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 4uag_1_A DATA FIRST_RESID 1 DATA SEQUENCE ADYQGKNVVI IGLGLTGLSC VDFFLARGVT PRVMDTRMTP PGLDKLPEAV DATA SEQUENCE ERHTGSLNDE WLMAADLIVA SPGIALAHPS LSAAADAGIE IVGDIELFCR DATA SEQUENCE EAQAPIVAIT GSNGKSTVTT LVGEMAKAAG VNVGVGGNIG LPALMLLDDE DATA SEQUENCE CELYVLELSS FQLETTSSLQ AVAATILNVT EDHMDRYPFG LQQYRAAXLR DATA SEQUENCE IYENAKVCVV NADDALTMPI XXXXXRCVSF GVNMGDYHLN HXXXETWLRV DATA SEQUENCE KGEKVLNVKE MKLSGQHNYT NALAALALAD AAGLPRASSL KALTTFTGLP DATA SEQUENCE HRFEVVLEHN GVRWINDSKA TNVGSTEAAL NGLHVDGTLH LLLGGDGKSA DATA SEQUENCE DFSPLARYLN GDNVRLYCFG RDGAQLAALR PEVAEQTETM EQAMRLLAPR DATA SEQUENCE VQPGDMVLLS PACASLDQFK NFEQRGNEFA RLAKELG VARS RESID RESNAME ATOMNAME SS_SHIFT SHIFT RC_SHIFT HM_SHIFT EF_SHIFT SIGMA FORMAT %4d %4s %4s %9.3f %9.3f %9.3f %9.3f %9.3f %9.3f 1 A HA 0.000 4.320 4.320 -0.000 0.000 0.244 1 A C 0.000 177.278 177.584 -0.510 0.000 1.274 1 A CA 0.000 51.841 52.037 -0.326 0.000 0.836 1 A CB 0.000 18.738 19.000 -0.437 0.000 0.831 2 D N -0.697 119.395 120.400 -0.515 0.000 2.425 2 D HA 0.640 5.285 4.640 0.008 0.000 0.240 2 D C -0.805 175.262 176.300 -0.388 0.000 1.080 2 D CA 0.006 53.779 54.000 -0.378 0.000 0.836 2 D CB 0.682 41.382 40.800 -0.166 0.000 1.125 2 D HN 0.353 8.723 8.370 -0.000 0.000 0.525 3 Y N 1.119 121.477 120.300 0.096 0.000 2.507 3 Y HA 0.218 4.773 4.550 0.008 0.000 0.254 3 Y C 1.098 177.048 175.900 0.084 0.000 1.171 3 Y CA -0.375 57.810 58.100 0.142 0.000 1.238 3 Y CB 0.048 38.705 38.460 0.328 0.000 1.148 3 Y HN 0.271 8.551 8.280 -0.000 0.000 0.525 4 Q N 0.981 120.858 119.800 0.128 0.000 2.269 4 Q HA 0.089 4.434 4.340 0.008 0.000 0.300 4 Q C 1.235 177.270 176.000 0.059 0.000 1.070 4 Q CA 1.447 57.297 55.803 0.078 0.000 0.957 4 Q CB 0.564 29.320 28.738 0.030 0.000 1.131 4 Q HN 0.798 9.068 8.270 -0.000 0.000 0.377 5 G N 3.493 112.321 108.800 0.046 0.000 2.162 5 G HA2 -0.283 3.682 3.960 0.008 0.000 0.260 5 G HA3 -0.283 3.682 3.960 0.008 0.000 0.260 5 G C 0.085 174.994 174.900 0.015 0.000 0.976 5 G CA 0.323 45.435 45.100 0.020 0.000 0.655 5 G HN 0.499 8.789 8.290 -0.000 0.000 0.533 6 K N 0.181 120.604 120.400 0.039 0.000 2.144 6 K HA 0.243 4.568 4.320 0.008 0.000 0.270 6 K C 0.143 176.715 176.600 -0.047 0.000 1.005 6 K CA -0.553 55.746 56.287 0.020 0.000 0.932 6 K CB 0.870 33.421 32.500 0.086 0.000 1.021 6 K HN 0.248 8.498 8.250 -0.000 0.000 0.462 7 N N 1.992 120.651 118.700 -0.068 0.000 2.402 7 N HA 0.070 4.815 4.740 0.008 0.000 0.259 7 N C -1.204 174.209 175.510 -0.163 0.000 1.167 7 N CA -0.352 52.626 53.050 -0.121 0.000 0.949 7 N CB 0.451 38.878 38.487 -0.099 0.000 1.212 7 N HN 0.130 8.510 8.380 -0.000 0.000 0.493 8 V N 4.071 123.832 119.914 -0.254 0.000 2.398 8 V HA 0.349 4.474 4.120 0.008 0.000 0.286 8 V C -0.096 175.801 176.094 -0.329 0.000 1.026 8 V CA -0.702 61.373 62.300 -0.374 0.000 0.868 8 V CB 1.532 32.901 31.823 -0.757 0.000 0.982 8 V HN 0.274 8.464 8.190 -0.000 0.000 0.443 9 V N 6.668 126.441 119.914 -0.234 0.000 2.487 9 V HA 0.522 4.647 4.120 0.008 0.000 0.298 9 V C -0.260 175.779 176.094 -0.092 0.000 1.028 9 V CA -0.417 61.802 62.300 -0.136 0.000 0.860 9 V CB 1.880 33.675 31.823 -0.046 0.000 0.991 9 V HN 0.684 8.874 8.190 -0.000 0.000 0.427 10 I N 5.666 126.209 120.570 -0.046 0.000 2.377 10 I HA 0.485 4.660 4.170 0.008 0.000 0.293 10 I C -0.458 175.681 176.117 0.035 0.000 0.987 10 I CA -0.401 60.899 61.300 -0.000 0.000 1.185 10 I CB 1.756 39.774 38.000 0.030 0.000 1.341 10 I HN 0.424 8.634 8.210 -0.000 0.000 0.455 11 I N 5.554 126.135 120.570 0.019 0.000 2.312 11 I HA 0.638 4.813 4.170 0.008 0.000 0.290 11 I C 0.349 176.472 176.117 0.011 0.000 1.008 11 I CA -0.289 61.017 61.300 0.010 0.000 1.226 11 I CB 1.279 39.262 38.000 -0.030 0.000 1.371 11 I HN 0.806 9.016 8.210 -0.000 0.000 0.468 12 G N 5.721 114.534 108.800 0.023 0.000 3.326 12 G HA2 -0.064 3.901 3.960 0.008 0.000 0.681 12 G HA3 -0.064 3.901 3.960 0.008 0.000 0.681 12 G C -0.894 174.028 174.900 0.036 0.000 1.255 12 G CA -0.954 44.158 45.100 0.021 0.000 0.976 12 G HN 0.550 8.840 8.290 -0.000 0.000 0.563 13 L N 2.737 123.981 121.223 0.035 0.000 3.108 13 L HA 0.449 4.794 4.340 0.008 0.000 0.251 13 L C 1.520 178.409 176.870 0.032 0.000 1.315 13 L CA 0.305 55.169 54.840 0.039 0.000 1.048 13 L CB 0.072 42.156 42.059 0.041 0.000 1.432 13 L HN 0.796 9.026 8.230 -0.000 0.000 0.543 14 G N -0.647 108.171 108.800 0.031 0.000 2.714 14 G HA2 0.252 4.217 3.960 0.008 0.000 0.197 14 G HA3 0.252 4.217 3.960 0.008 0.000 0.197 14 G C 0.897 175.816 174.900 0.031 0.000 1.449 14 G CA -0.482 44.636 45.100 0.029 0.000 1.065 14 G HN 0.092 8.382 8.290 -0.000 0.000 0.575 15 L N -0.435 120.805 121.223 0.029 0.000 2.027 15 L HA -0.068 4.277 4.340 0.008 0.000 0.206 15 L C 3.216 180.101 176.870 0.026 0.000 1.074 15 L CA 1.615 56.471 54.840 0.027 0.000 0.745 15 L CB -0.846 41.228 42.059 0.024 0.000 0.898 15 L HN 0.449 8.679 8.230 -0.000 0.000 0.433 16 T N -0.126 114.442 114.554 0.023 0.000 2.708 16 T HA -0.128 4.227 4.350 0.008 0.000 0.266 16 T C 1.868 176.584 174.700 0.027 0.000 1.037 16 T CA 1.433 63.543 62.100 0.016 0.000 1.146 16 T CB -0.622 68.254 68.868 0.013 0.000 0.865 16 T HN 0.549 8.789 8.240 -0.000 0.000 0.435 17 G N 1.245 110.067 108.800 0.036 0.000 2.418 17 G HA2 -0.115 3.850 3.960 0.008 0.000 0.217 17 G HA3 -0.115 3.850 3.960 0.008 0.000 0.217 17 G C 1.517 176.457 174.900 0.067 0.000 1.158 17 G CA 0.424 45.555 45.100 0.052 0.000 0.771 17 G HN 0.432 8.722 8.290 -0.000 0.000 0.545 18 L N 1.453 122.710 121.223 0.057 0.000 2.083 18 L HA -0.109 4.236 4.340 0.008 0.000 0.209 18 L C 3.316 180.229 176.870 0.072 0.000 1.083 18 L CA 1.510 56.388 54.840 0.062 0.000 0.752 18 L CB -0.396 41.692 42.059 0.049 0.000 0.899 18 L HN 0.455 8.685 8.230 -0.000 0.000 0.433 19 S N -1.346 114.389 115.700 0.059 0.000 2.402 19 S HA -0.177 4.298 4.470 0.008 0.000 0.229 19 S C 2.050 176.703 174.600 0.088 0.000 1.021 19 S CA 1.082 59.320 58.200 0.063 0.000 0.974 19 S CB -0.834 62.385 63.200 0.032 0.000 0.800 19 S HN 0.441 8.751 8.310 -0.000 0.000 0.484 20 C N 1.012 120.365 119.300 0.088 0.000 2.457 20 C HA 0.137 4.602 4.460 0.008 0.000 0.278 20 C C 2.764 177.941 174.990 0.311 0.000 1.309 20 C CA 0.403 59.511 59.018 0.150 0.000 1.735 20 C CB -1.342 26.495 27.740 0.162 0.000 1.992 20 C HN 0.527 8.757 8.230 -0.000 0.000 0.493 21 V N 1.517 121.565 119.914 0.224 0.000 2.287 21 V HA -0.233 3.892 4.120 0.008 0.000 0.248 21 V C 2.112 178.323 176.094 0.194 0.000 1.053 21 V CA 2.337 64.763 62.300 0.209 0.000 1.027 21 V CB -0.666 31.231 31.823 0.122 0.000 0.646 21 V HN 0.477 8.667 8.190 -0.000 0.000 0.447 22 D N -0.721 119.768 120.400 0.148 0.000 2.117 22 D HA -0.163 4.482 4.640 0.008 0.000 0.198 22 D C 1.858 178.222 176.300 0.108 0.000 0.982 22 D CA 1.193 55.260 54.000 0.111 0.000 0.828 22 D CB -0.361 40.492 40.800 0.089 0.000 0.967 22 D HN 0.462 8.832 8.370 -0.000 0.000 0.464 23 F N 0.467 120.385 119.950 -0.054 0.000 2.095 23 F HA -0.243 4.289 4.527 0.008 0.000 0.298 23 F C 1.939 177.591 175.800 -0.246 0.000 1.104 23 F CA 1.421 59.306 58.000 -0.191 0.000 1.232 23 F CB -0.294 38.503 39.000 -0.339 0.000 0.987 23 F HN -0.153 8.147 8.300 -0.000 0.000 0.475 24 F N 0.243 120.244 119.950 0.085 0.000 2.163 24 F HA -0.064 4.468 4.527 0.008 0.000 0.297 24 F C 2.174 177.931 175.800 -0.071 0.000 1.094 24 F CA 1.091 59.066 58.000 -0.041 0.000 1.290 24 F CB -0.875 38.141 39.000 0.026 0.000 1.017 24 F HN -0.084 8.216 8.300 -0.000 0.000 0.483 25 L N -0.462 120.843 121.223 0.137 0.000 2.083 25 L HA -0.212 4.133 4.340 0.008 0.000 0.209 25 L C 2.599 179.470 176.870 0.002 0.000 1.083 25 L CA 1.179 56.057 54.840 0.063 0.000 0.752 25 L CB -1.015 41.080 42.059 0.058 0.000 0.899 25 L HN 0.125 8.355 8.230 -0.000 0.000 0.433 26 A N -0.176 122.616 122.820 -0.047 0.000 2.121 26 A HA -0.128 4.197 4.320 0.008 0.000 0.218 26 A C 2.131 179.649 177.584 -0.110 0.000 1.154 26 A CA 1.130 53.119 52.037 -0.080 0.000 0.679 26 A CB -0.363 18.575 19.000 -0.104 0.000 0.795 26 A HN 0.383 8.533 8.150 -0.000 0.000 0.458 27 R N -1.594 118.828 120.500 -0.130 0.000 2.468 27 R HA 0.283 4.628 4.340 0.008 0.000 0.280 27 R C 0.920 177.212 176.300 -0.013 0.000 0.963 27 R CA 0.447 56.482 56.100 -0.109 0.000 1.083 27 R CB 0.246 30.428 30.300 -0.197 0.000 1.200 27 R HN 0.566 8.836 8.270 -0.000 0.000 0.541 28 G N 0.983 109.784 108.800 0.002 0.000 2.182 28 G HA2 -0.229 3.736 3.960 0.008 0.000 0.248 28 G HA3 -0.229 3.736 3.960 0.008 0.000 0.248 28 G C -0.218 174.710 174.900 0.046 0.000 1.042 28 G CA 0.062 45.174 45.100 0.019 0.000 0.775 28 G HN 0.146 8.436 8.290 -0.000 0.000 0.501 29 V N 0.616 120.579 119.914 0.082 0.000 2.483 29 V HA 0.561 4.686 4.120 0.008 0.000 0.297 29 V C 0.340 176.471 176.094 0.061 0.000 1.027 29 V CA -0.354 62.001 62.300 0.090 0.000 0.855 29 V CB 1.975 33.915 31.823 0.195 0.000 0.995 29 V HN 0.310 8.500 8.190 -0.000 0.000 0.424 30 T N 7.561 122.112 114.554 -0.005 0.000 2.747 30 T HA 0.369 4.724 4.350 0.008 0.000 0.301 30 T C -2.063 172.575 174.700 -0.104 0.000 0.952 30 T CA -0.761 61.320 62.100 -0.031 0.000 0.983 30 T CB 0.959 69.802 68.868 -0.042 0.000 0.930 30 T HN 0.532 8.772 8.240 -0.000 0.000 0.494 31 P HA 0.402 4.822 4.420 -0.000 0.000 0.276 31 P C -0.429 176.752 177.300 -0.199 0.000 1.261 31 P CA -0.832 62.138 63.100 -0.218 0.000 0.800 31 P CB 1.295 32.866 31.700 -0.215 0.000 1.066 32 R N -0.336 120.002 120.500 -0.270 0.000 2.604 32 R HA 0.666 5.011 4.340 0.008 0.000 0.287 32 R C -0.822 175.445 176.300 -0.054 0.000 0.970 32 R CA -1.065 54.851 56.100 -0.306 0.000 0.946 32 R CB 1.882 31.676 30.300 -0.843 0.000 1.127 32 R HN 0.268 8.538 8.270 -0.000 0.000 0.473 33 V N 4.726 124.723 119.914 0.139 0.000 2.656 33 V HA 0.613 4.738 4.120 0.008 0.000 0.307 33 V C -0.799 175.492 176.094 0.327 0.000 1.051 33 V CA -0.653 61.761 62.300 0.190 0.000 0.893 33 V CB 1.827 33.721 31.823 0.118 0.000 0.999 33 V HN 0.800 8.990 8.190 -0.000 0.000 0.426 34 M N 4.105 123.843 119.600 0.230 0.000 2.658 34 M HA 0.779 5.264 4.480 0.008 0.000 0.295 34 M C -1.721 174.635 176.300 0.094 0.000 1.248 34 M CA -0.579 54.832 55.300 0.185 0.000 0.843 34 M CB 2.561 35.241 32.600 0.134 0.000 1.749 34 M HN 0.558 8.848 8.290 -0.000 0.000 0.464 35 D N 0.416 120.861 120.400 0.074 0.000 2.886 35 D HA 0.176 4.821 4.640 0.008 0.000 0.216 35 D C 0.185 176.494 176.300 0.015 0.000 1.256 35 D CA 0.041 54.057 54.000 0.027 0.000 0.844 35 D CB 2.602 43.415 40.800 0.023 0.000 1.669 35 D HN 0.904 9.274 8.370 -0.000 0.000 0.513 36 T N 0.402 114.954 114.554 -0.005 0.000 3.035 36 T HA 0.052 4.407 4.350 0.008 0.000 0.268 36 T C 0.964 175.661 174.700 -0.006 0.000 1.109 36 T CA 0.420 62.519 62.100 -0.001 0.000 1.119 36 T CB 0.062 68.933 68.868 0.005 0.000 0.900 36 T HN 0.202 8.442 8.240 -0.000 0.000 0.503 37 R N 0.686 121.182 120.500 -0.008 0.000 2.491 37 R HA 0.317 4.662 4.340 0.008 0.000 0.283 37 R C 1.624 177.909 176.300 -0.026 0.000 1.072 37 R CA -0.293 55.800 56.100 -0.011 0.000 1.048 37 R CB 0.460 30.758 30.300 -0.003 0.000 0.983 37 R HN 0.222 8.492 8.270 -0.000 0.000 0.450 38 M N 0.866 120.448 119.600 -0.030 0.000 2.117 38 M HA -0.088 4.397 4.480 0.008 0.000 0.262 38 M C 0.339 176.615 176.300 -0.040 0.000 1.065 38 M CA 1.703 56.975 55.300 -0.046 0.000 1.114 38 M CB 0.035 32.612 32.600 -0.039 0.000 1.361 38 M HN 0.520 8.810 8.290 -0.000 0.000 0.408 39 T N 1.994 116.534 114.554 -0.024 0.000 3.410 39 T HA 0.315 4.670 4.350 0.008 0.000 0.328 39 T C -2.343 172.353 174.700 -0.007 0.000 1.567 39 T CA -1.061 61.029 62.100 -0.016 0.000 1.626 39 T CB 0.656 69.516 68.868 -0.014 0.000 0.939 39 T HN 0.164 8.404 8.240 -0.000 0.000 0.656 40 P HA 0.181 4.601 4.420 -0.000 0.000 0.269 40 P C -1.881 175.425 177.300 0.010 0.000 1.215 40 P CA -1.070 62.033 63.100 0.006 0.000 0.780 40 P CB 0.923 32.629 31.700 0.010 0.000 0.898 41 P HA -0.094 4.326 4.420 -0.000 0.000 0.219 41 P C 1.380 178.691 177.300 0.017 0.000 1.150 41 P CA 1.457 64.566 63.100 0.014 0.000 0.814 41 P CB -0.397 31.313 31.700 0.016 0.000 0.787 42 G N -0.306 108.507 108.800 0.021 0.000 2.920 42 G HA2 -0.019 3.946 3.960 0.008 0.000 0.208 42 G HA3 -0.019 3.946 3.960 0.008 0.000 0.208 42 G C 1.481 176.397 174.900 0.027 0.000 1.159 42 G CA -0.248 44.867 45.100 0.025 0.000 0.784 42 G HN 0.180 8.470 8.290 -0.000 0.000 0.535 43 L N 0.358 121.595 121.223 0.023 0.000 2.043 43 L HA -0.167 4.178 4.340 0.008 0.000 0.212 43 L C 2.417 179.300 176.870 0.023 0.000 1.075 43 L CA 1.908 56.762 54.840 0.023 0.000 0.752 43 L CB -0.178 41.890 42.059 0.014 0.000 0.891 43 L HN 0.242 8.472 8.230 -0.000 0.000 0.432 44 D N -0.583 119.828 120.400 0.019 0.000 2.178 44 D HA -0.186 4.459 4.640 0.008 0.000 0.201 44 D C 1.790 178.102 176.300 0.021 0.000 0.980 44 D CA 0.991 55.001 54.000 0.017 0.000 0.842 44 D CB 0.001 40.810 40.800 0.014 0.000 0.948 44 D HN 0.212 8.582 8.370 -0.000 0.000 0.472 45 K N -0.223 120.192 120.400 0.024 0.000 2.393 45 K HA 0.173 4.498 4.320 0.008 0.000 0.193 45 K C 0.011 176.630 176.600 0.033 0.000 1.026 45 K CA -0.249 56.054 56.287 0.027 0.000 1.064 45 K CB 0.245 32.762 32.500 0.027 0.000 0.833 45 K HN 0.067 8.317 8.250 -0.000 0.000 0.521 46 L N 3.228 124.472 121.223 0.035 0.000 2.410 46 L HA 0.165 4.510 4.340 0.008 0.000 0.273 46 L C -2.289 174.604 176.870 0.037 0.000 1.144 46 L CA -2.194 52.671 54.840 0.042 0.000 0.863 46 L CB -0.063 42.025 42.059 0.047 0.000 1.140 46 L HN 0.007 8.237 8.230 -0.000 0.000 0.463 47 P HA -0.034 4.386 4.420 -0.000 0.000 0.267 47 P C 0.229 177.547 177.300 0.031 0.000 1.200 47 P CA 0.025 63.144 63.100 0.032 0.000 0.772 47 P CB 0.586 32.305 31.700 0.033 0.000 0.855 48 E N 1.824 122.040 120.200 0.026 0.000 2.153 48 E HA -0.179 4.176 4.350 0.008 0.000 0.194 48 E C 1.738 178.353 176.600 0.026 0.000 0.988 48 E CA 1.202 57.618 56.400 0.026 0.000 0.811 48 E CB -0.152 29.560 29.700 0.021 0.000 0.746 48 E HN 0.547 8.907 8.360 -0.000 0.000 0.466 49 A N 0.534 123.367 122.820 0.021 0.000 2.119 49 A HA -0.005 4.320 4.320 0.008 0.000 0.217 49 A C 1.051 178.641 177.584 0.011 0.000 1.153 49 A CA 0.302 52.348 52.037 0.014 0.000 0.692 49 A CB 0.187 19.193 19.000 0.010 0.000 0.799 49 A HN 0.055 8.205 8.150 -0.000 0.000 0.458 50 V N 1.886 121.812 119.914 0.020 0.000 2.432 50 V HA 0.102 4.227 4.120 0.008 0.000 0.271 50 V C 0.074 176.190 176.094 0.037 0.000 1.046 50 V CA -0.636 61.672 62.300 0.015 0.000 0.945 50 V CB 0.897 32.738 31.823 0.029 0.000 0.992 50 V HN 0.493 8.683 8.190 -0.000 0.000 0.471 51 E N 5.695 125.902 120.200 0.011 0.000 2.384 51 E HA 0.269 4.624 4.350 0.008 0.000 0.266 51 E C 0.014 176.760 176.600 0.244 0.000 1.012 51 E CA -0.197 56.263 56.400 0.099 0.000 0.901 51 E CB 0.624 30.310 29.700 -0.023 0.000 0.967 51 E HN 0.572 8.932 8.360 -0.000 0.000 0.435 52 R N 2.513 123.238 120.500 0.375 0.000 2.771 52 R HA 0.464 4.809 4.340 0.008 0.000 0.274 52 R C -1.735 174.754 176.300 0.314 0.000 0.987 52 R CA -0.901 55.420 56.100 0.370 0.000 0.908 52 R CB 1.203 31.609 30.300 0.177 0.000 1.213 52 R HN 0.718 8.988 8.270 -0.000 0.000 0.468 53 H N 0.481 119.584 119.070 0.054 0.000 2.782 53 H HA 0.497 