN -0.499 7.654 8.210 0.014 0.065 0.464 82 D N -0.114 120.293 120.400 0.011 0.000 2.190 82 D HA -0.389 4.255 4.640 0.008 0.000 0.200 82 D C 1.765 178.075 176.300 0.018 0.000 0.992 82 D CA 3.409 57.416 54.000 0.011 0.000 0.854 82 D CB -1.508 39.296 40.800 0.007 0.000 0.936 82 D HN 0.503 8.857 8.370 0.013 0.024 0.462 83 E N -0.014 120.199 120.200 0.021 0.000 2.031 83 E HA -0.333 4.032 4.350 0.025 0.000 0.193 83 E C 2.400 179.024 176.600 0.040 0.000 0.994 83 E CA 2.635 59.052 56.400 0.027 0.000 0.800 83 E CB -0.244 29.472 29.700 0.026 0.000 0.752 83 E HN -0.816 7.535 8.360 0.019 0.021 0.447 84 I N -0.159 120.437 120.570 0.044 0.000 2.439 84 I HA -0.318 3.895 4.170 0.073 0.000 0.251 84 I C 1.218 177.380 176.117 0.076 0.000 1.139 84 I CA 1.719 63.059 61.300 0.066 0.000 1.438 84 I CB -0.220 37.823 38.000 0.070 0.000 1.085 84 I HN -0.836 7.396 8.210 0.036 0.000 0.427 85 V N -0.081 119.868 119.914 0.058 0.000 2.287 85 V HA -0.736 3.428 4.120 0.073 0.000 0.248 85 V C 1.492 177.613 176.094 0.044 0.000 1.053 85 V CA 5.765 68.097 62.300 0.054 0.000 1.027 85 V CB -0.507 31.336 31.823 0.033 0.000 0.646 85 V HN -0.333 7.884 8.190 0.045 0.000 0.447 86 S N -1.271 114.450 115.700 0.034 0.000 2.382 86 S HA -0.285 4.190 4.470 0.009 0.000 0.228 86 S C 1.767 176.393 174.600 0.042 0.000 1.027 86 S CA 2.930 61.144 58.200 0.023 0.000 0.991 86 S CB -0.411 62.798 63.200 0.016 0.000 0.823 86 S HN -0.281 8.048 8.310 0.031 0.000 0.469 87 A N 1.313 124.178 122.820 0.075 0.000 1.930 87 A HA -0.154 4.233 4.320 0.112 0.000 0.217 87 A C 1.994 179.716 177.584 0.230 0.000 1.175 87 A CA 2.575 54.690 52.037 0.130 0.000 0.627 87 A CB -0.178 18.899 19.000 0.128 0.000 0.815 87 A HN -0.500 7.612 8.150 0.071 0.080 0.443 88 Q N -2.250 117.659 119.800 0.182 0.000 2.187 88 Q HA -0.238 4.294 4.340 0.320 0.000 0.199 88 Q C 2.414 178.441 176.000 0.045 0.000 0.957 88 Q CA 2.501 58.423 55.803 0.197 0.000 0.857 88 Q CB 0.103 28.973 28.738 0.219 0.000 0.929 88 Q HN -0.346 8.005 8.270 0.136 0.000 0.453 89 K N -0.334 120.071 120.400 0.008 0.000 2.059 89 K HA -0.295 3.974 4.320 -0.086 0.000 0.212 89 K C -0.368 176.164 176.600 -0.114 0.000 1.050 89 K CA 5.497 61.745 56.287 -0.065 0.000 0.927 89 K CB -1.550 30.922 32.500 -0.047 0.000 0.714 89 K HN -0.433 7.836 8.250 0.032 0.000 0.447 90 P HA -0.125 4.181 4.420 -0.189 0.000 0.221 90 P C 1.438 178.564 177.300 -0.290 0.000 1.150 90 P CA 2.504 65.472 63.100 -0.220 0.000 0.800 90 P CB -0.303 31.227 31.700 -0.282 0.000 0.787 91 F N -2.479 117.315 119.950 -0.260 0.000 2.146 91 F HA -0.302 4.150 4.527 -0.124 0.000 0.298 91 F C 2.363 177.935 175.800 -0.379 0.000 1.096 91 F CA 4.352 62.188 58.000 -0.272 0.000 1.275 91 F CB -0.484 38.304 39.000 -0.353 0.000 1.008 91 F HN -0.732 7.563 8.300 -0.009 0.000 0.480 92 V N -0.982 118.696 119.914 -0.394 0.000 2.343 92 V HA -0.542 3.405 4.120 -0.290 0.000 0.247 92 V C 1.325 177.340 176.094 -0.132 0.000 1.051 92 V CA 4.086 66.208 62.300 -0.297 0.000 1.036 92 V CB -0.165 31.504 31.823 -0.257 0.000 0.654 92 V HN -0.640 7.294 8.190 -0.427 0.000 0.451 93 A N -2.563 120.169 122.820 -0.147 0.000 1.933 93 A HA -0.246 4.016 4.320 -0.098 0.000 0.218 93 A C 0.804 178.305 177.584 -0.138 0.000 1.175 93 A CA 2.465 54.428 52.037 -0.124 0.000 0.628 93 A CB -0.310 18.612 19.000 -0.129 0.000 0.814 93 A HN -0.502 7.548 8.150 -0.167 0.000 0.444 94 K N -2.285 117.989 120.400 -0.210 0.000 2.103 94 K HA -0.197 3.972 4.320 -0.251 0.000 0.204 94 K C 0.753 177.160 176.600 -0.321 0.000 1.052 94 K CA 1.727 57.824 56.287 -0.317 0.000 0.945 94 K CB 0.607 32.808 32.500 -0.498 0.000 0.722 94 K HN -0.617 7.497 8.250 -0.226 0.000 0.443 95 H N -1.578 117.480 119.070 -0.019 0.000 2.530 95 H HA 0.143 4.711 4.556 0.021 0.000 0.342 95 H C -1.478 173.855 175.328 0.008 0.000 1.312 95 H CA -0.317 55.743 56.048 0.020 0.000 1.376 95 H CB 1.380 31.191 29.762 0.082 0.000 1.692 95 H HN -0.633 7.613 8.280 -0.057 0.000 0.622 96 N N -1.286 117.512 118.700 0.163 0.000 2.535 96 N HA 0.104 4.879 4.740 0.058 0.000 0.294 96 N C -0.800 174.753 175.510 0.072 0.000 1.408 96 N CA -0.081 53.017 53.050 0.080 0.000 0.927 96 N CB 0.163 38.683 38.487 0.055 0.000 1.276 96 N HN 0.126 8.623 8.380 0.195 0.000 0.505 97 I N -5.377 115.252 120.570 0.098 0.000 2.846 97 I HA 0.480 4.692 4.170 0.069 0.000 0.307 97 I C -1.599 174.582 176.117 0.108 0.000 1.053 97 I CA -2.187 59.169 61.300 0.094 0.000 1.050 97 I CB 3.441 41.495 38.000 0.091 0.000 1.239 97 I HN -0.623 7.612 8.210 0.130 0.053 0.439 98 S N 1.120 116.881 115.700 0.102 0.000 2.584 98 S HA -0.074 4.437 4.470 0.067 0.000 0.270 98 S C 1.509 176.198 174.600 0.148 0.000 1.346 98 S CA -0.450 57.808 58.200 0.096 0.000 1.018 98 S CB 1.882 65.131 63.200 0.083 0.000 0.899 98 S HN 0.020 8.388 8.310 0.095 0.000 0.542 99 A N 2.511 125.398 122.820 0.111 0.000 1.933 99 A HA -0.243 4.188 4.320 0.184 0.000 0.218 99 A C 1.660 179.366 177.584 0.204 0.000 1.175 99 A CA 3.105 55.230 52.037 0.147 0.000 0.628 99 A CB -0.295 18.745 19.000 0.067 0.000 0.814 99 A HN 0.927 9.119 8.150 0.069 0.000 0.444 100 G N -1.774 107.122 108.800 0.160 0.000 2.418 100 G HA2 -0.360 3.747 3.960 0.168 0.000 0.217 100 G HA3 -0.360 3.683 3.960 0.138 0.000 0.217 100 G C 1.220 176.249 174.900 0.215 0.000 1.158 100 G CA 2.020 47.220 45.100 0.167 0.000 0.771 100 G HN 0.288 8.654 8.290 0.128 0.000 0.545 101 D N 2.867 123.403 120.400 0.227 0.000 2.097 101 D HA -0.238 4.618 4.640 0.360 0.000 0.195 101 D C 1.889 178.399 176.300 0.351 0.000 0.989 101 D CA 3.212 57.404 54.000 0.320 0.000 0.827 101 D CB -0.293 40.668 40.800 0.268 0.000 0.966 101 D HN -0.673 7.813 8.370 0.192 0.000 0.456 102 F N 1.215 121.269 119.950 0.172 0.000 2.095 102 F HA -0.365 4.249 4.527 0.144 0.000 0.298 102 F C 1.510 177.403 175.800 0.155 0.000 1.104 102 F CA 3.791 61.878 58.000 0.145 0.000 1.232 102 F CB 0.312 39.375 39.000 0.106 0.000 0.987 102 F HN -0.289 8.252 8.300 0.402 0.000 0.475 103 I N -0.788 119.942 120.570 0.267 0.000 2.163 103 I HA -0.555 3.716 4.170 0.168 0.000 0.243 103 I C 2.165 178.334 176.117 0.088 0.000 1.085 103 I CA 3.894 65.299 61.300 0.175 0.000 1.347 103 I CB -0.184 37.944 38.000 0.214 0.000 1.044 103 I HN -0.204 8.212 8.210 0.342 0.000 0.408 104 Q N -1.833 118.075 119.800 0.180 0.000 2.119 104 Q HA -0.294 4.142 4.340 0.159 0.000 0.201 104 Q C 2.541 178.611 176.000 0.116 0.000 0.972 104 Q CA 2.254 58.189 55.803 0.220 0.000 0.847 104 Q CB -0.433 28.520 28.738 0.359 0.000 0.903 104 Q HN -0.631 7.781 8.270 0.236 0.000 0.433 105 F N 2.034 121.835 119.950 -0.249 0.000 2.102 105 F HA -0.458 3.398 4.527 -1.118 0.000 0.298 105 F C 0.962 176.436 175.800 -0.543 0.000 1.105 105 F CA 3.125 60.644 58.000 -0.803 0.000 1.239 105 F CB -0.139 38.251 39.000 -1.016 0.000 0.991 105 F HN 0.111 8.504 8.300 0.156 0.000 0.474 106 A N -1.956 120.533 122.820 -0.551 0.000 1.902 106 A HA -0.356 3.644 4.320 -0.533 0.000 0.217 106 A C 2.157 179.650 177.584 -0.152 0.000 1.181 106 A CA 3.350 55.112 52.037 -0.459 0.000 0.623 106 A CB -1.038 17.639 19.000 -0.539 0.000 0.818 106 A HN 0.369 8.189 8.150 -0.549 0.000 0.443 107 G N -2.522 106.207 108.800 -0.119 0.000 2.418 107 G HA2 -0.399 3.542 3.960 -0.031 0.000 0.217 107 G HA3 -0.399 3.553 3.960 -0.014 0.000 0.217 107 G C 0.685 175.500 174.900 -0.142 0.000 1.158 107 G CA 1.623 46.686 45.100 -0.062 0.000 0.771 107 G HN -0.337 7.886 8.290 -0.113 0.000 0.545 108 A N 2.111 124.815 122.820 -0.193 0.000 1.898 108 A HA -0.327 3.903 4.320 -0.150 0.000 0.216 108 A C 2.011 179.407 177.584 -0.313 0.000 1.181 108 A CA 2.821 54.730 52.037 -0.214 0.000 0.620 108 A CB -0.367 18.532 19.000 -0.169 0.000 0.819 108 A HN -0.394 7.637 8.150 -0.199 0.000 0.442 109 V N -1.115 118.518 119.914 -0.470 0.000 2.287 109 V HA -0.508 3.374 4.120 -0.396 0.000 0.248 109 V C 2.454 178.344 176.094 -0.341 0.000 1.053 109 V CA 3.995 66.044 62.300 -0.419 0.000 1.027 109 V CB -0.215 31.296 31.823 -0.521 0.000 0.646 109 V HN 0.060 7.887 8.190 -0.604 0.000 0.447 110 G N -1.140 107.396 108.800 -0.440 0.000 2.421 110 G HA2 -0.316 2.885 3.960 -1.265 0.000 0.216 110 G HA3 -0.316 3.027 3.960 -1.030 0.000 0.216 110 G C 1.651 176.257 174.900 -0.490 0.000 1.171 110 G CA 2.115 46.694 45.100 -0.868 0.000 0.775 110 G HN -0.207 7.889 8.290 -0.324 0.000 0.543 111 V N 3.022 122.748 119.914 -0.314 0.000 2.392 111 V HA -0.454 3.525 4.120 -0.234 0.000 0.249 111 