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 2j46_1_A DATA FIRST_RESID 1 DATA SEQUENCE MFQQLSARLQ EAIGRLRGRG RITEEDLKAT LREIRRALMD ADVNLEVARD DATA SEQUENCE FVERVREEAL GKQVLESLTP AEVILATVYE ALKEALGGEA RLPVLKDRNL DATA SEQUENCE WFLVGLQGSG KTTTAAKLAL YYKGKGRRPL LVAADTQRPA AREQLRLLGE DATA SEQUENCE KVGVPVLEVM DGESPESIRR RVEEKARLEA RDLILVDTAG RLQIDEPLMG DATA SEQUENCE ELARLKEVLG PDEVLLVLDA MTGQEALSVA RAFDEKVGVT GLVLTKLDGD DATA SEQUENCE ARGGAALSAR HVTGKPIYFA GVSEKPEGLE PFYPERLAGR ILGMGD VARS RESID RESNAME ATOMNAME SS_SHIFT SHIFT RC_SHIFT HM_SHIFT EF_SHIFT SIGMA FORMAT %4d %4s %4s %9.3f %9.3f %9.3f %9.3f %9.3f %9.3f 1 M HA 0.000 4.484 4.480 0.007 0.000 0.227 1 M C 0.000 176.494 176.300 0.323 0.000 1.140 1 M CA 0.000 55.371 55.300 0.118 0.000 0.988 1 M CB 0.000 32.613 32.600 0.022 0.000 1.302 2 F N -7.756 112.198 119.950 0.007 0.000 2.656 2 F HA -0.464 4.192 4.527 -0.001 -0.129 0.381 2 F C 1.287 177.092 175.800 0.008 0.000 0.603 2 F CA 1.366 59.370 58.000 0.008 0.000 1.335 2 F CB -1.715 37.299 39.000 0.022 0.000 1.836 2 F HN 0.033 8.202 8.300 -0.219 0.000 0.290 3 Q N -0.696 119.190 119.800 0.144 0.000 2.062 3 Q HA -0.588 3.817 4.340 0.108 0.000 0.209 3 Q C 1.352 177.393 176.000 0.070 0.000 0.996 3 Q CA 4.527 60.388 55.803 0.096 0.000 0.859 3 Q CB -0.186 28.588 28.738 0.059 0.000 0.920 3 Q HN 0.331 8.616 8.270 0.117 0.056 0.415 4 Q N -1.490 118.334 119.800 0.041 0.000 2.079 4 Q HA -0.271 4.082 4.340 0.022 0.000 0.200 4 Q C 2.239 178.257 176.000 0.030 0.000 0.974 4 Q CA 3.352 59.168 55.803 0.022 0.000 0.840 4 Q CB -0.798 27.938 28.738 -0.003 0.000 0.898 4 Q HN -0.065 8.222 8.270 0.028 0.000 0.430 5 L N -0.882 120.367 121.223 0.043 0.000 2.017 5 L HA -0.326 4.027 4.340 0.022 0.000 0.208 5 L C 1.577 178.491 176.870 0.073 0.000 1.073 5 L CA 3.278 58.150 54.840 0.053 0.000 0.745 5 L CB -0.386 41.727 42.059 0.090 0.000 0.894 5 L HN -0.086 8.169 8.230 0.042 0.000 0.432 6 S N 0.161 115.925 115.700 0.107 0.000 2.359 6 S HA -0.348 4.269 4.470 0.085 -0.096 0.223 6 S C 2.283 176.917 174.600 0.058 0.000 1.039 6 S CA 3.714 61.966 58.200 0.086 0.000 1.042 6 S CB -0.693 62.562 63.200 0.092 0.000 0.915 6 S HN 0.016 8.408 8.310 0.137 0.000 0.439 7 A N 0.984 123.834 122.820 0.049 0.000 1.859 7 A HA -0.360 3.980 4.320 0.033 0.000 0.217 7 A C 2.027 179.629 177.584 0.030 0.000 1.198 7 A CA 3.237 55.294 52.037 0.034 0.000 0.629 7 A CB -0.852 18.165 19.000 0.028 0.000 0.830 7 A HN -0.247 7.935 8.150 0.054 0.000 0.446 8 R N -2.497 118.019 120.500 0.027 0.000 2.096 8 R HA -0.208 4.142 4.340 0.017 0.000 0.235 8 R C 2.957 179.271 176.300 0.025 0.000 1.127 8 R CA 2.080 58.191 56.100 0.019 0.000 0.968 8 R CB -0.491 29.814 30.300 0.009 0.000 0.861 8 R HN -0.374 7.913 8.270 0.028 0.000 0.440 9 L N -0.894 120.349 121.223 0.033 0.000 2.056 9 L HA -0.430 3.935 4.340 0.042 0.000 0.207 9 L C 1.909 178.807 176.870 0.047 0.000 1.078 9 L CA 3.277 58.144 54.840 0.045 0.000 0.749 9 L CB -0.510 41.585 42.059 0.060 0.000 0.901 9 L HN 0.285 8.537 8.230 0.036 0.000 0.433 10 Q N -1.564 118.261 119.800 0.042 0.000 2.124 10 Q HA -0.418 3.945 4.340 0.038 0.000 0.202 10 Q C 2.754 178.771 176.000 0.028 0.000 0.977 10 Q CA 3.710 59.535 55.803 0.035 0.000 0.850 10 Q CB -0.149 28.607 28.738 0.031 0.000 0.901 10 Q HN -0.056 8.239 8.270 0.043 0.000 0.429 11 E N -0.021 120.195 120.200 0.026 0.000 2.072 11 E HA -0.326 4.035 4.350 0.018 0.000 0.191 11 E C 2.191 178.804 176.600 0.022 0.000 0.985 11 E CA 2.821 59.233 56.400 0.021 0.000 0.801 11 E CB -0.315 29.396 29.700 0.017 0.000 0.750 11 E HN -0.142 8.234 8.360 0.026 0.000 0.452 12 A N -0.408 122.427 122.820 0.026 0.000 1.902 12 A HA -0.233 4.325 4.320 0.024 -0.224 0.217 12 A C 1.910 179.512 177.584 0.031 0.000 1.181 12 A CA 2.976 55.031 52.037 0.029 0.000 0.623 12 A CB -0.430 18.591 19.000 0.035 0.000 0.818 12 A HN -0.561 7.605 8.150 0.028 0.000 0.443 13 I N -2.402 118.189 120.570 0.036 0.000 2.252 13 I HA -0.491 3.700 4.170 0.035 0.000 0.245 13 I C 2.330 178.461 176.117 0.024 0.000 1.102 13 I CA 3.209 64.529 61.300 0.034 0.000 1.385 13 I CB 0.105 38.128 38.000 0.039 0.000 1.064 13 I HN -0.475 7.758 8.210 0.039 0.000 0.414 14 G N -1.429 107.383 108.800 0.021 0.000 2.432 14 G HA2 -0.314 3.654 3.960 0.014 0.000 0.219 14 G HA3 -0.314 3.654 3.960 0.013 0.000 0.219 14 G C 1.016 175.924 174.900 0.014 0.000 1.135 14 G CA 1.589 46.698 45.100 0.015 0.000 0.767 14 G HN -0.025 8.279 8.290 0.022 0.000 0.550 15 R N 2.062 122.571 120.500 0.015 0.000 2.127 15 R HA -0.312 4.035 4.340 0.011 0.000 0.238 15 R C 1.616 177.923 176.300 0.013 0.000 1.134 15 R CA 2.774 58.882 56.100 0.013 0.000 0.975 15 R CB -0.108 30.201 30.300 0.014 0.000 0.865 15 R HN -0.381 7.884 8.270 0.017 0.015 0.447 16 L N -5.339 115.892 121.223 0.014 0.000 2.478 16 L HA -0.111 4.236 4.340 0.013 0.000 0.223 16 L C -0.121 176.755 176.870 0.010 0.000 1.140 16 L CA 0.398 55.246 54.840 0.013 0.000 0.842 16 L CB -0.279 41.789 42.059 0.016 0.000 0.953 16 L HN -0.613 7.595 8.230 0.016 0.032 0.452 17 R N -0.758 119.748 120.500 0.009 0.000 2.539 17 R HA -0.097 4.246 4.340 0.006 0.000 0.275 17 R C 0.549 176.852 176.300 0.006 0.000 1.077 17 R CA 0.844 56.949 56.100 0.007 0.000 1.097 17 R CB 0.465 30.768 30.300 0.006 0.000 1.018 17 R HN -0.711 7.484 8.270 0.010 0.080 0.483 18 G N 1.624 110.427 108.800 0.004 0.000 2.176 18 G HA2 -0.249 3.713 3.960 0.003 0.000 0.252 18 G HA3 -0.249 3.713 3.960 0.003 0.000 0.252 18 G C 0.123 175.026 174.900 0.004 0.000 1.024 18 G CA 0.531 45.633 45.100 0.003 0.000 0.755 18 G HN 0.493 8.785 8.290 0.004 0.000 0.507 19 R N -1.537 118.966 120.500 0.004 0.000 2.509 19 R HA 0.158 4.501 4.340 0.004 0.000 0.297 19 R C 0.022 176.324 176.300 0.004 0.000 0.951 19 R CA -0.968 55.135 56.100 0.005 0.000 1.103 19 R CB 0.730 31.034 30.300 0.006 0.000 1.283 19 R HN 0.029 8.301 8.270 0.005 0.000 0.534 20 G N 0.132 108.934 108.800 0.004 0.000 2.601 20 G HA2 -0.329 3.633 3.960 0.003 0.000 0.252 20 G HA3 -0.329 3.632 3.960 0.003 0.000 0.252 20 G C -0.968 173.934 174.900 0.004 0.000 1.294 20 G CA -0.601 44.502 45.100 0.003 0.000 0.912 20 G HN -0.093 8.200 8.290 0.003 0.000 0.574 21 R N -0.191 120.311 120.500 0.004 0.000 2.679 21 R HA -0.042 4.431 4.340 0.005 -0.131 0.268 21 R C 0.058 176.361 176.300 0.005 0.000 1.044 21 R CA 0.489 56.592 56.100 0.004 0.000 1.105 21 R CB 0.630 30.932 30.300 0.004 0.000 0.989 21 R HN 0.024 8.296 8.270 0.003 0.000 0.447 22 I N -3.437 117.137 120.570 0.006 0.000 2.822 22 I HA 0.449 4.703 4.170 0.007 -0.080 0.312 22 I C -0.227 175.894 176.117 0.007 0.000 1.011 22 I CA -2.091 59.214 61.300 0.007 0.000 1.105 22 I CB 2.578 40.584 38.000 0.009 0.000 1.291 22 I HN 0.094 8.308 8.210 0.007 0.000 0.474 23 T N -0.807 113.752 114.554 0.007 0.000 2.881 23 T HA 0.298 4.652 4.350 0.006 0.000 0.278 23 T C 1.013 175.718 174.700 0.008 0.000 0.982 23 T CA -2.239 59.865 62.100 0.007 0.000 0.989 23 T CB 2.182 71.054 68.868 0.006 0.000 1.058 23 T HN 0.083 8.634 8.240 0.008 -0.307 0.529 24 E N 0.625 120.830 120.200 0.008 0.000 2.086 24 E HA -0.431 3.924 4.350 0.009 0.000 0.200 24 E C 2.281 178.887 176.600 0.010 0.000 1.012 24 E CA 4.305 60.710 56.400 0.008 0.000 0.812 24 E CB -0.356 29.348 29.700 0.007 0.000 0.743 24 E HN 0.566 8.931 8.360 0.007 0.000 0.453 25 E N -2.458 117.747 120.200 0.009 0.000 2.107 25 E HA -0.205 4.151 4.350 0.010 0.000 0.191 25 E C 2.449 179.056 176.600 0.011 0.000 0.982 25 E CA 2.642 59.047 56.400 0.009 0.000 0.809 25 E CB -0.702 29.003 29.700 0.008 0.000 0.756 25 E HN 0.178 8.542 8.360 0.008 0.000 0.459 26 D N 0.204 120.610 120.400 0.011 0.000 2.117 26 D HA -0.262 4.385 4.640 0.012 0.000 0.197 26 D C 2.103 178.412 176.300 0.015 0.000 0.987 26 D CA 3.204 57.212 54.000 0.012 0.000 0.829 26 D CB -0.327 40.479 40.800 0.011 0.000 0.961 26 D HN -0.465 7.911 8.370 0.010 0.000 0.460 27 L N -0.076 121.156 121.223 0.015 0.000 2.046 27 L HA -0.330 4.022 4.340 0.020 0.000 0.208 27 L C 1.253 178.136 176.870 0.021 0.000 1.077 27 L CA 3.185 58.036 54.840 0.018 0.000 0.747 27 L CB -0.131 41.938 42.059 0.016 0.000 0.896 27 L HN -0.340 7.898 8.230 0.013 0.000 0.432 28 K N -1.716 118.694 120.400 0.018 0.000 2.097 28 K HA -0.441 3.892 4.320 0.022 0.000 0.206 28 K C 2.180 178.792 176.600 0.021 0.000 1.049 28 K CA 3.646 59.944 56.287 0.019 0.000 0.933 28 K CB -0.408 32.102 32.500 0.016 0.000 0.717 28 K HN -0.316 7.943 8.250 0.016 0.000 0.442 29 A N -1.267 121.564 122.820 0.018 0.000 1.877 29 A HA -0.208 4.122 4.320 0.016 0.000 0.216 29 A C 2.190 179.787 177.584 0.022 0.000 1.186 29 A CA 3.238 55.286 52.037 0.018 0.000 0.620 29 A CB -0.864 18.144 19.000 0.015 0.000 0.822 29 A HN -0.305 7.854 8.150 0.016 0.000 0.443 30 T N 2.232 116.801 114.554 0.025 0.000 2.746 30 T HA -0.279 4.089 4.350 0.030 0.000 0.267 30 T C 1.912 176.637 174.700 0.041 0.000 1.039 30 T CA 4.959 67.078 62.100 0.032 0.000 1.142 30 T CB -0.371 68.517 68.868 0.033 0.000 0.866 30 T HN -0.558 7.697 8.240 0.024 0.000 0.444 31 L N 0.321 121.570 121.223 0.043 0.000 2.046 31 L HA -0.448 3.934 4.340 0.071 0.000 0.208 31 L C 1.887 178.786 176.870 0.049 0.000 1.077 31 L CA 3.566 58.439 54.840 0.055 0.000 0.747 31 L CB -0.690 41.399 42.059 0.049 0.000 0.896 31 L HN -0.217 8.035 8.230 0.037 0.000 0.432 32 R N -2.053 118.467 120.500 0.034 0.000 2.081 32 R HA -0.428 3.928 4.340 0.026 0.000 0.235 32 R C 2.243 178.556 176.300 0.021 0.000 1.131 32 R CA 3.860 59.975 56.100 0.025 0.000 0.960 32 R CB -0.461 29.849 30.300 0.018 0.000 0.856 32 R HN -0.223 8.065 8.270 0.030 0.000 0.436 33 E N 0.199 120.413 120.200 0.023 0.000 2.077 33 E HA -0.262 4.095 4.350 0.011 0.000 0.193 33 E C 2.477 179.087 176.600 0.017 0.000 0.989 33 E CA 2.958 59.369 56.400 0.018 0.000 0.800 33 E CB -0.141 29.571 29.700 0.020 0.000 0.746 33 E HN -0.502 7.873 8.360 0.025 0.000 0.452 34 I N -0.494 120.096 120.570 0.034 0.000 2.226 34 I HA -0.580 3.603 4.170 0.023 0.000 0.245 34 I C 1.448 177.564 176.117 -0.003 0.000 1.100 34 I CA 4.612 65.933 61.300 0.036 0.000 1.374 34 I CB -0.168 37.894 38.000 0.103 0.000 1.057 34 I HN -0.237 8.000 8.210 0.045 0.000 0.413 35 R N -0.347 120.163 120.500 0.016 0.000 2.083 35 R HA -0.471 3.859 4.340 -0.018 0.000 0.237 35 R C 2.209 178.490 176.300 -0.032 0.000 1.137 35 R CA 4.035 60.132 56.100 -0.006 0.000 0.951 35 R CB -0.195 30.115 30.300 0.015 0.000 0.851 35 R HN -0.304 7.987 8.270 0.036 0.000 0.434 36 R N -2.271 118.218 120.500 -0.018 0.000 2.081 36 R HA -0.306 4.020 4.340 -0.025 0.000 0.235 36 R C 2.231 178.510 176.300 -0.035 0.000 1.131 36 R CA 3.324 59.410 56.100 -0.023 0.000 0.960 36 R CB -0.243 30.050 30.300 -0.011 0.000 0.856 