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 2zoe_1_B DATA FIRST_RESID 204 DATA SEQUENCE QTILPYPNGL YVINKGDGYX RTNDKDLIGT LLIESSTSGS IIQPRLRNTT DATA SEQUENCE RPLFNTSNPT IFSQEYTEAR LNDAFNIQLF NTSTTLFKFV EEAPTNKNIS DATA SEQUENCE XKVYNTYEKY ELINYQNGNI DDKAEYYLPS LGKCEVSDAP SPQAPVVETP DATA SEQUENCE VDQDGFIQTG PNENIIVGVI NPSENIEEIS TPIPDDYTYN IPTSIQNNAC DATA SEQUENCE YVLFKVNTTG VYKITTKNNL PPLIIYEAIG SSNRNXNSNN LSNDNIKAIK DATA SEQUENCE YITGLNRSDA KSYLIVSLFK DKNYYIRIPQ ISSSTTSQLI FKRELGNISD DATA SEQUENCE LADSTVNILD NLNTSGTHYY TRQSPDVGNY ISYQLTIPGD FNNIASSIFS DATA SEQUENCE FRTRNNQGIG TLYRLTESIN GYNLITINNY SDLLNNVEPI SLLNGATYIF DATA SEQUENCE RVKVTELNNY NIIFDAYRNS 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 204 Q HA 0.000 4.340 4.340 -0.000 0.000 0.214 204 Q C 0.000 176.023 176.000 0.038 0.000 1.003 204 Q CA 0.000 55.822 55.803 0.031 0.000 1.022 204 Q CB 0.000 28.757 28.738 0.031 0.000 1.108 205 T N 0.419 114.995 114.554 0.036 0.000 2.918 205 T HA 0.576 4.926 4.350 -0.000 0.000 0.283 205 T C 0.280 175.018 174.700 0.065 0.000 1.001 205 T CA -0.516 61.612 62.100 0.046 0.000 1.041 205 T CB 0.762 69.651 68.868 0.036 0.000 1.028 205 T HN 0.264 8.504 8.240 -0.000 0.000 0.511 206 I N 1.999 122.624 120.570 0.091 0.000 2.452 206 I HA 0.138 4.308 4.170 -0.000 0.000 0.287 206 I C 0.066 176.270 176.117 0.144 0.000 1.079 206 I CA 0.160 61.547 61.300 0.147 0.000 1.387 206 I CB 0.039 38.135 38.000 0.161 0.000 1.404 206 I HN 0.385 8.595 8.210 -0.000 0.000 0.522 207 L N 9.671 130.999 121.223 0.175 0.000 2.259 207 L HA 0.346 4.685 4.340 -0.000 0.000 0.288 207 L C -1.824 175.251 176.870 0.342 0.000 1.051 207 L CA -1.498 53.422 54.840 0.133 0.000 0.824 207 L CB 0.894 42.764 42.059 -0.316 0.000 1.206 207 L HN 0.439 8.669 8.230 -0.000 0.000 0.429 208 P HA 0.145 4.565 4.420 -0.000 0.000 0.220 208 P C -1.265 175.880 177.300 -0.258 0.000 1.806 208 P CA 0.066 63.172 63.100 0.009 0.000 0.976 208 P CB -0.276 31.361 31.700 -0.105 0.000 1.952 209 Y N 1.271 121.649 120.300 0.130 0.000 2.576 209 Y HA 0.471 5.021 4.550 -0.000 0.000 0.346 209 Y C -1.994 173.980 175.900 0.124 0.000 1.018 209 Y CA -2.562 55.483 58.100 -0.092 0.000 1.050 209 Y CB 1.884 40.174 38.460 -0.284 0.000 1.280 209 Y HN 0.017 8.297 8.280 -0.000 0.000 0.474 210 P HA 0.066 4.486 4.420 -0.000 0.000 0.277 210 P C -0.852 176.697 177.300 0.414 0.000 1.276 210 P CA -0.393 62.825 63.100 0.196 0.000 0.788 210 P CB 0.705 32.444 31.700 0.064 0.000 1.114 211 N N -0.812 118.044 118.700 0.259 0.000 2.374 211 N HA 0.355 5.095 4.740 -0.000 0.000 0.241 211 N C 0.986 176.703 175.510 0.344 0.000 1.262 211 N CA 1.168 54.357 53.050 0.233 0.000 0.880 211 N CB -0.314 38.240 38.487 0.112 0.000 1.105 211 N HN 0.815 9.195 8.380 -0.000 0.000 0.438 212 G N -0.590 108.407 108.800 0.328 0.000 2.320 212 G HA2 0.062 4.022 3.960 -0.000 0.000 0.274 212 G HA3 0.062 4.022 3.960 -0.000 0.000 0.274 212 G C -1.648 173.292 174.900 0.066 0.000 1.324 212 G CA -0.904 44.283 45.100 0.145 0.000 0.957 212 G HN 0.394 8.684 8.290 -0.000 0.000 0.481 213 L N 0.245 121.343 121.223 -0.209 0.000 2.309 213 L HA 0.724 5.064 4.340 -0.000 0.000 0.282 213 L C -0.950 175.577 176.870 -0.572 0.000 1.036 213 L CA -0.750 53.995 54.840 -0.158 0.000 0.806 213 L CB 1.423 43.446 42.059 -0.060 0.000 1.220 213 L HN 0.560 8.790 8.230 -0.000 0.000 0.429 214 Y N 1.361 121.669 120.300 0.013 0.000 2.457 214 Y HA 0.480 5.030 4.550 -0.000 0.000 0.343 214 Y C -0.355 175.513 175.900 -0.052 0.000 0.994 214 Y CA -0.935 57.123 58.100 -0.070 0.000 1.031 214 Y CB 2.253 40.622 38.460 -0.152 0.000 1.246 214 Y HN 0.104 8.384 8.280 -0.000 0.000 0.449 215 V N 5.184 125.142 119.914 0.075 0.000 2.347 215 V HA 0.418 4.538 4.120 -0.000 0.000 0.280 215 V C -0.592 175.628 176.094 0.210 0.000 1.021 215 V CA -0.595 61.780 62.300 0.125 0.000 0.847 215 V CB 0.943 32.834 31.823 0.114 0.000 0.990 215 V HN 0.498 8.688 8.190 -0.000 0.000 0.444 216 I N 4.613 125.289 120.570 0.176 0.000 2.362 216 I HA 0.353 4.523 4.170 -0.000 0.000 0.289 216 I C 0.281 176.448 176.117 0.083 0.000 0.994 216 I CA -0.254 61.122 61.300 0.127 0.000 1.158 216 I CB 1.438 39.443 38.000 0.010 0.000 1.315 216 I HN 0.465 8.675 8.210 -0.000 0.000 0.451 217 N N 6.384 125.120 118.700 0.061 0.000 2.405 217 N HA 0.105 4.845 4.740 -0.000 0.000 0.260 217 N C 0.254 175.637 175.510 -0.212 0.000 1.152 217 N CA 0.217 53.073 53.050 -0.323 0.000 0.948 217 N CB 0.709 38.906 38.487 -0.483 0.000 1.111 217 N HN 0.481 8.861 8.380 -0.000 0.000 0.485 218 K N 2.223 122.475 120.400 -0.247 0.000 2.410 218 K HA 0.239 4.559 4.320 -0.000 0.000 0.200 218 K C 0.460 177.102 176.600 0.070 0.000 1.023 218 K CA -0.106 56.129 56.287 -0.087 0.000 1.149 218 K CB 0.057 32.496 32.500 -0.101 0.000 0.859 218 K HN 0.791 9.041 8.250 -0.000 0.000 0.514 219 G N 1.243 110.029 108.800 -0.024 0.000 2.479 219 G HA2 -0.157 3.803 3.960 -0.000 0.000 0.686 219 G HA3 -0.157 3.803 3.960 -0.000 0.000 0.686 219 G C -1.640 173.348 174.900 0.146 0.000 1.295 219 G CA -0.899 44.239 45.100 0.064 0.000 0.922 219 G HN 0.106 8.396 8.290 -0.000 0.000 0.582 220 D N -0.696 119.744 120.400 0.067 0.000 2.440 220 D HA 0.631 5.271 4.640 -0.000 0.000 0.258 220 D C 1.383 177.713 176.300 0.049 0.000 1.092 220 D CA 1.137 55.188 54.000 0.087 0.000 1.016 220 D CB 1.173 41.980 40.800 0.012 0.000 1.141 220 D HN 2.014 10.384 8.370 -0.000 0.000 0.552 221 G N 0.133 108.971 108.800 0.063 0.000 2.136 221 G HA2 -0.269 3.691 3.960 -0.000 0.000 0.242 221 G HA3 -0.269 3.691 3.960 -0.000 0.000 0.242 221 G C 0.079 174.966 174.900 -0.022 0.000 0.989 221 G CA 0.405 45.493 45.100 -0.019 0.000 0.682 221 G HN 0.383 8.673 8.290 -0.000 0.000 0.522 225 T N -1.243 113.197 114.554 -0.191 0.000 2.754 225 T HA 0.232 4.582 4.350 -0.000 0.000 0.286 225 T C 0.403 175.063 174.700 -0.067 0.000 0.997 225 T CA -0.220 61.819 62.100 -0.102 0.000 0.982 225 T CB 0.288 69.102 68.868 -0.090 0.000 1.027 225 T HN 0.796 9.036 8.240 -0.000 0.000 0.529 226 N N 0.615 119.296 118.700 -0.031 0.000 2.754 226 N HA -0.154 4.586 4.740 -0.000 0.000 0.248 226 N C -0.882 174.642 175.510 0.024 0.000 1.093 226 N CA 0.424 53.470 53.050 -0.007 0.000 0.699 226 N CB -1.445 37.028 38.487 -0.024 0.000 1.016 226 N HN 0.793 9.173 8.380 -0.000 0.000 0.552 227 D N -1.615 118.827 120.400 0.070 0.000 2.751 227 D HA -0.197 4.443 4.640 -0.000 0.000 0.233 227 D C 0.990 177.351 176.300 0.102 0.000 1.149 227 D CA 1.345 55.434 54.000 0.148 0.000 0.682 227 D CB -0.660 40.212 40.800 0.119 0.000 1.068 227 D HN 0.600 8.970 8.370 -0.000 0.000 0.429 228 K N 0.100 120.536 120.400 0.061 0.000 2.288 228 K HA -0.059 4.261 4.320 -0.000 0.000 0.201 228 K C 0.903 177.557 176.600 0.090 0.000 1.048 228 K CA 0.973 57.282 56.287 0.036 0.000 0.956 228 K CB 0.372 32.851 32.500 -0.034 0.000 0.746 228 K HN 0.095 8.345 8.250 -0.000 0.000 0.461 229 D N 0.123 120.620 120.400 0.161 0.000 2.440 229 D HA 0.006 4.646 4.640 -0.000 0.000 0.216 229 D C -0.627 175.823 176.300 0.250 0.000 1.150 229 D CA -0.223 53.905 54.000 0.213 0.000 0.832 229 D CB 0.386 41.336 40.800 0.250 0.000 0.992 229 D HN 0.069 8.439 8.370 -0.000 0.000 0.502 230 L N 1.987 123.325 121.223 0.192 0.000 2.477 230 L HA 0.038 4.378 4.340 -0.000 0.000 0.272 230 L C 1.169 178.010 176.870 -0.049 0.000 1.157 230 L CA 0.174 54.982 54.840 -0.054 0.000 0.889 230 L CB 0.319 42.313 42.059 -0.108 0.000 1.158 230 L HN -0.129 8.101 8.230 -0.000 0.000 0.473 231 I N 3.844 124.368 120.570 -0.076 0.000 2.277 231 I HA 0.185 4.355 4.170 -0.000 0.000 0.243 231 I C 1.207 177.291 176.117 -0.055 0.000 1.094 231 I CA 1.251 62.541 61.300 -0.017 0.000 1.393 231 I CB -1.193 36.832 38.000 0.042 0.000 1.078 231 I HN 0.778 8.988 8.210 -0.000 0.000 0.417 232 G N -0.190 108.539 108.800 -0.119 0.000 2.320 232 G HA2 0.268 4.228 3.960 -0.000 0.000 0.297 232 G HA3 0.268 4.228 3.960 -0.000 0.000 0.297 232 G C -1.253 173.569 174.900 -0.132 0.000 1.344 232 G CA -0.590 44.447 45.100 -0.105 0.000 0.851 232 G HN -0.042 8.248 8.290 -0.000 0.000 0.567 233 T N 0.833 115.331 114.554 -0.093 0.000 2.824 233 T HA 0.649 4.999 4.350 -0.000 0.000 0.282 233 T C -0.181 174.492 174.700 -0.046 0.000 0.993 233 T CA -0.419 61.632 62.100 -0.082 0.000 0.967 233 T CB 1.453 70.276 68.868 -0.076 0.000 0.960 233 T HN 0.488 8.728 8.240 -0.000 0.000 0.441 234 L N 3.194 124.395 121.223 -0.036 0.000 2.295 234 L HA 0.517 4.857 4.340 -0.000 0.000 0.285 234 L C -0.551 176.309 176.870 -0.017 0.000 1.035 234 L CA -1.169 53.660 54.840 -0.019 0.000 0.806 234 L CB 1.439 43.494 42.059 -0.006 0.000 1.214 234 L HN 0.402 8.632 8.230 -0.000 0.000 0.426 235 L N 5.653 126.868 121.223 -0.013 0.000 2.261 235 L HA 0.415 4.755 4.340 -0.000 0.000 0.289 235 L C -0.371 176.495 176.870 -0.005 0.000 1.059 235 L CA 0.289 55.123 54.840 -0.010 0.000 0.816 235 L CB 0.450 42.504 42.059 -0.009 0.000 1.191 235 L HN 0.345 8.575 8.230 -0.000 0.000 0.431 236 I N 5.461 126.029 120.570 -0.004 0.000 2.306 236 I HA 0.272 4.442 4.170 -0.000 0.000 0.288 236 I C 0.291 176.408 176.117 0.000 0.000 1.036 236 I CA -0.633 60.667 61.300 0.000 0.000 1.221 236 I CB 0.683 38.685 38.000 0.004 0.000 1.385 236 I HN 0.524 8.734 8.210 -0.000 0.000 0.472 237 E N 4.147 124.347 120.200 0.000 0.000 2.408 237 E HA 0.088 4.438 4.350 -0.000 0.000 0.259 237 E C 0.241 176.842 176.600 0.001 0.000 1.110 237 E CA -0.130 56.270 56.400 0.000 0.000 0.929 237 E CB 0.870 30.570 29.700 -0.000 0.000 0.971 237 E HN 0.664 9.024 8.360 -0.000 0.000 0.438 238 S N 0.572 116.272 115.700 0.001 0.000 2.558 238 S HA -0.042 4.428 4.470 -0.000 0.000 0.291 238 S C 0.383 174.985 174.600 0.002 0.000 1.306 238 S CA 0.036 58.237 58.200 0.002 0.000 1.056 238 S CB 0.355 63.556 63.200 0.001 0.000 0.836 238 S HN 0.506 8.816 8.310 -0.000 0.000 0.504 239 S N 0.854 116.556 115.700 0.003 0.000 3.698 239 S HA -0.126 4.344 4.470 -0.000 0.000 0.338 239 S C 0.085 174.688 174.600 0.004 0.000 1.089 239 S CA 1.105 59.307 58.200 0.004 0.000 0.991 239 S CB -2.138 61.063 63.200 0.003 0.000 0.909 239 S HN 1.078 9.388 8.310 -0.000 0.000 0.485 240 T N 1.131 115.688 114.554 0.005 0.000 2.909 240 T HA 0.573 4.923 4.350 -0.000 0.000 0.299 240 T C -0.274 174.431 174.700 0.008 0.000 1.073 240 T CA -0.481 61.623 62.100 0.006 0.000 0.999 240 T CB 2.061 70.931 68.868 0.004 0.000 1.098 240 T HN 0.064 8.304 8.240 -0.000 0.000 0.477 241 S N 0.502 116.208 115.700 0.010 0.000 2.549 241 S HA 0.821 5.291 4.470 -0.000 0.000 0.297 241 S C 0.142 174.752 174.600 0.016 0.000 1.115 241 S CA -0.710 57.499 58.200 0.015 0.000 1.059 241 S CB 1.453 64.662 63.200 0.016 0.000 1.046 241 S HN 0.961 9.271 8.310 -0.000 0.000 0.506 242 G N 0.486 109.300 108.800 0.023 0.000 2.563 242 G HA2 0.648 4.608 3.960 -0.000 0.000 0.302 242 G HA3 0.648 4.608 3.960 -0.000 0.000 0.302 242 G C -1.324 173.601 174.900 0.042 0.000 1.301 242 G CA -0.475 44.640 45.100 0.025 0.000 0.965 242 G HN 0.615 8.905 8.290 -0.000 0.000 0.480 243 S N -0.117 115.609 115.700 0.043 0.000 2.546 243 S HA 0.673 5.143 4.470 -0.000 0.000 0.272 243 S C -1.164 173.473 174.600 0.061 0.000 1.140 243 S CA -0.593 57.644 58.200 0.061 0.000 0.920 243 S CB 1.052 64.274 63.200 0.037 0.000 1.083 243 S HN 0.494 8.804 8.310 -0.000 0.000 0.476 244 I N 4.311 124.945 120.570 0.106 0.000 2.436 244 I HA 0.509 4.679 4.170 -0.000 0.000 0.289 244 I C -1.276 174.875 176.117 0.056 0.000 1.010 244 I CA -0.723 60.635 61.300 0.095 0.000 1.098 244 I CB 1.760 39.855 38.000 0.158 0.000 1.266 244 I HN 0.480 8.690 8.210 -0.000 0.000 0.434 245 I N 5.402 125.948 120.570 -0.040 0.000 2.509 245 I HA 0.299 4.469 4.170 -0.000 0.000 0.293 245 I C -0.268 175.684 176.117 -0.274 0.000 1.020 245 I CA -0.607 60.600 61.300 -0.155 0.000 1.088 245 I CB 1.760 39.687 38.000 -0.122 0.000 1.267 245 I HN 0.412 8.622 8.210 -0.000 0.000 0.430 246 Q N 8.277 127.738 119.800 -0.565 0.000 2.509 246 Q HA 0.453 4.793 4.340 -0.000 0.000 0.236 246 Q C -2.277 173.462 176.000 -0.435 0.000 1.073 246 Q CA -1.927 53.488 55.803 -0.647 0.000 0.867 246 Q CB 1.208 29.102 28.738 -1.406 0.000 1.181 246 Q HN 0.333 8.603 8.270 -0.000 0.000 0.526 247 P HA 0.068 4.488 4.420 -0.000 0.000 0.255 247 P C -0.682 176.546 177.300 -0.120 0.000 1.248 247 P CA -0.079 62.923 63.100 -0.163 0.000 0.807 247 P CB 0.384 32.015 31.700 -0.115 0.000 1.150 248 R N 0.047 120.474 120.500 -0.122 0.000 3.188 248 R HA -0.146 4.194 4.340 -0.000 0.000 0.247 248 R C 0.896 177.167 176.300 -0.049 0.000 0.918 248 R CA 0.192 56.250 56.100 -0.070 0.000 0.629 248 R CB -2.793 27.477 30.300 -0.052 0.000 1.087 248 R HN 0.366 8.636 8.270 -0.000 0.000 0.462 249 L N -0.526 120.668 121.223 -0.048 0.000 2.313 249 L HA -0.033 4.307 4.340 -0.000 0.000 0.214 249 L C 1.113 177.970 176.870 -0.020 0.000 1.119 249 L CA 1.077 55.897 54.840 -0.033 0.000 0.809 249 L CB -0.004 42.035 42.059 -0.033 0.000 0.933 249 L HN 0.083 8.313 8.230 -0.000 0.000 0.449 250 R N -0.062 120.428 120.500 -0.017 0.000 2.637 250 R HA 0.257 4.597 4.340 -0.000 0.000 0.291 250 R C 0.010 176.310 176.300 0.001 0.000 0.963 250 R CA -0.461 55.636 56.100 -0.004 0.000 0.901 250 R CB 1.114 31.416 30.300 0.004 0.000 1.160 250 R HN -0.032 8.238 8.270 -0.000 0.000 0.457 251 N N 0.366 119.071 118.700 0.008 0.000 2.422 251 N HA -0.024 4.716 4.740 -0.000 0.000 0.181 251 N C -0.185 175.344 175.510 0.032 0.000 1.080 251 N CA 0.527 53.586 53.050 0.015 0.000 0.893 251 N CB 0.398 38.892 38.487 0.012 0.000 0.973 251 N HN 0.403 8.783 8.380 -0.000 0.000 0.456 