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 3hhw_1_N DATA FIRST_RESID 2 DATA SEQUENCE SVTVKRIIDN TVIVPKLPAN EDPVEYPADY FRKSKEIPLY INTTKSLSDL DATA SEQUENCE RGYVYQGLKS GNVSIIHVNS YLYGALKDIR GKLDKDWSSF GINIGKAGDT DATA SEQUENCE IGIFDLVSLK ALDGVLPDGV SDASRTSADD KWLPLYLLGL YRVGRTQMPE DATA SEQUENCE YRKKLMDGLT NQCKMINEQF EPLVPEGRDI FDVWGNDSNY TKIVAAVDMF DATA SEQUENCE FHMFKKHECA SFRYGTIVSR FKDCAALATF GHLCKITGMS TEDVTTWILN DATA SEQUENCE REVADEMVQM MLPGQEIDKA DSYMPYLIDF GLSSKSPYWS VKNPAFHFWG DATA SEQUENCE QLTALLLRST RARNARQPDD IEYTSLTTAG LLYAYAVGSS ADLAQQFCVG DATA SEQUENCE DNKYTPDDST GGLTTNAPPQ GRDVVEWLGW FEDQNRKPTP DMMQYAKRAV DATA SEQUENCE MSLQGLREKT IGKYAKSEFD K VARS RESID RESNAME ATOMNAME SS_SHIFT SHIFT RC_SHIFT HM_SHIFT EF_SHIFT SIGMA FORMAT %4d %4s %4s %9.3f %9.3f %9.3f %9.3f %9.3f %9.3f 2 S HA 0.000 4.470 4.470 0.000 0.000 0.327 2 S C 0.000 174.600 174.600 -0.000 0.000 1.055 2 S CA 0.000 58.200 58.200 -0.000 0.000 1.107 2 S CB 0.000 63.200 63.200 -0.000 0.000 0.593 3 V N 0.423 120.337 119.914 -0.000 0.000 2.840 3 V HA 0.287 4.406 4.120 -0.001 0.000 0.234 3 V C 1.397 177.491 176.094 0.000 0.000 1.159 3 V CA 1.035 63.335 62.300 -0.000 0.000 1.194 3 V CB -0.745 31.078 31.823 -0.000 0.000 0.971 3 V HN 0.846 9.036 8.190 0.000 0.000 0.494 4 T N 1.299 115.853 114.554 0.000 0.000 2.834 4 T HA 0.508 4.857 4.350 -0.001 0.000 0.298 4 T C -0.516 174.184 174.700 0.001 0.000 0.966 4 T CA -0.169 61.931 62.100 0.000 0.000 1.141 4 T CB 0.938 69.806 68.868 0.000 0.000 0.905 4 T HN 0.082 8.322 8.240 0.000 0.000 0.535 5 V N 4.065 123.979 119.914 0.001 0.000 2.459 5 V HA 0.488 4.608 4.120 -0.001 0.000 0.295 5 V C 0.120 176.215 176.094 0.001 0.000 1.029 5 V CA -0.969 61.332 62.300 0.001 0.000 0.874 5 V CB 1.487 33.311 31.823 0.001 0.000 0.985 5 V HN 0.878 9.068 8.190 0.000 0.000 0.438 6 K N 3.235 123.636 120.400 0.001 0.000 2.207 6 K HA 0.582 4.902 4.320 -0.001 0.000 0.255 6 K C -0.389 176.212 176.600 0.001 0.000 0.941 6 K CA -0.831 55.457 56.287 0.001 0.000 0.825 6 K CB 2.437 34.937 32.500 0.001 0.000 1.119 6 K HN 0.567 8.817 8.250 0.000 0.000 0.430 7 R N 3.177 123.678 120.500 0.001 0.000 2.265 7 R HA 0.171 4.510 4.340 -0.001 0.000 0.314 7 R C 0.744 177.045 176.300 0.001 0.000 1.053 7 R CA -0.061 56.040 56.100 0.002 0.000 0.931 7 R CB 0.394 30.695 30.300 0.002 0.000 1.024 7 R HN 0.686 8.956 8.270 0.000 0.000 0.457 8 I N 4.297 124.867 120.570 0.001 0.000 2.110 8 I HA -0.290 3.880 4.170 -0.001 0.000 0.236 8 I C 2.092 178.210 176.117 0.001 0.000 1.068 8 I CA 1.052 62.353 61.300 0.001 0.000 1.333 8 I CB -0.286 37.715 38.000 0.001 0.000 1.054 8 I HN 0.687 8.897 8.210 0.000 0.000 0.402 9 I N 0.946 121.517 120.570 0.001 0.000 2.151 9 I HA -0.355 3.814 4.170 -0.001 0.000 0.243 9 I C 1.979 178.097 176.117 0.001 0.000 1.080 9 I CA 1.982 63.283 61.300 0.001 0.000 1.339 9 I CB -0.356 37.645 38.000 0.001 0.000 1.039 9 I HN 0.230 8.440 8.210 0.000 0.000 0.409 10 D N -0.035 120.366 120.400 0.001 0.000 2.249 10 D HA -0.106 4.533 4.640 -0.001 0.000 0.205 10 D C 0.859 177.160 176.300 0.001 0.000 0.962 10 D CA 0.747 54.747 54.000 0.001 0.000 0.860 10 D CB -0.241 40.559 40.800 0.001 0.000 0.955 10 D HN 0.484 8.854 8.370 0.000 0.000 0.505 11 N N -0.051 118.649 118.700 0.001 0.000 2.740 11 N HA -0.148 4.591 4.740 -0.001 0.000 0.248 11 N C -1.114 174.397 175.510 0.001 0.000 1.062 11 N CA 0.216 53.266 53.050 0.001 0.000 0.704 11 N CB -0.586 37.902 38.487 0.001 0.000 0.968 11 N HN 0.041 8.421 8.380 0.000 0.000 0.547 12 T N 0.029 114.583 114.554 0.001 0.000 2.863 12 T HA 0.468 4.817 4.350 -0.001 0.000 0.285 12 T C 0.470 175.170 174.700 0.001 0.000 1.009 12 T CA -0.627 61.474 62.100 0.001 0.000 0.989 12 T CB 2.156 71.025 68.868 0.001 0.000 1.004 12 T HN 0.223 8.463 8.240 0.000 0.000 0.455 13 V N 1.725 121.640 119.914 0.001 0.000 2.715 13 V HA 0.639 4.758 4.120 -0.001 0.000 0.299 13 V C 0.040 176.135 176.094 0.001 0.000 1.054 13 V CA -0.579 61.722 62.300 0.001 0.000 1.077 13 V CB 0.415 32.238 31.823 0.001 0.000 0.972 13 V HN 0.894 9.084 8.190 0.000 0.000 0.484 14 I N 3.360 123.931 120.570 0.001 0.000 2.647 14 I HA 0.604 4.773 4.170 -0.001 0.000 0.295 14 I C -0.911 175.207 176.117 0.001 0.000 1.078 14 I CA -0.872 60.428 61.300 0.001 0.000 1.048 14 I CB 2.265 40.266 38.000 0.002 0.000 1.239 14 I HN 0.538 8.748 8.210 0.000 0.000 0.421 15 V N 8.015 127.930 119.914 0.001 0.000 2.257 15 V HA 0.353 4.473 4.120 -0.001 0.000 0.269 15 V C -2.223 173.871 176.094 0.002 0.000 1.040 15 V CA -1.444 60.857 62.300 0.001 0.000 0.813 15 V CB 0.543 32.366 31.823 0.001 0.000 1.065 15 V HN 0.616 8.806 8.190 0.000 0.000 0.457 16 P HA 0.300 4.720 4.420 0.000 0.000 0.267 16 P C -0.566 176.735 177.300 0.002 0.000 1.209 16 P CA 0.023 63.124 63.100 0.002 0.000 0.763 16 P CB 0.303 32.004 31.700 0.002 0.000 0.816 17 K N 2.197 122.598 120.400 0.002 0.000 2.551 17 K HA 0.710 5.029 4.320 -0.001 0.000 0.269 17 K C -1.456 175.146 176.600 0.002 0.000 0.949 17 K CA -0.997 55.291 56.287 0.002 0.000 0.849 17 K CB 1.614 34.114 32.500 0.002 0.000 1.411 17 K HN 0.169 8.419 8.250 0.000 0.000 0.432 18 L N 0.917 122.141 121.223 0.002 0.000 2.333 18 L HA 0.516 4.855 4.340 -0.001 0.000 0.263 18 L C -2.212 174.660 176.870 0.002 0.000 1.014 18 L CA -2.295 52.546 54.840 0.002 0.000 0.820 18 L CB 1.744 43.803 42.059 0.002 0.000 1.352 18 L HN 0.603 8.833 8.230 0.000 0.000 0.421 19 P HA 0.101 4.521 4.420 0.000 0.000 0.264 19 P C -0.672 176.630 177.300 0.004 0.000 1.179 19 P CA -0.151 62.951 63.100 0.003 0.000 0.763 19 P CB 0.417 32.120 31.700 0.004 0.000 0.806 20 A N 2.598 125.421 122.820 0.004 0.000 2.407 20 A HA 0.254 4.573 4.320 -0.001 0.000 0.248 20 A C 0.331 177.919 177.584 0.006 0.000 1.082 20 A CA -0.102 51.938 52.037 0.004 0.000 0.785 20 A CB -0.253 18.750 19.000 0.005 0.000 1.020 20 A HN 0.639 8.789 8.150 0.000 0.000 0.489 21 N N 0.698 119.401 118.700 0.006 0.000 2.617 21 N HA 0.271 5.011 4.740 -0.001 0.000 0.263 21 N C -0.990 174.526 175.510 0.009 0.000 1.074 21 N CA -0.297 52.757 53.050 0.008 0.000 0.841 21 N CB 0.782 39.273 38.487 0.007 0.000 1.221 21 N HN 0.649 9.029 8.380 0.000 0.000 0.529 22 E N 1.943 122.149 120.200 0.010 0.000 3.406 22 E HA 0.171 4.520 4.350 -0.001 0.000 0.210 22 E C -1.337 175.271 176.600 0.013 0.000 1.167 22 E CA -0.698 55.708 56.400 0.011 0.000 1.132 22 E CB 0.089 29.795 29.700 0.009 0.000 1.309 22 E HN 0.415 8.775 8.360 0.000 0.000 0.424 23 D N 1.947 122.356 120.400 0.015 0.000 2.477 23 D HA 0.279 4.918 4.640 -0.001 0.000 0.239 23 D C -2.211 174.095 176.300 0.009 0.000 1.102 23 D CA -1.608 52.403 54.000 0.019 0.000 0.901 23 D CB 1.047 41.866 40.800 0.031 0.000 1.026 23 D HN 0.117 8.487 8.370 0.000 0.000 0.515 24 P HA 0.132 4.552 4.420 0.000 0.000 0.274 24 P C 0.304 177.571 177.300 -0.056 0.000 1.231 24 P CA -0.706 62.386 63.100 -0.014 0.000 0.790 24 P CB 0.994 32.697 31.700 0.005 0.000 0.951 25 V N -1.476 118.363 119.914 -0.126 0.000 2.834 25 V HA 0.348 4.468 4.120 -0.001 0.000 0.301 25 V C 0.031 175.949 176.094 -0.293 0.000 1.066 25 V CA -0.492 61.646 62.300 -0.269 0.000 1.052 25 V CB 0.495 32.041 31.823 -0.462 0.000 1.021 25 V HN 0.425 8.615 8.190 0.000 0.000 0.480 26 E N 2.455 122.469 120.200 -0.309 0.000 2.081 26 E HA 0.388 4.738 4.350 -0.001 0.000 0.276 26 E C -1.523 174.932 176.600 -0.243 0.000 0.950 26 E CA -0.361 55.924 56.400 -0.191 0.000 0.776 26 E CB 1.179 30.813 29.700 -0.110 0.000 1.094 26 E HN 0.750 9.110 8.360 0.000 0.000 0.402 27 Y N 3.044 123.316 120.300 -0.047 0.000 2.319 27 Y HA 0.086 4.635 4.550 -0.001 0.000 0.328 27 Y C -1.352 174.550 175.900 0.002 0.000 1.133 27 Y CA -2.053 56.044 58.100 -0.005 0.000 1.265 27 Y CB 0.440 38.910 38.460 0.017 0.000 1.218 27 Y HN 0.528 8.808 8.280 0.000 0.000 0.508 28 P HA -0.306 4.114 4.420 0.000 0.000 0.216 28 P C 1.149 178.340 177.300 -0.181 0.000 1.154 28 P CA 2.567 65.672 63.100 0.010 0.000 0.865 28 P CB 0.171 31.938 31.700 0.112 0.000 0.789 29 A N -0.441 122.280 122.820 -0.165 0.000 2.015 29 A HA -0.186 4.133 4.320 -0.001 0.000 0.219 29 A C 1.857 179.443 177.584 0.003 0.000 1.163 29 A CA 1.752 53.669 52.037 -0.200 0.000 0.646 29 A CB -1.152 17.893 19.000 0.075 0.000 0.806 29 A HN 0.117 8.267 8.150 0.000 0.000 0.448 30 D N -2.034 118.398 120.400 0.052 0.000 2.317 30 D HA -0.074 4.566 4.640 -0.001 0.000 0.211 30 D C 1.401 177.709 176.300 0.013 0.000 0.966 30 D CA 0.772 54.801 54.000 0.049 0.000 0.876 30 D CB -0.207 40.640 40.800 0.077 0.000 0.927 30 D HN 0.669 9.039 8.370 0.000 0.000 0.519 31 Y N 0.349 120.558 120.300 -0.152 0.000 2.184 31 Y HA -0.165 4.384 4.550 -0.001 0.000 0.290 31 Y C 1.727 177.423 175.900 -0.340 0.000 1.129 31 Y CA 1.392 59.317 58.100 -0.292 0.000 1.144 31 Y CB -0.356 37.826 38.460 -0.462 0.000 0.995 31 Y HN -0.198 8.082 8.280 0.000 0.000 0.513 32 F N -0.052 119.858 119.950 -0.065 0.000 2.604 32 F HA 0.010 4.536 4.527 -0.001 0.000 0.298 32 F C 2.410 178.144 175.800 -0.109 0.000 1.131 32 F CA 0.955 58.892 58.000 -0.105 0.000 1.457 32 F CB -0.362 38.605 39.000 -0.055 0.000 1.095 32 F HN -0.063 8.237 8.300 0.000 0.000 0.574 33 R N -0.143 120.379 120.500 0.036 0.000 2.189 33 R HA -0.078 4.261 4.340 -0.001 0.000 0.218 33 R C 1.675 177.942 176.300 -0.056 0.000 1.074 33 R CA 1.067 57.172 56.100 0.008 0.000 0.991 33 R CB 0.145 30.451 30.300 0.010 0.000 0.883 33 R HN 0.057 8.327 8.270 0.000 0.000 0.457 34 K N -1.187 119.127 120.400 -0.145 0.000 2.267 34 K HA 0.174 4.493 4.320 -0.001 0.000 0.213 34 K C 0.115 176.573 176.600 -0.238 0.000 1.060 34 K CA 0.358 56.538 56.287 -0.178 0.000 0.935 34 K CB 0.529 32.909 32.500 -0.200 0.000 1.096 34 K HN -0.127 8.123 8.250 0.000 0.000 0.468 35 S N 0.733 116.167 115.700 -0.444 0.000 2.452 35 S HA 0.231 4.700 4.470 -0.001 0.000 0.284 35 S C -0.089 174.303 174.600 -0.346 0.000 1.171 35 S CA -0.399 57.521 58.200 -0.467 0.000 1.064 35 S CB 0.602 63.343 63.200 -0.765 0.000 0.967 35 S HN 0.073 8.383 8.310 0.000 0.000 0.484 36 K N 2.893 123.210 120.400 -0.138 0.000 2.410 36 K HA 0.230 4.550 4.320 -0.001 0.000 0.200 36 K C -0.115 176.510 176.600 0.043 0.000 1.023 36 K CA -0.009 56.290 56.287 0.021 0.000 1.149 36 K CB 0.336 32.853 32.500 0.028 0.000 0.859 36 K HN 0.803 9.053 8.250 0.000 0.000 0.514 37 E N -0.480 119.697 120.200 -0.038 0.000 2.352 37 E HA 0.282 4.631 4.350 -0.001 0.000 0.280 37 E C -1.049 175.518 176.600 -0.055 0.000 0.930 37 E CA -0.728 55.655 56.400 -0.029 0.000 0.765 37 E CB 1.219 30.899 29.700 -0.033 0.000 1.219 37 E HN -0.118 8.242 8.360 0.000 0.000 0.434 38 I N 2.808 123.326 120.570 -0.087 0.000 2.337 38 I HA 0.250 4.420 4.170 -0.001 0.000 0.291 38 I C -2.148 173.903 176.117 -0.110 0.000 1.046 38 I CA -2.069 59.170 61.300 -0.102 0.000 1.324 38 I CB 0.840 38.697 38.000 -0.238 0.000 1.409 38 I HN 0.322 8.532 8.210 0.000 0.000 0.494 39 P HA 0.249 4.669 4.420 0.000 0.000 0.280 39 P C -0.995 176.050 177.300 -0.424 0.000 1.244 39 P CA -0.392 62.502 63.100 -0.345 0.000 0.784 39 P CB 0.976 32.493 31.700 -0.305 0.000 0.913 40 L N 4.787 125.671 121.223 -0.565 0.000 2.457 40 L HA 0.412 4.751 4.340 -0.001 0.000 0.266 40 L C -1.764 174.835 176.870 -0.451 0.000 0.979 40 L CA -0.677 53.941 54.840 -0.369 0.000 0.857 40 L CB 0.641 42.636 42.059 -0.107 0.000 1.213 40 L HN 0.208 8.438 8.230 0.000 0.000 0.418 41 Y N 6.172 126.443 120.300 -0.049 0.000 2.504 41 Y HA 0.622 5.171 4.550 -0.001 0.000 0.339 41 Y C -0.061 175.768 175.900 -0.118 0.000 0.974 41 Y CA -0.590 57.459 58.100 -0.083 0.000 1.232 41 Y CB 0.616 39.043 38.460 -0.056 0.000 1.108 41 Y HN 0.375 8.655 8.280 0.000 0.000 0.509 42 I N 2.854 123.370 120.570 -0.089 0.000 2.465 42 I HA 0.281 4.450 4.170 -0.001 0.000 0.291 42 I C -0.601 175.412 176.117 -0.173 0.000 1.014 42 I CA -0.972 60.223 61.300 -0.175 0.000 1.093 42 I CB 1.908 39.677 38.000 -0.385 0.000 1.267 42 I HN 0.439 8.649 8.210 0.000 0.000 0.431 43 N N 3.670 122.299 118.700 -0.118 0.000 2.437 43 N HA 0.297 5.037 4.740 -0.001 0.000 0.259 43 N C -1.012 174.450 175.510 -0.079 0.000 0.983 43 N CA -0.175 52.819 53.050 -0.094 0.000 0.937 43 N CB 1.092 39.534 38.487 -0.075 0.000 1.122 43 N HN 0.472 8.852 8.380 0.000 0.000 0.499 44 T N 2.664 117.174 114.554 -0.074 0.000 3.029 44 T HA 0.165 4.514 4.350 -0.001 0.000 0.346 44 T C 0.939 175.640 174.700 0.001 0.000 1.211 44 T CA -0.392 61.695 62.100 -0.021 0.000 1.009 44 T CB 0.642 69.503 68.868 -0.012 0.000 1.084 44 T HN 0.592 8.832 8.240 0.000 0.000 0.536 45 T N 1.615 116.180 114.554 0.018 0.000 2.999 45 T HA 0.200 4.549 4.350 -0.001 0.000 0.247 45 T C 0.645 175.380 174.700 0.058 0.000 1.012 45 T CA 0.250 62.367 62.100 0.028 0.000 1.048 45 T CB 0.193 69.070 68.868 0.015 0.000 1.020 45 T HN 0.120 8.360 8.240 0.000 0.000 0.478 46 K N 2.924 123.379 120.400 0.090 0.000 2.098 46 K HA 0.488 4.808 4.320 -0.001 0.000 0.258 46 K C 0.453 177.122 176.600 0.116 0.000 0.973 46 K CA -0.280 56.084 56.287 0.128 0.000 0.898 46 K CB 1.725 34.353 32.500 0.214 0.000 1.057 46 K HN 0.476 8.726 8.250 0.000 0.000 0.447 47 S N 0.964 116.725 115.700 0.102 0.000 2.626 47 S HA 0.051 4.520 4.470 -0.001 0.000 0.257 47 S C 1.343 176.009 174.600 0.111 0.000 1.288 47 S CA -0.543 57.708 58.200 0.085 0.000 0.980 47 S CB 0.378 63.615 63.200 0.060 0.000 0.975 47 S HN 0.547 8.857 8.310 0.000 0.000 0.577 48 L N 1.332 122.613 121.223 0.097 0.000 2.046 48 L HA -0.059 4.281 4.340 -0.001 0.000 0.208 48 L C 2.690 179.648 176.870 0.145 0.000 1.077 48 L CA 2.464 57.383 54.840 0.132 0.000 0.747 48 L CB -1.219 40.890 42.059 0.084 0.000 0.896 48 L HN 0.974 9.204 8.230 0.000 0.000 0.432 49 S N -1.468 114.280 115.700 0.079 0.000 2.368 49 S HA -0.162 4.307 4.470 -0.001 0.000 0.224 49 S C 1.670 176.262 174.600 -0.014 0.000 1.029 49 S CA 1.161 59.381 58.200 0.033 0.000 0.988 49 S CB -0.742 62.463 63.200 0.009 0.000 0.838 49 S HN 0.501 8.811 8.310 0.000 0.000 0.462 50 D N 1.835 122.236 120.400 0.001 0.000 2.149 50 D HA 0.103 4.742 4.640 -0.001 0.000 0.201 50 D C 1.946 178.203 176.300 -0.072 0.000 0.972 50 D CA 0.723 54.683 54.000 -0.068 0.000 0.835 50 D CB -0.462 40.356 40.800 0.029 0.000 0.966 50 D HN 0.366 8.736 8.370 0.000 0.000 0.476 51 L N 0.291 121.592 121.223 0.129 0.000 2.201 51 L HA -0.053 4.286 4.340 -0.001 0.000 0.212 51 L C 2.493 179.389 176.870 0.042 0.000 1.105 51 L CA 0.675 55.659 54.840 0.240 0.000 0.775 51 L CB -0.171 42.093 42.059 0.341 0.000 0.913 51 L HN -0.051 8.179 8.230 0.000 0.000 0.440 52 R N 0.165 120.642 120.500 -0.038 0.000 2.148 52 R HA -0.115 4.224 4.340 -0.001 0.000 0.227 52 R C 2.193 178.369 176.300 -0.206 0.000 1.103 52 R CA 1.211 57.177 56.100 -0.223 0.000 0.983 52 R CB -0.270 29.989 30.300 -0.068 0.000 0.874 52 R HN 0.370 8.640 8.270 0.000 0.000 0.451 53 G N -0.475 108.175 108.800 -0.249 0.000 2.394 53 G HA2 -0.238 3.721 3.960 -0.001 0.000 0.215 53 G HA3 -0.238 3.721 3.960 -0.001 0.000 0.215 53 G C 0.836 175.589 174.900 -0.245 0.000 1.165 53 G CA 0.441 45.361 45.100 -0.300 0.000 0.784 53 G HN 0.320 8.610 8.290 0.000 0.000 0.535 54 Y N 0.654 120.875 120.300 -0.132 0.000 2.293 54 Y HA -0.020 4.530 4.550 -0.001 