V C 2.103 178.052 176.094 -0.242 0.000 1.059 111 V CA 3.315 65.468 62.300 -0.245 0.000 1.051 111 V CB -0.134 31.584 31.823 -0.175 0.000 0.658 111 V HN -0.189 7.834 8.190 -0.277 0.000 0.455 112 S N -0.210 115.354 115.700 -0.226 0.000 2.474 112 S HA -0.270 4.106 4.470 -0.156 0.000 0.235 112 S C 1.034 175.542 174.600 -0.153 0.000 0.997 112 S CA 3.150 61.246 58.200 -0.174 0.000 0.949 112 S CB -0.791 62.315 63.200 -0.158 0.000 0.766 112 S HN -0.335 7.817 8.310 -0.243 0.012 0.517 113 N N 0.228 118.812 118.700 -0.194 0.000 2.494 113 N HA -0.037 4.632 4.740 -0.118 0.000 0.182 113 N C -0.619 174.823 175.510 -0.114 0.000 1.076 113 N CA 1.236 54.192 53.050 -0.156 0.000 0.908 113 N CB 0.628 38.986 38.487 -0.214 0.000 0.967 113 N HN -0.601 7.478 8.380 -0.253 0.149 0.449 114 c N 1.295 119.829 118.600 -0.111 0.000 2.325 114 c HA 0.355 4.903 4.570 -0.036 0.000 0.347 114 c C -2.035 172.052 174.090 -0.006 0.000 1.263 114 c CA -2.105 54.196 56.329 -0.047 0.000 1.806 114 c CB -1.626 40.867 42.510 -0.028 0.000 2.405 114 c HN -0.500 7.596 8.230 -0.141 0.050 0.537 115 P HA -0.365 4.218 4.420 0.017 -0.152 0.264 115 P C 0.427 177.773 177.300 0.076 0.000 1.183 115 P CA 1.508 64.626 63.100 0.030 0.000 0.763 115 P CB 0.073 31.787 31.700 0.024 0.000 0.807 116 G N 3.681 112.527 108.800 0.078 0.000 2.199 116 G HA2 -0.429 3.632 3.960 0.098 0.000 0.254 116 G HA3 -0.429 3.780 3.960 0.150 -0.158 0.254 116 G C -0.187 174.851 174.900 0.230 0.000 0.982 116 G CA 0.175 45.356 45.100 0.135 0.000 0.632 116 G HN 0.308 8.577 8.290 0.052 0.052 0.529 117 G N -0.058 108.805 108.800 0.105 0.000 2.611 117 G HA2 0.216 4.018 3.960 -0.263 0.000 0.273 117 G HA3 0.216 4.126 3.960 -0.193 -0.067 0.273 117 G C -1.807 173.040 174.900 -0.088 0.000 1.305 117 G CA -0.836 44.200 45.100 -0.107 0.000 1.010 117 G HN -0.330 7.926 8.290 0.058 0.069 0.509 118 V N -6.446 113.358 119.914 -0.183 0.000 3.102 118 V HA 0.411 4.505 4.120 -0.043 0.000 0.312 118 V C -1.226 174.812 176.094 -0.092 0.000 1.135 118 V CA -2.773 59.477 62.300 -0.083 0.000 1.022 118 V CB 3.505 35.316 31.823 -0.020 0.000 1.056 118 V HN -0.225 7.785 8.190 -0.300 0.000 0.436 119 R N 1.626 122.092 120.500 -0.057 0.000 2.205 119 R HA 0.201 4.493 4.340 -0.079 0.000 0.342 119 R C -0.091 176.185 176.300 -0.040 0.000 1.058 119 R CA -1.133 54.933 56.100 -0.057 0.000 0.904 119 R CB -0.647 29.629 30.300 -0.039 0.000 1.089 119 R HN 0.095 8.341 8.270 -0.039 0.000 0.471 120 I N 6.541 127.081 120.570 -0.049 0.000 2.533 120 I HA -0.018 4.127 4.170 -0.042 0.000 0.284 120 I C -1.592 174.540 176.117 0.026 0.000 1.109 120 I CA -1.750 59.531 61.300 -0.032 0.000 1.412 120 I CB -0.098 37.865 38.000 -0.062 0.000 1.396 120 I HN 0.110 8.278 8.210 -0.069 0.000 0.543 121 P HA -0.186 4.225 4.420 -0.015 0.000 0.264 121 P C -1.863 175.502 177.300 0.107 0.000 1.183 121 P CA 0.297 63.423 63.100 0.045 0.000 0.763 121 P CB 0.216 31.992 31.700 0.128 0.000 0.807 122 F N 3.806 123.650 119.950 -0.176 0.000 2.539 122 F HA 0.298 4.856 4.527 0.051 0.000 0.318 122 F C -2.607 172.992 175.800 -0.335 0.000 1.135 122 F CA -1.228 56.716 58.000 -0.094 0.000 0.915 122 F CB 3.677 42.675 39.000 -0.003 0.000 1.176 122 F HN -0.236 7.974 8.300 -0.149 0.000 0.440 123 F N 5.522 124.827 119.950 -1.076 0.000 2.495 123 F HA 0.605 4.987 4.527 -0.543 -0.181 0.327 123 F C -1.842 173.346 175.800 -1.020 0.000 1.103 123 F CA -1.845 55.693 58.000 -0.770 0.000 0.949 123 F CB 3.679 42.447 39.000 -0.385 0.000 1.142 123 F HN 0.158 7.960 8.300 -0.830 0.000 0.457 124 L N 1.290 122.271 121.223 -0.405 0.000 2.325 124 L HA 0.275 4.494 4.340 -0.201 0.000 0.278 124 L C -0.663 176.167 176.870 -0.066 0.000 1.023 124 L CA -0.975 53.747 54.840 -0.196 0.000 0.811 124 L CB 2.488 44.507 42.059 -0.067 0.000 1.249 124 L HN 0.442 8.520 8.230 -0.254 0.000 0.431 125 G N 3.948 112.735 108.800 -0.022 0.000 2.200 125 G HA2 -0.209 3.757 3.960 0.010 0.000 0.145 125 G HA3 -0.209 3.748 3.960 -0.005 0.000 0.145 125 G C -0.584 174.321 174.900 0.009 0.000 1.021 125 G CA -0.458 44.642 45.100 0.000 0.000 0.720 125 G HN 0.438 9.236 8.290 -0.004 -0.510 0.494 126 R N 1.040 121.551 120.500 0.018 0.000 2.522 126 R HA 0.015 4.363 4.340 0.013 0.000 0.284 126 R C -1.858 174.465 176.300 0.039 0.000 1.032 126 R CA -1.262 54.854 56.100 0.027 0.000 1.049 126 R CB -0.196 30.133 30.300 0.047 0.000 0.956 126 R HN -0.325 8.386 8.270 0.022 -0.428 0.422 127 P HA -0.142 4.299 4.420 0.035 0.000 0.270 127 P C -1.305 176.026 177.300 0.051 0.000 1.223 127 P CA -0.304 62.820 63.100 0.040 0.000 0.785 127 P CB 0.475 32.198 31.700 0.038 0.000 0.923 128 D N -0.038 120.389 120.400 0.045 0.000 2.449 128 D HA -0.264 4.401 4.640 0.041 0.000 0.236 128 D C 0.472 176.817 176.300 0.074 0.000 1.149 128 D CA 0.534 54.560 54.000 0.043 0.000 0.878 128 D CB 0.193 41.005 40.800 0.019 0.000 1.198 128 D HN -0.085 8.308 8.370 0.038 0.000 0.446 129 A N 2.147 125.022 122.820 0.093 0.000 2.520 129 A HA -0.117 4.309 4.320 0.177 0.000 0.235 129 A C -0.178 177.567 177.584 0.267 0.000 1.065 129 A CA 0.900 53.052 52.037 0.191 0.000 0.764 129 A CB 0.660 19.819 19.000 0.264 0.000 1.002 129 A HN 0.523 8.711 8.150 0.064 0.000 0.502 130 V N -2.453 117.628 119.914 0.278 0.000 3.432 130 V HA 0.239 4.538 4.120 0.299 0.000 0.298 130 V C -0.725 175.466 176.094 0.162 0.000 1.464 130 V CA -0.059 62.387 62.300 0.243 0.000 1.046 130 V CB 0.452 32.353 31.823 0.130 0.000 0.887 130 V HN 0.574 8.904 8.190 0.234 0.000 0.441 131 A N 0.254 123.128 122.820 0.089 0.000 2.594 131 A HA 0.157 4.193 4.320 -0.474 0.000 0.295 131 A C -1.980 175.352 177.584 -0.419 0.000 1.071 131 A CA -0.492 51.384 52.037 -0.268 0.000 0.685 131 A CB 2.348 21.284 19.000 -0.105 0.000 1.285 131 A HN -0.616 7.667 8.150 0.222 0.000 0.405 132 A N 0.340 122.723 122.820 -0.727 0.000 2.351 132 A HA -0.001 4.238 4.320 -0.136 0.000 0.257 132 A C 0.482 178.048 177.584 -0.030 0.000 1.087 132 A CA -0.460 51.382 52.037 -0.325 0.000 0.798 132 A CB 0.975 19.790 19.000 -0.308 0.000 1.033 132 A HN 0.185 7.841 8.150 -0.824 0.000 0.488 133 S N 2.728 118.498 115.700 0.117 0.000 2.560 133 S HA 0.002 4.540 4.470 0.113 0.000 0.284 133 S C -1.301 173.415 174.600 0.194 0.000 1.327 133 S CA -0.996 57.303 58.200 0.165 0.000 1.055 133 S CB 0.044 63.389 63.200 0.241 0.000 0.868 133 S HN -0.096 8.651 8.310 0.153 -0.345 0.506 134 P HA -0.032 4.370 4.420 -0.031 0.000 0.269 134 P C -1.404 175.727 177.300 -0.283 0.000 1.217 134 P CA -0.240 62.831 63.100 -0.049 0.000 0.783 134 P CB 0.573 32.231 31.700 -0.069 0.000 0.898 135 D N -1.081 118.874 120.400 -0.740 0.000 2.371 135 D HA -0.131 3.251 4.640 -2.096 0.000 0.242 135 D C -0.186 175.739 176.300 -0.625 0.000 1.218 135 D CA -0.371 52.790 54.000 -1.398 0.000 0.945 135 D CB 0.399 40.282 40.800 -1.528 0.000 1.137 135 D HN -0.028 8.003 8.370 -0.566 0.000 0.464 136 H N -3.750 115.082 119.070 -0.397 0.000 2.862 136 H HA -0.319 4.145 4.556 -0.154 0.000 0.290 136 H C -1.097 174.153 175.328 -0.130 0.000 1.211 136 H CA 1.062 56.993 56.048 -0.195 0.000 1.140 136 H CB -2.530 27.138 29.762 -0.157 0.000 1.341 136 H HN 0.457 8.195 8.280 -0.904 0.000 0.392 137 L N -5.039 116.141 121.223 -0.072 0.000 2.638 137 L HA 0.116 4.451 4.340 -0.008 0.000 0.232 137 L C -0.734 176.099 176.870 -0.061 0.000 1.099 137 L CA 0.109 54.927 54.840 -0.037 0.000 0.883 137 L CB 1.466 43.508 42.059 -0.029 0.000 1.136 137 L HN -0.101 8.020 8.230 -0.140 0.026 0.492 138 V N -0.402 119.451 119.914 -0.103 0.000 2.383 138 V HA 0.165 4.100 4.120 -0.309 0.000 0.275 138 V C -1.997 174.067 176.094 -0.050 0.000 1.036 138 V CA -2.152 60.021 62.300 -0.212 0.000 0.889 138 V CB 0.834 32.437 31.823 -0.366 0.000 0.985 138 V HN -0.344 7.795 8.190 -0.086 0.000 0.459 139 P HA -0.060 4.540 4.420 0.103 -0.118 0.267 139 P C -1.074 176.311 177.300 0.142 0.000 1.200 139 P CA 0.076 63.251 63.100 0.124 0.000 0.772 139 P CB 0.635 32.460 31.700 0.208 0.000 0.855 140 E N 0.639 120.918 120.200 0.131 0.000 2.263 140 E HA 0.285 4.737 4.350 0.169 0.000 0.264 140 E C -0.586 176.093 176.600 0.131 0.000 0.923 140 E CA -2.770 53.715 56.400 0.141 0.000 0.802 140 E CB 1.502 31.275 29.700 0.121 0.000 1.228 140 E HN -0.133 8.625 8.360 0.114 -0.329 0.417 141 P HA -0.075 4.417 4.420 0.120 0.000 0.229 141 P C -0.432 176.919 177.300 0.085 0.000 1.160 141 P CA 1.644 64.814 63.100 0.116 0.000 0.777 141 P CB 0.621 32.395 31.700 0.124 0.000 0.814 