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 1aic_1_B DATA FIRST_RESID 5 DATA SEQUENCE MFENITAAPA DPILGLADLF RADERPGKIN LGIGVYKDET GKTPVLTSVK DATA SEQUENCE KAEQYLLENE XTTKNYLGID GIPEFGRCTQ ELLFGKGSAL INDKRARTAQ DATA SEQUENCE TPGGTGALRV AADFLAKNTS VKXXRXXXVW VSNPSWPNHK SVFNSAGLXE DATA SEQUENCE VREYAYYDAE NHTLDFDALI NSLNEAQAGD VVLFHGCCHN PTGIDPTLEQ DATA SEQUENCE WQTLAQLSVE KGWLPLFDFA YQGFARGXLE EDAEGLRAFA AMHKELIVAS DATA SEQUENCE SYSHNFGLYN ERVGACTLVA ADSETVDRAF SQMKAAIRAN YSNPPAHGAS DATA SEQUENCE VVATILSNDA LRAIWEQELT DMRQRIQRMR QLFVNTLQEK GANRDFSFII DATA SEQUENCE KQNGMFSFSG LTKEQVLRLR EEFGVYAVAS GRVNVAGMTP DNMAPLCEAI DATA SEQUENCE VXAVL 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 5 M HA 0.000 4.480 4.480 -0.000 0.000 0.227 5 M C 0.000 176.114 176.300 -0.311 0.000 1.140 5 M CA 0.000 55.103 55.300 -0.328 0.000 0.988 5 M CB 0.000 32.303 32.600 -0.494 0.000 1.302 6 F N -2.261 117.687 119.950 -0.002 0.000 2.631 6 F HA -0.355 4.172 4.527 -0.002 0.000 0.563 6 F C 1.228 177.027 175.800 -0.002 0.000 0.513 6 F CA 1.779 59.778 58.000 -0.002 0.000 0.871 6 F CB -2.021 36.978 39.000 -0.002 0.000 1.668 6 F HN 0.794 9.094 8.300 -0.000 0.000 0.260 7 E N 0.327 120.599 120.200 0.120 0.000 2.136 7 E HA -0.231 4.118 4.350 -0.001 0.000 0.202 7 E C 1.148 177.787 176.600 0.064 0.000 1.019 7 E CA 1.955 58.396 56.400 0.069 0.000 0.819 7 E CB -0.416 29.297 29.700 0.022 0.000 0.739 7 E HN 0.686 9.046 8.360 -0.000 0.000 0.458 8 N N -0.200 118.538 118.700 0.064 0.000 2.401 8 N HA 0.195 4.934 4.740 -0.001 0.000 0.264 8 N C -0.738 174.803 175.510 0.052 0.000 1.238 8 N CA -0.240 52.839 53.050 0.047 0.000 0.889 8 N CB 0.596 39.101 38.487 0.030 0.000 1.196 8 N HN 0.049 8.429 8.380 -0.000 0.000 0.511 9 I N 2.128 122.741 120.570 0.072 0.000 2.598 9 I HA -0.043 4.126 4.170 -0.001 0.000 0.284 9 I C 0.944 177.074 176.117 0.022 0.000 1.140 9 I CA 0.244 61.573 61.300 0.048 0.000 1.420 9 I CB 0.578 38.607 38.000 0.049 0.000 1.387 9 I HN 0.131 8.341 8.210 -0.000 0.000 0.553 10 T N 3.930 118.491 114.554 0.011 0.000 2.910 10 T HA 0.526 4.875 4.350 -0.001 0.000 0.293 10 T C 0.378 175.074 174.700 -0.006 0.000 1.015 10 T CA -1.036 61.066 62.100 0.003 0.000 1.094 10 T CB 1.366 70.235 68.868 0.001 0.000 0.968 10 T HN 0.669 8.909 8.240 -0.000 0.000 0.521 11 A N 1.908 124.723 122.820 -0.008 0.000 2.547 11 A HA 0.518 4.838 4.320 -0.001 0.000 0.233 11 A C 0.901 178.474 177.584 -0.019 0.000 1.067 11 A CA -0.169 51.859 52.037 -0.015 0.000 0.763 11 A CB -0.724 18.270 19.000 -0.011 0.000 1.007 11 A HN 1.461 9.611 8.150 -0.000 0.000 0.506 12 A N 2.557 125.362 122.820 -0.025 0.000 2.340 12 A HA 0.627 4.946 4.320 -0.001 0.000 0.268 12 A C -1.634 175.936 177.584 -0.024 0.000 1.100 12 A CA -1.249 50.771 52.037 -0.028 0.000 0.803 12 A CB -0.411 18.567 19.000 -0.035 0.000 1.043 12 A HN 0.809 8.959 8.150 -0.000 0.000 0.488 13 P HA 0.337 4.757 4.420 -0.000 0.000 0.271 13 P C -0.176 177.110 177.300 -0.023 0.000 1.216 13 P CA 0.013 63.100 63.100 -0.022 0.000 0.771 13 P CB 0.797 32.483 31.700 -0.023 0.000 0.864 14 A N 2.941 125.751 122.820 -0.015 0.000 2.548 14 A HA 0.002 4.321 4.320 -0.001 0.000 0.247 14 A C 0.693 178.265 177.584 -0.020 0.000 1.067 14 A CA -0.131 51.899 52.037 -0.013 0.000 0.757 14 A CB -0.398 18.602 19.000 -0.000 0.000 0.996 14 A HN 0.661 8.811 8.150 -0.000 0.000 0.504 15 D N 4.249 124.633 120.400 -0.027 0.000 2.349 15 D HA 0.089 4.728 4.640 -0.001 0.000 0.266 15 D C -1.383 174.899 176.300 -0.032 0.000 1.293 15 D CA -1.332 52.639 54.000 -0.049 0.000 0.926 15 D CB 0.834 41.601 40.800 -0.055 0.000 1.090 15 D HN 0.216 8.586 8.370 -0.000 0.000 0.502 16 P HA -0.216 4.204 4.420 -0.000 0.000 0.217 16 P C 1.657 178.960 177.300 0.005 0.000 1.158 16 P CA 1.010 64.103 63.100 -0.011 0.000 0.887 16 P CB 0.210 31.897 31.700 -0.021 0.000 0.792 17 I N -1.519 119.046 120.570 -0.008 0.000 2.133 17 I HA -0.165 4.004 4.170 -0.001 0.000 0.238 17 I C 2.475 178.601 176.117 0.015 0.000 1.074 17 I CA 1.520 62.825 61.300 0.008 0.000 1.342 17 I CB -1.855 36.154 38.000 0.016 0.000 1.053 17 I HN -0.041 8.169 8.210 -0.000 0.000 0.404 18 L N 0.976 122.204 121.223 0.009 0.000 2.129 18 L HA -0.169 4.170 4.340 -0.001 0.000 0.212 18 L C 2.630 179.509 176.870 0.015 0.000 1.087 18 L CA 1.667 56.513 54.840 0.010 0.000 0.757 18 L CB -1.212 40.847 42.059 0.001 0.000 0.896 18 L HN 0.367 8.597 8.230 -0.000 0.000 0.434 19 G N -0.530 108.280 108.800 0.018 0.000 2.448 19 G HA2 -0.183 3.776 3.960 -0.001 0.000 0.218 19 G HA3 -0.183 3.776 3.960 -0.001 0.000 0.218 19 G C 1.532 176.471 174.900 0.065 0.000 1.135 19 G CA -0.071 45.050 45.100 0.036 0.000 0.784 19 G HN 0.124 8.414 8.290 -0.000 0.000 0.543 20 L N 1.217 122.485 121.223 0.075 0.000 2.201 20 L HA 0.102 4.441 4.340 -0.001 0.000 0.212 20 L C 3.083 180.025 176.870 0.120 0.000 1.105 20 L CA 1.537 56.456 54.840 0.133 0.000 0.775 20 L CB -1.122 41.018 42.059 0.135 0.000 0.913 20 L HN 0.307 8.537 8.230 -0.000 0.000 0.440 21 A N -0.349 122.503 122.820 0.052 0.000 1.873 21 A HA -0.246 4.074 4.320 -0.001 0.000 0.218 21 A C 1.935 179.566 177.584 0.077 0.000 1.193 21 A CA 2.083 54.137 52.037 0.028 0.000 0.629 21 A CB -0.598 18.407 19.000 0.007 0.000 0.826 21 A HN 0.472 8.622 8.150 -0.000 0.000 0.447 22 D N -0.708 119.732 120.400 0.067 0.000 2.312 22 D HA -0.025 4.614 4.640 -0.001 0.000 0.211 22 D C 1.815 178.160 176.300 0.074 0.000 0.964 22 D CA 0.546 54.582 54.000 0.060 0.000 0.877 22 D CB -0.041 40.785 40.800 0.043 0.000 0.924 22 D HN 0.447 8.817 8.370 -0.000 0.000 0.515 23 L N -0.253 121.042 121.223 0.120 0.000 2.179 23 L HA -0.078 4.261 4.340 -0.001 0.000 0.208 23 L C 2.137 179.080 176.870 0.121 0.000 1.096 23 L CA 0.458 55.400 54.840 0.171 0.000 0.779 23 L CB -0.047 42.180 42.059 0.279 0.000 0.922 23 L HN -0.104 8.126 8.230 -0.000 0.000 0.443 24 F N 1.548 121.375 119.950 -0.205 0.000 2.084 24 F HA -0.144 4.382 4.527 -0.001 0.000 0.296 24 F C 1.837 177.465 175.800 -0.286 0.000 1.111 24 F CA 0.875 58.530 58.000 -0.576 0.000 1.224 24 F CB -0.007 38.628 39.000 -0.609 0.000 0.991 24 F HN -0.014 8.286 8.300 -0.000 0.000 0.471 25 R N 0.295 120.789 120.500 -0.011 0.000 3.657 25 R HA 0.603 4.942 4.340 -0.001 0.000 0.220 25 R C -0.139 176.128 176.300 -0.055 0.000 1.548 25 R CA 0.556 56.613 56.100 -0.072 0.000 1.465 25 R CB 0.242 30.558 30.300 0.025 0.000 1.330 25 R HN 0.253 8.523 8.270 -0.000 0.000 0.707 26 A N 0.971 123.733 122.820 -0.097 0.000 2.031 26 A HA -0.121 4.198 4.320 -0.001 0.000 0.159 26 A C 1.356 178.920 177.584 -0.035 0.000 2.021 26 A CA 0.179 52.195 52.037 -0.035 0.000 1.557 26 A CB -0.342 18.666 19.000 0.014 0.000 1.617 26 A HN 0.517 8.667 8.150 -0.000 0.000 0.297 27 D N 0.884 121.237 120.400 -0.079 0.000 2.104 27 D HA -0.178 4.462 4.640 -0.001 0.000 0.194 27 D C 0.224 176.502 176.300 -0.036 0.000 0.994 27 D CA 1.625 55.619 54.000 -0.009 0.000 0.830 27 D CB -0.180 40.554 40.800 -0.110 0.000 0.959 27 D HN 0.274 8.644 8.370 -0.000 0.000 0.452 28 E N 0.435 120.530 120.200 -0.175 0.000 1.544 28 E HA -0.223 4.126 4.350 -0.001 0.000 0.167 28 E C -0.352 176.225 176.600 -0.039 0.000 1.106 28 E CA 0.604 56.920 56.400 -0.139 0.000 0.507 28 E CB -0.611 29.029 29.700 -0.099 0.000 1.038 28 E HN 0.193 8.553 8.360 -0.000 0.000 0.263 29 R N 0.311 120.793 120.500 -0.030 0.000 2.960 29 R HA 0.497 4.836 4.340 -0.001 0.000 0.249 29 R C -1.461 174.811 176.300 -0.047 0.000 1.192 29 R CA -1.364 54.781 56.100 0.075 0.000 1.035 29 R CB 0.510 31.041 30.300 0.385 0.000 1.234 29 R HN 0.042 8.312 8.270 -0.000 0.000 0.493 30 P HA -0.008 4.412 4.420 -0.000 0.000 0.199 30 P C 0.189 177.452 177.300 -0.063 0.000 1.169 30 P CA 0.941 64.024 63.100 -0.027 0.000 0.900 30 P CB -0.146 31.567 31.700 0.022 0.000 0.733 31 G N 0.960 109.734 108.800 -0.044 0.000 3.717 31 G HA2 0.106 4.065 3.960 -0.001 0.000 0.258 31 G HA3 0.106 4.065 3.960 -0.001 0.000 0.258 31 G C 0.149 175.021 174.900 -0.046 0.000 1.088 31 G CA -0.386 44.696 45.100 -0.030 0.000 1.737 31 G HN 0.177 8.467 8.290 -0.000 0.000 0.648 32 K N 0.600 120.947 120.400 -0.088 0.000 2.451 32 K HA 0.154 4.473 4.320 -0.001 0.000 0.280 32 K C -0.367 176.334 176.600 0.168 0.000 1.020 32 K CA 0.357 56.620 56.287 -0.040 0.000 1.008 32 K CB 1.104 33.458 32.500 -0.243 0.000 0.917 32 K HN 0.221 8.471 8.250 -0.000 0.000 0.478 33 I N 3.083 123.783 120.570 0.216 0.000 2.362 33 I HA 0.078 4.247 4.170 -0.001 0.000 0.289 33 I C -0.039 176.159 176.117 0.135 0.000 0.994 33 I CA -0.649 60.740 61.300 0.147 0.000 1.158 33 I CB 1.306 39.349 38.000 0.072 0.000 1.315 33 I HN 0.437 8.647 8.210 -0.000 0.000 0.451 34 N N 7.079 125.695 118.700 -0.139 0.000 2.426 34 N HA 0.356 5.095 4.740 -0.001 0.000 0.257 34 N C -0.191 175.191 175.510 -0.214 0.000 1.002 34 N CA -0.133 52.658 53.050 -0.433 0.000 0.942 34 N CB 1.089 38.878 38.487 -1.163 0.000 1.112 34 N HN 0.594 8.974 8.380 -0.000 0.000 0.499 35 L N 1.963 123.134 121.223 -0.086 0.000 2.857 35 L HA 0.389 4.728 4.340 -0.001 0.000 0.249 35 L C 1.512 178.375 176.870 -0.012 0.000 1.172 35 L CA -0.216 54.590 54.840 -0.056 0.000 0.980 35 L CB 0.807 42.845 42.059 -0.036 0.000 1.299 35 L HN 0.545 8.775 8.230 -0.000 0.000 0.535 36 G N 0.937 109.719 108.800 -0.031 0.000 3.523 36 G HA2 0.215 4.174 3.960 -0.001 0.000 0.270 36 G HA3 0.215 4.174 3.960 -0.001 0.000 0.270 36 G C 0.699 175.593 174.900 -0.010 0.000 1.134 36 G CA -0.218 44.886 45.100 0.006 0.000 0.825 36 G HN 0.210 8.500 8.290 -0.000 0.000 0.534 37 I N -2.325 118.229 120.570 -0.026 0.000 2.764 37 I HA 0.630 4.799 4.170 -0.001 0.000 0.294 37 I C 0.814 176.994 176.117 0.106 0.000 1.045 37 I CA -0.491 60.796 61.300 -0.021 0.000 1.340 37 I CB 1.710 39.657 38.000 -0.088 0.000 1.436 37 I HN -0.056 8.154 8.210 -0.000 0.000 0.567 38 G N 4.028 112.903 108.800 0.125 0.000 3.502 38 G HA2 0.398 4.357 3.960 -0.001 0.000 0.267 38 G HA3 0.398 4.357 3.960 -0.001 0.000 0.267 38 G C 0.082 175.178 174.900 0.326 0.000 1.090 38 G CA -0.001 45.281 45.100 0.303 0.000 0.795 38 G HN 0.405 8.695 8.290 -0.000 0.000 0.535 39 V N -0.375 119.615 119.914 0.128 0.000 3.103 39 V HA 0.539 4.658 4.120 -0.001 0.000 0.318 39 V C -0.692 175.498 176.094 0.159 0.000 1.114 39 V CA -1.319 61.018 62.300 0.063 0.000 1.020 39 V CB 2.171 33.797 31.823 -0.329 0.000 1.085 39 V HN 0.298 8.488 8.190 -0.000 0.000 0.446 40 Y N 2.333 122.755 120.300 0.205 0.000 2.304 40 Y HA 0.508 5.058 4.550 -0.001 0.000 0.327 40 Y C 0.055 176.015 175.900 0.099 0.000 1.209 40 Y CA 0.027 58.228 58.100 0.168 0.000 1.299 40 Y CB 0.708 39.350 38.460 0.303 0.000 1.249 40 Y HN 0.512 8.792 8.280 -0.000 0.000 0.519 41 K N 3.980 123.943 120.400 -0.729 0.000 2.426 41 K HA 0.241 4.560 4.320 -0.001 0.000 0.251 41 K C -1.295 174.875 176.600 -0.716 0.000 0.941 41 K CA -0.989 55.036 56.287 -0.437 0.000 0.808 41 K CB 1.353 33.690 32.500 -0.272 0.000 1.265 41 K HN 0.812 9.062 8.250 -0.000 0.000 0.432 42 D N 0.783 121.023 120.400 -0.268 0.000 2.511 42 D HA -0.024 4.615 4.640 -0.001 0.000 0.276 42 D C 0.925 177.171 176.300 -0.091 0.000 1.220 42 D CA -0.265 53.669 54.000 -0.111 0.000 1.077 42 D CB 0.402 41.269 40.800 0.111 0.000 1.126 42 D HN 0.533 8.903 8.370 -0.000 0.000 0.583 43 E N -0.703 119.483 120.200 -0.022 0.000 2.333 43 E HA -0.154 4.196 4.350 -0.001 0.000 0.198 43 E C 1.032 177.622 176.600 -0.018 0.000 1.007 43 E CA 1.150 57.538 56.400 -0.021 0.000 0.845 43 E CB -1.023 28.680 29.700 0.005 0.000 0.766 43 E HN 0.506 8.866 8.360 -0.000 0.000 0.507 44 T N -0.074 114.474 114.554 -0.010 0.000 3.035 44 T HA 0.278 4.627 4.350 -0.001 0.000 0.259 44 T C 1.204 175.895 174.700 -0.017 0.000 1.078 44 T CA 0.826 62.923 62.100 -0.004 0.000 1.132 44 T CB 0.118 68.993 68.868 0.011 0.000 0.900 44 T HN 0.477 8.717 8.240 -0.000 0.000 0.480 45 G N 1.656 110.433 108.800 -0.039 0.000 2.270 45 G HA2 -0.160 3.799 3.960 -0.001 0.000 0.224 45 G HA3 -0.160 3.799 3.960 -0.001 0.000 0.224 45 G C -0.306 174.571 174.900 -0.037 0.000 1.079 45 G CA -0.400 44.667 45.100 -0.055 0.000 0.807 45 G HN 0.464 8.754 8.290 -0.000 0.000 0.492 46 K N -0.634 119.755 120.400 -0.019 0.000 2.443 46 K HA 0.730 5.049 4.320 -0.001 0.000 0.251 46 K C -0.446 176.185 176.600 0.052 0.000 0.972 46 K CA -0.690 55.605 56.287 0.015 0.000 0.833 46 K CB 1.712 34.233 32.500 0.034 0.000 1.317 46 K HN 0.021 8.271 8.250 -0.000 0.000 0.441 47 T N 3.471 118.071 114.554 0.076 0.000 3.154 47 T HA 0.310 4.659 4.350 -0.001 0.000 0.381 47 T C -2.367 172.438 174.700 0.174 0.000 1.368 47 T CA -1.331 60.863 62.100 0.158 0.000 1.155 47 T CB 0.482 69.407 68.868 0.096 0.000 1.120 47 T HN 0.342 8.582 8.240 -0.000 0.000 0.570 48 P HA 0.370 4.790 4.420 -0.000 0.000 0.274 48 P C -0.544 176.846 177.300 0.150 0.000 1.256 48 P CA -0.689 62.495 63.100 0.140 0.000 0.795 48 P CB 0.564 32.340 31.700 0.126 0.000 1.038 49 V N 1.575 121.559 119.914 0.116 0.000 2.461 49 V HA 0.065 4.185 4.120 -0.001 0.000 0.275 49 V C 0.651 176.804 176.094 0.097 0.000 1.047 49 V CA -0.616 61.749 62.300 0.110 0.000 0.955 49 V CB 0.471 32.349 31.823 0.092 0.000 0.988 49 V HN 0.368 8.558 8.190 -0.000 0.000 0.471 50 L N 4.660 125.942 121.223 0.099 0.000 2.506 50 L HA 0.052 4.391 4.340 -0.001 0.000 0.281 50 L C 1.897 178.811 176.870 0.073 0.000 1.228 50 L CA 1.299 56.189 54.840 0.084 0.000 0.850 50 L CB 0.942 43.061 42.059 0.101 0.000 1.110 50 L HN 0.950 9.180 8.230 -0.000 0.000 0.496 51 T N -2.522 112.067 114.554 0.058 0.000 3.043 51 T HA -0.081 4.268 4.350 -0.001 0.000 0.263 51 T C 1.801 176.532 174.700 0.052 0.000 1.094 51 T CA 0.833 62.963 62.100 0.051 0.000 1.127 51 T CB -0.185 68.706 68.868 0.038 0.000 0.905 51 T HN 0.703 8.943 8.240 -0.000 0.000 0.490 52 S N 1.265 117.003 115.700 0.063 0.000 2.383 52 S HA -0.102 4.368 4.470 -0.001 0.000 0.229 52 S C 1.958 176.591 174.600 0.055 0.000 1.030 52 S CA 1.252 59.492 58.200 0.067 0.000 1.002 52 S CB -1.126 62.142 