0.000 0.291 54 Y C 2.921 178.760 175.900 -0.101 0.000 1.137 54 Y CA 0.565 58.553 58.100 -0.187 0.000 1.202 54 Y CB -0.598 37.562 38.460 -0.499 0.000 0.990 54 Y HN 0.051 8.331 8.280 0.000 0.000 0.537 55 V N -1.268 118.668 119.914 0.038 0.000 2.346 55 V HA -0.283 3.836 4.120 -0.001 0.000 0.244 55 V C 1.987 178.120 176.094 0.065 0.000 1.037 55 V CA 1.616 63.931 62.300 0.025 0.000 1.029 55 V CB -1.017 30.740 31.823 -0.110 0.000 0.663 55 V HN 0.350 8.540 8.190 0.000 0.000 0.454 56 Y N 1.212 121.463 120.300 -0.082 0.000 2.102 56 Y HA -0.295 4.254 4.550 -0.001 0.000 0.280 56 Y C 2.675 178.585 175.900 0.016 0.000 1.178 56 Y CA 2.139 60.214 58.100 -0.041 0.000 1.146 56 Y CB -0.046 38.379 38.460 -0.058 0.000 0.968 56 Y HN 0.221 8.501 8.280 0.000 0.000 0.504 57 Q N -1.085 118.792 119.800 0.128 0.000 2.354 57 Q HA 0.053 4.393 4.340 -0.001 0.000 0.203 57 Q C 2.424 178.459 176.000 0.059 0.000 0.933 57 Q CA 0.891 56.733 55.803 0.066 0.000 0.901 57 Q CB -0.337 28.464 28.738 0.105 0.000 1.007 57 Q HN 0.630 8.900 8.270 0.000 0.000 0.495 58 G N 0.691 109.543 108.800 0.086 0.000 2.448 58 G HA2 -0.137 3.822 3.960 -0.001 0.000 0.218 58 G HA3 -0.137 3.822 3.960 -0.001 0.000 0.218 58 G C 1.482 176.463 174.900 0.135 0.000 1.135 58 G CA 0.196 45.363 45.100 0.113 0.000 0.784 58 G HN 0.213 8.503 8.290 0.000 0.000 0.543 59 L N -0.430 120.869 121.223 0.126 0.000 2.131 59 L HA 0.104 4.443 4.340 -0.001 0.000 0.206 59 L C 2.891 179.824 176.870 0.105 0.000 1.087 59 L CA 0.752 55.688 54.840 0.160 0.000 0.767 59 L CB -0.148 42.019 42.059 0.180 0.000 0.917 59 L HN 0.115 8.345 8.230 0.000 0.000 0.441 60 K N -0.262 120.158 120.400 0.034 0.000 1.984 60 K HA -0.077 4.243 4.320 -0.001 0.000 0.209 60 K C 2.176 178.800 176.600 0.040 0.000 1.046 60 K CA 1.653 57.949 56.287 0.015 0.000 0.934 60 K CB -0.158 32.315 32.500 -0.045 0.000 0.717 60 K HN 0.113 8.363 8.250 0.000 0.000 0.438 61 S N -0.552 115.174 115.700 0.044 0.000 2.481 61 S HA -0.006 4.463 4.470 -0.001 0.000 0.231 61 S C 1.346 175.980 174.600 0.057 0.000 0.996 61 S CA 0.927 59.156 58.200 0.048 0.000 0.942 61 S CB 0.175 63.406 63.200 0.051 0.000 0.768 61 S HN 0.641 8.951 8.310 0.000 0.000 0.520 62 G N 1.763 110.610 108.800 0.078 0.000 2.179 62 G HA2 -0.221 3.738 3.960 -0.001 0.000 0.260 62 G HA3 -0.221 3.738 3.960 -0.001 0.000 0.260 62 G C -0.254 174.706 174.900 0.099 0.000 0.977 62 G CA -0.113 45.039 45.100 0.086 0.000 0.641 62 G HN 0.482 8.772 8.290 0.000 0.000 0.533 63 N N 0.187 118.946 118.700 0.099 0.000 2.816 63 N HA 0.496 5.235 4.740 -0.001 0.000 0.236 63 N C -0.844 174.739 175.510 0.122 0.000 1.076 63 N CA -0.013 53.096 53.050 0.099 0.000 0.902 63 N CB 1.889 40.420 38.487 0.074 0.000 1.149 63 N HN 0.384 8.764 8.380 0.000 0.000 0.506 64 V N 0.837 120.847 119.914 0.160 0.000 2.531 64 V HA 0.436 4.556 4.120 -0.001 0.000 0.301 64 V C -0.149 176.027 176.094 0.137 0.000 1.034 64 V CA -0.621 61.780 62.300 0.168 0.000 0.865 64 V CB 1.857 33.821 31.823 0.235 0.000 0.995 64 V HN 0.524 8.714 8.190 0.000 0.000 0.424 65 S N 4.887 120.665 115.700 0.132 0.000 2.548 65 S HA 0.232 4.702 4.470 -0.001 0.000 0.277 65 S C 0.905 175.486 174.600 -0.031 0.000 1.315 65 S CA -0.174 58.071 58.200 0.075 0.000 1.050 65 S CB 1.055 64.330 63.200 0.125 0.000 0.918 65 S HN 0.810 9.120 8.310 0.000 0.000 0.497 66 I N 6.061 126.554 120.570 -0.128 0.000 2.439 66 I HA -0.059 4.110 4.170 -0.001 0.000 0.251 66 I C 1.610 177.629 176.117 -0.164 0.000 1.139 66 I CA 1.101 62.248 61.300 -0.255 0.000 1.438 66 I CB -0.183 37.668 38.000 -0.249 0.000 1.085 66 I HN 0.738 8.948 8.210 0.000 0.000 0.427 67 I N 0.150 120.630 120.570 -0.151 0.000 2.208 67 I HA -0.324 3.846 4.170 -0.001 0.000 0.245 67 I C 2.429 178.453 176.117 -0.156 0.000 1.097 67 I CA 1.810 63.005 61.300 -0.176 0.000 1.363 67 I CB -2.092 35.748 38.000 -0.267 0.000 1.051 67 I HN 0.355 8.565 8.210 0.000 0.000 0.413 68 H N 0.159 119.197 119.070 -0.054 0.000 2.387 68 H HA -0.075 4.480 4.556 -0.001 0.000 0.299 68 H C 2.386 177.742 175.328 0.046 0.000 1.090 68 H CA 1.358 57.407 56.048 0.001 0.000 1.332 68 H CB -0.024 29.735 29.762 -0.005 0.000 1.386 68 H HN 0.070 8.350 8.280 0.000 0.000 0.516 69 V N 0.887 120.845 119.914 0.073 0.000 2.307 69 V HA -0.246 3.873 4.120 -0.001 0.000 0.245 69 V C 1.621 177.782 176.094 0.112 0.000 1.045 69 V CA 2.104 64.418 62.300 0.023 0.000 1.024 69 V CB -0.473 31.165 31.823 -0.309 0.000 0.651 69 V HN 0.537 8.727 8.190 0.000 0.000 0.449 70 N N 0.074 118.806 118.700 0.053 0.000 2.166 70 N HA -0.145 4.594 4.740 -0.001 0.000 0.186 70 N C 1.976 177.546 175.510 0.099 0.000 1.019 70 N CA 1.400 54.507 53.050 0.095 0.000 0.856 70 N CB -0.157 38.361 38.487 0.052 0.000 0.993 70 N HN 0.354 8.734 8.380 0.000 0.000 0.426 71 S N 0.212 115.966 115.700 0.090 0.000 2.368 71 S HA -0.138 4.331 4.470 -0.001 0.000 0.224 71 S C 1.703 176.410 174.600 0.178 0.000 1.029 71 S CA 0.658 58.917 58.200 0.100 0.000 0.988 71 S CB -0.380 62.871 63.200 0.085 0.000 0.838 71 S HN 0.420 8.730 8.310 0.000 0.000 0.462 72 Y N 2.204 122.565 120.300 0.103 0.000 2.224 72 Y HA -0.022 4.528 4.550 -0.001 0.000 0.289 72 Y C 1.823 177.790 175.900 0.111 0.000 1.146 72 Y CA 1.148 59.312 58.100 0.106 0.000 1.182 72 Y CB -0.387 38.136 38.460 0.104 0.000 0.983 72 Y HN 0.129 8.409 8.280 0.000 0.000 0.524 73 L N -1.208 120.083 121.223 0.113 0.000 2.141 73 L HA -0.222 4.117 4.340 -0.001 0.000 0.209 73 L C 2.204 179.116 176.870 0.070 0.000 1.094 73 L CA 1.504 56.391 54.840 0.078 0.000 0.763 73 L CB -0.692 41.499 42.059 0.220 0.000 0.908 73 L HN 0.306 8.536 8.230 0.000 0.000 0.437 74 Y N 0.590 120.828 120.300 -0.104 0.000 2.163 74 Y HA -0.130 4.419 4.550 -0.001 0.000 0.288 74 Y C 2.323 178.072 175.900 -0.252 0.000 1.136 74 Y CA 1.579 59.470 58.100 -0.348 0.000 1.147 74 Y CB -0.514 37.650 38.460 -0.493 0.000 0.987 74 Y HN 0.056 8.336 8.280 0.000 0.000 0.509 75 G N -0.828 107.898 108.800 -0.124 0.000 2.509 75 G HA2 -0.079 3.881 3.960 -0.001 0.000 0.218 75 G HA3 -0.079 3.881 3.960 -0.001 0.000 0.218 75 G C 1.422 176.183 174.900 -0.232 0.000 1.124 75 G CA 0.621 45.623 45.100 -0.164 0.000 0.776 75 G HN 0.548 8.838 8.290 0.000 0.000 0.547 76 A N -0.411 122.229 122.820 -0.301 0.000 2.348 76 A HA 0.581 4.900 4.320 -0.001 0.000 0.224 76 A C 1.330 178.815 177.584 -0.165 0.000 1.227 76 A CA -0.014 51.860 52.037 -0.272 0.000 0.885 76 A CB 0.213 18.927 19.000 -0.477 0.000 0.933 76 A HN 0.278 8.428 8.150 0.000 0.000 0.506 77 L N -1.130 119.998 121.223 -0.157 0.000 3.366 77 L HA 0.244 4.583 4.340 -0.001 0.000 0.304 77 L C 1.057 177.869 176.870 -0.096 0.000 1.292 77 L CA -0.059 54.710 54.840 -0.118 0.000 1.012 77 L CB 0.411 42.431 42.059 -0.065 0.000 1.414 77 L HN 0.128 8.358 8.230 0.000 0.000 0.603 78 K N 0.823 121.087 120.400 -0.227 0.000 2.555 78 K HA -0.048 4.271 4.320 -0.001 0.000 0.193 78 K C 0.281 176.770 176.600 -0.186 0.000 1.032 78 K CA 0.199 56.313 56.287 -0.288 0.000 1.004 78 K CB -0.103 32.185 32.500 -0.353 0.000 0.804 78 K HN 0.443 8.693 8.250 0.000 0.000 0.496 79 D N 1.144 121.443 120.400 -0.168 0.000 2.487 79 D HA -0.128 4.512 4.640 -0.001 0.000 0.243 79 D C 0.379 176.558 176.300 -0.201 0.000 1.154 79 D CA 0.311 54.226 54.000 -0.141 0.000 0.876 79 D CB 0.975 41.724 40.800 -0.086 0.000 1.161 79 D HN 0.071 8.441 8.370 0.000 0.000 0.478 80 I N 1.578 122.063 120.570 -0.141 0.000 3.812 80 I HA -0.006 4.163 4.170 -0.001 0.000 0.319 80 I C 0.515 176.553 176.117 -0.132 0.000 1.353 80 I CA -0.596 60.619 61.300 -0.142 0.000 1.170 80 I CB -0.246 37.706 38.000 -0.080 0.000 1.057 80 I HN 0.144 8.354 8.210 0.000 0.000 0.411 81 R N 1.439 121.852 120.500 -0.146 0.000 2.537 81 R HA 0.473 4.813 4.340 -0.001 0.000 0.280 81 R C 0.103 176.202 176.300 -0.335 0.000 1.058 81 R CA 0.457 56.473 56.100 -0.139 0.000 1.057 81 R CB 0.331 30.634 30.300 0.006 0.000 0.973 81 R HN 0.382 8.652 8.270 0.000 0.000 0.438 82 G N 2.245 110.804 108.800 -0.403 0.000 3.084 82 G HA2 -0.121 3.838 3.960 -0.001 0.000 0.543 82 G HA3 -0.121 3.838 3.960 -0.001 0.000 0.543 82 G C -1.085 173.536 174.900 -0.465 0.000 1.239 82 G CA -0.915 43.608 45.100 -0.962 0.000 1.190 82 G HN 0.480 8.770 8.290 0.000 0.000 0.549 83 K N 2.675 123.023 120.400 -0.086 0.000 2.213 83 K HA 0.638 4.958 4.320 -0.001 0.000 0.270 83 K C 0.396 177.196 176.600 0.332 0.000 1.002 83 K CA -0.840 55.525 56.287 0.130 0.000 0.868 83 K CB 0.759 33.306 32.500 0.079 0.000 1.093 83 K HN 0.434 8.684 8.250 0.000 0.000 0.454 84 L N 3.935 125.326 121.223 0.280 0.000 2.371 84 L HA 0.150 4.490 4.340 -0.001 0.000 0.272 84 L C 0.852 177.758 176.870 0.061 0.000 1.124 84 L CA 0.037 54.969 54.840 0.153 0.000 0.816 84 L CB 1.139 43.284 42.059 0.144 0.000 1.129 84 L HN 0.799 9.029 8.230 0.000 0.000 0.448 85 D N -0.364 120.030 120.400 -0.010 0.000 2.389 85 D HA 0.110 4.749 4.640 -0.001 0.000 0.206 85 D C 0.130 176.413 176.300 -0.030 0.000 1.055 85 D CA 0.106 54.097 54.000 -0.016 0.000 0.856 85 D CB 0.583 41.364 40.800 -0.031 0.000 0.957 85 D HN 0.256 8.626 8.370 0.000 0.000 0.509 86 K N -0.221 120.149 120.400 -0.050 0.000 2.466 86 K HA 0.285 4.604 4.320 -0.001 0.000 0.260 86 K C -1.392 175.205 176.600 -0.005 0.000 1.011 86 K CA -0.981 55.282 56.287 -0.040 0.000 0.871 86 K CB 1.650 34.105 32.500 -0.075 0.000 1.404 86 K HN -0.143 8.107 8.250 0.000 0.000 0.450 87 D N 0.744 121.153 120.400 0.016 0.000 2.424 87 D HA 0.030 4.669 4.640 -0.001 0.000 0.244 87 D C -0.963 175.414 176.300 0.130 0.000 1.134 87 D CA 0.366 54.405 54.000 0.064 0.000 0.881 87 D CB 0.378 41.203 40.800 0.042 0.000 1.191 87 D HN 0.196 8.566 8.370 0.000 0.000 0.445 88 W N 2.592 123.854 121.300 -0.064 0.000 2.362 88 W HA 0.420 5.079 4.660 -0.001 0.000 0.316 88 W C -1.126 175.352 176.519 -0.068 0.000 1.024 88 W CA -1.053 56.240 57.345 -0.086 0.000 1.270 88 W CB 0.393 29.793 29.460 -0.100 0.000 1.273 88 W HN 0.042 8.222 8.180 0.000 0.000 0.424 89 S N 3.315 119.095 115.700 0.133 0.000 2.572 89 S HA 0.509 4.979 4.470 -0.001 0.000 0.274 89 S C -1.119 173.427 174.600 -0.090 0.000 1.150 89 S CA -0.684 57.481 58.200 -0.058 0.000 0.944 89 S CB 2.007 65.190 63.200 -0.028 0.000 1.071 89 S HN 0.226 8.536 8.310 0.000 0.000 0.479 90 S N 1.847 117.450 115.700 -0.162 0.000 2.647 90 S HA 0.659 5.128 4.470 -0.001 0.000 0.300 90 S C -0.727 173.720 174.600 -0.256 0.000 1.129 90 S CA -0.496 57.580 58.200 -0.207 0.000 1.029 90 S CB -0.329 62.836 63.200 -0.058 0.000 1.007 90 S HN 0.722 9.032 8.310 0.000 0.000 0.484 91 F N 2.654 122.443 119.950 -0.268 0.000 3.039 91 F HA -0.170 4.357 4.527 -0.001 0.000 0.287 91 F C 1.429 177.045 175.800 -0.306 0.000 0.956 91 F CA 1.093 58.875 58.000 -0.363 0.000 0.971 91 F CB -1.679 36.876 39.000 -0.742 0.000 0.943 91 F HN 1.160 9.460 8.300 0.000 0.000 0.766 92 G N -0.217 108.538 108.800 -0.075 0.000 2.160 92 G HA2 -0.275 3.684 3.960 -0.001 0.000 0.251 92 G HA3 -0.275 3.684 3.960 -0.001 0.000 0.251 92 G C -0.016 174.855 174.900 -0.049 0.000 1.008 92 G CA 0.065 45.141 45.100 -0.041 0.000 0.724 92 G HN 0.508 8.798 8.290 0.000 0.000 0.514 93 I N 1.200 121.715 120.570 -0.091 0.000 2.388 93 I HA 0.226 4.395 4.170 -0.001 0.000 0.281 93 I C -0.211 175.865 176.117 -0.069 0.000 1.046 93 I CA -1.398 59.863 61.300 -0.064 0.000 1.187 93 I CB 0.384 38.344 38.000 -0.066 0.000 1.351 93 I HN 0.019 8.229 8.210 0.000 0.000 0.472 94 N N 6.320 124.994 118.700 -0.044 0.000 2.549 94 N HA 0.141 4.880 4.740 -0.001 0.000 0.267 94 N C 1.605 177.089 175.510 -0.043 0.000 1.182 94 N CA -0.169 52.859 53.050 -0.037 0.000 1.019 94 N CB 0.404 38.885 38.487 -0.011 0.000 1.380 94 N HN 0.627 9.007 8.380 0.000 0.000 0.505 95 I N -2.069 118.442 120.570 -0.098 0.000 2.617 95 I HA 0.280 4.449 4.170 -0.001 0.000 0.256 95 I C 0.928 177.028 176.117 -0.028 0.000 1.167 95 I CA 0.163 61.400 61.300 -0.105 0.000 1.469 95 I CB 0.145 37.995 38.000 -0.250 0.000 1.098 95 I HN 0.215 8.425 8.210 0.000 0.000 0.436 96 G N 0.632 109.447 108.800 0.025 0.000 2.690 96 G HA2 0.550 4.509 3.960 -0.001 0.000 0.293 96 G HA3 0.550 4.509 3.960 -0.001 0.000 0.293 96 G C -1.322 173.641 174.900 0.105 0.000 1.399 96 G CA -0.682 44.482 45.100 0.108 0.000 0.890 96 G HN -0.031 8.259 8.290 0.000 0.000 0.485 97 K N -0.452 120.003 120.400 0.093 0.000 2.208 97 K HA 0.644 4.964 4.320 -0.001 0.000 0.240 97 K C 1.204 177.847 176.600 0.071 0.000 1.088 97 K CA -0.420 55.910 56.287 0.070 0.000 0.902 97 K CB 1.945 34.473 32.500 0.047 0.000 1.355 97 K HN 0.419 8.669 8.250 0.000 0.000 0.526 98 A N 0.131 122.980 122.820 0.048 0.000 2.168 98 A HA 0.027 4.346 4.320 -0.001 0.000 0.215 98 A C 1.467 179.076 177.584 0.043 0.000 1.152 98 A CA 1.794 53.854 52.037 0.038 0.000 0.716 98 A CB -0.510 18.503 19.000 0.022 0.000 0.794 98 A HN 0.759 8.909 8.150 0.000 0.000 0.465 99 G N -0.824 108.005 108.800 0.048 0.000 2.724 99 G HA2 0.189 4.148 3.960 -0.001 0.000 0.205 99 G HA3 0.189 4.148 3.960 -0.001 0.000 0.205 99 G C -0.161 174.772 174.900 0.055 0.000 1.112 99 G CA 0.073 45.200 45.100 0.044 0.000 0.793 99 G HN 0.429 8.719 8.290 0.000 0.000 0.526 100 D N 1.449 121.890 120.400 0.068 0.000 2.455 100 D HA 0.353 4.992 4.640 -0.001 0.000 0.241 100 D C -0.090 176.261 176.300 0.085 0.000 1.138 100 D CA 0.703 54.746 54.000 0.072 0.000 0.877 100 D CB 1.056 41.905 40.800 0.082 0.000 1.187 100 D HN -0.086 8.284 8.370 0.000 0.000 0.451 101 T N 3.034 117.622 114.554 0.056 0.000 2.875 101 T HA 0.359 4.708 4.350 -0.001 0.000 0.307 101 T C 0.021 174.738 174.700 0.028 0.000 1.013 101 T CA -0.415 61.706 62.100 0.034 0.000 0.970 101 T CB -0.001 68.873 68.868 0.010 0.000 0.986 101 T HN 0.175 8.415 8.240 0.000 0.000 0.536 102 I N 2.375 122.983 120.570 0.062 0.000 2.863 102 I HA 0.787 4.957 4.170 -0.001 0.000 0.311 102 I C 0.605 176.751 176.117 0.050 0.000 1.026 102 I CA -0.186 61.169 61.300 0.092 0.000 1.077 102 I CB 1.688 39.813 38.000 0.209 0.000 1.262 102 I HN 0.628 8.838 8.210 0.000 0.000 0.461 103 G N 4.289 113.052 108.800 -0.063 0.000 3.211 103 G HA2 0.583 4.542 3.960 -0.001 0.000 0.262 103 G HA3 0.583 4.542 3.960 -0.001 0.000 0.262 103 G C -0.530 173.934 174.900 -0.728 0.000 1.352 103 G CA -0.848 43.989 45.100 -0.438 0.000 1.004 103 G HN 0.615 8.905 8.290 0.000 0.000 0.559 104 I N -1.156 118.685 120.570 -1.215 0.000 3.211 104 I HA 0.310 4.479 4.170 -0.001 0.000 0.297 104 I C 0.573 176.388 176.117 -0.504 0.000 1.095 104 I CA -0.025 60.647 61.300 -1.046 0.000 1.239 104 I CB 0.036 37.200 38.000 -1.393 0.000 1.455 104 I HN 0.543 8.753 8.210 0.000 0.000 0.630 105 F N -0.805 119.047 119.950 -0.163 0.000 2.825 105 F HA -0.252 4.274 4.527 -0.001 0.000 0.358 105 F C 0.683 176.466 175.800 -0.029 0.000 0.639 105 F CA 0.594 58.574 58.000 -0.033 0.000 1.153 105 F CB -2.115 36.931 39.000 0.076 0.000 1.610 105 F HN 0.520 8.820 8.300 0.000 0.000 0.305 106 D N 1.361 121.787 120.400 0.042 0.000 2.934 106 D HA 0.338 4.977 4.640 -0.001 0.000 0.237 106 D C 1.072 177.375 176.300 0.005 0.000 1.158 106 D CA 0.260 54.278 54.000 0.029 0.000 0.971 106 D CB 0.128 40.935 40.800 0.012 0.000 1.123 106 D HN 0.208 8.578 8.370 0.000 0.000 0.467 107 L N -0.663 