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 2ng1_1_A DATA FIRST_RESID 2 DATA SEQUENCE FQQLSARLQE AIGRLRGRGR ITEEDLKATL REIRRALMDA DVNLEVTRDF DATA SEQUENCE VERVREEALG KQVLESLTPA EVILATVYEA LKEALGGEAR LPVLKDRNLW DATA SEQUENCE FLVGLQGSGK TTTAAKLALY YKGKGRRPLL VAADTQRPAA REQLRLLGEK DATA SEQUENCE VGVPVLEVMD GESPESIRRR VEEKARLEAR DLILVDTAGR LQIDEPLMGE DATA SEQUENCE LARLKEVLGP DEVLLVLDAM TGQEALSVAR AFDEKVGVTG LVLTKLDGDA DATA SEQUENCE RGGAALSARH VTGKPIYFAG VSEKPEGLEP FYPERLAGRI LGM 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 2 F HA 0.000 4.527 4.527 -0.000 0.000 0.279 2 F C 0.000 175.808 175.800 0.013 0.000 0.967 2 F CA 0.000 58.011 58.000 0.018 0.000 1.383 2 F CB 0.000 39.015 39.000 0.025 0.000 1.145 3 Q N 1.599 121.475 119.800 0.128 0.000 2.124 3 Q HA -0.326 3.991 4.340 -0.039 0.000 0.215 3 Q C 2.140 178.183 176.000 0.072 0.000 1.015 3 Q CA 2.994 58.848 55.803 0.085 0.000 0.890 3 Q CB -0.217 28.546 28.738 0.041 0.000 0.966 3 Q HN 0.652 8.922 8.270 -0.000 0.000 0.412 4 Q N -1.015 118.820 119.800 0.058 0.000 1.993 4 Q HA -0.191 4.126 4.340 -0.039 0.000 0.202 4 Q C 2.089 178.119 176.000 0.051 0.000 0.984 4 Q CA 1.667 57.495 55.803 0.042 0.000 0.837 4 Q CB -0.331 28.423 28.738 0.027 0.000 0.902 4 Q HN 0.501 8.771 8.270 -0.000 0.000 0.423 5 L N 0.798 122.066 121.223 0.075 0.000 1.990 5 L HA -0.230 4.087 4.340 -0.039 0.000 0.213 5 L C 2.312 179.211 176.870 0.048 0.000 1.072 5 L CA 2.440 57.316 54.840 0.060 0.000 0.755 5 L CB -0.966 41.152 42.059 0.098 0.000 0.889 5 L HN 0.210 8.440 8.230 -0.000 0.000 0.432 6 S N 0.082 115.826 115.700 0.074 0.000 2.353 6 S HA -0.222 4.224 4.470 -0.039 0.000 0.222 6 S C 2.117 176.743 174.600 0.043 0.000 1.035 6 S CA 1.239 59.473 58.200 0.056 0.000 1.025 6 S CB -1.162 62.082 63.200 0.073 0.000 0.902 6 S HN 0.656 8.966 8.310 -0.000 0.000 0.440 7 A N 2.223 125.069 122.820 0.043 0.000 1.859 7 A HA -0.206 4.091 4.320 -0.039 0.000 0.218 7 A C 2.250 179.848 177.584 0.025 0.000 1.209 7 A CA 1.985 54.041 52.037 0.032 0.000 0.639 7 A CB -0.766 18.252 19.000 0.029 0.000 0.835 7 A HN 0.423 8.573 8.150 -0.000 0.000 0.450 8 R N -0.944 119.569 120.500 0.022 0.000 2.120 8 R HA 0.018 4.335 4.340 -0.039 0.000 0.234 8 R C 2.133 178.443 176.300 0.016 0.000 1.123 8 R CA 1.105 57.214 56.100 0.015 0.000 0.975 8 R CB -0.324 29.981 30.300 0.009 0.000 0.866 8 R HN 0.567 8.837 8.270 -0.000 0.000 0.446 9 L N 0.289 121.523 121.223 0.019 0.000 2.056 9 L HA -0.191 4.126 4.340 -0.039 0.000 0.207 9 L C 2.157 179.047 176.870 0.033 0.000 1.078 9 L CA 1.442 56.296 54.840 0.025 0.000 0.749 9 L CB -0.331 41.743 42.059 0.025 0.000 0.901 9 L HN 0.319 8.549 8.230 -0.000 0.000 0.433 10 Q N -0.622 119.197 119.800 0.031 0.000 2.291 10 Q HA -0.228 4.089 4.340 -0.039 0.000 0.205 10 Q C 1.772 177.786 176.000 0.023 0.000 0.970 10 Q CA 1.007 56.827 55.803 0.029 0.000 0.876 10 Q CB 0.106 28.860 28.738 0.026 0.000 0.935 10 Q HN 0.438 8.708 8.270 -0.000 0.000 0.455 11 E N 1.125 121.338 120.200 0.021 0.000 2.008 11 E HA -0.106 4.221 4.350 -0.039 0.000 0.191 11 E C 1.936 178.547 176.600 0.018 0.000 0.986 11 E CA 1.148 57.558 56.400 0.017 0.000 0.807 11 E CB -0.190 29.519 29.700 0.015 0.000 0.766 11 E HN 0.287 8.647 8.360 -0.000 0.000 0.450 12 A N 1.058 123.890 122.820 0.020 0.000 1.997 12 A HA -0.209 4.088 4.320 -0.039 0.000 0.221 12 A C 2.123 179.722 177.584 0.025 0.000 1.172 12 A CA 1.646 53.697 52.037 0.022 0.000 0.645 12 A CB -0.739 18.276 19.000 0.026 0.000 0.813 12 A HN 0.372 8.522 8.150 -0.000 0.000 0.454 13 I N -0.547 120.040 120.570 0.028 0.000 2.277 13 I HA -0.119 4.028 4.170 -0.039 0.000 0.243 13 I C 2.744 178.873 176.117 0.019 0.000 1.094 13 I CA 1.431 62.747 61.300 0.028 0.000 1.393 13 I CB -2.004 36.015 38.000 0.032 0.000 1.078 13 I HN 0.353 8.563 8.210 -0.000 0.000 0.417 14 G N 0.939 109.749 108.800 0.017 0.000 2.485 14 G HA2 -0.263 3.674 3.960 -0.039 0.000 0.221 14 G HA3 -0.263 3.674 3.960 -0.039 0.000 0.221 14 G C 1.594 176.501 174.900 0.011 0.000 1.115 14 G CA 0.207 45.314 45.100 0.012 0.000 0.751 14 G HN 0.318 8.608 8.290 -0.000 0.000 0.567 15 R N -0.332 120.175 120.500 0.013 0.000 3.385 15 R HA 0.365 4.682 4.340 -0.039 0.000 0.236 15 R C 0.552 176.859 176.300 0.011 0.000 1.663 15 R CA 0.024 56.131 56.100 0.011 0.000 1.444 15 R CB -0.167 30.140 30.300 0.012 0.000 1.218 15 R HN 0.360 8.630 8.270 -0.000 0.000 0.575 16 L N -1.534 119.695 121.223 0.010 0.000 3.857 16 L HA 0.163 4.479 4.340 -0.039 0.000 0.369 16 L C 0.213 177.087 176.870 0.007 0.000 1.105 16 L CA -0.283 54.562 54.840 0.009 0.000 1.360 16 L CB 0.270 42.336 42.059 0.012 0.000 1.813 16 L HN 0.018 8.248 8.230 -0.000 0.000 0.630 17 R N 1.028 121.532 120.500 0.006 0.000 2.734 17 R HA 0.286 4.603 4.340 -0.039 0.000 0.266 17 R C 1.119 177.421 176.300 0.003 0.000 1.044 17 R CA 0.701 56.803 56.100 0.004 0.000 1.128 17 R CB -0.161 30.141 30.300 0.003 0.000 1.010 17 R HN 0.233 8.503 8.270 -0.000 0.000 0.461 18 G N 1.274 110.075 108.800 0.001 0.000 2.269 18 G HA2 -0.374 3.563 3.960 -0.039 0.000 0.277 18 G HA3 -0.374 3.563 3.960 -0.039 0.000 0.277 18 G C 0.856 175.757 174.900 0.002 0.000 1.008 18 G CA 1.222 46.322 45.100 0.001 0.000 0.774 18 G HN 0.710 9.000 8.290 -0.000 0.000 0.511 19 R N -0.142 120.359 120.500 0.002 0.000 2.265 19 R HA 0.459 4.776 4.340 -0.039 0.000 0.194 19 R C 1.723 178.024 176.300 0.002 0.000 0.931 19 R CA 1.384 57.485 56.100 0.003 0.000 1.032 19 R CB -0.058 30.244 30.300 0.004 0.000 0.980 19 R HN 1.647 9.917 8.270 -0.000 0.000 0.497 20 G N 1.068 109.869 108.800 0.002 0.000 2.584 20 G HA2 -0.309 3.627 3.960 -0.039 0.000 0.229 20 G HA3 -0.309 3.627 3.960 -0.039 0.000 0.229 20 G C -1.145 173.756 174.900 0.002 0.000 1.320 20 G CA -0.240 44.861 45.100 0.001 0.000 0.891 20 G HN 0.357 8.647 8.290 -0.000 0.000 0.573 21 R N 0.520 121.021 120.500 0.001 0.000 2.343 21 R HA 0.379 4.696 4.340 -0.039 0.000 0.326 21 R C 1.012 177.313 176.300 0.002 0.000 1.055 21 R CA 0.422 56.523 56.100 0.002 0.000 0.961 21 R CB -0.243 30.058 30.300 0.001 0.000 0.978 21 R HN 0.650 8.920 8.270 -0.000 0.000 0.443 22 I N -0.625 119.947 120.570 0.003 0.000 2.713 22 I HA 0.354 4.501 4.170 -0.039 0.000 0.300 22 I C 0.799 176.918 176.117 0.004 0.000 1.009 22 I CA -0.589 60.714 61.300 0.004 0.000 1.305 22 I CB 1.375 39.378 38.000 0.006 0.000 1.430 22 I HN 0.444 8.654 8.210 -0.000 0.000 0.546 23 T N 0.462 115.019 114.554 0.004 0.000 2.814 23 T HA 0.299 4.626 4.350 -0.039 0.000 0.284 23 T C 0.725 175.428 174.700 0.005 0.000 0.998 23 T CA -0.039 62.063 62.100 0.004 0.000 0.935 23 T CB 0.668 69.538 68.868 0.004 0.000 1.167 23 T HN 0.820 9.060 8.240 -0.000 0.000 0.545 24 E N -0.577 119.626 120.200 0.004 0.000 2.512 24 E HA 0.037 4.364 4.350 -0.039 0.000 0.195 24 E C 1.112 177.715 176.600 0.006 0.000 1.083 24 E CA 0.348 56.751 56.400 0.005 0.000 0.873 24 E CB -0.002 29.700 29.700 0.004 0.000 0.897 24 E HN 0.586 8.946 8.360 -0.000 0.000 0.514 25 E N 0.676 120.880 120.200 0.006 0.000 2.447 25 E HA -0.001 4.326 4.350 -0.039 0.000 0.204 25 E C 1.021 177.626 176.600 0.007 0.000 0.977 25 E CA 0.336 56.739 56.400 0.006 0.000 0.950 25 E CB 0.383 30.087 29.700 0.005 0.000 0.975 25 E HN 0.240 8.600 8.360 -0.000 0.000 0.496 26 D N -0.085 120.320 120.400 0.007 0.000 2.213 26 D HA -0.085 4.532 4.640 -0.039 0.000 0.205 26 D C 1.806 178.113 176.300 0.011 0.000 0.961 26 D CA 0.340 54.346 54.000 0.009 0.000 0.853 26 D CB 0.276 41.081 40.800 0.008 0.000 0.967 26 D HN 0.149 8.519 8.370 -0.000 0.000 0.496 27 L N 2.054 123.283 121.223 0.011 0.000 1.948 27 L HA -0.133 4.184 4.340 -0.039 0.000 0.212 27 L C 2.073 178.952 176.870 0.015 0.000 1.074 27 L CA 1.854 56.702 54.840 0.013 0.000 0.753 27 L CB -0.583 41.482 42.059 0.011 0.000 0.888 27 L HN -0.241 7.989 8.230 -0.000 0.000 0.432 28 K N -0.504 119.904 120.400 0.013 0.000 2.144 28 K HA -0.280 4.017 4.320 -0.039 0.000 0.209 28 K C 1.975 178.583 176.600 0.014 0.000 1.047 28 K CA 1.660 57.955 56.287 0.013 0.000 0.927 28 K CB -0.484 32.022 32.500 0.010 0.000 0.716 28 K HN 0.594 8.844 8.250 -0.000 0.000 0.454 29 A N 0.673 123.501 122.820 0.013 0.000 1.858 29 A HA -0.158 4.139 4.320 -0.039 0.000 0.216 29 A C 2.276 179.869 177.584 0.016 0.000 1.190 29 A CA 2.145 54.189 52.037 0.013 0.000 0.617 29 A CB -0.981 18.025 19.000 0.011 0.000 0.827 29 A HN 0.278 8.428 8.150 -0.000 0.000 0.443 30 T N 0.505 115.071 114.554 0.019 0.000 2.746 30 T HA -0.084 4.243 4.350 -0.039 0.000 0.267 30 T C 1.830 176.550 174.700 0.032 0.000 1.039 30 T CA 1.410 63.525 62.100 0.024 0.000 1.142 30 T CB -0.404 68.479 68.868 0.026 0.000 0.866 30 T HN 0.327 8.567 8.240 -0.000 0.000 0.444 31 L N 1.106 122.350 121.223 0.034 0.000 2.012 31 L HA -0.170 4.147 4.340 -0.039 0.000 0.210 31 L C 2.926 179.819 176.870 0.040 0.000 1.073 31 L CA 1.727 56.595 54.840 0.046 0.000 0.748 31 L CB -0.525 41.558 42.059 0.041 0.000 0.891 31 L HN 0.328 8.558 8.230 -0.000 0.000 0.431 32 R N 0.383 120.898 120.500 0.026 0.000 2.096 32 R HA -0.240 4.077 4.340 -0.039 0.000 0.235 32 R C 1.976 178.283 176.300 0.012 0.000 1.127 32 R CA 1.910 58.021 56.100 0.017 0.000 0.968 32 R CB -0.602 29.705 30.300 0.013 0.000 0.861 32 R HN 0.417 8.687 8.270 -0.000 0.000 0.440 33 E N 0.919 121.128 120.200 0.015 0.000 2.085 33 E HA -0.186 4.141 4.350 -0.039 0.000 0.194 33 E C 2.007 178.610 176.600 0.005 0.000 0.994 33 E CA 1.599 58.005 56.400 0.010 0.000 0.801 33 E CB -0.079 29.629 29.700 0.014 0.000 0.743 33 E HN 0.509 8.869 8.360 -0.000 0.000 0.453 34 I N 0.766 121.346 120.570 0.018 0.000 2.315 34 I HA -0.257 3.890 4.170 -0.039 0.000 0.248 34 I C 2.782 178.877 176.117 -0.037 0.000 1.117 34 I CA 1.150 62.454 61.300 0.008 0.000 1.404 34 I CB -0.273 37.774 38.000 0.078 0.000 1.071 34 I HN 0.132 8.342 8.210 -0.000 0.000 0.419 35 R N 1.309 121.803 120.500 -0.010 0.000 2.075 35 R HA -0.134 4.183 4.340 -0.039 0.000 0.232 35 R C 2.331 178.606 176.300 -0.042 0.000 1.126 35 R CA 1.352 57.436 56.100 -0.027 0.000 0.963 35 R CB -0.254 30.047 30.300 0.002 0.000 0.858 35 R HN 0.221 8.491 8.270 -0.000 0.000 0.435 36 R N 0.111 120.596 120.500 -0.025 0.000 2.115 36 R HA -0.016 4.300 4.340 -0.039 0.000 0.230 36 R C 2.369 178.649 176.300 -0.034 0.000 1.111 36 R CA 1.212 57.298 56.100 -0.023 0.000 0.976 36 R CB -0.241 30.052 30.300 -0.012 0.000 0.870 36 R HN 0.360 8.630 8.270 -0.000 0.000 0.445 37 A N 1.203 123.998 122.820 -0.043 0.000 1.902 37 A HA -0.121 4.176 4.320 -0.039 0.000 0.217 37 A C 2.132 179.671 177.584 -0.075 0.000 1.181 37 A CA 1.083 53.091 