36 R HN -0.312 7.954 8.270 -0.007 0.000 0.436 37 A N -0.151 122.648 122.820 -0.035 0.000 1.908 37 A HA -0.241 4.059 4.320 -0.032 0.000 0.218 37 A C 2.119 179.658 177.584 -0.074 0.000 1.181 37 A CA 3.031 55.042 52.037 -0.042 0.000 0.627 37 A CB -0.582 18.400 19.000 -0.031 0.000 0.818 37 A HN -0.276 7.858 8.150 -0.027 0.000 0.445 38 L N -2.697 118.457 121.223 -0.116 0.000 2.017 38 L HA -0.450 3.790 4.340 -0.167 0.000 0.208 38 L C 2.392 179.193 176.870 -0.114 0.000 1.073 38 L CA 3.079 57.822 54.840 -0.161 0.000 0.745 38 L CB -0.165 41.740 42.059 -0.257 0.000 0.894 38 L HN -0.424 7.735 8.230 -0.118 0.000 0.432 39 M N -1.003 118.545 119.600 -0.086 0.000 2.229 39 M HA -0.268 4.371 4.480 -0.074 -0.203 0.264 39 M C 3.000 179.263 176.300 -0.060 0.000 1.063 39 M CA 3.550 58.809 55.300 -0.068 0.000 1.114 39 M CB 0.009 32.579 32.600 -0.050 0.000 1.387 39 M HN -0.179 8.064 8.290 -0.079 0.000 0.420 40 D N 0.038 120.405 120.400 -0.055 0.000 2.219 40 D HA -0.141 4.472 4.640 -0.045 0.000 0.205 40 D C 0.938 177.201 176.300 -0.062 0.000 0.970 40 D CA 2.796 56.766 54.000 -0.049 0.000 0.851 40 D CB -0.562 40.215 40.800 -0.039 0.000 0.943 40 D HN -0.089 8.249 8.370 -0.053 0.000 0.488 41 A N -3.261 119.512 122.820 -0.077 0.000 2.278 41 A HA 0.018 4.276 4.320 -0.103 0.000 0.212 41 A C -1.322 176.195 177.584 -0.111 0.000 1.213 41 A CA 0.061 52.037 52.037 -0.101 0.000 0.840 41 A CB 0.034 18.970 19.000 -0.107 0.000 0.866 41 A HN -0.662 7.317 8.150 -0.078 0.125 0.489 42 D N -7.811 112.536 120.400 -0.089 0.000 3.070 42 D HA -0.364 4.295 4.640 -0.069 -0.060 0.210 42 D C -0.886 175.365 176.300 -0.083 0.000 1.103 42 D CA 1.322 55.274 54.000 -0.081 0.000 0.980 42 D CB -2.014 38.736 40.800 -0.084 0.000 1.100 42 D HN -0.342 7.789 8.370 -0.079 0.191 0.423 43 V N -0.800 119.058 119.914 -0.093 0.000 2.655 43 V HA -0.228 3.838 4.120 -0.091 0.000 0.300 43 V C 0.305 176.348 176.094 -0.084 0.000 1.044 43 V CA 1.200 63.442 62.300 -0.096 0.000 1.095 43 V CB 0.328 32.077 31.823 -0.122 0.000 0.952 43 V HN -0.606 7.477 8.190 -0.099 0.047 0.485 44 N N 7.321 125.971 118.700 -0.083 0.000 2.354 44 N HA -0.176 4.530 4.740 -0.057 0.000 0.246 44 N C 0.512 175.981 175.510 -0.069 0.000 1.285 44 N CA -0.328 52.681 53.050 -0.068 0.000 0.925 44 N CB 0.403 38.855 38.487 -0.059 0.000 1.174 44 N HN 0.363 8.689 8.380 -0.089 0.000 0.478 45 L N 0.655 121.850 121.223 -0.047 0.000 2.012 45 L HA -0.223 4.098 4.340 -0.033 0.000 0.210 45 L C 1.453 178.302 176.870 -0.035 0.000 1.073 45 L CA 3.195 58.015 54.840 -0.034 0.000 0.748 45 L CB -0.260 41.788 42.059 -0.019 0.000 0.891 45 L HN 0.241 8.447 8.230 -0.039 0.000 0.431 46 E N -1.519 118.656 120.200 -0.043 0.000 2.051 46 E HA -0.399 3.950 4.350 -0.001 0.000 0.192 46 E C 2.095 178.635 176.600 -0.100 0.000 0.991 46 E CA 3.264 59.644 56.400 -0.035 0.000 0.799 46 E CB -0.223 29.473 29.700 -0.007 0.000 0.748 46 E HN -0.471 7.933 8.360 -0.043 -0.069 0.449 47 V N 0.310 120.082 119.914 -0.236 0.000 2.343 47 V HA -0.386 3.377 4.120 -0.594 0.000 0.247 47 V C 2.139 178.178 176.094 -0.092 0.000 1.051 47 V CA 3.894 65.981 62.300 -0.357 0.000 1.036 47 V CB -0.482 31.106 31.823 -0.391 0.000 0.654 47 V HN -0.148 8.247 8.190 -0.216 -0.334 0.451 48 A N -1.207 121.573 122.820 -0.066 0.000 1.898 48 A HA -0.297 4.005 4.320 -0.030 0.000 0.216 48 A C 2.125 179.748 177.584 0.064 0.000 1.181 48 A CA 3.255 55.280 52.037 -0.019 0.000 0.620 48 A CB -0.689 18.276 19.000 -0.058 0.000 0.819 48 A HN -0.112 7.986 8.150 -0.087 0.000 0.442 49 R N -1.836 118.689 120.500 0.041 0.000 2.081 49 R HA -0.392 3.987 4.340 0.065 0.000 0.235 49 R C 2.377 178.734 176.300 0.094 0.000 1.131 49 R CA 3.697 59.834 56.100 0.062 0.000 0.960 49 R CB -0.226 30.098 30.300 0.040 0.000 0.856 49 R HN -0.098 8.179 8.270 0.012 0.000 0.436 50 D N -0.319 120.144 120.400 0.106 0.000 2.144 50 D HA -0.223 4.481 4.640 0.106 0.000 0.200 50 D C 2.092 178.480 176.300 0.147 0.000 0.978 50 D CA 3.281 57.360 54.000 0.133 0.000 0.833 50 D CB -0.470 40.454 40.800 0.207 0.000 0.961 50 D HN -0.446 7.973 8.370 0.082 0.000 0.470 51 F N 1.945 121.907 119.950 0.021 0.000 2.102 51 F HA -0.379 4.164 4.527 0.028 0.000 0.298 51 F C 1.098 176.909 175.800 0.018 0.000 1.105 51 F CA 3.369 61.381 58.000 0.020 0.000 1.239 51 F CB 0.347 39.353 39.000 0.009 0.000 0.991 51 F HN -0.336 8.144 8.300 0.300 0.000 0.474 52 V N -1.510 118.598 119.914 0.323 0.000 2.809 52 V HA -0.383 3.873 4.120 0.227 0.000 0.256 52 V C 1.274 177.413 176.094 0.075 0.000 1.080 52 V CA 2.688 65.109 62.300 0.201 0.000 1.102 52 V CB -0.518 31.411 31.823 0.178 0.000 0.705 52 V HN -0.325 8.055 8.190 0.316 0.000 0.475 53 E N 1.124 121.359 120.200 0.058 0.000 2.072 53 E HA -0.343 4.021 4.350 0.024 0.000 0.191 53 E C 1.808 178.399 176.600 -0.014 0.000 0.985 53 E CA 3.048 59.462 56.400 0.024 0.000 0.801 53 E CB -0.398 29.321 29.700 0.032 0.000 0.750 53 E HN -0.287 8.120 8.360 0.079 0.000 0.452 54 R N -0.507 119.962 120.500 -0.051 0.000 2.082 54 R HA -0.280 4.015 4.340 -0.075 0.000 0.234 54 R C 2.133 178.362 176.300 -0.118 0.000 1.136 54 R CA 2.491 58.527 56.100 -0.107 0.000 0.935 54 R CB -0.824 29.362 30.300 -0.190 0.000 0.842 54 R HN -0.507 7.738 8.270 -0.042 0.000 0.430 55 V N -0.182 119.639 119.914 -0.155 0.000 2.282 55 V HA -0.455 3.596 4.120 -0.116 0.000 0.249 55 V C 1.229 177.303 176.094 -0.034 0.000 1.057 55 V CA 3.802 66.042 62.300 -0.099 0.000 1.032 55 V CB -0.402 31.386 31.823 -0.057 0.000 0.645 55 V HN -0.454 7.612 8.190 -0.207 0.000 0.447 56 R N -0.561 119.933 120.500 -0.011 0.000 2.096 56 R HA -0.497 3.847 4.340 0.008 0.000 0.240 56 R C 2.140 178.436 176.300 -0.007 0.000 1.139 56 R CA 4.245 60.346 56.100 0.001 0.000 0.952 56 R CB -0.060 30.247 30.300 0.011 0.000 0.854 56 R HN 0.082 8.349 8.270 -0.005 0.000 0.436 57 E N -1.436 118.755 120.200 -0.016 0.000 2.051 57 E HA -0.380 3.964 4.350 -0.010 0.000 0.192 57 E C 2.673 179.262 176.600 -0.019 0.000 0.991 57 E CA 3.413 59.803 56.400 -0.016 0.000 0.799 57 E CB -0.247 29.441 29.700 -0.021 0.000 0.748 57 E HN -0.402 7.946 8.360 -0.020 0.000 0.449 58 E N -1.445 118.737 120.200 -0.030 0.000 2.106 58 E HA -0.264 4.072 4.350 -0.024 0.000 0.192 58 E C 2.398 178.989 176.600 -0.015 0.000 0.984 58 E CA 2.525 58.909 56.400 -0.028 0.000 0.806 58 E CB -0.417 29.257 29.700 -0.044 0.000 0.750 58 E HN -0.389 7.947 8.360 -0.040 0.000 0.458 59 A N -0.307 122.507 122.820 -0.011 0.000 1.898 59 A HA -0.231 4.090 4.320 0.002 0.000 0.216 59 A C 2.091 179.675 177.584 0.001 0.000 1.181 59 A CA 3.148 55.185 52.037 -0.000 0.000 0.620 59 A CB -0.538 18.465 19.000 0.006 0.000 0.819 59 A HN 0.207 8.349 8.150 -0.014 0.000 0.442 60 L N -2.515 118.707 121.223 -0.001 0.000 2.083 60 L HA -0.354 3.987 4.340 0.002 0.000 0.209 60 L C 2.962 179.831 176.870 -0.001 0.000 1.083 60 L CA 2.516 57.356 54.840 0.000 0.000 0.752 60 L CB -0.408 41.651 42.059 0.000 0.000 0.899 60 L HN -0.235 7.993 8.230 -0.002 0.000 0.433 61 G N -1.719 107.078 108.800 -0.004 0.000 2.448 61 G HA2 -0.257 3.699 3.960 -0.007 0.000 0.219 61 G HA3 -0.257 3.701 3.960 -0.004 0.000 0.219 61 G C 0.284 175.182 174.900 -0.003 0.000 1.127 61 G CA 1.457 46.554 45.100 -0.005 0.000 0.766 61 G HN -0.207 8.080 8.290 -0.006 0.000 0.552 62 K N -0.924 119.475 120.400 -0.001 0.000 2.469 62 K HA 0.081 4.401 4.320 0.000 0.000 0.201 62 K C -1.255 175.346 176.600 0.002 0.000 1.028 62 K CA -0.745 55.542 56.287 0.001 0.000 1.170 62 K CB -0.231 32.271 32.500 0.003 0.000 0.874 62 K HN -0.670 7.465 8.250 -0.002 0.113 0.507 63 Q N -3.201 116.600 119.800 0.001 0.000 2.452 63 Q HA -0.419 3.922 4.340 0.002 0.000 0.318 63 Q C 0.225 176.227 176.000 0.004 0.000 1.386 63 Q CA 0.671 56.475 55.803 0.002 0.000 0.872 63 Q CB -2.906 25.833 28.738 0.001 0.000 1.151 63 Q HN -0.310 7.784 8.270 0.001 0.177 0.417 64 V N -0.750 119.167 119.914 0.005 0.000 2.392 64 V HA -0.400 3.725 4.120 0.007 0.000 0.249 64 V C 0.943 177.041 176.094 0.007 0.000 1.059 64 V CA 2.998 65.302 62.300 0.007 0.000 1.051 64 V CB 0.015 31.844 31.823 0.009 0.000 0.658 64 V HN -0.497 7.696 8.190 0.005 0.000 0.455 65 L N -5.172 116.054 121.223 0.006 0.000 2.376 65 L HA -0.196 4.148 4.340 0.007 0.000 0.219 65 L C 1.041 177.914 176.870 0.005 0.000 1.133 65 L CA 1.793 56.637 54.840 0.006 0.000 0.816 65 L CB -0.565 41.497 42.059 0.005 0.000 0.933 65 L HN -0.104 8.102 8.230 0.005 0.027 0.449 66 E N -5.575 114.628 120.200 0.004 0.000 2.452 66 E HA 0.110 4.462 4.350 0.003 0.000 0.197 66 E C -0.381 176.221 176.600 0.003 0.000 1.022 66 E CA -0.237 56.164 56.400 0.003 0.000 0.890 66 E CB 0.755 30.456 29.700 0.002 0.000 0.918 66 E HN -0.364 7.860 8.360 0.004 0.138 0.496 67 S N 0.885 116.587 115.700 0.003 0.000 2.564 67 S HA -0.038 4.433 4.470 0.002 0.000 0.278 67 S C 0.899 175.500 174.600 0.003 0.000 1.333 67 S CA 0.179 58.381 58.200 0.003 0.000 1.048 67 S CB 0.162 63.365 63.200 0.004 0.000 0.900 67 S HN -0.796 7.410 8.310 0.004 0.106 0.505 68 L N 2.175 123.399 121.223 0.002 0.000 2.465 68 L HA 0.039 4.381 4.340 0.002 0.000 0.224 68 L C 0.357 177.228 176.870 0.002 0.000 1.145 68 L CA 1.237 56.078 54.840 0.002 0.000 0.834 68 L CB 0.214 42.273 42.059 0.000 0.000 0.944 68 L HN 0.492 8.723 8.230 0.001 0.000 0.451 69 T N -6.091 108.465 114.554 0.002 0.000 3.504 69 T HA 0.466 4.818 4.350 0.003 0.000 0.286 69 T C -1.289 173.414 174.700 0.005 0.000 1.530 69 T CA -3.227 58.874 62.100 0.002 0.000 1.652 69 T CB 0.422 69.290 68.868 -0.000 0.000 0.895 69 T HN -0.518 7.687 8.240 0.002 0.037 0.674 70 P HA -0.155 4.271 4.420 0.009 0.000 0.218 70 P C 0.975 178.283 177.300 0.013 0.000 1.148 70 P CA 2.194 65.299 63.100 0.010 0.000 0.822 70 P CB -0.117 31.590 31.700 0.010 0.000 0.784 71 A N -2.144 120.683 122.820 0.012 0.000 1.948 71 A HA -0.306 4.026 4.320 0.019 0.000 0.220 71 A C 2.225 179.817 177.584 0.015 0.000 1.177 71 A CA 3.219 55.265 52.037 0.015 0.000 0.636 71 A CB -0.854 18.153 19.000 0.012 0.000 0.815 71 A HN 0.473 8.620 8.150 0.010 0.009 0.449 72 E N -2.061 118.144 120.200 0.008 0.000 2.106 72 E HA -0.236 4.115 4.350 0.002 0.000 0.192 72 E C 2.505 179.111 176.600 0.010 0.000 0.984 72 E CA 2.369 58.771 56.400 0.004 0.000 0.806 72 E CB -0.598 29.100 29.700 -0.004 0.000 0.750 72 E HN -0.522 7.834 8.360 0.006 0.008 0.458 73 V N 1.014 120.935 119.914 0.012 0.000 2.295 73 V HA -0.404 3.725 4.120 0.015 0.000 0.246 73 V C 2.133 178.242 176.094 0.025 0.000 1.049 73 V CA 4.015 66.324 62.300 0.016 0.000 1.024 73 V CB -0.608 31.222 31.823 0.012 0.000 0.648 73 V HN -0.774 7.422 8.190 0.010 0.000 0.447 74 I N -0.282 120.305 120.570 0.029 0.000 2.226 74 I HA -0.253 3.941 4.170 0.040 0.000 0.245 