120.577 121.223 0.028 0.000 3.260 107 L HA 0.312 4.651 4.340 -0.001 0.000 0.171 107 L C 0.235 177.103 176.870 -0.003 0.000 1.315 107 L CA 0.205 55.050 54.840 0.009 0.000 0.886 107 L CB 0.206 42.275 42.059 0.016 0.000 1.431 107 L HN -0.194 8.036 8.230 0.000 0.000 0.583 108 V N -0.474 119.435 119.914 -0.009 0.000 2.697 108 V HA 0.450 4.569 4.120 -0.001 0.000 0.300 108 V C -1.198 174.862 176.094 -0.057 0.000 1.115 108 V CA -0.478 61.801 62.300 -0.034 0.000 0.912 108 V CB 1.867 33.655 31.823 -0.058 0.000 1.024 108 V HN 0.227 8.417 8.190 0.000 0.000 0.431 109 S N 6.054 121.723 115.700 -0.051 0.000 2.449 109 S HA 0.881 5.350 4.470 -0.001 0.000 0.310 109 S C -0.808 173.717 174.600 -0.126 0.000 1.096 109 S CA -0.310 57.831 58.200 -0.098 0.000 1.095 109 S CB 0.597 63.762 63.200 -0.058 0.000 1.007 109 S HN 0.551 8.861 8.310 0.000 0.000 0.474 110 L N 2.980 124.097 121.223 -0.177 0.000 2.250 110 L HA 0.674 5.013 4.340 -0.001 0.000 0.252 110 L C -0.483 176.356 176.870 -0.052 0.000 1.054 110 L CA -1.103 53.683 54.840 -0.089 0.000 0.856 110 L CB 1.842 43.878 42.059 -0.038 0.000 1.443 110 L HN 0.439 8.669 8.230 0.000 0.000 0.427 111 K N 0.245 120.672 120.400 0.045 0.000 2.259 111 K HA 0.754 5.073 4.320 -0.001 0.000 0.252 111 K C -0.972 175.676 176.600 0.081 0.000 0.936 111 K CA -0.477 55.819 56.287 0.015 0.000 0.810 111 K CB 1.990 34.471 32.500 -0.031 0.000 1.143 111 K HN 0.644 8.894 8.250 0.000 0.000 0.427 112 A N 3.699 126.539 122.820 0.033 0.000 2.316 112 A HA 0.365 4.684 4.320 -0.001 0.000 0.284 112 A C -0.499 177.052 177.584 -0.054 0.000 1.115 112 A CA -0.699 51.329 52.037 -0.015 0.000 0.812 112 A CB 0.343 19.337 19.000 -0.010 0.000 1.064 112 A HN 0.614 8.764 8.150 0.000 0.000 0.489 113 L N 2.139 123.314 121.223 -0.081 0.000 2.499 113 L HA 0.046 4.386 4.340 -0.001 0.000 0.273 113 L C 0.084 176.915 176.870 -0.066 0.000 1.195 113 L CA 0.584 55.382 54.840 -0.071 0.000 0.882 113 L CB -0.342 41.669 42.059 -0.080 0.000 1.133 113 L HN 0.714 8.944 8.230 0.000 0.000 0.483 114 D N 1.881 122.249 120.400 -0.054 0.000 2.414 114 D HA 0.463 5.102 4.640 -0.001 0.000 0.242 114 D C 0.798 177.066 176.300 -0.052 0.000 1.129 114 D CA 1.016 54.985 54.000 -0.052 0.000 0.885 114 D CB 1.044 41.821 40.800 -0.038 0.000 1.198 114 D HN 0.763 9.133 8.370 0.000 0.000 0.437 115 G N 0.782 109.547 108.800 -0.058 0.000 3.584 115 G HA2 -0.097 3.862 3.960 -0.001 0.000 0.223 115 G HA3 -0.097 3.862 3.960 -0.001 0.000 0.223 115 G C -0.306 174.555 174.900 -0.065 0.000 0.932 115 G CA -0.584 44.485 45.100 -0.053 0.000 1.111 115 G HN 0.544 8.834 8.290 0.000 0.000 0.689 116 V N 3.040 122.900 119.914 -0.090 0.000 2.409 116 V HA 0.361 4.481 4.120 -0.001 0.000 0.270 116 V C 1.770 177.815 176.094 -0.081 0.000 1.019 116 V CA 0.586 62.812 62.300 -0.124 0.000 1.066 116 V CB 0.012 31.695 31.823 -0.233 0.000 1.021 116 V HN 0.623 8.813 8.190 0.000 0.000 0.476 117 L N 5.757 126.945 121.223 -0.059 0.000 2.179 117 L HA 0.313 4.652 4.340 -0.001 0.000 0.208 117 L C -0.167 176.693 176.870 -0.017 0.000 1.096 117 L CA 0.798 55.619 54.840 -0.031 0.000 0.779 117 L CB -2.489 39.556 42.059 -0.022 0.000 0.922 117 L HN 0.475 8.705 8.230 0.000 0.000 0.443 118 P HA -0.081 4.339 4.420 0.000 0.000 0.202 118 P C -0.010 177.280 177.300 -0.016 0.000 1.189 118 P CA 1.271 64.374 63.100 0.006 0.000 0.921 118 P CB -0.231 31.491 31.700 0.037 0.000 0.756 119 D N -1.987 118.364 120.400 -0.081 0.000 2.860 119 D HA -0.123 4.517 4.640 -0.001 0.000 0.229 119 D C 0.622 176.913 176.300 -0.014 0.000 1.169 119 D CA 1.503 55.332 54.000 -0.284 0.000 0.737 119 D CB -1.637 39.106 40.800 -0.096 0.000 1.080 119 D HN 0.400 8.770 8.370 0.000 0.000 0.424 120 G N -1.398 107.424 108.800 0.036 0.000 2.552 120 G HA2 0.579 4.538 3.960 -0.001 0.000 0.324 120 G HA3 0.579 4.538 3.960 -0.001 0.000 0.324 120 G C -0.021 174.995 174.900 0.194 0.000 1.217 120 G CA -0.163 45.016 45.100 0.132 0.000 0.989 120 G HN 0.689 8.979 8.290 0.000 0.000 0.490 121 V N -0.725 119.270 119.914 0.136 0.000 5.842 121 V HA -0.160 3.959 4.120 -0.001 0.000 0.251 121 V C 0.566 176.716 176.094 0.094 0.000 0.667 121 V CA 0.991 63.353 62.300 0.103 0.000 0.844 121 V CB -2.078 29.799 31.823 0.090 0.000 0.924 121 V HN 0.995 9.185 8.190 0.000 0.000 0.443 122 S N 1.337 117.048 115.700 0.017 0.000 2.578 122 S HA 0.778 5.247 4.470 -0.001 0.000 0.301 122 S C -0.788 173.748 174.600 -0.106 0.000 1.091 122 S CA -0.347 57.760 58.200 -0.155 0.000 1.032 122 S CB 2.215 65.235 63.200 -0.300 0.000 1.064 122 S HN 0.889 9.199 8.310 0.000 0.000 0.508 123 D N 1.324 121.634 120.400 -0.149 0.000 2.970 123 D HA 0.547 5.186 4.640 -0.001 0.000 0.230 123 D C -0.477 175.725 176.300 -0.164 0.000 1.276 123 D CA -0.434 53.502 54.000 -0.105 0.000 0.910 123 D CB 1.748 42.531 40.800 -0.028 0.000 1.590 123 D HN 0.496 8.866 8.370 0.000 0.000 0.551 124 A N 2.572 125.313 122.820 -0.132 0.000 2.577 124 A HA 0.289 4.609 4.320 -0.001 0.000 0.280 124 A C 1.386 178.895 177.584 -0.126 0.000 1.331 124 A CA -0.059 51.901 52.037 -0.128 0.000 0.935 124 A CB -0.053 18.892 19.000 -0.091 0.000 1.082 124 A HN 0.406 8.556 8.150 0.000 0.000 0.525 125 S N 0.182 115.781 115.700 -0.168 0.000 2.335 125 S HA 0.038 4.507 4.470 -0.001 0.000 0.217 125 S C 1.144 175.636 174.600 -0.181 0.000 1.032 125 S CA 0.504 58.606 58.200 -0.163 0.000 0.985 125 S CB -0.103 62.990 63.200 -0.178 0.000 0.896 125 S HN 0.559 8.869 8.310 0.000 0.000 0.445 126 R N 1.935 122.258 120.500 -0.295 0.000 2.491 126 R HA 0.222 4.561 4.340 -0.001 0.000 0.283 126 R C 0.971 177.207 176.300 -0.106 0.000 1.072 126 R CA 0.607 56.581 56.100 -0.211 0.000 1.048 126 R CB 0.606 30.716 30.300 -0.316 0.000 0.983 126 R HN 0.569 8.839 8.270 0.000 0.000 0.450 127 T N -3.046 111.488 114.554 -0.034 0.000 3.168 127 T HA 0.052 4.401 4.350 -0.001 0.000 0.261 127 T C 1.105 175.830 174.700 0.041 0.000 0.931 127 T CA -0.165 61.935 62.100 -0.001 0.000 0.949 127 T CB 0.200 69.065 68.868 -0.005 0.000 1.229 127 T HN 0.311 8.552 8.240 0.000 0.000 0.504 128 S N 1.477 117.211 115.700 0.057 0.000 2.577 128 S HA 0.564 5.033 4.470 -0.001 0.000 0.219 128 S C 1.358 176.042 174.600 0.140 0.000 0.962 128 S CA 0.144 58.395 58.200 0.084 0.000 0.921 128 S CB 0.102 63.343 63.200 0.068 0.000 0.789 128 S HN 0.713 9.023 8.310 0.000 0.000 0.497 129 A N 1.244 124.165 122.820 0.167 0.000 2.797 129 A HA 0.243 4.562 4.320 -0.001 0.000 0.287 129 A C 0.816 178.513 177.584 0.188 0.000 1.369 129 A CA -0.354 51.841 52.037 0.263 0.000 0.968 129 A CB -0.066 19.161 19.000 0.378 0.000 1.069 129 A HN 0.189 8.339 8.150 0.000 0.000 0.571 130 D N 0.553 121.061 120.400 0.180 0.000 1.966 130 D HA -0.051 4.588 4.640 -0.001 0.000 0.292 130 D C -0.293 176.120 176.300 0.187 0.000 1.078 130 D CA 0.681 54.796 54.000 0.192 0.000 0.850 130 D CB -0.229 40.651 40.800 0.134 0.000 1.006 130 D HN 0.237 8.607 8.370 0.000 0.000 0.362 131 D N 0.880 121.376 120.400 0.162 0.000 2.745 131 D HA 0.075 4.714 4.640 -0.001 0.000 0.229 131 D C 0.731 177.158 176.300 0.212 0.000 1.088 131 D CA 0.409 54.534 54.000 0.210 0.000 1.054 131 D CB 0.224 41.139 40.800 0.191 0.000 1.132 131 D HN 0.167 8.537 8.370 0.000 0.000 0.464 132 K N -0.104 120.421 120.400 0.208 0.000 2.644 132 K HA 0.161 4.480 4.320 -0.001 0.000 0.231 132 K C 1.231 177.980 176.600 0.249 0.000 1.493 132 K CA -0.272 56.151 56.287 0.226 0.000 0.836 132 K CB 0.670 33.353 32.500 0.305 0.000 1.853 132 K HN 0.251 8.501 8.250 0.000 0.000 0.390 133 W N 0.974 122.328 121.300 0.090 0.000 2.835 133 W HA 0.228 4.888 4.660 -0.001 0.000 0.278 133 W C 1.142 177.759 176.519 0.163 0.000 1.075 133 W CA -0.112 57.282 57.345 0.082 0.000 1.439 133 W CB -0.503 28.988 29.460 0.051 0.000 0.927 133 W HN 0.014 8.194 8.180 0.000 0.000 0.604 134 L N 3.183 124.046 121.223 -0.600 0.000 2.023 134 L HA 0.092 4.431 4.340 -0.001 0.000 0.205 134 L C -0.596 176.308 176.870 0.057 0.000 1.073 134 L CA 2.208 56.733 54.840 -0.524 0.000 0.745 134 L CB -1.681 40.061 42.059 -0.529 0.000 0.900 134 L HN -0.315 7.915 8.230 0.000 0.000 0.435 135 P HA -0.127 4.293 4.420 0.000 0.000 0.219 135 P C 2.067 179.575 177.300 0.347 0.000 1.150 135 P CA 1.209 64.538 63.100 0.382 0.000 0.814 135 P CB -0.017 31.919 31.700 0.394 0.000 0.787 136 L N -2.236 119.118 121.223 0.218 0.000 2.217 136 L HA -0.124 4.216 4.340 -0.001 0.000 0.211 136 L C 2.348 179.360 176.870 0.237 0.000 1.107 136 L CA 1.236 56.151 54.840 0.126 0.000 0.783 136 L CB -0.489 41.487 42.059 -0.138 0.000 0.919 136 L HN -0.099 8.131 8.230 0.000 0.000 0.442 137 Y N -0.362 120.018 120.300 0.132 0.000 2.395 137 Y HA -0.099 4.450 4.550 -0.001 0.000 0.293 137 Y C 2.011 178.029 175.900 0.197 0.000 1.123 137 Y CA 1.149 59.333 58.100 0.140 0.000 1.227 137 Y CB 0.002 38.531 38.460 0.115 0.000 1.012 137 Y HN 0.089 8.369 8.280 0.000 0.000 0.552 138 L N -0.790 120.591 121.223 0.264 0.000 2.093 138 L HA -0.218 4.121 4.340 -0.001 0.000 0.208 138 L C 2.156 179.308 176.870 0.471 0.000 1.085 138 L CA 1.155 56.237 54.840 0.402 0.000 0.755 138 L CB -0.608 41.688 42.059 0.396 0.000 0.904 138 L HN 0.214 8.444 8.230 0.000 0.000 0.435 139 L N -0.528 120.908 121.223 0.356 0.000 2.156 139 L HA -0.036 4.303 4.340 -0.001 0.000 0.208 139 L C 2.623 179.647 176.870 0.257 0.000 1.095 139 L CA 1.063 56.092 54.840 0.316 0.000 0.770 139 L CB -0.937 41.273 42.059 0.252 0.000 0.914 139 L HN 0.264 8.494 8.230 0.000 0.000 0.439 140 G N -0.066 108.812 108.800 0.131 0.000 2.448 140 G HA2 -0.135 3.825 3.960 -0.001 0.000 0.218 140 G HA3 -0.135 3.825 3.960 -0.001 0.000 0.218 140 G C 1.565 176.398 174.900 -0.111 0.000 1.135 140 G CA 0.221 45.341 45.100 0.034 0.000 0.784 140 G HN 0.248 8.538 8.290 0.000 0.000 0.543 141 L N -0.652 120.407 121.223 -0.273 0.000 2.478 141 L HA 0.082 4.421 4.340 -0.001 0.000 0.223 141 L C 2.339 179.138 176.870 -0.118 0.000 1.140 141 L CA 0.184 54.691 54.840 -0.556 0.000 0.842 141 L CB -0.248 41.154 42.059 -1.095 0.000 0.953 141 L HN 0.292 8.522 8.230 0.000 0.000 0.452 142 Y N 0.880 121.239 120.300 0.098 0.000 2.293 142 Y HA -0.241 4.308 4.550 -0.001 0.000 0.291 142 Y C 2.759 178.728 175.900 0.116 0.000 1.137 142 Y CA 1.504 59.745 58.100 0.234 0.000 1.202 142 Y CB -0.086 38.543 38.460 0.281 0.000 0.990 142 Y HN 0.026 8.306 8.280 0.000 0.000 0.537 143 R N -0.585 119.959 120.500 0.074 0.000 2.073 143 R HA -0.080 4.259 4.340 -0.001 0.000 0.229 143 R C 1.922 178.163 176.300 -0.098 0.000 1.120 143 R CA 1.635 57.720 56.100 -0.024 0.000 0.967 143 R CB -0.359 29.971 30.300 0.050 0.000 0.862 143 R HN 0.294 8.564 8.270 0.000 0.000 0.436 144 V N 0.202 120.048 119.914 -0.113 0.000 2.427 144 V HA -0.085 4.035 4.120 -0.001 0.000 0.248 144 V C 2.346 178.411 176.094 -0.049 0.000 1.051 144 V CA 1.903 64.124 62.300 -0.132 0.000 1.048 144 V CB -0.789 30.935 31.823 -0.165 0.000 0.666 144 V HN 0.619 8.809 8.190 0.000 0.000 0.456 145 G N -0.472 108.414 108.800 0.143 0.000 2.421 145 G HA2 -0.161 3.798 3.960 -0.001 0.000 0.217 145 G HA3 -0.161 3.798 3.960 -0.001 0.000 0.217 145 G C 1.767 176.658 174.900 -0.016 0.000 1.143 145 G CA 0.171 45.391 45.100 0.200 0.000 0.784 145 G HN 0.256 8.546 8.290 0.000 0.000 0.541 146 R N 0.195 120.630 120.500 -0.109 0.000 2.066 146 R HA -0.028 4.311 4.340 -0.001 0.000 0.232 146 R C 1.357 177.585 176.300 -0.119 0.000 1.131 146 R CA 0.746 56.765 56.100 -0.134 0.000 0.955 146 R CB -1.196 28.980 30.300 -0.206 0.000 0.851 146 R HN 0.315 8.585 8.270 0.000 0.000 0.432 147 T N 1.437 115.891 114.554 -0.165 0.000 2.769 147 T HA 0.026 4.375 4.350 -0.001 0.000 0.293 147 T C 0.773 175.362 174.700 -0.185 0.000 0.931 147 T CA 0.112 62.111 62.100 -0.168 0.000 1.139 147 T CB 0.590 69.348 68.868 -0.184 0.000 0.881 147 T HN 0.202 8.442 8.240 0.000 0.000 0.532 148 Q N 3.984 123.740 119.800 -0.074 0.000 2.280 148 Q HA 0.226 4.565 4.340 -0.001 0.000 0.201 148 Q C 0.456 176.474 176.000 0.031 0.000 0.890 148 Q CA 0.011 55.819 55.803 0.009 0.000 0.947 148 Q CB 0.263 29.010 28.738 0.015 0.000 1.081 148 Q HN 0.705 8.975 8.270 0.000 0.000 0.502 149 M N 1.403 120.995 119.600 -0.013 0.000 2.226 149 M HA 0.130 4.609 4.480 -0.001 0.000 0.324 149 M C -1.975 174.355 176.300 0.050 0.000 1.112 149 M CA -1.669 53.636 55.300 0.008 0.000 1.176 149 M CB 0.098 32.688 32.600 -0.016 0.000 1.430 149 M HN -0.240 8.050 8.290 0.000 0.000 0.462 150 P HA 0.033 4.453 4.420 0.000 0.000 0.244 150 P C -0.663 176.678 177.300 0.068 0.000 1.723 150 P CA 0.744 63.895 63.100 0.085 0.000 1.110 150 P CB -0.242 31.488 31.700 0.051 0.000 1.972 151 E N -0.348 119.894 120.200 0.071 0.000 3.313 151 E HA 0.085 4.434 4.350 -0.001 0.000 0.164 151 E C 0.109 176.711 176.600 0.004 0.000 0.947 151 E CA -0.094 56.318 56.400 0.020 0.000 1.390 151 E CB 0.124 29.808 29.700 -0.027 0.000 1.058 151 E HN 0.147 8.507 8.360 0.000 0.000 0.436 152 Y N -0.046 120.263 120.300 0.016 0.000 2.263 152 Y HA -0.120 4.429 4.550 -0.001 0.000 0.292 152 Y C 2.458 178.374 175.900 0.026 0.000 1.130 152 Y CA 1.525 59.646 58.100 0.035 0.000 1.179 152 Y CB 0.214 38.699 38.460 0.042 0.000 0.998 152 Y HN 0.083 8.363 8.280 0.000 0.000 0.532 153 R N 0.981 121.574 120.500 0.156 0.000 2.090 153 R HA -0.093 4.246 4.340 -0.001 0.000 0.228 153 R C 2.032 178.352 176.300 0.033 0.000 1.110 153 R CA 1.631 57.774 56.100 0.072 0.000 0.973 153 R CB -0.348 29.974 30.300 0.036 0.000 0.869 153 R HN 0.152 8.422 8.270 0.000 0.000 0.440 154 K N -0.049 120.366 120.400 0.024 0.000 2.148 154 K HA -0.045 4.274 4.320 -0.001 0.000 0.204 154 K C 1.254 177.852 176.600 -0.002 0.000 1.050 154 K CA 1.143 57.433 56.287 0.004 0.000 0.942 154 K CB 0.178 32.678 32.500 -0.000 0.000 0.724 154 K HN -0.015 8.235 8.250 0.000 0.000 0.446 155 K N 0.115 120.509 120.400 -0.010 0.000 2.418 155 K HA -0.019 4.300 4.320 -0.001 0.000 0.195 155 K C 1.203 177.804 176.600 0.001 0.000 1.035 155 K CA 0.427 56.700 56.287 -0.022 0.000 1.003 155 K CB 0.304 32.759 32.500 -0.076 0.000 0.793 155 K HN 0.124 8.374 8.250 0.000 0.000 0.494 156 L N 0.366 121.606 121.223 0.028 0.000 2.693 156 L HA 0.187 4.526 4.340 -0.001 0.000 0.235 156 L C 1.640 178.533 176.870 0.038 0.000 1.127 156 L CA 0.307 55.181 54.840 0.058 0.000 0.914 156 L CB 0.115 42.228 42.059 0.089 0.000 1.193 156 L HN -0.023 8.207 8.230 0.000 0.000 0.502 157 M N -0.182 119.426 119.600 0.012 0.000 2.171 157 M HA -0.047 4.432 4.480 -0.001 0.000 0.260 157 M C 1.531 177.829 176.300 -0.003 0.000 1.087 157 M CA 1.503 56.800 55.300 -0.006 0.000 1.154 157 M CB -0.613 31.979 32.600 -0.015 0.000 1.331 157 M HN 0.368 8.658 8.290 0.000 0.000 0.431 158 D N -1.496 118.900 120.400 -0.007 0.000 2.349 158 D HA -0.007 4.632 4.640 -0.001 0.000 0.215 158 D C 1.216 177.512 176.300 -0.007 0.000 1.016 158 D CA 0.639 54.621 54.000 -0.029 0.000 0.870 158 D CB -0.555 40.217 40.800 -0.047 0.000 0.917 158 D HN 0.357 8.727 8.370 0.000 0.000 0.524 159 G N 0.380 109.208 108.800 0.047 0.000 3.678 159 G HA2 0.373 4.332 3.960 -0.001 0.000 0.287 159 G HA3 0.373 4.332 3.960 -0.001 0.000 0.287 159 G C 0.558 175.589 174.900 0.219 0.000 1.280 159 G CA -0.194 44.973 45.100 0.111 0.000 1.118 159 