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 3ip3_1_C DATA FIRST_RESID 1 DATA SEQUENCE SLKICVIGSS GHFRYALEGL DEECSITGIA PGVPEEDLSK LEKAISEXNI DATA SEQUENCE KPKKYNNWWE XLEKEKPDIL VINTVFSLNG KILLEALERK IHAFVEKPIA DATA SEQUENCE TTFEDLEKIR SVYQKVRNEV FFTAXFGIRY RPHFLTAKKL VSEGAVGEIR DATA SEQUENCE LVNTQKSYKL GQRPDFYKKR ETYGGTIPWV GIHAIDWIHW ITGKKFLSVY DATA SEQUENCE ATHSRLHNSG HGELETTALC HFTLENEVFA SLSIDYLRPQ GAPTHDDDRX DATA SEQUENCE RIVGTRGIVE VINERVFLTD EKGHREVPLV EKGQIFEDFL REIRGQGKCX DATA SEQUENCE VTPEDSILTT EIALKARLSA DTGQIVLIEG 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 S HA 0.000 4.470 4.470 -0.000 0.000 0.327 1 S C 0.000 174.638 174.600 0.064 0.000 1.055 1 S CA 0.000 58.230 58.200 0.050 0.000 1.107 1 S CB 0.000 63.225 63.200 0.041 0.000 0.593 2 L N 3.526 124.796 121.223 0.078 0.000 2.290 2 L HA 0.514 4.853 4.340 -0.001 0.000 0.284 2 L C -0.255 176.683 176.870 0.114 0.000 1.078 2 L CA -0.271 54.632 54.840 0.105 0.000 0.815 2 L CB 1.141 43.276 42.059 0.127 0.000 1.162 2 L HN 0.201 8.431 8.230 -0.000 0.000 0.435 3 K N 4.825 125.292 120.400 0.112 0.000 2.172 3 K HA 0.593 4.913 4.320 -0.001 0.000 0.276 3 K C -0.785 175.895 176.600 0.134 0.000 1.013 3 K CA -0.385 55.967 56.287 0.109 0.000 0.913 3 K CB 1.679 34.233 32.500 0.090 0.000 1.055 3 K HN 0.446 8.696 8.250 -0.000 0.000 0.461 4 I N 2.529 123.177 120.570 0.130 0.000 2.465 4 I HA 0.252 4.421 4.170 -0.001 0.000 0.291 4 I C -0.484 175.696 176.117 0.105 0.000 1.014 4 I CA -0.830 60.554 61.300 0.140 0.000 1.093 4 I CB 1.721 39.812 38.000 0.151 0.000 1.267 4 I HN 0.571 8.781 8.210 -0.000 0.000 0.431 5 C N 5.340 124.701 119.300 0.101 0.000 2.454 5 C HA 0.720 5.180 4.460 -0.001 0.000 0.336 5 C C 0.081 175.111 174.990 0.066 0.000 1.189 5 C CA -0.561 58.505 59.018 0.079 0.000 1.877 5 C CB 1.766 29.547 27.740 0.068 0.000 2.348 5 C HN 0.458 8.688 8.230 -0.000 0.000 0.508 6 V N 3.476 123.418 119.914 0.047 0.000 2.540 6 V HA 0.507 4.626 4.120 -0.001 0.000 0.302 6 V C -0.394 175.707 176.094 0.012 0.000 1.035 6 V CA -0.253 62.061 62.300 0.022 0.000 0.873 6 V CB 1.550 33.368 31.823 -0.008 0.000 0.992 6 V HN 0.688 8.878 8.190 -0.000 0.000 0.428 7 I N 4.176 124.735 120.570 -0.017 0.000 2.362 7 I HA 0.773 4.942 4.170 -0.001 0.000 0.289 7 I C 0.685 176.766 176.117 -0.060 0.000 0.994 7 I CA 0.024 61.292 61.300 -0.052 0.000 1.158 7 I CB 1.447 39.348 38.000 -0.165 0.000 1.315 7 I HN 0.924 9.134 8.210 -0.000 0.000 0.451 8 G N 3.935 112.708 108.800 -0.045 0.000 2.707 8 G HA2 -0.140 3.819 3.960 -0.001 0.000 0.686 8 G HA3 -0.140 3.819 3.960 -0.001 0.000 0.686 8 G C -0.127 174.757 174.900 -0.026 0.000 1.315 8 G CA -0.108 44.971 45.100 -0.034 0.000 0.832 8 G HN 0.620 8.910 8.290 -0.000 0.000 0.573 9 S N -1.047 114.664 115.700 0.018 0.000 3.073 9 S HA 0.470 4.939 4.470 -0.001 0.000 0.252 9 S C 1.207 175.947 174.600 0.234 0.000 0.953 9 S CA 0.917 59.139 58.200 0.036 0.000 1.105 9 S CB -0.167 62.971 63.200 -0.103 0.000 1.070 9 S HN 1.282 9.592 8.310 -0.000 0.000 0.574 10 S N 0.656 116.503 115.700 0.246 0.000 2.568 10 S HA 0.478 4.947 4.470 -0.001 0.000 0.232 10 S C 0.719 175.575 174.600 0.428 0.000 0.975 10 S CA -0.066 58.335 58.200 0.335 0.000 0.949 10 S CB 0.958 64.364 63.200 0.343 0.000 0.829 10 S HN 0.635 8.945 8.310 -0.000 0.000 0.479 11 G N 0.203 109.214 108.800 0.352 0.000 3.135 11 G HA2 0.481 4.441 3.960 -0.001 0.000 0.278 11 G HA3 0.481 4.441 3.960 -0.001 0.000 0.278 11 G C -1.372 173.522 174.900 -0.009 0.000 1.302 11 G CA -0.809 44.465 45.100 0.291 0.000 0.880 11 G HN 0.340 8.630 8.290 -0.000 0.000 0.574 12 H N 1.030 120.104 119.070 0.007 0.000 2.768 12 H HA 0.183 4.738 4.556 -0.001 0.000 0.228 12 H C 1.380 176.551 175.328 -0.261 0.000 1.812 12 H CA -0.450 55.420 56.048 -0.296 0.000 1.273 12 H CB -0.735 28.812 29.762 -0.359 0.000 1.631 12 H HN 0.437 8.717 8.280 -0.000 0.000 0.526 13 F N -0.462 119.501 119.950 0.021 0.000 2.236 13 F HA -0.197 4.329 4.527 -0.001 0.000 0.302 13 F C 1.922 177.719 175.800 -0.005 0.000 1.073 13 F CA 0.860 58.869 58.000 0.014 0.000 1.336 13 F CB -0.301 38.692 39.000 -0.012 0.000 1.040 13 F HN 0.102 8.402 8.300 -0.000 0.000 0.507 14 R N -0.652 119.549 120.500 -0.498 0.000 2.200 14 R HA -0.175 4.164 4.340 -0.001 0.000 0.234 14 R C 1.942 178.203 176.300 -0.065 0.000 1.127 14 R CA 1.408 57.355 56.100 -0.255 0.000 0.989 14 R CB -0.684 29.370 30.300 -0.410 0.000 0.869 14 R HN 0.330 8.600 8.270 -0.000 0.000 0.459 15 Y N 0.411 120.716 120.300 0.008 0.000 2.165 15 Y HA -0.228 4.321 4.550 -0.001 0.000 0.286 15 Y C 2.475 178.363 175.900 -0.021 0.000 1.155 15 Y CA 0.970 59.121 58.100 0.085 0.000 1.164 15 Y CB -0.795 37.813 38.460 0.247 0.000 0.978 15 Y HN 0.095 8.375 8.280 -0.000 0.000 0.513 16 A N 0.096 122.916 122.820 0.000 0.000 1.845 16 A HA -0.144 4.175 4.320 -0.001 0.000 0.215 16 A C 2.345 179.644 177.584 -0.475 0.000 1.195 16 A CA 1.684 53.244 52.037 -0.795 0.000 0.616 16 A CB -1.179 17.374 19.000 -0.746 0.000 0.832 16 A HN 0.426 8.576 8.150 -0.000 0.000 0.443 17 L N -0.785 120.346 121.223 -0.153 0.000 2.079 17 L HA -0.222 4.118 4.340 -0.001 0.000 0.210 17 L C 2.291 179.163 176.870 0.004 0.000 1.081 17 L CA 1.782 56.598 54.840 -0.039 0.000 0.752 17 L CB -0.693 41.404 42.059 0.062 0.000 0.896 17 L HN 0.439 8.669 8.230 -0.000 0.000 0.433 18 E N -0.284 119.932 120.200 0.026 0.000 2.511 18 E HA -0.044 4.305 4.350 -0.001 0.000 0.196 18 E C 1.735 178.384 176.600 0.081 0.000 1.066 18 E CA 0.510 56.945 56.400 0.058 0.000 0.871 18 E CB 0.098 29.842 29.700 0.072 0.000 0.863 18 E HN 0.481 8.841 8.360 -0.000 0.000 0.520 19 G N -0.064 108.800 108.800 0.106 0.000 3.192 19 G HA2 0.175 4.135 3.960 -0.001 0.000 0.239 19 G HA3 0.175 4.135 3.960 -0.001 0.000 0.239 19 G C 0.329 175.378 174.900 0.249 0.000 1.084 19 G CA -0.379 44.836 45.100 0.192 0.000 0.784 19 G HN 0.003 8.293 8.290 -0.000 0.000 0.540 20 L N 1.557 122.885 121.223 0.175 0.000 2.467 20 L HA 0.367 4.707 4.340 -0.001 0.000 0.270 20 L C 0.197 177.136 176.870 0.114 0.000 1.205 20 L CA -0.157 54.781 54.840 0.163 0.000 0.828 20 L CB 0.804 42.918 42.059 0.093 0.000 1.101 20 L HN 0.339 8.569 8.230 -0.000 0.000 0.479 21 D N -1.108 119.354 120.400 0.103 0.000 2.652 21 D HA 0.205 4.844 4.640 -0.001 0.000 0.285 21 D C 0.123 176.460 176.300 0.062 0.000 1.173 21 D CA -0.687 53.354 54.000 0.069 0.000 0.981 21 D CB 0.747 41.580 40.800 0.054 0.000 1.440 21 D HN 0.315 8.685 8.370 -0.000 0.000 0.485 22 E N -0.608 119.621 120.200 0.048 0.000 2.209 22 E HA -0.098 4.251 4.350 -0.001 0.000 0.196 22 E C 0.949 177.575 176.600 0.045 0.000 0.993 22 E CA 1.028 57.453 56.400 0.042 0.000 0.819 22 E CB -0.008 29.712 29.700 0.033 0.000 0.745 22 E HN 0.396 8.756 8.360 -0.000 0.000 0.477 23 E N -0.230 119.997 120.200 0.045 0.000 2.494 23 E HA 0.027 4.377 4.350 -0.001 0.000 0.193 23 E C -0.092 176.545 176.600 0.061 0.000 1.074 23 E CA 0.138 56.565 56.400 0.044 0.000 0.867 23 E CB -0.313 29.406 29.700 0.032 0.000 0.924 23 E HN 0.331 8.691 8.360 -0.000 0.000 0.502 24 C N -0.956 118.390 119.300 0.077 0.000 2.994 24 C HA 0.873 5.332 4.460 -0.001 0.000 0.304 24 C C -0.056 174.990 174.990 0.093 0.000 1.273 24 C CA -1.266 57.812 59.018 0.099 0.000 1.537 24 C CB 1.538 29.364 27.740 0.144 0.000 2.001 24 C HN 0.133 8.363 8.230 -0.000 0.000 0.471 25 S N 0.029 115.786 115.700 0.095 0.000 2.537 25 S HA 0.736 5.205 4.470 -0.001 0.000 0.270 25 S C -1.279 173.371 174.600 0.084 0.000 1.142 25 S CA -0.603 57.645 58.200 0.080 0.000 0.870 25 S CB 0.788 64.027 63.200 0.065 0.000 1.112 25 S HN 0.784 9.094 8.310 -0.000 0.000 0.466 26 I N 2.974 123.586 120.570 0.069 0.000 2.301 26 I HA 0.277 4.446 4.170 -0.001 0.000 0.292 26 I C 1.267 177.425 176.117 0.068 0.000 1.046 26 I CA -0.369 60.970 61.300 0.065 0.000 1.282 26 I CB 1.471 39.497 38.000 0.043 0.000 1.409 26 I HN 1.009 9.219 8.210 -0.000 0.000 0.484 27 T N 0.817 115.421 114.554 0.084 0.000 3.054 27 T HA 0.379 4.728 4.350 -0.001 0.000 0.255 27 T C 0.542 175.323 174.700 0.135 0.000 1.035 27 T CA -0.239 61.919 62.100 0.096 0.000 0.941 27 T CB 0.459 69.385 68.868 0.097 0.000 1.026 27 T HN 0.669 8.909 8.240 -0.000 0.000 0.533 28 G N 1.527 110.408 108.800 0.134 0.000 2.755 28 G HA2 0.596 4.556 3.960 -0.001 0.000 0.297 28 G HA3 0.596 4.556 3.960 -0.001 0.000 0.297 28 G C -1.509 173.481 174.900 0.149 0.000 1.441 28 G CA -1.056 44.166 45.100 0.203 0.000 0.964 28 G HN 0.711 9.001 8.290 -0.000 0.000 0.540 29 I N -0.880 119.800 120.570 0.183 0.000 2.722 29 I HA 0.959 5.128 4.170 -0.001 0.000 0.295 29 I C -0.475 175.743 176.117 0.169 0.000 1.161 29 I CA -1.333 60.035 61.300 0.113 0.000 1.032 29 I CB 2.366 40.385 38.000 0.031 0.000 1.244 29 I HN 0.990 9.200 8.210 -0.000 0.000 0.421 30 A N 5.087 127.985 122.820 0.130 0.000 2.594 30 A HA 0.970 5.289 4.320 -0.001 0.000 0.295 30 A C -3.096 174.555 177.584 0.112 0.000 1.071 30 A CA -1.408 50.730 52.037 0.169 0.000 0.685 30 A CB 1.781 20.931 19.000 0.250 0.000 1.285 30 A HN 0.577 8.727 8.150 -0.000 0.000 0.405 31 P HA 0.351 4.771 4.420 -0.000 0.000 0.278 31 P C 0.767 178.137 177.300 0.115 0.000 1.266 31 P CA 0.248 63.395 63.100 0.078 0.000 0.807 31 P CB 1.027 32.769 31.700 0.070 0.000 1.094 32 G N -0.285 108.526 108.800 0.020 0.000 2.459 32 G HA2 0.206 4.165 3.960 -0.001 0.000 0.213 32 G HA3 0.206 4.165 3.960 -0.001 0.000 0.213 32 G C 0.196 175.153 174.900 0.095 0.000 1.155 32 G CA 0.498 45.577 45.100 -0.034 0.000 0.811 32 G HN 0.567 8.857 8.290 -0.000 0.000 0.534 33 V N -3.894 116.050 119.914 0.051 0.000 2.962 33 V HA 0.581 4.700 4.120 -0.001 0.000 0.313 33 V C -2.044 174.090 176.094 0.067 0.000 1.099 33 V CA -2.127 60.215 62.300 0.071 0.000 0.971 33 V CB 1.916 33.743 31.823 0.008 0.000 1.028 33 V HN -0.085 8.105 8.190 -0.000 0.000 0.430 34 P HA -0.198 4.222 4.420 -0.000 0.000 0.216 34 P C 1.243 178.564 177.300 0.036 0.000 1.154 34 P CA 2.109 65.242 63.100 0.055 0.000 0.865 34 P CB 0.167 31.893 31.700 0.044 0.000 0.789 35 E N -0.432 119.785 120.200 0.028 0.000 2.478 35 E HA -0.045 4.304 4.350 -0.001 0.000 0.194 35 E C 0.590 177.204 176.600 0.022 0.000 1.045 35 E CA 0.125 56.538 56.400 0.021 0.000 0.868 35 E CB -0.627 29.084 29.700 0.019 0.000 0.885 35 E HN 0.353 8.713 8.360 -0.000 0.000 0.505 36 E N 2.006 122.219 120.200 0.021 0.000 2.452 36 E HA -0.078 4.271 4.350 -0.001 0.000 0.261 36 E C -0.498 176.115 176.600 0.021 0.000 0.987 36 E CA -0.140 56.273 56.400 0.022 0.000 0.926 36 E CB 0.439 30.139 29.700 0.001 0.000 0.934 36 E HN -0.066 8.294 8.360 -0.000 0.000 0.452 37 D N 4.930 125.348 120.400 0.030 0.000 2.344 37 D HA 0.011 4.651 4.640 -0.001 0.000 0.253 37 D C 0.511 176.813 176.300 0.004 0.000 1.255 37 D CA 0.122 54.131 54.000 0.015 0.000 0.894 37 D CB 0.473 41.283 40.800 0.017 0.000 1.067 37 D HN 0.472 8.842 8.370 -0.000 0.000 0.492 38 L N 2.912 124.124 121.223 -0.018 0.000 2.592 38 L HA -0.021 4.318 4.340 -0.001 0.000 0.227 38 L C 2.253 179.077 176.870 -0.078 0.000 1.127 38 L CA 0.037 54.842 54.840 -0.058 0.000 0.884 38 L CB -0.236 41.790 42.059 -0.056 0.000 1.065 38 L HN 0.352 8.582 8.230 -0.000 0.000 0.457 39 S N 0.128 115.804 115.700 -0.040 0.000 2.383 39 S HA -0.231 4.239 4.470 -0.001 0.000 0.229 39 S C 1.889 176.470 174.600 -0.030 0.000 1.030 39 S CA 1.040 59.220 58.200 -0.033 0.000 1.002 39 S CB -0.124 63.068 63.200 -0.014 0.000 0.829 