63.200 0.115 0.000 0.829 52 S HN 0.382 8.692 8.310 -0.000 0.000 0.467 53 V N 2.310 122.266 119.914 0.070 0.000 2.270 53 V HA -0.105 4.014 4.120 -0.001 0.000 0.245 53 V C 2.859 178.981 176.094 0.046 0.000 1.043 53 V CA 1.746 64.079 62.300 0.056 0.000 1.014 53 V CB -0.617 31.255 31.823 0.082 0.000 0.645 53 V HN 0.381 8.571 8.190 -0.000 0.000 0.447 54 K N 0.471 120.906 120.400 0.057 0.000 2.074 54 K HA -0.196 4.123 4.320 -0.001 0.000 0.209 54 K C 2.117 178.748 176.600 0.053 0.000 1.048 54 K CA 1.532 57.854 56.287 0.057 0.000 0.926 54 K CB -0.388 32.145 32.500 0.054 0.000 0.713 54 K HN 0.467 8.717 8.250 -0.000 0.000 0.444 55 K N 0.056 120.484 120.400 0.046 0.000 2.097 55 K HA -0.048 4.271 4.320 -0.001 0.000 0.205 55 K C 2.111 178.744 176.600 0.055 0.000 1.050 55 K CA 1.131 57.446 56.287 0.047 0.000 0.938 55 K CB -0.053 32.467 32.500 0.033 0.000 0.718 55 K HN 0.094 8.344 8.250 -0.000 0.000 0.442 56 A N 1.491 124.329 122.820 0.029 0.000 2.016 56 A HA -0.109 4.211 4.320 -0.001 0.000 0.217 56 A C 1.690 179.313 177.584 0.064 0.000 1.162 56 A CA 0.941 52.992 52.037 0.024 0.000 0.662 56 A CB -0.152 18.818 19.000 -0.049 0.000 0.812 56 A HN 0.244 8.394 8.150 -0.000 0.000 0.450 57 E N -0.602 119.623 120.200 0.041 0.000 2.338 57 E HA -0.182 4.167 4.350 -0.001 0.000 0.197 57 E C 2.003 178.658 176.600 0.092 0.000 1.007 57 E CA 0.935 57.372 56.400 0.062 0.000 0.849 57 E CB -0.016 29.751 29.700 0.112 0.000 0.774 57 E HN 0.786 9.146 8.360 -0.000 0.000 0.506 58 Q N -0.173 119.682 119.800 0.091 0.000 2.297 58 Q HA -0.112 4.227 4.340 -0.001 0.000 0.203 58 Q C 1.821 177.864 176.000 0.072 0.000 0.931 58 Q CA 0.277 56.123 55.803 0.071 0.000 0.885 58 Q CB 0.042 28.819 28.738 0.063 0.000 0.991 58 Q HN 0.312 8.582 8.270 -0.000 0.000 0.498 59 Y N 1.070 121.366 120.300 -0.007 0.000 2.151 59 Y HA -0.294 4.256 4.550 -0.001 0.000 0.284 59 Y C 1.672 177.563 175.900 -0.015 0.000 1.166 59 Y CA 1.510 59.602 58.100 -0.013 0.000 1.163 59 Y CB -0.139 38.309 38.460 -0.021 0.000 0.974 59 Y HN 0.149 8.429 8.280 -0.000 0.000 0.511 60 L N -0.018 121.224 121.223 0.031 0.000 2.056 60 L HA -0.228 4.111 4.340 -0.001 0.000 0.207 60 L C 2.540 179.372 176.870 -0.064 0.000 1.078 60 L CA 1.427 56.246 54.840 -0.034 0.000 0.749 60 L CB -1.387 40.695 42.059 0.037 0.000 0.901 60 L HN 0.369 8.599 8.230 -0.000 0.000 0.433 61 L N -0.604 120.608 121.223 -0.019 0.000 2.013 61 L HA -0.284 4.055 4.340 -0.001 0.000 0.212 61 L C 2.392 179.219 176.870 -0.071 0.000 1.073 61 L CA 1.702 56.527 54.840 -0.025 0.000 0.753 61 L CB -0.139 41.918 42.059 -0.003 0.000 0.890 61 L HN 0.425 8.655 8.230 -0.000 0.000 0.432 62 E N -0.909 119.224 120.200 -0.113 0.000 2.299 62 E HA -0.134 4.215 4.350 -0.001 0.000 0.193 62 E C 1.344 177.828 176.600 -0.193 0.000 0.998 62 E CA 0.776 57.096 56.400 -0.133 0.000 0.851 62 E CB 0.144 29.766 29.700 -0.130 0.000 0.795 62 E HN 0.499 8.859 8.360 -0.000 0.000 0.492 63 N N -0.016 118.507 118.700 -0.294 0.000 2.322 63 N HA 0.038 4.777 4.740 -0.001 0.000 0.181 63 N C 0.006 175.411 175.510 -0.174 0.000 1.088 63 N CA 0.138 53.007 53.050 -0.302 0.000 0.885 63 N CB 0.642 38.786 38.487 -0.572 0.000 1.013 63 N HN 0.058 8.438 8.380 -0.000 0.000 0.472 67 T N 0.632 115.165 114.554 -0.036 0.000 2.942 67 T HA 0.526 4.875 4.350 -0.001 0.000 0.327 67 T C -1.564 173.107 174.700 -0.048 0.000 1.360 67 T CA -0.616 61.459 62.100 -0.041 0.000 1.055 67 T CB 1.999 70.848 68.868 -0.032 0.000 1.261 67 T HN 0.127 8.367 8.240 -0.000 0.000 0.485 68 K N 2.558 122.917 120.400 -0.068 0.000 2.699 68 K HA 0.235 4.554 4.320 -0.001 0.000 0.210 68 K C 0.618 177.137 176.600 -0.134 0.000 1.076 68 K CA -0.307 55.930 56.287 -0.083 0.000 1.109 68 K CB 0.153 32.602 32.500 -0.085 0.000 0.862 68 K HN 0.516 8.766 8.250 -0.000 0.000 0.470 69 N N 0.430 119.065 118.700 -0.109 0.000 2.381 69 N HA -0.025 4.714 4.740 -0.001 0.000 0.241 69 N C -0.543 174.919 175.510 -0.080 0.000 1.279 69 N CA -0.207 52.762 53.050 -0.135 0.000 0.896 69 N CB 0.449 38.911 38.487 -0.042 0.000 1.118 69 N HN -0.069 8.311 8.380 -0.000 0.000 0.438 70 Y N 1.022 121.322 120.300 0.000 0.000 2.683 70 Y HA 0.031 4.581 4.550 -0.001 0.000 0.340 70 Y C 0.667 176.570 175.900 0.004 0.000 1.245 70 Y CA 0.137 58.239 58.100 0.003 0.000 1.485 70 Y CB 0.357 38.820 38.460 0.006 0.000 1.328 70 Y HN 0.278 8.558 8.280 -0.000 0.000 0.603 71 L N 1.898 123.236 121.223 0.191 0.000 2.439 71 L HA 0.452 4.791 4.340 -0.001 0.000 0.259 71 L C 1.157 178.082 176.870 0.092 0.000 1.129 71 L CA -0.697 54.207 54.840 0.106 0.000 0.803 71 L CB 0.450 42.549 42.059 0.067 0.000 1.161 71 L HN 0.815 9.045 8.230 -0.000 0.000 0.462 72 G N 0.380 109.219 108.800 0.065 0.000 2.664 72 G HA2 0.118 4.077 3.960 -0.001 0.000 0.242 72 G HA3 0.118 4.077 3.960 -0.001 0.000 0.242 72 G C 1.037 175.958 174.900 0.035 0.000 1.225 72 G CA -0.576 44.550 45.100 0.043 0.000 0.849 72 G HN 0.499 8.789 8.290 -0.000 0.000 0.581 73 I N 1.016 121.584 120.570 -0.002 0.000 2.315 73 I HA -0.139 4.030 4.170 -0.001 0.000 0.251 73 I C 2.140 178.267 176.117 0.017 0.000 1.125 73 I CA 1.410 62.694 61.300 -0.028 0.000 1.392 73 I CB -0.878 37.063 38.000 -0.098 0.000 1.065 73 I HN 0.591 8.801 8.210 -0.000 0.000 0.424 74 D N 0.089 120.522 120.400 0.054 0.000 2.348 74 D HA 0.230 4.869 4.640 -0.001 0.000 0.211 74 D C 1.361 177.755 176.300 0.157 0.000 0.998 74 D CA 0.885 54.974 54.000 0.148 0.000 0.873 74 D CB -0.116 40.864 40.800 0.301 0.000 0.925 74 D HN 0.367 8.737 8.370 -0.000 0.000 0.524 75 G N 0.753 109.615 108.800 0.103 0.000 2.545 75 G HA2 -0.206 3.753 3.960 -0.001 0.000 0.216 75 G HA3 -0.206 3.753 3.960 -0.001 0.000 0.216 75 G C -0.563 174.382 174.900 0.074 0.000 1.314 75 G CA -0.446 44.691 45.100 0.063 0.000 0.906 75 G HN 0.252 8.542 8.290 -0.000 0.000 0.563 76 I N 2.804 123.402 120.570 0.046 0.000 2.581 76 I HA 0.114 4.283 4.170 -0.001 0.000 0.285 76 I C -0.822 175.372 176.117 0.128 0.000 1.129 76 I CA -1.269 60.072 61.300 0.068 0.000 1.397 76 I CB 1.176 39.194 38.000 0.029 0.000 1.399 76 I HN 0.311 8.521 8.210 -0.000 0.000 0.537 77 P HA -0.218 4.202 4.420 -0.000 0.000 0.214 77 P C 1.339 178.676 177.300 0.061 0.000 1.169 77 P CA 1.232 64.377 63.100 0.075 0.000 0.908 77 P CB 0.151 31.880 31.700 0.049 0.000 0.791 78 E N -1.584 118.643 120.200 0.044 0.000 2.171 78 E HA -0.204 4.145 4.350 -0.001 0.000 0.197 78 E C 1.878 178.478 176.600 -0.001 0.000 0.997 78 E CA 0.921 57.327 56.400 0.009 0.000 0.810 78 E CB -0.782 28.917 29.700 -0.002 0.000 0.738 78 E HN 0.255 8.615 8.360 -0.000 0.000 0.467 79 F N 1.011 120.908 119.950 -0.088 0.000 2.095 79 F HA -0.131 4.396 4.527 -0.001 0.000 0.298 79 F C 2.258 178.017 175.800 -0.069 0.000 1.104 79 F CA 1.975 59.902 58.000 -0.121 0.000 1.232 79 F CB -0.627 38.303 39.000 -0.116 0.000 0.987 79 F HN 0.005 8.305 8.300 -0.000 0.000 0.475 80 G N 0.108 108.920 108.800 0.020 0.000 2.422 80 G HA2 -0.233 3.726 3.960 -0.001 0.000 0.218 80 G HA3 -0.233 3.726 3.960 -0.001 0.000 0.218 80 G C 1.804 176.634 174.900 -0.117 0.000 1.146 80 G CA 0.762 45.839 45.100 -0.039 0.000 0.769 80 G HN 0.347 8.637 8.290 -0.000 0.000 0.547 81 R N -0.622 119.823 120.500 -0.093 0.000 2.093 81 R HA 0.026 4.365 4.340 -0.001 0.000 0.224 81 R C 2.644 178.872 176.300 -0.120 0.000 1.101 81 R CA 1.067 57.120 56.100 -0.080 0.000 0.979 81 R CB -0.632 29.639 30.300 -0.049 0.000 0.877 81 R HN 0.362 8.632 8.270 -0.000 0.000 0.441 82 C N 0.237 119.430 119.300 -0.180 0.000 2.440 82 C HA -0.057 4.402 4.460 -0.001 0.000 0.278 82 C C 2.696 177.555 174.990 -0.219 0.000 1.295 82 C CA 0.990 59.890 59.018 -0.196 0.000 1.738 82 C CB -0.759 26.830 27.740 -0.253 0.000 1.987 82 C HN 0.520 8.750 8.230 -0.000 0.000 0.492 83 T N 0.591 114.955 114.554 -0.318 0.000 2.708 83 T HA -0.227 4.122 4.350 -0.001 0.000 0.266 83 T C 1.825 176.372 174.700 -0.256 0.000 1.037 83 T CA 1.502 63.437 62.100 -0.276 0.000 1.146 83 T CB -0.321 68.330 68.868 -0.361 0.000 0.865 83 T HN 0.639 8.879 8.240 -0.000 0.000 0.435 84 Q N 0.444 120.135 119.800 -0.182 0.000 2.124 84 Q HA -0.123 4.216 4.340 -0.001 0.000 0.202 84 Q C 2.395 178.344 176.000 -0.086 0.000 0.977 84 Q CA 1.284 57.023 55.803 -0.106 0.000 0.850 84 Q CB -0.102 28.671 28.738 0.058 0.000 0.901 84 Q HN 0.621 8.891 8.270 -0.000 0.000 0.429 85 E N 0.358 120.512 120.200 -0.076 0.000 2.072 85 E HA -0.141 4.209 4.350 -0.001 0.000 0.191 85 E C 2.006 178.548 176.600 -0.097 0.000 0.985 85 E CA 0.660 57.030 56.400 -0.051 0.000 0.801 85 E CB 0.029 29.704 29.700 -0.041 0.000 0.750 85 E HN 0.298 8.658 8.360 -0.000 0.000 0.452 86 L N 0.362 121.503 121.223 -0.137 0.000 2.046 86 L HA -0.202 4.137 4.340 -0.001 0.000 0.208 86 L C 2.192 178.888 176.870 -0.291 0.000 1.077 86 L CA 0.524 55.275 54.840 -0.149 0.000 0.747 86 L CB -0.191 41.802 42.059 -0.110 0.000 0.896 86 L HN 0.198 8.428 8.230 -0.000 0.000 0.432 87 L N -1.262 119.674 121.223 -0.477 0.000 2.023 87 L HA -0.114 4.226 4.340 -0.001 0.000 0.205 87 L C 2.013 178.518 176.870 -0.609 0.000 1.073 87 L CA 1.902 56.299 54.840 -0.739 0.000 0.745 87 L CB -0.949 40.413 42.059 -1.162 0.000 0.900 87 L HN 0.104 8.334 8.230 -0.000 0.000 0.435 88 F N -0.528 119.349 119.950 -0.121 0.000 2.727 88 F HA 0.521 5.047 4.527 -0.001 0.000 0.302 88 F C 1.370 177.129 175.800 -0.068 0.000 1.097 88 F CA -0.045 57.900 58.000 -0.091 0.000 1.330 88 F CB -0.736 38.219 39.000 -0.074 0.000 1.084 88 F HN 0.134 8.434 8.300 -0.000 0.000 0.578 89 G N 1.238 110.072 108.800 0.057 0.000 2.733 89 G HA2 -0.272 3.687 3.960 -0.001 0.000 0.686 89 G HA3 -0.272 3.687 3.960 -0.001 0.000 0.686 89 G C 0.876 175.802 174.900 0.043 0.000 1.373 89 G CA -0.221 44.899 45.100 0.032 0.000 0.838 89 G HN 0.442 8.732 8.290 -0.000 0.000 0.588 90 K N -0.247 120.164 120.400 0.017 0.000 2.107 90 K HA -0.076 4.243 4.320 -0.001 0.000 0.211 90 K C 1.743 178.352 176.600 0.014 0.000 1.049 90 K CA 2.492 58.786 56.287 0.011 0.000 0.927 90 K CB -0.129 32.374 32.500 0.004 0.000 0.714 90 K HN 1.614 9.864 8.250 -0.000 0.000 0.452 91 G N 1.314 110.123 108.800 0.015 0.000 4.100 91 G HA2 0.085 4.044 3.960 -0.001 0.000 0.294 91 G HA3 0.085 4.044 3.960 -0.001 0.000 0.294 91 G C -0.412 174.491 174.900 0.005 0.000 1.040 91 G CA -0.076 45.028 45.100 0.007 0.000 0.829 91 G HN 0.399 8.689 8.290 -0.000 0.000 0.505 92 S N 0.127 115.836 115.700 0.014 0.000 2.568 92 S HA 0.462 4.932 4.470 -0.001 0.000 0.282 92 S C 1.930 176.508 174.600 -0.037 0.000 1.338 92 S CA 0.579 58.775 58.200 -0.006 0.000 1.045 92 S CB 1.522 64.730 63.200 0.013 0.000 0.873 92 S HN 0.758 9.068 8.310 -0.000 0.000 0.516 93 A N 4.302 127.092 122.820 -0.051 0.000 1.917 93 A HA -0.058 4.261 4.320 -0.001 0.000 0.219 93 A C 2.287 179.814 177.584 -0.096 0.000 1.182 93 A CA 1.682 53.682 52.037 -0.061 0.000 0.633 93 A CB -1.010 17.955 19.000 -0.058 0.000 0.819 93 A HN 0.899 9.049 8.150 -0.000 0.000 0.448 94 L N -0.785 120.339 121.223 -0.166 0.000 2.089 94 L HA -0.242 4.097 4.340 -0.001 0.000 0.213 94 L C 2.486 179.257 176.870 -0.165 0.000 1.079 94 L CA 1.879 56.568 54.840 -0.252 0.000 0.758 94 L CB -0.971 40.736 42.059 -0.587 0.000 0.891 94 L HN 0.463 8.693 8.230 -0.000 0.000 0.433 95 I N -0.661 119.852 120.570 -0.096 0.000 2.400 95 I HA -0.169 4.000 4.170 -0.001 0.000 0.248 95 I C 2.033 178.128 176.117 -0.037 0.000 1.109 95 I CA 0.641 61.920 61.300 -0.035 0.000 1.425 95 I CB -0.273 37.738 38.000 0.019 0.000 1.094 95 I HN 0.274 8.484 8.210 -0.000 0.000 0.425 96 N N 0.715 119.393 118.700 -0.037 0.000 2.409 96 N HA -0.109 4.630 4.740 -0.001 0.000 0.179 96 N C 0.969 176.460 175.510 -0.032 0.000 1.032 96 N CA 1.020 54.053 53.050 -0.028 0.000 0.898 96 N CB -0.146 38.328 38.487 -0.023 0.000 0.971 96 N HN 0.261 8.641 8.380 -0.000 0.000 0.441 97 D N 0.641 121.015 120.400 -0.043 0.000 2.340 97 D HA 0.018 4.657 4.640 -0.001 0.000 0.220 97 D C 0.189 176.464 176.300 -0.041 0.000 1.039 97 D CA 0.258 54.234 54.000 -0.039 0.000 0.866 97 D CB 0.164 40.937 40.800 -0.046 0.000 0.913 97 D HN -0.128 8.242 8.370 -0.000 0.000 0.523 98 K N 0.218 120.590 120.400 -0.047 0.000 3.162 98 K HA -0.207 4.112 4.320 -0.001 0.000 0.268 98 K C 0.423 176.988 176.600 -0.058 0.000 1.062 98 K CA 0.193 56.451 56.287 -0.048 0.000 0.769 98 K CB -1.452 31.028 32.500 -0.033 0.000 1.274 98 K HN 0.369 8.619 8.250 -0.000 0.000 0.478 99 R N -1.058 119.396 120.500 -0.077 0.000 2.334 99 R HA 0.193 4.532 4.340 -0.001 0.000 0.216 99 R C 0.650 176.898 176.300 -0.088 0.000 0.905 99 R CA 0.675 56.729 56.100 -0.076 0.000 1.064 99 R CB 0.732 30.980 30.300 -0.087 0.000 1.046 99 R HN 0.248 8.518 8.270 -0.000 0.000 0.508 100 A N 1.511 124.272 122.820 -0.099 0.000 2.355 100 A HA 0.653 4.972 4.320 -0.001 0.000 0.317 100 A C -0.669 176.822 177.584 -0.154 0.000 1.094 100 A CA -0.811 51.176 52.037 -0.083 0.000 0.764 100 A CB 1.243 20.243 19.000 -0.000 0.000 1.230 100 A HN -0.035 8.115 8.150 -0.000 0.000 0.448 101 R N 1.032 121.363 120.500 -0.281 0.000 2.670 101 R HA 0.725 5.064 4.340 -0.001 0.000 0.289 101 R C -1.145 174.852 176.300 -0.505 0.000 0.965 101 R CA -0.489 55.231 56.100 -0.634 0.000 0.899 101 R CB 1.554 31.006 30.300 -1.413 0.000 1.173 101 R HN 0.656 8.926 8.270 -0.000 0.000 0.456 102 T N 1.026 115.380 114.554 -0.333 0.000 2.812 102 T HA 0.637 4.986 4.350 -0.001 0.000 0.282 102 T C -0.677 174.173 174.700 0.250 0.000 0.990 102 T CA -0.586 61.516 62.100 0.004 0.000 0.960 102 T CB 1.807 70.681 68.868 0.009 0.000 0.948 102 T HN 0.597 8.836 8.240 -0.000 0.000 0.438 103 A N 3.270 126.326 122.820 0.393 0.000 2.288 103 A HA 0.617 4.936 4.320 -0.001 0.000 0.320 103 A C 0.135 177.895 177.584 0.293 0.000 1.217 103 A CA -0.736 51.535 52.037 0.390 0.000 0.840 103 A CB 0.784 19.963 19.000 0.298 0.000 1.179 103 A HN 0.805 8.955 8.150 -0.000 0.000 0.504 104 Q N 1.384 121.342 119.800 0.263 0.000 2.373 104 Q HA 0.441 4.781 4.340 -0.001 0.000 0.255 104 Q C -0.632 175.436 176.000 