5.058 4.556 0.008 0.000 0.347 53 H C -1.228 174.027 175.328 -0.121 0.000 1.038 53 H CA -0.123 55.797 56.048 -0.213 0.000 1.255 53 H CB 1.680 31.019 29.762 -0.706 0.000 1.623 53 H HN 0.977 9.257 8.280 -0.000 0.000 0.525 54 T N 1.319 115.623 114.554 -0.418 0.000 2.930 54 T HA 0.565 4.920 4.350 0.008 0.000 0.290 54 T C 0.983 175.499 174.700 -0.307 0.000 1.052 54 T CA -0.348 61.615 62.100 -0.229 0.000 1.017 54 T CB 1.630 70.422 68.868 -0.127 0.000 1.137 54 T HN 1.150 9.390 8.240 -0.000 0.000 0.511 55 G N 0.361 109.079 108.800 -0.137 0.000 2.217 55 G HA2 0.003 3.968 3.960 0.008 0.000 0.246 55 G HA3 0.003 3.968 3.960 0.008 0.000 0.246 55 G C 0.232 175.107 174.900 -0.041 0.000 0.990 55 G CA 0.550 45.589 45.100 -0.102 0.000 0.627 55 G HN 2.214 10.504 8.290 -0.000 0.000 0.522 56 S N -1.481 114.226 115.700 0.011 0.000 2.643 56 S HA 0.639 5.114 4.470 0.008 0.000 0.266 56 S C -0.788 173.875 174.600 0.106 0.000 1.130 56 S CA -0.880 57.368 58.200 0.080 0.000 0.817 56 S CB 1.252 64.517 63.200 0.109 0.000 1.107 56 S HN 0.868 9.178 8.310 -0.000 0.000 0.471 57 L N 2.062 123.278 121.223 -0.012 0.000 2.350 57 L HA 0.474 4.819 4.340 0.008 0.000 0.275 57 L C 0.162 176.876 176.870 -0.261 0.000 1.099 57 L CA -0.707 54.051 54.840 -0.135 0.000 0.808 57 L CB 0.611 42.536 42.059 -0.224 0.000 1.149 57 L HN 0.740 8.970 8.230 -0.000 0.000 0.442 58 N N 2.176 120.552 118.700 -0.539 0.000 2.462 58 N HA 0.044 4.789 4.740 0.008 0.000 0.242 58 N C 0.206 175.531 175.510 -0.308 0.000 1.010 58 N CA -0.223 52.386 53.050 -0.734 0.000 0.939 58 N CB 1.118 38.697 38.487 -1.514 0.000 1.127 58 N HN 0.502 8.882 8.380 -0.000 0.000 0.509 59 D N 2.691 122.980 120.400 -0.186 0.000 2.219 59 D HA -0.113 4.532 4.640 0.008 0.000 0.205 59 D C 0.963 177.251 176.300 -0.021 0.000 0.970 59 D CA 1.075 55.033 54.000 -0.070 0.000 0.851 59 D CB 0.488 41.264 40.800 -0.040 0.000 0.943 59 D HN 0.697 9.067 8.370 -0.000 0.000 0.488 60 E N -0.111 120.067 120.200 -0.037 0.000 2.077 60 E HA -0.174 4.181 4.350 0.008 0.000 0.193 60 E C 2.000 178.720 176.600 0.199 0.000 0.989 60 E CA 0.747 57.182 56.400 0.059 0.000 0.800 60 E CB -0.075 29.657 29.700 0.053 0.000 0.746 60 E HN 0.353 8.713 8.360 -0.000 0.000 0.452 61 W N 0.911 122.147 121.300 -0.107 0.000 2.409 61 W HA -0.011 4.654 4.660 0.008 0.000 0.299 61 W C 2.067 178.534 176.519 -0.086 0.000 1.203 61 W CA 0.394 57.680 57.345 -0.098 0.000 1.298 61 W CB -0.987 28.398 29.460 -0.126 0.000 1.127 61 W HN 0.063 8.243 8.180 -0.000 0.000 0.528 62 L N -0.380 120.926 121.223 0.140 0.000 2.017 62 L HA -0.245 4.100 4.340 0.008 0.000 0.208 62 L C 2.320 179.212 176.870 0.036 0.000 1.073 62 L CA 1.063 55.937 54.840 0.056 0.000 0.745 62 L CB -0.792 41.275 42.059 0.013 0.000 0.894 62 L HN -0.108 8.122 8.230 -0.000 0.000 0.432 63 M N -0.911 118.712 119.600 0.037 0.000 2.562 63 M HA -0.008 4.477 4.480 0.008 0.000 0.257 63 M C 2.119 178.433 176.300 0.023 0.000 1.099 63 M CA 0.911 56.227 55.300 0.026 0.000 1.099 63 M CB -1.026 31.588 32.600 0.023 0.000 1.427 63 M HN 0.228 8.518 8.290 -0.000 0.000 0.489 64 A N 0.060 122.898 122.820 0.030 0.000 2.195 64 A HA 0.476 4.801 4.320 0.008 0.000 0.210 64 A C 1.281 178.855 177.584 -0.016 0.000 1.165 64 A CA 0.363 52.406 52.037 0.009 0.000 0.806 64 A CB -0.302 18.704 19.000 0.011 0.000 0.847 64 A HN 0.356 8.506 8.150 -0.000 0.000 0.482 65 A N 0.188 122.999 122.820 -0.015 0.000 2.445 65 A HA 0.374 4.699 4.320 0.008 0.000 0.242 65 A C 0.462 178.031 177.584 -0.026 0.000 1.075 65 A CA 0.087 52.100 52.037 -0.039 0.000 0.777 65 A CB 0.238 19.217 19.000 -0.036 0.000 1.013 65 A HN 0.301 8.451 8.150 -0.000 0.000 0.493 66 D N -0.373 120.007 120.400 -0.033 0.000 2.271 66 D HA 0.127 4.772 4.640 0.008 0.000 0.206 66 D C -0.198 176.107 176.300 0.007 0.000 0.967 66 D CA 1.014 55.011 54.000 -0.006 0.000 0.867 66 D CB 0.237 41.038 40.800 0.003 0.000 0.960 66 D HN 0.307 8.677 8.370 -0.000 0.000 0.509 67 L N 0.745 121.955 121.223 -0.022 0.000 2.505 67 L HA 0.397 4.742 4.340 0.008 0.000 0.266 67 L C -1.664 175.170 176.870 -0.059 0.000 0.954 67 L CA -0.468 54.364 54.840 -0.012 0.000 0.852 67 L CB 2.098 44.165 42.059 0.013 0.000 1.282 67 L HN -0.243 7.987 8.230 -0.000 0.000 0.403 68 I N 5.429 125.983 120.570 -0.025 0.000 2.354 68 I HA 0.464 4.639 4.170 0.008 0.000 0.292 68 I C -0.668 175.440 176.117 -0.015 0.000 0.989 68 I CA -0.892 60.389 61.300 -0.031 0.000 1.188 68 I CB 1.875 39.868 38.000 -0.012 0.000 1.342 68 I HN 0.272 8.482 8.210 -0.000 0.000 0.457 69 V N 6.329 126.230 119.914 -0.023 0.000 2.311 69 V HA 0.491 4.616 4.120 0.008 0.000 0.275 69 V C 0.402 176.501 176.094 0.008 0.000 1.022 69 V CA -0.558 61.749 62.300 0.012 0.000 0.830 69 V CB 1.129 32.987 31.823 0.057 0.000 1.012 69 V HN 0.806 8.996 8.190 -0.000 0.000 0.452 70 A N 3.963 126.787 122.820 0.006 0.000 2.260 70 A HA 0.664 4.989 4.320 0.008 0.000 0.308 70 A C 0.557 178.141 177.584 -0.001 0.000 1.254 70 A CA -0.240 51.794 52.037 -0.005 0.000 0.874 70 A CB 0.500 19.493 19.000 -0.011 0.000 1.153 70 A HN 0.678 8.828 8.150 -0.000 0.000 0.527 71 S N 3.694 119.392 115.700 -0.003 0.000 2.573 71 S HA 0.179 4.654 4.470 0.008 0.000 0.277 71 S C -1.099 173.499 174.600 -0.003 0.000 1.346 71 S CA -0.338 57.864 58.200 0.003 0.000 1.034 71 S CB 0.469 63.672 63.200 0.005 0.000 0.879 71 S HN 0.724 9.034 8.310 -0.000 0.000 0.528 72 P HA -0.029 4.391 4.420 -0.000 0.000 0.225 72 P C 1.104 178.369 177.300 -0.057 0.000 1.148 72 P CA 0.834 63.970 63.100 0.060 0.000 0.779 72 P CB -0.197 31.601 31.700 0.164 0.000 0.780 73 G N -0.615 108.152 108.800 -0.055 0.000 2.920 73 G HA2 0.063 4.028 3.960 0.008 0.000 0.208 73 G HA3 0.063 4.028 3.960 0.008 0.000 0.208 73 G C 0.428 175.224 174.900 -0.172 0.000 1.159 73 G CA -0.009 45.016 45.100 -0.124 0.000 0.784 73 G HN 0.293 8.583 8.290 -0.000 0.000 0.535 74 I N 1.078 121.556 120.570 -0.153 0.000 2.404 74 I HA 0.676 4.851 4.170 0.008 0.000 0.293 74 I C 0.283 176.304 176.117 -0.159 0.000 0.992 74 I CA -1.000 60.221 61.300 -0.132 0.000 1.149 74 I CB 1.658 39.599 38.000 -0.098 0.000 1.315 74 I HN 0.022 8.232 8.210 -0.000 0.000 0.446 75 A N 7.058 129.794 122.820 -0.141 0.000 2.440 75 A HA 0.305 4.630 4.320 0.008 0.000 0.251 75 A C 0.987 178.550 177.584 -0.035 0.000 1.089 75 A CA -0.216 51.735 52.037 -0.143 0.000 0.779 75 A CB 0.177 19.094 19.000 -0.139 0.000 1.022 75 A HN 0.958 9.108 8.150 -0.000 0.000 0.492 76 L N 1.977 123.184 121.223 -0.027 0.000 2.265 76 L HA -0.196 4.149 4.340 0.008 0.000 0.215 76 L C 2.615 179.510 176.870 0.041 0.000 1.117 76 L CA 1.396 56.247 54.840 0.017 0.000 0.782 76 L CB -0.269 41.808 42.059 0.029 0.000 0.914 76 L HN 0.859 9.089 8.230 -0.000 0.000 0.441 77 A N -1.659 121.180 122.820 0.031 0.000 2.235 77 A HA -0.132 4.193 4.320 0.008 0.000 0.208 77 A C 0.777 178.382 177.584 0.036 0.000 1.172 77 A CA -0.034 52.026 52.037 0.038 0.000 0.786 77 A CB -0.919 18.103 19.000 0.036 0.000 0.804 77 A HN 0.459 8.609 8.150 -0.000 0.000 0.479 78 H N 0.365 119.416 119.070 -0.031 0.000 3.034 78 H HA 0.117 4.678 4.556 0.008 0.000 0.324 78 H C -1.660 173.658 175.328 -0.016 0.000 1.015 78 H CA -0.792 55.238 56.048 -0.031 0.000 1.429 78 H CB 0.877 30.615 29.762 -0.040 0.000 1.429 78 H HN 0.036 8.316 8.280 -0.000 0.000 0.585 79 P HA -0.192 4.228 4.420 -0.000 0.000 0.216 79 P C 1.256 178.638 177.300 0.137 0.000 1.150 79 P CA 1.704 64.809 63.100 0.008 0.000 0.843 79 P CB 0.249 31.897 31.700 -0.085 0.000 0.787 80 S N -1.044 114.863 115.700 0.344 0.000 2.383 80 S HA -0.103 4.372 4.470 0.008 0.000 0.227 80 S C 1.713 176.372 174.600 0.097 0.000 1.026 80 S CA 0.870 59.178 58.200 0.181 0.000 0.981 80 S CB -0.880 62.387 63.200 0.112 0.000 0.818 80 S HN 0.039 8.349 8.310 -0.000 0.000 0.472 81 L N 2.010 123.304 121.223 0.118 0.000 2.131 81 L HA 0.024 4.369 4.340 0.008 0.000 0.206 81 L C 2.505 179.407 176.870 0.053 0.000 1.087 81 L CA 1.596 56.468 54.840 0.052 0.000 0.767 81 L CB -1.157 40.926 42.059 0.041 0.000 0.917 81 L HN 0.390 8.620 8.230 -0.000 0.000 0.441 82 S N -0.983 114.757 115.700 0.067 0.000 2.402 82 S HA -0.115 4.360 4.470 0.008 0.000 0.229 82 S C 2.131 176.752 174.600 0.037 0.000 1.021 82 S CA 0.783 59.011 58.200 0.046 0.000 0.974 82 S CB -0.740 62.485 63.200 0.042 0.000 0.800 82 S HN 0.364 8.674 8.310 -0.000 0.000 0.484 83 A N 2.320 125.165 122.820 0.041 0.000 1.902 83 A HA 0.255 4.580 4.320 0.008 0.000 0.217 83 A C 2.547 180.146 177.584 0.025 0.000 1.181 83 A CA 1.780 53.836 52.037 0.030 0.000 0.623 83 A CB -1.486 17.533 19.000 0.032 0.000 0.818 83 A HN 0.801 8.951 8.150 -0.000 0.000 0.443 84 A N -0.161 122.674 122.820 0.026 0.000 1.902 84 A HA 0.159 4.484 4.320 0.008 0.000 0.217 84 A C 2.514 180.110 177.584 0.020 0.000 1.181 84 A CA 2.131 54.180 52.037 0.020 0.000 0.623 84 A CB -1.038 17.972 19.000 0.016 0.000 0.818 84 A HN 1.071 9.221 8.150 -0.000 0.000 0.443 85 A N 0.080 122.913 122.820 0.023 0.000 1.902 85 A HA -0.188 4.137 4.320 0.008 0.000 0.217 85 A C 1.723 179.319 177.584 0.019 0.000 1.181 85 A CA 1.917 53.967 52.037 0.022 0.000 0.623 85 A CB -0.629 18.385 19.000 0.024 0.000 0.818 85 A HN 0.448 8.598 8.150 -0.000 0.000 0.443 86 D N 0.097 120.509 120.400 0.019 0.000 2.178 86 D HA -0.031 4.614 4.640 0.008 0.000 0.201 86 D C 1.881 178.191 176.300 0.015 0.000 0.980 86 D CA 1.378 55.388 54.000 0.017 0.000 0.842 86 D CB -0.296 40.514 40.800 0.017 0.000 0.948 86 D HN 0.453 8.823 8.370 -0.000 0.000 0.472 87 A N -0.367 122.462 122.820 0.016 0.000 2.238 87 A HA 0.391 4.716 4.320 0.008 0.000 0.208 87 A C 1.737 179.329 177.584 0.014 0.000 1.177 87 A CA 0.997 53.042 52.037 0.014 0.000 0.804 87 A CB -0.285 18.723 19.000 0.014 0.000 0.823 87 A HN 0.239 8.389 8.150 -0.000 0.000 0.482 88 G N -0.720 108.089 108.800 0.016 0.000 2.147 88 G HA2 -0.222 3.743 3.960 0.008 0.000 0.244 88 G HA3 -0.222 3.743 3.960 0.008 0.000 0.244 88 G C 0.045 174.956 174.900 0.019 0.000 1.005 88 G CA 0.227 45.337 45.100 0.017 0.000 0.713 88 G HN 0.488 8.778 8.290 -0.000 0.000 0.515 89 I N 1.057 121.638 120.570 0.018 0.000 2.396 89 I HA 0.201 4.376 4.170 0.008 0.000 0.289 89 I C 1.004 177.136 176.117 0.023 0.000 1.056 89 I CA -0.394 60.917 61.300 0.019 0.000 1.365 89 I CB 1.053 39.062 38.000 0.014 0.000 1.407 89 I HN 0.263 8.473 8.210 -0.000 0.000 0.509 90 E N 7.025 127.243 120.200 0.031 0.000 2.415 90 E HA 0.188 4.543 4.350 0.008 0.000 0.263 90 E C -0.985 175.637 176.600 0.036 0.000 0.995 90 E CA 0.049 56.473 56.400 0.041 0.000 0.915 90 E CB 0.628 30.363 29.700 0.059 0.000 0.951 90 E HN 0.428 8.788 8.360 -0.000 0.000 0.449 91 I N 5.700 126.292 120.570 0.037 0.000 2.466 91 I HA 0.296 4.471 4.170 0.008 0.000 0.289 91 I C -0.361 175.780 176.117 0.040 0.000 1.026 91 I CA -0.861 60.458 61.300 0.031 0.000 1.078 91 I CB 1.612 39.626 38.000 0.024 0.000 1.249 91 I HN 0.346 8.556 8.210 -0.000 0.000 0.429 92 V N 2.293 122.231 119.914 0.041 0.000 3.158 92 V HA 1.007 5.132 4.120 0.008 0.000 0.311 92 V C -0.088 176.024 176.094 0.030 0.000 1.181 92 V CA -0.497 61.829 62.300 0.044 0.000 1.054 92 V CB 1.527 33.388 31.823 0.064 0.000 1.085 92 V HN 0.724 8.914 8.190 -0.000 0.000 0.446 93 G N -0.061 108.753 108.800 0.024 0.000 2.820 93 G HA2 0.471 4.436 3.960 0.008 0.000 0.291 93 G HA3 0.471 4.436 3.960 0.008 0.000 0.291 93 G C 0.254 175.141 174.900 -0.021 0.000 1.323 93 G CA 0.275 45.381 45.100 0.009 0.000 1.055 93 G HN 0.978 9.268 8.290 -0.000 0.000 0.520 94 D N -0.810 119.566 120.400 -0.041 0.000 2.178 94 D HA -0.145 4.500 4.640 0.008 0.000 0.202 94 D C 2.029 178.282 176.300 -0.079 0.000 0.974 94 D CA 0.617 54.557 54.000 -0.100 0.000 0.841 94 D CB 0.018 40.762 40.800 -0.093 0.000 0.953 94 D HN 0.158 8.528 8.370 -0.000 0.000 0.478 95 I N 1.130 121.678 120.570 -0.037 0.000 2.394 95 I HA -0.158 4.017 4.170 0.008 0.000 0.251 95 I C 2.444 178.595 176.117 0.056 0.000 1.136 95 I CA 0.868 62.166 61.300 -0.002 0.000 1.425 95 I CB -1.114 36.874 38.000 -0.021 0.000 1.079 95 I HN 0.050 8.260 8.210 -0.000 0.000 0.425 96 E N 1.707 121.922 120.200 0.025 0.000 2.051 96 E HA -0.181 4.174 4.350 0.008 0.000 0.192 96 E C 2.286 178.896 176.600 0.016 0.000 0.991 96 E CA 1.428 57.848 56.400 0.034 0.000 0.799 96 E CB -0.442 29.281 29.700 0.038 0.000 0.748 96 E HN 0.450 8.810 8.360 -0.000 0.000 0.449 97 L N -0.300 120.888 121.223 -0.060 0.000 2.042 97 L HA -0.136 4.209 4.340 0.008 0.000 0.210 97 L C 2.442 179.211 176.870 -0.168 0.000 1.076 97 L CA 1.399 56.131 54.840 -0.180 0.000 0.749 97 L CB -0.588 41.121 42.059 -0.583 0.000 0.893 97 L HN 0.182 8.412 8.230 -0.000 0.000 0.432 98 F N 0.338 120.130 119.950 -0.262 0.000 2.102 98 F HA -0.262 4.270 4.527 0.009 0.000 0.298 98 F C 2.559 178.274 175.800 -0.142 0.000 1.105 98 F CA 1.624 59.493 58.000 -0.217 0.000 1.239 98 F CB -0.462 38.400 39.000 -0.229 0.000 0.991 98 F HN 0.041 8.341 8.300 -0.000 0.000 0.474 99 C N 0.909 120.191 119.300 -0.031 0.000 2.425 99 C HA -0.145 4.320 4.460 0.008 0.000 0.277 99 C C 2.713 177.631 174.990 -0.120 0.000 1.280 99 C CA 1.126 60.099 59.018 -0.075 0.000 1.744 99 C CB -1.416 26.353 27.740 0.048 0.000 1.989 99 C HN 0.445 8.675 8.230 -0.000 0.000 0.491 100 R N 0.547 121.009 120.500 -0.063 0.000 2.189 100 R HA -0.080 4.265 4.340 0.008 0.000 0.223 100 R C 1.837 178.104 176.300 -0.055 0.000 1.092 100 R CA 0.945 57.033 56.100 -0.021 0.000 0.989 100 R CB -0.096 30.244 30.300 0.066 0.000 0.876 100 R HN 0.580 8.850 8.270 -0.000 0.000 0.457 101 E N 0.085 120.202 120.200 -0.138 0.000 2.340 101 E HA 0.153 4.508 4.350 0.008 0.000 0.198 101 E C 0.330 176.782 176.600 -0.246 0.000 0.961 101 E CA 0.162 56.484 56.400 -0.129 0.000 0.905 101 E CB 0.180 29.859 29.700 -0.034 0.000 0.884 101 E HN 0.174 8.534 8.360 -0.000 0.000 0.491 102 A N 2.068 124.588 122.820 -0.500 0.000 2.540 102 A HA 0.022 4.347 4.320 0.008 0.000 0.239 102 A C 0.627 178.140 177.584 -0.118 0.000 1.061 102 A CA 0.361 52.094 52.037 -0.508 0.000 0.758 102 A CB 0.206 18.703 19.000 -0.840 0.000 0.991 102 A HN -0.051 8.099 8.150 -0.000 0.000 0.502 103 Q N 0.106 119.936 119.800 0.050 0.000 2.155 103 Q HA 0.465 4.810 4.340 0.008 0.000 0.273 103 Q C -0.309 175.754 176.000 0.106 0.000 0.857 103 Q CA 0.533 56.374 55.803 0.063 0.000 1.116 103 Q CB 0.618 29.379 28.738 0.040 0.000 1.209 103 Q HN 0.876 9.146 8.270 -0.000 0.000 0.460 104 A N 0.841 123.778 122.820 0.195 0.000 2.556 104 A HA 0.791 5.116 4.320 0.008 0.000 0.294 104 A C -2.732 174.968 177.584 0.192 0.000 1.091 104 A CA -1.504 50.609 52.037 0.127 0.000 0.704 104 A CB 1.107 20.082 19.000 -0.040 0.000 1.300 104 A HN -0.066 8.084 8.150 -0.000 0.000 0.406 105 P HA 0.360 4.780 4.420 -0.000 0.000 0.267 105 P C -0.949 176.471 177.300 0.200 0.000 1.200 105 P CA 0.373 63.548 63.100 0.124 0.000 0.772 105 P CB 0.299 32.041 31.700 0.070 0.000 0.855 106 I N 1.711 122.393 120.570 0.186 0.000 2.406 106 I HA 0.232 4.407 4.170 0.008 0.000 0.290 106 I C -0.393 175.801 176.117 0.127 0.000 0.999 106 I CA -0.998 60.430 61.300 0.214 0.000 1.124 106 I CB 1.876 40.009 38.000 0.221 0.000 1.289 106 I HN -0.043 8.167 8.210 -0.000 0.000 0.441 107 V N 5.776 125.753 119.914 0.105 0.000 2.407 107 V HA 0.633 4.758 4.120 0.008 