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 1vgy_1_B DATA FIRST_RESID 2 DATA SEQUENCE TETQSLELAK ELISRPSVTP DDRDCQKLXA ERLHKIGFAA EEXHFGNTKN DATA SEQUENCE IWLRRGTKAP VVCFAGHTDV VPTGPVEKWD SPPFEPAERD GRLYGRGAAD DATA SEQUENCE XKTSIACFVT ACERFVAKHP NHQGSIALLI TSDEEGDALD GTTKVVDVLK DATA SEQUENCE ARDELIDYCI VGEPTAVDKL GDXIKNGRRG SLSGNLTVKG KQGHIAYPHL DATA SEQUENCE AINPVHTFAP ALLELTQEVW DEGNEYFPPT SFQISNINGG TGATNVIPGE DATA SEQUENCE LNVKFNFRFS TESTEAGLKQ RVHAILDKHG VQYDLQWSCS GQPFLTQAGK DATA SEQUENCE LTDVARAAIA ETCGIEAELS TTGGTSDGRF IKAXAQELIE LGPSNATIHQ DATA SEQUENCE INENVRLNDI PKLSAVYEGI LVRLL 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 T HA 0.000 nan 4.350 nan 0.000 0.228 2 T C 0.000 174.697 174.700 -0.006 0.000 1.109 2 T CA 0.000 62.096 62.100 -0.006 0.000 1.349 2 T CB 0.000 68.865 68.868 -0.005 0.000 0.612 3 E N -0.108 120.088 120.200 -0.007 0.000 2.425 3 E HA 0.525 4.874 4.350 -0.002 0.000 0.258 3 E C 0.633 177.229 176.600 -0.007 0.000 1.151 3 E CA -0.062 56.334 56.400 -0.007 0.000 0.958 3 E CB 0.637 30.332 29.700 -0.008 0.000 0.968 3 E HN 0.026 8.386 8.360 -0.000 0.000 0.451 4 T N 0.134 114.684 114.554 -0.006 0.000 3.040 4 T HA -0.003 4.346 4.350 -0.002 0.000 0.266 4 T C 1.255 175.953 174.700 -0.004 0.000 1.005 4 T CA 0.038 62.136 62.100 -0.004 0.000 0.906 4 T CB 0.237 69.105 68.868 -0.001 0.000 1.082 4 T HN 0.339 8.579 8.240 -0.000 0.000 0.531 5 Q N 0.611 120.407 119.800 -0.007 0.000 2.119 5 Q HA -0.035 4.304 4.340 -0.002 0.000 0.201 5 Q C 2.739 178.732 176.000 -0.010 0.000 0.972 5 Q CA 1.602 57.400 55.803 -0.009 0.000 0.847 5 Q CB -0.533 28.197 28.738 -0.014 0.000 0.903 5 Q HN 0.636 8.906 8.270 -0.000 0.000 0.433 6 S N 1.009 116.702 115.700 -0.012 0.000 2.356 6 S HA -0.115 4.354 4.470 -0.002 0.000 0.223 6 S C 1.875 176.474 174.600 -0.002 0.000 1.032 6 S CA 1.363 59.557 58.200 -0.010 0.000 1.005 6 S CB -0.521 62.671 63.200 -0.014 0.000 0.867 6 S HN 0.436 8.746 8.310 -0.000 0.000 0.449 7 L N 2.616 123.838 121.223 -0.001 0.000 2.043 7 L HA -0.198 4.141 4.340 -0.002 0.000 0.212 7 L C 2.378 179.255 176.870 0.012 0.000 1.075 7 L CA 2.336 57.180 54.840 0.006 0.000 0.752 7 L CB -0.854 41.208 42.059 0.005 0.000 0.891 7 L HN 0.535 8.765 8.230 -0.000 0.000 0.432 8 E N -0.812 119.393 120.200 0.008 0.000 2.072 8 E HA -0.263 4.087 4.350 -0.002 0.000 0.191 8 E C 2.176 178.783 176.600 0.011 0.000 0.985 8 E CA 1.493 57.899 56.400 0.010 0.000 0.801 8 E CB -0.673 29.031 29.700 0.007 0.000 0.750 8 E HN 0.434 8.794 8.360 -0.000 0.000 0.452 9 L N 1.318 122.544 121.223 0.005 0.000 2.093 9 L HA 0.003 4.342 4.340 -0.002 0.000 0.208 9 L C 2.426 179.306 176.870 0.016 0.000 1.085 9 L CA 2.039 56.882 54.840 0.005 0.000 0.755 9 L CB -0.856 41.198 42.059 -0.007 0.000 0.904 9 L HN 0.267 8.497 8.230 -0.000 0.000 0.435 10 A N -0.179 122.653 122.820 0.020 0.000 1.865 10 A HA -0.273 4.046 4.320 -0.002 0.000 0.217 10 A C 2.311 179.920 177.584 0.042 0.000 1.191 10 A CA 2.241 54.298 52.037 0.033 0.000 0.623 10 A CB -0.586 18.433 19.000 0.031 0.000 0.826 10 A HN 0.524 8.674 8.150 -0.000 0.000 0.444 11 K N -0.695 119.727 120.400 0.038 0.000 2.032 11 K HA -0.170 4.149 4.320 -0.002 0.000 0.209 11 K C 2.388 179.015 176.600 0.044 0.000 1.048 11 K CA 1.891 58.206 56.287 0.046 0.000 0.927 11 K CB -0.493 32.032 32.500 0.040 0.000 0.712 11 K HN 0.636 8.886 8.250 -0.000 0.000 0.441 12 E N 1.866 122.085 120.200 0.031 0.000 2.070 12 E HA -0.178 4.171 4.350 -0.002 0.000 0.197 12 E C 1.967 178.584 176.600 0.028 0.000 1.004 12 E CA 1.573 57.988 56.400 0.025 0.000 0.805 12 E CB -0.990 28.719 29.700 0.015 0.000 0.744 12 E HN 0.286 8.646 8.360 -0.000 0.000 0.451 13 L N -0.592 120.650 121.223 0.033 0.000 2.046 13 L HA -0.057 4.282 4.340 -0.002 0.000 0.208 13 L C 2.891 179.797 176.870 0.060 0.000 1.077 13 L CA 1.266 56.129 54.840 0.039 0.000 0.747 13 L CB -0.323 41.761 42.059 0.043 0.000 0.896 13 L HN 0.305 8.535 8.230 -0.000 0.000 0.432 14 I N -0.292 120.326 120.570 0.080 0.000 2.493 14 I HA -0.237 3.932 4.170 -0.002 0.000 0.254 14 I C 2.613 178.823 176.117 0.154 0.000 1.160 14 I CA 1.295 62.671 61.300 0.127 0.000 1.445 14 I CB -0.188 37.883 38.000 0.117 0.000 1.086 14 I HN 0.317 8.527 8.210 -0.000 0.000 0.433 15 S N 0.373 116.129 115.700 0.094 0.000 2.515 15 S HA -0.021 4.448 4.470 -0.002 0.000 0.231 15 S C 1.043 175.651 174.600 0.014 0.000 0.987 15 S CA 0.075 58.323 58.200 0.080 0.000 0.936 15 S CB -0.194 63.035 63.200 0.049 0.000 0.766 15 S HN 0.217 8.527 8.310 -0.000 0.000 0.528 16 R N 3.054 123.540 120.500 -0.023 0.000 2.221 16 R HA 0.377 4.716 4.340 -0.002 0.000 0.327 16 R C -2.696 173.422 176.300 -0.304 0.000 1.033 16 R CA -2.192 53.833 56.100 -0.125 0.000 0.887 16 R CB 0.793 31.047 30.300 -0.076 0.000 1.057 16 R HN 0.189 8.459 8.270 -0.000 0.000 0.455 17 P HA 0.067 4.487 4.420 -0.000 0.000 0.231 17 P C -0.892 176.036 177.300 -0.620 0.000 1.811 17 P CA -0.275 62.010 63.100 -1.359 0.000 1.051 17 P CB 0.199 31.020 31.700 -1.465 0.000 1.951 18 S N 0.257 115.781 115.700 -0.293 0.000 3.811 18 S HA 0.160 4.629 4.470 -0.002 0.000 0.205 18 S C 0.593 175.186 174.600 -0.013 0.000 1.445 18 S CA -0.639 57.499 58.200 -0.104 0.000 1.097 18 S CB -0.938 62.249 63.200 -0.021 0.000 1.350 18 S HN 0.055 8.365 8.310 -0.000 0.000 0.471 19 V N 2.859 122.759 119.914 -0.024 0.000 2.599 19 V HA 0.032 4.151 4.120 -0.002 0.000 0.300 19 V C 1.038 177.147 176.094 0.025 0.000 1.034 19 V CA -0.044 62.291 62.300 0.058 0.000 1.115 19 V CB 0.041 31.914 31.823 0.082 0.000 0.934 19 V HN 0.702 8.892 8.190 -0.000 0.000 0.485 20 T N 8.911 123.484 114.554 0.032 0.000 2.903 20 T HA 0.018 4.367 4.350 -0.002 0.000 0.299 20 T C -1.461 173.239 174.700 0.000 0.000 1.041 20 T CA 0.087 62.194 62.100 0.011 0.000 1.138 20 T CB 0.276 69.143 68.868 -0.003 0.000 1.040 20 T HN 0.754 8.994 8.240 -0.000 0.000 0.524 21 P HA 0.240 4.660 4.420 -0.000 0.000 0.274 21 P C -0.583 176.705 177.300 -0.021 0.000 1.673 21 P CA -0.260 62.834 63.100 -0.009 0.000 1.193 21 P CB 0.322 32.015 31.700 -0.011 0.000 1.571 22 D N 0.975 121.360 120.400 -0.025 0.000 2.338 22 D HA -0.003 4.636 4.640 -0.002 0.000 0.255 22 D C 0.826 177.101 176.300 -0.041 0.000 1.237 22 D CA 0.199 54.174 54.000 -0.042 0.000 0.883 22 D CB 0.647 41.415 40.800 -0.054 0.000 1.087 22 D HN -0.031 8.339 8.370 -0.000 0.000 0.485 23 D N 2.519 122.890 120.400 -0.049 0.000 2.224 23 D HA -0.103 4.536 4.640 -0.002 0.000 0.205 23 D C 0.479 176.755 176.300 -0.039 0.000 0.965 23 D CA 0.388 54.365 54.000 -0.037 0.000 0.852 23 D CB 0.263 41.028 40.800 -0.058 0.000 0.947 23 D HN 0.228 8.598 8.370 -0.000 0.000 0.494 24 R N 0.537 121.004 120.500 -0.054 0.000 3.641 24 R HA -0.191 4.148 4.340 -0.002 0.000 0.286 24 R C -0.634 175.642 176.300 -0.039 0.000 1.153 24 R CA 1.039 57.103 56.100 -0.061 0.000 0.775 24 R CB -2.549 27.695 30.300 -0.093 0.000 1.215 24 R HN 0.480 8.750 8.270 -0.000 0.000 0.474 25 D N -2.577 117.808 120.400 -0.026 0.000 2.772 25 D HA -0.231 4.408 4.640 -0.002 0.000 0.233 25 D C 0.964 177.263 176.300 -0.002 0.000 1.143 25 D CA 1.209 55.204 54.000 -0.009 0.000 0.700 25 D CB -1.351 39.444 40.800 -0.008 0.000 1.076 25 D HN 0.478 8.848 8.370 -0.000 0.000 0.430 26 C N -0.176 119.124 119.300 0.000 0.000 2.475 26 C HA -0.099 4.360 4.460 -0.002 0.000 0.279 26 C C 2.663 177.667 174.990 0.024 0.000 1.322 26 C CA 0.684 59.710 59.018 0.012 0.000 1.734 26 C CB -0.321 27.431 27.740 0.021 0.000 2.005 26 C HN 0.493 8.723 8.230 -0.000 0.000 0.495 27 Q N 0.654 120.473 119.800 0.031 0.000 2.167 27 Q HA -0.193 4.146 4.340 -0.002 0.000 0.202 27 Q C 2.267 178.297 176.000 0.050 0.000 0.970 27 Q CA 1.112 56.946 55.803 0.050 0.000 0.855 27 Q CB -0.188 28.588 28.738 0.065 0.000 0.911 27 Q HN 0.655 8.925 8.270 -0.000 0.000 0.438 28 K N 1.045 121.469 120.400 0.040 0.000 2.025 28 K HA -0.082 4.237 4.320 -0.002 0.000 0.207 28 K C 1.219 177.832 176.600 0.022 0.000 1.049 28 K CA 0.264 56.571 56.287 0.034 0.000 0.933 28 K CB -0.219 32.296 32.500 0.025 0.000 0.714 28 K HN 0.129 8.379 8.250 -0.000 0.000 0.438 32 E N 0.309 120.535 120.200 0.044 0.000 2.076 32 E HA -0.092 4.257 4.350 -0.002 0.000 0.190 32 E C 2.080 178.718 176.600 0.064 0.000 0.979 32 E CA 1.163 57.589 56.400 0.043 0.000 0.807 32 E CB -0.045 29.660 29.700 0.008 0.000 0.761 32 E HN 0.536 8.896 8.360 -0.000 0.000 0.454 33 R N 1.004 121.519 120.500 0.026 0.000 2.073 33 R HA -0.090 4.249 4.340 -0.002 0.000 0.234 33 R C 2.224 178.527 176.300 0.006 0.000 1.134 33 R CA 1.037 57.142 56.100 0.007 0.000 0.952 33 R CB -0.126 30.159 30.300 -0.026 0.000 0.850 33 R HN 0.120 8.390 8.270 -0.000 0.000 0.433 34 L N -0.743 120.460 121.223 -0.034 0.000 2.291 34 L HA -0.100 4.239 4.340 -0.002 0.000 0.214 34 L C 2.233 179.185 176.870 0.137 0.000 1.120 34 L CA 1.040 55.832 54.840 -0.081 0.000 0.799 34 L CB -0.432 41.401 42.059 -0.377 0.000 0.925 34 L HN 0.388 8.618 8.230 -0.000 0.000 0.446 35 H N 0.388 119.503 119.070 0.075 0.000 2.421 35 H HA -0.161 4.394 4.556 -0.002 0.000 0.298 35 H C 2.271 177.654 175.328 0.090 0.000 1.087 35 H CA 1.605 57.713 56.048 0.100 0.000 1.330 35 H CB 0.260 30.058 29.762 0.060 0.000 1.388 35 H HN -0.050 8.230 8.280 -0.000 0.000 0.526 36 K N 0.329 120.825 120.400 0.159 0.000 2.280 36 K HA -0.037 4.282 4.320 -0.002 0.000 0.202 36 K C 1.611 178.243 176.600 0.054 0.000 1.047 36 K CA 1.287 57.635 56.287 0.101 0.000 0.942 36 K CB -0.590 31.959 32.500 0.082 0.000 0.739 36 K HN 0.744 8.994 8.250 -0.000 0.000 0.457 37 I N -4.018 116.607 120.570 0.092 0.000 3.654 37 I HA 0.545 4.714 4.170 -0.002 0.000 0.337 37 I C 0.775 176.960 176.117 0.114 0.000 1.568 37 I CA 0.090 61.458 61.300 0.113 0.000 1.115 37 I CB 0.498 38.592 38.000 0.156 0.000 1.300 37 I HN 0.220 8.430 8.210 -0.000 0.000 0.471 38 G N 0.970 109.766 108.800 -0.006 0.000 2.141 38 G HA2 -0.251 3.708 3.960 -0.002 0.000 0.231 38 G HA3 -0.251 3.708 3.960 -0.002 0.000 0.231 38 G C -0.252 174.545 174.900 -0.172 0.000 0.984 38 G CA -0.385 44.643 45.100 -0.120 0.000 0.660 38 G HN 0.349 8.639 8.290 -0.000 0.000 0.525 39 F N 1.695 121.571 119.950 -0.124 0.000 2.411 39 F HA 0.702 5.228 4.527 -0.002 0.000 0.350 39 F C 0.822 176.580 175.800 -0.070 0.000 1.114 39 F CA -0.153 57.799 58.000 -0.079 0.000 1.135 39 F CB 1.591 40.567 39.000 -0.039 0.000 1.120 39 F HN 0.316 8.616 8.300 -0.000 0.000 0.495 40 A N 2.554 125.417 122.820 0.071 0.000 2.293 40 A HA 0.840 5.159 4.320 -0.002 0.000 0.302 40 A C -0.617 177.047 177.584 0.133 0.000 1.119 40 A CA -0.408 51.687 52.037 0.096 0.000 0.823 40 A CB 0.506 19.534 19.000 0.047 0.000 1.097 40 A HN 0.871 9.021 8.150 -0.000 0.000 0.491 41 A N 1.138 124.049 122.820 0.152 0.000 2.330 41 A HA 0.642 4.961 4.320 -0.002 0.000 0.313 41 A C -0.452 177.212 177.584 0.132 0.000 1.124 41 A CA -0.405 51.715 52.037 0.139 0.000 0.774 41 A CB 0.675 19.756 19.000 0.133 0.000 1.198 41 A HN 0.836 8.986 8.150 -0.000 0.000 0.465 42 E N 2.836 123.140 120.200 0.173 0.000 2.186 42 E HA 0.300 4.649 4.350 -0.002 0.000 0.255 42 E C -0.383 176.304 176.600 0.146 0.000 0.881 42 E CA -0.271 56.229 56.400 0.167 0.000 0.752 42 E CB 0.742 30.591 29.700 0.248 0.000 1.176 42 E HN 0.785 9.145 8.360 -0.000 0.000 0.421 46 F N 1.392 121.394 119.950 0.086 0.000 2.518 46 F HA 0.500 5.026 4.527 -0.002 0.000 0.323 46 F C 1.214 177.020 175.800 0.011 0.000 1.129 46 F CA 0.489 58.508 58.000 0.031 0.000 0.920 46 F CB 1.756 40.754 39.000 -0.004 0.000 1.160 46 F HN 0.925 9.225 8.300 -0.000 0.000 0.440 47 G N 3.099 111.995 108.800 0.160 0.000 2.622 47 G HA2 -0.367 3.592 3.960 -0.002 0.000 0.307 47 G HA3 -0.367 3.592 3.960 -0.002 0.000 0.307 47 G C 0.678 175.606 174.900 0.046 0.000 1.226 47 G CA 0.572 45.724 45.100 0.086 0.000 0.997 47 G HN 0.606 8.896 8.290 -0.000 0.000 0.551 48 N N 1.447 120.163 118.700 0.027 0.000 2.235 48 N HA 0.204 4.943 4.740 -0.002 0.000 0.209 48 N C 0.170 175.663 175.510 -0.029 0.000 1.122 48 N CA 0.819 53.867 53.050 -0.003 0.000 0.845 48 N CB 0.558 39.043 38.487 -0.005 0.000 1.004 48 N HN 0.500 8.880 8.380 -0.000 0.000 0.499 49 T N 0.866 115.412 114.554 -0.012 0.000 2.799 49 T HA 0.284 4.634 4.350 -0.002 0.000 0.286 49 T C 0.352 174.967 174.700 -0.142 0.000 0.973 49 T CA -0.364 61.713 62.100 -0.039 0.000 1.035 49 T CB 1.775 70.659 68.868 0.026 0.000 0.932 49 T HN -0.124 8.116 8.240 -0.000 0.000 0.469 50 K N 3.578 123.836 120.400 -0.236 0.000 2.211 50 K HA 0.404 4.723 4.320 -0.002 0.000 0.275 50 K C -0.186 176.319 176.600 -0.159 0.000 1.024 50 K CA -0.723 55.270 56.287 -0.491 0.000 0.887 50 K CB 0.664 32.833 32.500 -0.551 0.000 1.084 50 K HN 0.500 8.750 8.250 -0.000 0.000 0.463 51 N N 2.714 121.400 118.700 -0.023 0.000 2.262 51 N HA 0.545 5.284 4.740 -0.002 0.000 0.295 51 N C -1.261 174.364 175.510 0.192 0.000 1.161 51 N CA -0.576 52.542 53.050 0.112 0.000 0.767 51 N CB 2.382 40.960 38.487 0.152 0.000 1.499 51 N HN 0.465 8.845 8.380 -0.000 0.000 0.476 52 I