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 3olz_1_A DATA FIRST_RESID 3 DATA SEQUENCE HVIRIGGIFE YADGPNAQVM NAEEHAFRFS ANIINRNRTL LPNTTLTYDI DATA SEQUENCE QRIHFHDSFE ATKKAcDQLA LGVVAIFGPS QGSCTNAVQS ICNALEVPHI DATA SEQUENCE QLRWKHHPLD NKDTFYVNLY PDYASLSHAI LDLVQSLKWR SATVVYDDST DATA SEQUENCE GLIRLQELIM APSRYNIRLK IRQLPIDSDD SRPLLKEMKR GREFRIIFDC DATA SEQUENCE SHTMAAQILK QAMAMGMMTE YYHFIFTTLD LYALDLEPYR YSGVNLTGFR DATA SEQUENCE ILNVDNPHVS AIVEKWSMER LQXXXXXXXX XXXGVMMTDA ALLYDAVHIV DATA SEQUENCE SVCYQRAPQM TVNSLQcHRH KAWRFGGRFM NFIKEAQWEG LTGRIVFNKT DATA SEQUENCE SGLRTDFDLD IISLKEDGLE KVGVWSPADG LNI 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 3 H HA 0.000 4.544 4.556 -0.019 0.000 0.296 3 H C 0.000 175.303 175.328 -0.041 0.000 0.993 3 H CA 0.000 56.037 56.048 -0.019 0.000 1.023 3 H CB 0.000 29.765 29.762 0.004 0.000 1.292 4 V N 6.959 126.622 119.914 -0.419 0.000 2.495 4 V HA 0.412 4.554 4.120 -0.227 -0.159 0.298 4 V C -1.984 173.861 176.094 -0.415 0.000 1.031 4 V CA -1.243 60.867 62.300 -0.318 0.000 0.871 4 V CB 1.834 33.523 31.823 -0.224 0.000 0.988 4 V HN 0.232 8.075 8.190 -0.579 0.000 0.432 5 I N 7.347 127.722 120.570 -0.324 0.000 2.740 5 I HA 0.307 4.283 4.170 -0.324 0.000 0.303 5 I C -2.822 173.149 176.117 -0.244 0.000 1.044 5 I CA -1.883 59.212 61.300 -0.341 0.000 1.064 5 I CB 4.666 42.327 38.000 -0.566 0.000 1.249 5 I HN 0.214 8.259 8.210 -0.275 0.000 0.433 6 R N 6.598 126.986 120.500 -0.186 0.000 2.621 6 R HA 0.710 5.193 4.340 -0.092 -0.199 0.292 6 R C -1.565 174.730 176.300 -0.009 0.000 0.969 6 R CA -1.763 54.280 56.100 -0.096 0.000 0.887 6 R CB 2.933 33.181 30.300 -0.087 0.000 1.180 6 R HN 0.164 8.318 8.270 -0.193 0.000 0.450 7 I N -0.464 120.170 120.570 0.106 0.000 2.846 7 I HA 0.743 5.044 4.170 0.218 0.000 0.307 7 I C -2.227 174.090 176.117 0.334 0.000 1.053 7 I CA -2.829 58.627 61.300 0.260 0.000 1.050 7 I CB 3.777 42.021 38.000 0.407 0.000 1.239 7 I HN 0.172 8.452 8.210 0.115 0.000 0.439 8 G N -0.819 108.194 108.800 0.355 0.000 2.415 8 G HA2 0.668 4.942 3.960 0.253 0.000 0.327 8 G HA3 0.668 4.836 3.960 0.154 -0.115 0.327 8 G C -2.236 172.807 174.900 0.238 0.000 1.182 8 G CA -1.650 43.605 45.100 0.258 0.000 0.924 8 G HN 0.306 8.819 8.290 0.372 0.000 0.470 9 G N 1.417 110.216 108.800 -0.002 0.000 2.566 9 G HA2 0.938 4.573 3.960 -0.542 0.000 0.311 9 G HA3 0.938 4.314 3.960 -0.973 0.000 0.311 9 G C -2.662 171.897 174.900 -0.568 0.000 1.322 9 G CA -1.536 43.226 45.100 -0.564 0.000 0.969 9 G HN 0.249 8.590 8.290 0.086 0.000 0.490 10 I N 3.125 123.226 120.570 -0.782 0.000 2.418 10 I HA 0.665 4.804 4.170 -0.345 -0.175 0.287 10 I C -1.510 174.124 176.117 -0.805 0.000 1.008 10 I CA -1.095 59.876 61.300 -0.549 0.000 1.104 10 I CB 2.195 40.023 38.000 -0.287 0.000 1.264 10 I HN -0.354 7.382 8.210 -0.790 0.000 0.438 11 F N 6.352 126.235 119.950 -0.112 0.000 2.532 11 F HA 0.407 4.817 4.527 -0.195 0.000 0.321 11 F C -1.342 174.311 175.800 -0.245 0.000 1.089 11 F CA -1.624 56.271 58.000 -0.175 0.000 0.926 11 F CB 3.451 42.362 39.000 -0.149 0.000 1.168 11 F HN 0.317 8.620 8.300 0.005 0.000 0.459 12 E N 1.505 121.525 120.200 -0.299 0.000 2.227 12 E HA 0.460 4.709 4.350 -0.505 -0.202 0.282 12 E C -0.740 175.246 176.600 -1.023 0.000 1.015 12 E CA -0.946 55.025 56.400 -0.715 0.000 0.823 12 E CB 2.116 31.190 29.700 -1.043 0.000 1.081 12 E HN 0.517 8.721 8.360 -0.260 0.000 0.396 13 Y N 2.951 122.828 120.300 -0.705 0.000 2.477 13 Y HA 0.083 4.531 4.550 -0.169 0.000 0.347 13 Y C 0.152 175.979 175.900 -0.121 0.000 0.981 13 Y CA -0.971 56.946 58.100 -0.306 0.000 1.033 13 Y CB 3.374 41.741 38.460 -0.155 0.000 1.245 13 Y HN 0.265 8.270 8.280 -0.458 0.000 0.455 14 A N 5.444 128.516 122.820 0.420 0.000 1.948 14 A HA -0.304 4.391 4.320 0.625 0.000 0.220 14 A C 0.079 177.854 177.584 0.318 0.000 1.177 14 A CA 2.552 54.862 52.037 0.456 0.000 0.636 14 A CB -0.570 18.642 19.000 0.352 0.000 0.815 14 A HN 0.453 8.888 8.150 0.474 0.000 0.449 15 D N -4.049 116.468 120.400 0.195 0.000 2.340 15 D HA 0.041 4.791 4.640 0.185 0.000 0.217 15 D C 0.714 176.910 176.300 -0.173 0.000 1.081 15 D CA -0.418 53.638 54.000 0.093 0.000 0.842 15 D CB -0.315 40.514 40.800 0.047 0.000 0.934 15 D HN -0.427 8.052 8.370 0.206 0.015 0.511 16 G N 0.364 108.945 108.800 -0.365 0.000 2.596 16 G HA2 -0.386 3.378 3.960 -0.520 0.000 0.295 16 G HA3 -0.386 2.704 3.960 -1.450 0.000 0.295 16 G C -1.808 172.879 174.900 -0.355 0.000 1.240 16 G CA 0.688 45.366 45.100 -0.704 0.000 0.985 16 G HN -0.433 7.582 8.290 -0.156 0.181 0.555 17 P HA -0.104 4.303 4.420 -0.159 -0.082 0.222 17 P C -0.371 176.834 177.300 -0.159 0.000 1.147 17 P CA 1.735 64.730 63.100 -0.175 0.000 0.790 17 P CB 0.020 31.654 31.700 -0.110 0.000 0.780 18 N N -4.203 114.408 118.700 -0.147 0.000 2.412 18 N HA -0.055 4.635 4.740 -0.084 0.000 0.184 18 N C 0.109 175.544 175.510 -0.124 0.000 1.101 18 N CA 0.423 53.415 53.050 -0.097 0.000 0.881 18 N CB 0.596 39.063 38.487 -0.034 0.000 0.969 18 N HN -0.676 7.556 8.380 -0.168 0.048 0.459 19 A N -0.069 122.631 122.820 -0.200 0.000 2.567 19 A HA -0.170 4.066 4.320 -0.140 0.000 0.240 19 A C -1.012 176.418 177.584 -0.256 0.000 1.053 19 A CA 0.895 52.782 52.037 -0.249 0.000 0.755 19 A CB 0.615 19.312 19.000 -0.504 0.000 0.978 19 A HN -0.722 7.246 8.150 -0.232 0.043 0.507 20 Q N 3.253 122.955 119.800 -0.162 0.000 2.391 20 Q HA 0.039 4.295 4.340 -0.139 0.000 0.243 20 Q C 0.047 175.978 176.000 -0.115 0.000 0.874 20 Q CA 1.019 56.747 55.803 -0.125 0.000 0.950 20 Q CB 0.785 29.480 28.738 -0.072 0.000 1.103 20 Q HN 0.484 8.684 8.270 -0.118 0.000 0.544 21 V N 0.883 120.743 119.914 -0.091 0.000 2.407 21 V HA 0.097 4.183 4.120 -0.056 0.000 0.278 21 V C -0.759 175.329 176.094 -0.009 0.000 1.037 21 V CA -0.879 61.394 62.300 -0.045 0.000 0.900 21 V CB 0.579 32.401 31.823 -0.002 0.000 0.983 21 V HN -0.351 7.792 8.190 -0.079 0.000 0.459 22 M N 9.454 129.052 119.600 -0.004 0.000 2.219 22 M HA 0.009 4.567 4.480 0.132 0.000 0.353 22 M C -0.577 175.837 176.300 0.190 0.000 1.304 22 M CA 0.154 55.511 55.300 0.094 0.000 1.115 22 M CB 1.138 33.740 32.600 0.004 0.000 1.664 22 M HN 0.197 8.464 8.290 -0.039 0.000 0.459 23 N N 6.164 125.067 118.700 0.339 0.000 2.408 23 N HA 0.024 4.858 4.740 0.157 0.000 0.260 23 N C 0.224 175.812 175.510 0.130 0.000 1.242 23 N CA -0.623 52.518 53.050 0.152 0.000 0.959 23 N CB 0.611 39.064 38.487 -0.056 0.000 1.201 23 N HN -0.135 8.591 8.380 0.576 0.000 0.511 24 A N -2.068 120.850 122.820 0.163 0.000 1.969 24 A HA -0.185 4.393 4.320 0.430 0.000 0.218 24 A C 2.300 180.022 177.584 0.230 0.000 1.169 24 A CA 2.958 55.177 52.037 0.304 0.000 0.635 24 A CB -0.138 19.054 19.000 0.319 0.000 0.810 24 A HN 0.495 8.729 8.150 0.141 0.000 0.445 25 E N -0.802 119.445 120.200 0.078 0.000 2.007 25 E HA -0.429 3.981 4.350 0.100 0.000 0.194 25 E C 2.067 178.576 176.600 -0.152 0.000 0.999 25 E CA 3.692 60.117 56.400 0.042 0.000 0.811 25 E CB -0.517 29.253 29.700 0.115 0.000 0.762 25 E HN -0.418 8.065 8.360 0.050 -0.093 0.450 26 E N -0.770 119.071 120.200 -0.599 0.000 2.118 26 E HA -0.429 2.860 4.350 -1.767 0.000 0.195 26 E C 1.943 178.454 176.600 -0.148 0.000 0.992 26 E CA 2.990 58.809 56.400 -0.968 0.000 0.804 26 E CB -0.028 29.176 29.700 -0.826 0.000 0.741 26 E HN -0.346 7.997 8.360 -0.539 -0.307 0.458 27 H N 0.588 119.648 119.070 -0.018 0.000 2.326 27 H HA -0.223 4.392 4.556 0.099 0.000 0.301 27 H C 1.599 177.141 175.328 0.356 0.000 1.081 27 H CA 2.550 58.689 56.048 0.152 0.000 1.334 27 H CB 0.564 30.410 29.762 0.140 0.000 1.385 27 H HN -0.321 8.062 8.280 0.184 0.008 0.504 28 A N -0.866 122.137 122.820 0.305 0.000 1.948 28 A HA -0.382 4.090 4.320 0.253 0.000 0.220 28 A C 1.749 179.508 177.584 0.291 0.000 1.177 28 A CA 3.077 55.237 52.037 0.204 0.000 0.636 28 A CB -1.134 17.833 19.000 -0.055 0.000 0.815 28 A HN 0.053 8.404 8.150 0.335 0.000 0.449 29 F N 0.237 120.203 119.950 0.027 0.000 2.026 29 F HA -0.361 4.129 4.527 -0.061 0.000 0.296 29 F C 1.825 177.559 175.800 -0.110 0.000 1.133 29 F CA 3.281 61.241 58.000 -0.066 0.000 1.188 29 F CB -0.057 38.886 39.000 -0.094 0.000 0.968 29 F HN -0.348 8.117 8.300 0.284 0.005 0.476 30 R N -2.339 118.129 120.500 -0.054 0.000 2.105 30 R HA -0.477 3.591 4.340 -0.454 0.000 0.239 30 R C 2.601 178.958 176.300 0.095 0.000 1.135 30 R CA 3.396 59.421 56.100 -0.125 0.000 0.967 30 R CB -0.331 30.010 30.300 0.068 0.000 0.861 30 R HN -0.547 7.775 8.270 0.088 0.000 0.442 31 F N 1.181 121.157 119.950 0.042 0.000 2.095 31 F HA -0.350 4.248 4.527 0.118 0.000 0.298 31 F C 1.168 177.048 175.800 0.133 0.000 1.104 31 F CA 3.405 61.467 58.000 0.104 0.000 1.232 31 F CB 0.267 39.347 39.000 0.134 0.000 0.987 31 F HN 0.264 8.762 8.300 0.348 0.011 0.475 32 S N -0.307 115.471 115.700 0.130 0.000 2.387 32 S HA -0.356 4.090 4.470 -0.040 0.000 0.226 32 S C 2.059 176.514 174.600 -0.243 0.000 1.026 32 S CA 3.003 61.166 58.200 -0.062 0.000 0.972 32 S CB -0.990 62.157 63.200 -0.088 0.000 0.814 32 S HN -0.167 8.280 8.310 0.228 0.000 0.477 33 A N 2.920 125.591 122.820 -0.249 0.000 1.908 33 A HA -0.411 3.754 4.320 -0.259 0.000 0.218 33 A C 1.799 179.314 177.584 -0.114 0.000 1.181 33 A CA 3.179 55.099 52.037 -0.195 0.000 0.627 33 A CB -0.624 18.347 19.000 -0.049 0.000 0.818 33 A HN -0.432 7.553 8.150 -0.275 0.000 0.445 34 N N -2.328 116.331 118.700 -0.068 0.000 2.166 34 N HA -0.271 4.448 4.740 -0.036 0.000 0.186 34 N C 2.209 177.657 175.510 -0.105 0.000 1.019 34 N CA 2.881 55.895 53.050 -0.060 0.000 0.856 34 N CB -0.335 38.140 38.487 -0.020 0.000 0.993 34 N HN -0.664 7.686 8.380 -0.050 0.000 0.426 35 I N 0.245 120.715 120.570 -0.167 0.000 2.252 35 I HA -0.458 3.658 4.170 -0.089 0.000 0.245 35 I C 1.565 177.648 176.117 -0.057 0.000 1.102 35 I CA 3.801 65.037 61.300 -0.107 0.000 1.385 35 I CB 0.003 37.958 38.000 -0.076 0.000 1.064 35 I HN -0.735 7.345 8.210 -0.217 0.000 0.414 36 I N -1.527 118.956 120.570 -0.144 0.000 2.361 36 I HA -0.442 3.656 4.170 -0.120 0.000 0.251 36 I C 1.861 177.920 176.117 -0.096 0.000 1.133 36 I CA 3.745 64.944 61.300 -0.168 0.000 1.413 36 I CB -0.312 37.486 38.000 -0.337 0.000 1.073 36 I HN -0.304 7.781 8.210 -0.207 0.000 0.424 37 N N -3.992 114.654 118.700 -0.090 0.000 2.494 37 N HA -0.072 4.632 4.740 -0.060 0.000 0.182 37 N C 0.372 175.862 175.510 -0.033 0.000 1.076 37 N CA 1.374 54.387 53.050 -0.062 0.000 0.908 37 N CB 0.064 38.511 38.487 -0.067 0.000 0.967 37 N HN -0.547 7.669 8.380 -0.103 0.102 0.449 38 R N -3.656 116.830 120.500 -0.024 0.000 2.362 38 R HA 0.065 4.404 4.340 -0.002 0.000 0.227 38 R C -0.589 175.722 176.300 0.018 0.000 0.905 38 R CA -0.394 55.706 56.100 -0.001 0.000 1.067 38 R CB 0.830 31.131 30.300 0.002 0.000 1.078 38 R HN -0.720 7.381 8.270 -0.031 0.150 0.516 39 N N 0.821 119.533 118.700 0.019 0.000 2.422 39 N HA -0.006 4.768 4.740 0.057 0.000 0.264 39 N C -0.090 175.439 175.510 0.032 0.000 1.063 39 N CA -0.155 52.921 53.050 0.044 0.000 0.959 39 N CB 1.223 39.749 38.487 0.066 0.000 1.087 39 N HN -0.614 7.599 8.380 0.003 0.168 0.483 40 R N 6.157 126.679 120.500 0.036 0.000 2.275 40 R HA 0.038 4.392 4.340 0.022 0.000 0.199 40 R C 0.923 177.242 176.300 0.031 0.000 0.989 40 R CA 1.780 57.897 56.100 0.028 0.000 1.016 40 R CB 0.040 30.356 30.300 0.027 0.000 0.918 40 R HN 0.625 8.921 8.270 0.043 0.000 0.473 41 T N -0.293 114.286 114.554 0.042 0.000 3.037 41 T HA -0.073 4.300 4.350 0.038 0.000 0.251 41 T C -0.971 173.761 174.700 0.053 0.000 1.079 41 T CA 1.896 64.024 62.100 0.046 0.000 1.067 41 T CB 0.986 69.885 68.868 0.053 0.000 0.948 41 T HN -0.254 8.267 8.240 0.049 -0.251 0.496 42 L N 1.290 122.544 121.223 0.052 0.000 2.343 42 L HA 0.121 4.493 4.340 0.054 0.000 0.278 42 L C -1.073 175.809 176.870 0.020 0.000 0.996 42 L CA -0.930 53.938 54.840 0.046 0.000 0.831 42 L CB 1.579 43.675 42.059 0.060 0.000 1.232 42 L HN -0.737 7.661 8.230 0.047 -0.139 0.413 43 L N 2.354 123.596 121.223 0.032 0.000 3.795 43 L HA -0.305 4.073 4.340 0.064 0.000 0.489 43 L C -0.798 176.086 176.870 0.024 0.000 1.259 43 L CA 0.026 54.890 54.840 0.040 0.000 0.765 43 L CB -2.077 39.996 42.059 0.024 0.000 1.519 43 L HN 0.541 9.127 8.230 0.043 -0.330 0.842 44 P HA -0.060 4.369 4.420 0.014 0.000 0.218 44 P C 0.403 177.713 177.300 0.016 0.000 1.148 44 P CA 1.771 64.881 63.100 0.017 0.000 0.822 44 P CB 0.140 31.850 31.700 0.017 0.000 0.784 45 N N -3.284 115.431 118.700 0.025 0.000 2.187 45 N HA 0.153 4.906 4.740 0.022 0.000 0.212 45 N C -1.294 174.250 175.510 0.057 0.000 1.152 45 N CA -0.271 52.797 53.050 0.030 0.000 0.872 45 N CB 1.217 39.715 38.487 0.020 0.000 1.025 45 N HN 0.187 8.560 8.380 0.030 0.025 0.514 46 T N 1.914 116.503 114.554 0.058 0.000 2.824 46 T HA 0.269 4.861 4.350 0.106 -0.178 0.282 46 T C -1.153 173.541 174.700 -0.009 0.000 0.993 46 T CA -0.565 61.579 62.100 0.073 0.000 0.967 46 T CB 2.641 71.589 68.868 0.134 0.000 0.960 46 T HN -0.725 7.541 8.240 0.044 0.000 0.441 47 T N 8.132 122.657 114.554 -0.048 0.000 2.733 47 T HA 0.111 4.544 4.350 -0.081 -0.132 0.294 47 T C -1.367 173.248 174.700 -0.141 0.000 0.956 47 T CA 0.383 62.428 62.100 -0.091 0.000 0.987 47 T CB 1.130 69.942 68.868 -0.094 0.000 0.920 47 T HN 0.571 8.784 8.240 -0.045 0.000 0.470 48 L N 10.252 131.387 121.223 -0.147 0.000 2.325 48 L HA 0.133 4.480 4.340 -0.194 -0.124 0.284 48 L C -1.331 175.426 176.870 -0.188 