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 3fsx_1_D DATA FIRST_RESID 4 DATA SEQUENCE VTGAAGIGLA TLAADGSVLD TWFPAPELTE SGTSATSRLA VSDVPVELAA DATA SEQUENCE LIGRDDDRRT ETIAVRTVIG SLDDVAADPY DAYLRLHLLS HRLVAPHGLN DATA SEQUENCE AGGLFGVLTN VVWTNHGPCA IDGFEAVRAR LRRRGPVTVY GVDKFPRMVD DATA SEQUENCE YVVPTGVRIA DADRVRLGAH LAPGTTVMHE GFVNYNAGTL GASMVEGRIS DATA SEQUENCE AGVVVGDGSD VGGGASIMGT LSGGGTHVIS IGKRCLLGAN SGLGISLGDD DATA SEQUENCE CVVEAGLYVT AGTRVTMPDS NSVKARELSG SSNLLFRRNS VSGAVEVLAR DATA SEQUENCE DGQGIAL VARS RESID RESNAME ATOMNAME SS_SHIFT SHIFT RC_SHIFT HM_SHIFT EF_SHIFT SIGMA FORMAT %4d %4s %4s %9.3f %9.3f %9.3f %9.3f %9.3f %9.3f 4 V HA 0.000 4.120 4.120 -0.000 0.000 0.244 4 V C 0.000 176.093 176.094 -0.001 0.000 1.182 4 V CA 0.000 62.301 62.300 0.001 0.000 1.235 4 V CB 0.000 31.825 31.823 0.003 0.000 1.184 5 T N 1.531 116.084 114.554 -0.002 0.000 2.829 5 T HA 0.842 5.192 4.350 -0.000 0.000 0.280 5 T C 0.379 175.073 174.700 -0.010 0.000 0.999 5 T CA 0.162 62.258 62.100 -0.006 0.000 0.983 5 T CB 1.606 70.472 68.868 -0.004 0.000 0.968 5 T HN 1.444 9.684 8.240 -0.000 0.000 0.446 6 G N 0.856 109.646 108.800 -0.017 0.000 2.795 6 G HA2 0.867 4.827 3.960 -0.000 0.000 0.267 6 G HA3 0.867 4.827 3.960 -0.000 0.000 0.267 6 G C -1.089 173.788 174.900 -0.039 0.000 1.362 6 G CA -0.595 44.490 45.100 -0.025 0.000 1.048 6 G HN 1.012 9.302 8.290 -0.000 0.000 0.547 7 A N -2.450 120.336 122.820 -0.057 0.000 2.599 7 A HA 0.993 5.313 4.320 -0.000 0.000 0.290 7 A C -0.767 176.750 177.584 -0.111 0.000 1.101 7 A CA 0.062 52.047 52.037 -0.086 0.000 0.674 7 A CB 1.239 20.179 19.000 -0.100 0.000 1.277 7 A HN 2.394 10.544 8.150 -0.000 0.000 0.419 8 A N -0.975 121.755 122.820 -0.150 0.000 2.608 8 A HA 0.928 5.248 4.320 -0.000 0.000 0.292 8 A C -0.380 177.077 177.584 -0.212 0.000 1.066 8 A CA 0.047 51.989 52.037 -0.159 0.000 0.676 8 A CB 1.122 20.065 19.000 -0.095 0.000 1.277 8 A HN 2.616 10.765 8.150 -0.000 0.000 0.413 9 G N -0.068 108.616 108.800 -0.193 0.000 2.702 9 G HA2 0.559 4.519 3.960 -0.000 0.000 0.296 9 G HA3 0.559 4.519 3.960 -0.000 0.000 0.296 9 G C -1.326 173.645 174.900 0.117 0.000 1.463 9 G CA -0.576 44.449 45.100 -0.125 0.000 0.890 9 G HN 0.750 9.040 8.290 -0.000 0.000 0.534 10 I N 1.403 122.034 120.570 0.101 0.000 2.371 10 I HA 0.548 4.718 4.170 -0.000 0.000 0.290 10 I C 0.992 177.127 176.117 0.031 0.000 1.028 10 I CA 0.016 61.347 61.300 0.053 0.000 1.345 10 I CB 1.497 39.472 38.000 -0.040 0.000 1.407 10 I HN 0.590 8.800 8.210 -0.000 0.000 0.501 11 G N 5.815 114.535 108.800 -0.133 0.000 2.658 11 G HA2 0.664 4.624 3.960 -0.000 0.000 0.292 11 G HA3 0.664 4.624 3.960 -0.000 0.000 0.292 11 G C -1.863 172.829 174.900 -0.346 0.000 1.320 11 G CA -0.575 44.196 45.100 -0.550 0.000 0.933 11 G HN 0.378 8.668 8.290 -0.000 0.000 0.476 12 L N 1.198 122.238 121.223 -0.304 0.000 2.316 12 L HA 0.793 5.133 4.340 -0.000 0.000 0.280 12 L C 0.328 177.164 176.870 -0.057 0.000 1.006 12 L CA -0.557 54.230 54.840 -0.089 0.000 0.836 12 L CB 0.941 43.044 42.059 0.072 0.000 1.221 12 L HN 0.755 8.985 8.230 -0.000 0.000 0.418 13 A N 3.068 125.868 122.820 -0.033 0.000 2.312 13 A HA 0.812 5.132 4.320 -0.000 0.000 0.328 13 A C -0.274 177.322 177.584 0.021 0.000 1.158 13 A CA -0.422 51.617 52.037 0.003 0.000 0.821 13 A CB 0.703 19.806 19.000 0.172 0.000 1.170 13 A HN 0.650 8.800 8.150 -0.000 0.000 0.490 14 T N 2.981 117.530 114.554 -0.008 0.000 2.771 14 T HA 0.546 4.896 4.350 -0.000 0.000 0.281 14 T C -0.286 174.392 174.700 -0.037 0.000 0.982 14 T CA -0.158 61.939 62.100 -0.005 0.000 0.978 14 T CB 0.471 69.340 68.868 0.001 0.000 0.930 14 T HN 0.444 8.684 8.240 -0.000 0.000 0.447 15 L N 2.289 123.501 121.223 -0.019 0.000 2.331 15 L HA 0.752 5.092 4.340 -0.000 0.000 0.275 15 L C 0.781 177.630 176.870 -0.036 0.000 1.022 15 L CA -1.216 53.605 54.840 -0.031 0.000 0.812 15 L CB 1.392 43.451 42.059 0.000 0.000 1.257 15 L HN 0.692 8.922 8.230 -0.000 0.000 0.435 16 A N 1.661 124.451 122.820 -0.050 0.000 2.267 16 A HA 0.571 4.891 4.320 -0.000 0.000 0.271 16 A C 1.188 178.756 177.584 -0.027 0.000 1.131 16 A CA 0.454 52.465 52.037 -0.044 0.000 0.818 16 A CB 0.368 19.333 19.000 -0.059 0.000 1.118 16 A HN 0.911 9.061 8.150 -0.000 0.000 0.501 17 A N -0.341 122.466 122.820 -0.021 0.000 2.019 17 A HA -0.106 4.214 4.320 -0.000 0.000 0.219 17 A C 1.240 178.815 177.584 -0.014 0.000 1.164 17 A CA 2.062 54.090 52.037 -0.015 0.000 0.644 17 A CB -0.663 18.329 19.000 -0.013 0.000 0.805 17 A HN 0.846 8.996 8.150 -0.000 0.000 0.449 18 D N -2.716 117.673 120.400 -0.019 0.000 2.328 18 D HA 0.317 4.957 4.640 -0.000 0.000 0.221 18 D C 1.099 177.389 176.300 -0.016 0.000 1.072 18 D CA 0.779 54.769 54.000 -0.017 0.000 0.850 18 D CB -0.438 40.350 40.800 -0.020 0.000 0.922 18 D HN 0.704 9.074 8.370 -0.000 0.000 0.516 19 G N 0.305 109.095 108.800 -0.017 0.000 2.175 19 G HA2 -0.285 3.675 3.960 -0.000 0.000 0.244 19 G HA3 -0.285 3.675 3.960 -0.000 0.000 0.244 19 G C 0.401 175.285 174.900 -0.027 0.000 0.982 19 G CA 0.265 45.359 45.100 -0.009 0.000 0.641 19 G HN 0.817 9.107 8.290 -0.000 0.000 0.527 20 S N -0.319 115.353 115.700 -0.047 0.000 2.572 20 S HA 0.538 5.008 4.470 -0.000 0.000 0.279 20 S C 0.462 174.995 174.600 -0.110 0.000 1.341 20 S CA -0.088 58.066 58.200 -0.077 0.000 1.043 20 S CB 2.115 65.268 63.200 -0.078 0.000 0.887 20 S HN 1.088 9.398 8.310 -0.000 0.000 0.516 21 V N 4.912 124.721 119.914 -0.173 0.000 2.415 21 V HA 0.091 4.211 4.120 -0.000 0.000 0.267 21 V C 1.247 177.240 176.094 -0.169 0.000 1.042 21 V CA -0.155 62.001 62.300 -0.241 0.000 1.000 21 V CB -0.240 31.270 31.823 -0.523 0.000 1.015 21 V HN 0.919 9.109 8.190 -0.000 0.000 0.478 22 L N 3.159 124.291 121.223 -0.152 0.000 2.068 22 L HA 0.141 4.481 4.340 -0.000 0.000 0.204 22 L C 0.886 177.696 176.870 -0.101 0.000 1.076 22 L CA 1.087 55.834 54.840 -0.154 0.000 0.753 22 L CB -0.039 41.901 42.059 -0.197 0.000 0.910 22 L HN 0.885 9.115 8.230 -0.000 0.000 0.439 23 D N -2.531 117.748 120.400 -0.203 0.000 2.692 23 D HA 0.276 4.916 4.640 -0.000 0.000 0.303 23 D C -0.943 174.992 176.300 -0.608 0.000 1.278 23 D CA -0.377 53.269 54.000 -0.591 0.000 0.852 23 D CB 1.997 42.796 40.800 -0.001 0.000 1.375 23 D HN -0.249 8.121 8.370 -0.000 0.000 0.453 24 T N 0.111 114.132 114.554 -0.889 0.000 3.032 24 T HA 0.385 4.735 4.350 -0.000 0.000 0.312 24 T C -1.838 172.782 174.700 -0.134 0.000 1.078 24 T CA -0.532 61.323 62.100 -0.409 0.000 1.028 24 T CB 1.113 69.735 68.868 -0.411 0.000 1.091 24 T HN 0.472 8.712 8.240 -0.000 0.000 0.457 25 W N 5.283 126.475 121.300 -0.180 0.000 2.349 25 W HA 0.712 5.372 4.660 -0.000 0.000 0.309 25 W C -2.062 174.289 176.519 -0.279 0.000 1.083 25 W CA -2.024 55.398 57.345 0.128 0.000 1.224 25 W CB 0.289 29.863 29.460 0.190 0.000 1.256 25 W HN 0.544 8.724 8.180 -0.000 0.000 0.461 26 F N 9.246 128.972 119.950 -0.373 0.000 2.347 26 F HA 0.299 4.826 4.527 0.000 0.000 0.366 26 F C -1.368 174.149 175.800 -0.473 0.000 1.107 26 F CA -2.137 55.539 58.000 -0.540 0.000 1.058 26 F CB 1.422 40.069 39.000 -0.588 0.000 1.236 26 F HN 0.228 8.528 8.300 -0.000 0.000 0.456 27 P HA -0.100 4.320 4.420 -0.000 0.000 0.217 27 P C 0.121 177.424 177.300 0.005 0.000 1.150 27 P CA 1.012 63.910 63.100 -0.337 0.000 0.832 27 P CB 0.423 31.833 31.700 -0.484 0.000 0.787 28 A N -0.859 121.919 122.820 -0.071 0.000 3.216 28 A HA 0.408 4.728 4.320 -0.000 0.000 0.321 28 A C -2.511 174.995 177.584 -0.129 0.000 1.042 28 A CA -1.154 50.848 52.037 -0.058 0.000 0.838 28 A CB -0.059 18.923 19.000 -0.030 0.000 1.136 28 A HN 0.012 8.162 8.150 -0.000 0.000 0.483 29 P HA 0.385 4.805 4.420 -0.000 0.000 0.274 29 P C -0.567 176.619 177.300 -0.190 0.000 1.231 29 P CA 0.255 63.197 63.100 -0.263 0.000 0.790 29 P CB 0.993 32.483 31.700 -0.350 0.000 0.951 30 E N 0.978 121.087 120.200 -0.152 0.000 2.408 30 E HA 0.506 4.856 4.350 -0.000 0.000 0.275 30 E C -0.783 175.768 176.600 -0.083 0.000 0.935 30 E CA -1.121 55.222 56.400 -0.094 0.000 0.775 30 E CB 1.018 30.679 29.700 -0.064 0.000 1.277 30 E HN 0.206 8.566 8.360 -0.000 0.000 0.455 31 L N 1.281 122.474 121.223 -0.050 0.000 2.418 31 L HA 0.480 4.820 4.340 -0.000 0.000 0.265 31 L C 0.402 177.250 176.870 -0.036 0.000 1.143 31 L CA -0.064 54.753 54.840 -0.040 0.000 0.809 31 L CB 1.029 43.077 42.059 -0.020 0.000 1.124 31 L HN 0.885 9.115 8.230 -0.000 0.000 0.456 32 T N -2.019 112.515 114.554 -0.033 0.000 2.787 32 T HA 0.344 4.694 4.350 -0.000 0.000 0.297 32 T C -0.623 174.065 174.700 -0.021 0.000 1.221 32 T CA -1.006 61.077 62.100 -0.029 0.000 1.006 32 T CB 1.797 70.643 68.868 -0.036 0.000 1.328 32 T HN 0.649 8.889 8.240 -0.000 0.000 0.509 33 E N 1.163 121.353 120.200 -0.017 0.000 2.409 33 E HA 0.393 4.743 4.350 -0.000 0.000 0.257 33 E C 0.397 176.989 176.600 -0.013 0.000 1.150 33 E CA -0.378 56.014 56.400 -0.013 0.000 0.942 33 E CB 0.468 30.161 29.700 -0.011 0.000 0.979 33 E HN 0.876 9.236 8.360 -0.000 0.000 0.447 34 S N 1.357 117.051 115.700 -0.010 0.000 2.599 34 S HA 0.299 4.769 4.470 -0.000 0.000 0.303 34 S C 0.471 175.065 174.600 -0.010 0.000 1.267 34 S CA 0.057 58.252 58.200 -0.008 0.000 1.055 34 S CB 0.240 63.437 63.200 -0.005 0.000 0.790 34 S HN 0.838 9.148 8.310 -0.000 0.000 0.500 35 G N 1.380 110.174 108.800 -0.010 0.000 2.753 35 G HA2 0.600 4.560 3.960 -0.000 0.000 0.303 35 G HA3 0.600 4.560 3.960 -0.000 0.000 0.303 35 G C -1.343 173.551 174.900 -0.009 0.000 1.242 35 G CA -0.628 44.465 45.100 -0.011 0.000 0.810 35 G HN 0.777 9.067 8.290 -0.000 0.000 0.515 36 T N 1.386 115.934 114.554 -0.011 0.000 2.791 36 T HA 0.561 4.911 4.350 -0.000 0.000 0.288 36 T C 0.026 174.721 174.700 -0.008 0.000 0.999 36 T CA -0.130 61.965 62.100 -0.007 0.000 0.952 36 T CB 1.216 70.080 68.868 -0.006 0.000 0.938 36 T HN 0.472 8.712 8.240 -0.000 0.000 0.444 37 S N 2.850 118.548 115.700 -0.002 0.000 2.525 37 S HA 0.548 5.018 4.470 -0.000 0.000 0.285 37 S C 0.235 174.837 174.600 0.004 0.000 1.283 37 S CA -0.506 57.695 58.200 0.002 0.000 1.072 37 S CB 0.167 63.374 63.200 0.012 0.000 0.867 37 S HN 0.993 9.303 8.310 -0.000 0.000 0.492 38 A N 3.206 126.025 122.820 -0.002 0.000 2.590 38 A HA 0.611 4.931 4.320 -0.000 0.000 0.296 38 A C -0.597 176.967 177.584 -0.034 0.000 1.050 38 A CA -0.826 51.206 52.037 -0.009 0.000 0.697 38 A CB 1.104 20.094 19.000 -0.017 0.000 1.277 38 A HN 0.537 8.687 8.150 -0.000 0.000 0.411 39 T N 2.156 116.671 114.554 -0.066 0.000 2.797 39 T HA 0.735 5.085 4.350 -0.000 0.000 0.279 39 T C 0.116 174.706 174.700 -0.183 0.000 0.991 39 T CA 0.168 62.157 62.100 -0.185 0.000 0.979 39 T CB 1.208 69.810 68.868 -0.443 0.000 0.943 39 T HN 1.405 9.645 8.240 -0.000 0.000 0.444 40 S N 2.971 118.570 115.700 -0.168 0.000 2.599 40 S HA 0.649 5.119 4.470 -0.000 0.000 0.294 40 S C -0.588 173.930 174.600 -0.136 0.000 1.094 40 S CA -1.293 56.831 58.200 -0.126 0.000 0.931 40 S CB 1.452 64.607 63.200 -0.076 0.000 1.093 40 S HN 0.508 8.818 8.310 -0.000 0.000 0.488 41 R N 1.177 121.618 120.500 -0.099 0.000 2.347 41 R HA 0.300 4.640 4.340 -0.000 0.000 0.304 41 