G HN 0.257 8.547 8.290 0.000 0.000 0.563 160 L N -2.179 119.132 121.223 0.145 0.000 2.726 160 L HA 0.190 4.530 4.340 -0.001 0.000 0.287 160 L C 2.194 179.105 176.870 0.069 0.000 1.047 160 L CA 1.066 55.992 54.840 0.143 0.000 1.304 160 L CB -0.156 41.969 42.059 0.110 0.000 2.440 160 L HN 0.025 8.255 8.230 0.000 0.000 0.569 161 T N 0.357 114.926 114.554 0.025 0.000 2.915 161 T HA -0.044 4.306 4.350 -0.001 0.000 0.269 161 T C 1.309 175.997 174.700 -0.020 0.000 1.071 161 T CA 1.576 63.672 62.100 -0.008 0.000 1.132 161 T CB -0.329 68.522 68.868 -0.029 0.000 0.878 161 T HN 0.247 8.487 8.240 0.000 0.000 0.479 162 N N 1.499 120.183 118.700 -0.027 0.000 2.459 162 N HA -0.017 4.722 4.740 -0.001 0.000 0.181 162 N C 1.756 177.282 175.510 0.027 0.000 1.046 162 N CA 0.631 53.654 53.050 -0.044 0.000 0.904 162 N CB -0.176 38.240 38.487 -0.118 0.000 0.964 162 N HN 0.522 8.902 8.380 0.000 0.000 0.444 163 Q N -0.960 118.884 119.800 0.073 0.000 2.402 163 Q HA 0.185 4.524 4.340 -0.001 0.000 0.206 163 Q C 1.318 177.355 176.000 0.063 0.000 0.919 163 Q CA 0.291 56.173 55.803 0.131 0.000 0.923 163 Q CB 0.241 29.137 28.738 0.263 0.000 1.048 163 Q HN 0.353 8.623 8.270 0.000 0.000 0.515 164 C N 1.040 120.339 119.300 -0.002 0.000 2.456 164 C HA -0.017 4.442 4.460 -0.001 0.000 0.279 164 C C 1.761 176.725 174.990 -0.043 0.000 1.427 164 C CA 0.428 59.410 59.018 -0.060 0.000 1.778 164 C CB -0.587 27.120 27.740 -0.056 0.000 1.842 164 C HN 0.416 8.646 8.230 0.000 0.000 0.531 165 K N 0.311 120.704 120.400 -0.011 0.000 2.504 165 K HA 0.014 4.333 4.320 -0.001 0.000 0.195 165 K C 1.773 178.377 176.600 0.007 0.000 1.036 165 K CA 0.722 57.007 56.287 -0.004 0.000 0.984 165 K CB -0.010 32.493 32.500 0.006 0.000 0.788 165 K HN 0.441 8.691 8.250 0.000 0.000 0.488 166 M N -0.399 119.210 119.600 0.015 0.000 2.351 166 M HA 0.118 4.598 4.480 -0.001 0.000 0.250 166 M C 2.169 178.476 176.300 0.012 0.000 1.145 166 M CA 1.513 56.837 55.300 0.040 0.000 1.192 166 M CB -0.379 32.287 32.600 0.109 0.000 1.267 166 M HN 0.120 8.410 8.290 0.000 0.000 0.467 167 I N -3.849 116.697 120.570 -0.039 0.000 3.685 167 I HA 0.305 4.474 4.170 -0.001 0.000 0.258 167 I C -0.063 175.967 176.117 -0.145 0.000 1.135 167 I CA -0.291 60.966 61.300 -0.072 0.000 1.436 167 I CB 0.254 38.233 38.000 -0.036 0.000 1.670 167 I HN 0.010 8.220 8.210 0.000 0.000 0.424 168 N N 1.666 120.197 118.700 -0.281 0.000 2.262 168 N HA 0.360 5.100 4.740 -0.001 0.000 0.295 168 N C -1.343 173.944 175.510 -0.373 0.000 1.161 168 N CA -0.503 52.364 53.050 -0.306 0.000 0.767 168 N CB 2.229 40.521 38.487 -0.325 0.000 1.499 168 N HN 0.232 8.612 8.380 0.000 0.000 0.476 169 E N 1.439 121.486 120.200 -0.255 0.000 1.936 169 E HA 0.211 4.560 4.350 -0.001 0.000 0.267 169 E C -0.583 175.879 176.600 -0.230 0.000 1.076 169 E CA -0.036 56.245 56.400 -0.198 0.000 0.870 169 E CB 0.618 30.262 29.700 -0.095 0.000 1.093 169 E HN 0.283 8.643 8.360 0.000 0.000 0.411 170 Q N 1.769 121.364 119.800 -0.343 0.000 2.456 170 Q HA 0.568 4.907 4.340 -0.001 0.000 0.284 170 Q C -1.166 174.719 176.000 -0.191 0.000 1.061 170 Q CA -1.035 54.533 55.803 -0.391 0.000 0.799 170 Q CB 2.047 30.468 28.738 -0.529 0.000 1.445 170 Q HN 0.423 8.693 8.270 0.000 0.000 0.411 171 F N -1.933 117.938 119.950 -0.132 0.000 2.578 171 F HA 0.573 5.099 4.527 -0.001 0.000 0.311 171 F C 0.188 175.964 175.800 -0.040 0.000 1.094 171 F CA -0.753 57.188 58.000 -0.099 0.000 0.923 171 F CB 1.452 40.407 39.000 -0.075 0.000 1.230 171 F HN 0.497 8.797 8.300 0.000 0.000 0.450 172 E N 0.732 121.012 120.200 0.134 0.000 2.192 172 E HA 0.205 4.554 4.350 -0.001 0.000 0.196 172 E C -2.056 174.643 176.600 0.164 0.000 0.922 172 E CA -0.402 56.044 56.400 0.077 0.000 0.924 172 E CB -0.456 29.261 29.700 0.028 0.000 0.911 172 E HN 0.423 8.783 8.360 0.000 0.000 0.478 173 P HA -0.006 4.414 4.420 0.000 0.000 0.269 173 P C -0.458 176.977 177.300 0.225 0.000 1.215 173 P CA 0.368 63.620 63.100 0.253 0.000 0.780 173 P CB 0.480 32.387 31.700 0.345 0.000 0.898 174 L N 1.289 122.607 121.223 0.159 0.000 2.472 174 L HA 0.067 4.406 4.340 -0.001 0.000 0.260 174 L C 1.862 178.787 176.870 0.092 0.000 1.209 174 L CA -0.494 54.415 54.840 0.115 0.000 0.817 174 L CB -0.108 41.989 42.059 0.063 0.000 1.106 174 L HN 0.189 8.419 8.230 0.000 0.000 0.479 175 V N 0.546 120.494 119.914 0.058 0.000 2.283 175 V HA -0.081 4.038 4.120 -0.001 0.000 0.243 175 V C -0.699 175.377 176.094 -0.031 0.000 1.039 175 V CA 1.590 63.898 62.300 0.014 0.000 1.016 175 V CB -1.598 30.228 31.823 0.004 0.000 0.650 175 V HN 0.824 9.014 8.190 0.000 0.000 0.449 176 P HA 0.026 4.446 4.420 0.000 0.000 0.212 176 P C 1.375 178.608 177.300 -0.112 0.000 1.163 176 P CA 0.951 64.003 63.100 -0.079 0.000 0.892 176 P CB 0.056 31.724 31.700 -0.054 0.000 0.766 177 E N -0.363 119.792 120.200 -0.075 0.000 2.435 177 E HA 0.077 4.426 4.350 -0.001 0.000 0.195 177 E C 1.428 177.971 176.600 -0.094 0.000 1.029 177 E CA 0.446 56.794 56.400 -0.087 0.000 0.865 177 E CB -0.560 29.110 29.700 -0.051 0.000 0.833 177 E HN 0.194 8.554 8.360 0.000 0.000 0.510 178 G N 0.739 109.510 108.800 -0.049 0.000 3.530 178 G HA2 -0.010 3.949 3.960 -0.001 0.000 0.269 178 G HA3 -0.010 3.949 3.960 -0.001 0.000 0.269 178 G C 0.753 175.644 174.900 -0.014 0.000 1.314 178 G CA -0.256 44.849 45.100 0.008 0.000 1.441 178 G HN 0.047 8.337 8.290 0.000 0.000 0.595 179 R N -0.869 119.460 120.500 -0.284 0.000 2.576 179 R HA 0.097 4.437 4.340 -0.001 0.000 0.237 179 R C 0.526 176.306 176.300 -0.867 0.000 0.917 179 R CA -0.028 55.731 56.100 -0.568 0.000 1.002 179 R CB 0.570 30.460 30.300 -0.683 0.000 1.428 179 R HN 0.118 8.388 8.270 0.000 0.000 0.603 180 D N 0.968 121.035 120.400 -0.556 0.000 2.350 180 D HA 0.011 4.651 4.640 -0.001 0.000 0.213 180 D C 1.759 177.821 176.300 -0.397 0.000 1.031 180 D CA 0.425 54.176 54.000 -0.414 0.000 0.861 180 D CB 0.258 40.916 40.800 -0.237 0.000 0.926 180 D HN 0.327 8.697 8.370 0.000 0.000 0.520 181 I N -1.349 118.949 120.570 -0.453 0.000 2.286 181 I HA -0.083 4.086 4.170 -0.001 0.000 0.245 181 I C 1.631 177.567 176.117 -0.302 0.000 1.104 181 I CA 0.854 62.014 61.300 -0.234 0.000 1.397 181 I CB -0.724 37.242 38.000 -0.056 0.000 1.072 181 I HN -0.150 8.060 8.210 0.000 0.000 0.417 182 F N 0.606 120.265 119.950 -0.484 0.000 2.732 182 F HA 0.364 4.890 4.527 -0.001 0.000 0.303 182 F C 0.973 176.502 175.800 -0.451 0.000 1.110 182 F CA -0.505 56.834 58.000 -1.101 0.000 1.355 182 F CB -1.143 36.965 39.000 -1.486 0.000 1.081 182 F HN -0.080 8.220 8.300 0.000 0.000 0.565 183 D N 0.709 120.938 120.400 -0.286 0.000 2.323 183 D HA -0.036 4.604 4.640 -0.001 0.000 0.209 183 D C 2.301 178.640 176.300 0.066 0.000 0.973 183 D CA 0.691 54.650 54.000 -0.068 0.000 0.874 183 D CB 0.025 40.756 40.800 -0.114 0.000 0.930 183 D HN 0.300 8.670 8.370 0.000 0.000 0.521 184 V N -0.017 119.963 119.914 0.111 0.000 2.719 184 V HA -0.131 3.989 4.120 -0.001 0.000 0.252 184 V C 1.794 178.096 176.094 0.347 0.000 1.065 184 V CA 0.680 63.106 62.300 0.210 0.000 1.086 184 V CB -0.483 31.467 31.823 0.211 0.000 0.700 184 V HN 0.211 8.401 8.190 0.000 0.000 0.467 185 W N 1.380 122.716 121.300 0.061 0.000 2.355 185 W HA -0.023 4.637 4.660 -0.000 0.000 0.309 185 W C 2.570 179.227 176.519 0.229 0.000 1.206 185 W CA 1.184 58.533 57.345 0.007 0.000 1.284 185 W CB -1.500 27.874 29.460 -0.143 0.000 1.145 185 W HN 0.305 8.485 8.180 0.000 0.000 0.502 186 G N -0.063 109.057 108.800 0.533 0.000 2.509 186 G HA2 -0.219 3.740 3.960 -0.001 0.000 0.218 186 G HA3 -0.219 3.740 3.960 -0.001 0.000 0.218 186 G C 1.389 176.494 174.900 0.340 0.000 1.124 186 G CA 0.805 46.201 45.100 0.492 0.000 0.776 186 G HN 0.206 8.496 8.290 0.000 0.000 0.547 187 N N 0.626 119.487 118.700 0.267 0.000 2.409 187 N HA -0.027 4.712 4.740 -0.001 0.000 0.179 187 N C 0.187 175.808 175.510 0.185 0.000 1.032 187 N CA 0.315 53.481 53.050 0.193 0.000 0.898 187 N CB 0.057 38.632 38.487 0.147 0.000 0.971 187 N HN 0.325 8.705 8.380 0.000 0.000 0.441 188 D N 0.076 120.605 120.400 0.216 0.000 2.371 188 D HA 0.063 4.702 4.640 -0.001 0.000 0.256 188 D C 1.097 177.516 176.300 0.198 0.000 1.193 188 D CA 0.073 54.181 54.000 0.180 0.000 0.881 188 D CB 0.957 41.847 40.800 0.150 0.000 1.143 188 D HN -0.152 8.218 8.370 0.000 0.000 0.473 189 S N 3.495 119.285 115.700 0.149 0.000 2.382 189 S HA -0.170 4.300 4.470 -0.001 0.000 0.228 189 S C 1.586 176.260 174.600 0.124 0.000 1.027 189 S CA 1.107 59.388 58.200 0.134 0.000 0.991 189 S CB -0.147 63.128 63.200 0.124 0.000 0.823 189 S HN 0.538 8.848 8.310 0.000 0.000 0.469 190 N N -0.035 118.746 118.700 0.134 0.000 2.171 190 N HA -0.065 4.674 4.740 -0.001 0.000 0.184 190 N C 1.541 177.120 175.510 0.115 0.000 1.021 190 N CA 1.305 54.424 53.050 0.116 0.000 0.854 190 N CB -0.704 37.851 38.487 0.114 0.000 0.994 190 N HN 0.615 8.995 8.380 0.000 0.000 0.426 191 Y N 2.442 122.757 120.300 0.024 0.000 2.181 191 Y HA -0.157 4.392 4.550 -0.001 0.000 0.288 191 Y C 2.115 178.005 175.900 -0.016 0.000 1.146 191 Y CA 1.635 59.740 58.100 0.008 0.000 1.164 191 Y CB -0.691 37.770 38.460 0.002 0.000 0.982 191 Y HN -0.022 8.258 8.280 0.000 0.000 0.515 192 T N 0.120 114.596 114.554 -0.131 0.000 2.867 192 T HA -0.131 4.219 4.350 -0.001 0.000 0.268 192 T C 1.691 176.179 174.700 -0.354 0.000 1.057 192 T CA 1.608 63.536 62.100 -0.286 0.000 1.136 192 T CB -0.156 68.718 68.868 0.009 0.000 0.874 192 T HN 0.296 8.536 8.240 0.000 0.000 0.466 193 K N 0.648 120.930 120.400 -0.196 0.000 2.148 193 K HA 0.091 4.411 4.320 -0.001 0.000 0.204 193 K C 2.078 178.562 176.600 -0.192 0.000 1.050 193 K CA 0.924 57.108 56.287 -0.172 0.000 0.942 193 K CB -0.253 32.273 32.500 0.042 0.000 0.724 193 K HN 0.359 8.609 8.250 0.000 0.000 0.446 194 I N 0.148 120.624 120.570 -0.157 0.000 2.233 194 I HA -0.235 3.935 4.170 -0.001 0.000 0.243 194 I C 2.099 178.042 176.117 -0.290 0.000 1.093 194 I CA 0.815 62.055 61.300 -0.099 0.000 1.380 194 I CB -0.268 37.760 38.000 0.047 0.000 1.067 194 I HN -0.107 8.103 8.210 0.000 0.000 0.413 195 V N 1.288 120.907 119.914 -0.492 0.000 2.332 195 V HA -0.324 3.795 4.120 -0.001 0.000 0.248 195 V C 2.720 178.499 176.094 -0.525 0.000 1.055 195 V CA 2.177 64.143 62.300 -0.556 0.000 1.038 195 V CB -1.033 30.217 31.823 -0.956 0.000 0.651 195 V HN 0.514 8.704 8.190 0.000 0.000 0.450 196 A N -0.380 122.019 122.820 -0.701 0.000 1.929 196 A HA 0.018 4.337 4.320 -0.001 0.000 0.216 196 A C 2.381 179.457 177.584 -0.846 0.000 1.176 196 A CA 1.755 53.168 52.037 -1.040 0.000 0.628 196 A CB -0.601 17.468 19.000 -1.553 0.000 0.816 196 A HN 0.555 8.705 8.150 0.000 0.000 0.444 197 A N -0.492 122.054 122.820 -0.457 0.000 1.898 197 A HA 0.068 4.388 4.320 -0.001 0.000 0.216 197 A C 2.203 179.677 177.584 -0.184 0.000 1.181 197 A CA 1.609 53.582 52.037 -0.107 0.000 0.620 197 A CB -0.813 18.147 19.000 -0.066 0.000 0.819 197 A HN 0.327 8.477 8.150 0.000 0.000 0.442 198 V N 0.442 120.218 119.914 -0.231 0.000 2.261 198 V HA -0.270 3.849 4.120 -0.001 0.000 0.246 198 V C 2.342 178.507 176.094 0.118 0.000 1.047 198 V CA 2.542 64.787 62.300 -0.091 0.000 1.015 198 V CB -0.828 30.988 31.823 -0.012 0.000 0.642 198 V HN 0.702 8.892 8.190 0.000 0.000 0.446 199 D N -0.895 119.516 120.400 0.018 0.000 2.178 199 D HA -0.214 4.426 4.640 -0.001 0.000 0.201 199 D C 2.147 178.539 176.300 0.154 0.000 0.980 199 D CA 1.393 55.461 54.000 0.114 0.000 0.842 199 D CB -0.092 40.733 40.800 0.042 0.000 0.948 199 D HN 0.364 8.734 8.370 0.000 0.000 0.472 200 M N -0.952 118.631 119.600 -0.028 0.000 2.132 200 M HA -0.098 4.381 4.480 -0.001 0.000 0.263 200 M C 1.747 178.204 176.300 0.262 0.000 1.065 200 M CA 1.131 56.531 55.300 0.167 0.000 1.122 200 M CB -0.185 32.484 32.600 0.115 0.000 1.365 200 M HN 0.124 8.414 8.290 0.000 0.000 0.411 201 F N 0.569 120.544 119.950 0.042 0.000 2.102 201 F HA -0.214 4.313 4.527 -0.001 0.000 0.298 201 F C 1.369 177.120 175.800 -0.081 0.000 1.105 201 F CA 1.777 59.758 58.000 -0.031 0.000 1.239 201 F CB -0.383 38.418 39.000 -0.332 0.000 0.991 201 F HN 0.093 8.393 8.300 0.000 0.000 0.474 202 F N -1.079 118.962 119.950 0.151 0.000 2.661 202 F HA -0.000 4.526 4.527 -0.001 0.000 0.298 202 F C 2.289 178.094 175.800 0.008 0.000 1.137 202 F CA 1.091 59.125 58.000 0.057 0.000 1.454 202 F CB -1.060 38.025 39.000 0.142 0.000 1.103 202 F HN 0.121 8.421 8.300 0.000 0.000 0.577 203 H N -0.778 118.343 119.070 0.085 0.000 2.470 203 H HA -0.102 4.453 4.556 -0.001 0.000 0.289 203 H C 2.165 177.377 175.328 -0.194 0.000 1.033 203 H CA 1.529 57.575 56.048 -0.002 0.000 1.331 203 H CB 0.138 29.935 29.762 0.059 0.000 1.414 203 H HN 0.148 8.428 8.280 0.000 0.000 0.545 204 M N -0.295 119.087 119.600 -0.363 0.000 2.081 204 M HA 0.046 4.526 4.480 -0.001 0.000 0.261 204 M C -0.042 175.767 176.300 -0.818 0.000 1.075 204 M CA 1.441 56.251 55.300 -0.817 0.000 1.133 204 M CB -0.139 31.652 32.600 -1.348 0.000 1.330 204 M HN 0.114 8.404 8.290 0.000 0.000 0.414 205 F N 1.534 121.173 119.950 -0.519 0.000 2.626 205 F HA 0.262 4.788 4.527 -0.001 0.000 0.353 205 F C 1.116 176.857 175.800 -0.099 0.000 1.230 205 F CA -0.246 57.543 58.000 -0.352 0.000 1.298 205 F CB -0.530 38.154 39.000 -0.527 0.000 1.670 205 F HN 0.172 8.472 8.300 0.000 0.000 0.633 206 K N 0.332 120.711 120.400 -0.035 0.000 2.057 206 K HA -0.110 4.210 4.320 -0.001 0.000 0.207 206 K C 1.693 178.332 176.600 0.065 0.000 1.049 206 K CA 0.972 57.253 56.287 -0.010 0.000 0.931 206 K CB 0.048 32.480 32.500 -0.114 0.000 0.714 206 K HN 0.196 8.446 8.250 0.000 0.000 0.440 207 K N 0.602 121.050 120.400 0.080 0.000 2.426 207 K HA 0.010 4.329 4.320 -0.001 0.000 0.193 207 K C 0.437 177.115 176.600 0.128 0.000 1.028 207 K CA 0.150 56.484 56.287 0.079 0.000 1.047 207 K CB -0.181 32.348 32.500 0.048 0.000 0.821 207 K HN 0.313 8.563 8.250 0.000 0.000 0.513 208 H N 2.235 121.379 119.070 0.124 0.000 3.001 208 H HA -0.062 4.494 4.556 -0.001 0.000 0.334 208 H C 0.849 176.247 175.328 0.116 0.000 1.034 208 H CA 0.806 56.943 56.048 0.148 0.000 1.420 208 H CB 0.933 30.845 29.762 0.250 0.000 1.405 208 H HN 0.267 8.547 8.280 0.000 0.000 0.593 209 E N 2.328 122.300 120.200 -0.381 0.000 2.409 209 E HA -0.076 4.274 4.350 -0.001 0.000 0.198 209 E C 0.881 177.429 176.600 -0.088 0.000 1.024 209 E CA 0.744 57.028 56.400 -0.194 0.000 0.861 209 E CB -0.054 29.536 29.700 -0.182 0.000 0.788 209 E HN 0.326 8.686 8.360 0.000 0.000 0.521 210 C N 0.905 120.210 119.300 0.008 0.000 2.614 210 C HA 0.492 4.951 4.460 -0.001 0.000 0.299 210 C C 2.016 176.835 174.990 -0.285 0.000 1.293 210 C CA 0.023 59.143 59.018 0.171 0.000 1.713 210 C CB -0.910 27.100 27.740 0.449 0.000 1.890 210 C HN 0.602 8.832 8.230 0.000 0.000 0.602 211 A N 0.127 122.772 122.820 -0.292 0.000 2.209 211 A HA -0.065 4.254 4.320 -0.001 0.000 0.212 211 A C 2.230 179.569 177.584 -0.407 0.000 1.158 211 A CA 1.419 53.124 52.037 -0.554 0.000 0.742 211 A CB -0.390 18.564 19.000 -0.076 0.000 0.790 211 A HN 0.477 8.627 8.150 0.000 0.000 0.472 212 S N -1.139 114.413 115.700 -0.247 0.000 2.469 212 S HA -0.114 4.355 4.470 -0.001 0.000 0.238 212 S C 1.405 175.870 174.600 -0.226 0.000 0.998 212 S CA 0.898 58.960 58.200 -0.231 0.000 0.957 212 S CB -0.694 62.474 63.200 -0.052 0.000 0.764 212 S HN 0.564 8.874 8.310 0.000 0.000 0.514 213 F N 1.708 121.477 119.950 -0.303 0.000 2.333 213 F HA 0.015 4.541 4.527 -0.001 0.000 0.300 213 F C 2.421 178.166 175.800 -0.093 0.000 1.083 213 F CA 0.912 58.824 58.000 -0.147 0.000 1.395 213 F CB -0.146 38.757 39.000 -0.161 0.000 1.056 213 F HN 0.133 8.433 8.300 0.000 0.000 0.529 214 R N -0.803 119.662 120.500 -0.057 0.000 2.193 214 R HA -0.156 4.183 4.340 -0.001 0.000 0.229 214 R C -0.143 176.160 176.300 0.005 0.000 1.110 214 R CA 0.483 56.569 56.100 -0.023 0.000 0.988 214 R CB -0.589 29.662 30.300 -0.081 0.000 0.871 214 R HN 0.170 8.440 8.270 0.000 0.000 0.458 215 Y N 0.728 121.076 120.300 0.080 0.000 2.677 215 Y HA 0.073 4.623 4.550 -0.001 0.000 0.335 215 Y C 1.647 177.603 175.900 0.094 0.000 1.162 215 Y CA 0.848 58.992 58.100 0.073 0.000 1.483 215 Y CB 0.097 38.583 38.460 0.042 0.000 1.209 215 Y HN 0.327 8.607 8.280 0.000 0.000 0.528 216 G N 1.951 110.909 108.800 0.262 0.000 2.241 216 G HA2 -0.326 3.633 3.960 -0.001 0.000 0.244 216 G HA3 -0.326 3.633 3.960 -0.001 0.000 0.244 216 G C 0.940 175.976 174.900 0.227 0.000 0.998 216 G CA 0.569 45.795 45.100 0.210 0.000 0.621 216 G HN 0.603 8.893 8.290 0.000 0.000 0.519 217 T N -0.143 114.530 114.554 0.198 0.000 2.990 217 T HA 0.339 4.689 4.350 -0.001 0.000 0.250 217 T C 2.113 176.915 174.700 0.170 0.000 1.041 217 T CA 0.699 62.891 62.100 0.153 0.000 1.010 217 T CB 0.410 69.356 68.868 0.130 0.000 1.003 217 T HN 0.377 8.617 8.240 0.000 0.000 0.499 218 I N 2.816 123.495 120.570 0.182 0.000 2.614 218 I HA -0.102 4.067 4.170 -0.001 0.000 0.258 218 I C 2.103 178.338 176.117 0.196 0.000 1.189 218 I CA 0.808 62.217 61.300 0.182 0.000 1.462 218 I CB 0.100 38.197 38.000 0.160 0.000 1.092 218 I HN 0.149 8.359 8.210 0.000 0.000 0.442 219 V N -1.616 118.428 119.914 0.217 0.000 3.510 219 V HA -0.050 4.069 4.120 -0.001 0.000 0.270 219 V C 2.146 178.402 176.094 0.270 0.000 1.201 219 V CA 1.275 63.703 62.300 0.214 0.000 1.166 219 V CB -1.145 30.786 31.823 0.179 0.000 0.825 219 V HN 0.540 8.730 8.190 0.000 0.000 0.484 220 S N -0.008 115.884 115.700 0.320 0.000 2.470 220 S HA 0.039 4.509 4.470 -0.001 0.000 0.225 220 S C 1.303 176.053 174.600 0.249 0.000 1.006 220 S CA 0.032 58.446 58.200 0.357 0.000 0.934 220 S CB -0.372 62.964 63.200 0.226 0.000 0.778 220 S HN 0.686 8.996 8.310 0.000 0.000 0.517 221 R N 0.382 120.961 120.500 0.131 0.000 2.347 221 R HA 0.262 4.601 4.340 -0.001 0.000 0.304 221 R C -0.668 175.544 176.300 -0.146 0.000 1.072 221 R CA -0.267 55.653 56.100 -0.300 0.000 0.980 221 R CB -0.388 29.764 30.300 -0.248 0.000 0.986 221 R HN 0.283 8.553 8.270 0.000 0.000 0.448 222 F N 1.819 121.650 119.950 -0.200 0.000 3.093 222 F HA -0.372 4.154 4.527 -0.001 0.000 0.283 222 F C 1.537 177.363 175.800 0.044 0.000 0.848 222 F CA 1.465 59.421 58.000 -0.074 0.000 1.059 222 F CB -1.384 37.579 39.000 -0.063 0.000 1.191 222 F HN 0.725 9.025 8.300 0.000 0.000 0.514 223 K N 0.791 121.304 120.400 0.188 0.000 2.113 223 K HA -0.211 4.108 4.320 -0.001 0.000 0.208 223 K C 1.405 178.167 176.600 0.271 0.000 1.047 223 K CA 2.121 58.539 56.287 0.218 0.000 0.928 223 K CB -0.102 32.534 32.500 0.227 0.000 0.716 223 K HN 0.437 8.687 8.250 0.000 0.000 0.446 224 D N -0.347 120.235 120.400 0.303 0.000 2.354 224 D HA 0.009 4.648 4.640 -0.001 0.000 0.209 224 D C 0.166 176.718 176.300 0.420 0.000 1.015 224 D CA 0.367 54.631 54.000 0.441 0.000 0.867 224 D CB 0.263 41.247 40.800 0.306 0.000 0.933 224 D HN 0.214 8.584 8.370 0.000 0.000 0.520 225 C N 1.882 121.384 119.300 0.336 0.000 2.874 225 C HA 0.450 4.909 4.460 -0.001 0.000 0.523 225 C C 1.979 177.144 174.990 0.292 0.000 1.234 225 C CA -0.767 58.448 59.018 0.329 0.000 1.485 225 C CB -1.299 26.618 27.740 0.295 0.000 1.916 225 C HN 0.245 8.475 8.230 0.000 0.000 0.630 226 A N 1.140 124.151 122.820 0.319 0.000 2.015 226 A HA 0.104 4.423 4.320 -0.001 0.000 0.219 226 A C 2.322 180.094 177.584 0.313 0.000 1.163 226 A CA 1.708 53.906 52.037 0.267 0.000 0.646 226 A CB -0.285 18.850 19.000 0.225 0.000 0.806 226 A HN 0.702 8.852 8.150 0.000 0.000 0.448 227 A N -0.330 122.714 122.820 0.373 0.000 1.969 227 A HA 0.066 4.385 4.320 -0.001 0.000 0.218 227 A C 2.069 179.948 177.584 0.492 0.000 1.169 227 A CA 1.247 53.566 52.037 0.470 0.000 0.635 227 A CB -0.438 18.823 19.000 0.436 0.000 0.810 227 A HN 0.467 8.617 8.150 0.000 0.000 0.445 228 L N -1.091 120.345 121.223 0.356 0.000 2.131 228 L HA -0.082 4.257 4.340 -0.001 0.000 0.206 228 L C 3.048 180.056 176.870 0.230 0.000 1.087 228 L CA 0.791 55.798 54.840 0.278 0.000 0.767 228 L CB -0.489 41.610 42.059 0.067 0.000 0.917 228 L HN 0.413 8.643 8.230 0.000 0.000 0.441 229 A N -0.418 122.509 122.820 0.178 0.000 1.858 229 A HA -0.256 4.063 4.320 -0.001 0.000 0.216 229 A C 2.437 180.149 177.584 0.213 0.000 1.190 229 A CA 2.436 54.552 52.037 0.132 0.000 0.617 229 A CB -1.039 18.026 19.000 0.108 0.000 0.827 229 A HN 0.355 8.505 8.150 0.000 0.000 0.443 230 T N -1.661 113.063 114.554 0.282 0.000 2.720 230 T HA -0.181 4.169 4.350 -0.001 0.000 0.268 230 T C 1.629 176.549 174.700 0.367 0.000 1.037 230 T CA 1.896 64.152 62.100 0.261 0.000 1.144 230 T CB -0.447 68.534 68.868 0.189 0.000 0.864 230 T HN 0.370 8.610 8.240 0.000 0.000 0.444 231 F N 1.764 121.945 119.950 0.385 0.000 2.134 231 F HA 0.165 4.691 4.527 -0.001 0.000 0.299 231 F C 2.406 178.343 175.800 0.228 0.000 1.097 231 F CA 1.166 59.443 58.000 0.461 0.000 1.264 231 F CB -1.153 38.139 39.000 0.487 0.000 1.001 231 F HN 0.243 8.543 8.300 0.000 0.000 0.479 232 G N -1.352 107.512 108.800 0.107 0.000 2.421 232 G HA2 -0.367 3.592 3.960 -0.001 0.000 0.216 232 G HA3 -0.367 3.592 3.960 -0.001 0.000 0.216 232 G C 1.564 176.455 174.900 -0.016 0.000 1.171 232 G CA 1.167 46.221 45.100 -0.077 0.000 0.775 232 G HN 0.529 8.819 8.290 0.000 0.000 0.543 233 H N -0.135 118.926 119.070 -0.015 0.000 2.421 233 H HA 0.056 4.611 4.556 -0.001 0.000 0.298 233 H C 2.225 177.516 175.328 -0.061 0.000 1.087 233 H CA 1.251 57.277 56.048 -0.037 0.000 1.330 233 H CB -0.120 29.627 29.762 -0.025 0.000 1.388 233 H HN 0.252 8.532 8.280 0.000 0.000 0.526 234 L N -0.514 120.645 121.223 -0.106 0.000 2.109 234 L HA -0.064 4.276 4.340 -0.001 0.000 0.207 234 L C 2.196 178.969 176.870 -0.162 0.000 1.086 234 L CA 1.277 56.014 54.840 -0.172 0.000 0.760 234 L CB -0.858 41.215 42.059 0.023 0.000 0.910 234 L HN 0.427 8.657 8.230 0.000 0.000 0.437 235 C N -0.293 118.935 119.300 -0.119 0.000 2.425 235 C HA -0.137 4.322 4.460 -0.001 0.000 0.277 235 C C 2.674 177.573 174.990 -0.152 0.000 1.280 235 C CA 0.836 59.774 59.018 -0.133 0.000 1.744 235 C CB -0.857 26.753 27.740 -0.216 0.000 1.989 235 C HN 0.483 8.713 8.230 0.000 0.000 0.491 236 K N 0.117 120.410 120.400 -0.178 0.000 2.103 236 K HA 0.013 4.332 4.320 -0.001 0.000 0.204 236 K C 1.926 178.399 176.600 -0.212 0.000 1.052 236 K CA 0.807 56.996 56.287 -0.165 0.000 0.945 236 K CB -0.177 32.248 32.500 -0.126 0.000 0.722 236 K HN 0.361 8.611 8.250 0.000 0.000 0.443 237 I N 1.787 122.161 120.570 -0.327 0.000 2.546 237 I HA -0.166 4.003 4.170 -0.001 0.000 0.255 237 I C 2.119 178.060 176.117 -0.294 0.000 1.163 237 I CA 1.622 62.713 61.300 -0.349 0.000 1.457 237 I CB -0.529 37.160 38.000 -0.518 0.000 1.092 237 I HN 0.293 8.503 8.210 0.000 0.000 0.434 238 T N -3.322 111.062 114.554 -0.284 0.000 3.023 238 T HA 0.207 4.556 4.350 -0.001 0.000 0.249 238 T C 1.552 176.144 174.700 -0.179 0.000 1.050 238 T CA 0.657 62.589 62.100 -0.281 0.000 1.088 238 T CB 0.334 68.998 68.868 -0.340 0.000 0.946 238 T HN 0.376 8.616 8.240 0.000 0.000 0.480 239 G N 1.810 110.527 108.800 -0.139 0.000 2.143 239 G HA2 -0.235 3.724 3.960 -0.001 0.000 0.248 239 G HA3 -0.235 3.724 3.960 -0.001 0.000 0.248 239 G C -0.041 174.827 174.900 -0.054 0.000 0.991 239 G CA 0.482 45.527 45.100 -0.091 0.000 0.689 239 G HN 0.601 8.891 8.290 0.000 0.000 0.522 240 M N 0.966 120.545 119.600 -0.035 0.000 2.528 240 M HA 0.548 5.027 4.480 -0.001 0.000 0.318 240 M C 1.172 177.488 176.300 0.027 0.000 1.195 240 M CA -0.276 55.040 55.300 0.027 0.000 1.000 240 M CB 1.643 34.301 32.600 0.096 0.000 1.615 240 M HN 0.443 8.733 8.290 0.000 0.000 0.469 241 S N -0.363 115.368 115.700 0.051 0.000 2.600 241 S HA 0.123 4.593 4.470 -0.001 0.000 0.265 241 S C 1.228 175.870 174.600 0.070 0.000 1.325 241 S CA -0.024 58.198 58.200 0.037 0.000 1.002 241 S CB 0.747 63.975 63.200 0.047 0.000 0.921 241 S HN 0.873 9.183 8.310 0.000 0.000 0.554 242 T N -0.199 114.372 114.554 0.028 0.000 2.665 242 T HA -0.204 4.145 4.350 -0.001 0.000 0.268 242 T C 1.311 176.170 174.700 0.264 0.000 1.035 242 T CA 1.790 63.953 62.100 0.105 0.000 1.151 242 T CB -1.010 67.894 68.868 0.061 0.000 0.862 242 T HN 0.718 8.958 8.240 0.000 0.000 0.438 243 E N 1.583 121.884 120.200 0.170 0.000 2.085 243 E HA -0.101 4.249 4.350 -0.001 0.000 0.194 243 E C 2.207 178.910 176.600 0.171 0.000 0.994 243 E CA 1.535 58.026 56.400 0.153 0.000 0.801 243 E CB -0.333 29.427 29.700 0.100 0.000 0.743 243 E HN 0.568 8.928 8.360 0.000 0.000 0.453 244 D N -0.409 120.100 120.400 0.181 0.000 2.194 244 D HA -0.050 4.589 4.640 -0.001 0.000 0.204 244 D C 1.897 178.387 176.300 0.316 0.000 0.964 244 D CA 0.539 54.669 54.000 0.216 0.000 0.846 244 D CB 0.076 40.996 40.800 0.200 0.000 0.962 244 D HN 0.036 8.406 8.370 0.000 0.000 0.490 245 V N 1.202 121.330 119.914 0.356 0.000 2.515 245 V HA -0.186 3.933 4.120 -0.001 0.000 0.250 245 V C 2.418 178.789 176.094 0.462 0.000 1.058 245 V CA 1.603 64.194 62.300 0.485 0.000 1.064 245 V CB -0.748 31.422 31.823 0.579 0.000 0.675 245 V HN 0.200 8.390 8.190 0.000 0.000 0.461 246 T N 0.398 115.164 114.554 0.354 0.000 2.759 246 T HA -0.202 4.147 4.350 -0.001 0.000 0.269 246 T C 1.959 176.720 174.700 0.100 0.000 1.042 246 T CA 2.108 64.320 62.100 0.186 0.000 1.140 246 T CB -0.488 68.458 68.868 0.129 0.000 0.864 246 T HN 0.759 8.999 8.240 0.000 0.000 0.455 247 T N -2.180 112.436 114.554 0.104 0.000 3.085 247 T HA -0.042 4.307 4.350 -0.001 0.000 0.263 247 T C 1.270 175.894 174.700 -0.127 0.000 1.127 247 T CA 0.201 62.289 62.100 -0.019 0.000 1.103 247 T CB -0.527 68.320 68.868 -0.035 0.000 0.921 247 T HN 0.528 8.768 8.240 0.000 0.000 0.510 248 W N 1.237 122.469 121.300 -0.114 0.000 3.353 248 W HA 0.506 5.165 4.660 -0.001 0.000 0.304 248 W C -0.000 176.433 176.519 -0.143 0.000 1.273 248 W CA -1.078 56.108 57.345 -0.264 0.000 1.773 248 W CB -0.042 28.880 29.460 -0.897 0.000 1.095 248 W HN 0.174 8.354 8.180 0.000 0.000 0.676 249 I N 1.918 122.463 120.570 -0.043 0.000 2.505 249 I HA -0.060 4.109 4.170 -0.001 0.000 0.287 249 I C 0.749 176.713 176.117 -0.255 0.000 1.104 249 I CA 0.584 61.659 61.300 -0.375 0.000 1.387 249 I CB 0.617 38.404 38.000 -0.354 0.000 1.404 249 I HN -0.087 8.123 8.210 0.000 0.000 0.528 250 L N 6.393 127.457 121.223 -0.265 0.000 2.959 250 L HA 0.312 4.651 4.340 -0.001 0.000 0.259 250 L C -0.107 176.696 176.870 -0.111 0.000 1.185 250 L CA 0.004 54.773 54.840 -0.118 0.000 0.998 250 L CB -0.268 41.797 42.059 0.010 0.000 1.337 250 L HN 0.583 8.813 8.230 0.000 0.000 0.555 251 N N 0.125 118.705 118.700 -0.200 0.000 2.296 251 N HA 0.206 4.946 4.740 -0.001 0.000 0.294 251 N C 0.429 175.863 175.510 -0.127 0.000 1.033 251 N CA -0.493 52.478 53.050 -0.132 0.000 0.839 251 N CB 2.503 40.914 38.487 -0.127 0.000 1.395 251 N HN -0.103 8.277 8.380 0.000 0.000 0.479 252 R N 1.503 121.957 120.500 -0.076 0.000 2.091 252 R HA -0.071 4.268 4.340 -0.001 0.000 0.238 252 R C 1.304 177.566 176.300 -0.063 0.000 1.136 252 R CA 1.714 57.775 56.100 -0.065 0.000 0.959 252 R CB -0.056 30.219 30.300 -0.041 0.000 0.856 252 R HN 0.542 8.812 8.270 0.000 0.000 0.437 253 E N -0.177 119.991 120.200 -0.054 0.000 2.110 253 E HA -0.114 4.235 4.350 -0.001 0.000 0.193 253 E C 1.943 178.523 176.600 -0.032 0.000 0.988 253 E CA 1.504 57.881 56.400 -0.037 0.000 0.804 253 E CB -0.117 29.565 29.700 -0.030 0.000 0.745 253 E HN 0.249 8.610 8.360 0.000 0.000 0.458 254 V N 1.198 121.075 119.914 -0.062 0.000 2.427 254 V HA -0.201 3.918 4.120 -0.001 0.000 0.248 254 V C 2.438 178.462 176.094 -0.117 0.000 1.051 254 V CA 1.613 63.877 62.300 -0.059 0.000 1.048 254 V CB -0.821 30.878 31.823 -0.206 0.000 0.666 254 V HN 0.218 8.408 8.190 0.000 0.000 0.456 255 A N 0.106 122.842 122.820 -0.139 0.000 1.902 255 A HA -0.234 4.085 4.320 -0.001 0.000 0.217 255 A C 1.995 179.517 177.584 -0.104 0.000 1.181 255 A CA 1.960 53.916 52.037 -0.135 0.000 0.623 255 A CB -0.622 18.309 19.000 -0.115 0.000 0.818 255 A HN 0.514 8.664 8.150 0.000 0.000 0.443 256 D N -0.186 120.170 120.400 -0.073 0.000 2.123 256 D HA -0.139 4.500 4.640 -0.001 0.000 0.196 256 D C 1.918 178.187 176.300 -0.053 0.000 0.992 256 D CA 1.544 55.514 54.000 -0.051 0.000 0.833 256 D CB -0.393 40.388 40.800 -0.032 0.000 0.954 256 D HN 0.660 9.030 8.370 0.000 0.000 0.455 257 E N -0.304 119.863 120.200 -0.055 0.000 2.077 257 E HA -0.165 4.184 4.350 -0.001 0.000 0.193 257 E C 1.919 178.432 176.600 -0.145 0.000 0.989 257 E CA 0.678 57.045 56.400 -0.056 0.000 0.800 257 E CB -0.073 29.636 29.700 0.014 0.000 0.746 257 E HN 0.082 8.442 8.360 0.000 0.000 0.452 258 M N 0.640 120.096 119.600 -0.240 0.000 2.108 258 M HA -0.141 4.338 4.480 -0.001 0.000 0.261 258 M C 2.074 178.265 176.300 -0.181 0.000 1.066 258 M CA 1.348 56.442 55.300 -0.345 0.000 1.107 258 M CB -0.246 32.116 32.600 -0.396 0.000 1.356 258 M HN -0.045 8.245 8.290 0.000 0.000 0.406 259 V N 0.222 120.069 119.914 -0.112 0.000 2.332 259 V HA -0.319 3.800 4.120 -0.001 0.000 0.248 259 V C 2.454 178.543 176.094 -0.008 0.000 1.055 259 V CA 2.313 64.581 62.300 -0.052 0.000 1.038 259 V CB -1.017 30.781 31.823 -0.042 0.000 0.651 259 V HN 0.673 8.863 8.190 0.000 0.000 0.450 260 Q N -0.619 119.180 119.800 -0.001 0.000 2.061 260 Q HA -0.252 4.087 4.340 -0.001 0.000 0.204 260 Q C 2.259 178.321 176.000 0.104 0.000 0.984 260 Q CA 2.180 58.022 55.803 0.066 0.000 0.846 260 Q CB -0.164 28.584 28.738 0.016 0.000 0.902 260 Q HN 0.573 8.843 8.270 0.000 0.000 0.421 261 M N -0.596 119.022 119.600 0.030 0.000 2.229 261 M HA -0.093 4.387 4.480 -0.001 0.000 0.264 261 M C 0.989 177.446 176.300 0.261 0.000 1.063 261 M CA 0.873 56.247 55.300 0.124 0.000 1.114 261 M CB 0.233 32.864 32.600 0.051 0.000 1.387 261 M HN 0.258 8.548 8.290 0.000 0.000 0.420 262 M N 0.432 120.109 119.600 0.129 0.000 2.637 262 M HA 0.232 4.711 4.480 -0.001 0.000 0.286 262 M C -0.403 175.958 176.300 0.101 0.000 1.246 262 M CA -0.302 55.073 55.300 0.125 0.000 0.978 262 M CB -0.997 31.635 32.600 0.054 0.000 1.417 262 M HN 0.107 8.397 8.290 0.000 0.000 0.487 263 L N 3.566 124.857 121.223 0.113 0.000 2.534 263 L HA 0.192 4.531 4.340 -0.001 0.000 0.271 263 L C -2.000 174.880 176.870 0.018 0.000 1.178 263 L CA -0.866 53.964 54.840 -0.017 0.000 0.907 263 L CB 0.113 42.009 42.059 -0.271 0.000 1.164 263 L HN 0.043 8.273 8.230 0.000 0.000 0.482 264 P HA 0.226 4.646 