0.000 1.089 48 L CA -0.493 54.244 54.840 -0.172 0.000 0.836 48 L CB -0.030 41.929 42.059 -0.167 0.000 1.184 48 L HN -0.006 8.439 8.230 -0.130 -0.293 0.444 49 T N 4.908 119.334 114.554 -0.212 0.000 2.938 49 T HA 0.283 4.331 4.350 -0.504 0.000 0.285 49 T C -1.826 172.750 174.700 -0.206 0.000 1.028 49 T CA -2.021 59.877 62.100 -0.337 0.000 1.005 49 T CB 2.302 70.994 68.868 -0.294 0.000 1.157 49 T HN 0.397 8.520 8.240 -0.194 0.000 0.550 50 Y N -5.082 115.198 120.300 -0.033 0.000 2.615 50 Y HA 0.870 5.642 4.550 0.062 -0.185 0.341 50 Y C -1.781 174.176 175.900 0.095 0.000 1.089 50 Y CA -2.332 55.804 58.100 0.060 0.000 1.049 50 Y CB 2.874 41.411 38.460 0.128 0.000 1.296 50 Y HN -0.114 7.685 8.280 -0.801 0.000 0.470 51 D N 0.561 121.179 120.400 0.362 0.000 2.408 51 D HA 0.375 5.163 4.640 0.248 0.000 0.243 51 D C -1.883 174.605 176.300 0.313 0.000 1.075 51 D CA -0.935 53.224 54.000 0.264 0.000 0.832 51 D CB 3.026 43.902 40.800 0.127 0.000 1.162 51 D HN 0.326 8.915 8.370 0.365 0.000 0.515 52 I N 4.248 125.008 120.570 0.317 0.000 2.354 52 I HA 0.189 4.679 4.170 0.274 -0.156 0.292 52 I C -0.689 175.533 176.117 0.174 0.000 0.989 52 I CA -0.842 60.629 61.300 0.285 0.000 1.188 52 I CB 1.587 39.789 38.000 0.338 0.000 1.342 52 I HN 0.158 8.555 8.210 0.311 0.000 0.457 53 Q N 7.067 126.941 119.800 0.122 0.000 2.333 53 Q HA 0.365 4.739 4.340 0.057 0.000 0.267 53 Q C -1.737 174.320 176.000 0.095 0.000 1.012 53 Q CA -2.294 53.547 55.803 0.063 0.000 0.824 53 Q CB 2.832 31.567 28.738 -0.005 0.000 1.290 53 Q HN 0.356 8.681 8.270 0.092 0.000 0.449 54 R N 2.876 123.413 120.500 0.062 0.000 2.346 54 R HA 0.682 5.313 4.340 0.212 -0.163 0.311 54 R C -0.542 175.741 176.300 -0.028 0.000 0.983 54 R CA -0.617 55.531 56.100 0.080 0.000 0.880 54 R CB 1.475 31.747 30.300 -0.047 0.000 1.100 54 R HN 0.415 8.699 8.270 0.023 0.000 0.453 55 I N -4.627 115.919 120.570 -0.040 0.000 2.994 55 I HA 0.504 4.579 4.170 -0.159 0.000 0.306 55 I C -1.689 174.313 176.117 -0.191 0.000 1.195 55 I CA -2.284 58.941 61.300 -0.125 0.000 1.001 55 I CB 4.077 42.031 38.000 -0.078 0.000 1.244 55 I HN -0.151 8.069 8.210 0.017 0.000 0.437 56 H N 0.926 119.973 119.070 -0.039 0.000 2.836 56 H HA 0.148 4.877 4.556 -0.025 -0.188 0.368 56 H C 0.891 176.166 175.328 -0.088 0.000 1.164 56 H CA 1.449 57.483 56.048 -0.023 0.000 1.425 56 H CB 0.745 30.547 29.762 0.066 0.000 1.414 56 H HN -0.372 8.058 8.280 -0.049 -0.180 0.614 57 F N -0.858 119.191 119.950 0.166 0.000 2.518 57 F HA -0.316 4.333 4.527 -0.083 -0.172 0.359 57 F C 0.974 176.810 175.800 0.059 0.000 1.118 57 F CA 1.606 59.606 58.000 -0.001 0.000 1.287 57 F CB 0.394 39.376 39.000 -0.030 0.000 1.132 57 F HN 0.239 8.747 8.300 0.346 0.000 0.587 58 H N -1.630 117.602 119.070 0.271 0.000 2.770 58 H HA -0.384 4.254 4.556 0.137 0.000 0.309 58 H C -1.315 174.091 175.328 0.130 0.000 1.206 58 H CA 1.499 57.646 56.048 0.165 0.000 1.147 58 H CB -2.251 27.596 29.762 0.142 0.000 1.422 58 H HN 0.547 8.956 8.280 -0.123 -0.202 0.420 59 D N -0.539 119.971 120.400 0.182 0.000 2.434 59 D HA 0.297 5.041 4.640 0.174 0.000 0.275 59 D C -0.468 175.905 176.300 0.121 0.000 1.172 59 D CA -1.116 52.979 54.000 0.159 0.000 0.916 59 D CB 0.566 41.463 40.800 0.162 0.000 1.041 59 D HN -0.550 7.900 8.370 0.133 0.000 0.501 60 S N 5.555 121.335 115.700 0.132 0.000 2.359 60 S HA -0.360 4.153 4.470 0.071 0.000 0.224 60 S C 1.245 175.937 174.600 0.153 0.000 1.035 60 S CA 3.573 61.839 58.200 0.109 0.000 1.018 60 S CB -0.077 63.183 63.200 0.100 0.000 0.876 60 S HN 0.332 8.728 8.310 0.143 0.000 0.448 61 F N 0.950 120.910 119.950 0.017 0.000 2.065 61 F HA -0.381 4.148 4.527 0.004 0.000 0.298 61 F C 1.372 177.178 175.800 0.010 0.000 1.112 61 F CA 1.891 59.898 58.000 0.012 0.000 1.212 61 F CB -0.374 38.636 39.000 0.017 0.000 0.975 61 F HN -0.028 8.466 8.300 0.324 0.000 0.476 62 E N -0.952 119.195 120.200 -0.089 0.000 2.077 62 E HA -0.486 3.641 4.350 -0.371 0.000 0.193 62 E C 2.121 178.639 176.600 -0.137 0.000 0.989 62 E CA 3.003 59.285 56.400 -0.197 0.000 0.800 62 E CB -0.110 29.562 29.700 -0.047 0.000 0.746 62 E HN -0.564 8.112 8.360 0.075 -0.271 0.452 63 A N -1.714 121.070 122.820 -0.060 0.000 1.972 63 A HA -0.237 4.033 4.320 -0.084 0.000 0.219 63 A C 2.206 179.742 177.584 -0.080 0.000 1.169 63 A CA 3.150 55.147 52.037 -0.068 0.000 0.635 63 A CB -0.840 18.134 19.000 -0.042 0.000 0.810 63 A HN -0.195 7.868 8.150 -0.014 0.078 0.446 64 T N 0.901 115.423 114.554 -0.054 0.000 2.770 64 T HA -0.430 3.890 4.350 -0.049 0.000 0.263 64 T C 2.010 176.659 174.700 -0.085 0.000 1.039 64 T CA 5.083 67.159 62.100 -0.040 0.000 1.142 64 T CB -0.090 68.812 68.868 0.058 0.000 0.868 64 T HN -0.041 8.067 8.240 -0.025 0.116 0.435 65 K N 0.743 121.041 120.400 -0.170 0.000 2.074 65 K HA -0.405 3.829 4.320 -0.144 0.000 0.209 65 K C 2.392 178.917 176.600 -0.126 0.000 1.048 65 K CA 3.899 60.072 56.287 -0.190 0.000 0.926 65 K CB -0.237 32.056 32.500 -0.345 0.000 0.713 65 K HN -0.164 7.942 8.250 -0.241 0.000 0.444 66 K N -2.471 117.855 120.400 -0.122 0.000 2.167 66 K HA -0.040 4.376 4.320 -0.083 -0.146 0.203 66 K C 2.170 178.719 176.600 -0.085 0.000 1.052 66 K CA 1.282 57.513 56.287 -0.093 0.000 0.956 66 K CB -0.477 31.970 32.500 -0.088 0.000 0.735 66 K HN -0.465 7.705 8.250 -0.133 0.000 0.451 67 A N 0.144 122.906 122.820 -0.097 0.000 1.972 67 A HA -0.173 4.085 4.320 -0.103 0.000 0.219 67 A C 2.080 179.610 177.584 -0.089 0.000 1.169 67 A CA 2.987 54.962 52.037 -0.103 0.000 0.635 67 A CB -0.910 18.014 19.000 -0.127 0.000 0.810 67 A HN -0.321 7.768 8.150 -0.102 0.000 0.446 68 c N -2.314 116.240 118.600 -0.077 0.000 2.466 68 c HA -0.128 4.396 4.570 -0.078 0.000 0.278 68 c C 2.152 176.205 174.090 -0.061 0.000 1.288 68 c CA 3.092 59.380 56.329 -0.068 0.000 1.722 68 c CB -2.085 40.398 42.510 -0.044 0.000 2.017 68 c HN -0.295 7.876 8.230 -0.077 0.014 0.488 69 D N 0.352 120.720 120.400 -0.054 0.000 2.106 69 D HA -0.346 4.274 4.640 -0.034 0.000 0.191 69 D C 2.598 178.871 176.300 -0.046 0.000 0.997 69 D CA 3.825 57.799 54.000 -0.043 0.000 0.834 69 D CB -0.652 40.123 40.800 -0.042 0.000 0.956 69 D HN -0.384 7.951 8.370 -0.058 0.000 0.448 70 Q N -1.511 118.259 119.800 -0.049 0.000 2.167 70 Q HA -0.300 4.021 4.340 -0.031 0.000 0.202 70 Q C 2.681 178.639 176.000 -0.070 0.000 0.970 70 Q CA 2.840 58.616 55.803 -0.044 0.000 0.855 70 Q CB 0.060 28.779 28.738 -0.032 0.000 0.911 70 Q HN -0.522 7.715 8.270 -0.054 0.000 0.438 71 L N -1.130 120.041 121.223 -0.086 0.000 2.093 71 L HA -0.347 3.910 4.340 -0.138 0.000 0.208 71 L C 2.097 178.900 176.870 -0.111 0.000 1.085 71 L CA 2.760 57.531 54.840 -0.115 0.000 0.755 71 L CB -0.486 41.505 42.059 -0.113 0.000 0.904 71 L HN -0.518 7.564 8.230 -0.082 0.099 0.435 72 A N -0.446 122.323 122.820 -0.085 0.000 1.968 72 A HA -0.064 4.394 4.320 -0.078 -0.184 0.217 72 A C 1.449 178.996 177.584 -0.062 0.000 1.169 72 A CA 2.418 54.413 52.037 -0.070 0.000 0.638 72 A CB -0.217 18.756 19.000 -0.046 0.000 0.812 72 A HN -0.232 7.786 8.150 -0.076 0.087 0.446 73 L N -3.491 117.696 121.223 -0.061 0.000 2.291 73 L HA -0.144 4.168 4.340 -0.047 0.000 0.214 73 L C -0.714 176.109 176.870 -0.078 0.000 1.120 73 L CA 0.405 55.211 54.840 -0.056 0.000 0.799 73 L CB 0.910 42.944 42.059 -0.041 0.000 0.925 73 L HN -0.626 7.460 8.230 -0.060 0.108 0.446 74 G N -3.334 105.400 108.800 -0.110 0.000 3.439 74 G HA2 -0.316 3.657 3.960 -0.213 0.000 0.684 74 G HA3 -0.316 3.557 3.960 -0.145 0.000 0.684 74 G C -2.574 172.222 174.900 -0.173 0.000 1.005 74 G CA -0.216 44.785 45.100 -0.164 0.000 0.837 74 G HN -0.729 7.339 8.290 -0.112 0.155 0.470 75 V N -1.361 118.408 119.914 -0.241 0.000 3.114 75 V HA 0.774 4.947 4.120 -0.140 -0.137 0.308 75 V C -1.163 174.740 176.094 -0.318 0.000 1.168 75 V CA -2.949 59.241 62.300 -0.184 0.000 1.015 75 V CB 3.969 35.753 31.823 -0.066 0.000 1.050 75 V HN -0.108 7.896 8.190 -0.311 0.000 0.433 76 V N -6.515 113.309 119.914 -0.150 0.000 3.506 76 V HA 0.168 4.066 4.120 -0.369 0.000 0.263 76 V C -0.881 175.360 176.094 0.246 0.000 1.203 76 V CA -0.293 61.985 62.300 -0.036 0.000 1.133 76 V CB 0.494 32.406 31.823 0.148 0.000 0.802 76 V HN -0.051 8.106 8.190 -0.054 0.000 0.459 77 A N -2.306 120.607 122.820 0.154 0.000 2.597 77 A HA 0.251 4.772 4.320 0.101 -0.140 0.292 77 A C -2.663 174.973 177.584 0.087 0.000 1.057 77 A CA -0.361 51.741 52.037 0.109 0.000 0.674 77 A CB 2.918 21.940 19.000 0.036 0.000 1.278 77 A HN -0.856 7.364 8.150 0.116 0.000 0.416 78 I N -1.034 119.528 120.570 -0.013 0.000 2.439 78 I HA 0.427 4.879 4.170 0.163 -0.184 0.285 78 I C -1.291 174.825 176.117 -0.003 0.000 1.021 78 I CA -1.183 60.145 61.300 0.048 0.000 1.091 78 I CB 2.965 40.947 38.000 -0.030 0.000 1.242 78 I HN 0.023 8.203 8.210 -0.051 0.000 0.439 79 F N 6.872 126.828 119.950 0.010 0.000 2.566 79 F HA 0.281 4.969 4.527 0.055 -0.128 0.349 79 F C 0.637 176.347 175.800 -0.150 0.000 1.245 79 F CA -0.916 57.061 58.000 -0.038 0.000 1.169 79 F CB -1.172 37.779 39.000 -0.082 0.000 1.470 79 F HN 0.639 9.274 8.300 0.559 0.000 0.634 80 G N 2.836 111.731 108.800 0.158 0.000 2.732 80 G HA2 -0.076 3.897 3.960 0.021 0.000 0.244 80 G HA3 -0.076 4.255 3.960 0.618 0.000 0.244 80 G C -2.054 172.831 174.900 -0.024 0.000 1.226 80 G CA -1.108 44.099 45.100 0.178 0.000 0.860 80 G HN -0.366 8.073 8.290 0.249 0.000 0.583 81 P HA -0.005 4.489 4.420 -0.198 -0.193 0.269 81 P C 0.052 177.325 177.300 -0.044 0.000 1.215 81 P CA -0.573 62.458 63.100 -0.115 0.000 0.780 81 P CB 0.837 32.477 31.700 -0.099 0.000 0.898 82 S N -2.144 113.539 115.700 -0.029 0.000 2.522 82 S HA -0.180 4.310 4.470 0.033 0.000 0.227 82 S C 0.767 175.391 174.600 0.040 0.000 0.986 82 S CA 1.346 59.565 58.200 0.032 0.000 0.929 82 S CB -0.354 62.896 63.200 0.084 0.000 0.769 82 S HN 0.079 8.412 8.310 -0.051 -0.053 0.529 83 Q N 1.481 121.293 119.800 0.021 0.000 2.316 83 Q HA 0.051 4.411 4.340 0.034 0.000 0.215 83 Q C 1.564 177.566 176.000 0.003 0.000 1.020 83 Q CA -0.384 55.428 55.803 0.014 0.000 0.970 83 Q CB 0.870 29.573 28.738 -0.058 0.000 1.187 83 Q HN -0.426 7.998 8.270 0.000 -0.154 0.546 84 G N -1.883 106.932 108.800 0.025 0.000 2.539 84 G HA2 0.004 3.911 3.960 -0.088 0.000 0.215 84 G HA3 0.004 3.954 3.960 -0.017 0.000 0.215 84 G C 0.738 175.627 174.900 -0.017 0.000 1.141 84 G CA 1.141 46.225 45.100 -0.027 0.000 0.806 84 G HN 0.393 8.723 8.290 0.065 0.000 0.533 85 S N 0.085 115.823 115.700 0.063 0.000 2.406 85 S HA -0.144 4.347 4.470 0.035 0.000 0.224 85 S C 1.045 175.673 174.600 0.048 0.000 1.030 85 S CA 2.464 60.707 58.200 0.072 0.000 0.958 85 S CB 0.064 63.362 63.200 0.164 0.000 0.811 85 S HN -0.116 8.262 8.310 0.114 0.000 0.489 86 C N -1.174 118.155 119.300 0.048 0.000 2.446 86 C HA -0.141 4.339 4.460 0.033 0.000 0.279 86 C C 1.424 176.412 174.990 -0.004 0.000 1.366 86 C CA 2.607 61.638 59.018 0.021 0.000 1.763 86 C CB -0.020 27.721 27.740 0.001 0.000 1.929 86 C HN 0.070 8.333 8.230 0.054 0.000 0.509 87 T N -0.216 114.335 114.554 -0.005 0.000 3.014 87 T HA -0.215 4.177 4.350 0.069 0.000 0.263 87 T C 0.904 175.615 174.700 0.018 0.000 1.078 87 T CA 3.053 65.172 62.100 0.032 0.000 1.135 87 T CB -0.345 68.523 68.868 -0.000 0.000 0.895 87 T HN -0.272 7.933 8.240 -0.011 0.028 0.480 88 N N -0.531 118.139 118.700 -0.051 0.000 2.449 88 N HA -0.040 4.638 4.740 -0.103 0.000 0.191 88 N C 0.109 175.588 175.510 -0.051 0.000 1.161 88 N CA 0.827 53.827 53.050 -0.082 0.000 0.863 88 N CB -0.406 38.011 38.487 -0.117 0.000 0.980 88 N HN -0.383 7.966 8.380 -0.052 0.000 0.458 89 A N -1.226 121.571 122.820 -0.038 0.000 1.963 89 A HA 0.183 4.486 4.320 -0.028 0.000 0.207 89 A C 1.047 178.585 177.584 -0.078 0.000 1.243 89 A CA 1.782 53.798 52.037 -0.036 0.000 0.728 89 A CB 1.132 20.128 19.000 -0.007 0.000 0.895 89 A HN -0.766 7.295 8.150 -0.033 0.069 0.467 90 V N -0.041 119.793 119.914 -0.133 0.000 2.626 90 V HA -0.554 3.430 4.120 -0.227 0.000 0.252 90 V C 1.295 177.159 176.094 -0.384 0.000 1.067 90 V CA 4.097 66.224 62.300 -0.288 0.000 1.081 90 V CB -0.172 31.405 31.823 -0.411 0.000 0.686 90 V HN -0.715 7.410 8.190 -0.108 0.000 0.468 91 Q N -0.153 119.531 119.800 -0.193 0.000 2.084 91 Q HA -0.351 4.122 4.340 0.221 0.000 0.202 91 Q C 2.164 178.175 176.000 0.018 0.000 0.978 91 Q CA 3.548 59.381 55.803 0.051 0.000 0.844 91 Q CB -0.234 28.541 28.738 0.062 0.000 0.898 91 Q HN -0.404 7.791 8.270 -0.095 0.019 0.426 92 S N -0.919 114.769 115.700 -0.021 0.000 2.356 92 S HA -0.259 4.407 4.470 0.024 -0.182 0.223 92 S C 2.199 176.785 174.600 -0.023 0.000 1.032 92 S CA 2.774 60.971 58.200 -0.005 0.000 1.005 92 S CB -0.333 62.860 63.200 -0.013 0.000 0.867 92 S HN -0.308 7.978 8.310 -0.040 0.000 0.449 93 I N 1.942 122.476 120.570 -0.061 0.000 2.226 93 I HA -0.487 3.648 4.170 -0.058 0.000 0.245 93 I C 1.543 177.607 176.117 -0.088 0.000 1.100 93 I CA 3.982 65.237 61.300 -0.075 0.000 1.374 93 I CB -0.031 37.912 38.000 -0.095 0.000 1.057 93 I HN -0.717 7.446 8.210 -0.077 0.000 0.413 94 C N -2.922 116.322 119.300 -0.094 0.000 2.419 94 C HA -0.388 4.023 4.460 -0.081 0.000 0.281 94 C C 1.592 176.534 174.990 -0.081 0.000 1.336 94 C CA 5.097 64.080 59.018 -0.059 0.000 1.770 94 C CB -0.663 27.084 27.740 0.011 0.000 1.929 94 C HN 0.050 8.207 8.230 -0.121 0.000 0.509 95 N N -0.893 117.798 118.700 -0.015 0.000 2.250 95 N HA -0.185 4.536 4.740 -0.032 0.000 0.181 