52.037 -0.048 0.000 0.623 37 A CB -0.480 18.491 19.000 -0.049 0.000 0.818 37 A HN 0.171 8.321 8.150 -0.000 0.000 0.443 38 L N -1.215 119.931 121.223 -0.128 0.000 2.083 38 L HA -0.204 4.113 4.340 -0.039 0.000 0.209 38 L C 2.853 179.668 176.870 -0.092 0.000 1.083 38 L CA 1.450 56.190 54.840 -0.167 0.000 0.752 38 L CB -0.552 41.345 42.059 -0.270 0.000 0.899 38 L HN 0.415 8.645 8.230 -0.000 0.000 0.433 39 M N -0.499 119.061 119.600 -0.066 0.000 2.099 39 M HA -0.159 4.298 4.480 -0.039 0.000 0.262 39 M C 1.269 177.554 176.300 -0.026 0.000 1.067 39 M CA 1.434 56.711 55.300 -0.039 0.000 1.124 39 M CB -0.417 32.165 32.600 -0.029 0.000 1.353 39 M HN 0.137 8.427 8.290 -0.000 0.000 0.410 40 D N 0.493 120.879 120.400 -0.023 0.000 2.371 40 D HA 0.030 4.647 4.640 -0.039 0.000 0.234 40 D C 1.145 177.441 176.300 -0.008 0.000 1.049 40 D CA 0.502 54.494 54.000 -0.013 0.000 0.907 40 D CB 0.044 40.838 40.800 -0.010 0.000 0.891 40 D HN 0.318 8.688 8.370 -0.000 0.000 0.531 41 A N 0.111 122.925 122.820 -0.010 0.000 2.431 41 A HA 0.143 4.440 4.320 -0.039 0.000 0.239 41 A C 0.508 178.097 177.584 0.009 0.000 1.230 41 A CA 0.006 52.049 52.037 0.009 0.000 0.928 41 A CB 0.404 19.417 19.000 0.022 0.000 1.006 41 A HN -0.002 8.148 8.150 -0.000 0.000 0.520 42 D N -0.914 119.484 120.400 -0.004 0.000 2.775 42 D HA -0.123 4.494 4.640 -0.039 0.000 0.235 42 D C -0.464 175.838 176.300 0.003 0.000 1.120 42 D CA 0.741 54.740 54.000 -0.001 0.000 0.708 42 D CB -1.812 38.989 40.800 0.002 0.000 1.084 42 D HN 0.194 8.564 8.370 -0.000 0.000 0.434 43 V N 1.269 121.176 119.914 -0.012 0.000 2.649 43 V HA 0.172 4.269 4.120 -0.039 0.000 0.292 43 V C 1.262 177.347 176.094 -0.015 0.000 1.055 43 V CA -0.686 61.603 62.300 -0.017 0.000 1.023 43 V CB 1.542 33.325 31.823 -0.067 0.000 0.992 43 V HN 0.421 8.611 8.190 -0.000 0.000 0.480 44 N N 3.251 121.952 118.700 0.002 0.000 2.292 44 N HA -0.039 4.677 4.740 -0.039 0.000 0.258 44 N C 0.974 176.469 175.510 -0.025 0.000 1.261 44 N CA 0.221 53.278 53.050 0.013 0.000 0.845 44 N CB 0.652 39.177 38.487 0.063 0.000 1.064 44 N HN 0.673 9.053 8.380 -0.000 0.000 0.471 45 L N 3.039 124.255 121.223 -0.011 0.000 2.265 45 L HA -0.135 4.182 4.340 -0.039 0.000 0.215 45 L C 1.965 178.812 176.870 -0.038 0.000 1.117 45 L CA 1.194 56.022 54.840 -0.020 0.000 0.782 45 L CB -0.133 41.924 42.059 -0.003 0.000 0.914 45 L HN 0.675 8.905 8.230 -0.000 0.000 0.441 46 E N -0.938 119.227 120.200 -0.057 0.000 2.170 46 E HA -0.109 4.218 4.350 -0.039 0.000 0.191 46 E C 2.238 178.691 176.600 -0.245 0.000 0.981 46 E CA 0.551 56.888 56.400 -0.105 0.000 0.830 46 E CB 0.239 29.925 29.700 -0.023 0.000 0.775 46 E HN 0.261 8.621 8.360 -0.000 0.000 0.470 47 V N 1.174 120.894 119.914 -0.325 0.000 2.270 47 V HA -0.233 3.863 4.120 -0.039 0.000 0.245 47 V C 2.289 178.340 176.094 -0.072 0.000 1.043 47 V CA 2.092 64.221 62.300 -0.284 0.000 1.014 47 V CB -0.685 31.027 31.823 -0.186 0.000 0.645 47 V HN 0.300 8.490 8.190 -0.000 0.000 0.447 48 T N -0.067 114.448 114.554 -0.064 0.000 2.737 48 T HA -0.288 4.039 4.350 -0.039 0.000 0.269 48 T C 1.993 176.711 174.700 0.029 0.000 1.040 48 T CA 2.078 64.156 62.100 -0.037 0.000 1.142 48 T CB -0.296 68.536 68.868 -0.061 0.000 0.861 48 T HN 0.474 8.714 8.240 -0.000 0.000 0.456 49 R N 0.969 121.471 120.500 0.003 0.000 2.057 49 R HA -0.114 4.202 4.340 -0.039 0.000 0.229 49 R C 1.825 178.146 176.300 0.035 0.000 1.136 49 R CA 1.858 57.967 56.100 0.016 0.000 0.952 49 R CB -0.337 29.960 30.300 -0.005 0.000 0.848 49 R HN 0.240 8.510 8.270 -0.000 0.000 0.430 50 D N 0.292 120.699 120.400 0.011 0.000 2.123 50 D HA -0.188 4.429 4.640 -0.039 0.000 0.196 50 D C 1.652 177.978 176.300 0.042 0.000 0.992 50 D CA 1.114 55.118 54.000 0.008 0.000 0.833 50 D CB -0.465 40.318 40.800 -0.029 0.000 0.954 50 D HN 0.180 8.550 8.370 -0.000 0.000 0.455 51 F N 1.644 121.555 119.950 -0.064 0.000 2.025 51 F HA -0.268 4.234 4.527 -0.041 0.000 0.297 51 F C 2.422 178.201 175.800 -0.035 0.000 1.132 51 F CA 1.264 59.234 58.000 -0.050 0.000 1.191 51 F CB -0.621 38.348 39.000 -0.052 0.000 0.963 51 F HN -0.214 8.086 8.300 -0.000 0.000 0.481 52 V N 0.478 120.605 119.914 0.356 0.000 2.380 52 V HA -0.343 3.753 4.120 -0.039 0.000 0.251 52 V C 2.366 178.502 176.094 0.070 0.000 1.063 52 V CA 2.309 64.736 62.300 0.212 0.000 1.055 52 V CB -0.703 31.203 31.823 0.138 0.000 0.657 52 V HN 0.498 8.688 8.190 -0.000 0.000 0.455 53 E N 0.888 121.111 120.200 0.039 0.000 2.031 53 E HA -0.271 4.055 4.350 -0.039 0.000 0.193 53 E C 2.213 178.792 176.600 -0.034 0.000 0.994 53 E CA 1.838 58.239 56.400 0.002 0.000 0.800 53 E CB -0.492 29.207 29.700 -0.002 0.000 0.752 53 E HN 0.391 8.751 8.360 -0.000 0.000 0.447 54 R N 0.051 120.506 120.500 -0.076 0.000 2.139 54 R HA -0.095 4.222 4.340 -0.039 0.000 0.243 54 R C 2.105 178.322 176.300 -0.140 0.000 1.145 54 R CA 1.686 57.709 56.100 -0.129 0.000 0.976 54 R CB -0.788 29.385 30.300 -0.211 0.000 0.866 54 R HN 0.253 8.523 8.270 -0.000 0.000 0.449 55 V N 0.160 119.988 119.914 -0.142 0.000 2.407 55 V HA -0.081 4.016 4.120 -0.039 0.000 0.245 55 V C 2.534 178.605 176.094 -0.039 0.000 1.041 55 V CA 1.902 64.143 62.300 -0.098 0.000 1.040 55 V CB -0.586 31.208 31.823 -0.048 0.000 0.671 55 V HN 0.338 8.528 8.190 -0.000 0.000 0.455 56 R N 0.009 120.498 120.500 -0.019 0.000 2.070 56 R HA -0.204 4.112 4.340 -0.039 0.000 0.232 56 R C 2.410 178.700 176.300 -0.017 0.000 1.138 56 R CA 2.133 58.228 56.100 -0.007 0.000 0.936 56 R CB -0.281 30.020 30.300 0.001 0.000 0.839 56 R HN 0.593 8.863 8.270 -0.000 0.000 0.429 57 E N -0.021 120.164 120.200 -0.025 0.000 2.035 57 E HA -0.229 4.097 4.350 -0.039 0.000 0.204 57 E C 1.940 178.523 176.600 -0.029 0.000 1.025 57 E CA 1.652 58.036 56.400 -0.026 0.000 0.835 57 E CB 0.043 29.724 29.700 -0.033 0.000 0.764 57 E HN 0.309 8.669 8.360 -0.000 0.000 0.457 58 E N -0.213 119.962 120.200 -0.042 0.000 2.110 58 E HA -0.190 4.136 4.350 -0.039 0.000 0.193 58 E C 1.892 178.477 176.600 -0.026 0.000 0.988 58 E CA 0.932 57.309 56.400 -0.039 0.000 0.804 58 E CB -0.184 29.482 29.700 -0.058 0.000 0.745 58 E HN 0.294 8.654 8.360 -0.000 0.000 0.458 59 A N 1.292 124.098 122.820 -0.023 0.000 1.873 59 A HA -0.106 4.190 4.320 -0.039 0.000 0.215 59 A C 2.378 179.957 177.584 -0.008 0.000 1.186 59 A CA 0.908 52.938 52.037 -0.012 0.000 0.616 59 A CB -0.684 18.312 19.000 -0.006 0.000 0.823 59 A HN 0.157 8.307 8.150 -0.000 0.000 0.442 60 L N -0.528 120.690 121.223 -0.009 0.000 2.083 60 L HA -0.132 4.185 4.340 -0.039 0.000 0.209 60 L C 2.757 179.622 176.870 -0.007 0.000 1.083 60 L CA 1.052 55.888 54.840 -0.006 0.000 0.752 60 L CB -0.891 41.164 42.059 -0.006 0.000 0.899 60 L HN 0.490 8.720 8.230 -0.000 0.000 0.433 61 G N -0.092 108.702 108.800 -0.011 0.000 2.470 61 G HA2 -0.234 3.703 3.960 -0.039 0.000 0.220 61 G HA3 -0.234 3.703 3.960 -0.039 0.000 0.220 61 G C 1.547 176.442 174.900 -0.008 0.000 1.121 61 G CA 0.439 45.533 45.100 -0.010 0.000 0.766 61 G HN 0.309 8.599 8.290 -0.000 0.000 0.553 62 K N -0.309 120.086 120.400 -0.008 0.000 2.446 62 K HA 0.209 4.506 4.320 -0.039 0.000 0.203 62 K C 0.436 177.034 176.600 -0.004 0.000 1.027 62 K CA -0.211 56.073 56.287 -0.006 0.000 1.166 62 K CB 0.347 32.844 32.500 -0.005 0.000 0.869 62 K HN 0.118 8.368 8.250 -0.000 0.000 0.504 63 Q N -0.435 119.363 119.800 -0.004 0.000 2.439 63 Q HA -0.179 4.138 4.340 -0.039 0.000 0.325 63 Q C 0.797 176.796 176.000 -0.002 0.000 1.372 63 Q CA 0.432 56.233 55.803 -0.003 0.000 0.909 63 Q CB -1.835 26.902 28.738 -0.003 0.000 1.167 63 Q HN 0.274 8.544 8.270 -0.000 0.000 0.418 64 V N -3.071 116.842 119.914 -0.001 0.000 2.332 64 V HA -0.311 3.786 4.120 -0.039 0.000 0.248 64 V C 1.858 177.953 176.094 0.001 0.000 1.055 64 V CA 2.191 64.492 62.300 0.001 0.000 1.038 64 V CB -0.687 31.137 31.823 0.002 0.000 0.651 64 V HN 0.602 8.792 8.190 -0.000 0.000 0.450 65 L N 0.314 121.538 121.223 0.001 0.000 2.131 65 L HA -0.130 4.187 4.340 -0.039 0.000 0.210 65 L C 2.619 179.489 176.870 0.001 0.000 1.092 65 L CA 1.783 56.624 54.840 0.002 0.000 0.759 65 L CB -0.641 41.418 42.059 0.001 0.000 0.903 65 L HN 0.471 8.701 8.230 -0.000 0.000 0.435 66 E N -1.049 119.151 120.200 0.000 0.000 2.474 66 E HA 0.038 4.365 4.350 -0.039 0.000 0.195 66 E C 0.806 177.405 176.600 -0.001 0.000 1.039 66 E CA -0.141 56.258 56.400 -0.000 0.000 0.881 66 E CB 0.432 30.131 29.700 -0.001 0.000 0.970 66 E HN 0.171 8.531 8.360 -0.000 0.000 0.486 67 S N 0.496 116.196 115.700 -0.000 0.000 2.601 67 S HA 0.167 4.614 4.470 -0.039 0.000 0.271 67 S C 0.730 175.329 174.600 -0.000 0.000 1.305 67 S CA -0.507 57.692 58.200 -0.001 0.000 1.022 67 S CB 0.687 63.886 63.200 -0.001 0.000 0.940 67 S HN 0.075 8.385 8.310 -0.000 0.000 0.525 68 L N 2.807 124.029 121.223 -0.001 0.000 2.554 68 L HA 0.261 4.577 4.340 -0.039 0.000 0.225 68 L C 1.151 178.020 176.870 -0.001 0.000 1.104 68 L CA 0.154 54.993 54.840 -0.001 0.000 0.866 68 L CB -0.206 41.852 42.059 -0.002 0.000 1.047 68 L HN 0.796 9.026 8.230 -0.000 0.000 0.468 69 T N -3.972 110.581 114.554 -0.001 0.000 3.504 69 T HA 0.329 4.655 4.350 -0.039 0.000 0.286 69 T C -2.036 172.665 174.700 0.000 0.000 1.530 69 T CA -1.277 60.822 62.100 -0.001 0.000 1.652 69 T CB 0.789 69.654 68.868 -0.004 0.000 0.895 69 T HN -0.142 8.098 8.240 -0.000 0.000 0.674 70 P HA -0.011 4.409 4.420 -0.000 0.000 0.221 70 P C 1.718 179.023 177.300 0.007 0.000 1.150 70 P CA 0.835 63.938 63.100 0.004 0.000 0.800 70 P CB -0.010 31.693 31.700 0.005 0.000 0.787 71 A N 0.543 123.367 122.820 0.007 0.000 2.019 71 A HA -0.174 4.123 4.320 -0.039 0.000 0.219 71 A C 2.138 179.727 177.584 0.009 0.000 1.164 71 A CA 1.471 53.514 52.037 0.010 0.000 0.644 71 A CB -0.849 18.156 19.000 0.008 0.000 0.805 71 A HN 0.063 8.213 8.150 -0.000 0.000 0.449 72 E N -0.350 119.852 120.200 0.003 0.000 2.216 72 E HA -0.021 4.306 4.350 -0.039 0.000 0.192 72 E C 2.110 178.711 176.600 0.002 0.000 0.988 72 E CA 0.913 57.312 56.400 -0.002 0.000 0.834 72 E CB -0.465 29.230 29.700 -0.009 0.000 0.772 72 E HN 0.418 8.778 8.360 -0.000 0.000 0.479 73 V N 1.012 120.929 119.914 0.005 0.000 2.323 73 V HA -0.182 3.915 4.120 -0.039 0.000 0.244 73 V C 2.318 178.421 176.094 0.015 0.000 1.041 73 V CA 1.145 63.449 62.300 0.007 0.000 1.025 73 V CB -0.418 31.407 31.823 0.004 0.000 0.656 73 V HN 0.129 8.319 8.190 -0.000 0.000 0.451 74 I N -0.146 120.435 120.570 0.019 0.000 2.127 74 I HA -0.279 3.868 4.170 -0.039 0.000 0.241 74 I C 2.424 178.568 176.117 0.045 0.000 1.075 74 I CA 1.734 63.052 