252 T N 1.694 116.270 114.554 0.037 0.000 2.853 252 T HA 0.153 4.503 4.350 -0.000 0.000 0.298 252 T C 0.839 175.581 174.700 0.070 0.000 0.978 252 T CA 0.157 62.290 62.100 0.054 0.000 1.152 252 T CB 0.756 69.653 68.868 0.049 0.000 0.914 252 T HN 0.256 8.496 8.240 -0.000 0.000 0.539 253 T N 1.401 116.011 114.554 0.094 0.000 2.940 253 T HA 0.617 4.967 4.350 -0.000 0.000 0.288 253 T C -0.259 174.527 174.700 0.143 0.000 1.045 253 T CA -1.260 60.913 62.100 0.122 0.000 1.018 253 T CB 1.401 70.353 68.868 0.139 0.000 1.151 253 T HN 0.463 8.703 8.240 -0.000 0.000 0.529 254 R N 1.825 122.431 120.500 0.177 0.000 2.477 254 R HA 0.346 4.685 4.340 -0.000 0.000 0.285 254 R C -2.587 173.858 176.300 0.243 0.000 1.415 254 R CA -1.723 54.487 56.100 0.183 0.000 1.446 254 R CB 1.013 31.413 30.300 0.167 0.000 1.110 254 R HN 0.568 8.838 8.270 -0.000 0.000 0.590 255 P HA 0.080 4.500 4.420 -0.000 0.000 0.272 255 P C -0.403 176.886 177.300 -0.018 0.000 1.223 255 P CA -0.041 63.124 63.100 0.108 0.000 0.784 255 P CB 1.114 32.830 31.700 0.026 0.000 0.923 256 L N 2.184 123.337 121.223 -0.117 0.000 2.334 256 L HA 0.633 4.973 4.340 -0.000 0.000 0.272 256 L C -0.124 176.764 176.870 0.031 0.000 1.020 256 L CA -0.826 53.977 54.840 -0.061 0.000 0.812 256 L CB 1.032 42.987 42.059 -0.174 0.000 1.264 256 L HN 0.333 8.563 8.230 -0.000 0.000 0.439 257 F N 1.393 121.317 119.950 -0.044 0.000 2.604 257 F HA 0.452 4.978 4.527 -0.000 0.000 0.316 257 F C -1.231 174.615 175.800 0.077 0.000 1.136 257 F CA -0.504 57.495 58.000 -0.002 0.000 0.989 257 F CB 1.614 40.603 39.000 -0.019 0.000 1.258 257 F HN 0.465 8.765 8.300 -0.000 0.000 0.451 258 N N 2.369 120.676 118.700 -0.654 0.000 2.262 258 N HA 0.696 5.436 4.740 -0.000 0.000 0.295 258 N C -1.596 173.425 175.510 -0.816 0.000 1.161 258 N CA -0.917 51.804 53.050 -0.547 0.000 0.767 258 N CB 2.455 40.846 38.487 -0.160 0.000 1.499 258 N HN 0.594 8.974 8.380 -0.000 0.000 0.476 259 T N -1.265 113.014 114.554 -0.458 0.000 2.923 259 T HA 0.298 4.648 4.350 -0.000 0.000 0.311 259 T C 0.459 175.122 174.700 -0.062 0.000 1.183 259 T CA -0.541 61.423 62.100 -0.227 0.000 1.020 259 T CB 1.182 70.009 68.868 -0.069 0.000 1.165 259 T HN 0.549 8.789 8.240 -0.000 0.000 0.482 260 S N 2.932 118.628 115.700 -0.007 0.000 2.439 260 S HA 0.174 4.644 4.470 -0.000 0.000 0.224 260 S C 0.703 175.287 174.600 -0.026 0.000 1.029 260 S CA 0.057 58.246 58.200 -0.018 0.000 0.946 260 S CB -0.118 63.071 63.200 -0.020 0.000 0.797 260 S HN 0.682 8.992 8.310 -0.000 0.000 0.504 261 N N 1.445 120.131 118.700 -0.023 0.000 2.540 261 N HA 0.327 5.067 4.740 -0.000 0.000 0.275 261 N C -2.832 172.702 175.510 0.041 0.000 1.053 261 N CA -1.625 51.405 53.050 -0.033 0.000 0.876 261 N CB 2.146 40.559 38.487 -0.124 0.000 1.284 261 N HN -0.022 8.358 8.380 -0.000 0.000 0.518 262 P HA -0.006 4.414 4.420 -0.000 0.000 0.229 262 P C 1.312 178.669 177.300 0.095 0.000 1.160 262 P CA 0.931 64.108 63.100 0.128 0.000 0.777 262 P CB 0.246 32.012 31.700 0.109 0.000 0.814 263 T N -2.610 111.965 114.554 0.036 0.000 2.809 263 T HA -0.072 4.278 4.350 -0.000 0.000 0.260 263 T C 1.726 176.416 174.700 -0.017 0.000 1.039 263 T CA 0.680 62.786 62.100 0.010 0.000 1.141 263 T CB -1.047 67.813 68.868 -0.012 0.000 0.869 263 T HN -0.062 8.178 8.240 -0.000 0.000 0.437 264 I N 0.293 120.825 120.570 -0.062 0.000 2.188 264 I HA 0.251 4.421 4.170 -0.000 0.000 0.237 264 I C 0.141 176.214 176.117 -0.074 0.000 1.073 264 I CA 0.133 61.342 61.300 -0.152 0.000 1.359 264 I CB -0.541 37.303 38.000 -0.260 0.000 1.083 264 I HN 0.112 8.322 8.210 -0.000 0.000 0.412 265 F N 3.221 123.074 119.950 -0.163 0.000 2.661 265 F HA 0.291 4.818 4.527 -0.000 0.000 0.356 265 F C 1.099 177.018 175.800 0.198 0.000 1.244 265 F CA -0.917 57.084 58.000 0.002 0.000 1.290 265 F CB -1.650 37.404 39.000 0.089 0.000 1.677 265 F HN 0.106 8.406 8.300 -0.000 0.000 0.649 266 S N 0.119 115.989 115.700 0.284 0.000 2.632 266 S HA 0.125 4.595 4.470 -0.000 0.000 0.267 266 S C 1.361 175.959 174.600 -0.004 0.000 1.276 266 S CA -0.564 57.752 58.200 0.193 0.000 0.998 266 S CB 1.314 64.570 63.200 0.092 0.000 0.953 266 S HN 0.596 8.906 8.310 -0.000 0.000 0.547 267 Q N 0.528 120.073 119.800 -0.425 0.000 2.077 267 Q HA -0.226 4.114 4.340 -0.000 0.000 0.206 267 Q C 1.707 177.421 176.000 -0.477 0.000 0.989 267 Q CA 2.274 57.491 55.803 -0.977 0.000 0.853 267 Q CB -0.319 27.884 28.738 -0.892 0.000 0.907 267 Q HN 0.896 9.166 8.270 -0.000 0.000 0.418 268 E N -0.576 119.459 120.200 -0.275 0.000 2.077 268 E HA -0.214 4.136 4.350 -0.000 0.000 0.193 268 E C 1.573 178.054 176.600 -0.199 0.000 0.989 268 E CA 1.449 57.712 56.400 -0.229 0.000 0.800 268 E CB -0.376 29.251 29.700 -0.122 0.000 0.746 268 E HN 0.485 8.845 8.360 -0.000 0.000 0.452 269 Y N 1.226 121.410 120.300 -0.194 0.000 2.163 269 Y HA -0.236 4.314 4.550 -0.000 0.000 0.288 269 Y C 2.274 178.025 175.900 -0.248 0.000 1.136 269 Y CA 1.898 59.903 58.100 -0.157 0.000 1.147 269 Y CB -0.316 38.119 38.460 -0.041 0.000 0.987 269 Y HN -0.031 8.249 8.280 -0.000 0.000 0.509 270 T N 0.274 114.775 114.554 -0.089 0.000 2.746 270 T HA -0.205 4.145 4.350 -0.000 0.000 0.267 270 T C 1.577 176.016 174.700 -0.435 0.000 1.039 270 T CA 1.842 63.813 62.100 -0.214 0.000 1.142 270 T CB -0.265 68.612 68.868 0.016 0.000 0.866 270 T HN 0.456 8.696 8.240 -0.000 0.000 0.444 271 E N 0.939 120.763 120.200 -0.626 0.000 2.085 271 E HA -0.089 4.261 4.350 -0.000 0.000 0.194 271 E C 2.532 178.765 176.600 -0.612 0.000 0.994 271 E CA 0.989 56.783 56.400 -1.010 0.000 0.801 271 E CB -0.224 28.631 29.700 -1.407 0.000 0.743 271 E HN 0.485 8.845 8.360 -0.000 0.000 0.453 272 A N 1.359 123.896 122.820 -0.473 0.000 1.933 272 A HA -0.180 4.140 4.320 -0.000 0.000 0.218 272 A C 1.999 179.373 177.584 -0.349 0.000 1.175 272 A CA 1.132 52.954 52.037 -0.360 0.000 0.628 272 A CB -0.226 18.539 19.000 -0.392 0.000 0.814 272 A HN 0.021 8.171 8.150 -0.000 0.000 0.444 273 R N -0.853 119.392 120.500 -0.425 0.000 2.090 273 R HA 0.031 4.371 4.340 -0.000 0.000 0.228 273 R C 1.856 178.019 176.300 -0.228 0.000 1.110 273 R CA 0.825 56.719 56.100 -0.344 0.000 0.973 273 R CB -1.269 28.814 30.300 -0.361 0.000 0.869 273 R HN 0.464 8.734 8.270 -0.000 0.000 0.440 274 L N 1.938 123.034 121.223 -0.212 0.000 2.131 274 L HA -0.121 4.219 4.340 -0.000 0.000 0.210 274 L C 2.184 179.040 176.870 -0.024 0.000 1.092 274 L CA 1.494 56.270 54.840 -0.106 0.000 0.759 274 L CB -0.817 41.120 42.059 -0.202 0.000 0.903 274 L HN 0.304 8.534 8.230 -0.000 0.000 0.435 275 N N -0.457 118.236 118.700 -0.012 0.000 2.171 275 N HA -0.187 4.553 4.740 -0.000 0.000 0.184 275 N C 1.311 176.767 175.510 -0.090 0.000 1.021 275 N CA 1.328 54.374 53.050 -0.008 0.000 0.854 275 N CB 0.101 38.602 38.487 0.022 0.000 0.994 275 N HN 0.289 8.669 8.380 -0.000 0.000 0.426 276 D N 0.681 120.991 120.400 -0.149 0.000 2.149 276 D HA -0.101 4.539 4.640 -0.000 0.000 0.198 276 D C 1.713 177.879 176.300 -0.223 0.000 0.990 276 D CA 1.190 55.077 54.000 -0.189 0.000 0.839 276 D CB -0.231 40.429 40.800 -0.233 0.000 0.948 276 D HN 0.418 8.788 8.370 -0.000 0.000 0.460 277 A N -0.512 122.150 122.820 -0.263 0.000 1.861 277 A HA 0.027 4.347 4.320 -0.000 0.000 0.212 277 A C 1.516 178.740 177.584 -0.599 0.000 1.199 277 A CA 0.710 52.456 52.037 -0.485 0.000 0.613 277 A CB -0.396 18.258 19.000 -0.576 0.000 0.846 277 A HN 0.179 8.329 8.150 -0.000 0.000 0.446 278 F N -1.613 118.290 119.950 -0.079 0.000 2.682 278 F HA 0.266 4.793 4.527 -0.000 0.000 0.308 278 F C 0.767 176.514 175.800 -0.088 0.000 1.093 278 F CA 0.030 57.994 58.000 -0.060 0.000 1.244 278 F CB -0.124 38.853 39.000 -0.037 0.000 1.052 278 F HN 0.336 8.636 8.300 -0.000 0.000 0.573 279 N N 1.203 119.913 118.700 0.017 0.000 2.747 279 N HA -0.188 4.552 4.740 -0.000 0.000 0.249 279 N C -0.581 174.882 175.510 -0.079 0.000 1.107 279 N CA 0.084 53.114 53.050 -0.034 0.000 0.707 279 N CB -0.992 37.476 38.487 -0.032 0.000 1.054 279 N HN 0.017 8.397 8.380 -0.000 0.000 0.555 280 I N 0.724 121.220 120.570 -0.123 0.000 2.662 280 I HA -0.077 4.093 4.170 -0.000 0.000 0.285 280 I C 1.568 177.399 176.117 -0.477 0.000 1.161 280 I CA 0.571 61.658 61.300 -0.356 0.000 1.415 280 I CB 0.912 38.586 38.000 -0.545 0.000 1.385 280 I HN 0.388 8.598 8.210 -0.000 0.000 0.552 281 Q N 5.273 124.808 119.800 -0.443 0.000 2.287 281 Q HA 0.270 4.610 4.340 -0.000 0.000 0.201 281 Q C 0.174 175.924 176.000 -0.418 0.000 0.946 281 Q CA 0.875 56.492 55.803 -0.312 0.000 0.868 281 Q CB 0.493 29.128 28.738 -0.171 0.000 0.967 281 Q HN 0.550 8.820 8.270 -0.000 0.000 0.516 282 L N 0.431 121.357 121.223 -0.495 0.000 2.333 282 L HA 0.336 4.676 4.340 -0.000 0.000 0.280 282 L C 0.052 176.667 176.870 -0.425 0.000 1.004 282 L CA -0.361 54.292 54.840 -0.312 0.000 0.820 282 L CB 1.244 43.222 42.059 -0.134 0.000 1.247 282 L HN -0.002 8.228 8.230 -0.000 0.000 0.416 283 F N 0.635 120.598 119.950 0.021 0.000 2.653 283 F HA 0.079 4.606 4.527 -0.000 0.000 0.288 283 F C 1.265 177.158 175.800 0.154 0.000 1.121 283 F CA -0.161 57.891 58.000 0.087 0.000 1.384 283 F CB 0.342 39.372 39.000 0.050 0.000 1.115 283 F HN 0.635 8.935 8.300 -0.000 0.000 0.599 284 N N -0.773 118.080 118.700 0.255 0.000 2.387 284 N HA 0.129 4.868 4.740 -0.000 0.000 0.259 284 N C -0.721 174.860 175.510 0.119 0.000 1.369 284 N CA -0.007 53.156 53.050 0.188 0.000 0.867 284 N CB -0.256 38.337 38.487 0.177 0.000 1.341 284 N HN 0.029 8.409 8.380 -0.000 0.000 0.495 285 T N -3.109 111.498 114.554 0.087 0.000 2.952 285 T HA 0.703 5.053 4.350 -0.000 0.000 0.305 285 T C -1.141 173.580 174.700 0.035 0.000 1.064 285 T CA -0.669 61.464 62.100 0.055 0.000 1.008 285 T CB 1.883 70.773 68.868 0.038 0.000 1.078 285 T HN -0.007 8.233 8.240 -0.000 0.000 0.459 286 S N 0.701 116.422 115.700 0.035 0.000 2.549 286 S HA 0.673 5.143 4.470 -0.000 0.000 0.280 286 S C 0.647 175.256 174.600 0.015 0.000 1.109 286 S CA -0.200 58.016 58.200 0.028 0.000 0.905 286 S CB 1.695 64.927 63.200 0.053 0.000 1.081 286 S HN 1.128 9.438 8.310 -0.000 0.000 0.477 287 T N -0.108 114.449 114.554 0.006 0.000 3.129 287 T HA 0.285 4.635 4.350 -0.000 0.000 0.267 287 T C 0.306 175.004 174.700 -0.003 0.000 1.018 287 T CA -0.201 61.897 62.100 -0.003 0.000 0.903 287 T CB -0.121 68.742 68.868 -0.008 0.000 1.067 287 T HN 0.471 8.711 8.240 -0.000 0.000 0.549 288 T N 5.409 119.971 114.554 0.013 0.000 2.869 288 T HA 0.568 4.917 4.350 -0.000 0.000 0.295 288 T C 0.066 174.778 174.700 0.020 0.000 0.987 288 T CA -0.770 61.345 62.100 0.025 0.000 1.109 288 T CB 0.914 69.813 68.868 0.052 0.000 0.932 288 T HN 0.385 8.625 8.240 -0.000 0.000 0.518 289 L N 1.643 122.863 121.223 -0.004 0.000 2.330 289 L HA 0.909 5.249 4.340 -0.000 0.000 0.271 289 L C -0.852 176.016 176.870 -0.003 0.000 1.013 289 L CA -1.292 53.503 54.840 -0.075 0.000 0.816 289 L CB 0.867 42.855 42.059 -0.118 0.000 1.287 289 L HN 0.695 8.925 8.230 -0.000 0.000 0.435 290 F N -0.275 119.597 119.950 -0.130 0.000 2.599 290 F HA 0.869 5.396 4.527 -0.000 0.000 0.311 290 F C -0.699 174.917 175.800 -0.306 0.000 1.076 290 F CA -0.911 56.945 58.000 -0.239 0.000 0.937 290 F CB 1.856 40.698 39.000 -0.263 0.000 1.282 290 F HN 0.814 9.114 8.300 -0.000 0.000 0.460 291 K N 2.176 122.417 120.400 -0.265 0.000 2.542 291 K HA 0.638 4.958 4.320 -0.000 0.000 0.259 291 K C -2.533 173.793 176.600 -0.458 0.000 0.932 291 K CA -0.592 55.526 56.287 -0.282 0.000 0.820 291 K CB 1.976 34.383 32.500 -0.155 0.000 1.345 291 K HN 0.675 8.925 8.250 -0.000 0.000 0.432 292 F N 2.207 122.217 119.950 0.100 0.000 2.529 292 F HA 0.502 5.029 4.527 -0.000 0.000 0.320 292 F C -0.595 175.229 175.800 0.041 0.000 1.118 292 F CA -0.758 57.286 58.000 0.074 0.000 0.915 292 F CB 2.211 41.260 39.000 0.082 0.000 1.161 292 F HN 0.056 8.356 8.300 -0.000 0.000 0.445 293 V N 1.700 121.738 119.914 0.208 0.000 2.789 293 V HA 0.791 4.911 4.120 -0.000 0.000 0.311 293 V C -1.139 175.015 176.094 0.099 0.000 1.073 293 V CA -0.792 61.578 62.300 0.116 0.000 0.921 293 V CB 2.040 33.903 31.823 0.067 0.000 1.009 293 V HN 0.671 8.861 8.190 -0.000 0.000 0.426 294 E N 1.972 122.213 120.200 0.068 0.000 2.343 294 E HA 0.343 4.693 4.350 -0.000 0.000 0.288 294 E C -1.188 175.431 176.600 0.032 0.000 0.907 294 E CA -0.414 56.015 56.400 0.049 0.000 0.792 294 E CB 1.848 31.575 29.700 0.044 0.000 1.275 294 E HN 0.804 9.164 8.360 -0.000 0.000 0.402 295 E N 3.043 123.258 120.200 0.025 0.000 2.227 295 E HA 0.647 4.997 4.350 -0.000 0.000 0.282 295 E C -0.838 175.770 176.600 0.013 0.000 1.015 295 E CA -0.674 55.737 56.400 0.017 0.000 0.823 295 E CB 1.005 30.714 29.700 0.015 0.000 1.081 295 E HN 0.596 8.956 8.360 -0.000 0.000 0.396 296 A N 5.631 128.457 122.820 0.010 0.000 2.388 296 A HA 0.383 4.703 4.320 -0.000 0.000 0.257 296 A C -2.287 175.301 177.584 0.006 0.000 1.095 296 A CA -1.282 50.759 52.037 0.007 0.000 0.791 296 A CB 0.111 19.114 19.000 0.004 0.000 1.029 296 A HN 0.528 8.678 8.150 -0.000 0.000 0.489 297 P HA 0.089 4.509 4.420 -0.000 0.000 0.271 297 P C 1.246 178.548 177.300 0.003 0.000 1.244 297 P CA 0.408 63.511 63.100 0.004 0.000 0.793 297 P CB 0.275 31.977 31.700 0.003 0.000 0.984 298 T N -2.840 111.716 114.554 0.003 0.000 2.962 298 T HA -0.134 4.216 4.350 -0.000 0.000 0.270 298 T C 1.137 175.838 174.700 0.002 0.000 1.088 298 T CA 1.320 63.422 62.100 0.002 0.000 1.127 298 T CB -0.833 68.036 68.868 0.002 0.000 0.883 298 T HN 0.460 8.700 8.240 -0.000 0.000 0.493 299 N N 1.912 120.613 118.700 