95 N C 1.068 176.484 175.510 -0.156 0.000 1.017 95 N CA 2.622 55.661 53.050 -0.017 0.000 0.866 95 N CB -0.016 38.557 38.487 0.142 0.000 0.985 95 N HN -0.744 7.505 8.380 0.013 0.139 0.429 96 A N -1.061 121.699 122.820 -0.100 0.000 1.855 96 A HA -0.195 4.085 4.320 -0.067 0.000 0.215 96 A C 1.207 178.711 177.584 -0.134 0.000 1.191 96 A CA 2.577 54.561 52.037 -0.088 0.000 0.613 96 A CB 0.109 19.081 19.000 -0.048 0.000 0.829 96 A HN -0.444 7.664 8.150 -0.069 0.000 0.442 97 L N -4.708 116.428 121.223 -0.144 0.000 2.591 97 L HA 0.037 4.334 4.340 -0.070 0.000 0.228 97 L C -0.621 176.160 176.870 -0.149 0.000 1.133 97 L CA -0.059 54.717 54.840 -0.107 0.000 0.880 97 L CB 0.295 42.308 42.059 -0.076 0.000 1.033 97 L HN -0.484 7.665 8.230 -0.136 0.000 0.450 98 E N -4.658 115.270 120.200 -0.453 0.000 2.416 98 E HA -0.460 2.597 4.350 -2.242 -0.052 0.249 98 E C -1.854 174.684 176.600 -0.103 0.000 1.124 98 E CA 0.864 56.691 56.400 -0.955 0.000 0.732 98 E CB -2.809 26.532 29.700 -0.599 0.000 1.286 98 E HN -0.399 7.611 8.360 -0.508 0.045 0.394 99 V N -1.685 118.269 119.914 0.067 0.000 2.459 99 V HA 0.347 4.877 4.120 0.683 0.000 0.295 99 V C -2.899 173.413 176.094 0.363 0.000 1.029 99 V CA -4.293 58.217 62.300 0.350 0.000 0.874 99 V CB 2.098 33.966 31.823 0.075 0.000 0.985 99 V HN -0.909 7.244 8.190 -0.061 0.000 0.438 100 P HA -0.047 4.598 4.420 0.374 0.000 0.262 100 P C -1.895 175.508 177.300 0.171 0.000 1.182 100 P CA 0.477 63.748 63.100 0.286 0.000 0.761 100 P CB 0.484 32.234 31.700 0.082 0.000 0.795 101 H N 5.415 124.520 119.070 0.057 0.000 2.467 101 H HA 0.512 5.178 4.556 -0.082 -0.159 0.326 101 H C -1.013 174.259 175.328 -0.092 0.000 1.094 101 H CA -2.213 53.822 56.048 -0.022 0.000 1.253 101 H CB 2.882 32.676 29.762 0.054 0.000 1.439 101 H HN -0.155 8.314 8.280 0.315 0.000 0.479 102 I N 6.429 126.874 120.570 -0.208 0.000 2.378 102 I HA 0.301 4.312 4.170 -0.264 0.000 0.291 102 I C -1.504 174.451 176.117 -0.269 0.000 0.992 102 I CA -2.530 58.578 61.300 -0.319 0.000 1.154 102 I CB 0.242 37.898 38.000 -0.573 0.000 1.315 102 I HN 0.137 8.307 8.210 -0.066 0.000 0.448 103 Q N 5.429 125.116 119.800 -0.188 0.000 2.309 103 Q HA 0.454 4.699 4.340 -0.159 0.000 0.264 103 Q C -0.639 175.406 176.000 0.075 0.000 1.008 103 Q CA -1.165 54.566 55.803 -0.122 0.000 0.853 103 Q CB 2.992 31.633 28.738 -0.161 0.000 1.314 103 Q HN 0.031 8.227 8.270 -0.124 0.000 0.448 104 L N -0.592 120.699 121.223 0.113 0.000 2.781 104 L HA 0.135 4.623 4.340 0.246 0.000 0.245 104 L C -0.942 176.084 176.870 0.259 0.000 1.118 104 L CA 0.324 55.290 54.840 0.211 0.000 0.918 104 L CB 0.890 43.075 42.059 0.210 0.000 1.246 104 L HN 0.292 8.566 8.230 0.073 0.000 0.526 105 R N -3.449 117.145 120.500 0.156 0.000 2.744 105 R HA 0.160 4.495 4.340 -0.008 0.000 0.279 105 R C -1.809 174.533 176.300 0.069 0.000 0.977 105 R CA -2.197 53.934 56.100 0.052 0.000 0.906 105 R CB 3.073 33.380 30.300 0.011 0.000 1.197 105 R HN -0.847 7.486 8.270 0.105 0.000 0.463 106 W N 3.774 124.960 121.300 -0.191 0.000 2.295 106 W HA -0.265 4.486 4.660 0.150 0.000 0.335 106 W C -1.550 174.939 176.519 -0.049 0.000 1.351 106 W CA 2.054 59.395 57.345 -0.006 0.000 1.273 106 W CB 0.225 29.690 29.460 0.007 0.000 1.214 106 W HN 0.399 8.470 8.180 -0.181 0.000 0.563 107 K N 6.234 125.989 120.400 -1.075 0.000 2.477 107 K HA 0.083 3.752 4.320 -1.084 0.000 0.255 107 K C -1.793 173.707 176.600 -1.833 0.000 0.952 107 K CA -2.192 53.344 56.287 -1.251 0.000 0.826 107 K CB 3.292 35.350 32.500 -0.737 0.000 1.331 107 K HN -0.169 7.460 8.250 -1.036 0.000 0.437 108 H N 1.664 119.855 119.070 -1.465 0.000 2.899 108 H HA -0.069 4.043 4.556 -0.740 0.000 0.303 108 H C -0.829 174.090 175.328 -0.681 0.000 1.042 108 H CA 0.574 56.130 56.048 -0.821 0.000 1.479 108 H CB 0.252 29.822 29.762 -0.320 0.000 1.493 108 H HN 0.281 7.994 8.280 -0.946 0.000 0.534 109 H N 8.496 127.351 119.070 -0.358 0.000 2.643 109 H HA 0.285 4.616 4.556 -0.374 0.000 0.259 109 H C -2.258 172.840 175.328 -0.384 0.000 1.298 109 H CA -3.225 52.624 56.048 -0.332 0.000 1.301 109 H CB -0.232 29.468 29.762 -0.103 0.000 1.422 109 H HN 0.276 8.521 8.280 -0.057 0.000 0.521 110 P HA -0.133 4.102 4.420 -0.308 0.000 0.261 110 P C 1.237 178.499 177.300 -0.063 0.000 1.173 110 P CA -0.029 62.873 63.100 -0.330 0.000 0.760 110 P CB 0.553 32.090 31.700 -0.271 0.000 0.783 111 L N 3.731 124.966 121.223 0.020 0.000 2.042 111 L HA -0.354 4.022 4.340 0.060 0.000 0.210 111 L C 0.755 177.646 176.870 0.035 0.000 1.076 111 L CA 2.617 57.487 54.840 0.049 0.000 0.749 111 L CB -0.291 41.808 42.059 0.066 0.000 0.893 111 L HN 0.349 8.608 8.230 0.047 0.000 0.432 112 D N -5.397 115.017 120.400 0.025 0.000 2.392 112 D HA -0.072 4.585 4.640 0.027 0.000 0.228 112 D C -0.329 175.981 176.300 0.017 0.000 1.003 112 D CA 0.863 54.876 54.000 0.022 0.000 0.917 112 D CB -0.669 40.144 40.800 0.022 0.000 0.890 112 D HN -0.130 8.254 8.370 0.023 0.000 0.532 113 N N 0.906 119.614 118.700 0.013 0.000 2.434 113 N HA -0.070 4.680 4.740 0.016 0.000 0.272 113 N C -0.509 175.036 175.510 0.059 0.000 1.040 113 N CA 0.139 53.201 53.050 0.020 0.000 0.956 113 N CB 0.702 39.182 38.487 -0.011 0.000 1.108 113 N HN -0.427 7.755 8.380 0.008 0.202 0.481 114 K N 2.597 123.036 120.400 0.066 0.000 2.514 114 K HA 0.181 4.547 4.320 0.076 0.000 0.207 114 K C -0.827 175.843 176.600 0.117 0.000 1.035 114 K CA -1.139 55.195 56.287 0.079 0.000 1.113 114 K CB -0.319 32.215 32.500 0.057 0.000 0.846 114 K HN 0.137 8.421 8.250 0.057 0.000 0.491 115 D N 1.394 121.894 120.400 0.166 0.000 2.414 115 D HA -0.066 4.863 4.640 0.228 -0.152 0.242 115 D C 0.027 176.501 176.300 0.290 0.000 1.129 115 D CA 1.556 55.708 54.000 0.254 0.000 0.885 115 D CB 0.677 41.647 40.800 0.283 0.000 1.198 115 D HN -0.724 7.970 8.370 0.153 -0.233 0.437 116 T N -3.127 111.569 114.554 0.238 0.000 3.058 116 T HA 0.205 4.465 4.350 -0.150 0.000 0.278 116 T C 0.388 175.013 174.700 -0.126 0.000 0.974 116 T CA -0.720 61.366 62.100 -0.025 0.000 0.893 116 T CB 1.748 70.559 68.868 -0.095 0.000 1.138 116 T HN 0.627 9.423 8.240 0.318 -0.364 0.529 117 F N 5.972 125.980 119.950 0.098 0.000 2.752 117 F HA 0.126 4.656 4.527 0.005 0.000 0.332 117 F C -2.039 173.871 175.800 0.184 0.000 1.188 117 F CA -0.239 57.815 58.000 0.090 0.000 1.296 117 F CB -0.874 38.199 39.000 0.121 0.000 1.526 117 F HN -0.617 8.181 8.300 0.533 -0.179 0.576 118 Y N -4.373 115.916 120.300 -0.019 0.000 2.604 118 Y HA 0.926 5.646 4.550 -0.088 -0.224 0.331 118 Y C -2.773 172.981 175.900 -0.243 0.000 1.158 118 Y CA -2.314 55.727 58.100 -0.097 0.000 1.056 118 Y CB 2.357 40.785 38.460 -0.054 0.000 1.330 118 Y HN -0.493 7.536 8.280 -0.312 0.063 0.457 119 V N -6.686 113.083 119.914 -0.240 0.000 3.113 119 V HA 0.663 4.654 4.120 -0.456 -0.145 0.316 119 V C -2.015 174.043 176.094 -0.060 0.000 1.125 119 V CA -3.303 58.757 62.300 -0.400 0.000 1.026 119 V CB 3.527 34.741 31.823 -1.014 0.000 1.080 119 V HN -0.372 7.709 8.190 -0.182 0.000 0.444 120 N N 0.037 118.775 118.700 0.064 0.000 2.410 120 N HA 0.359 5.374 4.740 0.165 -0.177 0.287 120 N C -0.567 175.156 175.510 0.354 0.000 1.044 120 N CA -0.790 52.389 53.050 0.214 0.000 0.881 120 N CB 3.076 41.714 38.487 0.251 0.000 1.405 120 N HN -0.213 8.199 8.380 0.053 0.000 0.490 121 L N 3.435 124.862 121.223 0.341 0.000 2.418 121 L HA -0.052 4.545 4.340 0.429 0.000 0.218 121 L C -0.279 176.732 176.870 0.235 0.000 1.125 121 L CA 0.735 55.783 54.840 0.346 0.000 0.835 121 L CB 0.722 42.971 42.059 0.318 0.000 0.953 121 L HN 0.260 8.661 8.230 0.286 0.000 0.454 122 Y N 1.755 122.151 120.300 0.160 0.000 2.511 122 Y HA -0.140 4.443 4.550 0.056 0.000 0.332 122 Y C -2.628 173.291 175.900 0.032 0.000 1.177 122 Y CA -0.027 58.136 58.100 0.106 0.000 1.422 122 Y CB 0.754 39.329 38.460 0.192 0.000 1.271 122 Y HN -0.779 7.963 8.280 0.423 -0.209 0.550 123 P HA -0.124 4.131 4.420 -0.525 -0.150 0.267 123 P C -1.439 175.817 177.300 -0.074 0.000 1.205 123 P CA -0.197 62.520 63.100 -0.638 0.000 0.765 123 P CB 0.423 31.183 31.700 -1.566 0.000 0.828 124 D N 2.709 123.234 120.400 0.208 0.000 2.488 124 D HA -0.203 4.742 4.640 0.509 0.000 0.238 124 D C 1.345 177.829 176.300 0.307 0.000 1.138 124 D CA 0.531 54.768 54.000 0.395 0.000 0.873 124 D CB 1.436 42.474 40.800 0.397 0.000 1.183 124 D HN -0.294 8.240 8.370 0.273 0.000 0.458 125 Y N 5.020 125.482 120.300 0.270 0.000 2.439 125 Y HA -0.383 4.179 4.550 0.020 0.000 0.292 125 Y C 1.344 177.233 175.900 -0.019 0.000 1.130 125 Y CA 3.675 61.798 58.100 0.040 0.000 1.254 125 Y CB 0.275 38.598 38.460 -0.228 0.000 1.000 125 Y HN 0.470 9.159 8.280 0.681 0.000 0.554 126 A N -0.919 122.003 122.820 0.169 0.000 1.902 126 A HA -0.376 3.883 4.320 -0.102 0.000 0.217 126 A C 1.727 179.196 177.584 -0.192 0.000 1.181 126 A CA 3.227 55.249 52.037 -0.026 0.000 0.623 126 A CB -1.015 18.030 19.000 0.075 0.000 0.818 126 A HN -0.372 8.100 8.150 0.268 -0.162 0.443 127 S N -0.191 115.563 115.700 0.089 0.000 2.368 127 S HA -0.303 4.359 4.470 0.320 0.000 0.224 127 S C 2.115 176.712 174.600 -0.004 0.000 1.029 127 S CA 3.112 61.441 58.200 0.215 0.000 0.988 127 S CB 0.022 63.453 63.200 0.385 0.000 0.838 127 S HN -0.778 7.812 8.310 0.200 -0.160 0.462 128 L N 1.050 122.222 121.223 -0.086 0.000 2.042 128 L HA -0.433 3.581 4.340 -0.542 0.000 0.210 128 L C 1.952 178.551 176.870 -0.451 0.000 1.076 128 L CA 3.266 57.851 54.840 -0.425 0.000 0.749 128 L CB -0.355 41.322 42.059 -0.636 0.000 0.893 128 L HN -0.414 7.813 8.230 -0.004 0.000 0.432 129 S N -1.540 113.981 115.700 -0.297 0.000 2.382 129 S HA -0.298 4.059 4.470 -0.189 0.000 0.228 129 S C 2.093 176.576 174.600 -0.194 0.000 1.027 129 S CA 3.696 61.757 58.200 -0.231 0.000 0.991 129 S CB -0.747 62.333 63.200 -0.200 0.000 0.823 129 S HN -0.056 8.104 8.310 -0.250 0.000 0.469 130 H N 1.173 120.174 119.070 -0.115 0.000 2.357 130 H HA -0.287 4.263 4.556 -0.010 0.000 0.301 130 H C 1.748 176.948 175.328 -0.213 0.000 1.082 130 H CA 3.069 59.095 56.048 -0.036 0.000 1.342 130 H CB -0.087 29.777 29.762 0.170 0.000 1.389 130 H HN -0.776 7.240 8.280 -0.275 0.099 0.511 131 A N -0.724 121.687 122.820 -0.682 0.000 1.972 131 A HA -0.246 2.972 4.320 -1.838 0.000 0.219 131 A C 1.795 179.014 177.584 -0.609 0.000 1.169 131 A CA 3.013 54.149 52.037 -1.503 0.000 0.635 131 A CB -0.617 16.947 19.000 -2.394 0.000 0.810 131 A HN -0.113 7.509 8.150 -0.754 0.076 0.446 132 I N -1.476 118.859 120.570 -0.393 0.000 2.286 132 I HA -0.507 3.722 4.170 0.098 0.000 0.245 132 I C 1.595 177.637 176.117 -0.125 0.000 1.104 132 I CA 3.995 65.230 61.300 -0.107 0.000 1.397 132 I CB -0.007 37.939 38.000 -0.090 0.000 1.072 132 I HN -0.361 7.567 8.210 -0.455 0.009 0.417 133 L N 0.149 121.304 121.223 -0.113 0.000 2.046 133 L HA -0.518 3.735 4.340 -0.146 0.000 0.208 133 L C 1.894 178.688 176.870 -0.127 0.000 1.077 133 L CA 3.692 58.466 54.840 -0.109 0.000 0.747 133 L CB -0.482 41.560 42.059 -0.028 0.000 0.896 133 L HN -0.439 7.649 8.230 -0.104 0.079 0.432 134 D N -1.743 118.633 120.400 -0.039 0.000 2.144 134 D HA -0.224 4.419 4.640 0.006 0.000 0.199 134 D C 2.627 178.899 176.300 -0.046 0.000 0.984 134 D CA 3.137 57.152 54.000 0.025 0.000 0.834 134 D CB -0.408 40.545 40.800 0.255 0.000 0.955 134 D HN -0.278 8.082 8.370 -0.017 0.000 0.465 135 L N 0.440 121.607 121.223 -0.094 0.000 1.994 135 L HA -0.248 4.020 4.340 -0.121 0.000 0.208 135 L C 1.445 178.111 176.870 -0.340 0.000 1.071 135 L CA 2.965 57.703 54.840 -0.171 0.000 0.745 135 L CB -0.087 41.874 42.059 -0.164 0.000 0.892 135 L HN -0.724 7.451 8.230 -0.092 0.000 0.431 136 V N -1.339 118.326 119.914 -0.414 0.000 2.343 136 V HA -0.690 2.842 4.120 -0.979 0.000 0.247 136 V C 1.993 177.846 176.094 -0.402 0.000 1.051 136 V CA 4.459 66.403 62.300 -0.593 0.000 1.036 136 V CB -0.173 31.401 31.823 -0.415 0.000 0.654 136 V HN -0.260 7.732 8.190 -0.330 0.000 0.451 137 Q N -2.692 116.915 119.800 -0.323 0.000 2.167 137 Q HA -0.316 3.864 4.340 -0.266 0.000 0.202 137 Q C 2.494 178.437 176.000 -0.094 0.000 0.970 137 Q CA 2.834 58.487 55.803 -0.251 0.000 0.855 137 Q CB -0.083 28.487 28.738 -0.280 0.000 0.911 137 Q HN -0.305 7.777 8.270 -0.314 0.000 0.438 138 S N -1.069 114.559 115.700 -0.121 0.000 2.414 138 S HA -0.186 4.273 4.470 -0.019 0.000 0.227 138 S C 1.292 175.849 174.600 -0.072 0.000 1.022 138 S CA 2.114 60.276 58.200 -0.064 0.000 0.958 138 S CB -0.292 62.876 63.200 -0.052 0.000 0.797 138 S HN -0.784 7.309 8.310 -0.161 0.121 0.493 139 L N -1.522 119.587 121.223 -0.189 0.000 2.554 139 L HA -0.072 4.251 4.340 -0.029 0.000 0.226 139 L C -0.641 176.269 176.870 0.067 0.000 1.137 139 L CA 0.689 55.444 54.840 -0.143 0.000 0.863 139 L CB 0.242 41.976 42.059 -0.542 0.000 0.985 139 L HN -0.529 7.421 8.230 -0.310 0.094 0.451 140 K N -7.706 112.732 120.400 0.064 0.000 3.553 140 K HA -0.364 4.061 4.320 0.174 0.000 0.303 140 K C -0.086 176.711 176.600 0.327 0.000 1.327 140 K CA 0.751 57.151 56.287 0.188 0.000 0.983 140 K CB -3.043 29.561 32.500 0.173 0.000 1.275 140 K HN -0.897 7.170 8.250 -0.012 0.176 0.453 141 W N 0.239 121.568 121.300 0.048 0.000 2.435 141 W HA -0.279 4.412 4.660 0.052 0.000 0.337 141 W C 1.085 177.667 176.519 0.105 0.000 1.300 141 W CA -0.057 57.317 57.345 0.049 0.000 1.298 141 W CB -0.548 28.912 29.460 0.000 0.000 1.217 141 W HN -0.719 7.621 8.180 0.371 0.063 0.565 142 R N 1.186 121.856 