N -0.021 120.671 120.570 0.203 0.000 2.722 52 I HA 0.302 4.471 4.170 -0.002 0.000 0.292 52 I C -1.643 174.670 176.117 0.326 0.000 1.267 52 I CA -0.680 60.763 61.300 0.238 0.000 1.036 52 I CB 2.414 40.530 38.000 0.192 0.000 1.281 52 I HN 0.551 8.761 8.210 -0.000 0.000 0.423 53 W N 9.427 130.787 121.300 0.099 0.000 2.278 53 W HA 0.491 5.151 4.660 -0.001 0.000 0.317 53 W C -1.968 174.633 176.519 0.136 0.000 1.030 53 W CA -0.769 56.641 57.345 0.108 0.000 1.334 53 W CB 1.208 30.722 29.460 0.089 0.000 1.215 53 W HN 0.306 8.486 8.180 -0.000 0.000 0.405 54 L N 7.285 128.462 121.223 -0.078 0.000 2.264 54 L HA 0.512 4.851 4.340 -0.002 0.000 0.289 54 L C 0.206 176.974 176.870 -0.168 0.000 1.044 54 L CA -0.394 54.429 54.840 -0.028 0.000 0.807 54 L CB 1.460 43.564 42.059 0.075 0.000 1.192 54 L HN 0.401 8.631 8.230 -0.000 0.000 0.425 55 R N 3.668 124.076 120.500 -0.155 0.000 2.621 55 R HA 0.522 4.861 4.340 -0.002 0.000 0.284 55 R C -1.181 174.922 176.300 -0.328 0.000 0.998 55 R CA -0.818 55.104 56.100 -0.297 0.000 0.895 55 R CB 2.067 32.084 30.300 -0.470 0.000 1.195 55 R HN 0.623 8.893 8.270 -0.000 0.000 0.450 56 R N 3.022 123.168 120.500 -0.591 0.000 2.409 56 R HA 0.562 4.901 4.340 -0.002 0.000 0.313 56 R C -0.980 175.137 176.300 -0.305 0.000 0.953 56 R CA 0.352 56.044 56.100 -0.681 0.000 0.849 56 R CB 1.529 30.981 30.300 -1.414 0.000 1.171 56 R HN 0.899 9.169 8.270 -0.000 0.000 0.458 57 G N 1.433 110.123 108.800 -0.184 0.000 2.619 57 G HA2 -0.215 3.744 3.960 -0.002 0.000 0.686 57 G HA3 -0.215 3.744 3.960 -0.002 0.000 0.686 57 G C 0.102 174.980 174.900 -0.037 0.000 1.256 57 G CA -0.176 44.874 45.100 -0.084 0.000 0.826 57 G HN 0.658 8.948 8.290 -0.000 0.000 0.619 58 T N -2.909 111.640 114.554 -0.008 0.000 3.058 58 T HA 0.484 4.833 4.350 -0.002 0.000 0.278 58 T C 0.583 175.305 174.700 0.036 0.000 0.974 58 T CA 1.085 63.197 62.100 0.020 0.000 0.893 58 T CB 0.158 69.033 68.868 0.011 0.000 1.138 58 T HN 1.128 9.368 8.240 -0.000 0.000 0.529 59 K N 0.673 121.097 120.400 0.039 0.000 2.395 59 K HA 0.867 5.186 4.320 -0.002 0.000 0.245 59 K C -0.557 176.082 176.600 0.065 0.000 1.017 59 K CA -1.055 55.261 56.287 0.047 0.000 0.852 59 K CB 1.884 34.406 32.500 0.036 0.000 1.311 59 K HN 0.012 8.262 8.250 -0.000 0.000 0.452 60 A N 1.600 124.456 122.820 0.061 0.000 2.366 60 A HA 0.382 4.701 4.320 -0.002 0.000 0.249 60 A C -2.104 175.534 177.584 0.089 0.000 1.084 60 A CA -1.248 50.831 52.037 0.069 0.000 0.794 60 A CB -0.533 18.494 19.000 0.045 0.000 1.034 60 A HN 0.683 8.833 8.150 -0.000 0.000 0.491 61 P HA 0.251 4.671 4.420 -0.000 0.000 0.279 61 P C -0.672 176.715 177.300 0.144 0.000 1.239 61 P CA -0.062 63.122 63.100 0.140 0.000 0.789 61 P CB 1.311 33.168 31.700 0.261 0.000 0.933 62 V N 4.729 124.711 119.914 0.113 0.000 2.350 62 V HA 0.250 4.369 4.120 -0.002 0.000 0.276 62 V C -0.575 175.614 176.094 0.158 0.000 1.028 62 V CA -0.625 61.751 62.300 0.126 0.000 0.860 62 V CB 1.218 33.117 31.823 0.126 0.000 0.990 62 V HN 0.226 8.416 8.190 -0.000 0.000 0.453 63 V N 7.190 127.204 119.914 0.165 0.000 2.370 63 V HA 0.417 4.536 4.120 -0.002 0.000 0.279 63 V C 0.132 176.306 176.094 0.133 0.000 1.029 63 V CA -0.355 62.050 62.300 0.176 0.000 0.870 63 V CB 1.245 33.148 31.823 0.132 0.000 0.984 63 V HN 1.045 9.235 8.190 -0.000 0.000 0.451 64 C N 6.854 126.216 119.300 0.102 0.000 2.369 64 C HA 0.673 5.132 4.460 -0.002 0.000 0.322 64 C C -0.484 174.453 174.990 -0.089 0.000 1.258 64 C CA -1.006 58.045 59.018 0.055 0.000 1.487 64 C CB 0.303 28.132 27.740 0.149 0.000 2.165 64 C HN 0.821 9.051 8.230 -0.000 0.000 0.483 65 F N 5.701 125.379 119.950 -0.453 0.000 2.404 65 F HA 0.677 5.203 4.527 -0.002 0.000 0.345 65 F C 0.145 175.729 175.800 -0.360 0.000 1.110 65 F CA 0.016 57.547 58.000 -0.782 0.000 1.130 65 F CB 0.879 38.773 39.000 -1.844 0.000 1.129 65 F HN 0.871 9.171 8.300 -0.000 0.000 0.500 66 A N 4.202 126.508 122.820 -0.856 0.000 2.365 66 A HA 0.935 5.254 4.320 -0.002 0.000 0.318 66 A C -0.411 176.745 177.584 -0.714 0.000 1.091 66 A CA -0.050 51.692 52.037 -0.491 0.000 0.763 66 A CB 1.190 20.055 19.000 -0.226 0.000 1.248 66 A HN 1.321 9.470 8.150 -0.000 0.000 0.442 67 G N 0.125 108.762 108.800 -0.271 0.000 2.495 67 G HA2 0.601 4.560 3.960 -0.002 0.000 0.294 67 G HA3 0.601 4.560 3.960 -0.002 0.000 0.294 67 G C -1.488 173.441 174.900 0.049 0.000 1.397 67 G CA -0.304 44.689 45.100 -0.177 0.000 0.790 67 G HN 1.755 10.045 8.290 -0.000 0.000 0.486 68 H N -2.610 116.494 119.070 0.056 0.000 2.637 68 H HA 0.694 5.249 4.556 -0.001 0.000 0.363 68 H C 0.691 176.074 175.328 0.092 0.000 1.131 68 H CA -0.136 55.956 56.048 0.074 0.000 1.183 68 H CB 1.930 31.733 29.762 0.068 0.000 1.637 68 H HN 0.548 8.828 8.280 -0.000 0.000 0.531 69 T N -1.314 113.345 114.554 0.175 0.000 3.065 69 T HA 0.013 4.362 4.350 -0.002 0.000 0.252 69 T C 0.322 175.130 174.700 0.179 0.000 1.099 69 T CA -0.044 62.130 62.100 0.122 0.000 1.063 69 T CB -0.391 68.527 68.868 0.083 0.000 0.948 69 T HN 0.770 9.010 8.240 -0.000 0.000 0.506 70 D N 2.421 122.985 120.400 0.273 0.000 2.344 70 D HA 0.369 5.008 4.640 -0.002 0.000 0.244 70 D C 0.210 176.684 176.300 0.290 0.000 1.134 70 D CA -0.605 53.519 54.000 0.206 0.000 0.930 70 D CB 1.745 42.614 40.800 0.115 0.000 1.175 70 D HN 0.324 8.694 8.370 -0.000 0.000 0.437 71 V N -2.206 117.831 119.914 0.205 0.000 2.962 71 V HA 0.595 4.714 4.120 -0.002 0.000 0.313 71 V C 0.375 176.559 176.094 0.150 0.000 1.099 71 V CA -1.148 61.289 62.300 0.227 0.000 0.971 71 V CB 1.185 33.172 31.823 0.273 0.000 1.028 71 V HN 0.613 8.803 8.190 -0.000 0.000 0.430 72 V N -0.245 119.732 119.914 0.105 0.000 3.185 72 V HA 0.523 4.642 4.120 -0.002 0.000 0.305 72 V C -2.165 173.988 176.094 0.098 0.000 1.090 72 V CA -1.545 60.766 62.300 0.019 0.000 1.107 72 V CB -0.285 31.452 31.823 -0.144 0.000 1.061 72 V HN 0.878 9.068 8.190 -0.000 0.000 0.480 73 P HA 0.137 4.557 4.420 -0.000 0.000 0.266 73 P C 1.010 178.387 177.300 0.128 0.000 1.195 73 P CA 0.517 63.680 63.100 0.105 0.000 0.768 73 P CB 0.473 32.215 31.700 0.070 0.000 0.838 74 T N -0.178 114.440 114.554 0.107 0.000 3.023 74 T HA 0.228 4.577 4.350 -0.002 0.000 0.266 74 T C 0.995 175.869 174.700 0.290 0.000 1.093 74 T CA 0.566 62.745 62.100 0.133 0.000 1.129 74 T CB -1.041 67.664 68.868 -0.272 0.000 0.899 74 T HN 0.754 8.994 8.240 -0.000 0.000 0.491 75 G N 1.935 110.836 108.800 0.169 0.000 2.741 75 G HA2 -0.072 3.887 3.960 -0.002 0.000 0.222 75 G HA3 -0.072 3.887 3.960 -0.002 0.000 0.222 75 G C -2.809 172.183 174.900 0.153 0.000 1.364 75 G CA -0.791 44.401 45.100 0.153 0.000 0.866 75 G HN 0.448 8.738 8.290 -0.000 0.000 0.555 76 P HA 0.179 4.599 4.420 -0.000 0.000 0.256 76 P C 1.211 178.612 177.300 0.167 0.000 1.173 76 P CA 0.168 63.336 63.100 0.114 0.000 0.768 76 P CB 0.871 32.625 31.700 0.090 0.000 0.758 77 V N 4.248 124.215 119.914 0.089 0.000 2.392 77 V HA -0.230 3.889 4.120 -0.002 0.000 0.249 77 V C 2.198 178.363 176.094 0.119 0.000 1.059 77 V CA 2.220 64.540 62.300 0.033 0.000 1.051 77 V CB -0.732 31.061 31.823 -0.050 0.000 0.658 77 V HN 0.656 8.846 8.190 -0.000 0.000 0.455 78 E N -0.024 120.238 120.200 0.104 0.000 2.409 78 E HA -0.253 4.096 4.350 -0.002 0.000 0.198 78 E C 1.790 178.462 176.600 0.120 0.000 1.024 78 E CA 1.111 57.567 56.400 0.094 0.000 0.861 78 E CB -0.288 29.446 29.700 0.056 0.000 0.788 78 E HN 0.547 8.907 8.360 -0.000 0.000 0.521 79 K N -0.244 120.255 120.400 0.166 0.000 2.418 79 K HA 0.040 4.359 4.320 -0.002 0.000 0.195 79 K C -0.035 176.612 176.600 0.078 0.000 1.035 79 K CA 0.130 56.477 56.287 0.100 0.000 1.003 79 K CB 0.008 32.542 32.500 0.057 0.000 0.793 79 K HN 0.031 8.281 8.250 -0.000 0.000 0.494 80 W N 1.459 122.736 121.300 -0.039 0.000 2.184 80 W HA 0.032 4.691 4.660 -0.002 0.000 0.338 80 W C 0.987 177.465 176.519 -0.068 0.000 1.257 80 W CA -0.362 56.952 57.345 -0.052 0.000 1.243 80 W CB 0.467 29.888 29.460 -0.065 0.000 1.122 80 W HN -0.012 8.168 8.180 -0.000 0.000 0.585 81 D N 0.271 120.718 120.400 0.078 0.000 2.234 81 D HA -0.043 4.596 4.640 -0.002 0.000 0.205 81 D C 0.329 176.640 176.300 0.019 0.000 0.962 81 D CA 1.001 54.994 54.000 -0.013 0.000 0.855 81 D CB 0.149 40.867 40.800 -0.137 0.000 0.951 81 D HN 0.196 8.566 8.370 -0.000 0.000 0.500 82 S N -0.582 115.179 115.700 0.101 0.000 2.546 82 S HA 0.570 5.039 4.470 -0.002 0.000 0.274 82 S C -3.033 171.624 174.600 0.094 0.000 1.121 82 S CA -1.641 56.602 58.200 0.072 0.000 0.887 82 S CB 2.396 65.611 63.200 0.026 0.000 1.094 82 S HN -0.307 8.003 8.310 -0.000 0.000 0.474 83 P HA 0.118 4.538 4.420 -0.000 0.000 0.261 83 P C -1.669 175.459 177.300 -0.287 0.000 1.173 83 P CA -0.878 62.140 63.100 -0.136 0.000 0.760 83 P CB -0.012 31.647 31.700 -0.068 0.000 0.783 84 P HA -0.124 4.296 4.420 -0.000 0.000 0.218 84 P C 0.497 177.334 177.300 -0.772 0.000 1.149 84 P CA 1.594 63.947 63.100 -1.246 0.000 0.817 84 P CB -0.065 30.252 31.700 -2.306 0.000 0.785 85 F N 0.134 119.929 119.950 -0.259 0.000 2.668 85 F HA 0.252 4.778 4.527 -0.002 0.000 0.297 85 F C 0.566 176.322 175.800 -0.073 0.000 1.124 85 F CA -0.318 57.601 58.000 -0.135 0.000 1.353 85 F CB -0.393 38.533 39.000 -0.123 0.000 0.992 85 F HN -0.127 8.173 8.300 -0.000 0.000 0.524 86 E N 1.716 121.949 120.200 0.055 0.000 3.108 86 E HA 0.197 4.547 4.350 -0.002 0.000 0.228 86 E C -2.443 174.193 176.600 0.059 0.000 1.176 86 E CA -2.110 54.323 56.400 0.055 0.000 0.881 86 E CB 0.594 30.313 29.700 0.033 0.000 1.354 86 E HN -0.087 8.273 8.360 -0.000 0.000 0.400 87 P HA -0.128 4.292 4.420 -0.000 0.000 0.255 87 P C -0.813 176.545 177.300 0.097 0.000 1.151 87 P CA 0.601 63.757 63.100 0.094 0.000 0.767 87 P CB 0.437 32.187 31.700 0.083 0.000 0.736 88 A N 3.702 126.605 122.820 0.138 0.000 2.356 88 A HA 0.427 4.746 4.320 -0.002 0.000 0.310 88 A C -0.175 177.522 177.584 0.189 0.000 1.075 88 A CA -0.726 51.393 52.037 0.135 0.000 0.746 88 A CB 1.186 20.251 19.000 0.110 0.000 1.221 88 A HN 0.477 8.627 8.150 -0.000 0.000 0.443 89 E N 1.341 121.622 120.200 0.134 0.000 2.200 89 E HA 0.504 4.853 4.350 -0.002 0.000 0.283 89 E C -0.318 176.369 176.600 0.146 0.000 1.015 89 E CA -0.347 56.133 56.400 0.133 0.000 0.819 89 E CB 1.409 31.156 29.700 0.078 0.000 1.081 89 E HN 0.522 8.882 8.360 -0.000 0.000 0.397 90 R N 3.127 123.752 120.500 0.208 0.000 2.536 90 R HA 0.052 4.391 4.340 -0.002 0.000 0.269 90 R C -1.324 175.102 176.300 0.210 0.000 1.113 90 R CA -0.415 55.792 56.100 0.180 0.000 0.948 90 R CB 0.958 31.343 30.300 0.141 0.000 1.237 90 R HN 0.536 8.806 8.270 -0.000 0.000 0.441 91 D N 3.141 123.614 120.400 0.122 0.000 2.686 91 D HA -0.198 4.441 4.640 -0.002 0.000 0.235 91 D C 0.677 177.025 176.300 0.079 0.000 1.160 91 D CA 1.913 55.971 54.000 0.097 0.000 0.645 91 D CB -1.031 39.835 40.800 0.109 0.000 1.039 91 D HN 1.083 9.453 8.370 -0.000 0.000 0.423 92 G N -0.424 108.411 108.800 0.058 0.000 2.148 92 G HA2 -0.363 3.596 3.960 -0.002 0.000 0.254 92 G HA3 -0.363 3.596 3.960 -0.002 0.000 0.254 92 G C 0.300 175.200 174.900 -0.000 0.000 0.981 92 G CA 0.619 45.734 45.100 0.026 0.000 0.670 92 G HN 0.582 8.872 8.290 -0.000 0.000 0.528 93 R N -1.286 119.216 120.500 0.004 0.000 2.807 93 R HA 0.717 5.056 4.340 -0.002 0.000 0.276 93 R C -1.093 175.164 176.300 -0.072 0.000 0.979 93 R CA -1.073 54.960 56.100 -0.112 0.000 0.928 93 R CB 1.786 31.891 30.300 -0.325 0.000 1.191 93 R HN 0.214 8.484 8.270 -0.000 0.000 0.471 94 L N 2.438 123.571 121.223 -0.151 0.000 2.294 94 L HA 0.423 4.762 4.340 -0.002 0.000 0.283 94 L C -1.629 175.182 176.870 -0.099 0.000 1.015 94 L CA -0.295 54.523 54.840 -0.036 0.000 0.831 94 L CB 0.592 42.646 42.059 -0.008 0.000 1.217 94 L HN 0.457 8.687 8.230 -0.000 0.000 0.420 95 Y N 3.734 124.078 120.300 0.073 0.000 2.361 95 Y HA 0.832 5.381 4.550 -0.002 0.000 0.332 95 Y C 0.902 176.881 175.900 0.133 0.000 1.101 95 Y CA 0.054 58.222 58.100 0.113 0.000 1.137 95 Y CB 2.135 40.668 38.460 0.121 0.000 1.207 95 Y HN 0.776 9.056 8.280 -0.000 0.000 0.463 96 G N 1.789 110.797 108.800 0.346 0.000 2.368 96 G HA2 0.285 4.244 3.960 -0.002 0.000 0.303 96 G HA3 0.285 4.244 3.960 -0.002 0.000 0.303 96 G C -2.041 172.988 174.900 0.215 0.000 1.590 96 G CA -1.451 43.775 45.100 0.209 0.000 0.938 96 G HN 0.536 8.826 8.290 -0.000 0.000 0.675 97 R N 0.311 120.819 120.500 0.013 0.000 2.489 97 R HA 0.525 4.864 4.340 -0.002 0.000 0.287 97 R C 1.493 177.895 176.300 0.171 0.000 1.053 97 R CA 1.619 57.778 56.100 0.098 0.000 1.036 97 R CB 0.371 30.544 30.300 -0.211 0.000 0.966 97 R HN 2.446 10.716 8.270 -0.000 0.000 0.432 98 G N 2.371 111.294 108.800 0.205 0.000 2.175 98 G HA2 -0.330 3.629 3.960 -0.002 0.000 0.244 98 G HA3 -0.330 3.629 3.960 -0.002 0.000 0.244 98 G C 0.884 175.864 174.900 0.134 0.000 0.982 98 G CA 0.540 45.748 45.100 0.180 0.000 0.641 98 G HN 0.890 9.180 8.290 -0.000 0.000 0.527 99 A N 0.028 122.924 122.820 0.127 0.000 1.933 99 A HA 0.460 4.779 4.320 -0.002 0.000 0.218 99 A C 2.668 180.286 177.584 0.057 0.000 1.175 99 A CA 2.794 54.880 52.037 0.081 0.000 0.628 99 A CB -0.566 18.470 19.000 0.060 0.000 0.814 99 A HN 1.744 9.894 8.150 -0.000 0.000 0.444 100 A N -1.823 121.036 122.820 0.065 0.000 1.942 100 A HA 0.304 4.623 4.320 -0.002 0.000 0.209 100 A C 1.044 178.667 177.584 0.066 0.000 1.214 100 A CA 1.073 53.137 52.037 0.045 0.000 0.686 100 A CB 0.037 19.051 19.000 0.024 0.000 0.871 100 A HN 0.457 8.607 8.150 -0.000 0.000 0.460 104 T N 1.362 115.962 114.554 0.076 0.000 2.746 104 T HA -0.106 4.243 4.350 -0.002 0.000 0.267 104 T C 1.774 176.539 174.700 0.107 0.000 1.039 104 T CA 2.037 64.178 62.100 0.068 0.000 1.142 104 T CB -0.161 68.735 68.868 0.046 0.000 0.866 104 T HN 0.111 8.351 8.240 -0.000 0.000 0.444 105 S N 1.254 117.057 115.700 0.172 0.000 2.359 105 S HA -0.046 4.423 4.470 -0.002 0.000 0.224 105 S C 2.051 176.838 174.600 0.311 0.000 1.035 105 S CA 1.038 59.445 58.200 0.345 0.000 1.018 105 S CB -0.491 62.986 63.200 0.462 0.000 0.876 105 S HN 0.420 8.730 8.310 -0.000 0.000 0.448 106 I N 1.809 122.526 120.570 0.244 0.000 2.151 106 I HA -0.281 3.888 4.170 -0.002 0.000 0.243 106 I C 2.723 178.816 176.117 -0.040 0.000 1.080 106 I CA 1.289 62.630 61.300 0.068 0.000 1.339 106 I CB -0.546 37.534 38.000 0.132 0.000 1.039 106 I HN 0.284 8.494 8.210 -0.000 0.000 0.409 107 A N -0.198 122.637 122.820 0.025 0.000 1.902 107 A HA -0.233 4.086 4.320 -0.002 0.000 0.217 107 A C 2.440 180.022 177.584 -0.004 0.000 1.181 107 A CA 1.874 53.912 52.037 0.001 0.000 0.623 107 A CB -1.228 17.783 19.000 0.018 0.000 0.818 107 A HN 0.565 8.715 8.150 -0.000 0.000 0.443 108 C N -2.245 117.086 119.300 0.052 0.000 2.425 108 C HA -0.060 4.399 4.460 -0.002 0.000 0.277 108 C C 2.396 177.476 174.990 0.150 0.000 1.280 108 C CA 1.004 60.073 59.018 0.086 0.000 1.744 108 C CB -1.585 26.197 27.740 0.069 0.000 1.989 108 C HN 0.674 8.904 8.230 -0.000 0.000 0.491 109 F N 1.083 120.969 119.950 -0.107 0.000 2.234 109 F HA -0.039 4.487 4.527 -0.001 0.000 0.296 109 F C 2.204 177.816 175.800 -0.314 0.000 1.089 109 F CA 1.200 58.984 58.000 -0.360 0.000 1.343 109 F CB -0.386 37.848 39.000 -1.277 0.000 1.040 109 F HN -0.014 8.286 8.300 -0.000 0.000 0.498 110 V N 0.387 120.160 119.914 -0.234 0.000 2.287 110 V HA -0.365 3.754 4.120 -0.002 0.000 0.248 110 V C 2.614 178.564 176.094 -0.241 0.000 1.053 110 V CA 2.577 64.721 62.300 -0.259 0.000 1.027 110 V CB -1.427 30.300 31.823 -0.161 0.000 0.646 110 V HN 0.589 8.779 8.190 -0.000 0.000 0.447 111 T N -1.161 113.301 114.554 -0.154 0.000 2.867 111 T HA -0.095 4.254 4.350 -0.002 0.000 0.268 111 T C 1.909 176.537 174.700 -0.120 0.000 1.057 111 T CA 1.353 63.390 62.100 -0.106 0.000 1.136 111 T CB -0.464 68.369 68.868 -0.058 0.000 0.874 111 T HN 0.472 8.712 8.240 -0.000 0.000 0.466 112 A N 0.656 123.371 122.820 -0.175 0.000 1.933 112 A HA -0.023 4.297 4.320 -0.002 0.000 0.218 112 A C 2.735 180.189 177.584 -0.217 0.000 1.175 112 A CA 1.377 53.312 52.037 -0.172 0.000 0.628 112 A CB -1.458 17.425 19.000 -0.193 0.000 0.814 112 A HN 0.686 8.836 8.150 -0.000 0.000 0.444 113 C N -0.610 118.446 119.300 -0.406 0.000 2.425 113 C HA -0.089 4.370 4.460 -0.002 0.000 0.277 113 C C 2.655 177.642 174.990 -0.004 0.000 1.280 113 C CA 1.212 60.079 59.018 -0.251 0.000 1.744 113 C CB -1.239 26.274 27.740 -0.377 0.000 1.989 113 C HN 0.688 8.918 8.230 -0.000 0.000 0.491 114 E N 0.269 120.439 120.200 -0.051 0.000 2.028 114 E HA -0.148 4.201 4.350 -0.002 0.000 0.191 114 E C 2.440 179.057 176.600 0.029 0.000 0.988 114 E CA 0.941 57.342 56.400 0.001 0.000 0.799 114 E CB -0.175 29.507 29.700 -0.030 0.000 0.755 114 E HN 0.582 8.942 8.360 -0.000 0.000 0.447 115 R N -0.003 120.514 120.500 0.028 0.000 2.081 115 R HA -0.130 4.209 4.340 -0.002 0.000 0.235 115 R C 2.310 178.673 176.300 0.106 0.000 1.131 115 R CA 1.209 57.338 56.100 0.048 0.000 0.960 115 R CB -0.405 29.921 30.300 0.043 0.000 0.856 115 R HN 0.168 8.438 8.270 -0.000 0.000 0.436 116 F N 1.251 121.205 119.950 0.006 0.000 2.102 116 F HA -0.166 4.360 4.527 -0.002 0.000 0.298 116 F C 2.060 177.941 175.800 0.135 0.000 1.105 116 F CA 1.210 59.254 58.000 0.073 0.000 1.239 116 F CB -0.296 38.678 39.000 -0.045 0.000 0.991 116 F HN -0.296 8.004 8.300 -0.000 0.000 0.474 117 V N 0.374 120.306 119.914 0.029 0.000 2.515 117 V HA -0.239 3.880 4.120 -0.002 0.000 0.250 117 V C 2.642 178.695 176.094 -0.068 0.000 1.058 117 V CA 1.550 63.842 62.300 -0.013 0.000 1.064 117 V CB -1.356 30.556 31.823 0.149 0.000 0.675 117 V HN 0.489 8.679 8.190 -0.000 0.000 0.461 118 A N -0.701 122.087 122.820 -0.052 0.000 1.897 118 A HA -0.130 4.189 4.320 -0.002 0.000 0.215 118 A C 2.326 179.828 177.584 -0.136 0.000 1.181 118 A CA 1.292 53.288 52.037 -0.068 0.000 0.620 118 A CB -0.296 18.681 19.000 -0.040 0.000 0.821 118 A HN 0.386 8.536 8.150 -0.000 0.000 0.443 119 K N -0.697 119.595 120.400 -0.181 0.000 2.167 119 K HA -0.023 4.296 4.320 -0.002 0.000 0.203 119 K C -0.131 176.068 176.600 -0.668 0.000 1.052 119 K CA 0.782 56.862 56.287 -0.346 0.000 0.956 119 K CB -0.052 32.295 32.500 -0.255 0.000 0.735 119 K HN 0.615 8.865 8.250 -0.000 0.000 0.451 120 H N 0.411 119.257 119.070 -0.373 0.000 2.348 120 H HA 0.149 4.704 4.556 -0.002 0.000 0.232 120 H C -1.946 173.226 175.328 -0.261 0.000 1.419 120 H CA -1.437 54.384 56.048 -0.379 0.000 1.416 120 H CB 1.238 30.570 29.762 -0.716 0.000 1.510 120 H HN 0.031 8.311 8.280 -0.000 0.000 0.507 121 P HA -0.102 4.318 4.420 -0.000 0.000 0.220 121 P C 0.279 177.500 177.300 -0.132 0.000 1.148 121 P CA 0.916 63.959 63.100 -0.094 0.000 0.803 121 P CB 0.346 31.991 31.700 -0.092 0.000 0.782 122 N N -0.792 117.850 118.700 -0.098 0.000 2.376 122 N HA 0.045 4.784 4.740 -0.002 0.000 0.249 122 N C 0.157 175.619 175.510 -0.080 0.000 1.140 122 N CA -0.463 52.520 53.050 -0.112 0.000 0.870 122 N CB -0.624 37.827 38.487 -0.060 0.000 1.124 122 N HN 0.414 8.794 8.380 -0.000 0.000 0.505 123 H N -0.736 118.338 119.070 0.006 0.000 2.871 123 H HA 0.113 4.668 4.556 -0.002 0.000 0.355 123 H C 0.122 175.495 175.328 0.075 0.000 1.092 123 H CA -0.162 55.927 56.048 0.070 0.000 1.420 123 H CB 0.538 30.389 29.762 0.148 0.000 1.400 123 H HN 0.103 8.383 8.280 -0.000 0.000 0.604 124 Q N 1.580 121.531 119.800 0.252 0.000 2.316 124 Q HA 0.372 4.711 4.340 -0.002 0.000 0.215 124 Q C 0.931 177.101 176.000 0.282 0.000 1.020 124 Q CA -0.299 55.608 55.803 0.172 0.000 0.970 124 Q CB 0.951 29.764 28.738 0.125 0.000 1.187 124 Q HN 1.116 9.386 8.270 -0.000 0.000 0.546 125 G N 0.351 109.252 108.800 0.168 0.000 2.601 125 G HA2 -0.246 3.713 3.960 -0.002 0.000 0.261 125 G HA3 -0.246 3.713 3.960 -0.002 0.000 0.261 125 G C -0.685 174.328 174.900 0.188 0.000 1.289 125 G CA -0.209 44.989 45.100 0.163 0.000 0.920 125 G HN 0.609 8.899 8.290 -0.000 0.000 0.571 126 S N -1.039 114.754 115.700 0.155 0.000 2.618 126 S HA 0.759 5.228 4.470 -0.002 0.000 0.277 126 S C -0.457 174.191 174.600 0.081 0.000 1.138 126 S CA -0.498 57.770 58.200 0.115 0.000 0.844 126 S CB 1.982 65.213 63.200 0.052 0.000 1.127 126 S HN 0.830 9.140 8.310 -0.000 0.000 0.474 127 I N 1.340 121.924 120.570 0.022 0.000 2.498 127 I HA 0.759 4.928 4.170 -0.002 0.000 0.290 127 I C -0.220 175.938 176.117 0.068 0.000 1.032 127 I CA -0.563 60.790 61.300 0.089 0.000 1.073 127 I CB 1.744 39.858 38.000 0.189 0.000 1.251 127 I HN 0.749 8.959 8.210 -0.000 0.000 0.426 128 A N 6.259 129.118 122.820 0.066 0.000 2.527 128 A HA 0.969 5.288 4.320 -0.002 0.000 0.293 128 A C -1.596 175.977 177.584 -0.020 0.000 1.117 128 A CA -0.517 51.412 52.037 -0.181 0.000 0.723 128 A CB 1.703 20.241 19.000 -0.769 0.000 1.313 128 A HN 0.531 8.681 8.150 -0.000 0.000 0.411 129 L N 0.519 121.686 121.223 -0.095 0.000 2.410 129 L HA 0.570 4.909 4.340 -0.002 0.000 0.270 129 L C -0.727 176.226 176.870 0.138 0.000 0.983 129 L CA -0.015 54.870 54.840 0.076 0.000 0.822 129 L CB 1.893 44.026 42.059 0.122 0.000 1.285 129 L HN 0.657 8.887 8.230 -0.000 0.000 0.409 130 L N 4.888 126.258 121.223 0.245 0.000 2.337 130 L HA 0.601 4.940 4.340 -0.002 0.000 0.269 130 L C -1.240 175.753 176.870 0.205 0.000 1.018 130 L CA -0.267 54.795 54.840 0.370 0.000 0.876 130 L CB 0.454 42.762 42.059 0.414 0.000 1.236 130 L HN 0.438 8.668 8.230 -0.000 0.000 0.436 131 I N 3.023 123.717 120.570 0.207 0.000 2.441 131 I HA 0.447 4.616 4.170 -0.002 0.000 0.295 131 I C 0.216 176.420 176.117 0.146 0.000 0.994 131 I CA -0.261 61.135 61.300 0.160 0.000 1.144 131 I CB 1.848 39.939 38.000 0.153 0.000 1.314 131 I HN 0.407 8.617 8.210 -0.000 0.000 0.445 132 T N 2.282 116.919 114.554 0.139 0.000 2.907 132 T HA 0.377 4.726 4.350 -0.002 0.000 0.292 132 T C 0.666 175.434 174.700 0.114 0.000 1.043 132 T CA -0.350 61.819 62.100 0.116 0.000 1.003 132 T CB 1.317 70.251 68.868 0.109 0.000 1.084 132 T HN 0.688 8.928 8.240 -0.000 0.000 0.483 133 S N 1.522 117.259 115.700 0.061 0.000 2.540 133 S HA 0.249 4.718 4.470 -0.002 0.000 0.218 133 S C 0.062 174.687 174.600 0.043 0.000 0.977 133 S CA -0.285 57.946 58.200 0.051 0.000 0.918 133 S CB 0.075 63.273 63.200 -0.005 0.000 0.806 133 S HN 0.642 8.952 8.310 -0.000 0.000 0.496 134 D N 1.180 121.603 120.400 0.038 0.000 2.405 134 D HA 0.252 4.891 4.640 -0.002 0.000 0.264 134 D C 0.386 176.682 176.300 -0.007 0.000 1.240 134 D CA -0.171 53.833 54.000 0.008 0.000 0.893 134 D CB 0.929 41.732 40.800 0.004 0.000 1.198 134 D HN 0.156 8.526 8.370 -0.000 0.000 0.514 135 E N 1.680 121.824 120.200 -0.092 0.000 2.330 135 E HA 0.014 4.363 4.350 -0.002 0.000 0.200 135 E C 0.665 177.151 176.600 -0.190 0.000 0.922 135 E CA 0.343 56.654 56.400 -0.149 0.000 0.935 135 E CB 0.570 30.080 29.700 -0.317 0.000 0.917 135 E HN 0.389 8.749 8.360 -0.000 0.000 0.491 136 E N 0.403 120.461 120.200 -0.237 0.000 2.299 136 E HA 0.044 4.393 4.350 -0.002 0.000 0.193 136 E C 1.231 177.781 176.600 -0.083 0.000 0.998 136 E CA 0.521 56.825 56.400 -0.160 0.000 0.851 136 E CB 0.342 29.942 29.700 -0.167 0.000 0.795 136 E HN 0.187 8.547 8.360 -0.000 0.000 0.492 137 G N 2.129 110.897 108.800 -0.054 0.000 2.928 137 G HA2 -0.031 3.928 3.960 -0.002 0.000 0.163 137 G HA3 -0.031 3.928 3.960 -0.002 0.000 0.163 137 G C 0.591 175.488 174.900 -0.005 0.000 1.573 137 G CA 0.487 45.571 45.100 -0.026 0.000 1.084 137 G HN 0.122 8.412 8.290 -0.000 0.000 0.569 138 D N -1.199 119.203 120.400 0.003 0.000 2.224 138 D HA 0.214 4.853 4.640 -0.002 0.000 0.205 138 D C 1.602 177.920 176.300 0.029 0.000 0.965 138 D CA 1.361 55.370 54.000 0.015 0.000 0.852 138 D CB -0.245 40.560 40.800 0.008 0.000 0.947 138 D HN 0.987 9.357 8.370 -0.000 0.000 0.494 139 A N -0.557 122.273 122.820 0.018 0.000 2.832 139 A HA -0.230 4.089 4.320 -0.002 0.000 0.280 139 A C 1.346 178.910 177.584 -0.032 0.000 1.464 139 A CA 1.118 53.165 52.037 0.017 0.000 0.804 139 A CB -2.408 16.645 19.000 0.088 0.000 1.020 139 A HN 0.438 8.588 8.150 -0.000 0.000 0.563 140 L N -1.341 119.861 121.223 -0.036 0.000 2.217 140 L HA -0.049 4.290 4.340 -0.002 0.000 0.211 140 L C 1.196 177.995 176.870 -0.119 0.000 1.107 140 L CA 1.459 56.253 54.840 -0.077 0.000 0.783 140 L CB -0.137 41.896 42.059 -0.044 0.000 0.919 140 L HN 0.411 8.641 8.230 -0.000 0.000 0.442 141 D N -0.581 119.783 120.400 -0.059 0.000 2.462 141 D HA 0.166 4.805 4.640 -0.002 0.000 0.221 141 D C 0.908 177.245 176.300 0.062 0.000 1.173 141 D CA 0.213 54.214 54.000 0.000 0.000 0.831 141 D CB 0.728 41.584 40.800 0.093 0.000 1.001 141 D HN 0.197 8.567 8.370 -0.000 0.000 0.499 142 G N -0.126 108.655 108.800 -0.030 0.000 3.365 142 G HA2 0.056 4.015 3.960 -0.002 0.000 0.185 142 G HA3 0.056 4.015 3.960 -0.002 0.000 0.185 142 G C 1.235 176.107 174.900 -0.047 0.000 1.565 142 G CA 0.162 45.267 45.100 0.008 0.000 0.984 142 G HN -0.004 8.286 8.290 -0.000 0.000 0.604 143 T N 0.407 114.927 114.554 -0.057 0.000 2.653 143 T HA -0.236 4.113 4.350 -0.002 0.000 0.268 143 T C 2.445 176.988 174.700 -0.261 0.000 1.035 143 T CA 2.331 64.387 62.100 -0.073 0.000 1.154 143 T CB -0.686 68.218 68.868 0.060 0.000 0.862 143 T HN 0.468 8.708 8.240 -0.000 0.000 0.441 144 T N 1.466 115.620 114.554 -0.666 0.000 2.685 144 T HA -0.182 4.167 4.350 -0.002 0.000 0.268 144 T C 1.951 176.387 174.700 -0.439 0.000 1.034 144 T CA 1.320 62.916 62.100 -0.841 0.000 1.149 144 T CB -0.243 67.835 68.868 -1.317 0.000 0.860 144 T HN 0.326 8.566 8.240 -0.000 0.000 0.449 145 K N 0.405 120.580 120.400 -0.376 0.000 2.062 145 K HA 0.008 4.327 4.320 -0.002 0.000 0.205 145 K C 2.309 178.786 176.600 -0.206 0.000 1.051 145 K CA 1.005 57.052 56.287 -0.401 0.000 0.941 145 K CB -0.666 31.407 32.500 -0.711 0.000 0.719 145 K HN 0.329 8.579 8.250 -0.000 0.000 0.440 146 V N 1.527 121.401 119.914 -0.067 0.000 2.261 146 V HA -0.215 3.904 4.120 -0.002 0.000 0.246 146 V C 2.552 178.550 176.094 -0.160 0.000 1.047 146 V CA 1.478 63.754 62.300 -0.041 0.000 1.015 146 V CB -0.608 31.214 31.823 -0.002 0.000 