4.420 0.000 0.000 0.266 264 P C 0.313 177.640 177.300 0.045 0.000 1.195 264 P CA 0.657 63.774 63.100 0.029 0.000 0.768 264 P CB 0.583 32.288 31.700 0.009 0.000 0.838 265 G N 1.762 110.616 108.800 0.090 0.000 2.164 265 G HA2 -0.180 3.780 3.960 -0.001 0.000 0.212 265 G HA3 -0.180 3.780 3.960 -0.001 0.000 0.212 265 G C 0.485 175.563 174.900 0.297 0.000 1.031 265 G CA -0.369 44.817 45.100 0.143 0.000 0.730 265 G HN 0.488 8.778 8.290 0.000 0.000 0.501 266 Q N -0.208 119.770 119.800 0.296 0.000 2.217 266 Q HA 0.256 4.595 4.340 -0.001 0.000 0.217 266 Q C 1.009 177.235 176.000 0.377 0.000 0.844 266 Q CA 0.526 56.612 55.803 0.472 0.000 0.957 266 Q CB 0.257 29.270 28.738 0.459 0.000 1.127 266 Q HN 0.837 9.107 8.270 0.000 0.000 0.503 267 E N 0.416 120.689 120.200 0.121 0.000 2.791 267 E HA -0.236 4.114 4.350 -0.001 0.000 0.271 267 E C 0.968 177.600 176.600 0.054 0.000 1.044 267 E CA 0.606 56.987 56.400 -0.031 0.000 0.814 267 E CB -1.937 27.575 29.700 -0.313 0.000 1.400 267 E HN 0.556 8.916 8.360 0.000 0.000 0.423 268 I N -1.291 119.332 120.570 0.089 0.000 2.286 268 I HA -0.234 3.936 4.170 -0.001 0.000 0.248 268 I C 2.091 178.248 176.117 0.066 0.000 1.115 268 I CA 2.068 63.411 61.300 0.072 0.000 1.392 268 I CB -0.390 37.625 38.000 0.024 0.000 1.065 268 I HN 0.078 8.288 8.210 0.000 0.000 0.418 269 D N 2.715 123.141 120.400 0.044 0.000 2.271 269 D HA -0.097 4.542 4.640 -0.001 0.000 0.206 269 D C 0.865 177.183 176.300 0.029 0.000 0.967 269 D CA 0.177 54.194 54.000 0.028 0.000 0.867 269 D CB -0.157 40.655 40.800 0.021 0.000 0.960 269 D HN 0.617 8.987 8.370 0.000 0.000 0.509 270 K N 0.186 120.599 120.400 0.021 0.000 2.202 270 K HA 0.506 4.826 4.320 -0.001 0.000 0.264 270 K C 0.787 177.412 176.600 0.041 0.000 1.010 270 K CA -0.368 55.925 56.287 0.010 0.000 0.940 270 K CB 1.741 34.225 32.500 -0.025 0.000 0.983 270 K HN -0.113 8.137 8.250 0.000 0.000 0.475 271 A N 2.635 125.476 122.820 0.036 0.000 1.839 271 A HA -0.065 4.254 4.320 -0.001 0.000 0.213 271 A C 0.188 177.822 177.584 0.084 0.000 1.274 271 A CA 1.041 53.128 52.037 0.084 0.000 0.608 271 A CB -0.679 18.352 19.000 0.051 0.000 0.920 271 A HN 0.912 9.062 8.150 0.000 0.000 0.465 272 D N 1.032 121.451 120.400 0.031 0.000 2.398 272 D HA 0.352 4.991 4.640 -0.001 0.000 0.250 272 D C -0.330 176.102 176.300 0.219 0.000 1.287 272 D CA 0.575 54.616 54.000 0.069 0.000 0.992 272 D CB 0.410 41.023 40.800 -0.311 0.000 1.071 272 D HN 0.179 8.549 8.370 0.000 0.000 0.514 273 S N 1.341 117.135 115.700 0.158 0.000 2.618 273 S HA 0.270 4.739 4.470 -0.001 0.000 0.277 273 S C 0.270 174.950 174.600 0.133 0.000 1.138 273 S CA -0.638 57.619 58.200 0.095 0.000 0.844 273 S CB 0.859 64.085 63.200 0.043 0.000 1.127 273 S HN 0.264 8.574 8.310 0.000 0.000 0.474 274 Y N 1.735 122.188 120.300 0.256 0.000 2.395 274 Y HA -0.022 4.527 4.550 -0.001 0.000 0.293 274 Y C 2.392 178.527 175.900 0.391 0.000 1.123 274 Y CA 1.574 59.879 58.100 0.342 0.000 1.227 274 Y CB -0.370 38.246 38.460 0.260 0.000 1.012 274 Y HN 0.772 9.052 8.280 0.000 0.000 0.552 275 M N 0.406 120.277 119.600 0.452 0.000 2.202 275 M HA -0.012 4.467 4.480 -0.001 0.000 0.262 275 M C -1.344 174.976 176.300 0.033 0.000 1.063 275 M CA 1.742 57.229 55.300 0.312 0.000 1.097 275 M CB -1.984 30.831 32.600 0.360 0.000 1.382 275 M HN -0.170 8.120 8.290 0.000 0.000 0.413 276 P HA -0.120 4.300 4.420 0.000 0.000 0.223 276 P C -0.308 176.547 177.300 -0.742 0.000 1.144 276 P CA 1.345 63.865 63.100 -0.966 0.000 0.783 276 P CB -0.344 30.247 31.700 -1.848 0.000 0.771 277 Y N -1.651 118.648 120.300 -0.002 0.000 2.617 277 Y HA 0.197 4.746 4.550 -0.001 0.000 0.328 277 Y C 1.385 177.373 175.900 0.147 0.000 0.946 277 Y CA -0.914 57.205 58.100 0.033 0.000 1.241 277 Y CB -0.672 37.742 38.460 -0.078 0.000 1.226 277 Y HN -0.224 8.056 8.280 0.000 0.000 0.582 278 L N -1.549 119.797 121.223 0.204 0.000 2.012 278 L HA -0.177 4.162 4.340 -0.001 0.000 0.210 278 L C 1.745 178.657 176.870 0.070 0.000 1.073 278 L CA 1.450 56.376 54.840 0.142 0.000 0.748 278 L CB -1.125 40.985 42.059 0.085 0.000 0.891 278 L HN 0.215 8.445 8.230 0.000 0.000 0.431 279 I N 0.440 121.049 120.570 0.064 0.000 2.333 279 I HA -0.158 4.011 4.170 -0.001 0.000 0.246 279 I C 2.246 178.413 176.117 0.082 0.000 1.106 279 I CA 1.100 62.439 61.300 0.064 0.000 1.411 279 I CB -1.290 36.786 38.000 0.126 0.000 1.082 279 I HN 0.332 8.542 8.210 0.000 0.000 0.420 280 D N 0.841 121.289 120.400 0.079 0.000 2.123 280 D HA -0.207 4.432 4.640 -0.001 0.000 0.196 280 D C 2.076 178.304 176.300 -0.119 0.000 0.992 280 D CA 1.465 55.447 54.000 -0.030 0.000 0.833 280 D CB -0.234 40.494 40.800 -0.119 0.000 0.954 280 D HN 0.262 8.632 8.370 0.000 0.000 0.455 281 F N 0.049 120.001 119.950 0.004 0.000 2.615 281 F HA 0.173 4.700 4.527 -0.001 0.000 0.297 281 F C 2.006 177.705 175.800 -0.169 0.000 1.124 281 F CA 0.749 58.703 58.000 -0.076 0.000 1.451 281 F CB -0.101 38.860 39.000 -0.064 0.000 1.103 281 F HN 0.056 8.356 8.300 0.000 0.000 0.569 282 G N 0.182 108.988 108.800 0.011 0.000 2.136 282 G HA2 -0.294 3.666 3.960 -0.001 0.000 0.242 282 G HA3 -0.294 3.666 3.960 -0.001 0.000 0.242 282 G C 1.093 175.789 174.900 -0.339 0.000 0.989 282 G CA 0.439 45.490 45.100 -0.082 0.000 0.682 282 G HN 0.402 8.692 8.290 0.000 0.000 0.522 283 L N -0.143 120.789 121.223 -0.485 0.000 2.201 283 L HA 0.233 4.572 4.340 -0.001 0.000 0.212 283 L C 1.643 178.306 176.870 -0.344 0.000 1.105 283 L CA 1.541 55.862 54.840 -0.865 0.000 0.775 283 L CB -0.155 41.576 42.059 -0.546 0.000 0.913 283 L HN 0.399 8.629 8.230 0.000 0.000 0.440 284 S N -2.188 113.407 115.700 -0.174 0.000 2.595 284 S HA 0.491 4.960 4.470 -0.001 0.000 0.281 284 S C 0.319 174.871 174.600 -0.079 0.000 1.117 284 S CA -0.550 57.584 58.200 -0.110 0.000 0.873 284 S CB 2.037 65.150 63.200 -0.146 0.000 1.108 284 S HN -0.005 8.305 8.310 0.000 0.000 0.477 285 S N 1.255 116.914 115.700 -0.069 0.000 2.632 285 S HA 0.383 4.852 4.470 -0.001 0.000 0.237 285 S C -0.392 174.192 174.600 -0.026 0.000 1.037 285 S CA -0.228 57.969 58.200 -0.006 0.000 1.009 285 S CB 0.299 63.521 63.200 0.036 0.000 0.974 285 S HN 0.536 8.846 8.310 0.000 0.000 0.544 286 K N 2.101 122.390 120.400 -0.185 0.000 2.764 286 K HA 0.313 4.632 4.320 -0.001 0.000 0.239 286 K C -0.896 175.375 176.600 -0.548 0.000 1.048 286 K CA 0.061 56.188 56.287 -0.266 0.000 1.057 286 K CB 1.281 33.744 32.500 -0.061 0.000 1.251 286 K HN 0.025 8.275 8.250 0.000 0.000 0.524 287 S N 3.270 118.293 115.700 -1.128 0.000 2.531 287 S HA 0.248 4.717 4.470 -0.001 0.000 0.279 287 S C -1.670 172.513 174.600 -0.694 0.000 1.305 287 S CA -1.236 56.404 58.200 -0.933 0.000 1.058 287 S CB 0.649 63.131 63.200 -1.196 0.000 0.899 287 S HN 0.356 8.666 8.310 0.000 0.000 0.493 288 P HA 0.043 4.463 4.420 0.000 0.000 0.234 288 P C -0.416 176.453 177.300 -0.719 0.000 1.167 288 P CA 0.861 63.443 63.100 -0.863 0.000 0.763 288 P CB -0.051 30.825 31.700 -1.373 0.000 0.835 289 Y N -3.919 116.321 120.300 -0.100 0.000 2.584 289 Y HA 0.225 4.774 4.550 -0.001 0.000 0.254 289 Y C 0.881 176.883 175.900 0.171 0.000 1.177 289 Y CA -1.159 56.972 58.100 0.051 0.000 1.216 289 Y CB -0.510 37.993 38.460 0.072 0.000 1.172 289 Y HN -0.125 8.155 8.280 0.000 0.000 0.529 290 W N 1.603 122.978 121.300 0.125 0.000 2.150 290 W HA 0.135 4.795 4.660 -0.001 0.000 0.341 290 W C 1.547 178.116 176.519 0.083 0.000 1.276 290 W CA -0.357 57.043 57.345 0.093 0.000 1.238 290 W CB 0.781 30.264 29.460 0.038 0.000 1.128 290 W HN 0.073 8.253 8.180 0.000 0.000 0.581 291 S N -0.096 115.764 115.700 0.266 0.000 2.631 291 S HA -0.016 4.454 4.470 -0.001 0.000 0.217 291 S C 0.983 175.569 174.600 -0.024 0.000 0.958 291 S CA 0.479 58.733 58.200 0.090 0.000 0.920 291 S CB -0.620 62.517 63.200 -0.106 0.000 0.776 291 S HN 0.344 8.654 8.310 0.000 0.000 0.517 292 V N -2.295 117.643 119.914 0.040 0.000 3.471 292 V HA 0.369 4.488 4.120 -0.001 0.000 0.258 292 V C 1.629 177.775 176.094 0.086 0.000 1.192 292 V CA 0.186 62.492 62.300 0.009 0.000 1.116 292 V CB -0.387 31.392 31.823 -0.073 0.000 0.792 292 V HN 0.178 8.368 8.190 0.000 0.000 0.459 293 K N 1.480 121.979 120.400 0.164 0.000 2.393 293 K HA 0.246 4.565 4.320 -0.001 0.000 0.193 293 K C -0.035 176.631 176.600 0.110 0.000 1.026 293 K CA 0.363 56.728 56.287 0.130 0.000 1.064 293 K CB -0.125 32.455 32.500 0.134 0.000 0.833 293 K HN 0.638 8.888 8.250 0.000 0.000 0.521 294 N N 0.911 119.708 118.700 0.161 0.000 2.723 294 N HA 0.125 4.864 4.740 -0.001 0.000 0.290 294 N C -2.345 173.325 175.510 0.266 0.000 1.882 294 N CA -1.139 52.040 53.050 0.215 0.000 0.851 294 N CB 1.425 40.090 38.487 0.297 0.000 1.234 294 N HN -0.145 8.235 8.380 0.000 0.000 0.491 295 P HA -0.098 4.322 4.420 0.000 0.000 0.216 295 P C 1.247 178.689 177.300 0.236 0.000 1.153 295 P CA 0.870 64.075 63.100 0.175 0.000 0.844 295 P CB 0.355 32.097 31.700 0.070 0.000 0.787 296 A N -0.695 122.232 122.820 0.179 0.000 1.873 296 A HA -0.188 4.131 4.320 -0.001 0.000 0.215 296 A C 2.148 179.936 177.584 0.341 0.000 1.186 296 A CA 1.415 53.564 52.037 0.187 0.000 0.616 296 A CB -1.888 17.164 19.000 0.087 0.000 0.823 296 A HN 0.153 8.303 8.150 0.000 0.000 0.442 297 F N 0.415 120.493 119.950 0.215 0.000 2.134 297 F HA -0.201 4.326 4.527 -0.001 0.000 0.299 297 F C 2.142 178.177 175.800 0.392 0.000 1.097 297 F CA 2.266 60.446 58.000 0.299 0.000 1.264 297 F CB -0.693 38.418 39.000 0.186 0.000 1.001 297 F HN 0.508 8.808 8.300 0.000 0.000 0.479 298 H N -0.752 118.388 119.070 0.117 0.000 2.290 298 H HA -0.251 4.304 4.556 -0.001 0.000 0.298 298 H C 2.135 177.485 175.328 0.037 0.000 1.087 298 H CA 2.534 58.590 56.048 0.013 0.000 1.291 298 H CB -0.918 28.926 29.762 0.137 0.000 1.369 298 H HN 0.351 8.631 8.280 0.000 0.000 0.492 299 F N -0.478 119.480 119.950 0.014 0.000 2.075 299 F HA -0.204 4.322 4.527 -0.001 0.000 0.297 299 F C 2.278 178.071 175.800 -0.011 0.000 1.113 299 F CA 1.943 59.924 58.000 -0.031 0.000 1.218 299 F CB -0.770 38.257 39.000 0.045 0.000 0.984 299 F HN 0.380 8.680 8.300 0.000 0.000 0.472 300 W N 1.218 122.549 121.300 0.052 0.000 2.374 300 W HA -0.012 4.648 4.660 -0.001 0.000 0.288 300 W C 2.231 178.662 176.519 -0.148 0.000 1.218 300 W CA 1.912 59.261 57.345 0.006 0.000 1.245 300 W CB -0.904 28.638 29.460 0.136 0.000 1.126 300 W HN 0.083 8.263 8.180 0.000 0.000 0.545 301 G N -0.084 108.531 108.800 -0.308 0.000 2.414 301 G HA2 -0.252 3.707 3.960 -0.001 0.000 0.215 301 G HA3 -0.252 3.707 3.960 -0.001 0.000 0.215 301 G C 1.412 176.032 174.900 -0.468 0.000 1.188 301 G CA 1.047 45.814 45.100 -0.555 0.000 0.783 301 G HN 0.253 8.543 8.290 0.000 0.000 0.537 302 Q N -0.169 119.363 119.800 -0.447 0.000 2.079 302 Q HA -0.002 4.337 4.340 -0.001 0.000 0.200 302 Q C 2.593 178.387 176.000 -0.343 0.000 0.974 302 Q CA 0.751 56.334 55.803 -0.366 0.000 0.840 302 Q CB -0.750 27.723 28.738 -0.442 0.000 0.898 302 Q HN 0.437 8.707 8.270 0.000 0.000 0.430 303 L N 1.026 121.981 121.223 -0.447 0.000 2.012 303 L HA -0.175 4.165 4.340 -0.001 0.000 0.210 303 L C 2.089 178.791 176.870 -0.280 0.000 1.073 303 L CA 2.132 56.756 54.840 -0.360 0.000 0.748 303 L CB -1.029 40.751 42.059 -0.465 0.000 0.891 303 L HN 0.152 8.382 8.230 0.000 0.000 0.431 304 T N -0.047 114.268 114.554 -0.398 0.000 2.720 304 T HA -0.177 4.173 4.350 -0.001 0.000 0.268 304 T C 1.916 176.388 174.700 -0.380 0.000 1.037 304 T CA 1.413 63.250 62.100 -0.437 0.000 1.144 304 T CB -0.689 67.767 68.868 -0.687 0.000 0.864 304 T HN 0.539 8.779 8.240 0.000 0.000 0.444 305 A N 1.278 123.889 122.820 -0.347 0.000 1.902 305 A HA -0.007 4.312 4.320 -0.001 0.000 0.217 305 A C 2.259 179.743 177.584 -0.165 0.000 1.181 305 A CA 1.305 53.189 52.037 -0.255 0.000 0.623 305 A CB -0.808 18.108 19.000 -0.139 0.000 0.818 305 A HN 0.405 8.555 8.150 0.000 0.000 0.443 306 L N -0.231 120.904 121.223 -0.146 0.000 2.046 306 L HA -0.087 4.252 4.340 -0.001 0.000 0.208 306 L C 2.153 178.957 176.870 -0.109 0.000 1.077 306 L CA 1.730 56.510 54.840 -0.102 0.000 0.747 306 L CB -0.487 41.521 42.059 -0.084 0.000 0.896 306 L HN 0.381 8.611 8.230 0.000 0.000 0.432 307 L N -1.000 120.148 121.223 -0.125 0.000 2.362 307 L HA -0.137 4.202 4.340 -0.001 0.000 0.219 307 L C 1.647 178.454 176.870 -0.106 0.000 1.134 307 L CA 0.587 55.358 54.840 -0.115 0.000 0.807 307 L CB -0.343 41.663 42.059 -0.087 0.000 0.927 307 L HN 0.251 8.481 8.230 0.000 0.000 0.447 308 L N 0.069 121.204 121.223 -0.146 0.000 2.791 308 L HA 0.202 4.541 4.340 -0.001 0.000 0.239 308 L C 0.291 177.080 176.870 -0.137 0.000 1.203 308 L CA -0.296 54.454 54.840 -0.150 0.000 1.002 308 L CB 0.074 41.988 42.059 -0.243 0.000 1.295 308 L HN 0.240 8.470 8.230 0.000 0.000 0.504 309 R N -1.495 118.934 120.500 -0.119 0.000 3.762 309 R HA -0.134 4.205 4.340 -0.001 0.000 0.328 309 R C 0.434 176.696 176.300 -0.063 0.000 1.164 309 R CA 0.646 56.690 56.100 -0.094 0.000 0.861 309 R CB -2.712 27.531 30.300 -0.094 0.000 1.408 309 R HN 0.327 8.597 8.270 0.000 0.000 0.502 310 S N 0.775 116.446 115.700 -0.048 0.000 2.549 310 S HA 0.145 4.614 4.470 -0.001 0.000 0.286 310 S C 1.688 176.294 174.600 0.009 0.000 1.314 310 S CA 0.725 58.943 58.200 0.030 0.000 1.062 310 S CB 0.925 64.207 63.200 0.137 0.000 0.865 310 S HN 0.415 8.725 8.310 0.000 0.000 0.498 311 T N 2.221 116.785 114.554 0.018 0.000 3.081 311 T HA 0.078 4.427 4.350 -0.001 0.000 0.255 311 T C 1.296 175.977 174.700 -0.032 0.000 1.113 311 T CA 0.372 62.465 62.100 -0.011 0.000 1.082 311 T CB -0.175 68.689 68.868 -0.008 0.000 0.939 311 T HN 0.829 9.069 8.240 0.000 0.000 0.506 312 R N -0.017 120.448 120.500 -0.058 0.000 2.373 312 R HA 0.632 4.972 4.340 -0.001 0.000 0.221 312 R C 2.283 178.522 176.300 -0.101 0.000 0.893 312 R CA 0.406 56.444 56.100 -0.104 0.000 1.049 312 R CB -0.307 29.876 30.300 -0.195 0.000 1.119 312 R HN 0.254 8.524 8.270 0.000 0.000 0.535 313 A N 1.881 124.653 122.820 -0.079 0.000 2.066 313 A HA 0.018 4.337 4.320 -0.001 0.000 0.218 313 A C 1.927 179.477 177.584 -0.056 0.000 1.157 313 A CA 0.474 52.463 52.037 -0.080 0.000 0.670 313 A CB -0.298 18.657 19.000 -0.074 0.000 0.804 313 A HN 0.265 8.415 8.150 0.000 0.000 0.453 314 R N 0.284 120.763 120.500 -0.036 0.000 2.096 314 R HA -0.110 4.230 4.340 -0.001 0.000 0.240 314 R C 0.661 176.960 176.300 -0.001 0.000 1.139 314 R CA 1.596 57.687 56.100 -0.015 0.000 0.952 314 R CB -0.261 30.031 30.300 -0.012 0.000 0.854 314 R HN 0.442 8.712 8.270 0.000 0.000 0.436 315 N N 0.201 118.898 118.700 -0.005 0.000 2.276 315 N HA 0.124 4.863 4.740 -0.001 0.000 0.212 315 N C -0.443 175.083 175.510 0.026 0.000 1.127 315 N CA 0.131 53.188 53.050 0.010 0.000 0.834 315 N CB 0.728 39.217 38.487 0.003 0.000 1.014 315 N HN 0.161 8.541 8.380 0.000 0.000 0.491 316 A N 1.345 124.178 122.820 0.023 0.000 2.366 316 A HA 0.282 4.601 4.320 -0.001 0.000 0.249 316 A C 0.561 178.226 177.584 0.135 0.000 1.084 316 A CA -0.441 51.638 52.037 0.070 0.000 0.794 316 A CB 0.544 19.541 19.000 -0.004 0.000 1.034 316 A HN 0.117 8.267 8.150 0.000 0.000 0.491 317 R N 1.771 122.425 120.500 0.256 0.000 2.401 317 R HA 