142 Q N -4.150 115.696 119.800 0.076 0.000 2.403 142 Q HA -0.095 4.273 4.340 0.046 0.000 0.203 142 Q C -0.172 175.854 176.000 0.045 0.000 0.932 142 Q CA -0.037 55.798 55.803 0.053 0.000 0.945 142 Q CB -0.954 27.812 28.738 0.047 0.000 1.045 142 Q HN -0.067 8.221 8.270 0.084 0.033 0.511 143 D N 2.937 123.370 120.400 0.055 0.000 2.313 143 D HA 0.117 4.778 4.640 0.035 0.000 0.247 143 D C -0.488 175.834 176.300 0.037 0.000 1.094 143 D CA 0.413 54.441 54.000 0.045 0.000 0.925 143 D CB 0.758 41.593 40.800 0.058 0.000 1.188 143 D HN -0.402 7.852 8.370 0.069 0.157 0.430 144 S N -0.250 115.465 115.700 0.026 0.000 2.600 144 S HA -0.047 4.433 4.470 0.017 0.000 0.265 144 S C 1.472 176.085 174.600 0.023 0.000 1.325 144 S CA 0.040 58.251 58.200 0.019 0.000 1.002 144 S CB 2.325 65.531 63.200 0.011 0.000 0.921 144 S HN -0.011 8.313 8.310 0.022 0.000 0.554 145 V N 2.198 122.119 119.914 0.013 0.000 2.332 145 V HA -0.447 3.684 4.120 0.018 0.000 0.248 145 V C 1.560 177.664 176.094 0.018 0.000 1.055 145 V CA 4.172 66.480 62.300 0.012 0.000 1.038 145 V CB -0.038 31.781 31.823 -0.007 0.000 0.651 145 V HN 0.636 8.830 8.190 0.007 0.000 0.450 146 D N -1.386 119.022 120.400 0.013 0.000 2.123 146 D HA -0.348 4.300 4.640 0.014 0.000 0.196 146 D C 2.343 178.656 176.300 0.021 0.000 0.992 146 D CA 3.376 57.384 54.000 0.014 0.000 0.833 146 D CB -0.662 40.143 40.800 0.007 0.000 0.954 146 D HN -0.218 8.157 8.370 0.009 0.000 0.455 147 S N 0.625 116.339 115.700 0.023 0.000 2.356 147 S HA -0.189 4.295 4.470 0.023 0.000 0.223 147 S C 2.120 176.748 174.600 0.047 0.000 1.032 147 S CA 3.263 61.480 58.200 0.029 0.000 1.005 147 S CB -0.351 62.864 63.200 0.025 0.000 0.867 147 S HN -0.399 7.923 8.310 0.020 0.000 0.449 148 I N 2.190 122.793 120.570 0.055 0.000 2.179 148 I HA -0.540 3.685 4.170 0.092 0.000 0.242 148 I C 1.792 177.958 176.117 0.081 0.000 1.088 148 I CA 4.396 65.743 61.300 0.078 0.000 1.357 148 I CB -0.052 37.995 38.000 0.078 0.000 1.051 148 I HN -0.159 8.080 8.210 0.048 0.000 0.409 149 L N -1.712 119.548 121.223 0.061 0.000 2.093 149 L HA -0.405 3.978 4.340 0.071 0.000 0.208 149 L C 2.370 179.280 176.870 0.066 0.000 1.085 149 L CA 2.935 57.811 54.840 0.060 0.000 0.755 149 L CB -0.866 41.215 42.059 0.037 0.000 0.904 149 L HN 0.024 8.283 8.230 0.049 0.000 0.435 150 A N -0.884 121.968 122.820 0.052 0.000 1.898 150 A HA -0.287 4.059 4.320 0.042 0.000 0.216 150 A C 1.897 179.519 177.584 0.063 0.000 1.181 150 A CA 3.104 55.169 52.037 0.046 0.000 0.620 150 A CB -0.833 18.184 19.000 0.028 0.000 0.819 150 A HN -0.016 8.161 8.150 0.045 0.000 0.442 151 R N -0.678 119.868 120.500 0.076 0.000 2.066 151 R HA -0.225 4.158 4.340 0.072 0.000 0.232 151 R C 2.401 178.792 176.300 0.152 0.000 1.131 151 R CA 2.517 58.673 56.100 0.094 0.000 0.955 151 R CB -0.401 29.955 30.300 0.093 0.000 0.851 151 R HN -0.393 7.921 8.270 0.073 0.000 0.432 152 M N -2.320 117.393 119.600 0.189 0.000 2.159 152 M HA -0.277 4.434 4.480 0.386 0.000 0.263 152 M C 2.264 178.740 176.300 0.293 0.000 1.063 152 M CA 2.234 57.715 55.300 0.301 0.000 1.110 152 M CB -0.924 31.825 32.600 0.247 0.000 1.374 152 M HN 0.050 8.437 8.290 0.161 0.000 0.411 153 G N -1.026 107.876 108.800 0.169 0.000 2.422 153 G HA2 -0.390 3.827 3.960 0.111 0.000 0.218 153 G HA3 -0.390 3.617 3.960 0.078 0.000 0.218 153 G C 0.764 175.708 174.900 0.073 0.000 1.146 153 G CA 1.873 47.037 45.100 0.106 0.000 0.769 153 G HN 0.117 8.490 8.290 0.139 0.000 0.547 154 D N 1.934 122.378 120.400 0.073 0.000 2.149 154 D HA -0.296 4.353 4.640 0.014 0.000 0.198 154 D C 1.432 177.764 176.300 0.055 0.000 0.990 154 D CA 2.699 56.722 54.000 0.038 0.000 0.839 154 D CB -0.137 40.676 40.800 0.023 0.000 0.948 154 D HN -0.410 8.010 8.370 0.083 0.000 0.460 155 A N -4.892 118.011 122.820 0.138 0.000 2.167 155 A HA -0.001 4.511 4.320 0.321 0.000 0.214 155 A C -0.416 177.190 177.584 0.037 0.000 1.151 155 A CA 0.301 52.480 52.037 0.237 0.000 0.735 155 A CB 0.503 19.727 19.000 0.374 0.000 0.802 155 A HN -0.673 7.481 8.150 0.173 0.100 0.467 156 G N -5.204 103.539 108.800 -0.095 0.000 2.198 156 G HA2 -0.160 3.725 3.960 -0.126 0.000 0.156 156 G HA3 -0.160 3.591 3.960 -0.349 0.000 0.156 156 G C -1.509 173.161 174.900 -0.384 0.000 1.012 156 G CA -0.328 44.614 45.100 -0.263 0.000 0.692 156 G HN -0.560 7.569 8.290 -0.002 0.160 0.492 157 F N 0.648 120.635 119.950 0.062 0.000 2.436 157 F HA 0.543 5.279 4.527 0.020 -0.197 0.340 157 F C -0.031 175.762 175.800 -0.011 0.000 1.113 157 F CA -1.742 56.273 58.000 0.026 0.000 1.022 157 F CB 1.856 40.878 39.000 0.036 0.000 1.128 157 F HN -0.401 7.938 8.300 0.064 0.000 0.466 158 S N 3.657 119.427 115.700 0.117 0.000 2.624 158 S HA 0.338 4.821 4.470 0.022 0.000 0.263 158 S C -0.184 174.392 174.600 -0.041 0.000 1.287 158 S CA -1.423 56.784 58.200 0.010 0.000 0.990 158 S CB -0.653 62.516 63.200 -0.051 0.000 0.950 158 S HN 0.351 9.054 8.310 0.111 -0.327 0.561 159 P HA -0.189 4.206 4.420 -0.042 0.000 0.215 159 P C 1.157 178.333 177.300 -0.207 0.000 1.153 159 P CA 2.629 65.680 63.100 -0.081 0.000 0.853 159 P CB -0.224 31.448 31.700 -0.046 0.000 0.788 160 V N -7.635 112.067 119.914 -0.355 0.000 2.407 160 V HA -0.439 3.363 4.120 -0.529 0.000 0.248 160 V C 1.450 176.764 176.094 -1.300 0.000 1.055 160 V CA 3.438 65.299 62.300 -0.731 0.000 1.049 160 V CB -0.617 30.774 31.823 -0.720 0.000 0.662 160 V HN -0.196 7.817 8.190 -0.296 0.000 0.455 161 E N 0.566 120.218 120.200 -0.914 0.000 2.153 161 E HA -0.316 3.639 4.350 -0.659 0.000 0.194 161 E C 2.581 179.027 176.600 -0.258 0.000 0.988 161 E CA 3.032 59.121 56.400 -0.517 0.000 0.811 161 E CB -0.227 29.474 29.700 0.001 0.000 0.746 161 E HN -0.776 7.204 8.360 -0.634 0.000 0.466 162 V N 0.222 120.012 119.914 -0.207 0.000 2.295 162 V HA -0.535 3.469 4.120 -0.194 0.000 0.246 162 V C 1.693 177.753 176.094 -0.056 0.000 1.049 162 V CA 4.354 66.575 62.300 -0.132 0.000 1.024 162 V CB -0.155 31.642 31.823 -0.043 0.000 0.648 162 V HN -0.609 7.466 8.190 -0.192 0.000 0.447 163 V N -0.507 119.376 119.914 -0.052 0.000 2.287 163 V HA -0.550 3.709 4.120 0.231 0.000 0.248 163 V C 1.744 177.933 176.094 0.159 0.000 1.053 163 V CA 3.965 66.319 62.300 0.090 0.000 1.027 163 V CB -0.262 31.605 31.823 0.074 0.000 0.646 163 V HN -0.795 7.311 8.190 -0.140 0.000 0.447 164 W N -3.221 118.104 121.300 0.042 0.000 2.358 164 W HA -0.210 4.474 4.660 0.040 0.000 0.303 164 W C 2.955 179.586 176.519 0.187 0.000 1.208 164 W CA 0.888 58.279 57.345 0.076 0.000 1.274 164 W CB -0.913 28.589 29.460 0.070 0.000 1.138 164 W HN -0.536 7.539 8.180 -0.175 0.000 0.515 165 L N -1.354 120.034 121.223 0.274 0.000 2.131 165 L HA -0.361 4.188 4.340 0.348 0.000 0.210 165 L C 2.143 179.085 176.870 0.120 0.000 1.092 165 L CA 2.985 57.928 54.840 0.172 0.000 0.759 165 L CB -0.512 41.432 42.059 -0.190 0.000 0.903 165 L HN -0.096 8.225 8.230 0.152 0.000 0.435 166 L N -3.022 118.195 121.223 -0.011 0.000 2.622 166 L HA -0.109 3.955 4.340 -0.461 0.000 0.233 166 L C 1.868 178.554 176.870 -0.306 0.000 1.156 166 L CA 0.823 55.511 54.840 -0.254 0.000 0.866 166 L CB -0.969 40.991 42.059 -0.166 0.000 0.980 166 L HN -0.403 7.739 8.230 0.039 0.111 0.448 167 A N 0.476 123.308 122.820 0.021 0.000 2.076 167 A HA -0.341 3.836 4.320 -0.240 0.000 0.220 167 A C 1.668 179.006 177.584 -0.409 0.000 1.160 167 A CA 2.807 54.737 52.037 -0.179 0.000 0.653 167 A CB -0.726 18.213 19.000 -0.102 0.000 0.801 167 A HN -0.405 7.844 8.150 0.229 0.038 0.455 168 S N -0.407 115.131 115.700 -0.270 0.000 2.402 168 S HA -0.372 4.019 4.470 -0.132 0.000 0.233 168 S C 2.049 176.569 174.600 -0.134 0.000 1.030 168 S CA 3.521 61.652 58.200 -0.114 0.000 1.003 168 S CB -0.522 62.756 63.200 0.131 0.000 0.813 168 S HN -0.331 7.906 8.310 -0.093 0.018 0.477 169 H N 1.276 119.976 119.070 -0.616 0.000 2.563 169 H HA -0.061 4.319 4.556 -0.294 0.000 0.272 169 H C 0.997 175.882 175.328 -0.738 0.000 1.005 169 H CA 0.615 56.206 56.048 -0.761 0.000 1.171 169 H CB -0.320 28.590 29.762 -1.421 0.000 1.351 169 H HN -0.329 7.476 8.280 -0.580 0.127 0.602 170 S N -1.861 113.530 115.700 -0.515 0.000 2.481 170 S HA -0.178 4.339 4.470 -0.185 -0.158 0.231 170 S C -0.145 174.343 174.600 -0.188 0.000 0.996 170 S CA 2.036 60.066 58.200 -0.284 0.000 0.942 170 S CB 0.642 63.621 63.200 -0.368 0.000 0.768 170 S HN -0.455 7.362 8.310 -0.558 0.159 0.520 171 I N -7.584 112.862 120.570 -0.207 0.000 2.925 171 I HA 0.550 4.704 4.170 -0.307 -0.168 0.296 171 I C -2.536 173.165 176.117 -0.693 0.000 1.413 171 I CA -1.230 59.893 61.300 -0.295 0.000 0.932 171 I CB 0.286 38.275 38.000 -0.018 0.000 1.873 171 I HN -0.721 7.323 8.210 -0.205 0.043 0.619 172 A N 1.358 123.721 122.820 -0.761 0.000 2.594 172 A HA 0.389 4.296 4.320 -0.689 0.000 0.296 172 A C -2.714 174.395 177.584 -0.791 0.000 1.061 172 A CA 0.144 51.779 52.037 -0.668 0.000 0.689 172 A CB 2.869 21.675 19.000 -0.323 0.000 1.280 172 A HN -0.281 7.486 8.150 -0.638 0.000 0.406 173 A N 0.106 122.477 122.820 -0.747 0.000 2.564 173 A HA 0.715 4.491 4.320 -1.067 -0.097 0.288 173 A C -2.025 175.144 177.584 -0.693 0.000 1.164 173 A CA -1.183 50.387 52.037 -0.777 0.000 0.712 173 A CB 3.591 22.386 19.000 -0.342 0.000 1.303 173 A HN 0.248 8.072 8.150 -0.543 0.000 0.418 174 A N -1.401 121.129 122.820 -0.483 0.000 2.343 174 A HA 0.410 4.656 4.320 -0.123 0.000 0.316 174 A C -1.338 176.206 177.584 -0.067 0.000 1.104 174 A CA -1.065 50.869 52.037 -0.172 0.000 0.768 174 A CB 2.108 21.114 19.000 0.010 0.000 1.213 174 A HN 0.044 7.931 8.150 -0.440 0.000 0.456 175 D N 2.532 122.923 120.400 -0.015 0.000 2.422 175 D HA 0.052 4.692 4.640 -0.001 0.000 0.218 175 D C 0.564 176.883 176.300 0.030 0.000 1.047 175 D CA 2.195 56.199 54.000 0.006 0.000 0.885 175 D CB 1.598 42.402 40.800 0.007 0.000 1.035 175 D HN 0.352 8.721 8.370 -0.002 0.000 0.502 176 K N -0.693 119.737 120.400 0.050 0.000 2.370 176 K HA 0.191 4.541 4.320 0.050 0.000 0.194 176 K C 1.443 178.087 176.600 0.073 0.000 1.070 176 K CA 0.601 56.925 56.287 0.061 0.000 0.998 176 K CB -0.177 32.366 32.500 0.071 0.000 0.911 176 K HN -0.034 8.250 8.250 0.058 0.000 0.533 177 V N -1.137 118.833 119.914 0.094 0.000 2.287 177 V HA -0.320 3.862 4.120 0.103 0.000 0.248 177 V C 0.098 176.239 176.094 0.079 0.000 1.053 177 V CA 2.545 64.908 62.300 0.106 0.000 1.027 177 V CB 0.161 32.075 31.823 0.153 0.000 0.646 177 V HN -0.441 7.809 8.190 0.101 0.000 0.447 178 D N -3.981 116.462 120.400 0.072 0.000 2.389 178 D HA 0.370 5.034 4.640 0.041 0.000 0.256 178 D C -1.180 175.145 176.300 0.042 0.000 1.239 178 D CA -2.975 51.056 54.000 0.052 0.000 0.925 178 D CB 0.792 41.630 40.800 0.063 0.000 1.145 178 D HN -0.436 7.980 8.370 0.077 0.000 0.542 179 P HA 0.117 4.728 4.420 0.029 -0.174 0.234 179 P C 0.263 177.577 177.300 0.023 0.000 1.167 179 P CA 0.461 63.578 63.100 0.028 0.000 0.763 179 P CB 0.494 32.210 31.700 0.026 0.000 0.835 180 S N -0.192 115.523 115.700 0.024 0.000 2.489 180 S HA -0.078 4.404 4.470 0.019 0.000 0.228 180 S C 1.194 175.809 174.600 0.025 0.000 0.995 180 S CA 1.573 59.786 58.200 0.022 0.000 0.934 180 S CB 0.983 64.195 63.200 0.020 0.000 0.771 180 S HN -0.219 8.341 8.310 0.024 -0.236 0.522 181 I N -3.856 116.731 120.570 0.029 0.000 2.931 181 I HA 0.551 4.735 4.170 0.024 0.000 0.322 181 I C -2.601 173.527 176.117 0.019 0.000 1.446 181 I CA -3.127 58.190 61.300 0.028 0.000 0.825 181 I CB 0.484 38.508 38.000 0.040 0.000 2.195 181 I HN -0.492 7.695 8.210 0.031 0.041 0.608 182 P HA -0.025 4.513 4.420 0.003 -0.117 0.269 182 P C 0.943 178.238 177.300 -0.009 0.000 1.209 182 P CA 0.824 63.927 63.100 0.004 0.000 0.776 182 P CB 0.021 31.726 31.700 0.008 0.000 0.876 183 G N 2.346 111.128 108.800 -0.030 0.000 2.136 183 G HA2 -0.415 3.570 3.960 -0.054 0.000 0.242 183 G HA3 -0.415 3.531 3.960 -0.023 0.000 0.242 183 G C -0.203 174.658 174.900 -0.065 0.000 0.989 183 G CA -0.025 45.049 45.100 -0.043 0.000 0.682 183 G HN 0.072 8.489 8.290 -0.037 -0.149 0.522 184 T N 3.937 118.448 114.554 -0.073 0.000 2.794 184 T HA 0.358 4.679 4.350 -0.048 0.000 0.296 184 T C -1.751 172.847 174.700 -0.171 0.000 0.949 184 T CA -1.116 60.943 62.100 -0.068 0.000 1.101 184 T CB 0.350 69.212 68.868 -0.009 0.000 0.905 184 T HN -0.596 7.576 8.240 -0.061 0.032 0.516 185 P HA 0.388 4.682 4.420 -0.450 -0.145 0.278 185 P C 0.037 177.254 177.300 -0.140 0.000 1.258 185 P CA -0.864 62.079 63.100 -0.261 0.000 0.811 185 P CB 1.266 32.879 31.700 -0.145 0.000 1.063 186 F N -3.427 116.481 119.950 -0.070 0.000 2.615 186 F HA 0.321 5.071 4.527 0.048 -0.194 0.297 186 F C 0.309 176.171 175.800 0.104 0.000 1.124 186 F CA 0.272 58.285 58.000 0.022 0.000 1.451 186 F CB 0.477 39.461 39.000 -0.027 0.000 1.103 186 F HN 0.066 8.156 8.300 -0.350 0.000 0.569 187 D N -5.462 115.043 120.400 0.175 0.000 2.592 187 D HA 0.231 5.226 4.640 0.104 -0.292 0.263 187 D C 0.121 176.435 176.300 0.024 0.000 1.132 187 D CA -2.586 51.476 54.000 0.102 0.000 0.996 187 D CB 2.512 43.378 40.800 0.111 0.000 1.442 187 D HN -0.743 7.674 8.370 0.079 0.000 0.486 188 S N -4.403 111.298 115.700 0.001 0.000 2.561 188 S HA -0.038 4.435 4.470 0.006 0.000 0.225 188 S C 0.711 175.320 174.600 0.015 0.000 0.977 188 S CA 1.455 59.658 58.200 0.004 0.000 0.926 188 S CB -0.003 63.198 63.200 0.003 0.000 0.769 188 S HN 0.065 8.580 8.310 -0.014 -0.213 0.533 189 T N -0.854 113.703 114.554 0.005 0.000 3.585 189 T HA 0.524 4.886 4.350 0.021 0.000 0.252 189 T C -1.657 173.037 174.700 -0.010 0.000 1.382 189 T CA -3.100 59.006 62.100 0.011 0.000 1.584 189 T CB 0.050 68.932 68.868 0.023 0.000 0.892 189 T HN -0.369 8.087 8.240 -0.004 -0.219 0.671 190 P HA 0.282 4.768 4.420 -0.144 -0.152 0.230 190 P C 0.310 177.639 177.300 0.050 0.000 1.158 190 P CA 1.176 64.231 63.100 -0.075 0.000 0.769 190 P CB 0.002 31.641 31.700 -0.101 0.000 0.807 191 G N -3.310 105.536 108.800 0.077 0.000 3.189 191 G HA2 0.086 4.276 3.960 0.152 0.000 0.225 191 G HA3 0.086 4.085 3.960 0.066 0.000 0.225 191 G C -1.615 173.323 174.900 0.062 0.000 1.159 191 G CA -0.349 44.807 45.100 0.093 0.000 0.763 191 G HN -0.032 8.253 8.290 0.051 0.036 0.549 192 V N -0.823 119.123 119.914 0.052 0.000 2.577 192 V HA 0.236 4.501 4.120 0.067 -0.104 0.303 192 V C -1.945 174.187 176.094 0.063 0.000 1.042 192 V CA -1.450 60.882 62.300 0.055 0.000 0.872 192 V CB 2.727 34.571 31.823 0.034 0.000 0.998 192 V HN -0.526 7.627 8.190 0.037 0.059 0.423 193 F N 9.966 129.875 119.950 -0.068 0.000 2.509 193 F HA 0.000 4.444 4.527 -0.139 0.000 0.350 193 F C -2.373 173.382 175.800 -0.075 0.000 1.220 193 F CA -0.724 57.211 58.000 -0.108 0.000 1.151 193 F CB -0.259 38.662 39.000 -0.131 0.000 1.379 193 F HN 0.415 8.846 8.300 0.218 0.000 0.610 194 D N 3.136 123.313 120.400 -0.372 0.000 2.752 194 D HA 0.446 5.149 4.640 -0.242 -0.208 0.313 194 D C 0.014 176.177 176.300 -0.228 0.000 1.225 194 D CA -1.930 51.924 54.000 -0.244 0.000 0.976 194 D CB 2.307 43.053 40.800 -0.089 0.000 1.443 194 D HN -0.351 7.789 8.370 -0.384 0.000 0.515 195 S N -4.128 111.510 115.700 -0.103 0.000 2.631 195 S HA -0.088 4.463 4.470 0.134 0.000 0.217 195 S C 1.518 176.127 174.600 0.015 0.000 0.958 195 S CA 1.131 59.344 58.200 0.021 0.000 0.920 195 S CB -1.294 61.904 63.200 -0.003 0.000 0.776 195 S HN 0.423 8.679 8.310 -0.090 0.000 0.517 196 Q N 2.644 122.409 119.800 -0.058 0.000 2.135 196 Q HA -0.312 3.949 4.340 -0.132 0.000 0.204 196 Q C 1.618 177.580 176.000 -0.063 0.000 0.981 196 Q CA 2.636 58.383 55.803 -0.094 0.000 0.856 196 Q CB -1.018 27.651 28.738 -0.115 0.000 0.902 196 Q HN -0.667 7.687 8.270 -0.074 -0.129 0.425 197 F N 1.105 120.916 119.950 -0.232 0.000 2.095 197 F HA -0.298 4.118 4.527 -0.185 0.000 0.298 197 F C 1.481 177.103 175.800 -0.297 0.000 1.104 197 F CA 3.203 61.016 58.000 -0.311 0.000 1.232 197 F CB -0.398 38.286 39.000 -0.527 0.000 0.987 197 F HN -0.571 7.829 8.300 0.024 -0.085 0.475 198 F N -3.040 116.724 119.950 -0.311 0.000 2.234 198 F HA -0.257 3.923 4.527 -0.578 0.000 0.299 198 F C 2.215 177.983 175.800 -0.054 0.000 1.087 198 F CA 3.212 60.983 58.000 -0.383 0.000 1.340 198 F CB -0.050 38.690 39.000 -0.434 0.000 1.031 198 F HN -0.781 7.380 8.300 -0.233 0.000 0.500 199 I N -1.025 119.608 120.570 0.106 0.000 2.193 199 I HA -0.497 3.876 4.170 0.339 0.000 0.240 199 I C 2.165 178.284 176.117 0.002 0.000 1.084 199 I CA 3.888 65.276 61.300 0.146 0.000 1.365 199 I CB -0.122 37.915 38.000 0.062 0.000 1.064 199 I HN -0.593 7.649 8.210 0.053 0.000 0.410 200 E N -1.223 118.919 120.200 -0.098 0.000 2.208 200 E HA -0.287 3.966 4.350 -0.163 0.000 0.193 200 E C 2.450 178.976 176.600 -0.123 0.000 0.988 200 E CA 3.062 59.380 56.400 -0.137 0.000 0.828 200 E CB 0.056 29.674 29.700 -0.135 0.000 0.763 200 E HN 0.064 8.355 8.360 -0.115 0.000 0.478 201 T N -2.353 112.106 114.554 -0.158 0.000 