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 3p26_1_B DATA FIRST_RESID 139 DATA SEQUENCE VQRYYKTTVP TKPKKPHDIS AFVKSALPHL SFVVLGHVDA GKSTLMGRLL DATA SEQUENCE YDLNIVNQSQ LRKLQRXXXX XXXXXXXXXX XXXXXXXXXX RGVTVSICTS DATA SEQUENCE HFSTHRANFT IVDAPGHRDF VPNAIMGISQ ADMAILCVDC STXXXXXGFD DATA SEQUENCE LDGQTKEHML LASSLGIHNL IIAMNKMDNV DWSQQRFEEI KSKLLPYLVD DATA SEQUENCE IGFFEDNINW VPISGFSGEG VYKIEYTDEV RQWYNGPNLM STLENAAFKI DATA SEQUENCE SKENEGINKD DPFLFSVLEI IPSKKTSNDL ALVSGKLESG SIQPGESLTI DATA SEQUENCE YPSEQSCIVD KIQVGSQQXX XXXHEETDVA IKGDFVTLKL RKAYPEDIQN DATA SEQUENCE GDLAASVDYS SIHSAQCFVL ELTTFDMNRP LLPGTPFILF IGVKEQPARI DATA SEQUENCE KRLISFIDKG NTASKKKIRH LGSKQRAFVE IELIEVKRWI PLLTAHENDR DATA SEQUENCE LGRVVLRKDG RTIAAGKISE ITQ 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 139 V HA 0.000 4.120 4.120 -0.000 0.000 0.244 139 V C 0.000 175.902 176.094 -0.320 0.000 1.182 139 V CA 0.000 62.095 62.300 -0.342 0.000 1.235 139 V CB 0.000 31.426 31.823 -0.662 0.000 1.184 140 Q N 3.434 123.093 119.800 -0.234 0.000 2.096 140 Q HA -0.001 4.337 4.340 -0.003 0.000 0.204 140 Q C 1.028 176.910 176.000 -0.196 0.000 0.982 140 Q CA 1.890 57.595 55.803 -0.164 0.000 0.850 140 Q CB 0.353 29.023 28.738 -0.114 0.000 0.901 140 Q HN 0.674 8.944 8.270 -0.000 0.000 0.422 141 R N -0.735 119.581 120.500 -0.307 0.000 2.560 141 R HA 0.215 4.554 4.340 -0.003 0.000 0.267 141 R C -1.917 174.195 176.300 -0.314 0.000 1.150 141 R CA -0.489 55.476 56.100 -0.226 0.000 0.997 141 R CB 0.745 30.974 30.300 -0.118 0.000 1.250 141 R HN 0.105 8.375 8.270 -0.000 0.000 0.433 142 Y N 1.914 122.171 120.300 -0.072 0.000 2.374 142 Y HA 0.202 4.750 4.550 -0.003 0.000 0.322 142 Y C 0.187 176.091 175.900 0.006 0.000 1.275 142 Y CA -0.463 57.594 58.100 -0.071 0.000 1.307 142 Y CB 0.774 39.193 38.460 -0.068 0.000 1.282 142 Y HN 0.503 8.783 8.280 -0.000 0.000 0.509 143 Y N 2.977 123.364 120.300 0.146 0.000 2.610 143 Y HA 0.158 4.707 4.550 -0.001 0.000 0.332 143 Y C -0.246 175.698 175.900 0.073 0.000 1.201 143 Y CA -0.002 58.151 58.100 0.090 0.000 1.465 143 Y CB 0.282 38.802 38.460 0.101 0.000 1.283 143 Y HN 0.489 8.769 8.280 -0.000 0.000 0.563 144 K N 4.568 124.654 120.400 -0.524 0.000 2.565 144 K HA 0.316 4.634 4.320 -0.003 0.000 0.251 144 K C -1.647 174.694 176.600 -0.433 0.000 0.956 144 K CA -0.602 55.505 56.287 -0.300 0.000 0.809 144 K CB 1.893 34.316 32.500 -0.129 0.000 1.267 144 K HN 0.740 8.990 8.250 -0.000 0.000 0.438 145 T N 0.359 114.781 114.554 -0.221 0.000 2.916 145 T HA 0.382 4.731 4.350 -0.003 0.000 0.292 145 T C 0.272 174.956 174.700 -0.026 0.000 1.055 145 T CA -0.295 61.727 62.100 -0.131 0.000 1.009 145 T CB 1.410 70.266 68.868 -0.020 0.000 1.118 145 T HN 0.669 8.909 8.240 -0.000 0.000 0.497 146 T N 0.058 114.606 114.554 -0.010 0.000 3.182 146 T HA 0.392 4.741 4.350 -0.003 0.000 0.277 146 T C -0.160 174.558 174.700 0.029 0.000 1.013 146 T CA -0.251 61.863 62.100 0.023 0.000 0.900 146 T CB -0.075 68.804 68.868 0.019 0.000 1.098 146 T HN 0.296 8.536 8.240 -0.000 0.000 0.543 147 V N 3.570 123.501 119.914 0.027 0.000 2.328 147 V HA 0.427 4.545 4.120 -0.003 0.000 0.278 147 V C -2.387 173.727 176.094 0.034 0.000 1.021 147 V CA -2.087 60.230 62.300 0.029 0.000 0.838 147 V CB 1.230 33.069 31.823 0.026 0.000 0.999 147 V HN 0.263 8.453 8.190 -0.000 0.000 0.447 148 P HA 0.199 4.619 4.420 -0.000 0.000 0.268 148 P C -0.014 177.290 177.300 0.006 0.000 1.205 148 P CA 0.131 63.240 63.100 0.016 0.000 0.771 148 P CB 0.374 32.081 31.700 0.013 0.000 0.858 149 T N -0.324 114.224 114.554 -0.009 0.000 2.929 149 T HA 0.467 4.816 4.350 -0.003 0.000 0.284 149 T C -0.053 174.625 174.700 -0.036 0.000 1.014 149 T CA -1.087 61.002 62.100 -0.018 0.000 1.051 149 T CB 1.100 69.955 68.868 -0.022 0.000 1.028 149 T HN 0.106 8.346 8.240 -0.000 0.000 0.485 150 K N 2.395 122.776 120.400 -0.032 0.000 2.237 150 K HA 0.369 4.688 4.320 -0.003 0.000 0.270 150 K C -2.408 174.161 176.600 -0.051 0.000 1.015 150 K CA -1.705 54.561 56.287 -0.035 0.000 0.949 150 K CB 0.320 32.806 32.500 -0.023 0.000 0.976 150 K HN 0.430 8.680 8.250 -0.000 0.000 0.472 151 P HA -0.023 4.397 4.420 -0.000 0.000 0.269 151 P C 0.107 177.381 177.300 -0.042 0.000 1.215 151 P CA -0.215 62.846 63.100 -0.065 0.000 0.780 151 P CB 0.631 32.298 31.700 -0.056 0.000 0.898 152 K N 1.451 121.821 120.400 -0.049 0.000 2.002 152 K HA -0.075 4.244 4.320 -0.003 0.000 0.209 152 K C 0.361 176.959 176.600 -0.004 0.000 1.048 152 K CA 1.813 58.081 56.287 -0.032 0.000 0.930 152 K CB -0.172 32.303 32.500 -0.041 0.000 0.714 152 K HN 0.452 8.702 8.250 -0.000 0.000 0.438 153 K N 1.429 121.845 120.400 0.026 0.000 2.527 153 K HA 0.349 4.668 4.320 -0.003 0.000 0.240 153 K C -2.739 173.968 176.600 0.179 0.000 0.989 153 K CA -2.057 54.281 56.287 0.084 0.000 0.985 153 K CB 1.411 33.993 32.500 0.136 0.000 1.221 153 K HN -0.101 8.149 8.250 -0.000 0.000 0.458 154 P HA 0.024 4.444 4.420 -0.000 0.000 0.266 154 P C -0.438 176.951 177.300 0.149 0.000 1.193 154 P CA 0.472 63.627 63.100 0.092 0.000 0.770 154 P CB 0.518 32.231 31.700 0.022 0.000 0.836 155 H N 0.157 119.198 119.070 -0.049 0.000 2.821 155 H HA 0.174 4.728 4.556 -0.003 0.000 0.373 155 H C -0.638 174.684 175.328 -0.010 0.000 1.165 155 H CA -0.620 55.411 56.048 -0.027 0.000 1.154 155 H CB 2.103 31.828 29.762 -0.060 0.000 1.765 155 H HN 0.388 8.668 8.280 -0.000 0.000 0.549 156 D N 3.275 123.740 120.400 0.108 0.000 2.374 156 D HA -0.004 4.634 4.640 -0.003 0.000 0.240 156 D C 1.361 177.745 176.300 0.140 0.000 1.229 156 D CA -0.187 53.867 54.000 0.091 0.000 0.895 156 D CB 0.364 41.202 40.800 0.062 0.000 1.046 156 D HN 0.362 8.732 8.370 -0.000 0.000 0.498 157 I N 2.549 123.179 120.570 0.101 0.000 2.118 157 I HA -0.301 3.867 4.170 -0.003 0.000 0.241 157 I C 2.265 178.478 176.117 0.160 0.000 1.070 157 I CA 0.864 62.229 61.300 0.108 0.000 1.327 157 I CB -1.512 36.518 38.000 0.049 0.000 1.034 157 I HN 0.319 8.529 8.210 -0.000 0.000 0.405 158 S N 1.565 117.330 115.700 0.109 0.000 2.359 158 S HA -0.230 4.238 4.470 -0.003 0.000 0.223 158 S C 2.287 176.951 174.600 0.107 0.000 1.039 158 S CA 1.664 59.920 58.200 0.095 0.000 1.042 158 S CB -0.750 62.489 63.200 0.064 0.000 0.915 158 S HN 0.580 8.890 8.310 -0.000 0.000 0.439 159 A N 1.151 124.035 122.820 0.107 0.000 1.908 159 A HA -0.123 4.195 4.320 -0.003 0.000 0.218 159 A C 1.954 179.610 177.584 0.120 0.000 1.181 159 A CA 1.778 53.872 52.037 0.095 0.000 0.627 159 A CB -0.999 18.052 19.000 0.085 0.000 0.818 159 A HN 0.500 8.650 8.150 -0.000 0.000 0.445 160 F N 0.840 120.817 119.950 0.045 0.000 2.171 160 F HA -0.172 4.353 4.527 -0.003 0.000 0.300 160 F C 2.119 177.937 175.800 0.029 0.000 1.090 160 F CA 1.872 59.901 58.000 0.049 0.000 1.293 160 F CB -0.218 38.818 39.000 0.060 0.000 1.013 160 F HN 0.055 8.355 8.300 -0.000 0.000 0.486 161 V N 1.058 121.077 119.914 0.176 0.000 2.214 161 V HA -0.372 3.746 4.120 -0.003 0.000 0.245 161 V C 2.352 178.414 176.094 -0.053 0.000 1.047 161 V CA 2.497 64.836 62.300 0.065 0.000 0.998 161 V CB -1.060 30.826 31.823 0.105 0.000 0.633 161 V HN 0.254 8.444 8.190 -0.000 0.000 0.446 162 K N 0.526 120.921 120.400 -0.008 0.000 2.059 162 K HA -0.241 4.078 4.320 -0.003 0.000 0.212 162 K C 2.332 178.898 176.600 -0.057 0.000 1.050 162 K CA 1.969 58.249 56.287 -0.012 0.000 0.927 162 K CB -0.511 31.996 32.500 0.012 0.000 0.714 162 K HN 0.443 8.693 8.250 -0.000 0.000 0.447 163 S N 0.003 115.638 115.700 -0.108 0.000 2.603 163 S HA 0.062 4.531 4.470 -0.003 0.000 0.229 163 S C 0.331 174.793 174.600 -0.231 0.000 0.972 163 S CA 0.098 58.212 58.200 -0.142 0.000 0.935 163 S CB -0.067 63.051 63.200 -0.137 0.000 0.769 163 S HN 0.312 8.622 8.310 -0.000 0.000 0.536 164 A N 1.254 123.899 122.820 -0.292 0.000 2.312 164 A HA 0.662 4.981 4.320 -0.003 0.000 0.326 164 A C -0.402 177.074 177.584 -0.179 0.000 1.172 164 A CA -0.659 51.183 52.037 -0.325 0.000 0.821 164 A CB 0.397 19.110 19.000 -0.478 0.000 1.166 164 A HN 0.369 8.519 8.150 -0.000 0.000 0.493 165 L N 2.650 123.777 121.223 -0.159 0.000 2.525 165 L HA 0.242 4.581 4.340 -0.003 0.000 0.278 165 L C -1.878 174.858 176.870 -0.223 0.000 1.218 165 L CA -1.005 53.736 54.840 -0.166 0.000 0.878 165 L CB -0.338 41.642 42.059 -0.132 0.000 1.127 165 L HN 0.461 8.691 8.230 -0.000 0.000 0.492 166 P HA 0.125 4.545 4.420 -0.000 0.000 0.267 166 P C -1.439 175.639 177.300 -0.371 0.000 1.200 166 P CA 0.178 63.000 63.100 -0.463 0.000 0.772 166 P CB 0.434 31.533 31.700 -1.001 0.000 0.855 167 H N 1.444 120.302 119.070 -0.354 0.000 2.717 167 H HA 0.732 5.286 4.556 -0.002 0.000 0.366 167 H C -1.787 173.383 175.328 -0.262 0.000 1.132 167 H CA -0.895 54.950 56.048 -0.339 0.000 1.180 167 H CB 0.982 30.643 29.762 -0.168 0.000 1.678 167 H HN 0.245 8.525 8.280 -0.000 0.000 0.537 168 L N 3.848 124.433 121.223 -1.065 0.000 2.464 168 L HA 0.588 4.926 4.340 -0.003 0.000 0.266 168 L C -1.211 175.383 176.870 -0.459 0.000 0.965 168 L CA -0.251 54.284 54.840 -0.509 0.000 0.833 168 L CB 2.106 44.083 42.059 -0.136 0.000 1.296 168 L HN 0.797 9.027 8.230 -0.000 0.000 0.405 169 S N 3.202 118.822 115.700 -0.134 0.000 2.578 169 S HA 0.943 5.411 4.470 -0.003 0.000 0.301 169 S C -0.630 174.040 174.600 0.116 0.000 1.091 169 S CA -0.488 57.681 58.200 -0.051 0.000 1.032 169 S CB 1.509 64.791 63.200 0.136 0.000 1.064 169 S HN 0.776 9.086 8.310 -0.000 0.000 0.508 170 F N -1.088 118.838 119.950 -0.041 0.000 2.713 170 F HA 0.829 5.354 4.527 -0.002 0.000 0.311 170 F C -1.375 174.388 175.800 -0.062 0.000 1.141 170 F CA -1.372 56.608 58.000 -0.034 0.000 0.939 170 F CB 0.968 39.953 39.000 -0.024 0.000 1.325 170 F HN 0.617 8.917 8.300 -0.000 0.000 0.453 171 V N 1.763 121.758 119.914 0.136 0.000 2.769 171 V HA 0.794 4.912 4.120 -0.003 0.000 0.312 171 V C -1.356 174.799 176.094 0.103 0.000 1.061 171 V CA -0.889 61.414 62.300 0.006 0.000 0.931 171 V CB 2.209 33.987 31.823 -0.076 0.000 1.010 171 V HN 0.807 8.997 8.190 -0.000 0.000 0.433 172 V N 7.144 127.078 119.914 0.033 0.000 2.350 172 V HA 0.487 4.606 4.120 -0.003 0.000 0.276 172 V C -0.298 175.751 176.094 -0.075 0.000 1.028 172 V CA -0.457 61.861 62.300 0.030 0.000 0.860 172 V CB 0.949 32.812 31.823 0.066 0.000 0.990 172 V HN 0.598 8.788 8.190 -0.000 0.000 0.453 173 L N 3.558 124.724 121.223 -0.095 0.000 2.304 173 L HA 1.082 5.420 4.340 -0.003 0.000 0.268 173 L C 0.511 177.436 176.870 0.092 0.000 1.010 173 L CA 0.260 55.001 54.840 -0.164 0.000 0.813 173 L CB 1.625 43.508 42.059 -0.293 0.000 1.315 173 L HN 0.919 9.149 8.230 -0.000 0.000 0.445 174 G N -0.846 108.176 108.800 0.369 0.000 2.347 174 G HA2 0.025 3.984 3.960 -0.003 0.000 0.477 174 G HA3 0.025 3.984 3.960 -0.003 0.000 0.477 174 G C -1.206 173.882 174.900 0.315 0.000 1.349 174 G CA -0.877 44.410 45.100 0.311 0.000 1.000 174 G HN 0.816 9.106 8.290 -0.000 0.000 0.605 175 H N 0.054 119.206 119.070 0.135 0.000 2.836 175 H HA 0.210 4.765 4.556 -0.003 0.000 0.368 175 H C 2.262 177.635 175.328 0.076 0.000 1.164 175 H CA 1.065 57.154 56.048 0.067 0.000 1.425 175 H CB 1.549 31.314 29.762 0.004 0.000 1.414 175 H HN 1.107 9.387 8.280 -0.000 0.000 0.614 176 V N 1.043 120.795 119.914 -0.271 0.000 2.568 176 V HA -0.178 3.941 4.120 -0.003 0.000 0.253 176 V C 0.798 176.987 176.094 0.157 0.000 1.072 176 V CA 2.152 64.422 62.300 -0.049 0.000 1.084 176 V CB -0.119 31.603 31.823 -0.169 0.000 0.676 176 V HN 0.619 8.809 8.190 -0.000 0.000 0.469 177 D N 0.274 120.951 120.400 0.462 0.000 2.388 177 D HA 0.444 5.083 4.640 -0.003 0.000 0.221 177 D C 1.806 178.177 176.300 0.118 0.000 1.133 177 D CA 0.843 54.976 54.000 0.221 0.000 0.831 177 D CB 0.924 41.813 40.800 0.149 0.000 0.962 177 D HN 0.605 8.975 8.370 -0.000 0.000 0.502 178 A N 0.066 122.972 122.820 0.143 0.000 2.016 178 A HA 0.363 4.681 4.320 -0.003 0.000 0.217 178 A C 1.821 179.414 177.584 0.015 0.000 1.162 178 A CA 1.198 53.280 52.037 0.076 0.000 0.662 178 A CB 0.024 19.091 19.000 0.111 0.000 0.812 178 A HN 0.284 8.434 8.150 -0.000 0.000 0.450 179 G N -0.933 107.873 108.800 0.010 0.000 2.154 179 G HA2 -0.207 3.752 3.960 -0.003 0.000 0.186 179 G HA3 -0.207 3.752 3.960 -0.003 0.000 0.186 179 G C 0.826 175.711 174.900 -0.025 0.000 1.000 179 G CA 0.532 45.608 45.100 -0.040 0.000 0.664 179 G HN 0.398 8.688 8.290 -0.000 0.000 0.513 180 K N 0.962 121.367 120.400 0.008 0.000 2.049 180 K HA -0.285 4.034 4.320 -0.003 0.000 0.219 180 K C 2.912 179.512 176.600 -0.001 0.000 1.056 180 K CA 2.487 58.782 56.287 0.013 0.000 0.946 180 K CB -0.525 31.995 32.500 0.033 0.000 0.723 180 K HN 0.757 9.007 8.250 -0.000 0.000 0.453 181 S N 0.702 116.399 115.700 -0.005 0.000 2.355 181 S HA -0.181 4.288 4.470 -0.003 0.000 0.222 181 S C 2.381 176.966 174.600 -0.025 0.000 1.031 181 S CA 1.970 60.163 58.200 -0.011 0.000 0.993 181 S CB -1.173 62.022 63.200 -0.008 0.000 0.859 181 S HN 0.543 8.853 8.310 -0.000 0.000 0.453 182 T N 1.269 115.796 114.554 -0.045 0.000 2.720 182 T HA -0.120 4.229 4.350 -0.003 0.000 0.268 182 T C 1.792 176.455 174.700 -0.061 0.000 1.037 182 T CA 1.417 63.475 62.100 -0.070 0.000 1.144 182 T CB -0.952 67.843 68.868 -0.123 0.000 0.864 182 T HN 0.264 8.504 8.240 -0.000 0.000 0.444 183 L N 0.266 121.456 121.223 -0.055 0.000 2.042 183 L HA 0.045 4.384 4.340 -0.003 0.000 0.210 183 L C 2.498 179.356 176.870 -0.021 0.000 1.076 183 L CA 1.901 56.717 54.840 -0.040 0.000 0.749 183 L CB -0.972 41.067 42.059 -0.034 0.000 0.893 183 L HN 0.209 8.439 8.230 -0.000 0.000 0.432 184 M N -0.400 119.193 119.600 -0.011 0.000 2.117 184 M HA -0.070 4.408 4.480 -0.003 0.000 0.262 184 M C 2.256 178.549 176.300 -0.011 0.000 1.065 184 M CA 1.575 56.873 55.300 -0.003 0.000 1.114 184 M CB -2.085 30.519 32.600 0.005 0.000 1.361 184 M HN 0.424 8.714 8.290 -0.000 0.000 0.408 185 G N -0.263 108.531 108.800 -0.011 0.000 2.480 185 G HA2 -0.301 3.657 3.960 -0.003 0.000 0.216 185 G HA3 -0.301 3.657 3.960 -0.003 0.000 0.216 185 G C 1.687 176.603 174.900 0.026 0.000 1.200 185 G CA 1.415 46.515 45.100 -0.001 0.000 0.782 185 G HN 0.350 8.640 8.290 -0.000 0.000 0.554 186 R N 0.181 120.684 120.500 0.005 0.000 2.096 186 R HA -0.056 4.282 4.340 -0.003 0.000 0.240 186 R C 2.423 178.778 176.300 0.091 0.000 1.139 186 R CA 1.604 57.732 56.100 0.045 0.000 0.952 186 R CB -1.061 29.246 30.300 0.013 0.000 0.854 186 R HN 0.354 8.624 8.270 -0.000 0.000 0.436 187 L N 0.164 121.400 121.223 0.020 0.000 2.012 187 L HA -0.079 4.260 4.340 -0.003 0.000 0.210 187 L C 2.031 178.855 176.870 -0.077 0.000 1.073 187 L CA 1.815 56.635 54.840 -0.033 0.000 0.748 187 L CB -0.478 41.515 42.059 -0.109 0.000 0.891 187 L HN 0.321 8.551 8.230 -0.000 0.000 0.431 188 L N -2.058 119.119 121.223 -0.077 0.000 2.141 188 L HA -0.209 4.129 4.340 -0.003 0.000 0.209 188 L C 2.494 179.367 176.870 0.006 0.000 1.094 188 L CA 1.288 56.075 54.840 -0.089 0.000 0.763 188 L CB -0.892 41.136 42.059 -0.051 0.000 0.908 188 L HN 0.351 8.581 8.230 -0.000 0.000 0.437 189 Y N 1.334 121.604 120.300 -0.050 0.000 2.145 189 Y HA -0.289 4.259 4.550 -0.003 0.000 0.286 189 Y C 2.245 178.128 175.900 -0.029 0.000 1.145 189 Y CA 1.752 59.833 58.100 -0.030 0.000 1.148 189 Y CB -0.219 38.226 38.460 -0.024 0.000 0.981 189 Y HN 0.168 8.448 8.280 -0.000 0.000 0.507 190 D N 0.238 120.650 120.400 0.020 0.000 2.309 190 D HA -0.131 4.507 4.640 -0.003 0.000 0.212 190 D C 1.826 178.081 176.300 -0.076 0.000 0.968 190 D CA 1.134 55.084 54.000 -0.085 0.000 0.882 190 D CB -0.128 40.702 40.800 0.051 0.000 0.918 190 D HN 0.439 8.809 8.370 -0.000 0.000 0.503 191 L N -0.278 120.925 121.223 -0.033 0.000 2.558 191 L HA 0.033 4.372 4.340 -0.003 0.000 0.225 191 L C 0.205 177.046 176.870 -0.048 0.000 1.128 191 L CA 0.031 54.869 54.840 -0.002 0.000 0.868 191 L CB -0.080 41.927 42.059 -0.086 0.000 1.006 191 L HN -0.095 8.135 8.230 -0.000 0.000 0.454 192 N N -1.078 117.539 118.700 -0.137 0.000 2.782 192 N HA -0.225 4.513 4.740 -0.003 0.000 0.251 192 N C 0.610 176.086 175.510 -0.056 0.000 1.101 192 N CA 0.754 53.722 53.050 -0.138 0.000 0.764 192 N CB -1.496 36.927 38.487 -0.107 0.000 1.122 192 N HN 0.306 8.686 8.380 -0.000 0.000 0.561 193 I N -1.441 119.109 120.570 -0.034 0.000 3.427 193 I HA 0.049 4.217 4.170 -0.003 0.000 0.288 193 I C 0.253 176.381 176.117 0.018 0.000 1.249 193 I CA 0.512 61.815 61.300 0.004 0.000 1.421 193 I CB 0.355 38.361 38.000 0.011 0.000 1.086 193 I HN -0.099 8.111 8.210 -0.000 0.000 0.448 194 V N 1.285 121.216 119.914 0.030 0.000 2.604 194 V HA 0.292 4.410 4.120 -0.003 0.000 0.305 194 V C -0.310 175.872 176.094 0.147 0.000 1.043 194 V CA -0.984 61.368 62.300 0.087 0.000 0.888 194 V CB 1.818 33.712 31.823 0.117 0.000 0.995 194 V HN 0.132 8.322 8.190 -0.000 0.000 0.429 195 N N 1.981 120.760 118.700 0.132 0.000 2.371 195 N HA 0.065 4.803 4.740 -0.003 0.000 0.243 195 N C 0.990 176.666 175.510 0.277 0.000 1.287 195 N CA 0.036 53.179 53.050 0.155 0.000 0.911 195 N CB 0.422 38.963 38.487 0.091 0.000 1.142 195 N HN 0.829 9.209 8.380 -0.000 0.000 0.451 196 Q N 0.682 120.656 119.800 0.290 0.000 2.050 196 Q HA -0.198 4.140 4.340 -0.003 0.000 0.202 196 Q C 1.525 177.557 176.000 0.054 0.000 0.980 196 Q CA 2.177 58.107 55.803 0.211 0.000 0.840 196 Q CB -0.053 28.797 28.738 0.187 0.000 0.898 196 Q HN 0.762 9.032 8.270 -0.000 0.000 0.424 197 S N 0.005 115.741 115.700 0.060 0.000 2.356 197 S HA -0.247 4.222 4.470 -0.003 0.000 0.223 197 S C 1.927 176.540 174.600 0.022 0.000 1.032 197 S CA 1.330 59.548 58.200 0.030 0.000 1.005 197 S CB -0.590 62.629 63.200 0.032 0.000 0.867 197 S HN 0.492 8.802 8.310 -0.000 0.000 0.449 198 Q N 0.614 120.438 119.800 0.039 0.000 2.077 198 Q HA -0.122 4.216 4.340 -0.003 0.000 0.206 198 Q C 2.290 178.296 176.000 0.011 0.000 0.989 198 Q CA 1.733 57.555 55.803 0.032 0.000 0.853 198 Q CB -0.485 28.283 28.738 0.051 0.000 0.907 198 Q HN 0.544 8.814 8.270 -0.000 0.000 0.418 199 L N 0.763 121.984 121.223 -0.003 0.000 1.976 199 L HA -0.201 4.137 4.340 -0.003 0.000 0.209 199 L C 2.392 179.216 176.870 -0.076 0.000 1.071 199 L CA 1.788 56.582 54.840 -0.076 0.000 0.746 199 L CB -0.379 41.529 42.059 -0.252 0.000 0.890 199 L HN 0.053 8.283 8.230 -0.000 0.000 0.432 200 R N -0.607 119.848 120.500 -0.074 0.000 2.139 200 R HA -0.262 4.076 4.340 -0.003 0.000 0.243 200 R C 2.296 178.585 176.300 -0.020 0.000 1.145 200 R CA 1.812 57.885 56.100 -0.046 0.000 0.976 200 R CB -0.120 30.162 30.300 -0.030 0.000 0.866 200 R HN 0.299 8.569 8.270 -0.000 0.000 0.449 201 K N 0.626 121.019 120.400 -0.013 0.000 1.965 201 K HA -0.100 4.218 4.320 -0.003 0.000 0.214 201 K C 1.967 178.564 176.600 -0.004 0.000 1.046 201 K CA 1.490 57.775 56.287 -0.002 0.000 0.944 201 K CB -0.407 32.095 32.500 0.004 0.000 0.726 201 K HN 0.124 8.374 8.250 -0.000 0.000 0.441 202 L N 1.310 122.527 121.223 -0.010 0.000 2.263 202 L HA -0.207 4.132 4.340 -0.003 0.000 0.216 202 L C 1.454 178.315 176.870 -0.015 0.000 1.111 202 L CA 0.864 55.697 54.840 -0.012 0.000 0.773 202 L CB -0.625 41.423 42.059 -0.018 0.000 0.906 202 L HN 0.352 8.582 8.230 -0.000 0.000 0.439 203 Q N 1.067 120.857 119.800 -0.016 0.000 2.362 203 Q HA -0.046 4.292 4.340 -0.003 0.000 0.210 203 Q C 0.735 176.746 176.000 0.019 0.000 0.924 203 Q CA 0.318 56.119 55.803 -0.003 0.000 0.982 203 Q CB -0.545 28.195 28.738 0.004 0.000 1.028 203 Q HN 0.444 8.714 8.270 -0.000 0.000 0.482 230 G N 1.342 110.165 108.800 0.038 0.000 2.464 230 G HA2 0.114 4.072 3.960 -0.003 0.000 0.231 230 G HA3 0.114 4.072 3.960 -0.003 0.000 0.231 230 G C 1.123 176.045 174.900 0.037 0.000 1.267 230 G CA 0.002 45.124 45.100 0.037 0.000 0.863 230 G HN 0.046 8.336 8.290 -0.000 0.000 0.559 231 V N 1.495 121.430 119.914 0.034 0.000 2.324 231 V HA -0.117 4.001 4.120 -0.003 0.000 0.250 231 V C 1.969 178.085 176.094 0.038 0.000 1.060 231 V CA 2.304 64.623 62.300 0.032 0.000 1.042 231 V CB -1.080 30.760 31.823 0.029 0.000 0.650 231 V HN 0.965 9.155 8.190 -0.000 0.000 0.450 232 T N -1.427 113.151 114.554 0.040 0.000 2.770 232 T HA 0.666 5.014 4.350 -0.003 0.000 0.283 232 T C -0.851 173.878 174.700 0.049 0.000 0.988 232 T CA -0.539 61.589 62.100 0.047 0.000 0.957 232 T CB 1.580 70.474 68.868 0.043 0.000 0.930 232 T HN -0.085 8.155 8.240 -0.000 0.000 0.443 233 V N 3.850 123.798 119.914 0.057 0.000 2.427 233 V HA 0.462 4.581 4.120 -0.003 0.000 0.286 233 V C 1.217 177.336 176.094 0.042 0.000 1.034 233 V CA -0.128 62.200 62.300 0.048 0.000 0.893 233 V CB 1.528 33.380 31.823 0.048 0.000 0.982 233 V HN 1.161 9.351 8.190 -0.000 0.000 0.452 234 S N 4.439 120.156 115.700 0.029 0.000 2.564 234 S HA 0.378 4.846 4.470 -0.003 0.000 0.231 234 S C 0.361 174.961 174.600 0.001 0.000 1.067 234 S CA 0.081 58.295 58.200 0.023 0.000 0.908 234 S CB 0.202 63.420 63.200 0.029 0.000 0.809 234 S HN 0.731 9.041 8.310 -0.000 0.000 0.491 235 I N -1.470 119.099 120.570 -0.002 0.000 3.006 235 I HA 0.757 4.925 4.170 -0.003 0.000 0.306 235 I C -1.653 174.441 176.117 -0.037 0.000 1.250 235 I CA -1.336 59.949 61.300 -0.026 0.000 0.996 235 I CB 1.874 39.868 38.000 -0.009 0.000 1.261 235 I HN -0.017 8.193 8.210 -0.000 0.000 0.442 236 C N 2.306 121.561 119.300 -0.075 0.000 2.411 236 C HA 0.874 5.332 4.460 -0.003 0.000 0.330 236 C C 0.594 175.491 174.990 -0.156 0.000 1.224 236 C CA -0.083 58.883 59.018 -0.088 0.000 1.770 236 C CB 1.238 28.928 27.740 -0.084 0.000 2.297 236 C HN 0.931 9.161 8.230 -0.000 0.000 0.507 237 T N -0.097 114.348 114.554 -0.182 0.000 2.926 237 T HA 0.851 5.199 4.350 -0.003 0.000 0.289 237 T C -0.758 173.768 174.700 -0.290 0.000 1.054 237 T CA -0.564 61.325 62.100 -0.350 0.000 1.015 237 T CB 1.605 70.168 68.868 -0.509 0.000 1.167 237 T HN 0.607 8.847 8.240 -0.000 0.000 0.526 238 S N 0.650 116.094 115.700 -0.427 0.000 2.626 238 S HA 0.387 4.855 4.470 -0.003 0.000 0.275 238 S C -1.307 173.109 174.600 -0.305 0.000 1.175 238 S CA -0.899 57.168 58.200 -0.222 0.000 0.982 238 S CB 0.655 63.804 63.200 -0.084 0.000 1.093 238 S HN 0.749 9.059 8.310 -0.000 0.000 0.472 239 H N 2.436 121.506 119.070 0.001 0.000 2.463 239 H HA 0.722 5.277 4.556 -0.002 0.000 0.332 239 H C -0.530 174.892 175.328 0.156 0.000 1.127 239 H CA -0.373 55.673 56.048 -0.003 0.000 1.238 239 H CB 1.408 31.167 29.762 -0.004 0.000 1.478 239 H HN 0.707 8.987 8.280 -0.000 0.000 0.499 240 F N -1.083 118.990 119.950 0.206 0.000 2.713 240 F HA 0.627 5.152 4.527 -0.003 0.000 0.311 240 F C -1.362 174.587 175.800 0.248 0.000 1.141 240 F CA -0.834 57.278 58.000 0.187 0.000 0.939 240 F CB 1.381 40.462 39.000 0.135 0.000 1.325 240 F HN 0.303 8.603 8.300 -0.000 0.000 0.453 241 S N -0.006 115.997 115.700 0.504 0.000 2.632 241 S HA 0.825 5.293 4.470 -0.003 0.000 0.289 241 S C -0.655 174.209 174.600 0.441 0.000 1.115 241 S CA -0.349 58.075 58.200 0.373 0.000 0.889 241 S CB 2.081 65.404 63.200 0.204 0.000 1.116 241 S HN 1.030 9.340 8.310 -0.000 0.000 0.486 242 T N -1.739 113.027 114.554 0.354 0.000 2.807 242 T HA 0.415 4.763 4.350 -0.003 0.000 0.277 242 T C 1.027 175.859 174.700 0.221 0.000 1.006 242 T CA -0.650 61.629 62.100 0.299 0.000 1.006 242 T CB 0.521 69.534 68.868 0.241 0.000 1.274 242 T HN 0.828 9.068 8.240 -0.000 0.000 0.569 243 H N 0.130 119.310 119.070 0.184 0.000 2.546 243 H HA 0.181 4.735 4.556 -0.003 0.000 0.277 243 H C 1.475 176.888 175.328 0.142 0.000 1.004 243 H CA 0.585 56.717 56.048 0.140 0.000 1.231 243 H CB -0.026 29.810 29.762 0.124 0.000 1.382 243 H HN 0.578 8.858 8.280 -0.000 0.000 0.580 244 R N 0.403 120.695 120.500 -0.347 0.000 2.175 244 R HA 0.461 4.799 4.340 -0.003 0.000 0.202 244 R C 0.470 176.726 176.300 -0.072 0.000 1.018 244 R CA 0.683 56.685 56.100 -0.163 0.000 1.029 244 R CB 0.760 30.991 30.300 -0.115 0.000 0.959 244 R HN 0.305 8.575 8.270 -0.000 0.000 0.480 245 A N 0.538 123.302 122.820 -0.094 0.000 2.610 245 A HA 0.489 4.808 4.320 -0.003 0.000 0.291 245 A C -1.609 175.766 177.584 -0.348 0.000 1.086 245 A CA -0.928 50.905 52.037 -0.340 0.000 0.677 245 A CB 1.312 19.976 19.000 -0.560 0.000 1.278 245 A HN 0.009 8.159 8.150 -0.000 0.000 0.414 246 N N -0.132 118.240 118.700 -0.546 0.000 2.405 246 N HA 0.793 5.532 4.740 -0.003 0.000 0.299 246 N C -1.643 173.374 175.510 -0.822 0.000 1.075 246 N CA 0.202 53.026 53.050 -0.376 0.000 0.884 246 N CB 1.334 39.803 38.487 -0.030 0.000 1.194 246 N HN 0.459 8.838 8.380 -0.000 0.000 0.491 247 F N -0.494 119.213 119.950 -0.405 0.000 2.613 247 F HA 0.460 4.985 4.527 -0.003 0.000 0.314 247 F C 0.131 175.555 175.800 -0.627 0.000 1.075 247 F CA -0.503 57.083 58.000 -0.690 0.000 0.945 247 F CB 2.283 40.610 39.000 -1.122 0.000 1.310 247 F HN 0.096 8.396 8.300 -0.000 0.000 0.467 248 T N 3.635 117.941 114.554 -0.413 0.000 3.031 248 T HA 0.477 4.825 4.350 -0.003 0.000 0.305 248 T C -0.887 173.367 174.700 -0.742 0.000 0.985 248 T CA -0.487 61.270 62.100 -0.571 0.000 1.008 248 T CB 0.934 69.468 68.868 -0.558 0.000 1.005 248 T HN 0.197 8.437 8.240 -0.000 0.000 0.444 249 I N 4.159 124.314 120.570 -0.693 0.000 2.371 249 I HA 0.403 4.571 4.170 -0.003 0.000 0.290 249 I C 0.692 176.482 176.117 -0.544 0.000 1.028 249 I CA -0.928 59.931 61.300 -0.735 0.000 1.345 249 I CB 0.564 38.317 38.000 -0.412 0.000 1.407 249 I HN 0.420 8.630 8.210 -0.000 0.000 0.501 250 V N 3.062 122.698 119.914 -0.464 0.000 2.547 250 V HA 0.782 4.900 4.120 -0.003 0.000 0.299 250 V C -0.647 175.314 176.094 -0.221 0.000 1.040 250 V CA -0.357 61.750 62.300 -0.321 0.000 0.913 250 V CB 2.345 34.032 31.823 -0.226 0.000 0.992 250 V HN 0.789 8.979 8.190 -0.000 0.000 0.449 251 D N 1.904 122.198 120.400 -0.176 0.000 2.596 251 D HA 0.763 5.402 4.640 -0.003 0.000 0.262 251 D C -0.575 175.652 176.300 -0.120 0.000 1.210 251 D CA 0.067 53.983 54.000 -0.140 0.000 0.873 251 D CB 2.576 43.300 40.800 -0.128 0.000 1.408 251 D HN 1.049 9.419 8.370 -0.000 0.000 0.441 252 A N 1.310 124.059 122.820 -0.118 0.000 2.269 252 A HA 0.648 4.967 4.320 -0.003 0.000 0.327 252 A C -1.737 175.754 177.584 -0.155 0.000 1.112 252 A CA -1.039 50.930 52.037 -0.114 0.000 0.865 252 A CB 0.423 19.362 19.000 -0.101 0.000 1.227 252 A HN 0.452 8.602 8.150 -0.000 0.000 0.498 253 P HA -0.285 4.135 4.420 -0.000 0.000 0.226 253 P C 1.176 178.214 177.300 -0.435 0.000 1.154 253 P CA 3.350 66.222 63.100 -0.379 0.000 0.901 253 P CB 0.119 31.466 31.700 -0.587 0.000 0.788 254 G N -1.943 106.660 108.800 -0.329 0.000 2.317 254 G HA2 -0.297 3.662 3.960 -0.003 0.000 0.227 254 G HA3 -0.297 3.662 3.960 -0.003 0.000 0.227 254 G C 0.857 175.693 174.900 -0.106 0.000 1.042 254 G CA 0.386 45.380 45.100 -0.177 0.000 0.623 254 G HN 0.623 8.913 8.290 -0.000 0.000 0.509 255 H N 1.061 120.137 119.070 0.011 0.000 2.553 255 H HA 0.353 4.907 4.556 -0.003 0.000 0.269 255 H C 1.098 176.440 175.328 0.023 0.000 1.011 255 H CA 0.340 56.398 56.048 0.017 0.000 1.150 255 H CB 0.148 29.920 29.762 0.016 0.000 1.339 255 H HN 0.409 8.689 8.280 -0.000 0.000 0.604 256 R N 1.038 121.586 120.500 0.079 0.000 2.691 256 R HA 0.198 4.536 4.340 -0.003 0.000 0.259 256 R C -0.515 175.827 176.300 0.070 0.000 1.048 256 R CA -0.933 55.229 56.100 0.104 0.000 1.086 256 R CB 0.909 31.245 30.300 0.060 0.000 1.166 256 R HN 0.148 8.418 8.270 -0.000 0.000 0.526 257 D N 0.620 121.070 120.400 0.084 0.000 2.344 257 D HA -0.006 4.633 4.640 -0.003 0.000 0.244 257 D C 0.887 177.244 176.300 0.095 0.000 1.134 257 D CA -0.166 53.892 54.000 0.096 0.000 0.930 257 D CB 0.510 41.371 40.800 0.101 0.000 1.175 257 D HN 0.365 8.735 8.370 -0.000 0.000 0.437 258 F N 1.354 121.290 119.950 -0.023 0.000 2.063 258 F HA -0.358 4.168 4.527 -0.002 0.000 0.297 258 F C 1.908 177.694 175.800 -0.023 0.000 1.099 258 F CA 1.910 59.886 58.000 -0.041 0.000 1.220 258 F CB -0.118 38.816 39.000 -0.109 0.000 0.972 258 F HN 0.184 8.484 8.300 -0.000 0.000 0.487 259 V N 0.199 120.172 119.914 0.100 0.000 2.221 259 V HA -0.184 3.934 4.120 -0.003 0.000 0.242 259 V C -0.312 175.683 176.094 -0.164 0.000 1.041 259 V CA 2.006 64.279 62.300 -0.046 0.000 0.995 259 V CB -2.305 29.483 31.823 -0.059 0.000 0.635 259 V HN 0.183 8.373 8.190 -0.000 0.000 0.448 260 P HA -0.182 4.238 4.420 -0.000 0.000 0.216 260 P C 1.425 178.705 177.300 -0.034 0.000 1.153 260 P CA 2.051 65.125 63.100 -0.043 0.000 0.858 260 P CB -0.191 31.589 31.700 0.134 0.000 0.789 261 N N 0.199 118.870 118.700 -0.049 0.000 2.018 261 N HA -0.223 4.516 4.740 -0.003 0.000 0.196 261 N C 1.643 177.074 175.510 -0.132 0.000 1.043 261 N CA 2.303 55.302 53.050 -0.085 0.000 0.856 261 N CB -1.127 37.302 38.487 -0.097 0.000 1.042 261 N HN 0.003 8.383 8.380 -0.000 0.000 0.423 262 A N 0.402 123.103 122.820 -0.198 0.000 1.877 262 A HA -0.063 4.255 4.320 -0.003 0.000 0.216 262 A C 2.490 179.982 177.584 -0.154 0.000 1.186 262 A CA 1.495 53.396 52.037 -0.227 0.000 0.620 262 A CB -0.897 17.943 19.000 -0.267 0.000 0.822 262 A HN 0.462 8.612 8.150 -0.000 0.000 0.443 263 I N -0.932 119.558 120.570 -0.133 0.000 2.179 263 I HA -0.326 3.842 4.170 -0.003 0.000 0.242 263 I C 2.784 178.880 176.117 -0.035 0.000 1.088 263 I CA 1.702 62.947 61.300 -0.091 0.000 1.357 263 I CB -0.363 37.554 38.000 -0.139 0.000 1.051 263 I HN 0.362 8.572 8.210 -0.000 0.000 0.409 264 M N 0.272 119.862 119.600 -0.018 0.000 2.065 264 M HA -0.185 4.293 4.480 -0.003 0.000 0.259 264 M C 2.373 178.660 176.300 -0.023 0.000 1.069 264 M CA 2.355 57.656 55.300 0.003 0.000 1.110 264 M CB -0.920 31.686 32.600 0.008 0.000 1.328 264 M HN 0.387 8.677 8.290 -0.000 0.000 0.405 265 G N 0.126 108.891 108.800 -0.059 0.000 2.404 265 G HA2 -0.144 3.815 3.960 -0.003 0.000 0.215 265 G HA3 -0.144 3.815 3.960 -0.003 0.000 0.215 265 G C 1.460 176.324 174.900 -0.060 0.000 1.174 265 G CA 0.568 45.625 45.100 -0.072 0.000 0.780 265 G HN 0.395 8.685 8.290 -0.000 0.000 0.537 266 I N 1.946 122.470 120.570 -0.077 0.000 2.208 266 I HA -0.224 3.944 4.170 -0.003 0.000 0.245 266 I C 3.113 179.217 176.117 -0.022 0.000 1.097 266 I CA 1.616 62.881 61.300 -0.058 0.000 1.363 266 I CB -0.333 37.626 38.000 -0.068 0.000 1.051 266 I HN 0.370 8.580 8.210 -0.000 0.000 0.413 267 S N 0.355 116.045 115.700 -0.016 0.000 2.469 267 S HA -0.160 4.308 4.470 -0.003 0.000 0.238 267 S C 1.576 176.175 174.600 -0.002 0.000 0.998 267 S CA 0.836 59.032 58.200 -0.005 0.000 0.957 267 S CB -0.096 63.107 63.200 0.005 0.000 0.764 267 S HN 0.467 8.777 8.310 -0.000 0.000 0.514 268 Q N 0.466 120.278 119.800 0.020 0.000 2.159 268 Q HA 0.547 4.885 4.340 -0.003 0.000 0.217 268 Q C -0.003 176.081 176.000 0.140 0.000 0.818 268 Q CA 0.262 56.102 55.803 0.061 0.000 1.008 268 Q CB 0.889 29.696 28.738 0.115 0.000 1.148 268 Q HN 0.642 8.912 8.270 -0.000 0.000 0.491 269 A N 0.511 123.380 122.820 0.082 0.000 2.350 269 A HA 0.440 4.758 4.320 -0.003 0.000 0.324 269 A C 0.270 177.909 177.584 0.092 0.000 1.118 269 A CA -0.519 51.577 52.037 0.098 0.000 0.783 269 A CB 0.987 20.014 19.000 0.046 0.000 1.236 269 A HN -0.120 8.030 8.150 -0.000 0.000 0.457 270 D N 0.902 121.373 120.400 0.118 0.000 2.104 270 D HA -0.081 4.557 4.640 -0.003 0.000 0.194 270 D C 0.927 177.294 176.300 0.112 0.000 0.994 270 D CA 2.544 56.610 54.000 0.110 0.000 0.830 270 D CB -0.123 40.743 40.800 0.111 0.000 0.959 270 D HN 0.769 9.139 8.370 -0.000 0.000 0.452 271 M N -2.515 117.160 119.600 0.125 0.000 2.924 271 M HA 0.654 5.133 4.480 -0.003 0.000 0.271 271 M C -1.942 174.420 176.300 0.104 0.000 1.280 271 M CA -1.082 54.281 55.300 0.105 0.000 0.813 271 