0.642 146 V HN -0.020 8.170 8.190 -0.000 0.000 0.446 147 V N 0.435 120.249 119.914 -0.166 0.000 2.324 147 V HA -0.322 3.797 4.120 -0.002 0.000 0.250 147 V C 2.325 178.321 176.094 -0.164 0.000 1.060 147 V CA 2.377 64.576 62.300 -0.168 0.000 1.042 147 V CB -0.791 30.962 31.823 -0.117 0.000 0.650 147 V HN 0.567 8.757 8.190 -0.000 0.000 0.450 148 D N -0.193 120.106 120.400 -0.168 0.000 2.097 148 D HA -0.136 4.503 4.640 -0.002 0.000 0.195 148 D C 2.164 178.386 176.300 -0.131 0.000 0.989 148 D CA 1.417 55.328 54.000 -0.149 0.000 0.827 148 D CB -0.474 40.218 40.800 -0.181 0.000 0.966 148 D HN 0.315 8.685 8.370 -0.000 0.000 0.456 149 V N 1.006 120.844 119.914 -0.127 0.000 2.255 149 V HA -0.240 3.880 4.120 -0.002 0.000 0.247 149 V C 2.667 178.675 176.094 -0.143 0.000 1.051 149 V CA 1.331 63.572 62.300 -0.099 0.000 1.018 149 V CB -0.603 31.189 31.823 -0.052 0.000 0.641 149 V HN 0.199 8.389 8.190 -0.000 0.000 0.445 150 L N -0.471 120.615 121.223 -0.228 0.000 2.046 150 L HA -0.229 4.110 4.340 -0.002 0.000 0.208 150 L C 2.594 179.362 176.870 -0.171 0.000 1.077 150 L CA 1.947 56.621 54.840 -0.277 0.000 0.747 150 L CB -0.659 41.116 42.059 -0.472 0.000 0.896 150 L HN 0.282 8.512 8.230 -0.000 0.000 0.432 151 K N 0.126 120.440 120.400 -0.143 0.000 2.097 151 K HA -0.153 4.166 4.320 -0.002 0.000 0.206 151 K C 2.179 178.734 176.600 -0.076 0.000 1.049 151 K CA 1.181 57.410 56.287 -0.097 0.000 0.933 151 K CB -0.092 32.356 32.500 -0.086 0.000 0.717 151 K HN 0.286 8.536 8.250 -0.000 0.000 0.442 152 A N 1.885 124.659 122.820 -0.078 0.000 1.933 152 A HA -0.179 4.140 4.320 -0.002 0.000 0.218 152 A C 1.798 179.354 177.584 -0.046 0.000 1.175 152 A CA 1.621 53.624 52.037 -0.058 0.000 0.628 152 A CB -0.438 18.528 19.000 -0.057 0.000 0.814 152 A HN 0.458 8.608 8.150 -0.000 0.000 0.444 153 R N -1.279 119.190 120.500 -0.052 0.000 2.466 153 R HA 0.363 4.702 4.340 -0.002 0.000 0.279 153 R C 0.213 176.496 176.300 -0.028 0.000 0.976 153 R CA 1.091 57.171 56.100 -0.034 0.000 1.081 153 R CB -1.263 29.020 30.300 -0.029 0.000 1.215 153 R HN 0.451 8.721 8.270 -0.000 0.000 0.546 154 D N 1.076 121.454 120.400 -0.036 0.000 2.723 154 D HA -0.221 4.418 4.640 -0.002 0.000 0.236 154 D C -0.279 176.011 176.300 -0.016 0.000 1.138 154 D CA 1.484 55.468 54.000 -0.026 0.000 0.676 154 D CB -1.795 38.997 40.800 -0.014 0.000 1.069 154 D HN 0.748 9.118 8.370 -0.000 0.000 0.430 155 E N -0.151 120.029 120.200 -0.033 0.000 2.079 155 E HA 0.530 4.879 4.350 -0.002 0.000 0.252 155 E C 0.249 176.841 176.600 -0.013 0.000 0.992 155 E CA -0.571 55.830 56.400 0.003 0.000 0.829 155 E CB 0.201 29.909 29.700 0.013 0.000 1.158 155 E HN 0.653 9.013 8.360 -0.000 0.000 0.435 156 L N 3.982 125.213 121.223 0.013 0.000 2.399 156 L HA 0.518 4.857 4.340 -0.002 0.000 0.265 156 L C 0.225 177.124 176.870 0.050 0.000 1.089 156 L CA -1.052 53.791 54.840 0.005 0.000 0.802 156 L CB 1.226 43.275 42.059 -0.017 0.000 1.180 156 L HN 0.468 8.698 8.230 -0.000 0.000 0.454 157 I N 0.544 121.131 120.570 0.030 0.000 2.412 157 I HA 0.158 4.327 4.170 -0.002 0.000 0.296 157 I C 0.547 176.629 176.117 -0.059 0.000 0.987 157 I CA -0.295 61.033 61.300 0.048 0.000 1.180 157 I CB 1.929 39.981 38.000 0.087 0.000 1.340 157 I HN 0.657 8.867 8.210 -0.000 0.000 0.455 158 D N 4.036 124.362 120.400 -0.122 0.000 2.202 158 D HA -0.012 4.627 4.640 -0.002 0.000 0.214 158 D C -0.531 175.414 176.300 -0.592 0.000 0.967 158 D CA 1.619 55.369 54.000 -0.418 0.000 0.871 158 D CB 0.332 40.777 40.800 -0.591 0.000 1.020 158 D HN 0.311 8.681 8.370 -0.000 0.000 0.474 159 Y N -0.157 120.161 120.300 0.030 0.000 2.361 159 Y HA 0.366 4.915 4.550 -0.002 0.000 0.337 159 Y C -0.346 175.558 175.900 0.006 0.000 0.965 159 Y CA -1.099 57.010 58.100 0.014 0.000 1.091 159 Y CB 1.987 40.453 38.460 0.009 0.000 1.182 159 Y HN -0.096 8.184 8.280 -0.000 0.000 0.450 160 C N 5.527 124.898 119.300 0.120 0.000 2.441 160 C HA 0.822 5.281 4.460 -0.002 0.000 0.318 160 C C -0.993 173.987 174.990 -0.016 0.000 1.222 160 C CA -0.778 58.260 59.018 0.033 0.000 1.474 160 C CB -0.740 27.003 27.740 0.005 0.000 2.125 160 C HN 0.730 8.960 8.230 -0.000 0.000 0.479 161 I N 6.475 126.982 120.570 -0.106 0.000 2.355 161 I HA 0.364 4.533 4.170 -0.002 0.000 0.288 161 I C -0.036 175.868 176.117 -0.356 0.000 0.999 161 I CA -0.112 61.097 61.300 -0.151 0.000 1.163 161 I CB 1.620 39.541 38.000 -0.131 0.000 1.316 161 I HN 0.407 8.617 8.210 -0.000 0.000 0.454 162 V N 5.429 125.182 119.914 -0.268 0.000 2.406 162 V HA 0.316 4.435 4.120 -0.002 0.000 0.272 162 V C 1.343 177.238 176.094 -0.331 0.000 1.043 162 V CA -0.434 61.639 62.300 -0.377 0.000 0.915 162 V CB 1.133 32.854 31.823 -0.171 0.000 0.988 162 V HN 0.958 9.148 8.190 -0.000 0.000 0.466 163 G N 3.412 111.873 108.800 -0.565 0.000 3.186 163 G HA2 0.002 3.961 3.960 -0.002 0.000 0.214 163 G HA3 0.002 3.961 3.960 -0.002 0.000 0.214 163 G C 0.466 175.392 174.900 0.042 0.000 1.222 163 G CA -0.231 44.822 45.100 -0.079 0.000 0.921 163 G HN 0.667 8.957 8.290 -0.000 0.000 0.504 164 E N 1.295 121.492 120.200 -0.005 0.000 2.418 164 E HA 0.070 4.419 4.350 -0.002 0.000 0.261 164 E C -2.240 174.398 176.600 0.063 0.000 1.070 164 E CA -1.541 54.888 56.400 0.048 0.000 0.931 164 E CB 0.674 30.408 29.700 0.056 0.000 0.954 164 E HN 0.123 8.483 8.360 -0.000 0.000 0.439 165 P HA -0.002 4.418 4.420 -0.000 0.000 0.270 165 P C 0.349 177.662 177.300 0.022 0.000 1.242 165 P CA 0.276 63.399 63.100 0.038 0.000 0.768 165 P CB 0.331 32.046 31.700 0.024 0.000 0.820 166 T N -0.595 113.972 114.554 0.021 0.000 2.975 166 T HA 0.359 4.708 4.350 -0.002 0.000 0.257 166 T C 0.815 175.515 174.700 -0.000 0.000 1.003 166 T CA -0.116 61.989 62.100 0.010 0.000 0.932 166 T CB 0.054 68.932 68.868 0.017 0.000 1.087 166 T HN 0.369 8.609 8.240 -0.000 0.000 0.512 167 A N 1.248 124.066 122.820 -0.002 0.000 2.407 167 A HA 0.611 4.930 4.320 -0.002 0.000 0.248 167 A C 1.464 179.039 177.584 -0.014 0.000 1.082 167 A CA -0.407 51.624 52.037 -0.010 0.000 0.785 167 A CB 0.419 19.410 19.000 -0.015 0.000 1.020 167 A HN 0.168 8.318 8.150 -0.000 0.000 0.489 168 V N 1.131 121.037 119.914 -0.014 0.000 2.346 168 V HA -0.033 4.086 4.120 -0.002 0.000 0.244 168 V C 1.502 177.586 176.094 -0.017 0.000 1.037 168 V CA 2.322 64.613 62.300 -0.015 0.000 1.029 168 V CB -0.449 31.366 31.823 -0.013 0.000 0.663 168 V HN 1.026 9.216 8.190 -0.000 0.000 0.454 169 D N -1.449 118.941 120.400 -0.017 0.000 2.797 169 D HA 0.149 4.788 4.640 -0.002 0.000 0.151 169 D C 0.350 176.637 176.300 -0.021 0.000 1.472 169 D CA -0.154 53.834 54.000 -0.019 0.000 1.553 169 D CB 0.604 41.394 40.800 -0.016 0.000 1.590 169 D HN 0.204 8.574 8.370 -0.000 0.000 0.217 170 K N 2.083 122.472 120.400 -0.019 0.000 2.350 170 K HA 0.151 4.470 4.320 -0.002 0.000 0.279 170 K C 0.359 176.945 176.600 -0.023 0.000 1.027 170 K CA -0.389 55.885 56.287 -0.021 0.000 0.969 170 K CB 1.283 33.773 32.500 -0.017 0.000 0.954 170 K HN 0.193 8.443 8.250 -0.000 0.000 0.474 171 L N 2.713 123.918 121.223 -0.029 0.000 2.578 171 L HA -0.086 4.253 4.340 -0.002 0.000 0.279 171 L C 1.036 177.888 176.870 -0.030 0.000 1.227 171 L CA 1.995 56.814 54.840 -0.035 0.000 0.900 171 L CB -0.505 41.525 42.059 -0.048 0.000 1.144 171 L HN 1.072 9.302 8.230 -0.000 0.000 0.496 172 G N 3.297 112.082 108.800 -0.025 0.000 2.176 172 G HA2 -0.277 3.682 3.960 -0.002 0.000 0.253 172 G HA3 -0.277 3.682 3.960 -0.002 0.000 0.253 172 G C 0.078 174.972 174.900 -0.009 0.000 0.979 172 G CA 0.408 45.498 45.100 -0.016 0.000 0.641 172 G HN 0.892 9.182 8.290 -0.000 0.000 0.530 176 K N 4.463 124.852 120.400 -0.019 0.000 2.183 176 K HA 0.352 4.671 4.320 -0.002 0.000 0.274 176 K C 0.168 176.727 176.600 -0.068 0.000 1.009 176 K CA -0.432 55.821 56.287 -0.056 0.000 0.888 176 K CB 1.494 33.966 32.500 -0.046 0.000 1.078 176 K HN 0.809 9.059 8.250 -0.000 0.000 0.459 177 N N 0.867 119.484 118.700 -0.139 0.000 2.200 177 N HA 0.121 4.860 4.740 -0.002 0.000 0.224 177 N C 0.265 175.616 175.510 -0.264 0.000 1.179 177 N CA -0.302 52.653 53.050 -0.158 0.000 0.877 177 N CB 1.082 39.460 38.487 -0.181 0.000 1.072 177 N HN 0.642 9.022 8.380 -0.000 0.000 0.519 178 G N -0.189 108.384 108.800 -0.378 0.000 2.315 178 G HA2 0.388 4.347 3.960 -0.002 0.000 0.294 178 G HA3 0.388 4.347 3.960 -0.002 0.000 0.294 178 G C -1.902 172.508 174.900 -0.815 0.000 1.300 178 G CA -0.870 43.751 45.100 -0.798 0.000 0.843 178 G HN 0.133 8.423 8.290 -0.000 0.000 0.527 179 R N -0.579 119.282 120.500 -1.065 0.000 2.707 179 R HA 0.579 4.918 4.340 -0.002 0.000 0.272 179 R C -0.461 175.742 176.300 -0.162 0.000 1.011 179 R CA -0.990 54.834 56.100 -0.460 0.000 0.893 179 R CB 1.739 31.869 30.300 -0.283 0.000 1.233 179 R HN 0.636 8.906 8.270 -0.000 0.000 0.464 180 R N -0.166 120.339 120.500 0.008 0.000 2.738 180 R HA 0.376 4.715 4.340 -0.002 0.000 0.268 180 R C 0.899 177.031 176.300 -0.280 0.000 1.062 180 R CA 0.602 56.644 56.100 -0.098 0.000 1.158 180 R CB 0.257 30.530 30.300 -0.045 0.000 1.046 180 R HN 0.804 9.074 8.270 -0.000 0.000 0.493 181 G N -0.650 107.740 108.800 -0.684 0.000 2.580 181 G HA2 0.350 4.309 3.960 -0.002 0.000 0.278 181 G HA3 0.350 4.309 3.960 -0.002 0.000 0.278 181 G C -0.943 173.692 174.900 -0.442 0.000 1.212 181 G CA -0.309 44.310 45.100 -0.802 0.000 0.939 181 G HN 0.394 8.684 8.290 -0.000 0.000 0.513 182 S N -0.820 114.857 115.700 -0.038 0.000 2.672 182 S HA 0.522 4.991 4.470 -0.002 0.000 0.291 182 S C -1.387 173.424 174.600 0.353 0.000 1.145 182 S CA -0.625 57.690 58.200 0.191 0.000 1.013 182 S CB 1.104 64.361 63.200 0.094 0.000 1.017 182 S HN 0.755 9.065 8.310 -0.000 0.000 0.487 183 L N 4.641 126.126 121.223 0.437 0.000 2.404 183 L HA 0.729 5.068 4.340 -0.002 0.000 0.272 183 L C -0.780 176.320 176.870 0.383 0.000 0.980 183 L CA 0.183 55.241 54.840 0.364 0.000 0.836 183 L CB 1.866 44.044 42.059 0.197 0.000 1.238 183 L HN 0.592 8.822 8.230 -0.000 0.000 0.408 184 S N 2.529 118.379 115.700 0.249 0.000 2.537 184 S HA 0.936 5.405 4.470 -0.002 0.000 0.301 184 S C -0.142 174.375 174.600 -0.138 0.000 1.092 184 S CA -0.331 57.886 58.200 0.028 0.000 1.048 184 S CB 1.722 64.898 63.200 -0.040 0.000 1.053 184 S HN 0.927 9.237 8.310 -0.000 0.000 0.501 185 G N 1.204 109.484 108.800 -0.867 0.000 2.524 185 G HA2 0.530 4.489 3.960 -0.002 0.000 0.310 185 G HA3 0.530 4.489 3.960 -0.002 0.000 0.310 185 G C -1.269 172.988 174.900 -1.071 0.000 1.279 185 G CA -0.661 43.617 45.100 -1.369 0.000 0.974 185 G HN 0.520 8.810 8.290 -0.000 0.000 0.484 186 N N 1.107 119.404 118.700 -0.671 0.000 2.626 186 N HA 0.368 5.107 4.740 -0.002 0.000 0.249 186 N C -1.300 174.030 175.510 -0.300 0.000 1.021 186 N CA -0.600 52.218 53.050 -0.386 0.000 0.886 186 N CB 1.310 39.651 38.487 -0.244 0.000 1.149 186 N HN 0.368 8.748 8.380 -0.000 0.000 0.517 187 L N 2.873 123.959 121.223 -0.227 0.000 2.295 187 L HA 0.636 4.975 4.340 -0.002 0.000 0.285 187 L C -0.610 176.178 176.870 -0.136 0.000 1.035 187 L CA 0.047 54.797 54.840 -0.151 0.000 0.806 187 L CB 1.464 43.456 42.059 -0.111 0.000 1.214 187 L HN 0.466 8.696 8.230 -0.000 0.000 0.426 188 T N 4.832 119.346 114.554 -0.065 0.000 2.912 188 T HA 0.408 4.757 4.350 -0.002 0.000 0.326 188 T C -0.484 174.213 174.700 -0.006 0.000 1.080 188 T CA -0.358 61.710 62.100 -0.055 0.000 1.000 188 T CB 0.887 69.736 68.868 -0.032 0.000 1.008 188 T HN 0.328 8.568 8.240 -0.000 0.000 0.473 189 V N 3.204 123.075 119.914 -0.072 0.000 2.530 189 V HA 0.589 4.708 4.120 -0.002 0.000 0.282 189 V C 0.750 176.857 176.094 0.021 0.000 1.048 189 V CA -0.678 61.618 62.300 -0.007 0.000 0.997 189 V CB 0.508 32.277 31.823 -0.091 0.000 0.987 189 V HN 0.926 9.116 8.190 -0.000 0.000 0.477 190 K N 2.943 123.379 120.400 0.061 0.000 2.211 190 K HA 0.770 5.089 4.320 -0.002 0.000 0.275 190 K C 0.341 176.967 176.600 0.044 0.000 1.024 190 K CA 0.111 56.422 56.287 0.040 0.000 0.887 190 K CB 1.376 33.897 32.500 0.035 0.000 1.084 190 K HN 1.037 9.287 8.250 -0.000 0.000 0.463 191 G N 0.418 109.233 108.800 0.026 0.000 3.264 191 G HA2 0.620 4.579 3.960 -0.002 0.000 0.168 191 G HA3 0.620 4.579 3.960 -0.002 0.000 0.168 191 G C -0.899 174.007 174.900 0.009 0.000 1.145 191 G CA -0.337 44.776 45.100 0.023 0.000 0.855 191 G HN 0.622 8.912 8.290 -0.000 0.000 0.629 192 K N 0.646 121.046 120.400 -0.001 0.000 2.656 192 K HA 0.259 4.578 4.320 -0.002 0.000 0.253 192 K C -0.780 175.811 176.600 -0.016 0.000 1.002 192 K CA -0.422 55.860 56.287 -0.008 0.000 0.880 192 K CB 1.840 34.336 32.500 -0.007 0.000 1.232 192 K HN 0.574 8.824 8.250 -0.000 0.000 0.456 193 Q N 1.977 121.768 119.800 -0.015 0.000 2.395 193 Q HA 0.364 4.703 4.340 -0.002 0.000 0.271 193 Q C -0.359 175.631 176.000 -0.016 0.000 1.026 193 Q CA 0.734 56.526 55.803 -0.017 0.000 0.900 193 Q CB 0.766 29.496 28.738 -0.014 0.000 1.266 193 Q HN 0.837 9.107 8.270 -0.000 0.000 0.430 194 G N 1.313 110.106 108.800 -0.011 0.000 2.495 194 G HA2 0.090 