0.113 0.000 0.980 104 Q CA 0.420 56.334 55.803 0.185 0.000 0.882 104 Q CB 0.640 29.345 28.738 -0.055 0.000 1.249 104 Q HN 0.650 8.920 8.270 -0.000 0.000 0.438 105 T N 3.082 117.667 114.554 0.051 0.000 2.883 105 T HA 0.421 4.771 4.350 -0.001 0.000 0.301 105 T C -2.733 171.891 174.700 -0.128 0.000 1.158 105 T CA -1.513 60.605 62.100 0.029 0.000 1.007 105 T CB 1.564 70.504 68.868 0.121 0.000 1.186 105 T HN 0.482 8.722 8.240 -0.000 0.000 0.499 106 P HA 0.315 4.735 4.420 -0.000 0.000 0.252 106 P C 0.419 177.656 177.300 -0.104 0.000 1.635 106 P CA 0.623 63.576 63.100 -0.245 0.000 1.206 106 P CB -0.677 30.801 31.700 -0.370 0.000 1.911 107 G N 2.132 110.900 108.800 -0.053 0.000 2.795 107 G HA2 -0.104 3.856 3.960 -0.001 0.000 0.664 107 G HA3 -0.104 3.856 3.960 -0.001 0.000 0.664 107 G C 1.016 175.918 174.900 0.003 0.000 1.381 107 G CA -0.523 44.569 45.100 -0.012 0.000 0.853 107 G HN 0.440 8.730 8.290 -0.000 0.000 0.545 108 G N -1.225 107.567 108.800 -0.014 0.000 2.422 108 G HA2 0.034 3.993 3.960 -0.001 0.000 0.218 108 G HA3 0.034 3.993 3.960 -0.001 0.000 0.218 108 G C 1.908 176.824 174.900 0.026 0.000 1.146 108 G CA 2.422 47.508 45.100 -0.023 0.000 0.769 108 G HN 1.408 9.698 8.290 -0.000 0.000 0.547 109 T N 1.065 115.654 114.554 0.059 0.000 2.720 109 T HA -0.068 4.282 4.350 -0.001 0.000 0.268 109 T C 2.476 177.219 174.700 0.071 0.000 1.037 109 T CA 1.388 63.564 62.100 0.127 0.000 1.144 109 T CB -0.548 68.425 68.868 0.176 0.000 0.864 109 T HN 0.349 8.589 8.240 -0.000 0.000 0.444 110 G N 0.910 109.737 108.800 0.046 0.000 2.443 110 G HA2 0.033 3.992 3.960 -0.001 0.000 0.219 110 G HA3 0.033 3.992 3.960 -0.001 0.000 0.219 110 G C 1.769 176.727 174.900 0.097 0.000 1.131 110 G CA 0.785 45.919 45.100 0.056 0.000 0.775 110 G HN 0.593 8.883 8.290 -0.000 0.000 0.547 111 A N 0.439 123.311 122.820 0.087 0.000 1.898 111 A HA 0.104 4.423 4.320 -0.001 0.000 0.216 111 A C 2.315 179.968 177.584 0.116 0.000 1.181 111 A CA 1.242 53.346 52.037 0.111 0.000 0.620 111 A CB -0.386 18.674 19.000 0.100 0.000 0.819 111 A HN 0.288 8.438 8.150 -0.000 0.000 0.442 112 L N -0.398 120.877 121.223 0.087 0.000 1.994 112 L HA -0.124 4.216 4.340 -0.001 0.000 0.208 112 L C 2.540 179.389 176.870 -0.035 0.000 1.071 112 L CA 2.270 57.132 54.840 0.037 0.000 0.745 112 L CB -0.985 41.075 42.059 0.000 0.000 0.892 112 L HN 0.467 8.697 8.230 -0.000 0.000 0.431 113 R N -0.200 120.281 120.500 -0.032 0.000 2.073 113 R HA -0.129 4.210 4.340 -0.001 0.000 0.234 113 R C 2.235 178.579 176.300 0.074 0.000 1.134 113 R CA 2.051 58.142 56.100 -0.014 0.000 0.952 113 R CB -0.937 29.370 30.300 0.011 0.000 0.850 113 R HN 0.355 8.625 8.270 -0.000 0.000 0.433 114 V N -1.303 118.683 119.914 0.119 0.000 2.490 114 V HA -0.040 4.079 4.120 -0.001 0.000 0.250 114 V C 2.140 178.351 176.094 0.195 0.000 1.061 114 V CA 1.697 64.079 62.300 0.138 0.000 1.064 114 V CB -1.244 30.655 31.823 0.127 0.000 0.670 114 V HN 0.341 8.531 8.190 -0.000 0.000 0.461 115 A N 0.965 123.914 122.820 0.215 0.000 1.877 115 A HA 0.021 4.340 4.320 -0.001 0.000 0.216 115 A C 2.556 180.368 177.584 0.379 0.000 1.186 115 A CA 2.610 54.841 52.037 0.324 0.000 0.620 115 A CB -1.214 17.973 19.000 0.312 0.000 0.822 115 A HN 1.006 9.156 8.150 -0.000 0.000 0.443 116 A N -0.166 122.826 122.820 0.288 0.000 1.902 116 A HA -0.208 4.112 4.320 -0.001 0.000 0.217 116 A C 1.820 179.519 177.584 0.192 0.000 1.181 116 A CA 1.859 54.061 52.037 0.276 0.000 0.623 116 A CB -0.564 18.544 19.000 0.179 0.000 0.818 116 A HN 0.522 8.672 8.150 -0.000 0.000 0.443 117 D N -1.358 119.138 120.400 0.160 0.000 2.183 117 D HA -0.080 4.559 4.640 -0.001 0.000 0.203 117 D C 1.654 178.033 176.300 0.131 0.000 0.969 117 D CA 1.218 55.287 54.000 0.114 0.000 0.842 117 D CB -0.288 40.564 40.800 0.086 0.000 0.957 117 D HN 0.531 8.901 8.370 -0.000 0.000 0.484 118 F N 1.472 121.459 119.950 0.062 0.000 2.113 118 F HA -0.170 4.356 4.527 -0.001 0.000 0.297 118 F C 1.950 177.795 175.800 0.075 0.000 1.103 118 F CA 0.875 58.911 58.000 0.060 0.000 1.248 118 F CB -0.256 38.789 39.000 0.075 0.000 0.999 118 F HN -0.174 8.126 8.300 -0.000 0.000 0.475 119 L N 0.936 122.071 121.223 -0.148 0.000 2.056 119 L HA 0.021 4.361 4.340 -0.001 0.000 0.207 119 L C 2.699 179.482 176.870 -0.145 0.000 1.078 119 L CA 1.920 56.626 54.840 -0.223 0.000 0.749 119 L CB -1.704 40.409 42.059 0.090 0.000 0.901 119 L HN 0.289 8.519 8.230 -0.000 0.000 0.433 120 A N -1.330 121.469 122.820 -0.035 0.000 2.015 120 A HA -0.183 4.136 4.320 -0.001 0.000 0.219 120 A C 2.238 179.789 177.584 -0.054 0.000 1.163 120 A CA 1.522 53.546 52.037 -0.022 0.000 0.646 120 A CB -0.312 18.699 19.000 0.018 0.000 0.806 120 A HN 0.423 8.573 8.150 -0.000 0.000 0.448 121 K N -1.046 119.302 120.400 -0.086 0.000 2.352 121 K HA 0.145 4.464 4.320 -0.001 0.000 0.194 121 K C 0.510 177.046 176.600 -0.106 0.000 1.038 121 K CA 0.465 56.711 56.287 -0.069 0.000 1.023 121 K CB 0.279 32.756 32.500 -0.037 0.000 0.840 121 K HN 0.393 8.643 8.250 -0.000 0.000 0.519 122 N N -0.341 118.235 118.700 -0.207 0.000 2.143 122 N HA 0.059 4.798 4.740 -0.001 0.000 0.222 122 N C -0.284 175.113 175.510 -0.187 0.000 1.264 122 N CA 0.209 53.137 53.050 -0.204 0.000 0.897 122 N CB 1.687 39.994 38.487 -0.300 0.000 1.092 122 N HN -0.093 8.287 8.380 -0.000 0.000 0.516 123 T N -0.501 113.943 114.554 -0.184 0.000 2.864 123 T HA 0.215 4.564 4.350 -0.001 0.000 0.289 123 T C 0.877 175.545 174.700 -0.052 0.000 1.082 123 T CA -0.395 61.642 62.100 -0.105 0.000 1.009 123 T CB 1.756 70.558 68.868 -0.110 0.000 1.234 123 T HN 0.008 8.248 8.240 -0.000 0.000 0.526 124 S N -0.175 115.515 115.700 -0.016 0.000 2.575 124 S HA 0.172 4.641 4.470 -0.001 0.000 0.215 124 S C 0.728 175.335 174.600 0.013 0.000 0.966 124 S CA -0.362 57.839 58.200 0.002 0.000 0.911 124 S CB -0.259 62.952 63.200 0.017 0.000 0.780 124 S HN 0.438 8.748 8.310 -0.000 0.000 0.514 125 V N 2.718 122.640 119.914 0.014 0.000 2.720 125 V HA 0.147 4.267 4.120 -0.001 0.000 0.307 125 V C 0.328 176.428 176.094 0.009 0.000 1.071 125 V CA 0.585 62.901 62.300 0.027 0.000 1.199 125 V CB 0.436 32.276 31.823 0.028 0.000 0.900 125 V HN 0.562 8.752 8.190 -0.000 0.000 0.494 134 W N 6.279 127.416 121.300 -0.272 0.000 2.335 134 W HA 0.693 5.352 4.660 -0.001 0.000 0.307 134 W C 0.288 176.739 176.519 -0.113 0.000 1.117 134 W CA -0.027 57.225 57.345 -0.155 0.000 1.228 134 W CB 1.732 31.094 29.460 -0.163 0.000 1.240 134 W HN 0.760 8.940 8.180 -0.000 0.000 0.468 135 V N 0.946 120.850 119.914 -0.018 0.000 3.103 135 V HA 0.772 4.892 4.120 -0.001 0.000 0.318 135 V C 0.231 176.038 176.094 -0.479 0.000 1.114 135 V CA -1.156 61.042 62.300 -0.169 0.000 1.020 135 V CB 1.270 33.009 31.823 -0.140 0.000 1.085 135 V HN 0.480 8.670 8.190 -0.000 0.000 0.446 136 S N 1.409 116.704 115.700 -0.676 0.000 2.632 136 S HA 0.361 4.830 4.470 -0.001 0.000 0.267 136 S C -0.117 174.299 174.600 -0.307 0.000 1.276 136 S CA -0.567 57.100 58.200 -0.888 0.000 0.998 136 S CB 0.727 63.481 63.200 -0.743 0.000 0.953 136 S HN 1.058 9.368 8.310 -0.000 0.000 0.547 137 N N 2.345 120.951 118.700 -0.157 0.000 2.476 137 N HA 0.375 5.114 4.740 -0.001 0.000 0.257 137 N C -2.778 172.815 175.510 0.138 0.000 0.970 137 N CA -1.694 51.369 53.050 0.021 0.000 0.938 137 N CB 1.529 40.049 38.487 0.056 0.000 1.144 137 N HN 0.494 8.874 8.380 -0.000 0.000 0.500 138 P HA 0.271 4.691 4.420 -0.000 0.000 0.278 138 P C -0.781 176.568 177.300 0.082 0.000 1.266 138 P CA -0.357 62.817 63.100 0.122 0.000 0.807 138 P CB 1.727 33.543 31.700 0.193 0.000 1.094 139 S N -1.081 114.663 115.700 0.074 0.000 2.685 139 S HA 0.429 4.898 4.470 -0.001 0.000 0.282 139 S C -1.688 173.026 174.600 0.191 0.000 1.159 139 S CA -0.703 57.577 58.200 0.133 0.000 0.833 139 S CB 0.222 63.591 63.200 0.281 0.000 1.151 139 S HN 0.455 8.765 8.310 -0.000 0.000 0.485 140 W N 3.603 124.923 121.300 0.033 0.000 2.385 140 W HA 0.256 4.915 4.660 -0.001 0.000 0.336 140 W C -2.263 174.206 176.519 -0.083 0.000 1.351 140 W CA -1.122 56.154 57.345 -0.115 0.000 1.295 140 W CB 0.013 29.301 29.460 -0.288 0.000 1.239 140 W HN 0.562 8.742 8.180 -0.000 0.000 0.565 141 P HA -0.263 4.157 4.420 -0.000 0.000 0.217 141 P C 1.165 178.170 177.300 -0.491 0.000 1.148 141 P CA 2.090 65.015 63.100 -0.292 0.000 0.828 141 P CB 0.200 31.751 31.700 -0.248 0.000 0.783 142 N N -2.080 115.963 118.700 -1.096 0.000 2.521 142 N HA -0.087 4.653 4.740 -0.001 0.000 0.188 142 N C 1.367 176.458 175.510 -0.697 0.000 1.146 142 N CA 0.479 52.886 53.050 -1.072 0.000 0.893 142 N CB -0.504 36.945 38.487 -1.730 0.000 0.975 142 N HN 0.280 8.660 8.380 -0.000 0.000 0.451 143 H N -0.835 118.015 119.070 -0.366 0.000 2.389 143 H HA -0.030 4.525 4.556 -0.001 0.000 0.299 143 H C 1.917 177.292 175.328 0.079 0.000 1.081 143 H CA 1.117 57.160 56.048 -0.009 0.000 1.345 143 H CB 0.290 30.180 29.762 0.214 0.000 1.393 143 H HN 0.159 8.439 8.280 -0.000 0.000 0.520 144 K N 0.516 120.987 120.400 0.118 0.000 2.057 144 K HA -0.100 4.219 4.320 -0.001 0.000 0.206 144 K C 2.028 178.641 176.600 0.021 0.000 1.050 144 K CA 1.634 57.971 56.287 0.083 0.000 0.935 144 K CB 0.164 32.666 32.500 0.003 0.000 0.715 144 K HN 0.102 8.352 8.250 -0.000 0.000 0.439 145 S N 0.518 116.167 115.700 -0.085 0.000 2.406 145 S HA -0.102 4.367 4.470 -0.001 0.000 0.228 145 S C 1.964 176.497 174.600 -0.111 0.000 1.020 145 S CA 1.023 59.162 58.200 -0.102 0.000 0.965 145 S CB -0.035 63.073 63.200 -0.153 0.000 0.798 145 S HN 0.408 8.718 8.310 -0.000 0.000 0.488 146 V N -0.016 119.784 119.914 -0.190 0.000 2.453 146 V HA -0.035 4.084 4.120 -0.001 0.000 0.247 146 V C 1.798 177.751 176.094 -0.235 0.000 1.048 146 V CA 1.407 63.561 62.300 -0.243 0.000 1.049 146 V CB -0.955 30.667 31.823 -0.334 0.000 0.672 146 V HN 0.319 8.509 8.190 -0.000 0.000 0.457 147 F N 1.714 121.672 119.950 0.013 0.000 2.186 147 F HA 0.020 4.546 4.527 -0.001 0.000 0.299 147 F C 2.389 178.179 175.800 -0.016 0.000 1.090 147 F CA 2.025 60.029 58.000 0.006 0.000 1.307 147 F CB -1.144 37.851 39.000 -0.009 0.000 1.019 147 F HN 0.228 8.528 8.300 -0.000 0.000 0.489 148 N N -0.215 118.565 118.700 0.133 0.000 2.120 148 N HA -0.180 4.559 4.740 -0.001 0.000 0.188 148 N C 1.876 177.402 175.510 0.026 0.000 1.024 148 N CA 1.383 54.465 53.050 0.054 0.000 0.852 148 N CB -0.196 38.299 38.487 0.013 0.000 1.003 148 N HN 0.229 8.609 8.380 -0.000 0.000 0.424 149 S N 0.006 115.707 115.700 0.002 0.000 2.537 149 S HA 0.013 4.482 4.470 -0.001 0.000 0.240 149 S C 1.577 176.183 174.600 0.011 0.000 0.981 149 S CA 0.737 58.933 58.200 -0.006 0.000 0.948 149 S CB 0.020 63.204 63.200 -0.026 0.000 0.759 149 S HN 0.337 8.647 8.310 -0.000 0.000 0.531 150 A N 0.536 123.376 122.820 0.034 0.000 2.220 150 A HA 0.633 4.952 4.320 -0.001 0.000 0.211 150 A C 1.549 179.159 177.584 0.044 0.000 1.176 150 A CA 0.318 52.384 52.037 0.048 0.000 0.834 150 A CB -0.498 18.555 19.000 0.087 0.000 0.868 150 A HN 1.517 9.667 8.150 -0.000 0.000 0.488 151 G N -1.269 107.555 108.800 0.040 0.000 2.167 151 G HA2 -0.084 3.876 3.960 -0.001 0.000 0.194 151 G HA3 -0.084 3.876 3.960 -0.001 0.000 0.194 151 G C -0.335 174.578 174.900 0.023 0.000 1.027 151 G CA 0.161 45.275 45.100 0.023 0.000 0.717 151 G HN 0.302 8.592 8.290 -0.000 0.000 0.501 155 V N 2.559 122.346 119.914 -0.210 0.000 2.459 155 V HA 0.804 4.923 4.120 -0.001 0.000 0.295 155 V C -0.913 174.963 176.094 -0.364 0.000 1.029 155 V CA -0.532 61.596 62.300 -0.287 0.000 0.874 155 V CB 1.549 33.285 31.823 -0.144 0.000 0.985 155 V HN 0.618 8.808 8.190 -0.000 0.000 0.438 156 R N 3.506 123.653 120.500 -0.589 0.000 2.832 156 R HA 0.605 4.944 4.340 -0.001 0.000 0.271 156 R C -0.886 175.191 176.300 -0.372 0.000 0.996 156 R CA -0.603 55.063 56.100 -0.722 0.000 0.977 156 R CB 2.304 31.560 30.300 -1.740 0.000 1.168 156 R HN 0.866 9.136 8.270 -0.000 0.000 0.482 157 E N 2.117 122.245 120.200 -0.119 0.000 2.158 157 E HA 0.219 4.568 4.350 -0.001 0.000 0.271 157 E C -0.841 175.931 176.600 0.287 0.000 0.911 157 E CA -0.569 55.860 56.400 0.048 0.000 0.767 157 E CB 1.504 31.201 29.700 -0.005 0.000 1.120 157 E HN 0.400 8.760 8.360 -0.000 0.000 0.405 158 Y N 0.692 121.143 120.300 0.252 0.000 2.374 158 Y HA 0.693 5.242 4.550 -0.001 0.000 0.322 158 Y C 0.129 176.125 175.900 0.159 0.000 1.275 158 Y CA -1.313 56.900 58.100 0.187 0.000 1.307 158 Y CB 0.472 38.974 38.460 0.070 0.000 1.282 158 Y HN 0.415 8.695 8.280 -0.000 0.000 0.509 159 A N 0.955 123.959 122.820 0.307 0.000 2.287 159 A HA 0.481 4.800 4.320 -0.001 0.000 0.273 159 A C -0.714 177.069 177.584 0.331 0.000 1.091 159 A CA -0.029 52.143 52.037 0.225 0.000 0.817 159 A CB 0.184 19.275 19.000 0.153 0.000 1.069 159 A HN 1.030 9.180 8.150 -0.000 0.000 0.492 160 Y N -0.888 119.475 120.300 0.105 0.000 3.042 160 Y HA 0.200 4.749 4.550 -0.001 0.000 0.230 160 Y C -0.337 175.634 175.900 0.117 0.000 1.107 160 Y CA 0.109 58.269 58.100 0.098 0.000 1.346 160 Y CB 0.056 38.502 38.460 -0.022 0.000 1.421 160 Y HN 0.682 8.962 8.280 -0.000 0.000 0.438 161 Y N 2.651 123.020 120.300 0.115 0.000 2.352 161 Y HA 0.462 5.011 4.550 -0.001 0.000 0.326 161 Y C -0.731 175.173 175.900 0.006 0.000 1.166 161 Y CA -1.179 56.950 58.100 0.047 0.000 1.182 161 Y CB 0.955 39.523 38.460 0.180 0.000 1.216 161 Y HN 0.135 8.415 8.280 -0.000 0.000 0.474 162 D N 4.238 124.268 120.400 -0.618 0.000 2.443 162 D HA 0.315 4.955 4.640 -0.001 0.000 0.221 162 D C 0.377 176.024 176.300 -1.089 0.000 1.097 162 D CA 0.041 53.675 54.000 -0.610 0.000 0.865 162 D CB 1.280 41.853 40.800 -0.377 0.000 1.034 162 D HN 0.766 9.136 8.370 -0.000 0.000 0.511 163 A N 3.912 126.239 122.820 -0.823 0.000 2.121 163 A HA -0.112 4.207 4.320 -0.001 0.000 0.218 163 A C 1.664 178.887 177.584 -0.601 0.000 1.154 163 A CA 1.151 52.794 52.037 -0.655 0.000 0.679 163 A CB -0.091 18.773 19.000 -0.227 0.000 0.795 163 A HN 0.667 8.817 8.150 -0.000 0.000 