0.000 0.278 107 V C 0.330 176.450 176.094 0.042 0.000 1.037 107 V CA -0.343 61.991 62.300 0.057 0.000 0.900 107 V CB 1.297 33.136 31.823 0.028 0.000 0.983 107 V HN 0.822 9.012 8.190 -0.000 0.000 0.459 108 A N 6.678 129.515 122.820 0.028 0.000 2.343 108 A HA 0.915 5.240 4.320 0.008 0.000 0.316 108 A C -0.901 176.671 177.584 -0.020 0.000 1.104 108 A CA -0.491 51.548 52.037 0.003 0.000 0.768 108 A CB 0.846 19.849 19.000 0.004 0.000 1.213 108 A HN 0.752 8.902 8.150 -0.000 0.000 0.456 109 I N 1.597 122.145 120.570 -0.037 0.000 2.478 109 I HA 0.517 4.692 4.170 0.008 0.000 0.287 109 I C 0.188 176.271 176.117 -0.056 0.000 1.042 109 I CA -0.077 61.196 61.300 -0.044 0.000 1.067 109 I CB 2.472 40.445 38.000 -0.045 0.000 1.233 109 I HN 0.667 8.877 8.210 -0.000 0.000 0.431 110 T N 3.375 117.886 114.554 -0.071 0.000 2.742 110 T HA 0.965 5.320 4.350 0.008 0.000 0.282 110 T C -0.682 173.984 174.700 -0.057 0.000 1.025 110 T CA -0.252 61.802 62.100 -0.075 0.000 1.020 110 T CB 1.976 70.773 68.868 -0.118 0.000 1.317 110 T HN 1.036 9.276 8.240 -0.000 0.000 0.538 111 G N 0.270 109.036 108.800 -0.055 0.000 2.321 111 G HA2 0.214 4.179 3.960 0.008 0.000 0.339 111 G HA3 0.214 4.179 3.960 0.008 0.000 0.339 111 G C 0.382 175.289 174.900 0.011 0.000 1.518 111 G CA 0.230 45.312 45.100 -0.030 0.000 0.994 111 G HN 0.654 8.944 8.290 -0.000 0.000 0.668 112 S N -0.319 115.400 115.700 0.033 0.000 2.453 112 S HA 0.093 4.568 4.470 0.008 0.000 0.231 112 S C 0.801 175.422 174.600 0.035 0.000 1.005 112 S CA 1.428 59.679 58.200 0.086 0.000 0.949 112 S CB -0.073 63.198 63.200 0.119 0.000 0.774 112 S HN 0.779 9.089 8.310 -0.000 0.000 0.510 113 N N -1.719 116.996 118.700 0.025 0.000 2.405 113 N HA 0.489 5.234 4.740 0.008 0.000 0.274 113 N C 0.138 175.669 175.510 0.034 0.000 1.170 113 N CA 0.544 53.601 53.050 0.012 0.000 0.848 113 N CB 1.471 39.954 38.487 -0.006 0.000 1.629 113 N HN 0.087 8.467 8.380 -0.000 0.000 0.481 114 G N 1.719 110.540 108.800 0.035 0.000 2.194 114 G HA2 -0.317 3.648 3.960 0.008 0.000 0.236 114 G HA3 -0.317 3.648 3.960 0.008 0.000 0.236 114 G C 0.878 175.783 174.900 0.009 0.000 0.987 114 G CA 0.861 45.987 45.100 0.045 0.000 0.635 114 G HN 0.730 9.020 8.290 -0.000 0.000 0.520 115 K N 0.426 120.828 120.400 0.002 0.000 2.155 115 K HA 0.200 4.525 4.320 0.008 0.000 0.203 115 K C 2.242 178.833 176.600 -0.016 0.000 1.052 115 K CA 1.728 58.007 56.287 -0.014 0.000 0.948 115 K CB -0.259 32.233 32.500 -0.014 0.000 0.728 115 K HN 0.233 8.483 8.250 -0.000 0.000 0.448 116 S N 0.986 116.689 115.700 0.004 0.000 2.387 116 S HA -0.072 4.403 4.470 0.008 0.000 0.226 116 S C 1.872 176.477 174.600 0.009 0.000 1.026 116 S CA 1.518 59.731 58.200 0.022 0.000 0.972 116 S CB -0.294 62.943 63.200 0.063 0.000 0.814 116 S HN 0.430 8.740 8.310 -0.000 0.000 0.477 117 T N 2.150 116.715 114.554 0.018 0.000 2.708 117 T HA -0.046 4.309 4.350 0.008 0.000 0.266 117 T C 1.952 176.561 174.700 -0.151 0.000 1.037 117 T CA 1.237 63.333 62.100 -0.006 0.000 1.146 117 T CB -0.388 68.517 68.868 0.061 0.000 0.865 117 T HN 0.182 8.422 8.240 -0.000 0.000 0.435 118 V N 1.519 121.363 119.914 -0.117 0.000 2.358 118 V HA -0.163 3.962 4.120 0.008 0.000 0.246 118 V C 2.789 178.787 176.094 -0.160 0.000 1.047 118 V CA 1.873 64.078 62.300 -0.159 0.000 1.035 118 V CB -1.159 30.578 31.823 -0.143 0.000 0.658 118 V HN 0.521 8.711 8.190 -0.000 0.000 0.452 119 T N -0.142 114.345 114.554 -0.113 0.000 2.684 119 T HA -0.221 4.134 4.350 0.008 0.000 0.267 119 T C 1.966 176.591 174.700 -0.125 0.000 1.036 119 T CA 2.274 64.319 62.100 -0.092 0.000 1.148 119 T CB -0.422 68.415 68.868 -0.052 0.000 0.863 119 T HN 0.552 8.792 8.240 -0.000 0.000 0.436 120 T N 2.260 116.715 114.554 -0.165 0.000 2.777 120 T HA 0.072 4.427 4.350 0.008 0.000 0.266 120 T C 2.016 176.482 174.700 -0.390 0.000 1.040 120 T CA 0.753 62.719 62.100 -0.223 0.000 1.141 120 T CB -0.442 68.309 68.868 -0.196 0.000 0.868 120 T HN 0.220 8.460 8.240 -0.000 0.000 0.444 121 L N 0.733 121.633 121.223 -0.537 0.000 2.012 121 L HA -0.113 4.232 4.340 0.008 0.000 0.210 121 L C 2.669 179.389 176.870 -0.250 0.000 1.073 121 L CA 1.085 55.632 54.840 -0.488 0.000 0.748 121 L CB -0.663 41.148 42.059 -0.414 0.000 0.891 121 L HN 0.146 8.376 8.230 -0.000 0.000 0.431 122 V N 0.008 119.809 119.914 -0.189 0.000 2.407 122 V HA -0.220 3.905 4.120 0.008 0.000 0.248 122 V C 2.590 178.631 176.094 -0.089 0.000 1.055 122 V CA 1.904 64.133 62.300 -0.119 0.000 1.049 122 V CB -1.281 30.485 31.823 -0.095 0.000 0.662 122 V HN 0.599 8.789 8.190 -0.000 0.000 0.455 123 G N -0.404 108.340 108.800 -0.093 0.000 2.418 123 G HA2 -0.218 3.747 3.960 0.008 0.000 0.217 123 G HA3 -0.218 3.747 3.960 0.008 0.000 0.217 123 G C 1.489 176.358 174.900 -0.051 0.000 1.158 123 G CA 0.650 45.715 45.100 -0.058 0.000 0.771 123 G HN 0.475 8.765 8.290 -0.000 0.000 0.545 124 E N 0.259 120.412 120.200 -0.078 0.000 2.106 124 E HA -0.020 4.335 4.350 0.008 0.000 0.192 124 E C 2.632 179.213 176.600 -0.031 0.000 0.984 124 E CA 0.601 56.976 56.400 -0.041 0.000 0.806 124 E CB -0.351 29.319 29.700 -0.050 0.000 0.750 124 E HN 0.489 8.849 8.360 -0.000 0.000 0.458 125 M N 0.244 119.813 119.600 -0.052 0.000 2.117 125 M HA -0.131 4.354 4.480 0.008 0.000 0.262 125 M C 2.369 178.654 176.300 -0.024 0.000 1.065 125 M CA 1.620 56.899 55.300 -0.035 0.000 1.114 125 M CB -0.302 32.270 32.600 -0.047 0.000 1.361 125 M HN 0.056 8.346 8.290 -0.000 0.000 0.408 126 A N 0.682 123.484 122.820 -0.029 0.000 1.873 126 A HA -0.168 4.157 4.320 0.008 0.000 0.215 126 A C 2.103 179.677 177.584 -0.017 0.000 1.186 126 A CA 1.696 53.718 52.037 -0.024 0.000 0.616 126 A CB -0.512 18.471 19.000 -0.029 0.000 0.823 126 A HN 0.420 8.570 8.150 -0.000 0.000 0.442 127 K N -0.191 120.201 120.400 -0.014 0.000 2.063 127 K HA -0.095 4.230 4.320 0.008 0.000 0.208 127 K C 2.209 178.809 176.600 -0.000 0.000 1.048 127 K CA 1.189 57.473 56.287 -0.005 0.000 0.928 127 K CB -0.358 32.144 32.500 0.003 0.000 0.713 127 K HN 0.439 8.689 8.250 -0.000 0.000 0.442 128 A N 1.234 124.055 122.820 0.001 0.000 2.019 128 A HA -0.080 4.245 4.320 0.008 0.000 0.219 128 A C 2.151 179.736 177.584 0.002 0.000 1.164 128 A CA 1.750 53.790 52.037 0.005 0.000 0.644 128 A CB -0.434 18.570 19.000 0.007 0.000 0.805 128 A HN 0.337 8.487 8.150 -0.000 0.000 0.449 129 A N -1.936 120.883 122.820 -0.002 0.000 2.275 129 A HA 0.437 4.762 4.320 0.008 0.000 0.212 129 A C 1.677 179.258 177.584 -0.004 0.000 1.201 129 A CA 1.062 53.097 52.037 -0.002 0.000 0.843 129 A CB -0.807 18.191 19.000 -0.004 0.000 0.873 129 A HN 1.836 9.986 8.150 -0.000 0.000 0.492 130 G N -1.112 107.685 108.800 -0.005 0.000 2.143 130 G HA2 -0.191 3.774 3.960 0.008 0.000 0.248 130 G HA3 -0.191 3.774 3.960 0.008 0.000 0.248 130 G C 0.114 175.007 174.900 -0.012 0.000 0.991 130 G CA 0.185 45.281 45.100 -0.006 0.000 0.689 130 G HN 0.758 9.048 8.290 -0.000 0.000 0.522 131 V N 1.128 121.032 119.914 -0.017 0.000 2.546 131 V HA 0.341 4.466 4.120 0.008 0.000 0.284 131 V C 0.846 176.919 176.094 -0.035 0.000 1.050 131 V CA -0.901 61.383 62.300 -0.027 0.000 0.981 131 V CB 1.677 33.482 31.823 -0.030 0.000 0.990 131 V HN 0.420 8.610 8.190 -0.000 0.000 0.474 132 N N 4.074 122.747 118.700 -0.046 0.000 2.399 132 N HA 0.101 4.846 4.740 0.008 0.000 0.259 132 N C -0.902 174.553 175.510 -0.092 0.000 1.160 132 N CA 0.317 53.334 53.050 -0.055 0.000 0.946 132 N CB 1.208 39.662 38.487 -0.055 0.000 1.156 132 N HN 0.488 8.868 8.380 -0.000 0.000 0.489 133 V N 2.704 122.576 119.914 -0.071 0.000 2.555 133 V HA 0.775 4.900 4.120 0.008 0.000 0.302 133 V C 0.122 176.187 176.094 -0.049 0.000 1.038 133 V CA -0.624 61.626 62.300 -0.083 0.000 0.887 133 V CB 1.569 33.365 31.823 -0.044 0.000 0.991 133 V HN 0.655 8.845 8.190 -0.000 0.000 0.434 134 G N 5.203 113.976 108.800 -0.045 0.000 2.422 134 G HA2 0.593 4.558 3.960 0.008 0.000 0.317 134 G HA3 0.593 4.558 3.960 0.008 0.000 0.317 134 G C -1.264 173.720 174.900 0.140 0.000 1.210 134 G CA -0.372 44.789 45.100 0.102 0.000 0.930 134 G HN 0.786 9.076 8.290 -0.000 0.000 0.468 135 V N 2.015 121.977 119.914 0.080 0.000 2.448 135 V HA 0.949 5.074 4.120 0.008 0.000 0.295 135 V C 0.686 176.791 176.094 0.018 0.000 1.025 135 V CA 0.398 62.724 62.300 0.043 0.000 0.859 135 V CB 0.939 32.774 31.823 0.021 0.000 0.988 135 V HN 1.175 9.365 8.190 -0.000 0.000 0.431 136 G N 2.096 110.881 108.800 -0.025 0.000 2.500 136 G HA2 0.787 4.752 3.960 0.008 0.000 0.299 136 G HA3 0.787 4.752 3.960 0.008 0.000 0.299 136 G C -0.105 174.735 174.900 -0.099 0.000 1.242 136 G CA 0.428 45.494 45.100 -0.058 0.000 0.859 136 G HN 1.593 9.883 8.290 -0.000 0.000 0.481 137 G N -0.080 108.646 108.800 -0.122 0.000 2.464 137 G HA2 -0.091 3.874 3.960 0.008 0.000 0.216 137 G HA3 -0.091 3.874 3.960 0.008 0.000 0.216 137 G C 0.866 175.739 174.900 -0.045 0.000 1.186 137 G CA 0.933 45.963 45.100 -0.117 0.000 1.010 137 G HN 1.589 9.879 8.290 -0.000 0.000 0.585 138 N N 0.113 118.799 118.700 -0.024 0.000 2.364 138 N HA 0.011 4.756 4.740 0.008 0.000 0.183 138 N C 2.327 177.868 175.510 0.051 0.000 1.022 138 N CA 1.906 54.967 53.050 0.017 0.000 0.883 138 N CB -0.185 38.307 38.487 0.010 0.000 0.965 138 N HN 0.606 8.986 8.380 -0.000 0.000 0.438 139 I N -1.573 119.020 120.570 0.039 0.000 2.423 139 I HA -0.140 4.035 4.170 0.008 0.000 0.254 139 I C 1.351 177.523 176.117 0.091 0.000 1.151 139 I CA 1.535 62.878 61.300 0.073 0.000 1.421 139 I CB -0.035 37.994 38.000 0.048 0.000 1.079 139 I HN 0.411 8.621 8.210 -0.000 0.000 0.431 140 G N -0.123 108.711 108.800 0.057 0.000 3.302 140 G HA2 -0.115 3.850 3.960 0.008 0.000 0.216 140 G HA3 -0.115 3.850 3.960 0.008 0.000 0.216 140 G C -0.260 174.656 174.900 0.027 0.000 1.008 140 G CA -0.060 45.072 45.100 0.053 0.000 0.852 140 G HN 0.133 8.423 8.290 -0.000 0.000 0.485 141 L N 3.602 124.834 121.223 0.014 0.000 2.261 141 L HA 0.681 5.026 4.340 0.008 0.000 0.289 141 L C -2.284 174.569 176.870 -0.028 0.000 1.059 141 L CA -2.374 52.468 54.840 0.003 0.000 0.816 141 L CB 0.689 42.755 42.059 0.011 0.000 1.191 141 L HN -0.133 8.097 8.230 -0.000 0.000 0.431 142 P HA 0.030 4.450 4.420 -0.000 0.000 0.262 142 P C 0.187 177.424 177.300 -0.105 0.000 1.182 142 P CA 0.316 63.384 63.100 -0.054 0.000 0.761 142 P CB 0.846 32.532 31.700 -0.023 0.000 0.795 143 A N 4.279 126.970 122.820 -0.215 0.000 1.940 143 A HA -0.191 4.134 4.320 0.008 0.000 0.219 143 A C 1.907 179.346 177.584 -0.241 0.000 1.176 143 A CA 1.583 53.339 52.037 -0.469 0.000 0.631 143 A CB -1.366 17.134 19.000 -0.834 0.000 0.814 143 A HN 0.574 8.724 8.150 -0.000 0.000 0.446 144 L N -1.363 119.834 121.223 -0.044 0.000 2.265 144 L HA -0.124 4.221 4.340 0.008 0.000 0.215 144 L C 2.456 179.407 176.870 0.135 0.000 1.117 144 L CA 0.959 55.867 54.840 0.113 0.000 0.782 144 L CB -0.379 41.667 42.059 -0.022 0.000 0.914 144 L HN 0.426 8.656 8.230 -0.000 0.000 0.441 145 M N -0.917 118.726 119.600 0.072 0.000 2.619 145 M HA -0.068 4.417 4.480 0.008 0.000 0.251 145 M C 1.732 178.104 176.300 0.119 0.000 1.106 145 M CA 0.911 56.263 55.300 0.087 0.000 1.086 145 M CB 0.088 32.720 32.600 0.054 0.000 1.465 145 M HN 0.256 8.546 8.290 -0.000 0.000 0.506 146 L N -0.334 120.978 121.223 0.149 0.000 2.341 146 L HA 0.079 4.424 4.340 0.008 0.000 0.214 146 L C 0.737 177.846 176.870 0.398 0.000 1.115 146 L CA -0.068 54.928 54.840 0.260 0.000 0.820 146 L CB -0.235 41.981 42.059 0.261 0.000 0.944 146 L HN 0.232 8.462 8.230 -0.000 0.000 0.452 147 L N 2.022 123.452 121.223 0.345 0.000 2.584 147 L HA -0.023 4.322 4.340 0.008 0.000 0.272 147 L C -0.401 176.618 176.870 0.247 0.000 1.195 147 L CA 0.587 55.605 54.840 0.296 0.000 0.920 147 L CB -0.046 42.116 42.059 0.171 0.000 1.173 147 L HN 0.076 8.306 8.230 -0.000 0.000 0.489 148 D N 2.056 122.623 120.400 0.280 0.000 2.931 148 D HA 0.090 4.735 4.640 0.008 0.000 0.215 148 D C 0.017 176.391 176.300 0.123 0.000 1.297 148 D CA -0.494 53.605 54.000 0.166 0.000 0.892 148 D CB 1.565 42.453 40.800 0.146 0.000 1.642 148 D HN 0.330 8.700 8.370 -0.000 0.000 0.560 149 D N 1.476 121.921 120.400 0.074 0.000 2.310 149 D HA -0.109 4.536 4.640 0.008 0.000 0.212 149 D C 1.251 177.564 176.300 0.022 0.000 0.965 149 D CA 0.692 54.720 54.000 0.047 0.000 0.879 149 D CB 0.477 41.295 40.800 0.031 0.000 0.921 149 D HN 0.425 8.795 8.370 -0.000 0.000 0.510 150 E N -0.256 119.952 120.200 0.015 0.000 2.474 150 E HA -0.003 4.352 4.350 0.008 0.000 0.194 150 E C -0.170 176.403 176.600 -0.044 0.000 1.041 150 E CA -0.179 56.216 56.400 -0.008 0.000 0.874 150 E CB -0.223 29.476 29.700 -0.002 0.000 0.914 150 E HN 0.049 8.409 8.360 -0.000 0.000 0.498 151 C N 0.931 120.188 119.300 -0.072 0.000 2.637 151 C HA 0.187 4.652 4.460 0.008 0.000 0.418 151 C C 1.209 176.055 174.990 -0.239 0.000 1.319 151 C CA -0.080 58.812 59.018 -0.210 0.000 1.949 151 C CB -0.105 27.393 27.740 -0.403 0.000 2.639 151 C HN 0.454 8.684 8.230 -0.000 0.000 0.594 152 E N 2.215 122.282 120.200 -0.222 0.000 2.447 152 E HA 0.230 4.585 4.350 0.008 0.000 0.204 152 E C -0.632 175.872 176.600 -0.159 0.000 0.977 152 E CA 0.050 56.362 56.400 -0.147 0.000 0.950 152 E CB 0.574 30.222 29.700 -0.085 0.000 0.975 152 E HN 0.544 8.904 8.360 -0.000 0.000 0.496 153 L N 0.147 121.220 121.223 -0.250 0.000 2.549 153 L HA 0.349 4.694 4.340 0.008 0.000 0.259 153 L C -2.073 174.654 176.870 -0.238 0.000 0.934 153 L CA -0.761 53.982 54.840 -0.162 0.000 0.865 153 L CB 1.248 43.267 42.059 -0.067 0.000 1.352 153 L HN -0.185 8.045 8.230 -0.000 0.000 0.410 154 Y N 3.753 124.104 120.300 0.085 0.000 2.377 154 Y HA 0.723 5.278 4.550 0.008 0.000 0.339 154 Y C -0.279 175.651 175.900 0.051 0.000 1.011 154 Y CA -0.788 57.374 58.100 0.104 0.000 1.093 154 Y CB 2.170 40.776 38.460 0.242 0.000 1.201 154 Y HN 0.310 8.590 8.280 -0.000 0.000 0.455 155 V N 5.592 125.608 119.914 0.171 0.000 2.407 155 V HA 0.410 4.535 4.120 0.008 0.000 0.291 155 V C -0.523 175.586 176.094 0.025 0.000 1.018 155 V CA -0.872 61.470 62.300 0.070 0.000 0.842 155 V CB 1.272 33.106 31.823 0.017 0.000 0.996 155 V HN 0.578 8.768 8.190 -0.000 0.000 0.426 156 L N 3.992 125.212 121.223 -0.006 0.000 2.305 156 L HA 0.563 4.908 4.340 0.008 0.000 0.284 156 L C 0.235 177.073 176.870 -0.053 0.000 1.013 156 L CA -0.392 54.407 54.840 -0.067 0.000 0.819 156 L CB 2.065 44.054 42.059 -0.116 0.000 1.227 156 L HN 0.674 8.904 8.230 -0.000 0.000 0.417 157 E N 4.565 124.733 120.200 -0.053 0.000 2.259 157 E HA 0.419 4.774 4.350 0.008 0.000 0.281 157 E C -1.402 175.168 176.600 -0.050 0.000 1.037 157 E CA -0.424 55.951 56.400 -0.042 0.000 0.854 157 E CB 0.864 30.551 29.700 -0.022 0.000 1.051 157 E HN 0.478 8.838 8.360 -0.000 0.000 0.409 158 L N 3.963 125.155 121.223 -0.051 0.000 2.362 158 L HA 0.321 4.666 4.340 0.008 0.000 0.275 158 L C 0.179 177.016 176.870 -0.055 0.000 0.998 158 L CA -0.893 53.916 54.840 -0.052 0.000 0.820 158 L CB 1.896 43.922 42.059 -0.056 0.000 1.270 158 L HN 0.581 8.811 8.230 -0.000 0.000 0.415 159 S N 0.058 115.725 115.700 -0.056 0.000 2.632 159 S HA 0.162 4.637 4.470 0.008 0.000 0.267 159 S C 1.226 175.767 174.600 -0.099 0.000 1.276 159 S CA -0.102 58.030 58.200 -0.112 