3.007 201 T HA -0.287 3.987 4.350 -0.128 0.000 0.270 201 T C 1.241 175.860 174.700 -0.136 0.000 1.107 201 T CA 3.405 65.415 62.100 -0.151 0.000 1.118 201 T CB -0.504 68.229 68.868 -0.226 0.000 0.889 201 T HN -0.333 7.773 8.240 -0.224 0.000 0.506 202 Q N 1.273 121.029 119.800 -0.074 0.000 2.389 202 Q HA 0.001 4.238 4.340 -0.171 0.000 0.204 202 Q C -0.338 175.555 176.000 -0.178 0.000 0.944 202 Q CA 0.279 56.008 55.803 -0.123 0.000 0.908 202 Q CB 0.202 28.921 28.738 -0.032 0.000 1.002 202 Q HN -0.615 7.493 8.270 -0.025 0.147 0.493 203 L N -0.440 120.701 121.223 -0.137 0.000 2.467 203 L HA -0.049 4.389 4.340 -0.100 -0.158 0.270 203 L C 0.672 177.511 176.870 -0.052 0.000 1.205 203 L CA 0.210 55.002 54.840 -0.081 0.000 0.828 203 L CB 0.215 42.259 42.059 -0.025 0.000 1.101 203 L HN -0.791 7.331 8.230 -0.122 0.034 0.479 204 K N 1.224 121.613 120.400 -0.019 0.000 2.451 204 K HA -0.154 4.306 4.320 -0.031 -0.159 0.280 204 K C 0.598 177.206 176.600 0.013 0.000 1.020 204 K CA 0.549 56.828 56.287 -0.013 0.000 1.008 204 K CB 0.038 32.527 32.500 -0.020 0.000 0.917 204 K HN -0.127 8.117 8.250 -0.009 0.000 0.478 205 G N 1.532 110.333 108.800 0.002 0.000 2.491 205 G HA2 -0.071 3.875 3.960 -0.023 0.000 0.238 205 G HA3 -0.071 3.858 3.960 -0.052 0.000 0.238 205 G C -0.749 174.116 174.900 -0.059 0.000 1.277 205 G CA -0.224 44.856 45.100 -0.032 0.000 0.851 205 G HN 0.328 8.627 8.290 0.016 0.000 0.573 206 R N 1.682 122.134 120.500 -0.079 0.000 2.470 206 R HA 0.261 4.561 4.340 -0.067 0.000 0.210 206 R C -0.644 175.585 176.300 -0.118 0.000 0.873 206 R CA 0.304 56.361 56.100 -0.071 0.000 1.015 206 R CB 2.187 32.480 30.300 -0.011 0.000 1.348 206 R HN 0.350 8.456 8.270 -0.087 0.111 0.650 207 L N -6.590 114.521 121.223 -0.187 0.000 2.671 207 L HA 0.374 4.630 4.340 -0.141 0.000 0.259 207 L C -2.251 174.432 176.870 -0.312 0.000 1.021 207 L CA -0.607 54.135 54.840 -0.164 0.000 0.871 207 L CB 2.689 44.732 42.059 -0.026 0.000 1.472 207 L HN -0.606 7.496 8.230 -0.214 0.000 0.410 208 F N -0.392 119.578 119.950 0.034 0.000 2.415 208 F HA 0.504 5.056 4.527 0.041 0.000 0.348 208 F C -0.340 175.482 175.800 0.037 0.000 1.119 208 F CA -2.504 55.518 58.000 0.036 0.000 1.069 208 F CB 0.606 39.622 39.000 0.027 0.000 1.124 208 F HN 0.164 8.549 8.300 0.142 0.000 0.472 209 P HA -0.079 4.552 4.420 0.103 -0.150 0.223 209 P C -0.805 176.565 177.300 0.117 0.000 1.151 209 P CA 0.471 63.647 63.100 0.127 0.000 0.787 209 P CB 0.782 32.545 31.700 0.106 0.000 0.788 210 G N -0.756 108.126 108.800 0.137 0.000 3.267 210 G HA2 0.461 4.465 3.960 0.073 0.000 0.200 210 G HA3 0.461 4.640 3.960 0.075 -0.174 0.200 210 G C -1.327 173.619 174.900 0.077 0.000 1.603 210 G CA -0.696 44.457 45.100 0.088 0.000 0.753 210 G HN -0.226 8.148 8.290 0.178 0.023 0.755 211 T N -1.423 113.147 114.554 0.026 0.000 2.881 211 T HA 0.189 4.526 4.350 -0.022 0.000 0.278 211 T C 0.077 174.665 174.700 -0.187 0.000 0.982 211 T CA -1.300 60.775 62.100 -0.042 0.000 0.989 211 T CB 2.122 70.958 68.868 -0.052 0.000 1.058 211 T HN -0.271 8.235 8.240 0.023 -0.252 0.529 212 A N -1.468 121.162 122.820 -0.317 0.000 2.348 212 A HA 0.230 3.695 4.320 -1.424 0.000 0.224 212 A C -0.629 176.475 177.584 -0.799 0.000 1.227 212 A CA 0.702 52.265 52.037 -0.790 0.000 0.885 212 A CB 0.111 18.875 19.000 -0.394 0.000 0.933 212 A HN 0.400 8.419 8.150 -0.218 0.000 0.506 213 D N -2.368 117.781 120.400 -0.418 0.000 2.819 213 D HA 0.139 4.589 4.640 -0.315 0.000 0.326 213 D C -1.543 174.657 176.300 -0.168 0.000 1.408 213 D CA -0.549 53.288 54.000 -0.271 0.000 0.811 213 D CB 0.272 40.974 40.800 -0.162 0.000 1.148 213 D HN -0.074 8.108 8.370 -0.313 0.000 0.457 214 N N 0.620 119.218 118.700 -0.169 0.000 2.514 214 N HA 0.034 4.746 4.740 -0.048 0.000 0.277 214 N C -0.529 174.967 175.510 -0.024 0.000 1.126 214 N CA 0.075 53.087 53.050 -0.063 0.000 0.978 214 N CB 0.961 39.434 38.487 -0.024 0.000 1.106 214 N HN -0.103 8.130 8.380 -0.244 0.000 0.461 215 K N 4.139 124.539 120.400 0.001 0.000 2.451 215 K HA -0.272 4.055 4.320 0.011 0.000 0.280 215 K C 0.799 177.428 176.600 0.047 0.000 1.020 215 K CA 1.519 57.819 56.287 0.020 0.000 1.008 215 K CB 0.519 33.035 32.500 0.027 0.000 0.917 215 K HN 0.480 8.731 8.250 0.002 0.000 0.478 216 G N 3.588 112.419 108.800 0.050 0.000 2.162 216 G HA2 -0.332 3.665 3.960 0.061 0.000 0.260 216 G HA3 -0.332 3.676 3.960 0.081 0.000 0.260 216 G C -1.373 173.579 174.900 0.088 0.000 0.976 216 G CA 0.224 45.366 45.100 0.069 0.000 0.655 216 G HN 0.452 8.765 8.290 0.039 0.000 0.533 217 E N 0.799 121.058 120.200 0.098 0.000 2.195 217 E HA 0.577 5.150 4.350 0.152 -0.132 0.271 217 E C -2.149 174.574 176.600 0.206 0.000 0.923 217 E CA -1.691 54.803 56.400 0.157 0.000 0.790 217 E CB 2.913 32.720 29.700 0.178 0.000 1.155 217 E HN -0.878 7.485 8.360 0.079 0.045 0.402 218 A N 4.643 127.576 122.820 0.188 0.000 2.322 218 A HA 0.344 4.744 4.320 0.135 0.000 0.327 218 A C -1.445 176.155 177.584 0.027 0.000 1.134 218 A CA -1.713 50.391 52.037 0.111 0.000 0.831 218 A CB 2.653 21.645 19.000 -0.012 0.000 1.288 218 A HN 0.648 8.896 8.150 0.163 0.000 0.472 219 Q N -1.434 118.180 119.800 -0.309 0.000 2.349 219 Q HA -0.221 3.592 4.340 -1.057 -0.108 0.287 219 Q C -0.175 175.698 176.000 -0.211 0.000 1.044 219 Q CA 1.153 56.585 55.803 -0.619 0.000 0.918 219 Q CB 0.446 28.822 28.738 -0.604 0.000 1.242 219 Q HN 0.123 8.229 8.270 -0.273 0.000 0.405 220 S N 2.564 118.162 115.700 -0.170 0.000 2.654 220 S HA 0.433 4.900 4.470 -0.005 0.000 0.283 220 S C -0.842 173.742 174.600 -0.026 0.000 1.180 220 S CA -3.068 55.109 58.200 -0.038 0.000 1.021 220 S CB 0.990 64.199 63.200 0.014 0.000 1.018 220 S HN 0.131 8.298 8.310 -0.238 0.000 0.532 221 P HA 0.154 4.643 4.420 0.115 0.000 0.240 221 P C -1.533 175.852 177.300 0.142 0.000 1.190 221 P CA 0.352 63.511 63.100 0.098 0.000 0.781 221 P CB 0.608 32.353 31.700 0.075 0.000 0.931 222 L N -2.852 118.412 121.223 0.068 0.000 2.455 222 L HA 0.375 4.782 4.340 0.112 0.000 0.264 222 L C 0.479 177.383 176.870 0.057 0.000 0.968 222 L CA -1.335 53.547 54.840 0.069 0.000 0.827 222 L CB 3.232 45.299 42.059 0.014 0.000 1.317 222 L HN -0.854 7.349 8.230 0.043 0.052 0.407 223 Q N 2.593 122.430 119.800 0.062 0.000 2.135 223 Q HA -0.240 4.135 4.340 0.057 0.000 0.204 223 Q C 0.835 176.865 176.000 0.050 0.000 0.981 223 Q CA 2.817 58.653 55.803 0.055 0.000 0.856 223 Q CB -0.183 28.586 28.738 0.053 0.000 0.902 223 Q HN 0.497 8.810 8.270 0.071 0.000 0.425 224 G N -3.579 105.246 108.800 0.042 0.000 3.262 224 G HA2 -0.059 3.921 3.960 0.033 0.000 0.228 224 G HA3 -0.059 3.918 3.960 0.028 0.000 0.228 224 G C -1.565 173.354 174.900 0.031 0.000 1.197 224 G CA -0.511 44.609 45.100 0.033 0.000 0.819 224 G HN -0.144 8.157 8.290 0.042 0.015 0.531 225 E N -0.876 119.352 120.200 0.047 0.000 2.356 225 E HA 0.416 4.973 4.350 0.057 -0.172 0.275 225 E C -2.075 174.586 176.600 0.101 0.000 0.904 225 E CA -1.832 54.608 56.400 0.066 0.000 0.757 225 E CB 3.498 33.233 29.700 0.057 0.000 1.232 225 E HN -0.834 7.482 8.360 0.052 0.075 0.442 226 I N 2.465 123.130 120.570 0.158 0.000 2.562 226 I HA 0.256 4.530 4.170 0.173 0.000 0.301 226 I C -2.597 173.694 176.117 0.289 0.000 1.003 226 I CA -1.787 59.641 61.300 0.214 0.000 1.127 226 I CB 4.021 42.151 38.000 0.218 0.000 1.304 226 I HN 0.169 8.481 8.210 0.170 0.000 0.446 227 R N 5.645 126.269 120.500 0.208 0.000 2.534 227 R HA 0.324 4.756 4.340 0.154 0.000 0.301 227 R C -1.938 174.436 176.300 0.124 0.000 0.961 227 R CA -1.701 54.489 56.100 0.150 0.000 0.871 227 R CB 2.955 33.314 30.300 0.099 0.000 1.170 227 R HN 0.394 8.776 8.270 0.186 0.000 0.446 228 L N 5.181 126.425 121.223 0.035 0.000 2.417 228 L HA 0.233 4.757 4.340 0.079 -0.136 0.268 228 L C 0.656 177.568 176.870 0.070 0.000 1.158 228 L CA -0.120 54.742 54.840 0.036 0.000 0.819 228 L CB 0.422 42.449 42.059 -0.054 0.000 1.112 228 L HN 0.638 8.839 8.230 -0.049 0.000 0.458 229 Q N 3.002 122.843 119.800 0.069 0.000 2.124 229 Q HA -0.317 4.050 4.340 0.044 0.000 0.202 229 Q C 1.710 177.749 176.000 0.064 0.000 0.977 229 Q CA 3.173 59.006 55.803 0.050 0.000 0.850 229 Q CB -0.038 28.710 28.738 0.017 0.000 0.901 229 Q HN 0.421 8.618 8.270 0.073 0.117 0.429 230 S N -1.065 114.672 115.700 0.062 0.000 2.370 230 S HA -0.286 4.209 4.470 0.042 0.000 0.226 230 S C 1.687 176.302 174.600 0.026 0.000 1.033 230 S CA 3.480 61.713 58.200 0.055 