120.500 0.282 0.000 2.282 142 R HA -0.056 4.462 4.340 0.296 0.000 0.195 142 R C -0.592 175.810 176.300 0.170 0.000 0.909 142 R CA 0.774 57.009 56.100 0.225 0.000 1.039 142 R CB 1.216 31.599 30.300 0.138 0.000 1.015 142 R HN 0.251 8.647 8.270 0.210 0.000 0.513 143 S N -4.094 111.676 115.700 0.117 0.000 2.651 143 S HA 1.025 5.774 4.470 0.097 -0.221 0.279 143 S C -1.927 172.681 174.600 0.013 0.000 1.148 143 S CA -1.908 56.331 58.200 0.065 0.000 0.837 143 S CB 3.064 66.273 63.200 0.016 0.000 1.138 143 S HN -0.733 7.631 8.310 0.090 0.000 0.478 144 A N -2.104 120.717 122.820 0.002 0.000 2.569 144 A HA 0.291 4.638 4.320 -0.173 -0.131 0.292 144 A C -2.558 175.005 177.584 -0.034 0.000 1.032 144 A CA 0.021 52.032 52.037 -0.043 0.000 0.669 144 A CB 2.418 21.520 19.000 0.170 0.000 1.290 144 A HN -0.171 7.988 8.150 0.014 0.000 0.422 145 T N 1.454 115.957 114.554 -0.086 0.000 2.888 145 T HA 0.495 4.981 4.350 -0.066 -0.176 0.284 145 T C -0.997 173.633 174.700 -0.118 0.000 1.017 145 T CA -0.821 61.218 62.100 -0.102 0.000 1.022 145 T CB 2.205 70.981 68.868 -0.153 0.000 1.013 145 T HN -0.107 8.059 8.240 -0.124 0.000 0.465 146 V N 5.760 125.625 119.914 -0.081 0.000 2.357 146 V HA 0.365 4.574 4.120 -0.113 -0.157 0.284 146 V C -1.827 174.230 176.094 -0.062 0.000 1.018 146 V CA -1.070 61.190 62.300 -0.066 0.000 0.841 146 V CB 1.660 33.487 31.823 0.007 0.000 0.991 146 V HN 0.307 8.465 8.190 -0.052 0.000 0.437 147 V N 7.805 127.626 119.914 -0.155 0.000 2.357 147 V HA 0.830 5.145 4.120 -0.117 -0.266 0.284 147 V C -0.831 175.277 176.094 0.024 0.000 1.018 147 V CA -1.857 60.371 62.300 -0.120 0.000 0.841 147 V CB 1.254 32.951 31.823 -0.209 0.000 0.991 147 V HN 0.618 8.657 8.190 -0.251 0.000 0.437 148 Y N 3.543 123.822 120.300 -0.036 0.000 2.621 148 Y HA 0.774 5.512 4.550 -0.009 -0.193 0.334 148 Y C -1.989 173.900 175.900 -0.019 0.000 1.074 148 Y CA -3.174 54.908 58.100 -0.029 0.000 1.149 148 Y CB 2.887 41.305 38.460 -0.069 0.000 1.302 148 Y HN -0.238 7.896 8.280 -0.243 0.000 0.501 149 D N 0.345 120.797 120.400 0.086 0.000 2.584 149 D HA -0.074 4.508 4.640 -0.096 0.000 0.254 149 D C -1.124 175.188 176.300 0.020 0.000 1.085 149 D CA 0.980 54.973 54.000 -0.013 0.000 0.971 149 D CB 1.181 41.994 40.800 0.021 0.000 1.103 149 D HN 0.581 9.070 8.370 0.199 0.000 0.453 150 D N -4.496 115.973 120.400 0.114 0.000 2.384 150 D HA 0.123 4.805 4.640 0.070 0.000 0.250 150 D C 0.670 177.081 176.300 0.184 0.000 1.029 150 D CA -1.080 52.981 54.000 0.101 0.000 0.990 150 D CB 2.256 43.083 40.800 0.046 0.000 1.175 150 D HN -0.197 8.243 8.370 0.116 0.000 0.532 151 S N 0.156 115.928 115.700 0.119 0.000 2.440 151 S HA -0.310 4.269 4.470 0.181 0.000 0.240 151 S C 1.581 176.158 174.600 -0.039 0.000 1.014 151 S CA 2.958 61.213 58.200 0.091 0.000 0.980 151 S CB -0.214 63.010 63.200 0.041 0.000 0.775 151 S HN 0.399 8.757 8.310 0.080 0.000 0.499 152 T N 4.462 118.987 114.554 -0.049 0.000 3.035 152 T HA -0.196 4.088 4.350 -0.110 0.000 0.268 152 T C 1.486 175.980 174.700 -0.342 0.000 1.109 152 T CA 3.488 65.505 62.100 -0.139 0.000 1.119 152 T CB -0.139 68.697 68.868 -0.054 0.000 0.900 152 T HN -0.607 7.807 8.240 -0.005 -0.177 0.503 153 G N 0.914 109.516 108.800 -0.330 0.000 2.442 153 G HA2 -0.277 3.399 3.960 -0.474 0.000 0.219 153 G HA3 -0.277 3.478 3.960 -0.342 0.000 0.219 153 G C 0.412 174.971 174.900 -0.568 0.000 1.141 153 G CA 1.972 46.805 45.100 -0.446 0.000 0.763 153 G HN -0.072 8.069 8.290 -0.183 0.039 0.554 154 L N -0.409 120.409 121.223 -0.675 0.000 2.079 154 L HA -0.408 3.631 4.340 -0.502 0.000 0.210 154 L C 1.187 177.858 176.870 -0.331 0.000 1.081 154 L CA 2.421 56.957 54.840 -0.505 0.000 0.752 154 L CB -0.204 41.587 42.059 -0.447 0.000 0.896 154 L HN -0.802 6.971 8.230 -0.762 0.000 0.433 155 I N -3.830 116.548 120.570 -0.320 0.000 2.252 155 I HA -0.415 3.653 4.170 -0.171 0.000 0.245 155 I C 3.179 179.121 176.117 -0.292 0.000 1.102 155 I CA 2.904 64.063 61.300 -0.234 0.000 1.385 155 I CB -0.031 37.867 38.000 -0.170 0.000 1.064 155 I HN -0.829 7.178 8.210 -0.337 0.000 0.414 156 R N -0.976 119.165 120.500 -0.598 0.000 2.115 156 R HA -0.213 3.662 4.340 -0.775 0.000 0.230 156 R C 1.575 177.673 176.300 -0.336 0.000 1.111 156 R CA 2.954 58.561 56.100 -0.822 0.000 0.976 156 R CB 0.211 29.507 30.300 -1.674 0.000 0.870 156 R HN -0.619 7.245 8.270 -0.678 0.000 0.445 157 L N -3.035 118.022 121.223 -0.277 0.000 2.741 157 L HA 0.419 4.720 4.340 -0.065 0.000 0.237 157 L C 0.411 177.214 176.870 -0.111 0.000 1.178 157 L CA -1.232 53.525 54.840 -0.138 0.000 0.973 157 L CB -0.516 41.456 42.059 -0.143 0.000 1.255 157 L HN -0.235 7.666 8.230 -0.338 0.126 0.498 158 Q N 0.338 120.073 119.800 -0.108 0.000 2.096 158 Q HA -0.429 3.864 4.340 -0.079 0.000 0.204 158 Q C 1.646 177.626 176.000 -0.033 0.000 0.982 158 Q CA 3.522 59.284 55.803 -0.067 0.000 0.850 158 Q CB -0.590 28.121 28.738 -0.045 0.000 0.901 158 Q HN -0.743 7.398 8.270 -0.122 0.055 0.422 159 E N -1.973 118.203 120.200 -0.039 0.000 2.209 159 E HA -0.227 4.135 4.350 0.020 0.000 0.196 159 E C 1.068 177.662 176.600 -0.010 0.000 0.993 159 E CA 1.902 58.283 56.400 -0.032 0.000 0.819 159 E CB -0.717 28.873 29.700 -0.184 0.000 0.745 159 E HN 0.338 8.667 8.360 -0.051 0.000 0.477 160 L N -2.648 118.554 121.223 -0.035 0.000 2.202 160 L HA -0.064 4.275 4.340 -0.002 0.000 0.205 160 L C 1.660 178.529 176.870 -0.002 0.000 1.083 160 L CA 1.816 56.646 54.840 -0.018 0.000 0.790 160 L CB 0.601 42.639 42.059 -0.035 0.000 0.942 160 L HN -0.507 7.550 8.230 -0.052 0.142 0.452 161 I N -1.190 119.369 120.570 -0.019 0.000 2.493 161 I HA -0.354 3.812 4.170 -0.007 0.000 0.254 161 I C 1.629 177.752 176.117 0.011 0.000 1.160 161 I CA 1.672 62.965 61.300 -0.013 0.000 1.445 161 I CB -0.858 37.116 38.000 -0.045 0.000 1.086 161 I HN -0.168 8.021 8.210 -0.036 0.000 0.433 162 M N -1.966 117.646 119.600 0.020 0.000 3.057 162 M HA 0.051 4.552 4.480 0.034 0.000 0.246 162 M C -0.648 175.688 176.300 0.061 0.000 1.289 162 M CA 0.001 55.324 55.300 0.038 0.000 1.161 162 M CB -1.147 31.478 32.600 0.041 0.000 1.302 162 M HN -0.640 7.637 8.290 0.015 0.022 0.483 163 A N -0.040 122.820 122.820 0.066 0.000 1.887 163 A HA 0.162 4.544 4.320 0.104 0.000 0.212 163 A C -0.274 177.387 177.584 0.128 0.000 1.198 163 A CA 2.879 54.974 52.037 0.097 0.000 0.628 163 A CB -1.663 17.385 19.000 0.081 0.000 0.847 163 A HN -0.661 7.430 8.150 0.054 0.092 0.449 164 P HA -0.175 4.316 4.420 0.118 0.000 0.217 164 P C 0.156 177.503 177.300 0.077 0.000 1.148 164 P CA 2.354 65.511 63.100 0.096 0.000 0.834 164 P CB -0.159 31.580 31.700 0.065 0.000 0.783 165 S N -6.905 108.836 115.700 0.068 0.000 2.593 165 S HA -0.037 4.459 4.470 0.043 0.000 0.217 165 S C 0.563 175.199 174.600 0.060 0.000 0.966 165 S CA 1.142 59.374 58.200 0.053 0.000 0.914 165 S CB -0.286 62.940 63.200 0.044 0.000 0.776 165 S HN 0.106 8.434 8.310 0.068 0.023 0.523 166 R N 0.025 120.578 120.500 0.089 0.000 2.207 166 R HA 0.197 4.581 4.340 0.074 0.000 0.180 166 R C 0.050 176.426 176.300 0.125 0.000 1.445 166 R CA 0.429 56.589 56.100 0.100 0.000 1.217 166 R CB 1.136 31.506 30.300 0.115 0.000 1.135 166 R HN -0.394 7.883 8.270 0.109 0.058 0.481 167 Y N 1.629 121.950 120.300 0.035 0.000 2.289 167 Y HA 0.039 4.608 4.550 0.032 0.000 0.332 167 Y C -1.306 174.616 175.900 0.037 0.000 1.324 167 Y CA -0.907 57.215 58.100 0.036 0.000 1.478 167 Y CB 1.462 39.947 38.460 0.041 0.000 1.378 167 Y HN -0.423 8.033 8.280 0.294 0.000 0.558 168 N N 3.085 121.378 118.700 -0.679 0.000 2.949 168 N HA -0.016 4.676 4.740 -0.081 0.000 0.243 168 N C -2.040 173.496 175.510 0.044 0.000 1.113 168 N CA -0.879 51.990 53.050 -0.300 0.000 0.980 168 N CB -1.537 36.745 38.487 -0.342 0.000 1.256 168 N HN 0.069 7.421 8.380 -1.714 0.000 0.508 169 I N 1.095 121.868 120.570 0.340 0.000 2.529 169 I HA 0.203 4.735 4.170 0.291 -0.188 0.284 169 I C -2.011 174.214 176.117 0.181 0.000 1.088 169 I CA -0.951 60.547 61.300 0.330 0.000 1.062 169 I CB 2.516 40.751 38.000 0.391 0.000 1.218 169 I HN -0.537 7.864 8.210 0.318 0.000 0.442 170 R N 9.823 130.396 120.500 0.120 0.000 2.316 170 R HA 0.175 4.558 4.340 0.072 0.000 0.314 170 R C -2.094 174.247 176.300 0.068 0.000 1.069 170 R CA -0.073 56.072 56.100 0.076 0.000 0.959 170 R CB 0.605 30.933 30.300 0.048 0.000 0.987 170 R HN 0.011 8.350 8.270 0.114 0.000 0.446 171 L N 1.346 122.603 121.223 0.056 0.000 2.381 171 L HA 0.905 5.424 4.340 0.032 -0.159 0.274 171 L C -0.529 176.351 176.870 0.017 0.000 0.988 171 L CA -1.832 53.032 54.840 0.039 0.000 0.824 171 L CB 2.215 44.307 42.059 0.056 0.000 1.263 171 L HN 0.196 8.459 8.230 0.055 0.000 0.410 172 K N 3.214 123.611 120.400 -0.004 0.000 2.120 172 K HA 0.137 4.455 4.320 -0.004 0.000 0.245 172 K C -1.360 175.235 176.600 -0.008 0.000 1.024 172 K CA -0.292 55.988 56.287 -0.012 0.000 0.906 172 K CB 1.287 33.767 32.500 -0.032 0.000 1.051 172 K HN 0.099 8.341 8.250 -0.014 0.000 0.491 173 I N -0.366 120.206 120.570 0.003 0.000 2.548 173 I HA 0.414 4.774 4.170 0.036 -0.169 0.287 173 I C -0.523 175.615 176.117 0.034 0.000 1.103 173 I CA -0.815 60.508 61.300 0.039 0.000 1.049 173 I CB 2.641 40.683 38.000 0.070 0.000 1.232 173 I HN 0.155 8.365 8.210 0.001 0.000 0.429 174 R N 6.675 127.173 120.500 -0.004 0.000 2.686 174 R HA 0.394 4.693 4.340 -0.068 0.000 0.283 174 R C -2.195 173.943 176.300 -0.270 0.000 0.978 174 R CA -1.900 54.145 56.100 -0.091 0.000 0.897 174 R CB 4.060 34.297 30.300 -0.105 0.000 1.192 174 R HN 0.669 8.937 8.270 -0.003 0.000 0.457 175 Q N 2.927 122.503 119.800 -0.373 0.000 2.293 175 Q HA 0.457 4.284 4.340 -1.110 -0.152 0.261 175 Q C -0.548 175.230 176.000 -0.370 0.000 0.960 175 Q CA -1.239 54.147 55.803 -0.696 0.000 0.882 175 Q CB 2.348 30.681 28.738 -0.675 0.000 1.275 175 Q HN 0.204 8.327 8.270 -0.246 0.000 0.445 176 L N 6.470 127.490 121.223 -0.338 0.000 2.483 176 L HA 0.027 4.284 4.340 -0.139 0.000 0.276 176 L C -1.066 175.712 176.870 -0.152 0.000 1.213 176 L CA -0.979 53.753 54.840 -0.179 0.000 0.843 176 L CB -0.772 41.210 42.059 -0.128 0.000 1.107 176 L HN 0.082 8.062 8.230 -0.416 0.000 0.487 177 P HA 0.051 4.423 4.420 -0.080 0.000 0.264 177 P C -0.724 176.534 177.300 -0.069 0.000 1.193 177 P CA -0.159 62.894 63.100 -0.079 0.000 0.763 177 P CB 0.585 32.248 31.700 -0.061 0.000 0.810 178 I N -2.299 118.236 120.570 -0.059 0.000 2.406 178 I HA -0.178 3.964 4.170 -0.047 0.000 0.249 178 I C 0.446 176.540 176.117 -0.039 0.000 1.122 178 I CA 1.845 63.117 61.300 -0.046 0.000 1.431 178 I CB -0.188 37.790 38.000 -0.036 0.000 1.087 178 I HN -0.028 8.147 8.210 -0.057 0.000 0.424 179 D N 1.109 121.487 120.400 -0.037 0.000 2.084 179 D HA -0.117 4.506 4.640 -0.029 0.000 0.196 179 D C 0.334 176.615 176.300 -0.032 0.000 0.985 179 D CA 1.944 55.925 54.000 -0.031 0.000 0.826 179 D CB -0.111 40.672 40.800 -0.028 0.000 0.978 179 D HN 0.169 8.516 8.370 -0.038 0.000 0.456 180 S N -3.439 112.239 115.700 -0.036 0.000 2.648 180 S HA 0.123 4.574 4.470 -0.032 0.000 0.305 180 S C -1.385 173.189 174.600 -0.043 0.000 1.094 180 S CA -1.760 56.419 58.200 -0.036 0.000 0.983 180 S CB 1.586 64.766 63.200 -0.033 0.000 1.101 180 S HN -0.454 7.832 8.310 -0.039 0.000 0.514 181 D N -0.844 119.530 120.400 -0.042 0.000 2.463 181 D HA 0.034 4.641 4.640 -0.054 0.000 0.224 181 D C -1.289 174.981 176.300 -0.049 0.000 1.174 181 D CA -0.749 53.221 54.000 -0.050 0.000 0.829 181 D CB -0.231 40.538 40.800 -0.051 0.000 0.993 181 D HN 0.070 8.417 8.370 -0.038 0.000 0.497 182 D N 0.419 120.794 120.400 -0.043 0.000 2.380 182 D HA 0.056 4.672 4.640 -0.041 0.000 0.230 182 D C 0.438 176.711 176.300 -0.045 0.000 1.154 182 D CA -0.561 53.415 54.000 -0.040 0.000 0.859 182 D CB 0.316 41.097 40.800 -0.031 0.000 1.045 182 D HN -0.777 7.498 8.370 -0.040 0.071 0.495 183 S N 6.164 121.833 115.700 -0.052 0.000 2.572 183 S HA 0.192 4.630 4.470 -0.053 0.000 0.228 183 S C 0.940 175.512 174.600 -0.046 0.000 0.963 183 S CA -0.226 57.942 58.200 -0.055 0.000 0.939 183 S CB 0.476 63.635 63.200 -0.069 0.000 0.804 183 S HN -0.005 8.554 8.310 -0.056 -0.282 0.480 184 R N 2.719 123.195 120.500 -0.039 0.000 2.066 184 R HA -0.130 4.191 4.340 -0.032 0.000 0.232 184 R C -0.956 175.328 176.300 -0.027 0.000 1.131 184 R CA 5.758 61.840 56.100 -0.030 0.000 0.955 184 R CB -2.277 28.009 30.300 -0.023 0.000 0.851 184 R HN -0.706 7.715 8.270 -0.037 -0.173 0.432 185 P HA -0.212 4.194 4.420 -0.024 0.000 0.215 185 P C 1.163 178.444 177.300 -0.032 0.000 1.153 185 P CA 3.205 66.289 63.100 -0.028 0.000 0.853 185 P CB -0.528 31.154 31.700 -0.029 0.000 0.788 186 L N -2.718 118.482 121.223 -0.038 0.000 2.017 186 L HA -0.255 4.058 4.340 -0.045 0.000 0.208 186 L C 1.538 178.387 176.870 -0.035 0.000 1.073 186 L CA 2.830 57.645 54.840 -0.042 0.000 0.745 186 L CB -0.220 41.810 42.059 -0.048 0.000 0.894 186 L HN -0.547 7.659 8.230 -0.040 0.000 0.432 187 L N -2.103 119.104 121.223 -0.027 0.000 2.127 187 L HA -0.533 3.798 4.340 -0.015 0.000 0.211 187 L C 2.475 179.332 176.870 -0.022 0.000 1.089 187 L CA 3.247 58.074 54.840 -0.021 0.000 0.757 187 L CB -0.722 41.322 42.059 -0.026 0.000 0.899 187 L HN -0.359 7.854 8.230 -0.029 0.000 0.434 188 K N -2.150 118.237 120.400 -0.022 0.000 2.057 188 K HA -0.422 3.891 4.320 -0.013 0.000 0.207 188 K C 2.159 178.744 176.600 -0.026 0.000 1.049 188 K CA 3.969 60.245 56.287 -0.018 0.000 0.931 