0.002 0.000 2.454 299 N HA 0.034 4.774 4.740 -0.000 0.000 0.177 299 N C 0.421 175.931 175.510 0.001 0.000 1.049 299 N CA 0.032 53.083 53.050 0.001 0.000 0.887 299 N CB 0.102 38.589 38.487 0.001 0.000 1.095 299 N HN 0.690 9.070 8.380 -0.000 0.000 0.446 300 K N -0.057 120.344 120.400 0.001 0.000 2.385 300 K HA 0.440 4.760 4.320 -0.000 0.000 0.248 300 K C -1.115 175.485 176.600 -0.000 0.000 0.955 300 K CA -0.835 55.452 56.287 -0.000 0.000 0.816 300 K CB 1.385 33.885 32.500 -0.000 0.000 1.250 300 K HN -0.279 7.971 8.250 -0.000 0.000 0.434 301 N N 1.313 120.013 118.700 -0.001 0.000 2.513 301 N HA 0.380 5.120 4.740 -0.000 0.000 0.274 301 N C -0.594 174.914 175.510 -0.002 0.000 1.189 301 N CA -0.274 52.775 53.050 -0.001 0.000 0.975 301 N CB 0.633 39.119 38.487 -0.002 0.000 1.157 301 N HN 0.534 8.914 8.380 -0.000 0.000 0.465 302 I N -0.327 120.241 120.570 -0.003 0.000 2.689 302 I HA 0.247 4.417 4.170 -0.000 0.000 0.299 302 I C 0.218 176.331 176.117 -0.008 0.000 1.059 302 I CA -0.598 60.700 61.300 -0.005 0.000 1.055 302 I CB 2.052 40.050 38.000 -0.002 0.000 1.243 302 I HN 0.431 8.641 8.210 -0.000 0.000 0.425 306 V N 4.411 124.133 119.914 -0.321 0.000 2.495 306 V HA 0.561 4.681 4.120 -0.000 0.000 0.298 306 V C -1.140 174.790 176.094 -0.273 0.000 1.031 306 V CA -0.649 61.533 62.300 -0.197 0.000 0.871 306 V CB 1.337 33.188 31.823 0.047 0.000 0.988 306 V HN 0.586 8.776 8.190 -0.000 0.000 0.432 307 Y N 1.950 122.261 120.300 0.018 0.000 2.524 307 Y HA 0.480 5.030 4.550 -0.000 0.000 0.344 307 Y C 0.602 176.522 175.900 0.034 0.000 1.012 307 Y CA -1.063 57.053 58.100 0.027 0.000 1.068 307 Y CB 1.441 39.895 38.460 -0.009 0.000 1.249 307 Y HN 0.497 8.777 8.280 -0.000 0.000 0.468 308 N N 1.078 119.892 118.700 0.189 0.000 2.482 308 N HA 0.274 5.014 4.740 -0.000 0.000 0.260 308 N C -0.217 175.233 175.510 -0.100 0.000 1.236 308 N CA 0.290 53.354 53.050 0.024 0.000 0.938 308 N CB 1.199 39.679 38.487 -0.012 0.000 1.128 308 N HN 0.806 9.186 8.380 -0.000 0.000 0.448 309 T N -1.743 112.634 114.554 -0.294 0.000 2.838 309 T HA 0.702 5.052 4.350 -0.000 0.000 0.292 309 T C -1.170 173.243 174.700 -0.478 0.000 1.113 309 T CA -0.687 61.267 62.100 -0.243 0.000 1.008 309 T CB 1.052 69.871 68.868 -0.082 0.000 1.259 309 T HN 0.361 8.601 8.240 -0.000 0.000 0.520 310 Y N -0.946 119.478 120.300 0.205 0.000 2.553 310 Y HA 0.566 5.116 4.550 -0.000 0.000 0.347 310 Y C 0.056 176.095 175.900 0.231 0.000 1.019 310 Y CA -1.175 57.067 58.100 0.237 0.000 1.032 310 Y CB 1.914 40.566 38.460 0.320 0.000 1.284 310 Y HN 0.659 8.939 8.280 -0.000 0.000 0.466 311 E N 1.836 122.227 120.200 0.317 0.000 2.200 311 E HA 0.185 4.535 4.350 -0.000 0.000 0.283 311 E C -0.896 175.658 176.600 -0.077 0.000 1.015 311 E CA -0.810 55.651 56.400 0.102 0.000 0.819 311 E CB 1.307 31.015 29.700 0.013 0.000 1.081 311 E HN 0.342 8.702 8.360 -0.000 0.000 0.397 312 K N 4.227 124.379 120.400 -0.415 0.000 2.267 312 K HA 0.154 4.474 4.320 -0.000 0.000 0.282 312 K C -1.398 174.801 176.600 -0.669 0.000 1.078 312 K CA -0.257 55.541 56.287 -0.816 0.000 0.903 312 K CB 0.304 31.953 32.500 -1.418 0.000 1.111 312 K HN 0.401 8.651 8.250 -0.000 0.000 0.475 313 Y N 2.242 122.339 120.300 -0.340 0.000 2.330 313 Y HA 0.200 4.750 4.550 -0.000 0.000 0.336 313 Y C 0.039 175.829 175.900 -0.184 0.000 1.036 313 Y CA -0.587 57.410 58.100 -0.171 0.000 1.125 313 Y CB 1.621 40.060 38.460 -0.036 0.000 1.194 313 Y HN 0.566 8.846 8.280 -0.000 0.000 0.469 314 E N 3.594 123.797 120.200 0.005 0.000 2.165 314 E HA 0.409 4.759 4.350 -0.000 0.000 0.266 314 E C -1.854 174.774 176.600 0.047 0.000 0.889 314 E CA -1.018 55.368 56.400 -0.024 0.000 0.756 314 E CB 1.076 30.734 29.700 -0.070 0.000 1.131 314 E HN 0.565 8.925 8.360 -0.000 0.000 0.411 315 L N 7.165 128.409 121.223 0.036 0.000 2.275 315 L HA 0.500 4.840 4.340 -0.000 0.000 0.288 315 L C -0.925 176.035 176.870 0.149 0.000 1.046 315 L CA -0.372 54.469 54.840 0.002 0.000 0.805 315 L CB 0.890 42.817 42.059 -0.221 0.000 1.193 315 L HN 0.542 8.772 8.230 -0.000 0.000 0.426 316 I N 1.462 122.166 120.570 0.225 0.000 2.608 316 I HA 0.583 4.753 4.170 -0.000 0.000 0.295 316 I C -0.906 175.483 176.117 0.452 0.000 1.049 316 I CA -0.913 60.596 61.300 0.349 0.000 1.063 316 I CB 2.025 40.147 38.000 0.204 0.000 1.248 316 I HN 0.602 8.812 8.210 -0.000 0.000 0.424 317 N N 4.239 123.207 118.700 0.448 0.000 2.462 317 N HA 0.251 4.991 4.740 -0.000 0.000 0.242 317 N C -1.728 173.963 175.510 0.302 0.000 1.010 317 N CA -0.212 53.037 53.050 0.331 0.000 0.939 317 N CB 0.510 39.070 38.487 0.121 0.000 1.127 317 N HN 0.622 9.002 8.380 -0.000 0.000 0.509 318 Y N 3.323 123.747 120.300 0.206 0.000 2.353 318 Y HA 0.434 4.984 4.550 -0.000 0.000 0.340 318 Y C -0.944 175.021 175.900 0.110 0.000 0.972 318 Y CA -0.470 57.721 58.100 0.152 0.000 1.157 318 Y CB 0.765 39.365 38.460 0.233 0.000 1.157 318 Y HN 0.413 8.693 8.280 -0.000 0.000 0.495 319 Q N 4.903 124.578 119.800 -0.207 0.000 2.274 319 Q HA 0.243 4.583 4.340 -0.000 0.000 0.268 319 Q C -0.545 175.237 176.000 -0.363 0.000 1.015 319 Q CA -0.695 54.976 55.803 -0.220 0.000 0.775 319 Q CB 1.525 30.211 28.738 -0.086 0.000 1.256 319 Q HN 0.825 9.095 8.270 -0.000 0.000 0.442 320 N N 1.513 119.998 118.700 -0.359 0.000 2.727 320 N HA -0.230 4.510 4.740 -0.000 0.000 0.249 320 N C 0.673 175.800 175.510 -0.637 0.000 1.048 320 N CA 1.568 54.419 53.050 -0.331 0.000 0.714 320 N CB -1.087 37.312 38.487 -0.146 0.000 0.959 320 N HN 1.079 9.459 8.380 -0.000 0.000 0.544 321 G N -2.078 105.972 108.800 -1.249 0.000 2.148 321 G HA2 -0.344 3.616 3.960 -0.000 0.000 0.254 321 G HA3 -0.344 3.616 3.960 -0.000 0.000 0.254 321 G C -0.130 174.477 174.900 -0.488 0.000 0.981 321 G CA 0.367 44.689 45.100 -1.297 0.000 0.670 321 G HN 0.558 8.848 8.290 -0.000 0.000 0.528 322 N N -0.168 118.287 118.700 -0.407 0.000 2.272 322 N HA 0.556 5.296 4.740 -0.000 0.000 0.305 322 N C -0.074 175.478 175.510 0.070 0.000 1.103 322 N CA -0.743 52.255 53.050 -0.087 0.000 0.791 322 N CB 1.218 39.649 38.487 -0.094 0.000 1.356 322 N HN -0.026 8.354 8.380 -0.000 0.000 0.486 323 I N 2.080 122.736 120.570 0.142 0.000 2.308 323 I HA 0.084 4.254 4.170 -0.000 0.000 0.293 323 I C 0.736 176.888 176.117 0.059 0.000 1.078 323 I CA -0.035 61.359 61.300 0.155 0.000 1.292 323 I CB 0.170 38.240 38.000 0.118 0.000 1.423 323 I HN 0.370 8.580 8.210 -0.000 0.000 0.493 324 D N 3.425 123.846 120.400 0.035 0.000 2.183 324 D HA 0.021 4.660 4.640 -0.000 0.000 0.205 324 D C 0.127 176.376 176.300 -0.085 0.000 0.962 324 D CA 1.339 55.319 54.000 -0.034 0.000 0.849 324 D CB 0.492 41.260 40.800 -0.053 0.000 0.978 324 D HN 0.495 8.865 8.370 -0.000 0.000 0.488 325 D N -0.131 120.206 120.400 -0.105 0.000 2.819 325 D HA 0.302 4.942 4.640 -0.000 0.000 0.232 325 D C -0.624 175.693 176.300 0.029 0.000 1.160 325 D CA -0.470 53.384 54.000 -0.243 0.000 0.858 325 D CB 2.663 42.968 40.800 -0.825 0.000 1.610 325 D HN -0.178 8.192 8.370 -0.000 0.000 0.481 326 K N 0.864 121.335 120.400 0.118 0.000 2.565 326 K HA 0.662 4.982 4.320 -0.000 0.000 0.249 326 K C -1.900 174.845 176.600 0.242 0.000 0.958 326 K CA -0.539 55.881 56.287 0.222 0.000 0.806 326 K CB 2.002 34.556 32.500 0.090 0.000 1.194 326 K HN 0.518 8.768 8.250 -0.000 0.000 0.434 327 A N 3.793 126.766 122.820 0.255 0.000 2.414 327 A HA 0.548 4.868 4.320 -0.000 0.000 0.306 327 A C -1.407 176.162 177.584 -0.024 0.000 1.054 327 A CA -0.762 51.324 52.037 0.081 0.000 0.724 327 A CB 1.246 20.377 19.000 0.218 0.000 1.267 327 A HN 0.767 8.917 8.150 -0.000 0.000 0.418 328 E N 0.965 121.064 120.200 -0.167 0.000 2.185 328 E HA 0.350 4.700 4.350 -0.000 0.000 0.261 328 E C -1.986 174.507 176.600 -0.179 0.000 0.879 328 E CA -0.301 55.953 56.400 -0.243 0.000 0.756 328 E CB 2.211 31.722 29.700 -0.314 0.000 1.152 328 E HN 0.589 8.949 8.360 -0.000 0.000 0.416 329 Y N 2.633 122.803 120.300 -0.217 0.000 2.328 329 Y HA 0.284 4.834 4.550 -0.000 0.000 0.337 329 Y C -1.363 174.424 175.900 -0.188 0.000 0.966 329 Y CA -0.865 57.243 58.100 0.013 0.000 1.136 329 Y CB 0.773 39.321 38.460 0.146 0.000 1.170 329 Y HN 0.470 8.750 8.280 -0.000 0.000 0.470 330 Y N 7.071 127.214 120.300 -0.262 0.000 2.434 330 Y HA 0.311 4.861 4.550 -0.000 0.000 0.341 330 Y C -0.608 175.328 175.900 0.060 0.000 0.965 330 Y CA -0.784 57.224 58.100 -0.154 0.000 1.205 330 Y CB 0.819 39.002 38.460 -0.462 0.000 1.121 330 Y HN 0.509 8.789 8.280 -0.000 0.000 0.507 331 L N 7.564 129.079 121.223 0.486 0.000 2.281 331 L HA 0.504 4.844 4.340 -0.000 0.000 0.285 331 L C -2.557 174.593 176.870 0.466 0.000 1.074 331 L CA -2.450 52.710 54.840 0.534 0.000 0.817 331 L CB 0.494 42.883 42.059 0.550 0.000 1.168 331 L HN 0.289 8.519 8.230 -0.000 0.000 0.434 332 P HA 0.065 4.485 4.420 -0.000 0.000 0.261 332 P C -0.700 176.663 177.300 0.104 0.000 1.183 332 P CA 0.305 63.525 63.100 0.200 0.000 0.761 332 P CB 0.853 32.666 31.700 0.189 0.000 0.785 333 S N 2.322 118.010 115.700 -0.019 0.000 2.786 333 S HA 0.502 4.972 4.470 -0.000 0.000 0.302 333 S C 0.456 174.982 174.600 -0.122 0.000 1.080 333 S CA -0.770 57.416 58.200 -0.022 0.000 0.925 333 S CB 0.416 63.609 63.200 -0.012 0.000 1.325 333 S HN 0.277 8.587 8.310 -0.000 0.000 0.576 334 L N 1.921 123.019 121.223 -0.210 0.000 2.848 334 L HA 0.434 4.774 4.340 -0.000 0.000 0.240 334 L C 0.885 177.139 176.870 -1.026 0.000 1.232 334 L CA 0.036 54.591 54.840 -0.475 0.000 1.031 334 L CB -0.591 41.375 42.059 -0.155 0.000 1.338 334 L HN 0.932 9.162 8.230 -0.000 0.000 0.509 335 G N 1.021 109.369 108.800 -0.754 0.000 2.746 335 G HA2 -0.190 3.770 3.960 -0.000 0.000 0.685 335 G HA3 -0.190 3.770 3.960 -0.000 0.000 0.685 335 G C -0.981 173.873 174.900 -0.076 0.000 1.350 335 G CA -0.720 44.044 45.100 -0.561 0.000 0.837 335 G HN 0.186 8.476 8.290 -0.000 0.000 0.564 336 K N -1.057 119.367 120.400 0.039 0.000 2.468 336 K HA 0.597 4.917 4.320 -0.000 0.000 0.252 336 K C -1.107 175.340 176.600 -0.255 0.000 0.932 336 K CA -0.585 55.684 56.287 -0.029 0.000 0.794 336 K CB 1.943 34.434 32.500 -0.014 0.000 1.241 336 K HN 1.115 9.365 8.250 -0.000 0.000 0.428 337 C N 3.365 122.295 119.300 -0.615 0.000 2.408 337 C HA 0.531 4.991 4.460 -0.000 0.000 0.321 337 C C -1.070 173.734 174.990 -0.310 0.000 1.245 337 C CA -0.384 58.185 59.018 -0.747 0.000 1.523 337 C CB 1.010 27.767 27.740 -1.639 0.000 2.178 337 C HN 0.966 9.196 8.230 -0.000 0.000 0.488 338 E N 3.558 123.668 120.200 -0.150 0.000 2.155 338 E HA 0.583 4.933 4.350 -0.000 0.000 0.264 338 E C -0.579 175.980 176.600 -0.068 0.000 0.886 338 E CA -0.427 55.935 56.400 -0.064 0.000 0.752 338 E CB 1.426 31.147 29.700 0.035 0.000 1.133 338 E HN 0.769 9.129 8.360 -0.000 0.000 0.414 339 V N 2.467 122.344 119.914 -0.062 0.000 2.547 339 V HA 0.978 5.098 4.120 -0.000 0.000 0.299 339 V C -0.277 175.803 176.094 -0.023 0.000 1.040 339 V CA -0.090 62.185 62.300 -0.041 0.000 0.913 339 V CB 1.329 33.132 31.823 -0.034 0.000 0.992 339 V HN 0.757 8.947 8.190 -0.000 0.000 0.449 340 S N 1.440 117.130 115.700 -0.017 0.000 2.672 340 S HA 0.494 4.964 4.470 -0.000 0.000 0.271 340 S C -1.261 173.335 174.600 -0.008 0.000 1.171 340 S CA -0.971 57.223 58.200 -0.011 0.000 0.817 340 S CB 1.329 64.524 63.200 -0.008 0.000 1.150 340 S HN 0.766 9.076 8.310 -0.000 0.000 0.478 341 D N 1.687 122.084 120.400 -0.006 0.000 2.455 341 D HA 0.453 5.093 4.640 -0.000 0.000 0.241 341 D C 0.535 176.832 176.300 -0.005 0.000 1.138 341 D CA 0.530 54.527 54.000 -0.005 0.000 0.877 341 D CB 0.695 41.492 40.800 -0.003 0.000 1.187 341 D HN 0.881 9.251 8.370 -0.000 0.000 0.451 342 A N 4.240 127.057 122.820 -0.005 0.000 2.520 342 A HA 0.282 4.602 4.320 -0.000 0.000 0.245 342 A C -1.785 175.796 177.584 -0.005 0.000 1.072 342 A CA -0.856 51.177 52.037 -0.006 0.000 0.761 342 A CB -0.316 18.681 19.000 -0.006 0.000 1.004 342 A HN 0.376 8.526 8.150 -0.000 0.000 0.499 343 P HA 0.151 4.571 4.420 -0.000 0.000 0.274 343 P C -0.043 177.255 177.300 -0.003 0.000 1.231 343 P CA -0.302 62.796 63.100 -0.004 0.000 0.790 343 P CB 0.919 32.617 31.700 -0.003 0.000 0.951 344 S N 2.514 118.212 115.700 -0.003 0.000 2.525 344 S HA 0.112 4.582 4.470 -0.000 0.000 0.285 344 S C -1.052 173.546 174.600 -0.003 0.000 1.283 344 S CA -1.111 57.088 58.200 -0.003 0.000 1.072 344 S CB -0.266 62.933 63.200 -0.002 0.000 0.867 344 S HN 0.312 8.622 8.310 -0.000 0.000 0.492 345 P HA -0.061 4.359 4.420 -0.000 0.000 0.225 345 P C 0.508 177.807 177.300 -0.002 0.000 1.148 345 P CA 0.783 63.881 63.100 -0.003 0.000 0.779 345 P CB 0.129 31.827 31.700 -0.003 0.000 0.780 346 Q N -0.493 119.306 119.800 -0.002 0.000 2.403 346 Q HA 0.225 4.564 4.340 -0.000 0.000 0.203 346 Q C 0.982 176.981 176.000 -0.002 0.000 0.932 346 Q CA -0.171 55.631 55.803 -0.002 0.000 0.945 346 Q CB -0.514 28.223 28.738 -0.002 0.000 1.045 346 Q HN 0.165 8.435 8.270 -0.000 0.000 0.511 347 A N 3.971 126.790 122.820 -0.002 0.000 2.540 347 A HA 0.282 4.602 4.320 -0.000 0.000 0.239 347 A C -1.705 175.878 177.584 -0.001 0.000 1.061 347 A CA -0.827 51.209 52.037 -0.001 0.000 0.758 347 A CB -0.419 18.581 19.000 -0.001 0.000 0.991 347 A HN 0.049 8.199 8.150 -0.000 0.000 0.502 348 P HA 0.207 4.627 4.420 -0.000 0.000 0.271 348 P C -0.671 176.628 177.300 -0.001 0.000 1.216 348 P CA -0.151 62.949 63.100 -0.001 0.000 0.776 348 P CB 0.613 32.312 31.700 -0.001 0.000 0.881 349 V N 4.032 123.945 119.914 -0.001 0.000 2.372 349 V HA 0.055 4.175 4.120 -0.000 0.000 0.261 349 V C 0.623 176.717 176.094 -0.001 