61.300 0.030 0.000 1.334 74 I CB -0.533 37.487 38.000 0.033 0.000 1.040 74 I HN 0.292 8.502 8.210 -0.000 0.000 0.405 75 L N 1.008 122.256 121.223 0.042 0.000 2.051 75 L HA -0.261 4.056 4.340 -0.039 0.000 0.214 75 L C 2.474 179.392 176.870 0.080 0.000 1.076 75 L CA 2.301 57.174 54.840 0.056 0.000 0.758 75 L CB -0.685 41.389 42.059 0.025 0.000 0.890 75 L HN 0.236 8.466 8.230 -0.000 0.000 0.433 76 A N -1.150 121.701 122.820 0.053 0.000 1.898 76 A HA -0.190 4.107 4.320 -0.039 0.000 0.216 76 A C 2.374 180.019 177.584 0.101 0.000 1.181 76 A CA 2.264 54.345 52.037 0.074 0.000 0.620 76 A CB -1.337 17.681 19.000 0.030 0.000 0.819 76 A HN 0.641 8.791 8.150 -0.000 0.000 0.442 77 T N -2.965 111.614 114.554 0.041 0.000 2.904 77 T HA -0.042 4.285 4.350 -0.039 0.000 0.267 77 T C 1.668 176.334 174.700 -0.057 0.000 1.059 77 T CA 1.319 63.410 62.100 -0.015 0.000 1.137 77 T CB -0.571 68.274 68.868 -0.038 0.000 0.879 77 T HN 0.034 8.274 8.240 -0.000 0.000 0.467 78 V N 0.668 120.592 119.914 0.016 0.000 2.427 78 V HA -0.073 4.024 4.120 -0.039 0.000 0.248 78 V C 2.246 178.378 176.094 0.065 0.000 1.051 78 V CA 1.513 63.842 62.300 0.049 0.000 1.048 78 V CB -0.944 30.983 31.823 0.174 0.000 0.666 78 V HN 0.558 8.748 8.190 -0.000 0.000 0.456 79 Y N 1.631 121.929 120.300 -0.003 0.000 2.097 79 Y HA -0.234 4.294 4.550 -0.036 0.000 0.282 79 Y C 2.579 178.458 175.900 -0.034 0.000 1.152 79 Y CA 2.048 60.145 58.100 -0.005 0.000 1.136 79 Y CB -0.174 38.278 38.460 -0.013 0.000 0.975 79 Y HN 0.256 8.536 8.280 -0.000 0.000 0.498 80 E N 0.286 120.364 120.200 -0.203 0.000 2.150 80 E HA -0.148 4.179 4.350 -0.039 0.000 0.193 80 E C 2.387 178.814 176.600 -0.289 0.000 0.985 80 E CA 1.044 57.283 56.400 -0.268 0.000 0.814 80 E CB -0.672 28.970 29.700 -0.096 0.000 0.752 80 E HN 0.594 8.954 8.360 -0.000 0.000 0.466 81 A N 0.912 123.530 122.820 -0.337 0.000 1.969 81 A HA -0.078 4.218 4.320 -0.039 0.000 0.218 81 A C 2.315 179.725 177.584 -0.290 0.000 1.169 81 A CA 0.802 52.511 52.037 -0.545 0.000 0.635 81 A CB -0.497 17.760 19.000 -1.238 0.000 0.810 81 A HN 0.167 8.317 8.150 -0.000 0.000 0.445 82 L N -0.847 120.317 121.223 -0.099 0.000 2.095 82 L HA -0.105 4.211 4.340 -0.039 0.000 0.204 82 L C 2.588 179.390 176.870 -0.113 0.000 1.080 82 L CA 1.699 56.580 54.840 0.068 0.000 0.759 82 L CB -0.233 41.848 42.059 0.036 0.000 0.914 82 L HN 0.481 8.711 8.230 -0.000 0.000 0.439 83 K N -0.280 119.936 120.400 -0.307 0.000 2.057 83 K HA -0.208 4.088 4.320 -0.039 0.000 0.207 83 K C 1.954 178.460 176.600 -0.158 0.000 1.049 83 K CA 1.307 57.413 56.287 -0.302 0.000 0.931 83 K CB 0.137 32.353 32.500 -0.474 0.000 0.714 83 K HN 0.121 8.371 8.250 -0.000 0.000 0.440 84 E N 0.670 120.784 120.200 -0.143 0.000 2.031 84 E HA -0.143 4.184 4.350 -0.039 0.000 0.193 84 E C 2.021 178.608 176.600 -0.023 0.000 0.994 84 E CA 1.376 57.726 56.400 -0.083 0.000 0.800 84 E CB -0.593 29.047 29.700 -0.100 0.000 0.752 84 E HN 0.447 8.807 8.360 -0.000 0.000 0.447 85 A N 0.970 123.795 122.820 0.008 0.000 1.940 85 A HA -0.161 4.136 4.320 -0.039 0.000 0.219 85 A C 2.368 179.998 177.584 0.076 0.000 1.176 85 A CA 1.341 53.422 52.037 0.074 0.000 0.631 85 A CB -0.738 18.360 19.000 0.163 0.000 0.814 85 A HN 0.225 8.375 8.150 -0.000 0.000 0.446 86 L N -2.238 119.026 121.223 0.068 0.000 2.291 86 L HA 0.116 4.433 4.340 -0.039 0.000 0.214 86 L C 1.873 178.861 176.870 0.197 0.000 1.120 86 L CA 0.858 55.790 54.840 0.153 0.000 0.799 86 L CB -0.032 42.100 42.059 0.122 0.000 0.925 86 L HN 0.621 8.851 8.230 -0.000 0.000 0.446 87 G N -2.476 106.374 108.800 0.084 0.000 2.935 87 G HA2 0.102 4.038 3.960 -0.039 0.000 0.213 87 G HA3 0.102 4.038 3.960 -0.039 0.000 0.213 87 G C 0.667 175.570 174.900 0.006 0.000 0.984 87 G CA -0.348 44.789 45.100 0.063 0.000 0.790 87 G HN 0.549 8.839 8.290 -0.000 0.000 0.538 88 G N 0.667 109.450 108.800 -0.030 0.000 2.650 88 G HA2 -0.072 3.865 3.960 -0.039 0.000 0.264 88 G HA3 -0.072 3.865 3.960 -0.039 0.000 0.264 88 G C 0.115 174.972 174.900 -0.072 0.000 1.263 88 G CA 0.932 45.998 45.100 -0.057 0.000 0.960 88 G HN 1.585 9.875 8.290 -0.000 0.000 0.548 89 E N 1.400 121.562 120.200 -0.062 0.000 2.319 89 E HA 0.650 4.977 4.350 -0.039 0.000 0.268 89 E C 0.599 177.121 176.600 -0.130 0.000 1.050 89 E CA -0.412 55.937 56.400 -0.085 0.000 0.878 89 E CB 1.306 30.972 29.700 -0.057 0.000 1.066 89 E HN 1.272 9.632 8.360 -0.000 0.000 0.406 90 A N 2.643 125.312 122.820 -0.252 0.000 2.536 90 A HA 0.134 4.431 4.320 -0.039 0.000 0.234 90 A C 0.070 177.550 177.584 -0.174 0.000 1.076 90 A CA 0.303 52.123 52.037 -0.362 0.000 0.769 90 A CB 0.122 18.635 19.000 -0.812 0.000 1.020 90 A HN 0.665 8.815 8.150 -0.000 0.000 0.508 91 R N 0.037 120.475 120.500 -0.102 0.000 2.522 91 R HA 0.594 4.911 4.340 -0.039 0.000 0.283 91 R C -1.730 174.598 176.300 0.047 0.000 1.074 91 R CA -0.295 55.824 56.100 0.031 0.000 0.925 91 R CB 1.373 31.758 30.300 0.142 0.000 1.205 91 R HN 0.705 8.975 8.270 -0.000 0.000 0.436 92 L N 4.376 125.515 121.223 -0.140 0.000 2.381 92 L HA 0.630 4.947 4.340 -0.039 0.000 0.268 92 L C -2.139 174.365 176.870 -0.610 0.000 0.997 92 L CA -2.340 52.255 54.840 -0.408 0.000 0.818 92 L CB 2.474 44.421 42.059 -0.187 0.000 1.310 92 L HN 0.455 8.685 8.230 -0.000 0.000 0.416 93 P HA -0.017 4.403 4.420 -0.000 0.000 0.267 93 P C -0.858 176.294 177.300 -0.247 0.000 1.201 93 P CA -0.302 62.326 63.100 -0.786 0.000 0.775 93 P CB 0.288 31.393 31.700 -0.992 0.000 0.854 94 V N 0.823 120.649 119.914 -0.147 0.000 2.405 94 V HA 0.142 4.238 4.120 -0.039 0.000 0.264 94 V C 0.213 176.354 176.094 0.078 0.000 1.048 94 V CA -0.646 61.646 62.300 -0.014 0.000 0.966 94 V CB -0.011 31.806 31.823 -0.011 0.000 1.015 94 V HN 0.262 8.452 8.190 -0.000 0.000 0.477 95 L N 6.774 128.068 121.223 0.118 0.000 2.342 95 L HA 0.432 4.748 4.340 -0.039 0.000 0.285 95 L C 0.477 177.398 176.870 0.085 0.000 1.095 95 L CA 0.546 55.471 54.840 0.141 0.000 0.843 95 L CB -0.020 42.126 42.059 0.145 0.000 1.201 95 L HN 0.674 8.904 8.230 -0.000 0.000 0.445 96 K N 2.848 123.297 120.400 0.082 0.000 2.399 96 K HA 0.260 4.557 4.320 -0.039 0.000 0.247 96 K C 0.653 177.265 176.600 0.019 0.000 1.036 96 K CA -0.615 55.702 56.287 0.049 0.000 0.977 96 K CB 0.527 33.061 32.500 0.056 0.000 1.272 96 K HN 0.480 8.730 8.250 -0.000 0.000 0.501 97 D N 0.775 121.182 120.400 0.012 0.000 2.144 97 D HA -0.092 4.525 4.640 -0.039 0.000 0.200 97 D C 0.068 176.356 176.300 -0.020 0.000 0.978 97 D CA 1.301 55.299 54.000 -0.003 0.000 0.833 97 D CB 0.380 41.181 40.800 0.001 0.000 0.961 97 D HN 0.188 8.558 8.370 -0.000 0.000 0.470 98 R N 0.435 120.927 120.500 -0.013 0.000 2.532 98 R HA 0.421 4.738 4.340 -0.039 0.000 0.297 98 R C -1.146 175.141 176.300 -0.021 0.000 0.984 98 R CA -0.521 55.560 56.100 -0.030 0.000 0.884 98 R CB 1.645 31.935 30.300 -0.016 0.000 1.182 98 R HN -0.069 8.201 8.270 -0.000 0.000 0.442 99 N N 2.171 120.819 118.700 -0.087 0.000 2.295 99 N HA 0.417 5.134 4.740 -0.039 0.000 0.293 99 N C -1.625 173.769 175.510 -0.193 0.000 1.040 99 N CA -0.696 52.300 53.050 -0.091 0.000 0.840 99 N CB 2.465 40.812 38.487 -0.233 0.000 1.468 99 N HN 0.261 8.641 8.380 -0.000 0.000 0.478 100 L N 2.512 123.745 121.223 0.017 0.000 2.377 100 L HA 0.606 4.923 4.340 -0.039 0.000 0.270 100 L C -1.591 175.498 176.870 0.365 0.000 0.991 100 L CA -0.599 54.288 54.840 0.079 0.000 0.851 100 L CB 0.558 42.685 42.059 0.113 0.000 1.218 100 L HN 0.548 8.778 8.230 -0.000 0.000 0.420 101 W N 3.812 125.179 121.300 0.111 0.000 2.666 101 W HA 0.449 5.114 4.660 0.007 0.000 0.334 101 W C -0.604 176.124 176.519 0.349 0.000 1.051 101 W CA -1.366 56.071 57.345 0.153 0.000 1.224 101 W CB 1.119 30.635 29.460 0.093 0.000 1.405 101 W HN 0.157 8.337 8.180 -0.000 0.000 0.513 102 F N 3.147 123.247 119.950 0.250 0.000 2.385 102 F HA 0.433 4.944 4.527 -0.026 0.000 0.336 102 F C 0.198 176.074 175.800 0.127 0.000 1.100 102 F CA -1.495 56.593 58.000 0.148 0.000 1.116 102 F CB 0.841 39.904 39.000 0.105 0.000 1.166 102 F HN -0.184 8.116 8.300 -0.000 0.000 0.511 103 L N 4.830 126.184 121.223 0.219 0.000 2.305 103 L HA 0.576 4.892 4.340 -0.039 0.000 0.284 103 L C -0.314 176.583 176.870 0.044 0.000 1.013 103 L CA -0.692 54.218 54.840 0.117 0.000 0.819 103 L CB 1.167 43.270 42.059 0.074 0.000 1.227 103 L HN 0.419 8.649 8.230 -0.000 0.000 0.417 104 V N 0.253 120.151 119.914 -0.027 0.000 3.074 104 V HA 1.122 5.219 4.120 -0.039 0.000 0.314 104 V C -0.001 175.866 176.094 -0.379 0.000 1.117 104 V CA -0.308 61.907 62.300 -0.141 0.000 1.014 104 V CB 1.824 33.578 31.823 -0.116 0.000 1.057 104 V HN 0.931 9.121 8.190 -0.000 0.000 0.438 105 G N 0.466 108.966 108.800 -0.500 0.000 2.369 105 G HA2 0.312 4.249 3.960 -0.039 0.000 0.293 105 G HA3 0.312 4.249 3.960 -0.039 0.000 0.293 105 G C -1.661 173.226 174.900 -0.021 0.000 1.301 105 G CA -0.668 44.157 45.100 -0.459 0.000 0.913 105 G HN 0.979 9.269 8.290 -0.000 0.000 0.540 106 L N 0.501 121.750 121.223 0.044 0.000 2.399 106 L HA 0.542 4.859 4.340 -0.039 0.000 0.265 106 L C 1.124 178.023 176.870 0.048 0.000 1.089 106 L CA -0.741 54.163 54.840 0.106 0.000 0.802 106 L CB 1.416 43.539 42.059 0.107 0.000 1.180 106 L HN 0.776 9.006 8.230 -0.000 0.000 0.454 107 Q N 0.736 120.565 119.800 0.049 0.000 2.315 107 Q HA 0.164 4.481 4.340 -0.039 0.000 0.289 107 Q C 0.920 176.931 176.000 0.018 0.000 1.044 107 Q CA 0.991 56.810 55.803 0.027 0.000 0.920 107 Q CB 0.459 29.213 28.738 0.026 0.000 1.214 107 Q HN 0.852 9.122 8.270 -0.000 0.000 0.392 108 G N 2.244 111.050 108.800 0.009 0.000 2.176 108 G HA2 -0.350 3.587 3.960 -0.039 0.000 0.253 108 G HA3 -0.350 3.587 3.960 -0.039 0.000 0.253 108 G C 0.723 175.623 174.900 -0.000 0.000 0.979 108 G CA 0.676 45.778 45.100 0.005 0.000 0.641 108 G HN 0.900 9.190 8.290 -0.000 0.000 0.530 109 S N -0.418 115.281 115.700 -0.003 0.000 2.453 109 S HA 0.375 4.821 4.470 -0.039 0.000 0.231 109 S C 2.261 176.852 174.600 -0.015 0.000 1.005 109 S CA 1.567 59.759 58.200 -0.013 0.000 0.949 109 S CB 0.103 63.287 63.200 -0.028 0.000 0.774 109 S HN 2.407 10.717 8.310 -0.000 0.000 0.510 110 G N 1.458 110.252 108.800 -0.010 0.000 2.168 110 G HA2 -0.264 3.672 3.960 -0.039 0.000 0.197 110 G HA3 -0.264 3.672 3.960 -0.039 0.000 0.197 110 G C 0.627 175.521 174.900 -0.009 0.000 0.997 110 G CA 0.387 45.483 45.100 -0.007 0.000 0.658 110 G HN 0.547 8.837 8.290 -0.000 0.000 0.513 111 K N 0.123 120.514 120.400 -0.015 0.000 2.009 111 K HA -0.103 4.194 4.320 -0.039 0.000 0.210 111 K C 2.421 179.016 176.600 -0.007 0.000 