188 K CB -0.397 32.093 32.500 -0.016 0.000 0.714 188 K HN 0.120 8.347 8.250 -0.023 0.009 0.440 189 E N -0.690 119.490 120.200 -0.033 0.000 2.106 189 E HA -0.278 4.049 4.350 -0.038 0.000 0.192 189 E C 2.714 179.281 176.600 -0.055 0.000 0.984 189 E CA 2.671 59.046 56.400 -0.041 0.000 0.806 189 E CB -0.225 29.450 29.700 -0.042 0.000 0.750 189 E HN -0.525 7.717 8.360 -0.033 0.098 0.458 190 M N -1.447 118.119 119.600 -0.057 0.000 2.254 190 M HA -0.227 4.400 4.480 -0.094 -0.203 0.265 190 M C 2.002 178.243 176.300 -0.099 0.000 1.066 190 M CA 3.544 58.797 55.300 -0.078 0.000 1.123 190 M CB 0.254 32.817 32.600 -0.063 0.000 1.388 190 M HN -0.406 7.856 8.290 -0.048 0.000 0.425 191 K N 0.683 121.051 120.400 -0.054 0.000 2.031 191 K HA -0.237 4.057 4.320 -0.044 0.000 0.205 191 K C 3.063 179.615 176.600 -0.080 0.000 1.049 191 K CA 3.285 59.547 56.287 -0.042 0.000 0.939 191 K CB -0.140 32.368 32.500 0.015 0.000 0.717 191 K HN -0.197 7.943 8.250 -0.036 0.088 0.438 192 R N -0.872 119.595 120.500 -0.055 0.000 2.120 192 R HA -0.194 4.125 4.340 -0.035 0.000 0.234 192 R C 1.748 178.004 176.300 -0.073 0.000 1.123 192 R CA 2.428 58.499 56.100 -0.048 0.000 0.975 192 R CB 0.046 30.326 30.300 -0.034 0.000 0.866 192 R HN -0.139 8.105 8.270 -0.044 0.000 0.446 193 G N -3.720 105.022 108.800 -0.098 0.000 3.026 193 G HA2 0.076 3.987 3.960 -0.081 0.000 0.208 193 G HA3 0.076 3.975 3.960 -0.102 0.000 0.208 193 G C -1.401 173.395 174.900 -0.174 0.000 1.169 193 G CA -0.577 44.458 45.100 -0.109 0.000 0.788 193 G HN -0.500 7.622 8.290 -0.097 0.110 0.533 194 R N -4.767 115.569 120.500 -0.273 0.000 3.502 194 R HA -0.600 3.221 4.340 -0.864 0.000 0.266 194 R C -0.586 175.294 176.300 -0.700 0.000 1.077 194 R CA 1.126 56.903 56.100 -0.539 0.000 0.718 194 R CB -3.310 26.918 30.300 -0.121 0.000 1.120 194 R HN -0.509 7.431 8.270 -0.240 0.186 0.457 195 E N -0.467 119.399 120.200 -0.557 0.000 2.052 195 E HA -0.015 4.168 4.350 -0.279 0.000 0.283 195 E C -1.279 175.054 176.600 -0.445 0.000 1.071 195 E CA 0.073 56.251 56.400 -0.370 0.000 0.851 195 E CB 0.057 29.637 29.700 -0.200 0.000 1.066 195 E HN -0.346 7.729 8.360 -0.441 0.020 0.396 196 F N 1.762 121.592 119.950 -0.200 0.000 2.717 196 F HA 0.081 4.346 4.527 -0.436 0.000 0.297 196 F C -0.704 174.984 175.800 -0.187 0.000 1.113 196 F CA 0.601 58.397 58.000 -0.340 0.000 1.319 196 F CB 1.987 40.685 39.000 -0.504 0.000 1.097 196 F HN -0.099 8.131 8.300 -0.116 0.000 0.595 197 R N -0.417 119.965 120.500 -0.197 0.000 2.337 197 R HA 0.665 4.927 4.340 -0.434 -0.183 0.319 197 R C -1.653 174.428 176.300 -0.365 0.000 0.954 197 R CA -0.723 55.008 56.100 -0.615 0.000 0.840 197 R CB 1.373 30.710 30.300 -1.604 0.000 1.164 197 R HN -0.556 7.580 8.270 -0.223 0.000 0.472 198 I N 3.109 123.651 120.570 -0.048 0.000 2.647 198 I HA 0.495 4.675 4.170 -0.222 -0.143 0.295 198 I C -1.782 174.233 176.117 -0.170 0.000 1.078 198 I CA -1.279 59.910 61.300 -0.185 0.000 1.048 198 I CB 4.667 42.405 38.000 -0.436 0.000 1.239 198 I HN 0.548 8.860 8.210 0.171 0.000 0.421 199 I N 3.918 124.313 120.570 -0.292 0.000 2.382 199 I HA 0.471 4.765 4.170 -0.117 -0.194 0.286 199 I C -1.407 174.465 176.117 -0.408 0.000 1.002 199 I CA -1.163 60.016 61.300 -0.202 0.000 1.135 199 I CB 2.047 40.035 38.000 -0.020 0.000 1.288 199 I HN 0.454 8.475 8.210 -0.316 0.000 0.448 200 F N 7.902 127.678 119.950 -0.290 0.000 2.361 200 F HA 0.502 5.078 4.527 -0.206 -0.173 0.364 200 F C -1.264 174.478 175.800 -0.097 0.000 1.120 200 F CA -1.677 56.144 58.000 -0.297 0.000 1.102 200 F CB 1.567 40.183 39.000 -0.640 0.000 1.183 200 F HN 0.587 8.726 8.300 -0.268 0.000 0.476 201 D N 4.385 124.881 120.400 0.161 0.000 2.359 201 D HA 0.797 5.561 4.640 0.205 0.000 0.230 201 D C -0.602 175.802 176.300 0.173 0.000 1.118 201 D CA -1.220 52.886 54.000 0.177 0.000 0.844 201 D CB 1.258 42.139 40.800 0.135 0.000 1.059 201 D HN 0.297 8.746 8.370 0.132 0.000 0.493 202 C N 2.055 121.470 119.300 0.192 0.000 3.176 202 C HA 0.416 4.938 4.460 0.105 0.000 0.343 202 C C -2.025 173.057 174.990 0.153 0.000 1.332 202 C CA -1.747 57.356 59.018 0.141 0.000 1.200 202 C CB 2.834 30.641 27.740 0.112 0.000 1.440 202 C HN -0.471 7.897 8.230 0.230 0.000 0.458 203 S N 0.266 116.023 115.700 0.094 0.000 2.576 203 S HA -0.036 4.542 4.470 0.180 0.000 0.272 203 S C 1.456 176.094 174.600 0.063 0.000 1.352 203 S CA 0.292 58.552 58.200 0.100 0.000 1.021 203 S CB 1.252 64.455 63.200 0.005 0.000 0.887 203 S HN 0.333 8.679 8.310 0.059 0.000 0.542 204 H N 1.746 120.826 119.070 0.016 0.000 2.387 204 H HA -0.286 4.241 4.556 -0.048 0.000 0.299 204 H C 1.701 177.002 175.328 -0.046 0.000 1.099 204 H CA 3.203 59.230 56.048 -0.035 0.000 1.315 204 H CB -1.324 28.399 29.762 -0.065 0.000 1.380 204 H HN 0.710 9.293 8.280 0.505 0.000 0.513 205 T N 1.796 115.886 114.554 -0.773 0.000 2.622 205 T HA -0.426 3.698 4.350 -0.377 0.000 0.266 205 T C 1.724 176.293 174.700 -0.218 0.000 1.047 205 T CA 3.970 65.795 62.100 -0.458 0.000 1.159 205 T CB -0.173 68.429 68.868 -0.443 0.000 0.863 205 T HN -0.210 7.248 8.240 -1.302 0.000 0.422 206 M N 1.281 120.780 119.600 -0.167 0.000 2.213 206 M HA -0.375 4.041 4.480 -0.108 0.000 0.263 206 M C 0.846 177.088 176.300 -0.097 0.000 1.062 206 M CA 2.052 57.290 55.300 -0.105 0.000 1.105 206 M CB -0.557 32.003 32.600 -0.067 0.000 1.385 206 M HN -0.741 7.444 8.290 -0.175 0.000 0.417 207 A N -0.987 121.792 122.820 -0.068 0.000 1.930 207 A HA -0.242 4.096 4.320 0.031 0.000 0.217 207 A C 1.579 179.047 177.584 -0.193 0.000 1.175 207 A CA 2.887 54.886 52.037 -0.063 0.000 0.627 207 A CB -0.822 18.124 19.000 -0.089 0.000 0.815 207 A HN 0.093 8.104 8.150 -0.059 0.104 0.443 208 A N -2.102 120.620 122.820 -0.162 0.000 1.933 208 A HA -0.427 3.804 4.320 -0.149 0.000 0.218 208 A C 1.685 179.206 177.584 -0.104 0.000 1.175 208 A CA 3.008 54.969 52.037 -0.126 0.000 0.628 208 A CB -0.810 18.148 19.000 -0.070 0.000 0.814 208 A HN -0.394 7.670 8.150 -0.142 0.000 0.444 209 Q N -0.754 118.981 119.800 -0.108 0.000 2.046 209 Q HA -0.260 4.044 4.340 -0.060 0.000 0.200 209 Q C 2.404 178.329 176.000 -0.125 0.000 0.975 209 Q CA 2.624 58.372 55.803 -0.091 0.000 0.836 209 Q CB -0.305 28.380 28.738 -0.089 0.000 0.896 209 Q HN -0.714 7.381 8.270 -0.115 0.106 0.428 210 I N 0.264 120.719 120.570 -0.193 0.000 2.264 210 I HA -0.464 3.557 4.170 -0.247 0.000 0.248 210 I C 2.228 178.172 176.117 -0.288 0.000 1.111 210 I CA 4.073 65.196 61.300 -0.295 0.000 1.382 210 I CB -0.044 37.633 38.000 -0.539 0.000 1.060 210 I HN -0.383 7.712 8.210 -0.191 0.000 0.418 211 L N -1.015 120.035 121.223 -0.287 0.000 1.994 211 L HA -0.492 3.658 4.340 -0.316 0.000 0.208 211 L C 1.965 178.681 176.870 -0.257 0.000 1.071 211 L CA 3.230 57.834 54.840 -0.394 0.000 0.745 211 L CB -0.677 40.941 42.059 -0.735 0.000 0.892 211 L HN -0.437 7.627 8.230 -0.277 0.000 0.431 212 K N -1.039 119.326 120.400 -0.058 0.000 2.074 212 K HA -0.453 4.062 4.320 0.324 0.000 0.209 212 K C 2.651 179.289 176.600 0.063 0.000 1.048 212 K CA 3.176 59.545 56.287 0.136 0.000 0.926 212 K CB -0.254 32.307 32.500 0.100 0.000 0.713 212 K HN -0.671 7.537 8.250 -0.069 0.000 0.444 213 Q N -2.574 117.216 119.800 -0.017 0.000 2.269 213 Q HA -0.128 4.213 4.340 0.001 0.000 0.201 213 Q C 2.400 178.384 176.000 -0.025 0.000 0.946 213 Q CA 2.114 57.904 55.803 -0.022 0.000 0.877 213 Q CB 0.209 28.917 28.738 -0.049 0.000 0.963 213 Q HN -0.457 7.767 8.270 -0.057 0.012 0.472 214 A N 0.397 123.187 122.820 -0.050 0.000 1.969 214 A HA -0.233 4.063 4.320 -0.040 0.000 0.218 214 A C 1.226 178.827 177.584 0.029 0.000 1.169 214 A CA 2.981 55.004 52.037 -0.024 0.000 0.635 214 A CB -0.585 18.406 19.000 -0.016 0.000 0.810 214 A HN 0.233 8.331 8.150 -0.085 0.000 0.445 215 M N -1.330 118.316 119.600 0.077 0.000 2.200 215 M HA -0.299 4.252 4.480 0.118 0.000 0.265 215 M C 2.291 178.640 176.300 0.081 0.000 1.066 215 M CA 3.451 58.827 55.300 0.125 0.000 1.127 215 M CB 0.046 32.797 32.600 0.251 0.000 1.379 215 M HN -0.388 7.938 8.290 0.077 0.011 0.420 216 A N 0.125 122.983 122.820 0.062 0.000 1.972 216 A HA -0.228 4.119 4.320 0.045 0.000 0.219 216 A C 1.464 179.065 177.584 0.028 0.000 1.169 216 A CA 2.761 54.822 52.037 0.040 0.000 0.635 216 A CB -0.468 18.549 19.000 0.028 0.000 0.810 216 A HN -0.414 7.774 8.150 0.063 0.000 0.446 217 M N -5.021 114.589 119.600 0.017 0.000 2.494 217 M HA 0.115 4.602 4.480 0.013 0.000 0.232 217 M C 0.214 176.522 176.300 0.013 0.000 1.137 217 M CA -1.884 53.421 55.300 0.008 0.000 1.012 217 M CB -0.719 31.875 32.600 -0.010 0.000 1.567 217 M HN -0.612 7.560 8.290 0.014 0.126 0.486 218 G N -1.118 107.698 108.800 0.026 0.000 2.221 218 G HA2 -0.403 3.593 3.960 0.059 0.000 0.265 218 G HA3 -0.403 3.596 3.960 0.064 0.000 0.265 218 G C -0.118 174.787 174.900 0.009 0.000 1.041 218 G CA 0.991 46.118 45.100 0.046 0.000 0.807 218 G HN -0.262 7.868 8.290 0.033 0.180 0.502 219 M N -2.767 116.766 119.600 -0.112 0.000 2.405 219 M HA 0.039 4.098 4.480 -0.702 0.000 0.292 219 M C -0.513 175.571 176.300 -0.359 0.000 1.111 219 M CA -0.334 54.656 55.300 -0.517 0.000 0.979 219 M CB 0.825 33.083 32.600 -0.570 0.000 1.426 219 M HN -0.250 7.999 8.290 -0.067 0.000 0.509 220 M N 1.003 120.577 119.600 -0.045 0.000 3.428 220 M HA 0.094 4.578 4.480 0.007 0.000 0.229 220 M C -1.692 174.649 176.300 0.067 0.000 1.299 220 M CA -1.015 54.310 55.300 0.042 0.000 1.405 220 M CB -2.128 30.556 32.600 0.140 0.000 1.119 220 M HN -0.257 7.978 8.290 0.001 0.055 0.613 221 T N -3.494 111.125 114.554 0.109 0.000 2.716 221 T HA 0.443 4.838 4.350 0.076 0.000 0.286 221 T C 0.475 175.225 174.700 0.083 0.000 1.052 221 T CA -2.849 59.331 62.100 0.134 0.000 1.024 221 T CB 2.733 71.743 68.868 0.236 0.000 1.349 221 T HN -0.829 7.456 8.240 0.138 0.037 0.525 222 E N -0.270 119.890 120.200 -0.067 0.000 2.515 222 E HA -0.153 4.298 4.350 -0.122 -0.175 0.201 222 E C -0.219 176.251 176.600 -0.218 0.000 1.071 222 E CA 1.682 57.975 56.400 -0.178 0.000 0.880 222 E CB -1.592 27.945 29.700 -0.272 0.000 0.828 222 E HN 0.570 8.866 8.360 -0.106 0.000 0.540 223 Y N -2.464 117.852 120.300 0.025 0.000 2.544 223 Y HA -0.176 4.202 4.550 -0.286 0.000 0.286 223 Y C -0.575 175.177 175.900 -0.247 0.000 1.141 223 Y CA 1.331 59.312 58.100 -0.198 0.000 1.299 223 Y CB 0.547 38.849 38.460 -0.263 0.000 1.030 223 Y HN -0.763 7.526 8.280 0.121 0.064 0.543 224 Y N -2.289 118.082 120.300 0.118 0.000 2.409 224 Y HA 0.197 5.074 4.550 0.238 -0.185 0.339 224 Y C -1.395 174.437 175.900 -0.113 0.000 1.033 224 Y CA -0.964 57.174 58.100 0.064 0.000 1.094 224 Y CB 3.298 41.737 38.460 -0.035 0.000 1.210 224 Y HN -0.669 7.748 8.280 0.309 0.049 0.456 225 H N 2.981 122.073 119.070 0.037 0.000 2.906 225 H HA 0.587 5.355 4.556 0.014 -0.203 0.324 225 H C -1.625 173.927 175.328 0.374 0.000 0.973 225 H CA -2.607 53.512 56.048 0.119 0.000 1.321 225 H CB 3.177 33.132 29.762 0.321 0.000 1.535 225 H HN 0.618 9.069 8.280 0.285 0.000 0.518 226 F N 5.579 125.900 119.950 0.618 0.000 2.421 226 F HA 0.720 5.623 4.527 0.299 -0.196 0.337 226 F C -0.825 175.224 175.800 0.414 0.000 1.105 226 F CA -3.980 54.279 58.000 0.430 0.000 1.049 226 F CB 1.684 40.962 39.000 0.462 0.000 1.139 226 F HN 0.292 8.834 8.300 0.404 0.000 0.479 227 I N 0.848 121.651 120.570 0.388 0.000 2.406 227 I HA 0.727 5.331 4.170 0.301 -0.254 0.290 227 I C -1.285 174.903 176.117 0.119 0.000 0.999 227 I CA -1.273 60.167 61.300 0.233 0.000 1.124 227 I CB 2.688 40.729 38.000 0.069 0.000 1.289 227 I HN 0.659 9.049 8.210 0.300 0.000 0.441 228 F N 6.165 126.261 119.950 0.243 0.000 2.421 228 F HA 0.543 5.406 4.527 0.296 -0.158 0.337 228 F C 1.175 177.130 175.800 0.259 0.000 1.105 228 F CA -1.033 57.117 58.000 0.249 0.000 1.049 228 F CB 2.635 41.749 39.000 0.189 0.000 1.139 228 F HN 0.344 8.979 8.300 0.558 0.000 0.479 229 T N 0.538 115.326 114.554 0.390 0.000 3.043 229 T HA -0.168 4.403 4.350 0.368 0.000 0.263 229 T C 0.897 175.783 174.700 0.310 0.000 1.094 229 T CA 1.615 63.911 62.100 0.327 0.000 1.127 229 T CB 0.235 69.247 68.868 0.239 0.000 0.905 229 T HN 0.238 8.685 8.240 0.346 0.000 0.490 230 T N 2.537 117.290 114.554 0.330 0.000 2.867 230 T HA -0.158 4.346 4.350 0.256 0.000 0.297 230 T C 0.811 175.628 174.700 0.195 0.000 0.989 230 T CA 0.081 62.333 62.100 0.253 0.000 1.159 230 T CB 0.672 69.674 68.868 0.223 0.000 0.928 230 T HN -0.496 7.978 8.240 0.389 0.000 0.538 231 L N 8.077 129.391 121.223 0.152 0.000 2.610 231 L HA 0.009 4.588 4.340 0.155 -0.146 0.232 231 L C 0.198 177.072 176.870 0.007 0.000 1.149 231 L CA 0.724 55.627 54.840 0.106 0.000 0.872 231 L CB -0.139 41.941 42.059 0.035 0.000 0.992 231 L HN 0.891 9.228 8.230 0.178 0.000 0.447 232 D N -1.761 118.576 120.400 -0.105 0.000 2.395 232 D HA 0.137 4.329 4.640 -0.747 0.000 0.226 232 D C 0.950 176.987 176.300 -0.440 0.000 1.146 232 D CA -0.064 53.675 54.000 -0.436 0.000 0.830 232 D CB -0.193 40.375 40.800 -0.387 0.000 0.958 232 D HN -0.604 7.685 8.370 -0.016 0.072 0.501 233 L N 1.694 122.792 121.223 -0.208 0.000 2.043 233 L HA -0.325 3.924 4.340 -0.152 0.000 0.212 233 L C 0.691 177.475 176.870 -0.143 0.000 1.075 233 L CA 3.199 57.960 54.840 -0.132 0.000 0.752 233 L CB -0.339 41.717 42.059 -0.005 0.000 0.891 233 L HN -0.777 7.322 8.230 -0.093 0.075 0.432 234 Y N -6.485 113.814 120.300 -0.002 0.000 2.651 234 Y HA -0.288 4.258 4.550 -0.008 0.000 0.296 