0.000 0.998 159 S CB 1.579 64.665 63.200 -0.189 0.000 0.953 159 S HN 0.740 9.050 8.310 -0.000 0.000 0.547 160 S N 0.888 116.506 115.700 -0.137 0.000 2.400 160 S HA -0.141 4.334 4.470 0.008 0.000 0.232 160 S C 1.457 176.156 174.600 0.165 0.000 1.025 160 S CA 0.915 59.116 58.200 0.001 0.000 0.993 160 S CB -0.985 62.297 63.200 0.136 0.000 0.808 160 S HN 0.639 8.949 8.310 -0.000 0.000 0.478 161 F N 2.339 122.341 119.950 0.086 0.000 2.075 161 F HA -0.004 4.528 4.527 0.008 0.000 0.297 161 F C 2.901 178.718 175.800 0.028 0.000 1.113 161 F CA 0.848 58.873 58.000 0.042 0.000 1.218 161 F CB -1.487 37.488 39.000 -0.041 0.000 0.984 161 F HN 0.293 8.593 8.300 -0.000 0.000 0.472 162 Q N -0.045 119.865 119.800 0.185 0.000 2.124 162 Q HA -0.169 4.175 4.340 0.008 0.000 0.202 162 Q C 2.353 178.394 176.000 0.068 0.000 0.977 162 Q CA 1.332 57.190 55.803 0.093 0.000 0.850 162 Q CB -0.433 28.327 28.738 0.037 0.000 0.901 162 Q HN 0.406 8.676 8.270 -0.000 0.000 0.429 163 L N 0.584 121.841 121.223 0.057 0.000 2.131 163 L HA -0.190 4.155 4.340 0.008 0.000 0.210 163 L C 2.120 179.028 176.870 0.062 0.000 1.092 163 L CA 1.019 55.880 54.840 0.035 0.000 0.759 163 L CB -0.295 41.761 42.059 -0.006 0.000 0.903 163 L HN 0.253 8.483 8.230 -0.000 0.000 0.435 164 E N -0.412 119.857 120.200 0.114 0.000 2.118 164 E HA -0.211 4.144 4.350 0.008 0.000 0.195 164 E C 1.639 178.288 176.600 0.082 0.000 0.992 164 E CA 1.817 58.290 56.400 0.120 0.000 0.804 164 E CB -0.058 29.751 29.700 0.181 0.000 0.741 164 E HN 0.554 8.914 8.360 -0.000 0.000 0.458 165 T N -1.882 112.716 114.554 0.073 0.000 3.145 165 T HA 0.121 4.476 4.350 0.008 0.000 0.255 165 T C 0.322 175.049 174.700 0.046 0.000 1.039 165 T CA -0.359 61.774 62.100 0.054 0.000 0.928 165 T CB 0.455 69.351 68.868 0.047 0.000 1.029 165 T HN -0.202 8.038 8.240 -0.000 0.000 0.554 166 T N 1.908 116.488 114.554 0.044 0.000 2.797 166 T HA 0.524 4.879 4.350 0.008 0.000 0.279 166 T C 0.839 175.561 174.700 0.037 0.000 0.991 166 T CA -0.513 61.610 62.100 0.038 0.000 0.979 166 T CB 1.745 70.632 68.868 0.032 0.000 0.943 166 T HN 0.336 8.576 8.240 -0.000 0.000 0.444 167 S N 0.576 116.300 115.700 0.040 0.000 2.628 167 S HA 0.132 4.607 4.470 0.008 0.000 0.246 167 S C 1.245 175.867 174.600 0.037 0.000 1.062 167 S CA -0.407 57.816 58.200 0.038 0.000 1.028 167 S CB 0.323 63.547 63.200 0.039 0.000 0.985 167 S HN 0.381 8.691 8.310 -0.000 0.000 0.551 168 S N 1.640 117.364 115.700 0.040 0.000 2.568 168 S HA 0.413 4.888 4.470 0.008 0.000 0.232 168 S C -0.101 174.522 174.600 0.038 0.000 0.975 168 S CA -0.480 57.742 58.200 0.037 0.000 0.949 168 S CB 0.023 63.244 63.200 0.036 0.000 0.829 168 S HN 0.525 8.835 8.310 -0.000 0.000 0.479 169 L N 3.166 124.415 121.223 0.043 0.000 2.361 169 L HA 0.271 4.616 4.340 0.008 0.000 0.278 169 L C -0.167 176.733 176.870 0.049 0.000 1.113 169 L CA 0.744 55.614 54.840 0.050 0.000 0.849 169 L CB 0.361 42.449 42.059 0.048 0.000 1.155 169 L HN 0.083 8.313 8.230 -0.000 0.000 0.452 170 Q N 5.866 125.698 119.800 0.052 0.000 2.907 170 Q HA 0.482 4.827 4.340 0.008 0.000 0.262 170 Q C -0.301 175.737 176.000 0.062 0.000 0.997 170 Q CA -0.597 55.238 55.803 0.053 0.000 0.797 170 Q CB 1.218 29.982 28.738 0.043 0.000 1.228 170 Q HN 0.872 9.142 8.270 -0.000 0.000 0.466 171 A N 0.946 123.808 122.820 0.070 0.000 2.498 171 A HA 0.079 4.404 4.320 0.008 0.000 0.239 171 A C 1.180 178.807 177.584 0.071 0.000 1.068 171 A CA -0.181 51.901 52.037 0.076 0.000 0.766 171 A CB 0.707 19.752 19.000 0.075 0.000 1.003 171 A HN 0.549 8.699 8.150 -0.000 0.000 0.497 172 V N 1.517 121.473 119.914 0.069 0.000 2.626 172 V HA 0.279 4.404 4.120 0.008 0.000 0.252 172 V C 1.001 177.128 176.094 0.055 0.000 1.067 172 V CA 2.266 64.600 62.300 0.057 0.000 1.081 172 V CB -0.456 31.399 31.823 0.053 0.000 0.686 172 V HN 1.454 9.644 8.190 -0.000 0.000 0.468 173 A N -0.902 121.953 122.820 0.059 0.000 2.491 173 A HA 0.848 5.173 4.320 0.008 0.000 0.293 173 A C -0.734 176.893 177.584 0.072 0.000 1.047 173 A CA 0.126 52.198 52.037 0.059 0.000 0.735 173 A CB 1.429 20.448 19.000 0.032 0.000 1.281 173 A HN 0.973 9.123 8.150 -0.000 0.000 0.398 174 A N 1.062 123.954 122.820 0.119 0.000 2.414 174 A HA 0.959 5.284 4.320 0.008 0.000 0.306 174 A C -0.378 177.342 177.584 0.227 0.000 1.054 174 A CA -0.235 51.882 52.037 0.134 0.000 0.724 174 A CB 1.803 20.893 19.000 0.149 0.000 1.267 174 A HN 1.621 9.771 8.150 -0.000 0.000 0.418 175 T N 1.543 116.171 114.554 0.123 0.000 2.912 175 T HA 0.606 4.961 4.350 0.008 0.000 0.299 175 T C -1.234 173.472 174.700 0.009 0.000 1.052 175 T CA -0.337 61.877 62.100 0.191 0.000 0.996 175 T CB 0.481 69.446 68.868 0.161 0.000 1.070 175 T HN 0.483 8.723 8.240 -0.000 0.000 0.465 176 I N 6.217 126.819 120.570 0.053 0.000 2.312 176 I HA 0.280 4.455 4.170 0.008 0.000 0.290 176 I C 1.306 177.504 176.117 0.136 0.000 1.008 176 I CA -0.583 60.713 61.300 -0.007 0.000 1.226 176 I CB 1.473 39.424 38.000 -0.082 0.000 1.371 176 I HN 0.618 8.828 8.210 -0.000 0.000 0.468 177 L N 5.631 126.930 121.223 0.127 0.000 2.072 177 L HA -0.069 4.276 4.340 0.008 0.000 0.205 177 L C 0.184 177.173 176.870 0.198 0.000 1.079 177 L CA 1.095 56.086 54.840 0.252 0.000 0.752 177 L CB -0.390 41.760 42.059 0.152 0.000 0.906 177 L HN 0.827 9.057 8.230 -0.000 0.000 0.436 178 N N -3.246 115.502 118.700 0.080 0.000 3.322 178 N HA 0.379 5.124 4.740 0.008 0.000 0.233 178 N C -1.366 174.134 175.510 -0.018 0.000 1.399 178 N CA -0.751 52.322 53.050 0.038 0.000 0.894 178 N CB 1.737 40.259 38.487 0.059 0.000 1.440 178 N HN -0.302 8.078 8.380 -0.000 0.000 0.503 179 V N -0.054 119.841 119.914 -0.030 0.000 2.447 179 V HA 0.785 4.910 4.120 0.008 0.000 0.292 179 V C -0.539 175.570 176.094 0.025 0.000 1.021 179 V CA -0.314 61.945 62.300 -0.068 0.000 0.850 179 V CB 0.806 32.538 31.823 -0.151 0.000 1.005 179 V HN 1.035 9.225 8.190 -0.000 0.000 0.426 180 T N 0.168 114.785 114.554 0.105 0.000 2.906 180 T HA 0.585 4.940 4.350 0.008 0.000 0.295 180 T C -0.379 174.432 174.700 0.185 0.000 1.061 180 T CA -0.752 61.414 62.100 0.109 0.000 1.000 180 T CB 2.054 70.955 68.868 0.056 0.000 1.103 180 T HN 0.668 8.908 8.240 -0.000 0.000 0.486 181 E N 1.054 121.312 120.200 0.096 0.000 2.585 181 E HA 0.128 4.483 4.350 0.008 0.000 0.252 181 E C -0.848 175.693 176.600 -0.099 0.000 0.981 181 E CA 0.484 56.901 56.400 0.027 0.000 0.943 181 E CB 0.184 29.870 29.700 -0.024 0.000 0.923 181 E HN 0.636 8.996 8.360 -0.000 0.000 0.486 182 D N 1.800 122.003 120.400 -0.327 0.000 2.648 182 D HA 0.162 4.807 4.640 0.008 0.000 0.244 182 D C -0.997 174.917 176.300 -0.643 0.000 1.244 182 D CA -0.266 53.424 54.000 -0.517 0.000 0.772 182 D CB 0.685 41.178 40.800 -0.513 0.000 1.379 182 D HN 0.620 8.990 8.370 -0.000 0.000 0.428 183 H N 1.875 120.813 119.070 -0.221 0.000 2.820 183 H HA -0.147 4.414 4.556 0.009 0.000 0.295 183 H C 1.250 176.598 175.328 0.033 0.000 1.187 183 H CA 0.720 56.745 56.048 -0.038 0.000 1.144 183 H CB -0.979 28.819 29.762 0.061 0.000 1.354 183 H HN 0.422 8.702 8.280 -0.000 0.000 0.395 184 M N 0.524 120.138 119.600 0.024 0.000 2.374 184 M HA -0.084 4.401 4.480 0.008 0.000 0.264 184 M C 2.064 178.389 176.300 0.041 0.000 1.067 184 M CA 1.569 56.902 55.300 0.055 0.000 1.103 184 M CB -0.518 32.068 32.600 -0.023 0.000 1.402 184 M HN 0.383 8.673 8.290 -0.000 0.000 0.444 185 D N -0.425 119.989 120.400 0.022 0.000 2.263 185 D HA -0.198 4.447 4.640 0.008 0.000 0.208 185 D C 1.627 177.894 176.300 -0.055 0.000 0.971 185 D CA 0.961 54.957 54.000 -0.007 0.000 0.867 185 D CB -0.342 40.462 40.800 0.008 0.000 0.929 185 D HN 0.264 8.634 8.370 -0.000 0.000 0.492 186 R N -0.998 119.445 120.500 -0.096 0.000 2.397 186 R HA 0.090 4.435 4.340 0.008 0.000 0.241 186 R C -0.278 175.718 176.300 -0.508 0.000 0.914 186 R CA -0.072 55.823 56.100 -0.341 0.000 1.071 186 R CB 0.373 30.383 30.300 -0.483 0.000 1.116 186 R HN 0.221 8.491 8.270 -0.000 0.000 0.524 187 Y N 0.906 121.272 120.300 0.111 0.000 2.705 187 Y HA 0.298 4.853 4.550 0.008 0.000 0.355 187 Y C -1.667 174.293 175.900 0.101 0.000 1.039 187 Y CA -2.717 55.471 58.100 0.148 0.000 1.233 187 Y CB 1.497 40.064 38.460 0.177 0.000 1.103 187 Y HN -0.073 8.207 8.280 -0.000 0.000 0.624 188 P HA -0.066 4.354 4.420 -0.000 0.000 0.237 188 P C 0.432 177.599 177.300 -0.221 0.000 1.178 188 P CA 1.064 64.139 63.100 -0.041 0.000 0.766 188 P CB 0.094 31.727 31.700 -0.112 0.000 0.876 189 F N 0.169 120.193 119.950 0.124 0.000 2.668 189 F HA 0.407 4.939 4.527 0.008 0.000 0.297 189 F C 1.842 177.706 175.800 0.106 0.000 1.124 189 F CA 0.437 58.497 58.000 0.100 0.000 1.353 189 F CB -0.460 38.596 39.000 0.095 0.000 0.992 189 F HN 0.032 8.332 8.300 -0.000 0.000 0.524 190 G N 0.631 109.560 108.800 0.215 0.000 2.569 190 G HA2 -0.363 3.602 3.960 0.008 0.000 0.259 190 G HA3 -0.363 3.602 3.960 0.008 0.000 0.259 190 G C 0.661 175.662 174.900 0.169 0.000 1.263 190 G CA 0.061 45.254 45.100 0.155 0.000 0.928 190 G HN 0.258 8.548 8.290 -0.000 0.000 0.572 191 L N 0.071 121.371 121.223 0.128 0.000 2.083 191 L HA 0.034 4.378 4.340 0.008 0.000 0.209 191 L C 2.929 179.858 176.870 0.098 0.000 1.083 191 L CA 2.996 57.922 54.840 0.143 0.000 0.752 191 L CB -0.455 41.666 42.059 0.103 0.000 0.899 191 L HN 0.597 8.827 8.230 -0.000 0.000 0.433 192 Q N -0.879 118.969 119.800 0.079 0.000 2.230 192 Q HA -0.197 4.148 4.340 0.008 0.000 0.202 192 Q C 2.065 178.080 176.000 0.026 0.000 0.963 192 Q CA 1.186 57.014 55.803 0.041 0.000 0.866 192 Q CB -0.162 28.607 28.738 0.051 0.000 0.931 192 Q HN 0.684 8.954 8.270 -0.000 0.000 0.452 193 Q N -0.511 119.336 119.800 0.079 0.000 2.049 193 Q HA -0.176 4.169 4.340 0.008 0.000 0.198 193 Q C 1.887 177.794 176.000 -0.154 0.000 0.971 193 Q CA 0.959 56.803 55.803 0.068 0.000 0.833 193 Q CB -0.110 28.795 28.738 0.277 0.000 0.896 193 Q HN 0.321 8.591 8.270 -0.000 0.000 0.434 194 Y N 1.492 121.473 120.300 -0.532 0.000 2.128 194 Y HA -0.264 4.291 4.550 0.008 0.000 0.284 194 Y C 2.301 177.951 175.900 -0.418 0.000 1.154 194 Y CA 2.138 59.682 58.100 -0.927 0.000 1.149 194 Y CB -0.442 37.669 38.460 -0.580 0.000 0.976 194 Y HN 0.046 8.326 8.280 -0.000 0.000 0.505 195 R N 0.285 120.580 120.500 -0.341 0.000 2.081 195 R HA -0.166 4.179 4.340 0.008 0.000 0.235 195 R C 2.337 178.507 176.300 -0.217 0.000 1.131 195 R CA 1.384 57.287 56.100 -0.328 0.000 0.960 195 R CB -0.595 29.603 30.300 -0.170 0.000 0.856 195 R HN 0.447 8.717 8.270 -0.000 0.000 0.436 196 A N 1.168 123.906 122.820 -0.136 0.000 1.940 196 A HA 0.012 4.337 4.320 0.008 0.000 0.219 196 A C 1.390 178.929 177.584 -0.076 0.000 1.176 196 A CA 1.309 53.301 52.037 -0.075 0.000 0.631 196 A CB -0.668 18.312 19.000 -0.033 0.000 0.814 196 A HN 0.565 8.715 8.150 -0.000 0.000 0.446 200 R N 0.702 121.150 120.500 -0.086 0.000 2.152 200 R HA -0.047 4.298 4.340 0.008 0.000 0.232 200 R C 2.021 178.283 176.300 -0.063 0.000 1.117 200 R CA 1.572 57.648 56.100 -0.041 0.000 0.981 200 R CB -0.120 30.168 30.300 -0.021 0.000 0.870 200 R HN 0.345 8.615 8.270 -0.000 0.000 0.451 201 I N 0.227 120.691 120.570 -0.176 0.000 2.454 201 I HA -0.279 3.896 4.170 0.008 0.000 0.254 201 I C 1.080 177.138 176.117 -0.097 0.000 1.156 201 I CA 1.253 62.440 61.300 -0.188 0.000 1.433 201 I CB 0.117 37.931 38.000 -0.311 0.000 1.082 201 I HN 0.140 8.350 8.210 -0.000 0.000 0.432 202 Y N 1.099 121.400 120.300 0.001 0.000 2.519 202 Y HA 0.063 4.618 4.550 0.008 0.000 0.287 202 Y C 0.824 176.730 175.900 0.009 0.000 1.128 202 Y CA -0.267 57.836 58.100 0.005 0.000 1.282 202 Y CB -0.638 37.822 38.460 -0.000 0.000 1.027 202 Y HN 0.162 8.442 8.280 -0.000 0.000 0.551 203 E N 2.051 122.339 120.200 0.146 0.000 2.498 203 E HA -0.074 4.281 4.350 0.008 0.000 0.252 203 E C 0.159 176.805 176.600 0.077 0.000 1.025 203 E CA 0.257 56.713 56.400 0.092 0.000 0.938 203 E CB -0.129 29.606 29.700 0.060 0.000 0.947 203 E HN 0.259 8.619 8.360 -0.000 0.000 0.478 204 N N 0.296 119.036 118.700 0.067 0.000 2.741 204 N HA -0.218 4.527 4.740 0.008 0.000 0.251 204 N C -0.637 174.910 175.510 0.062 0.000 1.112 204 N CA 1.057 54.140 53.050 0.054 0.000 0.750 204 N CB -1.294 37.219 38.487 0.044 0.000 1.119 204 N HN 0.557 8.937 8.380 -0.000 0.000 0.561 205 A N 0.546 123.417 122.820 0.084 0.000 2.401 205 A HA 0.243 4.568 4.320 0.008 0.000 0.259 205 A C 1.395 179.018 177.584 0.065 0.000 1.103 205 A CA 0.178 52.269 52.037 0.090 0.000 0.789 205 A CB 0.748 19.836 19.000 0.146 0.000 1.035 205 A HN 0.293 8.443 8.150 -0.000 0.000 0.491 206 K N 1.596 122.030 120.400 0.056 0.000 2.025 206 K HA 0.007 4.332 4.320 0.008 0.000 0.207 206 K C -0.010 176.613 176.600 0.038 0.000 1.049 206 K CA 1.439 57.751 56.287 0.042 0.000 0.933 206 K CB -0.026 32.498 32.500 0.040 0.000 0.714 206 K HN 0.505 8.755 8.250 -0.000 0.000 0.438 207 V N 1.009 120.951 119.914 0.047 0.000 2.487 207 V HA 0.236 4.361 4.120 0.008 0.000 0.298 207 V C -0.764 175.363 176.094 0.055 0.000 1.028 207 V CA -1.053 61.271 62.300 0.040 0.000 0.860 207 V CB 1.480 33.329 31.823 0.042 0.000 0.991 207 V HN 0.239 8.429 8.190 -0.000 0.000 0.427 208 C N 4.693 123.999 119.300 0.010 0.000 2.319 208 C HA 0.689 5.154 4.460 0.008 0.000 0.335 208 C C 0.242 175.227 174.990 -0.008 0.000 1.274 208 C CA -0.629 58.379 59.018 -0.017 0.000 1.806 208 C CB 1.067 28.606 27.740 -0.335 0.000 2.329 208 C HN 0.649 8.879 8.230 -0.000 0.000 0.524 209 V N 5.238 125.224 119.914 0.121 0.000 2.350 209 V HA 0.522 4.647 4.120 0.008 0.000 0.285 209 V C 0.108 176.343 176.094 0.234 0.000 1.014 209 V CA -0.220 62.171 62.300 0.152 0.000 0.831 209 V CB 1.266 33.172 31.823 0.139 0.000 1.000 209 V HN 0.789 8.979 8.190 -0.000 0.000 0.433 210 V N 2.089 122.074 119.914 0.117 0.000 2.994 210 V HA 0.693 4.818 4.120 0.008 0.000 0.318 210 V C -0.135 175.798 176.094 -0.269 0.000 1.085 210 V CA -0.920 61.398 62.300 0.030 0.000 0.998 210 V CB 2.160 33.940 31.823 -0.073 0.000 1.063 210 V HN 0.685 8.875 8.190 -0.000 0.000 0.447 211 N N 1.700 120.137 118.700 -0.439 0.000 2.437 211 N HA 0.440 5.185 4.740 0.008 0.000 0.243 211 N C 0.879 176.128 175.510 -0.436 0.000 1.041 211 N CA 0.261 52.772 53.050 -0.899 0.000 0.940 211 N CB 1.437 39.585 38.487 -0.565 0.000 1.133 211 N HN 1.005 9.385 8.380 -0.000 0.000 0.506 212 A N 3.269 125.854 122.820 -0.393 0.000 2.076 212 A HA -0.130 4.195 4.320 0.008 0.000 0.220 212 A C 1.130 178.639 177.584 -0.125 0.000 1.160 212 A CA 1.318 53.248 52.037 -0.178 0.000 0.653 212 A CB -0.017 18.922 19.000 -0.103 0.000 0.801 212 A HN 0.694 8.844 8.150 -0.000 0.000 0.455 213 D N -0.656 119.659 120.400 -0.141 0.000 2.339 213 D HA 0.063 4.708 4.640 0.008 0.000 0.217 213 D C -0.377 175.889 176.300 -0.057 0.000 1.050 213 D CA 0.374 54.334 54.000 -0.067 0.000 0.856 213 D CB 0.313 41.098 40.800 -0.025 0.000 0.922 213 D HN 0.344 8.714 8.370 -0.000 0.000 0.518 214 D N 0.017 120.365 120.400 -0.086 0.000 2.421 214 D HA 0.323 4.968 4.640 0.008 0.000 0.254 214 D C 0.734 177.002 176.300 -0.053 0.000 1.238 214 D CA -0.584 53.383 54.000 -0.054 0.000 0.919 214 D CB 1.344 42.117 40.800 -0.044 0.000 1.152 214 D HN -0.122 8.248 8.370 -0.000 0.000 0.552 215 A N 3.989 126.787 122.820 -0.037 