0.000 1.055 349 V CA -0.462 61.837 62.300 -0.001 0.000 0.930 349 V CB 0.929 32.752 31.823 -0.001 0.000 1.031 349 V HN 0.269 8.459 8.190 -0.000 0.000 0.479 350 V N 5.413 125.326 119.914 -0.000 0.000 2.432 350 V HA 0.190 4.310 4.120 -0.000 0.000 0.271 350 V C 0.584 176.678 176.094 -0.000 0.000 1.046 350 V CA -0.562 61.738 62.300 -0.000 0.000 0.945 350 V CB 1.036 32.859 31.823 -0.000 0.000 0.992 350 V HN 0.879 9.069 8.190 -0.000 0.000 0.471 351 E N 3.580 123.780 120.200 -0.001 0.000 2.166 351 E HA 0.303 4.653 4.350 -0.000 0.000 0.279 351 E C 0.210 176.810 176.600 -0.001 0.000 1.095 351 E CA -0.079 56.320 56.400 -0.001 0.000 0.888 351 E CB 0.579 30.278 29.700 -0.001 0.000 1.041 351 E HN 0.826 9.186 8.360 -0.000 0.000 0.414 352 T N 1.073 115.626 114.554 -0.001 0.000 2.861 352 T HA 0.499 4.849 4.350 -0.000 0.000 0.287 352 T C -2.166 172.533 174.700 -0.002 0.000 1.003 352 T CA -1.946 60.153 62.100 -0.002 0.000 0.977 352 T CB 1.396 70.264 68.868 -0.001 0.000 0.996 352 T HN 0.145 8.385 8.240 -0.000 0.000 0.448 353 P HA 0.270 4.690 4.420 -0.000 0.000 0.275 353 P C -0.054 177.242 177.300 -0.006 0.000 1.228 353 P CA -0.569 62.529 63.100 -0.004 0.000 0.786 353 P CB 0.805 32.503 31.700 -0.004 0.000 0.927 354 V N 3.258 123.168 119.914 -0.007 0.000 2.540 354 V HA -0.025 4.095 4.120 -0.000 0.000 0.297 354 V C 0.411 176.498 176.094 -0.013 0.000 1.024 354 V CA 0.098 62.392 62.300 -0.010 0.000 1.105 354 V CB -0.428 31.387 31.823 -0.012 0.000 0.938 354 V HN 0.817 9.007 8.190 -0.000 0.000 0.482 355 D N 6.294 126.685 120.400 -0.015 0.000 2.383 355 D HA 0.190 4.830 4.640 -0.000 0.000 0.248 355 D C 0.068 176.354 176.300 -0.023 0.000 1.170 355 D CA -0.530 53.460 54.000 -0.016 0.000 0.977 355 D CB 0.351 41.142 40.800 -0.015 0.000 1.120 355 D HN 0.633 9.003 8.370 -0.000 0.000 0.481 356 Q N 0.133 119.921 119.800 -0.019 0.000 2.333 356 Q HA -0.014 4.326 4.340 -0.000 0.000 0.299 356 Q C -0.429 175.547 176.000 -0.039 0.000 1.067 356 Q CA 0.157 55.947 55.803 -0.022 0.000 0.943 356 Q CB 0.150 28.882 28.738 -0.010 0.000 1.233 356 Q HN 0.507 8.777 8.270 -0.000 0.000 0.401 357 D N 0.859 121.230 120.400 -0.048 0.000 2.390 357 D HA 0.482 5.122 4.640 -0.000 0.000 0.249 357 D C 0.203 176.448 176.300 -0.093 0.000 1.144 357 D CA 1.412 55.362 54.000 -0.083 0.000 0.880 357 D CB 0.725 41.481 40.800 -0.074 0.000 1.182 357 D HN 0.751 9.121 8.370 -0.000 0.000 0.451 358 G N 1.464 110.155 108.800 -0.182 0.000 2.350 358 G HA2 0.153 4.113 3.960 -0.000 0.000 0.276 358 G HA3 0.153 4.113 3.960 -0.000 0.000 0.276 358 G C -1.529 173.166 174.900 -0.341 0.000 1.313 358 G CA -0.885 44.109 45.100 -0.177 0.000 0.903 358 G HN 0.340 8.630 8.290 -0.000 0.000 0.490 359 F N -0.141 119.794 119.950 -0.025 0.000 2.523 359 F HA 0.843 5.370 4.527 -0.000 0.000 0.329 359 F C 0.541 176.379 175.800 0.063 0.000 1.061 359 F CA -0.782 57.231 58.000 0.021 0.000 0.967 359 F CB 2.197 41.248 39.000 0.084 0.000 1.218 359 F HN 0.436 8.736 8.300 -0.000 0.000 0.480 360 I N 1.063 121.770 120.570 0.229 0.000 2.785 360 I HA 0.313 4.483 4.170 -0.000 0.000 0.302 360 I C -1.246 174.855 176.117 -0.026 0.000 1.069 360 I CA -0.666 60.682 61.300 0.080 0.000 1.045 360 I CB 2.053 40.043 38.000 -0.017 0.000 1.236 360 I HN 0.536 8.746 8.210 -0.000 0.000 0.429 361 Q N 3.461 123.132 119.800 -0.215 0.000 2.307 361 Q HA 0.305 4.645 4.340 -0.000 0.000 0.262 361 Q C -0.174 175.641 176.000 -0.308 0.000 0.961 361 Q CA -0.338 55.144 55.803 -0.534 0.000 0.882 361 Q CB 1.480 29.716 28.738 -0.835 0.000 1.264 361 Q HN 0.807 9.077 8.270 -0.000 0.000 0.446 362 T N -0.369 114.021 114.554 -0.272 0.000 3.040 362 T HA 0.352 4.702 4.350 -0.000 0.000 0.266 362 T C 0.564 175.174 174.700 -0.150 0.000 1.005 362 T CA 0.093 62.083 62.100 -0.182 0.000 0.906 362 T CB 0.579 69.343 68.868 -0.174 0.000 1.082 362 T HN 0.479 8.719 8.240 -0.000 0.000 0.531 363 G N 2.388 111.084 108.800 -0.173 0.000 2.557 363 G HA2 0.664 4.624 3.960 -0.000 0.000 0.302 363 G HA3 0.664 4.624 3.960 -0.000 0.000 0.302 363 G C -2.633 172.207 174.900 -0.100 0.000 1.311 363 G CA -1.705 43.327 45.100 -0.114 0.000 1.030 363 G HN 0.224 8.514 8.290 -0.000 0.000 0.509 364 P HA 0.124 4.544 4.420 -0.000 0.000 0.275 364 P C -0.575 176.698 177.300 -0.046 0.000 1.228 364 P CA -0.604 62.468 63.100 -0.048 0.000 0.786 364 P CB 0.739 32.421 31.700 -0.030 0.000 0.927 365 N N 1.955 120.633 118.700 -0.035 0.000 2.412 365 N HA 0.031 4.771 4.740 -0.000 0.000 0.258 365 N C 0.188 175.691 175.510 -0.010 0.000 1.236 365 N CA 0.809 53.846 53.050 -0.023 0.000 0.882 365 N CB 0.448 38.927 38.487 -0.014 0.000 1.066 365 N HN 0.585 8.965 8.380 -0.000 0.000 0.465 366 E N 1.583 121.782 120.200 -0.002 0.000 2.354 366 E HA 0.213 4.563 4.350 -0.000 0.000 0.283 366 E C -1.746 174.857 176.600 0.006 0.000 0.938 366 E CA -0.555 55.845 56.400 -0.000 0.000 0.777 366 E CB 1.345 31.035 29.700 -0.017 0.000 1.222 366 E HN 0.447 8.807 8.360 -0.000 0.000 0.423 367 N N 6.161 124.868 118.700 0.012 0.000 2.751 367 N HA 0.173 4.913 4.740 -0.000 0.000 0.234 367 N C -1.370 174.162 175.510 0.036 0.000 1.403 367 N CA -0.285 52.773 53.050 0.014 0.000 0.747 367 N CB 0.607 39.105 38.487 0.018 0.000 1.326 367 N HN 0.453 8.833 8.380 -0.000 0.000 0.532 368 I N 3.939 124.541 120.570 0.053 0.000 2.301 368 I HA 0.358 4.528 4.170 -0.000 0.000 0.292 368 I C 0.585 176.792 176.117 0.152 0.000 1.046 368 I CA -0.462 60.909 61.300 0.117 0.000 1.282 368 I CB 0.632 38.736 38.000 0.174 0.000 1.409 368 I HN 0.260 8.470 8.210 -0.000 0.000 0.484 369 I N 6.982 127.604 120.570 0.087 0.000 2.331 369 I HA 0.348 4.518 4.170 -0.000 0.000 0.292 369 I C -0.133 176.004 176.117 0.034 0.000 0.998 369 I CA -0.578 60.731 61.300 0.016 0.000 1.267 369 I CB 1.533 39.429 38.000 -0.173 0.000 1.386 369 I HN 0.134 8.344 8.210 -0.000 0.000 0.476 370 V N 5.337 125.263 119.914 0.020 0.000 2.483 370 V HA 0.489 4.609 4.120 -0.000 0.000 0.297 370 V C 0.557 176.625 176.094 -0.043 0.000 1.027 370 V CA -0.637 61.621 62.300 -0.070 0.000 0.855 370 V CB 1.705 33.314 31.823 -0.357 0.000 0.995 370 V HN 0.899 9.089 8.190 -0.000 0.000 0.424 371 G N 3.226 112.028 108.800 0.003 0.000 2.467 371 G HA2 0.560 4.520 3.960 -0.000 0.000 0.257 371 G HA3 0.560 4.520 3.960 -0.000 0.000 0.257 371 G C -0.372 174.346 174.900 -0.304 0.000 1.227 371 G CA -0.117 44.871 45.100 -0.187 0.000 0.835 371 G HN 1.084 9.374 8.290 -0.000 0.000 0.556 372 V N 0.784 120.457 119.914 -0.400 0.000 2.823 372 V HA 0.603 4.723 4.120 -0.000 0.000 0.312 372 V C 0.329 176.150 176.094 -0.454 0.000 1.072 372 V CA -1.422 60.644 62.300 -0.389 0.000 0.937 372 V CB 1.593 33.229 31.823 -0.313 0.000 1.013 372 V HN 0.685 8.875 8.190 -0.000 0.000 0.430 373 I N 3.503 123.741 120.570 -0.553 0.000 2.752 373 I HA 0.014 4.184 4.170 -0.000 0.000 0.289 373 I C 0.869 176.818 176.117 -0.280 0.000 1.197 373 I CA 0.477 61.385 61.300 -0.655 0.000 1.432 373 I CB 0.168 37.673 38.000 -0.826 0.000 1.359 373 I HN 0.797 9.007 8.210 -0.000 0.000 0.571 374 N N 9.962 128.644 118.700 -0.030 0.000 2.427 374 N HA 0.063 4.803 4.740 -0.000 0.000 0.269 374 N C -1.600 173.970 175.510 0.100 0.000 1.235 374 N CA -1.705 51.399 53.050 0.091 0.000 0.934 374 N CB 0.895 39.483 38.487 0.169 0.000 1.121 374 N HN 0.305 8.685 8.380 -0.000 0.000 0.480 375 P HA -0.029 4.391 4.420 -0.000 0.000 0.242 375 P C 0.547 177.892 177.300 0.075 0.000 1.197 375 P CA 0.588 63.702 63.100 0.024 0.000 0.765 375 P CB 0.063 31.740 31.700 -0.038 0.000 0.936 376 S N -1.959 113.806 115.700 0.107 0.000 2.575 376 S HA 0.129 4.599 4.470 -0.000 0.000 0.215 376 S C 0.481 175.128 174.600 0.078 0.000 0.966 376 S CA -0.313 57.943 58.200 0.092 0.000 0.911 376 S CB -0.480 62.777 63.200 0.095 0.000 0.780 376 S HN 0.114 8.424 8.310 -0.000 0.000 0.514 377 E N 3.321 123.582 120.200 0.102 0.000 2.145 377 E HA 0.290 4.639 4.350 -0.000 0.000 0.270 377 E C -0.600 176.082 176.600 0.137 0.000 0.906 377 E CA -0.905 55.542 56.400 0.079 0.000 0.761 377 E CB 0.901 30.596 29.700 -0.007 0.000 1.116 377 E HN 0.503 8.863 8.360 -0.000 0.000 0.408 378 N N 3.597 122.358 118.700 0.102 0.000 2.416 378 N HA 0.050 4.790 4.740 -0.000 0.000 0.246 378 N C -0.399 175.228 175.510 0.194 0.000 1.260 378 N CA 0.258 53.383 53.050 0.125 0.000 0.897 378 N CB 0.994 39.540 38.487 0.098 0.000 1.110 378 N HN 0.366 8.746 8.380 -0.000 0.000 0.439 379 I N 0.578 121.263 120.570 0.191 0.000 2.355 379 I HA 0.135 4.305 4.170 -0.000 0.000 0.288 379 I C 0.143 176.379 176.117 0.198 0.000 0.999 379 I CA -0.753 60.693 61.300 0.242 0.000 1.163 379 I CB 1.206 39.333 38.000 0.212 0.000 1.316 379 I HN 0.298 8.508 8.210 -0.000 0.000 0.454 380 E N 5.834 126.164 120.200 0.217 0.000 2.277 380 E HA 0.331 4.680 4.350 -0.000 0.000 0.274 380 E C -0.704 175.982 176.600 0.144 0.000 1.022 380 E CA -0.392 56.121 56.400 0.188 0.000 0.853 380 E CB 2.139 31.984 29.700 0.241 0.000 1.086 380 E HN 0.516 8.876 8.360 -0.000 0.000 0.397 381 E N 2.245 122.511 120.200 0.110 0.000 2.224 381 E HA 0.314 4.664 4.350 -0.000 0.000 0.265 381 E C -0.849 175.775 176.600 0.040 0.000 0.878 381 E CA -0.550 55.886 56.400 0.061 0.000 0.759 381 E CB 1.079 30.810 29.700 0.052 0.000 1.164 381 E HN 0.387 8.747 8.360 -0.000 0.000 0.414 382 I N 4.753 125.315 120.570 -0.013 0.000 2.269 382 I HA 0.020 4.190 4.170 -0.000 0.000 0.293 382 I C 1.492 177.580 176.117 -0.049 0.000 1.106 382 I CA -0.074 61.205 61.300 -0.034 0.000 1.248 382 I CB 0.880 38.793 38.000 -0.145 0.000 1.444 382 I HN 0.578 8.788 8.210 -0.000 0.000 0.497 383 S N 2.328 118.016 115.700 -0.021 0.000 2.383 383 S HA -0.073 4.397 4.470 -0.000 0.000 0.227 383 S C 1.024 175.587 174.600 -0.061 0.000 1.026 383 S CA 0.530 58.711 58.200 -0.032 0.000 0.981 383 S CB -0.420 62.776 63.200 -0.007 0.000 0.818 383 S HN 0.577 8.887 8.310 -0.000 0.000 0.472 384 T N 5.400 119.906 114.554 -0.080 0.000 2.794 384 T HA 0.366 4.716 4.350 -0.000 0.000 0.296 384 T C -2.692 171.902 174.700 -0.178 0.000 0.949 384 T CA -1.239 60.797 62.100 -0.108 0.000 1.101 384 T CB 1.052 69.863 68.868 -0.096 0.000 0.905 384 T HN 0.265 8.505 8.240 -0.000 0.000 0.516 385 P HA 0.079 4.499 4.420 -0.000 0.000 0.263 385 P C 0.330 177.495 177.300 -0.225 0.000 1.195 385 P CA -0.315 62.693 63.100 -0.154 0.000 0.762 385 P CB -0.037 31.606 31.700 -0.095 0.000 0.799 386 I N 3.432 123.805 120.570 -0.329 0.000 2.692 386 I HA 0.295 4.464 4.170 -0.000 0.000 0.284 386 I C -2.093 173.902 176.117 -0.204 0.000 1.159 386 I CA -2.088 58.928 61.300 -0.473 0.000 1.423 386 I CB -0.014 37.529 38.000 -0.762 0.000 1.380 386 I HN 0.173 8.383 8.210 -0.000 0.000 0.580 387 P HA 0.150 4.570 4.420 -0.000 0.000 0.297 387 P C -0.204 177.173 177.300 0.127 0.000 1.303 387 P CA -0.080 63.036 63.100 0.025 0.000 0.753 387 P CB 0.557 32.286 31.700 0.047 0.000 1.281 388 D N -1.212 119.273 120.400 0.141 0.000 2.178 388 D HA -0.072 4.568 4.640 -0.000 0.000 0.201 388 D C -0.038 176.382 176.300 0.199 0.000 0.980 388 D CA 1.684 55.787 54.000 0.171 0.000 0.842 388 D CB -0.129 40.703 40.800 0.053 0.000 0.948 388 D HN 0.356 8.726 8.370 -0.000 0.000 0.472 389 D N -0.751 119.752 120.400 0.172 0.000 2.593 389 D HA 0.223 4.863 4.640 -0.000 0.000 0.251 389 D C -1.093 175.361 176.300 0.256 0.000 1.140 389 D CA -0.431 53.681 54.000 0.187 0.000 0.855 389 D CB 1.817 42.681 40.800 0.106 0.000 1.267 389 D HN -0.041 8.329 8.370 -0.000 0.000 0.532 390 Y N 0.587 120.969 120.300 0.137 0.000 2.504 390 Y HA 0.361 4.911 4.550 -0.000 0.000 0.344 390 Y C -1.092 174.941 175.900 0.222 0.000 1.023 390 Y CA -0.368 57.801 58.100 0.116 0.000 1.020 390 Y CB 2.227 40.669 38.460 -0.031 0.000 1.282 390 Y HN 0.095 8.375 8.280 -0.000 0.000 0.454 391 T N 5.682 119.953 114.554 -0.472 0.000 2.841 391 T HA 0.277 4.627 4.350 -0.000 0.000 0.285 391 T C -2.059 172.351 174.700 -0.483 0.000 0.991 391 T CA -0.425 61.502 62.100 -0.287 0.000 0.966 391 T CB 0.496 69.256 68.868 -0.180 0.000 0.962 391 T HN 0.448 8.688 8.240 -0.000 0.000 0.438 392 Y N 3.501 123.663 120.300 -0.230 0.000 2.328 392 Y HA 0.436 4.986 4.550 -0.000 0.000 0.336 392 Y C -0.134 175.746 175.900 -0.033 0.000 0.960 392 Y CA -1.102 56.944 58.100 -0.090 0.000 1.134 392 Y CB 0.703 39.281 38.460 0.197 0.000 1.166 392 Y HN 0.608 8.888 8.280 -0.000 0.000 0.464 393 N N 6.695 125.066 118.700 -0.547 0.000 2.442 393 N HA 0.263 5.003 4.740 -0.000 0.000 0.265 393 N C -0.908 174.193 175.510 -0.682 0.000 1.138 393 N CA -0.124 52.652 53.050 -0.457 0.000 0.956 393 N CB 0.743 39.050 38.487 -0.300 0.000 1.067 393 N HN 0.548 8.928 8.380 -0.000 0.000 0.474 394 I N 4.654 125.033 120.570 -0.318 0.000 2.452 394 I HA 0.134 4.304 4.170 -0.000 0.000 0.287 394 I C -1.550 174.506 176.117 -0.102 0.000 1.079 394 I CA -1.676 59.541 61.300 -0.138 0.000 1.387 394 I CB 0.281 38.297 38.000 0.026 0.000 1.404 394 I HN 0.345 8.555 8.210 -0.000 0.000 0.522 395 P HA 0.052 4.472 4.420 -0.000 0.000 0.273 395 P C 0.777 178.078 177.300 0.002 0.000 1.250 395 P CA -0.283 62.801 63.100 -0.026 0.000 0.793 395 P CB 0.370 32.081 31.700 0.019 0.000 1.011 396 T N -3.545 111.009 114.554 0.001 0.000 3.007 396 T HA -0.115 4.235 4.350 -0.000 0.000 0.270 396 T C 1.613 176.323 174.700 0.016 0.000 1.107 396 T CA 1.262 63.365 62.100 0.005 0.000 1.118 396 T CB -1.205 67.665 68.868 0.002 0.000 0.889 396 T HN 0.469 8.709 8.240 -0.000 0.000 0.506 397 S N 1.390 117.106 115.700 0.027 0.000 2.442 397 S HA -0.030 4.440 4.470 -0.000 0.000 0.236 397 S C 1.799 176.418 174.600 0.031 0.000 1.007 397 S CA 0.486 