0.458 164 E N -0.509 119.359 120.200 -0.552 0.000 2.065 164 E HA -0.015 4.334 4.350 -0.001 0.000 0.191 164 E C 1.146 177.383 176.600 -0.605 0.000 0.960 164 E CA 0.571 56.692 56.400 -0.466 0.000 0.824 164 E CB -0.123 29.406 29.700 -0.285 0.000 0.793 164 E HN 0.460 8.820 8.360 -0.000 0.000 0.459 165 N N 0.429 118.835 118.700 -0.489 0.000 2.422 165 N HA -0.038 4.701 4.740 -0.001 0.000 0.181 165 N C -0.593 174.720 175.510 -0.328 0.000 1.080 165 N CA 0.479 53.324 53.050 -0.341 0.000 0.893 165 N CB 0.275 38.646 38.487 -0.194 0.000 0.973 165 N HN 0.232 8.612 8.380 -0.000 0.000 0.456 166 H N -0.197 118.663 119.070 -0.350 0.000 2.827 166 H HA -0.105 4.450 4.556 -0.001 0.000 0.330 166 H C -0.353 174.942 175.328 -0.055 0.000 1.236 166 H CA 0.895 56.791 56.048 -0.255 0.000 1.165 166 H CB -2.031 27.394 29.762 -0.562 0.000 1.532 166 H HN 0.155 8.435 8.280 -0.000 0.000 0.434 167 T N -0.381 114.143 114.554 -0.051 0.000 2.681 167 T HA 0.410 4.760 4.350 -0.001 0.000 0.296 167 T C 0.357 175.020 174.700 -0.062 0.000 1.157 167 T CA -0.984 61.113 62.100 -0.005 0.000 1.025 167 T CB 2.307 71.142 68.868 -0.054 0.000 1.441 167 T HN 0.189 8.429 8.240 -0.000 0.000 0.504 168 L N 2.333 123.471 121.223 -0.143 0.000 2.315 168 L HA 0.314 4.653 4.340 -0.001 0.000 0.283 168 L C -0.565 176.205 176.870 -0.165 0.000 1.089 168 L CA -0.186 54.468 54.840 -0.310 0.000 0.833 168 L CB 0.465 42.308 42.059 -0.360 0.000 1.170 168 L HN 0.653 8.883 8.230 -0.000 0.000 0.442 169 D N 4.413 124.732 120.400 -0.134 0.000 2.441 169 D HA -0.023 4.616 4.640 -0.001 0.000 0.221 169 D C 0.647 176.971 176.300 0.041 0.000 1.156 169 D CA -0.165 53.807 54.000 -0.048 0.000 0.896 169 D CB 0.636 41.400 40.800 -0.059 0.000 1.028 169 D HN 0.441 8.811 8.370 -0.000 0.000 0.509 170 F N 3.005 122.883 119.950 -0.120 0.000 2.163 170 F HA -0.082 4.444 4.527 -0.001 0.000 0.297 170 F C 1.459 177.234 175.800 -0.041 0.000 1.094 170 F CA 1.145 59.092 58.000 -0.090 0.000 1.290 170 F CB 0.076 39.026 39.000 -0.083 0.000 1.017 170 F HN 0.331 8.631 8.300 -0.000 0.000 0.483 171 D N -0.025 120.401 120.400 0.043 0.000 2.097 171 D HA -0.148 4.491 4.640 -0.001 0.000 0.195 171 D C 2.312 178.572 176.300 -0.065 0.000 0.989 171 D CA 1.538 55.509 54.000 -0.048 0.000 0.827 171 D CB -0.413 40.386 40.800 -0.002 0.000 0.966 171 D HN 0.282 8.652 8.370 -0.000 0.000 0.456 172 A N 0.503 123.307 122.820 -0.027 0.000 2.019 172 A HA -0.105 4.214 4.320 -0.001 0.000 0.219 172 A C 2.008 179.591 177.584 -0.002 0.000 1.164 172 A CA 0.984 53.014 52.037 -0.012 0.000 0.644 172 A CB -0.555 18.451 19.000 0.010 0.000 0.805 172 A HN 0.300 8.450 8.150 -0.000 0.000 0.449 173 L N -0.562 120.652 121.223 -0.015 0.000 2.072 173 L HA -0.033 4.307 4.340 -0.001 0.000 0.205 173 L C 1.959 178.764 176.870 -0.108 0.000 1.079 173 L CA 1.549 56.410 54.840 0.035 0.000 0.752 173 L CB -0.699 41.432 42.059 0.120 0.000 0.906 173 L HN 0.244 8.474 8.230 -0.000 0.000 0.436 174 I N 0.870 121.284 120.570 -0.261 0.000 2.163 174 I HA -0.285 3.885 4.170 -0.001 0.000 0.243 174 I C 2.316 178.357 176.117 -0.126 0.000 1.085 174 I CA 1.354 62.508 61.300 -0.244 0.000 1.347 174 I CB -1.602 36.201 38.000 -0.328 0.000 1.044 174 I HN 0.422 8.632 8.210 -0.000 0.000 0.408 175 N N 1.062 119.701 118.700 -0.101 0.000 2.120 175 N HA -0.142 4.597 4.740 -0.001 0.000 0.188 175 N C 2.036 177.518 175.510 -0.047 0.000 1.024 175 N CA 1.884 54.900 53.050 -0.057 0.000 0.852 175 N CB -0.355 38.109 38.487 -0.037 0.000 1.003 175 N HN 0.446 8.826 8.380 -0.000 0.000 0.424 176 S N 0.551 116.234 115.700 -0.029 0.000 2.402 176 S HA 0.016 4.486 4.470 -0.001 0.000 0.229 176 S C 2.044 176.538 174.600 -0.177 0.000 1.021 176 S CA 0.479 58.672 58.200 -0.012 0.000 0.974 176 S CB -0.512 62.747 63.200 0.099 0.000 0.800 176 S HN 0.231 8.541 8.310 -0.000 0.000 0.484 177 L N 1.666 122.746 121.223 -0.239 0.000 2.376 177 L HA 0.049 4.388 4.340 -0.001 0.000 0.219 177 L C 2.286 178.969 176.870 -0.312 0.000 1.133 177 L CA 0.603 55.157 54.840 -0.477 0.000 0.816 177 L CB -0.606 41.227 42.059 -0.378 0.000 0.933 177 L HN 0.473 8.703 8.230 -0.000 0.000 0.449 178 N N -0.137 118.493 118.700 -0.117 0.000 2.381 178 N HA -0.146 4.593 4.740 -0.001 0.000 0.182 178 N C 1.211 176.700 175.510 -0.035 0.000 1.025 178 N CA 0.613 53.662 53.050 -0.002 0.000 0.888 178 N CB 0.226 38.712 38.487 -0.002 0.000 0.965 178 N HN 0.327 8.707 8.380 -0.000 0.000 0.438 179 E N 0.854 120.977 120.200 -0.128 0.000 2.338 179 E HA -0.004 4.345 4.350 -0.001 0.000 0.197 179 E C 0.496 177.049 176.600 -0.077 0.000 1.007 179 E CA 0.061 56.432 56.400 -0.048 0.000 0.849 179 E CB -0.140 29.601 29.700 0.068 0.000 0.774 179 E HN 0.245 8.605 8.360 -0.000 0.000 0.506 180 A N 1.394 123.935 122.820 -0.464 0.000 2.409 180 A HA 0.211 4.530 4.320 -0.001 0.000 0.262 180 A C 0.323 177.949 177.584 0.071 0.000 1.113 180 A CA -0.251 51.492 52.037 -0.489 0.000 0.790 180 A CB 0.357 18.380 19.000 -1.628 0.000 1.046 180 A HN -0.015 8.135 8.150 -0.000 0.000 0.496 181 Q N 0.516 120.441 119.800 0.207 0.000 2.308 181 Q HA 0.578 4.917 4.340 -0.001 0.000 0.207 181 Q C 0.399 176.603 176.000 0.341 0.000 1.035 181 Q CA 0.206 56.163 55.803 0.257 0.000 1.008 181 Q CB 0.935 29.788 28.738 0.192 0.000 1.168 181 Q HN 0.955 9.225 8.270 -0.000 0.000 0.565 182 A N 0.019 122.982 122.820 0.237 0.000 2.401 182 A HA 0.494 4.814 4.320 -0.001 0.000 0.259 182 A C 0.801 178.502 177.584 0.194 0.000 1.103 182 A CA 0.428 52.592 52.037 0.212 0.000 0.789 182 A CB -0.581 18.485 19.000 0.111 0.000 1.035 182 A HN 0.971 9.121 8.150 -0.000 0.000 0.491 183 G N 1.832 110.760 108.800 0.213 0.000 2.143 183 G HA2 -0.171 3.788 3.960 -0.001 0.000 0.249 183 G HA3 -0.171 3.788 3.960 -0.001 0.000 0.249 183 G C -0.200 174.805 174.900 0.174 0.000 0.981 183 G CA 0.317 45.520 45.100 0.172 0.000 0.665 183 G HN 0.804 9.094 8.290 -0.000 0.000 0.528 184 D N -0.100 120.434 120.400 0.224 0.000 2.225 184 D HA 0.515 5.154 4.640 -0.001 0.000 0.249 184 D C 0.766 177.173 176.300 0.178 0.000 1.052 184 D CA 0.199 54.321 54.000 0.203 0.000 0.909 184 D CB 2.002 42.966 40.800 0.274 0.000 1.186 184 D HN 0.721 9.091 8.370 -0.000 0.000 0.431 185 V N 0.609 120.590 119.914 0.111 0.000 2.509 185 V HA 0.544 4.663 4.120 -0.001 0.000 0.284 185 V C -0.495 175.596 176.094 -0.006 0.000 1.047 185 V CA -0.434 61.909 62.300 0.072 0.000 0.952 185 V CB 1.485 33.327 31.823 0.030 0.000 0.988 185 V HN 0.189 8.379 8.190 -0.000 0.000 0.469 186 V N 6.920 126.780 119.914 -0.091 0.000 2.398 186 V HA 0.425 4.545 4.120 -0.001 0.000 0.286 186 V C -0.037 175.810 176.094 -0.412 0.000 1.026 186 V CA -0.467 61.642 62.300 -0.317 0.000 0.868 186 V CB 1.366 32.792 31.823 -0.661 0.000 0.982 186 V HN 0.946 9.136 8.190 -0.000 0.000 0.443 187 L N 6.098 127.100 121.223 -0.369 0.000 2.257 187 L HA 0.587 4.926 4.340 -0.001 0.000 0.290 187 L C -1.067 175.531 176.870 -0.454 0.000 1.044 187 L CA 0.159 54.782 54.840 -0.362 0.000 0.810 187 L CB 0.342 42.219 42.059 -0.303 0.000 1.193 187 L HN 0.465 8.695 8.230 -0.000 0.000 0.425 188 F N 3.539 123.328 119.950 -0.268 0.000 2.415 188 F HA 0.366 4.892 4.527 -0.001 0.000 0.348 188 F C 0.555 176.226 175.800 -0.215 0.000 1.119 188 F CA -0.513 57.323 58.000 -0.274 0.000 1.069 188 F CB 0.786 39.266 39.000 -0.866 0.000 1.124 188 F HN 0.387 8.687 8.300 -0.000 0.000 0.472 189 H N 2.640 121.794 119.070 0.140 0.000 2.878 189 H HA 0.063 4.618 4.556 -0.001 0.000 0.290 189 H C 1.166 176.591 175.328 0.161 0.000 1.065 189 H CA 0.310 56.426 56.048 0.114 0.000 1.477 189 H CB 1.258 31.089 29.762 0.115 0.000 1.484 189 H HN 0.999 9.279 8.280 -0.000 0.000 0.504 190 G N 3.091 111.876 108.800 -0.025 0.000 2.448 190 G HA2 -0.120 3.840 3.960 -0.001 0.000 0.219 190 G HA3 -0.120 3.840 3.960 -0.001 0.000 0.219 190 G C 0.561 175.351 174.900 -0.184 0.000 1.127 190 G CA 0.975 45.824 45.100 -0.419 0.000 0.766 190 G HN 0.764 9.054 8.290 -0.000 0.000 0.552 191 C N -5.030 114.305 119.300 0.057 0.000 3.253 191 C HA 0.466 4.925 4.460 -0.001 0.000 0.342 191 C C 0.349 175.505 174.990 0.277 0.000 1.306 191 C CA -0.949 58.225 59.018 0.260 0.000 1.207 191 C CB 0.519 28.425 27.740 0.276 0.000 1.479 191 C HN 0.813 9.043 8.230 -0.000 0.000 0.469 192 C N 2.513 121.952 119.300 0.232 0.000 4.056 192 C HA -0.133 4.327 4.460 -0.001 0.000 0.302 192 C C 0.600 175.645 174.990 0.091 0.000 1.356 192 C CA 1.185 60.269 59.018 0.110 0.000 2.074 192 C CB -3.262 24.475 27.740 -0.006 0.000 1.328 192 C HN 1.305 9.535 8.230 -0.000 0.000 0.684 193 H N 1.855 120.947 119.070 0.036 0.000 3.243 193 H HA -0.019 4.536 4.556 -0.001 0.000 0.267 193 H C 0.629 175.861 175.328 -0.160 0.000 0.875 193 H CA 1.263 57.219 56.048 -0.154 0.000 1.413 193 H CB 0.402 30.038 29.762 -0.210 0.000 1.459 193 H HN 0.700 8.980 8.280 -0.000 0.000 0.536 194 N N 7.385 125.885 118.700 -0.333 0.000 2.422 194 N HA 0.085 4.824 4.740 -0.001 0.000 0.264 194 N C -2.009 173.266 175.510 -0.392 0.000 1.063 194 N CA -2.133 50.791 53.050 -0.211 0.000 0.959 194 N CB 1.223 39.675 38.487 -0.059 0.000 1.087 194 N HN 0.402 8.782 8.380 -0.000 0.000 0.483 195 P HA 0.142 4.562 4.420 -0.000 0.000 0.275 195 P C 0.583 177.577 177.300 -0.511 0.000 1.310 195 P CA 0.170 62.997 63.100 -0.456 0.000 0.904 195 P CB 0.705 32.080 31.700 -0.542 0.000 1.381 196 T N -0.675 113.686 114.554 -0.321 0.000 3.009 196 T HA 0.202 4.551 4.350 -0.001 0.000 0.258 196 T C 1.505 176.184 174.700 -0.035 0.000 1.063 196 T CA 1.430 63.341 62.100 -0.315 0.000 1.139 196 T CB -0.713 68.040 68.868 -0.191 0.000 0.890 196 T HN 0.230 8.470 8.240 -0.000 0.000 0.471 197 G N 1.403 110.241 108.800 0.064 0.000 2.166 197 G HA2 -0.250 3.709 3.960 -0.001 0.000 0.260 197 G HA3 -0.250 3.709 3.960 -0.001 0.000 0.260 197 G C 0.155 175.135 174.900 0.135 0.000 0.986 197 G CA 0.335 45.491 45.100 0.094 0.000 0.683 197 G HN 0.574 8.864 8.290 -0.000 0.000 0.527 198 I N 1.166 121.830 120.570 0.155 0.000 2.353 198 I HA 0.443 4.613 4.170 -0.001 0.000 0.293 198 I C -0.603 175.616 176.117 0.169 0.000 0.992 198 I CA -0.664 60.720 61.300 0.140 0.000 1.268 198 I CB 1.311 39.386 38.000 0.125 0.000 1.387 198 I HN -0.075 8.135 8.210 -0.000 0.000 0.478 199 D N 6.853 127.324 120.400 0.118 0.000 2.575 199 D HA 0.426 5.065 4.640 -0.001 0.000 0.236 199 D C -2.431 173.828 176.300 -0.067 0.000 1.075 199 D CA -1.325 52.752 54.000 0.129 0.000 0.860 199 D CB 1.768 42.701 40.800 0.222 0.000 1.475 199 D HN 0.141 8.511 8.370 -0.000 0.000 0.474 200 P HA 0.096 4.516 4.420 -0.000 0.000 0.269 200 P C 0.138 177.213 177.300 -0.375 0.000 1.215 200 P CA -0.154 62.603 63.100 -0.572 0.000 0.780 200 P CB 0.347 31.347 31.700 -1.166 0.000 0.898 201 T N -0.396 113.987 114.554 -0.285 0.000 2.788 201 T HA 0.087 4.436 4.350 -0.001 0.000 0.287 201 T C 1.077 175.790 174.700 0.021 0.000 1.007 201 T CA -0.598 61.447 62.100 -0.092 0.000 1.005 201 T CB 0.238 69.039 68.868 -0.112 0.000 1.012 201 T HN 0.162 8.402 8.240 -0.000 0.000 0.530 202 L N 0.535 121.852 121.223 0.155 0.000 2.083 202 L HA -0.005 4.335 4.340 -0.001 0.000 0.209 202 L C 2.588 179.555 176.870 0.163 0.000 1.083 202 L CA 1.780 56.772 54.840 0.254 0.000 0.752 202 L CB -1.160 41.008 42.059 0.183 0.000 0.899 202 L HN 0.847 9.077 8.230 -0.000 0.000 0.433 203 E N -0.975 119.259 120.200 0.057 0.000 2.077 203 E HA -0.269 4.080 4.350 -0.001 0.000 0.193 203 E C 2.110 178.714 176.600 0.006 0.000 0.989 203 E CA 1.507 57.922 56.400 0.025 0.000 0.800 203 E CB -0.103 29.588 29.700 -0.015 0.000 0.746 203 E HN 0.680 9.040 8.360 -0.000 0.000 0.452 204 Q N -0.441 119.288 119.800 -0.118 0.000 2.079 204 Q HA -0.158 4.181 4.340 -0.001 0.000 0.200 204 Q C 1.874 177.933 176.000 0.098 0.000 0.974 204 Q CA 1.234 56.921 55.803 -0.194 0.000 0.840 204 Q CB -0.195 28.122 28.738 -0.701 0.000 0.898 204 Q HN 0.405 8.675 8.270 -0.000 0.000 0.430 205 W N 1.381 122.753 121.300 0.119 0.000 2.338 205 W HA -0.220 4.440 4.660 -0.001 0.000 0.304 205 W C 2.330 178.917 176.519 0.114 0.000 1.212 205 W CA 0.881 58.350 57.345 0.206 0.000 1.264 205 W CB 0.074 29.665 29.460 0.219 0.000 1.142 205 W HN 0.233 8.413 8.180 -0.000 0.000 0.512 206 Q N -0.815 119.158 119.800 0.289 0.000 2.170 206 Q HA -0.156 4.183 4.340 -0.001 0.000 0.203 206 Q C 2.002 178.048 176.000 0.076 0.000 0.976 206 Q CA 1.936 57.812 55.803 0.121 0.000 0.858 206 Q CB -0.379 28.416 28.738 0.096 0.000 0.907 206 Q HN 0.213 8.483 8.270 -0.000 0.000 0.433 207 T N 1.055 115.696 114.554 0.145 0.000 2.701 207 T HA -0.099 4.251 4.350 -0.001 0.000 0.263 207 T C 1.805 176.583 174.700 0.129 0.000 1.040 207 T CA 0.892 63.086 62.100 0.156 0.000 1.147 207 T CB -0.219 68.833 68.868 0.307 0.000 0.865 207 T HN 0.182 8.422 8.240 -0.000 0.000 0.426 208 L N 0.859 122.217 121.223 0.225 0.000 2.083 208 L HA -0.104 4.235 4.340 -0.001 0.000 0.209 208 L C 3.025 179.867 176.870 -0.047 0.000 1.083 208 L CA 1.105 56.095 54.840 0.250 0.000 0.752 208 L CB -0.707 41.641 42.059 0.481 0.000 0.899 208 L HN 0.248 8.478 8.230 -0.000 0.000 0.433 209 A N -0.266 122.299 122.820 -0.425 0.000 1.877 209 A HA -0.291 4.028 4.320 -0.001 0.000 0.216 209 A C 2.240 179.672 177.584 -0.252 0.000 1.186 209 A CA 2.025 53.556 52.037 -0.844 0.000 0.620 209 A CB -0.535 18.085 19.000 -0.632 0.000 0.822 209 A HN 0.401 8.551 8.150 -0.000 0.000 0.443 210 Q N -0.547 119.165 119.800 -0.146 0.000 2.079 210 Q HA -0.089 4.250 4.340 -0.001 0.000 0.200 210 Q C 1.866 177.793 176.000 -0.122 0.000 0.974 210 Q CA 1.747 57.487 55.803 -0.106 0.000 0.840 210 Q CB -0.627 28.073 28.738 -0.064 0.000 0.898 210 Q HN 0.493 8.763 8.270 -0.000 0.000 0.430 211 L N 0.115 121.279 121.223 -0.097 0.000 2.042 211 L HA -0.113 4.226 4.340 -0.001 0.000 0.210 211 L C 2.332 179.009 176.870 -0.321 0.000 1.076 211 L CA 2.334 57.084 54.840 -0.150 0.000 0.749 211 L CB -1.147 40.882 42.059 -0.050 0.000 0.893 211 L HN 0.321 8.551 8.230 -0.000 0.000 0.432 212 S N -1.552 114.026 