0.000 2.015 215 A HA -0.064 4.261 4.320 0.008 0.000 0.219 215 A C 2.084 179.656 177.584 -0.021 0.000 1.163 215 A CA 0.729 52.747 52.037 -0.031 0.000 0.646 215 A CB -0.298 18.688 19.000 -0.023 0.000 0.806 215 A HN 0.693 8.843 8.150 -0.000 0.000 0.448 216 L N 0.247 121.458 121.223 -0.020 0.000 2.456 216 L HA -0.107 4.238 4.340 0.008 0.000 0.224 216 L C 2.616 179.480 176.870 -0.010 0.000 1.148 216 L CA 1.547 56.374 54.840 -0.021 0.000 0.825 216 L CB -0.836 41.202 42.059 -0.034 0.000 0.937 216 L HN 0.661 8.891 8.230 -0.000 0.000 0.450 217 T N -3.711 110.845 114.554 0.004 0.000 3.085 217 T HA 0.051 4.406 4.350 0.008 0.000 0.263 217 T C 0.799 175.589 174.700 0.150 0.000 1.127 217 T CA 0.101 62.240 62.100 0.065 0.000 1.103 217 T CB -0.070 68.827 68.868 0.047 0.000 0.921 217 T HN 0.063 8.303 8.240 -0.000 0.000 0.510 218 M N 1.715 121.348 119.600 0.054 0.000 2.249 218 M HA 0.333 4.818 4.480 0.008 0.000 0.351 218 M C -1.659 174.661 176.300 0.034 0.000 1.180 218 M CA -2.363 52.940 55.300 0.004 0.000 1.127 218 M CB 1.687 34.263 32.600 -0.039 0.000 1.546 218 M HN -0.145 8.145 8.290 -0.000 0.000 0.461 219 P HA -0.032 4.388 4.420 -0.000 0.000 0.214 219 P C 0.243 177.548 177.300 0.008 0.000 1.163 219 P CA 0.838 63.950 63.100 0.022 0.000 0.883 219 P CB 0.301 31.953 31.700 -0.080 0.000 0.788 227 C N 2.150 121.404 119.300 -0.076 0.000 2.466 227 C HA 0.472 4.937 4.460 0.008 0.000 0.379 227 C C 0.427 175.410 174.990 -0.012 0.000 1.251 227 C CA -0.734 58.235 59.018 -0.080 0.000 2.263 227 C CB 0.751 28.391 27.740 -0.166 0.000 2.511 227 C HN 0.472 8.702 8.230 -0.000 0.000 0.573 228 V N 3.844 123.776 119.914 0.031 0.000 2.740 228 V HA 0.336 4.461 4.120 0.008 0.000 0.303 228 V C 0.580 176.746 176.094 0.119 0.000 1.054 228 V CA 0.466 62.831 62.300 0.108 0.000 1.106 228 V CB 0.928 32.837 31.823 0.143 0.000 0.957 228 V HN 1.093 9.283 8.190 -0.000 0.000 0.486 229 S N 4.704 120.507 115.700 0.173 0.000 2.566 229 S HA 0.896 5.371 4.470 0.008 0.000 0.298 229 S C -0.886 173.895 174.600 0.301 0.000 1.083 229 S CA -0.777 57.504 58.200 0.136 0.000 0.978 229 S CB 2.011 65.231 63.200 0.033 0.000 1.073 229 S HN 0.673 8.983 8.310 -0.000 0.000 0.491 230 F N -0.948 119.078 119.950 0.126 0.000 2.593 230 F HA 1.031 5.562 4.527 0.008 0.000 0.320 230 F C 0.095 175.978 175.800 0.138 0.000 1.060 230 F CA -0.479 57.619 58.000 0.164 0.000 0.940 230 F CB 1.416 40.469 39.000 0.089 0.000 1.268 230 F HN 1.037 9.337 8.300 -0.000 0.000 0.475 231 G N 0.623 109.597 108.800 0.290 0.000 2.488 231 G HA2 0.408 4.373 3.960 0.008 0.000 0.301 231 G HA3 0.408 4.373 3.960 0.008 0.000 0.301 231 G C -0.921 174.131 174.900 0.254 0.000 1.339 231 G CA -0.271 44.923 45.100 0.157 0.000 0.803 231 G HN 0.713 9.003 8.290 -0.000 0.000 0.482 232 V N 0.454 120.489 119.914 0.201 0.000 2.300 232 V HA 0.006 4.131 4.120 0.008 0.000 0.241 232 V C 2.013 178.245 176.094 0.230 0.000 1.034 232 V CA 1.767 64.210 62.300 0.238 0.000 1.021 232 V CB -0.260 31.698 31.823 0.225 0.000 0.662 232 V HN 0.652 8.842 8.190 -0.000 0.000 0.458 233 N N -0.960 117.836 118.700 0.161 0.000 2.294 233 N HA 0.256 5.001 4.740 0.008 0.000 0.186 233 N C 0.394 175.904 175.510 0.000 0.000 1.107 233 N CA 0.314 53.425 53.050 0.102 0.000 0.884 233 N CB 0.653 39.189 38.487 0.082 0.000 1.030 233 N HN 0.409 8.789 8.380 -0.000 0.000 0.482 234 M N -0.375 119.244 119.600 0.031 0.000 2.724 234 M HA 0.588 5.073 4.480 0.008 0.000 0.310 234 M C 0.237 176.580 176.300 0.071 0.000 1.217 234 M CA -0.658 54.632 55.300 -0.017 0.000 0.894 234 M CB 2.609 35.201 32.600 -0.014 0.000 1.719 234 M HN 0.044 8.334 8.290 -0.000 0.000 0.479 235 G N 0.542 109.380 108.800 0.065 0.000 2.428 235 G HA2 -0.083 3.882 3.960 0.008 0.000 0.681 235 G HA3 -0.083 3.882 3.960 0.008 0.000 0.681 235 G C -0.637 174.423 174.900 0.266 0.000 1.340 235 G CA -0.792 44.405 45.100 0.162 0.000 0.915 235 G HN 0.737 9.027 8.290 -0.000 0.000 0.645 236 D N -0.645 119.900 120.400 0.241 0.000 2.149 236 D HA -0.049 4.596 4.640 0.008 0.000 0.198 236 D C 0.444 176.784 176.300 0.067 0.000 0.990 236 D CA 1.775 55.881 54.000 0.176 0.000 0.839 236 D CB 0.015 40.940 40.800 0.208 0.000 0.948 236 D HN 0.353 8.723 8.370 -0.000 0.000 0.460 237 Y N 0.612 121.014 120.300 0.171 0.000 2.328 237 Y HA 0.293 4.848 4.550 0.008 0.000 0.337 237 Y C 0.781 176.764 175.900 0.138 0.000 0.966 237 Y CA -0.731 57.420 58.100 0.084 0.000 1.136 237 Y CB 1.019 39.548 38.460 0.114 0.000 1.170 237 Y HN 0.013 8.293 8.280 -0.000 0.000 0.470 238 H N 1.502 120.681 119.070 0.182 0.000 2.960 238 H HA 0.608 5.169 4.556 0.008 0.000 0.323 238 H C -1.780 173.600 175.328 0.086 0.000 1.326 238 H CA -1.216 54.918 56.048 0.143 0.000 1.124 238 H CB 1.027 30.843 29.762 0.089 0.000 1.853 238 H HN 0.550 8.830 8.280 -0.000 0.000 0.536 239 L N 0.886 122.203 121.223 0.157 0.000 2.360 239 L HA 0.382 4.727 4.340 0.008 0.000 0.271 239 L C 0.404 177.241 176.870 -0.056 0.000 1.057 239 L CA -0.690 54.137 54.840 -0.023 0.000 0.803 239 L CB 1.336 43.344 42.059 -0.084 0.000 1.207 239 L HN 0.632 8.862 8.230 -0.000 0.000 0.445 240 N N 0.876 119.483 118.700 -0.156 0.000 2.504 240 N HA 0.277 5.022 4.740 0.008 0.000 0.280 240 N C -0.973 174.473 175.510 -0.107 0.000 1.052 240 N CA -0.575 52.432 53.050 -0.072 0.000 0.887 240 N CB 0.970 39.457 38.487 0.000 0.000 1.323 240 N HN 0.623 9.003 8.380 -0.000 0.000 0.509 246 T N 0.925 115.424 114.554 -0.092 0.000 2.861 246 T HA 0.548 4.903 4.350 0.008 0.000 0.287 246 T C -1.347 173.181 174.700 -0.285 0.000 1.003 246 T CA -0.617 61.425 62.100 -0.097 0.000 0.977 246 T CB 0.700 69.487 68.868 -0.135 0.000 0.996 246 T HN 0.246 8.486 8.240 -0.000 0.000 0.448 247 W N 2.162 123.327 121.300 -0.226 0.000 2.666 247 W HA 0.623 5.288 4.660 0.009 0.000 0.334 247 W C -0.642 175.755 176.519 -0.204 0.000 1.051 247 W CA -1.018 56.212 57.345 -0.192 0.000 1.224 247 W CB 0.994 30.373 29.460 -0.135 0.000 1.405 247 W HN 0.368 8.548 8.180 -0.000 0.000 0.513 248 L N 4.354 125.621 121.223 0.072 0.000 2.319 248 L HA 0.501 4.846 4.340 0.008 0.000 0.280 248 L C 0.480 177.352 176.870 0.004 0.000 1.099 248 L CA -0.377 54.475 54.840 0.020 0.000 0.828 248 L CB 0.194 42.264 42.059 0.019 0.000 1.150 248 L HN 0.383 8.613 8.230 -0.000 0.000 0.442 249 R N 2.623 123.027 120.500 -0.160 0.000 2.750 249 R HA 0.664 5.009 4.340 0.008 0.000 0.281 249 R C -1.310 174.745 176.300 -0.408 0.000 0.972 249 R CA -0.892 55.028 56.100 -0.300 0.000 0.912 249 R CB 2.821 32.840 30.300 -0.470 0.000 1.187 249 R HN 0.300 8.570 8.270 -0.000 0.000 0.464 250 V N 3.079 122.788 119.914 -0.341 0.000 2.349 250 V HA 0.191 4.316 4.120 0.008 0.000 0.284 250 V C -0.003 175.921 176.094 -0.283 0.000 1.014 250 V CA -0.827 61.193 62.300 -0.466 0.000 0.826 250 V CB 1.027 32.557 31.823 -0.488 0.000 1.009 250 V HN 0.763 8.953 8.190 -0.000 0.000 0.431 251 K N 4.087 124.384 120.400 -0.171 0.000 3.419 251 K HA -0.245 4.080 4.320 0.008 0.000 0.272 251 K C 1.188 177.811 176.600 0.037 0.000 0.973 251 K CA 0.708 57.002 56.287 0.011 0.000 0.749 251 K CB -1.297 31.166 32.500 -0.061 0.000 1.403 251 K HN 1.481 9.731 8.250 -0.000 0.000 0.456 252 G N -0.051 108.828 108.800 0.133 0.000 2.253 252 G HA2 -0.372 3.593 3.960 0.008 0.000 0.251 252 G HA3 -0.372 3.593 3.960 0.008 0.000 0.251 252 G C -0.093 174.786 174.900 -0.035 0.000 0.998 252 G CA 0.457 45.604 45.100 0.078 0.000 0.621 252 G HN 0.545 8.835 8.290 -0.000 0.000 0.524 253 E N 1.312 121.462 120.200 -0.083 0.000 2.200 253 E HA 0.481 4.836 4.350 0.008 0.000 0.283 253 E C 0.200 176.721 176.600 -0.132 0.000 1.015 253 E CA -0.700 55.635 56.400 -0.108 0.000 0.819 253 E CB 0.352 29.997 29.700 -0.092 0.000 1.081 253 E HN 0.291 8.651 8.360 -0.000 0.000 0.397 254 K N 2.896 123.194 120.400 -0.169 0.000 2.416 254 K HA 0.024 4.349 4.320 0.008 0.000 0.283 254 K C 0.775 177.369 176.600 -0.011 0.000 1.037 254 K CA 0.016 56.212 56.287 -0.150 0.000 0.995 254 K CB 0.994 33.212 32.500 -0.469 0.000 0.938 254 K HN 0.490 8.740 8.250 -0.000 0.000 0.475 255 V N 1.443 121.407 119.914 0.083 0.000 3.572 255 V HA 0.315 4.440 4.120 0.008 0.000 0.260 255 V C -0.211 175.976 176.094 0.155 0.000 1.324 255 V CA -0.120 62.234 62.300 0.090 0.000 1.068 255 V CB 0.210 32.053 31.823 0.034 0.000 0.837 255 V HN 0.496 8.686 8.190 -0.000 0.000 0.450 256 L N 1.720 123.079 121.223 0.226 0.000 2.611 256 L HA 0.577 4.922 4.340 0.008 0.000 0.260 256 L C -1.230 175.589 176.870 -0.084 0.000 0.924 256 L CA -0.249 54.646 54.840 0.091 0.000 0.901 256 L CB 1.982 44.041 42.059 0.001 0.000 1.369 256 L HN 0.204 8.434 8.230 -0.000 0.000 0.415 257 N N 2.979 121.353 118.700 -0.542 0.000 2.430 257 N HA 0.130 4.875 4.740 0.008 0.000 0.265 257 N C 1.057 176.206 175.510 -0.602 0.000 1.100 257 N CA 0.260 52.622 53.050 -1.148 0.000 0.961 257 N CB 1.737 39.322 38.487 -1.504 0.000 1.075 257 N HN 0.632 9.012 8.380 -0.000 0.000 0.478 258 V N 2.815 122.380 119.914 -0.581 0.000 3.383 258 V HA -0.138 3.987 4.120 0.008 0.000 0.272 258 V C 1.928 177.841 176.094 -0.302 0.000 1.181 258 V CA 1.483 63.501 62.300 -0.470 0.000 1.171 258 V CB -0.906 30.367 31.823 -0.916 0.000 0.800 258 V HN 0.763 8.953 8.190 -0.000 0.000 0.515 259 K N 0.266 120.482 120.400 -0.308 0.000 2.362 259 K HA -0.106 4.219 4.320 0.008 0.000 0.200 259 K C 1.592 178.114 176.600 -0.131 0.000 1.046 259 K CA 1.515 57.693 56.287 -0.182 0.000 0.952 259 K CB -0.260 32.126 32.500 -0.190 0.000 0.753 259 K HN 0.473 8.723 8.250 -0.000 0.000 0.466 260 E N 0.757 120.863 120.200 -0.157 0.000 2.358 260 E HA 0.042 4.397 4.350 0.008 0.000 0.195 260 E C 0.585 177.158 176.600 -0.046 0.000 1.010 260 E CA 0.517 56.861 56.400 -0.094 0.000 0.856 260 E CB -0.059 29.580 29.700 -0.101 0.000 0.795 260 E HN 0.463 8.823 8.360 -0.000 0.000 0.504 261 M N 0.839 120.416 119.600 -0.037 0.000 2.250 261 M HA 0.086 4.571 4.480 0.008 0.000 0.344 261 M C 1.349 177.673 176.300 0.040 0.000 1.150 261 M CA -0.237 55.080 55.300 0.028 0.000 1.147 261 M CB 0.966 33.615 32.600 0.081 0.000 1.498 261 M HN -0.320 7.970 8.290 -0.000 0.000 0.461 262 K N 1.754 122.180 120.400 0.043 0.000 2.116 262 K HA 0.203 4.528 4.320 0.008 0.000 0.203 262 K C 0.574 177.189 176.600 0.025 0.000 1.052 262 K CA 0.767 57.064 56.287 0.016 0.000 0.952 262 K CB -0.277 32.209 32.500 -0.024 0.000 0.729 262 K HN 0.605 8.855 8.250 -0.000 0.000 0.446 263 L N 1.878 123.130 121.223 0.049 0.000 2.483 263 L HA -0.002 4.343 4.340 0.008 0.000 0.275 263 L C 0.394 177.288 176.870 0.039 0.000 1.220 263 L CA 0.270 55.125 54.840 0.025 0.000 0.833 263 L CB 0.466 42.556 42.059 0.052 0.000 1.102 263 L HN 0.035 8.265 8.230 -0.000 0.000 0.490 264 S N -0.254 115.381 115.700 -0.109 0.000 2.697 264 S HA 0.872 5.347 4.470 0.008 0.000 0.289 264 S C -0.213 174.050 174.600 -0.563 0.000 1.149 264 S CA -0.169 57.910 58.200 -0.202 0.000 0.850 264 S CB 2.020 65.193 63.200 -0.045 0.000 1.151 264 S HN 1.089 9.399 8.310 -0.000 0.000 0.491 265 G N 0.755 109.155 108.800 -0.667 0.000 2.907 265 G HA2 -0.120 3.845 3.960 0.008 0.000 0.686 265 G HA3 -0.120 3.845 3.960 0.008 0.000 0.686 265 G C 0.069 174.462 174.900 -0.845 0.000 1.115 265 G CA 0.032 44.792 45.100 -0.568 0.000 0.760 265 G HN 0.689 8.979 8.290 -0.000 0.000 0.620 266 Q N 0.561 120.172 119.800 -0.314 0.000 2.135 266 Q HA -0.230 4.115 4.340 0.008 0.000 0.204 266 Q C 2.367 178.333 176.000 -0.057 0.000 0.981 266 Q CA 2.228 57.989 55.803 -0.071 0.000 0.856 266 Q CB -0.165 28.656 28.738 0.138 0.000 0.902 266 Q HN 0.986 9.256 8.270 -0.000 0.000 0.425 267 H N -1.131 117.865 119.070 -0.123 0.000 2.457 267 H HA -0.015 4.546 4.556 0.008 0.000 0.294 267 H C 1.153 176.432 175.328 -0.081 0.000 1.064 267 H CA 1.210 57.224 56.048 -0.057 0.000 1.330 267 H CB -0.131 29.594 29.762 -0.062 0.000 1.395 267 H HN 0.273 8.553 8.280 -0.000 0.000 0.541 268 N N 0.490 118.749 118.700 -0.735 0.000 2.409 268 N HA -0.083 4.662 4.740 0.008 0.000 0.179 268 N C 1.333 176.731 175.510 -0.187 0.000 1.032 268 N CA 0.503 53.256 53.050 -0.495 0.000 0.898 268 N CB -0.240 37.890 38.487 -0.594 0.000 0.971 268 N HN 0.351 8.731 8.380 -0.000 0.000 0.441 269 Y N 1.149 121.401 120.300 -0.078 0.000 2.263 269 Y HA -0.049 4.506 4.550 0.008 0.000 0.292 269 Y C 2.680 178.584 175.900 0.006 0.000 1.130 269 Y CA 1.039 59.127 58.100 -0.021 0.000 1.179 269 Y CB -1.275 37.195 38.460 0.017 0.000 0.998 269 Y HN 0.128 8.408 8.280 -0.000 0.000 0.532 270 T N -2.239 112.424 114.554 0.182 0.000 2.904 270 T HA -0.121 4.234 4.350 0.008 0.000 0.267 270 T C 1.682 176.345 174.700 -0.062 0.000 1.059 270 T CA 1.285 63.488 62.100 0.172 0.000 1.137 270 T CB -0.365 68.702 68.868 0.332 0.000 0.879 270 T HN 0.152 8.392 8.240 -0.000 0.000 0.467 271 N N 2.303 120.966 118.700 -0.062 0.000 2.120 271 N HA 0.062 4.807 4.740 0.008 0.000 0.188 271 N C 2.220 177.622 175.510 -0.180 0.000 1.024 271 N CA 1.530 54.489 53.050 -0.153 0.000 0.852 271 N CB -0.807 37.629 38.487 -0.085 0.000 1.003 271 N HN 0.625 9.005 8.380 -0.000 0.000 0.424 272 A N 1.071 123.844 122.820 -0.078 0.000 1.933 272 A HA -0.039 4.286 4.320 0.008 0.000 0.218 272 A C 2.369 179.893 177.584 -0.099 0.000 1.175 272 A CA 0.837 52.840 52.037 -0.056 0.000 0.628 272 A CB -0.671 18.356 19.000 0.045 0.000 0.814 272 A HN 0.211 8.361 8.150 -0.000 0.000 0.444 273 L N -0.762 120.405 121.223 -0.092 0.000 2.017 273 L HA -0.216 4.129 4.340 0.008 0.000 0.208 273 L C 3.139 179.777 176.870 -0.387 0.000 1.073 273 L CA 1.145 55.928 54.840 -0.094 0.000 0.745 273 L CB -0.680 41.422 42.059 0.072 0.000 0.894 273 L HN 0.439 8.669 8.230 -0.000 0.000 0.432 274 A N 0.184 122.580 122.820 -0.706 0.000 1.883 274 A HA -0.234 4.091 4.320 0.008 0.000 0.217 274 A C 2.543 179.851 177.584 -0.460 0.000 1.186 274 A CA 2.022 53.543 52.037 -0.859 0.000 0.624 274 A CB -0.832 17.519 19.000 -1.082 0.000 0.822 274 A HN 0.421 8.571 8.150 -0.000 0.000 0.444 275 A N -0.822 121.796 122.820 -0.337 0.000 1.902 275 A HA -0.049 4.276 4.320 0.008 0.000 0.217 275 A C 2.151 179.615 177.584 -0.200 0.000 1.181 275 A CA 1.799 53.698 52.037 -0.230 0.000 0.623 275 A CB -0.592 18.293 19.000 -0.192 0.000 0.818 275 A HN 0.669 8.819 8.150 -0.000 0.000 0.443 276 L N -0.445 120.659 121.223 -0.198 0.000 2.093 276 L HA 0.016 4.361 4.340 0.008 0.000 0.208 276 L C 2.684 179.421 176.870 -0.222 0.000 1.085 276 L CA 1.950 56.719 54.840 -0.118 0.000 0.755 276 L CB -0.743 41.324 42.059 0.013 0.000 0.904 276 L HN 0.343 8.573 8.230 -0.000 0.000 0.435 277 A N -0.443 122.010 122.820 -0.612 0.000 1.877 277 A HA -0.185 4.140 4.320 0.008 0.000 0.216 277 A C 2.239 179.650 177.584 -0.289 0.000 1.186 277 A CA 2.081 53.627 52.037 -0.818 0.000 0.620 277 A CB -0.901 17.467 19.000 -1.053 0.000 0.822 277 A HN 0.482 8.632 8.150 -0.000 0.000 0.443 278 L N -0.831 120.259 121.223 -0.221 0.000 2.017 278 L HA -0.180 4.165 4.340 0.008 0.000 0.208 278 L C 3.105 179.936 176.870 -0.066 0.000 1.073 278 L CA 1.117 55.893 54.840 -0.107 0.000 0.745 278 L CB -0.600 41.400 42.059 -0.099 0.000 0.894 278 L HN 0.425 8.655 8.230 -0.000 0.000 0.432 279 A N -0.174 122.601 122.820 -0.075 0.000 1.902 279 A HA -0.231 4.094 4.320 0.008 0.000 0.217 279 A C 1.931 179.511 177.584 -0.007 0.000 