58.705 58.200 0.032 0.000 0.965 397 S CB -0.812 62.415 63.200 0.044 0.000 0.773 397 S HN 0.393 8.703 8.310 -0.000 0.000 0.504 398 I N 2.335 122.926 120.570 0.034 0.000 2.530 398 I HA -0.167 4.003 4.170 -0.000 0.000 0.257 398 I C 2.393 178.521 176.117 0.019 0.000 1.179 398 I CA 1.189 62.507 61.300 0.030 0.000 1.440 398 I CB -0.490 37.533 38.000 0.038 0.000 1.087 398 I HN 0.333 8.543 8.210 -0.000 0.000 0.440 399 Q N -0.215 119.595 119.800 0.016 0.000 2.226 399 Q HA -0.146 4.194 4.340 -0.000 0.000 0.204 399 Q C 1.458 177.466 176.000 0.012 0.000 0.975 399 Q CA 1.329 57.140 55.803 0.012 0.000 0.866 399 Q CB -0.128 28.616 28.738 0.010 0.000 0.915 399 Q HN 0.610 8.880 8.270 -0.000 0.000 0.440 400 N N 0.363 119.071 118.700 0.014 0.000 2.414 400 N HA 0.028 4.768 4.740 -0.000 0.000 0.177 400 N C -0.284 175.233 175.510 0.012 0.000 1.062 400 N CA 0.559 53.617 53.050 0.013 0.000 0.890 400 N CB 0.513 39.009 38.487 0.016 0.000 1.070 400 N HN 0.345 8.725 8.380 -0.000 0.000 0.454 401 N N -1.095 117.612 118.700 0.010 0.000 3.127 401 N HA 0.420 5.160 4.740 -0.000 0.000 0.239 401 N C -1.414 174.091 175.510 -0.008 0.000 1.407 401 N CA -0.812 52.240 53.050 0.003 0.000 0.891 401 N CB 0.889 39.380 38.487 0.007 0.000 1.447 401 N HN -0.044 8.336 8.380 -0.000 0.000 0.507 402 A N -0.386 122.415 122.820 -0.032 0.000 2.429 402 A HA 0.549 4.869 4.320 -0.000 0.000 0.242 402 A C 0.599 178.115 177.584 -0.113 0.000 1.088 402 A CA 0.181 52.175 52.037 -0.072 0.000 0.784 402 A CB -0.607 18.328 19.000 -0.107 0.000 1.038 402 A HN 1.437 9.587 8.150 -0.000 0.000 0.501 403 C N -1.064 118.151 119.300 -0.143 0.000 3.171 403 C HA 0.881 5.341 4.460 -0.000 0.000 0.308 403 C C -1.130 173.733 174.990 -0.211 0.000 1.334 403 C CA -1.253 57.692 59.018 -0.123 0.000 1.473 403 C CB 0.188 27.956 27.740 0.047 0.000 1.866 403 C HN 0.749 8.979 8.230 -0.000 0.000 0.465 404 Y N 0.489 120.870 120.300 0.136 0.000 2.420 404 Y HA 0.644 5.194 4.550 -0.000 0.000 0.334 404 Y C 0.341 176.382 175.900 0.234 0.000 1.094 404 Y CA -0.781 57.440 58.100 0.201 0.000 1.126 404 Y CB 1.681 40.231 38.460 0.150 0.000 1.217 404 Y HN 0.740 9.020 8.280 -0.000 0.000 0.462 405 V N 5.432 125.604 119.914 0.430 0.000 2.350 405 V HA 0.499 4.619 4.120 -0.000 0.000 0.285 405 V C -1.335 174.983 176.094 0.374 0.000 1.014 405 V CA -0.874 61.592 62.300 0.277 0.000 0.831 405 V CB 0.859 32.703 31.823 0.035 0.000 1.000 405 V HN 0.670 8.860 8.190 -0.000 0.000 0.433 406 L N 9.180 130.549 121.223 0.243 0.000 2.319 406 L HA 0.769 5.109 4.340 -0.000 0.000 0.280 406 L C -0.542 176.372 176.870 0.073 0.000 1.099 406 L CA 0.332 55.172 54.840 0.001 0.000 0.828 406 L CB 0.613 42.600 42.059 -0.120 0.000 1.150 406 L HN 0.770 9.000 8.230 -0.000 0.000 0.442 407 F N 3.239 123.087 119.950 -0.170 0.000 2.745 407 F HA 0.792 5.319 4.527 -0.000 0.000 0.316 407 F C -1.387 174.329 175.800 -0.140 0.000 1.155 407 F CA -1.116 56.771 58.000 -0.189 0.000 0.937 407 F CB 1.235 40.081 39.000 -0.257 0.000 1.361 407 F HN 0.538 8.838 8.300 -0.000 0.000 0.472 408 K N 0.805 121.117 120.400 -0.146 0.000 2.509 408 K HA 0.766 5.086 4.320 -0.000 0.000 0.266 408 K C -1.575 174.999 176.600 -0.045 0.000 0.987 408 K CA -0.961 55.216 56.287 -0.183 0.000 0.868 408 K CB 2.457 34.867 32.500 -0.150 0.000 1.421 408 K HN 0.996 9.246 8.250 -0.000 0.000 0.444 409 V N -0.436 119.435 119.914 -0.071 0.000 2.617 409 V HA 0.263 4.383 4.120 -0.000 0.000 0.298 409 V C 0.748 176.812 176.094 -0.051 0.000 1.048 409 V CA -0.560 61.668 62.300 -0.120 0.000 0.964 409 V CB 1.311 32.990 31.823 -0.241 0.000 1.004 409 V HN 1.027 9.217 8.190 -0.000 0.000 0.466 410 N N 2.735 121.412 118.700 -0.039 0.000 2.216 410 N HA -0.042 4.698 4.740 -0.000 0.000 0.183 410 N C 0.559 176.089 175.510 0.033 0.000 1.017 410 N CA 1.509 54.554 53.050 -0.008 0.000 0.861 410 N CB 0.069 38.550 38.487 -0.011 0.000 0.986 410 N HN 0.913 9.293 8.380 -0.000 0.000 0.428 411 T N 0.017 114.619 114.554 0.080 0.000 2.841 411 T HA 0.245 4.595 4.350 -0.000 0.000 0.285 411 T C -0.847 173.936 174.700 0.138 0.000 0.991 411 T CA -0.644 61.513 62.100 0.096 0.000 0.966 411 T CB 1.579 70.498 68.868 0.086 0.000 0.962 411 T HN -0.086 8.154 8.240 -0.000 0.000 0.438 412 T N 3.267 117.873 114.554 0.087 0.000 2.871 412 T HA 0.509 4.859 4.350 -0.000 0.000 0.296 412 T C 0.698 175.403 174.700 0.008 0.000 0.998 412 T CA 0.333 62.457 62.100 0.040 0.000 1.162 412 T CB 0.162 69.058 68.868 0.048 0.000 0.947 412 T HN 0.955 9.195 8.240 -0.000 0.000 0.536 413 G N 1.531 110.328 108.800 -0.004 0.000 2.342 413 G HA2 0.443 4.403 3.960 -0.000 0.000 0.297 413 G HA3 0.443 4.403 3.960 -0.000 0.000 0.297 413 G C -1.443 173.420 174.900 -0.062 0.000 1.313 413 G CA -0.797 44.253 45.100 -0.084 0.000 0.830 413 G HN 0.645 8.935 8.290 -0.000 0.000 0.506 414 V N 0.295 120.104 119.914 -0.176 0.000 2.567 414 V HA 0.622 4.742 4.120 -0.000 0.000 0.289 414 V C -0.827 175.132 176.094 -0.226 0.000 1.049 414 V CA -0.131 62.105 62.300 -0.107 0.000 0.969 414 V CB 0.813 32.567 31.823 -0.114 0.000 0.995 414 V HN 0.581 8.771 8.190 -0.000 0.000 0.471 415 Y N 2.298 122.563 120.300 -0.057 0.000 2.477 415 Y HA 0.460 5.010 4.550 -0.000 0.000 0.347 415 Y C 0.089 175.971 175.900 -0.030 0.000 0.981 415 Y CA -0.885 57.204 58.100 -0.018 0.000 1.033 415 Y CB 2.028 40.513 38.460 0.041 0.000 1.245 415 Y HN 0.454 8.734 8.280 -0.000 0.000 0.455 416 K N 4.113 124.562 120.400 0.081 0.000 2.234 416 K HA 0.489 4.809 4.320 -0.000 0.000 0.277 416 K C -1.463 175.126 176.600 -0.019 0.000 1.038 416 K CA -0.395 55.887 56.287 -0.008 0.000 0.888 416 K CB 0.398 32.795 32.500 -0.172 0.000 1.091 416 K HN 0.509 8.759 8.250 -0.000 0.000 0.467 417 I N 3.267 123.809 120.570 -0.048 0.000 2.406 417 I HA 0.371 4.541 4.170 -0.000 0.000 0.290 417 I C 0.064 176.099 176.117 -0.136 0.000 0.999 417 I CA -0.542 60.628 61.300 -0.216 0.000 1.124 417 I CB 1.124 38.961 38.000 -0.272 0.000 1.289 417 I HN 0.671 8.881 8.210 -0.000 0.000 0.441 418 T N 3.417 117.857 114.554 -0.189 0.000 2.840 418 T HA 0.507 4.857 4.350 -0.000 0.000 0.317 418 T C -0.297 174.340 174.700 -0.105 0.000 1.401 418 T CA -0.338 61.712 62.100 -0.084 0.000 1.028 418 T CB 1.468 70.326 68.868 -0.018 0.000 1.317 418 T HN 0.811 9.051 8.240 -0.000 0.000 0.495 419 T N 1.023 115.546 114.554 -0.052 0.000 2.816 419 T HA 0.580 4.930 4.350 -0.000 0.000 0.282 419 T C 0.173 174.856 174.700 -0.030 0.000 0.993 419 T CA -0.742 61.336 62.100 -0.037 0.000 0.994 419 T CB 0.541 69.402 68.868 -0.011 0.000 1.025 419 T HN 0.580 8.820 8.240 -0.000 0.000 0.529 420 K N 1.588 121.973 120.400 -0.025 0.000 2.416 420 K HA 0.108 4.428 4.320 -0.000 0.000 0.283 420 K C 0.481 177.075 176.600 -0.010 0.000 1.037 420 K CA 0.346 56.620 56.287 -0.022 0.000 0.995 420 K CB -0.514 31.973 32.500 -0.022 0.000 0.938 420 K HN 0.703 8.953 8.250 -0.000 0.000 0.475 421 N N 3.536 122.232 118.700 -0.007 0.000 2.828 421 N HA -0.264 4.476 4.740 -0.000 0.000 0.248 421 N C -0.919 174.599 175.510 0.015 0.000 1.044 421 N CA 1.081 54.134 53.050 0.004 0.000 0.851 421 N CB -1.455 37.035 38.487 0.006 0.000 1.136 421 N HN 0.855 9.235 8.380 -0.000 0.000 0.572 422 N N -1.245 117.465 118.700 0.016 0.000 2.753 422 N HA -0.214 4.525 4.740 -0.000 0.000 0.251 422 N C -0.596 174.928 175.510 0.023 0.000 1.097 422 N CA 1.306 54.375 53.050 0.032 0.000 0.786 422 N CB -1.156 37.367 38.487 0.060 0.000 1.137 422 N HN 0.557 8.937 8.380 -0.000 0.000 0.566 423 L N 0.345 121.578 121.223 0.017 0.000 2.422 423 L HA 0.542 4.882 4.340 -0.000 0.000 0.264 423 L C -2.087 174.792 176.870 0.015 0.000 0.984 423 L CA -1.516 53.334 54.840 0.018 0.000 0.819 423 L CB 2.876 44.948 42.059 0.022 0.000 1.330 423 L HN -0.215 8.015 8.230 -0.000 0.000 0.410 424 P HA 0.305 4.725 4.420 -0.000 0.000 0.277 424 P C -2.802 174.510 177.300 0.020 0.000 1.271 424 P CA -1.661 61.453 63.100 0.023 0.000 0.795 424 P CB -0.090 31.625 31.700 0.026 0.000 1.101 425 P HA 0.201 4.621 4.420 -0.000 0.000 0.272 425 P C -0.532 176.785 177.300 0.028 0.000 1.230 425 P CA 0.243 63.354 63.100 0.018 0.000 0.788 425 P CB 0.627 32.339 31.700 0.021 0.000 0.949 426 L N 1.359 122.597 121.223 0.024 0.000 2.319 426 L HA 0.576 4.916 4.340 -0.000 0.000 0.267 426 L C 0.415 177.321 176.870 0.060 0.000 1.011 426 L CA -1.109 53.757 54.840 0.043 0.000 0.818 426 L CB 1.472 43.542 42.059 0.019 0.000 1.316 426 L HN 0.233 8.463 8.230 -0.000 0.000 0.432 427 I N 2.286 122.911 120.570 0.093 0.000 2.530 427 I HA 0.492 4.662 4.170 -0.000 0.000 0.297 427 I C -0.802 175.339 176.117 0.041 0.000 1.011 427 I CA -0.522 60.815 61.300 0.061 0.000 1.107 427 I CB 2.611 40.654 38.000 0.072 0.000 1.285 427 I HN 0.448 8.658 8.210 -0.000 0.000 0.436 428 I N 5.572 126.103 120.570 -0.064 0.000 2.545 428 I HA 0.484 4.654 4.170 -0.000 0.000 0.292 428 I C -1.468 174.613 176.117 -0.060 0.000 1.040 428 I CA -0.354 60.983 61.300 0.062 0.000 1.068 428 I CB 1.580 39.657 38.000 0.130 0.000 1.251 428 I HN 0.459 8.669 8.210 -0.000 0.000 0.424 429 Y N 4.401 124.908 120.300 0.346 0.000 2.630 429 Y HA 0.518 5.068 4.550 -0.000 0.000 0.337 429 Y C -0.341 175.743 175.900 0.307 0.000 1.051 429 Y CA -0.837 57.452 58.100 0.315 0.000 1.121 429 Y CB 1.251 39.898 38.460 0.312 0.000 1.299 429 Y HN 0.423 8.703 8.280 -0.000 0.000 0.498 430 E N 1.047 121.465 120.200 0.363 0.000 2.183 430 E HA 0.672 5.022 4.350 -0.000 0.000 0.271 430 E C -1.204 175.420 176.600 0.041 0.000 0.919 430 E CA -1.022 55.412 56.400 0.056 0.000 0.781 430 E CB 1.481 31.171 29.700 -0.017 0.000 1.140 430 E HN 0.783 9.143 8.360 -0.000 0.000 0.402 431 A N 5.384 128.142 122.820 -0.103 0.000 2.454 431 A HA 0.251 4.571 4.320 -0.000 0.000 0.260 431 A C 0.094 177.622 177.584 -0.094 0.000 1.106 431 A CA -0.196 51.814 52.037 -0.044 0.000 0.780 431 A CB -0.148 18.776 19.000 -0.127 0.000 1.044 431 A HN 0.637 8.787 8.150 -0.000 0.000 0.498 432 I N 2.464 122.999 120.570 -0.057 0.000 2.396 432 I HA 0.384 4.554 4.170 -0.000 0.000 0.289 432 I C 1.383 177.454 176.117 -0.076 0.000 1.056 432 I CA 1.041 62.302 61.300 -0.065 0.000 1.365 432 I CB 0.688 38.654 38.000 -0.057 0.000 1.407 432 I HN 0.994 9.204 8.210 -0.000 0.000 0.509 433 G N 3.945 112.698 108.800 -0.080 0.000 2.141 433 G HA2 -0.313 3.647 3.960 -0.000 0.000 0.242 433 G HA3 -0.313 3.647 3.960 -0.000 0.000 0.242 433 G C 0.943 175.792 174.900 -0.086 0.000 0.982 433 G CA 0.514 45.570 45.100 -0.073 0.000 0.662 433 G HN 0.717 9.007 8.290 -0.000 0.000 0.527 434 S N -0.640 114.991 115.700 -0.114 0.000 2.428 434 S HA 0.294 4.764 4.470 -0.000 0.000 0.230 434 S C 1.484 176.016 174.600 -0.114 0.000 1.014 434 S CA 1.214 59.339 58.200 -0.126 0.000 0.957 434 S CB 0.082 63.174 63.200 -0.179 0.000 0.784 434 S HN 0.783 9.093 8.310 -0.000 0.000 0.499 435 S N 2.327 117.960 115.700 -0.113 0.000 2.580 435 S HA 0.238 4.708 4.470 -0.000 0.000 0.266 435 S C 0.751 175.308 174.600 -0.070 0.000 1.354 435 S CA -0.205 57.940 58.200 -0.092 0.000 1.008 435 S CB -0.230 62.913 63.200 -0.093 0.000 0.898 435 S HN 0.778 9.088 8.310 -0.000 0.000 0.555 436 N N 0.251 118.916 118.700 -0.058 0.000 1.220 436 N HA -0.254 4.486 4.740 -0.000 0.000 0.114 436 N C -0.166 175.315 175.510 -0.048 0.000 0.835 436 N CA 0.894 53.916 53.050 -0.047 0.000 0.863 436 N CB -0.466 37.996 38.487 -0.042 0.000 0.992 436 N HN 0.764 9.144 8.380 -0.000 0.000 0.632 437 R N -0.206 120.268 120.500 -0.043 0.000 3.868 437 R HA -0.204 4.136 4.340 -0.000 0.000 0.476 437 R C -0.290 175.986 176.300 -0.041 0.000 0.241 437 R CA 1.187 57.261 56.100 -0.043 0.000 1.496 437 R CB -1.247 29.022 30.300 -0.051 0.000 1.052 437 R HN 0.916 9.186 8.270 -0.000 0.000 0.541 441 S N 0.845 116.533 115.700 -0.020 0.000 2.414 441 S HA -0.098 4.372 4.470 -0.000 0.000 0.225 441 S C 0.601 175.187 174.600 -0.023 0.000 1.041 441 S CA 1.199 59.388 58.200 -0.019 0.000 1.114 441 S CB -0.263 62.928 63.200 -0.014 0.000 1.064 441 S HN 0.584 8.894 8.310 -0.000 0.000 0.420 442 N N 2.279 120.965 118.700 -0.023 0.000 2.908 442 N HA 0.352 5.092 4.740 -0.000 0.000 0.316 442 N C -1.109 174.381 175.510 -0.033 0.000 1.619 442 N CA -0.005 53.027 53.050 -0.029 0.000 1.045 442 N CB 0.280 38.753 38.487 -0.023 0.000 1.357 442 N HN 0.283 8.663 8.380 -0.000 0.000 0.501 443 N N 0.572 119.249 118.700 -0.038 0.000 2.554 443 N HA 0.169 4.909 4.740 -0.000 0.000 0.271 443 N C -1.471 174.009 175.510 -0.050 0.000 1.081 443 N CA -0.531 52.495 53.050 -0.040 0.000 0.994 443 N CB 1.418 39.888 38.487 -0.028 0.000 1.641 443 N HN 0.131 8.511 8.380 -0.000 0.000 0.511 444 L N 2.462 123.650 121.223 -0.060 0.000 2.410 444 L HA 0.430 4.770 4.340 -0.000 0.000 0.273 444 L C -0.394 176.436 176.870 -0.067 0.000 1.144 444 L CA 0.117 54.912 54.840 -0.076 0.000 0.863 444 L CB 0.424 42.429 42.059 -0.089 0.000 1.140 444 L HN 0.558 8.788 8.230 -0.000 0.000 0.463 445 S N 4.524 120.180 115.700 -0.074 0.000 2.399 445 S HA 0.207 4.677 4.470 -0.000 0.000 0.301 445 S C -0.140 174.415 174.600 -0.075 0.000 1.093 445 S CA -0.562 57.599 58.200 -0.064 0.000 1.077 445 S CB 0.176 63.341 63.200 -0.060 0.000 0.980 445 S HN 0.610 8.920 8.310 -0.000 0.000 0.494 446 N N 2.419 121.084 118.700 -0.059 0.000 2.422 446 N HA 0.183 4.923 4.740 -0.000 0.000 0.264 446 N C -0.649 174.834 175.510 -0.044 0.000 1.063 446 N CA -0.447 52.571 53.050 -0.055 0.000 0.959 446 N CB 1.000 39.468 38.487 -0.032 0.000 1.087 446 N HN 0.436 8.816 8.380 -0.000 0.000 0.483 447 D N 1.323 121.693 120.400 -0.050 0.000 2.424 447 D HA 0.167 4.807 4.640 -0.000 0.000 