R C -0.482 175.782 176.300 -0.060 0.000 1.072 41 R CA -0.274 55.779 56.100 -0.079 0.000 0.980 41 R CB 0.234 30.503 30.300 -0.051 0.000 0.986 41 R HN 0.625 8.895 8.270 -0.000 0.000 0.448 42 L N 2.700 123.888 121.223 -0.058 0.000 2.410 42 L HA 0.144 4.484 4.340 -0.000 0.000 0.273 42 L C 0.931 177.781 176.870 -0.033 0.000 1.152 42 L CA -0.230 54.583 54.840 -0.045 0.000 0.855 42 L CB 0.969 43.001 42.059 -0.046 0.000 1.129 42 L HN 0.675 8.905 8.230 -0.000 0.000 0.463 43 A N 3.599 126.403 122.820 -0.028 0.000 2.448 43 A HA 0.160 4.480 4.320 -0.000 0.000 0.239 43 A C 1.348 178.920 177.584 -0.019 0.000 1.080 43 A CA -0.409 51.615 52.037 -0.021 0.000 0.779 43 A CB 0.499 19.488 19.000 -0.018 0.000 1.026 43 A HN 0.630 8.780 8.150 -0.000 0.000 0.499 44 V N 1.868 121.773 119.914 -0.014 0.000 2.250 44 V HA -0.314 3.806 4.120 -0.000 0.000 0.250 44 V C 2.829 178.916 176.094 -0.012 0.000 1.060 44 V CA 3.035 65.328 62.300 -0.012 0.000 1.030 44 V CB -1.050 30.768 31.823 -0.008 0.000 0.643 44 V HN 1.165 9.355 8.190 -0.000 0.000 0.445 45 S N -0.740 114.953 115.700 -0.012 0.000 2.474 45 S HA -0.145 4.325 4.470 -0.000 0.000 0.235 45 S C 1.245 175.836 174.600 -0.014 0.000 0.997 45 S CA 1.304 59.497 58.200 -0.011 0.000 0.949 45 S CB -0.315 62.879 63.200 -0.010 0.000 0.766 45 S HN 0.657 8.967 8.310 -0.000 0.000 0.517 46 D N 1.125 121.514 120.400 -0.018 0.000 2.349 46 D HA 0.229 4.869 4.640 -0.000 0.000 0.214 46 D C -0.216 176.068 176.300 -0.026 0.000 1.063 46 D CA 0.039 54.026 54.000 -0.022 0.000 0.847 46 D CB 0.557 41.342 40.800 -0.025 0.000 0.933 46 D HN 0.265 8.635 8.370 -0.000 0.000 0.513 47 V N 3.076 122.976 119.914 -0.024 0.000 2.455 47 V HA 0.155 4.275 4.120 -0.000 0.000 0.273 47 V C -1.876 174.204 176.094 -0.024 0.000 1.045 47 V CA -1.341 60.943 62.300 -0.027 0.000 0.976 47 V CB 0.833 32.644 31.823 -0.021 0.000 0.993 47 V HN -0.083 8.107 8.190 -0.000 0.000 0.475 48 P HA 0.059 4.479 4.420 -0.000 0.000 0.269 48 P C 1.081 178.373 177.300 -0.013 0.000 1.215 48 P CA -0.206 62.878 63.100 -0.026 0.000 0.780 48 P CB 0.545 32.220 31.700 -0.042 0.000 0.898 49 V N 0.551 120.463 119.914 -0.004 0.000 2.332 49 V HA -0.279 3.841 4.120 -0.000 0.000 0.248 49 V C 1.537 177.641 176.094 0.017 0.000 1.055 49 V CA 1.865 64.169 62.300 0.006 0.000 1.038 49 V CB -1.683 30.146 31.823 0.009 0.000 0.651 49 V HN 0.410 8.600 8.190 -0.000 0.000 0.450 50 E N 1.255 121.467 120.200 0.020 0.000 2.209 50 E HA -0.085 4.265 4.350 -0.000 0.000 0.196 50 E C 2.030 178.663 176.600 0.055 0.000 0.993 50 E CA 1.496 57.924 56.400 0.046 0.000 0.819 50 E CB -0.460 29.273 29.700 0.055 0.000 0.745 50 E HN 0.605 8.965 8.360 -0.000 0.000 0.477 51 L N -0.316 120.920 121.223 0.021 0.000 2.416 51 L HA 0.215 4.555 4.340 -0.000 0.000 0.216 51 L C 2.235 179.123 176.870 0.030 0.000 1.098 51 L CA 0.453 55.308 54.840 0.025 0.000 0.840 51 L CB -0.228 41.809 42.059 -0.038 0.000 0.981 51 L HN 0.159 8.389 8.230 -0.000 0.000 0.462 52 A N 0.651 123.482 122.820 0.018 0.000 1.933 52 A HA -0.136 4.184 4.320 -0.000 0.000 0.218 52 A C 2.425 180.023 177.584 0.024 0.000 1.175 52 A CA 1.584 53.630 52.037 0.015 0.000 0.628 52 A CB -0.470 18.536 19.000 0.009 0.000 0.814 52 A HN 0.352 8.502 8.150 -0.000 0.000 0.444 53 A N -0.799 122.040 122.820 0.032 0.000 2.172 53 A HA 0.158 4.478 4.320 -0.000 0.000 0.216 53 A C 1.790 179.399 177.584 0.042 0.000 1.154 53 A CA 1.147 53.205 52.037 0.034 0.000 0.701 53 A CB -0.421 18.601 19.000 0.037 0.000 0.789 53 A HN 0.486 8.636 8.150 -0.000 0.000 0.465 54 L N -1.062 120.193 121.223 0.054 0.000 2.664 54 L HA 0.324 4.664 4.340 -0.000 0.000 0.233 54 L C 0.193 177.096 176.870 0.055 0.000 1.113 54 L CA -0.214 54.667 54.840 0.068 0.000 0.896 54 L CB 0.035 42.164 42.059 0.117 0.000 1.163 54 L HN 0.205 8.435 8.230 -0.000 0.000 0.497 55 I N 0.564 121.157 120.570 0.039 0.000 2.529 55 I HA 0.393 4.563 4.170 -0.000 0.000 0.284 55 I C 0.720 176.852 176.117 0.025 0.000 1.082 55 I CA 0.200 61.517 61.300 0.029 0.000 1.406 55 I CB 1.090 39.101 38.000 0.017 0.000 1.405 55 I HN 0.075 8.285 8.210 -0.000 0.000 0.548 56 G N 5.648 114.462 108.800 0.023 0.000 2.340 56 G HA2 0.456 4.416 3.960 -0.000 0.000 0.299 56 G HA3 0.456 4.416 3.960 -0.000 0.000 0.299 56 G C -1.595 173.315 174.900 0.017 0.000 1.291 56 G CA -0.956 44.155 45.100 0.019 0.000 0.841 56 G HN 0.474 8.764 8.290 -0.000 0.000 0.500 57 R N 0.218 120.726 120.500 0.013 0.000 2.561 57 R HA 0.471 4.811 4.340 -0.000 0.000 0.297 57 R C -1.751 174.555 176.300 0.009 0.000 0.969 57 R CA -0.860 55.245 56.100 0.010 0.000 0.879 57 R CB 2.537 32.840 30.300 0.005 0.000 1.178 57 R HN 0.439 8.709 8.270 -0.000 0.000 0.445 58 D N 2.087 122.492 120.400 0.008 0.000 2.427 58 D HA 0.093 4.733 4.640 -0.000 0.000 0.226 58 D C -0.121 176.176 176.300 -0.006 0.000 1.076 58 D CA -0.299 53.705 54.000 0.006 0.000 0.849 58 D CB 1.222 42.031 40.800 0.016 0.000 1.052 58 D HN 0.427 8.797 8.370 -0.000 0.000 0.515 59 D N 2.365 122.757 120.400 -0.012 0.000 2.219 59 D HA -0.122 4.518 4.640 -0.000 0.000 0.205 59 D C 0.962 177.241 176.300 -0.034 0.000 0.970 59 D CA 0.773 54.761 54.000 -0.020 0.000 0.851 59 D CB 0.471 41.260 40.800 -0.020 0.000 0.943 59 D HN 0.508 8.878 8.370 -0.000 0.000 0.488 60 D N 0.382 120.756 120.400 -0.043 0.000 2.137 60 D HA -0.027 4.613 4.640 -0.000 0.000 0.202 60 D C 2.000 178.259 176.300 -0.067 0.000 0.970 60 D CA 0.595 54.553 54.000 -0.070 0.000 0.837 60 D CB -0.052 40.688 40.800 -0.100 0.000 0.981 60 D HN 0.145 8.515 8.370 -0.000 0.000 0.475 61 R N 0.037 120.513 120.500 -0.040 0.000 2.240 61 R HA 0.149 4.489 4.340 -0.000 0.000 0.203 61 R C 0.070 176.364 176.300 -0.011 0.000 1.011 61 R CA -0.020 56.071 56.100 -0.015 0.000 1.007 61 R CB 0.291 30.601 30.300 0.018 0.000 0.911 61 R HN -0.059 8.211 8.270 -0.000 0.000 0.468 62 R N 0.834 121.324 120.500 -0.017 0.000 3.336 62 R HA -0.125 4.215 4.340 -0.000 0.000 0.260 62 R C -0.717 175.578 176.300 -0.008 0.000 1.032 62 R CA 1.360 57.452 56.100 -0.014 0.000 0.693 62 R CB -2.976 27.314 30.300 -0.017 0.000 1.134 62 R HN 0.456 8.726 8.270 -0.000 0.000 0.433 63 T N -2.595 111.957 114.554 -0.004 0.000 2.916 63 T HA 0.713 5.063 4.350 -0.000 0.000 0.292 63 T C -0.054 174.648 174.700 0.003 0.000 1.064 63 T CA -1.061 61.038 62.100 -0.003 0.000 1.011 63 T CB 3.066 71.934 68.868 -0.000 0.000 1.152 63 T HN 0.289 8.529 8.240 -0.000 0.000 0.510 64 E N -0.074 120.129 120.200 0.005 0.000 2.343 64 E HA 0.640 4.990 4.350 -0.000 0.000 0.270 64 E C -1.427 175.184 176.600 0.018 0.000 0.895 64 E CA -1.096 55.311 56.400 0.012 0.000 0.767 64 E CB 2.065 31.772 29.700 0.012 0.000 1.248 64 E HN 0.501 8.861 8.360 -0.000 0.000 0.440 65 T N 2.248 116.816 114.554 0.024 0.000 2.812 65 T HA 0.558 4.908 4.350 -0.000 0.000 0.282 65 T C -0.280 174.436 174.700 0.027 0.000 0.990 65 T CA -0.621 61.497 62.100 0.031 0.000 0.960 65 T CB 0.394 69.286 68.868 0.041 0.000 0.948 65 T HN 0.518 8.758 8.240 -0.000 0.000 0.438 66 I N -0.165 120.419 120.570 0.024 0.000 2.828 66 I HA 0.959 5.129 4.170 -0.000 0.000 0.302 66 I C -0.506 175.605 176.117 -0.010 0.000 1.101 66 I CA -1.660 59.647 61.300 0.011 0.000 1.031 66 I CB 2.005 40.016 38.000 0.018 0.000 1.231 66 I HN 0.600 8.810 8.210 -0.000 0.000 0.427 67 A N 4.219 127.023 122.820 -0.027 0.000 2.274 67 A HA 0.798 5.118 4.320 -0.000 0.000 0.309 67 A C -0.210 177.329 177.584 -0.075 0.000 1.226 67 A CA -0.417 51.588 52.037 -0.054 0.000 0.853 67 A CB 0.826 19.800 19.000 -0.044 0.000 1.146 67 A HN 1.224 9.374 8.150 -0.000 0.000 0.518 68 V N 0.422 120.273 119.914 -0.106 0.000 3.102 68 V HA 0.871 4.991 4.120 -0.000 0.000 0.312 68 V C -0.478 175.566 176.094 -0.085 0.000 1.135 68 V CA -1.154 61.064 62.300 -0.137 0.000 1.022 68 V CB 1.823 33.488 31.823 -0.265 0.000 1.056 68 V HN 1.015 9.205 8.190 -0.000 0.000 0.436 69 R N 1.013 121.464 120.500 -0.082 0.000 2.439 69 R HA 0.699 5.039 4.340 -0.000 0.000 0.310 69 R C -0.911 175.367 176.300 -0.037 0.000 0.955 69 R CA -0.115 55.971 56.100 -0.024 0.000 0.853 69 R CB 1.892 32.169 30.300 -0.037 0.000 1.171 69 R HN 0.977 9.247 8.270 -0.000 0.000 0.449 70 T N 3.759 118.338 114.554 0.041 0.000 2.771 70 T HA 0.402 4.752 4.350 -0.000 0.000 0.281 70 T C -0.820 173.848 174.700 -0.054 0.000 0.982 70 T CA -0.463 61.643 62.100 0.010 0.000 0.978 70 T CB 1.475 70.423 68.868 0.134 0.000 0.930 70 T HN 0.263 8.503 8.240 -0.000 0.000 0.447 71 V N 4.676 124.562 119.914 -0.046 0.000 2.555 71 V HA 0.533 4.653 4.120 -0.000 0.000 0.302 71 V C -0.291 175.779 176.094 -0.041 0.000 1.038 71 V CA -0.867 61.400 62.300 -0.054 0.000 0.887 71 V CB 1.876 33.675 31.823 -0.041 0.000 0.991 71 V HN 0.800 8.990 8.190 -0.000 0.000 0.434 72 I N 3.156 123.696 120.570 -0.051 0.000 2.355 72 I HA 0.359 4.529 4.170 -0.000 0.000 0.288 72 I C 1.502 177.604 176.117 -0.024 0.000 0.999 72 I CA -0.152 61.130 61.300 -0.032 0.000 1.163 72 I CB 1.814 39.789 38.000 -0.041 0.000 1.316 72 I HN 0.776 8.986 8.210 -0.000 0.000 0.454 73 G N 3.754 112.546 108.800 -0.013 0.000 2.422 73 G HA2 -0.140 3.820 3.960 -0.000 0.000 0.218 73 G HA3 -0.140 3.820 3.960 -0.000 0.000 0.218 73 G C 0.636 175.531 174.900 -0.008 0.000 1.146 73 G CA 0.573 45.667 45.100 -0.010 0.000 0.769 73 G HN 0.498 8.788 8.290 -0.000 0.000 0.547 74 S N -1.512 114.186 115.700 -0.004 0.000 2.614 74 S HA 0.422 4.892 4.470 -0.000 0.000 0.275 74 S C 0.682 175.284 174.600 0.003 0.000 1.161 74 S CA -0.752 57.448 58.200 0.000 0.000 0.969 74 S CB 1.154 64.357 63.200 0.005 0.000 1.059 74 S HN 0.069 8.379 8.310 -0.000 0.000 0.482 75 L N 2.806 124.031 121.223 0.003 0.000 2.376 75 L HA 0.023 4.363 4.340 -0.000 0.000 0.219 75 L C 1.342 178.224 176.870 0.019 0.000 1.133 75 L CA 0.741 55.585 54.840 0.008 0.000 0.816 75 L CB -0.179 41.883 42.059 0.005 0.000 0.933 75 L HN 0.612 8.842 8.230 -0.000 0.000 0.449 76 D N -0.379 120.033 120.400 0.019 0.000 2.269 76 D HA -0.062 4.578 4.640 -0.000 0.000 0.208 76 D C 0.526 176.842 176.300 0.028 0.000 0.963 76 D CA 0.724 54.739 54.000 0.025 0.000 0.864 76 D CB -0.077 40.735 40.800 0.021 0.000 0.936 76 D HN 0.248 8.618 8.370 -0.000 0.000 0.505 77 D N -0.086 120.328 120.400 0.023 0.000 2.357 77 D HA 0.055 4.694 4.640 -0.000 0.000 0.242 77 D C 0.192 176.511 176.300 0.032 0.000 1.153 77 D CA -0.349 53.667 54.000 0.026 0.000 0.918 77 D CB 1.512 42.325 40.800 0.021 0.000 1.181 77 D HN -0.199 8.171 8.370 -0.000 0.000 0.435 78 V N 0.722 120.658 119.914 0.036 0.000 2.881 78 V HA 0.391 4.511 4.120 -0.000 0.000 0.303 78 V C -0.034 176.082 176.094 0.037 0.000 1.070 78 V CA -0.640 61.685 62.300 0.042 0.000 1.074 78 V CB 1.148 32.998 31.823 0.046 0.000 1.012 78 V HN 0.662 8.852 8.190 -0.000 0.000 0.482 79 A N 5.106 127.948 122.820 0.037 0.000 2.545 79 A HA 0.466 4.786 4.320 -0.000 0.000 0.253 79 A C 1.356 178.961 177.584 0.034 0.000 1.074 79 A CA 0.537 52.594 52.037 0.033 0.000 0.760 79 A CB 0.099 19.112 19.000 0.022 0.000 1.005 79 A HN 1.759 9.909 8.150 -0.000 0.000 0.506 80 A N 2.545 125.391 122.820 0.043 0.000 2.014 80 A HA 0.300 4.620 4.320 -0.000 0.000 0.218 80 A C 