115.700 -0.204 0.000 2.382 212 S HA -0.144 4.325 4.470 -0.001 0.000 0.228 212 S C 1.951 176.415 174.600 -0.226 0.000 1.027 212 S CA 1.393 59.427 58.200 -0.276 0.000 0.991 212 S CB -0.362 63.101 63.200 0.439 0.000 0.823 212 S HN 0.325 8.635 8.310 -0.000 0.000 0.469 213 V N 2.628 122.410 119.914 -0.219 0.000 2.358 213 V HA -0.158 3.962 4.120 -0.001 0.000 0.246 213 V C 2.523 178.468 176.094 -0.249 0.000 1.047 213 V CA 2.172 64.284 62.300 -0.313 0.000 1.035 213 V CB -0.761 30.868 31.823 -0.323 0.000 0.658 213 V HN 0.775 8.965 8.190 -0.000 0.000 0.452 214 E N -0.480 119.565 120.200 -0.258 0.000 2.230 214 E HA -0.152 4.198 4.350 -0.001 0.000 0.192 214 E C 1.831 178.268 176.600 -0.272 0.000 0.987 214 E CA 0.543 56.809 56.400 -0.225 0.000 0.841 214 E CB -0.126 29.465 29.700 -0.182 0.000 0.783 214 E HN 0.298 8.658 8.360 -0.000 0.000 0.481 215 K N 0.198 120.320 120.400 -0.464 0.000 2.356 215 K HA 0.156 4.475 4.320 -0.001 0.000 0.195 215 K C 0.958 177.292 176.600 -0.443 0.000 1.037 215 K CA 0.740 56.676 56.287 -0.584 0.000 1.014 215 K CB 0.563 32.390 32.500 -1.122 0.000 0.815 215 K HN 0.329 8.579 8.250 -0.000 0.000 0.507 216 G N 0.589 109.193 108.800 -0.327 0.000 2.142 216 G HA2 -0.209 3.750 3.960 -0.001 0.000 0.225 216 G HA3 -0.209 3.750 3.960 -0.001 0.000 0.225 216 G C -0.366 174.655 174.900 0.202 0.000 1.015 216 G CA -0.189 44.886 45.100 -0.043 0.000 0.716 216 G HN 0.229 8.519 8.290 -0.000 0.000 0.508 217 W N -1.115 120.265 121.300 0.134 0.000 2.184 217 W HA 0.607 5.266 4.660 -0.001 0.000 0.338 217 W C 0.641 177.292 176.519 0.220 0.000 1.257 217 W CA -1.412 56.025 57.345 0.154 0.000 1.243 217 W CB 0.630 30.197 29.460 0.179 0.000 1.122 217 W HN 0.231 8.411 8.180 -0.000 0.000 0.585 218 L N 4.978 126.460 121.223 0.432 0.000 2.264 218 L HA 0.425 4.764 4.340 -0.001 0.000 0.289 218 L C -2.373 174.716 176.870 0.364 0.000 1.044 218 L CA -2.201 52.857 54.840 0.364 0.000 0.807 218 L CB 0.440 42.660 42.059 0.269 0.000 1.192 218 L HN 0.049 8.279 8.230 -0.000 0.000 0.425 219 P HA 0.192 4.612 4.420 -0.000 0.000 0.276 219 P C -1.411 176.060 177.300 0.284 0.000 1.235 219 P CA -0.278 63.042 63.100 0.367 0.000 0.772 219 P CB 0.904 32.835 31.700 0.385 0.000 0.871 220 L N 5.577 126.905 121.223 0.176 0.000 2.377 220 L HA 0.516 4.856 4.340 -0.001 0.000 0.270 220 L C -1.612 175.313 176.870 0.091 0.000 0.991 220 L CA -0.867 54.079 54.840 0.177 0.000 0.851 220 L CB -0.190 41.945 42.059 0.127 0.000 1.218 220 L HN 0.126 8.356 8.230 -0.000 0.000 0.420 221 F N 3.086 123.105 119.950 0.115 0.000 2.394 221 F HA 0.391 4.917 4.527 -0.001 0.000 0.340 221 F C 0.419 176.274 175.800 0.092 0.000 1.105 221 F CA -0.050 57.995 58.000 0.075 0.000 1.124 221 F CB 1.251 40.264 39.000 0.022 0.000 1.145 221 F HN 0.483 8.783 8.300 -0.000 0.000 0.505 222 D N 3.587 124.078 120.400 0.152 0.000 2.440 222 D HA 0.216 4.855 4.640 -0.001 0.000 0.239 222 D C -1.469 174.904 176.300 0.121 0.000 1.084 222 D CA -0.278 53.797 54.000 0.125 0.000 0.843 222 D CB 0.388 41.202 40.800 0.023 0.000 1.097 222 D HN 0.183 8.553 8.370 -0.000 0.000 0.531 223 F N 3.260 123.251 119.950 0.068 0.000 2.366 223 F HA 0.503 5.029 4.527 -0.001 0.000 0.357 223 F C 0.774 176.526 175.800 -0.081 0.000 1.107 223 F CA -0.774 57.252 58.000 0.042 0.000 1.208 223 F CB 1.104 40.108 39.000 0.005 0.000 1.464 223 F HN 0.534 8.834 8.300 -0.000 0.000 0.501 224 A N 2.606 125.461 122.820 0.060 0.000 2.220 224 A HA 0.127 4.447 4.320 -0.001 0.000 0.211 224 A C -0.042 177.240 177.584 -0.502 0.000 1.176 224 A CA 0.470 52.323 52.037 -0.307 0.000 0.834 224 A CB -0.240 18.365 19.000 -0.659 0.000 0.868 224 A HN 0.521 8.671 8.150 -0.000 0.000 0.488 225 Y N 0.221 120.622 120.300 0.169 0.000 2.578 225 Y HA 0.336 4.885 4.550 -0.001 0.000 0.317 225 Y C 0.398 176.530 175.900 0.386 0.000 0.940 225 Y CA -0.706 57.499 58.100 0.176 0.000 1.174 225 Y CB 0.016 38.462 38.460 -0.024 0.000 1.198 225 Y HN 0.280 8.560 8.280 -0.000 0.000 0.597 226 Q N 0.846 120.894 119.800 0.414 0.000 2.271 226 Q HA 0.381 4.721 4.340 -0.001 0.000 0.273 226 Q C 0.974 177.150 176.000 0.294 0.000 1.051 226 Q CA 1.215 57.218 55.803 0.333 0.000 0.901 226 Q CB 0.416 29.189 28.738 0.058 0.000 1.174 226 Q HN 0.895 9.165 8.270 -0.000 0.000 0.385 227 G N 3.048 111.976 108.800 0.213 0.000 2.229 227 G HA2 -0.217 3.743 3.960 -0.001 0.000 0.189 227 G HA3 -0.217 3.743 3.960 -0.001 0.000 0.189 227 G C 0.058 174.873 174.900 -0.142 0.000 1.000 227 G CA -0.257 44.834 45.100 -0.015 0.000 0.663 227 G HN 0.647 8.937 8.290 -0.000 0.000 0.493 228 F N 1.714 121.711 119.950 0.078 0.000 2.678 228 F HA 0.700 5.226 4.527 -0.001 0.000 0.305 228 F C 1.284 177.102 175.800 0.030 0.000 1.090 228 F CA 0.456 58.483 58.000 0.045 0.000 1.272 228 F CB 1.126 40.166 39.000 0.067 0.000 1.060 228 F HN 0.403 8.703 8.300 -0.000 0.000 0.576 229 A N -0.250 122.680 122.820 0.183 0.000 2.343 229 A HA 0.696 5.015 4.320 -0.001 0.000 0.308 229 A C 0.709 178.349 177.584 0.093 0.000 1.092 229 A CA -0.525 51.594 52.037 0.136 0.000 0.751 229 A CB 1.027 20.130 19.000 0.173 0.000 1.203 229 A HN 0.334 8.484 8.150 -0.000 0.000 0.452 230 R N 0.849 121.381 120.500 0.054 0.000 1.467 230 R HA -0.308 4.031 4.340 -0.001 0.000 0.058 230 R C 0.901 177.199 176.300 -0.003 0.000 0.956 230 R CA 2.298 58.417 56.100 0.032 0.000 1.821 230 R CB -1.453 28.885 30.300 0.063 0.000 0.298 230 R HN 2.153 10.423 8.270 -0.000 0.000 0.684 234 E N 0.323 120.515 120.200 -0.013 0.000 2.127 234 E HA -0.033 4.316 4.350 -0.001 0.000 0.191 234 E C 1.432 178.047 176.600 0.026 0.000 0.964 234 E CA 0.949 57.346 56.400 -0.006 0.000 0.832 234 E CB 0.384 30.079 29.700 -0.008 0.000 0.790 234 E HN 0.425 8.785 8.360 -0.000 0.000 0.465 235 E N 1.422 121.644 120.200 0.036 0.000 2.130 235 E HA -0.194 4.156 4.350 -0.001 0.000 0.196 235 E C 1.481 178.149 176.600 0.113 0.000 0.998 235 E CA 1.430 57.870 56.400 0.066 0.000 0.806 235 E CB -0.093 29.642 29.700 0.058 0.000 0.738 235 E HN 0.144 8.504 8.360 -0.000 0.000 0.459 236 D N -0.717 119.766 120.400 0.139 0.000 2.312 236 D HA -0.014 4.625 4.640 -0.001 0.000 0.211 236 D C 1.124 177.623 176.300 0.332 0.000 0.964 236 D CA 1.050 55.195 54.000 0.242 0.000 0.877 236 D CB 0.040 41.010 40.800 0.284 0.000 0.924 236 D HN 0.226 8.596 8.370 -0.000 0.000 0.515 237 A N 0.050 122.990 122.820 0.201 0.000 2.348 237 A HA 0.054 4.373 4.320 -0.001 0.000 0.224 237 A C 1.784 179.378 177.584 0.016 0.000 1.227 237 A CA -0.120 52.021 52.037 0.172 0.000 0.885 237 A CB -0.125 18.843 19.000 -0.053 0.000 0.933 237 A HN 0.067 8.217 8.150 -0.000 0.000 0.506 238 E N 0.432 120.646 120.200 0.024 0.000 2.130 238 E HA -0.207 4.142 4.350 -0.001 0.000 0.196 238 E C 1.942 178.484 176.600 -0.095 0.000 0.998 238 E CA 1.431 57.836 56.400 0.009 0.000 0.806 238 E CB -0.235 29.512 29.700 0.078 0.000 0.738 238 E HN 0.557 8.917 8.360 -0.000 0.000 0.459 239 G N 1.665 110.263 108.800 -0.336 0.000 2.404 239 G HA2 -0.226 3.733 3.960 -0.001 0.000 0.215 239 G HA3 -0.226 3.733 3.960 -0.001 0.000 0.215 239 G C 1.543 176.010 174.900 -0.722 0.000 1.174 239 G CA 0.437 44.947 45.100 -0.984 0.000 0.780 239 G HN 0.300 8.590 8.290 -0.000 0.000 0.537 240 L N 0.019 120.800 121.223 -0.737 0.000 2.093 240 L HA 0.060 4.399 4.340 -0.001 0.000 0.208 240 L C 2.882 179.558 176.870 -0.323 0.000 1.085 240 L CA 1.411 55.697 54.840 -0.924 0.000 0.755 240 L CB -0.296 41.405 42.059 -0.596 0.000 0.904 240 L HN 0.156 8.386 8.230 -0.000 0.000 0.435 241 R N -0.340 120.081 120.500 -0.133 0.000 2.189 241 R HA -0.026 4.313 4.340 -0.001 0.000 0.218 241 R C 2.292 178.607 176.300 0.025 0.000 1.074 241 R CA 1.189 57.294 56.100 0.007 0.000 0.991 241 R CB -0.255 30.061 30.300 0.026 0.000 0.883 241 R HN 0.503 8.773 8.270 -0.000 0.000 0.457 242 A N -0.274 122.562 122.820 0.027 0.000 1.898 242 A HA -0.058 4.261 4.320 -0.001 0.000 0.214 242 A C 1.692 179.323 177.584 0.079 0.000 1.183 242 A CA 0.799 52.872 52.037 0.060 0.000 0.622 242 A CB -0.448 18.607 19.000 0.091 0.000 0.824 242 A HN 0.197 8.347 8.150 -0.000 0.000 0.444 243 F N 0.510 120.427 119.950 -0.055 0.000 2.126 243 F HA -0.133 4.393 4.527 -0.001 0.000 0.299 243 F C 2.747 178.563 175.800 0.026 0.000 1.096 243 F CA 1.158 59.137 58.000 -0.035 0.000 1.255 243 F CB -0.481 38.428 39.000 -0.152 0.000 0.997 243 F HN 0.251 8.551 8.300 -0.000 0.000 0.479 244 A N -0.394 122.517 122.820 0.151 0.000 2.067 244 A HA 0.061 4.380 4.320 -0.001 0.000 0.219 244 A C 2.334 179.945 177.584 0.045 0.000 1.158 244 A CA 1.273 53.355 52.037 0.075 0.000 0.661 244 A CB -1.097 17.909 19.000 0.011 0.000 0.801 244 A HN 0.292 8.442 8.150 -0.000 0.000 0.452 245 A N 0.134 122.989 122.820 0.058 0.000 1.969 245 A HA -0.024 4.296 4.320 -0.001 0.000 0.218 245 A C 2.060 179.665 177.584 0.035 0.000 1.169 245 A CA 1.699 53.753 52.037 0.028 0.000 0.635 245 A CB -0.448 18.566 19.000 0.024 0.000 0.810 245 A HN 0.653 8.803 8.150 -0.000 0.000 0.445 246 M N -2.257 117.398 119.600 0.091 0.000 2.292 246 M HA 0.317 4.796 4.480 -0.001 0.000 0.286 246 M C -0.033 176.272 176.300 0.008 0.000 1.002 246 M CA -0.134 55.191 55.300 0.042 0.000 1.029 246 M CB 0.223 32.820 32.600 -0.005 0.000 1.537 246 M HN 0.159 8.449 8.290 -0.000 0.000 0.543 247 H N 1.586 120.678 119.070 0.037 0.000 2.467 247 H HA 0.343 4.898 4.556 -0.001 0.000 0.331 247 H C 0.276 175.630 175.328 0.044 0.000 1.120 247 H CA -0.437 55.655 56.048 0.073 0.000 1.270 247 H CB 1.927 31.791 29.762 0.171 0.000 1.466 247 H HN 0.043 8.323 8.280 -0.000 0.000 0.504 248 K N 1.766 122.230 120.400 0.107 0.000 2.076 248 K HA -0.005 4.315 4.320 -0.001 0.000 0.204 248 K C 0.066 176.734 176.600 0.112 0.000 1.051 248 K CA 1.151 57.483 56.287 0.074 0.000 0.949 248 K CB 0.343 32.870 32.500 0.045 0.000 0.726 248 K HN 0.696 8.946 8.250 -0.000 0.000 0.443 249 E N 0.197 120.507 120.200 0.183 0.000 2.317 249 E HA 0.550 4.899 4.350 -0.001 0.000 0.270 249 E C -0.808 175.945 176.600 0.255 0.000 0.885 249 E CA -0.636 55.879 56.400 0.191 0.000 0.760 249 E CB 2.263 32.078 29.700 0.191 0.000 1.227 249 E HN 0.035 8.395 8.360 -0.000 0.000 0.434 250 L N -1.432 119.929 121.223 0.231 0.000 2.947 250 L HA 0.656 4.996 4.340 -0.001 0.000 0.267 250 L C -1.723 175.294 176.870 0.245 0.000 1.004 250 L CA -1.007 53.991 54.840 0.263 0.000 0.937 250 L CB 1.294 43.508 42.059 0.259 0.000 1.496 250 L HN 0.529 8.759 8.230 -0.000 0.000 0.409 251 I N 1.080 121.813 120.570 0.270 0.000 2.647 251 I HA 0.739 4.908 4.170 -0.001 0.000 0.295 251 I C -1.097 175.184 176.117 0.274 0.000 1.078 251 I CA -1.087 60.361 61.300 0.246 0.000 1.048 251 I CB 2.434 40.584 38.000 0.249 0.000 1.239 251 I HN 0.393 8.603 8.210 -0.000 0.000 0.421 252 V N 3.901 123.956 119.914 0.235 0.000 2.638 252 V HA 0.753 4.872 4.120 -0.001 0.000 0.306 252 V C -0.348 175.851 176.094 0.175 0.000 1.052 252 V CA -0.612 61.828 62.300 0.235 0.000 0.885 252 V CB 1.753 33.668 31.823 0.153 0.000 0.999 252 V HN 0.804 8.994 8.190 -0.000 0.000 0.424 253 A N 3.428 126.359 122.820 0.185 0.000 2.319 253 A HA 0.931 5.250 4.320 -0.001 0.000 0.310 253 A C -0.029 177.615 177.584 0.100 0.000 1.152 253 A CA -0.329 51.789 52.037 0.136 0.000 0.783 253 A CB 1.331 20.424 19.000 0.156 0.000 1.184 253 A HN 1.062 9.212 8.150 -0.000 0.000 0.474 254 S N 0.911 116.616 115.700 0.007 0.000 2.709 254 S HA 0.910 5.379 4.470 -0.001 0.000 0.302 254 S C -0.288 174.205 174.600 -0.177 0.000 1.127 254 S CA -0.522 57.620 58.200 -0.097 0.000 0.905 254 S CB 1.737 64.779 63.200 -0.263 0.000 1.151 254 S HN 1.590 9.900 8.310 -0.000 0.000 0.510 255 S N -0.643 114.881 115.700 -0.294 0.000 2.533 255 S HA 0.587 5.056 4.470 -0.001 0.000 0.271 255 S C -1.783 172.617 174.600 -0.333 0.000 1.143 255 S CA -0.589 57.473 58.200 -0.231 0.000 0.891 255 S CB 0.836 63.947 63.200 -0.149 0.000 1.105 255 S HN 0.680 8.990 8.310 -0.000 0.000 0.468 256 Y N 2.228 122.536 120.300 0.014 0.000 2.636 256 Y HA 0.320 4.869 4.550 -0.001 0.000 0.260 256 Y C 2.079 177.968 175.900 -0.018 0.000 1.177 256 Y CA -0.224 57.905 58.100 0.047 0.000 1.209 256 Y CB 0.301 38.688 38.460 -0.120 0.000 1.166 256 Y HN 0.598 8.878 8.280 -0.000 0.000 0.531 257 S N -0.503 115.200 115.700 0.005 0.000 2.356 257 S HA -0.195 4.274 4.470 -0.001 0.000 0.223 257 S C 1.347 175.624 174.600 -0.539 0.000 1.032 257 S CA 1.904 59.971 58.200 -0.223 0.000 1.005 257 S CB -0.194 62.916 63.200 -0.150 0.000 0.867 257 S HN 0.590 8.900 8.310 -0.000 0.000 0.449 258 H N 1.685 120.658 119.070 -0.162 0.000 2.370 258 H HA 0.089 4.644 4.556 -0.001 0.000 0.304 258 H C 2.085 177.534 175.328 0.202 0.000 1.055 258 H CA 1.362 57.356 56.048 -0.090 0.000 1.373 258 H CB -0.143 29.545 29.762 -0.123 0.000 1.423 258 H HN 0.434 8.714 8.280 -0.000 0.000 0.533 259 N N -0.022 118.972 118.700 0.490 0.000 2.457 259 N HA -0.092 4.647 4.740 -0.001 0.000 0.180 259 N C 0.636 176.360 175.510 0.357 0.000 1.050 259 N CA 0.863 54.222 53.050 0.515 0.000 0.906 259 N CB -0.407 38.393 38.487 0.521 0.000 0.968 259 N HN 0.264 8.644 8.380 -0.000 0.000 0.445 260 F N -0.314 119.753 119.950 0.195 0.000 2.678 260 F HA 0.412 4.938 4.527 -0.001 0.000 0.305 260 F C 1.594 177.370 175.800 -0.039 0.000 1.090 260 F CA 0.028 58.079 58.000 0.085 0.000 1.272 260 F CB 0.259 39.221 39.000 -0.064 0.000 1.060 260 F HN 0.175 8.475 8.300 -0.000 0.000 0.576 261 G N 1.056 109.822 108.800 -0.057 0.000 2.225 261 G HA2 -0.297 3.662 3.960 -0.001 0.000 0.267 261 G HA3 -0.297 3.662 3.960 -0.001 0.000 0.267 261 G C 0.375 175.148 174.900 -0.212 0.000 1.024 261 G CA 0.145 45.099 45.100 -0.243 0.000 0.784 261 G HN 0.224 8.514 8.290 -0.000 0.000 0.507 262 L N 0.287 121.363 121.223 -0.244 0.000 3.034 262 L HA 0.481 4.820 4.340 -0.001 0.000 0.245 262 L C 1.792 178.627 176.870 -0.059 0.000 1.295 262 L CA -1.117 53.675 54.840 -0.079 0.000 1.068 262 L CB -1.001 41.033 42.059 -0.042 0.000 1.426 262 L HN 0.338 8.568 8.230 -0.000 0.000 0.531 263 Y