M CB 2.550 35.204 32.600 0.091 0.000 1.658 271 M HN -0.214 8.076 8.290 -0.000 0.000 0.467 272 A N 0.977 123.820 122.820 0.038 0.000 2.413 272 A HA 0.889 5.208 4.320 -0.003 0.000 0.307 272 A C -1.251 176.293 177.584 -0.067 0.000 1.087 272 A CA -0.830 51.212 52.037 0.009 0.000 0.750 272 A CB 1.395 20.373 19.000 -0.036 0.000 1.296 272 A HN 0.810 8.960 8.150 -0.000 0.000 0.423 273 I N 1.717 122.254 120.570 -0.054 0.000 2.336 273 I HA 0.298 4.466 4.170 -0.003 0.000 0.292 273 I C -0.894 175.167 176.117 -0.093 0.000 0.991 273 I CA -0.669 60.560 61.300 -0.119 0.000 1.227 273 I CB 1.638 39.559 38.000 -0.132 0.000 1.366 273 I HN 0.550 8.760 8.210 -0.000 0.000 0.466 274 L N 7.737 128.884 121.223 -0.126 0.000 2.280 274 L HA 0.442 4.781 4.340 -0.003 0.000 0.287 274 L C -0.614 176.225 176.870 -0.052 0.000 1.023 274 L CA -0.067 54.726 54.840 -0.078 0.000 0.819 274 L CB 0.923 42.916 42.059 -0.109 0.000 1.212 274 L HN 0.607 8.837 8.230 -0.000 0.000 0.420 275 C N 4.789 124.091 119.300 0.003 0.000 2.415 275 C HA 0.625 5.084 4.460 -0.003 0.000 0.369 275 C C 0.101 175.120 174.990 0.048 0.000 1.279 275 C CA -0.647 58.380 59.018 0.015 0.000 1.886 275 C CB 0.307 28.065 27.740 0.030 0.000 2.468 275 C HN 0.601 8.831 8.230 -0.000 0.000 0.553 276 V N 4.329 124.260 119.914 0.028 0.000 2.483 276 V HA 0.292 4.410 4.120 -0.003 0.000 0.297 276 V C -0.103 176.012 176.094 0.035 0.000 1.027 276 V CA -0.438 61.901 62.300 0.064 0.000 0.855 276 V CB 1.667 33.509 31.823 0.031 0.000 0.995 276 V HN 0.836 9.026 8.190 -0.000 0.000 0.424 277 D N 3.115 123.556 120.400 0.069 0.000 2.348 277 D HA 0.089 4.728 4.640 -0.003 0.000 0.253 277 D C 0.521 176.853 176.300 0.053 0.000 1.161 277 D CA -0.139 53.882 54.000 0.034 0.000 0.876 277 D CB 1.701 42.513 40.800 0.020 0.000 1.160 277 D HN 0.646 9.016 8.370 -0.000 0.000 0.459 278 C N 2.406 121.700 119.300 -0.009 0.000 2.791 278 C HA 0.133 4.591 4.460 -0.003 0.000 0.270 278 C C 0.944 175.935 174.990 0.002 0.000 1.257 278 C CA -0.420 58.579 59.018 -0.032 0.000 1.699 278 C CB -1.287 26.409 27.740 -0.074 0.000 1.904 278 C HN 0.493 8.723 8.230 -0.000 0.000 0.603 279 S N 2.432 118.142 115.700 0.016 0.000 2.558 279 S HA 0.216 4.685 4.470 -0.003 0.000 0.288 279 S C 0.936 175.553 174.600 0.029 0.000 1.318 279 S CA 0.128 58.341 58.200 0.021 0.000 1.056 279 S CB 0.369 63.584 63.200 0.026 0.000 0.853 279 S HN 0.729 9.039 8.310 -0.000 0.000 0.505 287 F N 3.675 123.594 119.950 -0.052 0.000 2.402 287 F HA 0.493 5.018 4.527 -0.003 0.000 0.355 287 F C -0.441 175.319 175.800 -0.067 0.000 1.123 287 F CA -1.077 56.887 58.000 -0.060 0.000 1.021 287 F CB 1.259 40.224 39.000 -0.059 0.000 1.160 287 F HN 0.363 8.663 8.300 -0.000 0.000 0.451 288 D N 7.264 127.277 120.400 -0.646 0.000 2.316 288 D HA 0.103 4.741 4.640 -0.003 0.000 0.245 288 D C -0.715 174.987 176.300 -0.997 0.000 1.171 288 D CA -0.463 53.165 54.000 -0.619 0.000 0.856 288 D CB 1.902 42.480 40.800 -0.370 0.000 1.090 288 D HN 0.478 8.848 8.370 -0.000 0.000 0.476 289 L N 4.546 125.332 121.223 -0.728 0.000 2.342 289 L HA 0.138 4.477 4.340 -0.003 0.000 0.285 289 L C 0.045 176.683 176.870 -0.388 0.000 1.095 289 L CA -0.504 53.993 54.840 -0.572 0.000 0.843 289 L CB 0.039 41.865 42.059 -0.387 0.000 1.201 289 L HN 0.381 8.611 8.230 -0.000 0.000 0.445 290 D N 2.935 123.143 120.400 -0.320 0.000 2.361 290 D HA 0.059 4.698 4.640 -0.003 0.000 0.239 290 D C 1.045 177.246 176.300 -0.165 0.000 1.200 290 D CA 0.197 54.075 54.000 -0.204 0.000 0.915 290 D CB 0.652 41.384 40.800 -0.113 0.000 1.170 290 D HN 0.538 8.908 8.370 -0.000 0.000 0.444 291 G N 0.203 108.914 108.800 -0.149 0.000 2.433 291 G HA2 -0.313 3.646 3.960 -0.003 0.000 0.216 291 G HA3 -0.313 3.646 3.960 -0.003 0.000 0.216 291 G C 1.425 176.194 174.900 -0.218 0.000 1.186 291 G CA 1.263 46.258 45.100 -0.174 0.000 0.779 291 G HN 0.729 9.019 8.290 -0.000 0.000 0.543 292 Q N -0.779 118.832 119.800 -0.315 0.000 2.123 292 Q HA -0.029 4.309 4.340 -0.003 0.000 0.199 292 Q C 2.306 178.208 176.000 -0.163 0.000 0.966 292 Q CA 1.651 57.111 55.803 -0.573 0.000 0.845 292 Q CB -0.913 27.133 28.738 -1.154 0.000 0.907 292 Q HN 0.262 8.532 8.270 -0.000 0.000 0.439 293 T N 1.244 115.788 114.554 -0.017 0.000 2.778 293 T HA -0.137 4.212 4.350 -0.003 0.000 0.269 293 T C 1.574 176.347 174.700 0.122 0.000 1.050 293 T CA 1.706 63.877 62.100 0.118 0.000 1.137 293 T CB -0.044 68.876 68.868 0.086 0.000 0.860 293 T HN 0.321 8.561 8.240 -0.000 0.000 0.468 294 K N 0.227 120.632 120.400 0.009 0.000 2.137 294 K HA 0.041 4.359 4.320 -0.003 0.000 0.202 294 K C 2.486 179.165 176.600 0.131 0.000 1.052 294 K CA 0.542 56.858 56.287 0.049 0.000 0.961 294 K CB 0.039 32.463 32.500 -0.127 0.000 0.741 294 K HN 0.228 8.478 8.250 -0.000 0.000 0.452 295 E N 0.597 120.837 120.200 0.065 0.000 2.038 295 E HA -0.206 4.142 4.350 -0.003 0.000 0.195 295 E C 1.927 178.669 176.600 0.237 0.000 1.000 295 E CA 1.433 57.900 56.400 0.110 0.000 0.803 295 E CB -0.206 29.561 29.700 0.111 0.000 0.750 295 E HN 0.465 8.825 8.360 -0.000 0.000 0.448 296 H N -0.738 118.488 119.070 0.260 0.000 2.319 296 H HA -0.145 4.409 4.556 -0.003 0.000 0.297 296 H C 2.153 177.548 175.328 0.112 0.000 1.097 296 H CA 1.290 57.435 56.048 0.162 0.000 1.285 296 H CB 0.180 30.051 29.762 0.181 0.000 1.368 296 H HN 0.098 8.378 8.280 -0.000 0.000 0.495 297 M N -0.108 119.670 119.600 0.297 0.000 2.200 297 M HA -0.103 4.376 4.480 -0.003 0.000 0.265 297 M C 2.324 178.754 176.300 0.217 0.000 1.066 297 M CA 0.751 56.211 55.300 0.267 0.000 1.127 297 M CB -0.874 31.925 32.600 0.331 0.000 1.379 297 M HN 0.255 8.545 8.290 -0.000 0.000 0.420 298 L N 0.643 121.938 121.223 0.120 0.000 2.046 298 L HA -0.110 4.228 4.340 -0.003 0.000 0.208 298 L C 2.148 178.989 176.870 -0.048 0.000 1.077 298 L CA 1.701 56.505 54.840 -0.060 0.000 0.747 298 L CB -0.851 41.088 42.059 -0.200 0.000 0.896 298 L HN 0.217 8.447 8.230 -0.000 0.000 0.432 299 L N -0.744 120.491 121.223 0.020 0.000 2.017 299 L HA -0.176 4.162 4.340 -0.003 0.000 0.208 299 L C 2.704 179.582 176.870 0.013 0.000 1.073 299 L CA 1.191 56.043 54.840 0.020 0.000 0.745 299 L CB -1.062 41.015 42.059 0.030 0.000 0.894 299 L HN 0.364 8.594 8.230 -0.000 0.000 0.432 300 A N 0.348 123.199 122.820 0.050 0.000 1.873 300 A HA -0.294 4.024 4.320 -0.003 0.000 0.218 300 A C 2.561 180.147 177.584 0.003 0.000 1.193 300 A CA 2.590 54.666 52.037 0.064 0.000 0.629 300 A CB -0.935 18.163 19.000 0.162 0.000 0.826 300 A HN 0.527 8.677 8.150 -0.000 0.000 0.447 301 S N -0.851 114.805 115.700 -0.073 0.000 2.387 301 S HA -0.096 4.373 4.470 -0.003 0.000 0.226 301 S C 2.042 176.488 174.600 -0.256 0.000 1.026 301 S CA 1.598 59.550 58.200 -0.413 0.000 0.972 301 S CB -0.626 62.024 63.200 -0.917 0.000 0.814 301 S HN 0.446 8.756 8.310 -0.000 0.000 0.477 302 S N 2.070 117.699 115.700 -0.119 0.000 2.368 302 S HA 0.119 4.587 4.470 -0.003 0.000 0.225 302 S C 1.542 176.119 174.600 -0.038 0.000 1.030 302 S CA 1.379 59.563 58.200 -0.027 0.000 0.999 302 S CB -0.527 62.721 63.200 0.081 0.000 0.844 302 S HN 0.511 8.821 8.310 -0.000 0.000 0.459 303 L N 0.833 122.030 121.223 -0.044 0.000 2.645 303 L HA 0.229 4.568 4.340 -0.003 0.000 0.235 303 L C 1.491 178.313 176.870 -0.080 0.000 1.150 303 L CA 0.310 55.128 54.840 -0.036 0.000 0.911 303 L CB -0.366 41.683 42.059 -0.018 0.000 1.077 303 L HN 0.512 8.742 8.230 -0.000 0.000 0.438 304 G N 0.242 108.945 108.800 -0.162 0.000 2.141 304 G HA2 -0.246 3.713 3.960 -0.003 0.000 0.231 304 G HA3 -0.246 3.713 3.960 -0.003 0.000 0.231 304 G C 0.245 174.862 174.900 -0.473 0.000 0.984 304 G CA -0.514 44.416 45.100 -0.284 0.000 0.660 304 G HN 0.244 8.534 8.290 -0.000 0.000 0.525 305 I N 1.329 121.726 120.570 -0.289 0.000 2.471 305 I HA 0.237 4.405 4.170 -0.003 0.000 0.286 305 I C 1.493 177.502 176.117 -0.180 0.000 1.079 305 I CA -0.398 60.811 61.300 -0.152 0.000 1.398 305 I CB 0.615 38.637 38.000 0.036 0.000 1.403 305 I HN 0.163 8.373 8.210 -0.000 0.000 0.530 306 H N 4.159 123.338 119.070 0.182 0.000 2.788 306 H HA 0.239 4.793 4.556 -0.003 0.000 0.262 306 H C -0.042 175.463 175.328 0.295 0.000 0.968 306 H CA 0.059 56.248 56.048 0.234 0.000 1.218 306 H CB 0.538 30.400 29.762 0.166 0.000 1.443 306 H HN 0.518 8.798 8.280 -0.000 0.000 0.478 307 N N 1.622 120.495 118.700 0.289 0.000 2.430 307 N HA 0.372 5.111 4.740 -0.003 0.000 0.292 307 N C -0.566 174.952 175.510 0.014 0.000 1.051 307 N CA -0.181 52.957 53.050 0.147 0.000 0.917 307 N CB 2.614 41.171 38.487 0.115 0.000 1.164 307 N HN 0.064 8.444 8.380 -0.000 0.000 0.484 308 L N 1.879 123.032 121.223 -0.117 0.000 2.401 308 L HA 0.595 4.933 4.340 -0.003 0.000 0.266 308 L C -0.414 176.302 176.870 -0.257 0.000 0.991 308 L CA -0.725 53.961 54.840 -0.257 0.000 0.818 308 L CB 2.351 44.107 42.059 -0.506 0.000 1.321 308 L HN 0.308 8.538 8.230 -0.000 0.000 0.413 309 I N 3.779 124.198 120.570 -0.252 0.000 2.382 309 I HA 0.313 4.482 4.170 -0.003 0.000 0.286 309 I C -0.537 175.401 176.117 -0.298 0.000 1.002 309 I CA -0.672 60.475 61.300 -0.254 0.000 1.135 309 I CB 1.911 39.789 38.000 -0.202 0.000 1.288 309 I HN 0.315 8.525 8.210 -0.000 0.000 0.448 310 I N 5.964 126.291 120.570 -0.405 0.000 2.322 310 I HA 0.243 4.411 4.170 -0.003 0.000 0.292 310 I C 0.797 176.821 176.117 -0.156 0.000 1.060 310 I CA -0.300 60.780 61.300 -0.367 0.000 1.309 310 I CB 0.815 38.410 38.000 -0.675 0.000 1.415 310 I HN 0.523 8.733 8.210 -0.000 0.000 0.492 311 A N 8.636 131.394 122.820 -0.103 0.000 2.527 311 A HA 0.427 4.745 4.320 -0.003 0.000 0.313 311 A C 0.489 178.064 177.584 -0.015 0.000 1.410 311 A CA -0.520 51.494 52.037 -0.039 0.000 1.060 311 A CB -0.084 18.887 19.000 -0.049 0.000 1.137 311 A HN 0.603 8.753 8.150 -0.000 0.000 0.542 312 M N 3.199 122.820 119.600 0.034 0.000 2.618 312 M HA 0.097 4.575 4.480 -0.003 0.000 0.322 312 M C 0.111 176.408 176.300 -0.005 0.000 1.471 312 M CA 0.073 55.389 55.300 0.026 0.000 1.450 312 M CB -1.073 31.599 32.600 0.120 0.000 1.444 312 M HN 0.695 8.985 8.290 -0.000 0.000 0.471 313 N N 2.564 121.239 118.700 -0.041 0.000 2.476 313 N HA 0.253 4.991 4.740 -0.003 0.000 0.275 313 N C -0.251 175.191 175.510 -0.114 0.000 1.190 313 N CA 0.032 53.037 53.050 -0.076 0.000 0.977 313 N CB 0.895 39.343 38.487 -0.064 0.000 1.200 313 N HN 0.449 8.829 8.380 -0.000 0.000 0.515 314 K N 1.006 121.313 120.400 -0.154 0.000 3.162 314 K HA -0.155 4.163 4.320 -0.003 0.000 0.268 314 K C 0.553 177.044 176.600 -0.182 0.000 1.062 314 K CA 0.170 56.375 56.287 -0.136 0.000 0.769 314 K CB -0.834 31.615 32.500 -0.086 0.000 1.274 314 K HN 0.506 8.756 8.250 -0.000 0.000 0.478 315 M N -0.089 119.260 119.600 -0.418 0.000 2.296 315 M HA -0.106 4.372 4.480 -0.003 0.000 0.265 315 M C 1.241 177.172 176.300 -0.615 0.000 1.064 315 M CA 1.612 56.517 55.300 -0.659 0.000 1.109 315 M CB -0.498 31.293 32.600 -1.349 0.000 1.396 315 M HN 0.189 8.479 8.290 -0.000 0.000 0.430 316 D N 0.974 121.117 120.400 -0.428 0.000 2.116 316 D HA -0.169 4.469 4.640 -0.003 0.000 0.193 316 D C 1.342 177.653 176.300 0.018 0.000 0.998 316 D CA 1.163 55.139 54.000 -0.039 0.000 0.836 316 D CB -0.585 40.333 40.800 0.197 0.000 0.951 316 D HN 0.288 8.658 8.370 -0.000 0.000 0.449 317 N N -0.047 118.682 118.700 0.049 0.000 2.626 317 N HA -0.060 4.678 4.740 -0.003 0.000 0.193 317 N C 1.013 176.531 175.510 0.014 0.000 1.213 317 N CA 0.302 53.383 53.050 0.053 0.000 0.914 317 N CB 0.404 38.954 38.487 0.104 0.000 0.994 317 N HN 0.268 8.648 8.380 -0.000 0.000 0.447 318 V N -4.827 115.078 119.914 -0.014 0.000 3.355 318 V HA 0.240 4.358 4.120 -0.003 0.000 0.330 318 V C -0.367 175.746 176.094 0.031 0.000 1.479 318 V CA -0.530 61.769 62.300 -0.003 0.000 1.150 318 V CB -0.012 31.799 31.823 -0.020 0.000 1.044 318 V HN -0.062 8.128 8.190 -0.000 0.000 0.501 319 D N 0.680 121.119 120.400 0.066 0.000 2.689 319 D HA -0.253 4.386 4.640 -0.003 0.000 0.237 319 D C -0.040 176.474 176.300 0.356 0.000 1.148 319 D CA 1.430 55.555 54.000 0.209 0.000 0.656 319 D CB -1.157 39.737 40.800 0.158 0.000 1.050 319 D HN 0.894 9.264 8.370 -0.000 0.000 0.426 320 W N -0.702 120.692 121.300 0.156 0.000 5.770 320 W HA -0.256 4.402 4.660 -0.003 0.000 0.389 320 W C 0.876 177.487 176.519 0.155 0.000 1.469 320 W CA 0.708 58.206 57.345 0.256 0.000 0.975 320 W CB -2.459 27.201 29.460 0.334 0.000 2.622 320 W HN 0.219 8.399 8.180 -0.000 0.000 1.500 321 S N 0.662 116.433 115.700 0.118 0.000 2.443 321 S HA 0.049 4.518 4.470 -0.003 0.000 0.284 321 S C 1.404 175.804 174.600 -0.334 0.000 1.206 321 S CA 0.317 58.461 58.200 -0.094 0.000 1.074 321 S CB 0.983 64.145 63.200 -0.063 0.000 0.963 321 S HN 0.463 8.773 8.310 -0.000 0.000 0.501 322 Q N 3.402 122.681 119.800 -0.869 0.000 2.297 322 Q HA -0.203 4.136 4.340 -0.003 0.000 0.208 322 Q C 1.863 177.570 176.000 -0.488 0.000 0.981 322 Q CA 1.590 56.589 55.803 -1.339 0.000 0.876 322 Q CB -0.006 27.678 28.738 -1.756 0.000 0.921 322 Q HN 0.938 9.208 8.270 -0.000 0.000 0.446 323 Q N -0.587 119.027 119.800 -0.310 0.000 2.096 323 Q HA -0.123 4.215 4.340 -0.003 0.000 0.197 323 Q C 2.084 178.019 176.000 -0.107 0.000 0.964 323 Q CA 0.466 56.170 55.803 -0.164 0.000 0.838 323 Q CB 0.116 28.776 28.738 -0.129 0.000 0.906 323 Q HN 0.112 8.382 8.270 -0.000 0.000 0.444 324 R N 0.297 120.741 120.500 -0.094 0.000 2.088 324 R HA -0.172 4.166 4.340 -0.003 0.000 0.232 324 R C 2.003 178.259 176.300 -0.073 0.000 1.136 324 R CA 1.770 57.829 56.100 -0.069 0.000 0.926 324 R CB -1.366 28.907 30.300 -0.045 0.000 0.837 324 R HN 0.382 8.652 8.270 -0.000 0.000 0.429 325 F N 1.637 121.479 119.950 -0.179 0.000 2.063 325 F HA -0.331 4.195 4.527 -0.003 0.000 0.297 325 F C 2.259 177.953 175.800 -0.177 0.000 1.099 325 F CA 2.542 60.462 58.000 -0.132 0.000 1.220 325 F CB -0.240 38.735 39.000 -0.042 0.000 0.972 325 F HN 0.176 8.476 8.300 -0.000 0.000 0.487 326 E N 0.460 120.682 120.200 0.037 0.000 2.216 326 E HA -0.166 4.182 4.350 -0.003 0.000 0.192 326 E C 1.997 178.491 176.600 -0.177 0.000 0.988 326 E CA 1.332 57.689 56.400 -0.072 0.000 0.834 326 E CB -0.468 29.230 29.700 -0.003 0.000 0.772 326 E HN 0.758 9.118 8.360 -0.000 0.000 0.479 327 E N -0.108 120.001 120.200 -0.152 0.000 2.158 327 E HA -0.101 4.247 4.350 -0.003 0.000 0.191 327 E C 2.046 178.538 176.600 -0.181 0.000 0.982 327 E CA 0.820 57.143 56.400 -0.128 0.000 0.823 327 E CB -0.373 29.281 29.700 -0.076 0.000 0.766 327 E HN 0.311 8.671 8.360 -0.000 0.000 0.468 328 I N 1.500 121.880 120.570 -0.318 0.000 2.315 328 I HA -0.199 3.969 4.170 -0.003 0.000 0.248 328 I C 2.735 178.594 176.117 -0.431 0.000 1.117 328 I CA 1.195 62.160 61.300 -0.558 0.000 1.404 328 I CB -0.185 37.309 38.000 -0.844 0.000 1.071 328 I HN 0.101 8.311 8.210 -0.000 0.000 0.419 329 K N 0.975 121.076 120.400 -0.498 0.000 2.283 329 K HA -0.146 4.172 4.320 -0.003 0.000 0.202 329 K C 2.128 178.510 176.600 -0.364 0.000 1.048 329 K CA 1.602 57.496 56.287 -0.656 0.000 0.948 329 K CB 0.058 31.887 32.500 -1.118 0.000 0.742 329 K HN 0.375 8.625 8.250 -0.000 0.000 0.458 330 S N -0.015 115.550 115.700 -0.225 0.000 2.470 330 S HA 0.028 4.496 4.470 -0.003 0.000 0.225 330 S C 1.459 176.057 174.600 -0.003 0.000 1.006 330 S CA 0.165 58.303 58.200 -0.104 0.000 0.934 330 S CB 0.111 63.261 63.200 -0.083 0.000 0.778 330 S HN 0.179 8.489 8.310 -0.000 0.000 0.517 331 K N 1.209 121.631 120.400 0.037 0.000 2.128 331 K HA 0.292 4.610 4.320 -0.003 0.000 0.202 331 K C 2.028 178.746 176.600 0.197 0.000 1.050 331 K CA 0.232 56.600 56.287 0.135 0.000 0.966 331 K CB -0.796 31.853 32.500 0.249 0.000 0.759 331 K HN 0.285 8.535 8.250 -0.000 0.000 0.454 332 L N 1.139 122.490 121.223 0.212 0.000 2.049 332 L HA -0.045 4.293 