0.703 178.316 177.584 0.049 0.000 1.163 80 A CA 1.656 53.721 52.037 0.046 0.000 0.652 80 A CB -0.323 18.709 19.000 0.053 0.000 0.808 80 A HN 1.071 9.221 8.150 -0.000 0.000 0.449 81 D N -5.417 115.018 120.400 0.059 0.000 2.725 81 D HA 0.299 4.939 4.640 -0.000 0.000 0.292 81 D C -2.947 173.375 176.300 0.036 0.000 1.288 81 D CA -1.108 52.923 54.000 0.051 0.000 0.784 81 D CB 0.132 41.002 40.800 0.117 0.000 1.308 81 D HN -0.191 8.179 8.370 -0.000 0.000 0.429 82 P HA -0.013 4.407 4.420 -0.000 0.000 0.221 82 P C 0.875 178.261 177.300 0.143 0.000 1.150 82 P CA 1.067 64.164 63.100 -0.005 0.000 0.800 82 P CB -0.095 31.551 31.700 -0.090 0.000 0.787 83 Y N 0.057 120.469 120.300 0.188 0.000 2.128 83 Y HA -0.218 4.332 4.550 -0.000 0.000 0.284 83 Y C 2.439 178.512 175.900 0.289 0.000 1.154 83 Y CA 1.506 59.763 58.100 0.261 0.000 1.149 83 Y CB -1.458 37.116 38.460 0.191 0.000 0.976 83 Y HN 0.020 8.300 8.280 -0.000 0.000 0.505 84 D N 0.248 120.844 120.400 0.327 0.000 2.092 84 D HA -0.211 4.429 4.640 -0.000 0.000 0.193 84 D C 2.288 178.661 176.300 0.122 0.000 0.994 84 D CA 1.554 55.653 54.000 0.165 0.000 0.828 84 D CB -0.313 40.558 40.800 0.118 0.000 0.963 84 D HN 0.276 8.646 8.370 -0.000 0.000 0.450 85 A N -0.352 122.528 122.820 0.100 0.000 1.892 85 A HA -0.236 4.084 4.320 -0.000 0.000 0.218 85 A C 2.375 179.973 177.584 0.024 0.000 1.188 85 A CA 1.664 53.704 52.037 0.005 0.000 0.631 85 A CB -1.411 17.524 19.000 -0.108 0.000 0.822 85 A HN 0.427 8.577 8.150 -0.000 0.000 0.447 86 Y N -1.099 119.287 120.300 0.144 0.000 2.181 86 Y HA -0.169 4.381 4.550 0.000 0.000 0.288 86 Y C 2.282 178.415 175.900 0.388 0.000 1.146 86 Y CA 1.496 59.767 58.100 0.285 0.000 1.164 86 Y CB -0.277 38.394 38.460 0.351 0.000 0.982 86 Y HN 0.355 8.635 8.280 -0.000 0.000 0.515 87 L N 0.487 121.876 121.223 0.277 0.000 2.046 87 L HA -0.193 4.147 4.340 -0.000 0.000 0.208 87 L C 2.189 179.035 176.870 -0.040 0.000 1.077 87 L CA 1.681 56.355 54.840 -0.277 0.000 0.747 87 L CB -0.608 41.099 42.059 -0.586 0.000 0.896 87 L HN 0.051 8.281 8.230 -0.000 0.000 0.432 88 R N -0.874 119.637 120.500 0.019 0.000 2.083 88 R HA -0.139 4.201 4.340 -0.000 0.000 0.237 88 R C 2.259 178.607 176.300 0.079 0.000 1.137 88 R CA 1.855 57.975 56.100 0.034 0.000 0.951 88 R CB -0.545 29.771 30.300 0.028 0.000 0.851 88 R HN 0.381 8.651 8.270 -0.000 0.000 0.434 89 L N -0.820 120.459 121.223 0.094 0.000 2.046 89 L HA -0.179 4.161 4.340 -0.000 0.000 0.208 89 L C 2.216 179.153 176.870 0.110 0.000 1.077 89 L CA 1.398 56.285 54.840 0.077 0.000 0.747 89 L CB -0.623 41.419 42.059 -0.030 0.000 0.896 89 L HN 0.231 8.461 8.230 -0.000 0.000 0.432 90 H N -0.024 119.125 119.070 0.132 0.000 2.353 90 H HA -0.184 4.372 4.556 -0.000 0.000 0.298 90 H C 2.271 177.695 175.328 0.159 0.000 1.103 90 H CA 1.698 57.873 56.048 0.212 0.000 1.293 90 H CB -0.329 29.553 29.762 0.201 0.000 1.372 90 H HN 0.177 8.457 8.280 -0.000 0.000 0.501 91 L N -0.433 120.889 121.223 0.165 0.000 2.046 91 L HA -0.169 4.171 4.340 -0.000 0.000 0.208 91 L C 2.214 179.173 176.870 0.147 0.000 1.077 91 L CA 0.826 55.725 54.840 0.098 0.000 0.747 91 L CB -0.426 41.652 42.059 0.031 0.000 0.896 91 L HN 0.231 8.461 8.230 -0.000 0.000 0.432 92 L N -0.892 120.414 121.223 0.139 0.000 1.970 92 L HA -0.224 4.116 4.340 -0.000 0.000 0.212 92 L C 2.691 179.661 176.870 0.166 0.000 1.071 92 L CA 1.513 56.450 54.840 0.162 0.000 0.751 92 L CB -0.539 41.592 42.059 0.119 0.000 0.889 92 L HN 0.169 8.399 8.230 -0.000 0.000 0.432 93 S N -1.901 113.871 115.700 0.119 0.000 2.423 93 S HA -0.145 4.325 4.470 -0.000 0.000 0.231 93 S C 1.680 176.292 174.600 0.019 0.000 1.014 93 S CA 0.700 58.925 58.200 0.042 0.000 0.965 93 S CB -0.447 62.759 63.200 0.009 0.000 0.785 93 S HN 0.440 8.750 8.310 -0.000 0.000 0.495 94 H N 0.908 119.995 119.070 0.029 0.000 2.556 94 H HA 0.176 4.732 4.556 -0.000 0.000 0.268 94 H C 0.381 175.705 175.328 -0.006 0.000 0.996 94 H CA 0.372 56.439 56.048 0.031 0.000 1.157 94 H CB 0.141 29.952 29.762 0.081 0.000 1.355 94 H HN 0.286 8.566 8.280 -0.000 0.000 0.597 95 R N -0.717 119.829 120.500 0.077 0.000 3.878 95 R HA -0.188 4.152 4.340 -0.000 0.000 0.330 95 R C 0.972 177.358 176.300 0.143 0.000 1.186 95 R CA 0.352 56.475 56.100 0.037 0.000 0.885 95 R CB -2.003 28.195 30.300 -0.170 0.000 1.377 95 R HN 0.303 8.573 8.270 -0.000 0.000 0.523 96 L N -0.209 121.102 121.223 0.147 0.000 2.313 96 L HA 0.059 4.399 4.340 -0.000 0.000 0.214 96 L C 0.703 177.629 176.870 0.093 0.000 1.119 96 L CA 0.769 55.672 54.840 0.104 0.000 0.809 96 L CB 0.311 42.413 42.059 0.071 0.000 0.933 96 L HN -0.032 8.198 8.230 -0.000 0.000 0.449 97 V N -0.791 119.195 119.914 0.119 0.000 2.841 97 V HA 0.624 4.744 4.120 -0.000 0.000 0.310 97 V C -0.102 176.052 176.094 0.099 0.000 1.090 97 V CA -0.934 61.415 62.300 0.081 0.000 0.930 97 V CB 1.863 33.718 31.823 0.053 0.000 1.014 97 V HN 0.061 8.251 8.190 -0.000 0.000 0.425 98 A N 5.391 128.202 122.820 -0.015 0.000 2.252 98 A HA 0.899 5.219 4.320 -0.000 0.000 0.305 98 A C -2.653 174.796 177.584 -0.226 0.000 1.097 98 A CA -1.721 50.158 52.037 -0.262 0.000 0.849 98 A CB 0.323 19.194 19.000 -0.215 0.000 1.142 98 A HN 0.637 8.787 8.150 -0.000 0.000 0.499 99 P HA 0.138 4.558 4.420 -0.000 0.000 0.267 99 P C -0.270 176.898 177.300 -0.219 0.000 1.200 99 P CA 0.703 63.628 63.100 -0.292 0.000 0.772 99 P CB 0.073 31.581 31.700 -0.319 0.000 0.855 100 H N 0.140 119.185 119.070 -0.041 0.000 3.395 100 H HA -0.162 4.394 4.556 0.000 0.000 0.222 100 H C 1.378 176.697 175.328 -0.016 0.000 1.099 100 H CA 1.365 57.400 56.048 -0.022 0.000 1.182 100 H CB -2.126 27.618 29.762 -0.030 0.000 1.188 100 H HN 0.684 8.964 8.280 -0.000 0.000 0.317 101 G N 0.236 109.049 108.800 0.020 0.000 2.880 101 G HA2 0.356 4.316 3.960 -0.000 0.000 0.209 101 G HA3 0.356 4.316 3.960 -0.000 0.000 0.209 101 G C 0.633 175.547 174.900 0.024 0.000 1.157 101 G CA 0.771 45.884 45.100 0.023 0.000 0.779 101 G HN 0.296 8.586 8.290 -0.000 0.000 0.539 102 L N -3.899 117.338 121.223 0.023 0.000 2.403 102 L HA 0.577 4.917 4.340 -0.000 0.000 0.253 102 L C -0.914 175.983 176.870 0.045 0.000 1.045 102 L CA -1.867 52.991 54.840 0.030 0.000 0.845 102 L CB 0.828 42.901 42.059 0.023 0.000 1.447 102 L HN -0.246 7.984 8.230 -0.000 0.000 0.411 103 N N 0.899 119.629 118.700 0.050 0.000 2.406 103 N HA 0.366 5.106 4.740 -0.000 0.000 0.265 103 N C 0.160 175.715 175.510 0.075 0.000 1.203 103 N CA 0.638 53.727 53.050 0.066 0.000 0.945 103 N CB 1.432 39.953 38.487 0.057 0.000 1.165 103 N HN 0.918 9.298 8.380 -0.000 0.000 0.485 104 A N 2.641 125.522 122.820 0.101 0.000 2.460 104 A HA 0.352 4.672 4.320 -0.000 0.000 0.258 104 A C 1.013 178.708 177.584 0.185 0.000 1.300 104 A CA -0.258 51.867 52.037 0.147 0.000 0.913 104 A CB -0.310 18.813 19.000 0.205 0.000 1.031 104 A HN 0.579 8.729 8.150 -0.000 0.000 0.512 105 G N -2.250 106.635 108.800 0.141 0.000 2.572 105 G HA2 0.461 4.421 3.960 -0.000 0.000 0.261 105 G HA3 0.461 4.421 3.960 -0.000 0.000 0.261 105 G C 1.131 176.109 174.900 0.129 0.000 1.197 105 G CA 0.158 45.343 45.100 0.142 0.000 0.870 105 G HN 1.425 9.715 8.290 -0.000 0.000 0.548 106 G N -0.474 108.412 108.800 0.142 0.000 2.155 106 G HA2 -0.288 3.672 3.960 -0.000 0.000 0.257 106 G HA3 -0.288 3.672 3.960 -0.000 0.000 0.257 106 G C 1.189 176.159 174.900 0.117 0.000 0.983 106 G CA 0.717 45.892 45.100 0.126 0.000 0.676 106 G HN 0.597 8.887 8.290 -0.000 0.000 0.528 107 L N -1.286 120.018 121.223 0.136 0.000 2.131 107 L HA 0.143 4.483 4.340 -0.000 0.000 0.206 107 L C 2.463 179.358 176.870 0.041 0.000 1.087 107 L CA 1.342 56.204 54.840 0.036 0.000 0.767 107 L CB -0.482 41.564 42.059 -0.023 0.000 0.917 107 L HN 0.286 8.516 8.230 -0.000 0.000 0.441 108 F N 1.392 121.386 119.950 0.073 0.000 2.154 108 F HA -0.176 4.352 4.527 0.000 0.000 0.301 108 F C 2.123 177.934 175.800 0.018 0.000 1.087 108 F CA 1.635 59.684 58.000 0.081 0.000 1.274 108 F CB -0.418 38.674 39.000 0.153 0.000 1.009 108 F HN -0.019 8.281 8.300 -0.000 0.000 0.485 109 G N -1.029 107.799 108.800 0.045 0.000 2.572 109 G HA2 -0.064 3.896 3.960 -0.000 0.000 0.216 109 G HA3 -0.064 3.896 3.960 -0.000 0.000 0.216 109 G C 1.526 176.355 174.900 -0.119 0.000 1.133 109 G CA 0.891 45.957 45.100 -0.057 0.000 0.791 109 G HN 0.363 8.653 8.290 -0.000 0.000 0.538 110 V N 0.330 120.178 119.914 -0.109 0.000 2.795 110 V HA 0.299 4.419 4.120 -0.000 0.000 0.243 110 V C 1.310 177.310 176.094 -0.156 0.000 1.069 110 V CA 0.090 62.327 62.300 -0.105 0.000 1.089 110 V CB -0.025 31.762 31.823 -0.060 0.000 0.756 110 V HN 0.157 8.347 8.190 -0.000 0.000 0.471 111 L N 0.726 121.810 121.223 -0.231 0.000 2.439 111 L HA 0.198 4.538 4.340 -0.000 0.000 0.269 111 L C 0.529 177.269 176.870 -0.217 0.000 1.179 111 L CA 0.242 54.931 54.840 -0.251 0.000 0.828 111 L CB 0.596 42.384 42.059 -0.451 0.000 1.106 111 L HN 0.137 8.367 8.230 -0.000 0.000 0.467 112 T N 1.553 116.025 114.554 -0.137 0.000 2.869 112 T HA 0.070 4.420 4.350 -0.000 0.000 0.295 112 T C 0.189 174.815 174.700 -0.124 0.000 0.987 112 T CA -0.449 61.570 62.100 -0.134 0.000 1.109 112 T CB 0.524 69.323 68.868 -0.115 0.000 0.932 112 T HN 0.405 8.645 8.240 -0.000 0.000 0.518 113 N N 2.230 120.851 118.700 -0.132 0.000 2.475 113 N HA 0.235 4.975 4.740 -0.000 0.000 0.267 113 N C -1.103 174.307 175.510 -0.165 0.000 1.169 113 N CA -0.024 52.971 53.050 -0.092 0.000 0.947 113 N CB 0.367 38.810 38.487 -0.074 0.000 1.061 113 N HN 0.301 8.681 8.380 -0.000 0.000 0.466 114 V N 3.351 123.122 119.914 -0.237 0.000 2.656 114 V HA 0.333 4.453 4.120 -0.000 0.000 0.307 114 V C -0.297 175.388 176.094 -0.683 0.000 1.051 114 V CA -0.999 60.942 62.300 -0.599 0.000 0.893 114 V CB 2.044 33.130 31.823 -1.228 0.000 0.999 114 V HN 0.348 8.538 8.190 -0.000 0.000 0.426 115 V N 3.217 122.754 119.914 -0.629 0.000 2.372 115 V HA 0.232 4.352 4.120 -0.000 0.000 0.261 115 V C -0.676 175.113 176.094 -0.509 0.000 1.055 115 V CA -0.401 61.550 62.300 -0.580 0.000 0.930 115 V CB 0.098 31.376 31.823 -0.908 0.000 1.031 115 V HN 0.862 9.052 8.190 -0.000 0.000 0.479 116 W N 4.000 125.270 121.300 -0.050 0.000 2.358 116 W HA 0.558 5.218 4.660 -0.000 0.000 0.307 116 W C 0.834 177.375 176.519 0.037 0.000 1.203 116 W CA -0.387 57.001 57.345 0.071 0.000 1.279 116 W CB 1.053 30.623 29.460 0.182 0.000 1.264 116 W HN 0.639 8.819 8.180 -0.000 0.000 0.474 117 T N -1.073 113.599 114.554 0.197 0.000 2.926 117 T HA 0.207 4.557 4.350 -0.000 0.000 0.289 117 T C 0.961 175.671 174.700 0.015 0.000 1.054 117 T CA -0.964 61.138 62.100 0.003 0.000 1.015 117 T CB 1.345 70.298 68.868 0.142 0.000 1.167 117 T HN 0.458 8.698 8.240 -0.000 0.000 0.526 118 N N 0.020 118.597 118.700 -0.205 0.000 2.609 118 N HA -0.125 4.615 4.740 -0.000 0.000 0.190 118 N C 0.594 175.946 175.510 -0.264 0.000 1.157 118 N CA 0.632 53.615 53.050 -0.111 0.000 0.918 118 N CB -0.612 37.749 38.487 -0.210 0.000 0.978 118 N HN 0.748 9.128 8.380 -0.000 0.000 0.448 119 H N -0.904 118.206 119.070 0.067 0.000 2.592 119 H HA 0.360 4.916 4.556 -0.000 0.000 0.279 119 H C 1.090 