39 S HN 0.375 8.685 8.310 -0.000 0.000 0.467 40 K N 0.679 121.078 120.400 -0.002 0.000 2.057 40 K HA 0.082 4.401 4.320 -0.001 0.000 0.207 40 K C 2.124 178.684 176.600 -0.068 0.000 1.049 40 K CA 1.240 57.579 56.287 0.087 0.000 0.931 40 K CB -0.453 32.216 32.500 0.282 0.000 0.714 40 K HN 0.324 8.574 8.250 -0.000 0.000 0.440 41 L N 1.818 122.751 121.223 -0.483 0.000 1.994 41 L HA -0.171 4.168 4.340 -0.001 0.000 0.208 41 L C 1.783 178.446 176.870 -0.345 0.000 1.071 41 L CA 1.837 56.154 54.840 -0.872 0.000 0.745 41 L CB -0.348 41.208 42.059 -0.837 0.000 0.892 41 L HN 0.142 8.372 8.230 -0.000 0.000 0.431 42 E N -0.417 119.661 120.200 -0.204 0.000 2.097 42 E HA -0.307 4.043 4.350 -0.001 0.000 0.196 42 E C 2.162 178.725 176.600 -0.062 0.000 1.000 42 E CA 1.649 57.986 56.400 -0.105 0.000 0.804 42 E CB -0.200 29.457 29.700 -0.071 0.000 0.740 42 E HN 0.474 8.834 8.360 -0.000 0.000 0.454 43 K N 0.649 121.023 120.400 -0.043 0.000 2.002 43 K HA -0.150 4.170 4.320 -0.001 0.000 0.209 43 K C 2.176 178.787 176.600 0.018 0.000 1.048 43 K CA 1.295 57.580 56.287 -0.002 0.000 0.930 43 K CB -0.151 32.360 32.500 0.019 0.000 0.714 43 K HN 0.092 8.342 8.250 -0.000 0.000 0.438 44 A N 1.981 124.830 122.820 0.049 0.000 1.972 44 A HA -0.124 4.196 4.320 -0.001 0.000 0.219 44 A C 2.119 179.733 177.584 0.049 0.000 1.169 44 A CA 1.596 53.690 52.037 0.094 0.000 0.635 44 A CB -0.786 18.365 19.000 0.252 0.000 0.810 44 A HN 0.635 8.785 8.150 -0.000 0.000 0.446 45 I N -3.094 117.478 120.570 0.003 0.000 2.353 45 I HA -0.105 4.065 4.170 -0.001 0.000 0.248 45 I C 2.076 178.195 176.117 0.004 0.000 1.119 45 I CA 1.831 63.130 61.300 -0.001 0.000 1.417 45 I CB -0.584 37.400 38.000 -0.027 0.000 1.078 45 I HN 0.103 8.313 8.210 -0.000 0.000 0.421 46 S N 0.726 116.425 115.700 -0.002 0.000 2.370 46 S HA -0.142 4.328 4.470 -0.001 0.000 0.226 46 S C 0.984 175.590 174.600 0.010 0.000 1.033 46 S CA 1.099 59.300 58.200 0.002 0.000 1.011 46 S CB -0.463 62.735 63.200 -0.002 0.000 0.852 46 S HN 0.564 8.874 8.310 -0.000 0.000 0.457 50 I N 0.163 120.743 120.570 0.017 0.000 2.532 50 I HA 0.412 4.581 4.170 -0.001 0.000 0.292 50 I C -0.550 175.574 176.117 0.012 0.000 1.014 50 I CA 0.144 61.455 61.300 0.018 0.000 1.340 50 I CB 1.543 39.557 38.000 0.024 0.000 1.422 50 I HN -0.013 8.197 8.210 -0.000 0.000 0.528 51 K N 7.087 127.495 120.400 0.014 0.000 2.954 51 K HA 0.512 4.832 4.320 -0.001 0.000 0.171 51 K C -2.534 174.073 176.600 0.013 0.000 1.079 51 K CA -1.321 54.971 56.287 0.008 0.000 0.908 51 K CB 0.417 32.920 32.500 0.005 0.000 1.142 51 K HN 0.530 8.780 8.250 -0.000 0.000 0.613 52 P HA 0.130 4.550 4.420 -0.000 0.000 0.276 52 P C -1.026 176.289 177.300 0.025 0.000 1.252 52 P CA -0.628 62.494 63.100 0.037 0.000 0.802 52 P CB 0.737 32.466 31.700 0.048 0.000 1.035 53 K N 1.567 121.992 120.400 0.042 0.000 2.276 53 K HA 0.120 4.440 4.320 -0.001 0.000 0.283 53 K C 0.109 176.697 176.600 -0.019 0.000 1.044 53 K CA -0.356 55.908 56.287 -0.040 0.000 0.944 53 K CB 0.482 32.915 32.500 -0.112 0.000 1.012 53 K HN 0.350 8.600 8.250 -0.000 0.000 0.472 54 K N 3.917 124.266 120.400 -0.087 0.000 2.234 54 K HA 0.122 4.442 4.320 -0.001 0.000 0.282 54 K C -1.243 175.291 176.600 -0.111 0.000 1.039 54 K CA -0.244 56.032 56.287 -0.017 0.000 0.928 54 K CB 0.476 32.961 32.500 -0.024 0.000 1.039 54 K HN 0.385 8.635 8.250 -0.000 0.000 0.470 55 Y N 2.012 122.332 120.300 0.033 0.000 2.509 55 Y HA 0.212 4.762 4.550 -0.001 0.000 0.341 55 Y C 1.140 177.067 175.900 0.045 0.000 1.038 55 Y CA -0.721 57.402 58.100 0.039 0.000 1.089 55 Y CB 1.710 40.206 38.460 0.061 0.000 1.241 55 Y HN 0.652 8.932 8.280 -0.000 0.000 0.468 56 N N 0.553 119.370 118.700 0.195 0.000 2.333 56 N HA -0.092 4.648 4.740 -0.001 0.000 0.178 56 N C -0.303 175.294 175.510 0.146 0.000 1.018 56 N CA 0.719 53.844 53.050 0.126 0.000 0.882 56 N CB 0.259 38.783 38.487 0.061 0.000 0.984 56 N HN 0.534 8.914 8.380 -0.000 0.000 0.434 57 N N 1.009 119.802 118.700 0.155 0.000 2.443 57 N HA 0.017 4.756 4.740 -0.001 0.000 0.269 57 N C 1.071 176.649 175.510 0.114 0.000 0.985 57 N CA -0.513 52.581 53.050 0.074 0.000 0.921 57 N CB 0.871 39.318 38.487 -0.067 0.000 1.195 57 N HN 0.202 8.582 8.380 -0.000 0.000 0.492 58 W N 3.975 125.385 121.300 0.183 0.000 2.425 58 W HA -0.036 4.623 4.660 -0.001 0.000 0.277 58 W C 0.388 176.984 176.519 0.128 0.000 1.231 58 W CA 0.096 57.499 57.345 0.098 0.000 1.248 58 W CB -0.812 28.676 29.460 0.047 0.000 1.117 58 W HN 0.489 8.669 8.180 -0.000 0.000 0.568 59 W N 1.858 122.702 121.300 -0.760 0.000 2.333 59 W HA -0.038 4.622 4.660 -0.001 0.000 0.316 59 W C 1.681 178.044 176.519 -0.260 0.000 1.215 59 W CA 0.923 57.924 57.345 -0.572 0.000 1.278 59 W CB -1.622 27.475 29.460 -0.605 0.000 1.154 59 W HN -0.058 8.122 8.180 -0.000 0.000 0.486 63 E N 0.731 120.929 120.200 -0.003 0.000 2.097 63 E HA -0.160 4.190 4.350 -0.001 0.000 0.196 63 E C 1.737 178.339 176.600 0.003 0.000 1.000 63 E CA 1.829 58.235 56.400 0.010 0.000 0.804 63 E CB 0.174 29.881 29.700 0.012 0.000 0.740 63 E HN 0.379 8.739 8.360 -0.000 0.000 0.454 64 K N -0.527 119.859 120.400 -0.023 0.000 2.276 64 K HA 0.061 4.381 4.320 -0.001 0.000 0.198 64 K C 1.725 178.344 176.600 0.033 0.000 1.052 64 K CA 0.499 56.800 56.287 0.022 0.000 0.984 64 K CB 0.287 32.837 32.500 0.084 0.000 0.836 64 K HN 0.011 8.261 8.250 -0.000 0.000 0.490 65 E N 1.235 121.430 120.200 -0.007 0.000 2.230 65 E HA -0.025 4.324 4.350 -0.001 0.000 0.192 65 E C -0.151 176.472 176.600 0.039 0.000 0.987 65 E CA 0.313 56.732 56.400 0.031 0.000 0.841 65 E CB 0.151 29.860 29.700 0.014 0.000 0.783 65 E HN 0.086 8.446 8.360 -0.000 0.000 0.481 66 K N 1.105 121.522 120.400 0.028 0.000 3.490 66 K HA -0.147 4.172 4.320 -0.001 0.000 0.273 66 K C -2.336 174.292 176.600 0.047 0.000 0.916 66 K CA 0.443 56.751 56.287 0.036 0.000 0.718 66 K CB -2.063 30.458 32.500 0.035 0.000 1.477 66 K HN 0.268 8.518 8.250 -0.000 0.000 0.452 67 P HA 0.059 4.479 4.420 -0.000 0.000 0.269 67 P C 0.351 177.696 177.300 0.076 0.000 1.215 67 P CA -0.015 63.132 63.100 0.078 0.000 0.780 67 P CB 0.643 32.397 31.700 0.090 0.000 0.898 68 D N 0.940 121.400 120.400 0.099 0.000 2.271 68 D HA 0.096 4.736 4.640 -0.001 0.000 0.206 68 D C 0.788 177.198 176.300 0.182 0.000 0.967 68 D CA 1.121 55.180 54.000 0.098 0.000 0.867 68 D CB 0.413 41.288 40.800 0.126 0.000 0.960 68 D HN 0.370 8.740 8.370 -0.000 0.000 0.509 69 I N 0.914 121.629 120.570 0.243 0.000 2.582 69 I HA 0.243 4.412 4.170 -0.001 0.000 0.292 69 I C -1.217 175.052 176.117 0.255 0.000 1.066 69 I CA -1.044 60.465 61.300 0.349 0.000 1.053 69 I CB 2.940 41.209 38.000 0.449 0.000 1.241 69 I HN -0.236 7.974 8.210 -0.000 0.000 0.421 70 L N 7.145 128.523 121.223 0.257 0.000 2.341 70 L HA 0.605 4.944 4.340 -0.001 0.000 0.278 70 L C -0.946 176.028 176.870 0.173 0.000 1.005 70 L CA -0.502 54.439 54.840 0.168 0.000 0.818 70 L CB 1.881 44.005 42.059 0.109 0.000 1.259 70 L HN 0.306 8.536 8.230 -0.000 0.000 0.418 71 V N 6.831 126.817 119.914 0.119 0.000 2.350 71 V HA 0.439 4.558 4.120 -0.001 0.000 0.276 71 V C 0.016 176.129 176.094 0.032 0.000 1.028 71 V CA -0.259 62.108 62.300 0.111 0.000 0.860 71 V CB 1.118 33.000 31.823 0.098 0.000 0.990 71 V HN 0.571 8.761 8.190 -0.000 0.000 0.453 72 I N 5.335 125.900 120.570 -0.009 0.000 2.355 72 I HA 0.460 4.630 4.170 -0.001 0.000 0.288 72 I C 0.050 176.136 176.117 -0.051 0.000 0.999 72 I CA -0.182 61.074 61.300 -0.073 0.000 1.163 72 I CB 1.249 39.172 38.000 -0.127 0.000 1.316 72 I HN 0.868 9.078 8.210 -0.000 0.000 0.454 73 N N 2.541 121.231 118.700 -0.017 0.000 2.732 73 N HA 0.169 4.909 4.740 -0.001 0.000 0.230 73 N C -0.694 174.858 175.510 0.070 0.000 1.487 73 N CA -0.543 52.547 53.050 0.067 0.000 0.765 73 N CB 1.015 39.594 38.487 0.152 0.000 1.384 73 N HN 0.495 8.875 8.380 -0.000 0.000 0.530 74 T N -0.701 113.843 114.554 -0.016 0.000 2.780 74 T HA 0.375 4.725 4.350 -0.001 0.000 0.263 74 T C -0.232 174.334 174.700 -0.223 0.000 0.993 74 T CA -0.417 61.619 62.100 -0.106 0.000 1.010 74 T CB 0.761 69.519 68.868 -0.184 0.000 1.642 74 T HN 0.075 8.315 8.240 -0.000 0.000 0.587 75 V N 3.571 123.152 119.914 -0.556 0.000 2.644 75 V HA -0.044 4.076 4.120 -0.001 0.000 0.303 75 V C 1.364 177.156 176.094 -0.503 0.000 1.058 75 V CA 0.428 62.059 62.300 -1.114 0.000 1.228 75 V CB -0.714 30.595 31.823 -0.857 0.000 0.861 75 V HN 0.710 8.900 8.190 -0.000 0.000 0.484 76 F N 3.206 122.867 119.950 -0.482 0.000 2.087 76 F HA -0.224 4.302 4.527 -0.001 0.000 0.299 76 F C 2.623 178.312 175.800 -0.186 0.000 1.100 76 F CA 1.853 59.724 58.000 -0.216 0.000 1.226 76 F CB -1.595 37.313 39.000 -0.154 0.000 0.983 76 F HN 0.684 8.984 8.300 -0.000 0.000 0.479 77 S N -0.064 115.634 115.700 -0.003 0.000 2.447 77 S HA -0.129 4.340 4.470 -0.001 0.000 0.233 77 S C 1.871 176.418 174.600 -0.089 0.000 1.006 77 S CA 0.899 59.073 58.200 -0.044 0.000 0.957 77 S CB -0.829 62.346 63.200 -0.041 0.000 0.773 77 S HN 0.314 8.624 8.310 -0.000 0.000 0.507 78 L N 1.949 123.090 121.223 -0.136 0.000 2.341 78 L HA 0.267 4.607 4.340 -0.001 0.000 0.214 78 L C 1.770 178.527 176.870 -0.188 0.000 1.115 78 L CA 1.001 55.743 54.840 -0.163 0.000 0.820 78 L CB -0.831 41.108 42.059 -0.199 0.000 0.944 78 L HN 0.116 8.346 8.230 -0.000 0.000 0.452 79 N N 0.287 118.897 118.700 -0.149 0.000 2.104 79 N HA -0.140 4.600 4.740 -0.001 0.000 0.190 79 N C 1.740 177.147 175.510 -0.172 0.000 1.024 79 N CA 1.515 54.473 53.050 -0.154 0.000 0.853 79 N CB -0.588 37.847 38.487 -0.086 0.000 1.008 79 N HN 0.507 8.887 8.380 -0.000 0.000 0.424 80 G N 0.982 109.695 108.800 -0.146 0.000 2.421 80 G HA2 -0.184 3.775 3.960 -0.001 0.000 0.217 80 G HA3 -0.184 3.775 3.960 -0.001 0.000 0.217 80 G C 1.621 176.421 174.900 -0.165 0.000 1.143 80 G CA 0.478 45.486 45.100 -0.153 0.000 0.784 80 G HN 0.322 8.612 8.290 -0.000 0.000 0.541 81 K N -0.028 120.278 120.400 -0.157 0.000 2.057 81 K HA 0.100 4.419 4.320 -0.001 0.000 0.206 81 K C 2.339 178.819 176.600 -0.201 0.000 1.050 81 K CA 0.834 57.032 56.287 -0.148 0.000 0.935 81 K CB -0.183 32.246 32.500 -0.118 0.000 0.715 81 K HN 0.305 8.555 8.250 -0.000 0.000 0.439 82 I N 1.029 121.417 120.570 -0.303 0.000 2.439 82 I HA -0.214 3.955 4.170 -0.001 0.000 0.251 82 I C 2.260 178.199 176.117 -0.296 0.000 1.139 82 I CA 0.414 61.450 61.300 -0.441 0.000 1.438 82 I CB -0.152 37.420 38.000 -0.713 0.000 1.085 82 I HN 0.096 8.306 8.210 -0.000 0.000 0.427 83 L N 0.766 121.838 121.223 -0.252 0.000 2.083 83 L HA -0.204 4.135 4.340 -0.001 0.000 0.209 83 L C 2.233 178.965 176.870 -0.230 0.000 1.083 83 L CA 1.709 56.401 54.840 -0.247 0.000 0.752 83 L CB -0.614 41.262 42.059 -0.305 0.000 0.899 83 L HN 0.139 8.369 8.230 -0.000 0.000 0.433 84 L N -0.271 120.834 121.223 -0.197 0.000 1.970 84 L HA -0.211 4.128 4.340 -0.001 0.000 0.212 84 L C 2.527 179.339 176.870 -0.096 0.000 1.071 84 L CA 1.867 56.622 54.840 -0.142 0.000 0.751 84 L CB -1.005 40.988 42.059 -0.110 0.000 0.889 84 L HN 0.318 8.548 8.230 -0.000 0.000 0.432 85 E N -0.015 120.133 120.200 -0.087 0.000 2.065 85 E HA -0.312 4.037 4.350 -0.001 0.000 0.201 85 E C 2.164 178.753 176.600 -0.019 0.000 1.016 85 E CA 1.709 58.088 56.400 -0.036 0.000 0.818 85 E CB -0.726 28.982 29.700 0.014 0.000 0.749 85 E HN 0.641 9.001 8.360 -0.000 0.000 0.453 86 A N 1.049 123.842 122.820 -0.044 0.000 