0.000 1.011 230 S CB -1.071 62.180 63.200 0.085 0.000 0.852 230 S HN -0.607 7.743 8.310 0.068 0.000 0.457 231 D N 3.136 123.571 120.400 0.058 0.000 2.144 231 D HA -0.286 4.368 4.640 0.024 0.000 0.200 231 D C 1.781 177.965 176.300 -0.194 0.000 0.978 231 D CA 3.218 57.234 54.000 0.028 0.000 0.833 231 D CB -0.554 40.389 40.800 0.238 0.000 0.961 231 D HN -0.390 8.027 8.370 0.078 0.000 0.470 232 H N 2.252 121.226 119.070 -0.161 0.000 2.289 232 H HA -0.339 4.090 4.556 -0.211 0.000 0.296 232 H C 2.551 177.727 175.328 -0.254 0.000 1.091 232 H CA 3.496 59.430 56.048 -0.189 0.000 1.274 232 H CB 0.213 29.914 29.762 -0.101 0.000 1.364 232 H HN -0.390 7.949 8.280 0.098 0.000 0.490 233 L N -2.130 119.086 121.223 -0.010 0.000 2.056 233 L HA -0.380 3.954 4.340 -0.011 0.000 0.207 233 L C 1.750 178.473 176.870 -0.245 0.000 1.078 233 L CA 2.947 57.749 54.840 -0.062 0.000 0.749 233 L CB -0.037 42.023 42.059 0.003 0.000 0.901 233 L HN -0.285 7.979 8.230 0.056 0.000 0.433 234 L N -1.866 119.154 121.223 -0.340 0.000 2.131 234 L HA -0.293 3.897 4.340 -0.251 0.000 0.210 234 L C 2.652 179.020 176.870 -0.836 0.000 1.092 234 L CA 2.846 57.419 54.840 -0.444 0.000 0.759 234 L CB -0.387 41.485 42.059 -0.311 0.000 0.903 234 L HN -0.015 8.041 8.230 -0.290 0.000 0.435 235 A N -3.627 118.396 122.820 -1.329 0.000 2.067 235 A HA -0.216 2.869 4.320 -2.059 0.000 0.219 235 A C 0.839 178.047 177.584 -0.627 0.000 1.158 235 A CA 2.504 53.654 52.037 -1.479 0.000 0.661 235 A CB -0.340 17.856 19.000 -1.340 0.000 0.801 235 A HN -0.276 7.146 8.150 -1.212 0.000 0.452 236 R N -5.398 114.829 120.500 -0.455 0.000 2.344 236 R HA 0.101 4.299 4.340 -0.236 0.000 0.209 236 R C -0.138 176.064 176.300 -0.163 0.000 0.886 236 R CA 0.158 56.094 56.100 -0.273 0.000 1.040 236 R CB 1.954 32.080 30.300 -0.291 0.000 1.114 236 R HN -0.697 7.134 8.270 -0.469 0.158 0.547 237 D N 1.560 121.867 120.400 -0.156 0.000 2.382 237 D HA 0.158 4.757 4.640 -0.069 0.000 0.245 237 D C -1.083 175.182 176.300 -0.058 0.000 1.120 237 D CA -1.435 52.514 54.000 -0.086 0.000 0.890 237 D CB 2.421 43.176 40.800 -0.075 0.000 1.201 237 D HN -0.604 7.645 8.370 -0.201 0.000 0.433 238 P HA -0.138 4.271 4.420 -0.018 0.000 0.219 238 P C 0.774 178.067 177.300 -0.011 0.000 1.146 238 P CA 1.846 64.934 63.100 -0.020 0.000 0.808 238 P CB 0.374 32.066 31.700 -0.014 0.000 0.779 239 Q N -4.885 114.907 119.800 -0.013 0.000 2.172 239 Q HA -0.138 4.200 4.340 -0.003 0.000 0.200 239 Q C 1.271 177.273 176.000 0.003 0.000 0.964 239 Q CA 2.483 58.283 55.803 -0.005 0.000 0.855 239 Q CB 0.641 29.375 28.738 -0.006 0.000 0.918 239 Q HN -0.047 8.530 8.270 -0.018 -0.318 0.444 240 T N -6.399 108.158 114.554 0.006 0.000 2.958 240 T HA 0.294 4.674 4.350 0.051 0.000 0.256 240 T C 0.563 175.315 174.700 0.086 0.000 0.983 240 T CA 0.522 62.650 62.100 0.047 0.000 0.924 240 T CB 2.366 71.269 68.868 0.058 0.000 1.136 240 T HN -0.515 7.690 8.240 -0.012 0.028 0.506 241 A N 2.845 125.679 122.820 0.024 0.000 1.902 241 A HA -0.229 4.200 4.320 0.018 -0.098 0.217 241 A C 1.041 178.694 177.584 0.115 0.000 1.181 241 A CA 3.707 55.765 52.037 0.035 0.000 0.623 241 A CB -0.621 18.363 19.000 -0.026 0.000 0.818 241 A HN 0.027 8.174 8.150 -0.005 0.000 0.443 242 c N -3.009 115.639 118.600 0.079 0.000 2.440 242 c HA -0.325 4.291 4.570 0.078 0.000 0.278 242 c C 2.128 176.272 174.090 0.090 0.000 1.295 242 c CA 4.268 60.643 56.329 0.076 0.000 1.738 242 c CB -1.807 40.731 42.510 0.047 0.000 1.987 242 c HN 0.442 8.705 8.230 0.056 0.000 0.492 243 E N 0.405 120.668 120.200 0.104 0.000 2.072 243 E HA -0.293 4.109 4.350 0.088 0.000 0.191 243 E C 1.409 178.072 176.600 0.104 0.000 0.985 243 E CA 2.777 59.238 56.400 0.102 0.000 0.801 243 E CB -0.349 29.395 29.700 0.074 0.000 0.750 243 E HN -0.425 7.994 8.360 0.098 0.000 0.452 244 W N -0.474 120.808 121.300 -0.031 0.000 2.333 244 W HA -0.422 4.203 4.660 -0.059 0.000 0.316 244 W C 2.343 178.814 176.519 -0.080 0.000 1.215 244 W CA 4.191 61.525 57.345 -0.019 0.000 1.278 244 W CB 0.189 29.697 29.460 0.079 0.000 1.154 244 W HN -0.144 8.264 8.180 0.380 0.000 0.486 245 Q N -0.927 119.021 119.800 0.246 0.000 2.167 245 Q HA -0.352 4.090 4.340 0.170 0.000 0.202 245 Q C 2.566 178.516 176.000 -0.084 0.000 0.970 245 Q CA 3.228 59.097 55.803 0.111 0.000 0.855 245 Q CB -0.041 28.777 28.738 0.134 0.000 0.911 245 Q HN -0.284 8.152 8.270 0.277 0.000 0.438 246 S N -1.314 114.340 115.700 -0.076 0.000 2.469 246 S HA -0.180 4.221 4.470 -0.115 0.000 0.238 246 S C 1.092 175.566 174.600 -0.209 0.000 0.998 246 S CA 2.815 60.946 58.200 -0.115 0.000 0.957 246 S CB -0.102 63.072 63.200 -0.043 0.000 0.764 246 S HN -0.356 7.833 8.310 -0.022 0.108 0.514 247 M N -0.429 118.953 119.600 -0.362 0.000 2.419 247 M HA -0.070 4.158 4.480 -0.420 0.000 0.264 247 M C 0.010 176.098 176.300 -0.352 0.000 1.082 247 M CA -0.642 54.338 55.300 -0.533 0.000 1.119 247 M CB 0.084 31.885 32.600 -1.332 0.000 1.398 247 M HN -0.788 7.226 8.290 -0.400 0.036 0.453 248 V N 0.441 120.195 119.914 -0.267 0.000 2.540 248 V HA -0.421 3.636 4.120 -0.104 0.000 0.297 248 V C -0.384 175.600 176.094 -0.184 0.000 1.024 248 V CA 1.379 63.569 62.300 -0.184 0.000 1.105 248 V CB -0.353 31.308 31.823 -0.270 0.000 0.938 248 V HN -0.592 7.298 8.190 -0.267 0.140 0.482 249 N N 4.909 123.533 118.700 -0.125 0.000 2.721 249 N HA -0.373 4.320 4.740 -0.078 0.000 0.249 249 N C -1.147 174.297 175.510 -0.110 0.000 1.072 249 N CA 1.585 54.573 53.050 -0.103 0.000 0.710 249 N CB -0.653 37.773 38.487 -0.100 0.000 0.993 249 N HN 0.051 8.373 8.380 -0.096 0.000 0.547 250 N N -1.502 117.122 118.700 -0.128 0.000 2.765 250 N HA 0.189 4.867 4.740 -0.103 0.000 0.277 250 N C -0.486 174.951 175.510 -0.121 0.000 1.750 250 N CA -0.852 52.123 53.050 -0.125 0.000 0.827 250 N CB 0.545 38.943 38.487 -0.149 0.000 1.200 250 N HN -0.519 7.759 8.380 -0.140 0.018 0.494 251 Q N 3.410 123.157 119.800 -0.089 0.000 2.096 251 Q HA -0.156 4.128 4.340 -0.093 0.000 0.204 251 Q C -0.669 175.300 176.000 -0.051 0.000 0.982 251 Q CA 5.065 60.825 55.803 -0.071 0.000 0.850 251 Q CB -1.338 27.374 28.738 -0.042 0.000 0.901 251 Q HN 0.572 8.796 8.270 -0.076 0.000 0.422 252 P HA -0.223 4.181 4.420 -0.026 0.000 0.217 252 P C 1.288 178.542 177.300 -0.076 0.000 1.150 252 P CA 2.596 65.668 63.100 -0.048 0.000 0.832 252 P CB -0.429 31.241 31.700 -0.050 0.000 0.787 253 K N -1.403 118.927 120.400 -0.117 0.000 2.025 253 K HA -0.246 3.953 4.320 -0.201 0.000 0.207 253 K C 2.261 178.745 176.600 -0.193 0.000 1.049 253 K CA 3.222 59.398 56.287 -0.185 0.000 0.933 253 K CB -0.099 32.278 32.500 -0.204 0.000 0.714 253 K HN -0.797 7.604 8.250 -0.116 -0.220 0.438 254 I N -0.599 119.884 120.570 -0.146 0.000 2.163 254 I HA -0.583 3.525 4.170 -0.104 0.000 0.243 254 I C 2.099 178.280 176.117 0.106 0.000 1.085 254 I CA 4.331 65.581 61.300 -0.084 0.000 1.347 254 I CB -0.135 37.762 38.000 -0.172 0.000 1.044 254 I HN -0.362 7.758 8.210 -0.149 0.000 0.408 255 Q N -1.883 117.989 119.800 0.120 0.000 1.993 255 Q HA -0.493 4.071 4.340 0.373 0.000 0.202 255 Q C 2.308 178.378 176.000 0.117 0.000 0.984 255 Q CA 3.632 59.557 55.803 0.204 0.000 0.837 255 Q CB -0.211 28.599 28.738 0.120 0.000 0.902 255 Q HN -0.057 8.244 8.270 0.052 0.000 0.423 256 N N -1.055 117.645 118.700 -0.001 0.000 2.084 256 N HA -0.307 4.418 4.740 -0.026 0.000 0.190 256 N C 2.304 177.755 175.510 -0.100 0.000 1.030 256 N CA 3.275 56.290 53.050 -0.057 0.000 0.849 256 N CB 0.249 38.670 38.487 -0.111 0.000 1.012 256 N HN -0.332 8.030 8.380 -0.031 0.000 0.423 257 R N -1.888 118.485 120.500 -0.212 0.000 2.090 257 R HA -0.176 3.924 4.340 -0.400 0.000 0.228 257 R C 2.362 178.678 176.300 0.027 0.000 1.110 257 R CA 1.602 57.490 56.100 -0.353 0.000 0.973 257 R CB -1.014 28.673 30.300 -1.021 0.000 0.869 257 R HN -0.178 7.951 8.270 -0.235 0.000 0.440 258 F N 1.492 121.448 119.950 0.011 0.000 2.113 258 F HA -0.305 4.312 4.527 0.150 0.000 0.297 258 F C 0.715 176.549 175.800 0.057 0.000 1.103 258 F CA 3.191 61.261 58.000 0.116 0.000 1.248 258 F CB -0.106 39.053 39.000 0.265 0.000 0.999 258 F HN -0.314 8.156 8.300 0.283 0.000 0.475 259 A N -1.452 121.402 122.820 0.057 0.000 1.877 259 A HA -0.437 3.797 4.320 -0.144 0.000 0.216 259 A C 1.753 179.298 177.584 -0.065 0.000 1.186 259 A CA 3.260 55.262 52.037 -0.059 0.000 0.620 259 A CB -1.091 17.911 19.000 0.004 0.000 0.822 259 A HN -0.239 8.005 