234 Y C -0.017 175.882 175.900 -0.002 0.000 1.150 234 Y CA 0.392 58.490 58.100 -0.005 0.000 1.348 234 Y CB -1.738 36.721 38.460 -0.003 0.000 0.983 234 Y HN -0.052 8.191 8.280 -0.062 0.000 0.555 235 A N -1.865 120.731 122.820 -0.373 0.000 2.238 235 A HA 0.069 4.391 4.320 0.003 0.000 0.210 235 A C -0.176 177.377 177.584 -0.052 0.000 1.179 235 A CA -0.257 51.675 52.037 -0.176 0.000 0.827 235 A CB 0.896 19.694 19.000 -0.336 0.000 0.856 235 A HN -0.443 7.161 8.150 -0.598 0.186 0.488 236 L N -0.165 121.020 121.223 -0.064 0.000 2.380 236 L HA -0.069 4.268 4.340 -0.006 0.000 0.273 236 L C -0.572 176.307 176.870 0.015 0.000 1.138 236 L CA -0.509 54.315 54.840 -0.027 0.000 0.832 236 L CB 0.453 42.456 42.059 -0.093 0.000 1.124 236 L HN -0.626 7.395 8.230 -0.104 0.146 0.454 237 D N 3.216 123.639 120.400 0.039 0.000 2.348 237 D HA -0.073 4.590 4.640 0.039 0.000 0.259 237 D C -0.087 176.268 176.300 0.092 0.000 1.296 237 D CA 0.074 54.103 54.000 0.048 0.000 0.931 237 D CB -0.294 40.528 40.800 0.036 0.000 1.067 237 D HN 0.242 8.636 8.370 0.039 0.000 0.503 238 L N 4.719 125.991 121.223 0.082 0.000 2.741 238 L HA 0.206 4.765 4.340 0.366 0.000 0.237 238 L C 0.152 177.051 176.870 0.047 0.000 1.178 238 L CA -1.030 53.909 54.840 0.165 0.000 0.973 238 L CB 0.103 42.222 42.059 0.101 0.000 1.255 238 L HN 0.173 8.433 8.230 0.051 0.000 0.498 239 E N 1.666 121.841 120.200 -0.043 0.000 2.106 239 E HA -0.210 4.078 4.350 -0.103 0.000 0.192 239 E C -0.757 175.743 176.600 -0.166 0.000 0.984 239 E CA 4.154 60.499 56.400 -0.091 0.000 0.806 239 E CB -1.155 28.519 29.700 -0.043 0.000 0.750 239 E HN -0.616 7.916 8.360 -0.029 -0.189 0.458 240 P HA -0.112 4.135 4.420 -0.287 0.000 0.230 240 P C -0.621 176.321 177.300 -0.596 0.000 1.158 240 P CA 1.394 64.169 63.100 -0.543 0.000 0.769 240 P CB -0.119 31.084 31.700 -0.828 0.000 0.807 241 Y N -6.018 114.277 120.300 -0.009 0.000 2.426 241 Y HA 0.180 4.741 4.550 0.018 0.000 0.249 241 Y C 1.755 177.612 175.900 -0.071 0.000 1.103 241 Y CA -0.638 57.456 58.100 -0.010 0.000 1.256 241 Y CB 0.502 38.965 38.460 0.006 0.000 1.208 241 Y HN -0.743 7.326 8.280 -0.259 0.055 0.519 242 R N 2.536 122.984 120.500 -0.087 0.000 2.133 242 R HA -0.378 3.837 4.340 -0.209 0.000 0.247 242 R C 1.067 177.121 176.300 -0.409 0.000 1.151 242 R CA 3.978 59.880 56.100 -0.330 0.000 0.971 242 R CB -0.068 29.852 30.300 -0.635 0.000 0.866 242 R HN -0.657 7.542 8.270 -0.118 0.000 0.447 243 Y N -6.576 113.735 120.300 0.020 0.000 2.458 243 Y HA 0.059 4.612 4.550 0.004 0.000 0.256 243 Y C -0.031 175.876 175.900 0.012 0.000 1.159 243 Y CA -0.683 57.421 58.100 0.007 0.000 1.261 243 Y CB -0.449 38.008 38.460 -0.005 0.000 1.119 243 Y HN -0.008 8.214 8.280 -0.064 0.020 0.524 244 S N -1.158 114.614 115.700 0.119 0.000 2.428 244 S HA -0.149 4.384 4.470 0.105 0.000 0.230 244 S C 1.495 176.126 174.600 0.052 0.000 1.014 244 S CA 1.257 59.516 58.200 0.098 0.000 0.957 244 S CB 0.685 63.956 63.200 0.118 0.000 0.784 244 S HN -0.670 7.645 8.310 0.092 0.051 0.499 245 G N -0.166 108.648 108.800 0.023 0.000 2.176 245 G HA2 -0.293 3.654 3.960 -0.023 0.000 0.232 245 G HA3 -0.293 3.653 3.960 -0.023 0.000 0.232 245 G C -0.455 174.412 174.900 -0.055 0.000 0.986 245 G CA -0.177 44.911 45.100 -0.019 0.000 0.643 245 G HN 0.100 8.383 8.290 0.022 0.020 0.522 246 V N -3.209 116.675 119.914 -0.051 0.000 2.963 246 V HA -0.059 4.169 4.120 -0.119 -0.179 0.306 246 V C -0.349 175.653 176.094 -0.155 0.000 1.077 246 V CA -0.209 62.019 62.300 -0.119 0.000 1.124 246 V CB 0.236 31.950 31.823 -0.182 0.000 0.987 246 V HN -0.880 7.298 8.190 -0.020 0.000 0.487 247 N N 2.557 121.103 118.700 -0.256 0.000 2.455 247 N HA 0.104 4.670 4.740 -0.289 0.000 0.280 247 N C -1.778 173.622 175.510 -0.184 0.000 1.055 247 N CA -0.558 52.248 53.050 -0.406 0.000 0.961 247 N CB 1.460 39.306 38.487 -1.068 0.000 1.121 247 N HN -0.447 7.773 8.380 -0.266 0.000 0.476 248 L N 5.292 126.520 121.223 0.009 0.000 2.541 248 L HA 0.741 5.556 4.340 0.419 -0.224 0.266 248 L C -2.251 174.760 176.870 0.236 0.000 0.966 248 L CA -0.423 54.566 54.840 0.248 0.000 0.871 248 L CB 3.148 45.329 42.059 0.203 0.000 1.232 248 L HN 0.544 8.756 8.230 -0.030 0.000 0.408 249 T N 7.416 122.161 114.554 0.319 0.000 2.876 249 T HA 0.851 5.417 4.350 0.071 -0.174 0.289 249 T C -1.308 173.421 174.700 0.049 0.000 1.014 249 T CA -1.436 60.742 62.100 0.129 0.000 0.986 249 T CB 3.046 71.968 68.868 0.091 0.000 1.021 249 T HN 0.333 8.831 8.240 0.430 0.000 0.458 250 G N 2.529 111.250 108.800 -0.132 0.000 2.815 250 G HA2 0.712 4.593 3.960 -0.295 0.000 0.305 250 G HA3 0.712 4.693 3.960 0.034 0.000 0.305 250 G C -3.019 171.575 174.900 -0.510 0.000 1.277 250 G CA -0.510 44.458 45.100 -0.221 0.000 0.795 250 G HN -0.071 8.133 8.290 -0.142 0.000 0.528 251 F N -2.679 117.317 119.950 0.078 0.000 2.598 251 F HA 1.033 5.786 4.527 0.055 -0.193 0.327 251 F C -0.624 175.227 175.800 0.084 0.000 1.057 251 F CA -1.926 56.106 58.000 0.054 0.000 0.957 251 F CB 5.141 44.141 39.000 0.001 0.000 1.278 251 F HN -0.082 8.382 8.300 0.273 0.000 0.484 252 R N -0.761 119.909 120.500 0.285 0.000 2.522 252 R HA 0.400 4.887 4.340 0.245 0.000 0.283 252 R C -2.034 174.357 176.300 0.152 0.000 1.074 252 R CA -0.357 55.872 56.100 0.216 0.000 0.925 252 R CB 3.835 34.242 30.300 0.180 0.000 1.205 252 R HN 0.029 8.482 8.270 0.305 0.000 0.436 253 I N 5.708 126.335 120.570 0.094 0.000 3.708 253 I HA 0.115 4.334 4.170 0.082 0.000 0.302 253 I C -1.305 174.821 176.117 0.015 0.000 1.255 253 I CA -0.263 61.060 61.300 0.039 0.000 1.362 253 I CB 1.564 39.517 38.000 -0.079 0.000 1.100 253 I HN 0.800 9.069 8.210 0.098 0.000 0.434 254 L N 1.078 122.306 121.223 0.008 0.000 2.597 254 L HA -0.204 4.243 4.340 -0.048 -0.136 0.271 254 L C -0.934 175.885 176.870 -0.084 0.000 1.157 254 L CA 0.593 55.400 54.840 -0.055 0.000 0.928 254 L CB 0.146 42.138 42.059 -0.112 0.000 1.216 254 L HN -0.565 7.694 8.230 0.049 0.000 0.481 255 N N 7.456 126.116 118.700 -0.067 0.000 2.971 255 N HA -0.068 4.646 4.740 -0.044 0.000 0.294 255 N C 0.934 176.394 175.510 -0.083 0.000 1.210 255 N CA -0.808 52.206 53.050 -0.060 0.000 1.157 255 N CB -0.840 37.617 38.487 -0.050 0.000 1.450 255 N HN 0.246 8.589 8.380 -0.060 0.000 0.527 256 V N 2.425 122.272 119.914 -0.111 0.000 2.490 256 V HA -0.388 3.652 4.120 -0.134 0.000 0.250 256 V C 0.305 176.352 176.094 -0.078 0.000 1.061 256 V CA 3.017 65.243 62.300 -0.123 0.000 1.064 256 V CB 0.093 31.817 31.823 -0.166 0.000 0.670 256 V HN -0.448 7.634 8.190 -0.120 0.036 0.461 257 D N -2.713 117.653 120.400 -0.057 0.000 2.351 257 D HA -0.078 4.540 4.640 -0.037 0.000 0.216 257 D C 0.092 176.372 176.300 -0.033 0.000 0.968 257 D CA 1.415 55.392 54.000 -0.038 0.000 0.899 257 D CB -0.171 40.613 40.800 -0.026 0.000 0.907 257 D HN 0.024 8.342 8.370 -0.055 0.019 0.514 258 N N -0.091 118.586 118.700 -0.038 0.000 2.419 258 N HA 0.322 5.050 4.740 -0.021 0.000 0.264 258 N C -1.060 174.442 175.510 -0.015 0.000 1.031 258 N CA -2.613 50.421 53.050 -0.026 0.000 0.951 258 N CB 1.277 39.744 38.487 -0.034 0.000 1.101 258 N HN -0.708 7.584 8.380 -0.048 0.059 0.488 259 P HA -0.334 4.084 4.420 -0.004 0.000 0.216 259 P C 0.541 177.857 177.300 0.027 0.000 1.157 259 P CA 2.764 65.872 63.100 0.013 0.000 0.880 259 P CB 0.225 31.941 31.700 0.028 0.000 0.791 260 H N -4.440 114.612 119.070 -0.030 0.000 2.495 260 H HA -0.079 4.474 4.556 -0.004 0.000 0.287 260 H C 2.256 177.564 175.328 -0.034 0.000 1.033 260 H CA 2.828 58.864 56.048 -0.020 0.000 1.307 260 H CB 0.086 29.837 29.762 -0.018 0.000 1.401 260 H HN 0.240 8.609 8.280 0.147 0.000 0.555 261 V N 0.497 120.402 119.914 -0.015 0.000 2.323 261 V HA -0.514 3.550 4.120 -0.094 0.000 0.244 261 V C 1.311 177.333 176.094 -0.121 0.000 1.041 261 V CA 4.208 66.458 62.300 -0.083 0.000 1.025 261 V CB -0.162 31.615 31.823 -0.076 0.000 0.656 261 V HN -0.369 7.712 8.190 0.015 0.118 0.451 262 S N 0.097 115.741 115.700 -0.093 0.000 2.382 262 S HA -0.337 4.080 4.470 -0.088 0.000 0.228 262 S C 1.914 176.464 174.600 -0.082 0.000 1.027 262 S CA 3.604 61.755 58.200 -0.082 0.000 0.991 262 S CB -0.903 62.262 63.200 -0.059 0.000 0.823 262 S HN -0.448 7.819 8.310 -0.073 0.000 0.469 263 A N 1.940 124.688 122.820 -0.119 0.000 1.933 263 A HA -0.190 4.085 4.320 -0.075 0.000 0.218 263 A C 1.584 179.095 177.584 -0.122 0.000 1.175 263 A CA 3.169 55.127 52.037 -0.132 0.000 0.628 263 A CB -0.559 18.314 19.000 -0.212 0.000 0.814 263 A HN -0.323 7.741 8.150 -0.130 0.007 0.444 264 I N -1.887 118.574 120.570 -0.182 0.000 2.353 264 I HA -0.313 3.857 4.170 -0.000 0.000 0.248 264 I C 2.062 178.181 176.117 0.004 0.000 1.119 264 I CA 2.101 63.349 61.300 -0.086 0.000 1.417 264 I CB -0.905 36.971 38.000 -0.206 0.000 1.078 264 I HN -0.867 7.103 8.210 -0.241 0.096 0.421 265 V N 1.232 121.115 119.914 -0.052 0.000 2.427 265 V HA -0.525 3.599 4.120 0.007 0.000 0.248 265 V C 1.935 178.083 176.094 0.090 0.000 1.051 265 V CA 4.659 66.961 62.300 0.003 0.000 1.048 265 V CB -0.225 31.564 31.823 -0.057 0.000 0.666 265 V HN 0.077 8.212 8.190 -0.091 0.000 0.456 266 E N 0.792 121.016 120.200 0.040 0.000 2.051 266 E HA -0.337 4.037 4.350 0.041 0.000 0.192 266 E C 1.968 178.607 176.600 0.066 0.000 0.991 266 E CA 3.113 59.538 56.400 0.042 0.000 0.799 266 E CB -0.056 29.653 29.700 0.015 0.000 0.748 266 E HN -0.356 8.007 8.360 0.007 0.000 0.449 267 K N -0.147 120.315 120.400 0.104 0.000 2.097 267 K HA -0.292 4.101 4.320 0.121 0.000 0.206 267 K C 1.939 178.641 176.600 0.170 0.000 1.049 267 K CA 2.822 59.209 56.287 0.167 0.000 0.933 267 K CB -0.007 32.642 32.500 0.248 0.000 0.717 267 K HN -0.602 7.703 8.250 0.092 0.000 0.442 268 W N 0.009 121.242 121.300 -0.110 0.000 2.354 268 W HA -0.294 3.862 4.660 -0.839 0.000 0.315 268 W C 1.940 178.317 176.519 -0.238 0.000 1.206 268 W CA 2.903 59.970 57.345 -0.464 0.000 1.290 268 W CB 0.146 29.273 29.460 -0.554 0.000 1.152 268 W HN 0.035 8.359 8.180 0.253 0.008 0.489 269 S N 1.308 116.874 115.700 -0.223 0.000 2.399 269 S HA -0.266 3.918 4.470 -0.477 0.000 0.231 269 S C 2.118 176.587 174.600 -0.218 0.000 1.022 269 S CA 2.666 60.702 58.200 -0.272 0.000 0.983 269 S CB -0.843 62.335 63.200 -0.037 0.000 0.803 269 S HN -0.340 8.000 8.310 0.051 0.000 0.480 270 M N 0.706 120.233 119.600 -0.121 0.000 2.279 270 M HA -0.211 4.233 4.480 -0.061 0.000 0.264 270 M C 1.041 177.287 176.300 -0.090 0.000 1.062 270 M CA 2.888 58.147 55.300 -0.068 0.000 1.099 270 M CB -0.028 32.571 32.600 -0.002 0.000 1.394 270 M HN -0.447 7.781 8.290 -0.076 0.016 0.426 271 E N -2.321 117.786 120.200 -0.156 0.000 2.250 271 E HA -0.068 4.266 4.350 -0.026 0.000 0.192 271 E C -0.085 176.399 176.600 -0.194 0.000 0.986 271 E CA 0.563 56.900 56.400 -0.105 0.000 0.849 271 E CB 0.465 30.145 29.700 -0.034 0.000 0.797 271 E HN -0.649 7.418 8.360 -0.233 0.154 0.482 272 R N -0.167 120.117 120.500 -0.361 0.000 2.590 272 R HA -0.102 4.015 4.340 -0.371 0.000 0.274 272 R C -0.553 175.620 176.300 -0.211 0.000 1.061 272 R CA 0.759 56.645 56.100 -0.356 0.000 1.081 272 R CB 0.353 30.393 30.300 -0.434 0.000 0.984 272 R HN -0.776 7.118 8.270 -0.440 0.111 0.448 273 L N 0.399 121.509 121.223 -0.188 0.000 3.086 273 L HA 0.247 4.524 4.340 -0.105 0.000 0.274 273 L C 0.267 177.084 176.870 -0.087 0.000 1.184 273 L CA -0.368 54.398 54.840 -0.123 0.000 1.002 273 L CB -0.060 41.927 42.059 -0.121 0.000 1.383 273 L HN 0.227 8.327 8.230 -0.216 0.000 0.582 287 V N 0.913 120.921 119.914 0.157 0.000 3.264 287 V HA -0.028 4.219 4.120 0.213 0.000 0.304 287 V C -0.279 176.024 176.094 0.349 0.000 1.086 287 V CA -0.709 61.729 62.300 0.230 0.000 1.090 287 V CB 1.427 33.398 31.823 0.248 0.000 1.112 287 V HN -0.321 7.951 8.190 0.137 0.000 0.472 288 M N 3.812 123.594 119.600 0.304 0.000 2.135 288 M HA 0.123 4.678 4.480 0.125 0.000 0.345 288 M C -1.338 175.009 176.300 0.078 0.000 1.340 288 M CA -0.421 54.907 55.300 0.048 0.000 1.162 288 M CB 0.016 32.397 32.600 -0.365 0.000 1.570 288 M HN 0.212 8.650 8.290 0.247 0.000 0.454 289 M N 5.437 125.052 119.600 0.024 0.000 2.114 289 M HA 0.026 4.504 4.480 -0.003 0.000 0.293 289 M C 1.531 177.810 176.300 -0.034 0.000 1.201 289 M CA 0.836 56.115 55.300 -0.035 0.000 1.107 289 M CB 1.115 33.616 32.600 -0.165 0.000 1.405 289 M HN 0.465 8.780 8.290 0.041 0.000 0.486 290 T N 2.444 116.987 114.554 -0.018 0.000 2.821 290 T HA -0.383 3.994 4.350 0.044 0.000 0.267 290 T C 1.540 176.269 174.700 0.047 0.000 1.046 290 T CA 4.913 67.035 62.100 0.035 0.000 1.139 290 T CB 0.094 68.998 68.868 0.059 0.000 0.871 290 T HN 0.373 8.920 8.240 -0.073 -0.351 0.454 291 D N 0.814 121.246 120.400 0.054 0.000 2.106 291 D HA -0.337 4.393 4.640 0.151 0.000 0.191 291 D C 1.831 178.159 176.300 0.046 0.000 0.997 291 D CA 3.867 57.922 54.000 0.092 0.000 0.834 291 D CB -0.677 40.178 40.800 0.092 0.000 0.956 291 D HN 0.318 8.705 8.370 0.028 0.000 0.448 292 A N -0.967 121.811 122.820 -0.069 0.000 1.930 292 A HA -0.261 4.001 4.320 -0.097 0.000 0.217 292 A C 1.647 179.121 177.584 -0.183 0.000 1.175 292 A CA 2.772 54.683 52.037 -0.210 0.000 0.627 292 A CB -0.633 18.004 19.000 -0.606 0.000 0.815 292 A HN -0.572 7.523 8.150 -0.093 0.000 0.443 293 A N -0.974 121.741 122.820 -0.176 0.000 1.930 293 A HA -0.256 3.967 4.320 -0.162 0.000 0.217 293 A C 1.870 179.513 177.584 0.098 0.000 1.175 293 A CA 2.721 54.701 52.037 -0.095 0.000 