1.908 86 A HA -0.181 4.138 4.320 -0.001 0.000 0.218 86 A C 2.469 180.061 177.584 0.014 0.000 1.181 86 A CA 1.461 53.495 52.037 -0.004 0.000 0.627 86 A CB -0.765 18.229 19.000 -0.010 0.000 0.818 86 A HN 0.211 8.361 8.150 -0.000 0.000 0.445 87 L N -1.095 120.117 121.223 -0.019 0.000 2.056 87 L HA -0.202 4.137 4.340 -0.001 0.000 0.207 87 L C 2.638 179.527 176.870 0.033 0.000 1.078 87 L CA 1.673 56.524 54.840 0.019 0.000 0.749 87 L CB -0.632 41.406 42.059 -0.035 0.000 0.901 87 L HN 0.479 8.709 8.230 -0.000 0.000 0.433 88 E N 0.222 120.427 120.200 0.008 0.000 2.058 88 E HA -0.236 4.114 4.350 -0.001 0.000 0.194 88 E C 2.028 178.641 176.600 0.022 0.000 0.997 88 E CA 1.282 57.690 56.400 0.013 0.000 0.801 88 E CB -0.033 29.668 29.700 0.001 0.000 0.746 88 E HN 0.401 8.761 8.360 -0.000 0.000 0.450 89 R N 0.508 121.023 120.500 0.024 0.000 2.328 89 R HA 0.039 4.378 4.340 -0.001 0.000 0.200 89 R C 0.087 176.401 176.300 0.024 0.000 0.983 89 R CA 0.190 56.306 56.100 0.027 0.000 1.062 89 R CB 0.065 30.387 30.300 0.035 0.000 0.956 89 R HN -0.034 8.236 8.270 -0.000 0.000 0.479 90 K N 0.153 120.573 120.400 0.032 0.000 3.069 90 K HA -0.177 4.143 4.320 -0.001 0.000 0.267 90 K C -0.751 175.837 176.600 -0.019 0.000 1.082 90 K CA 0.672 56.977 56.287 0.030 0.000 0.782 90 K CB -1.484 31.027 32.500 0.017 0.000 1.230 90 K HN 0.272 8.522 8.250 -0.000 0.000 0.488 91 I N 2.242 122.819 120.570 0.013 0.000 2.325 91 I HA 0.082 4.252 4.170 -0.001 0.000 0.291 91 I C 0.939 177.123 176.117 0.112 0.000 1.019 91 I CA -0.870 60.434 61.300 0.006 0.000 1.302 91 I CB 0.614 38.648 38.000 0.057 0.000 1.401 91 I HN 0.122 8.332 8.210 -0.000 0.000 0.485 92 H N 5.127 124.339 119.070 0.236 0.000 3.038 92 H HA 0.275 4.831 4.556 -0.001 0.000 0.338 92 H C 0.039 175.615 175.328 0.415 0.000 1.041 92 H CA -0.153 56.107 56.048 0.353 0.000 1.394 92 H CB 0.538 30.531 29.762 0.384 0.000 1.357 92 H HN 0.682 8.962 8.280 -0.000 0.000 0.600 93 A N 3.485 126.688 122.820 0.639 0.000 2.393 93 A HA 0.468 4.787 4.320 -0.001 0.000 0.306 93 A C -1.420 176.531 177.584 0.611 0.000 1.050 93 A CA -0.650 51.677 52.037 0.483 0.000 0.724 93 A CB 1.248 20.396 19.000 0.246 0.000 1.248 93 A HN 0.466 8.616 8.150 -0.000 0.000 0.424 94 F N 3.272 123.321 119.950 0.165 0.000 2.382 94 F HA 0.588 5.115 4.527 -0.001 0.000 0.361 94 F C -0.645 175.179 175.800 0.039 0.000 1.109 94 F CA -0.990 57.011 58.000 0.003 0.000 1.031 94 F CB 1.464 40.274 39.000 -0.316 0.000 1.234 94 F HN 0.454 8.754 8.300 -0.000 0.000 0.445 95 V N 5.731 125.528 119.914 -0.195 0.000 2.628 95 V HA 0.470 4.590 4.120 -0.001 0.000 0.306 95 V C -0.614 175.291 176.094 -0.315 0.000 1.045 95 V CA -0.585 61.598 62.300 -0.196 0.000 0.905 95 V CB 1.725 33.499 31.823 -0.081 0.000 0.997 95 V HN 0.719 8.909 8.190 -0.000 0.000 0.436 96 E N 4.116 124.180 120.200 -0.227 0.000 2.413 96 E HA 0.199 4.549 4.350 -0.001 0.000 0.263 96 E C -0.255 176.207 176.600 -0.230 0.000 1.015 96 E CA 0.036 56.320 56.400 -0.193 0.000 0.916 96 E CB 0.582 30.284 29.700 0.003 0.000 0.947 96 E HN 0.678 9.038 8.360 -0.000 0.000 0.440 97 K N 5.274 125.440 120.400 -0.389 0.000 2.295 97 K HA 0.333 4.653 4.320 -0.001 0.000 0.270 97 K C -2.185 174.267 176.600 -0.247 0.000 1.011 97 K CA -1.472 54.561 56.287 -0.424 0.000 0.953 97 K CB -0.087 31.896 32.500 -0.862 0.000 0.956 97 K HN 0.313 8.563 8.250 -0.000 0.000 0.477 98 P HA 0.034 4.454 4.420 -0.000 0.000 0.274 98 P C 0.487 177.718 177.300 -0.116 0.000 1.231 98 P CA -0.466 62.548 63.100 -0.145 0.000 0.790 98 P CB 0.593 32.219 31.700 -0.123 0.000 0.951 99 I N -1.580 118.941 120.570 -0.082 0.000 3.291 99 I HA 0.308 4.477 4.170 -0.001 0.000 0.279 99 I C 0.467 176.525 176.117 -0.098 0.000 1.294 99 I CA 0.423 61.678 61.300 -0.075 0.000 1.428 99 I CB -0.163 37.833 38.000 -0.006 0.000 1.070 99 I HN 0.230 8.440 8.210 -0.000 0.000 0.478 100 A N 0.622 123.383 122.820 -0.099 0.000 2.612 100 A HA 0.564 4.883 4.320 -0.001 0.000 0.293 100 A C 0.327 177.836 177.584 -0.124 0.000 1.075 100 A CA 0.084 52.057 52.037 -0.107 0.000 0.680 100 A CB 0.727 19.666 19.000 -0.102 0.000 1.279 100 A HN 0.257 8.407 8.150 -0.000 0.000 0.411 101 T N -2.252 112.231 114.554 -0.117 0.000 3.044 101 T HA 0.445 4.794 4.350 -0.001 0.000 0.260 101 T C 0.465 175.063 174.700 -0.171 0.000 1.019 101 T CA 0.819 62.840 62.100 -0.131 0.000 0.921 101 T CB -0.576 68.247 68.868 -0.075 0.000 1.053 101 T HN 1.778 10.018 8.240 -0.000 0.000 0.533 102 T N -1.797 112.648 114.554 -0.182 0.000 2.900 102 T HA 0.611 4.961 4.350 -0.001 0.000 0.303 102 T C 0.056 174.633 174.700 -0.205 0.000 1.142 102 T CA -0.800 61.183 62.100 -0.195 0.000 1.007 102 T CB 1.008 69.837 68.868 -0.064 0.000 1.156 102 T HN -0.155 8.085 8.240 -0.000 0.000 0.490 103 F N 0.704 120.650 119.950 -0.006 0.000 2.216 103 F HA 0.053 4.580 4.527 -0.001 0.000 0.300 103 F C 2.605 178.401 175.800 -0.008 0.000 1.085 103 F CA 1.109 59.105 58.000 -0.007 0.000 1.326 103 F CB -0.494 38.506 39.000 -0.001 0.000 1.027 103 F HN 0.696 8.996 8.300 -0.000 0.000 0.497 104 E N 0.375 120.666 120.200 0.151 0.000 2.033 104 E HA -0.240 4.110 4.350 -0.001 0.000 0.199 104 E C 1.812 178.437 176.600 0.040 0.000 1.011 104 E CA 1.844 58.293 56.400 0.081 0.000 0.815 104 E CB -0.383 29.349 29.700 0.053 0.000 0.755 104 E HN 0.363 8.723 8.360 -0.000 0.000 0.451 105 D N 0.567 120.970 120.400 0.005 0.000 2.144 105 D HA -0.131 4.508 4.640 -0.001 0.000 0.199 105 D C 1.975 178.259 176.300 -0.027 0.000 0.984 105 D CA 0.446 54.430 54.000 -0.026 0.000 0.834 105 D CB -0.259 40.509 40.800 -0.054 0.000 0.955 105 D HN 0.044 8.414 8.370 -0.000 0.000 0.465 106 L N 0.997 122.214 121.223 -0.011 0.000 2.083 106 L HA -0.147 4.192 4.340 -0.001 0.000 0.209 106 L C 2.044 178.937 176.870 0.037 0.000 1.083 106 L CA 1.670 56.513 54.840 0.006 0.000 0.752 106 L CB -0.443 41.632 42.059 0.026 0.000 0.899 106 L HN -0.176 8.054 8.230 -0.000 0.000 0.433 107 E N 0.282 120.519 120.200 0.062 0.000 2.031 107 E HA -0.229 4.121 4.350 -0.001 0.000 0.193 107 E C 2.144 178.767 176.600 0.038 0.000 0.994 107 E CA 1.719 58.156 56.400 0.060 0.000 0.800 107 E CB -0.188 29.552 29.700 0.067 0.000 0.752 107 E HN 0.458 8.818 8.360 -0.000 0.000 0.447 108 K N -0.055 120.357 120.400 0.021 0.000 2.074 108 K HA -0.169 4.150 4.320 -0.001 0.000 0.209 108 K C 2.363 178.962 176.600 -0.001 0.000 1.048 108 K CA 1.671 57.962 56.287 0.006 0.000 0.926 108 K CB -0.358 32.136 32.500 -0.010 0.000 0.713 108 K HN 0.227 8.477 8.250 -0.000 0.000 0.444 109 I N 0.537 121.095 120.570 -0.020 0.000 2.202 109 I HA -0.265 3.904 4.170 -0.001 0.000 0.242 109 I C 2.741 178.887 176.117 0.049 0.000 1.091 109 I CA 1.090 62.360 61.300 -0.051 0.000 1.368 109 I CB -0.178 37.741 38.000 -0.135 0.000 1.058 109 I HN 0.142 8.352 8.210 -0.000 0.000 0.410 110 R N 0.236 120.785 120.500 0.082 0.000 2.096 110 R HA -0.190 4.150 4.340 -0.001 0.000 0.235 110 R C 2.489 178.873 176.300 0.140 0.000 1.127 110 R CA 1.803 57.992 56.100 0.148 0.000 0.968 110 R CB -0.220 30.147 30.300 0.111 0.000 0.861 110 R HN 0.285 8.555 8.270 -0.000 0.000 0.440 111 S N -0.298 115.452 115.700 0.084 0.000 2.343 111 S HA -0.115 4.355 4.470 -0.001 0.000 0.219 111 S C 1.956 176.593 174.600 0.061 0.000 1.033 111 S CA 1.681 59.916 58.200 0.060 0.000 1.014 111 S CB -0.313 62.909 63.200 0.038 0.000 0.915 111 S HN 0.225 8.535 8.310 -0.000 0.000 0.435 112 V N 0.837 120.787 119.914 0.060 0.000 2.343 112 V HA -0.120 4.000 4.120 -0.001 0.000 0.247 112 V C 2.208 178.361 176.094 0.098 0.000 1.051 112 V CA 2.116 64.450 62.300 0.055 0.000 1.036 112 V CB -1.015 30.826 31.823 0.031 0.000 0.654 112 V HN 0.721 8.911 8.190 -0.000 0.000 0.451 113 Y N 1.858 122.178 120.300 0.034 0.000 2.333 113 Y HA -0.288 4.261 4.550 -0.001 0.000 0.290 113 Y C 2.646 178.601 175.900 0.092 0.000 1.144 113 Y CA 1.928 60.086 58.100 0.097 0.000 1.228 113 Y CB -0.337 38.246 38.460 0.206 0.000 0.985 113 Y HN 0.569 8.849 8.280 -0.000 0.000 0.542 114 Q N -0.301 119.461 119.800 -0.063 0.000 2.079 114 Q HA -0.180 4.160 4.340 -0.001 0.000 0.200 114 Q C 1.926 177.839 176.000 -0.145 0.000 0.974 114 Q CA 1.742 57.461 55.803 -0.140 0.000 0.840 114 Q CB -0.320 28.404 28.738 -0.023 0.000 0.898 114 Q HN 0.226 8.496 8.270 -0.000 0.000 0.430 115 K N 0.787 121.141 120.400 -0.076 0.000 2.009 115 K HA -0.118 4.202 4.320 -0.001 0.000 0.210 115 K C 2.004 178.563 176.600 -0.068 0.000 1.049 115 K CA 1.903 58.159 56.287 -0.052 0.000 0.929 115 K CB -0.144 32.346 32.500 -0.016 0.000 0.714 115 K HN 0.357 8.607 8.250 -0.000 0.000 0.440 116 V N -1.392 118.478 119.914 -0.074 0.000 3.649 116 V HA 0.167 4.286 4.120 -0.001 0.000 0.275 116 V C 1.796 177.840 176.094 -0.083 0.000 1.281 116 V CA 0.365 62.646 62.300 -0.032 0.000 1.143 116 V CB -0.233 31.619 31.823 0.049 0.000 0.892 116 V HN 0.167 8.357 8.190 -0.000 0.000 0.441 117 R N 1.587 121.899 120.500 -0.313 0.000 2.204 117 R HA -0.255 4.085 4.340 -0.001 0.000 0.253 117 R C 1.627 177.872 176.300 -0.092 0.000 1.172 117 R CA 2.655 58.473 56.100 -0.470 0.000 0.994 117 R CB -0.359 29.581 30.300 -0.599 0.000 0.874 117 R HN 0.674 8.944 8.270 -0.000 0.000 0.462 118 N N -0.967 117.709 118.700 -0.040 0.000 2.373 118 N HA -0.011 4.728 4.740 -0.001 0.000 0.181 118 N C 0.653 176.201 175.510 0.062 0.000 1.082 118 N CA 0.684 53.743 53.050 0.015 0.000 0.885 118 N CB 0.530 39.014 38.487 -0.004 0.000 0.977 118 N HN 0.388 8.768 8.380 -0.000 0.000 0.462 119 E N -0.486 119.766 120.200 0.086 0.000 2.175 119 E HA 0.110 4.459 4.350 -0.001 0.000 0.195 119 E C -0.048 176.699 176.600 0.245 0.000 0.934 119 E CA 0.145 56.619 56.400 0.123 0.000 0.870 119 E CB 0.685 30.434 29.700 0.081 0.000 0.838 119 E HN -0.014 8.346 8.360 -0.000 0.000 0.474 120 V N 0.882 120.968 119.914 0.286 0.000 2.513 120 V HA 0.456 4.576 4.120 -0.001 0.000 0.299 120 V C -1.356 175.083 176.094 0.575 0.000 1.035 120 V CA -0.887 61.697 62.300 0.473 0.000 0.889 120 V CB 1.164 33.181 31.823 0.322 0.000 0.988 120 V HN 0.066 8.256 8.190 -0.000 0.000 0.440 121 F N 7.786 127.980 119.950 0.406 0.000 2.425 121 F HA 0.856 5.382 4.527 -0.001 0.000 0.331 121 F C -0.568 175.431 175.800 0.331 0.000 1.085 121 F CA -0.970 57.121 58.000 0.151 0.000 1.028 121 F CB 1.625 40.439 39.000 -0.311 0.000 1.177 121 F HN 0.647 8.947 8.300 -0.000 0.000 0.487 122 F N 1.879 121.513 119.950 -0.528 0.000 2.645 122 F HA 0.792 5.318 4.527 -0.001 0.000 0.310 122 F C -1.169 174.283 175.800 -0.580 0.000 1.102 122 F CA -0.626 57.211 58.000 -0.273 0.000 0.952 122 F CB 1.801 40.733 39.000 -0.113 0.000 1.326 122 F HN 0.514 8.814 8.300 -0.000 0.000 0.456 123 T N 0.835 115.382 114.554 -0.012 0.000 2.802 123 T HA 0.755 5.105 4.350 -0.001 0.000 0.311 123 T C -1.200 173.627 174.700 0.213 0.000 1.405 123 T CA -0.049 61.997 62.100 -0.090 0.000 1.016 123 T CB 1.450 70.320 68.868 0.003 0.000 1.352 123 T HN 1.223 9.463 8.240 -0.000 0.000 0.498 127 G N 0.217 108.785 108.800 -0.386 0.000 2.511 127 G HA2 -0.073 3.886 3.960 -0.001 0.000 0.217 127 G HA3 -0.073 3.886 3.960 -0.001 0.000 0.217 127 G C 1.552 176.442 174.900 -0.017 0.000 1.133 127 G CA 0.629 45.373 45.100 -0.593 0.000 0.792 127 G HN 0.515 8.805 8.290 -0.000 0.000 0.539 128 I N 0.225 120.834 120.570 0.064 0.000 2.335 128 I HA -0.184 3.985 4.170 -0.001 0.000 0.251 128 I C 2.869 178.917 176.117 -0.115 0.000 1.129 128 I CA 0.707 62.036 