4.049 3.960 -0.002 0.000 0.294 194 G HA3 0.090 4.049 3.960 -0.002 0.000 0.294 194 G C -2.016 172.912 174.900 0.048 0.000 1.397 194 G CA -0.745 44.362 45.100 0.012 0.000 0.790 194 G HN 0.720 9.010 8.290 -0.000 0.000 0.486 195 H N 0.261 119.349 119.070 0.030 0.000 2.610 195 H HA 0.280 4.835 4.556 -0.001 0.000 0.336 195 H C 1.240 176.623 175.328 0.091 0.000 1.087 195 H CA -0.057 56.041 56.048 0.083 0.000 1.405 195 H CB 1.508 31.363 29.762 0.155 0.000 1.460 195 H HN 0.370 8.650 8.280 -0.000 0.000 0.538 196 I N 3.915 124.331 120.570 -0.257 0.000 2.423 196 I HA -0.262 3.907 4.170 -0.002 0.000 0.254 196 I C 1.993 178.181 176.117 0.118 0.000 1.151 196 I CA 1.438 62.694 61.300 -0.072 0.000 1.421 196 I CB -0.122 37.781 38.000 -0.161 0.000 1.079 196 I HN 0.717 8.927 8.210 -0.000 0.000 0.431 197 A N -0.887 122.181 122.820 0.413 0.000 2.235 197 A HA -0.054 4.265 4.320 -0.002 0.000 0.208 197 A C 0.283 177.752 177.584 -0.191 0.000 1.172 197 A CA 0.646 52.747 52.037 0.107 0.000 0.786 197 A CB -0.415 18.578 19.000 -0.010 0.000 0.804 197 A HN 0.551 8.701 8.150 -0.000 0.000 0.479 198 Y N -0.714 119.669 120.300 0.139 0.000 2.511 198 Y HA 0.259 4.809 4.550 -0.000 0.000 0.356 198 Y C -1.792 174.014 175.900 -0.157 0.000 1.002 198 Y CA -2.008 56.084 58.100 -0.014 0.000 1.127 198 Y CB 0.941 39.319 38.460 -0.136 0.000 1.137 198 Y HN 0.176 8.456 8.280 -0.000 0.000 0.652 199 P HA -0.236 4.184 4.420 -0.000 0.000 0.218 199 P C 1.258 178.588 177.300 0.050 0.000 1.148 199 P CA 1.820 64.961 63.100 0.069 0.000 0.822 199 P CB 0.088 31.841 31.700 0.089 0.000 0.784 200 H N -0.481 118.634 119.070 0.074 0.000 2.521 200 H HA 0.060 4.615 4.556 -0.002 0.000 0.286 200 H C 1.505 176.870 175.328 0.063 0.000 1.034 200 H CA 0.558 56.644 56.048 0.062 0.000 1.278 200 H CB -1.162 28.639 29.762 0.065 0.000 1.386 200 H HN 0.207 8.487 8.280 -0.000 0.000 0.567 201 L N 0.316 121.337 121.223 -0.337 0.000 2.628 201 L HA 0.480 4.819 4.340 -0.002 0.000 0.229 201 L C 0.896 177.711 176.870 -0.093 0.000 1.137 201 L CA 0.050 54.769 54.840 -0.201 0.000 0.909 201 L CB 0.192 42.091 42.059 -0.267 0.000 1.137 201 L HN 0.280 8.510 8.230 -0.000 0.000 0.470 202 A N 0.211 122.994 122.820 -0.062 0.000 2.530 202 A HA 0.843 5.162 4.320 -0.002 0.000 0.288 202 A C -1.032 176.538 177.584 -0.023 0.000 1.172 202 A CA -0.434 51.581 52.037 -0.036 0.000 0.733 202 A CB 1.667 20.645 19.000 -0.036 0.000 1.320 202 A HN 0.048 8.198 8.150 -0.000 0.000 0.419 203 I N 1.682 122.239 120.570 -0.023 0.000 2.468 203 I HA 0.231 4.400 4.170 -0.002 0.000 0.284 203 I C -0.678 175.420 176.117 -0.030 0.000 1.038 203 I CA -0.564 60.729 61.300 -0.011 0.000 1.083 203 I CB 1.759 39.767 38.000 0.014 0.000 1.223 203 I HN 0.596 8.806 8.210 -0.000 0.000 0.443 204 N N 8.966 127.621 118.700 -0.075 0.000 2.406 204 N HA 0.235 4.974 4.740 -0.002 0.000 0.251 204 N C -1.675 173.841 175.510 0.009 0.000 1.069 204 N CA -1.943 51.040 53.050 -0.112 0.000 0.947 204 N CB 1.672 39.910 38.487 -0.415 0.000 1.111 204 N HN 0.301 8.681 8.380 -0.000 0.000 0.497 205 P HA -0.076 4.344 4.420 -0.000 0.000 0.223 205 P C 1.236 178.632 177.300 0.160 0.000 1.151 205 P CA 0.566 63.720 63.100 0.090 0.000 0.787 205 P CB 0.573 32.300 31.700 0.046 0.000 0.788 206 V N 0.484 120.504 119.914 0.177 0.000 2.379 206 V HA -0.206 3.913 4.120 -0.002 0.000 0.245 206 V C 2.603 178.877 176.094 0.300 0.000 1.044 206 V CA 1.733 64.184 62.300 0.252 0.000 1.036 206 V CB -1.627 30.339 31.823 0.239 0.000 0.664 206 V HN 0.258 8.448 8.190 -0.000 0.000 0.453 207 H N 0.515 119.629 119.070 0.073 0.000 2.395 207 H HA -0.103 4.452 4.556 -0.001 0.000 0.299 207 H C 2.526 177.891 175.328 0.061 0.000 1.070 207 H CA 1.652 57.730 56.048 0.050 0.000 1.356 207 H CB -0.056 29.729 29.762 0.039 0.000 1.401 207 H HN 0.605 8.885 8.280 -0.000 0.000 0.524 208 T N -0.842 113.846 114.554 0.223 0.000 2.951 208 T HA -0.161 4.188 4.350 -0.002 0.000 0.268 208 T C 1.788 176.605 174.700 0.196 0.000 1.073 208 T CA 0.593 62.799 62.100 0.176 0.000 1.134 208 T CB -0.494 68.472 68.868 0.164 0.000 0.884 208 T HN 0.159 8.399 8.240 -0.000 0.000 0.479 209 F N 2.566 122.541 119.950 0.043 0.000 2.367 209 F HA 0.439 4.965 4.527 -0.001 0.000 0.298 209 F C 2.480 178.251 175.800 -0.047 0.000 1.094 209 F CA -0.412 57.590 58.000 0.002 0.000 1.409 209 F CB -0.986 38.020 39.000 0.010 0.000 1.064 209 F HN 0.271 8.571 8.300 -0.000 0.000 0.528 210 A N 1.974 124.730 122.820 -0.107 0.000 1.881 210 A HA -0.239 4.080 4.320 -0.002 0.000 0.219 210 A C -0.018 177.337 177.584 -0.381 0.000 1.215 210 A CA 2.369 54.251 52.037 -0.259 0.000 0.648 210 A CB -2.443 16.468 19.000 -0.149 0.000 0.832 210 A HN 0.382 8.532 8.150 -0.000 0.000 0.455 211 P HA -0.081 4.339 4.420 -0.000 0.000 0.218 211 P C 1.450 178.287 177.300 -0.772 0.000 1.149 211 P CA 1.850 64.616 63.100 -0.558 0.000 0.817 211 P CB -0.166 31.163 31.700 -0.618 0.000 0.785 212 A N -0.156 122.262 122.820 -0.671 0.000 1.930 212 A HA -0.090 4.229 4.320 -0.002 0.000 0.215 212 A C 2.177 179.424 177.584 -0.561 0.000 1.176 212 A CA 1.032 52.796 52.037 -0.455 0.000 0.632 212 A CB -1.490 17.414 19.000 -0.161 0.000 0.819 212 A HN 0.163 8.313 8.150 -0.000 0.000 0.445 213 L N -0.536 120.113 121.223 -0.957 0.000 2.017 213 L HA -0.110 4.229 4.340 -0.002 0.000 0.208 213 L C 2.195 178.835 176.870 -0.383 0.000 1.073 213 L CA 2.080 56.429 54.840 -0.817 0.000 0.745 213 L CB -0.666 40.833 42.059 -0.933 0.000 0.894 213 L HN 0.334 8.564 8.230 -0.000 0.000 0.432 214 L N -0.152 120.859 121.223 -0.352 0.000 2.017 214 L HA -0.193 4.146 4.340 -0.002 0.000 0.208 214 L C 2.514 179.265 176.870 -0.198 0.000 1.073 214 L CA 2.178 56.885 54.840 -0.223 0.000 0.745 214 L CB -0.839 41.098 42.059 -0.204 0.000 0.894 214 L HN 0.560 8.790 8.230 -0.000 0.000 0.432 215 E N -0.703 119.361 120.200 -0.228 0.000 2.110 215 E HA -0.226 4.123 4.350 -0.002 0.000 0.193 215 E C 2.217 178.688 176.600 -0.215 0.000 0.988 215 E CA 1.419 57.717 56.400 -0.171 0.000 0.804 215 E CB -0.199 29.457 29.700 -0.073 0.000 0.745 215 E HN 0.591 8.951 8.360 -0.000 0.000 0.458 216 L N 0.471 121.546 121.223 -0.247 0.000 2.046 216 L HA -0.162 4.177 4.340 -0.002 0.000 0.208 216 L C 2.868 179.546 176.870 -0.319 0.000 1.077 216 L CA 1.776 56.402 54.840 -0.355 0.000 0.747 216 L CB -0.675 41.093 42.059 -0.484 0.000 0.896 216 L HN 0.352 8.582 8.230 -0.000 0.000 0.432 217 T N -3.895 110.587 114.554 -0.120 0.000 3.035 217 T HA -0.160 4.189 4.350 -0.002 0.000 0.268 217 T C 1.624 176.329 174.700 0.009 0.000 1.109 217 T CA 0.807 62.943 62.100 0.061 0.000 1.119 217 T CB -0.079 68.841 68.868 0.088 0.000 0.900 217 T HN 0.381 8.621 8.240 -0.000 0.000 0.503 218 Q N 0.196 119.943 119.800 -0.089 0.000 2.356 218 Q HA 0.249 4.588 4.340 -0.002 0.000 0.205 218 Q C 0.288 176.177 176.000 -0.185 0.000 0.901 218 Q CA -0.201 55.542 55.803 -0.099 0.000 0.938 218 Q CB 0.368 29.045 28.738 -0.102 0.000 1.081 218 Q HN 0.545 8.815 8.270 -0.000 0.000 0.517 219 E N 0.609 120.619 120.200 -0.316 0.000 2.392 219 E HA 0.051 4.400 4.350 -0.002 0.000 0.264 219 E C -1.094 175.116 176.600 -0.649 0.000 1.024 219 E CA 0.037 56.068 56.400 -0.615 0.000 0.903 219 E CB 0.856 29.843 29.700 -1.187 0.000 0.963 219 E HN -0.174 8.186 8.360 -0.000 0.000 0.432 220 V N 6.729 126.311 119.914 -0.553 0.000 2.333 220 V HA 0.087 4.206 4.120 -0.002 0.000 0.274 220 V C 0.110 175.952 176.094 -0.420 0.000 1.028 220 V CA -0.404 61.696 62.300 -0.333 0.000 0.851 220 V CB 0.565 32.296 31.823 -0.154 0.000 1.000 220 V HN 0.867 9.057 8.190 -0.000 0.000 0.456 221 W N 2.508 123.848 121.300 0.067 0.000 2.409 221 W HA 0.061 4.720 4.660 -0.002 0.000 0.299 221 W C 0.825 177.367 176.519 0.039 0.000 1.203 221 W CA 0.913 58.300 57.345 0.070 0.000 1.298 221 W CB 0.129 29.687 29.460 0.164 0.000 1.127 221 W HN 0.809 8.989 8.180 -0.000 0.000 0.528 222 D N -4.197 116.332 120.400 0.214 0.000 2.779 222 D HA 0.053 4.692 4.640 -0.002 0.000 0.331 222 D C 0.271 176.633 176.300 0.103 0.000 1.331 222 D CA -0.609 53.467 54.000 0.128 0.000 0.866 222 D CB 0.371 41.249 40.800 0.130 0.000 1.409 222 D HN -0.258 8.112 8.370 -0.000 0.000 0.486 223 E N -0.151 120.096 120.200 0.078 0.000 2.474 223 E HA 0.322 4.671 4.350 -0.002 0.000 0.194 223 E C 1.119 177.770 176.600 0.084 0.000 1.041 223 E CA 0.712 57.152 56.400 0.067 0.000 0.874 223 E CB 0.134 29.861 29.700 0.045 0.000 0.914 223 E HN 0.751 9.111 8.360 -0.000 0.000 0.498 224 G N 2.461 111.325 108.800 0.107 0.000 2.741 224 G HA2 -0.236 3.723 3.960 -0.002 0.000 0.222 224 G HA3 -0.236 3.723 3.960 -0.002 0.000 0.222 224 G C -0.135 174.834 174.900 0.116 0.000 1.364 224 G CA -0.045 45.136 45.100 0.135 0.000 0.866 224 G HN 0.406 8.696 8.290 -0.000 0.000 0.555 225 N N -2.490 116.291 118.700 0.136 0.000 3.517 225 N HA 0.331 5.071 4.740 -0.002 0.000 0.329 225 N C 0.815 176.340 175.510 0.024 0.000 1.569 225 N CA 0.317 53.419 53.050 0.086 0.000 0.852 225 N CB 0.137 38.698 38.487 0.124 0.000 1.955 225 N HN 0.751 9.131 8.380 -0.000 0.000 0.555 226 E N -1.285 118.864 120.200 -0.086 0.000 2.118 226 E HA -0.184 4.165 4.350 -0.002 0.000 0.195 226 E C 0.293 176.672 176.600 -0.368 0.000 0.992 226 E CA 1.607 57.829 56.400 -0.297 0.000 0.804 226 E CB -0.121 29.264 29.700 -0.525 0.000 0.741 226 E HN 0.552 8.912 8.360 -0.000 0.000 0.458 227 Y N -1.832 118.464 120.300 -0.005 0.000 2.507 227 Y HA 0.255 4.804 4.550 -0.002 0.000 0.263 227 Y C 0.046 175.737 175.900 -0.348 0.000 1.093 227 Y CA 0.008 57.992 58.100 -0.194 0.000 1.285 227 Y CB 0.562 38.855 38.460 -0.279 0.000 1.115 227 Y HN -0.111 8.169 8.280 -0.000 0.000 0.533 228 F N 1.230 121.243 119.950 0.105 0.000 2.561 228 F HA 0.527 5.053 4.527 -0.002 0.000 0.321 228 F C -2.284 173.543 175.800 0.045 0.000 1.065 228 F CA -2.733 55.301 58.000 0.057 0.000 0.934 228 F CB 1.659 40.689 39.000 0.049 0.000 1.215 228 F HN -0.310 7.990 8.300 -0.000 0.000 0.471 229 P HA 0.277 4.697 4.420 -0.000 0.000 0.276 229 P C -2.800 174.617 177.300 0.195 0.000 1.261 229 P CA -1.811 61.391 63.100 0.171 0.000 0.800 229 P CB 0.265 32.045 31.700 0.135 0.000 1.066 230 P HA 0.030 4.450 4.420 -0.000 0.000 0.266 230 P C -0.020 177.410 177.300 0.216 0.000 1.193 230 P CA 0.657 63.864 63.100 0.178 0.000 0.770 230 P CB -0.243 31.557 31.700 0.168 0.000 0.836 231 T N 1.858 116.562 114.554 0.250 0.000 2.934 231 T HA 0.117 4.467 4.350 -0.002 0.000 0.306 231 T C 0.470 175.389 174.700 0.366 0.000 1.042 231 T CA 0.613 62.891 62.100 0.297 0.000 1.145 231 T CB -0.143 68.921 68.868 0.327 0.000 0.982 231 T HN 0.249 8.489 8.240 -0.000 0.000 0.544 232 S N 2.685 118.570 115.700 0.309 0.000 2.449 232 S HA 0.613 5.082 4.470 -0.002 0.000 0.310 232 S C -0.998 173.724 174.600 0.204 0.000 1.096 232 S CA -0.868 57.496 58.200 0.274 0.000 1.095 232 S CB 0.195 63.501 63.200 0.175 0.000 1.007 232 S HN 0.535 8.845 8.310 -0.000 0.000 0.474 233 F N 5.028 124.978 119.950 -0.001 0.000 2.458 233 F HA 0.653 5.179 4.527 -0.002 0.000 0.336 233 F C -0.345 175.384 175.800 -0.118 0.000 1.114 233 F CA -0.303 57.504 58.000 -0.322 0.000 0.987 233 F CB 1.153 39.904 39.000 -0.415 0.000 1.130 233 F HN 0.427 8.727 8.300 -0.000 0.000 0.458 234 Q N 6.635 125.979 119.800 -0.759 0.000 2.315 234 Q HA 0.427 4.766 4.340 -0.002 0.000 0.273 234 Q C -1.131 174.505 176.000 -0.607 0.000 1.053 234 Q CA -0.665 54.841 55.803 -0.495 0.000 0.817 234 Q CB 3.105 31.722 28.738 -0.203 0.000 1.326 234 Q HN 0.778 9.048 8.270 -0.000 0.000 0.423 235 I N 1.673 122.019 120.570 -0.372 0.000 2.325 235 I HA 0.065 4.234 4.170 -0.002 0.000 0.291 235 I C 1.341 177.397 176.117 -0.101 0.000 1.019 235 I CA 0.201 61.390 61.300 -0.185 0.000 1.302 235 I CB 1.214 39.192 38.000 -0.037 0.000 1.401 235 I HN 0.704 8.914 8.210 -0.000 0.000 0.485 236 S N 4.601 120.250 115.700 -0.085 0.000 2.456 236 S HA 0.219 4.688 4.470 -0.002 0.000 0.224 236 S C 0.640 175.218 174.600 -0.037 0.000 1.035 236 S CA -0.023 58.140 58.200 -0.061 0.000 0.940 236 S CB 0.150 63.310 63.200 -0.067 0.000 0.799 236 S HN 0.653 8.963 8.310 -0.000 0.000 0.508 237 N N 0.116 118.797 118.700 -0.032 0.000 2.329 237 N HA 0.575 5.314 4.740 -0.002 0.000 0.282 237 N C -1.980 173.526 175.510 -0.007 0.000 1.198 237 N CA -0.482 52.555 53.050 -0.021 0.000 0.790 237 N CB 2.641 41.108 38.487 -0.035 0.000 1.579 237 N HN 0.287 8.667 8.380 -0.000 0.000 0.475 238 I N 0.923 121.494 120.570 0.001 0.000 2.649 238 I HA 0.393 4.562 4.170 -0.002 0.000 0.289 238 I C -1.933 174.185 176.117 0.001 0.000 1.222 238 I CA -0.446 60.860 61.300 0.009 0.000 1.046 238 I CB 1.511 39.542 38.000 0.053 0.000 1.272 238 I HN 0.535 8.745 8.210 -0.000 0.000 0.425 239 N N 4.566 123.258 118.700 -0.013 0.000 2.503 239 N HA 0.743 5.482 4.740 -0.002 0.000 0.287 239 N C -1.136 174.365 175.510 -0.015 0.000 1.096 239 N CA -0.624 52.419 53.050 -0.010 0.000 0.936 239 N CB 2.251 40.727 38.487 -0.017 0.000 1.570 239 N HN 0.748 9.128 8.380 -0.000 0.000 0.504 240 G N 0.342 109.141 