4.340 -0.003 0.000 0.203 332 L C 2.258 179.356 176.870 0.380 0.000 1.074 332 L CA 0.941 55.978 54.840 0.328 0.000 0.749 332 L CB -0.634 41.630 42.059 0.340 0.000 0.907 332 L HN 0.059 8.289 8.230 -0.000 0.000 0.439 333 L N 1.308 122.751 121.223 0.367 0.000 1.978 333 L HA -0.142 4.197 4.340 -0.003 0.000 0.218 333 L C -0.634 176.381 176.870 0.242 0.000 1.075 333 L CA 2.294 57.355 54.840 0.367 0.000 0.767 333 L CB -2.036 40.162 42.059 0.231 0.000 0.890 333 L HN 0.106 8.336 8.230 -0.000 0.000 0.434 334 P HA -0.206 4.214 4.420 -0.000 0.000 0.219 334 P C 1.327 178.727 177.300 0.167 0.000 1.146 334 P CA 1.498 64.687 63.100 0.149 0.000 0.808 334 P CB -0.275 31.499 31.700 0.123 0.000 0.779 335 Y N 0.394 120.758 120.300 0.107 0.000 2.184 335 Y HA -0.117 4.431 4.550 -0.003 0.000 0.290 335 Y C 2.045 178.014 175.900 0.116 0.000 1.129 335 Y CA 1.302 59.459 58.100 0.094 0.000 1.144 335 Y CB -0.867 37.650 38.460 0.094 0.000 0.995 335 Y HN -0.255 8.025 8.280 -0.000 0.000 0.513 336 L N -0.677 120.551 121.223 0.008 0.000 2.042 336 L HA -0.249 4.090 4.340 -0.003 0.000 0.210 336 L C 2.371 179.278 176.870 0.062 0.000 1.076 336 L CA 1.304 56.145 54.840 0.002 0.000 0.749 336 L CB -0.893 41.190 42.059 0.039 0.000 0.893 336 L HN 0.188 8.418 8.230 -0.000 0.000 0.432 337 V N 0.226 120.171 119.914 0.053 0.000 2.295 337 V HA -0.330 3.788 4.120 -0.003 0.000 0.246 337 V C 2.178 178.229 176.094 -0.072 0.000 1.049 337 V CA 2.230 64.538 62.300 0.013 0.000 1.024 337 V CB -0.531 31.336 31.823 0.073 0.000 0.648 337 V HN 0.510 8.700 8.190 -0.000 0.000 0.447 338 D N -0.746 119.611 120.400 -0.071 0.000 2.311 338 D HA -0.174 4.464 4.640 -0.003 0.000 0.212 338 D C 1.754 177.964 176.300 -0.150 0.000 0.972 338 D CA 1.061 55.013 54.000 -0.080 0.000 0.887 338 D CB -0.078 40.699 40.800 -0.039 0.000 0.915 338 D HN 0.487 8.857 8.370 -0.000 0.000 0.497 339 I N -2.027 118.398 120.570 -0.242 0.000 3.854 339 I HA 0.236 4.404 4.170 -0.003 0.000 0.312 339 I C 1.416 177.337 176.117 -0.326 0.000 1.273 339 I CA 0.688 61.812 61.300 -0.293 0.000 1.298 339 I CB 0.503 38.234 38.000 -0.449 0.000 1.071 339 I HN 0.291 8.501 8.210 -0.000 0.000 0.428 340 G N -0.014 108.564 108.800 -0.371 0.000 2.977 340 G HA2 -0.145 3.813 3.960 -0.003 0.000 0.211 340 G HA3 -0.145 3.813 3.960 -0.003 0.000 0.211 340 G C 0.109 174.565 174.900 -0.740 0.000 0.994 340 G CA -0.618 44.163 45.100 -0.531 0.000 0.795 340 G HN 0.109 8.399 8.290 -0.000 0.000 0.518 341 F N 0.446 120.158 119.950 -0.396 0.000 2.368 341 F HA 0.792 5.317 4.527 -0.003 0.000 0.308 341 F C 0.332 175.805 175.800 -0.544 0.000 1.198 341 F CA -0.501 57.275 58.000 -0.374 0.000 1.130 341 F CB 0.498 39.401 39.000 -0.162 0.000 1.300 341 F HN -0.090 8.210 8.300 -0.000 0.000 0.537 342 F N 0.061 120.180 119.950 0.283 0.000 2.507 342 F HA 0.274 4.800 4.527 -0.003 0.000 0.325 342 F C 1.175 177.079 175.800 0.174 0.000 1.116 342 F CA -1.069 57.039 58.000 0.181 0.000 0.930 342 F CB 1.413 40.494 39.000 0.134 0.000 1.146 342 F HN 0.580 8.880 8.300 -0.000 0.000 0.447 343 E N 1.115 121.528 120.200 0.355 0.000 2.164 343 E HA -0.295 4.054 4.350 -0.003 0.000 0.206 343 E C 0.850 177.607 176.600 0.262 0.000 1.032 343 E CA 2.182 58.755 56.400 0.289 0.000 0.832 343 E CB 0.141 29.986 29.700 0.242 0.000 0.742 343 E HN 0.650 9.010 8.360 -0.000 0.000 0.460 344 D N -0.615 119.932 120.400 0.244 0.000 2.348 344 D HA -0.064 4.575 4.640 -0.003 0.000 0.216 344 D C 0.565 176.967 176.300 0.169 0.000 0.970 344 D CA 0.684 54.791 54.000 0.178 0.000 0.889 344 D CB -0.301 40.572 40.800 0.121 0.000 0.912 344 D HN 0.306 8.676 8.370 -0.000 0.000 0.524 345 N N -0.243 118.582 118.700 0.209 0.000 2.251 345 N HA 0.189 4.928 4.740 -0.003 0.000 0.217 345 N C -0.181 175.376 175.510 0.079 0.000 1.124 345 N CA -0.069 53.084 53.050 0.172 0.000 0.843 345 N CB 1.051 39.696 38.487 0.263 0.000 1.024 345 N HN 0.058 8.438 8.380 -0.000 0.000 0.501 346 I N 0.361 120.962 120.570 0.050 0.000 2.509 346 I HA 0.301 4.469 4.170 -0.003 0.000 0.293 346 I C -0.901 175.149 176.117 -0.113 0.000 1.020 346 I CA -0.849 60.371 61.300 -0.133 0.000 1.088 346 I CB 1.900 39.776 38.000 -0.206 0.000 1.267 346 I HN -0.037 8.173 8.210 -0.000 0.000 0.430 347 N N 4.537 123.084 118.700 -0.254 0.000 2.284 347 N HA 0.531 5.269 4.740 -0.003 0.000 0.300 347 N C -1.852 173.519 175.510 -0.231 0.000 1.047 347 N CA -0.618 52.388 53.050 -0.075 0.000 0.821 347 N CB 1.590 40.088 38.487 0.018 0.000 1.337 347 N HN 0.369 8.749 8.380 -0.000 0.000 0.482 348 W N 1.645 123.024 121.300 0.132 0.000 2.475 348 W HA 0.622 5.280 4.660 -0.002 0.000 0.317 348 W C -0.965 175.697 176.519 0.239 0.000 1.046 348 W CA -0.730 56.704 57.345 0.148 0.000 1.215 348 W CB 1.029 30.589 29.460 0.167 0.000 1.335 348 W HN 0.013 8.193 8.180 -0.000 0.000 0.471 349 V N 5.349 125.454 119.914 0.319 0.000 2.482 349 V HA 0.414 4.532 4.120 -0.003 0.000 0.295 349 V C -2.090 174.090 176.094 0.143 0.000 1.026 349 V CA -2.316 60.077 62.300 0.154 0.000 0.856 349 V CB 2.140 34.049 31.823 0.144 0.000 1.001 349 V HN 0.274 8.464 8.190 -0.000 0.000 0.424 350 P HA 0.439 4.859 4.420 -0.000 0.000 0.276 350 P C -0.726 176.736 177.300 0.270 0.000 1.235 350 P CA 0.069 63.254 63.100 0.142 0.000 0.772 350 P CB 1.417 33.135 31.700 0.031 0.000 0.871 351 I N -0.748 119.886 120.570 0.106 0.000 2.994 351 I HA 0.609 4.777 4.170 -0.003 0.000 0.306 351 I C -1.116 174.979 176.117 -0.037 0.000 1.195 351 I CA -1.131 60.258 61.300 0.148 0.000 1.001 351 I CB 2.581 40.627 38.000 0.077 0.000 1.244 351 I HN 0.181 8.391 8.210 -0.000 0.000 0.437 352 S N 2.459 118.225 115.700 0.110 0.000 2.451 352 S HA 0.579 5.048 4.470 -0.003 0.000 0.301 352 S C 0.852 175.455 174.600 0.004 0.000 1.116 352 S CA 0.126 58.367 58.200 0.068 0.000 1.093 352 S CB 1.286 64.699 63.200 0.354 0.000 1.017 352 S HN 1.002 9.312 8.310 -0.000 0.000 0.482 353 G N 3.623 112.341 108.800 -0.138 0.000 2.511 353 G HA2 -0.118 3.841 3.960 -0.003 0.000 0.216 353 G HA3 -0.118 3.841 3.960 -0.003 0.000 0.216 353 G C 0.906 175.637 174.900 -0.281 0.000 1.218 353 G CA 0.989 45.886 45.100 -0.338 0.000 0.788 353 G HN 0.738 9.028 8.290 -0.000 0.000 0.560 354 F N 1.813 121.768 119.950 0.009 0.000 2.146 354 F HA -0.004 4.521 4.527 -0.003 0.000 0.298 354 F C 3.159 178.965 175.800 0.009 0.000 1.096 354 F CA 1.519 59.522 58.000 0.004 0.000 1.275 354 F CB -0.395 38.612 39.000 0.013 0.000 1.008 354 F HN 0.291 8.591 8.300 -0.000 0.000 0.480 355 S N -0.693 115.156 115.700 0.248 0.000 2.470 355 S HA 0.333 4.801 4.470 -0.003 0.000 0.222 355 S C 1.825 176.490 174.600 0.108 0.000 1.024 355 S CA 0.448 58.751 58.200 0.170 0.000 0.931 355 S CB -0.014 63.312 63.200 0.210 0.000 0.791 355 S HN 0.622 8.932 8.310 -0.000 0.000 0.513 356 G N 1.227 110.087 108.800 0.101 0.000 2.136 356 G HA2 -0.281 3.677 3.960 -0.003 0.000 0.242 356 G HA3 -0.281 3.677 3.960 -0.003 0.000 0.242 356 G C -0.229 174.709 174.900 0.062 0.000 0.989 356 G CA 0.267 45.407 45.100 0.067 0.000 0.682 356 G HN 0.743 9.033 8.290 -0.000 0.000 0.522 357 E N 0.050 120.328 120.200 0.129 0.000 2.351 357 E HA 0.422 4.770 4.350 -0.003 0.000 0.266 357 E C 1.537 178.142 176.600 0.010 0.000 1.031 357 E CA 0.877 57.323 56.400 0.077 0.000 0.911 357 E CB -0.241 29.598 29.700 0.232 0.000 0.986 357 E HN 1.433 9.793 8.360 -0.000 0.000 0.446 358 G N 2.735 111.293 108.800 -0.404 0.000 2.175 358 G HA2 -0.289 3.670 3.960 -0.003 0.000 0.244 358 G HA3 -0.289 3.670 3.960 -0.003 0.000 0.244 358 G C 0.740 175.533 174.900 -0.179 0.000 0.982 358 G CA 0.242 44.940 45.100 -0.671 0.000 0.641 358 G HN 0.464 8.754 8.290 -0.000 0.000 0.527 359 V N -0.953 118.921 119.914 -0.065 0.000 2.251 359 V HA 0.169 4.288 4.120 -0.003 0.000 0.237 359 V C 1.699 177.839 176.094 0.077 0.000 1.040 359 V CA 2.248 64.555 62.300 0.012 0.000 1.005 359 V CB -0.448 31.397 31.823 0.036 0.000 0.645 359 V HN 0.572 8.762 8.190 -0.000 0.000 0.458 360 Y N -0.826 119.430 120.300 -0.074 0.000 3.326 360 Y HA 0.185 4.733 4.550 -0.003 0.000 0.172 360 Y C 2.290 178.162 175.900 -0.048 0.000 0.896 360 Y CA -0.148 57.919 58.100 -0.056 0.000 1.808 360 Y CB 0.621 39.048 38.460 -0.054 0.000 1.427 360 Y HN -0.125 8.155 8.280 -0.000 0.000 0.334 361 K N 0.803 121.105 120.400 -0.163 0.000 2.314 361 K HA 0.100 4.419 4.320 -0.003 0.000 0.198 361 K C 0.003 176.526 176.600 -0.130 0.000 1.045 361 K CA 0.437 56.550 56.287 -0.290 0.000 0.988 361 K CB 0.446 32.703 32.500 -0.405 0.000 0.783 361 K HN 0.229 8.479 8.250 -0.000 0.000 0.484 362 I N 2.471 122.994 120.570 -0.078 0.000 2.291 362 I HA 0.024 4.193 4.170 -0.003 0.000 0.292 362 I C 0.058 176.099 176.117 -0.128 0.000 1.064 362 I CA -0.451 60.807 61.300 -0.069 0.000 1.269 362 I CB 0.260 38.246 38.000 -0.022 0.000 1.418 362 I HN 0.076 8.286 8.210 -0.000 0.000 0.485 363 E N 5.399 125.527 120.200 -0.121 0.000 2.374 363 E HA 0.121 4.469 4.350 -0.003 0.000 0.260 363 E C -1.114 175.379 176.600 -0.179 0.000 1.101 363 E CA -0.649 55.656 56.400 -0.158 0.000 0.907 363 E CB 0.296 29.959 29.700 -0.063 0.000 1.014 363 E HN 0.549 8.909 8.360 -0.000 0.000 0.427 364 Y N 1.185 121.433 120.300 -0.085 0.000 2.712 364 Y HA -0.027 4.522 4.550 -0.003 0.000 0.333 364 Y C 1.059 176.827 175.900 -0.220 0.000 1.225 364 Y CA 0.272 58.249 58.100 -0.205 0.000 1.499 364 Y CB 0.287 38.632 38.460 -0.192 0.000 1.288 364 Y HN 0.424 8.704 8.280 -0.000 0.000 0.575 365 T N 2.767 117.234 114.554 -0.145 0.000 2.906 365 T HA -0.107 4.241 4.350 -0.003 0.000 0.320 365 T C 1.146 175.772 174.700 -0.124 0.000 1.088 365 T CA -0.260 61.750 62.100 -0.149 0.000 1.120 365 T CB 0.391 69.128 68.868 -0.218 0.000 1.000 365 T HN 0.667 8.907 8.240 -0.000 0.000 0.550 366 D N 0.844 121.192 120.400 -0.086 0.000 2.264 366 D HA -0.073 4.566 4.640 -0.003 0.000 0.208 366 D C 1.768 178.019 176.300 -0.081 0.000 0.966 366 D CA 0.803 54.758 54.000 -0.075 0.000 0.864 366 D CB 0.253 41.023 40.800 -0.049 0.000 0.933 366 D HN 0.486 8.856 8.370 -0.000 0.000 0.499 367 E N -0.372 119.778 120.200 -0.084 0.000 2.077 367 E HA -0.106 4.243 4.350 -0.003 0.000 0.193 367 E C 2.243 178.806 176.600 -0.061 0.000 0.989 367 E CA 0.527 56.899 56.400 -0.047 0.000 0.800 367 E CB -0.136 29.543 29.700 -0.036 0.000 0.746 367 E HN 0.119 8.479 8.360 -0.000 0.000 0.452 368 V N 0.657 120.440 119.914 -0.218 0.000 2.453 368 V HA -0.136 3.983 4.120 -0.003 0.000 0.247 368 V C 2.096 177.882 176.094 -0.514 0.000 1.048 368 V CA 1.097 63.151 62.300 -0.409 0.000 1.049 368 V CB -0.329 31.093 31.823 -0.667 0.000 0.672 368 V HN 0.126 8.316 8.190 -0.000 0.000 0.457 369 R N 1.032 121.339 120.500 -0.321 0.000 2.200 369 R HA -0.170 4.168 4.340 -0.003 0.000 0.234 369 R C 2.340 178.506 176.300 -0.223 0.000 1.127 369 R CA 1.412 57.344 56.100 -0.280 0.000 0.989 369 R CB -0.658 29.549 30.300 -0.154 0.000 0.869 369 R HN 0.856 9.126 8.270 -0.000 0.000 0.459 370 Q N -0.729 118.992 119.800 -0.132 0.000 2.123 370 Q HA -0.119 4.219 4.340 -0.003 0.000 0.199 370 Q C 1.856 177.872 176.000 0.026 0.000 0.966 370 Q CA 1.314 57.097 55.803 -0.033 0.000 0.845 370 Q CB -0.490 28.267 28.738 0.032 0.000 0.907 370 Q HN 0.588 8.858 8.270 -0.000 0.000 0.439 371 W N 0.005 121.260 121.300 -0.076 0.000 2.683 371 W HA 0.207 4.865 4.660 -0.002 0.000 0.267 371 W C -0.053 176.411 176.519 -0.091 0.000 1.243 371 W CA -0.586 56.714 57.345 -0.075 0.000 1.380 371 W CB -0.338 29.087 29.460 -0.059 0.000 1.063 371 W HN -0.060 8.120 8.180 -0.000 0.000 0.599 372 Y N 5.361 125.046 120.300 -1.026 0.000 2.367 372 Y HA 0.149 4.698 4.550 -0.003 0.000 0.342 372 Y C 1.546 177.084 175.900 -0.603 0.000 0.979 372 Y CA -0.102 57.386 58.100 -1.019 0.000 1.161 372 Y CB 0.520 38.038 38.460 -1.571 0.000 1.155 372 Y HN -0.042 8.238 8.280 -0.000 0.000 0.503 373 N N 3.186 121.245 118.700 -1.068 0.000 2.432 373 N HA 0.084 4.822 4.740 -0.003 0.000 0.174 373 N C 0.845 175.865 175.510 -0.816 0.000 1.037 373 N CA 0.528 53.155 53.050 -0.705 0.000 0.892 373 N CB -0.238 38.017 38.487 -0.388 0.000 1.049 373 N HN 0.694 9.074 8.380 -0.000 0.000 0.442 374 G N 1.542 109.552 108.800 -1.318 0.000 2.621 374 G HA2 0.416 4.374 3.960 -0.003 0.000 0.271 374 G HA3 0.416 4.374 3.960 -0.003 0.000 0.271 374 G C -2.569 172.193 174.900 -0.231 0.000 1.236 374 G CA -0.808 43.922 45.100 -0.616 0.000 0.958 374 G HN 0.089 8.379 8.290 -0.000 0.000 0.512 375 P HA 0.098 4.519 4.420 -0.000 0.000 0.269 375 P C -0.079 177.443 177.300 0.371 0.000 1.215 375 P CA -0.530 62.677 63.100 0.178 0.000 0.780 375 P CB 0.654 32.431 31.700 0.129 0.000 0.898 376 N N 2.369 121.284 118.700 0.357 0.000 2.328 376 N HA 0.011 4.749 4.740 -0.003 0.000 0.277 376 N C 0.863 176.474 175.510 0.167 0.000 1.286 376 N CA -0.306 52.942 53.050 0.331 0.000 0.949 376 N CB -0.708 37.835 38.487 0.094 0.000 1.136 376 N HN 0.167 8.547 8.380 -0.000 0.000 0.550 377 L N -0.847 120.427 121.223 0.084 0.000 1.994 377 L HA -0.042 4.297 4.340 -0.003 0.000 0.208 377 L C 2.371 179.191 176.870 -0.084 0.000 1.071 377 L CA 1.864 56.700 54.840 -0.006 0.000 0.745 377 L CB -1.025 41.007 42.059 -0.044 0.000 0.892 377 L HN 0.746 8.976 8.230 -0.000 0.000 0.431 378 M N -0.991 118.541 119.600 -0.112 0.000 2.117 378 M HA -0.174 4.304 4.480 -0.003 0.000 0.262 378 M C 2.267 178.501 176.300 -0.111 0.000 1.065 378 M CA 2.059 57.216 55.300 -0.238 0.000 1.114 378 M CB -0.554 31.761 32.600 -0.475 0.000 1.361 378 M HN 0.309 8.599 8.290 -0.000 0.000 0.408 379 S N -0.500 115.200 115.700 -0.001 0.000 2.368 379 S HA -0.130 4.339 4.470 -0.003 0.000 0.225 379 S C 1.844 176.486 174.600 0.070 0.000 1.030 379 S CA 1.776 60.013 58.200 0.062 0.000 0.999 379 S CB -0.894 62.362 63.200 0.093 0.000 0.844 379 S HN 0.608 8.918 8.310 -0.000 0.000 0.459 380 T N 3.306 117.891 114.554 0.052 0.000 2.684 380 T HA -0.022 4.327 4.350 -0.003 0.000 0.267 380 T C 1.788 176.504 174.700 0.026 0.000 1.036 380 T CA 1.093 63.221 62.100 0.047 0.000 1.148 380 T CB -0.600 68.290 68.868 0.037 0.000 0.863 380 T HN 0.220 8.460 8.240 -0.000 0.000 0.436 381 L N 0.710 121.902 121.223 -0.050 0.000 2.013 381 L HA -0.186 4.152 4.340 -0.003 0.000 0.212 381 L C 2.831 179.841 176.870 0.234 0.000 1.073 381 L CA 1.666 56.478 54.840 -0.047 0.000 0.753 381 L CB -0.605 41.234 42.059 -0.367 0.000 0.890 381 L HN 0.369 8.599 8.230 -0.000 0.000 0.432 382 E N -0.110 120.252 120.200 0.270 0.000 2.110 382 E HA -0.216 4.133 4.350 -0.003 0.000 0.193 382 E C 1.878 178.707 176.600 0.381 0.000 0.988 382 E CA 1.420 58.062 56.400 0.403 0.000 0.804 382 E CB -0.232 29.667 29.700 0.332 0.000 0.745 382 E HN 0.613 8.973 8.360 -0.000 0.000 0.458 383 N N 0.647 119.499 118.700 0.253 0.000 2.142 383 N HA -0.139 4.599 4.740 -0.003 0.000 0.186 383 N C 1.993 177.628 175.510 0.207 0.000 1.023 383 N CA 0.720 53.901 53.050 0.219 0.000 0.852 383 N CB -0.134 38.425 38.487 0.120 0.000 0.998 383 N HN 0.076 8.456 8.380 -0.000 0.000 0.424 384 A N 1.545 124.457 122.820 0.153 0.000 1.883 384 A HA -0.112 4.207 4.320 -0.003 0.000 0.217 384 A C 2.375 180.019 177.584 0.099 0.000 1.186 384 A CA 1.875 53.980 52.037 0.114 0.000 0.624 384 A CB -0.968 18.080 19.000 0.080 0.000 0.822 384 A HN 0.357 8.507 8.150 -0.000 0.000 0.444 385 A N -1.516 121.350 122.820 0.077 0.000 1.933 385 A HA -0.015 4.303 4.320 -0.003 0.000 0.218 385 A C 1.959 179.456 177.584 -0.144 0.000 1.175 385 A CA 1.544 53.511 52.037 -0.116 0.000 0.628 385 A CB -0.718 18.055 19.000 -0.377 0.000 0.814 385 A HN 0.473 8.623 8.150 -0.000 0.000 0.444 386 F N 0.217 120.159 119.950 -0.013 0.000 2.146 386 F HA -0.097 4.429 4.527 -0.002 0.000 0.298 386 F C 2.276 178.079 175.800 0.004 0.000 1.096 386 F CA 1.816 59.810 58.000 -0.010 0.000 1.275 386 F CB -0.210 38.788 39.000 -0.003 0.000 