N 0.156 120.450 120.300 -0.010 0.000 2.053 263 Y HA -0.304 4.246 4.550 -0.001 0.000 0.277 263 Y C 2.124 178.010 175.900 -0.023 0.000 1.159 263 Y CA 2.012 60.083 58.100 -0.049 0.000 1.125 263 Y CB -0.592 37.830 38.460 -0.064 0.000 0.969 263 Y HN 0.561 8.841 8.280 -0.000 0.000 0.492 264 N N -0.368 118.437 118.700 0.174 0.000 2.383 264 N HA -0.067 4.673 4.740 -0.001 0.000 0.192 264 N C 0.598 176.136 175.510 0.047 0.000 1.141 264 N CA 0.597 53.700 53.050 0.088 0.000 0.851 264 N CB -0.252 38.277 38.487 0.070 0.000 0.976 264 N HN 0.331 8.711 8.380 -0.000 0.000 0.465 265 E N 0.709 120.932 120.200 0.039 0.000 2.481 265 E HA 0.105 4.454 4.350 -0.001 0.000 0.198 265 E C -0.355 176.230 176.600 -0.026 0.000 1.027 265 E CA -0.175 56.235 56.400 0.017 0.000 0.900 265 E CB 0.265 29.995 29.700 0.050 0.000 0.993 265 E HN 0.222 8.582 8.360 -0.000 0.000 0.482 266 R N -0.011 120.475 120.500 -0.023 0.000 2.496 266 R HA -0.107 4.233 4.340 -0.001 0.000 0.326 266 R C -0.974 175.282 176.300 -0.074 0.000 1.032 266 R CA 0.223 56.296 56.100 -0.046 0.000 0.827 266 R CB -2.333 27.924 30.300 -0.071 0.000 2.368 266 R HN -0.099 8.171 8.270 -0.000 0.000 0.490 267 V N 1.312 121.205 119.914 -0.035 0.000 2.447 267 V HA 0.840 4.960 4.120 -0.001 0.000 0.292 267 V C 0.839 177.021 176.094 0.146 0.000 1.021 267 V CA 0.020 62.313 62.300 -0.010 0.000 0.850 267 V CB 2.092 33.904 31.823 -0.018 0.000 1.005 267 V HN 0.853 9.043 8.190 -0.000 0.000 0.426 268 G N 2.737 111.638 108.800 0.167 0.000 2.606 268 G HA2 0.952 4.911 3.960 -0.001 0.000 0.300 268 G HA3 0.952 4.911 3.960 -0.001 0.000 0.300 268 G C -1.392 173.671 174.900 0.272 0.000 1.360 268 G CA -0.030 45.175 45.100 0.174 0.000 0.783 268 G HN 1.166 9.456 8.290 -0.000 0.000 0.484 269 A N -1.877 121.053 122.820 0.184 0.000 2.609 269 A HA 0.736 5.056 4.320 -0.001 0.000 0.291 269 A C -1.348 176.320 177.584 0.139 0.000 1.096 269 A CA -0.242 51.934 52.037 0.233 0.000 0.684 269 A CB 1.492 20.654 19.000 0.271 0.000 1.282 269 A HN 1.997 10.147 8.150 -0.000 0.000 0.412 270 C N 1.253 120.650 119.300 0.161 0.000 2.381 270 C HA 0.794 5.254 4.460 -0.001 0.000 0.328 270 C C -0.313 174.764 174.990 0.146 0.000 1.190 270 C CA 0.009 59.113 59.018 0.144 0.000 1.369 270 C CB 0.019 27.849 27.740 0.151 0.000 2.029 270 C HN 0.862 9.092 8.230 -0.000 0.000 0.448 271 T N 6.705 121.326 114.554 0.112 0.000 2.794 271 T HA 0.495 4.845 4.350 -0.001 0.000 0.280 271 T C -0.602 174.164 174.700 0.109 0.000 0.987 271 T CA -0.370 61.787 62.100 0.094 0.000 0.993 271 T CB 1.215 70.134 68.868 0.086 0.000 0.939 271 T HN 0.610 8.850 8.240 -0.000 0.000 0.449 272 L N 3.856 125.115 121.223 0.059 0.000 2.305 272 L HA 0.699 5.038 4.340 -0.001 0.000 0.284 272 L C -0.241 176.659 176.870 0.050 0.000 1.013 272 L CA -0.943 53.926 54.840 0.049 0.000 0.819 272 L CB 1.545 43.603 42.059 -0.001 0.000 1.227 272 L HN 0.481 8.711 8.230 -0.000 0.000 0.417 273 V N 2.554 122.516 119.914 0.081 0.000 2.715 273 V HA 0.986 5.105 4.120 -0.001 0.000 0.310 273 V C -0.420 175.706 176.094 0.054 0.000 1.054 273 V CA -0.118 62.197 62.300 0.025 0.000 0.928 273 V CB 1.799 33.596 31.823 -0.043 0.000 1.007 273 V HN 0.864 9.054 8.190 -0.000 0.000 0.437 274 A N 3.791 126.631 122.820 0.033 0.000 2.486 274 A HA 0.969 5.288 4.320 -0.001 0.000 0.277 274 A C 1.101 178.705 177.584 0.034 0.000 1.282 274 A CA -0.191 51.882 52.037 0.060 0.000 0.784 274 A CB 0.866 19.909 19.000 0.072 0.000 1.350 274 A HN 2.032 10.182 8.150 -0.000 0.000 0.454 275 A N -0.866 121.977 122.820 0.038 0.000 2.014 275 A HA 0.346 4.665 4.320 -0.001 0.000 0.218 275 A C 0.494 178.081 177.584 0.005 0.000 1.163 275 A CA 2.139 54.189 52.037 0.021 0.000 0.652 275 A CB -0.625 18.390 19.000 0.024 0.000 0.808 275 A HN 1.015 9.165 8.150 -0.000 0.000 0.449 276 D N -3.917 116.488 120.400 0.008 0.000 2.677 276 D HA 0.306 4.946 4.640 -0.001 0.000 0.298 276 D C 0.698 176.998 176.300 0.001 0.000 1.250 276 D CA 0.190 54.189 54.000 -0.001 0.000 0.888 276 D CB 0.187 40.990 40.800 0.005 0.000 1.397 276 D HN 0.003 8.373 8.370 -0.000 0.000 0.461 277 S N -0.179 115.519 115.700 -0.004 0.000 2.357 277 S HA -0.216 4.253 4.470 -0.001 0.000 0.221 277 S C 1.587 176.196 174.600 0.014 0.000 1.031 277 S CA 1.629 59.827 58.200 -0.004 0.000 0.982 277 S CB -0.777 62.418 63.200 -0.008 0.000 0.853 277 S HN 0.687 8.997 8.310 -0.000 0.000 0.458 278 E N 1.498 121.710 120.200 0.020 0.000 2.204 278 E HA -0.085 4.264 4.350 -0.001 0.000 0.195 278 E C 1.765 178.392 176.600 0.046 0.000 0.990 278 E CA 1.841 58.260 56.400 0.032 0.000 0.821 278 E CB -1.302 28.415 29.700 0.028 0.000 0.750 278 E HN 0.516 8.876 8.360 -0.000 0.000 0.477 279 T N 0.015 114.597 114.554 0.046 0.000 2.812 279 T HA -0.077 4.273 4.350 -0.001 0.000 0.264 279 T C 1.845 176.594 174.700 0.082 0.000 1.042 279 T CA 1.164 63.303 62.100 0.065 0.000 1.140 279 T CB -0.365 68.540 68.868 0.062 0.000 0.870 279 T HN 0.127 8.367 8.240 -0.000 0.000 0.445 280 V N 1.584 121.535 119.914 0.061 0.000 2.667 280 V HA -0.124 3.995 4.120 -0.001 0.000 0.252 280 V C 1.795 177.943 176.094 0.090 0.000 1.065 280 V CA 1.753 64.092 62.300 0.064 0.000 1.083 280 V CB -0.463 31.362 31.823 0.005 0.000 0.692 280 V HN 0.357 8.547 8.190 -0.000 0.000 0.468 281 D N -0.192 120.255 120.400 0.080 0.000 2.097 281 D HA -0.148 4.491 4.640 -0.001 0.000 0.197 281 D C 2.297 178.685 176.300 0.147 0.000 0.984 281 D CA 1.344 55.414 54.000 0.117 0.000 0.826 281 D CB -0.260 40.585 40.800 0.076 0.000 0.973 281 D HN 0.330 8.700 8.370 -0.000 0.000 0.460 282 R N 0.267 120.837 120.500 0.116 0.000 2.096 282 R HA -0.085 4.254 4.340 -0.001 0.000 0.235 282 R C 1.962 178.353 176.300 0.152 0.000 1.127 282 R CA 1.457 57.626 56.100 0.114 0.000 0.968 282 R CB -0.112 30.243 30.300 0.093 0.000 0.861 282 R HN 0.155 8.425 8.270 -0.000 0.000 0.440 283 A N -0.201 122.732 122.820 0.187 0.000 1.929 283 A HA -0.120 4.199 4.320 -0.001 0.000 0.216 283 A C 1.877 179.605 177.584 0.240 0.000 1.176 283 A CA 0.742 52.936 52.037 0.263 0.000 0.628 283 A CB -0.593 18.575 19.000 0.279 0.000 0.816 283 A HN 0.463 8.613 8.150 -0.000 0.000 0.444 284 F N 2.151 122.108 119.950 0.011 0.000 2.269 284 F HA -0.159 4.368 4.527 -0.001 0.000 0.301 284 F C 2.655 178.455 175.800 -0.000 0.000 1.082 284 F CA 1.368 59.342 58.000 -0.043 0.000 1.360 284 F CB -0.271 38.713 39.000 -0.026 0.000 1.041 284 F HN 0.335 8.635 8.300 -0.000 0.000 0.512 285 S N -0.591 115.140 115.700 0.051 0.000 2.382 285 S HA -0.222 4.247 4.470 -0.001 0.000 0.228 285 S C 1.842 176.414 174.600 -0.046 0.000 1.027 285 S CA 1.065 59.244 58.200 -0.035 0.000 0.991 285 S CB -0.659 62.561 63.200 0.033 0.000 0.823 285 S HN 0.484 8.794 8.310 -0.000 0.000 0.469 286 Q N 0.291 120.124 119.800 0.055 0.000 2.230 286 Q HA 0.142 4.481 4.340 -0.001 0.000 0.202 286 Q C 2.082 178.164 176.000 0.137 0.000 0.963 286 Q CA 0.868 56.741 55.803 0.116 0.000 0.866 286 Q CB -0.335 28.536 28.738 0.221 0.000 0.931 286 Q HN 0.690 8.960 8.270 -0.000 0.000 0.452 287 M N 0.546 120.162 119.600 0.027 0.000 2.132 287 M HA -0.151 4.328 4.480 -0.001 0.000 0.263 287 M C 1.791 177.949 176.300 -0.237 0.000 1.065 287 M CA 1.459 56.680 55.300 -0.132 0.000 1.122 287 M CB 0.158 32.526 32.600 -0.387 0.000 1.365 287 M HN -0.043 8.247 8.290 -0.000 0.000 0.411 288 K N -0.046 120.123 120.400 -0.385 0.000 2.103 288 K HA -0.038 4.281 4.320 -0.001 0.000 0.204 288 K C 1.985 178.463 176.600 -0.202 0.000 1.052 288 K CA 1.202 57.274 56.287 -0.358 0.000 0.945 288 K CB -0.257 32.000 32.500 -0.404 0.000 0.722 288 K HN 0.402 8.652 8.250 -0.000 0.000 0.443 289 A N 1.770 124.511 122.820 -0.131 0.000 1.948 289 A HA -0.191 4.128 4.320 -0.001 0.000 0.220 289 A C 2.365 179.898 177.584 -0.084 0.000 1.177 289 A CA 2.015 54.001 52.037 -0.085 0.000 0.636 289 A CB -0.610 18.368 19.000 -0.037 0.000 0.815 289 A HN 0.350 8.500 8.150 -0.000 0.000 0.449 290 A N -0.165 122.620 122.820 -0.060 0.000 1.873 290 A HA -0.061 4.258 4.320 -0.001 0.000 0.215 290 A C 2.119 179.620 177.584 -0.137 0.000 1.186 290 A CA 1.495 53.505 52.037 -0.046 0.000 0.616 290 A CB -0.585 18.438 19.000 0.038 0.000 0.823 290 A HN 0.488 8.638 8.150 -0.000 0.000 0.442 291 I N -1.001 119.443 120.570 -0.211 0.000 2.127 291 I HA -0.258 3.911 4.170 -0.001 0.000 0.241 291 I C 2.621 178.456 176.117 -0.469 0.000 1.075 291 I CA 1.791 62.836 61.300 -0.426 0.000 1.334 291 I CB -0.223 37.564 38.000 -0.356 0.000 1.040 291 I HN 0.259 8.469 8.210 -0.000 0.000 0.405 292 R N 1.414 121.739 120.500 -0.292 0.000 2.200 292 R HA -0.115 4.224 4.340 -0.001 0.000 0.234 292 R C 1.762 177.953 176.300 -0.181 0.000 1.127 292 R CA 1.579 57.544 56.100 -0.225 0.000 0.989 292 R CB -0.383 29.821 30.300 -0.161 0.000 0.869 292 R HN 0.407 8.677 8.270 -0.000 0.000 0.459 293 A N -1.408 121.316 122.820 -0.160 0.000 2.308 293 A HA 0.133 4.452 4.320 -0.001 0.000 0.217 293 A C 1.473 178.992 177.584 -0.107 0.000 1.216 293 A CA 0.415 52.389 52.037 -0.106 0.000 0.864 293 A CB -0.398 18.558 19.000 -0.073 0.000 0.902 293 A HN 0.553 8.703 8.150 -0.000 0.000 0.499 294 N N -1.517 117.069 118.700 -0.190 0.000 2.638 294 N HA 0.065 4.805 4.740 -0.001 0.000 0.220 294 N C 0.937 176.384 175.510 -0.106 0.000 1.031 294 N CA 0.847 53.810 53.050 -0.145 0.000 1.062 294 N CB 0.251 38.631 38.487 -0.179 0.000 1.406 294 N HN 0.422 8.802 8.380 -0.000 0.000 0.495 295 Y N -1.682 118.609 120.300 -0.015 0.000 2.672 295 Y HA 0.583 5.132 4.550 -0.002 0.000 0.252 295 Y C 0.952 176.840 175.900 -0.020 0.000 1.132 295 Y CA -0.170 57.924 58.100 -0.011 0.000 1.228 295 Y CB -0.018 38.439 38.460 -0.004 0.000 1.310 295 Y HN 0.047 8.327 8.280 -0.000 0.000 0.549 296 S N 0.979 116.561 115.700 -0.196 0.000 1.552 296 S HA -0.323 4.146 4.470 -0.001 0.000 0.237 296 S C -0.025 174.518 174.600 -0.095 0.000 0.756 296 S CA 2.148 60.261 58.200 -0.146 0.000 1.349 296 S CB -1.653 61.492 63.200 -0.091 0.000 1.675 296 S HN 1.026 9.336 8.310 -0.000 0.000 0.517 297 N N 0.631 119.402 118.700 0.119 0.000 2.961 297 N HA 0.670 5.409 4.740 -0.001 0.000 0.245 297 N C -3.434 172.249 175.510 0.288 0.000 1.404 297 N CA -1.113 52.034 53.050 0.161 0.000 0.880 297 N CB 1.256 39.782 38.487 0.066 0.000 1.461 297 N HN 0.291 8.671 8.380 -0.000 0.000 0.510 298 P HA 0.438 4.858 4.420 -0.000 0.000 0.285 298 P C -2.685 174.603 177.300 -0.019 0.000 1.269 298 P CA -1.412 61.721 63.100 0.056 0.000 0.844 298 P CB 0.278 31.998 31.700 0.033 0.000 1.094 299 P HA -0.029 4.391 4.420 -0.000 0.000 0.260 299 P C 0.503 177.750 177.300 -0.089 0.000 1.185 299 P CA 0.380 63.436 63.100 -0.073 0.000 0.763 299 P CB 0.210 31.854 31.700 -0.093 0.000 0.776 300 A N 3.121 125.912 122.820 -0.048 0.000 2.021 300 A HA -0.153 4.166 4.320 -0.001 0.000 0.216 300 A C 2.073 179.619 177.584 -0.062 0.000 1.163 300 A CA 1.170 53.166 52.037 -0.068 0.000 0.676 300 A CB -1.172 17.810 19.000 -0.031 0.000 0.818 300 A HN 0.623 8.773 8.150 -0.000 0.000 0.453 301 H N -0.037 118.965 119.070 -0.114 0.000 2.256 301 H HA -0.049 4.506 4.556 -0.001 0.000 0.299 301 H C 2.255 177.502 175.328 -0.134 0.000 1.071 301 H CA 2.389 58.375 56.048 -0.103 0.000 1.280 301 H CB -0.556 29.160 29.762 -0.077 0.000 1.370 301 H HN 0.317 8.597 8.280 -0.000 0.000 0.490 302 G N -0.346 108.384 108.800 -0.116 0.000 2.442 302 G HA2 -0.267 3.693 3.960 -0.001 0.000 0.219 302 G HA3 -0.267 3.693 3.960 -0.001 0.000 0.219 302 G C 1.832 176.525 174.900 -0.345 0.000 1.141 302 G CA 0.963 45.931 45.100 -0.220 0.000 0.763 302 G HN 0.621 8.911 8.290 -0.000 0.000 0.554 303 A N 0.304 122.882 122.820 -0.404 0.000 1.968 303 A HA 0.149 4.469 4.320 -0.001 0.000 0.217 303 A C 2.657 180.021 177.584 -0.366 0.000 1.169 303 A CA 1.955 53.629 52.037 -0.605 0.000 0.638 303 A CB -0.413 17.990 19.000 -0.994 0.000 0.812 303 A HN 0.292 8.442 8.150 -0.000 0.000 0.446 304 S N -0.430 115.099 115.700 -0.284 0.000 2.356 304 S HA -0.128 4.341 4.470 -0.001 0.000 0.223 304 S C 1.920 176.382 174.600 -0.230 0.000 1.032 304 S CA 1.434 59.516 58.200 -0.197 0.000 1.005 304 S CB -0.378 62.727 63.200 -0.158 0.000 0.867 304 S HN 0.344 8.654 8.310 -0.000 0.000 0.449 305 V N 1.471 121.189 119.914 -0.327 0.000 2.332 305 V HA -0.153 3.966 4.120 -0.001 0.000 0.248 305 V C 2.260 178.153 176.094 -0.336 0.000 1.055 305 V CA 1.506 63.627 62.300 -0.299 0.000 1.038 305 V CB -0.670 30.950 31.823 -0.338 0.000 0.651 305 V HN 0.330 8.520 8.190 -0.000 0.000 0.450 306 V N 0.134 119.753 119.914 -0.492 0.000 2.307 306 V HA -0.220 3.899 4.120 -0.001 0.000 0.245 306 V C 2.674 178.474 176.094 -0.490 0.000 1.045 306 V CA 1.965 63.784 62.300 -0.801 0.000 1.024 306 V CB -1.082 30.102 31.823 -1.066 0.000 0.651 306 V HN 0.561 8.751 8.190 -0.000 0.000 0.449 307 A N -0.526 122.143 122.820 -0.251 0.000 1.972 307 A HA -0.205 4.115 4.320 -0.001 0.000 0.219 307 A C 2.378 179.866 177.584 -0.160 0.000 1.169 307 A CA 2.406 54.350 52.037 -0.155 0.000 0.635 307 A CB -0.832 18.146 19.000 -0.037 0.000 0.810 307 A HN 0.506 8.656 8.150 -0.000 0.000 0.446 308 T N 0.328 114.781 114.554 -0.169 0.000 2.668 308 T HA -0.078 4.271 4.350 -0.001 0.000 0.262 308 T C 1.823 176.413 174.700 -0.183 0.000 1.045 308 T CA 1.504 63.494 62.100 -0.184 0.000 1.152 308 T CB -0.400 68.364 68.868 -0.173 0.000 0.864 308 T HN 0.421 8.661 8.240 -0.000 0.000 0.419 309 I N 0.889 121.362 120.570 -0.162 0.000 2.151 309 I HA -0.174 3.995 4.170 -0.001 0.000 0.243 309 I C 2.260 178.314 176.117 -0.105 0.000 1.080 309 I CA 1.387 62.621 61.300 -0.111 0.000 1.339 309 I CB -0.404 37.554 38.000 -0.071 0.000 1.039 309 I HN 0.202 8.412 8.210 -0.000 0.000 0.409 310 L N -0.338 120.791 121.223 -0.158 0.000 2.217 310 L HA -0.115 4.224 4.340 -0.001 0.000 0.211 310 L C 2.458 179.275 176.870 -0.088 0.000 1.107 310 L CA 0.819 55.585 54.840 -0.125 0.000 0.783 310 L CB -0.395 41.545 42.059 -0.199 0.000 0.919 310 L HN 0.168 8.398 8.230 -0.000 0.000 0.442 311 S N -0.517 115.120 115.700 -0.106 0.000 2.481 311 S HA -0.040 4.430 4.470 -0.001 0.000 0.231 311 S C 0.829 175.382 174.600 -0.078 0.000 0.996 311 S CA 0.390 58.538 58.200 -0.086 0.000 0.942 311 S CB -0.278 62.865 63.200 -0.095 0.000 0.768 311 S HN 0.402 8.712 8.310 -0.000 0.000 0.520 312 N N 0.987 119.637 118.700 -0.083 0.000 2.354 312 N HA 0.119 4.858 4.740 -0.001 0.000 0.287 312 N C -0.545 174.941 175.510 -0.040 0.000 1.016 312 N CA -0.268 52.735 53.050 -0.077 0.000 0.871 312 N CB 1.505 39.915 38.487 -0.129 0.000 1.299 312 N HN -0.185 8.195 8.380 -0.000 0.000 0.482 313 D N 2.810 123.193 120.400 -0.029 0.000 2.182 313 D HA -0.144 4.495 4.640 -0.001 0.000 0.201 313 D C 1.442 177.739 176.300 -0.005 0.000 0.986 313 D CA 1.281 55.274 54.000 -0.010 0.000 0.847 313 D CB 0.129 40.921 40.800 -0.013 0.000 0.942 313 D HN 0.704 9.074 8.370 -0.000 0.000 0.467 314 A N 0.666 123.476 122.820 -0.016 0.000 1.872 314 A HA -0.044 4.276 4.320 -0.001 0.000 0.214 314 A C 2.399 179.983 177.584 0.000 0.000 1.187 314 A CA 0.616 52.647 52.037 -0.011 0.000 0.614 314 A CB -0.610 18.379 19.000 -0.019 0.000 0.826 314 A HN 0.151 8.301 8.150 -0.000 0.000 0.442 315 L N -1.249 119.971 121.223 -0.005 0.000 2.109 315 L HA -0.053 4.286 4.340 -0.001 0.000 0.207 315 L C 2.745 179.663 176.870 0.080 0.000 1.086 315 L CA 1.251 56.100 54.840 0.015 0.000 0.760 315 L CB -0.363 41.680 42.059 -0.028 0.000 0.910 315 L HN 0.434 8.664 8.230 -0.000 0.000 0.437 316 R N 0.313 120.865 120.500 0.086 0.000 2.193 316 R HA -0.139 4.201 4.340 -0.001 0.000 0.229 316 R C 2.174 178.570 176.300 0.161 0.000 1.110 316 R CA 1.134 57.353 56.100 0.199 0.000 0.988 316 R CB -0.046 30.339 30.300 0.141 0.000 0.871 316 R HN 0.332 8.602 8.270 -0.000 0.000 0.458 317 A N 0.802 123.660 122.820 0.063 0.000 1.897 317 A HA -0.062 4.257 4.320 -0.001 0.000 0.215 317 A C 2.033 179.606 177.584 -0.019 0.000 1.181 317 A CA 0.978 53.018 52.037 0.005 0.000 0.620 317 A CB -0.273 18.724 19.000 -0.006 0.000 0.821 317 A HN 0.301 8.451 8.150 -0.000 0.000 0.443 318 I N -2.254 118.324 120.570 0.014 0.000 2.202 318 I HA -0.227 3.943 4.170 -0.001 0.000 0.242 318 I C 2.418 178.536 176.117 0.002 0.000 1.091 318 I CA 1.434 62.735 61.300 0.001 0.000 1.368 318 I CB -0.414 37.600 38.000 0.022 0.000 1.058 318 I HN 0.707 8.917 8.210 -0.000 0.000 0.410 319 W N 2.553 123.775 121.300 -0.130 0.000 2.333 319 W HA -0.232 4.427 4.660 -0.001 0.000 0.316 319 W C 2.309 178.691 176.519 -0.229 0.000 1.215 319 W CA 1.695 58.916 57.345 -0.208 0.000 1.278 319 W CB -0.425 28.877 29.460 -0.263 0.000 1.154 319 W HN 0.072 8.252 8.180 -0.000 0.000 0.486 320 E N -0.406 119.453 120.200 -0.568 0.000 2.153 320 E HA -0.312 4.037 4.350 -0.001 0.000 0.194 320 E C 2.018 178.296 176.600 -0.537 0.000 0.988 320 E CA 1.526 57.443 56.400 -0.805 0.000 0.811 320 E CB -0.269 29.148 29.700 -0.471 0.000 0.746 320 E HN 0.256 8.616 8.360 -0.000 0.000 0.466 321 Q N 1.071 120.673 119.800 -0.331 0.000 2.123 321 Q HA -0.136 4.203 4.340 -0.001 0.000 0.199 321 Q C 1.525 177.365 176.000 -0.267 0.000 0.966 321 Q CA 1.407 57.063 55.803 -0.245 0.000 0.845 321 Q CB 0.146 28.794 28.738 -0.150 0.000 0.907 321 Q HN 0.276 8.546 8.270 -0.000 0.000 0.439 322 E N -0.396 119.641 120.200 -0.273 0.000 2.106 322 E HA -0.167 4.183 4.350 -0.001 0.000 0.192 322 E C 1.798 178.177 176.600 -0.368 0.000 0.984 322 E CA 0.950 57.207 56.400 -0.238 0.000 0.806 322 E CB -0.140 29.478 29.700 -0.138 0.000 0.750 322 E HN 0.260 8.620 8.360 -0.000 0.000 0.458 323 L N 1.052 121.926 121.223 -0.583 0.000 2.093 323 L HA -0.115 4.225 4.340 -0.001 0.000 0.208 323 L C 2.182 178.722 176.870 -0.551 0.000 1.085 323 L CA 1.803 56.254 54.840 -0.649 0.000 0.755 323 L CB -0.604 40.919 42.059 -0.893 0.000 0.904 323 L HN -0.011 8.219 8.230 -0.000 0.000 0.435 324 T N -0.431 113.852 114.554 -0.451 0.000 2.788 324 T HA -0.155 4.194 4.350 -0.001 0.000 0.268 324 T C 1.399 175.953 174.700 -0.243 0.000 1.044 324 T CA 1.625 63.532 62.100 -0.323 0.000 1.139 324 T CB -0.308 68.404 68.868 -0.261 0.000 0.867 324 T HN 0.426 8.666 8.240 -0.000 0.000 0.454 325 D N 0.660 120.931 120.400 -0.215 0.000 2.277 325 D HA 0.082 4.721 4.640 -0.001 0.000 0.208 325 D C 2.065 178.292 176.300 -0.120 0.000 0.962 325 D CA 0.621 54.543 54.000 -0.131 0.000 0.865 325 D CB -0.110 40.635 40.800 -0.091 0.000 0.939 325 D HN 0.430 8.800 8.370 -0.000 0.000 0.510 326 M N 0.219 119.667 119.600 -0.254 0.000 2.098 326 M HA -0.082 4.397 4.480 -0.001 0.000 0.262 326 M C 2.417 178.629 176.300 -0.147 0.000 1.072 326 M CA 1.018 56.123 55.300 -0.326 0.000 1.133 326 M CB -0.278 31.899 32.600 -0.705 0.000 1.344 326 M HN -0.128 8.162 8.290 -0.000 0.000 0.414 327 R N 0.860 121.172 120.500 -0.314 0.000 2.094 327 R HA -0.213 4.126 4.340 -0.001 0.000 0.239 327 R C 2.076 178.344 176.300 -0.052 0.000 1.137 327 R CA 2.061 58.044 56.100 -0.193 0.000 0.943 327 R CB -0.237 29.891 30.300 -0.288 0.000 0.850 327 R HN 0.450 8.720 8.270 -0.000 0.000 0.433 328 Q N -0.514 119.244 119.800 -0.070 0.000 2.226 328 Q HA -0.183 4.156 4.340 -0.001 0.000 0.204 328 Q C 2.194 178.207 176.000 0.021 0.000 0.975 328 Q CA 1.493 57.281 55.803 -0.026 0.000 0.866 328 Q CB -0.085 28.628 28.738 -0.042 0.000 0.915 328 Q HN 0.331 8.601 8.270 -0.000 0.000 0.440 329 R N 0.684 121.223 120.500 0.064 0.000 2.075 329 R HA -0.103 4.236 4.340 -0.001 0.000 0.232 329 R C 2.028 178.384 176.300 0.095 0.000 1.126 329 R CA 1.012 57.174 56.100 0.103 0.000 0.963 329 R CB -0.075 30.348 30.300 0.204 0.000 0.858 329 R HN 0.214 8.484 8.270 -0.000 0.000 0.435 330 I N 0.840 121.490 120.570 0.134 0.000 2.142 330 I HA -0.311 3.858 4.170 -0.001 0.000 0.240 330 I C 2.445 178.590 176.117 0.047 0.000 1.078 330 I CA 1.482 62.839 61.300 0.096 0.000 1.343 330 I CB -0.376 37.716 38.000 0.153 0.000 1.046 330 I HN 0.321 8.531 8.210 -0.000 0.000 0.405 331 Q N 0.366 120.194 119.800 0.047 0.000 2.112 331 Q HA -0.241 4.099 4.340 -0.001 0.000 0.206 331 Q C 2.387 178.403 176.000 0.027 0.000 0.987 331 Q CA 1.532 57.354 55.803 0.032 0.000 0.858 331 Q CB -0.229 28.523 28.738 0.023 0.000 0.905 331 Q HN 0.471 8.741 8.270 -0.000 0.000 0.420 332 R N -0.405 120.111 120.500 0.026 0.000 2.096 332 R HA -0.076 4.264 4.340 -0.001 0.000 0.235 332 R C 2.099 178.414 176.300 0.026 0.000 1.127 332 R CA 1.043 57.157 56.100 0.023 0.000 0.968 332 R CB -0.049 30.264 30.300 0.021 0.000 0.861 332 R HN 0.262 8.532 8.270 -0.000 0.000 0.440 333 M N -0.044 119.568 119.600 0.020 0.000 2.200 333 M HA -0.054 4.425 4.480 -0.001 0.000 0.265 333 M C 1.956 178.279 176.300 0.037 0.000 1.066 333 M CA 1.383 56.690 55.300 0.012 0.000 1.127 333 M CB -0.717 31.864 32.600 -0.032 0.000 1.379 333 M HN 0.031 8.321 8.290 -0.000 0.000 0.420 334 R N -0.297 120.222 120.500 0.032 0.000 2.073 334 R HA -0.209 4.130 4.340 -0.001 0.000 0.234 334 R C 2.295 178.651 176.300 0.093 0.000 1.134 334 R CA 1.631 57.769 56.100 0.063 0.000 0.952 334 R CB -0.338 29.986 30.300 0.040 0.000 0.850 334 R HN 0.317 8.587 8.270 -0.000 0.000 0.433 335 Q N 0.899 120.733 119.800 0.056 0.000 2.016 335 Q HA -0.128 4.211 4.340 -0.001 0.000 0.200 335 Q C 1.843 177.869 176.000 0.044 0.000 0.978 335 Q CA 1.354 57.182 55.803 0.041 0.000 0.833 335 Q CB -0.333 28.421 28.738 0.027 0.000 0.895 335 Q HN 0.224 8.494 8.270 -0.000 0.000 0.427 336 L N 0.085 121.339 121.223 0.052 0.000 2.275 336 L HA -0.000 4.339 4.340 -0.001 0.000 0.215 336 L C 1.834 178.754 176.870 0.082 0.000 1.119 336 L CA 1.395 56.263 54.840 0.047 0.000 0.790 336 L CB -0.707 41.376 42.059 0.040 0.000 0.919 336 L HN 0.375 8.605 8.230 -0.000 0.000 0.443 337 F N -0.438 119.470 119.950 -0.070 0.000 2.149 337 F HA -0.085 4.441 4.527 -0.001 0.000 0.294 337 F C 2.327 178.048 175.800 -0.131 0.000 1.095 337 F CA 1.788 59.724 58.000 -0.106 0.000 1.276 337 F CB -0.667 38.264 39.000 -0.114 0.000 1.023 337 F HN -0.006 8.294 8.300 -0.000 0.000 0.480 338 V N -0.201 119.624 119.914 -0.148 0.000 2.871 338 V HA -0.118 4.001 4.120 -0.001 0.000 0.256 338 V C 1.981 177.962 176.094 -0.187 0.000 1.082 338 V CA 1.987 64.115 62.300 -0.286 0.000 1.105 338 V CB -0.814 30.933 31.823 -0.126 0.000 0.713 338 V HN 0.311 8.501 8.190 -0.000 0.000 0.473 339 N N 1.407 120.047 118.700 -0.100 0.000 2.106 339 N HA -0.100 4.639 4.740 -0.001 0.000 0.188 339 N C 1.909 177.365 175.510 -0.090 0.000 1.029 339 N CA 2.283 55.291 53.050 -0.070 0.000 0.848 339 N CB -0.903 37.564 38.487 -0.033 0.000 1.007 339 N HN 0.581 8.961 8.380 -0.000 0.000 0.423 340 T N 1.779 116.277 114.554 -0.094 0.000 2.833 340 T HA -0.069 4.280 4.350 -0.001 0.000 0.269 340 T C 1.867 176.472 174.700 -0.158 0.000 1.054 340 T CA 0.437 62.482 62.100 -0.092 0.000 1.135 340 T CB -0.152 68.688 68.868 -0.046 0.000 0.869 340 T HN 0.009 8.249 8.240 -0.000 0.000 0.466 341 L N 1.157 122.204 121.223 -0.293 0.000 2.027 341 L HA -0.023 4.316 4.340 -0.001 0.000 0.206 341 L C 2.621 179.374 176.870 -0.194 0.000 1.074 341 L CA 1.628 56.248 54.840 -0.368 0.000 0.745 341 L CB -1.056 40.573 42.059 -0.717 0.000 0.898 341 L HN 0.170 8.400 8.230 -0.000 0.000 0.433 342 Q N -0.051 119.664 119.800 -0.143 0.000 1.985 342 Q HA -0.262 4.077 4.340 -0.001 0.000 0.207 342 Q C 2.027 177.998 176.000 -0.048 0.000 0.996 342 Q CA 2.285 58.050 55.803 -0.065 0.000 0.851 342 Q CB -0.284 28.426 28.738 -0.046 0.000 0.921 342 Q HN 0.781 9.050 8.270 -0.000 0.000 0.418 343 E N -0.172 119.998 120.200 -0.050 0.000 2.274 343 E HA -0.105 4.245 4.350 -0.001 0.000 0.194 343 E C 1.731 178.312 176.600 -0.033 0.000 0.996 343 E CA 0.688 57.068 56.400 -0.033 0.000 0.840 343 E CB -0.055 29.629 29.700 -0.027 0.000 0.772 343 E HN -0.032 8.328 8.360 -0.000 0.000 0.491 344 K N 0.568 120.939 120.400 -0.048 0.000 2.487 344 K HA 0.015 4.334 4.320 -0.001 0.000 0.192 344 K C 0.625 177.206 176.600 -0.031 0.000 1.027 344 K CA 0.789 57.054 56.287 -0.038 0.000 1.054 344 K CB 0.341 32.812 32.500 -0.048 0.000 0.824 344 K HN 0.386 8.636 8.250 -0.000 0.000 0.510 345 G N 0.394 109.176 108.800 -0.030 0.000 2.155 345 G HA2 -0.166 3.793 3.960 -0.001 0.000 0.135 345 G HA3 -0.166 3.793 3.960 -0.001 0.000 0.135 345 G C -0.024 174.877 174.900 0.002 0.000 1.023 345 G CA -0.011 45.083 45.100 -0.010 0.000 0.688 345 G HN 0.447 8.737 8.290 -0.000 0.000 0.499 346 A N 0.335 123.151 122.820 -0.007 0.000 2.440 346 A HA 0.599 4.918 4.320 -0.001 0.000 0.251 346 A C 1.076 178.710 177.584 0.084 0.000 1.089 346 A CA 0.596 52.659 52.037 0.045 0.000 0.779 346 A CB 0.033 19.060 19.000 0.046 0.000 1.022 346 A HN 1.159 9.309 8.150 -0.000 0.000 0.492 347 N N 1.390 120.154 118.700 0.107 0.000 2.268 347 N HA 0.083 4.822 4.740 -0.001 0.000 0.204 347 N C 0.088 175.657 175.510 0.098 0.000 1.124 347 N CA -0.402 52.699 53.050 0.086 0.000 0.838 347 N CB 0.402 38.928 38.487 0.064 0.000 0.994 347 N HN 0.533 8.913 8.380 -0.000 0.000 0.489 348 R N 0.344 120.939 120.500 0.158 0.000 2.888 348 R HA 0.200 4.540 4.340 -0.001 0.000 0.266 348 R C -1.516 174.823 176.300 0.064 0.000 1.020 348 R CA -0.776 55.349 56.100 0.041 0.000 0.963 348 R CB 1.211 31.438 30.300 -0.121 0.000 1.197 348 R HN 0.105 8.375 8.270 -0.000 0.000 0.481 349 D N 0.508 120.888 120.400 -0.034 0.000 2.316 349 D HA 0.154 4.794 4.640 -0.001 0.000 0.245 349 D C -0.366 175.904 176.300 -0.049 0.000 1.171 349 D CA -0.153 53.868 54.000 0.035 0.000 0.856 349 D CB 0.317 41.150 40.800 0.056 0.000 1.090 349 D HN 0.333 8.703 8.370 -0.000 0.000 0.476 350 F N 1.988 121.912 119.950 -0.043 0.000 2.641 350 F HA 0.143 4.670 4.527 -0.001 0.000 0.302 350 F C 2.255 177.854 175.800 -0.334 0.000 1.098 350 F CA -0.305 57.541 58.000 -0.257 0.000 1.318 350 F CB 0.076 38.846 39.000 -0.384 0.000 1.035 350 F HN 0.327 8.627 8.300 -0.000 0.000 0.551 351 S N 0.887 116.606 115.700 0.032 0.000 2.400 351 S HA -0.309 4.160 4.470 -0.001 0.000 0.234 351 S C 1.983 176.598 174.600 0.024 0.000 1.049 351 S CA 2.167 60.386 58.200 0.032 0.000 1.039 351 S CB -0.820 62.431 63.200 0.084 0.000 0.856 351 S HN 0.665 8.975 8.310 -0.000 0.000 0.465 352 F N 1.142 121.123 119.950 0.051 0.000 2.307 352 F HA -0.041 4.485 4.527 -0.001 0.000 0.301 352 F C 1.696 177.553 175.800 0.096 0.000 1.076 352 F CA 0.409 58.444 58.000 0.059 0.000 1.383 352 F CB -0.708 38.302 39.000 0.017 0.000 1.055 352 F HN 0.083 8.383 8.300 -0.000 0.000 0.526 353 I N 1.676 121.967 120.570 -0.465 0.000 2.335 353 I HA -0.262 3.907 4.170 -0.001 0.000 0.251 353 I C 2.351 178.466 176.117 -0.004 0.000 1.129 353 I CA 1.311 62.493 61.300 -0.196 0.000 1.402 353 I CB -1.044 36.882 38.000 -0.124 0.000 1.069 353 I HN 0.336 8.546 8.210 -0.000 0.000 0.424 354 I N 0.100 120.675 120.570 0.009 0.000 3.111 354 I HA -0.171 3.998 4.170 -0.001 0.000 0.272 354 I C 1.895 178.050 176.117 0.063 0.000 1.268 354 I CA 0.717 62.041 61.300 0.040 0.000 1.467 354 I CB -0.246 37.773 38.000 0.032 0.000 1.087 354 I HN 0.146 8.356 8.210 -0.000 0.000 0.467 355 K N 0.464 120.920 120.400 0.093 0.000 2.353 355 K HA 0.180 4.499 4.320 -0.001 0.000 0.195 355 K C 0.450 177.118 176.600 0.113 0.000 1.031 355 K CA 0.067 56.416 56.287 0.103 0.000 1.079 355 K CB 0.443 33.018 32.500 0.125 0.000 0.857 355 K HN 0.392 8.642 8.250 -0.000 0.000 0.535 356 Q N 0.645 120.519 119.800 0.124 0.000 2.193 356 Q HA 0.249 4.588 4.340 -0.001 0.000 0.246 356 Q C -0.743 175.309 176.000 0.086 0.000 0.959 356 Q CA -0.366 55.511 55.803 0.125 0.000 0.904 356 Q CB 1.326 30.162 28.738 0.164 0.000 1.238 356 Q HN 0.093 8.363 8.270 -0.000 0.000 0.469 357 N N -0.598 118.149 118.700 0.077 0.000 2.314 357 N HA 0.598 5.337 4.740 -0.001 0.000 0.304 357 N C -0.419 175.090 175.510 -0.002 0.000 1.073 357 N CA -0.072 53.014 53.050 0.061 0.000 0.822 357 N CB 1.799 40.346 38.487 0.100 0.000 1.280 357 N HN 0.778 9.158 8.380 -0.000 0.000 0.489 358 G N 0.763 109.562 108.800 -0.002 0.000 2.568 358 G HA2 -0.295 3.665 3.960 -0.001 0.000 0.222 358 G HA3 -0.295 3.665 3.960 -0.001 0.000 0.222 358 G