1.049 111 K CA 2.235 58.512 56.287 -0.017 0.000 0.929 111 K CB -0.372 32.111 32.500 -0.030 0.000 0.714 111 K HN 0.292 8.542 8.250 -0.000 0.000 0.440 112 T N 0.321 114.871 114.554 -0.006 0.000 2.777 112 T HA -0.092 4.234 4.350 -0.039 0.000 0.266 112 T C 1.780 176.479 174.700 -0.002 0.000 1.040 112 T CA 1.825 63.922 62.100 -0.005 0.000 1.141 112 T CB -0.373 68.492 68.868 -0.005 0.000 0.868 112 T HN 0.379 8.619 8.240 -0.000 0.000 0.444 113 T N 1.793 116.346 114.554 -0.001 0.000 2.788 113 T HA -0.097 4.229 4.350 -0.039 0.000 0.268 113 T C 2.211 176.911 174.700 0.001 0.000 1.044 113 T CA 1.506 63.606 62.100 0.001 0.000 1.139 113 T CB -0.565 68.305 68.868 0.002 0.000 0.867 113 T HN 0.396 8.636 8.240 -0.000 0.000 0.454 114 T N 1.716 116.269 114.554 -0.001 0.000 2.904 114 T HA 0.103 4.430 4.350 -0.039 0.000 0.267 114 T C 2.390 177.087 174.700 -0.006 0.000 1.059 114 T CA 0.872 62.968 62.100 -0.007 0.000 1.137 114 T CB -0.379 68.487 68.868 -0.003 0.000 0.879 114 T HN 0.420 8.660 8.240 -0.000 0.000 0.467 115 A N 1.610 124.435 122.820 0.008 0.000 1.877 115 A HA 0.177 4.474 4.320 -0.039 0.000 0.216 115 A C 2.626 180.218 177.584 0.013 0.000 1.186 115 A CA 1.711 53.760 52.037 0.020 0.000 0.620 115 A CB -1.061 17.948 19.000 0.015 0.000 0.822 115 A HN 0.495 8.645 8.150 -0.000 0.000 0.443 116 A N -0.607 122.217 122.820 0.007 0.000 1.969 116 A HA -0.081 4.216 4.320 -0.039 0.000 0.218 116 A C 2.085 179.678 177.584 0.014 0.000 1.169 116 A CA 1.634 53.676 52.037 0.008 0.000 0.635 116 A CB -0.314 18.689 19.000 0.005 0.000 0.810 116 A HN 0.532 8.682 8.150 -0.000 0.000 0.445 117 K N -1.033 119.372 120.400 0.008 0.000 2.167 117 K HA 0.032 4.328 4.320 -0.039 0.000 0.203 117 K C 1.728 178.334 176.600 0.011 0.000 1.052 117 K CA 0.671 56.965 56.287 0.011 0.000 0.956 117 K CB -0.185 32.313 32.500 -0.003 0.000 0.735 117 K HN 0.333 8.583 8.250 -0.000 0.000 0.451 118 L N 1.195 122.406 121.223 -0.020 0.000 2.056 118 L HA -0.083 4.234 4.340 -0.039 0.000 0.207 118 L C 2.169 179.130 176.870 0.152 0.000 1.078 118 L CA 1.609 56.438 54.840 -0.017 0.000 0.749 118 L CB -0.855 41.200 42.059 -0.007 0.000 0.901 118 L HN 0.090 8.320 8.230 -0.000 0.000 0.433 119 A N -0.775 122.098 122.820 0.089 0.000 1.858 119 A HA -0.221 4.076 4.320 -0.039 0.000 0.216 119 A C 2.228 179.859 177.584 0.078 0.000 1.190 119 A CA 1.896 53.978 52.037 0.075 0.000 0.617 119 A CB -1.096 17.918 19.000 0.023 0.000 0.827 119 A HN 0.408 8.558 8.150 -0.000 0.000 0.443 120 L N -1.403 119.854 121.223 0.055 0.000 2.013 120 L HA -0.203 4.114 4.340 -0.039 0.000 0.212 120 L C 2.307 179.197 176.870 0.032 0.000 1.073 120 L CA 2.631 57.494 54.840 0.038 0.000 0.753 120 L CB -1.104 40.978 42.059 0.038 0.000 0.890 120 L HN 0.541 8.771 8.230 -0.000 0.000 0.432 121 Y N -0.958 119.302 120.300 -0.065 0.000 2.097 121 Y HA -0.338 4.189 4.550 -0.038 0.000 0.282 121 Y C 2.331 178.126 175.900 -0.175 0.000 1.152 121 Y CA 2.220 60.236 58.100 -0.140 0.000 1.136 121 Y CB -0.719 37.593 38.460 -0.247 0.000 0.975 121 Y HN 0.286 8.566 8.280 -0.000 0.000 0.498 122 Y N 0.501 120.760 120.300 -0.068 0.000 2.352 122 Y HA -0.134 4.391 4.550 -0.041 0.000 0.292 122 Y C 2.568 178.385 175.900 -0.139 0.000 1.136 122 Y CA 1.682 59.705 58.100 -0.128 0.000 1.227 122 Y CB -0.491 37.955 38.460 -0.023 0.000 0.991 122 Y HN 0.135 8.415 8.280 -0.000 0.000 0.545 123 K N -0.123 120.285 120.400 0.015 0.000 2.057 123 K HA -0.119 4.177 4.320 -0.039 0.000 0.207 123 K C 2.263 178.829 176.600 -0.056 0.000 1.049 123 K CA 1.419 57.699 56.287 -0.012 0.000 0.931 123 K CB -0.596 31.898 32.500 -0.009 0.000 0.714 123 K HN 0.335 8.585 8.250 -0.000 0.000 0.440 124 G N 0.211 108.942 108.800 -0.115 0.000 2.679 124 G HA2 -0.127 3.810 3.960 -0.039 0.000 0.212 124 G HA3 -0.127 3.810 3.960 -0.039 0.000 0.212 124 G C 1.063 175.867 174.900 -0.159 0.000 1.137 124 G CA 0.249 45.271 45.100 -0.130 0.000 0.787 124 G HN 0.120 8.410 8.290 -0.000 0.000 0.534 125 K N 0.067 120.358 120.400 -0.183 0.000 2.372 125 K HA 0.227 4.524 4.320 -0.039 0.000 0.200 125 K C 1.458 178.044 176.600 -0.023 0.000 1.022 125 K CA 0.308 56.517 56.287 -0.131 0.000 1.125 125 K CB 0.564 32.961 32.500 -0.173 0.000 0.855 125 K HN 0.296 8.546 8.250 -0.000 0.000 0.524 126 G N 1.700 110.487 108.800 -0.021 0.000 2.157 126 G HA2 -0.232 3.705 3.960 -0.039 0.000 0.239 126 G HA3 -0.232 3.705 3.960 -0.039 0.000 0.239 126 G C 0.088 174.993 174.900 0.009 0.000 0.982 126 G CA -0.237 44.862 45.100 -0.002 0.000 0.650 126 G HN 0.143 8.433 8.290 -0.000 0.000 0.527 127 R N -0.070 120.445 120.500 0.026 0.000 2.528 127 R HA 0.534 4.851 4.340 -0.039 0.000 0.271 127 R C 0.361 176.651 176.300 -0.016 0.000 1.056 127 R CA -0.527 55.577 56.100 0.008 0.000 1.117 127 R CB 0.523 30.844 30.300 0.036 0.000 1.085 127 R HN 0.266 8.536 8.270 -0.000 0.000 0.530 128 R N 2.233 122.707 120.500 -0.044 0.000 2.505 128 R HA 0.292 4.609 4.340 -0.039 0.000 0.284 128 R C -2.236 174.024 176.300 -0.067 0.000 1.324 128 R CA -1.694 54.380 56.100 -0.044 0.000 1.432 128 R CB 1.255 31.532 30.300 -0.039 0.000 1.107 128 R HN 0.345 8.615 8.270 -0.000 0.000 0.587 129 P HA 0.190 4.610 4.420 -0.000 0.000 0.276 129 P C -1.036 176.224 177.300 -0.067 0.000 1.252 129 P CA -0.693 62.354 63.100 -0.088 0.000 0.802 129 P CB 0.860 32.517 31.700 -0.071 0.000 1.035 130 L N 1.360 122.537 121.223 -0.077 0.000 2.439 130 L HA 0.442 4.759 4.340 -0.039 0.000 0.270 130 L C -1.474 175.365 176.870 -0.052 0.000 0.972 130 L CA -0.538 54.270 54.840 -0.054 0.000 0.836 130 L CB 1.065 43.093 42.059 -0.051 0.000 1.255 130 L HN 0.163 8.393 8.230 -0.000 0.000 0.404 131 L N 5.323 126.525 121.223 -0.036 0.000 2.350 131 L HA 0.659 4.975 4.340 -0.039 0.000 0.275 131 L C -0.661 176.191 176.870 -0.029 0.000 1.099 131 L CA -0.752 54.070 54.840 -0.030 0.000 0.808 131 L CB 1.729 43.775 42.059 -0.021 0.000 1.149 131 L HN 0.394 8.624 8.230 -0.000 0.000 0.442 132 V N 2.583 122.478 119.914 -0.033 0.000 2.443 132 V HA 0.439 4.536 4.120 -0.039 0.000 0.293 132 V C 0.080 176.144 176.094 -0.050 0.000 1.021 132 V CA -0.646 61.630 62.300 -0.039 0.000 0.848 132 V CB 1.678 33.476 31.823 -0.043 0.000 0.998 132 V HN 0.821 9.011 8.190 -0.000 0.000 0.424 133 A N 3.852 126.647 122.820 -0.042 0.000 2.506 133 A HA 0.673 4.970 4.320 -0.039 0.000 0.320 133 A C 1.100 178.652 177.584 -0.053 0.000 1.424 133 A CA 0.225 52.236 52.037 -0.043 0.000 1.044 133 A CB 0.467 19.450 19.000 -0.029 0.000 1.140 133 A HN 1.265 9.415 8.150 -0.000 0.000 0.538 134 A N 2.117 124.889 122.820 -0.080 0.000 2.276 134 A HA 0.136 4.433 4.320 -0.039 0.000 0.212 134 A C 0.625 178.169 177.584 -0.066 0.000 1.230 134 A CA 0.041 52.023 52.037 -0.092 0.000 0.844 134 A CB -0.190 18.707 19.000 -0.172 0.000 0.860 134 A HN 0.667 8.817 8.150 -0.000 0.000 0.486 135 D N 1.232 121.606 120.400 -0.044 0.000 2.352 135 D HA 0.101 4.718 4.640 -0.039 0.000 0.245 135 D C 1.095 177.383 176.300 -0.020 0.000 1.224 135 D CA 0.648 54.631 54.000 -0.027 0.000 0.879 135 D CB 0.868 41.657 40.800 -0.018 0.000 1.057 135 D HN 0.296 8.666 8.370 -0.000 0.000 0.491 136 T N 0.537 115.081 114.554 -0.017 0.000 3.219 136 T HA 0.021 4.348 4.350 -0.039 0.000 0.249 136 T C 1.019 175.715 174.700 -0.007 0.000 1.099 136 T CA 0.376 62.469 62.100 -0.012 0.000 0.988 136 T CB 0.087 68.949 68.868 -0.010 0.000 0.999 136 T HN 0.453 8.693 8.240 -0.000 0.000 0.550 137 Q N 0.250 120.046 119.800 -0.007 0.000 2.254 137 Q HA 0.269 4.586 4.340 -0.039 0.000 0.259 137 Q C 0.350 176.347 176.000 -0.003 0.000 0.815 137 Q CA -0.228 55.573 55.803 -0.004 0.000 0.961 137 Q CB 1.012 29.748 28.738 -0.002 0.000 1.140 137 Q HN 0.326 8.596 8.270 -0.000 0.000 0.502 138 R N 1.653 122.150 120.500 -0.004 0.000 2.352 138 R HA 0.261 4.578 4.340 -0.039 0.000 0.304 138 R C -2.331 173.966 176.300 -0.005 0.000 1.104 138 R CA -1.681 54.417 56.100 -0.004 0.000 0.991 138 R CB 1.240 31.539 30.300 -0.002 0.000 1.140 138 R HN -0.084 8.186 8.270 -0.000 0.000 0.540 139 P HA -0.229 4.191 4.420 -0.000 0.000 0.216 139 P C 1.219 178.516 177.300 -0.006 0.000 1.150 139 P CA 1.394 64.490 63.100 -0.006 0.000 0.843 139 P CB 0.332 32.029 31.700 -0.005 0.000 0.787 140 A N -0.212 122.605 122.820 -0.004 0.000 1.972 140 A HA -0.120 4.177 4.320 -0.039 0.000 0.219 140 A C 2.305 179.887 177.584 -0.004 0.000 1.169 140 A CA 2.034 54.068 52.037 -0.003 0.000 0.635 140 A CB -1.499 17.500 19.000 -0.002 0.000 0.810 140 A HN 0.218 8.368 8.150 -0.000 0.000 0.446 141 A N -0.123 122.695 122.820 -0.005 0.000 1.898 141 A HA -0.122 4.174 4.320 -0.039 0.000 0.216 141 A C 2.246 179.824 177.584 -0.009 0.000 1.181 141 A CA 1.334 53.368 52.037 -0.006 0.000 0.620 141 A CB -0.407 18.590 19.000 -0.006 0.000 0.819 141 A HN 0.558 8.708 8.150 -0.000 0.000 0.442 142 R N -0.530 119.964 120.500 -0.011 0.000 2.075 142 R HA -0.078 4.239 4.340 -0.039 0.000 0.232 142 R C 1.985 178.279 176.300 -0.011 0.000 1.126 142 R CA 1.171 57.263 56.100 -0.013 0.000 0.963 142 R CB -0.317 29.974 30.300 -0.014 0.000 0.858 142 R HN 0.437 8.707 8.270 -0.000 0.000 0.435 143 E N 1.132 121.327 120.200 -0.008 0.000 2.085 143 E HA -0.261 4.066 4.350 -0.039 0.000 0.194 143 E C 1.948 178.544 176.600 -0.006 0.000 0.994 143 E CA 1.263 57.659 56.400 -0.006 0.000 0.801 143 E CB -0.141 29.556 29.700 -0.005 0.000 0.743 143 E HN 0.417 8.777 8.360 -0.000 0.000 0.453 144 Q N 0.250 120.046 119.800 -0.005 0.000 2.061 144 Q HA -0.183 4.134 4.340 -0.039 0.000 0.204 144 Q C 2.278 178.275 176.000 -0.005 0.000 0.984 144 Q CA 1.325 57.126 55.803 -0.004 0.000 0.846 144 Q CB -0.169 28.567 28.738 -0.004 0.000 0.902 144 Q HN 0.194 8.464 8.270 -0.000 0.000 0.421 145 L N 0.945 122.163 121.223 -0.007 0.000 2.201 145 L HA -0.096 4.220 4.340 -0.039 0.000 0.212 145 L C 2.500 179.365 176.870 -0.008 0.000 1.105 145 L CA 1.511 56.346 54.840 -0.008 0.000 0.775 145 L CB -0.457 41.594 42.059 -0.013 0.000 0.913 145 L HN 0.188 8.418 8.230 -0.000 0.000 0.440 146 R N -0.612 119.883 120.500 -0.008 0.000 2.073 146 R HA -0.143 4.174 4.340 -0.039 0.000 0.234 146 R C 2.165 178.462 176.300 -0.006 0.000 1.134 146 R CA 1.846 57.942 56.100 -0.008 0.000 0.952 146 R CB -0.340 29.956 30.300 -0.008 0.000 0.850 146 R HN 0.423 8.693 8.270 -0.000 0.000 0.433 147 L N 0.693 121.914 121.223 -0.004 0.000 2.056 147 L HA -0.162 4.155 4.340 -0.039 0.000 0.207 147 L C 2.566 179.435 176.870 -0.002 0.000 1.078 147 L CA 0.968 55.806 54.840 -0.003 0.000 0.749 147 L CB -0.482 41.576 42.059 -0.002 0.000 0.901 147 L HN 0.253 8.483 8.230 -0.000 0.000 0.433 148 L N -0.080 