8.150 0.157 0.000 0.443 260 A N -2.737 120.073 122.820 -0.017 0.000 1.898 260 A HA -0.239 4.097 4.320 0.025 0.000 0.216 260 A C 2.128 179.745 177.584 0.056 0.000 1.181 260 A CA 3.184 55.233 52.037 0.020 0.000 0.620 260 A CB -0.605 18.406 19.000 0.018 0.000 0.819 260 A HN -0.364 7.779 8.150 -0.012 0.000 0.442 261 T N 0.958 115.557 114.554 0.074 0.000 2.942 261 T HA -0.174 4.319 4.350 0.239 0.000 0.265 261 T C 1.648 176.364 174.700 0.026 0.000 1.062 261 T CA 4.149 66.341 62.100 0.154 0.000 1.139 261 T CB -0.314 68.718 68.868 0.273 0.000 0.883 261 T HN -0.320 7.955 8.240 0.057 0.000 0.468 262 M N 1.380 120.860 119.600 -0.200 0.000 2.159 262 M HA -0.211 4.140 4.480 -0.215 0.000 0.263 262 M C 1.966 178.231 176.300 -0.057 0.000 1.063 262 M CA 2.274 57.423 55.300 -0.253 0.000 1.110 262 M CB -1.348 30.910 32.600 -0.569 0.000 1.374 262 M HN 0.186 8.292 8.290 -0.307 0.000 0.411 263 S N 0.287 115.978 115.700 -0.015 0.000 2.368 263 S HA -0.361 4.156 4.470 0.079 0.000 0.225 263 S C 1.915 176.552 174.600 0.060 0.000 1.030 263 S CA 3.836 62.072 58.200 0.059 0.000 0.999 263 S CB -0.169 63.085 63.200 0.090 0.000 0.844 263 S HN -0.298 7.990 8.310 -0.036 0.000 0.459 264 K N 0.978 121.428 120.400 0.084 0.000 2.032 264 K HA -0.316 4.013 4.320 0.015 0.000 0.209 264 K C 3.034 179.715 176.600 0.135 0.000 1.048 264 K CA 2.872 59.213 56.287 0.090 0.000 0.927 264 K CB -0.132 32.465 32.500 0.162 0.000 0.712 264 K HN -0.787 7.520 8.250 0.095 0.000 0.441 265 M N 0.323 120.085 119.600 0.269 0.000 2.080 265 M HA -0.374 4.415 4.480 0.515 0.000 0.260 265 M C 1.636 178.026 176.300 0.150 0.000 1.068 265 M CA 2.718 58.211 55.300 0.320 0.000 1.109 265 M CB -0.094 32.637 32.600 0.218 0.000 1.342 265 M HN -0.300 8.143 8.290 0.256 0.000 0.405 266 A N -2.674 120.207 122.820 0.101 0.000 2.125 266 A HA -0.164 4.221 4.320 0.108 0.000 0.219 266 A C 0.865 178.467 177.584 0.030 0.000 1.156 266 A CA 2.421 54.511 52.037 0.088 0.000 0.671 266 A CB -0.497 18.572 19.000 0.114 0.000 0.794 266 A HN 0.168 8.373 8.150 0.092 0.000 0.459 267 L N -4.473 116.734 121.223 -0.027 0.000 2.728 267 L HA 0.187 4.464 4.340 -0.105 0.000 0.238 267 L C -1.124 175.633 176.870 -0.188 0.000 1.143 267 L CA -1.642 53.130 54.840 -0.113 0.000 0.937 267 L CB 0.021 41.980 42.059 -0.167 0.000 1.225 267 L HN -0.726 7.340 8.230 -0.011 0.157 0.507 268 L N -0.291 120.802 121.223 -0.215 0.000 2.540 268 L HA -0.324 3.641 4.340 -0.625 0.000 0.276 268 L C 1.037 177.589 176.870 -0.531 0.000 1.212 268 L CA 1.759 56.290 54.840 -0.514 0.000 0.893 268 L CB -0.297 41.461 42.059 -0.501 0.000 1.138 268 L HN -0.724 7.432 8.230 -0.124 0.000 0.491 269 G N 0.257 108.627 108.800 -0.716 0.000 2.184 269 G HA2 -0.325 3.574 3.960 -0.102 0.000 0.264 269 G HA3 -0.325 3.756 3.960 -0.144 -0.208 0.264 269 G C -0.624 174.214 174.900 -0.102 0.000 0.975 269 G CA 0.225 45.175 45.100 -0.251 0.000 0.642 269 G HN 0.611 8.330 8.290 -0.950 0.000 0.536 270 Q N -1.094 118.617 119.800 -0.148 0.000 2.496 270 Q HA 0.220 4.520 4.340 -0.067 0.000 0.286 270 Q C -1.696 174.229 176.000 -0.125 0.000 1.103 270 Q CA -1.507 54.233 55.803 -0.105 0.000 0.813 270 Q CB 2.647 31.321 28.738 -0.107 0.000 1.444 270 Q HN -0.316 7.778 8.270 -0.208 0.050 0.443 271 D N 0.752 121.081 120.400 -0.117 0.000 2.440 271 D HA 0.151 4.707 4.640 -0.140 0.000 0.252 271 D C 0.055 176.249 176.300 -0.176 0.000 1.180 271 D CA -1.194 52.729 54.000 -0.128 0.000 0.894 271 D CB 0.774 41.527 40.800 -0.079 0.000 1.111 271 D HN 0.065 8.374 8.370 -0.101 0.000 0.544 272 K N 6.492 126.725 120.400 -0.278 0.000 2.173 272 K HA -0.354 3.624 4.320 -0.570 0.000 0.207 272 K C 1.717 178.161 176.600 -0.261 0.000 1.046 272 K CA 2.961 58.976 56.287 -0.453 0.000 0.929 272 K CB 0.063 32.196 32.500 -0.611 0.000 0.720 272 K HN 0.656 8.739 8.250 -0.278 0.000 0.453 273 T N -4.795 109.665 114.554 -0.158 0.000 3.072 273 T HA -0.093 4.217 4.350 -0.066 0.000 0.266 273 T C 1.214 175.885 174.700 -0.049 0.000 1.127 273 T CA 2.331 64.382 62.100 -0.080 0.000 1.107 273 T CB -0.261 68.571 68.868 -0.059 0.000 0.910 273 T HN -0.286 8.088 8.240 -0.153 -0.225 0.513 274 K N -0.833 119.532 120.400 -0.059 0.000 2.374 274 K HA 0.183 4.490 4.320 -0.021 0.000 0.196 274 K C -0.624 175.963 176.600 -0.021 0.000 1.023 274 K CA -0.402 55.866 56.287 -0.033 0.000 1.103 274 K CB 0.665 33.145 32.500 -0.032 0.000 0.848 274 K HN -0.276 7.773 8.250 -0.083 0.151 0.528 275 L N -2.431 118.780 121.223 -0.020 0.000 2.298 275 L HA 0.410 4.831 4.340 0.009 -0.075 0.268 275 L C -0.212 176.716 176.870 0.096 0.000 1.010 275 L CA -1.677 53.177 54.840 0.023 0.000 0.812 275 L CB 3.025 45.091 42.059 0.011 0.000 1.331 275 L HN -0.686 7.353 8.230 -0.043 0.166 0.450 276 I N 0.206 120.830 120.570 0.090 0.000 2.404 276 I HA 0.166 4.387 4.170 0.084 0.000 0.293 276 I C -1.538 174.576 176.117 -0.005 0.000 0.992 276 I CA -1.300 60.036 61.300 0.060 0.000 1.149 276 I CB 3.004 41.005 38.000 0.001 0.000 1.315 276 I HN 0.171 8.410 8.210 0.048 0.000 0.446 277 D N 7.403 127.761 120.400 -0.069 0.000 2.358 277 D HA -0.082 3.937 4.640 -1.035 0.000 0.258 277 D C -0.922 175.195 176.300 -0.306 0.000 1.223 277 D CA 0.675 54.393 54.000 -0.471 0.000 0.886 277 D CB -0.348 40.251 40.800 -0.335 0.000 1.120 277 D HN 0.321 8.703 8.370 0.020 0.000 0.482 278 c N 4.593 122.995 118.600 -0.330 0.000 2.849 278 c HA 0.370 4.883 4.570 -0.094 0.000 0.271 278 c C 1.207 175.290 174.090 -0.012 0.000 1.519 278 c CA -2.075 54.199 56.329 -0.092 0.000 1.783 278 c CB -1.485 41.055 42.510 0.049 0.000 2.869 278 c HN 0.340 8.273 8.230 -0.495 0.000 0.527 279 S N 3.116 118.731 115.700 -0.141 0.000 2.400 279 S HA -0.312 4.165 4.470 0.010 0.000 0.232 279 S C 1.002 175.592 174.600 -0.016 0.000 1.025 279 S CA 4.498 62.657 58.200 -0.068 0.000 0.993 279 S CB 0.083 63.196 63.200 -0.146 0.000 0.808 279 S HN -0.258 8.160 8.310 -0.269 -0.269 0.478 280 D N -1.228 119.160 120.400 -0.021 0.000 2.363 280 D HA -0.159 4.487 4.640 0.011 0.000 0.226 280 D C 0.929 177.255 176.300 0.044 0.000 1.020 280 D CA 1.072 55.080 54.000 0.013 0.000 0.892 280 D CB -1.395 39.418 40.800 0.023 0.000 0.900 280 D HN 0.202 8.528 8.370 -0.039 0.021 0.531 281 V N -0.351 119.565 119.914 0.004 0.000 2.719 281 V HA -0.241 3.892 4.120 0.022 0.000 0.252 281 V C 0.220 176.323 176.094 0.016 0.000 1.065 281 V CA 1.478 63.752 62.300 -0.042 0.000 1.086 281 V CB 0.485 32.157 31.823 -0.252 0.000 0.700 281 V HN -0.733 7.403 8.190 -0.006 0.051 0.467 282 I N 0.422 120.984 120.570 -0.014 0.000 2.648 282 I HA -0.007 4.068 4.170 -0.158 0.000 0.284 282 I C -2.048 174.044 176.117 -0.041 0.000 1.153 282 I CA -3.680 57.569 61.300 -0.085 0.000 1.426 282 I CB -1.741 36.198 38.000 -0.101 0.000 1.381 282 I HN -0.890 7.321 8.210 0.000 0.000 0.571 283 P HA 0.028 4.453 4.420 0.007 0.000 0.270 283 P C -1.485 175.794 177.300 -0.035 0.000 1.223 283 P CA -0.179 62.906 63.100 -0.026 0.000 0.785 283 P CB 0.532 32.208 31.700 -0.041 0.000 0.923 284 T N 2.768 117.311 114.554 -0.018 0.000 2.799 284 T HA 0.024 4.361 4.350 -0.022 0.000 0.296 284 T C -1.445 173.237 174.700 -0.031 0.000 0.947 284 T CA -1.142 60.946 62.100 -0.020 0.000 1.141 284 T CB 0.049 68.912 68.868 -0.008 0.000 0.891 284 T HN -0.091 8.145 8.240 -0.006 0.000 0.533 285 P HA 0.245 4.864 4.420 -0.055 -0.232 0.272 285 P C -2.227 175.059 177.300 -0.023 0.000 1.230 285 P CA -1.695 61.379 63.100 -0.043 0.000 0.788 285 P CB -0.042 31.626 31.700 -0.052 0.000 0.949 286 P HA 0.027 4.442 4.420 -0.008 0.000 0.274 286 P C -0.789 176.514 177.300 0.004 0.000 1.237 286 P CA -0.711 62.384 63.100 -0.008 0.000 0.793 286 P CB 0.531 32.225 31.700 -0.009 0.000 0.977 287 A N 0.270 123.093 122.820 0.007 0.000 2.406 287 A HA -0.156 4.175 4.320 0.018 0.000 0.243 287 A C 0.302 177.898 177.584 0.020 0.000 1.082 287 A CA -0.286 51.759 52.037 0.014 0.000 0.786 287 A CB 0.503 19.508 19.000 0.008 0.000 1.029 287 A HN -0.069 8.083 8.150 0.003 0.000 0.495 288 L N 0.566 121.805 121.223 0.027 0.000 2.559 288 L HA -0.131 4.290 4.340 0.038 -0.058 0.282 288 L C -0.717 176.164 176.870 0.020 0.000 1.232 288 L CA 0.899 55.756 54.840 0.029 0.000 0.885 288 L CB 0.863 42.936 42.059 0.024 0.000 1.131 288 L HN -0.165 8.082 8.230 0.027 0.000 0.498 289 V N 1.261 121.188 119.914 0.022 0.000 2.459 289 V HA 0.349 4.477 4.120 0.012 0.000 0.295 289 V C 0.135 176.243 176.094 0.023 0.000 1.029 289 V CA -1.275 61.035 