176.462 175.328 0.073 0.000 1.089 119 H CA 0.419 56.504 56.048 0.061 0.000 1.150 119 H CB 0.748 30.536 29.762 0.044 0.000 1.575 119 H HN 0.419 8.699 8.280 -0.000 0.000 0.547 120 G N 1.919 110.826 108.800 0.178 0.000 2.498 120 G HA2 -0.171 3.789 3.960 -0.000 0.000 0.651 120 G HA3 -0.171 3.789 3.960 -0.000 0.000 0.651 120 G C -3.006 171.987 174.900 0.156 0.000 1.284 120 G CA -1.204 43.995 45.100 0.164 0.000 0.950 120 G HN -0.055 8.235 8.290 -0.000 0.000 0.511 121 P HA 0.519 4.939 4.420 -0.000 0.000 0.271 121 P C -0.195 177.032 177.300 -0.122 0.000 1.216 121 P CA -0.134 62.887 63.100 -0.131 0.000 0.776 121 P CB 1.036 32.614 31.700 -0.202 0.000 0.881 122 C N 1.733 120.908 119.300 -0.209 0.000 2.889 122 C HA 0.752 5.212 4.460 -0.000 0.000 0.307 122 C C 0.661 175.548 174.990 -0.172 0.000 1.251 122 C CA -0.409 58.561 59.018 -0.081 0.000 1.593 122 C CB 1.824 29.639 27.740 0.125 0.000 2.104 122 C HN 0.669 8.899 8.230 -0.000 0.000 0.476 123 A N 1.540 124.319 122.820 -0.069 0.000 2.313 123 A HA 0.533 4.853 4.320 -0.000 0.000 0.261 123 A C 1.160 178.709 177.584 -0.059 0.000 1.090 123 A CA -0.166 51.817 52.037 -0.090 0.000 0.807 123 A CB 0.143 19.117 19.000 -0.043 0.000 1.055 123 A HN 0.777 8.927 8.150 -0.000 0.000 0.492 124 I N 0.275 120.794 120.570 -0.084 0.000 2.252 124 I HA -0.103 4.067 4.170 -0.000 0.000 0.245 124 I C 0.354 176.502 176.117 0.050 0.000 1.102 124 I CA 0.973 62.248 61.300 -0.042 0.000 1.385 124 I CB -1.249 36.718 38.000 -0.054 0.000 1.064 124 I HN 0.540 8.750 8.210 -0.000 0.000 0.414 125 D N 1.904 122.317 120.400 0.022 0.000 2.487 125 D HA 0.147 4.787 4.640 -0.000 0.000 0.243 125 D C 1.258 177.589 176.300 0.051 0.000 1.154 125 D CA 1.084 55.101 54.000 0.029 0.000 0.876 125 D CB 0.734 41.535 40.800 0.002 0.000 1.161 125 D HN 0.438 8.808 8.370 -0.000 0.000 0.478 126 G N 2.524 111.350 108.800 0.043 0.000 2.179 126 G HA2 -0.371 3.589 3.960 -0.000 0.000 0.257 126 G HA3 -0.371 3.589 3.960 -0.000 0.000 0.257 126 G C 0.587 175.499 174.900 0.021 0.000 1.010 126 G CA 0.361 45.471 45.100 0.017 0.000 0.736 126 G HN 0.569 8.859 8.290 -0.000 0.000 0.513 127 F N 0.718 120.644 119.950 -0.041 0.000 2.234 127 F HA 0.046 4.573 4.527 0.000 0.000 0.299 127 F C 2.328 178.105 175.800 -0.039 0.000 1.087 127 F CA 1.846 59.819 58.000 -0.045 0.000 1.340 127 F CB 0.225 39.197 39.000 -0.046 0.000 1.031 127 F HN 0.218 8.518 8.300 -0.000 0.000 0.500 128 E N 0.532 120.626 120.200 -0.176 0.000 2.150 128 E HA -0.131 4.219 4.350 -0.000 0.000 0.193 128 E C 2.339 178.776 176.600 -0.272 0.000 0.985 128 E CA 1.036 57.296 56.400 -0.233 0.000 0.814 128 E CB -0.683 28.979 29.700 -0.063 0.000 0.752 128 E HN 0.501 8.861 8.360 -0.000 0.000 0.466 129 A N 0.897 123.596 122.820 -0.202 0.000 1.929 129 A HA -0.065 4.255 4.320 -0.000 0.000 0.216 129 A C 2.572 180.019 177.584 -0.229 0.000 1.176 129 A CA 0.858 52.792 52.037 -0.172 0.000 0.628 129 A CB -0.488 18.448 19.000 -0.107 0.000 0.816 129 A HN 0.117 8.267 8.150 -0.000 0.000 0.444 130 V N 0.306 120.042 119.914 -0.296 0.000 2.332 130 V HA -0.272 3.848 4.120 -0.000 0.000 0.248 130 V C 2.668 178.501 176.094 -0.435 0.000 1.055 130 V CA 2.326 64.433 62.300 -0.321 0.000 1.038 130 V CB -0.768 30.883 31.823 -0.287 0.000 0.651 130 V HN 0.666 8.856 8.190 -0.000 0.000 0.450 131 R N 0.162 120.252 120.500 -0.684 0.000 2.073 131 R HA -0.182 4.158 4.340 -0.000 0.000 0.234 131 R C 2.331 178.453 176.300 -0.297 0.000 1.134 131 R CA 1.814 57.574 56.100 -0.566 0.000 0.952 131 R CB -0.495 29.430 30.300 -0.625 0.000 0.850 131 R HN 0.476 8.746 8.270 -0.000 0.000 0.433 132 A N 1.211 123.884 122.820 -0.245 0.000 1.908 132 A HA -0.179 4.141 4.320 -0.000 0.000 0.218 132 A C 2.223 179.719 177.584 -0.147 0.000 1.181 132 A CA 1.502 53.444 52.037 -0.159 0.000 0.627 132 A CB -0.451 18.473 19.000 -0.126 0.000 0.818 132 A HN 0.383 8.533 8.150 -0.000 0.000 0.445 133 R N -0.747 119.655 120.500 -0.163 0.000 2.075 133 R HA 0.029 4.369 4.340 -0.000 0.000 0.232 133 R C 2.034 178.233 176.300 -0.168 0.000 1.126 133 R CA 1.331 57.347 56.100 -0.140 0.000 0.963 133 R CB -0.468 29.753 30.300 -0.131 0.000 0.858 133 R HN 0.495 8.765 8.270 -0.000 0.000 0.435 134 L N 0.289 121.372 121.223 -0.234 0.000 2.201 134 L HA -0.107 4.233 4.340 -0.000 0.000 0.212 134 L C 2.559 179.271 176.870 -0.265 0.000 1.105 134 L CA 0.882 55.516 54.840 -0.344 0.000 0.775 134 L CB -0.322 41.442 42.059 -0.492 0.000 0.913 134 L HN 0.146 8.376 8.230 -0.000 0.000 0.440 135 R N 0.375 120.778 120.500 -0.162 0.000 2.241 135 R HA -0.138 4.202 4.340 -0.000 0.000 0.224 135 R C 2.157 178.422 176.300 -0.058 0.000 1.101 135 R CA 0.889 56.941 56.100 -0.080 0.000 0.995 135 R CB -0.117 30.145 30.300 -0.063 0.000 0.870 135 R HN 0.370 8.640 8.270 -0.000 0.000 0.463 136 R N -0.383 120.071 120.500 -0.076 0.000 2.237 136 R HA -0.065 4.275 4.340 -0.000 0.000 0.219 136 R C 1.972 178.254 176.300 -0.030 0.000 1.080 136 R CA 1.043 57.113 56.100 -0.049 0.000 0.995 136 R CB 0.033 30.300 30.300 -0.055 0.000 0.875 136 R HN 0.162 8.432 8.270 -0.000 0.000 0.462 137 R N -0.705 119.773 120.500 -0.037 0.000 2.210 137 R HA 0.192 4.532 4.340 -0.000 0.000 0.203 137 R C 0.760 177.106 176.300 0.075 0.000 1.010 137 R CA 0.569 56.685 56.100 0.026 0.000 1.008 137 R CB 0.668 31.002 30.300 0.056 0.000 0.923 137 R HN 0.258 8.528 8.270 -0.000 0.000 0.469 138 G N 0.222 109.063 108.800 0.068 0.000 2.350 138 G HA2 -0.034 3.926 3.960 -0.000 0.000 0.282 138 G HA3 -0.034 3.926 3.960 -0.000 0.000 0.282 138 G C -2.929 172.032 174.900 0.101 0.000 1.314 138 G CA -1.319 43.829 45.100 0.079 0.000 0.915 138 G HN -0.215 8.075 8.290 -0.000 0.000 0.499 139 P HA 0.376 4.796 4.420 -0.000 0.000 0.265 139 P C -0.234 177.155 177.300 0.148 0.000 1.187 139 P CA -0.143 63.006 63.100 0.081 0.000 0.766 139 P CB 0.966 32.696 31.700 0.050 0.000 0.820 140 V N 3.880 123.858 119.914 0.107 0.000 2.334 140 V HA 0.285 4.405 4.120 -0.000 0.000 0.281 140 V C 0.206 176.341 176.094 0.068 0.000 1.016 140 V CA -0.081 62.305 62.300 0.143 0.000 0.832 140 V CB 1.349 33.225 31.823 0.089 0.000 0.999 140 V HN 0.484 8.674 8.190 -0.000 0.000 0.439 141 T N 4.678 119.226 114.554 -0.010 0.000 2.779 141 T HA 0.536 4.886 4.350 -0.000 0.000 0.280 141 T C -0.324 174.202 174.700 -0.290 0.000 0.987 141 T CA -0.347 61.668 62.100 -0.142 0.000 0.966 141 T CB 1.673 70.412 68.868 -0.216 0.000 0.933 141 T HN 0.304 8.544 8.240 -0.000 0.000 0.442 142 V N 4.762 124.569 119.914 -0.178 0.000 2.347 142 V HA 0.251 4.371 4.120 -0.000 0.000 0.280 142 V C 0.004 176.029 176.094 -0.115 0.000 1.021 142 V CA -0.499 61.707 62.300 -0.156 0.000 0.847 142 V CB 0.842 32.636 31.823 -0.048 0.000 0.990 142 V HN 0.970 9.160 8.190 -0.000 0.000 0.444 143 Y N 3.344 123.721 120.300 0.128 0.000 2.365 143 Y HA 0.397 4.947 4.550 -0.000 0.000 0.293 143 Y C 1.497 177.475 175.900 0.129 0.000 1.119 143 Y CA 0.665 58.834 58.100 0.116 0.000 1.203 143 Y CB 0.527 39.057 38.460 0.117 0.000 1.026 143 Y HN 0.723 9.003 8.280 -0.000 0.000 0.549 144 G N -1.006 107.988 108.800 0.323 0.000 2.466 144 G HA2 0.454 4.414 3.960 -0.000 0.000 0.291 144 G HA3 0.454 4.414 3.960 -0.000 0.000 0.291 144 G C -2.205 172.893 174.900 0.329 0.000 1.460 144 G CA -0.685 44.592 45.100 0.295 0.000 0.791 144 G HN -0.269 8.021 8.290 -0.000 0.000 0.505 145 V N 1.510 121.577 119.914 0.254 0.000 2.439 145 V HA 0.660 4.780 4.120 -0.000 0.000 0.277 145 V C -1.105 175.124 176.094 0.225 0.000 1.008 145 V CA -0.438 61.950 62.300 0.147 0.000 0.846 145 V CB 1.174 33.006 31.823 0.015 0.000 1.031 145 V HN 0.883 9.073 8.190 -0.000 0.000 0.441 146 D N 2.177 122.794 120.400 0.362 0.000 2.653 146 D HA 0.360 5.000 4.640 -0.000 0.000 0.258 146 D C 0.491 177.052 176.300 0.435 0.000 1.252 146 D CA -0.657 53.574 54.000 0.386 0.000 0.777 146 D CB 2.302 43.348 40.800 0.411 0.000 1.339 146 D HN 0.229 8.599 8.370 -0.000 0.000 0.422 147 K N 0.090 120.662 120.400 0.286 0.000 2.365 147 K HA 0.130 4.450 4.320 -0.000 0.000 0.199 147 K C 0.061 176.592 176.600 -0.116 0.000 1.045 147 K CA 0.769 57.073 56.287 0.029 0.000 0.962 147 K CB 0.143 32.522 32.500 -0.202 0.000 0.759 147 K HN 0.171 8.421 8.250 -0.000 0.000 0.469 148 F N 1.477 121.540 119.950 0.188 0.000 2.467 148 F HA 0.307 4.834 4.527 0.000 0.000 0.336 148 F C -2.035 173.696 175.800 -0.115 0.000 1.123 148 F CA -2.733 55.271 58.000 0.006 0.000 0.964 148 F CB 1.475 40.474 39.000 -0.003 0.000 1.136 148 F HN -0.141 8.159 8.300 -0.000 0.000 0.447 149 P HA 0.407 4.827 4.420 -0.000 0.000 0.321 149 P C -1.053 176.104 177.300 -0.238 0.000 1.304 149 P CA -0.858 61.850 63.100 -0.654 0.000 0.759 149 P CB 1.047 32.146 31.700 -1.001 0.000 1.385 150 R N 0.034 120.407 120.500 -0.211 0.000 2.234 150 R HA 0.294 4.634 4.340 -0.000 0.000 0.324 150 R C 1.624 177.942 176.300 0.029 0.000 1.054 150 R CA -0.288 55.760 56.100 -0.087 0.000 0.912 150 R CB 0.300 30.516 30.300 -0.140 0.000 1.030 150 R HN 0.490 8.760 8.270 -0.000 0.000 0.455 151 M N 3.469 123.073 119.600 0.007 0.000 2.089 151 M HA -0.234 4.246 4.480 -0.000 0.000 0.257 151 M C 1.629 177.972 176.300 0.072 0.000 1.071 151 M CA 2.244 57.565 55.300 0.035 0.000 1.096 151 M CB 0.015 32.596 32.600 -0.031 0.000 1.330 151 M HN 0.583 8.873 8.290 -0.000 0.000 0.403 152 V N -2.719 117.185 119.914 -0.018 0.000 3.078 152 V HA -0.143 3.977 4.120 -0.000 0.000 0.265 152 V C 0.954 176.985 176.094 -0.105 0.000 1.122 152 V CA 1.769 64.033 62.300 -0.061 0.000 1.141 152 V CB -1.132 30.634 31.823 -0.095 0.000 0.735 152 V HN 0.356 8.546 8.190 -0.000 0.000 0.498 153 D N -1.006 119.319 120.400 -0.125 0.000 2.349 153 D HA 0.085 4.725 4.640 -0.000 0.000 0.224 153 D C 1.284 177.173 176.300 -0.684 0.000 1.029 153 D CA 0.919 54.699 54.000 -0.368 0.000 0.879 153 D CB 0.165 40.730 40.800 -0.391 0.000 0.906 153 D HN 0.687 9.057 8.370 -0.000 0.000 0.528 154 Y N -1.123 119.117 120.300 -0.099 0.000 2.701 154 Y HA 0.247 4.797 4.550 0.000 0.000 0.275 154 Y C 0.536 176.553 175.900 0.195 0.000 1.133 154 Y CA -0.249 57.897 58.100 0.076 0.000 1.241 154 Y CB 1.251 39.800 38.460 0.148 0.000 1.389 154 Y HN -0.238 8.042 8.280 -0.000 0.000 0.486 155 V N 0.555 120.580 119.914 0.184 0.000 2.932 155 V HA 0.583 4.703 4.120 -0.000 0.000 0.307 155 V C -1.731 174.336 176.094 -0.044 0.000 1.147 155 V CA -0.926 61.410 62.300 0.060 0.000 0.951 155 V CB 2.191 33.934 31.823 -0.134 0.000 1.031 155 V HN -0.227 7.963 8.190 -0.000 0.000 0.426 156 V N 8.413 128.290 119.914 -0.061 0.000 2.311 156 V HA 0.466 4.586 4.120 -0.000 0.000 0.275 156 V C -1.970 174.065 176.094 -0.099 0.000 1.022 156 V CA -1.292 60.962 62.300 -0.077 0.000 0.830 156 V CB 1.256 33.042 31.823 -0.061 0.000 1.012 156 V HN 0.915 9.105 8.190 -0.000 0.000 0.452 157 P HA 0.237 4.657 4.420 -0.000 0.000 0.271 157 P C 0.134 177.382 177.300 -0.087 0.000 1.218 157 P CA -0.065 62.960 63.100 -0.124 0.000 0.780 157 P CB 0.382 31.996 31.700 -0.143 0.000 0.901 158 T N -2.507 112.004 114.554 -0.072 0.000 2.882 158 T HA 0.455 4.805 4.350 -0.000 0.000 0.287 158 T C 1.089 175.758 174.700 -0.051 0.000 1.014 158 T CA 