121.141 121.223 -0.002 0.000 2.042 148 L HA -0.181 4.136 4.340 -0.039 0.000 0.210 148 L C 2.663 179.532 176.870 -0.000 0.000 1.076 148 L CA 1.567 56.407 54.840 -0.000 0.000 0.749 148 L CB -1.184 40.875 42.059 -0.000 0.000 0.893 148 L HN 0.367 8.597 8.230 -0.000 0.000 0.432 149 G N -0.642 108.156 108.800 -0.003 0.000 2.408 149 G HA2 -0.215 3.722 3.960 -0.039 0.000 0.217 149 G HA3 -0.215 3.722 3.960 -0.039 0.000 0.217 149 G C 1.418 176.316 174.900 -0.004 0.000 1.150 149 G CA 0.430 45.528 45.100 -0.004 0.000 0.776 149 G HN 0.421 8.711 8.290 -0.000 0.000 0.542 150 E N 0.257 120.455 120.200 -0.003 0.000 2.106 150 E HA -0.059 4.268 4.350 -0.039 0.000 0.192 150 E C 2.467 179.066 176.600 -0.001 0.000 0.984 150 E CA 0.676 57.075 56.400 -0.003 0.000 0.806 150 E CB -0.053 29.645 29.700 -0.003 0.000 0.750 150 E HN 0.338 8.698 8.360 -0.000 0.000 0.458 151 K N 0.588 120.988 120.400 0.000 0.000 2.097 151 K HA -0.104 4.193 4.320 -0.039 0.000 0.205 151 K C 2.162 178.763 176.600 0.003 0.000 1.050 151 K CA 1.472 57.760 56.287 0.002 0.000 0.938 151 K CB 0.035 32.537 32.500 0.003 0.000 0.718 151 K HN 0.140 8.390 8.250 -0.000 0.000 0.442 152 V N -2.730 117.186 119.914 0.003 0.000 3.623 152 V HA 0.279 4.376 4.120 -0.039 0.000 0.271 152 V C 0.823 176.917 176.094 0.002 0.000 1.248 152 V CA 0.503 62.806 62.300 0.005 0.000 1.156 152 V CB -0.364 31.465 31.823 0.009 0.000 0.870 152 V HN 0.388 8.578 8.190 -0.000 0.000 0.453 153 G N 0.075 108.874 108.800 -0.001 0.000 2.225 153 G HA2 -0.172 3.765 3.960 -0.039 0.000 0.264 153 G HA3 -0.172 3.765 3.960 -0.039 0.000 0.264 153 G C -0.159 174.738 174.900 -0.006 0.000 1.060 153 G CA 0.228 45.326 45.100 -0.004 0.000 0.833 153 G HN 0.942 9.232 8.290 -0.000 0.000 0.498 154 V N 1.491 121.402 119.914 -0.006 0.000 2.604 154 V HA 0.618 4.715 4.120 -0.039 0.000 0.305 154 V C -1.639 174.448 176.094 -0.012 0.000 1.043 154 V CA -1.692 60.602 62.300 -0.010 0.000 0.888 154 V CB 2.340 34.158 31.823 -0.008 0.000 0.995 154 V HN 0.222 8.412 8.190 -0.000 0.000 0.429 155 P HA 0.169 4.589 4.420 -0.000 0.000 0.268 155 P C -0.972 176.318 177.300 -0.018 0.000 1.205 155 P CA 0.126 63.216 63.100 -0.016 0.000 0.771 155 P CB 1.123 32.812 31.700 -0.018 0.000 0.858 156 V N 4.793 124.697 119.914 -0.015 0.000 2.483 156 V HA 0.301 4.398 4.120 -0.039 0.000 0.297 156 V C 0.221 176.305 176.094 -0.016 0.000 1.027 156 V CA -0.765 61.525 62.300 -0.017 0.000 0.855 156 V CB 1.765 33.580 31.823 -0.014 0.000 0.995 156 V HN 0.463 8.653 8.190 -0.000 0.000 0.424 157 L N 4.638 125.850 121.223 -0.019 0.000 2.272 157 L HA 0.589 4.906 4.340 -0.039 0.000 0.289 157 L C 0.008 176.866 176.870 -0.020 0.000 1.032 157 L CA -0.017 54.813 54.840 -0.018 0.000 0.810 157 L CB 1.096 43.144 42.059 -0.017 0.000 1.205 157 L HN 0.668 8.898 8.230 -0.000 0.000 0.422 158 E N 4.253 124.442 120.200 -0.017 0.000 2.156 158 E HA 0.322 4.649 4.350 -0.039 0.000 0.279 158 E C -0.326 176.264 176.600 -0.017 0.000 0.965 158 E CA -0.717 55.672 56.400 -0.018 0.000 0.789 158 E CB 1.924 31.616 29.700 -0.014 0.000 1.098 158 E HN 0.562 8.922 8.360 -0.000 0.000 0.397 159 V N 0.823 120.725 119.914 -0.021 0.000 3.441 159 V HA 0.306 4.403 4.120 -0.039 0.000 0.300 159 V C 0.264 176.350 176.094 -0.013 0.000 1.091 159 V CA -0.606 61.683 62.300 -0.018 0.000 1.099 159 V CB 0.514 32.323 31.823 -0.024 0.000 1.138 159 V HN 0.622 8.812 8.190 -0.000 0.000 0.471 160 M N 0.648 120.242 119.600 -0.010 0.000 2.471 160 M HA 0.410 4.867 4.480 -0.039 0.000 0.309 160 M C -0.435 175.861 176.300 -0.007 0.000 1.186 160 M CA -0.705 54.590 55.300 -0.007 0.000 1.008 160 M CB 0.941 33.538 32.600 -0.005 0.000 1.551 160 M HN 0.679 8.969 8.290 -0.000 0.000 0.477 161 D N 1.361 121.758 120.400 -0.006 0.000 2.487 161 D HA 0.170 4.787 4.640 -0.039 0.000 0.243 161 D C 1.121 177.419 176.300 -0.003 0.000 1.154 161 D CA 1.353 55.350 54.000 -0.005 0.000 0.876 161 D CB 0.454 41.251 40.800 -0.004 0.000 1.161 161 D HN 0.866 9.236 8.370 -0.000 0.000 0.478 162 G N 2.677 111.475 108.800 -0.003 0.000 2.180 162 G HA2 -0.377 3.560 3.960 -0.039 0.000 0.263 162 G HA3 -0.377 3.560 3.960 -0.039 0.000 0.263 162 G C 0.424 175.324 174.900 -0.000 0.000 0.989 162 G CA 0.725 45.824 45.100 -0.001 0.000 0.692 162 G HN 0.658 8.948 8.290 -0.000 0.000 0.526 163 E N 1.165 121.364 120.200 -0.002 0.000 2.415 163 E HA 0.407 4.734 4.350 -0.039 0.000 0.263 163 E C 1.197 177.799 176.600 0.003 0.000 0.995 163 E CA 0.216 56.616 56.400 -0.000 0.000 0.915 163 E CB 0.284 29.982 29.700 -0.003 0.000 0.951 163 E HN 0.581 8.941 8.360 -0.000 0.000 0.449 164 S N 3.834 119.538 115.700 0.006 0.000 2.585 164 S HA 0.148 4.595 4.470 -0.039 0.000 0.273 164 S C -1.846 172.763 174.600 0.016 0.000 1.339 164 S CA -1.148 57.059 58.200 0.011 0.000 1.028 164 S CB 1.237 64.444 63.200 0.012 0.000 0.906 164 S HN 0.443 8.753 8.310 -0.000 0.000 0.528 165 P HA -0.097 4.323 4.420 -0.000 0.000 0.215 165 P C 1.104 178.426 177.300 0.037 0.000 1.157 165 P CA 1.298 64.421 63.100 0.037 0.000 0.868 165 P CB -0.026 31.705 31.700 0.052 0.000 0.788 166 E N -0.723 119.496 120.200 0.031 0.000 2.118 166 E HA -0.156 4.170 4.350 -0.039 0.000 0.195 166 E C 2.244 178.857 176.600 0.022 0.000 0.992 166 E CA 1.478 57.894 56.400 0.027 0.000 0.804 166 E CB -0.955 28.758 29.700 0.022 0.000 0.741 166 E HN 0.122 8.482 8.360 -0.000 0.000 0.458 167 S N -0.301 115.409 115.700 0.017 0.000 2.355 167 S HA -0.107 4.339 4.470 -0.039 0.000 0.222 167 S C 1.906 176.513 174.600 0.013 0.000 1.031 167 S CA 0.933 59.141 58.200 0.012 0.000 0.993 167 S CB -0.238 62.967 63.200 0.008 0.000 0.859 167 S HN 0.184 8.494 8.310 -0.000 0.000 0.453 168 I N 1.316 121.894 120.570 0.014 0.000 2.208 168 I HA -0.207 3.940 4.170 -0.039 0.000 0.245 168 I C 2.758 178.888 176.117 0.021 0.000 1.097 168 I CA 1.489 62.796 61.300 0.012 0.000 1.363 168 I CB -0.364 37.641 38.000 0.008 0.000 1.051 168 I HN 0.293 8.503 8.210 -0.000 0.000 0.413 169 R N 1.010 121.529 120.500 0.033 0.000 2.083 169 R HA -0.176 4.141 4.340 -0.039 0.000 0.237 169 R C 2.541 178.857 176.300 0.026 0.000 1.137 169 R CA 1.544 57.668 56.100 0.040 0.000 0.951 169 R CB -0.127 30.201 30.300 0.046 0.000 0.851 169 R HN 0.270 8.540 8.270 -0.000 0.000 0.434 170 R N -0.096 120.416 120.500 0.020 0.000 2.080 170 R HA -0.134 4.183 4.340 -0.039 0.000 0.236 170 R C 2.494 178.800 176.300 0.009 0.000 1.137 170 R CA 1.787 57.895 56.100 0.014 0.000 0.943 170 R CB -0.344 29.963 30.300 0.011 0.000 0.846 170 R HN 0.301 8.571 8.270 -0.000 0.000 0.431 171 R N 0.190 120.695 120.500 0.008 0.000 2.081 171 R HA -0.076 4.241 4.340 -0.039 0.000 0.235 171 R C 2.381 178.682 176.300 0.002 0.000 1.131 171 R CA 1.288 57.390 56.100 0.003 0.000 0.960 171 R CB -0.505 29.796 30.300 0.001 0.000 0.856 171 R HN 0.096 8.366 8.270 -0.000 0.000 0.436 172 V N 1.599 121.516 119.914 0.006 0.000 2.295 172 V HA -0.204 3.893 4.120 -0.039 0.000 0.246 172 V C 2.236 178.332 176.094 0.004 0.000 1.049 172 V CA 1.722 64.025 62.300 0.004 0.000 1.024 172 V CB -0.362 31.469 31.823 0.014 0.000 0.648 172 V HN 0.242 8.432 8.190 -0.000 0.000 0.447 173 E N -0.135 120.070 120.200 0.009 0.000 2.110 173 E HA -0.225 4.102 4.350 -0.039 0.000 0.193 173 E C 2.161 178.761 176.600 0.000 0.000 0.988 173 E CA 1.250 57.653 56.400 0.006 0.000 0.804 173 E CB -0.303 29.404 29.700 0.011 0.000 0.745 173 E HN 0.722 9.082 8.360 -0.000 0.000 0.458 174 E N 1.071 121.271 120.200 0.001 0.000 2.051 174 E HA -0.209 4.118 4.350 -0.039 0.000 0.192 174 E C 2.106 178.703 176.600 -0.005 0.000 0.991 174 E CA 1.205 57.605 56.400 -0.002 0.000 0.799 174 E CB 0.039 29.738 29.700 -0.001 0.000 0.748 174 E HN 0.077 8.437 8.360 -0.000 0.000 0.449 175 K N 0.128 120.525 120.400 -0.006 0.000 2.057 175 K HA -0.149 4.147 4.320 -0.039 0.000 0.207 175 K C 2.051 178.643 176.600 -0.013 0.000 1.049 175 K CA 1.185 57.466 56.287 -0.010 0.000 0.931 175 K CB -0.193 32.300 32.500 -0.011 0.000 0.714 175 K HN 0.143 8.393 8.250 -0.000 0.000 0.440 176 A N 1.486 124.298 122.820 -0.014 0.000 1.908 176 A HA -0.193 4.104 4.320 -0.039 0.000 0.218 176 A C 2.179 179.753 177.584 -0.018 0.000 1.181 176 A CA 1.528 53.553 52.037 -0.020 0.000 0.627 176 A CB -0.555 18.433 19.000 -0.020 0.000 0.818 176 A HN 0.341 8.491 8.150 -0.000 0.000 0.445 177 R N -0.594 119.898 120.500 -0.012 0.000 2.070 177 R HA -0.059 4.258 4.340 -0.039 0.000 0.232 177 R C 2.085 178.379 176.300 -0.010 0.000 1.138 177 R CA 1.701 57.795 56.100 -0.010 0.000 0.936 177 R CB -0.507 29.789 30.300 -0.006 0.000 0.839 177 R HN 0.550 8.820 8.270 -0.000 0.000 0.429 178 L N 0.254 121.472 121.223 -0.009 0.000 2.261 178 L HA -0.156 4.161 4.340 -0.039 0.000 0.216 178 L C 1.296 178.159 176.870 -0.011 0.000 1.114 178 L CA 1.358 56.193 54.840 -0.009 0.000 0.777 178 L CB -0.184 41.871 42.059 -0.008 0.000 0.910 178 L HN 0.265 8.495 8.230 -0.000 0.000 0.440 179 E N -0.653 119.539 120.200 -0.014 0.000 2.538 179 E HA 0.279 4.606 4.350 -0.039 0.000 0.207 179 E C 0.847 177.436 176.600 -0.019 0.000 1.002 179 E CA 0.365 56.755 56.400 -0.016 0.000 0.952 179 E CB 0.636 30.325 29.700 -0.018 0.000 1.031 179 E HN 0.305 8.665 8.360 -0.000 0.000 0.476 180 A N 2.206 125.014 122.820 -0.019 0.000 2.783 180 A HA -0.233 4.064 4.320 -0.039 0.000 0.292 180 A C 0.035 177.600 177.584 -0.031 0.000 1.495 180 A CA 0.639 52.663 52.037 -0.022 0.000 0.787 180 A CB -1.273 17.716 19.000 -0.018 0.000 1.017 180 A HN 0.152 8.302 8.150 -0.000 0.000 0.516 181 R N 0.028 120.506 120.500 -0.036 0.000 2.401 181 R HA 0.284 4.601 4.340 -0.039 0.000 0.299 181 R C 0.559 176.819 176.300 -0.066 0.000 1.064 181 R CA 0.405 56.474 56.100 -0.052 0.000 1.000 181 R CB 0.269 30.537 30.300 -0.054 0.000 0.973 181 R HN 0.718 8.988 8.270 -0.000 0.000 0.438 182 D N 0.784 121.133 120.400 -0.086 0.000 2.469 182 D HA 0.086 4.703 4.640 -0.039 0.000 0.213 182 D C -0.116 176.079 176.300 -0.175 0.000 1.135 182 D CA -0.236 53.703 54.000 -0.100 0.000 0.834 182 D CB 0.245 41.000 40.800 -0.074 0.000 1.009 182 D HN 0.188 8.558 8.370 -0.000 0.000 0.507 183 L N 1.011 122.099 121.223 -0.225 0.000 2.491 183 L HA 0.475 4.792 4.340 -0.039 0.000 0.267 183 L C -1.760 174.914 176.870 -0.327 0.000 0.971 183 L CA -0.726 53.875 54.840 -0.399 0.000 0.857 183 L CB 1.570 43.321 42.059 -0.513 0.000 1.226 183 L HN -0.021 8.209 8.230 -0.000 0.000 0.408 184 I N 5.997 126.376 120.570 -0.319 0.000 2.354 184 I HA 0.388 4.535 4.170 -0.039 0.000 0.292 184 I C -0.779 175.240 176.117 -0.163 0.000 0.989 184 I CA -0.573 60.621 61.300 -0.177 0.000 1.188 