62.300 0.017 0.000 0.874 289 V CB 0.504 32.335 31.823 0.014 0.000 0.985 289 V HN 0.094 8.300 8.190 0.027 0.000 0.438 290 G N 2.890 111.700 108.800 0.017 0.000 2.757 290 G HA2 -0.152 3.810 3.960 0.004 0.000 0.638 290 G HA3 -0.152 3.833 3.960 0.041 0.000 0.638 290 G C -1.658 173.267 174.900 0.043 0.000 1.344 290 G CA -0.551 44.564 45.100 0.025 0.000 0.855 290 G HN 0.002 8.298 8.290 0.009 0.000 0.537 291 A N -0.351 122.516 122.820 0.077 0.000 2.566 291 A HA 0.139 4.493 4.320 0.056 0.000 0.292 291 A C -1.968 175.722 177.584 0.177 0.000 1.112 291 A CA -0.941 51.146 52.037 0.083 0.000 0.707 291 A CB 2.605 21.633 19.000 0.047 0.000 1.302 291 A HN -0.072 8.131 8.150 0.088 0.000 0.409 292 A N 1.750 124.626 122.820 0.093 0.000 2.567 292 A HA 0.353 4.892 4.320 0.007 -0.215 0.240 292 A C -0.549 177.112 177.584 0.129 0.000 1.053 292 A CA 0.451 52.521 52.037 0.055 0.000 0.755 292 A CB 0.257 19.253 19.000 -0.007 0.000 0.978 292 A HN 0.584 8.763 8.150 0.048 0.000 0.507 293 H N -0.214 118.863 119.070 0.012 0.000 3.042 293 H HA 0.443 5.122 4.556 0.031 -0.104 0.346 293 H C -1.926 173.411 175.328 0.015 0.000 1.294 293 H CA -1.659 54.400 56.048 0.019 0.000 1.141 293 H CB 1.436 31.202 29.762 0.007 0.000 1.872 293 H HN -0.249 8.059 8.280 -0.332 -0.227 0.541 294 L N 0.531 121.799 121.223 0.075 0.000 2.436 294 L HA 0.361 4.637 4.340 -0.108 0.000 0.265 294 L C -1.262 175.642 176.870 0.058 0.000 1.168 294 L CA -2.124 52.716 54.840 0.001 0.000 0.815 294 L CB -0.214 41.896 42.059 0.086 0.000 1.109 294 L HN 0.225 8.542 8.230 0.144 0.000 0.462 295 P HA -0.066 4.385 4.420 0.053 0.000 0.270 295 P C -0.776 176.601 177.300 0.129 0.000 1.223 295 P CA -0.363 62.678 63.100 -0.099 0.000 0.785 295 P CB 0.410 31.769 31.700 -0.568 0.000 0.923 296 A N 1.681 124.596 122.820 0.159 0.000 2.546 296 A HA -0.418 4.191 4.320 0.149 -0.200 0.243 296 A C 1.374 179.123 177.584 0.275 0.000 1.063 296 A CA 0.983 53.124 52.037 0.173 0.000 0.757 296 A CB -0.028 19.038 19.000 0.110 0.000 0.991 296 A HN 0.348 8.573 8.150 0.125 0.000 0.503 297 G N 3.354 112.277 108.800 0.204 0.000 2.199 297 G HA2 -0.404 3.603 3.960 0.078 0.000 0.254 297 G HA3 -0.404 3.624 3.960 0.112 0.000 0.254 297 G C -0.876 174.091 174.900 0.112 0.000 0.982 297 G CA -0.158 45.023 45.100 0.135 0.000 0.632 297 G HN 0.682 9.068 8.290 0.159 0.000 0.529 298 F N 0.264 120.223 119.950 0.015 0.000 2.380 298 F HA 0.395 5.045 4.527 -0.007 -0.126 0.321 298 F C -1.152 174.651 175.800 0.005 0.000 1.103 298 F CA -1.008 56.993 58.000 0.002 0.000 1.067 298 F CB 2.415 41.414 39.000 -0.002 0.000 1.265 298 F HN -0.626 7.918 8.300 0.517 0.066 0.517 299 S N -1.183 114.613 115.700 0.160 0.000 2.720 299 S HA 0.267 4.804 4.470 0.111 0.000 0.287 299 S C 0.402 175.045 174.600 0.071 0.000 1.168 299 S CA -1.790 56.468 58.200 0.096 0.000 0.832 299 S CB 2.943 66.168 63.200 0.041 0.000 1.166 299 S HN -0.014 8.668 8.310 0.129 -0.295 0.493 300 L N 1.166 122.419 121.223 0.050 0.000 2.127 300 L HA -0.201 4.139 4.340 0.001 0.000 0.211 300 L C 1.618 178.471 176.870 -0.028 0.000 1.089 300 L CA 2.802 57.653 54.840 0.018 0.000 0.757 300 L CB 0.095 42.187 42.059 0.056 0.000 0.899 300 L HN 0.516 8.780 8.230 0.057 0.000 0.434 301 S N -2.315 113.376 115.700 -0.015 0.000 2.469 301 S HA -0.279 4.170 4.470 -0.036 0.000 0.238 301 S C 1.421 175.992 174.600 -0.048 0.000 0.998 301 S CA 2.345 60.525 58.200 -0.033 0.000 0.957 301 S CB -0.901 62.282 63.200 -0.029 0.000 0.764 301 S HN -0.363 7.929 8.310 -0.002 0.016 0.514 302 D N 1.476 121.858 120.400 -0.030 0.000 2.355 302 D HA 0.085 4.704 4.640 -0.034 0.000 0.218 302 D C -0.603 175.669 176.300 -0.048 0.000 1.004 302 D CA 1.687 55.683 54.000 -0.008 0.000 0.880 302 D CB 0.280 41.150 40.800 0.115 0.000 0.911 302 D HN -0.254 7.969 8.370 -0.007 0.143 0.528 303 V N 0.177 120.001 119.914 -0.149 0.000 2.488 303 V HA -0.188 3.753 4.120 -0.299 0.000 0.277 303 V C -0.693 175.260 176.094 -0.234 0.000 1.046 303 V CA 0.401 62.513 62.300 -0.313 0.000 0.986 303 V CB 0.355 31.765 31.823 -0.688 0.000 0.989 303 V HN -0.562 7.385 8.190 -0.143 0.157 0.475 304 E N 8.869 128.943 120.200 -0.210 0.000 1.861 304 E HA 0.003 4.281 4.350 -0.120 0.000 0.263 304 E C -1.056 175.460 176.600 -0.140 0.000 1.137 304 E CA -0.776 55.534 56.400 -0.151 0.000 0.944 304 E CB -0.988 28.626 29.700 -0.144 0.000 1.092 304 E HN 0.086 8.315 8.360 -0.219 0.000 0.420 305 Q N 2.431 122.168 119.800 -0.104 0.000 2.311 305 Q HA -0.216 4.119 4.340 -0.009 0.000 0.272 305 Q C -0.010 175.981 176.000 -0.015 0.000 1.012 305 Q CA 1.050 56.835 55.803 -0.029 0.000 0.891 305 Q CB 0.328 29.078 28.738 0.019 0.000 1.201 305 Q HN -0.142 8.069 8.270 -0.098 0.000 0.391 306 A N 2.270 125.097 122.820 0.011 0.000 2.600 306 A HA 0.187 4.493 4.320 -0.025 0.000 0.252 306 A C -1.698 175.893 177.584 0.012 0.000 1.200 306 A CA -0.730 51.299 52.037 -0.014 0.000 0.981 306 A CB 1.376 20.337 19.000 -0.065 0.000 1.207 306 A HN 0.622 8.804 8.150 0.053 0.000 0.577 307 c N 0.775 119.402 118.600 0.046 0.000 2.225 307 c HA 0.316 4.905 4.570 0.032 0.000 0.323 307 c C 0.915 175.026 174.090 0.035 0.000 1.164 307 c CA -1.690 54.666 56.329 0.044 0.000 1.565 307 c CB -1.694 40.854 42.510 0.064 0.000 2.124 307 c HN 0.085 8.355 8.230 0.067 0.000 0.461 308 A N 7.827 130.660 122.820 0.022 0.000 1.972 308 A HA -0.196 4.135 4.320 0.018 0.000 0.219 308 A C 0.691 178.287 177.584 0.019 0.000 1.169 308 A CA 2.643 54.690 52.037 0.018 0.000 0.635 308 A CB -0.242 18.764 19.000 0.010 0.000 0.810 308 A HN 0.866 9.026 8.150 0.017 0.000 0.446 309 A N -2.625 120.207 122.820 0.020 0.000 2.014 309 A HA -0.067 4.262 4.320 0.014 0.000 0.218 309 A C 0.104 177.699 177.584 0.018 0.000 1.163 309 A CA 1.101 53.148 52.037 0.017 0.000 0.652 309 A CB 0.692 19.701 19.000 0.016 0.000 0.808 309 A HN 0.418 8.555 8.150 0.021 0.026 0.449 310 T N 0.127 114.696 114.554 0.024 0.000 3.031 310 T HA 0.231 4.590 4.350 0.016 0.000 0.305 310 T C -3.064 171.660 174.700 0.039 0.000 0.985 310 T CA -2.461 59.651 62.100 0.021 0.000 1.008 310 T CB 1.808 70.681 68.868 0.009 0.000 1.005 310 T HN -0.755 7.471 8.240 0.030 0.032 0.444 311 P HA -0.024 4.452 4.420 0.093 0.000 0.269 311 P C -1.083 176.279 177.300 0.103 0.000 1.209 311 P CA -0.594 62.553 63.100 0.078 0.000 0.776 311 P CB 0.681 32.418 31.700 0.062 0.000 0.876 312 F N 3.870 123.824 119.950 0.006 0.000 2.572 312 F HA -0.115 4.499 4.527 0.011 -0.081 0.370 312 F C -1.477 174.327 175.800 0.007 0.000 1.103 312 F CA -0.826 57.179 58.000 0.009 0.000 1.286 312 F CB 1.030 40.036 39.000 0.011 0.000 1.105 312 F HN -0.225 8.574 8.300 0.305 -0.317 0.583 313 P HA 0.012 4.379 4.420 -0.088 0.000 0.272 313 P C -1.802 175.505 177.300 0.012 0.000 1.223 313 P CA -0.815 62.175 63.100 -0.183 0.000 0.784 313 P CB 0.686 32.208 31.700 -0.297 0.000 0.923 314 A N 1.888 124.731 122.820 0.037 0.000 2.666 314 A HA 0.007 4.405 4.320 0.130 0.000 0.301 314 A C -0.313 177.314 177.584 0.071 0.000 1.470 314 A CA -0.203 51.882 52.037 0.081 0.000 1.159 314 A CB -0.808 18.224 19.000 0.053 0.000 1.116 314 A HN 0.145 8.301 8.150 0.009 0.000 0.548 315 L N 4.434 125.730 121.223 0.121 0.000 2.379 315 L HA 0.264 4.649 4.340 0.075 0.000 0.269 315 L C 0.262 177.197 176.870 0.108 0.000 1.084 315 L CA -0.844 54.061 54.840 0.109 0.000 0.802 315 L CB 1.185 43.336 42.059 0.152 0.000 1.175 315 L HN -0.352 7.987 8.230 0.182 0.000 0.448 316 T N -3.317 111.295 114.554 0.097 0.000 2.934 316 T HA 0.149 4.551 4.350 0.087 0.000 0.283 316 T C -1.133 173.642 174.700 0.124 0.000 1.005 316 T CA -1.737 60.419 62.100 0.093 0.000 1.041 316 T CB 2.038 70.946 68.868 0.066 0.000 1.042 316 T HN -0.190 8.105 8.240 0.092 0.000 0.505 317 A N 1.897 124.785 122.820 0.114 0.000 2.293 317 A HA 0.187 4.810 4.320 0.172 -0.199 0.302 317 A C 0.044 177.685 177.584 0.096 0.000 1.119 317 A CA -1.192 50.927 52.037 0.136 0.000 0.823 317 A CB 1.339 20.422 19.000 0.139 0.000 1.097 317 A HN 0.254 8.461 8.150 0.096 0.000 0.491 318 D N 2.090 122.549 120.400 0.097 0.000 2.548 318 D HA -0.020 4.568 4.640 -0.086 0.000 0.231 318 D C -0.386 175.928 176.300 0.023 0.000 1.142 318 D CA 0.444 54.441 54.000 -0.005 0.000 0.866 318 D CB 0.330 41.132 40.800 0.004 0.000 1.190 318 D HN -0.272 8.207 8.370 0.181 0.000 0.469 319 P HA 0.000 4.432 4.420 0.019 0.000 0.216 319 P CA 0.000 63.106 63.100 0.011 0.000 0.800 319 P CB 0.000 31.698 31.700 -0.004 0.000 0.726