0.120 62.190 62.100 -0.050 0.000 1.049 158 T CB 0.485 69.332 68.868 -0.033 0.000 1.001 158 T HN 0.845 9.085 8.240 -0.000 0.000 0.525 159 G N 0.159 108.935 108.800 -0.040 0.000 2.143 159 G HA2 -0.148 3.812 3.960 -0.000 0.000 0.248 159 G HA3 -0.148 3.812 3.960 -0.000 0.000 0.248 159 G C -0.072 174.803 174.900 -0.042 0.000 0.991 159 G CA 0.022 45.100 45.100 -0.035 0.000 0.689 159 G HN 1.084 9.374 8.290 -0.000 0.000 0.522 160 V N 0.104 119.988 119.914 -0.049 0.000 2.823 160 V HA 0.765 4.885 4.120 -0.000 0.000 0.312 160 V C 0.317 176.379 176.094 -0.053 0.000 1.072 160 V CA -1.057 61.209 62.300 -0.055 0.000 0.937 160 V CB 1.955 33.734 31.823 -0.072 0.000 1.013 160 V HN 0.359 8.549 8.190 -0.000 0.000 0.430 161 R N 3.487 123.956 120.500 -0.053 0.000 2.670 161 R HA 0.746 5.086 4.340 -0.000 0.000 0.289 161 R C -1.415 174.841 176.300 -0.073 0.000 0.965 161 R CA -0.687 55.378 56.100 -0.058 0.000 0.899 161 R CB 2.376 32.648 30.300 -0.047 0.000 1.173 161 R HN 0.586 8.856 8.270 -0.000 0.000 0.456 162 I N 2.165 122.682 120.570 -0.089 0.000 2.517 162 I HA 0.186 4.356 4.170 -0.000 0.000 0.280 162 I C 0.868 176.894 176.117 -0.151 0.000 1.061 162 I CA -0.314 60.921 61.300 -0.109 0.000 1.091 162 I CB 1.891 39.831 38.000 -0.100 0.000 1.205 162 I HN 0.802 9.012 8.210 -0.000 0.000 0.459 163 A N 3.775 126.460 122.820 -0.224 0.000 1.933 163 A HA -0.143 4.176 4.320 -0.000 0.000 0.218 163 A C 0.905 178.259 177.584 -0.383 0.000 1.175 163 A CA 1.648 53.457 52.037 -0.381 0.000 0.628 163 A CB -0.109 18.432 19.000 -0.765 0.000 0.814 163 A HN 0.689 8.839 8.150 -0.000 0.000 0.444 164 D N -1.700 118.515 120.400 -0.309 0.000 2.421 164 D HA 0.557 5.197 4.640 -0.000 0.000 0.254 164 D C 0.293 176.536 176.300 -0.096 0.000 1.238 164 D CA 0.204 54.105 54.000 -0.164 0.000 0.919 164 D CB 1.186 41.927 40.800 -0.099 0.000 1.152 164 D HN 0.077 8.447 8.370 -0.000 0.000 0.552 165 A N 3.296 126.060 122.820 -0.094 0.000 2.235 165 A HA -0.011 4.309 4.320 -0.000 0.000 0.208 165 A C 1.275 178.819 177.584 -0.067 0.000 1.172 165 A CA 0.299 52.284 52.037 -0.087 0.000 0.786 165 A CB 0.021 18.959 19.000 -0.104 0.000 0.804 165 A HN 0.452 8.602 8.150 -0.000 0.000 0.479 166 D N 0.231 120.605 120.400 -0.043 0.000 2.310 166 D HA -0.069 4.571 4.640 -0.000 0.000 0.212 166 D C 1.366 177.703 176.300 0.061 0.000 0.965 166 D CA 0.647 54.644 54.000 -0.006 0.000 0.879 166 D CB -0.033 40.778 40.800 0.019 0.000 0.921 166 D HN 0.344 8.714 8.370 -0.000 0.000 0.510 167 R N 0.312 120.855 120.500 0.072 0.000 2.427 167 R HA 0.198 4.538 4.340 -0.000 0.000 0.262 167 R C -0.259 176.096 176.300 0.092 0.000 0.943 167 R CA -0.032 56.187 56.100 0.197 0.000 1.081 167 R CB 1.222 31.626 30.300 0.174 0.000 1.166 167 R HN -0.025 8.245 8.270 -0.000 0.000 0.534 168 V N 1.955 121.861 119.914 -0.013 0.000 2.380 168 V HA 0.302 4.422 4.120 -0.000 0.000 0.286 168 V C 0.303 176.348 176.094 -0.080 0.000 1.015 168 V CA -0.845 61.379 62.300 -0.128 0.000 0.834 168 V CB 2.074 33.823 31.823 -0.124 0.000 1.009 168 V HN 0.102 8.292 8.190 -0.000 0.000 0.428 169 R N 2.336 122.778 120.500 -0.096 0.000 2.641 169 R HA 0.329 4.669 4.340 -0.000 0.000 0.269 169 R C -0.170 176.116 176.300 -0.023 0.000 1.074 169 R CA -0.673 55.419 56.100 -0.014 0.000 1.133 169 R CB 0.646 30.962 30.300 0.025 0.000 1.029 169 R HN 0.545 8.815 8.270 -0.000 0.000 0.488 170 L N 1.753 122.969 121.223 -0.011 0.000 2.525 170 L HA 0.096 4.436 4.340 -0.000 0.000 0.278 170 L C 1.140 178.018 176.870 0.013 0.000 1.218 170 L CA 2.090 56.896 54.840 -0.057 0.000 0.878 170 L CB 0.630 42.561 42.059 -0.213 0.000 1.127 170 L HN 0.919 9.149 8.230 -0.000 0.000 0.492 171 G N 2.699 111.507 108.800 0.012 0.000 2.238 171 G HA2 -0.139 3.821 3.960 -0.000 0.000 0.217 171 G HA3 -0.139 3.821 3.960 -0.000 0.000 0.217 171 G C 0.371 175.312 174.900 0.069 0.000 0.996 171 G CA 0.087 45.241 45.100 0.091 0.000 0.632 171 G HN 1.228 9.518 8.290 -0.000 0.000 0.503 172 A N 0.964 123.786 122.820 0.002 0.000 2.425 172 A HA 0.555 4.875 4.320 -0.000 0.000 0.249 172 A C 0.124 177.718 177.584 0.015 0.000 1.084 172 A CA 0.300 52.311 52.037 -0.043 0.000 0.781 172 A CB 0.174 19.098 19.000 -0.127 0.000 1.019 172 A HN 0.864 9.014 8.150 -0.000 0.000 0.490 173 H N 3.563 122.586 119.070 -0.079 0.000 2.638 173 H HA 0.512 5.068 4.556 0.000 0.000 0.303 173 H C -1.689 173.604 175.328 -0.059 0.000 1.034 173 H CA -0.453 55.563 56.048 -0.053 0.000 1.225 173 H CB 0.441 30.176 29.762 -0.044 0.000 1.394 173 H HN 0.542 8.822 8.280 -0.000 0.000 0.477 174 L N 5.033 126.125 121.223 -0.218 0.000 2.316 174 L HA 0.511 4.851 4.340 -0.000 0.000 0.280 174 L C 0.529 177.283 176.870 -0.193 0.000 1.006 174 L CA -0.877 53.884 54.840 -0.132 0.000 0.836 174 L CB 1.515 43.509 42.059 -0.108 0.000 1.221 174 L HN 0.544 8.774 8.230 -0.000 0.000 0.418 175 A N 4.893 127.660 122.820 -0.090 0.000 2.332 175 A HA 0.630 4.950 4.320 -0.000 0.000 0.258 175 A C -2.349 175.201 177.584 -0.056 0.000 1.087 175 A CA -1.308 50.687 52.037 -0.071 0.000 0.802 175 A CB -0.170 18.857 19.000 0.044 0.000 1.042 175 A HN 0.429 8.579 8.150 -0.000 0.000 0.489 176 P HA 0.221 4.641 4.420 -0.000 0.000 0.264 176 P C 0.933 178.219 177.300 -0.023 0.000 1.183 176 P CA 2.132 65.210 63.100 -0.036 0.000 0.763 176 P CB 0.538 32.224 31.700 -0.024 0.000 0.807 177 G N 1.282 110.068 108.800 -0.025 0.000 2.176 177 G HA2 -0.193 3.767 3.960 -0.000 0.000 0.232 177 G HA3 -0.193 3.767 3.960 -0.000 0.000 0.232 177 G C 0.271 175.160 174.900 -0.019 0.000 0.986 177 G CA -0.124 44.965 45.100 -0.018 0.000 0.643 177 G HN 0.586 8.876 8.290 -0.000 0.000 0.522 178 T N 1.880 116.418 114.554 -0.027 0.000 2.869 178 T HA 0.555 4.905 4.350 -0.000 0.000 0.295 178 T C 0.107 174.786 174.700 -0.035 0.000 0.987 178 T CA 0.787 62.870 62.100 -0.029 0.000 1.109 178 T CB 1.488 70.335 68.868 -0.035 0.000 0.932 178 T HN 0.197 8.437 8.240 -0.000 0.000 0.518 179 T N 2.976 117.512 114.554 -0.031 0.000 2.812 179 T HA 0.464 4.814 4.350 -0.000 0.000 0.282 179 T C -0.363 174.315 174.700 -0.037 0.000 0.990 179 T CA -0.534 61.546 62.100 -0.034 0.000 0.960 179 T CB 1.109 69.964 68.868 -0.022 0.000 0.948 179 T HN 0.317 8.557 8.240 -0.000 0.000 0.438 180 V N 5.449 125.332 119.914 -0.052 0.000 2.370 180 V HA 0.432 4.552 4.120 -0.000 0.000 0.279 180 V C 0.158 176.216 176.094 -0.060 0.000 1.029 180 V CA -0.803 61.466 62.300 -0.052 0.000 0.870 180 V CB 1.146 32.928 31.823 -0.069 0.000 0.984 180 V HN 0.779 8.969 8.190 -0.000 0.000 0.451 181 M N 2.520 122.107 119.600 -0.021 0.000 2.363 181 M HA 0.391 4.871 4.480 -0.000 0.000 0.280 181 M C 1.428 177.733 176.300 0.008 0.000 1.182 181 M CA -0.324 54.979 55.300 0.004 0.000 0.974 181 M CB 0.209 32.862 32.600 0.089 0.000 1.452 181 M HN 0.678 8.968 8.290 -0.000 0.000 0.507 182 H N -0.375 118.701 119.070 0.011 0.000 2.422 182 H HA -0.125 4.431 4.556 -0.000 0.000 0.298 182 H C 1.400 176.745 175.328 0.028 0.000 1.098 182 H CA 1.613 57.671 56.048 0.017 0.000 1.315 182 H CB 0.000 29.770 29.762 0.012 0.000 1.382 182 H HN 0.522 8.802 8.280 -0.000 0.000 0.523 183 E N 0.837 121.133 120.200 0.161 0.000 2.447 183 E HA 0.101 4.451 4.350 -0.000 0.000 0.195 183 E C 1.037 177.694 176.600 0.096 0.000 1.028 183 E CA 0.185 56.647 56.400 0.105 0.000 0.876 183 E CB -0.017 29.729 29.700 0.077 0.000 0.885 183 E HN 0.419 8.779 8.360 -0.000 0.000 0.500 184 G N 0.335 109.185 108.800 0.085 0.000 2.554 184 G HA2 0.270 4.230 3.960 -0.000 0.000 0.238 184 G HA3 0.270 4.230 3.960 -0.000 0.000 0.238 184 G C -0.904 174.089 174.900 0.155 0.000 1.259 184 G CA -0.137 45.011 45.100 0.079 0.000 0.843 184 G HN 0.176 8.466 8.290 -0.000 0.000 0.582 185 F N 1.229 121.163 119.950 -0.025 0.000 2.596 185 F HA 0.560 5.086 4.527 -0.000 0.000 0.311 185 F C -1.166 174.608 175.800 -0.043 0.000 1.116 185 F CA -1.045 56.935 58.000 -0.033 0.000 0.957 185 F CB 2.072 41.054 39.000 -0.029 0.000 1.250 185 F HN 0.426 8.726 8.300 -0.000 0.000 0.444 186 V N 5.865 125.110 119.914 -1.116 0.000 2.482 186 V HA 0.367 4.487 4.120 -0.000 0.000 0.295 186 V C -0.266 175.128 176.094 -1.168 0.000 1.026 186 V CA -0.863 60.908 62.300 -0.880 0.000 0.856 186 V CB 1.251 32.832 31.823 -0.404 0.000 1.001 186 V HN 0.845 9.035 8.190 -0.000 0.000 0.424 187 N N 2.266 120.388 118.700 -0.964 0.000 2.364 187 N HA 0.290 5.030 4.740 -0.000 0.000 0.264 187 N C -0.425 174.865 175.510 -0.366 0.000 1.263 187 N CA -0.322 52.388 53.050 -0.566 0.000 0.959 187 N CB 0.810 39.123 38.487 -0.291 0.000 1.204 187 N HN 0.664 9.044 8.380 -0.000 0.000 0.550 188 Y N -0.193 119.938 120.300 -0.281 0.000 2.314 188 Y HA 0.237 4.787 4.550 0.000 0.000 0.334 188 Y C 0.782 176.586 175.900 -0.158 0.000 1.266 188 Y CA -0.921 57.061 58.100 -0.196 0.000 1.391 188 Y CB 0.112 38.468 38.460 -0.173 0.000 1.306 188 Y HN 0.696 8.976 8.280 -0.000 0.000 0.558 189 N N -0.150 118.532 118.700 -0.030 0.000 2.740 189 N HA -0.173 4.567 4.740 -0.000 0.000 0.248 189 N C -1.484 173.856 175.510 -0.283 0.000 1.062 189 N CA 0.876 53.832 53.050 -0.158 0.000 0.704 189 N CB -1.240 37.146 38.487 -0.168 0.000 0.968 189 N HN 1.245 9.625 8.380 -0.000 0.000 0.547 190 A N -1.643 121.055 122.820 -0.202 0.000 2.599 190 A HA 0.945 5.265 4.320 -0.000 0.000 0.290 190 A C 0.735 178.254 177.584 -0.108 0.000 1.101 190 A CA 0.327 52.253 52.037 -0.184 0.000 0.674 190 A CB 1.207 20.067 19.000 -0.232 0.000 1.277 190 A HN 1.290 9.440 8.150 -0.000 0.000 0.419 191 G N -0.862 107.890 108.800 -0.079 0.000 2.292 191 G HA2 0.563 4.523 3.960 -0.000 0.000 0.194 191 G HA3 0.563 4.523 3.960 -0.000 0.000 0.194 191 G C -0.209 174.699 174.900 0.014 0.000 1.329 191 G CA 0.770 45.854 45.100 -0.027 0.000 1.100 191 G HN 2.238 10.528 8.290 -0.000 0.000 0.470 192 T N -0.871 113.737 114.554 0.090 0.000 2.912 192 T HA 0.722 5.072 4.350 -0.000 0.000 0.288 192 T C 1.027 175.813 174.700 0.144 0.000 1.030 192 T CA -0.524 61.620 62.100 0.073 0.000 1.020 192 T CB 1.913 70.802 68.868 0.035 0.000 1.056 192 T HN 0.633 8.873 8.240 -0.000 0.000 0.480 193 L N 0.727 121.996 121.223 0.076 0.000 2.515 193 L HA 0.419 4.759 4.340 -0.000 0.000 0.223 193 L C 1.472 178.389 176.870 0.080 0.000 1.079 193 L CA 0.276 55.169 54.840 0.088 0.000 0.857 193 L CB -0.187 41.887 42.059 0.025 0.000 1.050 193 L HN 0.984 9.214 8.230 -0.000 0.000 0.476 194 G N -0.634 108.195 108.800 0.048 0.000 3.187 194 G HA2 0.589 4.549 3.960 -0.000 0.000 0.175 194 G HA3 0.589 4.549 3.960 -0.000 0.000 0.175 194 G C -1.252 173.657 174.900 0.015 0.000 1.112 194 G CA 0.183 45.301 45.100 0.030 0.000 0.821 194 G HN 0.004 8.294 8.290 -0.000 0.000 0.636 195 A N -0.025 122.799 122.820 0.007 0.000 2.302 195 A HA 0.709 5.029 4.320 -0.000 0.000 0.295 195 A C -0.127 177.456 177.584 -0.001 0.000 1.235 195 A CA 0.047 52.084 52.037 -0.001 0.000 0.876 195 A CB 0.170 19.169 19.000 -0.002 0.000 1.133 195 A HN 0.813 8.963 8.150 -0.000 0.000 0.533 196 S N 1.510 117.207 115.700 -0.005 0.000 2.546 196 S HA 0.502 4.972 4.470 -0.000 0.000 0.272 196 S C -0.628 173.966 174.600 -0.010 0.000 1.140 196 S CA -0.545 57.651 58.200 -0.006 0.000 0.920 196 