C 0.471 175.221 174.900 -0.250 0.000 1.321 358 G CA -0.187 44.853 45.100 -0.099 0.000 0.893 358 G HN 0.498 8.788 8.290 -0.000 0.000 0.569 359 M N -0.224 119.018 119.600 -0.597 0.000 2.447 359 M HA 0.300 4.779 4.480 -0.001 0.000 0.264 359 M C 0.285 176.169 176.300 -0.694 0.000 1.095 359 M CA 0.947 55.834 55.300 -0.688 0.000 1.125 359 M CB 0.092 32.109 32.600 -0.972 0.000 1.389 359 M HN 0.234 8.524 8.290 -0.000 0.000 0.459 360 F N -0.414 119.421 119.950 -0.192 0.000 2.425 360 F HA 0.544 5.071 4.527 -0.001 0.000 0.331 360 F C 0.228 175.966 175.800 -0.103 0.000 1.085 360 F CA -1.169 56.738 58.000 -0.154 0.000 1.028 360 F CB 1.263 40.139 39.000 -0.206 0.000 1.177 360 F HN -0.274 8.026 8.300 -0.000 0.000 0.487 361 S N 1.201 116.993 115.700 0.153 0.000 2.547 361 S HA 0.504 4.973 4.470 -0.001 0.000 0.270 361 S C -1.606 173.137 174.600 0.239 0.000 1.150 361 S CA -0.667 57.621 58.200 0.147 0.000 0.850 361 S CB 1.152 64.462 63.200 0.184 0.000 1.118 361 S HN 0.244 8.554 8.310 -0.000 0.000 0.461 362 F N 3.092 123.145 119.950 0.171 0.000 2.444 362 F HA 0.205 4.731 4.527 -0.001 0.000 0.360 362 F C 1.992 177.988 175.800 0.328 0.000 1.106 362 F CA -1.112 56.987 58.000 0.164 0.000 1.170 362 F CB 0.803 39.829 39.000 0.043 0.000 1.113 362 F HN 0.710 9.010 8.300 -0.000 0.000 0.521 363 S N 1.635 117.629 115.700 0.490 0.000 2.469 363 S HA 0.040 4.510 4.470 -0.001 0.000 0.238 363 S C 1.522 176.459 174.600 0.560 0.000 0.998 363 S CA 0.489 59.018 58.200 0.550 0.000 0.957 363 S CB -0.639 62.829 63.200 0.447 0.000 0.764 363 S HN 1.265 9.575 8.310 -0.000 0.000 0.514 364 G N 0.407 109.435 108.800 0.380 0.000 2.204 364 G HA2 -0.160 3.799 3.960 -0.001 0.000 0.244 364 G HA3 -0.160 3.799 3.960 -0.001 0.000 0.244 364 G C -0.445 174.576 174.900 0.202 0.000 1.062 364 G CA 0.091 45.358 45.100 0.278 0.000 0.798 364 G HN 0.446 8.736 8.290 -0.000 0.000 0.496 365 L N 1.003 122.324 121.223 0.164 0.000 2.330 365 L HA 0.816 5.155 4.340 -0.001 0.000 0.271 365 L C 1.264 178.169 176.870 0.058 0.000 1.013 365 L CA 0.024 54.946 54.840 0.136 0.000 0.816 365 L CB 1.739 43.896 42.059 0.163 0.000 1.287 365 L HN 0.415 8.645 8.230 -0.000 0.000 0.435 366 T N -1.499 113.083 114.554 0.047 0.000 2.882 366 T HA 0.229 4.578 4.350 -0.001 0.000 0.287 366 T C 1.122 175.827 174.700 0.009 0.000 1.014 366 T CA -0.573 61.536 62.100 0.015 0.000 1.049 366 T CB 0.773 69.650 68.868 0.016 0.000 1.001 366 T HN 0.574 8.814 8.240 -0.000 0.000 0.525 367 K N 0.462 120.858 120.400 -0.007 0.000 2.089 367 K HA -0.232 4.087 4.320 -0.001 0.000 0.210 367 K C 1.960 178.562 176.600 0.004 0.000 1.048 367 K CA 2.103 58.386 56.287 -0.006 0.000 0.926 367 K CB -0.136 32.358 32.500 -0.011 0.000 0.714 367 K HN 0.708 8.958 8.250 -0.000 0.000 0.448 368 E N -0.044 120.160 120.200 0.007 0.000 2.216 368 E HA -0.110 4.239 4.350 -0.001 0.000 0.192 368 E C 1.919 178.530 176.600 0.018 0.000 0.988 368 E CA 0.827 57.233 56.400 0.010 0.000 0.834 368 E CB 0.112 29.818 29.700 0.010 0.000 0.772 368 E HN 0.344 8.704 8.360 -0.000 0.000 0.479 369 Q N 0.034 119.850 119.800 0.027 0.000 2.083 369 Q HA -0.100 4.239 4.340 -0.001 0.000 0.198 369 Q C 2.407 178.430 176.000 0.038 0.000 0.969 369 Q CA 1.651 57.479 55.803 0.042 0.000 0.838 369 Q CB -0.079 28.697 28.738 0.064 0.000 0.900 369 Q HN 0.401 8.671 8.270 -0.000 0.000 0.436 370 V N -1.400 118.532 119.914 0.031 0.000 2.548 370 V HA -0.159 3.960 4.120 -0.001 0.000 0.249 370 V C 1.947 178.036 176.094 -0.009 0.000 1.055 370 V CA 1.194 63.506 62.300 0.020 0.000 1.065 370 V CB -0.524 31.312 31.823 0.022 0.000 0.681 370 V HN 0.309 8.499 8.190 -0.000 0.000 0.462 371 L N 0.173 121.392 121.223 -0.007 0.000 2.005 371 L HA -0.104 4.235 4.340 -0.001 0.000 0.207 371 L C 3.010 179.872 176.870 -0.013 0.000 1.072 371 L CA 2.262 57.091 54.840 -0.019 0.000 0.744 371 L CB -0.320 41.735 42.059 -0.006 0.000 0.895 371 L HN 0.372 8.602 8.230 -0.000 0.000 0.433 372 R N -0.443 120.060 120.500 0.005 0.000 2.096 372 R HA -0.223 4.116 4.340 -0.001 0.000 0.235 372 R C 2.195 178.512 176.300 0.029 0.000 1.127 372 R CA 1.459 57.569 56.100 0.017 0.000 0.968 372 R CB -0.353 29.960 30.300 0.023 0.000 0.861 372 R HN 0.235 8.505 8.270 -0.000 0.000 0.440 373 L N 1.260 122.498 121.223 0.024 0.000 2.042 373 L HA -0.167 4.172 4.340 -0.001 0.000 0.210 373 L C 2.577 179.451 176.870 0.006 0.000 1.076 373 L CA 1.865 56.723 54.840 0.030 0.000 0.749 373 L CB -0.639 41.438 42.059 0.030 0.000 0.893 373 L HN 0.225 8.455 8.230 -0.000 0.000 0.432 374 R N -0.867 119.587 120.500 -0.077 0.000 2.073 374 R HA -0.094 4.245 4.340 -0.001 0.000 0.229 374 R C 1.954 178.250 176.300 -0.007 0.000 1.120 374 R CA 1.241 57.199 56.100 -0.238 0.000 0.967 374 R CB 0.002 30.037 30.300 -0.441 0.000 0.862 374 R HN 0.389 8.659 8.270 -0.000 0.000 0.436 375 E N 0.586 120.820 120.200 0.056 0.000 2.042 375 E HA -0.108 4.242 4.350 -0.001 0.000 0.189 375 E C 1.777 178.458 176.600 0.135 0.000 0.974 375 E CA 0.943 57.414 56.400 0.119 0.000 0.806 375 E CB -0.111 29.602 29.700 0.022 0.000 0.769 375 E HN 0.280 8.640 8.360 -0.000 0.000 0.451 376 E N -0.455 119.800 120.200 0.091 0.000 2.478 376 E HA 0.047 4.396 4.350 -0.001 0.000 0.198 376 E C -0.682 176.041 176.600 0.205 0.000 1.046 376 E CA 0.026 56.467 56.400 0.069 0.000 0.870 376 E CB -0.091 29.635 29.700 0.043 0.000 0.818 376 E HN -0.018 8.342 8.360 -0.000 0.000 0.527 377 F N -1.958 117.990 119.950 -0.003 0.000 2.184 377 F HA 0.075 4.601 4.527 -0.001 0.000 0.319 377 F C 1.183 177.010 175.800 0.045 0.000 1.284 377 F CA 0.833 58.844 58.000 0.018 0.000 0.914 377 F CB -0.719 38.299 39.000 0.031 0.000 4.125 377 F HN 0.077 8.377 8.300 -0.000 0.000 0.146 378 G N 0.889 109.626 108.800 -0.105 0.000 2.399 378 G HA2 -0.138 3.821 3.960 -0.001 0.000 0.216 378 G HA3 -0.138 3.821 3.960 -0.001 0.000 0.216 378 G C -0.331 174.598 174.900 0.048 0.000 1.096 378 G CA -0.173 44.795 45.100 -0.220 0.000 0.650 378 G HN 1.397 9.687 8.290 -0.000 0.000 0.512 379 V N 2.177 122.124 119.914 0.055 0.000 2.406 379 V HA 0.581 4.700 4.120 -0.001 0.000 0.272 379 V C -0.184 175.957 176.094 0.080 0.000 1.043 379 V CA -0.546 61.819 62.300 0.109 0.000 0.915 379 V CB 0.836 32.699 31.823 0.067 0.000 0.988 379 V HN 0.286 8.476 8.190 -0.000 0.000 0.466 380 Y N 3.234 123.573 120.300 0.066 0.000 2.330 380 Y HA 0.718 5.268 4.550 -0.001 0.000 0.336 380 Y C 0.439 176.348 175.900 0.014 0.000 1.036 380 Y CA -0.185 57.954 58.100 0.065 0.000 1.125 380 Y CB 1.759 40.279 38.460 0.099 0.000 1.194 380 Y HN 0.762 9.042 8.280 -0.000 0.000 0.469 381 A N 1.911 124.789 122.820 0.097 0.000 2.594 381 A HA 0.738 5.057 4.320 -0.001 0.000 0.291 381 A C -1.484 176.142 177.584 0.070 0.000 1.105 381 A CA -0.809 51.274 52.037 0.077 0.000 0.694 381 A CB 0.730 19.771 19.000 0.069 0.000 1.291 381 A HN 0.415 8.565 8.150 -0.000 0.000 0.410 382 V N 1.449 121.405 119.914 0.070 0.000 2.715 382 V HA 0.324 4.444 4.120 -0.001 0.000 0.299 382 V C 1.790 177.914 176.094 0.051 0.000 1.054 382 V CA 0.754 63.090 62.300 0.060 0.000 1.077 382 V CB 1.108 32.965 31.823 0.057 0.000 0.972 382 V HN 1.367 9.557 8.190 -0.000 0.000 0.484 383 A N 3.467 126.308 122.820 0.034 0.000 2.076 383 A HA -0.119 4.200 4.320 -0.001 0.000 0.220 383 A C 2.160 179.740 177.584 -0.005 0.000 1.160 383 A CA 1.733 53.779 52.037 0.015 0.000 0.653 383 A CB -0.545 18.460 19.000 0.008 0.000 0.801 383 A HN 1.040 9.190 8.150 -0.000 0.000 0.455 384 S N -1.678 114.023 115.700 0.002 0.000 2.595 384 S HA 0.289 4.758 4.470 -0.001 0.000 0.235 384 S C 1.523 176.029 174.600 -0.155 0.000 0.974 384 S CA 0.988 59.141 58.200 -0.079 0.000 0.942 384 S CB -0.560 62.675 63.200 0.058 0.000 0.766 384 S HN 1.863 10.173 8.310 -0.000 0.000 0.536 385 G N 1.460 110.260 108.800 0.000 0.000 2.179 385 G HA2 -0.327 3.633 3.960 -0.001 0.000 0.260 385 G HA3 -0.327 3.633 3.960 -0.001 0.000 0.260 385 G C 0.124 175.162 174.900 0.231 0.000 0.977 385 G CA 0.100 45.237 45.100 0.062 0.000 0.641 385 G HN 0.707 8.997 8.290 -0.000 0.000 0.533 386 R N -0.006 120.689 120.500 0.325 0.000 2.537 386 R HA 0.496 4.835 4.340 -0.001 0.000 0.280 386 R C -0.606 175.813 176.300 0.199 0.000 1.058 386 R CA 0.134 56.450 56.100 0.360 0.000 1.057 386 R CB 0.678 31.107 30.300 0.214 0.000 0.973 386 R HN 0.194 8.464 8.270 -0.000 0.000 0.438 387 V N 4.551 124.576 119.914 0.186 0.000 2.760 387 V HA 0.179 4.298 4.120 -0.001 0.000 0.309 387 V C -0.959 175.216 176.094 0.135 0.000 1.077 387 V CA -0.998 61.363 62.300 0.102 0.000 0.910 387 V CB 2.134 33.989 31.823 0.053 0.000 1.008 387 V HN 0.825 9.015 8.190 -0.000 0.000 0.424 388 N N 4.463 123.226 118.700 0.105 0.000 2.437 388 N HA 0.170 4.910 4.740 -0.001 0.000 0.243 388 N C 0.749 176.191 175.510 -0.114 0.000 1.041 388 N CA 0.077 53.164 53.050 0.061 0.000 0.940 388 N CB 1.730 40.274 38.487 0.094 0.000 1.133 388 N HN 0.415 8.795 8.380 -0.000 0.000 0.506 389 V N 3.521 123.332 119.914 -0.172 0.000 2.469 389 V HA -0.224 3.895 4.120 -0.001 0.000 0.251 389 V C 2.093 178.078 176.094 -0.182 0.000 1.064 389 V CA 2.202 64.375 62.300 -0.212 0.000 1.066 389 V CB -0.765 30.950 31.823 -0.180 0.000 0.667 389 V HN 0.794 8.984 8.190 -0.000 0.000 0.461 390 A N 0.037 122.748 122.820 -0.182 0.000 2.248 390 A HA 0.110 4.429 4.320 -0.001 0.000 0.210 390 A C 2.053 179.497 177.584 -0.233 0.000 1.174 390 A CA 1.130 53.038 52.037 -0.215 0.000 0.750 390 A CB -0.574 18.281 19.000 -0.241 0.000 0.780 390 A HN 0.553 8.703 8.150 -0.000 0.000 0.478 391 G N -1.028 107.664 108.800 -0.181 0.000 3.042 391 G HA2 0.357 4.316 3.960 -0.001 0.000 0.212 391 G HA3 0.357 4.316 3.960 -0.001 0.000 0.212 391 G C 0.469 175.288 174.900 -0.135 0.000 1.166 391 G CA -0.330 44.675 45.100 -0.157 0.000 0.767 391 G HN 0.453 8.743 8.290 -0.000 0.000 0.546 392 M N 1.501 121.015 119.600 -0.142 0.000 2.367 392 M HA 0.474 4.953 4.480 -0.001 0.000 0.339 392 M C -0.009 176.243 176.300 -0.081 0.000 1.177 392 M CA -0.355 54.879 55.300 -0.109 0.000 1.068 392 M CB 1.939 34.457 32.600 -0.138 0.000 1.602 392 M HN 0.065 8.355 8.290 -0.000 0.000 0.457 393 T N -1.762 112.763 114.554 -0.048 0.000 2.896 393 T HA 0.485 4.834 4.350 -0.001 0.000 0.297 393 T C -2.605 172.088 174.700 -0.012 0.000 1.108 393 T CA -1.753 60.327 62.100 -0.033 0.000 1.004 393 T CB 1.895 70.744 68.868 -0.031 0.000 1.159 393 T HN 0.277 8.517 8.240 -0.000 0.000 0.499 394 P HA -0.016 4.404 4.420 -0.000 0.000 0.218 394 P C 0.509 177.812 177.300 0.005 0.000 1.148 394 P CA 1.070 64.173 63.100 0.005 0.000 0.822 394 P CB -0.054 31.649 31.700 0.005 0.000 0.784 395 D N -0.503 119.898 120.400 0.002 0.000 2.097 395 D HA -0.159 4.480 4.640 -0.001 0.000 0.195 395 D C 1.454 177.758 176.300 0.006 0.000 0.989 395 D CA 1.356 55.358 54.000 0.004 0.000 0.827 395 D CB -0.715 40.086 40.800 0.002 0.000 0.966 395 D HN 0.297 8.667 8.370 -0.000 0.000 0.456 396 N N -0.038 118.664 118.700 0.004 0.000 2.336 396 N HA -0.013 4.726 4.740 -0.001 0.000 0.189 396 N C 1.275 176.796 175.510 0.018 0.000 1.113 396 N CA 0.118 53.174 53.050 0.009 0.000 0.858 396 N CB -0.141 38.349 38.487 0.005 0.000 0.970 396 N HN 0.094 8.474 8.380 -0.000 0.000 0.471 397 M N 0.758 120.371 119.600 0.021 0.000 2.080 397 M HA 0.050 4.529 4.480 -0.001 0.000 0.260 397 M C 1.920 178.246 176.300 0.042 0.000 1.068 397 M CA 1.646 56.973 55.300 0.044 0.000 1.109 397 M CB -0.426 32.201 32.600 0.044 0.000 1.342 397 M HN 0.292 8.582 8.290 -0.000 0.000 0.405 398 A N 0.552 123.387 122.820 0.024 0.000 1.873 398 A HA -0.018 4.301 4.320 -0.001 0.000 0.215 398 A C -0.300 177.296 177.584 0.019 0.000 1.186 398 A CA 1.380 53.426 52.037 0.015 0.000 0.616 398 A CB -2.258 16.747 19.000 0.009 0.000 0.823 398 A HN 0.503 8.653 8.150 -0.000 0.000 0.442 399 P HA -0.161 4.259 4.420 -0.000 0.000 0.219 399 P C 1.736 179.058 177.300 0.038 0.000 1.146 399 P CA 0.943 64.061 63.100 0.029 0.000 0.808 399 P CB -0.132 31.585 31.700 0.028 0.000 0.779 400 L N -0.469 120.781 121.223 0.046 0.000 2.049 400 L HA -0.084 4.255 4.340 -0.001 0.000 0.203 400 L C 2.359 179.271 176.870 0.071 0.000 1.074 400 L CA 1.666 56.544 54.840 0.064 0.000 0.749 400 L CB -0.881 41.220 42.059 0.069 0.000 0.907 400 L HN -0.032 8.198 8.230 -0.000 0.000 0.439 401 C N 0.348 119.684 119.300 0.060 0.000 2.422 401 C HA -0.150 4.309 4.460 -0.001 0.000 0.279 401 C C 2.470 177.448 174.990 -0.020 0.000 1.305 401 C CA 0.923 59.937 59.018 -0.006 0.000 1.757 401 C CB -0.763 26.947 27.740 -0.051 0.000 1.962 401 C HN 0.600 8.830 8.230 -0.000 0.000 0.499 402 E N 1.103 121.305 120.200 0.003 0.000 2.021 402 E HA -0.212 4.137 4.350 -0.001 0.000 0.200 402 E C 2.270 178.881 176.600 0.019 0.000 1.015 402 E CA 1.944 58.349 56.400 0.008 0.000 0.824 402 E CB -0.320 29.391 29.700 0.020 0.000 0.762 402 E HN 0.563 8.923 8.360 -0.000 0.000 0.454 403 A N 0.335 123.175 122.820 0.034 0.000 1.902 403 A HA -0.186 4.133 4.320 -0.001 0.000 0.217 403 A C 2.298 179.909 177.584 0.046 0.000 1.181 403 A CA 1.593 53.657 52.037 0.046 0.000 0.623 403 A CB -0.757 18.279 19.000 0.059 0.000 0.818 403 A HN 0.333 8.483 8.150 -0.000 0.000 0.443 404 I N -0.506 120.089 120.570 0.042 0.000 2.226 404 I HA -0.155 4.014 4.170 -0.001 0.000 0.245 404 I C 1.308 177.444 176.117 0.031 0.000 1.100 404 I CA 0.381 61.707 61.300 0.044 0.000 1.374 404 I CB -0.446 37.567 38.000 0.022 0.000 1.057 404 I HN 0.092 8.302 8.210 -0.000 0.000 0.413 408 V N -1.877 118.069 119.914 0.053 0.000 3.398 408 V HA 0.518 4.637 4.120 -0.001 0.000 0.298 408 V C 0.640 176.775 176.094 0.068 0.000 1.496 408 V CA -0.083 62.252 62.300 0.057 0.000 1.044 408 V CB -0.562 31.297 31.823 0.060 0.000 0.880 408 V HN 0.272 8.462 8.190 -0.000 0.000 0.443 409 L N 0.000 121.271 121.223 0.080 0.000 2.949 409 L HA 0.000 4.339 4.340 -0.001 0.000 0.249 409 L CA 0.000 54.898 54.840 0.097 0.000 0.813 409 L CB 0.000 42.136 42.059 0.128 0.000 0.961 409 L HN 0.000 8.230 8.230 -0.000 0.000 0.502