0.220 447 D C -0.399 175.879 176.300 -0.036 0.000 1.150 447 D CA -0.296 53.678 54.000 -0.044 0.000 0.831 447 D CB -0.153 40.616 40.800 -0.052 0.000 0.981 447 D HN 0.415 8.785 8.370 -0.000 0.000 0.500 448 N N 0.810 119.496 118.700 -0.024 0.000 2.727 448 N HA -0.197 4.543 4.740 -0.000 0.000 0.249 448 N C -0.673 174.819 175.510 -0.030 0.000 1.048 448 N CA 0.480 53.520 53.050 -0.017 0.000 0.714 448 N CB -1.256 37.214 38.487 -0.027 0.000 0.959 448 N HN 0.459 8.839 8.380 -0.000 0.000 0.544 449 I N 0.815 121.374 120.570 -0.018 0.000 2.436 449 I HA -0.024 4.146 4.170 -0.000 0.000 0.289 449 I C 1.548 177.649 176.117 -0.028 0.000 1.083 449 I CA 0.318 61.597 61.300 -0.035 0.000 1.372 449 I CB 0.597 38.573 38.000 -0.039 0.000 1.408 449 I HN -0.022 8.188 8.210 -0.000 0.000 0.516 450 K N 5.174 125.500 120.400 -0.124 0.000 2.358 450 K HA 0.274 4.594 4.320 -0.000 0.000 0.200 450 K C 0.409 176.838 176.600 -0.285 0.000 1.030 450 K CA -0.111 56.031 56.287 -0.242 0.000 1.097 450 K CB 0.871 33.223 32.500 -0.247 0.000 0.862 450 K HN 0.638 8.888 8.250 -0.000 0.000 0.534 451 A N 2.628 125.321 122.820 -0.212 0.000 2.362 451 A HA 0.447 4.767 4.320 -0.000 0.000 0.276 451 A C 0.138 177.628 177.584 -0.157 0.000 1.153 451 A CA -0.440 51.464 52.037 -0.221 0.000 0.813 451 A CB -0.360 18.509 19.000 -0.219 0.000 1.081 451 A HN 0.384 8.534 8.150 -0.000 0.000 0.507 452 I N -0.477 119.994 120.570 -0.164 0.000 2.582 452 I HA 0.596 4.765 4.170 -0.000 0.000 0.292 452 I C -0.531 175.654 176.117 0.114 0.000 1.066 452 I CA -0.942 60.325 61.300 -0.055 0.000 1.053 452 I CB 2.198 40.030 38.000 -0.279 0.000 1.241 452 I HN 0.527 8.737 8.210 -0.000 0.000 0.421 453 K N 5.060 125.597 120.400 0.228 0.000 2.293 453 K HA 0.279 4.599 4.320 -0.000 0.000 0.267 453 K C -1.152 175.731 176.600 0.471 0.000 1.010 453 K CA -0.701 55.776 56.287 0.317 0.000 0.875 453 K CB 1.016 33.632 32.500 0.192 0.000 1.106 453 K HN 0.681 8.931 8.250 -0.000 0.000 0.450 454 Y N 6.382 126.969 120.300 0.478 0.000 2.717 454 Y HA -0.086 4.464 4.550 -0.000 0.000 0.330 454 Y C 0.506 176.510 175.900 0.173 0.000 1.217 454 Y CA 0.280 58.584 58.100 0.340 0.000 1.506 454 Y CB 0.436 39.158 38.460 0.436 0.000 1.268 454 Y HN 0.560 8.840 8.280 -0.000 0.000 0.561 455 I N 3.179 123.445 120.570 -0.507 0.000 2.962 455 I HA 0.115 4.285 4.170 -0.000 0.000 0.246 455 I C 0.919 176.515 176.117 -0.868 0.000 1.091 455 I CA 0.850 61.867 61.300 -0.471 0.000 1.469 455 I CB -0.702 37.216 38.000 -0.138 0.000 1.324 455 I HN 0.639 8.849 8.210 -0.000 0.000 0.461 456 T N -1.172 112.887 114.554 -0.825 0.000 2.749 456 T HA 0.577 4.927 4.350 -0.000 0.000 0.310 456 T C -0.991 173.631 174.700 -0.130 0.000 1.496 456 T CA 0.213 61.992 62.100 -0.536 0.000 1.006 456 T CB 1.565 70.296 68.868 -0.228 0.000 1.457 456 T HN 0.815 9.055 8.240 -0.000 0.000 0.497 457 G N 0.452 109.301 108.800 0.082 0.000 2.392 457 G HA2 0.418 4.378 3.960 -0.000 0.000 0.677 457 G HA3 0.418 4.378 3.960 -0.000 0.000 0.677 457 G C -1.636 173.377 174.900 0.188 0.000 1.334 457 G CA -0.240 44.931 45.100 0.119 0.000 0.961 457 G HN 1.601 9.891 8.290 -0.000 0.000 0.616 458 L N -2.931 118.355 121.223 0.105 0.000 2.630 458 L HA 0.780 5.120 4.340 -0.000 0.000 0.258 458 L C 0.264 177.183 176.870 0.081 0.000 1.072 458 L CA -1.128 53.764 54.840 0.085 0.000 0.885 458 L CB 1.303 43.390 42.059 0.047 0.000 1.502 458 L HN 0.509 8.739 8.230 -0.000 0.000 0.406 459 N N -0.927 117.825 118.700 0.086 0.000 2.415 459 N HA 0.154 4.894 4.740 -0.000 0.000 0.174 459 N C 0.168 175.718 175.510 0.067 0.000 1.048 459 N CA -0.356 52.742 53.050 0.081 0.000 0.895 459 N CB 0.236 38.776 38.487 0.089 0.000 1.036 459 N HN 0.433 8.813 8.380 -0.000 0.000 0.449 460 R N 1.812 122.355 120.500 0.071 0.000 2.501 460 R HA -0.074 4.266 4.340 -0.000 0.000 0.319 460 R C 0.910 177.245 176.300 0.059 0.000 0.913 460 R CA 0.256 56.398 56.100 0.069 0.000 1.104 460 R CB 0.263 30.611 30.300 0.079 0.000 0.901 460 R HN 0.296 8.566 8.270 -0.000 0.000 0.407 461 S N 2.172 117.904 115.700 0.053 0.000 2.423 461 S HA -0.153 4.317 4.470 -0.000 0.000 0.231 461 S C 1.036 175.665 174.600 0.048 0.000 1.014 461 S CA 1.110 59.338 58.200 0.046 0.000 0.965 461 S CB 0.023 63.247 63.200 0.039 0.000 0.785 461 S HN 0.841 9.151 8.310 -0.000 0.000 0.495 462 D N 1.634 122.070 120.400 0.059 0.000 2.328 462 D HA 0.260 4.900 4.640 -0.000 0.000 0.221 462 D C 0.505 176.851 176.300 0.076 0.000 1.072 462 D CA 0.185 54.225 54.000 0.068 0.000 0.850 462 D CB -0.246 40.600 40.800 0.078 0.000 0.922 462 D HN 0.459 8.829 8.370 -0.000 0.000 0.516 463 A N 1.599 124.458 122.820 0.066 0.000 2.990 463 A HA 0.201 4.520 4.320 -0.000 0.000 0.282 463 A C 0.615 178.212 177.584 0.022 0.000 1.688 463 A CA -0.724 51.346 52.037 0.055 0.000 1.391 463 A CB -0.652 18.375 19.000 0.045 0.000 1.112 463 A HN 0.316 8.466 8.150 -0.000 0.000 0.588 464 K N 1.366 121.782 120.400 0.027 0.000 2.416 464 K HA 0.403 4.723 4.320 -0.000 0.000 0.283 464 K C -0.209 176.372 176.600 -0.031 0.000 1.037 464 K CA 0.616 56.910 56.287 0.011 0.000 0.995 464 K CB 0.298 32.815 32.500 0.027 0.000 0.938 464 K HN 0.645 8.895 8.250 -0.000 0.000 0.475 465 S N 2.088 117.765 115.700 -0.037 0.000 2.636 465 S HA 0.513 4.983 4.470 -0.000 0.000 0.266 465 S C -1.416 173.163 174.600 -0.035 0.000 1.147 465 S CA -1.036 57.086 58.200 -0.129 0.000 0.815 465 S CB 0.452 63.552 63.200 -0.167 0.000 1.119 465 S HN 0.809 9.119 8.310 -0.000 0.000 0.470 466 Y N -0.969 119.273 120.300 -0.098 0.000 2.615 466 Y HA 0.849 5.399 4.550 -0.000 0.000 0.341 466 Y C -1.571 174.264 175.900 -0.109 0.000 1.089 466 Y CA -1.649 56.387 58.100 -0.106 0.000 1.049 466 Y CB 0.766 39.154 38.460 -0.120 0.000 1.296 466 Y HN 0.728 9.008 8.280 -0.000 0.000 0.470 467 L N 3.202 124.495 121.223 0.118 0.000 2.325 467 L HA 0.526 4.866 4.340 -0.000 0.000 0.278 467 L C -0.873 176.062 176.870 0.107 0.000 1.023 467 L CA -1.001 53.859 54.840 0.033 0.000 0.811 467 L CB 1.679 43.736 42.059 -0.002 0.000 1.249 467 L HN 0.538 8.768 8.230 -0.000 0.000 0.431 468 I N 4.353 124.953 120.570 0.049 0.000 2.390 468 I HA 0.363 4.533 4.170 -0.000 0.000 0.283 468 I C -0.252 175.877 176.117 0.019 0.000 1.016 468 I CA -0.422 60.905 61.300 0.045 0.000 1.151 468 I CB 1.633 39.647 38.000 0.023 0.000 1.293 468 I HN 0.275 8.485 8.210 -0.000 0.000 0.458 469 V N 2.690 122.622 119.914 0.031 0.000 2.789 469 V HA 0.591 4.711 4.120 -0.000 0.000 0.311 469 V C 0.007 176.107 176.094 0.009 0.000 1.073 469 V CA -0.746 61.561 62.300 0.012 0.000 0.921 469 V CB 1.911 33.725 31.823 -0.014 0.000 1.009 469 V HN 0.661 8.851 8.190 -0.000 0.000 0.426 470 S N 4.611 120.301 115.700 -0.015 0.000 2.416 470 S HA 0.657 5.127 4.470 -0.000 0.000 0.287 470 S C -0.485 174.007 174.600 -0.181 0.000 1.139 470 S CA -0.457 57.683 58.200 -0.101 0.000 1.058 470 S CB -0.710 62.455 63.200 -0.058 0.000 0.967 470 S HN 0.641 8.951 8.310 -0.000 0.000 0.495 471 L N 5.004 126.072 121.223 -0.258 0.000 2.334 471 L HA 0.650 4.990 4.340 -0.000 0.000 0.276 471 L C -0.945 175.743 176.870 -0.304 0.000 1.014 471 L CA -0.834 53.830 54.840 -0.293 0.000 0.815 471 L CB 1.432 43.217 42.059 -0.457 0.000 1.268 471 L HN 0.534 8.764 8.230 -0.000 0.000 0.428 472 F N 0.858 120.940 119.950 0.219 0.000 2.495 472 F HA 0.333 4.860 4.527 -0.000 0.000 0.327 472 F C 1.148 177.028 175.800 0.134 0.000 1.103 472 F CA -0.712 57.385 58.000 0.162 0.000 0.949 472 F CB 1.868 40.946 39.000 0.129 0.000 1.142 472 F HN 0.465 8.765 8.300 -0.000 0.000 0.457 473 K N 1.226 121.766 120.400 0.233 0.000 2.103 473 K HA -0.202 4.118 4.320 -0.000 0.000 0.207 473 K C 1.276 177.923 176.600 0.077 0.000 1.048 473 K CA 2.130 58.488 56.287 0.119 0.000 0.930 473 K CB -0.107 32.447 32.500 0.091 0.000 0.716 473 K HN 0.812 9.062 8.250 -0.000 0.000 0.444 474 D N 0.153 120.606 120.400 0.089 0.000 2.349 474 D HA -0.036 4.604 4.640 -0.000 0.000 0.224 474 D C -0.208 176.061 176.300 -0.052 0.000 1.029 474 D CA 0.373 54.379 54.000 0.009 0.000 0.879 474 D CB 0.135 40.935 40.800 0.001 0.000 0.906 474 D HN 0.136 8.506 8.370 -0.000 0.000 0.528 475 K N -0.134 120.230 120.400 -0.060 0.000 2.238 475 K HA 0.405 4.725 4.320 -0.000 0.000 0.239 475 K C -0.521 175.848 176.600 -0.385 0.000 0.987 475 K CA -0.914 55.217 56.287 -0.260 0.000 0.857 475 K CB 1.150 33.418 32.500 -0.385 0.000 1.154 475 K HN -0.144 8.106 8.250 -0.000 0.000 0.439 476 N N 0.951 119.323 118.700 -0.547 0.000 2.362 476 N HA 0.364 5.104 4.740 -0.000 0.000 0.298 476 N C -1.381 173.628 175.510 -0.835 0.000 1.048 476 N CA -0.378 52.325 53.050 -0.577 0.000 0.858 476 N CB 0.938 39.160 38.487 -0.443 0.000 1.218 476 N HN 0.377 8.757 8.380 -0.000 0.000 0.488 477 Y N 0.511 120.414 120.300 -0.661 0.000 2.562 477 Y HA 0.478 5.028 4.550 -0.000 0.000 0.343 477 Y C -0.727 174.877 175.900 -0.494 0.000 1.025 477 Y CA -0.750 57.023 58.100 -0.545 0.000 1.082 477 Y CB 1.445 39.487 38.460 -0.696 0.000 1.264 477 Y HN 0.369 8.649 8.280 -0.000 0.000 0.478 478 Y N 1.780 122.224 120.300 0.240 0.000 2.376 478 Y HA 0.564 5.114 4.550 -0.000 0.000 0.340 478 Y C -0.612 175.625 175.900 0.561 0.000 0.965 478 Y CA -0.975 57.339 58.100 0.357 0.000 1.078 478 Y CB 1.468 40.064 38.460 0.227 0.000 1.193 478 Y HN 0.357 8.637 8.280 -0.000 0.000 0.452 479 I N 4.124 125.124 120.570 0.717 0.000 2.354 479 I HA 0.395 4.565 4.170 -0.000 0.000 0.292 479 I C -0.148 176.278 176.117 0.515 0.000 0.989 479 I CA -0.773 60.855 61.300 0.546 0.000 1.188 479 I CB 1.299 39.528 38.000 0.381 0.000 1.342 479 I HN 0.457 8.667 8.210 -0.000 0.000 0.457 480 R N 7.560 128.351 120.500 0.485 0.000 2.202 480 R HA 0.507 4.847 4.340 -0.000 0.000 0.334 480 R C -1.003 175.373 176.300 0.127 0.000 1.036 480 R CA -0.472 55.782 56.100 0.258 0.000 0.878 480 R CB 0.568 31.049 30.300 0.302 0.000 1.067 480 R HN 0.590 8.860 8.270 -0.000 0.000 0.457 481 I N 8.056 128.663 120.570 0.062 0.000 2.304 481 I HA 0.293 4.463 4.170 -0.000 0.000 0.291 481 I C -1.752 174.370 176.117 0.008 0.000 1.018 481 I CA -2.407 58.925 61.300 0.053 0.000 1.260 481 I CB 1.568 39.617 38.000 0.083 0.000 1.390 481 I HN 0.455 8.665 8.210 -0.000 0.000 0.475 482 P HA -0.031 4.389 4.420 -0.000 0.000 0.273 482 P C -0.761 176.543 177.300 0.007 0.000 1.250 482 P CA -0.469 62.635 63.100 0.005 0.000 0.793 482 P CB 0.553 32.267 31.700 0.022 0.000 1.011 483 Q N 0.807 120.608 119.800 0.003 0.000 2.274 483 Q HA 0.192 4.532 4.340 -0.000 0.000 0.280 483 Q C -0.320 175.687 176.000 0.013 0.000 1.047 483 Q CA -0.003 55.805 55.803 0.007 0.000 0.907 483 Q CB -0.328 28.413 28.738 0.005 0.000 1.171 483 Q HN 0.420 8.690 8.270 -0.000 0.000 0.381 484 I N 1.674 122.252 120.570 0.015 0.000 2.418 484 I HA 0.336 4.506 4.170 -0.000 0.000 0.287 484 I C 0.281 176.405 176.117 0.012 0.000 1.008 484 I CA -0.317 60.992 61.300 0.014 0.000 1.104 484 I CB 2.036 40.045 38.000 0.015 0.000 1.264 484 I HN 0.602 8.812 8.210 -0.000 0.000 0.438 485 S N 2.718 118.424 115.700 0.011 0.000 2.593 485 S HA 0.075 4.545 4.470 -0.000 0.000 0.217 485 S C 0.937 175.541 174.600 0.007 0.000 0.966 485 S CA -0.027 58.179 58.200 0.009 0.000 0.914 485 S CB -0.382 62.824 63.200 0.009 0.000 0.776 485 S HN 0.750 9.060 8.310 -0.000 0.000 0.523 486 S N 1.901 117.605 115.700 0.007 0.000 2.576 486 S HA 0.230 4.700 4.470 -0.000 0.000 0.272 486 S C 1.306 175.907 174.600 0.003 0.000 1.352 486 S CA 0.090 58.292 58.200 0.005 0.000 1.021 486 S CB 0.654 63.857 63.200 0.004 0.000 0.887 486 S HN 0.611 8.921 8.310 -0.000 0.000 0.542 487 S N 1.341 117.041 115.700 0.001 0.000 2.535 487 S HA 0.118 4.588 4.470 -0.000 0.000 0.214 487 S C 0.688 175.285 174.600 -0.005 0.000 0.980 487 S CA 0.197 58.397 58.200 -0.001 0.000 0.907 487 S CB -0.503 62.696 63.200 -0.000 0.000 0.790 487 S HN 0.872 9.182 8.310 -0.000 0.000 0.510 488 T N 0.823 115.374 114.554 -0.005 0.000 2.875 488 T HA 0.476 4.826 4.350 -0.000 0.000 0.284 488 T C -0.144 174.548 174.700 -0.013 0.000 0.995 488 T CA -0.486 61.609 62.100 -0.009 0.000 1.060 488 T CB 1.098 69.961 68.868 -0.008 0.000 0.967 488 T HN 0.058 8.298 8.240 -0.000 0.000 0.476 489 T N 3.771 118.313 114.554 -0.021 0.000 2.888 489 T HA 0.320 4.670 4.350 -0.000 0.000 0.301 489 T C 0.418 175.100 174.700 -0.030 0.000 1.001 489 T CA -0.257 61.824 62.100 -0.031 0.000 1.147 489 T CB 0.404 69.245 68.868 -0.046 0.000 0.931 489 T HN 0.739 8.979 8.240 -0.000 0.000 0.541 490 S N 2.909 118.593 115.700 -0.027 0.000 2.654 490 S HA 0.467 4.937 4.470 -0.000 0.000 0.283 490 S C -0.127 174.453 174.600 -0.033 0.000 1.180 490 S CA -0.989 57.199 58.200 -0.020 0.000 1.021 490 S CB 1.252 64.450 63.200 -0.002 0.000 1.018 490 S HN 0.641 8.951 8.310 -0.000 0.000 0.532 491 Q N 0.435 120.220 119.800 -0.025 0.000 2.413 491 Q HA 0.553 4.893 4.340 -0.000 0.000 0.276 491 Q C -1.654 174.349 176.000 0.005 0.000 1.099 491 Q CA -0.874 54.914 55.803 -0.026 0.000 0.814 491 Q CB 2.178 30.887 28.738 -0.047 0.000 1.379 491 Q HN 0.382 8.652 8.270 -0.000 0.000 0.436 492 L N 2.825 124.086 121.223 0.064 0.000 2.280 492 L HA 0.422 4.762 4.340 -0.000 0.000 0.287 492 L C -1.412 175.430 176.870 -0.047 0.000 1.023 492 L CA -0.324 54.523 54.840 0.011 0.000 0.819 492 L CB 0.990 43.144 42.059 0.159 0.000 1.212 492 L HN 0.506 8.736 8.230 -0.000 0.000 0.420 493 I N 5.833 126.293 120.570 -0.183 0.000 2.330 493 I HA 0.298 4.468 4.170 -0.000 0.000 0.289 493 I C -0.522 175.452 176.117 -0.239 0.000 1.001 493 I CA -0.264 60.970 61.300 -0.110 0.000 1.193 493 I CB 0.797 38.749 38.000 -0.080 0.000 1.345 