108.800 -0.002 0.000 2.746 240 G HA2 0.801 4.760 3.960 -0.002 0.000 0.297 240 G HA3 0.801 4.760 3.960 -0.002 0.000 0.297 240 G C -0.515 174.386 174.900 0.003 0.000 1.426 240 G CA -0.276 44.823 45.100 -0.001 0.000 0.989 240 G HN 0.769 9.059 8.290 -0.000 0.000 0.520 241 G N -0.378 108.420 108.800 -0.003 0.000 2.406 241 G HA2 0.409 4.368 3.960 -0.002 0.000 0.680 241 G HA3 0.409 4.368 3.960 -0.002 0.000 0.680 241 G C 0.506 175.401 174.900 -0.009 0.000 1.338 241 G CA 0.578 45.675 45.100 -0.006 0.000 0.941 241 G HN 1.802 10.092 8.290 -0.000 0.000 0.633 242 T N -2.312 112.235 114.554 -0.012 0.000 3.040 242 T HA 0.487 4.836 4.350 -0.002 0.000 0.250 242 T C 2.082 176.777 174.700 -0.009 0.000 1.058 242 T CA 1.688 63.781 62.100 -0.011 0.000 0.988 242 T CB 0.507 69.368 68.868 -0.012 0.000 0.993 242 T HN 2.791 11.031 8.240 -0.000 0.000 0.519 243 G N 1.266 110.061 108.800 -0.009 0.000 2.238 243 G HA2 -0.004 3.955 3.960 -0.002 0.000 0.217 243 G HA3 -0.004 3.955 3.960 -0.002 0.000 0.217 243 G C 0.323 175.217 174.900 -0.009 0.000 0.996 243 G CA -0.228 44.868 45.100 -0.007 0.000 0.632 243 G HN 1.153 9.443 8.290 -0.000 0.000 0.503 244 A N 1.076 123.887 122.820 -0.015 0.000 2.409 244 A HA 0.645 4.964 4.320 -0.002 0.000 0.267 244 A C 1.449 179.013 177.584 -0.033 0.000 1.127 244 A CA 1.306 53.330 52.037 -0.022 0.000 0.795 244 A CB 0.348 19.332 19.000 -0.026 0.000 1.061 244 A HN 1.352 9.502 8.150 -0.000 0.000 0.502 245 T N -0.657 113.879 114.554 -0.030 0.000 3.129 245 T HA -0.011 4.338 4.350 -0.002 0.000 0.251 245 T C 0.514 175.175 174.700 -0.064 0.000 1.117 245 T CA 0.617 62.697 62.100 -0.033 0.000 1.034 245 T CB -0.489 68.369 68.868 -0.016 0.000 0.968 245 T HN 0.726 8.966 8.240 -0.000 0.000 0.526 246 N N 0.471 119.105 118.700 -0.109 0.000 2.282 246 N HA 0.225 4.964 4.740 -0.002 0.000 0.240 246 N C -0.697 174.589 175.510 -0.373 0.000 1.182 246 N CA -0.469 52.440 53.050 -0.236 0.000 0.874 246 N CB 0.330 38.686 38.487 -0.219 0.000 1.126 246 N HN 0.286 8.666 8.380 -0.000 0.000 0.516 247 V N 1.018 120.814 119.914 -0.195 0.000 2.680 247 V HA 0.464 4.583 4.120 -0.002 0.000 0.309 247 V C -0.031 176.005 176.094 -0.096 0.000 1.052 247 V CA -0.891 61.317 62.300 -0.152 0.000 0.908 247 V CB 2.363 34.135 31.823 -0.084 0.000 1.001 247 V HN 0.089 8.279 8.190 -0.000 0.000 0.431 248 I N 6.898 127.421 120.570 -0.078 0.000 2.304 248 I HA 0.314 4.483 4.170 -0.002 0.000 0.291 248 I C -2.015 174.076 176.117 -0.043 0.000 1.018 248 I CA -1.854 59.408 61.300 -0.063 0.000 1.260 248 I CB 1.877 39.835 38.000 -0.071 0.000 1.390 248 I HN 0.436 8.646 8.210 -0.000 0.000 0.475 249 P HA -0.006 4.414 4.420 -0.000 0.000 0.268 249 P C 0.628 177.918 177.300 -0.017 0.000 1.208 249 P CA 0.055 63.144 63.100 -0.019 0.000 0.777 249 P CB 0.869 32.564 31.700 -0.008 0.000 0.875 250 G N 0.950 109.742 108.800 -0.013 0.000 2.744 250 G HA2 0.047 4.006 3.960 -0.002 0.000 0.211 250 G HA3 0.047 4.006 3.960 -0.002 0.000 0.211 250 G C 0.282 175.178 174.900 -0.005 0.000 1.146 250 G CA 0.067 45.161 45.100 -0.010 0.000 0.787 250 G HN 0.714 9.004 8.290 -0.000 0.000 0.534 251 E N -1.511 118.684 120.200 -0.008 0.000 2.423 251 E HA 0.609 4.958 4.350 -0.002 0.000 0.280 251 E C -2.175 174.413 176.600 -0.020 0.000 1.030 251 E CA -1.079 55.315 56.400 -0.011 0.000 0.812 251 E CB 1.633 31.324 29.700 -0.015 0.000 1.313 251 E HN 0.005 8.365 8.360 -0.000 0.000 0.456 252 L N 1.924 123.122 121.223 -0.042 0.000 2.436 252 L HA 0.495 4.834 4.340 -0.002 0.000 0.268 252 L C -1.546 175.255 176.870 -0.115 0.000 0.974 252 L CA -0.376 54.424 54.840 -0.066 0.000 0.826 252 L CB 1.913 43.928 42.059 -0.074 0.000 1.291 252 L HN 0.732 8.962 8.230 -0.000 0.000 0.406 253 N N 4.120 122.763 118.700 -0.096 0.000 2.421 253 N HA 0.614 5.353 4.740 -0.002 0.000 0.285 253 N C -1.747 173.690 175.510 -0.121 0.000 1.027 253 N CA -0.285 52.700 53.050 -0.109 0.000 0.918 253 N CB 1.810 40.252 38.487 -0.076 0.000 1.152 253 N HN 0.482 8.862 8.380 -0.000 0.000 0.485 254 V N 3.299 123.125 119.914 -0.147 0.000 2.577 254 V HA 0.387 4.506 4.120 -0.002 0.000 0.303 254 V C -0.489 175.572 176.094 -0.054 0.000 1.042 254 V CA -0.834 61.413 62.300 -0.088 0.000 0.872 254 V CB 1.820 33.562 31.823 -0.135 0.000 0.998 254 V HN 0.571 8.761 8.190 -0.000 0.000 0.423 255 K N 4.964 125.335 120.400 -0.049 0.000 2.274 255 K HA 0.763 5.082 4.320 -0.002 0.000 0.262 255 K C -1.115 175.437 176.600 -0.079 0.000 0.961 255 K CA -0.373 55.830 56.287 -0.140 0.000 0.833 255 K CB 2.018 34.436 32.500 -0.136 0.000 1.102 255 K HN 0.631 8.881 8.250 -0.000 0.000 0.436 256 F N -0.271 119.554 119.950 -0.208 0.000 2.650 256 F HA 0.599 5.125 4.527 -0.002 0.000 0.320 256 F C -1.095 174.522 175.800 -0.305 0.000 1.091 256 F CA -1.051 56.738 58.000 -0.352 0.000 0.962 256 F CB 1.593 40.321 39.000 -0.453 0.000 1.363 256 F HN 0.389 8.689 8.300 -0.000 0.000 0.482 257 N N 0.376 118.967 118.700 -0.182 0.000 2.405 257 N HA 0.434 5.173 4.740 -0.002 0.000 0.274 257 N C -2.418 172.996 175.510 -0.160 0.000 1.170 257 N CA -0.362 52.638 53.050 -0.084 0.000 0.848 257 N CB 2.226 40.673 38.487 -0.066 0.000 1.629 257 N HN 0.600 8.980 8.380 -0.000 0.000 0.481 258 F N 1.254 121.277 119.950 0.121 0.000 2.458 258 F HA 0.511 5.037 4.527 -0.002 0.000 0.336 258 F C 0.509 176.413 175.800 0.175 0.000 1.114 258 F CA -0.754 57.314 58.000 0.114 0.000 0.987 258 F CB 1.418 40.472 39.000 0.090 0.000 1.130 258 F HN 0.136 8.436 8.300 -0.000 0.000 0.458 259 R N 4.274 124.962 120.500 0.314 0.000 2.247 259 R HA 0.293 4.632 4.340 -0.002 0.000 0.329 259 R C -1.148 175.297 176.300 0.242 0.000 1.014 259 R CA -0.529 55.693 56.100 0.203 0.000 0.907 259 R CB 0.248 30.614 30.300 0.111 0.000 1.146 259 R HN 0.564 8.834 8.270 -0.000 0.000 0.499 260 F N -0.435 119.543 119.950 0.046 0.000 2.422 260 F HA 0.639 5.165 4.527 -0.002 0.000 0.333 260 F C 0.660 176.348 175.800 -0.185 0.000 1.095 260 F CA -1.197 56.780 58.000 -0.038 0.000 1.038 260 F CB 0.967 39.904 39.000 -0.105 0.000 1.156 260 F HN 0.331 8.631 8.300 -0.000 0.000 0.483 261 S N 0.406 116.029 115.700 -0.128 0.000 2.694 261 S HA 0.288 4.757 4.470 -0.002 0.000 0.278 261 S C 1.095 175.405 174.600 -0.484 0.000 1.152 261 S CA 0.061 57.850 58.200 -0.686 0.000 1.010 261 S CB 0.782 63.720 63.200 -0.437 0.000 1.104 261 S HN 0.937 9.247 8.310 -0.000 0.000 0.547 262 T N -1.458 112.659 114.554 -0.729 0.000 3.051 262 T HA 0.016 4.365 4.350 -0.002 0.000 0.269 262 T C 1.097 175.746 174.700 -0.085 0.000 1.127 262 T CA 0.769 62.708 62.100 -0.268 0.000 1.107 262 T CB -0.488 68.296 68.868 -0.139 0.000 0.898 262 T HN 0.618 8.858 8.240 -0.000 0.000 0.517 263 E N 1.295 121.459 120.200 -0.060 0.000 2.347 263 E HA 0.122 4.471 4.350 -0.002 0.000 0.196 263 E C 0.615 177.227 176.600 0.020 0.000 1.008 263 E CA 0.302 56.709 56.400 0.011 0.000 0.852 263 E CB 0.124 29.849 29.700 0.042 0.000 0.783 263 E HN 0.488 8.848 8.360 -0.000 0.000 0.505 264 S N -0.238 115.478 115.700 0.026 0.000 2.677 264 S HA 0.455 4.924 4.470 -0.002 0.000 0.304 264 S C 0.034 174.611 174.600 -0.038 0.000 1.108 264 S CA -0.742 57.450 58.200 -0.013 0.000 0.944 264 S CB 2.118 65.294 63.200 -0.041 0.000 1.127 264 S HN 0.201 8.511 8.310 -0.000 0.000 0.511 265 T N -2.003 112.457 114.554 -0.157 0.000 2.942 265 T HA 0.476 4.826 4.350 -0.002 0.000 0.289 265 T C 0.878 175.283 174.700 -0.490 0.000 1.044 265 T CA -0.753 61.230 62.100 -0.194 0.000 1.023 265 T CB 1.548 70.344 68.868 -0.120 0.000 1.123 265 T HN 0.669 8.909 8.240 -0.000 0.000 0.512 266 E N 0.776 120.673 120.200 -0.505 0.000 2.058 266 E HA -0.177 4.172 4.350 -0.002 0.000 0.194 266 E C 2.236 178.520 176.600 -0.528 0.000 0.997 266 E CA 1.442 57.446 56.400 -0.660 0.000 0.801 266 E CB -0.576 28.909 29.700 -0.358 0.000 0.746 266 E HN 0.781 9.141 8.360 -0.000 0.000 0.450 267 A N 0.935 123.549 122.820 -0.344 0.000 1.883 267 A HA -0.127 4.192 4.320 -0.002 0.000 0.217 267 A C 2.492 179.920 177.584 -0.260 0.000 1.186 267 A CA 1.978 53.849 52.037 -0.277 0.000 0.624 267 A CB -1.457 17.440 19.000 -0.170 0.000 0.822 267 A HN 0.489 8.639 8.150 -0.000 0.000 0.444 268 G N -0.219 108.441 108.800 -0.232 0.000 2.446 268 G HA2 -0.197 3.762 3.960 -0.002 0.000 0.217 268 G HA3 -0.197 3.762 3.960 -0.002 0.000 0.217 268 G C 1.569 176.351 174.900 -0.197 0.000 1.168 268 G CA 1.112 46.112 45.100 -0.167 0.000 0.771 268 G HN 0.438 8.728 8.290 -0.000 0.000 0.551 269 L N -0.189 120.801 121.223 -0.389 0.000 2.046 269 L HA -0.048 4.291 4.340 -0.002 0.000 0.208 269 L C 2.973 179.607 176.870 -0.395 0.000 1.077 269 L CA 1.318 55.840 54.840 -0.530 0.000 0.747 269 L CB -0.301 41.062 42.059 -1.159 0.000 0.896 269 L HN 0.186 8.416 8.230 -0.000 0.000 0.432 270 K N -0.541 119.537 120.400 -0.536 0.000 2.057 270 K HA -0.211 4.108 4.320 -0.002 0.000 0.207 270 K C 2.216 178.857 176.600 0.067 0.000 1.049 270 K CA 0.972 56.959 56.287 -0.501 0.000 0.931 270 K CB -0.173 31.782 32.500 -0.910 0.000 0.714 270 K HN 0.193 8.443 8.250 -0.000 0.000 0.440 271 Q N 1.547 121.355 119.800 0.013 0.000 2.124 271 Q HA -0.173 4.166 4.340 -0.002 0.000 0.202 271 Q C 1.853 177.960 176.000 0.180 0.000 0.977 271 Q CA 1.631 57.502 55.803 0.115 0.000 0.850 271 Q CB 0.080 28.831 28.738 0.022 0.000 0.901 271 Q HN 0.286 8.556 8.270 -0.000 0.000 0.429 272 R N -0.701 119.892 120.500 0.155 0.000 2.090 272 R HA -0.032 4.307 4.340 -0.002 0.000 0.228 272 R C 2.490 178.957 176.300 0.278 0.000 1.110 272 R CA 1.155 57.385 56.100 0.216 0.000 0.973 272 R CB -0.129 30.354 30.300 0.304 0.000 0.869 272 R HN 0.076 8.346 8.270 -0.000 0.000 0.440 273 V N 0.535 120.648 119.914 0.332 0.000 2.295 273 V HA -0.264 3.855 4.120 -0.002 0.000 0.246 273 V C 2.185 178.390 176.094 0.184 0.000 1.049 273 V CA 1.720 64.194 62.300 0.290 0.000 1.024 273 V CB -0.631 31.456 31.823 0.441 0.000 0.648 273 V HN 0.387 8.577 8.190 -0.000 0.000 0.447 274 H N 0.070 119.319 119.070 0.298 0.000 2.353 274 H HA -0.093 4.462 4.556 -0.002 0.000 0.300 274 H C 2.371 177.818 175.328 0.200 0.000 1.090 274 H CA 1.770 57.983 56.048 0.276 0.000 1.327 274 H CB -0.284 29.672 29.762 0.323 0.000 1.383 274 H HN 0.463 8.743 8.280 -0.000 0.000 0.508 275 A N 0.837 123.819 122.820 0.271 0.000 1.933 275 A HA -0.109 4.210 4.320 -0.002 0.000 0.218 275 A C 2.632 180.282 177.584 0.110 0.000 1.175 275 A CA 1.114 53.249 52.037 0.163 0.000 0.628 275 A CB -0.651 18.413 19.000 0.106 0.000 0.814 275 A HN 0.283 8.433 8.150 -0.000 0.000 0.444 276 I N -0.576 120.061 120.570 0.112 0.000 2.286 276 I HA -0.200 3.969 4.170 -0.002 0.000 0.245 276 I C 2.296 178.503 176.117 0.149 0.000 1.104 276 I CA 0.852 62.209 61.300 0.095 0.000 1.397 276 I CB -0.220 37.824 38.000 0.075 0.000 1.072 276 I HN 0.276 8.486 8.210 -0.000 0.000 0.417 277 L N 0.218 121.509 121.223 0.113 0.000 2.046 277 L HA -0.225 4.114 4.340 -0.002 0.000 0.208 277 L C 2.009 179.013 176.870 0.224 0.000 1.077 277 L CA 1.227 56.130 54.840 0.104 0.000 0.747 277 L CB -0.640 41.288 42.059 -0.218 0.000 0.896 277 L HN 0.255 8.485 8.230 -0.000 0.000 0.432 278 D N 0.193 120.738 120.400 0.242 0.000 2.183 278 D HA -0.151 4.488 4.640 -0.002 0.000 0.203 278 D C 2.066 178.431 176.300 0.109 0.000 0.969 278 D CA 1.120 55.257 54.000 0.229 0.000 0.842 278 D CB -0.062 40.874 40.800 0.227 0.000 0.957 278 D HN 0.443 8.813 8.370 -0.000 0.000 0.484 279 K N 0.103 120.512 120.400 0.015 0.000 2.288 279 K HA -0.096 4.223 4.320 -0.002 0.000 0.201 279 K C 1.246 177.720 176.600 -0.211 0.000 1.048 279 K CA 1.061 57.275 56.287 -0.122 0.000 0.956 279 K CB -0.146 32.224 32.500 -0.217 0.000 0.746 279 K HN 0.163 8.413 8.250 -0.000 0.000 0.461 280 H N 0.199 119.304 119.070 0.059 0.000 2.526 280 H HA 0.155 4.710 4.556 -0.002 0.000 0.274 280 H C 0.815 176.191 175.328 0.080 0.000 0.999 280 H CA 0.642 56.721 56.048 0.050 0.000 1.157 280 H CB 0.730 30.509 29.762 0.027 0.000 1.407 280 H HN 0.589 8.869 8.280 -0.000 0.000 0.568 281 G N 1.339 110.241 108.800 0.170 0.000 2.179 281 G HA2 -0.291 3.668 3.960 -0.002 0.000 0.257 281 G HA3 -0.291 3.668 3.960 -0.002 0.000 0.257 281 G C 0.347 175.366 174.900 0.198 0.000 1.010 281 G CA 0.471 45.666 45.100 0.159 0.000 0.736 281 G HN 0.229 8.519 8.290 -0.000 0.000 0.513 282 V N 0.665 120.738 119.914 0.265 0.000 2.715 282 V HA 0.336 4.455 4.120 -0.002 0.000 0.299 282 V C 0.529 176.851 176.094 0.381 0.000 1.054 282 V CA -0.054 62.429 62.300 0.305 0.000 1.077 282 V CB 1.585 33.599 31.823 0.318 0.000 0.972 282 V HN 0.394 8.584 8.190 -0.000 0.000 0.484 283 Q N 4.117 124.090 119.800 0.288 0.000 2.307 283 Q HA 0.596 4.935 4.340 -0.002 0.000 0.262 283 Q C -0.950 175.190 176.000 0.233 0.000 0.961 283 Q CA -0.328 55.578 55.803 0.170 0.000 0.882 283 Q CB 2.057 30.844 28.738 0.082 0.000 1.264 283 Q HN 0.831 9.101 8.270 -0.000 0.000 0.446 284 Y N -1.370 118.962 120.300 0.054 0.000 2.741 284 Y HA 0.497 5.046 4.550 -0.002 0.000 0.339 284 Y C -1.489 174.432 175.900 0.035 0.000 1.226 284 Y CA -1.339 56.776 58.100 0.025 0.000 1.072 284 Y CB 1.013 39.485 38.460 0.020 0.000 1.331 284 Y HN 0.232 8.512 8.280 -0.000 0.000 0.453 285 D N 1.692 122.177 120.400 0.142 0.000 2.248 285 D HA 0.538 5.177 4.640 -0.002 0.000 0.246 285 D C -1.577 174.845 176.300 0.204 0.000 1.027 285 D CA -0.201 53.860 54.000 0.101 0.000 0.853 285 D CB 2.590 43.410 40.800 0.034 0.000 1.243 285 D HN 0.612 8.982 8.370 -0.000 0.000 0.462 286 L N 1.769 123.100 121.223 0.180 0.000 2.482 286 L HA 0.274 4.613 4.340 -0.002 0.000 0.269 286 L C -1.222 175.559 176.870 -0.147 0.000 0.967 286 L CA -0.338 54.489 54.840 -0.022 0.000 0.851 286 L CB 1.703 43.756 42.059 -0.010 0.000 1.242 286 L HN 0.234 8.464 8.230 -0.000 0.000 0.404 287 Q N 3.802 123.463 119.800 -0.233 0.000 2.256 287 Q HA 0.504 4.843 4.340 -0.002 0.000 0.257 287 Q C -1.598 174.240 176.000 -0.269 0.000 0.936 287 Q CA -0.135 55.583 55.803 -0.141 0.000 0.903 287 Q CB 1.678 30.374 28.738 -0.071 0.000 1.263 287 Q HN 0.625 8.895 8.270 -0.000 0.000 0.440 288 W N 0.591 121.902 121.300 0.017 0.000 2.639 288 W HA 0.605 5.265 4.660 -0.001 0.000 0.347 288 W C -0.040 176.474 176.519 -0.008 0.000 1.067 288 W CA -0.605 56.736 57.345 -0.006 0.000 1.218 288 W CB 2.088 31.575 29.460 0.045 0.000 1.393 288 W HN 0.389 8.569 8.180 -0.000 0.000 0.557 289 S N 1.437 117.298 115.700 0.269 0.000 2.548 289 S HA 0.562 5.031 4.470 -0.002 0.000 0.276 289 S C -1.650 173.048 174.600 0.164 0.000 1.129 289 S CA -0.575 57.718 58.200 0.155 0.000 0.931 289 S CB 0.920 64.164 63.200 0.074 0.000 1.068 289 S HN 0.595 8.905 8.310 -0.000 0.000 0.480 290 C N 4.468 123.845 119.300 0.129 0.000 2.346 290 C HA 0.675 5.134 4.460 -0.002 0.000 0.326 290 C C 1.380 176.436 174.990 0.110 0.000 1.224 290 C CA -0.209 58.893 59.018 0.139 0.000 1.408 290 C CB 0.122 27.937 27.740 0.125 0.000 2.089 290 C HN 0.974 9.204 8.230 -0.000 0.000 0.456 291 S N 3.385 119.147 115.700 0.103 0.000 2.593 291 S HA 0.523 4.992 4.470 -0.002 0.000 0.217 291 S C 0.635 175.262 174.600 0.045 0.000 0.966 291 S CA 0.349 58.590 58.200 0.068 0.000 0.914 291 S CB 0.009 63.241 63.200 0.052 0.000 0.776 291 S HN 1.876 10.186 8.310 -0.000 0.000 0.523 292 G N 0.350 109.186 108.800 0.059 0.000 2.376 292 G HA2 0.354 4.313 3.960 -0.002 0.000 0.302 292 G HA3 0.354 4.313 3.960 -0.002 0.000 0.302 292 G C -1.754 173.146 174.900 0.000 0.000 1.586 292 G CA -0.984 44.128 45.100 0.020 0.000 0.907 292 G HN 0.038 8.328 8.290 -0.000 0.000 0.655 293 Q N 0.121 119.920 119.800 -0.002 0.000 2.199 293 Q HA 0.530 4.869 4.340 -0.002 0.000 0.232 293 Q C -2.185 173.713 176.000 -0.170 0.000 0.969 293 Q CA -1.580 54.175 55.803 -0.079 0.000 0.925 293 Q CB 1.474 30.234 28.738 0.036 0.000 1.198 293 Q HN 0.425 8.695 8.270 -0.000 0.000 0.494 294 P HA 0.126 4.546 4.420 -0.000 0.000 0.269 294 P C -0.858 176.456 177.300 0.024 0.000 1.209 294 P CA 0.116 63.061 63.100 -0.259 0.000 0.776 294 P CB 0.177 31.590 31.700 -0.478 0.000 0.876 295 F N 1.479 121.445 119.950 0.025 0.000 2.588 295 F HA 0.809 5.335 4.527 -0.002 0.000 0.310 295 F C -1.872 173.974 175.800 0.077 0.000 1.082 295 F CA -1.501 56.514 58.000 0.025 0.000 0.929 295 F CB 1.467 40.449 39.000 -0.030 0.000 1.254 295 F HN 0.213 8.513 8.300 -0.000 0.000 0.455 296 L N 1.762 123.047 121.223 0.103 0.000 2.545 296 L HA 0.688 5.027 4.340 -0.002 0.000 0.258 296 L C -1.379 175.463 176.870 -0.046 0.000 0.942 296 L CA -0.009 54.785 54.840 -0.078 0.000 0.855 296 L CB 2.684 44.721 42.059 -0.036 0.000 1.374 296 L HN 0.840 9.070 8.230 -0.000 0.000 0.411 297 T N 3.500 117.971 114.554 -0.139 0.000 2.809 297 T HA 0.475 4.824 4.350 -0.002 0.000 0.296 297 T C -0.311 174.231 174.700 -0.264 0.000 1.015 297 T CA -0.341 61.693 62.100 -0.110 0.000 0.954 297 T CB 0.976 69.827 68.868 -0.029 0.000 0.950 297 T HN 0.635 8.875 8.240 -0.000 0.000 0.450 298 Q N 1.369 121.017 119.800 -0.253 0.000 2.471 298 Q HA 0.580 4.919 4.340 -0.002 0.000 0.223 298 Q C 0.517 176.454 176.000 -0.105 0.000 1.045 298 Q CA -0.775 54.816 55.803 -0.354 0.000 0.956 298 Q CB 0.536 29.196 28.738 -0.130 0.000 1.249 298 Q HN 0.806 9.076 8.270 -0.000 0.000 0.549 299 A N 0.336 123.186 122.820 0.050 0.000 2.567 299 A HA 0.423 4.742 4.320 -0.002 0.000 0.240 299 A C 0.407 178.032 177.584 0.068 0.000 1.053 299 A CA 1.002 53.096 52.037 0.096 0.000 0.755 299 A CB -0.396 18.702 19.000 0.163 0.000 0.978 299 A HN 0.759 8.909 8.150 -0.000 0.000 0.507 300 G N 0.768 109.602 108.800 0.057 0.000 2.588 300 G HA2 0.332 4.291 3.960 -0.002 0.000 0.281 300 G HA3 0.332 4.291 3.960 -0.002 0.000 0.281 300 G C 0.601 175.536 174.900 0.059 0.000 1.223 300 G CA 0.187 45.325 45.100 0.064 0.000 0.871 300 G HN 0.639 8.929 8.290 -0.000 0.000 0.492 301 K N -0.890 119.558 120.400 0.080 0.000 2.057 301 K HA 0.006 4.325 4.320 -0.002 0.000 0.206 301 K C 2.501 179.084 176.600 -0.028 0.000 1.050 301 K CA 1.555 57.860 56.287 0.030 0.000 0.935 301 K CB -0.272 32.259 32.500 0.051 0.000 0.715 301 K HN 0.213 8.463 8.250 -0.000 0.000 0.439 302 L N 1.233 122.474 121.223 0.031 0.000 2.017 302 L HA -0.162 4.177 4.340 -0.002 0.000 0.208 302 L C 2.352 179.224 176.870 0.004 0.000 1.073 302 L CA 2.516 57.354 54.840 -0.003 0.000 0.745 302 L CB -1.007 41.140 42.059 0.147 0.000 0.894 302 L HN 0.429 8.659 8.230 -0.000 0.000 0.432 303 T N -4.389 110.180 114.554 0.024 0.000 2.821 303 T HA -0.146 4.203 4.350 -0.002 0.000 0.267 303 T C 1.694 176.402 174.700 0.014 0.000 1.046 303 T CA 1.194 63.306 62.100 0.020 0.000 1.139 303 T CB -0.606 68.277 68.868 0.026 0.000 0.871 303 T HN 0.267 8.507 8.240 -0.000 0.000 0.454 304 D N 1.536 121.942 120.400 0.010 0.000 2.117 304 D HA -0.083 4.556 4.640 -0.002 0.000 0.197 304 D C 2.477 178.770 176.300 -0.012 0.000 0.987 304 D CA 1.614 55.616 54.000 0.004 0.000 0.829 304 D CB -0.513 40.290 40.800 0.004 0.000 0.961 304 D HN 0.513 8.883 8.370 -0.000 0.000 0.460 305 V N -0.844 119.049 119.914 -0.035 0.000 2.427 305 V HA -0.068 4.051 4.120 -0.002 0.000 0.248 305 V C 2.234 178.315 176.094 -0.021 0.000 1.051 305 V CA 1.686 63.957 62.300 -0.047 0.000 1.048 305 V CB -1.006 30.755 31.823 -0.102 0.000 0.666 305 V HN 0.115 8.305 8.190 -0.000 0.000 0.456 306 A N 0.486 123.303 122.820 -0.006 0.000 1.902 306 A HA -0.135 4.184 4.320 -0.002 0.000 0.217 306 A C 2.446 180.040 177.584 0.016 0.000 1.181 306 A CA 1.911 53.960 52.037 0.021 0.000 0.623 306 A CB -0.596 18.425 19.000 0.036 0.000 0.818 306 A HN 0.553 8.703 8.150 -0.000 0.000 0.443 307 R N -0.706 119.801 120.500 0.011 0.000 2.075 307 R HA -0.049 4.290 4.340 -0.002 0.000 0.232 307 R C 2.495 178.798 176.300 0.005 0.000 1.126 307 R CA 1.181 57.287 56.100 0.009 0.000 0.963 307 R CB -0.392 29.914 30.300 0.010 0.000 0.858 307 R HN 0.515 8.785 8.270 -0.000 0.000 0.435 308 A N 0.887 123.707 122.820 0.001 0.000 1.902 308 A HA -0.116 4.203 4.320 -0.002 0.000 0.217 308 A C 2.311 179.895 177.584 0.001 0.000 1.181 308 A CA 1.709 53.746 52.037 -0.000 0.000 0.623 308 A CB -0.660 18.337 19.000 -0.005 0.000 0.818 308 A HN 0.416 8.566 8.150 -0.000 0.000 0.443 309 A N -0.273 122.548 122.820 0.001 0.000 1.930 309 A HA -0.039 4.280 4.320 -0.002 0.000 0.217 309 A C 2.122 179.708 177.584 0.002 0.000 1.175 309 A CA 1.473 53.513 52.037 0.005 0.000 0.627 309 A CB -0.544 18.464 19.000 0.013 0.000 0.815 309 A HN 0.495 8.645 8.150 -0.000 0.000 0.443 310 I N -0.409 120.162 120.570 0.003 0.000 2.202 310 I HA -0.236 3.933 4.170 -0.002 0.000 0.242 310 I C 2.995 179.109 176.117 -0.005 0.000 1.091 310 I CA 0.915 62.213 61.300 -0.004 0.000 1.368 310 I CB -0.345 37.654 38.000 -0.001 0.000 1.058 310 I HN 0.351 8.561 8.210 -0.000 0.000 0.410 311 A N 0.442 123.261 122.820 -0.002 0.000 1.892 311 A HA -0.311 4.008 4.320 -0.002 0.000 0.218 311 A C 2.310 179.893 177.584 -0.002 0.000 1.188 311 A CA 2.279 54.316 52.037 -0.001 0.000 0.631 311 A CB -0.748 18.252 19.000 0.001 0.000 0.822 311 A HN 0.535 8.685 8.150 -0.000 0.000 0.447 312 E N -1.169 119.031 120.200 -0.000 0.000 2.072 312 E HA -0.150 4.199 4.350 -0.002 0.000 0.191 312 E C 1.894 178.493 176.600 -0.002 0.000 0.985 312 E CA 1.675 58.076 56.400 0.001 0.000 0.801 312 E CB -0.098 29.605 29.700 0.005 0.000 0.750 312 E HN 0.552 8.912 8.360 -0.000 0.000 0.452 313 T N -0.773 113.777 114.554 -0.006 0.000 2.937 313 T HA -0.030 4.319 4.350 -0.002 0.000 0.260 313 T C 1.672 176.363 174.700 -0.016 0.000 1.051 313 T CA 0.984 63.077 62.100 -0.012 0.000 1.141 313 T CB 0.083 68.939 68.868 -0.019 0.000 0.879 313 T HN 0.298 8.538 8.240 -0.000 0.000 0.459 314 C N 0.448 119.739 119.300 -0.016 0.000 3.065 314 C HA 0.573 5.032 4.460 -0.002 0.000 0.285 314 C C 2.075 177.058 174.990 -0.012 0.000 1.257 314 C CA -0.578 58.430 59.018 -0.017 0.000 1.691 314 C CB -0.593 27.134 27.740 -0.022 0.000 2.089 314 C HN 0.736 8.966 8.230 -0.000 0.000 0.630 315 G N 2.074 110.869 108.800 -0.008 0.000 2.160 315 G HA2 -0.249 3.710 3.960 -0.002 0.000 0.251 315 G HA3 -0.249 3.710 3.960 -0.002 0.000 0.251 315 G C -0.088 174.808 174.900 -0.006 0.000 1.008 315 G CA 0.845 45.941 45.100 -0.006 0.000 0.724 315 G HN 0.794 9.084 8.290 -0.000 0.000 0.514 316 I N -4.573 115.993 120.570 -0.006 0.000 3.145 316 I HA 0.847 5.016 4.170 -0.002 0.000 0.313 316 I C -0.590 175.525 176.117 -0.004 0.000 1.122 316 I CA -1.410 59.886 61.300 -0.006 0.000 0.987 316 I CB 2.011 40.007 38.000 -0.008 0.000 1.236 316 I HN -0.115 8.095 8.210 -0.000 0.000 0.453 317 E N 2.119 122.317 120.200 -0.003 0.000 2.081 317 E HA 0.609 4.958 4.350 -0.002 0.000 0.281 317 E C 0.046 176.645 176.600 -0.001 0.000 0.986 317 E CA -0.612 55.788 56.400 -0.001 0.000 0.796 317 E CB 1.418 31.118 29.700 -0.001 0.000 1.085 317 E HN 0.789 9.149 8.360 -0.000 0.000 0.398 318 A N 2.943 125.764 122.820 0.001 0.000 2.425 318 A HA 0.548 4.868 4.320 -0.002 0.000 0.249 318 A C 0.667 178.253 177.584 0.003 0.000 1.084 318 A CA 0.102 52.141 52.037 0.002 0.000 0.781 318 A CB 0.122 19.125 19.000 0.006 0.000 1.019 318 A HN 0.801 8.951 8.150 -0.000 0.000 0.490 319 E N 1.814 122.015 120.200 0.000 0.000 2.214 319 E HA 0.612 4.961 4.350 -0.002 0.000 0.274 319 E C -0.580 176.021 176.600 0.001 0.000 0.977 319 E CA -0.744 55.656 56.400 0.000 0.000 0.827 319 E CB 0.830 30.526 29.700 -0.005 0.000 1.130 319 E HN 0.692 9.052 8.360 -0.000 0.000 0.394 320 L N 1.402 122.631 121.223 0.009 0.000 2.375 320 L HA 0.675 5.015 4.340 -0.002 0.000 0.271 320 L C 0.535 177.394 176.870 -0.017 0.000 1.107 320 L CA -0.524 54.321 54.840 0.007 0.000 0.806 320 L CB 1.627 43.721 42.059 0.058 0.000 1.146 320 L HN 0.607 8.837 8.230 -0.000 0.000 0.447 321 S N -0.378 115.288 115.700 -0.057 0.000 2.556 321 S HA 0.507 4.976 4.470 -0.002 0.000 0.271 321 S C 0.057 174.555 174.600 -0.169 0.000 1.135 321 S CA -0.086 58.061 58.200 -0.088 0.000 0.858 321 S CB 1.895 65.062 63.200 -0.055 0.000 1.114 321 S HN 0.721 9.031 8.310 -0.000 0.000 0.468 322 T N -0.660 113.759 114.554 -0.225 0.000 3.091 322 T HA 0.271 4.620 4.350 -0.002 0.000 0.277 322 T C 0.913 175.530 174.700 -0.138 0.000 0.996 322 T CA 0.446 62.361 62.100 -0.308 0.000 0.897 322 T CB -0.507 67.933 68.868 -0.714 0.000 1.109 322 T HN 0.831 9.071 8.240 -0.000 0.000 0.534 323 T N -0.422 114.089 114.554 -0.072 0.000 2.689 323 T HA 0.574 4.923 4.350 -0.002 0.000 0.308 323 T C 1.258 175.949 174.700 -0.015 0.000 1.021 323 T CA 0.268 62.359 62.100 -0.014 0.000 0.973 323 T CB 0.204 69.072 68.868 -0.001 0.000 1.113 323 T HN 1.332 9.572 8.240 -0.000 0.000 0.522 324 G N -0.270 108.533 108.800 0.004 0.000 2.512 324 G HA2 0.200 4.159 3.960 -0.002 0.000 0.240 324 G HA3 0.200 4.159 3.960 -0.002 0.000 0.240 324 G C 0.319 175.224 174.900 0.008 0.000 1.246 324 G CA 0.124 45.226 45.100 0.002 0.000 0.919 324 G HN 1.363 9.653 8.290 -0.000 0.000 0.577 325 G N -1.748 107.057 108.800 0.008 0.000 3.086 325 G HA2 0.692 4.651 3.960 -0.002 0.000 0.159 325 G HA3 0.692 4.651 3.960 -0.002 0.000 0.159 325 G C 0.498 175.407 174.900 0.015 0.000 1.654 325 G CA 1.654 46.764 45.100 0.017 0.000 1.078 325 G HN 1.735 10.025 8.290 -0.000 0.000 0.558 326 T N -2.534 112.035 114.554 0.026 0.000 2.618 326 T HA 0.613 4.962 4.350 -0.002 0.000 0.286 326 T C -0.542 174.183 174.700 0.042 0.000 1.027 326 T CA 0.428 62.552 62.100 0.040 0.000 1.063 326 T CB 1.171 70.056 68.868 0.029 0.000 1.440 326 T HN 1.389 9.629 8.240 -0.000 0.000 0.505 327 S N -0.416 115.304 115.700 0.034 0.000 2.755 327 S HA 0.425 4.894 4.470 -0.002 0.000 0.286 327 S C -0.530 174.034 174.600 -0.061 0.000 1.207 327 S CA -0.546 57.668 58.200 0.022 0.000 0.892 327 S CB 0.512 63.749 63.200 0.062 0.000 1.240 327 S HN 0.549 8.859 8.310 -0.000 0.000 0.525 328 D N 0.837 121.240 120.400 0.004 0.000 2.371 328 D HA 0.159 4.798 4.640 -0.002 0.000 0.221 328 D C 1.853 178.107 176.300 -0.075 0.000 0.986 328 D CA 1.158 55.181 54.000 0.039 0.000 0.899 328 D CB -0.799 40.114 40.800 0.187 0.000 0.902 328 D HN 0.704 9.074 8.370 -0.000 0.000 0.530 329 G N 1.529 110.261 108.800 -0.114 