1.181 279 A CA 1.987 54.001 52.037 -0.038 0.000 0.623 279 A CB -0.529 18.447 19.000 -0.041 0.000 0.818 279 A HN 0.353 8.503 8.150 -0.000 0.000 0.443 280 D N 0.113 120.518 120.400 0.008 0.000 2.097 280 D HA -0.070 4.575 4.640 0.008 0.000 0.195 280 D C 2.228 178.555 176.300 0.046 0.000 0.989 280 D CA 1.649 55.683 54.000 0.056 0.000 0.827 280 D CB -0.459 40.429 40.800 0.146 0.000 0.966 280 D HN 0.419 8.789 8.370 -0.000 0.000 0.456 281 A N 0.735 123.574 122.820 0.031 0.000 1.969 281 A HA 0.020 4.345 4.320 0.008 0.000 0.218 281 A C 2.169 179.769 177.584 0.027 0.000 1.169 281 A CA 1.790 53.847 52.037 0.033 0.000 0.635 281 A CB -0.473 18.543 19.000 0.027 0.000 0.810 281 A HN 0.222 8.371 8.150 -0.000 0.000 0.445 282 A N -1.798 121.032 122.820 0.017 0.000 2.235 282 A HA 0.392 4.717 4.320 0.008 0.000 0.208 282 A C 1.798 179.392 177.584 0.016 0.000 1.172 282 A CA 1.253 53.300 52.037 0.017 0.000 0.786 282 A CB -0.916 18.089 19.000 0.010 0.000 0.804 282 A HN 1.867 10.017 8.150 -0.000 0.000 0.479 283 G N -1.414 107.398 108.800 0.018 0.000 2.141 283 G HA2 -0.205 3.760 3.960 0.008 0.000 0.242 283 G HA3 -0.205 3.760 3.960 0.008 0.000 0.242 283 G C 0.083 174.991 174.900 0.013 0.000 0.982 283 G CA 0.187 45.298 45.100 0.017 0.000 0.662 283 G HN 0.430 8.720 8.290 -0.000 0.000 0.527 284 L N 1.131 122.360 121.223 0.010 0.000 2.426 284 L HA 0.371 4.716 4.340 0.008 0.000 0.271 284 L C -1.555 175.322 176.870 0.012 0.000 1.169 284 L CA -1.872 52.972 54.840 0.005 0.000 0.836 284 L CB 0.401 42.459 42.059 -0.002 0.000 1.112 284 L HN -0.076 8.154 8.230 -0.000 0.000 0.465 285 P HA 0.072 4.492 4.420 -0.000 0.000 0.267 285 P C 0.171 177.481 177.300 0.017 0.000 1.209 285 P CA -0.183 62.925 63.100 0.013 0.000 0.763 285 P CB 0.595 32.301 31.700 0.009 0.000 0.816 286 R N 3.596 124.110 120.500 0.024 0.000 2.127 286 R HA -0.198 4.147 4.340 0.008 0.000 0.238 286 R C 1.843 178.158 176.300 0.024 0.000 1.134 286 R CA 1.815 57.933 56.100 0.031 0.000 0.975 286 R CB -0.584 29.739 30.300 0.038 0.000 0.865 286 R HN 0.558 8.828 8.270 -0.000 0.000 0.447 287 A N 0.340 123.171 122.820 0.019 0.000 1.865 287 A HA -0.202 4.123 4.320 0.008 0.000 0.217 287 A C 2.154 179.747 177.584 0.015 0.000 1.191 287 A CA 2.115 54.162 52.037 0.017 0.000 0.623 287 A CB -0.751 18.258 19.000 0.014 0.000 0.826 287 A HN 0.576 8.726 8.150 -0.000 0.000 0.444 288 S N -0.421 115.286 115.700 0.012 0.000 2.423 288 S HA -0.087 4.388 4.470 0.008 0.000 0.231 288 S C 1.974 176.579 174.600 0.008 0.000 1.014 288 S CA 1.348 59.553 58.200 0.009 0.000 0.965 288 S CB -0.517 62.687 63.200 0.006 0.000 0.785 288 S HN 0.442 8.752 8.310 -0.000 0.000 0.495 289 S N 2.257 117.961 115.700 0.007 0.000 2.382 289 S HA 0.122 4.597 4.470 0.008 0.000 0.228 289 S C 1.764 176.368 174.600 0.006 0.000 1.027 289 S CA 1.113 59.314 58.200 0.001 0.000 0.991 289 S CB -0.522 62.680 63.200 0.004 0.000 0.823 289 S HN 0.441 8.751 8.310 -0.000 0.000 0.469 290 L N 1.057 122.289 121.223 0.016 0.000 2.093 290 L HA -0.095 4.250 4.340 0.008 0.000 0.208 290 L C 2.377 179.257 176.870 0.017 0.000 1.085 290 L CA 1.105 55.956 54.840 0.018 0.000 0.755 290 L CB -0.445 41.628 42.059 0.024 0.000 0.904 290 L HN 0.231 8.461 8.230 -0.000 0.000 0.435 291 K N 0.376 120.786 120.400 0.017 0.000 2.044 291 K HA -0.202 4.123 4.320 0.008 0.000 0.210 291 K C 2.246 178.863 176.600 0.028 0.000 1.049 291 K CA 1.621 57.919 56.287 0.019 0.000 0.927 291 K CB -0.399 32.111 32.500 0.017 0.000 0.713 291 K HN 0.288 8.538 8.250 -0.000 0.000 0.443 292 A N 1.345 124.181 122.820 0.026 0.000 1.978 292 A HA -0.142 4.183 4.320 0.008 0.000 0.220 292 A C 2.098 179.720 177.584 0.063 0.000 1.170 292 A CA 1.290 53.349 52.037 0.037 0.000 0.636 292 A CB -0.646 18.358 19.000 0.006 0.000 0.810 292 A HN 0.193 8.343 8.150 -0.000 0.000 0.448 293 L N -0.167 121.081 121.223 0.043 0.000 2.191 293 L HA -0.142 4.202 4.340 0.008 0.000 0.212 293 L C 2.857 179.777 176.870 0.083 0.000 1.103 293 L CA 1.729 56.606 54.840 0.062 0.000 0.769 293 L CB -0.611 41.468 42.059 0.032 0.000 0.908 293 L HN 0.686 8.916 8.230 -0.000 0.000 0.438 294 T N -5.233 109.354 114.554 0.055 0.000 3.067 294 T HA -0.065 4.290 4.350 0.008 0.000 0.261 294 T C 1.667 176.398 174.700 0.051 0.000 1.110 294 T CA 0.989 63.112 62.100 0.039 0.000 1.113 294 T CB -0.248 68.628 68.868 0.014 0.000 0.917 294 T HN 0.411 8.651 8.240 -0.000 0.000 0.499 295 T N -1.487 113.114 114.554 0.077 0.000 3.040 295 T HA 0.290 4.645 4.350 0.008 0.000 0.252 295 T C 0.377 175.137 174.700 0.100 0.000 1.064 295 T CA -0.602 61.541 62.100 0.072 0.000 1.110 295 T CB -0.661 68.249 68.868 0.070 0.000 0.921 295 T HN 0.272 8.512 8.240 -0.000 0.000 0.480 296 F N 4.536 124.487 119.950 0.002 0.000 2.578 296 F HA 0.325 4.857 4.527 0.009 0.000 0.381 296 F C 1.529 177.333 175.800 0.006 0.000 1.069 296 F CA -0.181 57.821 58.000 0.003 0.000 1.231 296 F CB 1.039 40.038 39.000 -0.000 0.000 1.086 296 F HN 0.196 8.496 8.300 -0.000 0.000 0.564 297 T N 2.022 116.145 114.554 -0.719 0.000 3.037 297 T HA 0.564 4.919 4.350 0.008 0.000 0.251 297 T C 0.810 175.111 174.700 -0.665 0.000 1.079 297 T CA 0.244 62.038 62.100 -0.510 0.000 1.067 297 T CB -0.431 68.263 68.868 -0.289 0.000 0.948 297 T HN 1.284 9.524 8.240 -0.000 0.000 0.496 298 G N 0.679 108.649 108.800 -1.383 0.000 2.353 298 G HA2 0.214 4.179 3.960 0.008 0.000 0.615 298 G HA3 0.214 4.179 3.960 0.008 0.000 0.615 298 G C -1.679 173.005 174.900 -0.359 0.000 1.280 298 G CA -0.894 43.785 45.100 -0.701 0.000 1.000 298 G HN 0.456 8.746 8.290 -0.000 0.000 0.516 299 L N 0.616 121.829 121.223 -0.017 0.000 2.333 299 L HA 0.569 4.914 4.340 0.008 0.000 0.269 299 L C -2.070 174.813 176.870 0.021 0.000 1.010 299 L CA -2.136 52.752 54.840 0.079 0.000 0.818 299 L CB 2.278 44.454 42.059 0.195 0.000 1.306 299 L HN 0.363 8.593 8.230 -0.000 0.000 0.430 300 P HA 0.024 4.444 4.420 -0.000 0.000 0.265 300 P C -0.412 176.820 177.300 -0.113 0.000 1.187 300 P CA 0.381 63.353 63.100 -0.213 0.000 0.766 300 P CB 0.161 31.677 31.700 -0.307 0.000 0.820 301 H N -1.505 117.637 119.070 0.119 0.000 3.641 301 H HA -0.176 4.385 4.556 0.008 0.000 0.193 301 H C 0.365 175.747 175.328 0.090 0.000 1.013 301 H CA 0.893 57.022 56.048 0.135 0.000 1.212 301 H CB -1.170 28.772 29.762 0.300 0.000 1.089 301 H HN 0.347 8.627 8.280 -0.000 0.000 0.339 302 R N 0.309 120.897 120.500 0.148 0.000 2.287 302 R HA 0.296 4.641 4.340 0.008 0.000 0.316 302 R C -0.528 175.888 176.300 0.193 0.000 1.050 302 R CA -1.001 55.187 56.100 0.147 0.000 0.983 302 R CB -1.023 29.361 30.300 0.141 0.000 1.140 302 R HN 0.151 8.421 8.270 -0.000 0.000 0.528 303 F N 1.675 121.638 119.950 0.022 0.000 2.861 303 F HA -0.299 4.233 4.527 0.008 0.000 0.230 303 F C -0.195 175.617 175.800 0.020 0.000 1.020 303 F CA 1.388 59.397 58.000 0.016 0.000 0.852 303 F CB -0.114 38.901 39.000 0.026 0.000 0.724 303 F HN 0.667 8.967 8.300 -0.000 0.000 0.843 304 E N 1.306 121.479 120.200 -0.045 0.000 2.115 304 E HA 0.404 4.759 4.350 0.008 0.000 0.282 304 E C -0.433 176.142 176.600 -0.041 0.000 0.987 304 E CA -0.683 55.705 56.400 -0.020 0.000 0.797 304 E CB 0.994 30.680 29.700 -0.024 0.000 1.086 304 E HN 0.148 8.508 8.360 -0.000 0.000 0.397 305 V N 6.411 126.318 119.914 -0.013 0.000 2.425 305 V HA -0.045 4.080 4.120 0.008 0.000 0.276 305 V C 1.291 177.420 176.094 0.058 0.000 1.017 305 V CA 0.213 62.529 62.300 0.027 0.000 1.062 305 V CB 0.532 32.384 31.823 0.048 0.000 0.997 305 V HN 0.719 8.909 8.190 -0.000 0.000 0.476 306 V N 3.238 123.219 119.914 0.112 0.000 3.471 306 V HA 0.437 4.562 4.120 0.008 0.000 0.258 306 V C 0.189 176.298 176.094 0.025 0.000 1.192 306 V CA 0.378 62.723 62.300 0.074 0.000 1.116 306 V CB 0.361 32.254 31.823 0.116 0.000 0.792 306 V HN 0.545 8.735 8.190 -0.000 0.000 0.459 307 L N 0.703 121.977 121.223 0.085 0.000 2.588 307 L HA 0.634 4.979 4.340 0.008 0.000 0.263 307 L C -1.223 175.770 176.870 0.206 0.000 0.935 307 L CA -0.438 54.429 54.840 0.045 0.000 0.891 307 L CB 2.093 44.043 42.059 -0.181 0.000 1.318 307 L HN 0.308 8.538 8.230 -0.000 0.000 0.409 308 E N 4.512 124.812 120.200 0.167 0.000 2.235 308 E HA 0.394 4.749 4.350 0.008 0.000 0.252 308 E C -1.770 174.973 176.600 0.238 0.000 0.886 308 E CA -0.464 56.063 56.400 0.211 0.000 0.767 308 E CB 0.730 30.513 29.700 0.138 0.000 1.205 308 E HN 0.758 9.118 8.360 -0.000 0.000 0.421 309 H N 4.612 123.765 119.070 0.138 0.000 3.029 309 H HA 0.187 4.751 4.556 0.013 0.000 0.358 309 H C -0.538 174.857 175.328 0.112 0.000 1.129 309 H CA -0.530 55.571 56.048 0.088 0.000 1.230 309 H CB 0.960 30.744 29.762 0.037 0.000 1.827 309 H HN 0.641 8.921 8.280 -0.000 0.000 0.530 310 N N 2.673 121.142 118.700 -0.386 0.000 2.747 310 N HA -0.168 4.577 4.740 0.008 0.000 0.249 310 N C 0.900 176.355 175.510 -0.092 0.000 1.107 310 N CA 1.705 54.569 53.050 -0.309 0.000 0.707 310 N CB -1.497 36.747 38.487 -0.406 0.000 1.054 310 N HN 1.058 9.438 8.380 -0.000 0.000 0.555 311 G N -2.541 106.243 108.800 -0.025 0.000 2.143 311 G HA2 -0.258 3.707 3.960 0.008 0.000 0.248 311 G HA3 -0.258 3.707 3.960 0.008 0.000 0.248 311 G C -0.179 174.735 174.900 0.023 0.000 0.991 311 G CA 0.340 45.445 45.100 0.009 0.000 0.689 311 G HN 0.602 8.892 8.290 -0.000 0.000 0.522 312 V N 0.082 120.032 119.914 0.060 0.000 2.531 312 V HA 0.597 4.722 4.120 0.008 0.000 0.301 312 V C 0.449 176.618 176.094 0.125 0.000 1.034 312 V CA -1.038 61.287 62.300 0.040 0.000 0.865 312 V CB 1.765 33.603 31.823 0.026 0.000 0.995 312 V HN 0.350 8.540 8.190 -0.000 0.000 0.424 313 R N 3.150 123.674 120.500 0.040 0.000 2.265 313 R HA 0.424 4.769 4.340 0.008 0.000 0.319 313 R C -1.595 174.725 176.300 0.033 0.000 1.006 313 R CA -0.292 55.872 56.100 0.107 0.000 0.880 313 R CB 1.207 31.545 30.300 0.064 0.000 1.077 313 R HN 0.632 8.902 8.270 -0.000 0.000 0.454 314 W N 4.874 126.204 121.300 0.051 0.000 2.329 314 W HA 0.440 5.103 4.660 0.004 0.000 0.312 314 W C -0.391 176.224 176.519 0.161 0.000 1.054 314 W CA -0.333 57.090 57.345 0.130 0.000 1.245 314 W CB 0.712 30.199 29.460 0.044 0.000 1.255 314 W HN 0.305 8.485 8.180 -0.000 0.000 0.436 315 I N 3.959 124.686 120.570 0.261 0.000 2.382 315 I HA 0.129 4.304 4.170 0.008 0.000 0.286 315 I C -0.059 175.928 176.117 -0.216 0.000 1.002 315 I CA -0.969 60.281 61.300 -0.084 0.000 1.135 315 I CB 1.302 38.987 38.000 -0.526 0.000 1.288 315 I HN 0.271 8.481 8.210 -0.000 0.000 0.448 316 N N 4.767 123.404 118.700 -0.106 0.000 2.439 316 N HA 0.060 4.805 4.740 0.008 0.000 0.243 316 N C -0.473 174.935 175.510 -0.169 0.000 1.088 316 N CA 0.080 52.994 53.050 -0.227 0.000 0.940 316 N CB 0.551 39.112 38.487 0.124 0.000 1.180 316 N HN 0.452 8.832 8.380 -0.000 0.000 0.505 317 D N 1.529 121.790 120.400 -0.232 0.000 2.892 317 D HA 0.141 4.786 4.640 0.008 0.000 0.291 317 D C 0.926 177.190 176.300 -0.061 0.000 1.341 317 D CA -0.099 53.855 54.000 -0.078 0.000 0.844 317 D CB 0.036 40.816 40.800 -0.033 0.000 1.093 317 D HN 0.401 8.771 8.370 -0.000 0.000 0.480 318 S N 0.059 115.742 115.700 -0.029 0.000 2.419 318 S HA -0.182 4.293 4.470 0.008 0.000 0.235 318 S C 1.804 176.394 174.600 -0.017 0.000 1.019 318 S CA 1.134 59.331 58.200 -0.005 0.000 0.982 318 S CB -0.033 63.191 63.200 0.039 0.000 0.789 318 S HN 0.319 8.629 8.310 -0.000 0.000 0.490 319 K N 0.681 121.049 120.400 -0.053 0.000 2.442 319 K HA 0.121 4.446 4.320 0.008 0.000 0.198 319 K C 0.469 176.902 176.600 -0.278 0.000 1.042 319 K CA 0.568 56.622 56.287 -0.389 0.000 0.958 319 K CB -0.206 32.134 32.500 -0.268 0.000 0.766 319 K HN 0.383 8.633 8.250 -0.000 0.000 0.474 320 A N 1.573 124.313 122.820 -0.135 0.000 2.797 320 A HA 0.037 4.362 4.320 0.008 0.000 0.296 320 A C 0.720 178.244 177.584 -0.099 0.000 1.580 320 A CA 0.037 52.012 52.037 -0.103 0.000 1.277 320 A CB -0.360 18.602 19.000 -0.064 0.000 1.101 320 A HN 0.364 8.514 8.150 -0.000 0.000 0.562 321 T N -1.262 113.220 114.554 -0.119 0.000 3.054 321 T HA 0.210 4.565 4.350 0.008 0.000 0.255 321 T C 0.292 174.949 174.700 -0.072 0.000 1.035 321 T CA 0.122 62.173 62.100 -0.083 0.000 0.941 321 T CB -0.595 68.218 68.868 -0.092 0.000 1.026 321 T HN 0.733 8.973 8.240 -0.000 0.000 0.533 322 N N -0.970 117.686 118.700 -0.073 0.000 2.697 322 N HA 0.453 5.198 4.740 0.008 0.000 0.272 322 N C 0.533 176.033 175.510 -0.017 0.000 1.381 322 N CA -1.012 52.004 53.050 -0.057 0.000 0.797 322 N CB 1.098 39.518 38.487 -0.112 0.000 1.523 322 N HN -0.190 8.190 8.380 -0.000 0.000 0.518 323 V N -0.044 119.879 119.914 0.015 0.000 2.427 323 V HA -0.037 4.088 4.120 0.008 0.000 0.248 323 V C 2.251 178.342 176.094 -0.004 0.000 1.051 323 V CA 2.427 64.754 62.300 0.046 0.000 1.048 323 V CB -1.278 30.596 31.823 0.084 0.000 0.666 323 V HN 0.902 9.092 8.190 -0.000 0.000 0.456 324 G N -1.260 107.530 108.800 -0.017 0.000 2.442 324 G HA2 -0.294 3.671 3.960 0.008 0.000 0.219 324 G HA3 -0.294 3.671 3.960 0.008 0.000 0.219 324 G C 1.930 176.779 174.900 -0.084 0.000 1.141 324 G CA 1.279 46.359 45.100 -0.034 0.000 0.763 324 G HN 0.481 8.771 8.290 -0.000 0.000 0.554 325 S N -0.283 115.367 115.700 -0.083 0.000 2.368 325 S HA -0.092 4.383 4.470 0.008 0.000 0.224 325 S C 2.533 177.053 174.600 -0.133 0.000 1.029 325 S CA 2.009 60.142 58.200 -0.112 0.000 0.988 325 S CB -0.450 62.697 63.200 -0.088 0.000 0.838 325 S HN 0.376 8.686 8.310 -0.000 0.000 0.462 326 T N 1.854 116.345 114.554 -0.106 0.000 2.867 326 T HA -0.007 4.348 4.350 0.008 0.000 0.268 326 T C 1.622 176.195 174.700 -0.212 0.000 1.057 326 T CA 1.069 63.099 62.100 -0.117 0.000 1.136 326 T CB -0.252 68.567 68.868 -0.081 0.000 0.874 326 T HN 0.499 8.739 8.240 -0.000 0.000 0.466 327 E N 1.003 121.066 120.200 -0.228 0.000 2.077 327 E HA -0.110 4.245 4.350 0.008 0.000 0.193 327 E C 2.557 178.921 176.600 -0.394 0.000 0.989 327 E CA 1.033 57.208 56.400 -0.376 0.000 0.800 327 E CB -0.196 29.402 29.700 -0.170 0.000 0.746 327 E HN 0.476 8.836 8.360 -0.000 0.000 0.452 328 A N 1.265 123.882 122.820 -0.339 0.000 1.978 328 A HA -0.139 4.186 4.320 0.008 0.000 0.220 328 A C 2.319 179.629 177.584 -0.457 0.000 1.170 328 A CA 1.705 53.437 52.037 -0.508 0.000 0.636 328 A CB -0.464 18.066 19.000 -0.784 0.000 0.810 328 A HN 0.306 8.456 8.150 -0.000 0.000 0.448 329 A N -0.533 122.109 122.820 -0.298 0.000 1.929 329 A HA 0.109 4.434 4.320 0.008 0.000 0.216 329 A C 2.092 179.578 177.584 -0.163 0.000 1.176 329 A CA 1.331 53.269 52.037 -0.165 0.000 0.628 329 A CB -0.397 18.661 19.000 0.096 0.000 0.816 329 A HN 0.458 8.608 8.150 -0.000 0.000 0.444 330 L N -0.685 120.377 121.223 -0.268 0.000 2.249 330 L HA 0.030 4.375 4.340 0.008 0.000 0.207 330 L C 0.748 177.461 176.870 -0.261 0.000 1.090 330 L CA 0.013 54.682 54.840 -0.286 0.000 0.802 330 L CB -0.469 41.301 42.059 -0.483 0.000 0.947 330 L HN 0.288 8.518 8.230 -0.000 0.000 0.453 331 N N 1.168 119.664 118.700 -0.341 0.000 2.416 331 N HA 0.136 4.881 4.740 0.008 0.000 0.271 331 N C 0.910 176.426 175.510 0.010 0.000 1.245 331 N CA 1.074 54.092 53.050 -0.053 0.000 0.940 331 N CB 0.503 38.974 38.487 -0.025 0.000 1.175 331 N HN 0.344 8.724 8.380 -0.000 0.000 0.483 332 G N 2.464 111.313 108.800 0.082 0.000 2.159 332 G HA2 -0.279 3.686 