S CB 1.453 64.649 63.200 -0.007 0.000 1.083 196 S HN 0.847 9.157 8.310 -0.000 0.000 0.476 197 M N 3.968 123.564 119.600 -0.007 0.000 2.105 197 M HA 0.484 4.964 4.480 -0.000 0.000 0.350 197 M C -1.579 174.718 176.300 -0.006 0.000 1.308 197 M CA -0.089 55.207 55.300 -0.006 0.000 1.108 197 M CB 0.194 32.793 32.600 -0.001 0.000 1.622 197 M HN 0.340 8.630 8.290 -0.000 0.000 0.468 198 V N 6.776 126.685 119.914 -0.009 0.000 2.313 198 V HA 0.347 4.467 4.120 -0.000 0.000 0.278 198 V C 0.007 176.104 176.094 0.004 0.000 1.017 198 V CA -0.286 62.008 62.300 -0.009 0.000 0.823 198 V CB 0.777 32.585 31.823 -0.025 0.000 1.010 198 V HN 0.957 9.147 8.190 -0.000 0.000 0.443 199 E N 2.881 123.090 120.200 0.014 0.000 2.630 199 E HA 0.344 4.694 4.350 -0.000 0.000 0.218 199 E C 0.842 177.464 176.600 0.036 0.000 0.977 199 E CA 0.045 56.464 56.400 0.031 0.000 1.038 199 E CB 1.680 31.399 29.700 0.032 0.000 1.051 199 E HN 0.769 9.129 8.360 -0.000 0.000 0.487 200 G N 0.854 109.672 108.800 0.030 0.000 3.251 200 G HA2 0.518 4.478 3.960 -0.000 0.000 0.248 200 G HA3 0.518 4.478 3.960 -0.000 0.000 0.248 200 G C -0.864 174.079 174.900 0.072 0.000 1.320 200 G CA -0.849 44.274 45.100 0.038 0.000 0.982 200 G HN -0.097 8.193 8.290 -0.000 0.000 0.575 201 R N -0.005 120.545 120.500 0.084 0.000 2.265 201 R HA 0.405 4.745 4.340 -0.000 0.000 0.328 201 R C -0.727 175.641 176.300 0.114 0.000 0.969 201 R CA -0.434 55.773 56.100 0.179 0.000 0.832 201 R CB 1.782 32.190 30.300 0.181 0.000 1.139 201 R HN 0.280 8.550 8.270 -0.000 0.000 0.457 202 I N 2.893 123.508 120.570 0.075 0.000 2.287 202 I HA 0.129 4.299 4.170 -0.000 0.000 0.290 202 I C 0.261 176.364 176.117 -0.024 0.000 1.069 202 I CA -0.189 61.099 61.300 -0.020 0.000 1.237 202 I CB 1.253 39.194 38.000 -0.099 0.000 1.418 202 I HN 0.551 8.761 8.210 -0.000 0.000 0.481 203 S N 4.214 119.922 115.700 0.013 0.000 2.596 203 S HA 0.359 4.829 4.470 -0.000 0.000 0.260 203 S C 0.642 175.163 174.600 -0.131 0.000 1.336 203 S CA -0.767 57.433 58.200 -0.000 0.000 0.993 203 S CB 0.979 64.178 63.200 -0.001 0.000 0.923 203 S HN 0.726 9.036 8.310 -0.000 0.000 0.567 204 A N 0.413 123.099 122.820 -0.225 0.000 2.546 204 A HA 0.473 4.793 4.320 -0.000 0.000 0.243 204 A C 1.496 178.921 177.584 -0.265 0.000 1.063 204 A CA 0.334 52.097 52.037 -0.457 0.000 0.757 204 A CB -1.193 17.394 19.000 -0.689 0.000 0.991 204 A HN 1.764 9.914 8.150 -0.000 0.000 0.503 205 G N 1.007 109.655 108.800 -0.254 0.000 2.213 205 G HA2 -0.167 3.793 3.960 -0.000 0.000 0.236 205 G HA3 -0.167 3.793 3.960 -0.000 0.000 0.236 205 G C 0.216 175.173 174.900 0.096 0.000 0.991 205 G CA 0.058 45.127 45.100 -0.052 0.000 0.629 205 G HN 1.412 9.702 8.290 -0.000 0.000 0.517 206 V N 1.398 121.297 119.914 -0.026 0.000 2.498 206 V HA 0.612 4.732 4.120 -0.000 0.000 0.279 206 V C 0.547 176.631 176.094 -0.018 0.000 1.048 206 V CA -0.478 61.821 62.300 -0.002 0.000 0.967 206 V CB 1.664 33.470 31.823 -0.029 0.000 0.988 206 V HN 0.262 8.452 8.190 -0.000 0.000 0.473 207 V N 5.518 125.437 119.914 0.008 0.000 2.628 207 V HA 0.540 4.660 4.120 -0.000 0.000 0.306 207 V C -0.366 175.721 176.094 -0.012 0.000 1.045 207 V CA -0.572 61.722 62.300 -0.010 0.000 0.905 207 V CB 2.303 34.130 31.823 0.008 0.000 0.997 207 V HN 0.580 8.770 8.190 -0.000 0.000 0.436 208 V N 3.287 123.193 119.914 -0.013 0.000 2.444 208 V HA 0.663 4.783 4.120 -0.000 0.000 0.294 208 V C 0.697 176.791 176.094 -0.001 0.000 1.022 208 V CA -0.335 61.960 62.300 -0.009 0.000 0.850 208 V CB 1.584 33.400 31.823 -0.013 0.000 0.992 208 V HN 0.983 9.172 8.190 -0.000 0.000 0.426 209 G N 2.172 110.972 108.800 -0.001 0.000 2.599 209 G HA2 0.303 4.263 3.960 -0.000 0.000 0.264 209 G HA3 0.303 4.263 3.960 -0.000 0.000 0.264 209 G C -0.308 174.596 174.900 0.006 0.000 1.200 209 G CA -0.307 44.795 45.100 0.004 0.000 0.896 209 G HN 0.714 9.004 8.290 -0.000 0.000 0.536 210 D N -0.851 119.554 120.400 0.009 0.000 2.533 210 D HA 0.318 4.958 4.640 -0.000 0.000 0.236 210 D C 1.550 177.854 176.300 0.006 0.000 1.137 210 D CA 1.858 55.864 54.000 0.009 0.000 0.867 210 D CB 0.340 41.146 40.800 0.010 0.000 1.170 210 D HN 1.015 9.385 8.370 -0.000 0.000 0.474 211 G N 2.394 111.197 108.800 0.004 0.000 2.184 211 G HA2 -0.259 3.701 3.960 -0.000 0.000 0.264 211 G HA3 -0.259 3.701 3.960 -0.000 0.000 0.264 211 G C 0.400 175.302 174.900 0.002 0.000 0.975 211 G CA 0.458 45.560 45.100 0.003 0.000 0.642 211 G HN 0.612 8.902 8.290 -0.000 0.000 0.536 212 S N 1.265 116.966 115.700 0.001 0.000 2.537 212 S HA 0.550 5.020 4.470 -0.000 0.000 0.275 212 S C -0.438 174.160 174.600 -0.003 0.000 1.272 212 S CA -0.440 57.760 58.200 -0.000 0.000 1.050 212 S CB 1.352 64.551 63.200 -0.001 0.000 0.961 212 S HN 0.328 8.638 8.310 -0.000 0.000 0.496 213 D N 1.599 121.997 120.400 -0.003 0.000 2.362 213 D HA 0.404 5.044 4.640 -0.000 0.000 0.247 213 D C -0.814 175.481 176.300 -0.009 0.000 1.050 213 D CA -0.354 53.644 54.000 -0.005 0.000 0.839 213 D CB 1.812 42.611 40.800 -0.002 0.000 1.283 213 D HN 0.173 8.543 8.370 -0.000 0.000 0.477 214 V N 1.889 121.797 119.914 -0.010 0.000 2.328 214 V HA 0.496 4.616 4.120 -0.000 0.000 0.278 214 V C 1.109 177.198 176.094 -0.009 0.000 1.021 214 V CA -0.786 61.505 62.300 -0.015 0.000 0.838 214 V CB 1.189 33.002 31.823 -0.016 0.000 0.999 214 V HN 0.602 8.792 8.190 -0.000 0.000 0.447 215 G N 3.321 112.113 108.800 -0.012 0.000 2.636 215 G HA2 0.404 4.364 3.960 -0.000 0.000 0.246 215 G HA3 0.404 4.364 3.960 -0.000 0.000 0.246 215 G C 0.691 175.591 174.900 -0.000 0.000 1.216 215 G CA 0.017 45.114 45.100 -0.006 0.000 0.854 215 G HN 1.067 9.357 8.290 -0.000 0.000 0.572 216 G N -1.163 107.641 108.800 0.007 0.000 2.150 216 G HA2 0.488 4.448 3.960 -0.000 0.000 0.250 216 G HA3 0.488 4.448 3.960 -0.000 0.000 0.250 216 G C 1.328 176.235 174.900 0.010 0.000 1.179 216 G CA 0.760 45.868 45.100 0.015 0.000 0.934 216 G HN 2.033 10.323 8.290 -0.000 0.000 0.453 217 G N 0.996 109.806 108.800 0.018 0.000 2.168 217 G HA2 0.111 4.071 3.960 -0.000 0.000 0.263 217 G HA3 0.111 4.071 3.960 -0.000 0.000 0.263 217 G C 0.757 175.658 174.900 0.002 0.000 0.977 217 G CA 0.672 45.782 45.100 0.016 0.000 0.659 217 G HN 1.966 10.256 8.290 -0.000 0.000 0.533 218 A N -0.330 122.480 122.820 -0.015 0.000 2.386 218 A HA 0.738 5.058 4.320 -0.000 0.000 0.248 218 A C 0.736 178.290 177.584 -0.050 0.000 1.082 218 A CA 0.963 52.965 52.037 -0.058 0.000 0.789 218 A CB 0.951 19.909 19.000 -0.070 0.000 1.025 218 A HN 1.603 9.753 8.150 -0.000 0.000 0.490 219 S N 1.380 117.013 115.700 -0.112 0.000 2.596 219 S HA 0.578 5.048 4.470 -0.000 0.000 0.318 219 S C -0.739 173.796 174.600 -0.108 0.000 1.097 219 S CA -0.557 57.612 58.200 -0.052 0.000 1.080 219 S CB -0.131 63.103 63.200 0.058 0.000 0.991 219 S HN 0.478 8.788 8.310 -0.000 0.000 0.471 220 I N 5.488 126.038 120.570 -0.034 0.000 2.328 220 I HA 0.373 4.543 4.170 -0.000 0.000 0.287 220 I C 0.612 176.736 176.117 0.011 0.000 1.012 220 I CA -0.393 60.884 61.300 -0.038 0.000 1.195 220 I CB 1.087 39.065 38.000 -0.036 0.000 1.350 220 I HN 0.926 9.136 8.210 -0.000 0.000 0.464 221 M N 3.942 123.561 119.600 0.031 0.000 2.503 221 M HA -0.146 4.334 4.480 -0.000 0.000 0.208 221 M C 0.242 176.580 176.300 0.064 0.000 0.434 221 M CA 0.353 55.680 55.300 0.046 0.000 0.551 221 M CB -0.755 31.853 32.600 0.014 0.000 2.025 221 M HN 0.868 9.158 8.290 -0.000 0.000 0.827 222 G N 0.261 109.139 108.800 0.131 0.000 2.510 222 G HA2 0.508 4.468 3.960 -0.000 0.000 0.280 222 G HA3 0.508 4.468 3.960 -0.000 0.000 0.280 222 G C -0.349 174.577 174.900 0.043 0.000 1.386 222 G CA -0.028 45.134 45.100 0.103 0.000 1.047 222 G HN 0.393 8.683 8.290 -0.000 0.000 0.527 223 T N 1.170 115.722 114.554 -0.004 0.000 2.829 223 T HA 0.217 4.566 4.350 -0.000 0.000 0.293 223 T C 1.090 175.728 174.700 -0.104 0.000 0.970 223 T CA 0.418 62.488 62.100 -0.051 0.000 1.168 223 T CB 0.025 68.859 68.868 -0.057 0.000 0.911 223 T HN 0.553 8.793 8.240 -0.000 0.000 0.535 224 L N 2.076 123.243 121.223 -0.092 0.000 4.560 224 L HA -0.262 4.078 4.340 -0.000 0.000 0.415 224 L C 1.985 178.770 176.870 -0.142 0.000 1.123 224 L CA 0.717 55.487 54.840 -0.117 0.000 0.991 224 L CB -2.068 39.904 42.059 -0.144 0.000 2.127 224 L HN 0.835 9.065 8.230 -0.000 0.000 0.765 225 S N -1.028 114.620 115.700 -0.086 0.000 2.555 225 S HA 0.392 4.862 4.470 -0.000 0.000 0.230 225 S C 0.949 175.554 174.600 0.009 0.000 0.978 225 S CA 0.680 58.882 58.200 0.004 0.000 0.934 225 S CB 0.678 63.993 63.200 0.191 0.000 0.766 225 S HN 1.099 9.409 8.310 -0.000 0.000 0.533 226 G N -1.164 107.623 108.800 -0.022 0.000 2.345 226 G HA2 0.422 4.382 3.960 -0.000 0.000 0.310 226 G HA3 0.422 4.382 3.960 -0.000 0.000 0.310 226 G C 0.526 175.409 174.900 -0.028 0.000 1.476 226 G CA -0.271 44.818 45.100 -0.019 0.000 0.978 226 G HN 0.726 9.016 8.290 -0.000 0.000 0.656 227 G N 0.152 108.933 108.800 -0.031 0.000 3.224 227 G HA2 0.152 4.112 3.960 -0.000 0.000 0.244 227 G HA3 0.152 4.112 3.960 -0.000 0.000 0.244 227 G C 2.039 176.905 174.900 -0.057 0.000 1.059 227 G CA 2.590 47.664 45.100 -0.044 0.000 0.715 227 G HN 2.836 11.127 8.290 -0.000 0.000 0.689 228 G N -2.065 106.701 108.800 -0.056 0.000 2.248 228 G HA2 0.015 3.975 3.960 -0.000 0.000 0.252 228 G HA3 0.015 3.975 3.960 -0.000 0.000 0.252 228 G C 0.711 175.559 174.900 -0.087 0.000 1.085 228 G CA 1.553 46.618 45.100 -0.058 0.000 0.845 228 G HN 1.651 9.941 8.290 -0.000 0.000 0.494 229 T N -4.088 110.385 114.554 -0.134 0.000 3.321 229 T HA 0.305 4.655 4.350 -0.000 0.000 0.251 229 T C 0.626 175.135 174.700 -0.318 0.000 0.999 229 T CA 0.437 62.377 62.100 -0.266 0.000 1.186 229 T CB 0.688 69.320 68.868 -0.394 0.000 1.163 229 T HN 0.376 8.616 8.240 -0.000 0.000 0.399 230 H N 2.541 121.598 119.070 -0.021 0.000 2.463 230 H HA 0.608 5.164 4.556 -0.000 0.000 0.332 230 H C 0.285 175.591 175.328 -0.036 0.000 1.127 230 H CA -0.973 55.055 56.048 -0.033 0.000 1.238 230 H CB 1.555 31.294 29.762 -0.039 0.000 1.478 230 H HN 0.363 8.643 8.280 -0.000 0.000 0.499 231 V N 2.000 121.959 119.914 0.076 0.000 2.999 231 V HA 0.142 4.262 4.120 -0.000 0.000 0.307 231 V C 1.023 177.125 176.094 0.012 0.000 1.084 231 V CA -0.499 61.818 62.300 0.028 0.000 1.155 231 V CB -0.018 31.817 31.823 0.020 0.000 0.975 231 V HN 0.700 8.890 8.190 -0.000 0.000 0.490 232 I N 1.458 122.033 120.570 0.009 0.000 2.707 232 I HA 0.910 5.080 4.170 -0.000 0.000 0.309 232 I C 0.065 176.178 176.117 -0.006 0.000 1.001 232 I CA -0.361 60.938 61.300 -0.002 0.000 1.129 232 I CB 2.087 40.084 38.000 -0.005 0.000 1.308 232 I HN 0.916 9.126 8.210 -0.000 0.000 0.466 233 S N 5.002 120.694 115.700 -0.013 0.000 2.632 233 S HA 0.762 5.232 4.470 -0.000 0.000 0.289 233 S C -0.817 173.776 174.600 -0.012 0.000 1.115 233 S CA -0.842 57.352 58.200 -0.011 0.000 0.889 233 S CB 2.043 65.235 63.200 -0.014 0.000 1.116 233 S HN 0.671 8.981 8.310 -0.000 0.000 0.486 234 I N 1.318 121.882 120.570 -0.010 0.000 2.509 234 I HA 0.549 4.719 4.170 -0.000 0.000 0.293 234 I C 1.073 177.188 176.117 -0.002 0.000 1.020 234 I CA -0.813 60.483 61.300 -0.006 0.000 1.088 234 I CB 2.094 40.087 38.000 -0.011 0.000 1.267 234 I HN 0.962 9.172 8.210 -0.000 0.000 0.430 235 G N 4.905 113.706 108.800 0.003 0.000 2.580 235 G HA2 0.289 4.249 3.960 -0.000 0.000 0.225 235 G HA3 0.289 4.249 3.960 -0.000 0.000 0.225 235 G C -0.256 174.646 174.900 0.004 0.000 1.521 235 G CA -0.457 44.645 45.100 0.003 0.000 1.068 235 G HN 0.523 8.813 8.290 -0.000 0.000 0.564 236 K N -0.228 120.174 120.400 0.005 0.000 2.098 236 K HA 0.427 4.747 4.320 -0.000 0.000 0.261 236 K C 0.124 176.728 176.600 0.006 0.000 0.987 236 K CA -0.495 55.795 56.287 0.005 0.000 0.916 236 K CB 1.211 33.713 32.500 0.004 0.000 1.039 236 K HN 0.476 8.726 8.250 -0.000 0.000 0.455 237 R N -0.939 119.564 120.500 0.005 0.000 3.758 237 R HA -0.201 4.139 4.340 -0.000 0.000 0.299 237 R C -0.486 175.819 176.300 0.008 0.000 1.182 237 R CA 0.263 56.366 56.100 0.005 0.000 0.809 237 R CB -2.789 27.514 30.300 0.004 0.000 1.249 237 R HN 0.574 8.844 8.270 -0.000 0.000 0.497 238 C N 0.258 119.563 119.300 0.009 0.000 2.500 238 C HA 0.634 5.094 4.460 -0.000 0.000 0.367 238 C C 0.522 175.518 174.990 0.009 0.000 1.283 238 C CA -0.669 58.357 59.018 0.014 0.000 2.456 238 C CB 0.948 28.697 27.740 0.016 0.000 2.457 238 C HN 0.386 8.616 8.230 -0.000 0.000 0.632 239 L N 2.264 123.494 121.223 0.013 0.000 2.482 239 L HA 0.573 4.913 4.340 -0.000 0.000 0.269 239 L C -1.052 175.820 176.870 0.004 0.000 0.967 239 L CA -0.044 54.800 54.840 0.006 0.000 0.851 239 L CB 0.967 43.031 42.059 0.008 0.000 1.242 239 L HN 0.583 8.813 8.230 -0.000 0.000 0.404 240 L N 4.949 126.165 121.223 -0.012 0.000 2.272 240 L HA 0.614 4.954 4.340 -0.000 0.000 0.289 240 L C 1.035 177.890 176.870 -0.024 0.000 1.032 240 L CA -0.655 54.168 54.840 -0.029 0.000 0.810 240 L CB 1.350 43.376 42.059 -0.055 0.000 1.205 240 L HN 0.766 8.996 8.230 -0.000 0.000 0.422 241 G N 2.050 110.838 108.800 -0.021 0.000 2.636 241 G HA2 0.387 4.347 3.960 -0.000 0.000 0.246 241 G HA3 0.387 4.347 3.960 -0.000 0.000 0.246 241 G C 0.258 175.145 174.900 -0.022 0.000 1.216 241 G CA -0.242 44.849 45.100 -0.014 0.000 0.854 241 G HN 0.801 9.091 8.290 -0.000 0.000 0.572 242 A N 0.757 123.570 122.820 -0.011 0.000 2.531 242 A HA 0.313 4.633 4.320 -0.000 0.000 0.236 242 A C 1.186 178.763 177.584 -0.012 0.000 1.062 242 A CA 0.497 52.529 52.037 -0.009 0.000 0.760 242 A CB -0.172 18.827 19.000 -0.000 0.000 0.995 242 A HN 1.127 9.277 8.150 -0.000 0.000 0.501 243 N N -0.767 117.926 118.700 -0.012 0.000 2.708 243 N HA -0.182 4.558 4.740 -0.000 0.000 0.251 243 N C 0.352 175.847 175.510 -0.025 0.000 1.123 243 N CA 1.418 54.465 53.050 -0.005 0.000 0.739 243 N CB -1.884 36.610 38.487 0.012 0.000 1.113 243 N HN 1.110 9.490 8.380 -0.000 0.000 0.561 244 S N -1.626 114.029 115.700 -0.076 0.000 2.713 244 S HA 0.849 5.319 4.470 -0.000 0.000 0.277 244 S C 0.668 175.046 174.600 -0.369 0.000 1.168 244 S CA 0.028 58.137 58.200 -0.151 0.000 0.994 244 S CB 2.580 65.702 63.200 -0.129 0.000 1.054 244 S HN 0.459 8.769 8.310 -0.000 0.000 0.555 245 G N -0.895 107.487 108.800 -0.697 0.000 2.690 245 G HA2 0.599 4.559 3.960 -0.000 0.000 0.293 245 G HA3 0.599 4.559 3.960 -0.000 0.000 0.293 245 G C -2.141 172.115 174.900 -1.073 0.000 1.399 245 G CA -0.731 43.450 45.100 -1.530 0.000 0.890 245 G HN 0.924 9.214 8.290 -0.000 0.000 0.485 246 L N 0.876 121.671 121.223 -0.713 0.000 2.470 246 L HA 0.777 5.117 4.340 -0.000 0.000 0.268 246 L C 0.488 177.310 176.870 -0.080 0.000 0.964 246 L CA -0.030 54.629 54.840 -0.301 0.000 0.839 246 L CB 2.162 44.083 42.059 -0.230 0.000 1.276 246 L HN 0.797 9.027 8.230 -0.000 0.000 0.403 247 G N 5.372 114.159 108.800 -0.022 0.000 3.596 247 G HA2 0.370 4.330 3.960 -0.000 0.000 0.274 247 G HA3 0.370 4.330 3.960 -0.000 0.000 0.274 247 G C -0.137 174.752 174.900 -0.018 0.000 1.007 247 G CA 0.309 45.427 45.100 0.030 0.000 0.825 247 G HN 0.633 8.923 8.290 -0.000 0.000 0.508 248 I N -3.189 117.344 120.570 -0.062 0.000 2.934 248 I HA 0.703 4.873 4.170 -0.000 0.000 0.306 248 I C -0.310 175.783 176.117 -0.041 0.000 1.110 248 I CA -1.037 60.236 61.300 -0.044 0.000 1.019 248 I CB 1.988 39.954 38.000 -0.056 0.000 1.227 248 I HN -0.235 7.975 8.210 -0.000 0.000 0.434 249 S N 3.471 119.162 115.700 -0.015 0.000 2.572 249 S HA 0.545 5.015 4.470 -0.000 0.000 0.279 249 S C -0.205 174.399 174.600 0.006 0.000 1.341 249 S CA -0.392 57.803 58.200 -0.009 0.000 1.043 249 S CB 0.520 63.718 63.200 -0.004 0.000 0.887 249 S HN 0.375 8.685 8.310 -0.000 0.000 0.516 250 L N 1.371 122.601 121.223 0.011 0.000 2.333 250 L HA 0.615 4.955 4.340 -0.000 0.000 0.269 250 L C 1.094 177.982 176.870 0.031 0.000 1.010 250 L CA -0.819 54.047 54.840 0.042 0.000 0.818 250 L CB 1.637 43.724 42.059 0.046 0.000 1.306 250 L HN 0.797 9.027 8.230 -0.000 0.000 0.430 251 G N 0.152 108.975 108.800 0.039 0.000 2.928 251 G HA2 0.170 4.130 3.960 -0.000 0.000 0.163 251 G HA3 0.170 4.130 3.960 -0.000 0.000 0.163 251 G C -0.620 174.292 174.900 0.020 0.000 1.573 251 G CA -0.274 44.840 45.100 0.023 0.000 1.084 251 G HN 0.532 8.822 8.290 -0.000 0.000 0.569 252 D N 0.397 120.806 120.400 0.015 0.000 2.277 252 D HA 0.302 4.942 4.640 -0.000 0.000 0.250 252 D C -0.391 175.918 176.300 0.015 0.000 1.032 252 D CA -0.120 53.888 54.000 0.012 0.000 0.947 252 D CB 1.088 41.892 40.800 0.006 0.000 1.159 252 D HN 0.379 8.749 8.370 -0.000 0.000 0.460 253 D N -0.221 120.187 120.400 0.013 0.000 2.723 253 D HA -0.163 4.477 4.640 -0.000 0.000 0.236 253 D C -0.530 175.780 176.300 0.018 0.000 1.138 253 D CA 0.544 54.550 54.000 0.011 0.000 0.676 253 D CB -1.501 39.301 40.800 0.003 0.000 1.069 253 D HN 0.219 8.589 8.370 -0.000 0.000 0.430 254 C N 0.073 119.394 119.300 0.035 0.000 2.391 254 C HA 0.727 5.187 4.460 -0.000 0.000 0.339 254 C C 0.703 175.736 174.990 0.071 0.000 1.205 254 C CA -0.668 58.389 59.018 0.066 0.000 1.937 254 C CB 2.183 29.993 27.740 0.117 0.000 2.341 254 C HN 0.154 8.384 8.230 -0.000 0.000 0.516 255 V N 2.680 122.651 119.914 0.095 0.000 2.656 255 V HA 0.574 4.694 4.120 -0.000 0.000 0.307 255 V C -0.584 175.605 176.094 0.158 0.000 1.051 255 V CA -0.440 61.911 62.300 0.086 0.000 0.893 255 V CB 1.969 33.821 31.823 0.048 0.000 0.999 255 V HN 0.684 8.874 8.190 -0.000 0.000 0.426 256 V N 3.822 123.797 119.914 0.103 0.000 2.417 256 V HA 0.392 4.512 4.120 -0.000 0.000 0.291 256 V C 0.187 176.310 176.094 0.049 0.000 1.024 256 V CA -0.737 61.622 62.300 0.099 0.000 0.861 256 V CB 1.668 33.480 31.823 -0.019 0.000 0.985 256 V HN 1.064 9.254 8.190 -0.000 0.000 0.436 257 E N 4.332 124.571 120.200 0.065 0.000 2.404 257 E HA 0.508 4.858 4.350 -0.000 0.000 0.261 257 E C 0.279 176.888 176.600 0.014 0.000 1.074 257 E CA -0.359 56.063 56.400 0.037 0.000 0.917 257 E CB 1.026 30.752 29.700 0.044 0.000 0.965 257 E HN 0.839 9.199 8.360 -0.000 0.000 0.433 258 A N 2.334 125.159 122.820 0.009 0.000 2.584 258 A HA 0.342 4.662 4.320 -0.000 0.000 0.239 258 A C 1.375 178.964 177.584 0.007 0.000 1.043 258 A CA 0.583 52.622 52.037 0.002 0.000 0.756 258 A CB -0.987 18.016 19.000 0.005 0.000 0.963 258 A HN 1.399 9.549 8.150 -0.000 0.000 0.511 259 G N 0.434 109.235 108.800 0.003 0.000 2.179 259 G HA2 -0.134 3.826 3.960 -0.000 0.000 0.260 259 G HA3 -0.134 3.826 3.960 -0.000 0.000 0.260 259 G C 0.050 174.967 174.900 0.029 0.000 0.977 259 G CA 0.520 45.630 45.100 0.018 0.000 0.641 259 G HN 1.753 10.043 8.290 -0.000 0.000 0.533 260 L N 0.575 121.805 121.223 0.012 0.000 2.275 260 L HA 0.771 5.111 4.340 -0.000 0.000 0.288 260 L C -0.335 176.529 176.870 -0.009 0.000 1.046 260 L CA -1.725 53.133 54.840 0.029 0.000 0.805 260 L CB 0.923 43.004 42.059 0.036 0.000 1.193 260 L HN 0.164 8.394 8.230 -0.000 0.000 0.426 261 Y N 4.717 125.001 120.300 -0.028 0.000 2.404 261 Y HA 0.497 5.047 4.550 -0.000 0.000 0.344 261 Y C -0.440 175.414 175.900 -0.078 0.000 0.970 261 Y CA -0.567 57.503 58.100 -0.051 0.000 1.180 261 Y CB 1.189 39.626 38.460 -0.039 0.000 1.138 261 Y HN 0.393 8.673 8.280 -0.000 0.000 0.510 262 V N 6.132 126.048 119.914 0.004 0.000 2.334 262 V HA 0.202 4.322 4.120 -0.000 0.000 0.267 262 V C 0.269 176.392 176.094 0.047 0.000 1.040 262 V CA -0.505 61.753 62.300 -0.070 0.000 0.866 262 V CB 0.798 32.357 31.823 -0.441 0.000 1.019 262 V HN 0.861 9.051 8.190 -0.000 0.000 0.468 263 T N 2.191 116.801 114.554 0.093 0.000 2.912 263 T HA 0.601 4.951 4.350 -0.000 0.000 0.280 263 T C 1.383 176.085 174.700 0.002 0.000 0.989 263 T CA 0.007 62.148 62.100 0.068 0.000 0.995 263 T CB 1.875 70.754 68.868 0.018 0.000 1.077 263 T HN 0.594 8.834 8.240 -0.000 0.000 0.531 264 A N 0.666 123.486 122.820 0.001 0.000 1.978 264 A HA 0.180 4.500 4.320 -0.000 0.000 0.220 264 A C 2.203 179.788 177.584 0.002 0.000 1.170 264 A CA 1.527 53.561 52.037 -0.004 0.000 0.636 264 A CB -1.340 17.659 19.000 -0.001 0.000 0.810 264 A HN 1.118 9.268 8.150 -0.000 0.000 0.448 265 G N -1.548 107.251 108.800 -0.001 0.000 3.088 265 G HA2 0.284 4.244 3.960 -0.000 0.000 0.217 265 G HA3 0.284 4.244 3.960 -0.000 0.000 0.217 265 G C 0.413 175.317 174.900 0.007 0.000 1.159 265 G CA 0.418 45.519 45.100 0.001 0.000 0.760 265 G HN 0.323 8.613 8.290 -0.000 0.000 0.550 266 T N 1.314 115.875 114.554 0.011 0.000 2.867 266 T HA 0.158 4.508 4.350 -0.000 0.000 0.297 266 T C 0.527 175.251 174.700 0.040 0.000 0.989 266 T CA -0.089 62.025 62.100 0.024 0.000 1.159 266 T CB 1.089 69.974 68.868 0.028 0.000 0.928 266 T HN 0.294 8.534 8.240 -0.000 0.000 0.538 267 R N 3.051 123.575 120.500 0.040 0.000 2.347 267 R HA 0.393 4.733 4.340 -0.000 0.000 0.304 267 R C -0.316 176.024 176.300 0.067 0.000 1.072 267 R CA -0.461 55.667 56.100 0.047 0.000 0.980 267 R CB 0.201 30.520 30.300 0.032 0.000 0.986 267 R HN 0.541 8.811 8.270 -0.000 0.000 0.448 268 V N 1.063 121.028 119.914 0.085 0.000 2.628 268 V HA 0.554 4.674 4.120 -0.000 0.000 0.306 268 V C -0.407 175.725 176.094 0.063 0.000 1.045 268 V CA -0.708 61.656 62.300 0.107 0.000 0.905 268 V CB 2.034 33.979 31.823 0.204 0.000 0.997 268 V HN 0.697 8.887 8.190 -0.000 0.000 0.436 269 T N 6.424 121.005 114.554 0.045 0.000 2.795 269 T HA 0.623 4.973 4.350 -0.000 0.000 0.282 269 T C -0.064 174.637 174.700 0.000 0.000 0.980 269 T CA -0.258 61.854 62.100 0.020 0.000 1.012 269 T CB 1.158 70.036 68.868 0.017 0.000 0.936 269 T HN 0.744 8.984 8.240 -0.000 0.000 0.457 270 M N 3.167 122.763 119.600 -0.008 0.000 2.494 270 M HA 0.308 4.788 4.480 -0.000 0.000 0.300 270 M C -1.498 174.786 176.300 -0.026 0.000 1.189 270 M CA -2.440 52.843 55.300 -0.028 0.000 0.982 270 M CB 1.175 33.761 32.600 -0.023 0.000 1.534 270 M HN 0.278 8.568 8.290 -0.000 0.000 0.488 271 P HA -0.136 4.284 4.420 -0.000 0.000 0.225 271 P C 0.067 177.355 177.300 -0.020 0.000 1.148 271 P CA 1.098 64.181 63.100 -0.030 0.000 0.779 271 P CB -0.088 31.590 31.700 -0.036 0.000 0.780 272 D N -2.813 117.577 120.400 -0.017 0.000 2.340 272 D HA 0.083 4.723 4.640 -0.000 0.000 0.220 272 D C 0.576 176.871 176.300 -0.007 0.000 1.039 272 D CA -0.025 53.968 54.000 -0.011 0.000 0.866 272 D CB -0.387 40.407 40.800 -0.010 0.000 