1.008 386 F HN 0.122 8.422 8.300 -0.000 0.000 0.480 387 K N 0.006 120.519 120.400 0.188 0.000 2.044 387 K HA -0.210 4.109 4.320 -0.003 0.000 0.210 387 K C 1.984 178.631 176.600 0.077 0.000 1.049 387 K CA 1.460 57.816 56.287 0.116 0.000 0.927 387 K CB -0.357 32.201 32.500 0.096 0.000 0.713 387 K HN 0.140 8.390 8.250 -0.000 0.000 0.443 388 I N 0.962 121.563 120.570 0.052 0.000 2.099 388 I HA -0.282 3.886 4.170 -0.003 0.000 0.239 388 I C 2.515 178.647 176.117 0.024 0.000 1.066 388 I CA 1.400 62.720 61.300 0.033 0.000 1.324 388 I CB -1.307 36.699 38.000 0.011 0.000 1.037 388 I HN 0.181 8.391 8.210 -0.000 0.000 0.401 389 S N 0.205 115.899 115.700 -0.009 0.000 2.441 389 S HA -0.238 4.230 4.470 -0.003 0.000 0.242 389 S C 2.049 176.672 174.600 0.038 0.000 1.018 389 S CA 1.479 59.672 58.200 -0.012 0.000 0.988 389 S CB -0.133 63.014 63.200 -0.089 0.000 0.778 389 S HN 0.234 8.544 8.310 -0.000 0.000 0.498 390 K N 1.105 121.542 120.400 0.062 0.000 2.031 390 K HA -0.001 4.318 4.320 -0.003 0.000 0.205 390 K C 2.010 178.641 176.600 0.051 0.000 1.049 390 K CA 1.585 57.912 56.287 0.067 0.000 0.939 390 K CB -0.553 31.992 32.500 0.075 0.000 0.717 390 K HN 0.594 8.844 8.250 -0.000 0.000 0.438 391 E N 0.435 120.662 120.200 0.045 0.000 2.038 391 E HA -0.193 4.155 4.350 -0.003 0.000 0.195 391 E C 1.744 178.368 176.600 0.041 0.000 1.000 391 E CA 1.507 57.930 56.400 0.039 0.000 0.803 391 E CB -0.366 29.355 29.700 0.036 0.000 0.750 391 E HN 0.458 8.818 8.360 -0.000 0.000 0.448 392 N N 0.765 119.491 118.700 0.043 0.000 2.503 392 N HA -0.177 4.561 4.740 -0.003 0.000 0.189 392 N C 1.379 176.922 175.510 0.056 0.000 1.048 392 N CA 0.402 53.482 53.050 0.049 0.000 0.905 392 N CB -0.031 38.488 38.487 0.054 0.000 0.951 392 N HN 0.249 8.629 8.380 -0.000 0.000 0.446 393 E N -0.039 120.192 120.200 0.051 0.000 2.347 393 E HA -0.065 4.284 4.350 -0.003 0.000 0.196 393 E C 2.043 178.672 176.600 0.049 0.000 1.008 393 E CA 0.369 56.801 56.400 0.053 0.000 0.852 393 E CB 0.043 29.772 29.700 0.048 0.000 0.783 393 E HN 0.428 8.788 8.360 -0.000 0.000 0.505 394 G N 0.945 109.771 108.800 0.044 0.000 2.572 394 G HA2 -0.049 3.909 3.960 -0.003 0.000 0.216 394 G HA3 -0.049 3.909 3.960 -0.003 0.000 0.216 394 G C 0.776 175.701 174.900 0.042 0.000 1.133 394 G CA -0.321 44.803 45.100 0.039 0.000 0.791 394 G HN 0.086 8.376 8.290 -0.000 0.000 0.538 395 I N 1.596 122.194 120.570 0.047 0.000 2.989 395 I HA -0.089 4.079 4.170 -0.003 0.000 0.311 395 I C 0.172 176.315 176.117 0.044 0.000 1.221 395 I CA 0.193 61.521 61.300 0.046 0.000 1.449 395 I CB 0.183 38.215 38.000 0.053 0.000 1.325 395 I HN 0.051 8.261 8.210 -0.000 0.000 0.557 396 N N 5.198 123.921 118.700 0.038 0.000 2.619 396 N HA 0.326 5.065 4.740 -0.003 0.000 0.294 396 N C 0.396 175.924 175.510 0.029 0.000 1.279 396 N CA -0.704 52.367 53.050 0.034 0.000 0.867 396 N CB 1.046 39.553 38.487 0.033 0.000 1.329 396 N HN 0.288 8.668 8.380 -0.000 0.000 0.557 397 K N 0.079 120.494 120.400 0.025 0.000 2.459 397 K HA 0.097 4.416 4.320 -0.003 0.000 0.193 397 K C -0.209 176.408 176.600 0.028 0.000 1.030 397 K CA 0.695 56.993 56.287 0.019 0.000 1.026 397 K CB 0.152 32.660 32.500 0.013 0.000 0.809 397 K HN 0.415 8.665 8.250 -0.000 0.000 0.504 398 D N 1.187 121.607 120.400 0.033 0.000 2.333 398 D HA -0.018 4.621 4.640 -0.003 0.000 0.208 398 D C -0.063 176.266 176.300 0.049 0.000 0.984 398 D CA 0.368 54.393 54.000 0.041 0.000 0.873 398 D CB 0.189 41.012 40.800 0.038 0.000 0.935 398 D HN 0.136 8.506 8.370 -0.000 0.000 0.521 399 D N 2.381 122.806 120.400 0.042 0.000 2.348 399 D HA 0.140 4.778 4.640 -0.003 0.000 0.253 399 D C -2.195 174.125 176.300 0.033 0.000 1.161 399 D CA -1.139 52.883 54.000 0.037 0.000 0.876 399 D CB 1.271 42.090 40.800 0.031 0.000 1.160 399 D HN -0.010 8.360 8.370 -0.000 0.000 0.459 400 P HA 0.054 4.474 4.420 -0.000 0.000 0.268 400 P C -0.356 176.903 177.300 -0.070 0.000 1.205 400 P CA -0.355 62.704 63.100 -0.068 0.000 0.771 400 P CB 0.319 31.848 31.700 -0.284 0.000 0.858 401 F N 4.103 123.953 119.950 -0.167 0.000 2.427 401 F HA 0.456 4.981 4.527 -0.002 0.000 0.352 401 F C -0.922 174.773 175.800 -0.176 0.000 1.100 401 F CA -0.199 57.723 58.000 -0.131 0.000 1.191 401 F CB 0.229 39.177 39.000 -0.086 0.000 1.128 401 F HN 0.102 8.402 8.300 -0.000 0.000 0.533 402 L N 7.497 128.214 121.223 -0.845 0.000 2.431 402 L HA 0.496 4.835 4.340 -0.003 0.000 0.266 402 L C -1.638 174.786 176.870 -0.744 0.000 0.978 402 L CA -0.884 53.527 54.840 -0.716 0.000 0.822 402 L CB 2.314 44.116 42.059 -0.429 0.000 1.310 402 L HN 0.691 8.921 8.230 -0.000 0.000 0.409 403 F N 1.709 121.231 119.950 -0.712 0.000 2.607 403 F HA 0.458 4.984 4.527 -0.002 0.000 0.322 403 F C -0.608 175.049 175.800 -0.239 0.000 1.176 403 F CA -0.263 57.442 58.000 -0.492 0.000 0.977 403 F CB 2.007 40.721 39.000 -0.476 0.000 1.242 403 F HN 0.277 8.576 8.300 -0.000 0.000 0.465 404 S N 4.583 119.867 115.700 -0.693 0.000 2.465 404 S HA 0.460 4.928 4.470 -0.003 0.000 0.279 404 S C -0.579 173.622 174.600 -0.666 0.000 1.201 404 S CA -0.605 57.294 58.200 -0.502 0.000 1.053 404 S CB 1.167 64.146 63.200 -0.368 0.000 0.953 404 S HN 0.443 8.753 8.310 -0.000 0.000 0.488 405 V N 6.361 126.119 119.914 -0.261 0.000 2.470 405 V HA 0.159 4.277 4.120 -0.003 0.000 0.276 405 V C 0.841 176.881 176.094 -0.090 0.000 1.040 405 V CA 0.277 62.518 62.300 -0.098 0.000 1.008 405 V CB 0.583 32.459 31.823 0.089 0.000 0.990 405 V HN 0.869 9.059 8.190 -0.000 0.000 0.477 406 L N 3.118 124.299 121.223 -0.070 0.000 2.609 406 L HA 0.475 4.814 4.340 -0.003 0.000 0.230 406 L C 0.763 177.651 176.870 0.029 0.000 1.064 406 L CA 0.426 55.253 54.840 -0.021 0.000 0.873 406 L CB 0.528 42.581 42.059 -0.012 0.000 1.139 406 L HN 0.597 8.827 8.230 -0.000 0.000 0.490 407 E N 0.175 120.407 120.200 0.053 0.000 2.363 407 E HA 0.392 4.741 4.350 -0.003 0.000 0.281 407 E C -1.618 175.026 176.600 0.072 0.000 0.953 407 E CA -0.601 55.835 56.400 0.061 0.000 0.778 407 E CB 3.075 32.812 29.700 0.062 0.000 1.220 407 E HN -0.125 8.235 8.360 -0.000 0.000 0.431 408 I N 3.331 123.936 120.570 0.058 0.000 2.330 408 I HA 0.229 4.397 4.170 -0.003 0.000 0.286 408 I C -0.404 175.738 176.117 0.040 0.000 1.025 408 I CA -0.368 60.962 61.300 0.051 0.000 1.197 408 I CB 0.712 38.737 38.000 0.043 0.000 1.358 408 I HN 0.389 8.599 8.210 -0.000 0.000 0.467 409 I N 9.613 130.205 120.570 0.038 0.000 2.436 409 I HA 0.187 4.356 4.170 -0.003 0.000 0.289 409 I C -1.909 174.219 176.117 0.019 0.000 1.083 409 I CA -2.008 59.309 61.300 0.030 0.000 1.372 409 I CB -0.032 37.985 38.000 0.029 0.000 1.408 409 I HN 0.364 8.574 8.210 -0.000 0.000 0.516 410 P HA 0.099 4.519 4.420 -0.000 0.000 0.264 410 P C -0.613 176.690 177.300 0.006 0.000 1.229 410 P CA 0.061 63.169 63.100 0.013 0.000 0.780 410 P CB 0.248 31.957 31.700 0.016 0.000 0.808 411 S N 3.072 118.771 115.700 -0.002 0.000 2.677 411 S HA 0.771 5.240 4.470 -0.003 0.000 0.290 411 S C -0.252 174.343 174.600 -0.008 0.000 1.124 411 S CA -0.804 57.390 58.200 -0.009 0.000 1.017 411 S CB 1.243 64.431 63.200 -0.020 0.000 1.215 411 S HN 0.445 8.755 8.310 -0.000 0.000 0.524 412 K N -0.657 119.736 120.400 -0.012 0.000 2.527 412 K HA 0.436 4.754 4.320 -0.003 0.000 0.260 412 K C -1.124 175.468 176.600 -0.013 0.000 0.937 412 K CA -1.028 55.254 56.287 -0.008 0.000 0.826 412 K CB 1.359 33.857 32.500 -0.004 0.000 1.359 412 K HN 0.751 9.001 8.250 -0.000 0.000 0.434 413 K N -0.360 120.035 120.400 -0.008 0.000 2.948 413 K HA -0.252 4.066 4.320 -0.003 0.000 0.253 413 K C -0.645 175.946 176.600 -0.015 0.000 0.970 413 K CA 1.660 57.943 56.287 -0.007 0.000 0.716 413 K CB -2.327 30.170 32.500 -0.004 0.000 1.249 413 K HN 0.674 8.924 8.250 -0.000 0.000 0.483 414 T N -0.300 114.239 114.554 -0.026 0.000 2.832 414 T HA 0.196 4.544 4.350 -0.003 0.000 0.296 414 T C 0.879 175.556 174.700 -0.038 0.000 0.968 414 T CA 0.064 62.141 62.100 -0.038 0.000 1.107 414 T CB 1.567 70.400 68.868 -0.058 0.000 0.916 414 T HN 0.393 8.633 8.240 -0.000 0.000 0.517 415 S N 3.666 119.346 115.700 -0.033 0.000 2.575 415 S HA 0.097 4.566 4.470 -0.003 0.000 0.215 415 S C 1.593 176.169 174.600 -0.041 0.000 0.966 415 S CA 0.033 58.217 58.200 -0.026 0.000 0.911 415 S CB -0.218 62.972 63.200 -0.017 0.000 0.780 415 S HN 0.749 9.059 8.310 -0.000 0.000 0.514 416 N N 1.585 120.248 118.700 -0.061 0.000 2.299 416 N HA 0.051 4.790 4.740 -0.003 0.000 0.187 416 N C -0.618 174.815 175.510 -0.127 0.000 1.099 416 N CA 0.395 53.397 53.050 -0.080 0.000 0.867 416 N CB 0.111 38.552 38.487 -0.076 0.000 0.974 416 N HN 0.265 8.645 8.380 -0.000 0.000 0.477 417 D N 0.653 120.964 120.400 -0.149 0.000 2.835 417 D HA -0.173 4.465 4.640 -0.003 0.000 0.230 417 D C -0.105 176.047 176.300 -0.247 0.000 1.130 417 D CA 0.428 54.272 54.000 -0.260 0.000 0.738 417 D CB -1.217 39.313 40.800 -0.450 0.000 1.090 417 D HN 0.353 8.723 8.370 -0.000 0.000 0.433 418 L N -0.382 120.745 121.223 -0.160 0.000 2.476 418 L HA 0.488 4.827 4.340 -0.003 0.000 0.264 418 L C 0.971 177.766 176.870 -0.126 0.000 1.224 418 L CA 0.430 55.190 54.840 -0.133 0.000 0.821 418 L CB 0.717 42.719 42.059 -0.095 0.000 1.101 418 L HN 0.258 8.488 8.230 -0.000 0.000 0.488 419 A N 2.032 124.790 122.820 -0.104 0.000 2.599 419 A HA 0.606 4.924 4.320 -0.003 0.000 0.294 419 A C -1.431 176.120 177.584 -0.054 0.000 1.055 419 A CA -0.583 51.408 52.037 -0.076 0.000 0.683 419 A CB 1.170 20.117 19.000 -0.088 0.000 1.278 419 A HN 0.548 8.698 8.150 -0.000 0.000 0.412 420 L N 1.839 123.046 121.223 -0.026 0.000 2.294 420 L HA 0.572 4.910 4.340 -0.003 0.000 0.283 420 L C -0.994 175.892 176.870 0.025 0.000 1.015 420 L CA -0.827 54.008 54.840 -0.007 0.000 0.831 420 L CB 1.615 43.675 42.059 0.001 0.000 1.217 420 L HN 0.470 8.700 8.230 -0.000 0.000 0.420 421 V N 2.333 122.272 119.914 0.042 0.000 2.350 421 V HA 0.313 4.431 4.120 -0.003 0.000 0.285 421 V C 0.137 176.359 176.094 0.213 0.000 1.014 421 V CA -0.367 62.002 62.300 0.115 0.000 0.831 421 V CB 1.650 33.540 31.823 0.112 0.000 1.000 421 V HN 0.698 8.888 8.190 -0.000 0.000 0.433 422 S N 3.071 118.894 115.700 0.205 0.000 2.525 422 S HA 0.877 5.345 4.470 -0.003 0.000 0.278 422 S C 0.499 175.221 174.600 0.203 0.000 1.234 422 S CA 0.231 58.567 58.200 0.227 0.000 1.058 422 S CB 1.537 64.825 63.200 0.148 0.000 0.983 422 S HN 1.134 9.444 8.310 -0.000 0.000 0.495 423 G N 2.031 110.921 108.800 0.149 0.000 2.578 423 G HA2 0.510 4.469 3.960 -0.003 0.000 0.302 423 G HA3 0.510 4.469 3.960 -0.003 0.000 0.302 423 G C -1.839 172.740 174.900 -0.536 0.000 1.243 423 G CA -0.605 44.225 45.100 -0.450 0.000 0.843 423 G HN 0.588 8.878 8.290 -0.000 0.000 0.486 424 K N 0.081 119.913 120.400 -0.947 0.000 2.443 424 K HA 0.598 4.916 4.320 -0.003 0.000 0.252 424 K C -1.152 175.098 176.600 -0.583 0.000 0.933 424 K CA -0.732 55.053 56.287 -0.837 0.000 0.792 424 K CB 1.818 33.664 32.500 -1.090 0.000 1.185 424 K HN 0.245 8.495 8.250 -0.000 0.000 0.425 425 L N 3.909 124.987 121.223 -0.242 0.000 2.410 425 L HA 0.093 4.431 4.340 -0.003 0.000 0.273 425 L C 1.256 178.003 176.870 -0.204 0.000 1.144 425 L CA 0.549 55.320 54.840 -0.115 0.000 0.863 425 L CB 0.832 42.920 42.059 0.047 0.000 1.140 425 L HN 0.713 8.943 8.230 -0.000 0.000 0.463 426 E N 0.604 120.662 120.200 -0.237 0.000 2.473 426 E HA 0.183 4.531 4.350 -0.003 0.000 0.204 426 E C -0.073 176.440 176.600 -0.146 0.000 0.994 426 E CA 0.164 56.451 56.400 -0.189 0.000 0.945 426 E CB 0.963 30.540 29.700 -0.204 0.000 0.990 426 E HN 0.503 8.863 8.360 -0.000 0.000 0.493 427 S N -1.303 114.298 115.700 -0.166 0.000 2.543 427 S HA 0.519 4.987 4.470 -0.003 0.000 0.274 427 S C 0.053 174.619 174.600 -0.057 0.000 1.149 427 S CA 0.140 58.270 58.200 -0.117 0.000 0.866 427 S CB 1.081 64.180 63.200 -0.169 0.000 1.111 427 S HN 0.343 8.653 8.310 -0.000 0.000 0.457 428 G N 2.748 111.551 108.800 0.006 0.000 2.552 428 G HA2 -0.036 3.922 3.960 -0.003 0.000 0.265 428 G HA3 -0.036 3.922 3.960 -0.003 0.000 0.265 428 G C 0.048 175.019 174.900 0.118 0.000 1.234 428 G CA 0.588 45.730 45.100 0.069 0.000 0.944 428 G HN 2.244 10.534 8.290 -0.000 0.000 0.568 429 S N -1.605 114.182 115.700 0.146 0.000 2.685 429 S HA 0.802 5.270 4.470 -0.003 0.000 0.282 429 S C -1.009 173.567 174.600 -0.041 0.000 1.159 429 S CA 0.071 58.315 58.200 0.074 0.000 0.833 429 S CB 2.473 65.653 63.200 -0.033 0.000 1.151 429 S HN 2.149 10.459 8.310 -0.000 0.000 0.485 430 I N 0.288 120.736 120.570 -0.203 0.000 2.752 430 I HA 0.514 4.682 4.170 -0.003 0.000 0.295 430 I C -1.731 174.176 176.117 -0.351 0.000 1.219 430 I CA -0.229 60.808 61.300 -0.439 0.000 1.030 430 I CB 2.195 39.724 38.000 -0.785 0.000 1.259 430 I HN 0.915 9.125 8.210 -0.000 0.000 0.423 431 Q N 6.860 126.458 119.800 -0.337 0.000 2.397 431 Q HA 0.557 4.896 4.340 -0.003 0.000 0.275 431 Q C -2.603 173.243 176.000 -0.257 0.000 1.090 431 Q CA -2.049 53.575 55.803 -0.297 0.000 0.809 431 Q CB 2.089 30.671 28.738 -0.260 0.000 1.362 431 Q HN 0.321 8.591 8.270 -0.000 0.000 0.431 432 P HA 0.002 4.422 4.420 -0.000 0.000 0.265 432 P C 0.514 177.723 177.300 -0.151 0.000 1.193 432 P CA 1.113 64.104 63.100 -0.182 0.000 0.765 432 P CB 0.553 32.160 31.700 -0.155 0.000 0.823 433 G N 1.845 110.562 108.800 -0.139 0.000 2.376 433 G HA2 -0.182 3.776 3.960 -0.003 0.000 0.208 433 G HA3 -0.182 3.776 3.960 -0.003 0.000 0.208 433 G C 0.120 174.950 174.900 -0.117 0.000 1.032 433 G CA -0.391 44.643 45.100 -0.111 0.000 0.641 433 G HN 0.534 8.824 8.290 -0.000 0.000 0.503 434 E N 1.042 121.150 120.200 -0.153 0.000 2.392 434 E HA 0.548 4.896 4.350 -0.003 0.000 0.256 434 E C -0.022 176.480 176.600 -0.165 0.000 1.145 434 E CA 0.414 56.718 56.400 -0.160 0.000 0.929 434 E CB 0.831 30.398 29.700 -0.222 0.000 0.998 434 E HN 0.314 8.674 8.360 -0.000 0.000 0.442 435 S N 0.409 116.033 115.700 -0.127 0.000 2.704 435 S HA 0.646 5.114 4.470 -0.003 0.000 0.305 435 S C -0.839 173.703 174.600 -0.098 0.000 1.107 435 S CA -0.842 57.302 58.200 -0.094 0.000 0.993 435 S CB 0.895 64.084 63.200 -0.017 0.000 1.110 435 S HN 0.396 8.706 8.310 -0.000 0.000 0.534 436 L N -1.481 119.712 121.223 -0.051 0.000 2.491 436 L HA 0.869 5.207 4.340 -0.003 0.000 0.254 436 L C -0.722 176.174 176.870 0.044 0.000 1.048 436 L CA -0.587 54.270 54.840 0.030 0.000 0.855 436 L CB 1.123 43.214 42.059 0.053 0.000 1.466 436 L HN 0.476 8.706 8.230 -0.000 0.000 0.409 437 T N 1.496 116.096 114.554 0.076 0.000 2.824 437 T HA 0.758 5.107 4.350 -0.003 0.000 0.282 437 T C -0.329 174.297 174.700 -0.122 0.000 0.993 437 T CA -0.100 61.962 62.100 -0.064 0.000 0.967 437 T CB 1.126 69.915 68.868 -0.131 0.000 0.960 437 T HN 0.537 8.777 8.240 -0.000 0.000 0.441 438 I N 3.186 123.626 120.570 -0.216 0.000 2.336 438 I HA 0.418 4.586 4.170 -0.003 0.000 0.292 438 I C -0.848 175.093 176.117 -0.293 0.000 0.991 438 I CA -0.921 60.305 61.300 -0.123 0.000 1.227 438 I CB 0.846 38.823 38.000 -0.038 0.000 1.366 438 I HN 0.570 8.780 8.210 -0.000 0.000 0.466 439 Y N 6.639 126.971 120.300 0.053 0.000 2.420 439 Y HA 0.353 4.902 4.550 -0.002 0.000 0.334 439 Y C -1.714 174.224 175.900 0.064 0.000 1.094 439 Y CA -2.018 56.113 58.100 0.050 0.000 1.126 439 Y CB 0.943 39.419 38.460 0.027 0.000 1.217 439 Y HN 0.413 8.693 8.280 -0.000 0.000 0.462 440 P HA -0.033 4.387 4.420 -0.000 0.000 0.251 440 P C 1.084 178.485 177.300 0.168 0.000 1.223 440 P CA 0.782 64.030 63.100 0.246 0.000 0.796 440 P CB 0.239 32.107 31.700 0.280 0.000 1.068 441 S N 0.291 116.046 115.700 0.092 0.000 2.423 441 S HA -0.150 4.319 4.470 -0.003 0.000 0.231 441 S C 1.038 175.675 174.600 0.061 0.000 1.014 441 S CA 0.602 58.859 58.200 0.096 0.000 0.965 441 S CB -1.152 62.045 63.200 -0.004 0.000 0.785 441 S HN 0.212 8.522 8.310 -0.000 0.000 0.495 442 E N 0.800 120.925 120.200 -0.126 0.000 2.791 442 E HA -0.216 4.132 4.350 -0.003 0.000 0.271 442 E C -0.326 176.192 176.600 -0.137 0.000 1.044 442 E CA 0.733 56.984 56.400 -0.248 0.000 0.814 442 E CB -1.883 27.775 29.700 -0.070 0.000 1.400 442 E HN 0.997 9.357 8.360 -0.000 0.000 0.423 443 Q N -0.110 119.595 119.800 -0.158 0.000 2.267 443 Q HA 0.548 4.886 4.340 -0.003 0.000 0.255 443 Q C -0.435 175.533 176.000 -0.054 0.000 0.923 443 Q CA -0.306 55.441 55.803 -0.093 0.000 0.925 443 Q CB 1.593 30.139 28.738 -0.320 0.000 1.195 443 Q HN -0.087 8.183 8.270 -0.000 0.000 0.417 444 S N 1.916 117.667 115.700 0.084 0.000 2.541 444 S HA 0.538 5.006 4.470 -0.003 0.000 0.283 444 S C -0.676 173.993 174.600 0.114 0.000 1.196 444 S CA -0.609 57.656 58.200 0.109 0.000 1.062 444 S CB 0.793 64.115 63.200 0.203 0.000 1.009 444 S HN 0.728 9.038 8.310 -0.000 0.000 0.502 445 C N 2.440 121.756 119.300 0.026 0.000 3.154 445 C HA 0.643 5.101 4.460 -0.003 0.000 0.312 445 C C -0.500 174.449 174.990 -0.067 0.000 1.349 445 C CA -0.943 58.053 59.018 -0.037 0.000 1.518 445 C CB 0.733 28.430 27.740 -0.073 0.000 1.934 445 C HN 0.767 8.997 8.230 -0.000 0.000 0.462 446 I N 1.587 122.095 120.570 -0.103 0.000 2.433 446 I HA 0.459 4.628 4.170 -0.003 0.000 0.292 446 I C -0.269 175.763 176.117 -0.142 0.000 1.001 446 I CA -0.530 60.699 61.300 -0.117 0.000 1.119 446 I CB 1.650 39.584 38.000 -0.112 0.000 1.289 446 I HN 0.450 8.660 8.210 -0.000 0.000 0.438 447 V N 6.272 126.084 119.914 -0.170 0.000 2.406 447 V HA 0.246 4.365 4.120 -0.003 0.000 0.272 447 V C 0.429 176.428 176.094 -0.159 0.000 1.043 447 V CA -0.013 62.176 62.300 -0.184 0.000 0.915 447 V CB 1.172 32.847 31.823 -0.246 0.000 0.988 447 V HN 0.924 9.114 8.190 -0.000 0.000 0.466 448 D N 4.855 125.173 120.400 -0.137 0.000 2.449 448 D HA 0.181 4.819 4.640 -0.003 0.000 0.210 448 D C 0.176 176.406 176.300 -0.117 0.000 1.094 448 D CA 0.096 54.024 54.000 -0.120 0.000 0.846 448 D CB 0.510 41.249 40.800 -0.102 0.000 1.003 448 D HN 0.583 8.953 8.370 -0.000 0.000 0.504 449 K N 0.296 120.622 120.400 -0.124 0.000 2.527 449 K HA 0.498 4.817 4.320 -0.003 0.000 0.260 449 K C -1.090 175.435 176.600 -0.124 0.000 0.937 449 K CA -0.670 55.546 56.287 -0.119 0.000 0.826 449 K CB 2.840 35.280 32.500 -0.101 0.000 1.359 449 K HN -0.083 8.167 8.250 -0.000 0.000 0.434 450 I N 2.766 123.262 120.570 -0.123 0.000 2.411 450 I HA 0.203 4.371 4.170 -0.003 0.000 0.284 450 I C -0.439 175.630 176.117 -0.080 0.000 1.012 450 I CA -0.659 60.575 61.300 -0.111 0.000 1.119 450 I CB 1.744 39.662 38.000 -0.136 0.000 1.261 450 I HN 0.320 8.530 8.210 -0.000 0.000 0.448 451 Q N 4.622 124.389 119.800 -0.055 0.000 2.256 451 Q HA 0.582 4.920 4.340 -0.003 0.000 0.254 451 Q C -0.662 175.318 176.000 -0.033 0.000 0.916 451 Q CA -0.343 55.435 55.803 -0.042 0.000 0.932 451 Q CB 3.145 31.866 28.738 -0.028 0.000 1.207 451 Q HN 0.512 8.782 8.270 -0.000 0.000 0.426 452 V N 1.631 121.516 119.914 -0.048 0.000 3.181 452 V HA 0.883 5.001 4.120 -0.003 0.000 0.314 452 V C 0.024 176.038 176.094 -0.133 0.000 1.173 452 V CA 0.510 62.763 62.300 -0.079 0.000 1.052 452 V CB 1.689 33.472 31.823 -0.067 0.000 1.123 452 V HN 1.018 9.208 8.190 -0.000 0.000 0.454 453 G N 1.764 110.401 108.800 -0.271 0.000 2.782 453 G HA2 -0.198 3.761 3.960 -0.003 0.000 0.228 453 G HA3 -0.198 3.761 3.960 -0.003 0.000 0.228 453 G C 0.581 175.259 174.900 -0.371 0.000 1.372 453 G CA 0.136 45.034 45.100 -0.338 0.000 0.862 453 G HN 1.489 9.779 8.290 -0.000 0.000 0.547 454 S N -0.137 115.448 115.700 -0.192 0.000 2.474 454 S HA -0.086 4.382 4.470 -0.003 0.000 0.235 454 S C 2.142 176.742 174.600 -0.000 0.000 0.997 454 S CA 1.953 60.143 58.200 -0.016 0.000 0.949 454 S CB -0.091 63.156 63.200 0.078 0.000 0.766 454 S HN 0.622 8.932 8.310 -0.000 0.000 0.517 455 Q N 1.290 121.079 119.800 -0.018 0.000 2.172 455 Q HA -0.084 4.255 4.340 -0.003 0.000 0.200 455 Q C 1.384 177.390 176.000 0.010 0.000 0.964 455 Q CA 0.445 56.254 55.803 0.011 0.000 0.855 455 Q CB -0.233 28.522 28.738 0.028 0.000 0.918 455 Q HN 0.793 9.063 8.270 -0.000 0.000 0.444 463 E N 2.374 122.648 120.200 0.125 0.000 2.257 463 E HA 0.193 4.542 4.350 -0.003 0.000 0.278 463 E C -0.657 175.930 176.600 -0.021 0.000 1.049 463 E CA 0.342 56.784 56.400 0.069 0.000 0.876 463 E CB 0.887 30.625 29.700 0.064 0.000 1.035 463 E HN 0.272 8.632 8.360 -0.000 0.000 0.419 464 E N 2.222 122.395 120.200 -0.045 0.000 2.281 464 E HA 0.142 4.491 4.350 -0.003 0.000 0.266 464 E C -0.879 175.690 176.600 -0.052 0.000 0.893 464 E CA -0.513 55.846 56.400 -0.068 0.000 0.798 464 E CB 1.700 31.335 29.700 -0.108 0.000 1.245 464 E HN 0.502 8.862 8.360 -0.000 0.000 0.410 465 T N -0.792 113.730 114.554 -0.053 0.000 2.918 465 T HA 0.247 4.595 4.350 -0.003 0.000 0.283 465 T C 0.389 175.003 174.700 -0.143 0.000 1.001 465 T CA -0.660 61.408 62.100 -0.052 0.000 1.041 465 T CB 1.312 70.177 68.868 -0.007 0.000 1.028 465 T HN 0.121 8.361 8.240 -0.000 0.000 0.511 466 D N 0.243 120.515 120.400 -0.214 0.000 2.350 466 D HA 0.236 4.875 4.640 -0.003 0.000 0.213 466 D C -0.017 175.965 176.300 -0.530 0.000 1.031 466 D CA 0.405 54.180 54.000 -0.375 0.000 0.861 466 D CB 0.278 40.766 40.800 -0.520 0.000 0.926 466 D HN 0.385 8.755 8.370 -0.000 0.000 0.520 467 V N 0.331 119.902 119.914 -0.572 0.000 2.777 467 V HA 0.702 4.821 4.120 -0.003 0.000 0.306 467 V C -0.711 175.088 176.094 -0.491 0.000 1.112 467 V CA -1.180 60.700 62.300 -0.701 0.000 0.917 467 V CB 2.046 33.086 31.823 -1.306 0.000 1.018 467 V HN 0.017 8.207 8.190 -0.000 0.000 0.426 468 A N 5.403 128.045 122.820 -0.298 0.000 2.355 468 A HA 1.007 5.325 4.320 -0.003 0.000 0.324 468 A C -0.728 176.819 177.584 -0.062 0.000 1.117 468 A CA -0.611 51.354 52.037 -0.121 0.000 0.785 468 A CB 1.698 20.669 19.000 -0.048 0.000 1.254 468 A HN 1.130 9.280 8.150 -0.000 0.000 0.453 469 I N -0.969 119.614 120.570 0.021 0.000 3.239 469 I HA 0.528 4.697 4.170 -0.003 0.000 0.314 469 I C -0.219 175.931 176.117 0.055 0.000 1.126 469 I CA -0.968 60.365 61.300 0.055 0.000 0.973 469 I CB 1.717 39.767 38.000 0.082 0.000 1.252 469 I HN 0.771 8.981 8.210 -0.000 0.000 0.463 470 K N 1.251 121.681 120.400 0.049 0.000 2.548 470 K HA 0.022 4.341 4.320 -0.003 0.000 0.277 470 K C 0.952 177.563 176.600 0.018 0.000 1.001 470 K CA 1.977 58.272 56.287 0.014 0.000 1.102 470 K CB -0.197 32.310 32.500 0.012 0.000 0.848 470 K HN 1.118 9.368 8.250 -0.000 0.000 0.487 471 G N 3.370 112.160 108.800 -0.018 0.000 2.299 471 G HA2 -0.223 3.736 3.960 -0.003 0.000 0.237 471 G HA3 -0.223 3.736 3.960 -0.003 0.000 0.237 471 G C -0.318 174.589 174.900 0.013 0.000 1.027 471 G CA 0.223 45.347 45.100 0.040 0.000 0.619 471 G HN 0.717 9.007 8.290 -0.000 0.000 0.513 472 D N 0.652 121.011 120.400 -0.069 0.000 2.424 472 D HA 0.469 5.108 4.640 -0.003 0.000 0.244 472 D C 0.166 176.394 176.300 -0.121 0.000 1.134 472 D CA 0.171 54.092 54.000 -0.131 0.000 0.881 472 D CB 0.274 41.032 40.800 -0.069 0.000 1.191 472 D HN 0.166 8.536 8.370 -0.000 0.000 0.445 473 F N 1.491 121.404 119.950 -0.062 0.000 2.411 473 F HA 0.310 4.835 4.527 -0.003 0.000 0.355 473 F C 0.751 176.575 175.800 0.040 0.000 1.117 473 F CA -0.518 57.508 58.000 0.043 0.000 1.139 473 F CB 0.885 39.975 39.000 0.151 0.000 1.120 473 F HN 0.030 8.330 8.300 -0.000 0.000 0.493 474 V N -0.059 119.979 119.914 0.206 0.000 3.181 474 V HA 0.727 4.845 4.120 -0.003 0.000 0.308 474 V C -0.684 175.528 176.094 0.197 0.000 1.214 474 V CA -0.711 61.682 62.300 0.155 0.000 1.053 474 V CB 1.944 33.833 31.823 0.110 0.000 1.069 474 V HN 0.505 8.695 8.190 -0.000 0.000 0.441 475 T N 3.405 118.023 114.554 0.108 0.000 2.792 475 T HA 0.675 5.023 4.350 -0.003 0.000 0.280 475 T C -0.494 174.216 174.700 0.017 0.000 0.990 475 T CA -0.285 61.872 62.100 0.096 0.000 0.960 475 T CB 1.011 69.917 68.868 0.063 0.000 0.939 475 T HN 0.672 8.912 8.240 -0.000 0.000 0.439 476 L N 3.182 124.397 121.223 -0.013 0.000 2.282 476 L HA 0.508 4.847 4.340 -0.003 0.000 0.288 476 L C 0.466 177.283 176.870 -0.089 0.000 1.033 476 L CA -0.833 53.938 54.840 -0.114 0.000 0.807 476 L CB 1.269 43.177 42.059 -0.253 0.000 1.209 476 L HN 0.405 8.635 8.230 -0.000 0.000 0.423 477 K N 4.672 125.013 120.400 -0.099 0.000 2.284 477 K HA 0.477 4.796 4.320 -0.003 0.000 0.287 477 K C -1.043 175.488 176.600 -0.115 0.000 1.081 477 K CA -0.383 55.849 56.287 -0.091 0.000 0.910 477 K CB 0.535 32.985 32.500 -0.084 0.000 1.088 477 K HN 0.524 8.774 8.250 -0.000 0.000 0.478 478 L N 4.712 125.867 121.223 -0.114 0.000 2.307 478 L HA 0.479 4.818 4.340 -0.003 0.000 0.284 478 L C 0.273 177.060 176.870 -0.137 0.000 1.023 478 L CA -0.948 53.814 54.840 -0.131 0.000 0.810 478 L CB 1.636 43.618 42.059 -0.129 0.000 1.231 478 L HN 0.517 8.747 8.230 -0.000 0.000 0.423 479 R N 1.915 122.332 120.500 -0.139 0.000 2.459 479 R HA 0.217 4.556 4.340 -0.003 0.000 0.281 479 R C 0.204 176.400 176.300 -0.174 0.000 1.050 479 R CA -0.551 55.460 56.100 -0.148 0.000 1.055 479 R CB 0.640 30.863 30.300 -0.129 0.000 1.045 479 R HN 0.477 8.747 8.270 -0.000 0.000 0.495 480 K N -0.026 120.243 120.400 -0.217 0.000 3.117 480 K HA -0.211 4.107 4.320 -0.003 0.000 0.269 480 K C -1.531 174.889 176.600 -0.299 0.000 1.098 480 K CA 0.661 56.806 56.287 -0.236 0.000 0.785 480 K CB -0.844 31.565 32.500 -0.151 0.000 1.242 480 K HN 0.684 8.934 8.250 -0.000 0.000 0.491 481 A N 0.769 123.322 122.820 -0.445 0.000 2.340 481 A HA 0.687 5.005 4.320 -0.003 0.000 0.331 481 A C -1.190 176.018 177.584 -0.627 0.000 1.140 481 A CA -0.546 51.272 52.037 -0.366 0.000 0.801 481 A CB 0.626 19.506 19.000 -0.200 0.000 1.234 481 A HN 0.310 8.460 8.150 -0.000 0.000 0.469 482 Y N 1.847 122.057 120.300 -0.150 0.000 2.646 482 Y HA 0.347 4.897 4.550 -0.001 0.000 0.334 482 Y C -2.034 173.813 175.900 -0.088 0.000 1.004 482 Y CA -2.028 56.013 58.100 -0.099 0.000 1.301 482 Y CB 1.408 39.814 38.460 -0.091 0.000 1.093 482 Y HN 0.531 8.811 8.280 -0.000 0.000 0.530 483 P HA -0.175 4.245 4.420 -0.000 0.000 0.219 483 P C 0.664 177.998 177.300 0.058 0.000 1.146 483 P CA 1.491 64.607 63.100 0.027 0.000 0.808 483 P CB 0.399 32.106 31.700 0.012 0.000 0.779 484 E N -0.758 119.499 120.200 0.096 0.000 2.333 484 E HA -0.127 4.222 4.350 -0.003 0.000 0.198 484 E C 0.884 177.544 176.600 0.099 0.000 1.007 484 E CA 0.943 57.402 56.400 0.098 0.000 0.845 484 E CB -0.631 29.143 29.700 0.124 0.000 0.766 484 E HN 0.309 8.669 8.360 -0.000 0.000 0.507 485 D N -0.176 120.282 120.400 0.096 0.000 2.535 485 D HA 0.202 4.841 4.640 -0.003 0.000 0.229 485 D C -0.372 175.951 176.300 0.040 0.000 1.238 485 D CA -0.040 54.009 54.000 0.082 0.000 0.824 485 D CB 0.585 41.462 40.800 0.128 0.000 1.045 485 D HN 0.150 8.520 8.370 -0.000 0.000 0.500 486 I N 1.325 121.917 120.570 0.036 0.000 2.382 486 I HA 0.238 4.407 4.170 -0.003 0.000 0.286 486 I C -0.001 176.145 176.117 0.049 0.000 1.002 486 I CA -0.424 60.898 61.300 0.037 0.000 1.135 486 I CB 1.668 39.684 38.000 0.027 0.000 1.288 486 I HN -0.398 7.812 8.210 -0.000 0.000 0.448 487 Q N 4.217 124.049 119.800 0.054 0.000 2.399 487 Q HA 0.430 4.768 4.340 -0.003 0.000 0.276 487 Q C -0.637 175.392 176.000 0.049 0.000 1.098 487 Q CA -0.949 54.884 55.803 0.050 0.000 0.827 487 Q CB 2.326 31.092 28.738 0.047 0.000 1.386 487 Q HN 0.537 8.807 8.270 -0.000 0.000 0.443 488 N N -0.104 118.621 118.700 0.042 0.000 2.412 488 N HA 0.067 4.805 4.740 -0.003 0.000 0.254 488 N C 0.544 176.071 175.510 0.029 0.000 1.232 488 N CA 0.878 53.947 53.050 0.033 0.000 0.880 488 N CB 0.269 38.775 38.487 0.032 0.000 1.076 488 N HN 0.892 9.272 8.380 -0.000 0.000 0.458 489 G N 1.139 109.946 108.800 0.013 0.000 2.194 489 G HA2 -0.227 3.731 3.960 -0.003 0.000 0.236 489 G HA3 -0.227 3.731 3.960 -0.003 0.000 0.236 489 G C -0.235 174.678 174.900 0.022 0.000 0.987 489 G CA -0.261 44.845 45.100 0.011 0.000 0.635 489 G HN 0.574 8.864 8.290 -0.000 0.000 0.520 490 D N -0.183 120.242 120.400 0.042 0.000 2.360 490 D HA 0.584 5.222 4.640 -0.003 0.000 0.242 490 D C 0.108 176.452 176.300 0.073 0.000 1.184 490 D CA -0.011 54.034 54.000 0.074 0.000 0.930 490 D CB 1.399 42.254 40.800 0.092 0.000 1.161 490 D HN 0.204 8.574 8.370 -0.000 0.000 0.447 491 L N 0.788 122.084 121.223 0.122 0.000 2.381 491 L HA 0.646 4.984 4.340 -0.003 0.000 0.274 491 L C -0.986 176.023 176.870 0.232 0.000 0.988 491 L CA -0.729 54.182 54.840 0.118 0.000 0.824 491 L CB 1.257 43.357 42.059 0.068 0.000 1.263 491 L HN 0.421 8.651 8.230 -0.000 0.000 0.410 492 A N 3.597 126.550 122.820 0.222 0.000 2.337 492 A HA 1.029 5.347 4.320 -0.003 0.000 0.331 492 A C -0.894 176.786 177.584 0.160 0.000 1.137 492 A CA 0.097 52.289 52.037 0.259 0.000 0.807 492 A CB 1.509 20.686 19.000 0.295 0.000 1.250 492 A HN 1.143 9.293 8.150 -0.000 0.000 0.468 493 A N 0.307 123.293 122.820 0.278 0.000 2.594 493 A HA 0.751 5.069 4.320 -0.003 0.000 0.291 493 A C 0.052 177.855 177.584 0.365 0.000 1.105 493 A CA -0.437 51.730 52.037 0.217 0.000 0.694 493 A CB 0.442 19.568 19.000 0.210 0.000 1.291 493 A HN 1.235 9.385 8.150 -0.000 0.000 0.410 494 S N 0.088 115.981 115.700 0.321 0.000 2.571 494 S HA 0.109 4.577 4.470 -0.003 0.000 0.298 494 S C 1.845 176.585 174.600 0.233 0.000 1.280 494 S CA 0.308 58.652 58.200 0.240 0.000 1.052 494 S CB 0.640 63.952 63.200 0.187 0.000 0.799 494 S HN 1.716 10.025 8.310 -0.000 0.000 0.501 495 V N 0.376 120.383 119.914 0.155 0.000 2.594 495 V HA -0.124 3.994 4.120 -0.003 0.000 0.253 495 V C 1.335 177.513 176.094 0.141 0.000 1.069 495 V CA 1.794 64.175 62.300 0.136 0.000 1.082 495 V CB -0.733 31.139 31.823 0.082 0.000 0.680 495 V HN 0.899 9.089 8.190 -0.000 0.000 0.469 496 D N -1.703 118.783 120.400 0.143 0.000 2.358 496 D HA 0.063 4.702 4.640 -0.003 0.000 0.224 496 D C 0.175 176.571 176.300 0.160 0.000 1.123 496 D CA -0.395 53.677 54.000 0.120 0.000 0.833 496 D CB -0.486 40.368 40.800 0.090 0.000 0.946 496 D HN 0.646 9.016 8.370 -0.000 0.000 0.505 497 Y N 1.550 121.887 120.300 0.062 0.000 2.331 497 Y HA 0.399 4.948 4.550 -0.003 0.000 0.338 497 Y C 0.391 176.289 175.900 -0.004 0.000 0.992 497 Y CA -0.651 57.469 58.100 0.033 0.000 1.121 497 Y CB 1.671 40.156 38.460 0.042 0.000 1.184 497 Y HN -0.037 8.243 8.280 -0.000 0.000 0.469 498 S N 1.169 116.552 115.700 -0.529 0.000 2.941 498 S HA 0.155 4.623 4.470 -0.003 0.000 0.251 498 S C 0.256 174.529 174.600 -0.544 0.000 1.029 498 S CA -0.335 57.624 58.200 -0.403 0.000 1.062 498 S CB 0.248 63.341 63.200 -0.178 0.000 0.977 498 S HN 0.502 8.812 8.310 -0.000 0.000 0.552 499 S N 1.365 116.557 115.700 -0.848 0.000 2.575 499 S HA 0.401 4.869 4.470 -0.003 0.000 0.215 499 S C 0.443 174.791 174.600 -0.420 0.000 0.966 499 S CA -0.298 57.616 58.200 -0.477 0.000 0.911 499 S CB -0.197 62.751 63.200 -0.420 0.000 0.780 499 S HN 0.594 8.904 8.310 -0.000 0.000 0.514 500 I N 2.688 122.858 120.570 -0.666 0.000 2.395 500 I HA 0.275 4.444 4.170 -0.003 0.000 0.289 500 I C -0.011 175.543 176.117 -0.938 0.000 1.023 500 I CA -0.150 60.763 61.300 -0.645 0.000 1.350 500 I CB 0.591 38.117 38.000 -0.790 0.000 1.409 500 I HN 0.196 8.406 8.210 -0.000 0.000 0.507 501 H N 3.605 122.527 119.070 -0.246 0.000 2.930 501 H HA 0.372 4.927 4.556 -0.002 0.000 0.371 501 H C -1.031 174.196 175.328 -0.168 0.000 1.169 501 H CA -0.779 55.154 56.048 -0.193 0.000 1.157 501 H CB 2.198 31.861 29.762 -0.165 0.000 1.789 501 H HN 0.401 8.681 8.280 -0.000 0.000 0.547 502 S N 0.935 116.592 115.700 -0.072 0.000 2.480 502 S HA 0.724 5.193 4.470 -0.003 0.000 0.286 502 S C -0.145 174.258 174.600 -0.329 0.000 1.180 502 S CA -0.587 57.498 58.200 -0.192 0.000 1.075 