184 I CB 1.419 39.373 38.000 -0.077 0.000 1.342 184 I HN 0.454 8.664 8.210 -0.000 0.000 0.457 185 L N 7.225 128.393 121.223 -0.092 0.000 2.316 185 L HA 0.454 4.771 4.340 -0.039 0.000 0.280 185 L C -0.577 176.303 176.870 0.018 0.000 1.006 185 L CA -0.805 54.031 54.840 -0.006 0.000 0.836 185 L CB 1.720 43.769 42.059 -0.016 0.000 1.221 185 L HN 0.291 8.521 8.230 -0.000 0.000 0.418 186 V N 1.333 121.279 119.914 0.054 0.000 2.334 186 V HA 0.124 4.221 4.120 -0.039 0.000 0.267 186 V C -0.102 175.922 176.094 -0.117 0.000 1.040 186 V CA -0.465 61.785 62.300 -0.084 0.000 0.866 186 V CB 1.214 32.869 31.823 -0.279 0.000 1.019 186 V HN 0.614 8.804 8.190 -0.000 0.000 0.468 187 D N 4.680 125.029 120.400 -0.085 0.000 2.374 187 D HA 0.200 4.817 4.640 -0.039 0.000 0.240 187 D C 0.941 177.177 176.300 -0.107 0.000 1.229 187 D CA 0.017 53.978 54.000 -0.065 0.000 0.895 187 D CB 0.783 41.562 40.800 -0.036 0.000 1.046 187 D HN 0.726 9.096 8.370 -0.000 0.000 0.498 188 T N 0.668 115.144 114.554 -0.130 0.000 2.698 188 T HA 0.474 4.801 4.350 -0.039 0.000 0.295 188 T C 0.646 175.324 174.700 -0.037 0.000 1.007 188 T CA -0.760 61.266 62.100 -0.124 0.000 0.980 188 T CB 0.730 69.536 68.868 -0.104 0.000 1.036 188 T HN 0.387 8.627 8.240 -0.000 0.000 0.526 189 A N 0.087 122.901 122.820 -0.011 0.000 2.477 189 A HA 0.580 4.876 4.320 -0.039 0.000 0.246 189 A C 0.698 178.316 177.584 0.057 0.000 1.078 189 A CA -0.143 51.903 52.037 0.016 0.000 0.770 189 A CB -0.607 18.402 19.000 0.015 0.000 1.011 189 A HN 1.279 9.429 8.150 -0.000 0.000 0.494 190 G N 2.185 111.013 108.800 0.047 0.000 2.513 190 G HA2 0.615 4.552 3.960 -0.039 0.000 0.317 190 G HA3 0.615 4.552 3.960 -0.039 0.000 0.317 190 G C -0.546 174.387 174.900 0.056 0.000 1.277 190 G CA -0.628 44.514 45.100 0.070 0.000 0.955 190 G HN 0.622 8.912 8.290 -0.000 0.000 0.484 191 R N 1.648 122.191 120.500 0.071 0.000 2.867 191 R HA 0.386 4.703 4.340 -0.039 0.000 0.268 191 R C 1.265 177.595 176.300 0.049 0.000 1.014 191 R CA -1.084 55.044 56.100 0.046 0.000 0.946 191 R CB 1.561 31.882 30.300 0.035 0.000 1.208 191 R HN 0.447 8.717 8.270 -0.000 0.000 0.477 192 L N 0.738 121.981 121.223 0.032 0.000 2.261 192 L HA -0.187 4.129 4.340 -0.039 0.000 0.216 192 L C 0.700 177.590 176.870 0.035 0.000 1.114 192 L CA 1.544 56.402 54.840 0.030 0.000 0.777 192 L CB -0.177 41.893 42.059 0.018 0.000 0.910 192 L HN 0.462 8.692 8.230 -0.000 0.000 0.440 193 Q N -1.003 118.817 119.800 0.033 0.000 2.482 193 Q HA 0.341 4.658 4.340 -0.039 0.000 0.286 193 Q C -0.674 175.333 176.000 0.013 0.000 1.007 193 Q CA -0.887 54.932 55.803 0.028 0.000 0.801 193 Q CB 2.005 30.750 28.738 0.012 0.000 1.455 193 Q HN -0.070 8.200 8.270 -0.000 0.000 0.398 194 I N 1.627 122.189 120.570 -0.013 0.000 2.821 194 I HA -0.110 4.037 4.170 -0.039 0.000 0.294 194 I C -0.134 175.942 176.117 -0.069 0.000 1.210 194 I CA 0.789 62.040 61.300 -0.083 0.000 1.430 194 I CB -0.081 37.834 38.000 -0.142 0.000 1.356 194 I HN 0.628 8.838 8.210 -0.000 0.000 0.563 195 D N 5.792 126.147 120.400 -0.075 0.000 2.414 195 D HA 0.164 4.780 4.640 -0.039 0.000 0.232 195 D C 0.867 177.126 176.300 -0.068 0.000 1.070 195 D CA -0.391 53.578 54.000 -0.051 0.000 0.839 195 D CB 1.136 41.919 40.800 -0.027 0.000 1.079 195 D HN 0.302 8.672 8.370 -0.000 0.000 0.521 196 E N 3.387 123.551 120.200 -0.059 0.000 2.049 196 E HA -0.122 4.205 4.350 -0.039 0.000 0.198 196 E C -0.892 175.682 176.600 -0.043 0.000 1.007 196 E CA 1.373 57.739 56.400 -0.057 0.000 0.809 196 E CB -1.096 28.579 29.700 -0.042 0.000 0.749 196 E HN 0.510 8.870 8.360 -0.000 0.000 0.450 197 P HA -0.110 4.310 4.420 -0.000 0.000 0.215 197 P C 1.600 178.891 177.300 -0.015 0.000 1.157 197 P CA 0.957 64.046 63.100 -0.018 0.000 0.863 197 P CB -0.019 31.673 31.700 -0.013 0.000 0.787 198 L N -1.845 119.367 121.223 -0.018 0.000 2.083 198 L HA -0.175 4.142 4.340 -0.039 0.000 0.209 198 L C 2.421 179.284 176.870 -0.012 0.000 1.083 198 L CA 1.363 56.198 54.840 -0.009 0.000 0.752 198 L CB -0.662 41.395 42.059 -0.004 0.000 0.899 198 L HN 0.020 8.250 8.230 -0.000 0.000 0.433 199 M N -0.541 119.030 119.600 -0.049 0.000 2.108 199 M HA -0.148 4.309 4.480 -0.039 0.000 0.261 199 M C 2.295 178.585 176.300 -0.018 0.000 1.066 199 M CA 1.890 57.148 55.300 -0.069 0.000 1.107 199 M CB -1.761 30.761 32.600 -0.131 0.000 1.356 199 M HN 0.278 8.568 8.290 -0.000 0.000 0.406 200 G N -0.446 108.345 108.800 -0.014 0.000 2.404 200 G HA2 -0.200 3.736 3.960 -0.039 0.000 0.215 200 G HA3 -0.200 3.736 3.960 -0.039 0.000 0.215 200 G C 1.502 176.415 174.900 0.022 0.000 1.174 200 G CA 0.597 45.699 45.100 0.003 0.000 0.780 200 G HN 0.507 8.797 8.290 -0.000 0.000 0.537 201 E N -0.367 119.845 120.200 0.020 0.000 2.118 201 E HA -0.124 4.203 4.350 -0.039 0.000 0.195 201 E C 2.379 179.014 176.600 0.057 0.000 0.992 201 E CA 0.661 57.080 56.400 0.031 0.000 0.804 201 E CB -0.142 29.569 29.700 0.019 0.000 0.741 201 E HN 0.324 8.684 8.360 -0.000 0.000 0.458 202 L N 1.015 122.278 121.223 0.067 0.000 1.994 202 L HA -0.115 4.202 4.340 -0.039 0.000 0.208 202 L C 2.227 179.201 176.870 0.174 0.000 1.071 202 L CA 2.220 57.135 54.840 0.125 0.000 0.745 202 L CB -0.957 41.183 42.059 0.136 0.000 0.892 202 L HN 0.018 8.248 8.230 -0.000 0.000 0.431 203 A N -0.572 122.317 122.820 0.116 0.000 1.940 203 A HA -0.251 4.046 4.320 -0.039 0.000 0.219 203 A C 2.423 180.066 177.584 0.099 0.000 1.176 203 A CA 1.807 53.904 52.037 0.101 0.000 0.631 203 A CB -0.608 18.424 19.000 0.054 0.000 0.814 203 A HN 0.473 8.623 8.150 -0.000 0.000 0.446 204 R N -0.249 120.301 120.500 0.085 0.000 2.073 204 R HA -0.083 4.233 4.340 -0.039 0.000 0.234 204 R C 1.897 178.262 176.300 0.108 0.000 1.134 204 R CA 1.779 57.924 56.100 0.074 0.000 0.952 204 R CB -1.147 29.186 30.300 0.054 0.000 0.850 204 R HN 0.438 8.708 8.270 -0.000 0.000 0.433 205 L N 1.047 122.358 121.223 0.147 0.000 2.042 205 L HA -0.128 4.189 4.340 -0.039 0.000 0.210 205 L C 2.184 179.262 176.870 0.346 0.000 1.076 205 L CA 2.379 57.344 54.840 0.208 0.000 0.749 205 L CB -0.636 41.523 42.059 0.167 0.000 0.893 205 L HN 0.312 8.542 8.230 -0.000 0.000 0.432 206 K N -0.428 120.187 120.400 0.359 0.000 2.097 206 K HA -0.214 4.083 4.320 -0.039 0.000 0.206 206 K C 2.009 178.625 176.600 0.028 0.000 1.049 206 K CA 1.837 58.192 56.287 0.112 0.000 0.933 206 K CB -0.292 32.218 32.500 0.018 0.000 0.717 206 K HN 0.472 8.722 8.250 -0.000 0.000 0.442 207 E N -0.107 120.130 120.200 0.062 0.000 2.085 207 E HA -0.165 4.162 4.350 -0.039 0.000 0.194 207 E C 1.872 178.497 176.600 0.042 0.000 0.994 207 E CA 1.599 58.020 56.400 0.036 0.000 0.801 207 E CB 0.100 29.824 29.700 0.039 0.000 0.743 207 E HN 0.174 8.534 8.360 -0.000 0.000 0.453 208 V N 0.668 120.625 119.914 0.072 0.000 2.407 208 V HA -0.180 3.916 4.120 -0.039 0.000 0.245 208 V C 2.088 178.228 176.094 0.076 0.000 1.041 208 V CA 1.256 63.597 62.300 0.068 0.000 1.040 208 V CB -0.183 31.685 31.823 0.074 0.000 0.671 208 V HN 0.255 8.445 8.190 -0.000 0.000 0.455 209 L N 0.163 121.458 121.223 0.120 0.000 2.477 209 L HA 0.343 4.659 4.340 -0.039 0.000 0.220 209 L C 1.526 178.427 176.870 0.052 0.000 1.106 209 L CA 0.700 55.619 54.840 0.130 0.000 0.851 209 L CB -0.514 41.717 42.059 0.286 0.000 0.994 209 L HN 0.515 8.745 8.230 -0.000 0.000 0.462 210 G N 2.274 111.061 108.800 -0.022 0.000 2.372 210 G HA2 -0.204 3.732 3.960 -0.039 0.000 0.290 210 G HA3 -0.204 3.732 3.960 -0.039 0.000 0.290 210 G C -2.158 172.676 174.900 -0.110 0.000 0.965 210 G CA -0.519 44.534 45.100 -0.079 0.000 1.263 210 G HN 0.173 8.463 8.290 -0.000 0.000 0.498 211 P HA 0.187 4.607 4.420 -0.000 0.000 0.269 211 P C 0.374 177.626 177.300 -0.080 0.000 1.209 211 P CA -0.167 62.818 63.100 -0.193 0.000 0.776 211 P CB 0.837 32.188 31.700 -0.582 0.000 0.876 212 D N 0.437 120.880 120.400 0.073 0.000 2.323 212 D HA 0.006 4.623 4.640 -0.039 0.000 0.209 212 D C 0.288 176.563 176.300 -0.041 0.000 0.973 212 D CA 1.004 55.035 54.000 0.051 0.000 0.874 212 D CB 0.535 41.422 40.800 0.146 0.000 0.930 212 D HN 0.444 8.814 8.370 -0.000 0.000 0.521 213 E N 0.356 120.513 120.200 -0.071 0.000 2.331 213 E HA 0.410 4.736 4.350 -0.039 0.000 0.275 213 E C -1.082 175.473 176.600 -0.075 0.000 0.895 213 E CA -0.766 55.501 56.400 -0.222 0.000 0.753 213 E CB 3.452 32.701 29.700 -0.753 0.000 1.216 213 E HN -0.236 8.124 8.360 -0.000 0.000 0.434 214 V N 3.344 123.229 119.914 -0.049 0.000 2.385 214 V HA 0.299 4.396 4.120 -0.039 0.000 0.277 214 V C -0.375 175.742 176.094 0.038 0.000 1.012 214 V CA -0.545 61.776 62.300 0.035 0.000 0.832 214 V CB 0.794 32.617 31.823 -0.000 0.000 1.028 214 V HN 0.438 8.628 8.190 -0.000 0.000 0.436 215 L N 5.430 126.703 121.223 0.083 0.000 2.257 215 L HA 0.526 4.843 4.340 -0.039 0.000 0.290 215 L C -0.281 176.582 176.870 -0.013 0.000 1.044 215 L CA -0.584 54.286 54.840 0.049 0.000 0.810 215 L CB 1.301 43.436 42.059 0.127 0.000 1.193 215 L HN 0.456 8.686 8.230 -0.000 0.000 0.425 216 L N 5.394 126.563 121.223 -0.090 0.000 2.281 216 L HA 0.361 4.678 4.340 -0.039 0.000 0.285 216 L C -0.242 176.536 176.870 -0.154 0.000 1.074 216 L CA 0.055 54.773 54.840 -0.202 0.000 0.817 216 L CB 1.279 43.192 42.059 -0.243 0.000 1.168 216 L HN 0.285 8.515 8.230 -0.000 0.000 0.434 217 V N 6.990 126.809 119.914 -0.159 0.000 2.406 217 V HA 0.363 4.460 4.120 -0.039 0.000 0.272 217 V C 0.148 176.178 176.094 -0.107 0.000 1.043 217 V CA -0.370 61.872 62.300 -0.096 0.000 0.915 217 V CB 0.877 32.663 31.823 -0.062 0.000 0.988 217 V HN 0.616 8.806 8.190 -0.000 0.000 0.466 218 L N 3.797 124.973 121.223 -0.078 0.000 2.356 218 L HA 0.506 4.822 4.340 -0.039 0.000 0.277 218 L C -0.209 176.636 176.870 -0.041 0.000 0.996 218 L CA -0.647 54.156 54.840 -0.062 0.000 0.822 218 L CB 1.986 44.006 42.059 -0.064 0.000 1.256 218 L HN 0.506 8.736 8.230 -0.000 0.000 0.413 219 D N 2.430 122.812 120.400 -0.030 0.000 2.346 219 D HA 0.147 4.764 4.640 -0.039 0.000 0.260 219 D C 0.927 177.211 176.300 -0.028 0.000 1.252 219 D CA 0.102 54.087 54.000 -0.024 0.000 0.895 219 D CB 1.915 42.705 40.800 -0.017 0.000 1.097 219 D HN 0.647 9.017 8.370 -0.000 0.000 0.489 220 A N 4.900 127.700 122.820 -0.033 0.000 2.125 220 A HA -0.148 4.149 4.320 -0.039 0.000 0.219 220 A C 2.060 179.607 177.584 -0.060 0.000 1.156 220 A CA 0.895 52.907 52.037 -0.042 0.000 0.671 220 A CB -0.364 18.608 19.000 -0.046 0.000 0.794 220 A HN 0.744 8.894 8.150 -0.000 0.000 0.459 221 M N 0.082 119.648 119.600 -0.057 0.000 2.619 221 M HA -0.041 4.415 4.480 -0.039 0.000 0.251 221 