3.960 0.008 0.000 0.256 332 G HA3 -0.279 3.686 3.960 0.008 0.000 0.256 332 G C 0.047 174.980 174.900 0.056 0.000 0.977 332 G CA 0.186 45.324 45.100 0.063 0.000 0.652 332 G HN 0.640 8.930 8.290 -0.000 0.000 0.531 333 L N 1.570 122.817 121.223 0.040 0.000 2.513 333 L HA 0.570 4.915 4.340 0.008 0.000 0.272 333 L C 0.509 177.437 176.870 0.096 0.000 1.187 333 L CA -0.589 54.281 54.840 0.050 0.000 0.895 333 L CB 0.245 42.327 42.059 0.039 0.000 1.147 333 L HN 0.354 8.584 8.230 -0.000 0.000 0.483 334 H N 4.143 123.238 119.070 0.041 0.000 2.552 334 H HA 0.623 5.184 4.556 0.009 0.000 0.311 334 H C -1.261 174.098 175.328 0.050 0.000 1.071 334 H CA -0.535 55.538 56.048 0.042 0.000 1.307 334 H CB 0.969 30.753 29.762 0.037 0.000 1.416 334 H HN 0.418 8.698 8.280 -0.000 0.000 0.464 335 V N 5.992 125.531 119.914 -0.626 0.000 2.531 335 V HA 0.102 4.227 4.120 0.008 0.000 0.301 335 V C 0.396 176.183 176.094 -0.512 0.000 1.034 335 V CA -0.749 61.289 62.300 -0.436 0.000 0.865 335 V CB 1.999 33.711 31.823 -0.185 0.000 0.995 335 V HN 0.886 9.076 8.190 -0.000 0.000 0.424 336 D N 3.029 123.228 120.400 -0.335 0.000 2.149 336 D HA 0.000 4.645 4.640 0.008 0.000 0.201 336 D C 1.314 177.570 176.300 -0.074 0.000 0.972 336 D CA 1.692 55.608 54.000 -0.140 0.000 0.835 336 D CB 0.532 41.323 40.800 -0.015 0.000 0.966 336 D HN 0.718 9.088 8.370 -0.000 0.000 0.476 337 G N -0.394 108.361 108.800 -0.075 0.000 3.157 337 G HA2 0.209 4.174 3.960 0.008 0.000 0.206 337 G HA3 0.209 4.174 3.960 0.008 0.000 0.206 337 G C -0.182 174.673 174.900 -0.076 0.000 1.903 337 G CA -0.041 45.030 45.100 -0.049 0.000 0.771 337 G HN 0.029 8.319 8.290 -0.000 0.000 0.750 338 T N 0.867 115.367 114.554 -0.090 0.000 2.824 338 T HA 0.476 4.831 4.350 0.008 0.000 0.280 338 T C -0.873 173.675 174.700 -0.254 0.000 0.995 338 T CA -0.232 61.754 62.100 -0.191 0.000 1.009 338 T CB 1.849 70.558 68.868 -0.265 0.000 0.955 338 T HN 0.306 8.546 8.240 -0.000 0.000 0.452 339 L N 4.749 125.829 121.223 -0.237 0.000 2.281 339 L HA 0.296 4.641 4.340 0.008 0.000 0.285 339 L C -0.325 176.398 176.870 -0.244 0.000 1.074 339 L CA -0.106 54.632 54.840 -0.170 0.000 0.817 339 L CB 0.030 42.040 42.059 -0.081 0.000 1.168 339 L HN 0.626 8.856 8.230 -0.000 0.000 0.434 340 H N 6.601 125.688 119.070 0.030 0.000 2.724 340 H HA 0.263 4.822 4.556 0.004 0.000 0.278 340 H C -0.823 174.602 175.328 0.161 0.000 1.159 340 H CA -0.686 55.471 56.048 0.182 0.000 1.254 340 H CB 1.293 31.080 29.762 0.043 0.000 1.412 340 H HN 0.439 8.719 8.280 -0.000 0.000 0.488 341 L N 5.058 126.441 121.223 0.268 0.000 2.265 341 L HA 0.265 4.610 4.340 0.008 0.000 0.289 341 L C -0.871 176.149 176.870 0.250 0.000 1.033 341 L CA -0.478 54.462 54.840 0.167 0.000 0.814 341 L CB 0.604 42.700 42.059 0.060 0.000 1.203 341 L HN 0.390 8.620 8.230 -0.000 0.000 0.423 342 L N 6.562 127.921 121.223 0.228 0.000 2.281 342 L HA 0.444 4.789 4.340 0.008 0.000 0.285 342 L C -0.501 176.478 176.870 0.182 0.000 1.074 342 L CA 0.246 55.273 54.840 0.311 0.000 0.817 342 L CB 0.705 42.973 42.059 0.349 0.000 1.168 342 L HN 0.520 8.750 8.230 -0.000 0.000 0.434 343 L N 3.274 124.550 121.223 0.088 0.000 2.381 343 L HA 0.993 5.338 4.340 0.008 0.000 0.268 343 L C 0.285 176.807 176.870 -0.580 0.000 0.997 343 L CA -0.539 54.189 54.840 -0.187 0.000 0.818 343 L CB 2.060 43.987 42.059 -0.220 0.000 1.310 343 L HN 0.741 8.971 8.230 -0.000 0.000 0.416 344 G N 0.490 108.856 108.800 -0.722 0.000 2.359 344 G HA2 0.497 4.462 3.960 0.008 0.000 0.293 344 G HA3 0.497 4.462 3.960 0.008 0.000 0.293 344 G C -0.587 173.937 174.900 -0.627 0.000 1.300 344 G CA 0.340 44.879 45.100 -0.935 0.000 0.888 344 G HN 1.186 9.476 8.290 -0.000 0.000 0.541 345 G N -0.458 108.120 108.800 -0.370 0.000 2.384 345 G HA2 0.407 4.372 3.960 0.008 0.000 0.200 345 G HA3 0.407 4.372 3.960 0.008 0.000 0.200 345 G C -1.083 173.832 174.900 0.024 0.000 1.205 345 G CA 0.832 45.911 45.100 -0.036 0.000 1.116 345 G HN 1.793 10.083 8.290 -0.000 0.000 0.547 346 D N 0.948 121.396 120.400 0.080 0.000 2.396 346 D HA 0.536 5.181 4.640 0.008 0.000 0.225 346 D C 1.409 177.773 176.300 0.105 0.000 1.121 346 D CA 0.733 54.788 54.000 0.090 0.000 0.853 346 D CB 0.593 41.448 40.800 0.091 0.000 1.043 346 D HN 0.938 9.308 8.370 -0.000 0.000 0.500 347 G N 2.952 111.850 108.800 0.164 0.000 2.848 347 G HA2 -0.121 3.844 3.960 0.008 0.000 0.208 347 G HA3 -0.121 3.844 3.960 0.008 0.000 0.208 347 G C 0.609 175.502 174.900 -0.010 0.000 1.152 347 G CA -0.201 45.021 45.100 0.203 0.000 0.789 347 G HN 0.721 9.011 8.290 -0.000 0.000 0.531 348 K N -0.613 119.785 120.400 -0.002 0.000 3.069 348 K HA -0.218 4.107 4.320 0.008 0.000 0.267 348 K C 1.017 177.565 176.600 -0.087 0.000 1.082 348 K CA 0.410 56.679 56.287 -0.030 0.000 0.782 348 K CB -1.809 30.673 32.500 -0.030 0.000 1.230 348 K HN 0.263 8.513 8.250 -0.000 0.000 0.488 349 S N -3.075 112.555 115.700 -0.117 0.000 3.382 349 S HA -0.259 4.216 4.470 0.008 0.000 0.293 349 S C 0.447 174.897 174.600 -0.250 0.000 1.262 349 S CA 0.806 58.912 58.200 -0.156 0.000 0.969 349 S CB -1.095 62.049 63.200 -0.094 0.000 1.136 349 S HN 0.810 9.120 8.310 -0.000 0.000 0.635 350 A N 1.178 123.772 122.820 -0.376 0.000 2.425 350 A HA 0.441 4.766 4.320 0.008 0.000 0.242 350 A C 0.243 177.453 177.584 -0.622 0.000 1.077 350 A CA 0.084 51.852 52.037 -0.449 0.000 0.781 350 A CB 0.223 18.957 19.000 -0.442 0.000 1.020 350 A HN 0.349 8.499 8.150 -0.000 0.000 0.494 351 D N 0.848 121.023 120.400 -0.375 0.000 2.316 351 D HA 0.334 4.979 4.640 0.008 0.000 0.245 351 D C -0.056 176.119 176.300 -0.208 0.000 1.171 351 D CA -0.212 53.621 54.000 -0.278 0.000 0.856 351 D CB -0.028 40.700 40.800 -0.120 0.000 1.090 351 D HN 0.283 8.653 8.370 -0.000 0.000 0.476 352 F N 1.745 121.686 119.950 -0.015 0.000 2.780 352 F HA 0.013 4.546 4.527 0.010 0.000 0.299 352 F C 2.501 178.301 175.800 0.001 0.000 1.146 352 F CA -0.054 57.938 58.000 -0.013 0.000 1.428 352 F CB -0.423 38.564 39.000 -0.022 0.000 1.115 352 F HN 0.318 8.618 8.300 -0.000 0.000 0.583 353 S N 0.958 116.751 115.700 0.155 0.000 2.400 353 S HA -0.201 4.274 4.470 0.008 0.000 0.234 353 S C -0.356 174.298 174.600 0.090 0.000 1.049 353 S CA 1.674 59.932 58.200 0.097 0.000 1.039 353 S CB -1.310 61.919 63.200 0.049 0.000 0.856 353 S HN 0.269 8.579 8.310 -0.000 0.000 0.465 354 P HA -0.016 4.404 4.420 -0.000 0.000 0.221 354 P C 1.068 178.479 177.300 0.185 0.000 1.145 354 P CA 0.776 63.941 63.100 0.108 0.000 0.795 354 P CB -0.131 31.632 31.700 0.105 0.000 0.775 355 L N -1.470 119.870 121.223 0.195 0.000 2.217 355 L HA -0.066 4.279 4.340 0.008 0.000 0.211 355 L C 2.396 179.400 176.870 0.224 0.000 1.107 355 L CA 0.977 55.971 54.840 0.257 0.000 0.783 355 L CB -1.076 41.066 42.059 0.138 0.000 0.919 355 L HN -0.040 8.190 8.230 -0.000 0.000 0.442 356 A N 1.582 124.465 122.820 0.105 0.000 1.948 356 A HA -0.242 4.083 4.320 0.008 0.000 0.220 356 A C 2.346 179.927 177.584 -0.006 0.000 1.177 356 A CA 1.944 54.007 52.037 0.043 0.000 0.636 356 A CB -0.609 18.403 19.000 0.020 0.000 0.815 356 A HN 0.585 8.735 8.150 -0.000 0.000 0.449 357 R N -2.058 118.385 120.500 -0.094 0.000 2.285 357 R HA -0.063 4.282 4.340 0.008 0.000 0.213 357 R C 0.798 176.899 176.300 -0.333 0.000 1.068 357 R CA 1.424 57.373 56.100 -0.252 0.000 1.004 357 R CB -0.501 29.569 30.300 -0.383 0.000 0.873 357 R HN 0.549 8.819 8.270 -0.000 0.000 0.467 358 Y N 0.444 120.737 120.300 -0.011 0.000 2.457 358 Y HA 0.300 4.854 4.550 0.007 0.000 0.263 358 Y C 1.124 177.011 175.900 -0.021 0.000 1.164 358 Y CA -0.107 57.985 58.100 -0.013 0.000 1.274 358 Y CB 0.657 39.110 38.460 -0.012 0.000 1.097 358 Y HN -0.045 8.235 8.280 -0.000 0.000 0.523 359 L N 0.120 121.395 121.223 0.086 0.000 2.965 359 L HA 0.241 4.586 4.340 0.008 0.000 0.254 359 L C -0.173 176.698 176.870 0.001 0.000 1.220 359 L CA -0.189 54.675 54.840 0.039 0.000 1.023 359 L CB -0.189 41.886 42.059 0.026 0.000 1.355 359 L HN 0.091 8.321 8.230 -0.000 0.000 0.545 360 N N 1.187 119.885 118.700 -0.004 0.000 2.476 360 N HA 0.637 5.382 4.740 0.008 0.000 0.275 360 N C 0.484 175.985 175.510 -0.016 0.000 1.190 360 N CA 0.583 53.622 53.050 -0.017 0.000 0.977 360 N CB 1.786 40.258 38.487 -0.026 0.000 1.200 360 N HN 0.190 8.570 8.380 -0.000 0.000 0.515 361 G N 0.219 109.007 108.800 -0.020 0.000 2.592 361 G HA2 -0.170 3.795 3.960 0.008 0.000 0.684 361 G HA3 -0.170 3.795 3.960 0.008 0.000 0.684 361 G C -0.489 174.395 174.900 -0.026 0.000 1.291 361 G CA -0.584 44.505 45.100 -0.019 0.000 0.891 361 G HN 0.506 8.796 8.290 -0.000 0.000 0.544 362 D N 0.296 120.682 120.400 -0.024 0.000 2.340 362 D HA 0.024 4.669 4.640 0.008 0.000 0.220 362 D C 1.062 177.337 176.300 -0.042 0.000 1.039 362 D CA 0.420 54.403 54.000 -0.028 0.000 0.866 362 D CB 0.155 40.944 40.800 -0.019 0.000 0.913 362 D HN 0.307 8.677 8.370 -0.000 0.000 0.523 363 N N 0.689 119.359 118.700 -0.050 0.000 2.416 363 N HA 0.081 4.826 4.740 0.008 0.000 0.267 363 N C -0.399 175.049 175.510 -0.105 0.000 1.294 363 N CA 0.033 53.038 53.050 -0.075 0.000 0.891 363 N CB 2.147 40.597 38.487 -0.060 0.000 1.238 363 N HN 0.002 8.382 8.380 -0.000 0.000 0.508 364 V N -1.724 118.129 119.914 -0.102 0.000 2.686 364 V HA 0.679 4.804 4.120 0.008 0.000 0.306 364 V C -0.769 175.244 176.094 -0.136 0.000 1.065 364 V CA -0.889 61.343 62.300 -0.114 0.000 0.894 364 V CB 2.641 34.427 31.823 -0.063 0.000 1.004 364 V HN -0.114 8.076 8.190 -0.000 0.000 0.424 365 R N 4.368 124.767 120.500 -0.170 0.000 2.670 365 R HA 0.739 5.084 4.340 0.008 0.000 0.289 365 R C -1.155 174.993 176.300 -0.252 0.000 0.965 365 R CA -0.742 55.230 56.100 -0.214 0.000 0.899 365 R CB 2.196 32.409 30.300 -0.145 0.000 1.173 365 R HN 0.896 9.166 8.270 -0.000 0.000 0.456 366 L N 3.217 124.200 121.223 -0.400 0.000 2.329 366 L HA 0.530 4.875 4.340 0.008 0.000 0.279 366 L C -0.882 175.661 176.870 -0.544 0.000 1.014 366 L CA -0.929 53.734 54.840 -0.295 0.000 0.814 366 L CB 1.080 43.039 42.059 -0.166 0.000 1.257 366 L HN 0.464 8.694 8.230 -0.000 0.000 0.424 367 Y N 1.414 121.766 120.300 0.087 0.000 2.363 367 Y HA 0.400 4.953 4.550 0.005 0.000 0.325 367 Y C -0.238 175.779 175.900 0.195 0.000 0.984 367 Y CA -0.734 57.448 58.100 0.136 0.000 1.248 367 Y CB 1.552 40.108 38.460 0.161 0.000 1.116 367 Y HN 0.471 8.751 8.280 -0.000 0.000 0.470 368 C N 4.847 124.279 119.300 0.220 0.000 2.411 368 C HA 0.847 5.312 4.460 0.008 0.000 0.330 368 C C -0.274 174.838 174.990 0.204 0.000 1.224 368 C CA -1.049 58.029 59.018 0.101 0.000 1.770 368 C CB -0.572 27.139 27.740 -0.048 0.000 2.297 368 C HN 0.790 9.020 8.230 -0.000 0.000 0.507 369 F N -0.205 119.774 119.950 0.048 0.000 2.789 369 F HA 0.927 5.459 4.527 0.008 0.000 0.319 369 F C 0.302 176.141 175.800 0.065 0.000 1.168 369 F CA 0.018 58.059 58.000 0.068 0.000 0.934 369 F CB 0.511 39.574 39.000 0.104 0.000 1.375 369 F HN 1.226 9.526 8.300 -0.000 0.000 0.480 370 G N 0.818 109.792 108.800 0.290 0.000 2.693 370 G HA2 -0.269 3.696 3.960 0.008 0.000 0.226 370 G HA3 -0.269 3.696 3.960 0.008 0.000 0.226 370 G C 0.468 175.408 174.900 0.067 0.000 1.354 370 G CA 0.353 45.562 45.100 0.182 0.000 0.873 370 G HN 1.253 9.543 8.290 -0.000 0.000 0.562 371 R N -0.569 119.967 120.500 0.060 0.000 2.113 371 R HA -0.122 4.223 4.340 0.008 0.000 0.244 371 R C 1.179 177.502 176.300 0.038 0.000 1.142 371 R CA 2.377 58.507 56.100 0.050 0.000 0.953 371 R CB -0.248 30.087 30.300 0.058 0.000 0.860 371 R HN 0.503 8.773 8.270 -0.000 0.000 0.438 372 D N -1.131 119.281 120.400 0.021 0.000 2.463 372 D HA 0.124 4.769 4.640 0.008 0.000 0.224 372 D C 1.071 177.342 176.300 -0.048 0.000 1.174 372 D CA 0.291 54.317 54.000 0.043 0.000 0.829 372 D CB 0.685 41.591 40.800 0.176 0.000 0.993 372 D HN 0.438 8.808 8.370 -0.000 0.000 0.497 373 G N 1.258 110.018 108.800 -0.066 0.000 2.469 373 G HA2 -0.309 3.656 3.960 0.008 0.000 0.219 373 G HA3 -0.309 3.656 3.960 0.008 0.000 0.219 373 G C 1.631 176.497 174.900 -0.057 0.000 1.150 373 G CA 1.076 46.125 45.100 -0.084 0.000 0.763 373 G HN 0.386 8.676 8.290 -0.000 0.000 0.561 374 A N -0.081 122.731 122.820 -0.013 0.000 1.930 374 A HA -0.041 4.284 4.320 0.008 0.000 0.217 374 A C 2.275 179.858 177.584 -0.002 0.000 1.175 374 A CA 1.951 53.987 52.037 -0.001 0.000 0.627 374 A CB -0.427 18.583 19.000 0.016 0.000 0.815 374 A HN 0.477 8.627 8.150 -0.000 0.000 0.443 375 Q N -0.566 119.246 119.800 0.020 0.000 2.167 375 Q HA -0.068 4.277 4.340 0.008 0.000 0.202 375 Q C 1.875 177.868 176.000 -0.011 0.000 0.970 375 Q CA 1.160 57.009 55.803 0.077 0.000 0.855 375 Q CB -0.158 28.716 28.738 0.227 0.000 0.911 375 Q HN 0.688 8.958 8.270 -0.000 0.000 0.438 376 L N -0.188 120.919 121.223 -0.192 0.000 2.072 376 L HA -0.054 4.291 4.340 0.008 0.000 0.205 376 L C 2.500 179.270 176.870 -0.167 0.000 1.079 376 L CA 0.886 55.526 54.840 -0.332 0.000 0.752 376 L CB -0.452 41.319 42.059 -0.480 0.000 0.906 376 L HN 0.217 8.447 8.230 -0.000 0.000 0.436 377 A N 0.107 122.862 122.820 -0.109 0.000 1.972 377 A HA -0.140 4.185 4.320 0.008 0.000 0.219 377 A C 2.446 180.000 177.584 -0.050 0.000 1.169 377 A CA 1.508 53.502 52.037 -0.072 0.000 0.635 377 A CB -0.651 18.322 19.000 -0.046 0.000 0.810 377 A HN 0.382 8.532 8.150 -0.000 0.000 0.446 378 A N -0.416 122.385 122.820 -0.031 0.000 2.178 378 A HA 0.051 4.376 4.320 0.008 0.000 0.218 378 A C 2.001 179.582 177.584 -0.006 0.000 1.157 378 A CA 1.112 53.144 52.037 -0.009 0.000 0.689 378 A CB -0.559 18.449 19.000 0.014 0.000 0.787 378 A HN 0.502 8.652 8.150 -0.000 0.000 0.465 379 L N -1.780 119.432 121.223 -0.018 0.000 2.042 379 L HA -0.082 4.263 4.340 0.008 0.000 0.210 379 L C 1.740 178.601 176.870 -0.015 0.000 1.076 379 L CA 1.377 56.212 54.840 -0.008 0.000 0.749 379 L CB -0.052 41.993 42.059 -0.023 0.000 0.893 379 L HN 0.431 8.661 8.230 -0.000 0.000 0.432 380 R N -1.257 119.224 120.500 -0.031 0.000 2.984 380 R HA 0.165 4.510 4.340 0.008 0.000 0.252 380 R C -2.226 174.048 176.300 -0.043 0.000 1.842 380 R CA -1.097 54.983 56.100 -0.033 0.000 1.389 380 R CB 1.097 31.375 30.300 -0.036 0.000 1.454 380 R HN -0.169 8.101 8.270 -0.000 0.000 0.578 381 P HA -0.220 4.200 4.420 -0.000 0.000 0.216 381 P C 0.869 178.144 177.300 -0.041 0.000 1.150 381 P CA 1.112 64.191 63.100 -0.035 0.000 0.837 381 P CB 0.255 31.942 31.700 -0.021 0.000 0.786 382 E N 0.206 120.384 120.200 -0.037 0.000 2.268 382 E HA -0.101 4.254 4.350 0.008 0.000 0.195 382 E C 1.315 177.885 176.600 -0.050 0.000 0.995 382 E CA 1.600 57.978 56.400 -0.035 0.000 0.836 382 E CB -0.802 28.881 29.700 -0.028 0.000 0.763 382 E HN 0.283 8.643 8.360 -0.000 0.000 0.491 383 V N -2.404 117.469 119.914 -0.068 0.000 3.214 383 V HA 0.642 4.767 4.120 0.008 0.000 0.330 383 V C 0.546 176.545 176.094 -0.158 0.000 1.403 383 V CA -0.263 61.977 62.300 -0.100 0.000 1.143 383 V CB 0.150 31.917 31.823 -0.095 0.000 1.098 383 V HN 0.301 8.491 8.190 -0.000 0.000 0.463 384 A N 0.466 123.207 122.820 -0.132 0.000 2.324 384 A HA 0.843 5.168 4.320 0.008 0.000 0.330 384 A C -0.200 177.303 177.584 -0.135 0.000 1.165 384 A CA -0.517 51.425 52.037 -0.158 0.000 0.813 384 A CB 1.048 19.987 19.000 -0.101 0.000 1.197 384 A