74 I C 2.602 178.754 176.117 0.058 0.000 1.100 74 I CA 1.879 63.204 61.300 0.042 0.000 1.374 74 I CB -1.200 36.825 38.000 0.043 0.000 1.057 74 I HN -0.301 7.924 8.210 0.025 0.000 0.413 75 L N 0.734 121.987 121.223 0.049 0.000 1.990 75 L HA -0.449 3.936 4.340 0.076 0.000 0.213 75 L C 1.591 178.514 176.870 0.088 0.000 1.072 75 L CA 3.685 58.560 54.840 0.060 0.000 0.755 75 L CB -0.802 41.271 42.059 0.024 0.000 0.889 75 L HN 0.002 8.255 8.230 0.037 0.000 0.432 76 A N -3.618 119.241 122.820 0.065 0.000 1.933 76 A HA -0.365 4.029 4.320 0.124 0.000 0.218 76 A C 1.800 179.462 177.584 0.130 0.000 1.175 76 A CA 3.166 55.263 52.037 0.100 0.000 0.628 76 A CB -0.483 18.550 19.000 0.055 0.000 0.814 76 A HN -0.132 8.043 8.150 0.043 0.000 0.444 77 T N -2.171 112.424 114.554 0.069 0.000 2.942 77 T HA -0.226 4.128 4.350 0.007 0.000 0.265 77 T C 1.919 176.617 174.700 -0.004 0.000 1.062 77 T CA 3.283 65.394 62.100 0.018 0.000 1.139 77 T CB -0.313 68.552 68.868 -0.006 0.000 0.883 77 T HN -0.499 7.776 8.240 0.057 0.000 0.468 78 V N 3.047 123.002 119.914 0.068 0.000 2.358 78 V HA -0.382 3.778 4.120 0.068 0.000 0.246 78 V C 1.242 177.427 176.094 0.151 0.000 1.047 78 V CA 4.599 66.976 62.300 0.129 0.000 1.035 78 V CB -0.818 31.132 31.823 0.213 0.000 0.658 78 V HN -0.101 8.142 8.190 0.089 0.000 0.452 79 Y N 1.249 121.571 120.300 0.037 0.000 2.128 79 Y HA -0.525 4.054 4.550 0.049 0.000 0.284 79 Y C 1.090 176.991 175.900 0.000 0.000 1.154 79 Y CA 3.697 61.814 58.100 0.027 0.000 1.149 79 Y CB -0.199 38.265 38.460 0.008 0.000 0.976 79 Y HN -0.129 8.318 8.280 0.278 0.000 0.505 80 E N -0.718 119.384 120.200 -0.164 0.000 2.077 80 E HA -0.438 3.657 4.350 -0.426 0.000 0.193 80 E C 2.035 178.481 176.600 -0.258 0.000 0.989 80 E CA 2.601 58.841 56.400 -0.267 0.000 0.800 80 E CB -0.655 28.979 29.700 -0.111 0.000 0.746 80 E HN -0.371 8.009 8.360 0.034 0.000 0.452 81 A N -0.702 121.953 122.820 -0.276 0.000 1.930 81 A HA -0.159 3.936 4.320 -0.374 0.000 0.217 81 A C 2.196 179.663 177.584 -0.196 0.000 1.175 81 A CA 2.857 54.621 52.037 -0.455 0.000 0.627 81 A CB -0.467 17.895 19.000 -1.063 0.000 0.815 81 A HN -0.481 7.521 8.150 -0.246 0.000 0.443 82 L N -1.704 119.543 121.223 0.039 0.000 2.017 82 L HA -0.505 4.098 4.340 0.439 0.000 0.208 82 L C 1.907 178.787 176.870 0.017 0.000 1.073 82 L CA 3.081 58.047 54.840 0.210 0.000 0.745 82 L CB -0.432 41.733 42.059 0.178 0.000 0.894 82 L HN 0.022 8.263 8.230 0.017 0.000 0.432 83 K N -0.263 120.029 120.400 -0.179 0.000 2.020 83 K HA -0.460 3.758 4.320 -0.170 0.000 0.212 83 K C 2.233 178.778 176.600 -0.092 0.000 1.050 83 K CA 3.601 59.765 56.287 -0.205 0.000 0.929 83 K CB -0.200 32.071 32.500 -0.381 0.000 0.714 83 K HN -0.192 7.879 8.250 -0.299 0.000 0.443 84 E N -1.147 118.995 120.200 -0.096 0.000 2.085 84 E HA -0.398 3.923 4.350 -0.047 0.000 0.194 84 E C 2.582 179.197 176.600 0.024 0.000 0.994 84 E CA 2.929 59.301 56.400 -0.047 0.000 0.801 84 E CB -0.282 29.376 29.700 -0.071 0.000 0.743 84 E HN -0.333 7.944 8.360 -0.139 0.000 0.453 85 A N -0.240 122.626 122.820 0.077 0.000 1.940 85 A HA -0.286 4.126 4.320 0.154 0.000 0.219 85 A C 1.518 179.184 177.584 0.135 0.000 1.176 85 A CA 3.108 55.238 52.037 0.155 0.000 0.631 85 A CB -0.359 18.806 19.000 0.274 0.000 0.814 85 A HN -0.133 8.061 8.150 0.072 0.000 0.446 86 L N -8.360 112.943 121.223 0.132 0.000 2.554 86 L HA -0.047 4.417 4.340 0.207 0.000 0.226 86 L C 0.693 177.685 176.870 0.203 0.000 1.137 86 L CA 0.259 55.218 54.840 0.197 0.000 0.863 86 L CB 0.286 42.482 42.059 0.230 0.000 0.985 86 L HN -0.611 7.562 8.230 0.107 0.121 0.451 87 G N -5.180 103.677 108.800 0.095 0.000 2.425 87 G HA2 -0.157 3.855 3.960 0.086 0.000 0.177 87 G HA3 -0.157 3.827 3.960 0.041 0.000 0.177 87 G C -0.158 174.746 174.900 0.008 0.000 0.999 87 G CA -0.449 44.685 45.100 0.057 0.000 0.723 87 G HN -0.409 7.643 8.290 0.067 0.278 0.491 88 G N 2.301 111.090 108.800 -0.018 0.000 2.609 88 G HA2 -0.506 3.433 3.960 -0.035 0.000 0.288 88 G HA3 -0.506 3.475 3.960 -0.065 -0.061 0.288 88 G C -2.091 172.781 174.900 -0.048 0.000 1.211 88 G CA -0.041 45.033 45.100 -0.044 0.000 0.963 88 G HN 0.138 8.417 8.290 -0.019 0.000 0.541 89 E N 3.258 123.441 120.200 -0.028 0.000 2.366 89 E HA 0.009 4.348 4.350 -0.018 0.000 0.266 89 E C -0.626 175.968 176.600 -0.010 0.000 1.051 89 E CA -1.160 55.231 56.400 -0.015 0.000 0.884 89 E CB 1.212 30.911 29.700 -0.001 0.000 1.006 89 E HN -0.044 8.303 8.360 -0.021 0.000 0.417 90 A N 3.302 126.124 122.820 0.003 0.000 2.498 90 A HA -0.043 4.240 4.320 -0.062 0.000 0.239 90 A C -0.228 177.364 177.584 0.015 0.000 1.068 90 A CA 0.836 52.866 52.037 -0.011 0.000 0.766 90 A CB 0.670 19.707 19.000 0.061 0.000 1.003 90 A HN 0.068 8.233 8.150 0.024 0.000 0.497 91 R N 2.370 122.884 120.500 0.023 0.000 2.725 91 R HA 0.298 4.688 4.340 0.082 0.000 0.277 91 R C -1.968 174.417 176.300 0.140 0.000 0.987 91 R CA -1.017 55.152 56.100 0.115 0.000 0.901 91 R CB 3.405 33.817 30.300 0.185 0.000 1.207 91 R HN 0.403 8.674 8.270 0.002 0.000 0.463 92 L N 0.672 121.867 121.223 -0.047 0.000 2.350 92 L HA 0.487 4.404 4.340 -0.706 0.000 0.260 92 L C -2.357 173.973 176.870 -0.900 0.000 1.015 92 L CA -3.655 50.886 54.840 -0.497 0.000 0.821 92 L CB 1.906 43.836 42.059 -0.214 0.000 1.370 92 L HN 0.078 8.291 8.230 -0.028 0.000 0.416 93 P HA -0.103 3.705 4.420 -1.020 0.000 0.269 93 P C -1.287 175.851 177.300 -0.269 0.000 1.209 93 P CA -0.572 61.965 63.100 -0.939 0.000 0.776 93 P CB 0.131 31.102 31.700 -1.214 0.000 0.876 94 V N 2.178 122.012 119.914 -0.132 0.000 2.521 94 V HA -0.153 3.990 4.120 0.037 0.000 0.286 94 V C 0.001 176.199 176.094 0.174 0.000 1.034 94 V CA 0.415 62.735 62.300 0.033 0.000 1.045 94 V CB 0.303 32.144 31.823 0.030 0.000 0.974 94 V HN -0.183 8.033 8.190 -0.173 -0.130 0.480 95 L N 8.150 129.476 121.223 0.172 0.000 2.289 95 L HA 0.139 4.750 4.340 0.200 -0.151 0.285 95 L C -0.384 176.540 176.870 0.090 0.000 1.049 95 L CA -0.490 54.443 54.840 0.155 0.000 0.804 95 L CB 0.706 42.840 42.059 0.124 0.000 1.195 95 L HN 0.198 8.514 8.230 0.144 0.000 0.428 96 K N 3.704 124.144 120.400 0.066 0.000 2.208 96 K HA 0.342 4.684 4.320 0.037 0.000 0.240 96 K C -0.300 176.303 176.600 0.005 0.000 1.088 96 K CA -2.068 54.242 56.287 0.038 0.000 0.902 96 K CB 1.414 33.940 32.500 0.044 0.000 1.355 96 K HN 0.518 9.199 8.250 0.068 -0.389 0.526 97 D N -1.260 119.140 120.400 0.000 0.000 2.117 97 D HA -0.222 4.410 4.640 -0.013 0.000 0.197 97 D C 0.028 176.306 176.300 -0.036 0.000 0.987 97 D CA 2.206 56.197 54.000 -0.014 0.000 0.829 97 D CB 0.295 41.090 40.800 -0.008 0.000 0.961 97 D HN 0.283 8.657 8.370 0.006 0.000 0.460 98 R N -3.600 116.879 120.500 -0.036 0.000 2.750 98 R HA 0.268 4.713 4.340 -0.092 -0.160 0.281 98 R C -1.696 174.564 176.300 -0.067 0.000 0.972 98 R CA -0.940 55.122 56.100 -0.063 0.000 0.912 98 R CB 3.128 33.401 30.300 -0.045 0.000 1.187 98 R HN -0.499 7.759 8.270 -0.021 0.000 0.464 99 N N 0.675 119.288 118.700 -0.146 0.000 2.287 99 N HA 0.275 5.136 4.740 -0.032 -0.141 0.289 99 N C -2.364 172.989 175.510 -0.263 0.000 1.066 99 N CA -0.516 52.416 53.050 -0.197 0.000 0.841 99 N CB 4.084 42.301 38.487 -0.450 0.000 1.599 99 N HN -0.006 8.266 8.380 -0.180 0.000 0.476 100 L N 3.103 124.280 121.223 -0.077 0.000 2.404 100 L HA 0.595 5.064 4.340 -0.091 -0.183 0.272 100 L C -2.768 174.281 176.870 0.298 0.000 0.980 100 L CA -0.723 54.126 54.840 0.014 0.000 0.836 100 L CB 2.886 44.987 42.059 0.069 0.000 1.238 100 L HN 0.568 9.188 8.230 0.076 -0.343 0.408 101 W N 3.634 124.983 121.300 0.081 0.000 2.736 101 W HA 0.661 5.530 4.660 0.061 -0.172 0.335 101 W C -1.299 175.398 176.519 0.296 0.000 1.059 101 W CA -3.746 53.664 57.345 0.109 0.000 1.226 101 W CB 2.683 32.177 29.460 0.056 0.000 1.416 101 W HN 0.853 9.138 8.180 0.175 0.000 0.505 102 F N -0.316 119.773 119.950 0.231 0.000 2.379 102 F HA 0.420 5.163 4.527 0.124 -0.142 0.332 102 F C -0.534 175.336 175.800 0.118 0.000 1.096 102 F CA -2.763 55.321 58.000 0.139 0.000 1.105 102 F CB 1.639 40.697 39.000 0.097 0.000 1.189 102 F HN 0.372 8.943 8.300 0.452 0.000 0.515 103 L N 1.729 123.085 121.223 0.222 0.000 2.296 103 L HA 0.793 5.384 4.340 0.112 -0.184 0.286 103 L C -1.006 175.886 176.870 0.038 0.000 1.023 103 L CA -1.001 53.903 54.840 0.107 0.000 0.812 103 L CB 1.277 43.373 42.059 0.063 0.000 1.223 103 L HN 0.637 8.959 8.230 0.153 0.000 0.421 104 V N -2.972 116.924 119.914 -0.030 0.000 3.001 104 V HA 0.862 4.941 4.120 -0.068 0.000 0.314 104 V C -1.285 174.582 176.094 -0.379 0.000 1.099 104 V CA -3.773 58.439 62.300 -0.147 0.000 0.989 104 V CB 3.674 35.440 31.823 -0.095 0.000 1.040 104 V HN 0.400 8.562 8.190 -0.046 0.000 0.434 105 G N -0.885 107.619 108.800 -0.494 0.000 2.368 105 G HA2 0.028 3.793 3.960 -0.324 0.000 0.302 105 G HA3 0.028 3.488 3.960 -0.833 0.000 0.302 105 G C -2.196 172.666 174.900 -0.064 0.000 1.329 105 G CA -0.170 44.655 45.100 -0.458 0.000 0.935 105 G HN -0.193 7.900 8.290 -0.327 0.000 0.590 106 L N -1.065 120.167 121.223 0.015 0.000 2.436 106 L HA 0.077 4.592 4.340 0.135 -0.093 0.265 106 L C 0.252 177.143 176.870 0.034 0.000 1.168 106 L CA -0.474 54.416 54.840 0.082 0.000 0.815 106 L CB 1.009 43.119 42.059 0.085 0.000 1.109 106 L HN 0.360 8.578 8.230 -0.020 0.000 0.462 107 Q N 1.995 121.820 119.800 0.041 0.000 2.300 107 Q HA -0.333 4.016 4.340 0.014 0.000 0.280 107 Q C 0.881 176.890 176.000 0.015 0.000 1.033 107 Q CA 1.704 57.520 55.803 0.022 0.000 0.903 107 Q CB 0.526 29.277 28.738 0.022 0.000 1.195 107 Q HN -0.159 8.110 8.270 0.054 0.034 0.386 108 G N 4.366 113.170 108.800 0.007 0.000 2.234 108 G HA2 -0.414 3.550 3.960 0.006 0.000 0.235 108 G HA3 -0.414 3.547 3.960 0.003 0.000 0.235 108 G C 0.254 175.153 174.900 -0.002 0.000 0.997 108 G CA 0.452 45.554 45.100 0.004 0.000 0.623 108 G HN 0.570 8.862 8.290 0.005 0.000 0.514 109 S N 1.222 116.918 115.700 -0.007 0.000 2.507 109 S HA -0.174 4.286 4.470 -0.017 0.000 0.235 109 S C 1.126 175.716 174.600 -0.018 0.000 0.988 109 S CA 1.134 59.323 58.200 -0.018 0.000 0.944 109 S CB 0.314 63.492 63.200 -0.036 0.000 0.762 109 S HN -0.435 7.785 8.310 -0.005 0.087 0.526 110 G N 1.975 110.768 108.800 -0.012 0.000 2.143 110 G HA2 -0.442 3.512 3.960 -0.009 0.000 0.249 110 G HA3 -0.442 3.514 3.960 -0.007 0.000 0.249 110 G C 0.206 175.098 174.900 -0.014 0.000 0.981 110 G CA 0.553 45.647 45.100 -0.010 0.000 0.665 110 G HN -0.397 7.784 8.290 -0.009 0.104 0.528 111 K N 0.309 120.697 120.400 -0.020 0.000 2.032 111 K HA -0.369 3.936 4.320 -0.025 0.000 0.209 111 K C 1.135 177.727 176.600 -0.013 0.000 1.048 111 K CA 3.941 60.215 56.287 -0.023 0.000 0.927 