61.300 0.050 0.000 1.402 128 I CB -0.235 37.801 38.000 0.061 0.000 1.069 128 I HN 0.109 8.319 8.210 -0.000 0.000 0.424 129 R N 0.222 120.623 120.500 -0.166 0.000 2.139 129 R HA -0.211 4.128 4.340 -0.001 0.000 0.243 129 R C 1.895 178.004 176.300 -0.318 0.000 1.145 129 R CA 1.694 57.516 56.100 -0.464 0.000 0.976 129 R CB -0.416 29.266 30.300 -1.030 0.000 0.866 129 R HN 0.402 8.672 8.270 -0.000 0.000 0.449 130 Y N 0.137 120.365 120.300 -0.119 0.000 2.490 130 Y HA 0.091 4.641 4.550 -0.001 0.000 0.281 130 Y C 0.684 176.595 175.900 0.017 0.000 1.174 130 Y CA 0.030 58.108 58.100 -0.037 0.000 1.295 130 Y CB 0.061 38.493 38.460 -0.046 0.000 1.062 130 Y HN -0.161 8.119 8.280 -0.000 0.000 0.522 131 R N 0.902 121.473 120.500 0.118 0.000 2.543 131 R HA 0.041 4.381 4.340 -0.001 0.000 0.277 131 R C -1.661 174.626 176.300 -0.023 0.000 1.074 131 R CA -1.448 54.685 56.100 0.055 0.000 1.076 131 R CB -0.081 30.213 30.300 -0.010 0.000 0.993 131 R HN -0.012 8.258 8.270 -0.000 0.000 0.459 132 P HA -0.280 4.140 4.420 -0.000 0.000 0.217 132 P C 0.936 178.243 177.300 0.012 0.000 1.162 132 P CA 1.604 64.744 63.100 0.067 0.000 0.901 132 P CB -0.099 31.673 31.700 0.121 0.000 0.793 133 H N -2.275 116.779 119.070 -0.026 0.000 2.387 133 H HA -0.066 4.490 4.556 -0.001 0.000 0.299 133 H C 1.928 177.095 175.328 -0.268 0.000 1.090 133 H CA 1.229 57.168 56.048 -0.182 0.000 1.332 133 H CB -1.490 28.111 29.762 -0.269 0.000 1.386 133 H HN 0.164 8.444 8.280 -0.000 0.000 0.516 134 F N 0.940 120.663 119.950 -0.379 0.000 2.187 134 F HA 0.072 4.598 4.527 -0.001 0.000 0.295 134 F C 2.850 178.650 175.800 0.001 0.000 1.091 134 F CA 0.351 58.233 58.000 -0.196 0.000 1.308 134 F CB -0.398 38.462 39.000 -0.233 0.000 1.030 134 F HN 0.001 8.301 8.300 -0.000 0.000 0.487 135 L N -0.555 120.784 121.223 0.193 0.000 2.042 135 L HA -0.273 4.067 4.340 -0.001 0.000 0.210 135 L C 2.366 179.249 176.870 0.021 0.000 1.076 135 L CA 1.769 56.706 54.840 0.161 0.000 0.749 135 L CB -1.085 41.033 42.059 0.098 0.000 0.893 135 L HN 0.171 8.401 8.230 -0.000 0.000 0.432 136 T N -0.234 114.304 114.554 -0.026 0.000 2.684 136 T HA -0.204 4.145 4.350 -0.001 0.000 0.267 136 T C 1.984 176.617 174.700 -0.112 0.000 1.036 136 T CA 1.386 63.445 62.100 -0.069 0.000 1.148 136 T CB -0.298 68.523 68.868 -0.077 0.000 0.863 136 T HN 0.473 8.713 8.240 -0.000 0.000 0.436 137 A N 1.795 124.527 122.820 -0.147 0.000 1.883 137 A HA -0.161 4.158 4.320 -0.001 0.000 0.217 137 A C 2.182 179.629 177.584 -0.229 0.000 1.186 137 A CA 2.266 54.193 52.037 -0.182 0.000 0.624 137 A CB -0.598 18.270 19.000 -0.220 0.000 0.822 137 A HN 0.430 8.580 8.150 -0.000 0.000 0.444 138 K N 0.483 120.689 120.400 -0.322 0.000 2.063 138 K HA -0.175 4.145 4.320 -0.001 0.000 0.208 138 K C 2.001 178.420 176.600 -0.301 0.000 1.048 138 K CA 2.235 58.216 56.287 -0.510 0.000 0.928 138 K CB -0.296 31.647 32.500 -0.927 0.000 0.713 138 K HN 0.477 8.727 8.250 -0.000 0.000 0.442 139 K N 0.154 120.444 120.400 -0.184 0.000 2.025 139 K HA -0.092 4.228 4.320 -0.001 0.000 0.207 139 K C 2.063 178.593 176.600 -0.117 0.000 1.049 139 K CA 1.488 57.702 56.287 -0.121 0.000 0.933 139 K CB -0.215 32.240 32.500 -0.074 0.000 0.714 139 K HN 0.172 8.422 8.250 -0.000 0.000 0.438 140 L N 0.609 121.761 121.223 -0.117 0.000 2.013 140 L HA -0.233 4.107 4.340 -0.001 0.000 0.212 140 L C 2.437 179.241 176.870 -0.109 0.000 1.073 140 L CA 1.175 55.954 54.840 -0.102 0.000 0.753 140 L CB -0.503 41.497 42.059 -0.098 0.000 0.890 140 L HN 0.069 8.299 8.230 -0.000 0.000 0.432 141 V N -1.136 118.693 119.914 -0.142 0.000 2.255 141 V HA -0.330 3.789 4.120 -0.001 0.000 0.247 141 V C 2.615 178.629 176.094 -0.133 0.000 1.051 141 V CA 2.170 64.384 62.300 -0.144 0.000 1.018 141 V CB -0.419 31.289 31.823 -0.192 0.000 0.641 141 V HN 0.374 8.564 8.190 -0.000 0.000 0.445 142 S N -0.992 114.616 115.700 -0.153 0.000 2.419 142 S HA -0.212 4.257 4.470 -0.001 0.000 0.235 142 S C 1.719 176.264 174.600 -0.091 0.000 1.019 142 S CA 1.479 59.603 58.200 -0.127 0.000 0.982 142 S CB -0.265 62.855 63.200 -0.133 0.000 0.789 142 S HN 0.683 8.993 8.310 -0.000 0.000 0.490 143 E N -0.600 119.550 120.200 -0.084 0.000 2.465 143 E HA 0.259 4.608 4.350 -0.001 0.000 0.191 143 E C 1.039 177.604 176.600 -0.059 0.000 1.053 143 E CA 0.271 56.632 56.400 -0.064 0.000 0.869 143 E CB 0.290 29.954 29.700 -0.059 0.000 0.977 143 E HN 0.477 8.837 8.360 -0.000 0.000 0.483 144 G N 0.559 109.319 108.800 -0.066 0.000 2.132 144 G HA2 -0.352 3.608 3.960 -0.001 0.000 0.234 144 G HA3 -0.352 3.608 3.960 -0.001 0.000 0.234 144 G C 0.997 175.866 174.900 -0.051 0.000 0.989 144 G CA 0.249 45.315 45.100 -0.057 0.000 0.676 144 G HN 0.397 8.687 8.290 -0.000 0.000 0.522 145 A N -0.325 122.461 122.820 -0.056 0.000 2.019 145 A HA 0.274 4.593 4.320 -0.001 0.000 0.219 145 A C 2.520 180.080 177.584 -0.041 0.000 1.164 145 A CA 3.011 55.020 52.037 -0.047 0.000 0.644 145 A CB -0.271 18.698 19.000 -0.051 0.000 0.805 145 A HN 1.749 9.899 8.150 -0.000 0.000 0.449 146 V N -4.405 115.480 119.914 -0.048 0.000 3.621 146 V HA 0.546 4.665 4.120 -0.001 0.000 0.285 146 V C 1.238 177.308 176.094 -0.041 0.000 1.346 146 V CA 0.550 62.826 62.300 -0.041 0.000 1.104 146 V CB -1.060 30.735 31.823 -0.046 0.000 0.913 146 V HN 1.530 9.720 8.190 -0.000 0.000 0.432 147 G N 1.021 109.794 108.800 -0.044 0.000 2.527 147 G HA2 -0.312 3.647 3.960 -0.001 0.000 0.268 147 G HA3 -0.312 3.647 3.960 -0.001 0.000 0.268 147 G C -0.144 174.725 174.900 -0.051 0.000 1.175 147 G CA 0.488 45.562 45.100 -0.043 0.000 0.962 147 G HN 0.741 9.031 8.290 -0.000 0.000 0.560 148 E N 0.256 120.427 120.200 -0.049 0.000 2.283 148 E HA 0.451 4.800 4.350 -0.001 0.000 0.278 148 E C 0.391 176.953 176.600 -0.063 0.000 1.027 148 E CA -0.521 55.844 56.400 -0.058 0.000 0.843 148 E CB 0.461 30.128 29.700 -0.055 0.000 1.062 148 E HN 0.373 8.733 8.360 -0.000 0.000 0.401 149 I N 4.770 125.295 120.570 -0.075 0.000 2.556 149 I HA 0.013 4.182 4.170 -0.001 0.000 0.284 149 I C 1.406 177.465 176.117 -0.096 0.000 1.114 149 I CA -0.026 61.227 61.300 -0.079 0.000 1.418 149 I CB 0.527 38.476 38.000 -0.085 0.000 1.394 149 I HN 0.423 8.633 8.210 -0.000 0.000 0.552 150 R N 4.475 124.922 120.500 -0.088 0.000 2.257 150 R HA 0.427 4.766 4.340 -0.001 0.000 0.195 150 R C -0.633 175.593 176.300 -0.123 0.000 0.921 150 R CA -0.029 56.001 56.100 -0.117 0.000 1.069 150 R CB 0.220 30.477 30.300 -0.073 0.000 1.115 150 R HN 0.446 8.716 8.270 -0.000 0.000 0.571 151 L N 0.225 121.413 121.223 -0.059 0.000 2.565 151 L HA 0.431 4.771 4.340 -0.001 0.000 0.261 151 L C -1.694 175.180 176.870 0.008 0.000 0.932 151 L CA -0.729 54.108 54.840 -0.006 0.000 0.878 151 L CB 2.480 44.564 42.059 0.042 0.000 1.333 151 L HN -0.241 7.989 8.230 -0.000 0.000 0.409 152 V N 3.953 123.884 119.914 0.030 0.000 2.487 152 V HA 0.572 4.692 4.120 -0.001 0.000 0.298 152 V C -0.579 175.570 176.094 0.092 0.000 1.028 152 V CA -0.702 61.633 62.300 0.059 0.000 0.860 152 V CB 2.029 33.892 31.823 0.066 0.000 0.991 152 V HN 0.840 9.030 8.190 -0.000 0.000 0.427 153 N N 2.120 120.880 118.700 0.100 0.000 2.372 153 N HA 0.759 5.498 4.740 -0.001 0.000 0.291 153 N C -0.504 175.110 175.510 0.173 0.000 1.024 153 N CA -0.666 52.454 53.050 0.117 0.000 0.873 153 N CB 2.118 40.656 38.487 0.083 0.000 1.206 153 N HN 0.820 9.200 8.380 -0.000 0.000 0.486 154 T N -1.480 113.198 114.554 0.207 0.000 2.900 154 T HA 0.448 4.797 4.350 -0.001 0.000 0.295 154 T C -1.038 173.798 174.700 0.226 0.000 1.044 154 T CA -0.915 61.364 62.100 0.298 0.000 0.995 154 T CB 2.009 71.114 68.868 0.396 0.000 1.072 154 T HN 0.488 8.728 8.240 -0.000 0.000 0.473 155 Q N 1.205 121.167 119.800 0.271 0.000 2.323 155 Q HA 0.482 4.821 4.340 -0.001 0.000 0.271 155 Q C -1.571 174.521 176.000 0.152 0.000 1.048 155 Q CA -0.946 54.953 55.803 0.161 0.000 0.792 155 Q CB 1.383 30.197 28.738 0.126 0.000 1.280 155 Q HN 0.468 8.738 8.270 -0.000 0.000 0.441 156 K N 2.109 122.504 120.400 -0.009 0.000 2.358 156 K HA 0.441 4.761 4.320 -0.001 0.000 0.260 156 K C -1.433 175.040 176.600 -0.211 0.000 0.956 156 K CA -0.433 55.746 56.287 -0.180 0.000 0.834 156 K CB 2.040 34.321 32.500 -0.366 0.000 1.102 156 K HN 0.537 8.787 8.250 -0.000 0.000 0.431 157 S N 3.628 119.209 115.700 -0.200 0.000 2.789 157 S HA 0.520 4.990 4.470 -0.001 0.000 0.286 157 S C -1.547 173.091 174.600 0.063 0.000 1.153 157 S CA -0.599 57.557 58.200 -0.073 0.000 1.084 157 S CB 0.170 63.385 63.200 0.024 0.000 1.036 157 S HN 0.319 8.629 8.310 -0.000 0.000 0.484 158 Y N 2.328 122.661 120.300 0.054 0.000 2.487 158 Y HA 0.481 5.031 4.550 -0.001 0.000 0.337 158 Y C 0.616 176.696 175.900 0.300 0.000 1.076 158 Y CA -1.750 56.448 58.100 0.163 0.000 1.115 158 Y CB 1.047 39.670 38.460 0.272 0.000 1.235 158 Y HN 0.478 8.758 8.280 -0.000 0.000 0.468 159 K N 2.184 122.843 120.400 0.433 0.000 2.368 159 K HA 0.074 4.394 4.320 -0.001 0.000 0.282 159 K C 0.451 177.233 176.600 0.302 0.000 1.035 159 K CA -0.161 56.309 56.287 0.306 0.000 0.973 159 K CB 0.962 33.594 32.500 0.221 0.000 0.957 159 K HN 0.457 8.707 8.250 -0.000 0.000 0.474 160 L N 3.448 124.746 121.223 0.125 0.000 2.051 160 L HA 0.143 4.482 4.340 -0.001 0.000 0.202 160 L C 1.009 177.772 176.870 -0.178 0.000 1.097 160 L CA 2.390 57.103 54.840 -0.211 0.000 0.762 160 L CB -1.070 40.768 42.059 -0.367 0.000 0.913 160 L HN 0.998 9.228 8.230 -0.000 0.000 0.447 161 G N -0.291 108.458 108.800 -0.085 0.000 2.633 161 G HA2 -0.374 3.586 3.960 -0.001 0.000 0.263 161 G HA3 -0.374 3.586 3.960 -0.001 0.000 0.263 161 G C -0.256 174.619 174.900 -0.040 0.000 1.310 161 G CA 0.344 45.421 45.100 -0.039 0.000 0.914 161 G HN 0.759 9.049 8.290 -0.000 0.000 0.569 162 Q N 0.178 119.944 119.800 -0.057 0.000 2.337 162 Q HA 0.435 4.774 4.340 -0.001 0.000 0.270 162 Q C 0.169 176.044 176.000 -0.208 0.000 1.002 162 Q CA 0.084 55.831 55.803 -0.092 0.000 0.888 162 Q CB 0.283 28.956 28.738 -0.107 0.000 1.222 162 Q HN 0.520 8.790 8.270 -0.000 0.000 0.400 163 R N 3.489 123.811 120.500 -0.297 0.000 2.771 163 R HA 0.493 4.832 4.340 -0.001 0.000 0.274 163 R C -2.576 173.367 176.300 -0.594 0.000 0.987 163 R CA -2.138 53.560 56.100 -0.670 0.000 0.908 163 R CB 0.879 30.470 30.300 -1.181 0.000 1.213 163 R HN 0.603 8.873 8.270 -0.000 0.000 0.468 164 P HA 0.019 4.439 4.420 -0.000 0.000 0.266 164 P C 0.193 177.250 177.300 -0.405 0.000 1.193 164 P CA -0.017 62.837 63.100 -0.410 0.000 0.770 164 P CB 0.583 32.087 31.700 -0.326 0.000 0.836 165 D N 1.016 121.300 120.400 -0.193 0.000 2.221 165 D HA -0.155 4.484 4.640 -0.001 0.000 0.204 165 D C 1.479 177.727 176.300 -0.086 0.000 0.982 165 D CA 1.180 55.101 54.000 -0.131 0.000 0.857 165 D CB -0.462 40.304 40.800 -0.058 0.000 0.934 165 D HN 0.519 8.889 8.370 -0.000 0.000 0.475 166 F N -0.848 119.066 119.950 -0.061 0.000 2.546 166 F HA -0.097 4.429 4.527 -0.001 0.000 0.298 166 F C 1.663 177.405 175.800 -0.097 0.000 1.120 166 F CA 0.395 58.342 58.000 -0.089 0.000 1.456 166 F CB -0.929 37.978 39.000 -0.155 0.000 1.088 166 F HN -0.132 8.168 8.300 -0.000 0.000 0.572 167 Y N 1.397 121.204 120.300 -0.821 0.000 2.497 167 Y HA 0.003 4.552 4.550 -0.001 0.000 0.292 167 Y C 1.960 177.530 175.900 -0.550 0.000 1.137 167 Y CA 0.939 58.546 58.100 -0.821 0.000 1.285 167 Y CB -0.521 37.410 38.460 -0.881 0.000 0.991 167 Y HN 0.176 8.456 8.280 -0.000 0.000 0.556 168 K N -0.353 119.966 120.400 -0.135 0.000 2.379 168 K HA 0.040 4.360 4.320 -0.001 0.000 0.194 168 K C 0.133 176.728 176.600 -0.008 0.000 1.031 168 K CA 0.440 56.681 56.287 -0.077 0.000 1.037 168 K CB 0.349 32.803 32.500 -0.076 0.000 0.824 168 K HN -0.095 8.155 8.250 -0.000 0.000 0.516 169 K N 0.916 121.339 120.400 0.038 0.000 2.292 169 K HA 0.167 4.486 4.320 -0.001 0.000 0.257 169 K C 0.380 177.066 176.600 0.142 0.000 0.940 169 K CA -0.398 55.934 56.287 0.075 0.000 0.811 169 K CB 2.074 34.611 32.500 0.061 0.000 1.120 169 K HN -0.183 8.067 8.250 -0.000 0.000 0.428 170 R N 2.600 123.181 120.500 0.135 0.000 2.113 170 R HA -0.227 4.112 4.340 -0.001 0.000 0.244 170 R C 1.588 177.949 176.300 0.102 0.000 1.142 170 R CA 2.298 58.481 56.100 0.139 0.000 0.953 170 R CB -0.236 30.117 30.300 0.089 0.000 0.860 170 R HN 0.824 9.094 8.270 -0.000 0.000 0.438 171 E N -1.082 119.162 120.200 0.074 0.000 2.118 171 E HA -0.189 4.161 4.350 -0.001 0.000 0.195 171 E C 1.247 177.875 176.600 0.048 0.000 0.992 171 E CA 1.983 58.411 56.400 0.047 0.000 0.804 171 E CB -0.028 29.694 29.700 0.037 0.000 0.741 171 E HN 0.696 9.056 8.360 -0.000 0.000 0.458 172 T N -2.237 112.367 114.554 0.085 0.000 3.033 172 T HA -0.082 4.267 4.350 -0.001 0.000 0.248 172 T C 1.785 176.587 174.700 0.170 0.000 1.040 172 T CA 0.471 62.622 62.100 0.084 0.000 1.133 172 T CB -0.522 68.409 68.868 0.104 0.000 0.895 172 T HN 0.220 8.460 8.240 -0.000 0.000 0.465 173 Y N 2.634 122.962 120.300 0.048 0.000 2.184 173 Y HA 0.300 4.850 4.550 -0.001 0.000 0.290 173 Y C 2.169 178.147 175.900 0.129 0.000 1.129 173 Y CA 1.014 59.122 58.100 0.014 0.000 1.144 173 Y CB -0.685 37.738 38.460 -0.062 0.000 0.995 173 Y HN 0.452 8.732 8.280 -0.000 0.000 0.513 174 G N -0.721 108.045 108.800 -0.057 0.000 2.225 174 G HA2 -0.029 3.931 3.960 -0.001 0.000 0.254 174 G HA3 -0.029 3.931 3.960 -0.001 0.000 0.254 174 G C 0.849 175.582 174.900 -0.279 0.000 0.988 174 G CA 0.556 45.562 45.100 -0.157 0.000 0.625 174 G HN 1.515 9.805 8.290 -0.000 0.000 0.527 175 G N -2.497 105.948 108.800 -0.591 0.000 2.629 175 G HA2 0.285 4.244 3.960 -0.001 0.000 0.686 175 G HA3 0.285 4.244 3.960 -0.001 0.000 0.686 175 G C 0.460 175.105 174.900 -0.425 0.000 1.232 175 G CA 0.431 45.311 45.100 -0.367 0.000 0.803 175 G HN 1.166 9.456 8.290 -0.000 0.000 0.638 176 T N 1.146 115.731 114.554 0.051 0.000 2.904 176 T HA 0.009 4.359 4.350 -0.001 0.000 0.267 176 T C 2.613 177.362 174.700 0.081 0.000 1.059 176 T CA 1.626 63.862 62.100 0.227 0.000 1.137 176 T CB -0.143 68.929 68.868 0.341 0.000 0.879 176 T HN 0.480 8.720 8.240 -0.000 0.000 0.467 177 I N 1.433 122.041 120.570 0.065 0.000 2.127 177 I HA -0.128 4.042 4.170 -0.001 0.000 0.241 177 I C -0.714 175.384 176.117 -0.031 0.000 1.075 177 I CA 1.405 62.721 61.300 0.028 0.000 1.334 177 I CB -1.228 36.811 38.000 0.065 0.000 1.040 177 I HN 0.175 8.385 8.210 -0.000 0.000 0.405 178 P HA -0.174 4.246 4.420 -0.000 0.000 0.221 178 P C 1.313 178.555 177.300 -0.096 0.000 1.150 178 P CA 1.331 64.374 63.100 -0.094 0.000 0.800 178 P CB -0.144 31.486 31.700 -0.117 0.000 0.787 179 W N 0.015 121.149 121.300 -0.277 0.000 2.501 179 W HA -0.080 4.580 4.660 -0.001 0.000 0.309 179 W C 1.413 177.841 176.519 -0.153 0.000 1.165 179 W CA 0.893 58.075 57.345 -0.273 0.000 1.381 179 W CB -0.396 28.942 29.460 -0.203 0.000 1.142 179 W HN -0.304 7.876 8.180 -0.000 0.000 0.509 180 V N 1.040 120.830 119.914 -0.206 0.000 2.379 180 V HA -0.065 4.055 4.120 -0.001 0.000 0.243 180 V C 2.582 178.498 176.094 -0.297 0.000 1.035 180 V CA 1.982 64.092 62.300 -0.317 0.000 1.035 180 V CB -1.396 30.211 31.823 -0.360 0.000 0.673 180 V HN 0.364 8.554 8.190 -0.000 0.000 0.457 181 G N -0.373 108.298 108.800 -0.215 0.000 2.443 181 G HA2 -0.210 3.750 3.960 -0.001 0.000 0.219 181 G HA3 -0.210 3.750 3.960 -0.001 0.000 0.219 181 G C 1.629 176.396 174.900 -0.221 0.000 1.131 181 G CA 0.717 45.709 45.100 -0.180 0.000 0.775 181 G HN 0.464 8.754 8.290 -0.000 0.000 0.547 182 I N -0.134 120.286 120.570 -0.251 0.000 2.335 182 I HA -0.205 3.965 4.170 -0.001 0.000 0.251 182 I C 2.556 178.534 176.117 -0.232 0.000 1.129 182 I CA 0.934 62.101 61.300 -0.222 0.000 1.402 182 I CB -0.066 37.826 38.000 -0.181 0.000 1.069 182 I HN 0.196 8.406 8.210 -0.000 0.000 0.424 183 H N 0.603 119.478 119.070 -0.324 0.000 2.289 183 H HA -0.192 4.364 4.556 -0.001 0.000 0.296 183 H C 2.241 176.839 175.328 -1.217 0.000 1.091 183 H CA 1.863 57.589 56.048 -0.538 0.000 1.274 183 H CB -0.442 28.954 29.762 -0.610 0.000 1.364 183 H HN 0.481 8.761 8.280 -0.000 0.000 0.490 184 A N 0.594 122.758 122.820 -1.093 0.000 1.968 184 A HA -0.039 4.281 4.320 -0.001 0.000 0.217 184 A C 2.702 180.074 177.584 -0.352 0.000 1.169 184 A CA 0.722 52.140 52.037 -1.032 0.000 0.638 184 A CB -0.583 18.090 19.000 -0.544 0.000 0.812 184 A HN 0.281 8.431 8.150 -0.000 0.000 0.446 185 I N -0.264 120.124 120.570 -0.304 0.000 2.226 185 I HA -0.248 3.922 4.170 -0.001 0.000 0.245 185 I C 2.260 178.239 176.117 -0.230 0.000 1.100 185 I CA 1.832 62.972 61.300 -0.266 0.000 1.374 185 I CB -0.307 37.476 38.000 -0.363 0.000 1.057 185 I HN 0.379 8.589 8.210 -0.000 0.000 0.413 186 D N 0.323 120.518 120.400 -0.343 0.000 2.104 186 D HA -0.233 4.407 4.640 -0.001 0.000 0.194 186 D C 2.017 178.358 176.300 0.068 0.000 0.994 186 D CA 1.530 55.331 54.000 -0.331 0.000 0.830 186 D CB -0.065 40.258 40.800 -0.796 0.000 0.959 186 D HN 0.231 8.601 8.370 -0.000 0.000 0.452 187 W N 0.721 122.048 121.300 0.045 0.000 2.321 187 W HA -0.115 4.544 4.660 -0.001 0.000 0.306 187 W C 2.374 179.014 176.519 0.201 0.000 1.217 187 W CA 0.383 57.844 57.345 0.193 0.000 1.257 187 W CB -1.343 28.231 29.460 0.189 0.000 1.145 187 W HN 0.167 8.347 8.180 -0.000 0.000 0.509 188 I N -0.922 119.878 120.570 0.382 0.000 2.202 188 I HA -0.329 3.840 4.170 -0.001 0.000 0.242 188 I C 2.572 178.867 176.117 0.296 0.000 1.091 188 I CA 2.015 63.485 61.300 0.284 0.000 1.368 188 I CB -0.959 37.189 38.000 0.246 0.000 1.058 188 I HN -0.063 8.147 8.210 -0.000 0.000 0.410 189 H N 0.146 119.380 119.070 0.274 0.000 2.319 189 H HA -0.305 4.250 4.556 -0.001 0.000 0.297 189 H C 1.921 177.367 175.328 0.196 0.000 1.097 189 H CA 2.220 58.419 56.048 0.251 0.000 1.285 189 H CB -0.472 29.320 29.762 0.050 0.000 1.368 189 H HN 0.475 8.755 8.280 -0.000 0.000 0.495 190 W N 0.963 122.171 121.300 -0.155 0.000 2.379 190 W HA -0.102 4.557 4.660 -0.001 0.000 0.307 190 W C 2.084 178.531 176.519 -0.120 0.000 1.200 190 W CA 1.625 58.840 57.345 -0.216 0.000 1.297 190 W CB -0.495 28.896 29.460 -0.114 0.000 1.140 190 W HN 0.226 8.406 8.180 -0.000 0.000 0.507 191 I N 0.713 121.189 120.570 -0.156 0.000 2.252 191 I HA -0.235 3.934 4.170 -0.001 0.000 0.245 191 I C 2.407 178.401 176.117 -0.205 0.000 1.102 191 I CA 2.212 63.319 61.300 -0.322 0.000 1.385 191 I CB -1.902 36.000 38.000 -0.164 0.000 1.064 191 I HN 0.173 8.383 8.210 -0.000 0.000 0.414 192 T N -1.738 112.758 114.554 -0.096 0.000 2.978 192 T HA 0.105 4.454 4.350 -0.001 0.000 0.262 192 T C 1.724 176.370 174.700 -0.089 0.000 1.063 192 T CA 0.836 62.883 62.100 -0.087 0.000 1.140 192 T CB -0.204 68.624 68.868 -0.067 0.000 0.886 192 T HN 0.465 8.705 8.240 -0.000 0.000 0.470 193 G N 1.743 110.487 108.800 -0.094 0.000 2.168 193 G HA2 -0.265 3.695 3.960 -0.001 0.000 0.257 193 G HA3 -0.265 3.695 3.960 -0.001 0.000 0.257 193 G C -0.055 174.847 174.900 0.003 0.000 0.997 193 G CA 0.540 45.588 45.100 -0.087 0.000 0.708 193 G HN 0.700 8.990 8.290 -0.000 0.000 0.520 194 K N -0.090 120.337 120.400 0.044 0.000 2.156 194 K HA 0.507 4.826 4.320 -0.001 0.000 0.250 194 K C 0.391 177.092 176.600 0.170 0.000 0.955 194 K CA -0.837 55.482 56.287 0.053 0.000 0.855 194 K CB 1.512 33.987 32.500 -0.042 0.000 1.101 194 K HN 0.132 8.382 8.250 -0.000 0.000 0.434 195 K N 1.100 121.584 120.400 0.139 0.000 2.154 195 K HA 0.237 4.556 4.320 -0.001 0.000 0.264 195 K C -0.634 176.082 176.600 0.193 0.000 1.008 195 K CA -0.340 56.076 56.287 0.214 0.000 0.937 195 K CB 0.415 32.997 32.500 0.137 0.000 1.002 195 K HN 0.255 8.505 8.250 -0.000 0.000 0.469 196 F N 2.496 122.452 119.950 0.010 0.000 2.405 196 F HA 0.168 4.695 4.527 -0.001 0.000 0.355 196 F C 1.159 177.002 175.800 0.071 0.000 1.121 196 F CA -0.403 57.618 58.000 0.035 0.000 1.112 196 F CB 0.582 39.569 39.000 -0.021 0.000 1.126 196 F HN 0.359 8.659 8.300 -0.000 0.000 0.481 197 L N 1.433 122.782 121.223 0.210 0.000 2.200 197 L HA 0.140 4.479 4.340 -0.001 0.000 0.200 197 L C 0.583 177.572 176.870 0.198 0.000 1.072 197 L CA 0.502 55.444 54.840 0.169 0.000 0.787 197 L CB -0.220 41.912 42.059 0.122 0.000 0.957 197 L HN 0.648 8.878 8.230 -0.000 0.000 0.459 198 S N -1.552 114.301 115.700 0.255 0.000 2.596 198 S HA 0.598 5.068 4.470 -0.001 0.000 0.270 198 S C -1.115 173.684 174.600 0.332 0.000 1.155 198 S CA -0.748 57.600 58.200 0.247 0.000 0.827 198 S CB 2.599 65.899 63.200 0.166 0.000 1.130 198 S HN -0.123 8.187 8.310 -0.000 0.000 0.467 199 V N 1.779 121.845 119.914 0.254 0.000 2.760 199 V HA 0.766 4.886 4.120 -0.001 0.000 0.309 199 V C -2.226 173.934 176.094 0.110 0.000 1.077 199 V CA -0.612 61.787 62.300 0.165 0.000 0.910 199 V CB 1.937 33.861 31.823 0.170 0.000 1.008 199 V HN 1.066 9.256 8.190 -0.000 0.000 0.424 200 Y N 5.779 126.017 120.300 -0.103 0.000 2.341 200 Y HA 0.858 5.408 4.550 0.000 0.000 0.338 200 Y C -0.191 175.617 175.900 -0.154 0.000 0.965 200 Y CA -0.123 57.905 58.100 -0.120 0.000 1.108 200 Y CB 1.563 39.931 38.460 -0.154 0.000 1.180 200 Y HN 1.016 9.296 8.280 -0.000 0.000 0.458 201 A N 3.732 126.090 122.820 -0.770 0.000 2.539 201 A HA 0.858 5.177 4.320 -0.001 0.000 0.296 201 A C -0.875 176.284 177.584 -0.709 0.000 1.073 201 A CA -0.295 51.362 52.037 -0.633 0.000 0.700 201 A CB 1.337 20.118 19.000 -0.364 0.000 1.296 201 A HN 0.847 8.997 8.150 -0.000 0.000 0.405 202 T N -0.897 113.366 114.554 -0.486 0.000 2.896 202 T HA 0.873 5.222 4.350 -0.001 0.000 0.297 202 T C -0.658 173.936 174.700 -0.177 0.000 1.108 202 T CA -0.478 61.408 62.100 -0.357 0.000 1.004 202 T CB 1.432 70.163 68.868 -0.227 0.000 1.159 202 T HN 1.281 9.521 8.240 -0.000 0.000 0.499 203 H N -1.213 117.826 119.070 -0.051 0.000 3.008 203 H HA 0.807 5.362 4.556 -0.001 0.000 0.354 203 H C -1.549 173.795 175.328 0.027 0.000 1.252 203 H CA -1.119 54.929 56.048 -0.001 0.000 1.117 203 H CB 1.780 31.552 29.762 0.017 0.000 1.857 203 H HN 0.727 9.007 8.280 -0.000 0.000 0.547 204 S N 0.078 115.902 115.700 0.206 0.000 2.547 204 S HA 0.248 4.717 4.470 -0.001 0.000 0.281 204 S C 0.265 174.910 174.600 0.075 0.000 1.118 204 S CA -0.961 57.315 58.200 0.128 0.000 0.947 204 S CB 1.341 64.613 63.200 0.120 0.000 1.053 204 S HN 0.836 9.146 8.310 -0.000 0.000 0.482 205 R N 3.975 124.500 120.500 0.043 0.000 2.427 205 R HA 0.370 4.710 4.340 -0.001 0.000 0.262 205 R C -0.186 176.142 176.300 0.046 0.000 0.943 205 R CA -0.377 55.746 56.100 0.038 0.000 1.081 205 R CB -0.414 29.887 30.300 0.003 0.000 1.166 205 R HN 0.438 8.708 8.270 -0.000 0.000 0.534 206 L N 2.814 124.072 121.223 0.059 0.000 2.456 206 L HA 0.074 4.413 4.340 -0.001 0.000 0.272 206 L C 0.168 177.104 176.870 0.111 0.000 1.189 206 L CA -0.001 54.850 54.840 0.019 0.000 0.846 206 L CB 0.050 42.153 42.059 0.074 0.000 1.111 206 L HN 0.449 8.679 8.230 -0.000 0.000 0.475 207 H N 2.297 