0.114 4.453 4.340 -0.001 0.000 0.299 317 R C -0.202 176.283 176.300 0.309 0.000 1.064 317 R CA -0.085 56.152 56.100 0.228 0.000 1.000 317 R CB 0.114 30.491 30.300 0.129 0.000 0.973 317 R HN 0.811 9.081 8.270 0.000 0.000 0.438 318 Q N 4.353 124.294 119.800 0.236 0.000 2.337 318 Q HA 0.221 4.561 4.340 -0.001 0.000 0.255 318 Q C -2.147 174.010 176.000 0.262 0.000 0.997 318 Q CA -1.821 54.167 55.803 0.309 0.000 0.925 318 Q CB 0.918 29.812 28.738 0.260 0.000 1.212 318 Q HN 0.295 8.566 8.270 0.000 0.000 0.436 319 P HA 0.088 4.508 4.420 0.000 0.000 0.274 319 P C -0.890 176.482 177.300 0.120 0.000 1.231 319 P CA -0.227 62.967 63.100 0.157 0.000 0.790 319 P CB 0.785 32.572 31.700 0.146 0.000 0.951 320 D N 0.811 121.253 120.400 0.070 0.000 2.354 320 D HA 0.067 4.707 4.640 -0.001 0.000 0.247 320 D C -0.144 176.135 176.300 -0.035 0.000 1.138 320 D CA 0.219 54.259 54.000 0.067 0.000 0.958 320 D CB 0.146 40.975 40.800 0.049 0.000 1.144 320 D HN 0.393 8.763 8.370 0.000 0.000 0.458 321 D N -0.096 120.284 120.400 -0.033 0.000 2.689 321 D HA -0.171 4.468 4.640 -0.001 0.000 0.237 321 D C -0.329 175.842 176.300 -0.214 0.000 1.148 321 D CA 0.677 54.623 54.000 -0.090 0.000 0.656 321 D CB -1.437 39.338 40.800 -0.041 0.000 1.050 321 D HN 0.355 8.725 8.370 0.000 0.000 0.426 322 I N -4.231 116.049 120.570 -0.483 0.000 3.108 322 I HA 0.468 4.637 4.170 -0.001 0.000 0.312 322 I C 0.297 176.012 176.117 -0.669 0.000 1.095 322 I CA -1.199 59.768 61.300 -0.555 0.000 1.000 322 I CB 1.950 39.578 38.000 -0.618 0.000 1.229 322 I HN -0.210 8.000 8.210 0.000 0.000 0.454 323 E N 1.439 121.392 120.200 -0.411 0.000 1.979 323 E HA 0.131 4.480 4.350 -0.001 0.000 0.285 323 E C -0.133 176.336 176.600 -0.218 0.000 1.188 323 E CA -0.159 56.101 56.400 -0.233 0.000 1.214 323 E CB -0.040 29.602 29.700 -0.096 0.000 1.210 323 E HN 0.624 8.984 8.360 0.000 0.000 0.477 324 Y N 0.484 120.668 120.300 -0.193 0.000 2.014 324 Y HA -0.394 4.156 4.550 -0.001 0.000 0.272 324 Y C 2.866 178.793 175.900 0.045 0.000 1.164 324 Y CA 2.078 60.024 58.100 -0.257 0.000 1.114 324 Y CB -1.203 37.118 38.460 -0.232 0.000 0.961 324 Y HN 0.477 8.757 8.280 0.000 0.000 0.489 325 T N -2.645 112.071 114.554 0.271 0.000 2.597 325 T HA -0.275 4.074 4.350 -0.001 0.000 0.267 325 T C 2.014 176.864 174.700 0.251 0.000 1.053 325 T CA 2.046 64.299 62.100 0.255 0.000 1.165 325 T CB -1.095 67.883 68.868 0.184 0.000 0.863 325 T HN 0.300 8.540 8.240 0.000 0.000 0.427 326 S N 1.673 117.487 115.700 0.191 0.000 2.402 326 S HA 0.177 4.646 4.470 -0.001 0.000 0.229 326 S C 2.019 176.761 174.600 0.237 0.000 1.021 326 S CA 0.790 59.105 58.200 0.192 0.000 0.974 326 S CB -0.536 62.740 63.200 0.127 0.000 0.800 326 S HN 0.405 8.715 8.310 0.000 0.000 0.484 327 L N 1.021 122.395 121.223 0.252 0.000 2.141 327 L HA -0.082 4.257 4.340 -0.001 0.000 0.209 327 L C 2.567 179.761 176.870 0.540 0.000 1.094 327 L CA 1.022 56.092 54.840 0.383 0.000 0.763 327 L CB -0.972 41.311 42.059 0.374 0.000 0.908 327 L HN 0.290 8.520 8.230 0.000 0.000 0.437 328 T N -1.382 113.487 114.554 0.525 0.000 2.770 328 T HA -0.149 4.200 4.350 -0.001 0.000 0.263 328 T C 1.934 176.902 174.700 0.446 0.000 1.039 328 T CA 1.805 64.236 62.100 0.552 0.000 1.142 328 T CB -0.206 69.019 68.868 0.596 0.000 0.868 328 T HN 0.292 8.532 8.240 0.000 0.000 0.435 329 T N 2.094 116.875 114.554 0.378 0.000 2.746 329 T HA -0.048 4.302 4.350 -0.001 0.000 0.267 329 T C 2.391 177.245 174.700 0.256 0.000 1.039 329 T CA 1.216 63.503 62.100 0.313 0.000 1.142 329 T CB -0.558 68.501 68.868 0.320 0.000 0.866 329 T HN 0.420 8.660 8.240 0.000 0.000 0.444 330 A N 1.331 124.344 122.820 0.322 0.000 1.902 330 A HA 0.082 4.402 4.320 -0.001 0.000 0.217 330 A C 2.615 180.512 177.584 0.521 0.000 1.181 330 A CA 1.955 54.225 52.037 0.389 0.000 0.623 330 A CB -1.371 17.861 19.000 0.386 0.000 0.818 330 A HN 0.516 8.666 8.150 0.000 0.000 0.443 331 G N -0.245 108.852 108.800 0.496 0.000 2.421 331 G HA2 -0.131 3.828 3.960 -0.001 0.000 0.216 331 G HA3 -0.131 3.828 3.960 -0.001 0.000 0.216 331 G C 1.494 176.447 174.900 0.089 0.000 1.171 331 G CA 1.171 46.389 45.100 0.197 0.000 0.775 331 G HN 0.502 8.792 8.290 0.000 0.000 0.543 332 L N 0.191 121.498 121.223 0.140 0.000 2.012 332 L HA 0.003 4.342 4.340 -0.001 0.000 0.210 332 L C 2.560 179.427 176.870 -0.004 0.000 1.073 332 L CA 1.689 56.556 54.840 0.044 0.000 0.748 332 L CB -0.650 41.471 42.059 0.102 0.000 0.891 332 L HN 0.199 8.429 8.230 0.000 0.000 0.431 333 L N -1.526 119.714 121.223 0.028 0.000 1.994 333 L HA -0.252 4.087 4.340 -0.001 0.000 0.208 333 L C 2.398 179.215 176.870 -0.088 0.000 1.071 333 L CA 1.897 56.735 54.840 -0.003 0.000 0.745 333 L CB -1.120 40.916 42.059 -0.037 0.000 0.892 333 L HN 0.434 8.664 8.230 0.000 0.000 0.431 334 Y N 0.501 120.665 120.300 -0.226 0.000 2.097 334 Y HA -0.262 4.287 4.550 -0.001 0.000 0.282 334 Y C 2.465 177.934 175.900 -0.719 0.000 1.152 334 Y CA 1.479 59.156 58.100 -0.706 0.000 1.136 334 Y CB -1.119 37.125 38.460 -0.361 0.000 0.975 334 Y HN 0.290 8.570 8.280 0.000 0.000 0.498 335 A N -0.724 121.832 122.820 -0.441 0.000 1.908 335 A HA -0.283 4.036 4.320 -0.001 0.000 0.218 335 A C 2.252 179.518 177.584 -0.530 0.000 1.181 335 A CA 1.847 53.599 52.037 -0.475 0.000 0.627 335 A CB -1.625 17.225 19.000 -0.251 0.000 0.818 335 A HN 0.650 8.800 8.150 0.000 0.000 0.445 336 Y N 0.478 120.390 120.300 -0.647 0.000 2.200 336 Y HA -0.031 4.518 4.550 -0.001 0.000 0.290 336 Y C 2.662 178.053 175.900 -0.847 0.000 1.137 336 Y CA 1.056 58.657 58.100 -0.832 0.000 1.163 336 Y CB -0.549 37.598 38.460 -0.521 0.000 0.988 336 Y HN 0.315 8.595 8.280 0.000 0.000 0.518 337 A N -0.581 121.613 122.820 -1.043 0.000 1.883 337 A HA -0.179 4.140 4.320 -0.001 0.000 0.217 337 A C 2.345 179.428 177.584 -0.836 0.000 1.186 337 A CA 2.252 53.394 52.037 -1.492 0.000 0.624 337 A CB -1.362 16.482 19.000 -1.927 0.000 0.822 337 A HN 0.319 8.469 8.150 0.000 0.000 0.444 338 V N -0.260 119.204 119.914 -0.749 0.000 2.261 338 V HA -0.163 3.956 4.120 -0.001 0.000 0.246 338 V C 2.721 178.561 176.094 -0.424 0.000 1.047 338 V CA 2.067 64.044 62.300 -0.538 0.000 1.015 338 V CB -1.362 30.096 31.823 -0.609 0.000 0.642 338 V HN 0.618 8.808 8.190 0.000 0.000 0.446 339 G N -0.561 107.949 108.800 -0.484 0.000 2.650 339 G HA2 -0.109 3.850 3.960 -0.001 0.000 0.214 339 G HA3 -0.109 3.850 3.960 -0.001 0.000 0.214 339 G C 1.550 176.249 174.900 -0.336 0.000 1.136 339 G CA 1.001 45.912 45.100 -0.316 0.000 0.789 339 G HN 0.650 8.940 8.290 0.000 0.000 0.536 340 S N -1.130 114.257 115.700 -0.522 0.000 2.523 340 S HA 0.269 4.738 4.470 -0.001 0.000 0.217 340 S C 0.772 175.234 174.600 -0.230 0.000 0.996 340 S CA -0.085 57.863 58.200 -0.419 0.000 0.921 340 S CB 0.540 63.312 63.200 -0.715 0.000 0.829 340 S HN -0.026 8.284 8.310 0.000 0.000 0.495 341 S N 2.208 117.786 115.700 -0.203 0.000 2.130 341 S HA 0.668 5.137 4.470 -0.001 0.000 0.165 341 S C -0.212 174.332 174.600 -0.093 0.000 1.677 341 S CA -0.615 57.529 58.200 -0.094 0.000 1.227 341 S CB 0.823 64.021 63.200 -0.004 0.000 1.115 341 S HN 0.638 8.948 8.310 0.000 0.000 0.452 342 A N 2.049 124.818 122.820 -0.084 0.000 2.410 342 A HA 0.285 4.604 4.320 -0.001 0.000 0.292 342 A C 0.213 177.770 177.584 -0.044 0.000 1.232 342 A CA -0.451 51.545 52.037 -0.069 0.000 0.893 342 A CB -0.020 18.943 19.000 -0.062 0.000 1.131 342 A HN 0.545 8.695 8.150 0.000 0.000 0.530 343 D N 3.245 123.622 120.400 -0.037 0.000 2.767 343 D HA 0.107 4.746 4.640 -0.001 0.000 0.231 343 D C -0.270 176.017 176.300 -0.021 0.000 1.105 343 D CA 0.153 54.141 54.000 -0.020 0.000 1.024 343 D CB 0.081 40.876 40.800 -0.008 0.000 1.123 343 D HN 0.249 8.619 8.370 0.000 0.000 0.470 344 L N 1.411 122.620 121.223 -0.022 0.000 2.462 344 L HA 0.242 4.581 4.340 -0.001 0.000 0.272 344 L C 0.527 177.388 176.870 -0.014 0.000 1.166 344 L CA -0.100 54.729 54.840 -0.018 0.000 0.880 344 L CB 0.539 42.587 42.059 -0.018 0.000 1.142 344 L HN 0.187 8.417 8.230 0.000 0.000 0.473 345 A N 3.995 126.807 122.820 -0.013 0.000 2.520 345 A HA 0.489 4.808 4.320 -0.001 0.000 0.298 345 A C -0.610 176.966 177.584 -0.014 0.000 1.051 345 A CA -0.666 51.363 52.037 -0.013 0.000 0.690 345 A CB 1.013 20.002 19.000 -0.018 0.000 1.281 345 A HN 0.588 8.738 8.150 0.000 0.000 0.402 346 Q N 0.439 120.234 119.800 -0.008 0.000 2.330 346 Q HA 0.108 4.447 4.340 -0.001 0.000 0.279 346 Q C 0.151 176.117 176.000 -0.055 0.000 1.024 346 Q CA 0.272 56.074 55.803 -0.002 0.000 0.900 346 Q CB 0.537 29.284 28.738 0.016 0.000 1.221 346 Q HN 0.717 8.987 8.270 0.000 0.000 0.396 347 Q N 2.660 122.408 119.800 -0.086 0.000 2.391 347 Q HA 0.180 4.519 4.340 -0.001 0.000 0.243 347 Q C -0.569 175.047 176.000 -0.639 0.000 0.874 347 Q CA 0.612 56.201 55.803 -0.357 0.000 0.950 347 Q CB 0.919 29.422 28.738 -0.393 0.000 1.103 347 Q HN 0.485 8.755 8.270 0.000 0.000 0.544 348 F N 0.260 120.213 119.950 0.006 0.000 2.599 348 F HA 0.497 5.024 4.527 -0.001 0.000 0.311 348 F C -0.002 175.804 175.800 0.009 0.000 1.076 348 F CA -1.186 56.817 58.000 0.006 0.000 0.937 348 F CB 1.762 40.763 39.000 0.002 0.000 1.282 348 F HN -0.017 8.283 8.300 0.000 0.000 0.460 349 C N -0.578 118.842 119.300 0.200 0.000 3.241 349 C HA 0.821 5.280 4.460 -0.001 0.000 0.312 349 C C 0.057 175.103 174.990 0.094 0.000 1.350 349 C CA -0.650 58.438 59.018 0.117 0.000 1.415 349 C CB 1.204 28.991 27.740 0.079 0.000 1.770 349 C HN 0.989 9.219 8.230 0.000 0.000 0.466 350 V N -0.475 119.478 119.914 0.065 0.000 2.988 350 V HA 0.802 4.921 4.120 -0.001 0.000 0.356 350 V C 0.815 176.931 176.094 0.038 0.000 1.380 350 V CA 0.868 63.196 62.300 0.046 0.000 1.184 350 V CB -0.472 31.371 31.823 0.034 0.000 1.204 350 V HN 2.364 10.554 8.190 0.000 0.000 0.530 351 G N 1.050 109.875 108.800 0.042 0.000 3.898 351 G HA2 -0.099 3.861 3.960 -0.001 0.000 0.196 351 G HA3 -0.099 3.861 3.960 -0.001 0.000 0.196 351 G C -0.258 174.669 174.900 0.044 0.000 1.322 351 G CA 0.104 45.226 45.100 0.036 0.000 0.942 351 G HN 0.782 9.072 8.290 0.000 0.000 0.400 352 D N 1.670 122.102 120.400 0.054 0.000 2.269 352 D HA 0.578 5.217 4.640 -0.001 0.000 0.244 352 D C -0.291 176.060 176.300 0.085 0.000 0.992 352 D CA -0.359 53.686 54.000 0.075 0.000 0.894 352 D CB 1.568 42.410 40.800 0.070 0.000 1.248 352 D HN 0.619 8.989 8.370 0.000 0.000 0.468 353 N N -0.366 118.411 118.700 0.129 0.000 2.825 353 N HA 0.204 4.943 4.740 -0.001 0.000 0.253 353 N C -1.096 174.510 175.510 0.160 0.000 1.426 353 N CA -0.877 52.248 53.050 0.125 0.000 0.851 353 N CB 2.351 40.906 38.487 0.113 0.000 1.470 353 N HN 0.325 8.705 8.380 0.000 0.000 0.517 354 K N 0.606 121.049 120.400 0.071 0.000 2.172 354 K HA 0.279 4.599 4.320 -0.001 0.000 0.276 354 K C -1.478 175.154 176.600 0.053 0.000 1.013 354 K CA -0.340 55.913 56.287 -0.057 0.000 0.913 354 K CB 0.504 32.957 32.500 -0.079 0.000 1.055 354 K HN 0.646 8.896 8.250 0.000 0.000 0.461 355 Y N -1.032 119.265 120.300 -0.004 0.000 2.396 355 Y HA 0.376 4.926 4.550 -0.001 0.000 0.332 355 Y C -0.286 175.612 175.900 -0.004 0.000 1.034 355 Y CA -0.962 57.135 58.100 -0.005 0.000 1.057 355 Y CB 1.976 40.433 38.460 -0.005 0.000 1.220 355 Y HN 0.409 8.689 8.280 0.000 0.000 0.440 356 T N 3.836 118.440 114.554 0.083 0.000 3.954 356 T HA 0.328 4.677 4.350 -0.001 0.000 0.226 356 T C -1.939 172.792 174.700 0.051 0.000 1.049 356 T CA -0.841 61.282 62.100 0.038 0.000 1.481 356 T CB -0.131 68.723 68.868 -0.022 0.000 0.853 356 T HN 0.608 8.848 8.240 0.000 0.000 0.632 357 P HA 0.119 4.539 4.420 0.000 0.000 0.215 357 P C -0.045 177.277 177.300 0.036 0.000 1.157 357 P CA 1.068 64.199 63.100 0.051 0.000 0.868 357 P CB 0.208 31.939 31.700 0.053 0.000 0.788 358 D N -1.497 118.927 120.400 0.040 0.000 2.616 358 D HA 0.219 4.858 4.640 -0.001 0.000 0.238 358 D C -0.816 175.501 176.300 0.027 0.000 1.354 358 D CA -0.344 53.673 54.000 0.028 0.000 0.970 358 D CB 0.443 41.257 40.800 0.024 0.000 1.369 358 D HN -0.255 8.115 8.370 0.000 0.000 0.585 359 D N 1.479 121.889 120.400 0.017 0.000 2.557 359 D HA 0.055 4.695 4.640 -0.001 0.000 0.317 359 D C -0.616 175.686 176.300 0.004 0.000 1.403 359 D CA -0.068 53.939 54.000 0.011 0.000 0.886 359 D CB 0.738 41.542 40.800 0.007 0.000 1.363 359 D HN 0.225 8.595 8.370 0.000 0.000 0.458 360 S N 0.945 116.647 115.700 0.004 0.000 2.455 360 S HA 0.335 4.804 4.470 -0.001 0.000 0.278 360 S C 0.319 174.921 174.600 0.002 0.000 1.216 360 S CA 0.090 58.290 58.200 0.000 0.000 1.055 360 S CB 1.211 64.410 63.200 -0.002 0.000 0.939 360 S HN -0.012 8.298 8.310 0.000 0.000 0.494 361 T N 2.994 117.548 114.554 0.001 0.000 2.867 361 T HA 0.614 4.963 4.350 -0.001 0.000 0.282 361 T C 0.957 175.658 174.700 0.003 0.000 1.000 361 T CA -0.675 61.427 62.100 0.003 0.000 1.042 361 T CB 1.651 70.521 68.868 0.003 0.000 0.973 361 T HN 0.627 8.867 8.240 0.000 0.000 0.465 362 G N 0.017 108.820 108.800 0.004 0.000 2.695 362 G HA2 0.585 4.544 3.960 -0.001 0.000 0.213 362 G HA3 0.585 4.544 3.960 -0.001 0.000 0.213 362 G C 0.484 175.388 174.900 0.006 0.000 1.406 362 G CA -0.442 44.661 45.100 0.005 0.000 1.049 362 G HN 1.414 9.704 8.290 0.000 0.000 0.573 363 G N -1.964 106.841 108.800 0.007 0.000 2.643 363 G HA2 0.174 4.133 3.960 -0.001 0.000 0.280 363 G HA3 0.174 4.133 3.960 -0.001 0.000 0.280 363 G C 0.552 175.457 174.900 0.009 0.000 1.120 363 G CA 0.334 45.439 45.100 0.008 0.000 1.165 363 G HN 1.876 10.166 8.290 0.000 0.000 0.540 364 L N -1.310 119.920 121.223 0.011 0.000 4.988 364 L HA -0.238 4.101 4.340 -0.001 0.000 0.439 364 L C 1.966 178.845 176.870 0.016 0.000 1.080 364 L CA 3.076 57.925 54.840 0.014 0.000 1.018 364 L CB -1.284 40.783 42.059 0.012 0.000 1.945 364 L HN 0.853 9.083 8.230 0.000 0.000 0.782 365 T N -1.894 112.667 114.554 0.013 0.000 3.496 365 T HA 0.079 4.429 4.350 -0.001 0.000 0.253 365 T C 0.919 175.627 174.700 0.013 0.000 1.134 365 T CA 1.099 63.206 62.100 0.012 0.000 0.993 365 T CB -0.489 68.384 68.868 0.008 0.000 1.018 365 T HN 0.520 8.760 8.240 0.000 0.000 0.571 366 T N 0.832 115.398 114.554 0.020 0.000 3.201 366 T HA 0.325 4.675 4.350 -0.001 0.000 0.338 366 T C 0.521 175.249 174.700 0.047 0.000 1.095 366 T CA -0.735 61.380 62.100 0.025 0.000 1.426 366 T CB 0.111 68.989 68.868 0.016 0.000 0.956 366 T HN 0.140 8.380 8.240 0.000 0.000 0.551 367 N N 3.162 121.897 118.700 0.058 0.000 2.368 367 N HA 0.347 5.086 4.740 -0.001 0.000 0.178 367 N C 1.045 176.641 175.510 0.143 0.000 1.021 367 N CA 0.652 53.756 53.050 0.091 0.000 0.875 367 N CB 0.123 38.656 38.487 0.077 0.000 1.020 367 N HN 0.708 9.088 8.380 0.000 0.000 0.433 368 A N 1.340 124.219 122.820 0.097 0.000 2.547 368 A HA 0.214 4.533 4.320 -0.001 0.000 0.233 368 A C -1.929 175.663 177.584 0.013 0.000 1.067 368 A CA -0.781 51.304 52.037 0.080 0.000 0.763 368 A CB -0.635 18.375 19.000 0.018 0.000 1.007 368 A HN 0.393 8.543 8.150 0.000 0.000 0.506 369 P HA 0.150 4.570 4.420 0.000 0.000 0.270 369 P C -2.526 174.351 177.300 -0.706 0.000 1.221 369 P CA -0.673 61.913 63.100 -0.856 0.000 0.788 369 P CB -0.836 30.304 31.700 -0.933 0.000 0.904 370 P HA 