111 K CB -0.001 32.479 32.500 -0.033 0.000 0.712 111 K HN -0.754 7.455 8.250 -0.021 0.028 0.441 112 T N -0.868 113.680 114.554 -0.010 0.000 2.777 112 T HA -0.251 4.210 4.350 -0.008 -0.116 0.266 112 T C 2.103 176.800 174.700 -0.005 0.000 1.040 112 T CA 4.601 66.697 62.100 -0.007 0.000 1.141 112 T CB -0.830 68.034 68.868 -0.007 0.000 0.868 112 T HN 0.324 8.558 8.240 -0.010 0.000 0.444 113 T N 2.422 116.973 114.554 -0.005 0.000 2.684 113 T HA -0.332 4.017 4.350 -0.001 0.000 0.267 113 T C 1.596 176.292 174.700 -0.006 0.000 1.036 113 T CA 5.173 67.271 62.100 -0.003 0.000 1.148 113 T CB -0.873 67.994 68.868 -0.001 0.000 0.863 113 T HN 0.015 8.252 8.240 -0.005 0.000 0.436 114 T N 4.095 118.642 114.554 -0.011 0.000 2.720 114 T HA -0.415 3.917 4.350 -0.031 0.000 0.268 114 T C 1.180 175.867 174.700 -0.022 0.000 1.037 114 T CA 4.872 66.958 62.100 -0.023 0.000 1.144 114 T CB -0.558 68.296 68.868 -0.024 0.000 0.864 114 T HN -0.140 8.093 8.240 -0.011 0.000 0.444 115 A N 0.178 122.996 122.820 -0.003 0.000 1.883 115 A HA -0.304 4.031 4.320 0.025 0.000 0.217 115 A C 1.582 179.174 177.584 0.013 0.000 1.186 115 A CA 3.152 55.197 52.037 0.013 0.000 0.624 115 A CB -1.035 17.973 19.000 0.014 0.000 0.822 115 A HN -0.305 7.844 8.150 -0.003 0.000 0.444 116 A N -2.430 120.394 122.820 0.007 0.000 1.902 116 A HA -0.305 4.023 4.320 0.013 0.000 0.217 116 A C 2.193 179.787 177.584 0.016 0.000 1.181 116 A CA 3.153 55.196 52.037 0.011 0.000 0.623 116 A CB -0.773 18.231 19.000 0.007 0.000 0.818 116 A HN -0.531 7.621 8.150 0.003 0.000 0.443 117 K N -1.473 118.930 120.400 0.005 0.000 2.097 117 K HA -0.287 4.046 4.320 0.021 0.000 0.206 117 K C 2.322 178.926 176.600 0.008 0.000 1.049 117 K CA 3.141 59.431 56.287 0.005 0.000 0.933 117 K CB -0.062 32.431 32.500 -0.012 0.000 0.717 117 K HN -0.468 7.780 8.250 -0.003 0.000 0.442 118 L N -0.820 120.390 121.223 -0.022 0.000 2.093 118 L HA -0.298 3.979 4.340 -0.105 0.000 0.208 118 L C 0.614 177.593 176.870 0.182 0.000 1.085 118 L CA 2.665 57.501 54.840 -0.007 0.000 0.755 118 L CB -0.347 41.680 42.059 -0.054 0.000 0.904 118 L HN -0.014 8.198 8.230 -0.031 0.000 0.435 119 A N -0.662 122.226 122.820 0.114 0.000 1.877 119 A HA -0.312 4.086 4.320 0.130 0.000 0.216 119 A C 1.947 179.593 177.584 0.102 0.000 1.186 119 A CA 3.216 55.316 52.037 0.105 0.000 0.620 119 A CB -0.930 18.095 19.000 0.042 0.000 0.822 119 A HN -0.297 7.896 8.150 0.071 0.000 0.443 120 L N -0.830 120.437 121.223 0.073 0.000 2.046 120 L HA -0.350 4.010 4.340 0.033 0.000 0.208 120 L C 1.358 178.258 176.870 0.049 0.000 1.077 120 L CA 2.868 57.738 54.840 0.051 0.000 0.747 120 L CB -0.658 41.426 42.059 0.042 0.000 0.896 120 L HN -0.448 7.820 8.230 0.063 0.000 0.432 121 Y N -0.141 120.126 120.300 -0.055 0.000 2.081 121 Y HA -0.595 3.897 4.550 -0.097 0.000 0.280 121 Y C 1.713 177.520 175.900 -0.156 0.000 1.163 121 Y CA 4.450 62.469 58.100 -0.135 0.000 1.135 121 Y CB -0.025 38.286 38.460 -0.249 0.000 0.970 121 Y HN -0.349 8.038 8.280 0.177 0.000 0.498 122 Y N -3.743 116.567 120.300 0.016 0.000 2.314 122 Y HA -0.419 4.036 4.550 -0.159 0.000 0.293 122 Y C 2.047 177.882 175.900 -0.108 0.000 1.129 122 Y CA 3.704 61.766 58.100 -0.063 0.000 1.201 122 Y CB -0.194 38.288 38.460 0.035 0.000 0.999 122 Y HN -0.200 8.217 8.280 0.229 0.000 0.541 123 K N 1.356 121.784 120.400 0.047 0.000 2.057 123 K HA -0.269 4.261 4.320 0.009 -0.205 0.207 123 K C 3.105 179.677 176.600 -0.048 0.000 1.049 123 K CA 3.099 59.386 56.287 0.000 0.000 0.931 123 K CB -0.252 32.249 32.500 0.002 0.000 0.714 123 K HN -0.122 8.168 8.250 0.068 0.000 0.440 124 G N -0.974 107.766 108.800 -0.099 0.000 2.471 124 G HA2 -0.181 3.690 3.960 -0.150 0.000 0.219 124 G HA3 -0.181 3.730 3.960 -0.082 0.000 0.219 124 G C 0.513 175.319 174.900 -0.157 0.000 1.125 124 G CA 1.470 46.495 45.100 -0.126 0.000 0.775 124 G HN -0.200 8.025 8.290 -0.109 0.000 0.548 125 K N -0.431 119.846 120.400 -0.205 0.000 2.417 125 K HA 0.121 4.356 4.320 -0.142 0.000 0.196 125 K C 0.445 177.019 176.600 -0.042 0.000 1.023 125 K CA -1.545 54.651 56.287 -0.152 0.000 1.122 125 K CB -0.411 31.956 32.500 -0.222 0.000 0.850 125 K HN -0.882 7.086 8.250 -0.237 0.140 0.521 126 G N -0.674 108.106 108.800 -0.033 0.000 2.157 126 G HA2 -0.395 3.560 3.960 -0.009 0.000 0.248 126 G HA3 -0.395 3.555 3.960 -0.017 0.000 0.248 126 G C -0.465 174.435 174.900 0.000 0.000 0.979 126 G CA 0.232 45.325 45.100 -0.012 0.000 0.650 126 G HN -0.159 7.932 8.290 -0.045 0.172 0.529 127 R N -1.495 119.015 120.500 0.017 0.000 2.583 127 R HA 0.034 4.364 4.340 -0.016 0.000 0.268 127 R C -0.273 176.016 176.300 -0.018 0.000 1.101 127 R CA -2.018 54.081 56.100 -0.001 0.000 1.180 127 R CB 0.810 31.115 30.300 0.009 0.000 1.128 127 R HN -0.420 7.872 8.270 0.035 0.000 0.568 128 R N -0.324 120.149 120.500 -0.044 0.000 2.402 128 R HA 0.519 4.840 4.340 -0.031 0.000 0.290 128 R C -2.201 174.060 176.300 -0.064 0.000 1.321 128 R CA -2.242 53.832 56.100 -0.044 0.000 1.283 128 R CB 0.519 30.795 30.300 -0.041 0.000 1.111 128 R HN 0.144 8.735 8.270 -0.062 -0.358 0.578 129 P HA 0.814 5.350 4.420 -0.122 -0.189 0.278 129 P C -1.847 175.416 177.300 -0.063 0.000 1.258 129 P CA -1.534 61.519 63.100 -0.079 0.000 0.811 129 P CB 1.388 33.058 31.700 -0.050 0.000 1.063 130 L N 0.591 121.769 121.223 -0.074 0.000 2.409 130 L HA 0.427 4.743 4.340 -0.039 0.000 0.272 130 L C -2.110 174.733 176.870 -0.045 0.000 0.980 130 L CA -0.943 53.866 54.840 -0.051 0.000 0.826 130 L CB 3.699 45.728 42.059 -0.049 0.000 1.268 130 L HN 0.255 8.425 8.230 -0.100 0.000 0.407 131 L N 5.839 127.046 121.223 -0.028 0.000 2.326 131 L HA 0.450 4.937 4.340 -0.019 -0.158 0.278 131 L C -1.171 175.687 176.870 -0.021 0.000 1.092 131 L CA -0.389 54.440 54.840 -0.020 0.000 0.810 131 L CB 1.531 43.583 42.059 -0.012 0.000 1.153 131 L HN 0.432 8.648 8.230 -0.024 0.000 0.439 132 V N 2.824 122.725 119.914 -0.022 0.000 2.407 132 V HA 0.497 4.968 4.120 -0.025 -0.367 0.291 132 V C -1.663 174.409 176.094 -0.038 0.000 1.018 132 V CA -1.800 60.483 62.300 -0.029 0.000 0.842 132 V CB 1.892 33.697 31.823 -0.030 0.000 0.996 132 V HN 0.443 8.621 8.190 -0.020 0.000 0.426 133 A N 7.588 130.388 122.820 -0.033 0.000 2.527 133 A HA 0.348 4.647 4.320 -0.036 0.000 0.313 133 A C -1.463 176.095 177.584 -0.043 0.000 1.410 133 A CA -1.261 50.756 52.037 -0.034 0.000 1.060 133 A CB 0.005 18.991 19.000 -0.023 0.000 1.137 133 A HN 0.690 8.824 8.150 -0.027 0.000 0.542 134 A N 2.050 124.831 122.820 -0.064 0.000 2.423 134 A HA 0.115 4.397 4.320 -0.063 0.000 0.246 134 A C -1.341 176.206 177.584 -0.061 0.000 1.278 134 A CA -0.751 51.239 52.037 -0.078 0.000 0.903 134 A CB 0.638 19.553 19.000 -0.141 0.000 0.997 134 A HN -0.018 8.090 8.150 -0.071 0.000 0.510 135 D N -1.028 119.347 120.400 -0.042 0.000 2.344 135 D HA -0.099 4.524 4.640 -0.027 0.000 0.253 135 D C 0.459 176.746 176.300 -0.020 0.000 1.255 135 D CA 0.114 54.098 54.000 -0.027 0.000 0.894 135 D CB 0.281 41.070 40.800 -0.018 0.000 1.067 135 D HN -0.397 7.950 8.370 -0.038 0.000 0.492 136 T N 4.460 119.003 114.554 -0.018 0.000 3.148 136 T HA -0.033 4.309 4.350 -0.013 0.000 0.253 136 T C 0.894 175.589 174.700 -0.007 0.000 1.134 136 T CA 1.187 63.279 62.100 -0.012 0.000 1.051 136 T CB -0.189 68.672 68.868 -0.010 0.000 0.959 136 T HN 0.683 8.912 8.240 -0.019 0.000 0.525 137 Q N 0.683 120.479 119.800 -0.006 0.000 2.391 137 Q HA 0.129 4.467 4.340 -0.003 0.000 0.243 137 Q C 0.119 176.117 176.000 -0.003 0.000 0.874 137 Q CA 0.410 56.211 55.803 -0.003 0.000 0.950 137 Q CB 2.077 30.814 28.738 -0.001 0.000 1.103 137 Q HN -0.202 8.310 8.270 -0.007 -0.246 0.544 138 R N 0.111 120.609 120.500 -0.004 0.000 2.352 138 R HA 0.468 4.806 4.340 -0.002 0.000 0.304 138 R C -1.950 174.347 176.300 -0.005 0.000 1.104 138 R CA -2.858 53.240 56.100 -0.003 0.000 0.991 138 R CB 0.187 30.486 30.300 -0.002 0.000 1.140 138 R HN -0.729 7.711 8.270 -0.006 -0.173 0.540 139 P HA -0.206 4.211 4.420 -0.006 0.000 0.216 139 P C 0.724 178.022 177.300 -0.005 0.000 1.150 139 P CA 2.694 65.791 63.100 -0.005 0.000 0.837 139 P CB 0.230 31.928 31.700 -0.004 0.000 0.786 140 A N -4.173 118.645 122.820 -0.003 0.000 1.972 140 A HA -0.151 4.167 4.320 -0.003 0.000 0.219 140 A C 2.084 179.666 177.584 -0.003 0.000 1.169 140 A CA 2.659 54.695 52.037 -0.003 0.000 0.635 140 A CB -0.824 18.175 19.000 -0.001 0.000 0.810 140 A HN 0.256 8.393 8.150 -0.003 0.011 0.446 141 A N -2.019 120.798 122.820 -0.004 0.000 1.930 141 A HA -0.295 4.023 4.320 -0.004 0.000 0.217 141 A C 1.922 179.501 177.584 -0.008 0.000 1.175 141 A CA 2.825 54.858 52.037 -0.005 0.000 0.627 141 A CB -0.560 18.436 19.000 -0.005 0.000 0.815 141 A HN -0.466 7.682 8.150 -0.004 0.000 0.443 142 R N -2.539 117.956 120.500 -0.009 0.000 2.075 142 R HA -0.341 3.991 4.340 -0.014 0.000 0.232 142 R C 2.541 178.835 176.300 -0.009 0.000 1.126 142 R CA 3.534 59.627 56.100 -0.011 0.000 0.963 142 R CB -0.203 30.090 30.300 -0.012 0.000 0.858 142 R HN -0.463 7.802 8.270 -0.009 0.000 0.435 143 E N -0.513 119.683 120.200 -0.007 0.000 2.110 143 E HA -0.348 3.998 4.350 -0.005 0.000 0.193 143 E C 1.991 178.588 176.600 -0.004 0.000 0.988 143 E CA 3.001 59.398 56.400 -0.005 0.000 0.804 143 E CB -0.438 29.260 29.700 -0.004 0.000 0.745 143 E HN -0.241 8.115 8.360 -0.006 0.000 0.458 144 Q N -0.164 119.633 119.800 -0.004 0.000 2.061 144 Q HA -0.315 4.024 4.340 -0.002 0.000 0.204 144 Q C 2.310 178.308 176.000 -0.004 0.000 0.984 144 Q CA 3.137 58.938 55.803 -0.003 0.000 0.846 144 Q CB -0.044 28.693 28.738 -0.003 0.000 0.902 144 Q HN -0.484 7.783 8.270 -0.004 0.000 0.421 145 L N -0.968 120.252 121.223 -0.006 0.000 2.093 145 L HA -0.220 4.117 4.340 -0.005 0.000 0.208 145 L C 1.368 178.235 176.870 -0.006 0.000 1.085 145 L CA 2.520 57.357 54.840 -0.006 0.000 0.755 145 L CB -0.411 41.642 42.059 -0.010 0.000 0.904 145 L HN -0.701 7.525 8.230 -0.007 0.000 0.435 146 R N -0.588 119.909 120.500 -0.006 0.000 2.096 146 R HA -0.426 3.910 4.340 -0.006 0.000 0.240 146 R C 2.335 178.633 176.300 -0.004 0.000 1.139 146 R CA 3.811 59.907 56.100 -0.006 0.000 0.952 146 R CB -0.186 30.110 30.300 -0.006 0.000 0.854 146 R HN -0.432 7.834 8.270 -0.007 0.000 0.436 147 L N -2.569 118.653 121.223 -0.003 0.000 2.109 147 L HA -0.206 4.133 4.340 -0.001 0.000 0.207 147 L C 2.492 179.362 176.870 -0.000 0.000 1.086 147 L CA 2.596 57.435 54.840 -0.001 0.000 0.760 147 L CB -0.041 42.017 42.059 -0.001 0.000 0.910 147 L HN -0.387 7.841 8.230 -0.003 0.000 0.437 148 L N -1.721 119.501 121.223 -0.000 0.000 2.093 148 L HA -0.374 3.967 4.340 0.003 0.000 0.208 148 L C 2.377 179.248 176.870 0.002 0.000 1.085 148 