M C 1.411 177.688 176.300 -0.039 0.000 1.106 221 M CA 1.395 56.659 55.300 -0.060 0.000 1.086 221 M CB -0.506 32.062 32.600 -0.053 0.000 1.465 221 M HN 0.553 8.843 8.290 -0.000 0.000 0.506 222 T N -2.062 112.477 114.554 -0.026 0.000 3.278 222 T HA 0.437 4.763 4.350 -0.039 0.000 0.251 222 T C 1.163 175.858 174.700 -0.009 0.000 1.039 222 T CA 0.088 62.180 62.100 -0.014 0.000 0.935 222 T CB -0.469 68.396 68.868 -0.005 0.000 1.034 222 T HN 0.530 8.770 8.240 -0.000 0.000 0.575 223 G N 2.242 111.033 108.800 -0.015 0.000 2.627 223 G HA2 -0.372 3.565 3.960 -0.039 0.000 0.312 223 G HA3 -0.372 3.565 3.960 -0.039 0.000 0.312 223 G C 0.811 175.715 174.900 0.006 0.000 1.299 223 G CA 0.501 45.598 45.100 -0.005 0.000 0.989 223 G HN 0.378 8.668 8.290 -0.000 0.000 0.547 224 Q N -0.109 119.698 119.800 0.011 0.000 2.297 224 Q HA -0.088 4.229 4.340 -0.039 0.000 0.208 224 Q C 2.478 178.489 176.000 0.017 0.000 0.981 224 Q CA 2.051 57.865 55.803 0.018 0.000 0.876 224 Q CB -0.297 28.453 28.738 0.019 0.000 0.921 224 Q HN 0.719 8.989 8.270 -0.000 0.000 0.446 225 E N 0.551 120.759 120.200 0.013 0.000 2.077 225 E HA -0.116 4.211 4.350 -0.039 0.000 0.193 225 E C 1.766 178.377 176.600 0.020 0.000 0.989 225 E CA 1.299 57.709 56.400 0.016 0.000 0.800 225 E CB -0.301 29.407 29.700 0.013 0.000 0.746 225 E HN 0.271 8.631 8.360 -0.000 0.000 0.452 226 A N 0.686 123.515 122.820 0.014 0.000 1.915 226 A HA -0.242 4.055 4.320 -0.039 0.000 0.220 226 A C 2.243 179.837 177.584 0.017 0.000 1.198 226 A CA 2.075 54.119 52.037 0.011 0.000 0.647 226 A CB -1.018 17.980 19.000 -0.003 0.000 0.825 226 A HN 0.380 8.530 8.150 -0.000 0.000 0.456 227 L N 0.449 121.681 121.223 0.015 0.000 2.376 227 L HA -0.078 4.239 4.340 -0.039 0.000 0.219 227 L C 2.631 179.517 176.870 0.027 0.000 1.133 227 L CA 1.120 55.969 54.840 0.015 0.000 0.816 227 L CB -0.512 41.554 42.059 0.013 0.000 0.933 227 L HN 0.557 8.787 8.230 -0.000 0.000 0.449 228 S N -1.134 114.585 115.700 0.032 0.000 2.481 228 S HA -0.063 4.384 4.470 -0.039 0.000 0.231 228 S C 1.773 176.404 174.600 0.052 0.000 0.996 228 S CA 0.531 58.751 58.200 0.033 0.000 0.942 228 S CB -0.270 62.946 63.200 0.026 0.000 0.768 228 S HN 0.195 8.505 8.310 -0.000 0.000 0.520 229 V N 1.329 121.291 119.914 0.080 0.000 3.129 229 V HA 0.188 4.285 4.120 -0.039 0.000 0.259 229 V C 2.760 178.997 176.094 0.239 0.000 1.116 229 V CA 1.019 63.411 62.300 0.153 0.000 1.127 229 V CB -0.583 31.353 31.823 0.189 0.000 0.742 229 V HN 0.636 8.826 8.190 -0.000 0.000 0.474 230 A N 0.352 123.257 122.820 0.141 0.000 1.930 230 A HA -0.214 4.082 4.320 -0.039 0.000 0.217 230 A C 2.229 179.885 177.584 0.119 0.000 1.175 230 A CA 1.880 53.992 52.037 0.125 0.000 0.627 230 A CB -0.446 18.573 19.000 0.032 0.000 0.815 230 A HN 0.476 8.626 8.150 -0.000 0.000 0.443 231 R N 0.191 120.733 120.500 0.069 0.000 2.096 231 R HA -0.020 4.297 4.340 -0.039 0.000 0.235 231 R C 2.108 178.432 176.300 0.039 0.000 1.127 231 R CA 1.826 57.949 56.100 0.038 0.000 0.968 231 R CB -0.694 29.613 30.300 0.012 0.000 0.861 231 R HN 0.395 8.665 8.270 -0.000 0.000 0.440 232 A N -0.358 122.482 122.820 0.034 0.000 1.855 232 A HA -0.090 4.207 4.320 -0.039 0.000 0.215 232 A C 2.079 179.632 177.584 -0.052 0.000 1.191 232 A CA 1.403 53.414 52.037 -0.042 0.000 0.613 232 A CB -0.881 18.052 19.000 -0.113 0.000 0.829 232 A HN 0.361 8.511 8.150 -0.000 0.000 0.442 233 F N 0.326 120.278 119.950 0.004 0.000 2.069 233 F HA -0.219 4.282 4.527 -0.045 0.000 0.298 233 F C 2.251 178.056 175.800 0.008 0.000 1.113 233 F CA 2.073 60.081 58.000 0.013 0.000 1.214 233 F CB -0.473 38.537 39.000 0.016 0.000 0.978 233 F HN 0.289 8.589 8.300 -0.000 0.000 0.474 234 D N 0.080 120.595 120.400 0.190 0.000 2.092 234 D HA -0.229 4.387 4.640 -0.039 0.000 0.193 234 D C 2.160 178.491 176.300 0.051 0.000 0.994 234 D CA 1.605 55.660 54.000 0.093 0.000 0.828 234 D CB -0.302 40.528 40.800 0.050 0.000 0.963 234 D HN 0.415 8.785 8.370 -0.000 0.000 0.450 235 E N -0.256 119.962 120.200 0.031 0.000 2.058 235 E HA -0.168 4.158 4.350 -0.039 0.000 0.194 235 E C 1.720 178.321 176.600 0.001 0.000 0.997 235 E CA 1.005 57.408 56.400 0.006 0.000 0.801 235 E CB 0.120 29.816 29.700 -0.008 0.000 0.746 235 E HN 0.106 8.466 8.360 -0.000 0.000 0.450 236 K N -0.578 119.818 120.400 -0.007 0.000 2.393 236 K HA 0.050 4.347 4.320 -0.039 0.000 0.193 236 K C 1.093 177.706 176.600 0.022 0.000 1.026 236 K CA 0.259 56.538 56.287 -0.014 0.000 1.064 236 K CB 1.049 33.512 32.500 -0.061 0.000 0.833 236 K HN 0.090 8.340 8.250 -0.000 0.000 0.521 237 V N -1.617 118.332 119.914 0.058 0.000 3.261 237 V HA 0.226 4.323 4.120 -0.039 0.000 0.212 237 V C 0.169 176.302 176.094 0.065 0.000 1.381 237 V CA 0.152 62.507 62.300 0.091 0.000 1.322 237 V CB 1.184 33.120 31.823 0.188 0.000 1.188 237 V HN 0.229 8.419 8.190 -0.000 0.000 0.520 238 G N 1.277 110.120 108.800 0.071 0.000 3.199 238 G HA2 0.031 3.968 3.960 -0.039 0.000 0.680 238 G HA3 0.031 3.968 3.960 -0.039 0.000 0.680 238 G C -0.968 173.949 174.900 0.027 0.000 1.197 238 G CA -0.298 44.820 45.100 0.031 0.000 1.143 238 G HN 0.432 8.722 8.290 -0.000 0.000 0.492 239 V N 2.489 122.417 119.914 0.022 0.000 2.481 239 V HA 0.699 4.795 4.120 -0.039 0.000 0.286 239 V C 1.563 177.633 176.094 -0.041 0.000 1.042 239 V CA 0.466 62.764 62.300 -0.003 0.000 0.928 239 V CB 1.444 33.262 31.823 -0.009 0.000 0.986 239 V HN 1.196 9.386 8.190 -0.000 0.000 0.462 240 T N 0.542 115.064 114.554 -0.052 0.000 3.039 240 T HA 0.396 4.723 4.350 -0.039 0.000 0.250 240 T C 0.725 175.340 174.700 -0.143 0.000 1.052 240 T CA 0.574 62.637 62.100 -0.062 0.000 1.125 240 T CB 0.474 69.322 68.868 -0.033 0.000 0.908 240 T HN 0.964 9.204 8.240 -0.000 0.000 0.473 241 G N 0.251 108.938 108.800 -0.188 0.000 2.721 241 G HA2 0.666 4.603 3.960 -0.039 0.000 0.296 241 G HA3 0.666 4.603 3.960 -0.039 0.000 0.296 241 G C -2.037 172.691 174.900 -0.286 0.000 1.383 241 G CA -1.094 43.715 45.100 -0.485 0.000 0.788 241 G HN 0.347 8.637 8.290 -0.000 0.000 0.500 242 L N -0.765 120.257 121.223 -0.335 0.000 2.333 242 L HA 0.787 5.103 4.340 -0.039 0.000 0.263 242 L C -0.821 175.986 176.870 -0.105 0.000 1.014 242 L CA -1.235 53.492 54.840 -0.188 0.000 0.820 242 L CB 2.472 44.403 42.059 -0.213 0.000 1.352 242 L HN 0.285 8.515 8.230 -0.000 0.000 0.421 243 V N 2.682 122.564 119.914 -0.053 0.000 2.525 243 V HA 0.398 4.494 4.120 -0.039 0.000 0.299 243 V C -0.428 175.638 176.094 -0.046 0.000 1.034 243 V CA -0.338 61.971 62.300 0.016 0.000 0.863 243 V CB 2.113 33.988 31.823 0.086 0.000 0.999 243 V HN 0.473 8.663 8.190 -0.000 0.000 0.423 244 L N 5.452 126.631 121.223 -0.073 0.000 2.264 244 L HA 0.496 4.813 4.340 -0.039 0.000 0.287 244 L C 0.780 177.649 176.870 -0.003 0.000 1.039 244 L CA -0.177 54.624 54.840 -0.065 0.000 0.829 244 L CB 1.722 43.710 42.059 -0.117 0.000 1.211 244 L HN 0.836 9.066 8.230 -0.000 0.000 0.427 245 T N -0.707 113.845 114.554 -0.003 0.000 2.881 245 T HA 0.338 4.665 4.350 -0.039 0.000 0.278 245 T C 0.501 175.203 174.700 0.003 0.000 0.982 245 T CA -0.685 61.422 62.100 0.012 0.000 0.989 245 T CB 1.164 70.034 68.868 0.003 0.000 1.058 245 T HN 0.607 8.847 8.240 -0.000 0.000 0.529 246 K N 0.019 120.423 120.400 0.007 0.000 3.069 246 K HA -0.141 4.155 4.320 -0.039 0.000 0.267 246 K C 1.036 177.618 176.600 -0.029 0.000 1.082 246 K CA 0.443 56.724 56.287 -0.010 0.000 0.782 246 K CB -1.780 30.706 32.500 -0.023 0.000 1.230 246 K HN 0.579 8.829 8.250 -0.000 0.000 0.488 247 L N 0.723 121.948 121.223 0.004 0.000 2.201 247 L HA -0.177 4.140 4.340 -0.039 0.000 0.212 247 L C 2.256 179.098 176.870 -0.046 0.000 1.105 247 L CA 1.845 56.678 54.840 -0.011 0.000 0.775 247 L CB -0.448 41.696 42.059 0.142 0.000 0.913 247 L HN 0.438 8.668 8.230 -0.000 0.000 0.440 248 D N -0.744 119.656 120.400 -0.000 0.000 2.371 248 D HA -0.103 4.514 4.640 -0.039 0.000 0.221 248 D C 1.546 177.827 176.300 -0.031 0.000 0.986 248 D CA 1.102 55.103 54.000 0.002 0.000 0.899 248 D CB 0.021 40.834 40.800 0.022 0.000 0.902 248 D HN 0.274 8.644 8.370 -0.000 0.000 0.530 249 G N 0.047 108.813 108.800 -0.058 0.000 3.377 249 G HA2 -0.024 3.913 3.960 -0.039 0.000 0.257 249 G HA3 -0.024 3.913 3.960 -0.039 0.000 0.257 249 G C -0.091 174.741 174.900 -0.113 0.000 1.038 249 G CA -0.364 44.698 45.100 -0.064 0.000 0.809 249 G HN 0.033 8.323 8.290 -0.000 0.000 0.526 250 D N 2.202 122.488 120.400 -0.191 0.000 2.416 250 D HA 0.455 5.072 4.640 -0.039 0.000 0.240 250 D C 0.614 176.701 176.300 -0.354 0.000 1.250 250 D CA -0.099 53.704 54.000 -0.328 0.000 0.967 250 D CB 0.388 40.839 40.800 -0.581 0.000 1.059 250 D HN 0.226 8.596 8.370 -0.000 0.000 0.512 251 A N 4.123 126.823 122.820 -0.200 0.000 2.363 251 A HA 0.665 4.962 4.320 -0.039 0.000 0.270 251 A C 0.954 178.458 177.584 -0.134 0.000 1.121 251 A CA -0.175 51.785 52.037 -0.130 0.000 0.800 251 A CB 0.432 19.389 19.000 -0.072 0.000 1.052 251 A HN 0.806 8.956 8.150 -0.000 0.000 0.493 252 R N 0.814 121.268 120.500 -0.076 0.000 3.694 252 R HA -0.180 4.137 4.340 -0.039 0.000 0.137 252 R C 1.077 177.398 176.300 0.034 0.000 0.662 252 R CA 1.295 57.386 56.100 -0.015 0.000 1.054 252 R CB -1.683 28.601 30.300 -0.026 0.000 0.853 252 R HN 2.445 10.715 8.270 -0.000 0.000 0.612 253 G N -0.911 107.883 108.800 -0.010 0.000 2.173 253 G HA2 -0.054 3.883 3.960 -0.039 0.000 0.142 253 G HA3 -0.054 3.883 3.960 -0.039 0.000 0.142 253 G C 0.652 175.704 174.900 0.254 0.000 1.019 253 G CA 0.680 45.876 45.100 0.160 0.000 0.699 253 G HN 0.938 9.228 8.290 -0.000 0.000 0.495 254 G N 0.919 109.784 108.800 0.108 0.000 2.442 254 G HA2 0.154 4.091 3.960 -0.039 0.000 0.219 254 G HA3 0.154 4.091 3.960 -0.039 0.000 0.219 254 G C 1.992 176.938 174.900 0.078 0.000 1.141 254 G CA 2.628 47.773 45.100 0.075 0.000 0.763 254 G HN 1.546 9.836 8.290 -0.000 0.000 0.554 255 A N 1.393 124.253 122.820 0.067 0.000 1.851 255 A HA 0.166 4.462 4.320 -0.039 0.000 0.216 255 A C 2.864 180.487 177.584 0.065 0.000 1.195 255 A CA 2.668 54.735 52.037 0.049 0.000 0.622 255 A CB -1.051 17.961 19.000 0.021 0.000 0.831 255 A HN 0.922 9.072 8.150 -0.000 0.000 0.444 256 A N -0.894 122.001 122.820 0.125 0.000 1.972 256 A HA 0.033 4.330 4.320 -0.039 0.000 0.219 256 A C 2.103 179.761 177.584 0.123 0.000 1.169 256 A CA 1.492 53.609 52.037 0.134 0.000 0.635 256 A CB -0.512 18.680 19.000 0.320 0.000 0.810 256 A HN 0.474 8.624 8.150 -0.000 0.000 0.446 257 L N -0.616 120.688 121.223 0.135 0.000 2.341 257 L HA -0.015 4.302 4.340 -0.039 0.000 0.214 257 L C 2.053 178.968 176.870 