0.627 293 A CB -0.568 18.369 19.000 -0.106 0.000 0.815 293 A HN -0.579 7.467 8.150 -0.173 0.000 0.443 294 L N -2.098 119.192 121.223 0.112 0.000 2.093 294 L HA -0.288 4.167 4.340 0.191 0.000 0.208 294 L C 2.308 179.330 176.870 0.253 0.000 1.085 294 L CA 2.596 57.548 54.840 0.185 0.000 0.755 294 L CB -0.380 41.789 42.059 0.183 0.000 0.904 294 L HN -0.185 8.094 8.230 0.081 0.000 0.435 295 L N -0.997 120.369 121.223 0.239 0.000 2.072 295 L HA -0.311 4.227 4.340 0.329 0.000 0.205 295 L C 1.408 178.458 176.870 0.301 0.000 1.079 295 L CA 2.470 57.483 54.840 0.288 0.000 0.752 295 L CB -0.830 41.392 42.059 0.272 0.000 0.906 295 L HN -0.649 7.693 8.230 0.188 0.000 0.436 296 Y N 0.428 120.820 120.300 0.154 0.000 2.165 296 Y HA -0.502 4.184 4.550 0.227 0.000 0.286 296 Y C 1.365 177.436 175.900 0.285 0.000 1.155 296 Y CA 3.426 61.651 58.100 0.209 0.000 1.164 296 Y CB -0.168 38.385 38.460 0.155 0.000 0.978 296 Y HN -0.165 8.319 8.280 0.340 0.000 0.513 297 D N -1.015 119.662 120.400 0.463 0.000 2.178 297 D HA -0.345 4.591 4.640 0.494 0.000 0.202 297 D C 2.101 178.543 176.300 0.237 0.000 0.974 297 D CA 3.232 57.484 54.000 0.420 0.000 0.841 297 D CB -0.584 40.493 40.800 0.462 0.000 0.953 297 D HN -0.401 8.248 8.370 0.467 0.000 0.478 298 A N 0.057 123.054 122.820 0.296 0.000 1.873 298 A HA -0.164 4.351 4.320 0.326 0.000 0.215 298 A C 2.064 179.871 177.584 0.371 0.000 1.186 298 A CA 3.176 55.436 52.037 0.372 0.000 0.616 298 A CB -0.490 18.828 19.000 0.529 0.000 0.823 298 A HN -0.275 7.967 8.150 0.320 0.099 0.442 299 V N -1.890 118.152 119.914 0.213 0.000 2.490 299 V HA -0.613 3.571 4.120 0.107 0.000 0.250 299 V C 2.290 178.298 176.094 -0.143 0.000 1.061 299 V CA 4.501 66.790 62.300 -0.018 0.000 1.064 299 V CB -0.102 31.549 31.823 -0.286 0.000 0.670 299 V HN -0.121 8.174 8.190 0.175 0.000 0.461 300 H N -0.313 118.566 119.070 -0.317 0.000 2.363 300 H HA -0.249 4.047 4.556 -0.433 0.000 0.301 300 H C 2.196 177.136 175.328 -0.647 0.000 1.074 300 H CA 4.833 60.540 56.048 -0.568 0.000 1.354 300 H CB 0.089 29.304 29.762 -0.911 0.000 1.397 300 H HN -0.766 7.480 8.280 -0.034 0.013 0.516 301 I N -0.218 120.092 120.570 -0.434 0.000 2.226 301 I HA -0.520 3.340 4.170 -0.518 0.000 0.245 301 I C 1.504 177.567 176.117 -0.089 0.000 1.100 301 I CA 4.513 65.631 61.300 -0.303 0.000 1.374 301 I CB -0.081 37.907 38.000 -0.020 0.000 1.057 301 I HN -0.320 7.712 8.210 -0.296 0.000 0.413 302 V N -0.842 119.088 119.914 0.027 0.000 2.515 302 V HA -0.589 3.564 4.120 0.055 0.000 0.250 302 V C 1.792 178.004 176.094 0.197 0.000 1.058 302 V CA 4.297 66.673 62.300 0.127 0.000 1.064 302 V CB -0.288 31.701 31.823 0.275 0.000 0.675 302 V HN -0.223 8.012 8.190 0.075 0.000 0.461 303 S N 0.822 116.549 115.700 0.045 0.000 2.335 303 S HA -0.223 4.298 4.470 0.086 0.000 0.217 303 S C 2.017 176.656 174.600 0.066 0.000 1.032 303 S CA 3.486 61.700 58.200 0.023 0.000 0.985 303 S CB -0.508 62.600 63.200 -0.153 0.000 0.896 303 S HN -0.756 7.421 8.310 -0.044 0.106 0.445 304 V N 2.301 122.185 119.914 -0.050 0.000 2.363 304 V HA -0.510 3.620 4.120 0.016 0.000 0.254 304 V C 1.806 177.930 176.094 0.050 0.000 1.074 304 V CA 4.192 66.480 62.300 -0.019 0.000 1.069 304 V CB -0.106 31.632 31.823 -0.142 0.000 0.659 304 V HN -0.081 8.016 8.190 -0.156 0.000 0.455 305 C N -2.652 116.707 119.300 0.098 0.000 2.467 305 C HA -0.290 4.219 4.460 0.082 0.000 0.279 305 C C 1.477 176.601 174.990 0.223 0.000 1.347 305 C CA 4.816 63.925 59.018 0.151 0.000 1.748 305 C CB -0.511 27.326 27.740 0.161 0.000 1.977 305 C HN -0.299 7.966 8.230 0.086 0.017 0.501 306 Y N 0.327 120.770 120.300 0.238 0.000 2.293 306 Y HA -0.399 4.101 4.550 -0.084 0.000 0.291 306 Y C 0.593 176.423 175.900 -0.116 0.000 1.137 306 Y CA 3.071 61.186 58.100 0.024 0.000 1.202 306 Y CB -0.040 38.427 38.460 0.011 0.000 0.990 306 Y HN -0.821 7.754 8.280 0.492 0.000 0.537 307 Q N -2.161 117.627 119.800 -0.019 0.000 2.123 307 Q HA -0.232 4.009 4.340 -0.164 0.000 0.199 307 Q C 1.358 177.238 176.000 -0.201 0.000 0.966 307 Q CA 2.157 57.897 55.803 -0.105 0.000 0.845 307 Q CB 0.434 29.184 28.738 0.021 0.000 0.907 307 Q HN -0.620 7.698 8.270 0.111 0.019 0.439 308 R N -5.022 115.354 120.500 -0.207 0.000 2.276 308 R HA 0.015 4.259 4.340 -0.161 0.000 0.196 308 R C 0.090 176.044 176.300 -0.577 0.000 0.961 308 R CA -0.028 55.922 56.100 -0.250 0.000 1.024 308 R CB 0.249 30.495 30.300 -0.090 0.000 0.940 308 R HN -0.736 7.438 8.270 -0.160 0.000 0.480 309 A N 2.575 124.920 122.820 -0.792 0.000 2.425 309 A HA 0.173 3.673 4.320 -1.367 0.000 0.249 309 A C -1.927 175.371 177.584 -0.478 0.000 1.084 309 A CA -2.314 49.182 52.037 -0.902 0.000 0.781 309 A CB -0.679 17.927 19.000 -0.657 0.000 1.019 309 A HN -0.541 7.098 8.150 -0.625 0.135 0.490 310 P HA -0.062 4.257 4.420 -0.167 0.000 0.269 310 P C -0.768 176.380 177.300 -0.253 0.000 1.215 310 P CA -0.510 62.492 63.100 -0.164 0.000 0.780 310 P CB 0.966 32.658 31.700 -0.013 0.000 0.898 311 Q N 1.033 120.685 119.800 -0.247 0.000 2.308 311 Q HA -0.216 3.876 4.340 -0.413 0.000 0.313 311 Q C -0.602 175.175 176.000 -0.371 0.000 1.075 311 Q CA 1.323 56.940 55.803 -0.311 0.000 0.995 311 Q CB 0.088 28.698 28.738 -0.213 0.000 1.107 311 Q HN 0.299 8.451 8.270 -0.196 0.000 0.380 312 M N 3.036 122.300 119.600 -0.560 0.000 2.704 312 M HA 0.369 3.791 4.480 -1.763 0.000 0.284 312 M C -2.031 173.889 176.300 -0.633 0.000 1.275 312 M CA -1.834 52.757 55.300 -1.183 0.000 0.811 312 M CB 3.695 35.546 32.600 -1.248 0.000 1.741 312 M HN -0.392 7.612 8.290 -0.476 0.000 0.458 313 T N -3.417 110.745 114.554 -0.653 0.000 2.907 313 T HA 0.362 4.721 4.350 0.015 0.000 0.292 313 T C -0.688 174.134 174.700 0.203 0.000 1.043 313 T CA -2.017 60.058 62.100 -0.041 0.000 1.003 313 T CB 3.022 71.934 68.868 0.073 0.000 1.084 313 T HN -0.108 7.405 8.240 -1.211 0.000 0.483 314 V N 2.839 122.806 119.914 0.088 0.000 2.508 314 V HA -0.154 3.881 4.120 -0.143 0.000 0.281 314 V C -0.690 175.401 176.094 -0.004 0.000 1.041 314 V CA 0.686 62.960 62.300 -0.043 0.000 1.016 314 V CB 0.421 32.167 31.823 -0.129 0.000 0.984 314 V HN 0.237 8.450 8.190 0.039 0.000 0.478 315 N N 6.788 125.447 118.700 -0.069 0.000 2.361 315 N HA 0.125 4.901 4.740 0.061 0.000 0.302 315 N C -1.232 174.231 175.510 -0.078 0.000 1.074 315 N CA -0.940 52.123 53.050 0.022 0.000 0.850 315 N CB 2.542 41.160 38.487 0.217 0.000 1.228 315 N HN 0.103 8.313 8.380 -0.283 0.000 0.491 316 S N 2.121 117.802 115.700 -0.032 0.000 2.430 316 S HA -0.016 4.482 4.470 -0.080 -0.075 0.282 316 S C -0.838 173.734 174.600 -0.048 0.000 1.186 316 S CA 0.003 58.172 58.200 -0.052 0.000 1.060 316 S CB -0.322 62.860 63.200 -0.031 0.000 0.966 316 S HN 0.282 8.590 8.310 -0.002 0.000 0.501 317 L N 6.435 127.609 121.223 -0.082 0.000 2.331 317 L HA 0.358 4.663 4.340 -0.058 0.000 0.275 317 L C -1.326 175.465 176.870 -0.132 0.000 1.022 317 L CA -0.736 54.054 54.840 -0.083 0.000 0.812 317 L CB 1.970 43.983 42.059 -0.078 0.000 1.257 317 L HN 0.059 8.226 8.230 -0.105 0.000 0.435 318 Q N 0.122 119.804 119.800 -0.196 0.000 2.330 318 Q HA 0.207 4.363 4.340 -0.307 0.000 0.269 318 Q C -1.165 174.578 176.000 -0.427 0.000 1.022 318 Q CA -0.836 54.743 55.803 -0.373 0.000 0.796 318 Q CB 1.720 30.136 28.738 -0.536 0.000 1.271 318 Q HN 0.086 8.248 8.270 -0.179 0.000 0.450 319 c N 2.318 120.702 118.600 -0.360 0.000 2.429 319 c HA -0.262 4.217 4.570 -0.153 0.000 0.277 319 c C 1.002 174.985 174.090 -0.179 0.000 1.262 319 c CA 1.488 57.697 56.329 -0.200 0.000 1.733 319 c CB 0.082 42.543 42.510 -0.081 0.000 2.010 319 c HN 0.589 8.632 8.230 -0.312 0.000 0.483 320 H N -1.633 117.413 119.070 -0.040 0.000 2.389 320 H HA -0.015 4.525 4.556 -0.027 0.000 0.299 320 H C 0.295 175.572 175.328 -0.084 0.000 1.081 320 H CA 1.269 57.291 56.048 -0.044 0.000 1.345 320 H CB -0.334 29.405 29.762 -0.038 0.000 1.393 320 H HN -0.130 7.779 8.280 -0.619 0.000 0.520 321 R N 0.153 120.449 120.500 -0.340 0.000 3.160 321 R HA -0.127 3.992 4.340 -0.368 0.000 0.266 321 R C -0.323 175.820 176.300 -0.262 0.000 1.167 321 R CA 1.457 57.341 56.100 -0.360 0.000 1.124 321 R CB 0.382 30.445 30.300 -0.395 0.000 1.034 321 R HN 0.303 8.118 8.270 -0.760 0.000 0.536 322 H N -4.010 115.042 119.070 -0.030 0.000 2.926 322 H HA 0.181 4.723 4.556 -0.023 0.000 0.249 322 H C -0.585 174.730 175.328 -0.021 0.000 0.963 322 H CA 0.132 56.168 56.048 -0.020 0.000 1.158 322 H CB 0.440 30.200 29.762 -0.003 0.000 1.445 322 H HN 0.169 8.009 8.280 -0.733 0.000 0.452 323 K N 1.720 122.321 120.400 0.334 0.000 2.569 323 K HA -0.176 4.254 4.320 0.183 0.000 0.280 323 K C -0.351 176.305 176.600 0.093 0.000 0.984 323 K CA 0.346 56.748 56.287 0.191 0.000 1.064 323 K CB 0.426 33.017 32.500 0.152 0.000 0.866 323 K HN -0.161 8.326 8.250 0.394 0.000 0.492 324 A N 3.434 126.302 122.820 0.079 0.000 2.284 324 A HA 0.123 4.481 4.320 0.064 0.000 0.317 324 A C -1.780 175.910 177.584 0.176 0.000 1.120 324 A CA -0.937 51.147 52.037 0.078 0.000 0.900 324 A CB 1.545 20.556 19.000 0.019 0.000 1.319 324 A HN 0.016 8.209 8.150 0.071 0.000 0.494 325 W N 0.091 121.380 121.300 -0.019 0.000 2.316 325 W HA 0.092 4.785 4.660 0.055 0.000 0.308 325 W C 0.799 177.346 176.519 0.046 0.000 1.106 325 W CA -1.576 55.797 57.345 0.046 0.000 1.262 325 W CB 1.085 30.599 29.460 0.091 0.000 1.233 325 W HN -0.234 8.111 8.180 0.274 0.000 0.447 326 R N 7.052 127.425 120.500 -0.211 0.000 2.152 326 R HA -0.297 3.888 4.340 -0.260 0.000 0.232 326 R C 0.846 176.742 176.300 -0.673 0.000 1.117 326 R CA 2.523 58.368 56.100 -0.425 0.000 0.981 326 R CB -0.266 29.733 30.300 -0.501 0.000 0.870 326 R HN 0.371 8.595 8.270 -0.076 0.000 0.451 327 F N -4.936 114.463 119.950 -0.918 0.000 2.512 327 F HA 0.091 4.318 4.527 -0.500 0.000 0.296 327 F C 1.398 176.700 175.800 -0.830 0.000 1.110 327 F CA 1.426 58.880 58.000 -0.910 0.000 1.446 327 F CB -0.285 38.083 39.000 -1.053 0.000 1.092 327 F HN -0.245 7.261 8.300 -1.287 0.022 0.554 328 G N 0.071 108.385 108.800 -0.811 0.000 2.599 328 G HA2 -0.535 3.575 3.960 0.250 0.000 0.219 328 G HA3 -0.535 3.925 3.960 0.429 -0.242 0.219 328 G C 0.969 176.094 174.900 0.374 0.000 1.193 328 G CA 2.551 47.719 45.100 0.113 0.000 0.778 328 G HN -0.518 7.111 8.290 -1.101 0.000 0.589 329 G N 0.782 109.774 108.800 0.320 0.000 2.513 329 G HA2 -0.477 3.602 3.960 0.198 0.000 0.219 329 G HA3 -0.477 3.587 3.960 0.174 0.000 0.219 329 G C 0.989 175.931 174.900 0.069 0.000 1.160 329 G CA 1.811 47.036 45.100 0.209 0.000 0.767 329 G HN 0.181 8.614 8.290 0.238 0.000 0.571 330 R N 1.660 122.219 120.500 0.099 0.000 2.090 330 R HA -0.218 4.161 4.340 0.065 0.000 0.228 330 R C 1.777 178.286 176.300 0.347 0.000 1.110 330 R CA 2.508 58.698 56.100 0.149 0.000 0.973 330 R CB -0.100 30.303 30.300 0.172 0.000 0.869 330 R HN -0.777 7.537 8.270 0.073 0.000 0.440 331 F N 1.586 121.632 119.950 0.161 0.000 2.102 331 F HA -0.264 4.450 4.527 0.313 0.000 0.298 331 F C 1.461 177.378 175.800 0.195 0.000 1.105 331 F CA 1.868 60.007 58.000 0.231 0.000 1.239 331 F CB -0.287 38.841 39.000 0.214 0.000 0.991 331 F HN -0.316 8.209 8.300 0.374 0.000 0.474 332 M N -1.171 118.476 119.600 0.078 0.000 2.202 332 M HA -0.493 3.837 4.480 -0.251 0.000 0.262 332 M C 1.717 177.892 176.300 -0.208 0.000 1.063 332 M CA 2.905 58.093 55.300 -0.186 0.000 1.097 332 M CB -0.413 31.945 32.600 -0.403 0.000 1.382 332 M HN 0.427 8.834 8.290 0.194 0.000 0.413 333 N N -0.436 118.189 118.700 -0.125 0.000 2.188 333 N HA -0.262 4.356 4.740 -0.205 0.000 0.184 333 N C 2.192 177.623 175.510 -0.133 0.000 1.018 333 N CA 3.393 56.344 53.050 -0.166 0.000 0.858 333 N CB -0.174 38.200 38.487 -0.188 0.000 0.989 333 N HN -0.612 7.621 8.380 -0.058 0.113 0.426 334 F N 0.938 120.860 119.950 -0.046 0.000 2.069 334 F HA -0.326 4.210 4.527 0.015 0.000 0.298 334 F C 2.205 177.973 175.800 -0.054 0.000 1.113 334 F CA 4.071 62.068 58.000 -0.005 0.000 1.214 334 F CB -0.095 38.959 39.000 0.090 0.000 0.978 334 F HN -0.671 7.765 8.300 0.226 0.000 0.474 335 I N -1.829 118.752 120.570 0.017 0.000 2.145 335 I HA -0.607 3.546 4.170 -0.029 0.000 0.244 335 I C 2.938 179.007 176.117 -0.080 0.000 1.075 335 I CA 3.714 64.951 61.300 -0.106 0.000 1.332 335 I CB -0.356 37.446 38.000 -0.331 0.000 1.033 335 I HN -0.512 7.664 8.210 -0.057 0.000 0.410 336 K N -0.987 119.317 120.400 -0.161 0.000 2.057 336 K HA -0.347 3.802 4.320 -0.285 0.000 0.206 336 K C 1.951 178.608 176.600 0.096 0.000 1.050 336 K CA 3.465 59.667 56.287 -0.141 0.000 0.935 336 K CB -0.050 32.325 32.500 -0.208 0.000 0.715 336 K HN -0.535 7.605 8.250 -0.184 0.000 0.439 337 E N -3.906 116.319 120.200 0.041 0.000 2.478 337 E HA -0.182 4.203 4.350 0.059 0.000 0.198 337 E C -0.244 176.441 176.600 0.143 0.000 1.046 337 E CA 0.351 56.786 56.400 0.060 0.000 0.870 337 E CB 0.046 29.726 29.700 -0.034 0.000 0.818 337 E HN -0.674 7.678 8.360 -0.014 0.000 0.527 338 A N -0.226 122.728 122.820 0.224 0.000 2.483 338 A HA -0.164 4.291 4.320 0.226 0.000 0.238 338 A C -1.323 176.394 177.584 0.221 0.000 1.070 338 A CA 0.958 53.148 52.037 0.254 0.000 0.770 338 A CB 0.539 19.720 19.000 0.301 0.000 1.008 338 A HN -0.751 7.344 8.150 0.232 0.194 0.497 339 Q N 0.624 120.548 119.800 0.205 0.000 2.275 339 Q HA 0.561 5.182 4.340 0.108 -0.216 0.258 339 Q C -1.566 174.591 176.000 0.262 0.000 0.960 339 Q CA -0.980 54.918 55.803 0.159 0.000 0.801 339 Q CB 1.994 