0.000 2.448 329 G HA2 -0.307 3.652 3.960 -0.002 0.000 0.219 329 G HA3 -0.307 3.652 3.960 -0.002 0.000 0.219 329 G C 1.606 176.072 174.900 -0.724 0.000 1.127 329 G CA 0.612 45.579 45.100 -0.222 0.000 0.766 329 G HN 0.389 8.679 8.290 -0.000 0.000 0.552 330 R N -0.998 119.052 120.500 -0.750 0.000 2.152 330 R HA 0.061 4.400 4.340 -0.002 0.000 0.232 330 R C 1.823 177.720 176.300 -0.671 0.000 1.117 330 R CA 1.268 56.795 56.100 -0.956 0.000 0.981 330 R CB -0.513 29.445 30.300 -0.570 0.000 0.870 330 R HN 0.349 8.619 8.270 -0.000 0.000 0.451 331 F N 1.180 120.956 119.950 -0.291 0.000 2.274 331 F HA 0.255 4.781 4.527 -0.002 0.000 0.288 331 F C 2.194 177.866 175.800 -0.214 0.000 1.069 331 F CA -0.054 57.824 58.000 -0.203 0.000 1.343 331 F CB -0.384 38.535 39.000 -0.134 0.000 1.089 331 F HN -0.171 8.129 8.300 -0.000 0.000 0.517 332 I N 0.144 120.702 120.570 -0.020 0.000 2.361 332 I HA -0.257 3.912 4.170 -0.002 0.000 0.251 332 I C 2.282 178.319 176.117 -0.133 0.000 1.133 332 I CA 1.126 62.385 61.300 -0.068 0.000 1.413 332 I CB -0.429 37.540 38.000 -0.051 0.000 1.073 332 I HN 0.009 8.219 8.210 -0.000 0.000 0.424 333 K N 2.065 122.308 120.400 -0.262 0.000 2.281 333 K HA -0.046 4.273 4.320 -0.002 0.000 0.203 333 K C 1.048 177.572 176.600 -0.126 0.000 1.046 333 K CA 0.915 57.069 56.287 -0.221 0.000 0.938 333 K CB -0.243 32.034 32.500 -0.372 0.000 0.737 333 K HN 0.328 8.578 8.250 -0.000 0.000 0.458 337 Q N 1.051 120.794 119.800 -0.095 0.000 2.096 337 Q HA -0.046 4.293 4.340 -0.002 0.000 0.204 337 Q C 0.300 176.266 176.000 -0.057 0.000 0.982 337 Q CA 2.537 58.285 55.803 -0.092 0.000 0.850 337 Q CB 0.117 28.760 28.738 -0.159 0.000 0.901 337 Q HN 0.778 9.048 8.270 -0.000 0.000 0.422 338 E N -0.715 119.451 120.200 -0.057 0.000 2.292 338 E HA 0.559 4.908 4.350 -0.002 0.000 0.272 338 E C -1.695 174.939 176.600 0.057 0.000 0.881 338 E CA -0.588 55.830 56.400 0.030 0.000 0.754 338 E CB 2.234 32.010 29.700 0.127 0.000 1.201 338 E HN 0.166 8.526 8.360 -0.000 0.000 0.425 339 L N 4.530 125.791 121.223 0.064 0.000 2.482 339 L HA 0.622 4.961 4.340 -0.002 0.000 0.263 339 L C -1.585 175.326 176.870 0.069 0.000 0.957 339 L CA -0.545 54.332 54.840 0.062 0.000 0.836 339 L CB 1.344 43.431 42.059 0.046 0.000 1.324 339 L HN 0.680 8.910 8.230 -0.000 0.000 0.406 340 I N -0.079 120.520 120.570 0.048 0.000 3.145 340 I HA 0.660 4.830 4.170 -0.002 0.000 0.313 340 I C -1.280 174.851 176.117 0.023 0.000 1.122 340 I CA -0.754 60.567 61.300 0.035 0.000 0.987 340 I CB 2.477 40.496 38.000 0.032 0.000 1.236 340 I HN 0.567 8.777 8.210 -0.000 0.000 0.453 341 E N 2.378 122.592 120.200 0.024 0.000 2.222 341 E HA 0.680 5.029 4.350 -0.002 0.000 0.267 341 E C -1.660 174.971 176.600 0.051 0.000 0.884 341 E CA -0.813 55.599 56.400 0.020 0.000 0.764 341 E CB 3.068 32.782 29.700 0.022 0.000 1.169 341 E HN 0.457 8.817 8.360 -0.000 0.000 0.413 342 L N 1.771 123.053 121.223 0.099 0.000 2.580 342 L HA 0.721 5.061 4.340 -0.002 0.000 0.266 342 L C -0.868 176.131 176.870 0.216 0.000 0.955 342 L CA 0.108 55.041 54.840 0.155 0.000 0.886 342 L CB 1.604 43.799 42.059 0.226 0.000 1.263 342 L HN 0.662 8.892 8.230 -0.000 0.000 0.406 343 G N 4.124 112.993 108.800 0.116 0.000 2.619 343 G HA2 0.676 4.635 3.960 -0.002 0.000 0.305 343 G HA3 0.676 4.635 3.960 -0.002 0.000 0.305 343 G C -3.384 171.535 174.900 0.031 0.000 1.330 343 G CA -0.699 44.466 45.100 0.108 0.000 0.789 343 G HN 0.429 8.719 8.290 -0.000 0.000 0.487 344 P HA 0.317 4.737 4.420 -0.000 0.000 0.289 344 P C 0.372 177.667 177.300 -0.008 0.000 1.299 344 P CA -0.188 62.906 63.100 -0.009 0.000 0.766 344 P CB 0.837 32.528 31.700 -0.015 0.000 1.226 345 S N 0.522 116.210 115.700 -0.020 0.000 2.563 345 S HA -0.054 4.416 4.470 -0.002 0.000 0.294 345 S C 1.208 175.794 174.600 -0.023 0.000 1.279 345 S CA -0.161 58.026 58.200 -0.023 0.000 1.069 345 S CB -0.907 62.274 63.200 -0.032 0.000 0.828 345 S HN 0.521 8.831 8.310 -0.000 0.000 0.497 346 N N 4.219 122.903 118.700 -0.026 0.000 2.270 346 N HA 0.153 4.892 4.740 -0.002 0.000 0.198 346 N C 1.356 176.836 175.510 -0.050 0.000 1.117 346 N CA 0.527 53.554 53.050 -0.038 0.000 0.845 346 N CB -0.565 37.896 38.487 -0.044 0.000 0.980 346 N HN 0.530 8.910 8.380 -0.000 0.000 0.486 347 A N 0.901 123.697 122.820 -0.040 0.000 1.958 347 A HA -0.190 4.129 4.320 -0.002 0.000 0.221 347 A C 2.077 179.635 177.584 -0.044 0.000 1.178 347 A CA 2.315 54.328 52.037 -0.040 0.000 0.642 347 A CB -1.159 17.821 19.000 -0.034 0.000 0.816 347 A HN 0.567 8.717 8.150 -0.000 0.000 0.453 348 T N -1.843 112.685 114.554 -0.043 0.000 3.134 348 T HA 0.433 4.782 4.350 -0.002 0.000 0.260 348 T C 0.540 175.226 174.700 -0.023 0.000 1.027 348 T CA 0.047 62.125 62.100 -0.038 0.000 0.913 348 T CB -1.049 67.796 68.868 -0.038 0.000 1.046 348 T HN 0.617 8.857 8.240 -0.000 0.000 0.553 349 I N 0.074 120.609 120.570 -0.059 0.000 2.752 349 I HA 0.201 4.370 4.170 -0.002 0.000 0.287 349 I C 0.573 176.666 176.117 -0.040 0.000 1.188 349 I CA -0.070 61.177 61.300 -0.089 0.000 1.427 349 I CB -0.514 37.326 38.000 -0.267 0.000 1.365 349 I HN 0.531 8.741 8.210 -0.000 0.000 0.585 350 H N 1.403 120.520 119.070 0.079 0.000 2.861 350 H HA -0.184 4.371 4.556 -0.002 0.000 0.289 350 H C -0.355 175.001 175.328 0.047 0.000 1.176 350 H CA 0.605 56.702 56.048 0.080 0.000 1.146 350 H CB -1.502 28.299 29.762 0.064 0.000 1.330 350 H HN 0.785 9.065 8.280 -0.000 0.000 0.379 351 Q N 0.176 120.040 119.800 0.108 0.000 2.445 351 Q HA 0.504 4.843 4.340 -0.002 0.000 0.281 351 Q C 0.213 176.088 176.000 -0.209 0.000 1.101 351 Q CA -1.355 54.432 55.803 -0.027 0.000 0.833 351 Q CB 1.998 30.696 28.738 -0.066 0.000 1.416 351 Q HN 0.235 8.505 8.270 -0.000 0.000 0.451 352 I N -0.723 119.598 120.570 -0.415 0.000 2.754 352 I HA 0.087 4.256 4.170 -0.002 0.000 0.285 352 I C 0.106 175.572 176.117 -1.085 0.000 1.166 352 I CA -0.285 60.333 61.300 -1.137 0.000 1.417 352 I CB 0.020 37.492 38.000 -0.879 0.000 1.382 352 I HN 0.598 8.808 8.210 -0.000 0.000 0.588 353 N N 0.683 118.441 118.700 -1.571 0.000 2.741 353 N HA -0.243 4.496 4.740 -0.002 0.000 0.250 353 N C 0.070 175.592 175.510 0.020 0.000 1.115 353 N CA 1.126 53.945 53.050 -0.385 0.000 0.724 353 N CB -1.297 37.093 38.487 -0.162 0.000 1.090 353 N HN 0.987 9.367 8.380 -0.000 0.000 0.558 354 E N 1.219 121.398 120.200 -0.035 0.000 2.534 354 E HA 0.028 4.377 4.350 -0.002 0.000 0.264 354 E C 0.334 176.981 176.600 0.078 0.000 0.981 354 E CA 0.412 56.862 56.400 0.084 0.000 0.948 354 E CB 0.360 30.181 29.700 0.201 0.000 0.934 354 E HN 0.551 8.911 8.360 -0.000 0.000 0.459 355 N N 1.174 119.825 118.700 -0.082 0.000 2.927 355 N HA 0.452 5.191 4.740 -0.002 0.000 0.248 355 N C -1.940 173.466 175.510 -0.173 0.000 1.443 355 N CA -0.941 51.956 53.050 -0.255 0.000 0.870 355 N CB 1.886 39.899 38.487 -0.790 0.000 1.444 355 N HN 0.236 8.616 8.380 -0.000 0.000 0.519 356 V N -0.039 119.770 119.914 -0.175 0.000 2.709 356 V HA 0.533 4.653 4.120 -0.002 0.000 0.308 356 V C -0.472 175.548 176.094 -0.125 0.000 1.062 356 V CA -0.822 61.412 62.300 -0.110 0.000 0.901 356 V CB 1.673 33.464 31.823 -0.055 0.000 1.003 356 V HN 0.731 8.921 8.190 -0.000 0.000 0.425 357 R N 4.139 124.583 120.500 -0.094 0.000 2.570 357 R HA 0.182 4.521 4.340 -0.002 0.000 0.277 357 R C 1.075 177.342 176.300 -0.055 0.000 1.039 357 R CA -0.019 56.036 56.100 -0.074 0.000 1.065 357 R CB 0.559 30.827 30.300 -0.053 0.000 0.964 357 R HN 0.735 9.005 8.270 -0.000 0.000 0.428 358 L N 2.541 123.738 121.223 -0.042 0.000 2.046 358 L HA -0.251 4.088 4.340 -0.002 0.000 0.208 358 L C 1.702 178.558 176.870 -0.023 0.000 1.077 358 L CA 1.233 56.057 54.840 -0.025 0.000 0.747 358 L CB -0.312 41.741 42.059 -0.010 0.000 0.896 358 L HN 0.614 8.844 8.230 -0.000 0.000 0.432 359 N N -0.194 118.492 118.700 -0.023 0.000 2.309 359 N HA -0.161 4.578 4.740 -0.002 0.000 0.182 359 N C 1.369 176.860 175.510 -0.031 0.000 1.018 359 N CA 1.017 54.053 53.050 -0.023 0.000 0.876 359 N CB -0.321 38.155 38.487 -0.019 0.000 0.972 359 N HN 0.258 8.638 8.380 -0.000 0.000 0.434 360 D N 0.687 121.064 120.400 -0.038 0.000 2.218 360 D HA -0.036 4.603 4.640 -0.002 0.000 0.204 360 D C 1.966 178.232 176.300 -0.056 0.000 0.976 360 D CA 0.240 54.212 54.000 -0.048 0.000 0.853 360 D CB -0.064 40.706 40.800 -0.049 0.000 0.939 360 D HN 0.310 8.680 8.370 -0.000 0.000 0.481 361 I N 1.644 122.187 120.570 -0.045 0.000 2.052 361 I HA -0.237 3.932 4.170 -0.002 0.000 0.235 361 I C -0.539 175.547 176.117 -0.052 0.000 1.046 361 I CA 1.345 62.619 61.300 -0.043 0.000 1.308 361 I CB -1.678 36.307 38.000 -0.025 0.000 1.031 361 I HN 0.049 8.259 8.210 -0.000 0.000 0.395 362 P HA -0.175 4.245 4.420 -0.000 0.000 0.218 362 P C 1.299 178.566 177.300 -0.054 0.000 1.148 362 P CA 1.681 64.757 63.100 -0.039 0.000 0.822 362 P CB -0.130 31.555 31.700 -0.026 0.000 0.784 363 K N -0.850 119.514 120.400 -0.060 0.000 2.097 363 K HA -0.104 4.215 4.320 -0.002 0.000 0.205 363 K C 2.090 178.618 176.600 -0.120 0.000 1.050 363 K CA 0.781 57.026 56.287 -0.070 0.000 0.938 363 K CB -0.690 31.774 32.500 -0.059 0.000 0.718 363 K HN 0.055 8.305 8.250 -0.000 0.000 0.442 364 L N 0.680 121.804 121.223 -0.165 0.000 2.056 364 L HA -0.109 4.230 4.340 -0.002 0.000 0.207 364 L C 2.256 178.879 176.870 -0.412 0.000 1.078 364 L CA 1.717 56.362 54.840 -0.326 0.000 0.749 364 L CB -0.742 41.127 42.059 -0.316 0.000 0.901 364 L HN 0.016 8.246 8.230 -0.000 0.000 0.433 365 S N -0.886 114.695 115.700 -0.198 0.000 2.383 365 S HA -0.108 4.361 4.470 -0.002 0.000 0.227 365 S C 2.121 176.695 174.600 -0.044 0.000 1.026 365 S CA 1.064 59.214 58.200 -0.082 0.000 0.981 365 S CB -0.379 62.801 63.200 -0.033 0.000 0.818 365 S HN 0.648 8.958 8.310 -0.000 0.000 0.472 366 A N 0.631 123.416 122.820 -0.058 0.000 1.930 366 A HA 0.033 4.352 4.320 -0.002 0.000 0.217 366 A C 2.288 179.864 177.584 -0.014 0.000 1.175 366 A CA 1.533 53.556 52.037 -0.023 0.000 0.627 366 A CB -0.876 18.109 19.000 -0.024 0.000 0.815 366 A HN 0.430 8.580 8.150 -0.000 0.000 0.443 367 V N -1.064 118.814 119.914 -0.060 0.000 2.295 367 V HA -0.263 3.856 4.120 -0.002 0.000 0.246 367 V C 2.422 178.572 176.094 0.093 0.000 1.049 367 V CA 1.899 64.184 62.300 -0.026 0.000 1.024 367 V CB -1.008 30.760 31.823 -0.092 0.000 0.648 367 V HN 0.633 8.823 8.190 -0.000 0.000 0.447 368 Y N 0.579 120.905 120.300 0.042 0.000 2.165 368 Y HA -0.220 4.329 4.550 -0.002 0.000 0.286 368 Y C 2.632 178.519 175.900 -0.022 0.000 1.155 368 Y CA 1.404 59.554 58.100 0.082 0.000 1.164 368 Y CB -0.820 37.746 38.460 0.176 0.000 0.978 368 Y HN 0.392 8.672 8.280 -0.000 0.000 0.513 369 E N -0.392 119.869 120.200 0.101 0.000 2.077 369 E HA -0.148 4.201 4.350 -0.002 0.000 0.193 369 E C 2.519 179.105 176.600 -0.024 0.000 0.989 369 E CA 1.016 57.413 56.400 -0.005 0.000 0.800 369 E CB -0.469 29.255 29.700 0.040 0.000 0.746 369 E HN 0.482 8.842 8.360 -0.000 0.000 0.452 370 G N 1.093 109.901 108.800 0.014 0.000 2.432 370 G HA2 -0.223 3.736 3.960 -0.002 0.000 0.219 370 G HA3 -0.223 3.736 3.960 -0.002 0.000 0.219 370 G C 1.558 176.435 174.900 -0.039 0.000 1.135 370 G CA 0.707 45.807 45.100 0.000 0.000 0.767 370 G HN 0.241 8.531 8.290 -0.000 0.000 0.550 371 I N 0.081 120.639 120.570 -0.021 0.000 2.286 371 I HA -0.058 4.111 4.170 -0.002 0.000 0.245 371 I C 2.638 178.654 176.117 -0.168 0.000 1.104 371 I CA 0.502 61.772 61.300 -0.051 0.000 1.397 371 I CB -0.143 37.884 38.000 0.045 0.000 1.072 371 I HN 0.121 8.331 8.210 -0.000 0.000 0.417 372 L N -0.171 120.883 121.223 -0.282 0.000 2.046 372 L HA -0.186 4.154 4.340 -0.002 0.000 0.208 372 L C 2.601 179.079 176.870 -0.654 0.000 1.077 372 L CA 0.951 55.420 54.840 -0.618 0.000 0.747 372 L CB -0.654 40.725 42.059 -1.134 0.000 0.896 372 L HN 0.052 8.282 8.230 -0.000 0.000 0.432 373 V N 0.045 119.699 119.914 -0.433 0.000 2.282 373 V HA -0.342 3.777 4.120 -0.002 0.000 0.249 373 V C 2.621 178.645 176.094 -0.116 0.000 1.057 373 V CA 1.994 64.208 62.300 -0.144 0.000 1.032 373 V CB -0.640 31.168 31.823 -0.026 0.000 0.645 373 V HN 0.425 8.615 8.190 -0.000 0.000 0.447 374 R N -0.725 119.702 120.500 -0.122 0.000 2.115 374 R HA 0.024 4.363 4.340 -0.002 0.000 0.226 374 R C 2.138 178.358 176.300 -0.132 0.000 1.100 374 R CA 1.079 57.119 56.100 -0.100 0.000 0.980 374 R CB -0.189 30.058 30.300 -0.088 0.000 0.875 374 R HN 0.440 8.710 8.270 -0.000 0.000 0.445 375 L N -0.152 120.957 121.223 -0.190 0.000 2.298 375 L HA 0.080 4.419 4.340 -0.002 0.000 0.209 375 L C 0.352 177.167 176.870 -0.092 0.000 1.084 375 L CA 0.109 54.818 54.840 -0.219 0.000 0.816 375 L CB 0.041 41.907 42.059 -0.322 0.000 0.967 375 L HN 0.032 8.262 8.230 -0.000 0.000 0.460 376 L N 0.000 121.174 121.223 -0.082 0.000 2.949 376 L HA 0.000 4.339 4.340 -0.002 0.000 0.249 376 L CA 0.000 54.868 54.840 0.046 0.000 0.813 376 L CB 0.000 42.081 42.059 0.036 0.000 0.961 376 L HN 0.000 8.230 8.230 -0.000 0.000 0.502