0.075 0.000 1.115 257 L CA 1.032 55.925 54.840 0.087 0.000 0.820 257 L CB 0.093 42.184 42.059 0.052 0.000 0.944 257 L HN 0.300 8.530 8.230 -0.000 0.000 0.452 258 S N -0.701 115.044 115.700 0.074 0.000 2.511 258 S HA 0.191 4.638 4.470 -0.039 0.000 0.214 258 S C 2.092 176.748 174.600 0.093 0.000 0.997 258 S CA 0.374 58.629 58.200 0.092 0.000 0.908 258 S CB 0.402 63.651 63.200 0.083 0.000 0.803 258 S HN 0.356 8.666 8.310 -0.000 0.000 0.504 259 A N 3.420 126.266 122.820 0.043 0.000 1.859 259 A HA -0.251 4.046 4.320 -0.039 0.000 0.218 259 A C 2.091 179.672 177.584 -0.006 0.000 1.209 259 A CA 2.054 54.089 52.037 -0.003 0.000 0.639 259 A CB -0.792 18.173 19.000 -0.058 0.000 0.835 259 A HN 0.456 8.606 8.150 -0.000 0.000 0.450 260 R N -1.359 119.144 120.500 0.006 0.000 2.159 260 R HA -0.242 4.075 4.340 -0.039 0.000 0.237 260 R C 2.040 178.359 176.300 0.031 0.000 1.131 260 R CA 2.241 58.342 56.100 0.002 0.000 0.982 260 R CB -0.451 29.861 30.300 0.020 0.000 0.868 260 R HN 0.806 9.076 8.270 -0.000 0.000 0.453 261 H N -0.406 118.658 119.070 -0.009 0.000 2.399 261 H HA 0.057 4.593 4.556 -0.034 0.000 0.300 261 H C 1.843 177.167 175.328 -0.006 0.000 1.048 261 H CA 1.581 57.628 56.048 -0.002 0.000 1.370 261 H CB 0.096 29.866 29.762 0.012 0.000 1.428 261 H HN 0.000 8.280 8.280 -0.000 0.000 0.534 262 V N 0.135 120.017 119.914 -0.053 0.000 2.323 262 V HA -0.187 3.910 4.120 -0.039 0.000 0.244 262 V C 2.613 178.642 176.094 -0.109 0.000 1.041 262 V CA 2.138 64.379 62.300 -0.097 0.000 1.025 262 V CB -0.801 31.031 31.823 0.014 0.000 0.656 262 V HN 0.783 8.973 8.190 -0.000 0.000 0.451 263 T N -2.672 111.838 114.554 -0.074 0.000 3.031 263 T HA 0.245 4.572 4.350 -0.039 0.000 0.254 263 T C 1.709 176.359 174.700 -0.084 0.000 1.060 263 T CA 1.313 63.371 62.100 -0.071 0.000 1.135 263 T CB 0.458 69.287 68.868 -0.065 0.000 0.896 263 T HN 1.062 9.302 8.240 -0.000 0.000 0.472 264 G N 1.737 110.484 108.800 -0.088 0.000 2.179 264 G HA2 -0.202 3.735 3.960 -0.039 0.000 0.260 264 G HA3 -0.202 3.735 3.960 -0.039 0.000 0.260 264 G C 0.006 174.854 174.900 -0.088 0.000 0.977 264 G CA 0.322 45.373 45.100 -0.081 0.000 0.641 264 G HN 0.705 8.995 8.290 -0.000 0.000 0.533 265 K N 0.805 121.139 120.400 -0.110 0.000 2.156 265 K HA 0.591 4.887 4.320 -0.039 0.000 0.250 265 K C -2.586 173.891 176.600 -0.206 0.000 0.955 265 K CA -1.883 54.308 56.287 -0.160 0.000 0.855 265 K CB 2.379 34.775 32.500 -0.174 0.000 1.101 265 K HN 0.164 8.414 8.250 -0.000 0.000 0.434 266 P HA 0.385 4.805 4.420 -0.000 0.000 0.286 266 P C -0.460 176.556 177.300 -0.474 0.000 1.261 266 P CA -0.556 62.351 63.100 -0.322 0.000 0.821 266 P CB 0.729 32.248 31.700 -0.302 0.000 1.013 267 I N 3.234 123.595 120.570 -0.348 0.000 2.301 267 I HA 0.095 4.241 4.170 -0.039 0.000 0.292 267 I C 1.024 177.011 176.117 -0.218 0.000 1.046 267 I CA -0.329 60.720 61.300 -0.419 0.000 1.282 267 I CB 0.369 37.872 38.000 -0.827 0.000 1.409 267 I HN 0.304 8.514 8.210 -0.000 0.000 0.484 268 Y N 5.652 125.856 120.300 -0.161 0.000 2.269 268 Y HA 0.165 4.681 4.550 -0.057 0.000 0.294 268 Y C 0.518 176.104 175.900 -0.524 0.000 1.120 268 Y CA 0.435 58.354 58.100 -0.301 0.000 1.159 268 Y CB -0.176 38.140 38.460 -0.241 0.000 1.024 268 Y HN 0.280 8.560 8.280 -0.000 0.000 0.532 269 F N -1.390 118.649 119.950 0.148 0.000 2.593 269 F HA 0.715 5.216 4.527 -0.044 0.000 0.320 269 F C -0.187 175.639 175.800 0.044 0.000 1.060 269 F CA -1.601 56.452 58.000 0.087 0.000 0.940 269 F CB 1.486 40.508 39.000 0.038 0.000 1.268 269 F HN -0.270 8.030 8.300 -0.000 0.000 0.475 270 A N 0.451 123.457 122.820 0.309 0.000 2.414 270 A HA 0.756 5.052 4.320 -0.039 0.000 0.306 270 A C -0.562 177.129 177.584 0.179 0.000 1.054 270 A CA -0.651 51.521 52.037 0.225 0.000 0.724 270 A CB 1.174 20.392 19.000 0.363 0.000 1.267 270 A HN 0.965 9.115 8.150 -0.000 0.000 0.418 271 G N 0.242 109.113 108.800 0.119 0.000 2.329 271 G HA2 0.517 4.453 3.960 -0.039 0.000 0.309 271 G HA3 0.517 4.453 3.960 -0.039 0.000 0.309 271 G C 0.366 175.320 174.900 0.089 0.000 1.110 271 G CA 0.266 45.416 45.100 0.084 0.000 0.923 271 G HN 1.684 9.974 8.290 -0.000 0.000 0.430 272 V N -0.120 119.847 119.914 0.087 0.000 3.432 272 V HA 0.562 4.659 4.120 -0.039 0.000 0.298 272 V C 0.532 176.660 176.094 0.058 0.000 1.464 272 V CA 0.525 62.876 62.300 0.085 0.000 1.046 272 V CB -0.604 31.283 31.823 0.107 0.000 0.887 272 V HN 1.048 9.238 8.190 -0.000 0.000 0.441 273 S N -0.200 115.528 115.700 0.046 0.000 2.595 273 S HA 0.337 4.784 4.470 -0.039 0.000 0.270 273 S C 0.272 174.888 174.600 0.027 0.000 1.145 273 S CA 0.195 58.415 58.200 0.034 0.000 0.825 273 S CB 1.535 64.756 63.200 0.035 0.000 1.107 273 S HN 0.422 8.732 8.310 -0.000 0.000 0.461 274 E N 0.580 120.792 120.200 0.020 0.000 2.502 274 E HA 0.102 4.429 4.350 -0.039 0.000 0.194 274 E C -0.218 176.393 176.600 0.018 0.000 1.062 274 E CA 0.093 56.502 56.400 0.016 0.000 0.867 274 E CB -0.058 29.649 29.700 0.011 0.000 0.888 274 E HN 0.316 8.676 8.360 -0.000 0.000 0.510 275 K N 1.970 122.383 120.400 0.022 0.000 2.258 275 K HA 0.159 4.456 4.320 -0.039 0.000 0.264 275 K C -1.667 174.949 176.600 0.026 0.000 1.007 275 K CA -2.809 53.492 56.287 0.023 0.000 0.941 275 K CB 0.302 32.818 32.500 0.026 0.000 0.966 275 K HN -0.164 8.086 8.250 -0.000 0.000 0.480 276 P HA -0.202 4.218 4.420 -0.000 0.000 0.217 276 P C 0.597 177.921 177.300 0.040 0.000 1.151 276 P CA 1.407 64.523 63.100 0.027 0.000 0.849 276 P CB 0.268 31.982 31.700 0.024 0.000 0.787 277 E N -0.631 119.597 120.200 0.047 0.000 2.489 277 E HA 0.059 4.386 4.350 -0.039 0.000 0.193 277 E C 1.862 178.504 176.600 0.070 0.000 1.057 277 E CA 0.680 57.121 56.400 0.068 0.000 0.866 277 E CB -1.359 28.381 29.700 0.066 0.000 0.916 277 E HN 0.160 8.520 8.360 -0.000 0.000 0.500 278 G N 1.488 110.320 108.800 0.053 0.000 2.501 278 G HA2 -0.162 3.775 3.960 -0.039 0.000 0.220 278 G HA3 -0.162 3.775 3.960 -0.039 0.000 0.220 278 G C 0.619 175.558 174.900 0.065 0.000 1.114 278 G CA 0.261 45.394 45.100 0.055 0.000 0.757 278 G HN 0.287 8.577 8.290 -0.000 0.000 0.559 279 L N 1.316 122.572 121.223 0.054 0.000 2.276 279 L HA 0.482 4.798 4.340 -0.039 0.000 0.286 279 L C -0.013 176.887 176.870 0.050 0.000 1.061 279 L CA -0.710 54.157 54.840 0.045 0.000 0.807 279 L CB 1.064 43.104 42.059 -0.032 0.000 1.177 279 L HN 0.418 8.648 8.230 -0.000 0.000 0.429 280 E N 4.663 124.940 120.200 0.128 0.000 2.408 280 E HA 0.586 4.912 4.350 -0.039 0.000 0.275 280 E C -2.892 173.831 176.600 0.206 0.000 0.935 280 E CA -2.534 53.937 56.400 0.118 0.000 0.775 280 E CB 1.198 30.976 29.700 0.129 0.000 1.277 280 E HN 0.228 8.588 8.360 -0.000 0.000 0.455 281 P HA -0.014 4.406 4.420 -0.000 0.000 0.267 281 P C -1.016 176.366 177.300 0.138 0.000 1.200 281 P CA -0.014 63.007 63.100 -0.131 0.000 0.772 281 P CB 0.143 31.814 31.700 -0.049 0.000 0.855 282 F N 3.488 123.360 119.950 -0.131 0.000 2.438 282 F HA 0.302 4.806 4.527 -0.038 0.000 0.356 282 F C -0.546 175.203 175.800 -0.086 0.000 1.099 282 F CA -0.146 57.841 58.000 -0.022 0.000 1.185 282 F CB 0.133 39.100 39.000 -0.055 0.000 1.115 282 F HN 0.227 8.527 8.300 -0.000 0.000 0.526 283 Y N 8.244 128.187 120.300 -0.596 0.000 2.575 283 Y HA 0.317 4.849 4.550 -0.031 0.000 0.326 283 Y C -1.785 173.671 175.900 -0.740 0.000 0.979 283 Y CA -2.164 55.649 58.100 -0.478 0.000 1.286 283 Y CB 0.958 39.271 38.460 -0.244 0.000 1.093 283 Y HN 0.477 8.757 8.280 -0.000 0.000 0.501 284 P HA -0.205 4.215 4.420 -0.000 0.000 0.215 284 P C 1.037 178.183 177.300 -0.256 0.000 1.153 284 P CA 1.777 64.592 63.100 -0.475 0.000 0.853 284 P CB 0.375 31.954 31.700 -0.202 0.000 0.788 285 E N -0.140 119.978 120.200 -0.137 0.000 2.077 285 E HA -0.199 4.128 4.350 -0.039 0.000 0.193 285 E C 2.200 178.833 176.600 0.055 0.000 0.989 285 E CA 0.926 57.313 56.400 -0.023 0.000 0.800 285 E CB -0.719 29.033 29.700 0.087 0.000 0.746 285 E HN 0.048 8.408 8.360 -0.000 0.000 0.452 286 R N 0.061 120.580 120.500 0.032 0.000 2.075 286 R HA -0.056 4.260 4.340 -0.039 0.000 0.232 286 R C 2.274 178.555 176.300 -0.031 0.000 1.126 286 R CA 1.016 57.119 56.100 0.006 0.000 0.963 286 R CB -0.361 29.915 30.300 -0.041 0.000 0.858 286 R HN 0.252 8.522 8.270 -0.000 0.000 0.435 287 L N 0.220 121.371 121.223 -0.120 0.000 2.131 287 L HA -0.017 4.299 4.340 -0.039 0.000 0.210 287 L C 1.961 178.758 176.870 -0.122 0.000 1.092 287 L CA 2.001 56.758 54.840 -0.139 0.000 0.759 287 L CB -0.674 41.251 42.059 -0.224 0.000 0.903 287 L HN 0.216 8.446 8.230 -0.000 0.000 0.435 288 A N -0.621 122.143 122.820 -0.093 0.000 1.873 288 A HA -0.001 4.296 4.320 -0.039 0.000 0.215 288 A C 2.353 180.029 177.584 0.153 0.000 1.186 288 A CA 1.346 53.353 52.037 -0.050 0.000 0.616 288 A CB -1.520 17.326 19.000 -0.256 0.000 0.823 288 A HN 0.480 8.630 8.150 -0.000 0.000 0.442 289 G N -0.554 108.420 108.800 0.291 0.000 2.422 289 G HA2 -0.226 3.710 3.960 -0.039 0.000 0.218 289 G HA3 -0.226 3.710 3.960 -0.039 0.000 0.218 289 G C 1.768 176.718 174.900 0.084 0.000 1.146 289 G CA 0.995 46.229 45.100 0.224 0.000 0.769 289 G HN 0.564 8.854 8.290 -0.000 0.000 0.547 290 R N -0.158 120.370 120.500 0.047 0.000 2.066 290 R HA 0.090 4.407 4.340 -0.039 0.000 0.232 290 R C 2.566 178.882 176.300 0.027 0.000 1.131 290 R CA 1.049 57.165 56.100 0.026 0.000 0.955 290 R CB -0.396 29.916 30.300 0.020 0.000 0.851 290 R HN 0.371 8.641 8.270 -0.000 0.000 0.432 291 I N 0.811 121.380 120.570 -0.001 0.000 2.264 291 I HA -0.264 3.883 4.170 -0.039 0.000 0.248 291 I C 1.552 177.689 176.117 0.034 0.000 1.111 291 I CA 1.263 62.559 61.300 -0.006 0.000 1.382 291 I CB -0.104 37.844 38.000 -0.087 0.000 1.060 291 I HN 0.148 8.358 8.210 -0.000 0.000 0.418 292 L N 0.431 121.689 121.223 0.058 0.000 2.627 292 L HA 0.203 4.520 4.340 -0.039 0.000 0.232 292 L C 1.670 178.563 176.870 0.038 0.000 1.150 292 L CA 0.433 55.311 54.840 0.063 0.000 0.917 292 L CB -0.520 41.601 42.059 0.104 0.000 1.104 292 L HN 0.494 8.724 8.230 -0.000 0.000 0.445 293 G N -0.030 108.789 108.800 0.032 0.000 2.257 293 G HA2 -0.355 3.581 3.960 -0.039 0.000 0.267 293 G HA3 -0.355 3.581 3.960 -0.039 0.000 0.267 293 G C 0.541 175.444 174.900 0.006 0.000 0.984 293 G CA 0.627 45.739 45.100 0.020 0.000 0.626 293 G HN 0.345 8.635 8.290 -0.000 0.000 0.540 294 M N 0.000 119.598 119.600 -0.004 0.000 2.572 294 M HA 0.000 4.457 4.480 -0.039 0.000 0.227 294 M CA 0.000 55.281 55.300 -0.031 0.000 0.988 294 M CB 0.000 32.553 32.600 -0.078 0.000 1.302 294 M HN 0.000 8.290 8.290 -0.000 0.000 0.411