502 S CB 1.339 64.331 63.200 -0.348 0.000 0.996 502 S HN 0.745 9.055 8.310 -0.000 0.000 0.487 503 A N 2.153 124.848 122.820 -0.209 0.000 2.594 503 A HA 0.557 4.876 4.320 -0.003 0.000 0.295 503 A C 0.251 177.908 177.584 0.121 0.000 1.071 503 A CA -0.535 51.417 52.037 -0.142 0.000 0.685 503 A CB 1.127 20.147 19.000 0.033 0.000 1.285 503 A HN 0.619 8.769 8.150 -0.000 0.000 0.405 504 Q N -0.581 119.297 119.800 0.130 0.000 2.302 504 Q HA 0.091 4.429 4.340 -0.003 0.000 0.202 504 Q C -0.280 175.814 176.000 0.157 0.000 0.936 504 Q CA 1.107 57.077 55.803 0.278 0.000 0.886 504 Q CB 0.232 29.115 28.738 0.242 0.000 0.986 504 Q HN 0.767 9.037 8.270 -0.000 0.000 0.487 505 C N 0.448 119.823 119.300 0.125 0.000 2.609 505 C HA 0.689 5.148 4.460 -0.003 0.000 0.313 505 C C -0.649 174.406 174.990 0.107 0.000 1.175 505 C CA -1.080 57.909 59.018 -0.047 0.000 1.434 505 C CB 0.630 28.345 27.740 -0.043 0.000 2.005 505 C HN 0.333 8.563 8.230 -0.000 0.000 0.471 506 F N -0.095 119.873 119.950 0.029 0.000 2.711 506 F HA 0.837 5.362 4.527 -0.002 0.000 0.313 506 F C -0.977 174.851 175.800 0.046 0.000 1.141 506 F CA -1.283 56.731 58.000 0.024 0.000 0.941 506 F CB 0.551 39.565 39.000 0.024 0.000 1.349 506 F HN 0.227 8.527 8.300 -0.000 0.000 0.464 507 V N 2.448 122.509 119.914 0.244 0.000 2.472 507 V HA 0.501 4.619 4.120 -0.003 0.000 0.290 507 V C -0.711 175.540 176.094 0.262 0.000 1.037 507 V CA -0.561 61.847 62.300 0.180 0.000 0.908 507 V CB 1.456 33.371 31.823 0.152 0.000 0.985 507 V HN 0.544 8.734 8.190 -0.000 0.000 0.454 508 L N 3.515 124.861 121.223 0.205 0.000 2.322 508 L HA 0.456 4.794 4.340 -0.003 0.000 0.281 508 L C 0.203 177.134 176.870 0.102 0.000 1.014 508 L CA -0.175 54.766 54.840 0.168 0.000 0.815 508 L CB 1.512 43.634 42.059 0.105 0.000 1.247 508 L HN 0.726 8.956 8.230 -0.000 0.000 0.421 509 E N 3.380 123.600 120.200 0.034 0.000 1.996 509 E HA 0.281 4.629 4.350 -0.003 0.000 0.280 509 E C -1.292 175.180 176.600 -0.214 0.000 1.092 509 E CA -0.506 55.742 56.400 -0.254 0.000 0.862 509 E CB 0.583 30.174 29.700 -0.183 0.000 1.066 509 E HN 0.394 8.754 8.360 -0.000 0.000 0.396 510 L N 4.306 125.372 121.223 -0.262 0.000 2.307 510 L HA 0.386 4.724 4.340 -0.003 0.000 0.284 510 L C -0.685 176.045 176.870 -0.232 0.000 1.023 510 L CA -0.128 54.585 54.840 -0.212 0.000 0.810 510 L CB 2.078 44.020 42.059 -0.195 0.000 1.231 510 L HN 0.355 8.585 8.230 -0.000 0.000 0.423 511 T N 3.015 117.418 114.554 -0.252 0.000 2.770 511 T HA 0.354 4.702 4.350 -0.003 0.000 0.283 511 T C -0.216 174.173 174.700 -0.520 0.000 0.988 511 T CA -0.269 61.665 62.100 -0.276 0.000 0.957 511 T CB 1.109 69.869 68.868 -0.180 0.000 0.930 511 T HN 0.643 8.883 8.240 -0.000 0.000 0.443 512 T N 2.683 116.996 114.554 -0.401 0.000 2.929 512 T HA 0.700 5.048 4.350 -0.003 0.000 0.284 512 T C -0.435 174.041 174.700 -0.374 0.000 1.014 512 T CA -0.463 61.352 62.100 -0.474 0.000 1.051 512 T CB 0.243 68.982 68.868 -0.214 0.000 1.028 512 T HN 0.286 8.526 8.240 -0.000 0.000 0.485 513 F N 0.443 120.384 119.950 -0.014 0.000 2.808 513 F HA 0.461 4.987 4.527 -0.003 0.000 0.257 513 F C 0.881 176.687 175.800 0.009 0.000 1.286 513 F CA -1.062 56.938 58.000 -0.001 0.000 0.999 513 F CB -0.027 38.975 39.000 0.003 0.000 2.005 513 F HN 0.347 8.647 8.300 -0.000 0.000 0.528 514 D N 2.099 122.657 120.400 0.263 0.000 2.393 514 D HA 0.278 4.916 4.640 -0.003 0.000 0.232 514 D C -0.345 176.025 176.300 0.117 0.000 1.192 514 D CA 0.421 54.505 54.000 0.139 0.000 0.882 514 D CB 0.479 41.340 40.800 0.101 0.000 1.038 514 D HN 0.201 8.571 8.370 -0.000 0.000 0.499 515 M N 1.393 121.043 119.600 0.084 0.000 2.598 515 M HA 0.196 4.674 4.480 -0.003 0.000 0.317 515 M C 1.112 177.442 176.300 0.051 0.000 1.201 515 M CA -0.898 54.441 55.300 0.065 0.000 0.971 515 M CB 1.407 34.033 32.600 0.044 0.000 1.657 515 M HN 0.016 8.306 8.290 -0.000 0.000 0.470 516 N N 0.170 118.897 118.700 0.044 0.000 2.395 516 N HA 0.070 4.809 4.740 -0.003 0.000 0.175 516 N C -0.131 175.396 175.510 0.028 0.000 1.029 516 N CA 0.499 53.570 53.050 0.034 0.000 0.897 516 N CB 0.329 38.834 38.487 0.030 0.000 0.991 516 N HN 0.472 8.852 8.380 -0.000 0.000 0.441 517 R N -0.113 120.406 120.500 0.032 0.000 2.750 517 R HA 0.477 4.815 4.340 -0.003 0.000 0.281 517 R C -2.778 173.542 176.300 0.035 0.000 0.972 517 R CA -1.921 54.195 56.100 0.025 0.000 0.912 517 R CB 1.821 32.135 30.300 0.023 0.000 1.187 517 R HN 0.083 8.353 8.270 -0.000 0.000 0.464 518 P HA 0.106 4.526 4.420 -0.000 0.000 0.274 518 P C -0.734 176.605 177.300 0.065 0.000 1.231 518 P CA -0.587 62.559 63.100 0.078 0.000 0.790 518 P CB 0.523 32.292 31.700 0.115 0.000 0.951 519 L N 2.358 123.619 121.223 0.063 0.000 2.380 519 L HA 0.322 4.660 4.340 -0.003 0.000 0.273 519 L C 0.319 177.229 176.870 0.065 0.000 1.138 519 L CA 0.268 55.133 54.840 0.043 0.000 0.832 519 L CB -0.753 41.300 42.059 -0.011 0.000 1.124 519 L HN 0.307 8.537 8.230 -0.000 0.000 0.454 520 L N 3.772 125.030 121.223 0.060 0.000 2.309 520 L HA 0.544 4.883 4.340 -0.003 0.000 0.261 520 L C -2.235 174.660 176.870 0.042 0.000 1.021 520 L CA -2.140 52.733 54.840 0.056 0.000 0.823 520 L CB 2.034 44.124 42.059 0.052 0.000 1.366 520 L HN 0.360 8.590 8.230 -0.000 0.000 0.423 521 P HA 0.011 4.431 4.420 -0.000 0.000 0.261 521 P C 0.692 178.007 177.300 0.025 0.000 1.173 521 P CA 1.164 64.276 63.100 0.020 0.000 0.760 521 P CB 0.457 32.163 31.700 0.010 0.000 0.783 522 G N 1.799 110.613 108.800 0.025 0.000 2.199 522 G HA2 -0.235 3.724 3.960 -0.003 0.000 0.254 522 G HA3 -0.235 3.724 3.960 -0.003 0.000 0.254 522 G C 0.275 175.195 174.900 0.033 0.000 0.982 522 G CA 0.102 45.213 45.100 0.017 0.000 0.632 522 G HN 0.583 8.873 8.290 -0.000 0.000 0.529 523 T N 3.960 118.556 114.554 0.071 0.000 2.784 523 T HA 0.468 4.816 4.350 -0.003 0.000 0.291 523 T C -2.055 172.737 174.700 0.153 0.000 0.942 523 T CA -0.111 62.052 62.100 0.105 0.000 1.161 523 T CB 1.657 70.601 68.868 0.126 0.000 0.885 523 T HN 0.251 8.491 8.240 -0.000 0.000 0.534 524 P HA 0.581 5.001 4.420 -0.000 0.000 0.281 524 P C -0.748 176.618 177.300 0.110 0.000 1.249 524 P CA -0.570 62.513 63.100 -0.028 0.000 0.810 524 P CB 0.611 32.286 31.700 -0.041 0.000 1.008 525 F N -0.884 119.074 119.950 0.013 0.000 3.090 525 F HA 0.682 5.208 4.527 -0.003 0.000 0.324 525 F C -1.583 174.233 175.800 0.026 0.000 1.189 525 F CA -1.367 56.652 58.000 0.032 0.000 0.907 525 F CB 0.596 39.622 39.000 0.042 0.000 1.445 525 F HN -0.032 8.268 8.300 -0.000 0.000 0.500 526 I N 2.319 123.104 120.570 0.358 0.000 2.406 526 I HA 0.448 4.616 4.170 -0.003 0.000 0.290 526 I C -1.390 174.912 176.117 0.309 0.000 0.999 526 I CA -0.873 60.519 61.300 0.154 0.000 1.124 526 I CB 1.848 39.894 38.000 0.077 0.000 1.289 526 I HN 0.528 8.738 8.210 -0.000 0.000 0.441 527 L N 7.221 128.520 121.223 0.127 0.000 2.282 527 L HA 0.541 4.880 4.340 -0.003 0.000 0.288 527 L C -1.394 175.474 176.870 -0.003 0.000 1.033 527 L CA 0.249 55.234 54.840 0.241 0.000 0.807 527 L CB 0.495 42.726 42.059 0.287 0.000 1.209 527 L HN 0.279 8.509 8.230 -0.000 0.000 0.423 528 F N 6.608 126.655 119.950 0.161 0.000 2.388 528 F HA 0.544 5.069 4.527 -0.003 0.000 0.358 528 F C 0.013 175.866 175.800 0.088 0.000 1.122 528 F CA -0.342 57.723 58.000 0.109 0.000 1.056 528 F CB 1.433 40.489 39.000 0.095 0.000 1.155 528 F HN 0.360 8.660 8.300 -0.000 0.000 0.461 529 I N 3.910 124.597 120.570 0.195 0.000 2.512 529 I HA 0.644 4.812 4.170 -0.003 0.000 0.287 529 I C 0.365 176.535 176.117 0.088 0.000 1.069 529 I CA 0.021 61.393 61.300 0.120 0.000 1.056 529 I CB 0.970 39.009 38.000 0.065 0.000 1.229 529 I HN 0.736 8.946 8.210 -0.000 0.000 0.429 530 G N 5.355 114.196 108.800 0.067 0.000 2.591 530 G HA2 -0.332 3.627 3.960 -0.003 0.000 0.298 530 G HA3 -0.332 3.627 3.960 -0.003 0.000 0.298 530 G C 0.556 175.497 174.900 0.068 0.000 1.195 530 G CA 0.813 45.937 45.100 0.039 0.000 0.989 530 G HN 1.529 9.819 8.290 -0.000 0.000 0.551 531 V N -1.535 118.409 119.914 0.051 0.000 3.542 531 V HA 0.524 4.642 4.120 -0.003 0.000 0.296 531 V C 0.827 176.969 176.094 0.080 0.000 1.364 531 V CA 1.180 63.520 62.300 0.066 0.000 1.118 531 V CB -0.144 31.701 31.823 0.036 0.000 0.972 531 V HN 0.536 8.726 8.190 -0.000 0.000 0.430 532 K N 1.433 121.877 120.400 0.072 0.000 2.168 532 K HA 0.671 4.989 4.320 -0.003 0.000 0.239 532 K C -0.676 175.921 176.600 -0.005 0.000 0.999 532 K CA -0.475 55.835 56.287 0.038 0.000 0.900 532 K CB 2.305 34.821 32.500 0.026 0.000 1.111 532 K HN 0.484 8.734 8.250 -0.000 0.000 0.452 533 E N 1.491 121.628 120.200 -0.104 0.000 2.321 533 E HA 0.130 4.478 4.350 -0.003 0.000 0.281 533 E C -1.586 174.874 176.600 -0.234 0.000 0.910 533 E CA -0.491 55.704 56.400 -0.341 0.000 0.770 533 E CB 1.645 31.081 29.700 -0.439 0.000 1.225 533 E HN 0.261 8.621 8.360 -0.000 0.000 0.417 534 Q N 3.611 123.265 119.800 -0.243 0.000 2.268 534 Q HA 0.376 4.715 4.340 -0.003 0.000 0.266 534 Q C -2.727 173.186 176.000 -0.145 0.000 1.006 534 Q CA -2.002 53.722 55.803 -0.131 0.000 0.824 534 Q CB 2.432 31.148 28.738 -0.037 0.000 1.306 534 Q HN 0.457 8.727 8.270 -0.000 0.000 0.424 535 P HA 0.331 4.751 4.420 -0.000 0.000 0.269 535 P C -1.203 175.955 177.300 -0.236 0.000 1.209 535 P CA 0.158 63.155 63.100 -0.171 0.000 0.776 535 P CB 0.829 32.452 31.700 -0.129 0.000 0.876 536 A N 2.308 124.862 122.820 -0.443 0.000 2.536 536 A HA 0.865 5.184 4.320 -0.003 0.000 0.293 536 A C -1.243 175.819 177.584 -0.869 0.000 1.119 536 A CA -0.665 51.020 52.037 -0.587 0.000 0.654 536 A CB 1.542 20.196 19.000 -0.577 0.000 1.291 536 A HN 0.655 8.805 8.150 -0.000 0.000 0.439 537 R N -0.309 119.800 120.500 -0.653 0.000 2.710 537 R HA 0.646 4.984 4.340 -0.003 0.000 0.270 537 R C -1.374 174.900 176.300 -0.043 0.000 1.021 537 R CA -0.920 54.953 56.100 -0.378 0.000 0.889 537 R CB 0.672 30.866 30.300 -0.176 0.000 1.243 537 R HN 0.454 8.724 8.270 -0.000 0.000 0.464 538 I N 2.744 123.426 120.570 0.187 0.000 2.587 538 I HA -0.016 4.153 4.170 -0.003 0.000 0.284 538 I C 1.126 177.262 176.117 0.033 0.000 1.134 538 I CA 0.469 61.857 61.300 0.147 0.000 1.410 538 I CB 0.849 38.927 38.000 0.130 0.000 1.392 538 I HN 0.855 9.065 8.210 -0.000 0.000 0.545 539 K N 6.391 126.788 120.400 -0.004 0.000 2.063 539 K HA 0.143 4.462 4.320 -0.003 0.000 0.204 539 K C 0.420 177.010 176.600 -0.017 0.000 1.039 539 K CA 0.698 56.971 56.287 -0.024 0.000 0.957 539 K CB 0.498 32.969 32.500 -0.049 0.000 0.764 539 K HN 0.498 8.748 8.250 -0.000 0.000 0.447 540 R N 0.296 120.784 120.500 -0.020 0.000 2.744 540 R HA 0.356 4.695 4.340 -0.003 0.000 0.279 540 R C -1.596 174.685 176.300 -0.032 0.000 0.977 540 R CA -0.938 55.148 56.100 -0.023 0.000 0.906 540 R CB 1.629 31.913 30.300 -0.026 0.000 1.197 540 R HN -0.013 8.257 8.270 -0.000 0.000 0.463 541 L N 3.585 124.778 121.223 -0.049 0.000 2.257 541 L HA 0.339 4.677 4.340 -0.003 0.000 0.290 541 L C 0.711 177.526 176.870 -0.092 0.000 1.044 541 L CA 0.354 55.138 54.840 -0.093 0.000 0.810 541 L CB 0.996 42.977 42.059 -0.129 0.000 1.193 541 L HN 0.717 8.947 8.230 -0.000 0.000 0.425 542 I N 0.652 121.180 120.570 -0.070 0.000 2.522 542 I HA 0.104 4.273 4.170 -0.003 0.000 0.240 542 I C 0.497 176.584 176.117 -0.050 0.000 1.078 542 I CA 0.470 61.749 61.300 -0.036 0.000 1.422 542 I CB 0.153 38.163 38.000 0.016 0.000 1.188 542 I HN 0.683 8.893 8.210 -0.000 0.000 0.442 543 S N -0.652 115.028 115.700 -0.034 0.000 2.547 543 S HA 0.491 4.960 4.470 -0.003 0.000 0.270 543 S C -0.901 173.669 174.600 -0.051 0.000 1.150 543 S CA -0.825 57.363 58.200 -0.020 0.000 0.850 543 S CB 1.373 64.630 63.200 0.095 0.000 1.118 543 S HN -0.017 8.293 8.310 -0.000 0.000 0.461 544 F N 1.079 121.059 119.950 0.049 0.000 2.410 544 F HA 0.497 5.023 4.527 -0.003 0.000 0.334 544 F C 0.569 176.400 175.800 0.052 0.000 1.134 544 F CA -0.672 57.338 58.000 0.017 0.000 1.227 544 F CB 0.539 39.533 39.000 -0.011 0.000 1.194 544 F HN 0.464 8.764 8.300 -0.000 0.000 0.571 545 I N 2.863 123.571 120.570 0.230 0.000 2.312 545 I HA 0.153 4.321 4.170 -0.003 0.000 0.290 545 I C 0.010 176.187 176.117 0.100 0.000 1.008 545 I CA -0.396 60.982 61.300 0.130 0.000 1.226 545 I CB 1.146 39.131 38.000 -0.026 0.000 1.371 545 I HN 0.614 8.824 8.210 -0.000 0.000 0.468 546 D N 5.662 126.117 120.400 0.091 0.000 2.454 546 D HA 0.063 4.702 4.640 -0.003 0.000 0.247 546 D C 0.227 176.548 176.300 0.035 0.000 1.143 546 D CA 0.730 54.757 54.000 0.045 0.000 0.972 546 D CB 0.184 41.007 40.800 0.038 0.000 1.070 546 D HN 0.007 8.377 8.370 -0.000 0.000 0.433 547 K N 0.219 120.645 120.400 0.044 0.000 2.339 547 K HA 0.529 4.847 4.320 -0.003 0.000 0.264 547 K C 0.794 177.424 176.600 0.050 0.000 0.986 547 K CA -0.005 56.305 56.287 0.039 0.000 0.866 547 K CB 1.181 33.700 32.500 0.032 0.000 1.103 547 K HN 0.436 8.686 8.250 -0.000 0.000 0.441 548 G N 4.207 113.035 108.800 0.046 0.000 4.430 548 G HA2 -0.412 3.547 3.960 -0.003 0.000 0.332 548 G HA3 -0.412 3.547 3.960 -0.003 0.000 0.332 548 G C 0.804 175.744 174.900 0.067 0.000 1.338 548 G CA 0.734 45.866 45.100 0.054 0.000 1.024 548 G HN 0.657 8.947 8.290 -0.000 0.000 0.750 549 N N -0.272 118.487 118.700 0.098 0.000 2.113 549 N HA 0.132 4.870 4.740 -0.003 0.000 0.223 549 N C 0.043 175.687 175.510 0.223 0.000 1.310 549 N CA 0.597 53.747 53.050 0.166 0.000 0.896 549 N CB 0.740 39.334 38.487 0.179 0.000 1.097 549 N HN 0.454 8.834 8.380 -0.000 0.000 0.507 550 T N 1.248 115.888 114.554 0.144 0.000 2.902 550 T HA 0.159 4.507 4.350 -0.003 0.000 0.301 550 T C 0.081 174.880 174.700 0.166 0.000 1.012 550 T CA -0.091 62.086 62.100 0.128 0.000 1.151 550 T CB 0.994 69.910 68.868 0.079 0.000 0.946 550 T HN 0.174 8.414 8.240 -0.000 0.000 0.542 551 A N 4.078 126.988 122.820 0.150 0.000 2.410 551 A HA 0.447 4.766 4.320 -0.003 0.000 0.292 551 A C 0.851 178.508 177.584 0.122 0.000 1.232 551 A CA -0.479 51.655 52.037 0.162 0.000 0.893 551 A CB 0.001 19.049 19.000 0.079 0.000 1.131 551 A HN 0.774 8.924 8.150 -0.000 0.000 0.530 552 S N 2.091 117.884 115.700 0.154 0.000 2.572 552 S HA 0.123 4.591 4.470 -0.003 0.000 0.279 552 S C 0.994 175.666 174.600 0.120 0.000 1.341 552 S CA -0.134 58.144 58.200 0.131 0.000 1.043 552 S CB 0.430 63.725 63.200 0.160 0.000 0.887 552 S HN 0.650 8.960 8.310 -0.000 0.000 0.516 553 K N 1.927 122.377 120.400 0.084 0.000 2.459 553 K HA 0.082 4.400 4.320 -0.003 0.000 0.193 553 K C 0.048 176.699 176.600 0.085 0.000 1.030 553 K CA 0.338 56.666 56.287 0.068 0.000 1.026 553 K CB 0.042 32.568 32.500 0.043 0.000 0.809 553 K HN 0.515 8.765 8.250 -0.000 0.000 0.504 554 K N 2.353 122.823 120.400 0.117 0.000 2.361 554 K HA 0.011 4.330 4.320 -0.003 0.000 0.283 554 K C -0.424 176.306 176.600 0.216 0.000 1.078 554 K CA 0.270 56.639 56.287 0.137 0.000 1.041 554 K CB 0.333 32.887 32.500 0.091 0.000 0.932 554 K HN -0.039 8.211 8.250 -0.000 0.000 0.462 555 K N 2.480 122.958 120.400 0.131 0.000 2.524 555 K HA -0.014 4.304 4.320 -0.003 0.000 0.279 555 K C 0.085 176.767 176.600 0.137 0.000 0.993 555 K CA 0.391 56.737 56.287 0.098 0.000 1.030 555 K CB 0.340 32.876 32.500 0.060 0.000 0.891 555 K HN 0.523 8.773 8.250 -0.000 0.000 0.488 556 I N 3.542 124.115 120.570 0.004 0.000 2.362 556 I HA 0.224 4.392 4.170 -0.003 0.000 0.289 556 I C 0.376 176.426 176.117 -0.113 0.000 0.994 556 I CA -0.530 60.681 61.300 -0.149 0.000 1.158 556 I CB 0.783 38.364 38.000 -0.699 0.000 1.315 556 I HN 0.609 8.819 8.210 -0.000 0.000 0.451 557 R N 4.650 125.111 120.500 -0.064 0.000 2.287 557 R HA 0.249 4.588 4.340 -0.003 0.000 0.197 557 R C -0.363 175.989 176.300 0.086 0.000 0.900 557 R CA 0.313 56.431 56.100 0.031 0.000 1.052 557 R CB -0.135 30.241 30.300 0.128 0.000 