493 I HN 0.383 8.593 8.210 -0.000 0.000 0.461 494 F N 5.212 125.175 119.950 0.021 0.000 2.443 494 F HA 0.526 5.053 4.527 -0.000 0.000 0.335 494 F C 0.459 176.323 175.800 0.107 0.000 1.104 494 F CA -0.665 57.370 58.000 0.058 0.000 1.013 494 F CB 1.679 40.707 39.000 0.047 0.000 1.136 494 F HN 0.318 8.618 8.300 -0.000 0.000 0.470 495 K N 2.912 123.480 120.400 0.280 0.000 2.637 495 K HA 0.403 4.723 4.320 -0.000 0.000 0.248 495 K C -0.869 175.763 176.600 0.053 0.000 0.971 495 K CA -0.942 55.433 56.287 0.147 0.000 0.858 495 K CB 1.183 33.700 32.500 0.028 0.000 1.170 495 K HN 0.593 8.843 8.250 -0.000 0.000 0.443 496 R N 2.507 122.954 120.500 -0.089 0.000 2.522 496 R HA 0.045 4.385 4.340 -0.000 0.000 0.284 496 R C -0.747 175.369 176.300 -0.306 0.000 1.032 496 R CA 0.622 56.391 56.100 -0.551 0.000 1.049 496 R CB 0.604 30.621 30.300 -0.471 0.000 0.956 496 R HN 0.438 8.708 8.270 -0.000 0.000 0.422 497 E N 5.328 125.326 120.200 -0.336 0.000 2.155 497 E HA 0.217 4.567 4.350 -0.000 0.000 0.264 497 E C -0.553 175.947 176.600 -0.166 0.000 0.886 497 E CA -0.525 55.770 56.400 -0.174 0.000 0.752 497 E CB 1.307 30.928 29.700 -0.132 0.000 1.133 497 E HN 0.525 8.885 8.360 -0.000 0.000 0.414 498 L N 1.018 122.171 121.223 -0.117 0.000 2.439 498 L HA 0.692 5.031 4.340 -0.000 0.000 0.259 498 L C 1.052 177.879 176.870 -0.071 0.000 1.129 498 L CA -0.211 54.571 54.840 -0.097 0.000 0.803 498 L CB 0.784 42.792 42.059 -0.085 0.000 1.161 498 L HN 0.732 8.962 8.230 -0.000 0.000 0.462 499 G N 1.476 110.236 108.800 -0.067 0.000 2.728 499 G HA2 -0.263 3.697 3.960 -0.000 0.000 0.294 499 G HA3 -0.263 3.697 3.960 -0.000 0.000 0.294 499 G C 0.095 174.953 174.900 -0.069 0.000 1.342 499 G CA -0.011 45.054 45.100 -0.058 0.000 0.866 499 G HN 0.938 9.228 8.290 -0.000 0.000 0.534 500 N N -0.093 118.562 118.700 -0.074 0.000 2.501 500 N HA 0.051 4.791 4.740 -0.000 0.000 0.195 500 N C 1.865 177.277 175.510 -0.164 0.000 1.213 500 N CA 0.927 53.917 53.050 -0.100 0.000 0.864 500 N CB 0.011 38.447 38.487 -0.085 0.000 0.999 500 N HN 0.762 9.142 8.380 -0.000 0.000 0.454 501 I N 0.695 121.175 120.570 -0.150 0.000 2.916 501 I HA -0.217 3.953 4.170 -0.000 0.000 0.267 501 I C 1.454 177.471 176.117 -0.166 0.000 1.263 501 I CA 0.604 61.790 61.300 -0.190 0.000 1.471 501 I CB -0.131 37.782 38.000 -0.145 0.000 1.089 501 I HN 0.264 8.474 8.210 -0.000 0.000 0.468 502 S N -0.250 115.376 115.700 -0.124 0.000 2.440 502 S HA -0.215 4.255 4.470 -0.000 0.000 0.238 502 S C 1.528 176.081 174.600 -0.079 0.000 1.010 502 S CA 1.208 59.356 58.200 -0.086 0.000 0.972 502 S CB -0.475 62.687 63.200 -0.063 0.000 0.774 502 S HN 0.454 8.764 8.310 -0.000 0.000 0.501 503 D N 1.723 122.039 120.400 -0.139 0.000 2.190 503 D HA -0.065 4.575 4.640 -0.000 0.000 0.200 503 D C 1.434 177.608 176.300 -0.210 0.000 0.992 503 D CA 0.836 54.743 54.000 -0.155 0.000 0.854 503 D CB -0.318 40.320 40.800 -0.270 0.000 0.936 503 D HN 0.346 8.716 8.370 -0.000 0.000 0.462 504 L N 0.564 121.644 121.223 -0.237 0.000 2.554 504 L HA 0.173 4.513 4.340 -0.000 0.000 0.226 504 L C 0.872 177.735 176.870 -0.012 0.000 1.137 504 L CA -0.178 54.528 54.840 -0.224 0.000 0.863 504 L CB -1.162 40.773 42.059 -0.207 0.000 0.985 504 L HN -0.155 8.075 8.230 -0.000 0.000 0.451 505 A N 0.439 123.283 122.820 0.039 0.000 2.592 505 A HA 0.029 4.349 4.320 -0.000 0.000 0.250 505 A C 0.143 177.815 177.584 0.147 0.000 1.017 505 A CA 0.259 52.344 52.037 0.081 0.000 0.794 505 A CB -0.755 18.288 19.000 0.071 0.000 0.917 505 A HN 0.540 8.690 8.150 -0.000 0.000 0.515 506 D N -0.102 120.340 120.400 0.070 0.000 3.729 506 D HA -0.025 4.615 4.640 -0.000 0.000 0.242 506 D C -0.262 176.075 176.300 0.061 0.000 1.091 506 D CA 1.965 55.983 54.000 0.029 0.000 1.096 506 D CB -1.214 39.585 40.800 -0.002 0.000 0.901 506 D HN 0.984 9.354 8.370 -0.000 0.000 0.416 507 S N -0.138 115.568 115.700 0.009 0.000 2.542 507 S HA 0.569 5.039 4.470 -0.000 0.000 0.276 507 S C -0.704 173.833 174.600 -0.105 0.000 1.148 507 S CA -0.656 57.531 58.200 -0.023 0.000 0.886 507 S CB 1.440 64.636 63.200 -0.007 0.000 1.109 507 S HN 0.129 8.439 8.310 -0.000 0.000 0.458 508 T N 3.199 117.664 114.554 -0.149 0.000 2.832 508 T HA 0.426 4.776 4.350 -0.000 0.000 0.296 508 T C -0.308 174.175 174.700 -0.362 0.000 0.968 508 T CA -0.329 61.641 62.100 -0.216 0.000 1.107 508 T CB 0.879 69.644 68.868 -0.171 0.000 0.916 508 T HN 0.492 8.732 8.240 -0.000 0.000 0.517 509 V N 5.418 125.022 119.914 -0.516 0.000 2.304 509 V HA 0.234 4.354 4.120 -0.000 0.000 0.269 509 V C 0.376 176.087 176.094 -0.638 0.000 1.036 509 V CA -1.047 60.836 62.300 -0.696 0.000 0.840 509 V CB 0.325 31.475 31.823 -1.121 0.000 1.036 509 V HN 0.786 8.976 8.190 -0.000 0.000 0.466 510 N N 5.265 123.665 118.700 -0.499 0.000 2.411 510 N HA 0.271 5.011 4.740 -0.000 0.000 0.259 510 N C -0.417 174.962 175.510 -0.218 0.000 1.103 510 N CA -0.435 52.427 53.050 -0.313 0.000 0.954 510 N CB 1.625 39.961 38.487 -0.251 0.000 1.085 510 N HN 0.403 8.783 8.380 -0.000 0.000 0.485 511 I N 3.613 124.088 120.570 -0.158 0.000 2.452 511 I HA 0.140 4.310 4.170 -0.000 0.000 0.287 511 I C 0.692 176.759 176.117 -0.082 0.000 1.079 511 I CA -0.202 61.046 61.300 -0.086 0.000 1.387 511 I CB -0.004 37.982 38.000 -0.023 0.000 1.404 511 I HN 0.225 8.435 8.210 -0.000 0.000 0.522 512 L N 6.225 127.382 121.223 -0.110 0.000 2.276 512 L HA 0.379 4.719 4.340 -0.000 0.000 0.286 512 L C 0.208 177.083 176.870 0.008 0.000 1.061 512 L CA -0.336 54.388 54.840 -0.193 0.000 0.807 512 L CB 0.984 42.844 42.059 -0.332 0.000 1.177 512 L HN 0.505 8.735 8.230 -0.000 0.000 0.429 513 D N 1.827 122.307 120.400 0.134 0.000 2.392 513 D HA 0.168 4.808 4.640 -0.000 0.000 0.246 513 D C -0.087 176.321 176.300 0.180 0.000 1.013 513 D CA -0.262 53.824 54.000 0.143 0.000 0.993 513 D CB 1.341 42.220 40.800 0.132 0.000 1.219 513 D HN 0.608 8.978 8.370 -0.000 0.000 0.538 514 N N -0.071 118.700 118.700 0.118 0.000 2.669 514 N HA -0.223 4.517 4.740 -0.000 0.000 0.266 514 N C 0.150 175.710 175.510 0.083 0.000 1.024 514 N CA 0.598 53.707 53.050 0.100 0.000 0.766 514 N CB -1.969 36.577 38.487 0.099 0.000 0.898 514 N HN 0.459 8.839 8.380 -0.000 0.000 0.548 515 L N -4.998 116.234 121.223 0.015 0.000 2.910 515 L HA 0.469 4.809 4.340 -0.000 0.000 0.252 515 L C 1.411 178.262 176.870 -0.032 0.000 1.195 515 L CA -0.549 54.197 54.840 -0.156 0.000 1.003 515 L CB 0.041 42.012 42.059 -0.147 0.000 1.328 515 L HN 0.158 8.388 8.230 -0.000 0.000 0.540 516 N N 0.875 119.598 118.700 0.038 0.000 2.270 516 N HA -0.090 4.650 4.740 -0.000 0.000 0.181 516 N C 0.968 176.504 175.510 0.044 0.000 1.016 516 N CA 0.935 54.013 53.050 0.045 0.000 0.870 516 N CB 0.087 38.600 38.487 0.043 0.000 0.979 516 N HN 0.417 8.797 8.380 -0.000 0.000 0.431 517 T N -0.549 114.055 114.554 0.082 0.000 2.856 517 T HA 0.279 4.629 4.350 -0.000 0.000 0.306 517 T C 0.069 174.822 174.700 0.089 0.000 1.062 517 T CA -0.376 61.764 62.100 0.067 0.000 1.083 517 T CB 0.261 69.164 68.868 0.058 0.000 0.984 517 T HN 0.341 8.581 8.240 -0.000 0.000 0.542 518 S N 1.740 117.398 115.700 -0.070 0.000 2.638 518 S HA 0.846 5.316 4.470 -0.000 0.000 0.298 518 S C 0.602 174.947 174.600 -0.426 0.000 1.111 518 S CA 0.096 58.178 58.200 -0.197 0.000 1.027 518 S CB 1.225 64.290 63.200 -0.224 0.000 1.064 518 S HN 1.649 9.959 8.310 -0.000 0.000 0.525 519 G N 0.892 109.253 108.800 -0.733 0.000 2.513 519 G HA2 -0.132 3.827 3.960 -0.000 0.000 0.227 519 G HA3 -0.132 3.827 3.960 -0.000 0.000 0.227 519 G C -0.051 174.138 174.900 -1.184 0.000 1.176 519 G CA -0.301 44.106 45.100 -1.155 0.000 0.967 519 G HN 1.185 9.475 8.290 -0.000 0.000 0.587 520 T N 1.670 115.744 114.554 -0.801 0.000 2.871 520 T HA 0.455 4.805 4.350 -0.000 0.000 0.296 520 T C -0.242 173.834 174.700 -1.040 0.000 0.998 520 T CA 1.162 62.821 62.100 -0.735 0.000 1.162 520 T CB -0.242 68.325 68.868 -0.501 0.000 0.947 520 T HN 0.635 8.875 8.240 -0.000 0.000 0.536 521 H N 2.758 121.489 119.070 -0.566 0.000 2.974 521 H HA 0.300 4.856 4.556 -0.000 0.000 0.285 521 H C -1.110 173.866 175.328 -0.588 0.000 1.227 521 H CA -0.581 55.197 56.048 -0.449 0.000 1.569 521 H CB 0.207 29.890 29.762 -0.132 0.000 1.648 521 H HN 0.503 8.783 8.280 -0.000 0.000 0.521 522 Y N 1.345 121.428 120.300 -0.360 0.000 2.301 522 Y HA 0.327 4.877 4.550 -0.000 0.000 0.325 522 Y C -0.405 175.139 175.900 -0.594 0.000 1.203 522 Y CA -0.435 57.480 58.100 -0.309 0.000 1.255 522 Y CB 0.685 39.044 38.460 -0.167 0.000 1.232 522 Y HN 0.479 8.759 8.280 -0.000 0.000 0.501 523 Y N 0.139 120.607 120.300 0.280 0.000 2.315 523 Y HA 0.328 4.878 4.550 -0.000 0.000 0.324 523 Y C -0.347 175.697 175.900 0.241 0.000 1.062 523 Y CA -1.139 57.110 58.100 0.249 0.000 1.159 523 Y CB 1.577 40.208 38.460 0.285 0.000 1.145 523 Y HN 0.436 8.716 8.280 -0.000 0.000 0.442 524 T N 5.704 120.427 114.554 0.281 0.000 2.771 524 T HA 0.602 4.951 4.350 -0.000 0.000 0.291 524 T C -0.120 174.695 174.700 0.192 0.000 0.954 524 T CA -0.769 61.450 62.100 0.199 0.000 1.045 524 T CB 0.282 69.221 68.868 0.118 0.000 0.917 524 T HN 0.363 8.603 8.240 -0.000 0.000 0.484 525 R N 1.972 122.571 120.500 0.165 0.000 2.740 525 R HA 0.289 4.629 4.340 -0.000 0.000 0.273 525 R C -0.493 175.801 176.300 -0.010 0.000 0.998 525 R CA -0.950 55.209 56.100 0.099 0.000 0.900 525 R CB 1.528 31.902 30.300 0.123 0.000 1.223 525 R HN 0.702 8.972 8.270 -0.000 0.000 0.466 526 Q N 1.471 121.212 119.800 -0.097 0.000 2.320 526 Q HA -0.021 4.319 4.340 -0.000 0.000 0.311 526 Q C -0.415 175.442 176.000 -0.239 0.000 1.083 526 Q CA 0.628 56.229 55.803 -0.337 0.000 1.001 526 Q CB 0.534 29.112 28.738 -0.267 0.000 1.074 526 Q HN 0.495 8.765 8.270 -0.000 0.000 0.379 527 S N 5.491 121.015 115.700 -0.292 0.000 2.531 527 S HA 0.297 4.767 4.470 -0.000 0.000 0.279 527 S C -2.202 172.338 174.600 -0.101 0.000 1.305 527 S CA -1.393 56.734 58.200 -0.122 0.000 1.058 527 S CB 0.557 63.712 63.200 -0.076 0.000 0.899 527 S HN 0.557 8.867 8.310 -0.000 0.000 0.493 528 P HA 0.189 4.609 4.420 -0.000 0.000 0.272 528 P C -0.446 176.840 177.300 -0.025 0.000 1.240 528 P CA -0.472 62.621 63.100 -0.013 0.000 0.791 528 P CB 0.380 32.082 31.700 0.003 0.000 0.978 529 D N -0.209 120.166 120.400 -0.041 0.000 2.360 529 D HA 0.034 4.674 4.640 -0.000 0.000 0.242 529 D C -0.319 175.969 176.300 -0.020 0.000 1.184 529 D CA -0.206 53.769 54.000 -0.041 0.000 0.930 529 D CB 0.474 41.231 40.800 -0.071 0.000 1.161 529 D HN -0.076 8.294 8.370 -0.000 0.000 0.447 530 V N 2.059 121.971 119.914 -0.003 0.000 2.584 530 V HA 0.290 4.410 4.120 -0.000 0.000 0.303 530 V C 1.712 177.795 176.094 -0.017 0.000 1.035 530 V CA 1.526 63.829 62.300 0.006 0.000 1.172 530 V CB 0.265 32.099 31.823 0.017 0.000 0.896 530 V HN 0.926 9.116 8.190 -0.000 0.000 0.486 531 G N 3.852 112.639 108.800 -0.021 0.000 2.217 531 G HA2 -0.213 3.747 3.960 -0.000 0.000 0.246 531 G HA3 -0.213 3.747 3.960 -0.000 0.000 0.246 531 G C 0.146 174.941 174.900 -0.174 0.000 0.990 531 G CA 0.082 45.143 45.100 -0.065 0.000 0.627 531 G HN 0.628 8.918 8.290 -0.000 0.000 0.522 532 N N -0.354 118.255 118.700 -0.152 0.000 2.477 532 N HA 0.673 5.413 4.740 -0.000 0.000 0.284 532 N C -0.749 174.692 175.510 -0.116 0.000 1.182 532 N CA -0.442 52.460 53.050 -0.247 0.000 0.949 532 N CB 0.577 38.975 38.487 -0.148 0.000 1.204 532 N HN 0.079 8.459 8.380 -0.000 0.000 0.526 533 Y N 0.349 120.631 120.300 -0.029 0.000 2.352 533 Y HA 0.544 5.093 4.550 -0.000 0.000 0.326 533 Y C 0.386 176.237 175.900 -0.082 0.000 1.166 533 Y CA -0.794 57.281 58.100 -0.042 0.000 1.182 533 Y CB 0.863 39.291 38.460 -0.053 0.000 1.216 533 Y HN 0.305 8.585 8.280 -0.000 0.000 0.474 534 I N 1.268 121.881 120.570 0.071 0.000 2.582 534 I HA 0.593 4.762 4.170 -0.000 0.000 0.292 534 I C -1.006 174.916 176.117 -0.325 0.000 1.066 534 I CA -0.120 61.089 61.300 -0.152 0.000 1.053 534 I CB 1.457 39.359 38.000 -0.163 0.000 1.241 534 I HN 0.554 8.764 8.210 -0.000 0.000 0.421 535 S N 5.024 120.390 115.700 -0.556 0.000 2.568 535 S HA 0.690 5.160 4.470 -0.000 0.000 0.293 535 S C -1.666 172.402 174.600 -0.886 0.000 1.089 535 S CA -0.375 57.496 58.200 -0.548 0.000 0.945 535 S CB 1.635 64.638 63.200 -0.329 0.000 1.077 535 S HN 0.468 8.778 8.310 -0.000 0.000 0.485 536 Y N 0.890 121.007 120.300 -0.305 0.000 2.373 536 Y HA 0.468 5.018 4.550 -0.000 0.000 0.336 536 Y C 0.030 175.809 175.900 -0.202 0.000 0.979 536 Y CA -0.682 57.219 58.100 -0.332 0.000 1.080 536 Y CB 1.453 39.584 38.460 -0.548 0.000 1.190 536 Y HN 0.514 8.794 8.280 -0.000 0.000 0.446 537 Q N 3.765 123.527 119.800 -0.063 0.000 2.271 537 Q HA 0.643 4.983 4.340 -0.000 0.000 0.258 537 Q C -1.699 174.308 176.000 0.013 0.000 0.936 537 Q CA -0.679 55.111 55.803 -0.021 0.000 0.909 537 Q CB 1.237 29.951 28.738 -0.040 0.000 1.253 537 Q HN 0.789 9.059 8.270 -0.000 0.000 0.440 538 L N 3.307 124.564 121.223 0.056 0.000 2.406 538 L HA 0.374 4.714 4.340 -0.000 0.000 0.270 538 L C -0.862 176.058 176.870 0.083 0.000 0.982 538 L CA -0.411 54.463 54.840 0.056 0.000 0.843 538 L CB 2.253 44.344 42.059 0.053 0.000 1.225 538 L HN 0.624 8.854 8.230 -0.000 0.000 0.412 539 T N 4.893 119.481 114.554 0.057 0.000 2.891 539 T HA 0.362 4.712 4.350 -0.000 0.000 0.315 539 T C 0.305 175.051 174.700 0.076 0.000 1.054 539 T CA -0.345 61.797 62.100 0.071 0.000 0.958 539 T CB -0.131 68.764 68.868 0.045 0.000 1.008 539 T HN 0.423 8.663 8.240 -0.000 0.000 0.521 540 I N 1.834 122.461 120.570 0.095 0.000 2.692 540 I HA 0.392 