0.913 272 D HN -0.118 8.252 8.370 -0.000 0.000 0.523 273 S N -1.431 114.265 115.700 -0.007 0.000 2.044 273 S HA -0.191 4.279 4.470 -0.000 0.000 0.248 273 S C 0.389 174.989 174.600 0.001 0.000 1.146 273 S CA 0.322 58.520 58.200 -0.003 0.000 1.370 273 S CB -1.720 61.478 63.200 -0.002 0.000 1.698 273 S HN 0.594 8.904 8.310 -0.000 0.000 0.578 274 N N 2.016 120.716 118.700 0.000 0.000 2.381 274 N HA 0.306 5.046 4.740 -0.000 0.000 0.241 274 N C -0.108 175.407 175.510 0.007 0.000 1.279 274 N CA 1.270 54.322 53.050 0.003 0.000 0.896 274 N CB 0.865 39.353 38.487 0.002 0.000 1.118 274 N HN 0.659 9.039 8.380 -0.000 0.000 0.438 275 S N -0.396 115.312 115.700 0.013 0.000 2.599 275 S HA 0.763 5.233 4.470 -0.000 0.000 0.287 275 S C -0.361 174.254 174.600 0.024 0.000 1.105 275 S CA -0.786 57.426 58.200 0.021 0.000 0.899 275 S CB 1.545 64.759 63.200 0.023 0.000 1.100 275 S HN 0.422 8.732 8.310 -0.000 0.000 0.482 276 V N -1.803 118.132 119.914 0.036 0.000 3.181 276 V HA 0.694 4.814 4.120 -0.000 0.000 0.308 276 V C -1.119 175.006 176.094 0.051 0.000 1.214 276 V CA -1.358 60.965 62.300 0.039 0.000 1.053 276 V CB 1.497 33.344 31.823 0.039 0.000 1.069 276 V HN 0.882 9.072 8.190 -0.000 0.000 0.441 277 K N 1.213 121.639 120.400 0.044 0.000 2.382 277 K HA 0.472 4.792 4.320 -0.000 0.000 0.275 277 K C 1.336 177.974 176.600 0.063 0.000 1.009 277 K CA 0.470 56.785 56.287 0.045 0.000 0.970 277 K CB 1.356 33.874 32.500 0.030 0.000 0.934 277 K HN 1.041 9.291 8.250 -0.000 0.000 0.479 278 A N 3.817 126.676 122.820 0.066 0.000 1.978 278 A HA -0.233 4.087 4.320 -0.000 0.000 0.220 278 A C 2.004 179.623 177.584 0.058 0.000 1.170 278 A CA 1.783 53.869 52.037 0.081 0.000 0.636 278 A CB -0.419 18.581 19.000 0.001 0.000 0.810 278 A HN 0.849 8.999 8.150 -0.000 0.000 0.448 279 R N 0.094 120.615 120.500 0.035 0.000 2.159 279 R HA -0.153 4.187 4.340 -0.000 0.000 0.237 279 R C 1.281 177.606 176.300 0.042 0.000 1.131 279 R CA 1.748 57.866 56.100 0.031 0.000 0.982 279 R CB -0.605 29.710 30.300 0.024 0.000 0.868 279 R HN 0.589 8.859 8.270 -0.000 0.000 0.453 280 E N 0.787 121.016 120.200 0.049 0.000 2.478 280 E HA -0.030 4.320 4.350 -0.000 0.000 0.198 280 E C 1.182 177.816 176.600 0.058 0.000 1.046 280 E CA 0.565 56.993 56.400 0.046 0.000 0.870 280 E CB 0.108 29.832 29.700 0.041 0.000 0.818 280 E HN 0.440 8.800 8.360 -0.000 0.000 0.527 281 L N 0.136 121.412 121.223 0.088 0.000 2.728 281 L HA 0.147 4.487 4.340 -0.000 0.000 0.238 281 L C 0.796 177.730 176.870 0.105 0.000 1.143 281 L CA -0.390 54.517 54.840 0.113 0.000 0.937 281 L CB 0.696 42.880 42.059 0.207 0.000 1.225 281 L HN -0.131 8.099 8.230 -0.000 0.000 0.507 282 S N 0.465 116.207 115.700 0.070 0.000 2.544 282 S HA 0.261 4.731 4.470 -0.000 0.000 0.290 282 S C 1.334 175.957 174.600 0.038 0.000 1.276 282 S CA 1.015 59.244 58.200 0.048 0.000 1.075 282 S CB 0.300 63.518 63.200 0.030 0.000 0.849 282 S HN 0.674 8.984 8.310 -0.000 0.000 0.494 283 G N 3.636 112.458 108.800 0.036 0.000 2.217 283 G HA2 -0.235 3.725 3.960 -0.000 0.000 0.246 283 G HA3 -0.235 3.725 3.960 -0.000 0.000 0.246 283 G C 0.288 175.206 174.900 0.030 0.000 0.990 283 G CA 0.218 45.332 45.100 0.023 0.000 0.627 283 G HN 0.854 9.144 8.290 -0.000 0.000 0.522 284 S N 0.431 116.160 115.700 0.049 0.000 2.593 284 S HA 0.652 5.122 4.470 -0.000 0.000 0.269 284 S C 0.611 175.235 174.600 0.039 0.000 1.334 284 S CA 0.307 58.531 58.200 0.040 0.000 1.015 284 S CB 1.535 64.761 63.200 0.043 0.000 0.912 284 S HN 0.539 8.849 8.310 -0.000 0.000 0.541 285 S N 1.675 117.386 115.700 0.019 0.000 2.718 285 S HA 0.453 4.923 4.470 -0.000 0.000 0.300 285 S C 0.158 174.757 174.600 -0.001 0.000 1.117 285 S CA -0.868 57.340 58.200 0.014 0.000 1.002 285 S CB 0.575 63.778 63.200 0.006 0.000 1.092 285 S HN 0.772 9.082 8.310 -0.000 0.000 0.542 286 N N 0.135 118.833 118.700 -0.003 0.000 2.776 286 N HA -0.137 4.603 4.740 -0.000 0.000 0.249 286 N C -1.166 174.313 175.510 -0.051 0.000 1.111 286 N CA 0.516 53.553 53.050 -0.021 0.000 0.711 286 N CB -1.627 36.846 38.487 -0.024 0.000 1.065 286 N HN 0.459 8.839 8.380 -0.000 0.000 0.556 287 L N 0.354 121.545 121.223 -0.055 0.000 2.325 287 L HA 0.627 4.967 4.340 -0.000 0.000 0.278 287 L C 0.232 177.004 176.870 -0.163 0.000 1.023 287 L CA -1.025 53.711 54.840 -0.173 0.000 0.811 287 L CB 1.702 43.619 42.059 -0.237 0.000 1.249 287 L HN 0.033 8.263 8.230 -0.000 0.000 0.431 288 L N 2.386 123.455 121.223 -0.257 0.000 2.325 288 L HA 0.562 4.902 4.340 -0.000 0.000 0.281 288 L C -1.311 175.390 176.870 -0.281 0.000 1.004 288 L CA 0.182 54.933 54.840 -0.149 0.000 0.823 288 L CB 1.202 43.214 42.059 -0.078 0.000 1.236 288 L HN 0.203 8.433 8.230 -0.000 0.000 0.415 289 F N 4.972 124.917 119.950 -0.009 0.000 2.420 289 F HA 0.741 5.268 4.527 0.000 0.000 0.342 289 F C 0.390 176.187 175.800 -0.005 0.000 1.113 289 F CA -0.308 57.689 58.000 -0.005 0.000 1.059 289 F CB 1.333 40.329 39.000 -0.007 0.000 1.128 289 F HN 0.559 8.859 8.300 -0.000 0.000 0.475 290 R N 1.698 122.296 120.500 0.164 0.000 2.739 290 R HA 0.612 4.952 4.340 -0.000 0.000 0.271 290 R C -1.576 174.775 176.300 0.086 0.000 1.010 290 R CA -1.231 54.928 56.100 0.099 0.000 0.897 290 R CB 1.819 32.149 30.300 0.049 0.000 1.236 290 R HN 0.658 8.928 8.270 -0.000 0.000 0.466 291 R N 1.932 122.470 120.500 0.064 0.000 2.229 291 R HA 0.165 4.505 4.340 -0.000 0.000 0.328 291 R C -0.597 175.725 176.300 0.036 0.000 1.009 291 R CA -0.589 55.543 56.100 0.052 0.000 0.864 291 R CB 0.916 31.245 30.300 0.048 0.000 1.085 291 R HN 0.690 8.960 8.270 -0.000 0.000 0.453 292 N N 1.978 120.697 118.700 0.030 0.000 2.411 292 N HA -0.096 4.644 4.740 -0.000 0.000 0.261 292 N C 0.570 176.091 175.510 0.018 0.000 1.248 292 N CA 0.548 53.611 53.050 0.020 0.000 0.885 292 N CB 1.041 39.538 38.487 0.017 0.000 1.062 292 N HN 0.758 9.138 8.380 -0.000 0.000 0.471 293 S N 2.131 117.840 115.700 0.015 0.000 2.527 293 S HA -0.007 4.463 4.470 -0.000 0.000 0.222 293 S C 1.602 176.209 174.600 0.011 0.000 0.985 293 S CA 0.203 58.411 58.200 0.014 0.000 0.921 293 S CB 0.210 63.417 63.200 0.012 0.000 0.772 293 S HN 0.347 8.657 8.310 -0.000 0.000 0.529 294 V N 2.134 122.054 119.914 0.010 0.000 2.492 294 V HA 0.055 4.175 4.120 -0.000 0.000 0.241 294 V C 2.800 178.900 176.094 0.009 0.000 1.041 294 V CA 1.466 63.770 62.300 0.008 0.000 1.057 294 V CB -0.289 31.538 31.823 0.006 0.000 0.711 294 V HN 0.736 8.926 8.190 -0.000 0.000 0.468 295 S N -0.248 115.458 115.700 0.010 0.000 2.517 295 S HA 0.269 4.739 4.470 -0.000 0.000 0.214 295 S C 1.733 176.341 174.600 0.013 0.000 0.991 295 S CA 0.847 59.053 58.200 0.010 0.000 0.906 295 S CB 0.722 63.928 63.200 0.010 0.000 0.789 295 S HN 1.144 9.454 8.310 -0.000 0.000 0.513 296 G N 1.172 109.981 108.800 0.016 0.000 2.184 296 G HA2 -0.180 3.780 3.960 -0.000 0.000 0.264 296 G HA3 -0.180 3.780 3.960 -0.000 0.000 0.264 296 G C 0.298 175.212 174.900 0.024 0.000 0.975 296 G CA 0.104 45.216 45.100 0.019 0.000 0.642 296 G HN 1.345 9.635 8.290 -0.000 0.000 0.536 297 A N -0.075 122.760 122.820 0.024 0.000 2.388 297 A HA 0.666 4.986 4.320 -0.000 0.000 0.257 297 A C 0.718 178.327 177.584 0.042 0.000 1.095 297 A CA 0.236 52.291 52.037 0.030 0.000 0.791 297 A CB 0.907 19.921 19.000 0.024 0.000 1.029 297 A HN 1.170 9.320 8.150 -0.000 0.000 0.489 298 V N 3.066 123.013 119.914 0.057 0.000 2.508 298 V HA 0.204 4.324 4.120 -0.000 0.000 0.281 298 V C 0.328 176.473 176.094 0.085 0.000 1.041 298 V CA 0.260 62.611 62.300 0.086 0.000 1.016 298 V CB 0.239 32.126 31.823 0.106 0.000 0.984 298 V HN 0.964 9.154 8.190 -0.000 0.000 0.478 299 E N 2.723 122.972 120.200 0.082 0.000 2.312 299 E HA 0.688 5.038 4.350 -0.000 0.000 0.267 299 E C -1.382 175.208 176.600 -0.018 0.000 0.894 299 E CA -0.755 55.663 56.400 0.031 0.000 0.773 299 E CB 2.980 32.682 29.700 0.004 0.000 1.241 299 E HN 0.434 8.794 8.360 -0.000 0.000 0.432 300 V N 3.203 123.047 119.914 -0.118 0.000 2.604 300 V HA 0.524 4.644 4.120 -0.000 0.000 0.305 300 V C -1.594 174.358 176.094 -0.237 0.000 1.043 300 V CA -0.538 61.552 62.300 -0.349 0.000 0.888 300 V CB 1.245 32.745 31.823 -0.539 0.000 0.995 300 V HN 0.459 8.649 8.190 -0.000 0.000 0.429 301 L N 5.153 126.226 121.223 -0.251 0.000 2.354 301 L HA 0.859 5.199 4.340 -0.000 0.000 0.264 301 L C 0.372 177.145 176.870 -0.162 0.000 1.008 301 L CA -0.205 54.541 54.840 -0.156 0.000 0.819 301 L CB 1.812 43.808 42.059 -0.106 0.000 1.339 301 L HN 0.787 9.017 8.230 -0.000 0.000 0.420 302 A N 1.277 124.031 122.820 -0.109 0.000 2.425 302 A HA 0.408 4.728 4.320 -0.000 0.000 0.249 302 A C 0.786 178.330 177.584 -0.067 0.000 1.084 302 A CA -0.058 51.928 52.037 -0.085 0.000 0.781 302 A CB 0.119 19.084 19.000 -0.059 0.000 1.019 302 A HN 0.802 8.952 8.150 -0.000 0.000 0.490 303 R N 0.283 120.750 120.500 -0.056 0.000 2.334 303 R HA 0.043 4.383 4.340 -0.000 0.000 0.216 303 R C -0.345 175.938 176.300 -0.027 0.000 0.905 303 R CA 0.781 56.858 56.100 -0.039 0.000 1.064 303 R CB 0.360 30.641 30.300 -0.032 0.000 1.046 303 R HN 0.882 9.152 8.270 -0.000 0.000 0.508 304 D N -1.910 118.473 120.400 -0.028 0.000 2.539 304 D HA 0.078 4.718 4.640 -0.000 0.000 0.232 304 D C 1.005 177.293 176.300 -0.019 0.000 1.256 304 D CA 0.380 54.368 54.000 -0.020 0.000 0.810 304 D CB 0.478 41.267 40.800 -0.019 0.000 1.090 304 D HN 0.092 8.462 8.370 -0.000 0.000 0.519 305 G N 1.040 109.826 108.800 -0.023 0.000 2.189 305 G HA2 -0.306 3.654 3.960 -0.000 0.000 0.267 305 G HA3 -0.306 3.654 3.960 -0.000 0.000 0.267 305 G C 0.661 175.549 174.900 -0.021 0.000 0.975 305 G CA 0.284 45.372 45.100 -0.021 0.000 0.644 305 G HN 0.356 8.646 8.290 -0.000 0.000 0.537 306 Q N 0.322 120.109 119.800 -0.023 0.000 2.186 306 Q HA 0.452 4.792 4.340 -0.000 0.000 0.241 306 Q C 1.346 177.331 176.000 -0.025 0.000 0.849 306 Q CA 0.472 56.262 55.803 -0.021 0.000 1.053 306 Q CB 0.312 29.040 28.738 -0.017 0.000 1.146 306 Q HN 1.673 9.943 8.270 -0.000 0.000 0.475 307 G N 1.484 110.266 108.800 -0.030 0.000 2.914 307 G HA2 -0.254 3.706 3.960 -0.000 0.000 0.254 307 G HA3 -0.254 3.706 3.960 -0.000 0.000 0.254 307 G C -0.150 174.727 174.900 -0.037 0.000 1.449 307 G CA -0.611 44.468 45.100 -0.034 0.000 0.925 307 G HN 0.291 8.581 8.290 -0.000 0.000 0.555 308 I N 0.721 121.267 120.570 -0.040 0.000 2.428 308 I HA 0.599 4.769 4.170 -0.000 0.000 0.296 308 I C 0.876 176.977 176.117 -0.027 0.000 0.985 308 I CA -0.165 61.109 61.300 -0.043 0.000 1.260 308 I CB 1.037 39.006 38.000 -0.052 0.000 1.389 308 I HN 1.051 9.261 8.210 -0.000 0.000 0.484 309 A N 6.922 129.728 122.820 -0.022 0.000 2.318 309 A HA 0.618 4.938 4.320 -0.000 0.000 0.317 309 A C -0.118 177.465 177.584 -0.001 0.000 1.159 309 A CA -0.580 51.451 52.037 -0.010 0.000 0.799 309 A CB 0.940 19.936 19.000 -0.008 0.000 1.194 309 A HN 0.562 8.712 8.150 -0.000 0.000 0.479 310 L N 0.000 121.225 121.223 0.003 0.000 2.949 310 L HA 0.000 4.340 4.340 -0.000 0.000 0.249 310 L CA 0.000 54.848 54.840 0.013 0.000 0.813 310 L CB 0.000 42.066 42.059 0.011 0.000 0.961 310 L HN 0.000 8.230 8.230 -0.000 0.000 0.502