L CA 3.081 57.922 54.840 0.002 0.000 0.755 148 L CB -0.557 41.503 42.059 0.001 0.000 0.904 148 L HN -0.408 7.821 8.230 -0.001 0.000 0.435 149 G N -2.044 106.756 108.800 -0.000 0.000 2.422 149 G HA2 -0.417 3.542 3.960 -0.003 0.000 0.218 149 G HA3 -0.417 3.544 3.960 0.001 0.000 0.218 149 G C 0.958 175.858 174.900 -0.000 0.000 1.146 149 G CA 1.855 46.954 45.100 -0.001 0.000 0.769 149 G HN 0.082 8.371 8.290 -0.001 0.000 0.547 150 E N 1.766 121.965 120.200 -0.001 0.000 2.077 150 E HA -0.288 4.061 4.350 -0.002 0.000 0.193 150 E C 2.782 179.382 176.600 0.001 0.000 0.989 150 E CA 2.968 59.368 56.400 -0.001 0.000 0.800 150 E CB -0.216 29.483 29.700 -0.001 0.000 0.746 150 E HN -0.328 8.031 8.360 -0.001 0.000 0.452 151 K N -0.691 119.710 120.400 0.002 0.000 2.097 151 K HA -0.204 4.118 4.320 0.003 0.000 0.205 151 K C 1.825 178.428 176.600 0.005 0.000 1.050 151 K CA 2.630 58.919 56.287 0.004 0.000 0.938 151 K CB 0.247 32.750 32.500 0.005 0.000 0.718 151 K HN -0.553 7.617 8.250 0.002 0.081 0.442 152 V N -7.322 112.595 119.914 0.006 0.000 3.647 152 V HA 0.224 4.349 4.120 0.008 0.000 0.279 152 V C 0.606 176.703 176.094 0.005 0.000 1.314 152 V CA -0.831 61.474 62.300 0.008 0.000 1.125 152 V CB -0.171 31.659 31.823 0.012 0.000 0.907 152 V HN -0.475 7.718 8.190 0.005 0.000 0.434 153 G N 0.592 109.393 108.800 0.002 0.000 2.246 153 G HA2 -0.376 3.583 3.960 -0.001 0.000 0.273 153 G HA3 -0.376 3.583 3.960 -0.002 0.000 0.273 153 G C -0.978 173.921 174.900 -0.002 0.000 1.055 153 G CA 0.905 46.005 45.100 -0.001 0.000 0.851 153 G HN -0.522 7.610 8.290 0.002 0.160 0.500 154 V N 0.267 120.180 119.914 -0.002 0.000 2.604 154 V HA 0.399 4.514 4.120 -0.007 0.000 0.305 154 V C -2.234 173.855 176.094 -0.008 0.000 1.043 154 V CA -3.554 58.743 62.300 -0.005 0.000 0.888 154 V CB 2.838 34.661 31.823 -0.001 0.000 0.995 154 V HN -0.517 7.673 8.190 -0.001 0.000 0.429 155 P HA 0.051 4.465 4.420 -0.011 0.000 0.272 155 P C -1.891 175.400 177.300 -0.014 0.000 1.223 155 P CA -0.309 62.784 63.100 -0.013 0.000 0.784 155 P CB 0.567 32.258 31.700 -0.015 0.000 0.923 156 V N 0.819 120.726 119.914 -0.012 0.000 2.577 156 V HA 0.484 4.802 4.120 -0.015 -0.207 0.303 156 V C -0.725 175.361 176.094 -0.013 0.000 1.042 156 V CA -1.423 60.869 62.300 -0.013 0.000 0.872 156 V CB 3.117 34.934 31.823 -0.011 0.000 0.998 156 V HN 0.059 8.243 8.190 -0.011 0.000 0.423 157 L N 8.521 129.735 121.223 -0.015 0.000 2.272 157 L HA 0.422 4.754 4.340 -0.012 0.000 0.289 157 L C -1.844 175.016 176.870 -0.016 0.000 1.032 157 L CA -1.321 53.511 54.840 -0.014 0.000 0.810 157 L CB 1.809 43.859 42.059 -0.014 0.000 1.205 157 L HN 0.661 8.881 8.230 -0.017 0.000 0.422 158 E N 7.156 127.348 120.200 -0.014 0.000 2.134 158 E HA 0.245 4.585 4.350 -0.017 0.000 0.278 158 E C -0.124 176.468 176.600 -0.014 0.000 0.959 158 E CA -1.359 55.032 56.400 -0.014 0.000 0.783 158 E CB 1.243 30.936 29.700 -0.011 0.000 1.095 158 E HN 0.466 8.819 8.360 -0.012 0.000 0.399 159 V N 2.562 122.466 119.914 -0.018 0.000 3.237 159 V HA 0.028 4.243 4.120 -0.013 -0.103 0.305 159 V C -0.877 175.210 176.094 -0.012 0.000 1.096 159 V CA -0.218 62.073 62.300 -0.015 0.000 1.130 159 V CB 0.740 32.550 31.823 -0.021 0.000 1.048 159 V HN -0.069 8.108 8.190 -0.022 0.000 0.484 160 M N 1.236 120.831 119.600 -0.009 0.000 2.359 160 M HA 0.120 4.596 4.480 -0.006 0.000 0.322 160 M C -0.419 175.878 176.300 -0.006 0.000 1.166 160 M CA -0.214 55.082 55.300 -0.006 0.000 1.067 160 M CB 1.880 34.478 32.600 -0.004 0.000 1.523 160 M HN 0.264 8.876 8.290 -0.008 -0.327 0.467 161 D N 0.750 121.147 120.400 -0.005 0.000 2.487 161 D HA -0.268 4.552 4.640 -0.005 -0.183 0.243 161 D C 1.670 177.968 176.300 -0.003 0.000 1.154 161 D CA 1.536 55.534 54.000 -0.004 0.000 0.876 161 D CB -0.426 40.372 40.800 -0.003 0.000 1.161 161 D HN 0.044 8.411 8.370 -0.005 0.000 0.478 162 G N 4.392 113.190 108.800 -0.003 0.000 2.168 162 G HA2 -0.517 3.443 3.960 -0.000 0.000 0.257 162 G HA3 -0.517 3.443 3.960 -0.001 0.000 0.257 162 G C -0.533 174.367 174.900 -0.000 0.000 0.997 162 G CA 0.473 45.572 45.100 -0.001 0.000 0.708 162 G HN 0.229 8.516 8.290 -0.004 0.000 0.520 163 E N 0.183 120.382 120.200 -0.002 0.000 2.384 163 E HA -0.052 4.299 4.350 0.001 0.000 0.266 163 E C -0.358 176.244 176.600 0.003 0.000 1.012 163 E CA 0.161 56.561 56.400 -0.000 0.000 0.901 163 E CB 1.349 31.048 29.700 -0.002 0.000 0.967 163 E HN -0.690 7.637 8.360 -0.004 0.031 0.435 164 S N 5.773 121.476 115.700 0.006 0.000 2.585 164 S HA 0.136 4.612 4.470 0.011 0.000 0.273 164 S C -0.241 174.367 174.600 0.014 0.000 1.339 164 S CA -1.429 56.777 58.200 0.010 0.000 1.028 164 S CB -0.501 62.706 63.200 0.011 0.000 0.906 164 S HN 0.104 8.417 8.310 0.006 0.000 0.528 165 P HA -0.265 4.172 4.420 0.029 0.000 0.216 165 P C 1.485 178.805 177.300 0.033 0.000 1.150 165 P CA 2.435 65.555 63.100 0.032 0.000 0.837 165 P CB 0.008 31.736 31.700 0.046 0.000 0.786 166 E N -2.220 117.996 120.200 0.027 0.000 2.077 166 E HA -0.233 4.134 4.350 0.029 0.000 0.193 166 E C 2.555 179.167 176.600 0.019 0.000 0.989 166 E CA 3.802 60.217 56.400 0.024 0.000 0.800 166 E CB -0.890 28.822 29.700 0.020 0.000 0.746 166 E HN 0.387 8.751 8.360 0.025 0.010 0.452 167 S N 0.682 116.391 115.700 0.015 0.000 2.368 167 S HA -0.181 4.295 4.470 0.010 0.000 0.225 167 S C 1.898 176.505 174.600 0.011 0.000 1.030 167 S CA 3.311 61.517 58.200 0.011 0.000 0.999 167 S CB -0.565 62.639 63.200 0.007 0.000 0.844 167 S HN -0.496 7.823 8.310 0.014 0.000 0.459 168 I N 2.748 123.325 120.570 0.012 0.000 2.163 168 I HA -0.533 3.640 4.170 0.005 0.000 0.243 168 I C 1.498 177.626 176.117 0.018 0.000 1.085 168 I CA 4.019 65.325 61.300 0.010 0.000 1.347 168 I CB -0.427 37.577 38.000 0.007 0.000 1.044 168 I HN -0.191 8.027 8.210 0.013 0.000 0.408 169 R N -0.883 119.634 120.500 0.028 0.000 2.091 169 R HA -0.444 3.921 4.340 0.041 0.000 0.238 169 R C 1.818 178.131 176.300 0.021 0.000 1.136 169 R CA 3.862 59.982 56.100 0.034 0.000 0.959 169 R CB -0.348 29.975 30.300 0.039 0.000 0.856 169 R HN -0.187 8.102 8.270 0.031 0.000 0.437 170 R N -1.261 119.248 120.500 0.016 0.000 2.083 170 R HA -0.317 4.030 4.340 0.011 0.000 0.237 170 R C 2.505 178.809 176.300 0.007 0.000 1.137 170 R CA 3.222 59.329 56.100 0.011 0.000 0.951 170 R CB -0.322 29.983 30.300 0.009 0.000 0.851 170 R HN -0.435 7.845 8.270 0.017 0.000 0.434 171 R N -2.025 118.478 120.500 0.006 0.000 2.092 171 R HA -0.254 4.086 4.340 0.001 0.000 0.231 171 R C 2.599 178.899 176.300 0.001 0.000 1.119 171 R CA 3.266 59.367 56.100 0.002 0.000 0.970 171 R CB -0.133 30.167 30.300 0.000 0.000 0.864 171 R HN -0.416 7.858 8.270 0.007 0.000 0.440 172 V N 0.411 120.328 119.914 0.004 0.000 2.295 172 V HA -0.491 3.627 4.120 -0.003 0.000 0.246 172 V C 1.822 177.916 176.094 0.000 0.000 1.049 172 V CA 4.292 66.593 62.300 0.002 0.000 1.024 172 V CB -0.554 31.276 31.823 0.012 0.000 0.648 172 V HN 0.058 8.253 8.190 0.007 0.000 0.447 173 E N -0.907 119.296 120.200 0.004 0.000 2.077 173 E HA -0.444 3.906 4.350 -0.001 0.000 0.193 173 E C 2.250 178.848 176.600 -0.003 0.000 0.989 173 E CA 3.462 59.863 56.400 0.001 0.000 0.800 173 E CB -0.397 29.307 29.700 0.006 0.000 0.746 173 E HN -0.334 8.031 8.360 0.008 0.000 0.452 174 E N -0.455 119.743 120.200 -0.002 0.000 2.051 174 E HA -0.336 4.012 4.350 -0.004 0.000 0.192 174 E C 1.911 178.507 176.600 -0.007 0.000 0.991 174 E CA 2.937 59.334 56.400 -0.004 0.000 0.799 174 E CB -0.024 29.674 29.700 -0.002 0.000 0.748 174 E HN -0.471 7.889 8.360 -0.000 0.000 0.449 175 K N -0.701 119.694 120.400 -0.008 0.000 2.057 175 K HA -0.282 4.032 4.320 -0.010 0.000 0.207 175 K C 2.206 178.797 176.600 -0.015 0.000 1.049 175 K CA 3.108 59.388 56.287 -0.011 0.000 0.931 175 K CB -0.074 32.419 32.500 -0.012 0.000 0.714 175 K HN -0.518 7.728 8.250 -0.007 0.000 0.440 176 A N -2.168 120.641 122.820 -0.017 0.000 1.933 176 A HA -0.316 3.987 4.320 -0.028 0.000 0.218 176 A C 1.721 179.292 177.584 -0.021 0.000 1.175 176 A CA 3.198 55.221 52.037 -0.024 0.000 0.628 176 A CB -0.653 18.331 19.000 -0.027 0.000 0.814 176 A HN -0.129 8.013 8.150 -0.015 0.000 0.444 177 R N -0.849 119.641 120.500 -0.016 0.000 2.066 177 R HA -0.277 4.054 4.340 -0.015 0.000 0.232 177 R C 2.904 179.196 176.300 -0.013 0.000 1.131 177 R CA 3.106 59.198 56.100 -0.014 0.000 0.955 177 R CB -0.014 30.280 30.300 -0.009 0.000 0.851 177 R HN -0.530 7.732 8.270 -0.013 0.000 0.432 178 L N -2.363 118.853 121.223 -0.012 0.000 2.131 178 L HA -0.247 4.087 4.340 -0.009 0.000 0.210 178 L C 1.393 178.255 176.870 -0.012 0.000 1.092 178 L CA 2.106 56.939 54.840 -0.011 0.000 0.759 178 L CB 0.249 42.303 42.059 -0.009 0.000 0.903 178 L HN -0.362 7.861 8.230 -0.011 0.000 0.435 179 E N -5.432 114.758 120.200 -0.015 0.000 2.501 179 E HA 0.126 4.467 4.350 -0.015 0.000 0.201 179 E C -1.100 175.488 176.600 -0.021 0.000 1.016 179 E CA -0.697 55.692 56.400 -0.017 0.000 0.920 179 E CB 0.961 30.649 29.700 -0.018 0.000 1.023 179 E HN -0.442 7.884 8.360 -0.016 0.024 0.474 180 A N -1.316 121.492 122.820 -0.021 0.000 2.687 180 A HA -0.454 3.852 4.320 -0.024 0.000 0.299 180 A C -1.157 176.407 177.584 -0.034 0.000 1.497 180 A CA 0.669 52.691 52.037 -0.024 0.000 0.751 180 A CB -1.430 17.558 19.000 -0.020 0.000 1.048 180 A HN -0.589 7.496 8.150 -0.019 0.053 0.464 181 R N -2.310 118.167 120.500 -0.039 0.000 2.490 181 R HA 0.063 4.633 4.340 -0.055 -0.263 0.280 181 R C 0.349 176.607 176.300 -0.070 0.000 1.077 181 R CA -0.736 55.331 56.100 -0.055 0.000 1.065 181 R CB 0.136 30.402 30.300 -0.056 0.000 1.003 181 R HN -0.535 7.714 8.270 -0.036 0.000 0.470 182 D N -1.242 119.102 120.400 -0.094 0.000 2.503 182 D HA 0.090 4.669 4.640 -0.102 0.000 0.218 182 D C -0.849 175.333 176.300 -0.196 0.000 1.183 182 D CA -0.778 53.153 54.000 -0.115 0.000 0.827 182 D CB 1.837 42.585 40.800 -0.087 0.000 1.034 182 D HN 0.317 8.629 8.370 -0.097 0.000 0.510 183 L N 0.754 121.833 121.223 -0.239 0.000 2.541 183 L HA 0.424 4.603 4.340 -0.503 -0.140 0.266 183 L C -3.011 173.665 176.870 -0.322 0.000 0.966 183 L CA 0.249 54.844 54.840 -0.409 0.000 0.871 183 L CB 2.653 44.405 42.059 -0.512 0.000 1.232 183 L HN -0.959 7.157 8.230 -0.190 0.000 0.408 184 I N 6.229 126.614 120.570 -0.308 0.000 2.339 184 I HA 0.378 4.636 4.170 -0.131 -0.166 0.290 184 I C -1.690 174.348 176.117 -0.132 0.000 0.994 184 I CA -0.940 60.263 61.300 -0.162 0.000 1.191 184 I CB 1.671 39.623 38.000 -0.080 0.000 1.343 184 I HN 0.699 8.693 8.210 -0.360 0.000 0.458 185 L N 8.096 129.278 121.223 -0.068 0.000 2.295 185 L HA 0.475 5.003 4.340 0.082 -0.139 0.281 185 L C -1.243 175.652 176.870 0.041 0.000 1.018 