1.117 557 R HN 0.837 9.107 8.270 -0.000 0.000 0.568 558 H N -2.519 116.558 119.070 0.012 0.000 3.037 558 H HA 0.567 5.122 4.556 -0.003 0.000 0.355 558 H C -1.492 173.851 175.328 0.024 0.000 1.263 558 H CA -1.114 54.939 56.048 0.008 0.000 1.129 558 H CB 1.034 30.815 29.762 0.032 0.000 1.861 558 H HN -0.123 8.157 8.280 -0.000 0.000 0.546 559 L N 2.569 123.830 121.223 0.064 0.000 2.295 559 L HA 0.713 5.051 4.340 -0.003 0.000 0.281 559 L C 0.328 177.280 176.870 0.137 0.000 1.018 559 L CA 0.182 55.040 54.840 0.030 0.000 0.841 559 L CB 0.764 42.788 42.059 -0.059 0.000 1.218 559 L HN 1.028 9.258 8.230 -0.000 0.000 0.424 560 G N 2.660 111.570 108.800 0.183 0.000 2.531 560 G HA2 0.435 4.394 3.960 -0.003 0.000 0.281 560 G HA3 0.435 4.394 3.960 -0.003 0.000 0.281 560 G C -0.559 174.394 174.900 0.088 0.000 1.382 560 G CA -0.602 44.599 45.100 0.169 0.000 1.045 560 G HN 0.612 8.902 8.290 -0.000 0.000 0.533 561 S N 0.274 116.018 115.700 0.075 0.000 2.593 561 S HA 0.275 4.744 4.470 -0.003 0.000 0.269 561 S C 0.006 174.635 174.600 0.049 0.000 1.334 561 S CA -0.290 57.943 58.200 0.055 0.000 1.015 561 S CB 0.745 63.984 63.200 0.064 0.000 0.912 561 S HN 0.538 8.848 8.310 -0.000 0.000 0.541 562 K N 0.864 121.295 120.400 0.050 0.000 3.278 562 K HA -0.191 4.128 4.320 -0.003 0.000 0.270 562 K C -0.507 176.107 176.600 0.023 0.000 0.955 562 K CA 0.887 57.204 56.287 0.050 0.000 0.723 562 K CB -1.813 30.722 32.500 0.058 0.000 1.382 562 K HN 0.707 8.957 8.250 -0.000 0.000 0.461 563 Q N 0.057 119.861 119.800 0.007 0.000 2.451 563 Q HA 0.511 4.849 4.340 -0.003 0.000 0.281 563 Q C -0.251 175.745 176.000 -0.006 0.000 1.099 563 Q CA -1.028 54.793 55.803 0.029 0.000 0.806 563 Q CB 2.513 31.320 28.738 0.115 0.000 1.419 563 Q HN 0.143 8.413 8.270 -0.000 0.000 0.427 564 R N 0.101 120.615 120.500 0.025 0.000 2.562 564 R HA 0.870 5.208 4.340 -0.003 0.000 0.298 564 R C -1.149 175.141 176.300 -0.017 0.000 0.961 564 R CA -0.594 55.478 56.100 -0.047 0.000 0.881 564 R CB 2.049 32.309 30.300 -0.066 0.000 1.159 564 R HN 0.702 8.972 8.270 -0.000 0.000 0.450 565 A N 2.273 124.994 122.820 -0.166 0.000 2.597 565 A HA 0.549 4.867 4.320 -0.003 0.000 0.292 565 A C -1.720 175.681 177.584 -0.306 0.000 1.057 565 A CA -0.776 51.150 52.037 -0.185 0.000 0.674 565 A CB 0.868 19.749 19.000 -0.198 0.000 1.278 565 A HN 0.509 8.659 8.150 -0.000 0.000 0.416 566 F N 0.862 120.773 119.950 -0.065 0.000 2.420 566 F HA 0.570 5.095 4.527 -0.003 0.000 0.352 566 F C 0.380 176.133 175.800 -0.079 0.000 1.108 566 F CA 0.070 58.040 58.000 -0.050 0.000 1.162 566 F CB 1.759 40.742 39.000 -0.029 0.000 1.118 566 F HN 0.329 8.629 8.300 -0.000 0.000 0.510 567 V N 2.525 122.504 119.914 0.108 0.000 2.925 567 V HA 0.351 4.469 4.120 -0.003 0.000 0.311 567 V C -0.695 175.419 176.094 0.034 0.000 1.104 567 V CA -1.153 61.162 62.300 0.026 0.000 0.954 567 V CB 2.140 33.943 31.823 -0.033 0.000 1.022 567 V HN 0.672 8.862 8.190 -0.000 0.000 0.427 568 E N 2.799 122.996 120.200 -0.005 0.000 2.156 568 E HA 0.529 4.877 4.350 -0.003 0.000 0.279 568 E C -1.485 175.062 176.600 -0.089 0.000 0.965 568 E CA -0.625 55.747 56.400 -0.046 0.000 0.789 568 E CB 1.251 30.927 29.700 -0.041 0.000 1.098 568 E HN 0.421 8.781 8.360 -0.000 0.000 0.397 569 I N 3.280 123.716 120.570 -0.224 0.000 2.525 569 I HA 0.310 4.478 4.170 -0.003 0.000 0.301 569 I C -0.029 175.867 176.117 -0.369 0.000 0.992 569 I CA -0.614 60.527 61.300 -0.265 0.000 1.162 569 I CB 1.531 39.289 38.000 -0.403 0.000 1.332 569 I HN 0.661 8.871 8.210 -0.000 0.000 0.458 570 E N 5.513 125.572 120.200 -0.235 0.000 2.199 570 E HA 0.468 4.816 4.350 -0.003 0.000 0.265 570 E C -1.356 175.150 176.600 -0.156 0.000 0.882 570 E CA -0.658 55.637 56.400 -0.176 0.000 0.759 570 E CB 1.685 31.326 29.700 -0.099 0.000 1.148 570 E HN 0.443 8.803 8.360 -0.000 0.000 0.412 571 L N 6.016 127.204 121.223 -0.057 0.000 2.380 571 L HA 0.354 4.693 4.340 -0.003 0.000 0.273 571 L C 0.567 177.417 176.870 -0.033 0.000 1.138 571 L CA -0.283 54.550 54.840 -0.011 0.000 0.832 571 L CB 0.226 42.369 42.059 0.140 0.000 1.124 571 L HN 0.523 8.753 8.230 -0.000 0.000 0.454 572 I N -0.855 119.665 120.570 -0.083 0.000 2.910 572 I HA 0.401 4.569 4.170 -0.003 0.000 0.310 572 I C -0.255 175.814 176.117 -0.079 0.000 1.043 572 I CA -0.748 60.506 61.300 -0.078 0.000 1.053 572 I CB 1.764 39.705 38.000 -0.098 0.000 1.242 572 I HN 0.710 8.920 8.210 -0.000 0.000 0.452 573 E N 1.120 121.274 120.200 -0.077 0.000 2.210 573 E HA -0.138 4.211 4.350 -0.003 0.000 0.201 573 E C -1.003 175.534 176.600 -0.104 0.000 1.339 573 E CA 0.033 56.383 56.400 -0.083 0.000 0.699 573 E CB -1.091 28.565 29.700 -0.074 0.000 1.126 573 E HN 0.445 8.805 8.360 -0.000 0.000 0.355 574 V N 1.883 121.713 119.914 -0.140 0.000 2.353 574 V HA 0.043 4.161 4.120 -0.003 0.000 0.264 574 V C 1.249 177.181 176.094 -0.269 0.000 1.049 574 V CA -0.160 62.012 62.300 -0.214 0.000 0.896 574 V CB 1.297 32.928 31.823 -0.321 0.000 1.025 574 V HN 0.220 8.410 8.190 -0.000 0.000 0.475 575 K N 3.453 123.731 120.400 -0.203 0.000 2.314 575 K HA 0.193 4.512 4.320 -0.003 0.000 0.198 575 K C 0.806 177.268 176.600 -0.231 0.000 1.045 575 K CA 0.523 56.700 56.287 -0.183 0.000 0.988 575 K CB 0.232 32.667 32.500 -0.109 0.000 0.783 575 K HN 0.591 8.841 8.250 -0.000 0.000 0.484 576 R N -0.773 119.569 120.500 -0.264 0.000 2.579 576 R HA 0.111 4.449 4.340 -0.003 0.000 0.260 576 R C -1.553 174.648 176.300 -0.165 0.000 1.103 576 R CA -0.551 55.413 56.100 -0.227 0.000 0.942 576 R CB 0.703 30.961 30.300 -0.071 0.000 1.251 576 R HN -0.054 8.216 8.270 -0.000 0.000 0.450 577 W N 4.592 125.919 121.300 0.044 0.000 2.193 577 W HA 0.165 4.823 4.660 -0.003 0.000 0.338 577 W C 0.424 176.970 176.519 0.046 0.000 1.310 577 W CA -0.668 56.707 57.345 0.051 0.000 1.243 577 W CB 0.461 29.959 29.460 0.064 0.000 1.165 577 W HN 0.200 8.380 8.180 -0.000 0.000 0.566 578 I N 5.804 126.594 120.570 0.367 0.000 2.321 578 I HA 0.164 4.333 4.170 -0.003 0.000 0.291 578 I C -1.767 174.429 176.117 0.133 0.000 0.998 578 I CA -3.188 58.226 61.300 0.190 0.000 1.227 578 I CB 0.502 38.581 38.000 0.132 0.000 1.368 578 I HN 0.036 8.246 8.210 -0.000 0.000 0.466 579 P HA 0.228 4.648 4.420 -0.000 0.000 0.271 579 P C -0.856 176.416 177.300 -0.047 0.000 1.220 579 P CA -0.351 62.769 63.100 0.033 0.000 0.768 579 P CB 1.257 33.000 31.700 0.073 0.000 0.848 580 L N 4.192 125.353 121.223 -0.102 0.000 2.354 580 L HA 0.565 4.903 4.340 -0.003 0.000 0.269 580 L C -0.181 176.607 176.870 -0.135 0.000 1.005 580 L CA -0.756 53.987 54.840 -0.163 0.000 0.819 580 L CB 1.443 43.344 42.059 -0.264 0.000 1.311 580 L HN 0.276 8.506 8.230 -0.000 0.000 0.423 581 L N 1.234 122.376 121.223 -0.135 0.000 2.431 581 L HA 0.638 4.976 4.340 -0.003 0.000 0.266 581 L C 0.060 176.850 176.870 -0.135 0.000 0.978 581 L CA -0.196 54.585 54.840 -0.099 0.000 0.822 581 L CB 2.208 44.229 42.059 -0.062 0.000 1.310 581 L HN 0.789 9.019 8.230 -0.000 0.000 0.409 582 T N 0.999 115.450 114.554 -0.171 0.000 2.898 582 T HA 0.446 4.794 4.350 -0.003 0.000 0.301 582 T C 1.266 175.789 174.700 -0.295 0.000 1.049 582 T CA -0.010 61.909 62.100 -0.302 0.000 1.095 582 T CB 1.218 69.727 68.868 -0.598 0.000 0.976 582 T HN 0.758 8.998 8.240 -0.000 0.000 0.539 583 A N 1.489 124.169 122.820 -0.234 0.000 2.019 583 A HA -0.129 4.190 4.320 -0.003 0.000 0.219 583 A C 2.133 179.682 177.584 -0.060 0.000 1.164 583 A CA 1.537 53.513 52.037 -0.102 0.000 0.644 583 A CB -1.201 17.786 19.000 -0.021 0.000 0.805 583 A HN 1.071 9.221 8.150 -0.000 0.000 0.449 584 H N -1.813 117.287 119.070 0.050 0.000 2.524 584 H HA 0.074 4.628 4.556 -0.003 0.000 0.282 584 H C 1.106 176.463 175.328 0.049 0.000 1.016 584 H CA 0.960 57.038 56.048 0.049 0.000 1.270 584 H CB -0.097 29.693 29.762 0.047 0.000 1.394 584 H HN 0.464 8.744 8.280 -0.000 0.000 0.568 585 E N 1.024 121.252 120.200 0.047 0.000 2.122 585 E HA -0.011 4.338 4.350 -0.003 0.000 0.190 585 E C 0.482 177.123 176.600 0.067 0.000 0.977 585 E CA 0.301 56.762 56.400 0.102 0.000 0.820 585 E CB 0.294 30.049 29.700 0.092 0.000 0.770 585 E HN 0.407 8.767 8.360 -0.000 0.000 0.462 586 N N 0.399 119.110 118.700 0.019 0.000 2.578 586 N HA -0.022 4.716 4.740 -0.003 0.000 0.282 586 N C -0.390 175.124 175.510 0.007 0.000 1.119 586 N CA -0.013 53.043 53.050 0.010 0.000 0.948 586 N CB 1.790 40.266 38.487 -0.018 0.000 1.546 586 N HN -0.240 8.140 8.380 -0.000 0.000 0.525 587 D N 2.299 122.721 120.400 0.035 0.000 2.123 587 D HA -0.068 4.571 4.640 -0.003 0.000 0.196 587 D C 1.611 177.932 176.300 0.035 0.000 0.992 587 D CA 1.623 55.656 54.000 0.054 0.000 0.833 587 D CB 0.566 41.431 40.800 0.108 0.000 0.954 587 D HN 0.426 8.796 8.370 -0.000 0.000 0.455 588 R N -0.128 120.387 120.500 0.025 0.000 2.062 588 R HA 0.039 4.378 4.340 -0.003 0.000 0.229 588 R C 2.589 178.878 176.300 -0.018 0.000 1.128 588 R CA 0.488 56.589 56.100 0.003 0.000 0.960 588 R CB -1.045 29.255 30.300 -0.001 0.000 0.855 588 R HN 0.339 8.609 8.270 -0.000 0.000 0.432 589 L N 0.038 121.242 121.223 -0.032 0.000 2.191 589 L HA -0.042 4.296 4.340 -0.003 0.000 0.212 589 L C 1.886 178.727 176.870 -0.049 0.000 1.103 589 L CA 1.265 56.076 54.840 -0.048 0.000 0.769 589 L CB -0.493 41.528 42.059 -0.064 0.000 0.908 589 L HN 0.268 8.498 8.230 -0.000 0.000 0.438 590 G N -0.067 108.706 108.800 -0.045 0.000 3.327 590 G HA2 0.062 4.020 3.960 -0.003 0.000 0.240 590 G HA3 0.062 4.020 3.960 -0.003 0.000 0.240 590 G C 0.482 175.368 174.900 -0.025 0.000 1.222 590 G CA -0.345 44.721 45.100 -0.057 0.000 0.871 590 G HN 0.043 8.333 8.290 -0.000 0.000 0.525 591 R N 0.262 120.757 120.500 -0.009 0.000 2.460 591 R HA 0.559 4.897 4.340 -0.003 0.000 0.303 591 R C -0.597 175.727 176.300 0.040 0.000 0.968 591 R CA -0.456 55.652 56.100 0.013 0.000 0.889 591 R CB 2.092 32.395 30.300 0.005 0.000 1.123 591 R HN 0.135 8.405 8.270 -0.000 0.000 0.455 592 V N -1.115 118.839 119.914 0.067 0.000 3.078 592 V HA 0.721 4.840 4.120 -0.003 0.000 0.311 592 V C -0.554 175.616 176.094 0.127 0.000 1.138 592 V CA -0.884 61.487 62.300 0.118 0.000 1.007 592 V CB 2.465 34.384 31.823 0.160 0.000 1.045 592 V HN 0.356 8.546 8.190 -0.000 0.000 0.432 593 V N 3.112 123.141 119.914 0.192 0.000 2.604 593 V HA 0.620 4.739 4.120 -0.003 0.000 0.305 593 V C -0.716 175.535 176.094 0.262 0.000 1.043 593 V CA -0.498 61.915 62.300 0.189 0.000 0.888 593 V CB 1.503 33.420 31.823 0.157 0.000 0.995 593 V HN 0.792 8.982 8.190 -0.000 0.000 0.429 594 L N 5.334 126.644 121.223 0.145 0.000 2.307 594 L HA 0.674 5.012 4.340 -0.003 0.000 0.284 594 L C 0.171 177.149 176.870 0.180 0.000 1.023 594 L CA -0.122 54.789 54.840 0.118 0.000 0.810 594 L CB 1.435 43.312 42.059 -0.304 0.000 1.231 594 L HN 0.545 8.775 8.230 -0.000 0.000 0.423 595 R N 2.665 123.359 120.500 0.323 0.000 2.750 595 R HA 0.753 5.091 4.340 -0.003 0.000 0.281 595 R C -1.002 175.466 176.300 0.280 0.000 0.972 595 R CA -1.081 55.187 56.100 0.279 0.000 0.912 595 R CB 2.802 33.309 30.300 0.346 0.000 1.187 595 R HN 0.632 8.902 8.270 -0.000 0.000 0.464 596 K N 0.572 121.092 120.400 0.200 0.000 2.498 596 K HA 0.289 4.608 4.320 -0.003 0.000 0.254 596 K C -1.107 175.573 176.600 0.132 0.000 0.933 596 K CA -0.719 55.680 56.287 0.185 0.000 0.806 596 K CB 1.594 34.209 32.500 0.192 0.000 1.301 596 K HN 0.416 8.666 8.250 -0.000 0.000 0.432 597 D N 2.052 122.522 120.400 0.116 0.000 2.708 597 D HA -0.175 4.463 4.640 -0.003 0.000 0.236 597 D C 0.808 177.158 176.300 0.082 0.000 1.146 597 D CA 2.180 56.232 54.000 0.086 0.000 0.662 597 D CB -1.320 39.522 40.800 0.069 0.000 1.059 597 D HN 1.183 9.553 8.370 -0.000 0.000 0.428 598 G N -0.818 108.042 108.800 0.101 0.000 2.162 598 G HA2 -0.380 3.578 3.960 -0.003 0.000 0.260 598 G HA3 -0.380 3.578 3.960 -0.003 0.000 0.260 598 G C 0.336 175.284 174.900 0.080 0.000 0.976 598 G CA 0.564 45.717 45.100 0.089 0.000 0.655 598 G HN 0.558 8.848 8.290 -0.000 0.000 0.533 599 R N -0.251 120.305 120.500 0.094 0.000 2.740 599 R HA 0.593 4.932 4.340 -0.003 0.000 0.282 599 R C -0.405 175.965 176.300 0.115 0.000 0.969 599 R CA -0.462 55.690 56.100 0.087 0.000 0.918 599 R CB 1.339 31.685 30.300 0.076 0.000 1.175 599 R HN 0.086 8.356 8.270 -0.000 0.000 0.464 600 T N 3.758 118.383 114.554 0.117 0.000 2.738 600 T HA 0.151 4.499 4.350 -0.003 0.000 0.294 600 T C 1.415 176.282 174.700 0.279 0.000 0.914 600 T CA -0.142 62.062 62.100 0.174 0.000 1.052 600 T CB -0.056 68.896 68.868 0.141 0.000 0.897 600 T HN 0.566 8.806 8.240 -0.000 0.000 0.522 601 I N 0.465 121.154 120.570 0.197 0.000 3.462 601 I HA 0.667 4.835 4.170 -0.003 0.000 0.290 601 I C 0.775 176.807 176.117 -0.142 0.000 1.236 601 I CA -0.375 60.989 61.300 0.107 0.000 1.418 601 I CB 0.226 38.226 38.000 0.001 0.000 1.102 601 I HN 0.516 8.726 8.210 -0.000 0.000 0.441 602 A N 0.918 123.590 122.820 -0.246 0.000 2.586 602 A HA 0.861 5.180 4.320 -0.003 0.000 0.291 602 A C -1.548 175.812 177.584 -0.372 0.000 1.062 602 A CA -0.137 51.457 52.037 -0.739 0.000 0.666 602 A CB 0.811 19.506 19.000 -0.508 0.000 1.281 602 A HN 0.382 8.532 8.150 -0.000 0.000 0.421 603 A N -0.205 122.361 122.820 -0.424 0.000 2.386 603 A HA 0.955 5.273 4.320 -0.003 0.000 0.311 603 A C 0.024 177.543 177.584 -0.109 0.000 1.068 603 A CA -0.037 51.958 52.037 -0.071 0.000 0.743 603 A CB 1.636 20.723 19.000 0.146 0.000 1.258 603 A HN 2.384 10.534 8.150 -0.000 0.000 0.429 604 G N 0.495 109.274 108.800 -0.034 0.000 2.642 604 G HA2 0.627 4.585 3.960 -0.003 0.000 0.293 604 G HA3 0.627 4.585 3.960 -0.003 0.000 0.293 604 G C -1.313 173.595 174.900 0.013 0.000 1.341 604 G CA -0.755 44.329 45.100 -0.027 0.000 0.916 604 G HN 0.659 8.949 8.290 -0.000 0.000 0.474 605 K N 0.481 120.891 120.400 0.016 0.000 2.270 605 K HA 0.433 4.751 4.320 -0.003 0.000 0.255 605 K C -0.421 176.221 176.600 0.069 0.000 0.936 605 K CA -0.675 55.632 56.287 0.034 0.000 0.809 605 K CB 2.728 35.248 32.500 0.034 0.000 1.131 605 K HN 0.344 8.594 8.250 -0.000 0.000 0.427 606 I N 2.611 123.209 120.570 0.047 0.000 2.505 606 I HA -0.060 4.108 4.170 -0.003 0.000 0.287 606 I C 0.803 176.945 176.117 0.041 0.000 1.104 606 I CA 0.295 61.635 61.300 0.066 0.000 1.387 606 I CB 0.838 38.805 38.000 -0.054 0.000 1.404 606 I HN 0.704 8.914 8.210 -0.000 0.000 0.528 607 S N 4.218 120.004 115.700 0.144 0.000 2.475 607 S HA 0.095 4.563 4.470 -0.003 0.000 0.224 607 S C 0.461 175.166 174.600 0.175 0.000 1.042 607 S CA 0.127 58.441 58.200 0.190 0.000 0.935 607 S CB 0.247 63.636 63.200 0.315 0.000 0.801 607 S HN 0.750 9.060 8.310 -0.000 0.000 0.509 608 E N -0.006 120.279 120.200 0.143 0.000 2.381 608 E HA 0.372 4.720 4.350 -0.003 0.000 0.286 608 E C -2.082 174.589 176.600 0.117 0.000 0.960 608 E CA -0.535 55.931 56.400 0.110 0.000 0.793 608 E CB 1.255 31.005 29.700 0.084 0.000 1.225 608 E HN -0.015 8.345 8.360 -0.000 0.000 0.420 609 I N 2.859 123.457 120.570 0.048 0.000 2.304 609 I HA 0.137 4.306 4.170 -0.003 0.000 0.291 609 I C 0.647 176.770 176.117 0.009 0.000 1.018 609 I CA 0.043 61.375 61.300 0.053 0.000 1.260 609 I CB 1.547 39.513 38.000 -0.057 0.000 1.390 609 I HN 0.446 8.656 8.210 -0.000 0.000 0.475 610 T N 6.063 120.651 114.554 0.057 0.000 3.792 610 T HA 0.054 4.402 4.350 -0.003 0.000 0.233 610 T C 0.744 175.431 174.700 -0.022 0.000 0.860 610 T CA -0.504 61.599 62.100 0.004 0.000 0.915 610 T CB -1.112 67.761 68.868 0.009 0.000 1.216 610 T HN 0.620 8.860 8.240 -0.000 0.000 0.664 611 Q N 0.000 119.760 119.800 -0.067 0.000 2.315 611 Q HA 0.000 4.338 4.340 -0.003 0.000 0.214 611 Q CA 0.000 55.739 55.803 -0.106 0.000 1.022 611 Q CB 0.000 28.627 28.738 -0.186 0.000 1.108 611 Q HN 0.000 8.270 8.270 -0.000 0.000 0.481