0.135 4.555 4.420 0.000 0.000 0.272 370 P C -0.412 176.674 177.300 -0.357 0.000 1.223 370 P CA 0.139 62.849 63.100 -0.650 0.000 0.784 370 P CB 0.353 31.529 31.700 -0.874 0.000 0.923 371 Q N 1.374 121.085 119.800 -0.149 0.000 2.322 371 Q HA 0.537 4.876 4.340 -0.001 0.000 0.256 371 Q C 0.529 176.566 176.000 0.062 0.000 0.960 371 Q CA -0.092 55.697 55.803 -0.024 0.000 0.934 371 Q CB 1.118 29.839 28.738 -0.028 0.000 1.200 371 Q HN 0.805 9.075 8.270 0.000 0.000 0.435 372 G N 1.958 110.853 108.800 0.157 0.000 2.331 372 G HA2 -0.136 3.823 3.960 -0.001 0.000 0.479 372 G HA3 -0.136 3.823 3.960 -0.001 0.000 0.479 372 G C -0.752 174.382 174.900 0.390 0.000 1.262 372 G CA -0.975 44.248 45.100 0.204 0.000 1.029 372 G HN 0.589 8.879 8.290 0.000 0.000 0.487 373 R N -0.084 120.630 120.500 0.358 0.000 2.661 373 R HA 0.282 4.622 4.340 -0.001 0.000 0.429 373 R C -0.862 175.795 176.300 0.595 0.000 1.044 373 R CA -0.456 55.907 56.100 0.437 0.000 1.065 373 R CB 0.860 31.287 30.300 0.213 0.000 1.377 373 R HN 0.419 8.689 8.270 0.000 0.000 0.600 374 D N 0.972 121.678 120.400 0.510 0.000 2.336 374 D HA -0.009 4.630 4.640 -0.001 0.000 0.249 374 D C 1.168 177.648 176.300 0.301 0.000 1.213 374 D CA -0.029 54.166 54.000 0.326 0.000 0.870 374 D CB 1.690 42.607 40.800 0.194 0.000 1.076 374 D HN -0.093 8.277 8.370 0.000 0.000 0.483 375 V N 4.631 124.491 119.914 -0.090 0.000 2.392 375 V HA -0.236 3.883 4.120 -0.001 0.000 0.249 375 V C 1.945 177.901 176.094 -0.229 0.000 1.059 375 V CA 1.901 63.806 62.300 -0.658 0.000 1.051 375 V CB -0.097 30.932 31.823 -1.323 0.000 0.658 375 V HN 0.580 8.770 8.190 0.000 0.000 0.455 376 V N 0.132 119.985 119.914 -0.102 0.000 2.332 376 V HA -0.288 3.831 4.120 -0.001 0.000 0.248 376 V C 2.445 178.567 176.094 0.047 0.000 1.055 376 V CA 2.552 64.837 62.300 -0.026 0.000 1.038 376 V CB -0.886 30.928 31.823 -0.014 0.000 0.651 376 V HN 0.649 8.839 8.190 0.000 0.000 0.450 377 E N -1.121 119.127 120.200 0.080 0.000 2.047 377 E HA -0.230 4.119 4.350 -0.001 0.000 0.191 377 E C 2.062 178.720 176.600 0.096 0.000 0.987 377 E CA 1.647 58.082 56.400 0.057 0.000 0.799 377 E CB -0.233 29.468 29.700 0.002 0.000 0.752 377 E HN 0.715 9.075 8.360 0.000 0.000 0.449 378 W N 0.543 121.932 121.300 0.149 0.000 2.388 378 W HA -0.112 4.548 4.660 -0.001 0.000 0.294 378 W C 1.949 178.660 176.519 0.320 0.000 1.212 378 W CA 0.134 57.647 57.345 0.280 0.000 1.271 378 W CB -0.245 29.434 29.460 0.364 0.000 1.126 378 W HN 0.092 8.272 8.180 0.000 0.000 0.535 379 L N 0.171 121.597 121.223 0.338 0.000 2.191 379 L HA -0.022 4.317 4.340 -0.001 0.000 0.212 379 L C 2.429 179.452 176.870 0.256 0.000 1.103 379 L CA 2.042 57.043 54.840 0.267 0.000 0.769 379 L CB -1.550 40.567 42.059 0.097 0.000 0.908 379 L HN 0.064 8.294 8.230 0.000 0.000 0.438 380 G N -2.010 106.917 108.800 0.210 0.000 2.394 380 G HA2 -0.326 3.633 3.960 -0.001 0.000 0.214 380 G HA3 -0.326 3.633 3.960 -0.001 0.000 0.214 380 G C 1.479 176.500 174.900 0.201 0.000 1.176 380 G CA 0.518 45.712 45.100 0.156 0.000 0.786 380 G HN 0.503 8.793 8.290 0.000 0.000 0.533 381 W N 0.611 121.953 121.300 0.070 0.000 2.358 381 W HA 0.036 4.695 4.660 -0.001 0.000 0.303 381 W C 2.145 178.788 176.519 0.206 0.000 1.208 381 W CA 1.290 58.676 57.345 0.068 0.000 1.274 381 W CB -0.402 29.021 29.460 -0.061 0.000 1.138 381 W HN 0.117 8.297 8.180 0.000 0.000 0.515 382 F N 1.116 121.210 119.950 0.240 0.000 2.186 382 F HA -0.203 4.324 4.527 -0.001 0.000 0.299 382 F C 2.496 178.256 175.800 -0.067 0.000 1.090 382 F CA 1.718 59.747 58.000 0.047 0.000 1.307 382 F CB -0.232 38.949 39.000 0.302 0.000 1.019 382 F HN -0.202 8.098 8.300 0.000 0.000 0.489 383 E N 0.399 120.624 120.200 0.042 0.000 2.085 383 E HA -0.233 4.116 4.350 -0.001 0.000 0.194 383 E C 1.648 178.150 176.600 -0.163 0.000 0.994 383 E CA 1.478 57.836 56.400 -0.070 0.000 0.801 383 E CB -0.344 29.363 29.700 0.011 0.000 0.743 383 E HN 0.506 8.866 8.360 0.000 0.000 0.453 384 D N 0.177 120.469 120.400 -0.180 0.000 2.269 384 D HA -0.095 4.544 4.640 -0.001 0.000 0.208 384 D C 1.192 177.295 176.300 -0.328 0.000 0.963 384 D CA 0.570 54.438 54.000 -0.219 0.000 0.864 384 D CB -0.004 40.683 40.800 -0.188 0.000 0.936 384 D HN 0.041 8.411 8.370 0.000 0.000 0.505 385 Q N 0.249 119.758 119.800 -0.485 0.000 2.282 385 Q HA 0.125 4.464 4.340 -0.001 0.000 0.205 385 Q C -0.506 175.230 176.000 -0.440 0.000 0.915 385 Q CA -0.143 55.347 55.803 -0.523 0.000 0.949 385 Q CB -0.715 27.578 28.738 -0.741 0.000 1.035 385 Q HN 0.195 8.465 8.270 0.000 0.000 0.484 386 N N 0.230 118.717 118.700 -0.354 0.000 2.735 386 N HA -0.279 4.460 4.740 -0.001 0.000 0.248 386 N C -0.642 174.639 175.510 -0.382 0.000 1.083 386 N CA 0.641 53.520 53.050 -0.285 0.000 0.703 386 N CB -0.661 37.710 38.487 -0.193 0.000 1.005 386 N HN 0.264 8.644 8.380 0.000 0.000 0.550 387 R N -1.918 118.197 120.500 -0.642 0.000 3.847 387 R HA -0.243 4.096 4.340 -0.001 0.000 0.304 387 R C -0.473 175.302 176.300 -0.875 0.000 1.203 387 R CA 1.507 57.043 56.100 -0.940 0.000 0.835 387 R CB -0.862 29.246 30.300 -0.320 0.000 1.253 387 R HN 0.451 8.721 8.270 0.000 0.000 0.516 388 K N 0.564 120.528 120.400 -0.727 0.000 2.376 388 K HA 0.358 4.678 4.320 -0.001 0.000 0.257 388 K C -2.581 174.005 176.600 -0.023 0.000 0.939 388 K CA -2.371 53.784 56.287 -0.219 0.000 0.809 388 K CB 1.609 34.030 32.500 -0.132 0.000 1.121 388 K HN -0.286 7.964 8.250 0.000 0.000 0.425 389 P HA -0.015 4.405 4.420 0.000 0.000 0.265 389 P C -0.885 176.516 177.300 0.169 0.000 1.193 389 P CA 0.032 63.342 63.100 0.351 0.000 0.765 389 P CB 0.625 32.507 31.700 0.304 0.000 0.823 390 T N 5.930 120.577 114.554 0.155 0.000 2.910 390 T HA 0.130 4.480 4.350 -0.001 0.000 0.293 390 T C -1.239 173.510 174.700 0.083 0.000 1.015 390 T CA -1.084 61.080 62.100 0.107 0.000 1.094 390 T CB 0.244 69.227 68.868 0.191 0.000 0.968 390 T HN 0.301 8.541 8.240 0.000 0.000 0.521 391 P HA -0.201 4.219 4.420 0.000 0.000 0.220 391 P C 1.020 178.374 177.300 0.090 0.000 1.155 391 P CA 1.294 64.443 63.100 0.082 0.000 0.880 391 P CB 0.191 31.938 31.700 0.079 0.000 0.790 392 D N -1.988 118.477 120.400 0.109 0.000 2.149 392 D HA -0.078 4.561 4.640 -0.001 0.000 0.201 392 D C 1.982 178.317 176.300 0.058 0.000 0.972 392 D CA 0.926 55.014 54.000 0.146 0.000 0.835 392 D CB -0.405 40.544 40.800 0.249 0.000 0.966 392 D HN 0.047 8.417 8.370 0.000 0.000 0.476 393 M N -0.788 118.689 119.600 -0.205 0.000 2.117 393 M HA -0.134 4.346 4.480 -0.001 0.000 0.262 393 M C 1.896 178.148 176.300 -0.081 0.000 1.065 393 M CA 1.034 56.066 55.300 -0.446 0.000 1.114 393 M CB -0.059 32.284 32.600 -0.430 0.000 1.361 393 M HN 0.109 8.399 8.290 0.000 0.000 0.408 394 M N -0.127 119.481 119.600 0.012 0.000 2.200 394 M HA -0.163 4.317 4.480 -0.001 0.000 0.265 394 M C 2.087 178.427 176.300 0.068 0.000 1.066 394 M CA 1.737 57.080 55.300 0.071 0.000 1.127 394 M CB -0.297 32.379 32.600 0.126 0.000 1.379 394 M HN 0.112 8.402 8.290 0.000 0.000 0.420 395 Q N -1.200 118.653 119.800 0.088 0.000 2.084 395 Q HA -0.218 4.122 4.340 -0.001 0.000 0.202 395 Q C 1.984 178.037 176.000 0.088 0.000 0.978 395 Q CA 1.961 57.817 55.803 0.089 0.000 0.844 395 Q CB -0.647 28.155 28.738 0.106 0.000 0.898 395 Q HN 0.632 8.902 8.270 0.000 0.000 0.426 396 Y N -0.070 120.244 120.300 0.025 0.000 2.114 396 Y HA -0.271 4.278 4.550 -0.001 0.000 0.282 396 Y C 1.994 177.843 175.900 -0.086 0.000 1.165 396 Y CA 2.124 60.237 58.100 0.022 0.000 1.148 396 Y CB -0.574 37.984 38.460 0.165 0.000 0.972 396 Y HN 0.208 8.488 8.280 0.000 0.000 0.504 397 A N 0.126 122.901 122.820 -0.076 0.000 1.930 397 A HA -0.177 4.143 4.320 -0.001 0.000 0.217 397 A C 2.297 179.759 177.584 -0.203 0.000 1.175 397 A CA 1.731 53.547 52.037 -0.368 0.000 0.627 397 A CB -0.732 17.667 19.000 -1.002 0.000 0.815 397 A HN 0.519 8.669 8.150 0.000 0.000 0.443 398 K N -0.349 120.015 120.400 -0.059 0.000 2.032 398 K HA -0.165 4.154 4.320 -0.001 0.000 0.209 398 K C 2.294 178.867 176.600 -0.046 0.000 1.048 398 K CA 1.516 57.813 56.287 0.016 0.000 0.927 398 K CB -0.183 32.344 32.500 0.045 0.000 0.712 398 K HN 0.431 8.681 8.250 0.000 0.000 0.441 399 R N -0.113 120.328 120.500 -0.099 0.000 2.096 399 R HA -0.113 4.226 4.340 -0.001 0.000 0.235 399 R C 2.376 178.562 176.300 -0.190 0.000 1.127 399 R CA 1.251 57.270 56.100 -0.136 0.000 0.968 399 R CB -0.324 29.881 30.300 -0.158 0.000 0.861 399 R HN 0.249 8.519 8.270 0.000 0.000 0.440 400 A N 0.722 123.370 122.820 -0.286 0.000 1.877 400 A HA -0.139 4.180 4.320 -0.001 0.000 0.216 400 A C 2.220 179.720 177.584 -0.141 0.000 1.186 400 A CA 1.961 53.831 52.037 -0.280 0.000 0.620 400 A CB -0.471 18.309 19.000 -0.367 0.000 0.822 400 A HN 0.275 8.425 8.150 0.000 0.000 0.443 401 V N -3.803 116.065 119.914 -0.078 0.000 3.590 401 V HA 0.108 4.227 4.120 -0.001 0.000 0.265 401 V C 2.059 178.146 176.094 -0.011 0.000 1.239 401 V CA 1.188 63.479 62.300 -0.015 0.000 1.117 401 V CB -0.627 31.235 31.823 0.065 0.000 0.818 401 V HN 0.469 8.659 8.190 0.000 0.000 0.451 402 M N 1.124 120.710 119.600 -0.023 0.000 2.143 402 M HA -0.196 4.283 4.480 -0.001 0.000 0.258 402 M C 1.817 178.106 176.300 -0.018 0.000 1.071 402 M CA 2.307 57.598 55.300 -0.016 0.000 1.088 402 M CB -0.026 32.559 32.600 -0.025 0.000 1.360 402 M HN 0.495 8.785 8.290 0.000 0.000 0.404 403 S N 0.122 115.805 115.700 -0.028 0.000 2.557 403 S HA 0.311 4.780 4.470 -0.001 0.000 0.223 403 S C 0.280 174.868 174.600 -0.021 0.000 0.969 403 S CA -0.356 57.829 58.200 -0.025 0.000 0.927 403 S CB -0.085 63.095 63.200 -0.032 0.000 0.806 403 S HN 0.308 8.618 8.310 0.000 0.000 0.489 404 L N 3.356 124.568 121.223 -0.018 0.000 2.455 404 L HA 0.201 4.540 4.340 -0.001 0.000 0.272 404 L C 0.510 177.375 176.870 -0.009 0.000 1.174 404 L CA 0.110 54.943 54.840 -0.013 0.000 0.869 404 L CB 0.225 42.280 42.059 -0.007 0.000 1.130 404 L HN 0.332 8.562 8.230 0.000 0.000 0.474 405 Q N 2.142 121.937 119.800 -0.009 0.000 2.397 405 Q HA 0.548 4.887 4.340 -0.001 0.000 0.275 405 Q C 0.191 176.188 176.000 -0.004 0.000 1.090 405 Q CA -0.601 55.198 55.803 -0.007 0.000 0.809 405 Q CB 2.107 30.840 28.738 -0.008 0.000 1.362 405 Q HN 0.747 9.017 8.270 0.000 0.000 0.431 406 G N 2.223 111.022 108.800 -0.003 0.000 2.372 406 G HA2 -0.240 3.719 3.960 -0.001 0.000 0.297 406 G HA3 -0.240 3.719 3.960 -0.001 0.000 0.297 406 G C -0.416 174.485 174.900 0.002 0.000 1.005 406 G CA 0.318 45.418 45.100 -0.001 0.000 1.173 406 G HN 0.483 8.773 8.290 0.000 0.000 0.511 407 L N -0.765 120.460 121.223 0.004 0.000 2.421 407 L HA 0.616 4.955 4.340 -0.001 0.000 0.263 407 L C 1.328 178.206 176.870 0.013 0.000 1.122 407 L CA -0.824 54.022 54.840 0.010 0.000 0.804 407 L CB 0.815 42.882 42.059 0.013 0.000 1.150 407 L HN 0.269 8.499 8.230 0.000 0.000 0.457 408 R N 0.324 120.835 120.500 0.019 0.000 2.643 408 R HA 0.266 4.606 4.340 -0.001 0.000 0.272 408 R C -0.566 175.752 176.300 0.030 0.000 0.995 408 R CA -0.818 55.295 56.100 0.021 0.000 1.032 408 R CB 1.406 31.718 30.300 0.021 0.000 1.126 408 R HN 0.636 8.906 8.270 0.000 0.000 0.505 409 E N 1.373 121.590 120.200 0.027 0.000 2.418 409 E HA -0.032 4.317 4.350 -0.001 0.000 0.261 409 E C -0.401 176.227 176.600 0.047 0.000 1.070 409 E CA -0.533 55.886 56.400 0.033 0.000 0.931 409 E CB 0.502 30.216 29.700 0.024 0.000 0.954 409 E HN 0.392 8.752 8.360 0.000 0.000 0.439 410 K N -0.209 120.227 120.400 0.061 0.000 3.069 410 K HA -0.188 4.132 4.320 -0.001 0.000 0.267 410 K C -0.910 175.750 176.600 0.101 0.000 1.082 410 K CA 1.422 57.757 56.287 0.081 0.000 0.782 410 K CB -2.078 30.460 32.500 0.064 0.000 1.230 410 K HN 0.837 9.087 8.250 0.000 0.000 0.488 411 T N -3.173 111.442 114.554 0.101 0.000 2.948 411 T HA 0.566 4.915 4.350 -0.001 0.000 0.285 411 T C 1.513 176.292 174.700 0.131 0.000 1.019 411 T CA -0.579 61.582 62.100 0.101 0.000 1.013 411 T CB 1.246 70.153 68.868 0.066 0.000 1.117 411 T HN 0.060 8.300 8.240 0.000 0.000 0.533 412 I N 0.771 121.395 120.570 0.090 0.000 2.546 412 I HA 0.086 4.255 4.170 -0.001 0.000 0.255 412 I C 2.620 178.783 176.117 0.075 0.000 1.163 412 I CA 1.023 62.352 61.300 0.048 0.000 1.457 412 I CB -0.481 37.450 38.000 -0.116 0.000 1.092 412 I HN 0.970 9.180 8.210 0.000 0.000 0.434 413 G N 0.736 109.567 108.800 0.052 0.000 2.402 413 G HA2 -0.292 3.668 3.960 -0.001 0.000 0.216 413 G HA3 -0.292 3.668 3.960 -0.001 0.000 0.216 413 G C 1.660 176.600 174.900 0.067 0.000 1.162 413 G CA 0.816 45.944 45.100 0.047 0.000 0.777 413 G HN 0.211 8.501 8.290 0.000 0.000 0.539 414 K N -0.311 120.136 120.400 0.079 0.000 2.062 414 K HA -0.053 4.266 4.320 -0.001 0.000 0.205 414 K C 2.051 178.697 176.600 0.077 0.000 1.051 414 K CA 0.880 57.206 56.287 0.065 0.000 0.941 414 K CB -0.646 31.891 32.500 0.061 0.000 0.719 414 K HN 0.328 8.578 8.250 0.000 0.000 0.440 415 Y N 0.569 120.880 120.300 0.018 0.000 2.070 415 Y HA -0.260 4.290 4.550 -0.001 0.000 0.280 415 Y C 2.030 177.921 175.900 -0.015 0.000 1.148 415 Y CA 2.409 60.517 58.100 0.014 0.000 1.125 415 Y CB -0.834 37.692 38.460 0.110 0.000 0.975 415 Y HN 0.125 8.405 8.280 0.000 0.000 0.492 416 A N 0.221 123.131 122.820 0.150 0.000 1.917 416 A HA -0.291 4.029 4.320 -0.001 0.000 0.219 416 A C 2.272 179.884 177.584 0.047 0.000 1.182 416 A CA 2.228 54.340 52.037 0.125 0.000 0.633 416 A CB -0.906 18.248 19.000 0.256 0.000 0.819 416 A HN 0.599 8.749 8.150 0.000 0.000 0.448 417 K N 0.343 120.757 120.400 0.023 0.000 2.026 417 K HA -0.147 4.173 4.320 -0.001 0.000 0.208 417 K C 2.100 178.666 176.600 -0.057 0.000 1.048 417 K CA 1.962 58.255 56.287 0.009 0.000 0.929 417 K CB -0.241 32.263 32.500 0.006 0.000 0.713 417 K HN 0.577 8.827 8.250 0.000 0.000 0.439 418 S N -0.467 115.158 115.700 -0.126 0.000 2.522 418 S HA -0.053 4.416 4.470 -0.001 0.000 0.227 418 S C 1.739 176.175 174.600 -0.274 0.000 0.986 418 S CA 0.792 58.895 58.200 -0.162 0.000 0.929 418 S CB 0.166 63.281 63.200 -0.143 0.000 0.769 418 S HN 0.368 8.678 8.310 0.000 0.000 0.529 419 E N 0.960 120.890 120.200 -0.449 0.000 2.086 419 E HA 0.156 4.505 4.350 -0.001 0.000 0.190 419 E C 0.766 177.005 176.600 -0.603 0.000 0.975 419 E CA 0.931 56.904 56.400 -0.713 0.000 0.813 419 E CB -0.167 28.799 29.700 -1.223 0.000 0.768 419 E HN 0.582 8.942 8.360 0.000 0.000 0.457 420 F N -0.380 119.522 119.950 -0.081 0.000 2.724 420 F HA 0.287 4.813 4.527 -0.001 0.000 0.306 420 F C 0.326 176.109 175.800 -0.028 0.000 1.100 420 F CA -0.279 57.700 58.000 -0.034 0.000 1.255 420 F CB 0.588 39.579 39.000 -0.015 0.000 1.072 420 F HN -0.129 8.171 8.300 0.000 0.000 0.589 421 D N 1.494 121.951 120.400 0.095 0.000 2.479 421 D HA 0.199 4.838 4.640 -0.001 0.000 0.247 421 D C -0.180 176.129 176.300 0.014 0.000 1.119 421 D CA -0.022 54.009 54.000 0.052 0.000 0.922 421 D CB 0.284 41.104 40.800 0.033 0.000 1.014 421 D HN -0.174 8.196 8.370 0.000 0.000 0.510 422 K N 0.000 120.412 120.400 0.020 0.000 2.780 422 K HA 0.000 4.319 4.320 -0.001 0.000 0.191 422 K CA 0.000 56.289 56.287 0.003 0.000 0.838 422 K CB 0.000 32.500 32.500 -0.000 0.000 1.064 422 K HN 0.000 8.250 8.250 0.000 0.000 0.543