121.395 119.070 0.046 0.000 2.677 207 H HA -0.124 4.431 4.556 -0.001 0.000 0.321 207 H C 0.382 175.747 175.328 0.063 0.000 1.171 207 H CA 0.751 56.828 56.048 0.049 0.000 1.139 207 H CB -1.309 28.482 29.762 0.048 0.000 1.515 207 H HN 0.776 9.056 8.280 -0.000 0.000 0.423 208 N N -1.096 117.679 118.700 0.125 0.000 2.268 208 N HA -0.006 4.733 4.740 -0.001 0.000 0.204 208 N C -0.126 175.508 175.510 0.207 0.000 1.124 208 N CA 0.294 53.426 53.050 0.136 0.000 0.838 208 N CB 0.527 39.078 38.487 0.107 0.000 0.994 208 N HN 0.182 8.562 8.380 -0.000 0.000 0.489 209 S N -0.438 115.350 115.700 0.146 0.000 3.628 209 S HA -0.022 4.447 4.470 -0.001 0.000 0.373 209 S C 1.099 175.698 174.600 -0.002 0.000 0.968 209 S CA 0.790 59.056 58.200 0.110 0.000 1.215 209 S CB -1.959 61.331 63.200 0.149 0.000 0.912 209 S HN 1.207 9.517 8.310 -0.000 0.000 0.495 210 G N -0.026 108.744 108.800 -0.051 0.000 2.162 210 G HA2 -0.346 3.614 3.960 -0.001 0.000 0.260 210 G HA3 -0.346 3.614 3.960 -0.001 0.000 0.260 210 G C 0.002 174.755 174.900 -0.245 0.000 0.976 210 G CA 0.695 45.702 45.100 -0.156 0.000 0.655 210 G HN 0.809 9.099 8.290 -0.000 0.000 0.533 211 H N 0.304 119.321 119.070 -0.089 0.000 2.555 211 H HA 0.425 4.980 4.556 -0.001 0.000 0.283 211 H C 2.079 177.346 175.328 -0.102 0.000 1.037 211 H CA 1.243 57.218 56.048 -0.123 0.000 1.169 211 H CB 0.012 29.681 29.762 -0.155 0.000 1.375 211 H HN 1.123 9.403 8.280 -0.000 0.000 0.582 212 G N 1.235 110.030 108.800 -0.008 0.000 2.620 212 G HA2 -0.435 3.524 3.960 -0.001 0.000 0.315 212 G HA3 -0.435 3.524 3.960 -0.001 0.000 0.315 212 G C 1.042 175.949 174.900 0.011 0.000 1.179 212 G CA 0.573 45.666 45.100 -0.012 0.000 0.971 212 G HN 0.519 8.809 8.290 -0.000 0.000 0.544 213 E N 0.538 120.749 120.200 0.018 0.000 2.489 213 E HA 0.302 4.652 4.350 -0.001 0.000 0.193 213 E C 1.231 177.868 176.600 0.062 0.000 1.057 213 E CA -0.229 56.193 56.400 0.037 0.000 0.866 213 E CB 0.270 30.002 29.700 0.053 0.000 0.916 213 E HN 0.457 8.817 8.360 -0.000 0.000 0.500 214 L N 2.321 123.571 121.223 0.045 0.000 2.455 214 L HA 0.047 4.387 4.340 -0.001 0.000 0.272 214 L C -0.359 176.585 176.870 0.123 0.000 1.174 214 L CA -0.242 54.644 54.840 0.076 0.000 0.869 214 L CB 0.582 42.568 42.059 -0.122 0.000 1.130 214 L HN -0.144 8.086 8.230 -0.000 0.000 0.474 215 E N 2.170 122.484 120.200 0.190 0.000 2.289 215 E HA 0.147 4.496 4.350 -0.001 0.000 0.278 215 E C 0.792 177.527 176.600 0.225 0.000 1.032 215 E CA 0.266 56.733 56.400 0.111 0.000 0.854 215 E CB 1.238 30.931 29.700 -0.011 0.000 1.046 215 E HN 0.691 9.051 8.360 -0.000 0.000 0.409 216 T N -1.249 113.416 114.554 0.186 0.000 3.057 216 T HA 0.040 4.390 4.350 -0.001 0.000 0.254 216 T C 0.679 175.491 174.700 0.187 0.000 1.094 216 T CA 0.277 62.516 62.100 0.231 0.000 1.088 216 T CB -0.089 68.890 68.868 0.185 0.000 0.934 216 T HN 0.543 8.783 8.240 -0.000 0.000 0.497 217 T N -0.920 113.721 114.554 0.145 0.000 2.894 217 T HA 0.793 5.142 4.350 -0.001 0.000 0.309 217 T C -1.399 173.368 174.700 0.112 0.000 1.208 217 T CA -0.635 61.530 62.100 0.108 0.000 1.016 217 T CB 2.131 71.057 68.868 0.096 0.000 1.192 217 T HN 0.565 8.805 8.240 -0.000 0.000 0.491 218 A N 1.071 123.936 122.820 0.075 0.000 2.599 218 A HA 0.782 5.101 4.320 -0.001 0.000 0.294 218 A C -2.245 175.346 177.584 0.011 0.000 1.055 218 A CA -0.832 51.244 52.037 0.064 0.000 0.683 218 A CB 1.682 20.736 19.000 0.090 0.000 1.278 218 A HN 1.356 9.506 8.150 -0.000 0.000 0.412 219 L N 0.893 122.097 121.223 -0.032 0.000 2.470 219 L HA 0.769 5.108 4.340 -0.001 0.000 0.268 219 L C -1.238 175.557 176.870 -0.126 0.000 0.964 219 L CA -0.085 54.727 54.840 -0.047 0.000 0.839 219 L CB 1.662 43.708 42.059 -0.022 0.000 1.276 219 L HN 0.881 9.111 8.230 -0.000 0.000 0.403 220 C N 3.505 122.723 119.300 -0.138 0.000 2.455 220 C HA 0.605 5.065 4.460 -0.001 0.000 0.320 220 C C -0.686 174.130 174.990 -0.291 0.000 1.226 220 C CA -0.786 58.039 59.018 -0.323 0.000 1.569 220 C CB 1.115 28.553 27.740 -0.503 0.000 2.200 220 C HN 0.772 9.002 8.230 -0.000 0.000 0.491 221 H N 2.079 120.920 119.070 -0.383 0.000 2.511 221 H HA 0.587 5.142 4.556 -0.001 0.000 0.328 221 H C -1.659 173.484 175.328 -0.310 0.000 1.044 221 H CA -0.590 55.338 56.048 -0.200 0.000 1.212 221 H CB 0.604 30.358 29.762 -0.013 0.000 1.428 221 H HN 0.580 8.860 8.280 -0.000 0.000 0.483 222 F N 2.359 122.406 119.950 0.162 0.000 2.469 222 F HA 0.263 4.789 4.527 -0.001 0.000 0.332 222 F C 0.769 176.684 175.800 0.192 0.000 1.103 222 F CA -0.590 57.530 58.000 0.199 0.000 0.979 222 F CB 1.989 41.040 39.000 0.085 0.000 1.137 222 F HN 0.314 8.614 8.300 -0.000 0.000 0.463 223 T N 4.978 119.792 114.554 0.433 0.000 2.749 223 T HA 0.613 4.963 4.350 -0.001 0.000 0.287 223 T C -0.348 174.422 174.700 0.116 0.000 0.970 223 T CA -0.366 61.950 62.100 0.359 0.000 0.980 223 T CB 0.581 69.675 68.868 0.377 0.000 0.924 223 T HN 0.156 8.396 8.240 -0.000 0.000 0.456 224 L N 2.301 123.499 121.223 -0.042 0.000 2.298 224 L HA 0.466 4.806 4.340 -0.001 0.000 0.268 224 L C 0.765 177.576 176.870 -0.098 0.000 1.010 224 L CA -0.816 53.924 54.840 -0.167 0.000 0.812 224 L CB 0.719 42.582 42.059 -0.327 0.000 1.331 224 L HN 0.608 8.838 8.230 -0.000 0.000 0.450 225 E N 0.308 120.465 120.200 -0.073 0.000 2.485 225 E HA -0.089 4.260 4.350 -0.001 0.000 0.266 225 E C 0.097 176.639 176.600 -0.098 0.000 1.090 225 E CA 0.389 56.758 56.400 -0.052 0.000 0.987 225 E CB -0.099 29.584 29.700 -0.029 0.000 0.974 225 E HN 0.574 8.934 8.360 -0.000 0.000 0.455 226 N N 1.108 119.760 118.700 -0.080 0.000 2.741 226 N HA -0.244 4.496 4.740 -0.001 0.000 0.250 226 N C -1.141 174.265 175.510 -0.174 0.000 1.115 226 N CA 1.298 54.287 53.050 -0.102 0.000 0.724 226 N CB -1.194 37.235 38.487 -0.098 0.000 1.090 226 N HN 0.737 9.117 8.380 -0.000 0.000 0.558 227 E N -2.444 117.640 120.200 -0.193 0.000 2.360 227 E HA -0.239 4.111 4.350 -0.001 0.000 0.238 227 E C -0.781 175.306 176.600 -0.855 0.000 1.186 227 E CA 0.887 57.066 56.400 -0.368 0.000 0.719 227 E CB -1.473 28.113 29.700 -0.190 0.000 1.236 227 E HN 0.254 8.614 8.360 -0.000 0.000 0.386 228 V N 1.559 121.094 119.914 -0.632 0.000 2.432 228 V HA 0.342 4.461 4.120 -0.001 0.000 0.275 228 V C 0.121 175.851 176.094 -0.606 0.000 1.043 228 V CA -0.075 61.864 62.300 -0.602 0.000 0.925 228 V CB 0.322 31.962 31.823 -0.305 0.000 0.985 228 V HN 0.116 8.306 8.190 -0.000 0.000 0.466 229 F N 2.792 122.708 119.950 -0.057 0.000 2.458 229 F HA 0.819 5.345 4.527 -0.002 0.000 0.330 229 F C 0.407 176.145 175.800 -0.104 0.000 1.082 229 F CA -1.146 56.796 58.000 -0.095 0.000 0.995 229 F CB 1.641 40.569 39.000 -0.121 0.000 1.170 229 F HN 0.501 8.801 8.300 -0.000 0.000 0.478 230 A N 1.378 124.254 122.820 0.093 0.000 2.359 230 A HA 0.706 5.025 4.320 -0.001 0.000 0.303 230 A C -0.621 177.047 177.584 0.140 0.000 1.066 230 A CA -0.632 51.477 52.037 0.120 0.000 0.730 230 A CB 0.955 20.035 19.000 0.133 0.000 1.211 230 A HN 0.784 8.934 8.150 -0.000 0.000 0.439 231 S N 1.454 117.217 115.700 0.104 0.000 2.549 231 S HA 0.788 5.258 4.470 -0.001 0.000 0.297 231 S C -0.790 173.908 174.600 0.162 0.000 1.115 231 S CA -0.635 57.611 58.200 0.077 0.000 1.059 231 S CB 1.542 64.760 63.200 0.030 0.000 1.046 231 S HN 1.616 9.926 8.310 -0.000 0.000 0.506 232 L N 1.884 123.187 121.223 0.133 0.000 2.504 232 L HA 0.598 4.938 4.340 -0.001 0.000 0.265 232 L C -0.572 176.338 176.870 0.066 0.000 0.975 232 L CA -0.209 54.719 54.840 0.146 0.000 0.864 232 L CB 1.593 43.806 42.059 0.257 0.000 1.212 232 L HN 0.864 9.094 8.230 -0.000 0.000 0.416 233 S N 5.957 121.692 115.700 0.059 0.000 2.438 233 S HA 0.783 5.253 4.470 -0.001 0.000 0.293 233 S C -0.433 174.168 174.600 0.003 0.000 1.141 233 S CA -0.403 57.816 58.200 0.031 0.000 1.080 233 S CB 0.154 63.378 63.200 0.040 0.000 0.978 233 S HN 0.544 8.854 8.310 -0.000 0.000 0.479 234 I N 4.372 124.932 120.570 -0.017 0.000 2.466 234 I HA 0.453 4.622 4.170 -0.001 0.000 0.289 234 I C -1.075 175.016 176.117 -0.045 0.000 1.026 234 I CA -0.681 60.578 61.300 -0.069 0.000 1.078 234 I CB 2.117 40.068 38.000 -0.081 0.000 1.249 234 I HN 0.705 8.915 8.210 -0.000 0.000 0.429 235 D N 3.348 123.705 120.400 -0.072 0.000 2.661 235 D HA 0.269 4.908 4.640 -0.001 0.000 0.228 235 D C -1.077 175.227 176.300 0.006 0.000 1.183 235 D CA -0.580 53.421 54.000 0.002 0.000 0.844 235 D CB 1.182 42.013 40.800 0.051 0.000 1.555 235 D HN 0.439 8.809 8.370 -0.000 0.000 0.453 236 Y N 0.761 121.123 120.300 0.103 0.000 2.867 236 Y HA 0.344 4.893 4.550 -0.001 0.000 0.351 236 Y C 0.284 176.244 175.900 0.101 0.000 1.046 236 Y CA -0.398 57.782 58.100 0.134 0.000 1.520 236 Y CB 0.399 38.937 38.460 0.129 0.000 1.337 236 Y HN 0.264 8.544 8.280 -0.000 0.000 0.525 237 L N 0.053 121.415 121.223 0.232 0.000 3.122 237 L HA 0.255 4.595 4.340 -0.001 0.000 0.274 237 L C 0.565 177.511 176.870 0.128 0.000 1.222 237 L CA -0.194 54.739 54.840 0.154 0.000 1.028 237 L CB 0.390 42.515 42.059 0.110 0.000 1.386 237 L HN 0.085 8.315 8.230 -0.000 0.000 0.578 238 R N 2.783 123.378 120.500 0.158 0.000 2.446 238 R HA 0.115 4.454 4.340 -0.001 0.000 0.325 238 R C -2.205 174.165 176.300 0.118 0.000 0.997 238 R CA -1.233 54.947 56.100 0.133 0.000 1.010 238 R CB 0.346 30.743 30.300 0.163 0.000 0.946 238 R HN -0.096 8.174 8.270 -0.000 0.000 0.422 239 P HA -0.053 4.367 4.420 -0.000 0.000 0.266 239 P C 0.028 177.371 177.300 0.071 0.000 1.195 239 P CA -0.197 62.945 63.100 0.070 0.000 0.768 239 P CB 0.773 32.504 31.700 0.052 0.000 0.838 240 Q N 2.339 122.176 119.800 0.062 0.000 2.173 240 Q HA -0.141 4.198 4.340 -0.001 0.000 0.208 240 Q C 2.108 178.139 176.000 0.052 0.000 0.989 240 Q CA 2.268 58.105 55.803 0.057 0.000 0.872 240 Q CB -1.161 27.602 28.738 0.042 0.000 0.909 240 Q HN 0.737 9.007 8.270 -0.000 0.000 0.420 241 G N 0.197 109.023 108.800 0.044 0.000 2.776 241 G HA2 0.167 4.127 3.960 -0.001 0.000 0.209 241 G HA3 0.167 4.127 3.960 -0.001 0.000 0.209 241 G C 0.424 175.349 174.900 0.043 0.000 1.145 241 G CA 0.468 45.592 45.100 0.039 0.000 0.791 241 G HN 0.383 8.673 8.290 -0.000 0.000 0.530 242 A N 0.595 123.447 122.820 0.054 0.000 2.386 242 A HA 0.551 4.871 4.320 -0.001 0.000 0.248 242 A C -0.405 177.213 177.584 0.058 0.000 1.082 242 A CA -0.928 51.142 52.037 0.056 0.000 0.789 242 A CB 0.696 19.736 19.000 0.067 0.000 1.025 242 A HN 0.088 8.238 8.150 -0.000 0.000 0.490 243 P HA -0.107 4.313 4.420 -0.000 0.000 0.216 243 P C 0.753 178.091 177.300 0.063 0.000 1.154 243 P CA 2.296 65.426 63.100 0.050 0.000 0.865 243 P CB -0.005 31.721 31.700 0.042 0.000 0.789 244 T N -5.714 108.886 114.554 0.077 0.000 2.864 244 T HA 0.355 4.705 4.350 -0.001 0.000 0.289 244 T C 0.702 175.485 174.700 0.139 0.000 1.082 244 T CA -0.416 61.747 62.100 0.104 0.000 1.009 244 T CB 1.142 70.064 68.868 0.090 0.000 1.234 244 T HN 0.156 8.396 8.240 -0.000 0.000 0.526 245 H N -0.252 118.864 119.070 0.077 0.000 2.548 245 H HA 0.274 4.829 4.556 -0.001 0.000 0.268 245 H C -0.037 175.394 175.328 0.173 0.000 0.975 245 H CA 0.716 56.817 56.048 0.088 0.000 1.195 245 H CB 0.159 29.936 29.762 0.026 0.000 1.397 245 H HN 0.708 8.988 8.280 -0.000 0.000 0.572 246 D N -0.726 119.537 120.400 -0.229 0.000 2.581 246 D HA 0.227 4.866 4.640 -0.001 0.000 0.232 246 D C -1.163 175.166 176.300 0.049 0.000 1.143 246 D CA -0.851 53.095 54.000 -0.089 0.000 0.881 246 D CB 1.857 42.555 40.800 -0.169 0.000 1.500 246 D HN 0.202 8.572 8.370 -0.000 0.000 0.458 247 D N 0.554 121.008 120.400 0.091 0.000 2.517 247 D HA 0.186 4.825 4.640 -0.001 0.000 0.263 247 D C -1.354 175.015 176.300 0.115 0.000 1.233 247 D CA -0.295 53.755 54.000 0.082 0.000 0.849 247 D CB 0.355 41.193 40.800 0.064 0.000 1.261 247 D HN 0.101 8.471 8.370 -0.000 0.000 0.516 248 D N 1.684 122.192 120.400 0.180 0.000 2.350 248 D HA 0.424 5.063 4.640 -0.001 0.000 0.249 248 D C 0.628 177.062 176.300 0.223 0.000 1.119 248 D CA 0.217 54.407 54.000 0.317 0.000 0.886 248 D CB 1.223 42.310 40.800 0.478 0.000 1.195 248 D HN 0.321 8.691 8.370 -0.000 0.000 0.437 252 I N 4.845 125.422 120.570 0.012 0.000 2.355 252 I HA 0.338 4.507 4.170 -0.001 0.000 0.288 252 I C -0.315 175.797 176.117 -0.009 0.000 0.999 252 I CA -0.979 60.320 61.300 -0.001 0.000 1.163 252 I CB 1.993 39.978 38.000 -0.025 0.000 1.316 252 I HN 0.206 8.416 8.210 -0.000 0.000 0.454 253 V N 5.768 125.678 119.914 -0.007 0.000 2.347 253 V HA 0.720 4.839 4.120 -0.001 0.000 0.280 253 V C 0.642 176.722 176.094 -0.023 0.000 1.021 253 V CA -0.318 61.976 62.300 -0.009 0.000 0.847 253 V CB 1.024 32.849 31.823 0.003 0.000 0.990 253 V HN 0.890 9.080 8.190 -0.000 0.000 0.444 254 G N 2.283 111.068 108.800 -0.026 0.000 2.788 254 G HA2 0.496 4.456 3.960 -0.001 0.000 0.293 254 G HA3 0.496 4.456 3.960 -0.001 0.000 0.293 254 G C 0.920 175.803 174.900 -0.028 0.000 1.305 254 G CA 0.295 45.374 45.100 -0.035 0.000 1.005 254 G HN 0.670 8.960 8.290 -0.000 0.000 0.496 255 T N -1.585 112.950 114.554 -0.032 0.000 2.833 255 T HA -0.079 4.271 4.350 -0.001 0.000 0.269 255 T C 1.735 176.422 174.700 -0.020 0.000 1.054 255 T CA 0.945 63.030 62.100 -0.026 0.000 1.135 255 T CB 0.014 68.864 68.868 -0.030 0.000 0.869 255 T HN 0.334 8.574 8.240 -0.000 0.000 0.466 256 R N 0.882 121.369 120.500 -0.022 0.000 2.316 256 R HA 0.497 4.837 4.340 -0.001 0.000 0.201 256 R C 1.151 177.443 176.300 -0.013 0.000 0.888 256 R CA 0.635 56.724 56.100 -0.018 0.000 1.041 256 R CB 0.833 31.120 30.300 -0.021 0.000 1.115 256 R HN 0.538 8.808 8.270 -0.000 0.000 0.559 257 G N 0.339 109.130 108.800 -0.015 0.000 2.548 257 G HA2 0.561 4.521 3.960 -0.001 0.000 0.301 257 G HA3 0.561 4.521 3.960 -0.001 0.000 0.301 257 G C -1.625 173.270 174.900 -0.008 0.000 1.349 257 G CA -0.696 44.400 45.100 -0.007 0.000 0.792 257 G HN -0.035 8.255 8.290 -0.000 0.000 0.481 258 I N 0.411 120.982 120.570 0.001 0.000 2.447 258 I HA 0.422 4.592 4.170 -0.001 0.000 0.287 258 I C -0.487 175.636 176.117 0.010 0.000 1.023 258 I CA -0.973 60.328 61.300 0.002 0.000 1.083 258 I CB 2.272 40.276 38.000 0.007 0.000 1.245 258 I HN 0.180 8.390 8.210 -0.000 0.000 0.434 259 V N 5.737 125.649 119.914 -0.004 0.000 2.427 259 V HA 0.348 4.467 4.120 -0.001 0.000 0.286 259 V C -0.116 175.982 176.094 0.007 0.000 1.034 259 V CA -0.395 61.903 62.300 -0.004 0.000 0.893 259 V CB 1.659 33.455 31.823 -0.045 0.000 0.982 259 V HN 0.692 8.882 8.190 -0.000 0.000 0.452 260 E N 2.970 123.200 120.200 0.050 0.000 2.199 260 E HA 0.631 4.981 4.350 -0.001 0.000 0.269 260 E C -1.549 175.083 176.600 0.053 0.000 0.899 260 E CA -0.556 55.874 56.400 0.051 0.000 0.772 260 E CB 2.192 31.928 29.700 0.061 0.000 1.155 260 E HN 0.460 8.820 8.360 -0.000 0.000 0.408 261 V N 6.063 125.949 119.914 -0.046 0.000 2.313 261 V HA 0.475 4.595 4.120 -0.001 0.000 0.278 261 V C -0.309 175.738 176.094 -0.077 0.000 1.017 261 V CA -0.538 61.675 62.300 -0.143 0.000 0.823 261 V CB 0.802 32.351 31.823 -0.457 0.000 1.010 261 V HN 0.594 8.784 8.190 -0.000 0.000 0.443 262 I N 4.051 124.628 120.570 0.010 0.000 2.692 262 I HA 0.522 4.692 4.170 -0.001 0.000 0.293 262 I C 0.042 176.168 176.117 0.016 0.000 1.200 262 I CA -0.253 61.052 61.300 0.008 0.000 1.036 262 I CB 1.976 39.973 38.000 -0.005 0.000 1.258 262 I HN 0.620 8.830 8.210 -0.000 0.000 0.421 263 N N 4.745 123.425 118.700 -0.033 0.000 2.754 263 N HA -0.210 4.529 4.740 -0.001 0.000 0.248 263 N C -0.063 175.364 175.510 -0.138 0.000 1.093 263 N CA 1.553 54.577 53.050 -0.043 0.000 0.699 263 N CB -0.970 37.529 38.487 0.020 0.000 1.016 263 N HN 0.863 9.243 8.380 -0.000 0.000 0.552 264 E N -2.600 117.394 120.200 -0.343 0.000 2.883 264 E HA -0.331 4.018 4.350 -0.001 0.000 0.271 264 E C -0.220 176.142 176.600 -0.397 0.000 1.049 264 E CA 1.171 57.101 56.400 -0.784 0.000 0.817 264 E CB -0.680 28.632 29.700 -0.646 0.000 1.407 264 E HN 0.558 8.918 8.360 -0.000 0.000 0.434 265 R N -0.529 119.858 120.500 -0.189 0.000 2.854 265 R HA 0.678 5.017 4.340 -0.001 0.000 0.271 265 R C -0.780 175.414 176.300 -0.176 0.000 0.994 265 R CA -0.869 55.134 56.100 -0.161 0.000 0.945 265 R CB 2.155 32.393 30.300 -0.103 0.000 1.194 265 R HN -0.116 8.154 8.270 -0.000 0.000 0.476 266 V N 2.425 122.096 119.914 -0.404 0.000 2.555 266 V HA 0.569 4.688 4.120 -0.001 0.000 0.302 266 V C -1.085 174.651 176.094 -0.595 0.000 1.038 266 V CA -0.633 61.480 62.300 -0.311 0.000 0.887 266 V CB 1.380 33.074 31.823 -0.216 0.000 0.991 266 V HN 0.509 8.699 8.190 -0.000 0.000 0.434 267 F N 4.382 124.293 119.950 -0.065 0.000 2.565 267 F HA 0.783 5.309 4.527 -0.001 0.000 0.313 267 F C -0.523 175.256 175.800 -0.035 0.000 1.091 267 F CA -0.830 57.148 58.000 -0.038 0.000 0.915 267 F CB 2.028 41.013 39.000 -0.025 0.000 1.208 267 F HN 0.324 8.624 8.300 -0.000 0.000 0.453 268 L N 1.884 123.192 121.223 0.142 0.000 2.410 268 L HA 0.796 5.136 4.340 -0.001 0.000 0.270 268 L C -0.898 176.028 176.870 0.094 0.000 0.983 268 L CA 0.016 54.901 54.840 0.074 0.000 0.822 268 L CB 2.140 44.206 42.059 0.011 0.000 1.285 268 L HN 0.613 8.843 8.230 -0.000 0.000 0.409 269 T N 3.486 118.086 114.554 0.076 0.000 2.841 269 T HA 0.786 5.136 4.350 -0.001 0.000 0.283 269 T C -1.263 173.462 174.700 0.042 0.000 1.000 269 T CA -0.456 61.692 62.100 0.080 0.000 0.977 269 T CB 1.581 70.495 68.868 0.077 0.000 0.979 269 T HN 0.782 9.022 8.240 -0.000 0.000 0.446 270 D N 0.794 121.216 120.400 0.038 0.000 2.921 270 D HA 0.260 4.899 4.640 -0.001 0.000 0.329 270 D C 0.673 176.984 176.300 0.018 0.000 1.293 270 D CA -0.762 53.248 54.000 0.017 0.000 0.964 270 D CB 0.059 40.861 40.800 0.003 0.000 1.435 270 D HN 0.310 8.680 8.370 -0.000 0.000 0.548 271 E N 0.154 120.358 120.200 0.007 0.000 2.160 271 E HA -0.126 4.224 4.350 -0.001 0.000 0.195 271 E C 1.427 178.033 176.600 0.009 0.000 0.991 271 E CA 1.517 57.921 56.400 0.007 0.000 0.810 271 E CB -0.200 29.500 29.700 -0.001 0.000 0.742 271 E HN 0.378 8.738 8.360 -0.000 0.000 0.466 272 K N -0.368 120.034 120.400 0.004 0.000 2.044 272 K HA 0.204 4.523 4.320 -0.001 0.000 0.204 272 K C 1.022 177.623 176.600 0.001 0.000 1.049 272 K CA 1.013 57.298 56.287 -0.003 0.000 0.945 272 K CB 0.222 32.712 32.500 -0.015 0.000 0.724 272 K HN 0.216 8.466 8.250 -0.000 0.000 0.440 273 G N -0.369 108.437 108.800 0.010 0.000 2.335 273 G HA2 0.116 4.076 3.960 -0.001 0.000 0.291 273 G HA3 0.116 4.076 3.960 -0.001 0.000 0.291 273 G C -1.943 172.995 174.900 0.063 0.000 1.261 273 G CA -0.863 44.252 45.100 0.026 0.000 0.871 273 G HN 0.264 8.554 8.290 -0.000 0.000 0.491 274 H N -0.159 118.922 119.070 0.018 0.000 2.489 274 H HA 0.862 5.417 4.556 -0.001 0.000 0.343 274 H C -0.292 175.069 175.328 0.055 0.000 1.086 274 H CA -0.714 55.356 56.048 0.037 0.000 1.198 274 H CB 1.927 31.708 29.762 0.032 0.000 1.490 274 H HN 0.996 9.276 8.280 -0.000 0.000 0.504 275 R N 1.642 122.204 120.500 0.104 0.000 2.690 275 R HA 0.277 4.616 4.340 -0.001 0.000 0.269 275 R C -1.314 175.046 176.300 0.100 0.000 1.037 275 R CA -0.886 55.251 56.100 0.062 0.000 0.877 275 R CB 1.687 31.960 30.300 -0.045 0.000 1.255 275 R HN 0.678 8.948 8.270 -0.000 0.000 0.467 276 E N 1.513 121.724 120.200 0.018 0.000 2.316 276 E HA 0.237 4.586 4.350 -0.001 0.000 0.275 276 E C -0.771 175.680 176.600 -0.249 0.000 1.029 276 E CA -0.591 55.617 56.400 -0.320 0.000 0.871 276 E CB 1.258 30.728 29.700 -0.383 0.000 1.022 276 E HN 0.358 8.718 8.360 -0.000 0.000 0.418 277 V N 7.420 127.150 119.914 -0.306 0.000 2.465 277 V HA 0.273 4.392 4.120 -0.001 0.000 0.279 277 V C -1.898 174.082 176.094 -0.190 0.000 1.045 277 V CA -1.637 60.548 62.300 -0.193 0.000 0.938 277 V CB 1.034 32.763 31.823 -0.157 0.000 0.986 277 V HN 0.785 8.975 8.190 -0.000 0.000 0.467 278 P HA 0.200 4.620 4.420 -0.000 0.000 0.268 278 P C -0.609 176.640 177.300 -0.086 0.000 1.205 278 P CA -0.109 62.931 63.100 -0.100 0.000 0.771 278 P CB 0.692 32.351 31.700 -0.068 0.000 0.858 279 L N 2.414 123.596 121.223 -0.069 0.000 2.418 279 L HA 0.300 4.640 4.340 -0.001 0.000 0.265 279 L C 1.264 178.121 176.870 -0.022 0.000 1.143 279 L CA -1.036 53.778 54.840 -0.044 0.000 0.809 279 L CB 0.740 42.788 42.059 -0.018 0.000 1.124 279 L HN 0.241 8.471 8.230 -0.000 0.000 0.456 280 V N -0.999 118.907 119.914 -0.012 0.000 3.441 280 V HA 0.263 4.383 4.120 -0.001 0.000 0.300 280 V C 0.253 176.360 176.094 0.022 0.000 1.062 280 V CA -0.914 61.387 62.300 0.002 0.000 1.064 280 V CB 0.809 32.633 31.823 0.002 0.000 1.197 280 V HN 0.782 8.972 8.190 -0.000 0.000 0.451 281 E N 1.543 121.760 120.200 0.027 0.000 2.585 281 E HA 0.069 4.419 4.350 -0.001 0.000 0.252 281 E C 0.393 177.030 176.600 0.063 0.000 0.981 281 E CA 0.348 56.773 56.400 0.042 0.000 0.943 281 E CB 0.086 29.809 29.700 0.038 0.000 0.923 281 E HN 0.844 9.204 8.360 -0.000 0.000 0.486 282 K N 2.454 122.900 120.400 0.077 0.000 2.285 282 K HA 0.332 4.652 4.320 -0.001 0.000 0.255 282 K C 0.437 177.113 176.600 0.127 0.000 1.000 282 K CA 0.030 56.381 56.287 0.107 0.000 0.887 282 K CB 0.633 33.202 32.500 0.114 0.000 0.997 282 K HN 0.430 8.680 8.250 -0.000 0.000 0.510 283 G N -0.401 108.513 108.800 0.191 0.000 3.105 283 G HA2 0.362 4.322 3.960 -0.001 0.000 0.277 283 G HA3 0.362 4.322 3.960 -0.001 0.000 0.277 283 G C -1.538 173.480 174.900 0.195 0.000 1.375 283 G CA -0.501 44.746 45.100 0.246 0.000 0.962 283 G HN 0.485 8.775 8.290 -0.000 0.000 0.541 284 Q N -0.145 119.683 119.800 0.046 0.000 2.296 284 Q HA 0.199 4.538 4.340 -0.001 0.000 0.254 284 Q C 0.549 176.200 176.000 -0.582 0.000 0.936 284 Q CA -0.626 55.069 55.803 -0.180 0.000 0.834 284 Q CB 2.543 31.263 28.738 -0.029 0.000 1.340 284 Q HN 0.599 8.869 8.270 -0.000 0.000 0.428 285 I N 3.624 123.600 120.570 -0.989 0.000 2.194 285 I HA -0.257 3.913 4.170 -0.001 0.000 0.246 285 I C 1.264 177.117 176.117 -0.439 0.000 1.093 285 I CA 1.551 62.178 61.300 -1.122 0.000 1.355 285 I CB 0.034 37.602 38.000 -0.721 0.000 1.046 285 I HN 0.655 8.865 8.210 -0.000 0.000 0.413 286 F N 1.532 121.214 119.950 -0.447 0.000 2.367 286 F HA -0.073 4.453 4.527 -0.001 0.000 0.298 286 F C 2.286 177.965 175.800 -0.201 0.000 1.094 286 F CA 1.290 59.020 58.000 -0.449 0.000 1.409 286 F CB -0.175 38.548 39.000 -0.461 0.000 1.064 286 F HN 0.102 8.402 8.300 -0.000 0.000 0.528 287 E N -0.346 119.784 120.200 -0.118 0.000 2.077 287 E HA -0.251 4.098 4.350 -0.001 0.000 0.193 287 E C 1.669 178.181 176.600 -0.146 0.000 0.989 287 E CA 1.421 57.753 56.400 -0.113 0.000 0.800 287 E CB -0.229 29.445 29.700 -0.042 0.000 0.746 287 E HN 0.314 8.674 8.360 -0.000 0.000 0.452 288 D N -0.026 120.289 120.400 -0.142 0.000 2.117 288 D HA -0.153 4.486 4.640 -0.001 0.000 0.197 288 D C 1.527 177.736 176.300 -0.151 0.000 0.987 288 D CA 0.647 54.597 54.000 -0.082 0.000 0.829 288 D CB -0.132 40.696 