30.789 28.738 0.096 0.000 1.302 339 Q HN 0.093 8.500 8.270 0.228 0.000 0.433 340 W N 4.995 126.306 121.300 0.018 0.000 3.256 340 W HA 0.164 4.851 4.660 0.045 0.000 0.324 340 W C -2.635 173.896 176.519 0.020 0.000 1.196 340 W CA -0.413 56.956 57.345 0.040 0.000 1.206 340 W CB 4.173 33.681 29.460 0.081 0.000 1.385 340 W HN -0.017 8.315 8.180 0.253 0.000 0.522 341 E N 6.129 125.959 120.200 -0.616 0.000 2.105 341 E HA 0.208 4.496 4.350 -0.335 -0.138 0.285 341 E C -0.739 175.193 176.600 -1.114 0.000 1.055 341 E CA -0.656 55.377 56.400 -0.610 0.000 0.843 341 E CB 0.201 29.623 29.700 -0.463 0.000 1.067 341 E HN 0.110 7.989 8.360 -0.800 0.000 0.398 342 G N 4.486 112.959 108.800 -0.545 0.000 2.887 342 G HA2 0.469 3.943 3.960 -0.811 0.000 0.277 342 G HA3 0.469 4.625 3.960 0.135 -0.114 0.277 342 G C -0.461 174.377 174.900 -0.105 0.000 1.346 342 G CA -1.421 43.475 45.100 -0.340 0.000 1.058 342 G HN 0.376 8.516 8.290 -0.249 0.000 0.535 343 L N -1.355 119.902 121.223 0.058 0.000 2.079 343 L HA -0.239 4.066 4.340 -0.059 0.000 0.210 343 L C 1.166 178.021 176.870 -0.026 0.000 1.081 343 L CA 2.787 57.616 54.840 -0.018 0.000 0.752 343 L CB 0.117 42.140 42.059 -0.059 0.000 0.896 343 L HN 0.129 8.803 8.230 0.209 -0.319 0.433 344 T N -7.536 107.031 114.554 0.021 0.000 3.332 344 T HA 0.058 4.502 4.350 -0.016 -0.104 0.246 344 T C 0.280 174.980 174.700 0.000 0.000 0.943 344 T CA -1.086 61.016 62.100 0.002 0.000 0.922 344 T CB -0.662 68.208 68.868 0.003 0.000 1.086 344 T HN -0.515 8.046 8.240 0.073 -0.277 0.590 345 G N 1.454 110.240 108.800 -0.025 0.000 2.553 345 G HA2 -0.538 3.390 3.960 -0.054 0.000 0.242 345 G HA3 -0.538 3.420 3.960 -0.003 0.000 0.242 345 G C -2.066 172.810 174.900 -0.040 0.000 1.277 345 G CA -0.424 44.658 45.100 -0.031 0.000 0.910 345 G HN -0.530 7.645 8.290 -0.043 0.088 0.576 346 R N 2.797 123.285 120.500 -0.021 0.000 2.343 346 R HA -0.108 4.200 4.340 -0.054 0.000 0.326 346 R C -0.443 175.855 176.300 -0.004 0.000 1.055 346 R CA 0.558 56.642 56.100 -0.026 0.000 0.961 346 R CB -0.215 30.073 30.300 -0.020 0.000 0.978 346 R HN 0.253 8.520 8.270 -0.004 0.000 0.443 347 I N 7.881 128.446 120.570 -0.008 0.000 2.359 347 I HA 0.144 4.262 4.170 -0.088 0.000 0.294 347 I C -1.817 174.198 176.117 -0.171 0.000 0.987 347 I CA -0.236 61.024 61.300 -0.067 0.000 1.225 347 I CB 2.020 40.037 38.000 0.028 0.000 1.366 347 I HN 0.192 8.405 8.210 0.005 0.000 0.466 348 V N 5.103 124.815 119.914 -0.336 0.000 3.023 348 V HA 0.373 4.268 4.120 -0.375 0.000 0.294 348 V C -2.373 173.461 176.094 -0.433 0.000 1.324 348 V CA -1.608 60.487 62.300 -0.342 0.000 0.979 348 V CB 3.419 35.185 31.823 -0.095 0.000 1.093 348 V HN 0.066 8.056 8.190 -0.334 0.000 0.434 349 F N 3.918 123.904 119.950 0.059 0.000 2.470 349 F HA 0.391 5.071 4.527 0.060 -0.116 0.329 349 F C -0.779 175.028 175.800 0.011 0.000 1.072 349 F CA -2.225 55.797 58.000 0.035 0.000 0.989 349 F CB 1.998 40.995 39.000 -0.005 0.000 1.193 349 F HN 0.189 8.481 8.300 -0.013 0.000 0.481 350 N N 2.113 120.928 118.700 0.190 0.000 2.454 350 N HA -0.208 4.576 4.740 0.073 0.000 0.260 350 N C 0.860 176.404 175.510 0.056 0.000 1.218 350 N CA 0.836 53.943 53.050 0.095 0.000 0.904 350 N CB 1.581 40.113 38.487 0.075 0.000 1.065 350 N HN -0.113 8.390 8.380 0.205 0.000 0.462 351 K N 5.364 125.776 120.400 0.019 0.000 2.148 351 K HA -0.198 4.110 4.320 -0.020 0.000 0.204 351 K C 1.568 178.119 176.600 -0.081 0.000 1.050 351 K CA 3.005 59.276 56.287 -0.026 0.000 0.942 351 K CB -0.110 32.372 32.500 -0.030 0.000 0.724 351 K HN 0.559 8.821 8.250 0.019 0.000 0.446 352 T N -4.095 110.420 114.554 -0.066 0.000 2.894 352 T HA -0.062 4.224 4.350 -0.108 0.000 0.258 352 T C 1.778 176.402 174.700 -0.127 0.000 1.043 352 T CA 2.782 64.829 62.100 -0.088 0.000 1.141 352 T CB 0.257 69.095 68.868 -0.051 0.000 0.873 352 T HN -0.511 7.881 8.240 -0.040 -0.175 0.449 353 S N 0.937 116.577 115.700 -0.100 0.000 2.470 353 S HA 0.025 4.413 4.470 -0.137 0.000 0.225 353 S C 1.616 176.058 174.600 -0.263 0.000 1.006 353 S CA 0.931 59.052 58.200 -0.132 0.000 0.934 353 S CB 1.025 64.200 63.200 -0.042 0.000 0.778 353 S HN -0.542 8.014 8.310 -0.059 -0.281 0.517 354 G N 2.479 111.145 108.800 -0.224 0.000 2.175 354 G HA2 -0.357 3.512 3.960 -0.255 0.000 0.265 354 G HA3 -0.357 3.285 3.960 -0.530 0.000 0.265 354 G C -1.465 173.372 174.900 -0.105 0.000 0.979 354 G CA 0.698 45.616 45.100 -0.304 0.000 0.663 354 G HN -0.169 8.032 8.290 -0.147 0.000 0.533 355 L N -2.033 119.207 121.223 0.028 0.000 2.357 355 L HA 0.077 4.527 4.340 0.184 0.000 0.273 355 L C -0.670 176.376 176.870 0.294 0.000 1.080 355 L CA -1.490 53.448 54.840 0.163 0.000 0.803 355 L CB 0.940 43.067 42.059 0.114 0.000 1.174 355 L HN -0.833 7.338 8.230 0.001 0.059 0.443 356 R N 1.155 121.855 120.500 0.333 0.000 3.266 356 R HA 0.208 4.821 4.340 0.217 -0.142 0.224 356 R C 0.637 177.147 176.300 0.350 0.000 1.525 356 R CA -0.635 55.627 56.100 0.268 0.000 1.364 356 R CB -1.060 29.345 30.300 0.174 0.000 1.276 356 R HN 0.234 8.702 8.270 0.331 0.000 0.660 357 T N -0.561 114.181 114.554 0.312 0.000 3.081 357 T HA -0.013 4.615 4.350 0.464 0.000 0.250 357 T C -0.531 174.301 174.700 0.219 0.000 1.100 357 T CA 0.424 62.727 62.100 0.337 0.000 1.038 357 T CB 0.438 69.437 68.868 0.219 0.000 0.962 357 T HN -0.200 8.158 8.240 0.244 0.028 0.516 358 D N 0.667 121.177 120.400 0.184 0.000 2.492 358 D HA 0.269 4.751 4.640 -0.264 0.000 0.248 358 D C -2.108 174.244 176.300 0.087 0.000 1.101 358 D CA -0.381 53.594 54.000 -0.043 0.000 0.840 358 D CB 2.526 43.293 40.800 -0.056 0.000 1.209 358 D HN -0.413 8.050 8.370 0.218 0.038 0.524 359 F N -2.444 117.517 119.950 0.018 0.000 2.877 359 F HA 0.334 4.849 4.527 -0.019 0.000 0.319 359 F C -2.926 172.902 175.800 0.047 0.000 1.174 359 F CA -1.379 56.630 58.000 0.016 0.000 0.903 359 F CB 1.732 40.745 39.000 0.021 0.000 1.357 359 F HN -0.313 7.578 8.300 -0.682 0.000 0.472 360 D N -0.017 120.568 120.400 0.310 0.000 2.502 360 D HA 0.591 5.479 4.640 0.156 -0.155 0.249 360 D C -0.992 175.508 176.300 0.332 0.000 1.092 360 D CA -0.460 53.671 54.000 0.219 0.000 0.839 360 D CB 2.596 43.456 40.800 0.099 0.000 1.264 360 D HN -0.010 8.563 8.370 0.337 0.000 0.511 361 L N 2.567 124.026 121.223 0.394 0.000 2.334 361 L HA 0.326 4.976 4.340 0.311 -0.124 0.273 361 L C -1.162 175.882 176.870 0.291 0.000 1.013 361 L CA -1.254 53.810 54.840 0.374 0.000 0.816 361 L CB 2.820 45.161 42.059 0.471 0.000 1.278 361 L HN 0.387 8.871 8.230 0.423 0.000 0.431 362 D N 2.170 122.706 120.400 0.227 0.000 2.210 362 D HA 0.269 5.113 4.640 0.143 -0.119 0.249 362 D C -0.648 175.749 176.300 0.162 0.000 1.078 362 D CA -0.557 53.539 54.000 0.159 0.000 0.875 362 D CB 1.395 42.254 40.800 0.097 0.000 1.175 362 D HN 0.360 8.858 8.370 0.214 0.000 0.440 363 I N 2.735 123.363 120.570 0.097 0.000 2.297 363 I HA 0.155 4.379 4.170 -0.134 -0.135 0.291 363 I C -0.418 175.673 176.117 -0.043 0.000 1.033 363 I CA -2.003 59.278 61.300 -0.032 0.000 1.253 363 I CB -1.080 36.904 38.000 -0.027 0.000 1.396 363 I HN -0.182 7.975 8.210 0.102 0.114 0.476 364 I N 1.932 122.456 120.570 -0.077 0.000 2.648 364 I HA 0.870 5.202 4.170 -0.011 -0.168 0.304 364 I C -1.348 174.750 176.117 -0.032 0.000 1.009 364 I CA -2.267 59.018 61.300 -0.026 0.000 1.114 364 I CB 3.444 41.454 38.000 0.017 0.000 1.293 364 I HN 0.065 8.194 8.210 -0.135 0.000 0.449 365 S N 1.227 116.924 115.700 -0.005 0.000 2.540 365 S HA 0.616 5.285 4.470 0.023 -0.186 0.275 365 S C -1.488 173.115 174.600 0.004 0.000 1.123 365 S CA -1.984 56.221 58.200 0.008 0.000 0.907 365 S CB 3.301 66.504 63.200 0.005 0.000 1.081 365 S HN 0.177 8.486 8.310 -0.001 0.000 0.476 366 L N 5.405 126.633 121.223 0.008 0.000 2.369 366 L HA 0.081 4.414 4.340 -0.012 0.000 0.279 366 L C -1.759 175.090 176.870 -0.036 0.000 1.108 366 L CA 0.039 54.873 54.840 -0.010 0.000 0.852 366 L CB 0.222 42.282 42.059 0.003 0.000 1.169 366 L HN 0.061 8.305 8.230 0.023 0.000 0.452 367 K N 5.962 126.334 120.400 -0.047 0.000 2.280 367 K HA 0.304 4.593 4.320 -0.052 0.000 0.234 367 K C 1.045 177.581 176.600 -0.106 0.000 1.028 367 K CA -2.955 53.299 56.287 -0.056 0.000 0.882 367 K CB 1.114 33.595 32.500 -0.032 0.000 1.194 367 K HN -0.124 7.987 8.250 -0.043 0.114 0.458 368 E N 0.883 121.027 120.200 -0.093 0.000 2.085 368 E HA -0.404 3.883 4.350 -0.350 -0.147 0.194 368 E C 1.044 177.559 176.600 -0.142 0.000 0.994 368 E CA 3.650 59.957 56.400 -0.154 0.000 0.801 368 E CB -0.021 29.715 29.700 0.061 0.000 0.743 368 E HN 0.505 8.836 8.360 -0.049 0.000 0.453 369 D N -6.168 114.208 120.400 -0.040 0.000 2.371 369 D HA -0.247 4.403 4.640 0.017 0.000 0.221 369 D C 0.592 176.871 176.300 -0.036 0.000 0.986 369 D CA 0.229 54.223 54.000 -0.011 0.000 0.899 369 D CB -0.186 40.619 40.800 0.008 0.000 0.902 369 D HN -0.040 8.311 8.370 -0.024 0.005 0.530 370 G N -0.885 107.873 108.800 -0.071 0.000 2.384 370 G HA2 -0.285 3.628 3.960 -0.078 0.000 0.668 370 G HA3 -0.285 3.653 3.960 -0.036 0.000 0.668 370 G C -1.997 172.884 174.900 -0.031 0.000 1.280 370 G CA -0.862 44.205 45.100 -0.055 0.000 0.992 370 G HN -0.561 7.466 8.290 -0.093 0.207 0.512 371 L N 0.964 122.181 121.223 -0.011 0.000 2.499 371 L HA -0.058 4.421 4.340 0.002 -0.138 0.273 371 L C -0.258 176.615 176.870 0.005 0.000 1.195 371 L CA 0.587 55.430 54.840 0.005 0.000 0.882 371 L CB 0.113 42.190 42.059 0.030 0.000 1.133 371 L HN 0.179 8.406 8.230 -0.006 0.000 0.483 372 E N 6.011 126.213 120.200 0.003 0.000 2.292 372 E HA 0.248 4.599 4.350 0.002 0.000 0.272 372 E C -1.954 174.648 176.600 0.004 0.000 0.881 372 E CA -1.756 54.645 56.400 0.002 0.000 0.754 372 E CB 3.882 33.580 29.700 -0.003 0.000 1.201 372 E HN 0.168 8.530 8.360 0.003 0.000 0.425 373 K N 7.666 128.069 120.400 0.005 0.000 2.315 373 K HA -0.073 4.376 4.320 0.011 -0.123 0.291 373 K C 0.271 176.876 176.600 0.009 0.000 1.074 373 K CA 0.991 57.284 56.287 0.009 0.000 0.936 373 K CB -0.685 31.821 32.500 0.010 0.000 1.049 373 K HN 0.554 8.806 8.250 0.003 0.000 0.471 374 V N 1.154 121.073 119.914 0.008 0.000 3.271 374 V HA 0.409 4.534 4.120 0.009 0.000 0.327 374 V C -1.813 174.291 176.094 0.017 0.000 1.389 374 V CA -1.511 60.794 62.300 0.009 0.000 1.156 374 V CB 0.177 32.002 31.823 0.003 0.000 1.103 374 V HN 0.199 8.391 8.190 0.004 0.000 0.453 375 G N -1.851 106.966 108.800 0.029 0.000 2.323 375 G HA2 0.280 4.314 3.960 0.042 0.000 0.291 375 G HA3 0.280 4.271 3.960 0.052 0.000 0.291 375 G C -2.774 172.173 174.900 0.078 0.000 1.278 375 G CA 0.471 45.600 45.100 0.048 0.000 0.860 375 G HN -0.849 7.404 8.290 0.029 0.054 0.504 376 V N -7.604 112.376 119.914 0.111 0.000 3.216 376 V HA 0.907 5.297 4.120 0.187 -0.157 0.302 376 V C -3.100 173.144 176.094 0.251 0.000 1.286 376 V CA -2.920 59.477 62.300 0.160 0.000 1.048 376 V CB 3.941 35.822 31.823 0.097 0.000 1.081 376 V HN 0.081 8.334 8.190 0.105 0.000 0.442 377 W N 1.439 122.772 121.300 0.055 0.000 3.274 377 W HA 0.702 5.573 4.660 0.011 -0.205 0.327 377 W C -2.475 174.029 176.519 -0.025 0.000 1.172 377 W CA -0.637 56.726 57.345 0.031 0.000 1.217 377 W CB 3.824 33.336 29.460 0.087 0.000 1.376 377 W HN -0.023 8.364 8.180 0.345 0.000 0.507 378 S N 3.515 118.707 115.700 -0.846 0.000 2.618 378 S HA 0.798 4.834 4.470 -0.909 -0.112 0.277 378 S C -1.789 171.693 174.600 -1.864 0.000 1.138 378 S CA -3.409 54.142 58.200 -1.082 0.000 0.844 378 S CB 1.905 64.798 63.200 -0.511 0.000 1.127 378 S HN -0.191 7.525 8.310 -0.990 0.000 0.474 379 P HA -0.085 3.728 4.420 -1.012 0.000 0.217 379 P C -0.178 176.782 177.300 -0.566 0.000 1.150 379 P CA 1.779 64.329 63.100 -0.917 0.000 0.832 379 P CB 0.150 31.577 31.700 -0.455 0.000 0.787 380 A N -2.264 120.277 122.820 -0.465 0.000 1.874 380 A HA -0.111 4.060 4.320 -0.247 0.000 0.214 380 A C 1.178 178.588 177.584 -0.290 0.000 1.189 380 A CA 1.639 53.496 52.037 -0.300 0.000 0.615 380 A CB 0.062 18.927 19.000 -0.224 0.000 0.830 380 A HN 0.014 7.874 8.150 -0.482 0.000 0.443 381 D N -2.944 117.251 120.400 -0.342 0.000 2.349 381 D HA 0.056 4.579 4.640 -0.195 0.000 0.215 381 D C 1.133 177.260 176.300 -0.289 0.000 1.016 381 D CA -0.117 53.726 54.000 -0.262 0.000 0.870 381 D CB 0.475 41.145 40.800 -0.217 0.000 0.917 381 D HN -0.534 7.595 8.370 -0.402 0.000 0.524 382 G N 0.079 108.595 108.800 -0.472 0.000 2.564 382 G HA2 -0.435 3.243 3.960 -0.540 0.000 0.273 382 G HA3 -0.435 3.419 3.960 -0.177 0.000 0.273 382 G C -1.556 173.178 174.900 -0.277 0.000 1.242 382 G CA -0.240 44.622 45.100 -0.396 0.000 0.951 382 G HN -0.471 7.402 8.290 -0.609 0.051 0.564 383 L N 1.145 122.420 121.223 0.087 0.000 2.418 383 L HA 0.301 4.963 4.340 0.337 -0.120 0.265 383 L C -0.417 176.499 176.870 0.076 0.000 1.143 383 L CA -0.514 54.455 54.840 0.214 0.000 0.809 383 L CB 1.348 43.550 42.059 0.238 0.000 1.124 383 L HN -0.047 8.250 8.230 0.112 0.000 0.456 384 N N 4.756 123.507 118.700 0.085 0.000 2.747 384 N HA 0.169 4.927 4.740 0.030 0.000 0.262 384 N C -1.942 173.596 175.510 0.048 0.000 1.261 384 N CA 0.072 53.147 53.050 0.042 0.000 0.809 384 N CB 1.047 39.542 38.487 0.013 0.000 1.450 384 N HN -0.020 8.435 8.380 0.124 0.000 0.560 385 I N 0.000 120.593 120.570 0.038 0.000 2.984 385 I HA 0.000 4.295 4.170 0.035 -0.103 0.288 385 I CA 0.000 61.319 61.300 0.031 0.000 1.566 385 I CB 0.000 38.016 38.000 0.027 0.000 1.214 385 I HN 0.000 8.230 8.210 0.034 0.000 0.494