185 L CA -1.103 53.749 54.840 0.020 0.000 0.841 185 L CB 1.131 43.197 42.059 0.013 0.000 1.218 185 L HN 0.666 8.856 8.230 -0.067 0.000 0.424 186 V N 5.616 125.580 119.914 0.084 0.000 2.334 186 V HA 0.091 4.317 4.120 -0.042 -0.131 0.267 186 V C -1.476 174.577 176.094 -0.069 0.000 1.040 186 V CA -0.827 61.457 62.300 -0.026 0.000 0.866 186 V CB 0.208 31.963 31.823 -0.114 0.000 1.019 186 V HN 0.724 9.018 8.190 0.173 0.000 0.468 187 D N 9.474 129.836 120.400 -0.062 0.000 2.402 187 D HA 0.192 4.811 4.640 -0.035 0.000 0.235 187 D C -0.225 176.018 176.300 -0.095 0.000 1.226 187 D CA -1.413 52.555 54.000 -0.054 0.000 0.918 187 D CB 1.027 41.810 40.800 -0.029 0.000 1.043 187 D HN 0.322 8.661 8.370 -0.053 0.000 0.506 188 T N 3.360 117.840 114.554 -0.122 0.000 2.754 188 T HA 0.012 4.265 4.350 -0.161 0.000 0.286 188 T C -0.890 173.781 174.700 -0.047 0.000 0.997 188 T CA -1.389 60.634 62.100 -0.130 0.000 0.982 188 T CB 1.456 70.227 68.868 -0.163 0.000 1.027 188 T HN -0.420 7.755 8.240 -0.108 0.000 0.529 189 A N -0.141 122.664 122.820 -0.024 0.000 2.511 189 A HA -0.168 4.148 4.320 -0.005 0.000 0.242 189 A C -0.199 177.407 177.584 0.038 0.000 1.069 189 A CA 0.679 52.719 52.037 0.005 0.000 0.763 189 A CB 0.234 19.240 19.000 0.010 0.000 1.001 189 A HN 0.059 8.190 8.150 -0.032 0.000 0.498 190 G N 1.077 109.895 108.800 0.030 0.000 2.372 190 G HA2 0.182 4.160 3.960 0.030 0.000 0.323 190 G HA3 0.182 4.333 3.960 0.070 -0.149 0.323 190 G C -2.071 172.856 174.900 0.045 0.000 1.152 190 G CA -0.518 44.609 45.100 0.045 0.000 0.906 190 G HN 0.215 8.515 8.290 0.017 0.000 0.460 191 R N 1.082 121.620 120.500 0.064 0.000 2.867 191 R HA 0.335 4.695 4.340 0.033 0.000 0.268 191 R C 0.704 177.034 176.300 0.050 0.000 1.014 191 R CA -2.236 53.892 56.100 0.047 0.000 0.946 191 R CB 3.074 33.399 30.300 0.042 0.000 1.208 191 R HN 0.032 8.356 8.270 0.090 0.000 0.477 192 L N -0.061 121.182 121.223 0.033 0.000 2.217 192 L HA -0.136 4.224 4.340 0.032 0.000 0.211 192 L C 0.303 177.193 176.870 0.035 0.000 1.107 192 L CA 2.527 57.385 54.840 0.030 0.000 0.783 192 L CB 0.520 42.590 42.059 0.018 0.000 0.919 192 L HN 0.509 8.754 8.230 0.026 0.000 0.442 193 Q N -4.218 115.601 119.800 0.030 0.000 2.433 193 Q HA 0.121 4.479 4.340 0.031 0.000 0.279 193 Q C -1.209 174.801 176.000 0.015 0.000 1.105 193 Q CA -1.904 53.913 55.803 0.023 0.000 0.815 193 Q CB 3.088 31.831 28.738 0.007 0.000 1.403 193 Q HN -0.655 7.631 8.270 0.026 0.000 0.435 194 I N 1.040 121.604 120.570 -0.009 0.000 2.618 194 I HA -0.151 3.970 4.170 -0.082 0.000 0.284 194 I C -0.746 175.335 176.117 -0.060 0.000 1.146 194 I CA 1.503 62.759 61.300 -0.073 0.000 1.425 194 I CB 0.240 38.154 38.000 -0.143 0.000 1.383 194 I HN 0.279 8.486 8.210 -0.004 0.000 0.562 195 D N 7.389 127.751 120.400 -0.063 0.000 2.552 195 D HA 0.125 4.736 4.640 -0.049 0.000 0.239 195 D C -0.194 176.071 176.300 -0.058 0.000 1.139 195 D CA -1.634 52.337 54.000 -0.049 0.000 0.914 195 D CB 2.043 42.827 40.800 -0.027 0.000 1.461 195 D HN -0.300 8.031 8.370 -0.066 0.000 0.462 196 E N -0.303 119.869 120.200 -0.046 0.000 2.051 196 E HA -0.083 4.234 4.350 -0.055 0.000 0.192 196 E C 0.500 177.081 176.600 -0.031 0.000 0.991 196 E CA 4.472 60.846 56.400 -0.042 0.000 0.799 196 E CB -2.409 27.272 29.700 -0.031 0.000 0.748 196 E HN 0.590 8.926 8.360 -0.039 0.000 0.449 197 P HA -0.212 4.202 4.420 -0.010 0.000 0.215 197 P C 1.565 178.859 177.300 -0.010 0.000 1.153 197 P CA 2.672 65.764 63.100 -0.012 0.000 0.853 197 P CB -0.218 31.477 31.700 -0.008 0.000 0.788 198 L N -1.377 119.837 121.223 -0.015 0.000 1.994 198 L HA -0.279 4.063 4.340 0.004 0.000 0.208 198 L C 2.222 179.085 176.870 -0.011 0.000 1.071 198 L CA 3.405 58.241 54.840 -0.007 0.000 0.745 198 L CB 0.108 42.165 42.059 -0.003 0.000 0.892 198 L HN -0.108 8.661 8.230 -0.020 -0.550 0.431 199 M N -2.823 116.746 119.600 -0.052 0.000 2.149 199 M HA -0.366 4.074 4.480 -0.066 0.000 0.261 199 M C 2.682 178.975 176.300 -0.012 0.000 1.064 199 M CA 1.774 57.035 55.300 -0.065 0.000 1.102 199 M CB -1.539 30.988 32.600 -0.121 0.000 1.369 199 M HN 0.177 8.425 8.290 -0.069 0.000 0.408 200 G N -1.814 106.981 108.800 -0.009 0.000 2.404 200 G HA2 -0.343 3.619 3.960 0.003 0.000 0.215 200 G HA3 -0.343 3.622 3.960 0.008 0.000 0.215 200 G C 1.162 176.077 174.900 0.025 0.000 1.174 200 G CA 1.910 47.014 45.100 0.007 0.000 0.780 200 G HN 0.006 8.280 8.290 -0.018 0.005 0.537 201 E N 2.187 122.402 120.200 0.024 0.000 2.150 201 E HA -0.287 4.083 4.350 0.032 0.000 0.193 201 E C 2.169 178.804 176.600 0.057 0.000 0.985 201 E CA 2.589 59.009 56.400 0.032 0.000 0.814 201 E CB -0.218 29.494 29.700 0.020 0.000 0.752 201 E HN -0.418 7.951 8.360 0.015 0.000 0.466 202 L N -0.153 121.113 121.223 0.071 0.000 2.044 202 L HA -0.252 4.159 4.340 0.119 0.000 0.205 202 L C 1.299 178.280 176.870 0.184 0.000 1.075 202 L CA 2.997 57.915 54.840 0.130 0.000 0.747 202 L CB -0.639 41.509 42.059 0.148 0.000 0.903 202 L HN -0.167 8.083 8.230 0.057 0.014 0.435 203 A N -1.329 121.565 122.820 0.124 0.000 1.908 203 A HA -0.385 4.007 4.320 0.120 0.000 0.218 203 A C 1.771 179.416 177.584 0.102 0.000 1.181 203 A CA 3.288 55.388 52.037 0.105 0.000 0.627 203 A CB -0.846 18.188 19.000 0.057 0.000 0.818 203 A HN -0.099 8.105 8.150 0.090 0.000 0.445 204 R N -0.785 119.767 120.500 0.087 0.000 2.081 204 R HA -0.231 4.315 4.340 0.065 -0.166 0.235 204 R C 2.163 178.530 176.300 0.112 0.000 1.131 204 R CA 1.883 58.029 56.100 0.077 0.000 0.960 204 R CB -0.517 29.816 30.300 0.055 0.000 0.856 204 R HN -0.525 7.790 8.270 0.076 0.000 0.436 205 L N -0.786 120.528 121.223 0.152 0.000 2.079 205 L HA -0.354 4.083 4.340 0.162 0.000 0.210 205 L C 1.254 178.341 176.870 0.362 0.000 1.081 205 L CA 3.433 58.403 54.840 0.218 0.000 0.752 205 L CB -0.312 41.843 42.059 0.161 0.000 0.896 205 L HN 0.079 8.393 8.230 0.140 0.000 0.433 206 K N -1.023 119.593 120.400 0.360 0.000 2.057 206 K HA -0.460 3.836 4.320 -0.039 0.000 0.207 206 K C 2.205 178.824 176.600 0.032 0.000 1.049 206 K CA 3.741 60.093 56.287 0.108 0.000 0.931 206 K CB -0.341 32.172 32.500 0.020 0.000 0.714 206 K HN -0.179 8.282 8.250 0.351 0.000 0.440 207 E N -1.924 118.312 120.200 0.061 0.000 2.077 207 E HA -0.301 4.058 4.350 0.016 0.000 0.193 207 E C 2.168 178.794 176.600 0.045 0.000 0.989 207 E CA 2.593 59.015 56.400 0.037 0.000 0.800 207 E CB -0.015 29.708 29.700 0.038 0.000 0.746 207 E HN -0.641 7.768 8.360 0.082 0.000 0.452 208 V N -1.945 118.013 119.914 0.075 0.000 2.407 208 V HA -0.237 3.914 4.120 0.052 0.000 0.245 208 V C 1.437 177.579 176.094 0.080 0.000 1.041 208 V CA 3.237 65.579 62.300 0.070 0.000 1.040 208 V CB 0.365 32.232 31.823 0.074 0.000 0.671 208 V HN -0.575 7.673 8.190 0.097 0.000 0.455 209 L N -3.904 117.395 121.223 0.127 0.000 2.446 209 L HA -0.016 4.390 4.340 0.110 0.000 0.219 209 L C 0.701 177.608 176.870 0.061 0.000 1.116 209 L CA 0.564 55.486 54.840 0.137 0.000 0.844 209 L CB 0.323 42.560 42.059 0.297 0.000 0.970 209 L HN -0.108 8.224 8.230 0.170 0.000 0.457 210 G N -0.814 107.983 108.800 -0.005 0.000 2.350 210 G HA2 -0.222 3.726 3.960 -0.019 0.000 0.298 210 G HA3 -0.222 3.763 3.960 -0.073 -0.069 0.298 210 G C -1.725 173.123 174.900 -0.086 0.000 1.037 210 G CA -0.448 44.621 45.100 -0.051 0.000 1.074 210 G HN -0.404 7.884 8.290 -0.003 0.000 0.511 211 P HA -0.054 4.471 4.420 -0.026 -0.121 0.268 211 P C -0.610 176.644 177.300 -0.076 0.000 1.205 211 P CA -0.298 62.698 63.100 -0.173 0.000 0.771 211 P CB 0.510 31.870 31.700 -0.566 0.000 0.858 212 D N 0.547 120.987 120.400 0.067 0.000 2.333 212 D HA -0.120 4.525 4.640 0.008 0.000 0.208 212 D C -0.060 176.229 176.300 -0.019 0.000 0.984 212 D CA 1.072 55.107 54.000 0.059 0.000 0.873 212 D CB 0.705 41.581 40.800 0.127 0.000 0.935 212 D HN 0.136 8.606 8.370 0.167 0.000 0.521 213 E N -2.035 118.127 120.200 -0.064 0.000 2.340 213 E HA 0.379 4.619 4.350 -0.182 0.000 0.273 213 E C -2.182 174.357 176.600 -0.101 0.000 0.891 213 E CA -1.815 54.442 56.400 -0.238 0.000 0.757 213 E CB 4.111 33.342 29.700 -0.781 0.000 1.231 213 E HN -0.826 7.582 8.360 0.079 0.000 0.439 214 V N 2.751 122.626 119.914 -0.065 0.000 2.380 214 V HA 0.232 4.558 4.120 0.106 -0.142 0.286 214 V C -1.369 174.744 176.094 0.033 0.000 1.015 214 V CA -0.702 61.615 62.300 0.028 0.000 0.834 214 V CB 0.929 32.763 31.823 0.018 0.000 1.009 214 V HN 0.376 8.523 8.190 -0.071 0.000 0.428 215 L N 7.306 128.570 121.223 0.069 0.000 2.257 215 L HA 0.484 5.037 4.340 0.042 -0.187 0.290 215 L C -1.553 175.319 176.870 0.003 0.000 1.044 215 L CA -1.302 53.572 54.840 0.056 0.000 0.810 215 L CB 1.028 43.156 42.059 0.114 0.000 1.193 215 L HN 0.747 9.050 8.230 0.120 0.000 0.425 216 L N 6.924 128.113 121.223 -0.057 0.000 2.265 216 L HA 0.470 4.848 4.340 -0.235 -0.178 0.288 216 L C -1.742 175.055 176.870 -0.122 0.000 1.058 216 L CA -1.446 53.297 54.840 -0.162 0.000 0.809 216 L CB 1.575 43.521 42.059 -0.189 0.000 1.179 216 L HN 0.282 8.484 8.230 -0.047 0.000 0.429 217 V N 8.635 128.465 119.914 -0.140 0.000 2.407 217 V HA 0.348 4.613 4.120 -0.060 -0.181 0.278 217 V C -1.109 174.922 176.094 -0.105 0.000 1.037 217 V CA -0.289 61.956 62.300 -0.090 0.000 0.900 217 V CB 0.412 32.197 31.823 -0.063 0.000 0.983 217 V HN 0.377 8.457 8.190 -0.183 0.000 0.459 218 L N 6.896 128.074 121.223 -0.076 0.000 2.385 218 L HA 0.322 4.625 4.340 -0.062 0.000 0.273 218 L C -1.954 174.889 176.870 -0.045 0.000 0.990 218 L CA -1.522 53.281 54.840 -0.063 0.000 0.821 218 L CB 3.855 45.876 42.059 -0.063 0.000 1.279 218 L HN 0.356 8.547 8.230 -0.066 0.000 0.412 219 D N 2.715 123.095 120.400 -0.033 0.000 2.344 219 D HA 0.115 4.742 4.640 -0.023 0.000 0.253 219 D C 1.020 177.302 176.300 -0.031 0.000 1.255 219 D CA -0.523 53.462 54.000 -0.025 0.000 0.894 219 D CB 0.307 41.096 40.800 -0.017 0.000 1.067 219 D HN 0.366 8.718 8.370 -0.030 0.000 0.492 220 A N 8.186 130.987 122.820 -0.033 0.000 2.070 220 A HA -0.275 4.014 4.320 -0.051 0.000 0.220 220 A C 1.530 179.080 177.584 -0.056 0.000 1.159 220 A CA 2.703 54.714 52.037 -0.044 0.000 0.656 220 A CB -0.021 18.963 19.000 -0.026 0.000 0.800 220 A HN 0.406 8.540 8.150 -0.027 0.000 0.453 221 M N -4.819 114.755 119.600 -0.042 0.000 2.632 221 M HA -0.215 4.226 4.480 -0.066 0.000 0.256 221 M C 0.975 177.247 176.300 -0.047 0.000 1.080 221 M CA 2.265 57.536 55.300 -0.049 0.000 1.084 221 M CB -0.145 32.436 32.600 -0.030 0.000 1.439 221 M HN -0.344 8.166 8.290 -0.030 -0.239 0.509 222 T N -5.442 109.088 114.554 -0.040 0.000 3.129 222 T HA -0.048 4.284 4.350 -0.030 0.000 0.251 222 T C 0.987 175.663 174.700 -0.041 0.000 1.117 222 T CA -0.130 61.950 62.100 -0.033 0.000 1.034 222 T CB 0.776 69.632 68.868 -0.020 0.000 0.968 222 T HN -0.547 7.620 8.240 -0.038 0.050 0.526 223 G N 1.811 110.575 108.800 -0.059 0.000 2.547 223 G HA2 -0.479 3.442 3.960 -0.065 0.000 0.271 223 G HA3 -0.479 3.428 3.960 -0.089 0.000 0.271 223 G C 0.389 175.257 174.900 -0.053 0.000 1.209 223 G CA 0.493 45.551 45.100 -0.068 0.000 0.959 223 G HN -0.734 7.473 8.290 -0.068 0.043 0.563 224 Q N 2.967 122.739 119.800 -0.047 0.000 2.291 224 Q HA -0.301 4.017 4.340 -0.037 0.000 0.206 224 Q C 2.046 178.034 176.000 -0.020 0.000 0.976 224 Q CA 2.648 58.430 55.803 -0.035 0.000 0.875 224 Q CB -0.488 28.230 28.738 -0.034 0.000 0.927 224 Q HN 0.438 8.678 8.270 -0.049 0.000 0.450 225 E N 0.426 120.615 120.200 -0.017 0.000 2.160 225 E HA -0.310 4.040 4.350 -0.000 0.000 0.195 225 E C 1.287 177.889 176.600 0.005 0.000 0.991 225 E CA 2.544 58.942 56.400 -0.004 0.000 0.810 225 E CB -0.697 29.001 29.700 -0.003 0.000 0.742 225 E HN -0.387 7.941 8.360 -0.022 0.019 0.466 226 A N -1.397 121.419 122.820 -0.006 0.000 1.940 226 A HA -0.260 4.064 4.320 0.007 0.000 0.219 226 A C 1.967 179.554 177.584 0.006 0.000 1.176 226 A CA 3.147 55.182 52.037 -0.004 0.000 0.631 226 A CB -0.539 18.446 19.000 -0.025 0.000 0.814 226 A HN -0.361 7.768 8.150 -0.017 0.010 0.446 227 L N -3.766 117.457 121.223 -0.001 0.000 2.156 227 L HA -0.381 3.963 4.340 0.006 0.000 0.208 227 L C 1.843 178.726 176.870 0.022 0.000 1.095 227 L CA 2.400 57.244 54.840 0.006 0.000 0.770 227 L CB -0.567 41.491 42.059 -0.001 0.000 0.914 227 L HN -0.441 7.679 8.230 -0.009 0.105 0.439 228 S N 1.281 116.994 115.700 0.021 0.000 2.368 228 S HA -0.226 4.258 4.470 0.023 0.000 0.224 228 S C 2.199 176.832 174.600 0.055 0.000 1.029 228 S CA 3.786 62.002 58.200 0.028 0.000 0.988 228 S CB -0.631 62.579 63.200 0.017 0.000 0.838 228 S HN -0.675 7.561 8.310 0.014 0.083 0.462 229 V N 2.275 122.236 119.914 0.078 0.000 2.287 229 V HA -0.497 3.725 4.120 0.170 0.000 0.248 229 V C 1.258 177.487 176.094 0.226 0.000 1.053 229 V CA 4.005 66.404 62.300 0.165 0.000 1.027 229 V CB -0.774 31.146 31.823 0.162 0.000 0.646 229 V HN -0.050 8.177 8.190 0.061 0.000 0.447 230 A N -1.479 121.417 122.820 0.126 0.000 1.902 230 A HA -0.338 4.062 4.320 0.133 0.000 0.217 230 A C 1.876 179.529 177.584 0.115 0.000 1.181 230 A CA 3.272 55.374 52.037 0.109 0.000 0.623 230 A CB -0.807 18.215 19.000 0.036 0.000 0.818 230 A HN -0.172 8.027 8.150 0.081 0.000 0.443 231 R N -0.975 119.570 120.500 0.076 0.000 2.081 231 R HA -0.351 4.017 4.340 0.047 0.000 0.235 231 R C 1.894 178.225 176.300 0.052 0.000 1.131 231 R CA 3.172 59.303 56.100 0.053 0.000 0.960 231 R CB -0.096 30.222 30.300 0.031 0.000 0.856 231 R HN -0.300 8.008 8.270 0.064 0.000 0.436 232 A N -0.626 122.223 122.820 0.048 0.000 1.877 232 A HA -0.217 4.079 4.320 -0.040 0.000 0.216 232 A C 2.050 179.603 177.584 -0.053 0.000 1.186 232 A CA 2.851 54.871 52.037 -0.029 0.000 0.620 232 A CB -0.560 18.386 19.000 -0.089 0.000 0.822 232 A HN -0.426 7.761 8.150 0.062 0.000 0.443 233 F N -2.332 117.623 119.950 0.010 0.000 2.186 233 F HA -0.270 4.271 4.527 0.023 0.000 0.299 233 F C 2.282 178.091 175.800 0.015 0.000 1.090 233 F CA 3.857 61.868 58.000 0.018 0.000 1.307 233 F CB -0.082 38.932 39.000 0.023 0.000 1.019 233 F HN -0.196 8.290 8.300 0.310 0.000 0.489 234 D N -1.031 119.474 120.400 0.175 0.000 2.144 234 D HA -0.246 4.455 4.640 0.103 0.000 0.200 234 D C 2.573 178.907 176.300 0.056 0.000 0.978 234 D CA 3.276 57.334 54.000 0.097 0.000 0.833 234 D CB -0.077 40.760 40.800 0.062 0.000 0.961 234 D HN -0.255 8.219 8.370 0.173 0.000 0.470 235 E N -1.082 119.139 120.200 0.035 0.000 2.106 235 E HA -0.227 4.131 4.350 0.012 0.000 0.192 235 E C 2.109 178.711 176.600 0.002 0.000 0.984 235 E CA 2.300 58.706 56.400 0.011 0.000 0.806 235 E CB 0.252 29.950 29.700 -0.003 0.000 0.750 235 E HN -0.362 8.020 8.360 0.037 0.000 0.458 236 K N -4.602 115.792 120.400 -0.011 0.000 2.334 236 K HA -0.059 4.248 4.320 -0.021 0.000 0.195 236 K C 0.711 177.317 176.600 0.009 0.000 1.045 236 K CA 1.885 58.155 56.287 -0.027 0.000 1.004 236 K CB 1.203 33.648 32.500 -0.091 0.000 0.837 236 K HN -0.400 7.840 8.250 -0.016 0.000 0.510 237 V N -5.494 114.452 119.914 0.053 0.000 3.102 237 V HA 0.106 4.276 4.120 0.084 0.000 0.225 237 V C -0.108 176.035 176.094 0.081 0.000 1.301 237 V CA -0.043 62.316 62.300 0.100 0.000 1.308 237 V CB 2.950 34.894 31.823 0.202 0.000 1.129 237 V HN -0.502 7.726 8.190 0.063 0.000 0.502 238 G N 0.729 109.581 108.800 0.088 0.000 3.445 238 G HA2 -0.250 3.728 3.960 0.030 0.000 0.686 238 G HA3 -0.250 4.002 3.960 0.046 -0.264 0.686 238 G C -1.312 173.619 174.900 0.052 0.000 1.113 238 G CA -0.220 44.911 45.100 0.052 0.000 0.974 238 G HN -0.501 7.856 8.290 0.112 0.000 0.492 239 V N 4.944 124.884 119.914 0.045 0.000 2.581 239 V HA 0.279 4.418 4.120 0.032 0.000 0.303 239 V C 0.450 176.538 176.094 -0.009 0.000 1.041 239 V CA -2.151 60.165 62.300 0.026 0.000 0.907 239 V CB 2.992 34.834 31.823 0.032 0.000 0.994 239 V HN -0.112 8.400 8.190 0.041 -0.297 0.442 240 T N 2.446 116.987 114.554 -0.022 0.000 2.990 240 T HA 0.256 4.586 4.350 -0.034 0.000 0.249 240 T C 0.212 174.871 174.700 -0.068 0.000 1.039 240 T CA -0.300 61.782 62.100 -0.030 0.000 1.036 240 T CB 1.785 70.642 68.868 -0.019 0.000 0.994 240 T HN 0.770 9.000 8.240 -0.017 0.000 0.489 241 G N 0.091 108.839 108.800 -0.088 0.000 2.576 241 G HA2 0.408 4.160 3.960 -0.347 0.000 0.290 241 G HA3 0.408 4.242 3.960 -0.375 -0.099 0.290 241 G C -3.354 171.461 174.900 -0.142 0.000 1.442 241 G CA 0.402 45.350 45.100 -0.254 0.000 0.792 241 G HN -0.865 7.395 8.290 -0.049 0.000 0.491 242 L N -1.717 119.387 121.223 -0.197 0.000 2.333 242 L HA 0.855 5.328 4.340 -0.081 -0.182 0.269 242 L C -1.320 175.525 176.870 -0.042 0.000 1.010 242 L CA -1.561 53.211 54.840 -0.114 0.000 0.818 242 L CB 3.655 45.624 42.059 -0.149 0.000 1.306 242 L HN 0.376 8.414 8.230 -0.320 0.000 0.430 243 V N 0.694 120.604 119.914 -0.008 0.000 2.483 243 V HA 0.599 5.140 4.120 0.060 -0.384 0.297 243 V C -1.418 174.652 176.094 -0.039 0.000 1.027 243 V CA -1.508 60.814 62.300 0.036 0.000 0.855 243 V CB 2.173 34.056 31.823 0.099 0.000 0.995 243 V HN 0.407 8.580 8.190 -0.027 0.000 0.424 244 L N 8.338 129.513 121.223 -0.080 0.000 2.265 244 L HA 0.745 5.227 4.340 -0.076 -0.187 0.289 244 L C -0.199 176.646 176.870 -0.041 0.000 1.033 244 L CA -1.543 53.244 54.840 -0.088 0.000 0.814 244 L CB 0.999 42.963 42.059 -0.159 0.000 1.203 244 L HN 0.287 8.457 8.230 -0.101 0.000 0.423 245 T N 1.565 116.105 114.554 -0.024 0.000 2.927 245 T HA 0.344 4.697 4.350 0.005 0.000 0.281 245 T C 0.218 174.920 174.700 0.003 0.000 0.998 245 T CA -2.345 59.752 62.100 -0.004 0.000 1.019 245 T CB 2.633 71.497 68.868 -0.006 0.000 1.061 245 T HN 0.532 8.754 8.240 -0.030 0.000 0.518 246 K N -1.836 118.574 120.400 0.016 0.000 3.129 246 K HA -0.394 4.073 4.320 0.026 -0.131 0.273 246 K C 1.417 178.039 176.600 0.037 0.000 1.123 246 K CA 1.446 57.746 56.287 0.022 0.000 0.800 246 K CB -2.351 30.154 32.500 0.009 0.000 1.238 246 K HN 0.551 8.812 8.250 0.019 0.000 0.492 247 L N -3.361 117.897 121.223 0.058 0.000 2.353 247 L HA -0.271 4.139 4.340 0.116 0.000 0.220 247 L C 0.014 176.959 176.870 0.125 0.000 1.133 247 L CA 2.115 57.021 54.840 0.109 0.000 0.798 247 L CB -0.261 41.876 42.059 0.130 0.000 0.922 247 L HN -0.343 7.897 8.230 0.052 0.021 0.445 248 D N -4.919 115.533 120.400 0.087 0.000 2.363 248 D HA -0.144 4.554 4.640 0.097 0.000 0.220 248 D C 0.305 176.642 176.300 0.061 0.000 0.994 248 D CA -0.206 53.841 54.000 0.079 0.000 0.890 248 D CB -0.228 40.609 40.800 0.062 0.000 0.906 248 D HN -0.212 8.176 8.370 0.072 0.025 0.530 249 G N 0.437 109.265 108.800 0.046 0.000 2.572 249 G HA2 -0.092 3.877 3.960 0.015 0.000 0.261 249 G HA3 -0.092 3.882 3.960 0.023 0.000 0.261 249 G C -0.869 174.041 174.900 0.017 0.000 1.197 249 G CA -0.552 44.562 45.100 0.024 0.000 0.870 249 G HN -0.550 7.614 8.290 0.046 0.154 0.548 250 D N 0.434 120.837 120.400 0.005 0.000 2.352 250 D HA -0.103 4.538 4.640 0.001 0.000 0.245 250 D C -1.222 175.060 176.300 -0.030 0.000 1.224 250 D CA 0.598 54.595 54.000 -0.006 0.000 0.879 250 D CB -0.620 40.179 40.800 -0.003 0.000 1.057 250 D HN 0.060 8.432 8.370 0.004 0.000 0.491 251 A N 2.597 125.382 122.820 -0.058 0.000 2.608 251 A HA 0.202 4.474 4.320 -0.081 0.000 0.292 251 A C -1.054 176.430 177.584 -0.167 0.000 1.066 251 A CA -0.525 51.453 52.037 -0.099 0.000 0.676 251 A CB 3.002 21.940 19.000 -0.103 0.000 1.277 251 A HN -0.450 7.666 8.150 -0.057 0.000 0.413 252 R N 2.841 123.238 120.500 -0.172 0.000 2.096 252 R HA -0.367 3.868 4.340 -0.174 0.000 0.240 252 R C 1.701 177.757 176.300 -0.407 0.000 1.139 252 R CA 3.102 59.075 56.100 -0.212 0.000 0.952 252 R CB 0.267 30.479 30.300 -0.146 0.000 0.854 252 R HN 0.806 8.992 8.270 -0.139 0.000 0.436 253 G N -5.234 103.249 108.800 -0.529 0.000 2.194 253 G HA2 -0.327 2.624 3.960 -1.683 0.000 0.236 253 G HA3 -0.327 3.064 3.960 -0.949 0.000 0.236 253 G C 1.371 175.996 174.900 -0.459 0.000 0.987 253 G CA 0.037 44.565 45.100 -0.954 0.000 0.635 253 G HN 0.067 8.119 8.290 -0.397 0.000 0.520 254 G N 1.249 109.893 108.800 -0.260 0.000 2.418 254 G HA2 -0.316 3.716 3.960 -0.127 0.000 0.217 254 G HA3 -0.316 3.576 3.960 -0.113 0.000 0.217 254 G C -1.265 173.577 174.900 -0.096 0.000 1.158 254 G CA 0.823 45.839 45.100 -0.140 0.000 0.771 254 G HN 0.415 8.508 8.290 -0.249 0.048 0.545 255 A N -0.556 122.202 122.820 -0.103 0.000 2.440 255 A HA -0.159 4.128 4.320 -0.055 0.000 0.251 255 A C -0.676 176.879 177.584 -0.048 0.000 1.089 255 A CA 0.191 52.187 52.037 -0.067 0.000 0.779 255 A CB 0.205 19.164 19.000 -0.068 0.000 1.022 255 A HN -0.503 7.571 8.150 -0.126 0.000 0.492 256 A N 1.958 124.765 122.820 -0.021 0.000 3.995 256 A HA -0.438 3.994 4.320 -0.013 -0.119 0.247 256 A C 1.522 179.142 177.584 0.060 0.000 0.802 256 A CA 2.018 54.052 52.037 -0.004 0.000 1.413 256 A CB -2.345 16.637 19.000 -0.030 0.000 1.038 256 A HN 0.590 8.729 8.150 -0.018 0.000 0.728 257 L N -2.476 118.812 121.223 0.108 0.000 2.270 257 L HA -0.361 4.094 4.340 0.191 0.000 0.217 257 L C 0.480 177.402 176.870 0.087 0.000 1.107 257 L CA 2.595 57.520 54.840 0.141 0.000 0.772 257 L CB -0.148 41.989 42.059 0.129 0.000 0.902 257 L HN -0.448 7.791 8.230 0.093 0.046 0.439 258 S N -3.402 112.323 115.700 0.043 0.000 2.539 258 S HA 0.244 4.741 4.470 0.044 0.000 0.221 258 S C 0.753 175.387 174.600 0.057 0.000 0.987 258 S CA 0.735 58.954 58.200 0.032 0.000 0.929 258 S CB 0.467 63.655 63.200 -0.021 0.000 0.832 258 S HN 0.149 8.391 8.310 0.027 0.084 0.492 259 A N 