40.800 0.047 0.000 0.961 288 D HN 0.057 8.427 8.370 -0.000 0.000 0.460 289 F N 0.521 120.244 119.950 -0.378 0.000 2.134 289 F HA -0.084 4.443 4.527 -0.001 0.000 0.299 289 F C 1.984 177.460 175.800 -0.539 0.000 1.097 289 F CA 1.152 58.879 58.000 -0.455 0.000 1.264 289 F CB -0.077 38.510 39.000 -0.688 0.000 1.001 289 F HN -0.037 8.263 8.300 -0.000 0.000 0.479 290 L N -0.376 120.638 121.223 -0.348 0.000 2.109 290 L HA -0.120 4.219 4.340 -0.001 0.000 0.207 290 L C 2.593 179.298 176.870 -0.275 0.000 1.086 290 L CA 0.948 55.603 54.840 -0.308 0.000 0.760 290 L CB -0.647 41.257 42.059 -0.258 0.000 0.910 290 L HN -0.032 8.198 8.230 -0.000 0.000 0.437 291 R N 0.147 120.502 120.500 -0.241 0.000 2.103 291 R HA -0.251 4.088 4.340 -0.001 0.000 0.242 291 R C 2.202 178.325 176.300 -0.295 0.000 1.142 291 R CA 1.883 57.857 56.100 -0.210 0.000 0.960 291 R CB -0.312 29.896 30.300 -0.154 0.000 0.858 291 R HN 0.320 8.590 8.270 -0.000 0.000 0.439 292 E N 0.927 120.860 120.200 -0.445 0.000 2.051 292 E HA -0.175 4.174 4.350 -0.001 0.000 0.192 292 E C 1.764 177.989 176.600 -0.625 0.000 0.991 292 E CA 1.240 57.251 56.400 -0.648 0.000 0.799 292 E CB -0.037 28.985 29.700 -1.130 0.000 0.748 292 E HN 0.089 8.449 8.360 -0.000 0.000 0.449 293 I N 0.828 121.013 120.570 -0.640 0.000 2.361 293 I HA -0.178 3.992 4.170 -0.001 0.000 0.251 293 I C 1.610 177.574 176.117 -0.254 0.000 1.133 293 I CA 1.379 62.379 61.300 -0.501 0.000 1.413 293 I CB -0.836 36.934 38.000 -0.383 0.000 1.073 293 I HN 0.127 8.337 8.210 -0.000 0.000 0.424 294 R N 0.358 120.729 120.500 -0.215 0.000 2.568 294 R HA 0.256 4.595 4.340 -0.001 0.000 0.288 294 R C 1.233 177.460 176.300 -0.122 0.000 1.077 294 R CA 0.437 56.462 56.100 -0.125 0.000 1.102 294 R CB -0.108 30.134 30.300 -0.096 0.000 1.278 294 R HN 0.375 8.645 8.270 -0.000 0.000 0.560 295 G N 1.474 110.178 108.800 -0.160 0.000 2.309 295 G HA2 -0.371 3.588 3.960 -0.001 0.000 0.286 295 G HA3 -0.371 3.588 3.960 -0.001 0.000 0.286 295 G C 0.708 175.540 174.900 -0.114 0.000 1.002 295 G CA 0.703 45.722 45.100 -0.135 0.000 0.786 295 G HN 0.469 8.759 8.290 -0.000 0.000 0.511 296 Q N -0.932 118.793 119.800 -0.125 0.000 2.451 296 Q HA 0.416 4.755 4.340 -0.001 0.000 0.206 296 Q C 1.458 177.399 176.000 -0.099 0.000 0.947 296 Q CA 0.694 56.439 55.803 -0.096 0.000 0.937 296 Q CB 0.425 29.111 28.738 -0.088 0.000 1.025 296 Q HN 0.927 9.197 8.270 -0.000 0.000 0.511 297 G N -0.406 108.314 108.800 -0.133 0.000 2.321 297 G HA2 0.194 4.153 3.960 -0.001 0.000 0.296 297 G HA3 0.194 4.153 3.960 -0.001 0.000 0.296 297 G C -1.820 172.977 174.900 -0.173 0.000 1.287 297 G CA -0.948 44.079 45.100 -0.122 0.000 0.846 297 G HN -0.212 8.078 8.290 -0.000 0.000 0.508 298 K N -0.063 120.258 120.400 -0.133 0.000 2.274 298 K HA 0.566 4.885 4.320 -0.001 0.000 0.262 298 K C 0.200 176.731 176.600 -0.115 0.000 0.961 298 K CA -0.456 55.742 56.287 -0.149 0.000 0.833 298 K CB 1.358 33.813 32.500 -0.075 0.000 1.102 298 K HN 0.724 8.974 8.250 -0.000 0.000 0.436 302 T N 1.922 116.474 114.554 -0.004 0.000 2.860 302 T HA 0.405 4.754 4.350 -0.001 0.000 0.299 302 T C -1.367 173.142 174.700 -0.318 0.000 1.045 302 T CA -1.255 60.813 62.100 -0.054 0.000 1.071 302 T CB 1.680 70.542 68.868 -0.009 0.000 0.985 302 T HN 0.370 8.610 8.240 -0.000 0.000 0.537 303 P HA 0.013 4.433 4.420 -0.000 0.000 0.221 303 P C 1.139 178.079 177.300 -0.599 0.000 1.150 303 P CA 0.797 63.224 63.100 -1.121 0.000 0.800 303 P CB 0.089 30.777 31.700 -1.687 0.000 0.787 304 E N -0.051 119.980 120.200 -0.281 0.000 2.031 304 E HA -0.179 4.170 4.350 -0.001 0.000 0.193 304 E C 1.794 178.328 176.600 -0.110 0.000 0.994 304 E CA 1.349 57.687 56.400 -0.104 0.000 0.800 304 E CB -1.015 28.684 29.700 -0.000 0.000 0.752 304 E HN 0.191 8.551 8.360 -0.000 0.000 0.447 305 D N -0.000 120.351 120.400 -0.082 0.000 2.154 305 D HA -0.177 4.462 4.640 -0.001 0.000 0.190 305 D C 2.022 178.209 176.300 -0.188 0.000 1.003 305 D CA 1.623 55.575 54.000 -0.082 0.000 0.849 305 D CB -0.498 40.264 40.800 -0.063 0.000 0.942 305 D HN 0.041 8.411 8.370 -0.000 0.000 0.446 306 S N -0.089 115.506 115.700 -0.174 0.000 2.382 306 S HA -0.071 4.399 4.470 -0.001 0.000 0.228 306 S C 2.220 176.804 174.600 -0.028 0.000 1.027 306 S CA 0.441 58.604 58.200 -0.062 0.000 0.991 306 S CB -0.106 63.058 63.200 -0.060 0.000 0.823 306 S HN 0.265 8.575 8.310 -0.000 0.000 0.469 307 I N 0.857 121.396 120.570 -0.052 0.000 2.163 307 I HA -0.165 4.005 4.170 -0.001 0.000 0.240 307 I C 2.314 178.385 176.117 -0.077 0.000 1.081 307 I CA 0.852 62.146 61.300 -0.009 0.000 1.353 307 I CB -0.296 37.718 38.000 0.024 0.000 1.054 307 I HN 0.226 8.436 8.210 -0.000 0.000 0.407 308 L N 0.644 121.776 121.223 -0.152 0.000 2.017 308 L HA -0.203 4.136 4.340 -0.001 0.000 0.208 308 L C 2.771 179.439 176.870 -0.337 0.000 1.073 308 L CA 2.571 57.263 54.840 -0.246 0.000 0.745 308 L CB -0.971 40.877 42.059 -0.351 0.000 0.894 308 L HN 0.460 8.690 8.230 -0.000 0.000 0.432 309 T N -5.241 109.089 114.554 -0.374 0.000 2.833 309 T HA -0.166 4.184 4.350 -0.001 0.000 0.269 309 T C 1.799 176.354 174.700 -0.242 0.000 1.054 309 T CA 1.735 63.593 62.100 -0.403 0.000 1.135 309 T CB -1.047 67.541 68.868 -0.466 0.000 0.869 309 T HN 0.343 8.583 8.240 -0.000 0.000 0.466 310 T N 1.485 115.956 114.554 -0.137 0.000 2.777 310 T HA -0.045 4.305 4.350 -0.001 0.000 0.266 310 T C 1.827 176.464 174.700 -0.104 0.000 1.040 310 T CA 1.446 63.487 62.100 -0.098 0.000 1.141 310 T CB -0.329 68.504 68.868 -0.059 0.000 0.868 310 T HN 0.608 8.848 8.240 -0.000 0.000 0.444 311 E N 0.522 120.673 120.200 -0.081 0.000 2.051 311 E HA -0.122 4.227 4.350 -0.001 0.000 0.192 311 E C 2.171 178.776 176.600 0.009 0.000 0.991 311 E CA 1.079 57.484 56.400 0.009 0.000 0.799 311 E CB -0.208 29.506 29.700 0.023 0.000 0.748 311 E HN 0.480 8.840 8.360 -0.000 0.000 0.449 312 I N 1.038 121.532 120.570 -0.127 0.000 2.163 312 I HA -0.295 3.875 4.170 -0.001 0.000 0.243 312 I C 2.635 178.739 176.117 -0.022 0.000 1.085 312 I CA 1.135 62.352 61.300 -0.138 0.000 1.347 312 I CB -0.382 37.312 38.000 -0.510 0.000 1.044 312 I HN 0.167 8.377 8.210 -0.000 0.000 0.408 313 A N 1.057 123.827 122.820 -0.084 0.000 1.883 313 A HA -0.181 4.138 4.320 -0.001 0.000 0.217 313 A C 2.302 179.871 177.584 -0.026 0.000 1.186 313 A CA 1.570 53.584 52.037 -0.038 0.000 0.624 313 A CB -0.942 18.003 19.000 -0.091 0.000 0.822 313 A HN 0.404 8.554 8.150 -0.000 0.000 0.444 314 L N -1.310 119.861 121.223 -0.086 0.000 2.083 314 L HA -0.185 4.154 4.340 -0.001 0.000 0.209 314 L C 2.569 179.479 176.870 0.067 0.000 1.083 314 L CA 1.431 56.160 54.840 -0.185 0.000 0.752 314 L CB -0.488 41.187 42.059 -0.640 0.000 0.899 314 L HN 0.170 8.400 8.230 -0.000 0.000 0.433 315 K N 0.606 121.148 120.400 0.236 0.000 2.026 315 K HA -0.097 4.223 4.320 -0.001 0.000 0.208 315 K C 2.187 178.889 176.600 0.169 0.000 1.048 315 K CA 1.592 58.051 56.287 0.287 0.000 0.929 315 K CB -0.776 31.864 32.500 0.234 0.000 0.713 315 K HN 0.261 8.511 8.250 -0.000 0.000 0.439 316 A N 0.680 123.587 122.820 0.145 0.000 1.902 316 A HA -0.188 4.131 4.320 -0.001 0.000 0.217 316 A C 2.242 179.824 177.584 -0.003 0.000 1.181 316 A CA 1.822 53.905 52.037 0.076 0.000 0.623 316 A CB -0.459 18.625 19.000 0.140 0.000 0.818 316 A HN 0.305 8.455 8.150 -0.000 0.000 0.443 317 R N -0.766 119.748 120.500 0.023 0.000 2.075 317 R HA -0.107 4.232 4.340 -0.001 0.000 0.232 317 R C 2.056 178.365 176.300 0.015 0.000 1.126 317 R CA 1.581 57.692 56.100 0.018 0.000 0.963 317 R CB -0.417 29.904 30.300 0.034 0.000 0.858 317 R HN 0.431 8.701 8.270 -0.000 0.000 0.435 318 L N 0.711 121.977 121.223 0.073 0.000 2.012 318 L HA -0.175 4.164 4.340 -0.001 0.000 0.210 318 L C 2.380 179.267 176.870 0.029 0.000 1.073 318 L CA 2.276 57.177 54.840 0.101 0.000 0.748 318 L CB -0.827 41.358 42.059 0.210 0.000 0.891 318 L HN 0.178 8.408 8.230 -0.000 0.000 0.431 319 S N -0.776 114.925 115.700 0.001 0.000 2.359 319 S HA -0.255 4.214 4.470 -0.001 0.000 0.223 319 S C 2.135 176.639 174.600 -0.160 0.000 1.039 319 S CA 1.584 59.754 58.200 -0.052 0.000 1.042 319 S CB -0.579 62.580 63.200 -0.069 0.000 0.915 319 S HN 0.667 8.977 8.310 -0.000 0.000 0.439 320 A N 0.960 123.608 122.820 -0.286 0.000 1.969 320 A HA -0.059 4.261 4.320 -0.001 0.000 0.218 320 A C 1.908 179.253 177.584 -0.400 0.000 1.169 320 A CA 1.706 53.429 52.037 -0.524 0.000 0.635 320 A CB -0.726 17.689 19.000 -0.974 0.000 0.810 320 A HN 0.579 8.729 8.150 -0.000 0.000 0.445 321 D N -0.551 119.742 120.400 -0.179 0.000 2.178 321 D HA -0.088 4.552 4.640 -0.001 0.000 0.202 321 D C 2.040 178.352 176.300 0.021 0.000 0.974 321 D CA 1.996 56.008 54.000 0.019 0.000 0.841 321 D CB -0.193 40.660 40.800 0.090 0.000 0.953 321 D HN 0.631 9.001 8.370 -0.000 0.000 0.478 322 T N -4.150 110.406 114.554 0.003 0.000 3.001 322 T HA 0.355 4.704 4.350 -0.001 0.000 0.251 322 T C 1.617 176.334 174.700 0.029 0.000 1.040 322 T CA 0.611 62.727 62.100 0.027 0.000 0.985 322 T CB 0.871 69.761 68.868 0.037 0.000 1.011 322 T HN 0.141 8.381 8.240 -0.000 0.000 0.509 323 G N 1.550 110.358 108.800 0.014 0.000 2.143 323 G HA2 -0.212 3.747 3.960 -0.001 0.000 0.248 323 G HA3 -0.212 3.747 3.960 -0.001 0.000 0.248 323 G C -0.280 174.700 174.900 0.134 0.000 0.991 323 G CA 0.161 45.298 45.100 0.062 0.000 0.689 323 G HN 0.720 9.010 8.290 -0.000 0.000 0.522 324 Q N -0.759 119.107 119.800 0.111 0.000 2.387 324 Q HA 0.677 5.016 4.340 -0.001 0.000 0.273 324 Q C 0.274 176.379 176.000 0.174 0.000 1.089 324 Q CA -1.182 54.694 55.803 0.122 0.000 0.824 324 Q CB 1.985 30.761 28.738 0.063 0.000 1.367 324 Q HN 0.339 8.609 8.270 -0.000 0.000 0.443 325 I N 1.416 122.078 120.570 0.152 0.000 2.648 325 I HA 0.050 4.220 4.170 -0.001 0.000 0.284 325 I C -0.346 175.825 176.117 0.091 0.000 1.153 325 I CA -0.065 61.317 61.300 0.138 0.000 1.426 325 I CB 0.393 38.414 38.000 0.035 0.000 1.381 325 I HN 0.197 8.407 8.210 -0.000 0.000 0.571 326 V N 7.457 127.432 119.914 0.100 0.000 2.540 326 V HA 0.376 4.496 4.120 -0.001 0.000 0.302 326 V C 0.011 176.164 176.094 0.097 0.000 1.035 326 V CA -0.723 61.627 62.300 0.083 0.000 0.873 326 V CB 1.906 33.782 31.823 0.088 0.000 0.992 326 V HN 0.448 8.638 8.190 -0.000 0.000 0.428 327 L N 4.882 126.147 121.223 0.070 0.000 2.349 327 L HA 0.423 4.763 4.340 -0.001 0.000 0.275 327 L C 0.824 177.744 176.870 0.084 0.000 1.115 327 L CA 0.072 54.959 54.840 0.078 0.000 0.820 327 L CB 1.184 43.272 42.059 0.049 0.000 1.135 327 L HN 0.623 8.853 8.230 -0.000 0.000 0.445 328 I N 0.092 120.735 120.570 0.121 0.000 2.512 328 I HA 0.041 4.210 4.170 -0.001 0.000 0.247 328 I C 1.194 177.358 176.117 0.079 0.000 1.094 328 I CA 0.173 61.544 61.300 0.117 0.000 1.427 328 I CB 0.076 38.187 38.000 0.186 0.000 1.149 328 I HN 0.599 8.809 8.210 -0.000 0.000 0.438 329 E N 1.655 121.910 120.200 0.091 0.000 2.408 329 E HA 0.254 4.604 4.350 -0.001 0.000 0.259 329 E C 0.383 177.007 176.600 0.040 0.000 1.110 329 E CA 0.839 57.278 56.400 0.066 0.000 0.929 329 E CB 0.335 30.079 29.700 0.073 0.000 0.971 329 E HN 0.375 8.735 8.360 -0.000 0.000 0.438 330 G N 0.000 108.818 108.800 0.030 0.000 5.446 330 G HA2 0.000 3.959 3.960 -0.001 0.000 0.244 330 G HA3 0.000 3.959 3.960 -0.001 0.000 0.244 330 G CA 0.000 45.110 45.100 0.017 0.000 0.502 330 G HN 0.000 8.290 8.290 -0.000 0.000 0.925