HN 0.428 8.578 8.150 -0.000 0.000 0.484 385 E N 1.081 121.184 120.200 -0.162 0.000 2.222 385 E HA 0.328 4.683 4.350 0.008 0.000 0.267 385 E C -1.143 175.476 176.600 0.033 0.000 0.884 385 E CA -0.481 55.897 56.400 -0.038 0.000 0.764 385 E CB 2.368 32.081 29.700 0.023 0.000 1.169 385 E HN 0.717 9.077 8.360 -0.000 0.000 0.413 386 Q N 1.618 121.453 119.800 0.059 0.000 2.337 386 Q HA 0.445 4.790 4.340 0.008 0.000 0.266 386 Q C -0.916 175.154 176.000 0.116 0.000 1.023 386 Q CA -0.401 55.455 55.803 0.088 0.000 0.829 386 Q CB 1.583 30.351 28.738 0.051 0.000 1.306 386 Q HN 0.709 8.979 8.270 -0.000 0.000 0.449 387 T N -0.979 113.674 114.554 0.164 0.000 2.831 387 T HA 0.322 4.677 4.350 0.008 0.000 0.287 387 T C 0.536 175.336 174.700 0.167 0.000 1.070 387 T CA -0.745 61.444 62.100 0.148 0.000 1.010 387 T CB 1.511 70.469 68.868 0.150 0.000 1.264 387 T HN 0.601 8.841 8.240 -0.000 0.000 0.532 388 E N 0.470 120.745 120.200 0.125 0.000 2.060 388 E HA 0.042 4.397 4.350 0.008 0.000 0.189 388 E C 0.897 177.601 176.600 0.173 0.000 0.974 388 E CA 1.299 57.774 56.400 0.124 0.000 0.808 388 E CB 0.050 29.791 29.700 0.068 0.000 0.768 388 E HN 0.869 9.229 8.360 -0.000 0.000 0.453 389 T N -3.017 111.598 114.554 0.102 0.000 2.940 389 T HA 0.309 4.664 4.350 0.008 0.000 0.288 389 T C 0.993 175.563 174.700 -0.216 0.000 1.045 389 T CA -0.693 61.416 62.100 0.016 0.000 1.018 389 T CB 1.534 70.373 68.868 -0.048 0.000 1.151 389 T HN -0.038 8.202 8.240 -0.000 0.000 0.529 390 M N 0.156 119.432 119.600 -0.540 0.000 2.200 390 M HA 0.008 4.493 4.480 0.008 0.000 0.265 390 M C 2.245 178.364 176.300 -0.302 0.000 1.066 390 M CA 1.790 56.553 55.300 -0.895 0.000 1.127 390 M CB -0.353 31.802 32.600 -0.742 0.000 1.379 390 M HN 0.969 9.259 8.290 -0.000 0.000 0.420 391 E N 0.089 120.205 120.200 -0.140 0.000 2.077 391 E HA -0.278 4.077 4.350 0.008 0.000 0.193 391 E C 1.850 178.412 176.600 -0.063 0.000 0.989 391 E CA 1.784 58.141 56.400 -0.072 0.000 0.800 391 E CB -0.090 29.581 29.700 -0.048 0.000 0.746 391 E HN 0.644 9.004 8.360 -0.000 0.000 0.452 392 Q N -0.021 119.747 119.800 -0.053 0.000 2.084 392 Q HA -0.166 4.179 4.340 0.008 0.000 0.202 392 Q C 2.228 178.229 176.000 0.003 0.000 0.978 392 Q CA 1.570 57.364 55.803 -0.014 0.000 0.844 392 Q CB -0.205 28.541 28.738 0.013 0.000 0.898 392 Q HN 0.409 8.679 8.270 -0.000 0.000 0.426 393 A N 0.819 123.635 122.820 -0.005 0.000 1.902 393 A HA -0.197 4.128 4.320 0.008 0.000 0.217 393 A C 2.080 179.631 177.584 -0.055 0.000 1.181 393 A CA 1.463 53.529 52.037 0.049 0.000 0.623 393 A CB -0.480 18.586 19.000 0.110 0.000 0.818 393 A HN 0.284 8.434 8.150 -0.000 0.000 0.443 394 M N -0.930 118.633 119.600 -0.062 0.000 2.117 394 M HA -0.135 4.350 4.480 0.008 0.000 0.262 394 M C 2.237 178.500 176.300 -0.061 0.000 1.065 394 M CA 1.490 56.760 55.300 -0.050 0.000 1.114 394 M CB -0.688 31.901 32.600 -0.018 0.000 1.361 394 M HN 0.369 8.659 8.290 -0.000 0.000 0.408 395 R N 0.133 120.604 120.500 -0.048 0.000 2.189 395 R HA -0.061 4.284 4.340 0.008 0.000 0.218 395 R C 2.151 178.433 176.300 -0.031 0.000 1.074 395 R CA 0.718 56.796 56.100 -0.037 0.000 0.991 395 R CB -0.327 29.956 30.300 -0.030 0.000 0.883 395 R HN 0.224 8.494 8.270 -0.000 0.000 0.457 396 L N 1.210 122.416 121.223 -0.029 0.000 2.044 396 L HA -0.087 4.258 4.340 0.008 0.000 0.205 396 L C 1.974 178.813 176.870 -0.052 0.000 1.075 396 L CA 1.459 56.305 54.840 0.009 0.000 0.747 396 L CB -0.295 41.821 42.059 0.096 0.000 0.903 396 L HN 0.115 8.345 8.230 -0.000 0.000 0.435 397 L N -1.732 119.326 121.223 -0.275 0.000 2.179 397 L HA 0.246 4.591 4.340 0.008 0.000 0.208 397 L C 2.478 179.157 176.870 -0.319 0.000 1.096 397 L CA 1.677 56.210 54.840 -0.511 0.000 0.779 397 L CB -1.808 39.503 42.059 -1.247 0.000 0.922 397 L HN 0.071 8.301 8.230 -0.000 0.000 0.443 398 A N 0.947 123.668 122.820 -0.165 0.000 1.917 398 A HA -0.088 4.237 4.320 0.008 0.000 0.219 398 A C 0.510 178.072 177.584 -0.037 0.000 1.182 398 A CA 2.105 54.127 52.037 -0.025 0.000 0.633 398 A CB -2.123 16.923 19.000 0.076 0.000 0.819 398 A HN 0.499 8.649 8.150 -0.000 0.000 0.448 399 P HA -0.109 4.311 4.420 -0.000 0.000 0.222 399 P C 1.162 178.451 177.300 -0.018 0.000 1.147 399 P CA 1.004 64.097 63.100 -0.012 0.000 0.790 399 P CB -0.063 31.637 31.700 0.000 0.000 0.780 400 R N -1.219 119.252 120.500 -0.048 0.000 2.276 400 R HA 0.124 4.469 4.340 0.008 0.000 0.196 400 R C 0.205 176.480 176.300 -0.042 0.000 0.961 400 R CA 0.026 56.124 56.100 -0.004 0.000 1.024 400 R CB -0.135 30.215 30.300 0.084 0.000 0.940 400 R HN 0.078 8.348 8.270 -0.000 0.000 0.480 401 V N 2.904 122.710 119.914 -0.179 0.000 2.508 401 V HA 0.013 4.138 4.120 0.008 0.000 0.281 401 V C 0.219 176.292 176.094 -0.035 0.000 1.041 401 V CA 0.329 62.504 62.300 -0.208 0.000 1.016 401 V CB 1.180 32.810 31.823 -0.322 0.000 0.984 401 V HN 0.158 8.348 8.190 -0.000 0.000 0.478 402 Q N 5.203 125.017 119.800 0.023 0.000 2.351 402 Q HA 0.465 4.810 4.340 0.008 0.000 0.273 402 Q C -2.614 173.392 176.000 0.010 0.000 1.077 402 Q CA -2.465 53.351 55.803 0.023 0.000 0.843 402 Q CB 1.576 30.337 28.738 0.039 0.000 1.367 402 Q HN 0.379 8.649 8.270 -0.000 0.000 0.449 403 P HA 0.015 4.435 4.420 -0.000 0.000 0.262 403 P C 0.618 177.919 177.300 0.002 0.000 1.182 403 P CA 1.383 64.481 63.100 -0.003 0.000 0.761 403 P CB 0.229 31.925 31.700 -0.007 0.000 0.795 404 G N 1.974 110.774 108.800 -0.001 0.000 2.234 404 G HA2 -0.186 3.779 3.960 0.008 0.000 0.235 404 G HA3 -0.186 3.779 3.960 0.008 0.000 0.235 404 G C 0.137 175.023 174.900 -0.023 0.000 0.997 404 G CA -0.263 44.834 45.100 -0.005 0.000 0.623 404 G HN 0.485 8.775 8.290 -0.000 0.000 0.514 405 D N 0.191 120.580 120.400 -0.017 0.000 2.371 405 D HA 0.560 5.205 4.640 0.008 0.000 0.242 405 D C 0.670 176.933 176.300 -0.062 0.000 1.218 405 D CA 0.258 54.249 54.000 -0.014 0.000 0.945 405 D CB 0.729 41.574 40.800 0.075 0.000 1.137 405 D HN 0.405 8.775 8.370 -0.000 0.000 0.464 406 M N 0.555 120.120 119.600 -0.058 0.000 2.395 406 M HA 0.406 4.891 4.480 0.008 0.000 0.307 406 M C -1.837 174.387 176.300 -0.126 0.000 1.091 406 M CA -0.785 54.449 55.300 -0.110 0.000 0.919 406 M CB 1.779 34.342 32.600 -0.062 0.000 1.662 406 M HN -0.016 8.274 8.290 -0.000 0.000 0.440 407 V N 5.409 125.139 119.914 -0.307 0.000 2.370 407 V HA 0.506 4.631 4.120 0.008 0.000 0.283 407 V C -1.019 175.052 176.094 -0.039 0.000 1.023 407 V CA -0.732 61.421 62.300 -0.244 0.000 0.857 407 V CB 1.349 32.744 31.823 -0.713 0.000 0.985 407 V HN 0.725 8.915 8.190 -0.000 0.000 0.443 408 L N 6.653 127.869 121.223 -0.012 0.000 2.343 408 L HA 0.622 4.967 4.340 0.008 0.000 0.278 408 L C -0.846 175.940 176.870 -0.140 0.000 0.996 408 L CA -0.540 54.240 54.840 -0.101 0.000 0.831 408 L CB 1.555 43.573 42.059 -0.069 0.000 1.232 408 L HN 0.624 8.854 8.230 -0.000 0.000 0.413 409 L N 4.584 125.556 121.223 -0.419 0.000 2.312 409 L HA 0.552 4.897 4.340 0.008 0.000 0.287 409 L C -0.181 176.539 176.870 -0.251 0.000 1.091 409 L CA 0.747 55.337 54.840 -0.416 0.000 0.846 409 L CB 0.657 42.151 42.059 -0.941 0.000 1.219 409 L HN 0.721 8.951 8.230 -0.000 0.000 0.439 410 S N 6.602 122.235 115.700 -0.113 0.000 2.293 410 S HA 0.487 4.962 4.470 0.008 0.000 0.154 410 S C -2.051 172.511 174.600 -0.063 0.000 1.602 410 S CA -0.751 57.404 58.200 -0.075 0.000 1.260 410 S CB 0.632 63.810 63.200 -0.038 0.000 1.270 410 S HN 0.596 8.906 8.310 -0.000 0.000 0.416 411 P HA 0.225 4.645 4.420 -0.000 0.000 0.245 411 P C 0.734 177.967 177.300 -0.113 0.000 1.206 411 P CA 0.818 63.867 63.100 -0.085 0.000 0.781 411 P CB 0.003 31.675 31.700 -0.046 0.000 0.994 412 A N -2.253 120.529 122.820 -0.064 0.000 2.861 412 A HA -0.204 4.121 4.320 0.008 0.000 0.261 412 A C 0.423 178.041 177.584 0.057 0.000 1.351 412 A CA 1.086 53.117 52.037 -0.009 0.000 0.904 412 A CB -2.632 16.369 19.000 0.002 0.000 1.076 412 A HN 0.400 8.550 8.150 -0.000 0.000 0.729 413 C N -1.522 117.785 119.300 0.010 0.000 3.090 413 C HA 0.804 5.269 4.460 0.008 0.000 0.305 413 C C 0.988 175.999 174.990 0.035 0.000 1.292 413 C CA -0.574 58.472 59.018 0.046 0.000 1.482 413 C CB 1.537 29.288 27.740 0.017 0.000 1.897 413 C HN 1.707 9.937 8.230 -0.000 0.000 0.469 414 A N 1.155 124.012 122.820 0.062 0.000 2.406 414 A HA 0.441 4.766 4.320 0.008 0.000 0.243 414 A C 1.145 178.811 177.584 0.138 0.000 1.082 414 A CA 0.637 52.734 52.037 0.101 0.000 0.786 414 A CB 0.130 19.203 19.000 0.122 0.000 1.029 414 A HN 1.500 9.650 8.150 -0.000 0.000 0.495 415 S N 0.530 116.340 115.700 0.183 0.000 2.556 415 S HA 0.084 4.559 4.470 0.008 0.000 0.216 415 S C 1.119 175.921 174.600 0.337 0.000 0.970 415 S CA 0.273 58.637 58.200 0.272 0.000 0.912 415 S CB -0.409 62.897 63.200 0.175 0.000 0.790 415 S HN 0.564 8.874 8.310 -0.000 0.000 0.504 416 L N 2.283 123.640 121.223 0.224 0.000 2.478 416 L HA 0.016 4.361 4.340 0.008 0.000 0.223 416 L C 2.235 179.191 176.870 0.144 0.000 1.140 416 L CA 0.952 55.901 54.840 0.182 0.000 0.842 416 L CB -0.592 41.554 42.059 0.144 0.000 0.953 416 L HN 0.429 8.659 8.230 -0.000 0.000 0.452 417 D N -0.149 120.340 120.400 0.148 0.000 2.224 417 D HA -0.220 4.425 4.640 0.008 0.000 0.205 417 D C 1.619 177.961 176.300 0.070 0.000 0.965 417 D CA 1.180 55.241 54.000 0.102 0.000 0.852 417 D CB 0.091 40.951 40.800 0.100 0.000 0.947 417 D HN 0.439 8.809 8.370 -0.000 0.000 0.494 418 Q N -1.732 118.122 119.800 0.090 0.000 2.210 418 Q HA 0.236 4.581 4.340 0.008 0.000 0.252 418 Q C -0.404 175.385 176.000 -0.351 0.000 0.811 418 Q CA -0.158 55.563 55.803 -0.137 0.000 0.953 418 Q CB 1.207 29.816 28.738 -0.214 0.000 1.136 418 Q HN 0.117 8.387 8.270 -0.000 0.000 0.491 419 F N -0.037 119.955 119.950 0.071 0.000 2.598 419 F HA 0.340 4.871 4.527 0.007 0.000 0.327 419 F C 1.153 176.972 175.800 0.033 0.000 1.057 419 F CA -0.990 57.039 58.000 0.048 0.000 0.957 419 F CB 1.172 40.206 39.000 0.057 0.000 1.278 419 F HN -0.313 7.987 8.300 -0.000 0.000 0.484 420 K N 0.472 121.003 120.400 0.217 0.000 2.057 420 K HA -0.129 4.196 4.320 0.008 0.000 0.207 420 K C -0.450 176.206 176.600 0.093 0.000 1.049 420 K CA 1.771 58.124 56.287 0.110 0.000 0.931 420 K CB -0.075 32.464 32.500 0.065 0.000 0.714 420 K HN 0.897 9.147 8.250 -0.000 0.000 0.440 421 N N -2.622 116.126 118.700 0.080 0.000 3.356 421 N HA -0.026 4.719 4.740 0.008 0.000 0.246 421 N C 0.355 175.805 175.510 -0.099 0.000 1.480 421 N CA -0.416 52.631 53.050 -0.005 0.000 0.877 421 N CB -0.239 38.164 38.487 -0.140 0.000 1.431 421 N HN -0.080 8.300 8.380 -0.000 0.000 0.500 422 F N -1.016 118.881 119.950 -0.087 0.000 2.365 422 F HA 0.267 4.798 4.527 0.008 0.000 0.300 422 F C 1.387 176.951 175.800 -0.394 0.000 1.090 422 F CA 0.888 58.765 58.000 -0.205 0.000 1.408 422 F CB -0.412 38.505 39.000 -0.138 0.000 1.060 422 F HN 0.534 8.834 8.300 -0.000 0.000 0.534 423 E N 0.616 120.132 120.200 -1.140 0.000 2.072 423 E HA -0.213 4.142 4.350 0.008 0.000 0.191 423 E C 2.262 178.565 176.600 -0.496 0.000 0.985 423 E CA 1.335 57.096 56.400 -1.066 0.000 0.801 423 E CB -0.401 28.861 29.700 -0.730 0.000 0.750 423 E HN 0.669 9.029 8.360 -0.000 0.000 0.452 424 Q N 0.775 120.402 119.800 -0.287 0.000 2.084 424 Q HA -0.220 4.125 4.340 0.008 0.000 0.202 424 Q C 2.288 178.217 176.000 -0.118 0.000 0.978 424 Q CA 1.421 57.178 55.803 -0.076 0.000 0.844 424 Q CB 0.007 28.792 28.738 0.079 0.000 0.898 424 Q HN 0.105 8.375 8.270 -0.000 0.000 0.426 425 R N -0.538 119.696 120.500 -0.444 0.000 2.083 425 R HA -0.138 4.207 4.340 0.008 0.000 0.237 425 R C 2.208 178.330 176.300 -0.296 0.000 1.137 425 R CA 1.708 57.271 56.100 -0.895 0.000 0.951 425 R CB -0.655 28.972 30.300 -1.122 0.000 0.851 425 R HN 0.396 8.666 8.270 -0.000 0.000 0.434 426 G N 0.496 109.188 108.800 -0.180 0.000 2.422 426 G HA2 -0.265 3.700 3.960 0.008 0.000 0.218 426 G HA3 -0.265 3.700 3.960 0.008 0.000 0.218 426 G C 1.134 176.186 174.900 0.253 0.000 1.146 426 G CA 0.754 45.929 45.100 0.124 0.000 0.769 426 G HN 0.335 8.625 8.290 -0.000 0.000 0.547 427 N N 0.796 119.597 118.700 0.169 0.000 2.188 427 N HA -0.046 4.699 4.740 0.008 0.000 0.184 427 N C 2.143 177.717 175.510 0.105 0.000 1.018 427 N CA 1.005 54.147 53.050 0.153 0.000 0.858 427 N CB -0.262 38.287 38.487 0.104 0.000 0.989 427 N HN 0.514 8.894 8.380 -0.000 0.000 0.426 428 E N -0.227 120.038 120.200 0.109 0.000 2.106 428 E HA -0.132 4.223 4.350 0.008 0.000 0.192 428 E C 1.619 178.275 176.600 0.092 0.000 0.984 428 E CA 0.435 56.902 56.400 0.112 0.000 0.806 428 E CB -0.219 29.612 29.700 0.218 0.000 0.750 428 E HN 0.291 8.651 8.360 -0.000 0.000 0.458 429 F N 1.947 121.898 119.950 0.001 0.000 2.095 429 F HA -0.236 4.295 4.527 0.008 0.000 0.298 429 F C 2.266 178.063 175.800 -0.006 0.000 1.104 429 F CA 1.686 59.690 58.000 0.006 0.000 1.232 429 F CB -0.319 38.695 39.000 0.023 0.000 0.987 429 F HN -0.063 8.237 8.300 -0.000 0.000 0.475 430 A N 0.227 123.064 122.820 0.029 0.000 1.933 430 A HA -0.175 4.150 4.320 0.008 0.000 0.218 430 A C 2.324 179.779 177.584 -0.215 0.000 1.175 430 A CA 1.651 53.628 52.037 -0.100 0.000 0.628 430 A CB -0.817 18.218 19.000 0.058 0.000 0.814 430 A HN 0.471 8.621 8.150 -0.000 0.000 0.444 431 R N -0.584 119.831 120.500 -0.141 0.000 2.073 431 R HA -0.042 4.303 4.340 0.008 0.000 0.234 431 R C 2.032 178.189 176.300 -0.237 0.000 1.134 431 R CA 1.614 57.622 56.100 -0.153 0.000 0.952 431 R CB -0.398 29.854 30.300 -0.080 0.000 0.850 431 R HN 0.537 8.807 8.270 -0.000 0.000 0.433 432 L N -0.285 120.782 121.223 -0.261 0.000 2.093 432 L HA -0.119 4.226 4.340 0.008 0.000 0.208 432 L C 2.580 179.142 176.870 -0.512 0.000 1.085 432 L CA 1.128 55.785 54.840 -0.305 0.000 0.755 432 L CB -0.474 41.451 42.059 -0.223 0.000 0.904 432 L HN 0.322 8.552 8.230 -0.000 0.000 0.435 433 A N 0.270 122.643 122.820 -0.745 0.000 1.902 433 A HA -0.228 4.097 4.320 0.008 0.000 0.217 433 A C 2.301 179.289 177.584 -0.994 0.000 1.181 433 A CA 1.728 53.054 52.037 -1.185 0.000 0.623 433 A CB -0.325 18.022 19.000 -1.088 0.000 0.818 433 A HN 0.317 8.467 8.150 -0.000 0.000 0.443 434 K N -0.605 119.431 120.400 -0.608 0.000 2.211 434 K HA -0.115 4.210 4.320 0.008 0.000 0.203 434 K C 2.072 178.448 176.600 -0.374 0.000 1.050 434 K CA 1.240 57.260 56.287 -0.446 0.000 0.945 434 K CB -0.045 32.274 32.500 -0.302 0.000 0.732 434 K HN 0.706 8.956 8.250 -0.000 0.000 0.451 435 E N 0.929 120.922 120.200 -0.346 0.000 2.072 435 E HA -0.131 4.224 4.350 0.008 0.000 0.190 435 E C 1.555 177.999 176.600 -0.260 0.000 0.982 435 E CA 0.868 57.115 56.400 -0.256 0.000 0.803 435 E CB 0.202 29.780 29.700 -0.204 0.000 0.755 435 E HN 0.231 8.591 8.360 -0.000 0.000 0.453 436 L N -0.173 120.832 121.223 -0.363 0.000 2.554 436 L HA 0.296 4.641 4.340 0.008 0.000 0.225 436 L C 1.236 177.954 176.870 -0.253 0.000 1.104 436 L CA -0.023 54.657 54.840 -0.268 0.000 0.866 436 L CB 0.701 42.630 42.059 -0.216 0.000 1.047 436 L HN 0.024 8.254 8.230 -0.000 0.000 0.468 437 G N 0.000 108.509 108.800 -0.485 0.000 5.446 437 G HA2 0.000 3.965 3.960 0.008 0.000 0.244 437 G HA3 0.000 3.965 3.960 0.008 0.000 0.244 437 G CA 0.000 44.929 45.100 -0.286 0.000 0.502 437 G HN 0.000 8.290 8.290 -0.000 0.000 0.925