3.185 126.025 122.820 0.034 0.000 1.908 259 A HA -0.370 3.954 4.320 0.006 0.000 0.218 259 A C 0.982 178.582 177.584 0.026 0.000 1.181 259 A CA 3.670 55.713 52.037 0.010 0.000 0.627 259 A CB -0.872 18.107 19.000 -0.034 0.000 0.818 259 A HN -0.083 7.972 8.150 0.031 0.113 0.445 260 R N -1.880 118.648 120.500 0.046 0.000 2.073 260 R HA -0.415 3.927 4.340 0.003 0.000 0.234 260 R C 1.553 177.898 176.300 0.074 0.000 1.134 260 R CA 3.599 59.723 56.100 0.040 0.000 0.952 260 R CB -0.168 30.161 30.300 0.048 0.000 0.850 260 R HN -0.022 8.281 8.270 0.056 0.000 0.433 261 H N -1.614 117.462 119.070 0.010 0.000 2.321 261 H HA -0.193 4.369 4.556 0.011 0.000 0.300 261 H C 1.648 176.978 175.328 0.004 0.000 1.087 261 H CA 3.121 59.177 56.048 0.013 0.000 1.319 261 H CB 0.074 29.854 29.762 0.029 0.000 1.379 261 H HN -0.638 7.780 8.280 0.230 0.000 0.501 262 V N -0.502 119.535 119.914 0.205 0.000 2.599 262 V HA -0.142 4.081 4.120 0.172 0.000 0.245 262 V C 1.723 177.851 176.094 0.058 0.000 1.046 262 V CA 3.033 65.412 62.300 0.131 0.000 1.065 262 V CB 0.442 32.313 31.823 0.081 0.000 0.703 262 V HN -0.016 8.277 8.190 0.172 0.000 0.464 263 T N -4.361 110.212 114.554 0.033 0.000 3.023 263 T HA 0.072 4.428 4.350 0.010 0.000 0.249 263 T C 1.344 176.037 174.700 -0.012 0.000 1.050 263 T CA 0.247 62.351 62.100 0.006 0.000 1.088 263 T CB 1.895 70.758 68.868 -0.008 0.000 0.946 263 T HN 0.153 8.415 8.240 0.036 0.000 0.480 264 G N 3.596 112.386 108.800 -0.017 0.000 2.166 264 G HA2 -0.494 3.445 3.960 -0.035 0.000 0.260 264 G HA3 -0.494 3.559 3.960 -0.035 -0.114 0.260 264 G C -0.954 173.911 174.900 -0.058 0.000 0.986 264 G CA 0.804 45.883 45.100 -0.035 0.000 0.683 264 G HN -0.387 7.901 8.290 -0.004 0.000 0.527 265 K N 0.535 120.891 120.400 -0.074 0.000 2.164 265 K HA 0.548 4.788 4.320 -0.133 0.000 0.258 265 K C -2.003 174.485 176.600 -0.185 0.000 0.951 265 K CA -3.722 52.487 56.287 -0.130 0.000 0.844 265 K CB -0.012 32.413 32.500 -0.124 0.000 1.099 265 K HN -0.617 7.558 8.250 -0.062 0.038 0.435 266 P HA 0.153 4.436 4.420 -0.228 0.000 0.274 266 P C -1.273 175.751 177.300 -0.460 0.000 1.231 266 P CA -0.502 62.370 63.100 -0.379 0.000 0.790 266 P CB 0.818 32.169 31.700 -0.582 0.000 0.951 267 I N -0.335 120.057 120.570 -0.297 0.000 2.304 267 I HA -0.044 4.093 4.170 -0.305 -0.150 0.291 267 I C -0.145 175.861 176.117 -0.185 0.000 1.018 267 I CA 0.163 61.297 61.300 -0.277 0.000 1.260 267 I CB -0.117 37.653 38.000 -0.384 0.000 1.390 267 I HN 0.097 8.203 8.210 -0.172 0.000 0.475 268 Y N 3.829 124.010 120.300 -0.197 0.000 2.389 268 Y HA 0.167 4.652 4.550 -0.424 -0.190 0.292 268 Y C -0.487 174.923 175.900 -0.816 0.000 1.117 268 Y CA -0.117 57.689 58.100 -0.490 0.000 1.195 268 Y CB 1.693 39.822 38.460 -0.552 0.000 1.076 268 Y HN 0.376 8.567 8.280 -0.149 0.000 0.548 269 F N -5.138 114.858 119.950 0.076 0.000 2.599 269 F HA 0.673 5.478 4.527 -0.034 -0.298 0.311 269 F C -2.189 173.580 175.800 -0.052 0.000 1.076 269 F CA -1.785 56.207 58.000 -0.014 0.000 0.937 269 F CB 5.149 44.120 39.000 -0.048 0.000 1.282 269 F HN -0.812 7.534 8.300 0.076 0.000 0.460 270 A N -0.574 122.345 122.820 0.164 0.000 2.455 270 A HA 0.797 5.289 4.320 0.020 -0.160 0.300 270 A C -1.970 175.667 177.584 0.088 0.000 1.040 270 A CA -1.409 50.668 52.037 0.067 0.000 0.697 270 A CB 3.835 22.842 19.000 0.011 0.000 1.265 270 A HN 0.738 9.005 8.150 0.194 0.000 0.407 271 G N 0.790 109.621 108.800 0.053 0.000 2.338 271 G HA2 0.410 4.389 3.960 0.032 0.000 0.295 271 G HA3 0.410 4.547 3.960 0.048 -0.149 0.295 271 G C -1.132 173.803 174.900 0.058 0.000 1.132 271 G CA -0.282 44.846 45.100 0.047 0.000 0.922 271 G HN 0.562 8.872 8.290 0.032 0.000 0.427 272 V N 4.141 124.095 119.914 0.067 0.000 3.621 272 V HA 0.114 4.282 4.120 0.080 0.000 0.263 272 V C -0.625 175.505 176.094 0.059 0.000 1.272 272 V CA -0.054 62.291 62.300 0.074 0.000 1.080 272 V CB 0.600 32.476 31.823 0.088 0.000 0.816 272 V HN 0.455 8.684 8.190 0.065 0.000 0.451 273 S N -3.945 111.784 115.700 0.048 0.000 2.661 273 S HA 0.172 4.665 4.470 0.038 0.000 0.268 273 S C 0.468 175.087 174.600 0.031 0.000 1.162 273 S CA -0.867 57.356 58.200 0.040 0.000 0.817 273 S CB 1.198 64.422 63.200 0.041 0.000 1.141 273 S HN -0.877 7.460 8.310 0.046 0.000 0.477 274 E N -0.588 119.628 120.200 0.027 0.000 2.385 274 E HA -0.042 4.320 4.350 0.020 0.000 0.194 274 E C 0.336 176.948 176.600 0.021 0.000 1.013 274 E CA 0.636 57.049 56.400 0.021 0.000 0.866 274 E CB -0.029 29.682 29.700 0.018 0.000 0.832 274 E HN 0.271 8.647 8.360 0.027 0.000 0.500 275 K N 0.309 120.724 120.400 0.025 0.000 2.397 275 K HA -0.058 4.275 4.320 0.022 0.000 0.265 275 K C 0.289 176.905 176.600 0.026 0.000 0.982 275 K CA -0.381 55.921 56.287 0.025 0.000 0.931 275 K CB -0.442 32.075 32.500 0.029 0.000 0.943 275 K HN -1.022 7.244 8.250 0.027 0.000 0.501 276 P HA -0.180 4.253 4.420 0.022 0.000 0.222 276 P C -0.224 177.098 177.300 0.036 0.000 1.147 276 P CA 2.423 65.539 63.100 0.026 0.000 0.790 276 P CB 0.253 31.966 31.700 0.023 0.000 0.780 277 E N -5.170 115.056 120.200 0.043 0.000 2.465 277 E HA -0.047 4.347 4.350 0.072 0.000 0.191 277 E C 0.775 177.412 176.600 0.061 0.000 1.053 277 E CA -0.320 56.116 56.400 0.061 0.000 0.869 277 E CB -0.699 29.039 29.700 0.063 0.000 0.977 277 E HN -0.136 8.222 8.360 0.040 0.025 0.483 278 G N -1.719 107.109 108.800 0.047 0.000 2.679 278 G HA2 -0.121 4.024 3.960 0.042 0.000 0.212 278 G HA3 -0.121 3.872 3.960 0.055 0.000 0.212 278 G C -1.603 173.326 174.900 0.047 0.000 1.137 278 G CA 0.654 45.783 45.100 0.048 0.000 0.787 278 G HN -0.246 7.832 8.290 0.040 0.236 0.534 279 L N -0.217 121.026 121.223 0.032 0.000 2.257 279 L HA 0.664 5.210 4.340 0.032 -0.186 0.290 279 L C -1.523 175.351 176.870 0.008 0.000 1.044 279 L CA -0.676 54.171 54.840 0.011 0.000 0.810 279 L CB 1.048 43.076 42.059 -0.052 0.000 1.193 279 L HN -0.583 7.611 8.230 0.030 0.054 0.425 280 E N 7.027 127.262 120.200 0.057 0.000 2.277 280 E HA 0.494 4.852 4.350 0.014 0.000 0.266 280 E C -2.645 173.981 176.600 0.042 0.000 0.901 280 E CA -3.472 52.958 56.400 0.051 0.000 0.782 280 E CB 2.271 32.039 29.700 0.113 0.000 1.228 280 E HN 0.625 9.036 8.360 0.086 0.000 0.424 281 P HA -0.023 4.409 4.420 -0.442 -0.277 0.266 281 P C -1.285 175.665 177.300 -0.583 0.000 1.195 281 P CA 0.416 63.272 63.100 -0.406 0.000 0.768 281 P CB 0.401 31.830 31.700 -0.451 0.000 0.838 282 F N 5.361 124.942 119.950 -0.615 0.000 2.420 282 F HA 0.061 4.386 4.527 -0.336 0.000 0.352 282 F C -2.014 173.455 175.800 -0.551 0.000 1.108 282 F CA -0.439 57.293 58.000 -0.446 0.000 1.162 282 F CB 1.849 40.707 39.000 -0.236 0.000 1.118 282 F HN 0.071 8.090 8.300 -0.302 0.101 0.510 283 Y N 6.189 126.006 120.300 -0.806 0.000 2.464 283 Y HA 0.211 4.470 4.550 -0.485 0.000 0.326 283 Y C -1.902 173.458 175.900 -0.900 0.000 0.969 283 Y CA -3.638 54.075 58.100 -0.645 0.000 1.270 283 Y CB -0.613 37.660 38.460 -0.310 0.000 1.103 283 Y HN 0.074 7.886 8.280 -0.781 0.000 0.491 284 P HA -0.343 3.707 4.420 -0.617 0.000 0.216 284 P C 0.837 177.992 177.300 -0.242 0.000 1.153 284 P CA 2.578 65.386 63.100 -0.488 0.000 0.858 284 P CB 0.218 31.788 31.700 -0.217 0.000 0.789 285 E N -3.511 116.592 120.200 -0.162 0.000 2.106 285 E HA -0.381 3.886 4.350 -0.139 0.000 0.192 285 E C 1.888 178.507 176.600 0.031 0.000 0.984 285 E CA 3.066 59.425 56.400 -0.068 0.000 0.806 285 E CB -1.358 28.336 29.700 -0.011 0.000 0.750 285 E HN 0.540 8.812 8.360 -0.146 0.000 0.458 286 R N -0.007 120.475 120.500 -0.030 0.000 2.070 286 R HA -0.312 4.033 4.340 0.008 0.000 0.233 286 R C 2.060 178.356 176.300 -0.007 0.000 1.137 286 R CA 3.225 59.318 56.100 -0.012 0.000 0.945 286 R CB -0.136 30.154 30.300 -0.018 0.000 0.845 286 R HN -0.813 7.421 8.270 -0.060 0.000 0.430 287 L N -1.436 119.751 121.223 -0.061 0.000 2.046 287 L HA -0.308 3.997 4.340 -0.058 0.000 0.208 287 L C 1.407 178.243 176.870 -0.056 0.000 1.077 287 L CA 2.845 57.645 54.840 -0.067 0.000 0.747 287 L CB -0.557 41.477 42.059 -0.041 0.000 0.896 287 L HN -0.654 7.500 8.230 -0.127 0.000 0.432 288 A N -2.036 120.776 122.820 -0.013 0.000 1.883 288 A HA -0.375 3.962 4.320 0.029 0.000 0.217 288 A C 2.287 179.995 177.584 0.208 0.000 1.186 288 A CA 3.469 55.543 52.037 0.061 0.000 0.624 288 A CB -1.013 17.954 19.000 -0.055 0.000 0.822 288 A HN 0.018 8.145 8.150 -0.039 0.000 0.444 289 G N -2.437 106.533 108.800 0.283 0.000 2.446 289 G HA2 -0.385 3.638 3.960 0.105 0.000 0.217 289 G HA3 -0.385 3.665 3.960 0.150 0.000 0.217 289 G C 1.517 176.449 174.900 0.053 0.000 1.168 289 G CA 1.704 46.900 45.100 0.159 0.000 0.771 289 G HN -0.406 8.059 8.290 0.291 0.000 0.551 290 R N 1.963 122.479 120.500 0.027 0.000 2.073 290 R HA -0.249 4.220 4.340 0.003 -0.127 0.234 290 R C 3.319 179.622 176.300 0.003 0.000 1.134 290 R CA 3.292 59.393 56.100 0.002 0.000 0.952 290 R CB -0.171 30.121 30.300 -0.014 0.000 0.850 290 R HN -0.477 7.809 8.270 0.027 0.000 0.433 291 I N -0.362 120.200 120.570 -0.013 0.000 2.264 291 I HA -0.372 3.799 4.170 0.003 0.000 0.248 291 I C 1.340 177.485 176.117 0.047 0.000 1.111 291 I CA 3.876 65.177 61.300 0.003 0.000 1.382 291 I CB 0.143 38.129 38.000 -0.023 0.000 1.060 291 I HN -0.262 7.931 8.210 -0.027 0.000 0.418 292 L N -6.219 115.040 121.223 0.060 0.000 2.611 292 L HA -0.090 4.287 4.340 0.062 0.000 0.229 292 L C 0.202 177.087 176.870 0.025 0.000 1.137 292 L CA -0.369 54.506 54.840 0.058 0.000 0.901 292 L CB -0.430 41.682 42.059 0.088 0.000 1.098 292 L HN -0.839 7.317 8.230 0.070 0.116 0.456 293 G N -1.840 106.970 108.800 0.017 0.000 2.143 293 G HA2 -0.371 3.593 3.960 0.006 0.000 0.249 293 G HA3 -0.371 3.594 3.960 0.008 0.000 0.249 293 G C -0.420 174.471 174.900 -0.014 0.000 0.981 293 G CA 0.193 45.295 45.100 0.004 0.000 0.665 293 G HN -0.189 7.822 8.290 0.020 0.292 0.528 294 M N 0.679 120.262 119.600 -0.029 0.000 2.409 294 M HA 0.169 4.615 4.480 -0.057 0.000 0.329 294 M C -0.047 176.225 176.300 -0.046 0.000 1.180 294 M CA 0.275 55.539 55.300 -0.059 0.000 1.053 294 M CB 1.235 33.761 32.600 -0.124 0.000 1.586 294 M HN -0.415 7.826 8.290 -0.022 0.036 0.461 295 G N 2.031 110.801 108.800 -0.051 0.000 2.562 295 G HA2 -0.397 3.538 3.960 -0.041 0.000 0.250 295 G HA3 -0.397 3.536 3.960 -0.044 0.000 0.250 295 G C -1.270 173.616 174.900 -0.024 0.000 1.269 295 G CA -0.136 44.940 45.100 -0.040 0.000 0.919 295 G HN 0.331 8.587 8.290 -0.057 0.000 0.574 296 D N 0.000 120.389 120.400 -0.018 0.000 6.856 296 D HA 0.000 4.635 4.640 -0.009 0.000 0.175 296 D CA 0.000 53.995 54.000 -0.008 0.000 0.868 296 D CB 0.000 40.796 40.800 -0.007 0.000 0.688 296 D HN 0.000 8.358 8.370 -0.020 0.000 0.683