4.562 4.170 -0.000 0.000 0.284 540 I C -2.470 173.729 176.117 0.137 0.000 1.159 540 I CA -2.242 59.109 61.300 0.085 0.000 1.423 540 I CB 0.078 38.096 38.000 0.031 0.000 1.380 540 I HN 0.231 8.441 8.210 -0.000 0.000 0.580 541 P HA 0.353 4.773 4.420 -0.000 0.000 0.271 541 P C 0.123 177.497 177.300 0.124 0.000 1.233 541 P CA 0.469 63.640 63.100 0.118 0.000 0.789 541 P CB 0.530 32.291 31.700 0.102 0.000 0.951 542 G N 0.042 108.902 108.800 0.101 0.000 2.555 542 G HA2 -0.020 3.940 3.960 -0.000 0.000 0.686 542 G HA3 -0.020 3.940 3.960 -0.000 0.000 0.686 542 G C -1.532 173.435 174.900 0.113 0.000 1.275 542 G CA -0.781 44.377 45.100 0.096 0.000 0.871 542 G HN 0.598 8.888 8.290 -0.000 0.000 0.603 543 D N -0.750 119.709 120.400 0.099 0.000 2.210 543 D HA 0.531 5.171 4.640 -0.000 0.000 0.249 543 D C -0.135 176.255 176.300 0.149 0.000 1.062 543 D CA -0.424 53.647 54.000 0.117 0.000 0.891 543 D CB 0.993 41.840 40.800 0.078 0.000 1.186 543 D HN 0.389 8.759 8.370 -0.000 0.000 0.432 544 F N 4.562 124.537 119.950 0.042 0.000 2.438 544 F HA 0.170 4.696 4.527 -0.000 0.000 0.360 544 F C 0.575 176.397 175.800 0.038 0.000 1.118 544 F CA -0.158 57.869 58.000 0.045 0.000 1.164 544 F CB 0.089 39.113 39.000 0.040 0.000 1.131 544 F HN 0.323 8.623 8.300 -0.000 0.000 0.527 545 N N 3.075 121.442 118.700 -0.554 0.000 3.153 545 N HA 0.251 4.991 4.740 -0.000 0.000 0.177 545 N C -0.641 174.450 175.510 -0.698 0.000 1.389 545 N CA -0.160 52.590 53.050 -0.500 0.000 1.117 545 N CB 0.260 38.624 38.487 -0.205 0.000 1.201 545 N HN 0.401 8.781 8.380 -0.000 0.000 0.503 546 N N -0.791 117.689 118.700 -0.367 0.000 2.471 546 N HA 0.174 4.914 4.740 -0.000 0.000 0.264 546 N C -1.469 173.983 175.510 -0.097 0.000 1.493 546 N CA -0.218 52.688 53.050 -0.241 0.000 0.932 546 N CB 1.236 39.624 38.487 -0.165 0.000 1.405 546 N HN 0.299 8.679 8.380 -0.000 0.000 0.505 547 I N 1.645 122.168 120.570 -0.078 0.000 2.395 547 I HA 0.484 4.654 4.170 -0.000 0.000 0.289 547 I C 0.280 176.415 176.117 0.030 0.000 1.023 547 I CA -0.876 60.414 61.300 -0.015 0.000 1.350 547 I CB 0.932 38.925 38.000 -0.010 0.000 1.409 547 I HN 0.192 8.402 8.210 -0.000 0.000 0.507 548 A N 5.565 128.414 122.820 0.049 0.000 2.454 548 A HA 0.406 4.726 4.320 -0.000 0.000 0.260 548 A C 0.352 177.989 177.584 0.089 0.000 1.106 548 A CA -0.077 52.009 52.037 0.083 0.000 0.780 548 A CB -0.199 18.845 19.000 0.074 0.000 1.044 548 A HN 0.772 8.922 8.150 -0.000 0.000 0.498 549 S N 1.967 117.748 115.700 0.135 0.000 2.565 549 S HA 0.278 4.748 4.470 -0.000 0.000 0.276 549 S C 0.753 175.432 174.600 0.132 0.000 1.326 549 S CA -0.356 57.933 58.200 0.149 0.000 1.045 549 S CB 0.123 63.459 63.200 0.226 0.000 0.918 549 S HN 0.877 9.187 8.310 -0.000 0.000 0.505 550 S N 3.658 119.375 115.700 0.028 0.000 4.359 550 S HA -0.151 4.319 4.470 -0.000 0.000 0.523 550 S C 0.419 174.909 174.600 -0.185 0.000 0.950 550 S CA 0.152 58.293 58.200 -0.098 0.000 1.346 550 S CB -1.156 61.937 63.200 -0.179 0.000 0.952 550 S HN 0.576 8.886 8.310 -0.000 0.000 0.516 551 I N 3.389 123.908 120.570 -0.084 0.000 3.153 551 I HA -0.184 3.986 4.170 -0.000 0.000 0.330 551 I C 0.462 176.458 176.117 -0.201 0.000 1.198 551 I CA 1.093 62.368 61.300 -0.041 0.000 1.475 551 I CB 0.024 38.007 38.000 -0.028 0.000 1.295 551 I HN 0.402 8.612 8.210 -0.000 0.000 0.540 552 F N 4.151 124.000 119.950 -0.169 0.000 2.458 552 F HA 0.531 5.058 4.527 -0.000 0.000 0.330 552 F C 0.504 176.025 175.800 -0.466 0.000 1.082 552 F CA -0.207 57.570 58.000 -0.372 0.000 0.995 552 F CB 1.821 40.502 39.000 -0.530 0.000 1.170 552 F HN 0.318 8.618 8.300 -0.000 0.000 0.478 553 S N 2.614 118.048 115.700 -0.443 0.000 2.614 553 S HA 0.656 5.126 4.470 -0.000 0.000 0.288 553 S C -1.358 172.856 174.600 -0.642 0.000 1.137 553 S CA -0.484 57.464 58.200 -0.419 0.000 0.992 553 S CB 0.420 63.481 63.200 -0.233 0.000 1.026 553 S HN 0.405 8.715 8.310 -0.000 0.000 0.486 554 F N 4.373 124.138 119.950 -0.309 0.000 2.467 554 F HA 0.676 5.203 4.527 -0.000 0.000 0.336 554 F C 0.559 176.038 175.800 -0.535 0.000 1.123 554 F CA -0.804 56.847 58.000 -0.582 0.000 0.964 554 F CB 1.605 40.092 39.000 -0.854 0.000 1.136 554 F HN 0.539 8.839 8.300 -0.000 0.000 0.447 555 R N -0.164 120.104 120.500 -0.386 0.000 2.739 555 R HA 0.787 5.127 4.340 -0.000 0.000 0.271 555 R C -1.318 174.878 176.300 -0.173 0.000 1.010 555 R CA -1.044 54.930 56.100 -0.211 0.000 0.897 555 R CB 1.674 31.878 30.300 -0.161 0.000 1.236 555 R HN 0.549 8.819 8.270 -0.000 0.000 0.466 556 T N -1.449 113.114 114.554 0.015 0.000 2.952 556 T HA 0.492 4.842 4.350 -0.000 0.000 0.286 556 T C 0.330 175.077 174.700 0.077 0.000 1.024 556 T CA -1.017 61.145 62.100 0.104 0.000 1.029 556 T CB 2.244 71.227 68.868 0.191 0.000 1.094 556 T HN 0.551 8.791 8.240 -0.000 0.000 0.515 557 R N 0.263 120.821 120.500 0.096 0.000 2.144 557 R HA 0.260 4.600 4.340 -0.000 0.000 0.195 557 R C 1.887 178.218 176.300 0.052 0.000 1.077 557 R CA 0.710 56.848 56.100 0.063 0.000 1.120 557 R CB -0.517 29.809 30.300 0.043 0.000 1.060 557 R HN 0.770 9.040 8.270 -0.000 0.000 0.520 558 N N -0.094 118.645 118.700 0.065 0.000 2.278 558 N HA 0.015 4.754 4.740 -0.000 0.000 0.181 558 N C -0.107 175.443 175.510 0.067 0.000 1.023 558 N CA 0.362 53.446 53.050 0.057 0.000 0.862 558 N CB 0.289 38.812 38.487 0.059 0.000 1.003 558 N HN 0.146 8.526 8.380 -0.000 0.000 0.431 559 N N 0.638 119.389 118.700 0.085 0.000 2.361 559 N HA 0.178 4.918 4.740 -0.000 0.000 0.302 559 N C -1.083 174.488 175.510 0.103 0.000 1.074 559 N CA -0.578 52.524 53.050 0.087 0.000 0.850 559 N CB 1.776 40.315 38.487 0.087 0.000 1.228 559 N HN -0.012 8.368 8.380 -0.000 0.000 0.491 560 Q N 0.744 120.600 119.800 0.093 0.000 2.306 560 Q HA 0.640 4.980 4.340 -0.000 0.000 0.241 560 Q C -0.526 175.548 176.000 0.123 0.000 0.948 560 Q CA -0.200 55.665 55.803 0.103 0.000 0.886 560 Q CB 1.254 30.042 28.738 0.084 0.000 1.227 560 Q HN 0.758 9.028 8.270 -0.000 0.000 0.457 561 G N 2.175 111.064 108.800 0.148 0.000 2.576 561 G HA2 0.341 4.301 3.960 -0.000 0.000 0.290 561 G HA3 0.341 4.301 3.960 -0.000 0.000 0.290 561 G C -0.284 174.728 174.900 0.187 0.000 1.442 561 G CA -0.614 44.588 45.100 0.169 0.000 0.792 561 G HN 0.494 8.784 8.290 -0.000 0.000 0.491 562 I N 0.707 121.384 120.570 0.179 0.000 2.146 562 I HA 0.286 4.456 4.170 -0.000 0.000 0.231 562 I C 1.627 177.872 176.117 0.213 0.000 1.063 562 I CA 2.255 63.654 61.300 0.166 0.000 1.340 562 I CB -1.262 36.813 38.000 0.126 0.000 1.100 562 I HN 1.461 9.671 8.210 -0.000 0.000 0.403 563 G N 1.448 110.343 108.800 0.159 0.000 3.434 563 G HA2 -0.085 3.875 3.960 -0.000 0.000 0.686 563 G HA3 -0.085 3.875 3.960 -0.000 0.000 0.686 563 G C -0.411 174.359 174.900 -0.217 0.000 1.099 563 G CA -0.568 44.584 45.100 0.086 0.000 0.931 563 G HN 0.324 8.614 8.290 -0.000 0.000 0.520 564 T N 2.520 116.675 114.554 -0.665 0.000 2.879 564 T HA 0.556 4.906 4.350 -0.000 0.000 0.290 564 T C -0.345 173.710 174.700 -1.076 0.000 0.993 564 T CA -0.571 61.083 62.100 -0.744 0.000 0.975 564 T CB 1.842 70.309 68.868 -0.669 0.000 0.981 564 T HN 1.111 9.351 8.240 -0.000 0.000 0.439 565 L N 4.567 125.328 121.223 -0.771 0.000 2.264 565 L HA 0.614 4.954 4.340 -0.000 0.000 0.289 565 L C -1.608 175.023 176.870 -0.398 0.000 1.044 565 L CA -0.386 54.189 54.840 -0.442 0.000 0.807 565 L CB 0.011 42.093 42.059 0.038 0.000 1.192 565 L HN 0.602 8.832 8.230 -0.000 0.000 0.425 566 Y N 3.866 124.160 120.300 -0.010 0.000 2.468 566 Y HA 0.569 5.119 4.550 -0.000 0.000 0.342 566 Y C 0.104 176.067 175.900 0.104 0.000 1.021 566 Y CA -0.791 57.320 58.100 0.019 0.000 1.079 566 Y CB 1.435 39.859 38.460 -0.059 0.000 1.226 566 Y HN 0.481 8.761 8.280 -0.000 0.000 0.460 567 R N 2.480 123.090 120.500 0.182 0.000 2.297 567 R HA 0.433 4.773 4.340 -0.000 0.000 0.308 567 R C -1.429 174.793 176.300 -0.131 0.000 1.029 567 R CA -0.879 55.105 56.100 -0.193 0.000 0.929 567 R CB 0.679 30.810 30.300 -0.282 0.000 1.046 567 R HN 0.704 8.974 8.270 -0.000 0.000 0.461 568 L N 4.379 125.481 121.223 -0.202 0.000 2.283 568 L HA 0.242 4.582 4.340 -0.000 0.000 0.287 568 L C -0.526 176.281 176.870 -0.105 0.000 1.073 568 L CA 0.419 55.190 54.840 -0.115 0.000 0.822 568 L CB 1.447 43.444 42.059 -0.103 0.000 1.186 568 L HN 0.588 8.818 8.230 -0.000 0.000 0.436 569 T N 4.964 119.488 114.554 -0.051 0.000 2.870 569 T HA 0.130 4.480 4.350 -0.000 0.000 0.300 569 T C 1.111 175.820 174.700 0.016 0.000 0.989 569 T CA -0.179 61.893 62.100 -0.047 0.000 1.139 569 T CB 0.640 69.482 68.868 -0.043 0.000 0.920 569 T HN 0.742 8.982 8.240 -0.000 0.000 0.537 570 E N 2.191 122.366 120.200 -0.042 0.000 2.075 570 E HA 0.047 4.396 4.350 -0.000 0.000 0.190 570 E C 0.365 176.865 176.600 -0.167 0.000 0.969 570 E CA 0.281 56.676 56.400 -0.008 0.000 0.815 570 E CB 0.219 29.882 29.700 -0.061 0.000 0.776 570 E HN 0.403 8.763 8.360 -0.000 0.000 0.457 571 S N 0.794 116.391 115.700 -0.173 0.000 2.486 571 S HA 0.309 4.779 4.470 -0.000 0.000 0.144 571 S C 0.601 175.107 174.600 -0.156 0.000 1.542 571 S CA -0.487 57.591 58.200 -0.203 0.000 1.262 571 S CB 0.384 63.493 63.200 -0.151 0.000 1.462 571 S HN 0.094 8.404 8.310 -0.000 0.000 0.381 572 I N 2.286 122.759 120.570 -0.161 0.000 2.404 572 I HA 0.093 4.263 4.170 -0.000 0.000 0.231 572 I C 0.410 176.451 176.117 -0.127 0.000 1.064 572 I CA 1.059 62.288 61.300 -0.118 0.000 1.383 572 I CB -0.458 37.485 38.000 -0.096 0.000 1.171 572 I HN 0.581 8.791 8.210 -0.000 0.000 0.422 573 N N 0.452 119.062 118.700 -0.150 0.000 2.884 573 N HA 0.458 5.198 4.740 -0.000 0.000 0.211 573 N C -0.336 175.066 175.510 -0.180 0.000 1.442 573 N CA 0.155 53.118 53.050 -0.145 0.000 0.757 573 N CB 0.623 39.052 38.487 -0.098 0.000 1.461 573 N HN 0.525 8.905 8.380 -0.000 0.000 0.557 574 G N -0.260 108.365 108.800 -0.292 0.000 2.619 574 G HA2 -0.073 3.887 3.960 -0.000 0.000 0.686 574 G HA3 -0.073 3.887 3.960 -0.000 0.000 0.686 574 G C -1.293 173.387 174.900 -0.367 0.000 1.256 574 G CA -1.254 43.647 45.100 -0.331 0.000 0.826 574 G HN 0.249 8.539 8.290 -0.000 0.000 0.619 575 Y N 0.397 120.634 120.300 -0.106 0.000 2.301 575 Y HA 0.606 5.156 4.550 -0.000 0.000 0.328 575 Y C 0.894 176.729 175.900 -0.110 0.000 1.242 575 Y CA 0.186 58.219 58.100 -0.113 0.000 1.323 575 Y CB 1.561 39.944 38.460 -0.128 0.000 1.266 575 Y HN 0.806 9.086 8.280 -0.000 0.000 0.527 576 N N 0.843 119.575 118.700 0.052 0.000 2.264 576 N HA 0.450 5.190 4.740 -0.000 0.000 0.288 576 N C -2.339 173.150 175.510 -0.035 0.000 1.094 576 N CA -0.534 52.507 53.050 -0.014 0.000 0.817 576 N CB 1.123 39.593 38.487 -0.028 0.000 1.604 576 N HN 0.406 8.786 8.380 -0.000 0.000 0.473 577 L N 3.181 124.359 121.223 -0.074 0.000 2.307 577 L HA 0.550 4.890 4.340 -0.000 0.000 0.284 577 L C -0.592 176.299 176.870 0.034 0.000 1.023 577 L CA -0.524 54.269 54.840 -0.078 0.000 0.810 577 L CB 1.228 43.089 42.059 -0.331 0.000 1.231 577 L HN 0.533 8.763 8.230 -0.000 0.000 0.423 578 I N 2.579 123.207 120.570 0.096 0.000 2.339 578 I HA 0.214 4.383 4.170 -0.000 0.000 0.290 578 I C 0.228 176.455 176.117 0.183 0.000 0.994 578 I CA -0.363 61.004 61.300 0.113 0.000 1.191 578 I CB 1.465 39.505 38.000 0.067 0.000 1.343 578 I HN 0.527 8.737 8.210 -0.000 0.000 0.458 579 T N 6.993 121.641 114.554 0.155 0.000 2.784 579 T HA 0.195 4.545 4.350 -0.000 0.000 0.291 579 T C 1.699 176.388 174.700 -0.017 0.000 0.942 579 T CA -0.202 61.909 62.100 0.019 0.000 1.161 579 T CB 1.085 69.936 68.868 -0.028 0.000 0.885 579 T HN 0.267 8.507 8.240 -0.000 0.000 0.534 580 I N 2.030 122.576 120.570 -0.039 0.000 2.385 580 I HA 0.176 4.346 4.170 -0.000 0.000 0.244 580 I C 1.058 177.139 176.117 -0.059 0.000 1.089 580 I CA 0.903 62.214 61.300 0.018 0.000 1.410 580 I CB -0.371 37.704 38.000 0.125 0.000 1.117 580 I HN 0.532 8.742 8.210 -0.000 0.000 0.429 581 N N 0.250 118.853 118.700 -0.162 0.000 2.636 581 N HA 0.247 4.987 4.740 -0.000 0.000 0.261 581 N C -1.368 173.853 175.510 -0.481 0.000 1.195 581 N CA -0.491 52.383 53.050 -0.294 0.000 0.902 581 N CB 1.353 39.665 38.487 -0.292 0.000 1.627 581 N HN -0.030 8.350 8.380 -0.000 0.000 0.491 582 N N 0.253 118.643 118.700 -0.518 0.000 2.443 582 N HA 0.524 5.264 4.740 -0.000 0.000 0.293 582 N C -1.444 173.666 175.510 -0.667 0.000 1.159 582 N CA -0.300 52.472 53.050 -0.464 0.000 0.904 582 N CB 1.257 39.597 38.487 -0.244 0.000 1.214 582 N HN 0.348 8.728 8.380 -0.000 0.000 0.513 583 Y N -0.160 120.142 120.300 0.003 0.000 2.373 583 Y HA 0.288 4.838 4.550 -0.000 0.000 0.336 583 Y C 0.776 176.719 175.900 0.073 0.000 0.979 583 Y CA -0.697 57.451 58.100 0.080 0.000 1.080 583 Y CB 2.003 40.574 38.460 0.186 0.000 1.190 583 Y HN 0.532 8.812 8.280 -0.000 0.000 0.446 584 S N 0.952 116.761 115.700 0.182 0.000 2.355 584 S HA -0.072 4.398 4.470 -0.000 0.000 0.222 584 S C -0.141 174.549 174.600 0.150 0.000 1.031 584 S CA 1.251 59.529 58.200 0.129 0.000 0.993 584 S CB -0.043 63.211 63.200 0.089 0.000 0.859 584 S HN 0.628 8.938 8.310 -0.000 0.000 0.453 585 D N -0.434 120.066 120.400 0.168 0.000 2.481 585 D HA 0.450 5.089 4.640 -0.000 0.000 0.244 585 D C 0.031 176.433 176.300 0.169 0.000 1.057 585 D CA -0.541 53.548 54.000 0.147 0.000 0.848 585 D CB 1.761 42.624 40.800 0.105 0.000 1.388 585 D HN -0.087 8.283 8.370 -0.000 0.000 0.475 586 L N 0.755 122.073 121.223 0.158 0.000 2.500 586 L HA 0.219 4.559 4.340 -0.000 0.000 0.219 586 L C 0.263 177.182 176.870 0.080 0.000 1.057 586 L CA 0.134 55.062 54.840 0.147 0.000 0.854 586 L CB -0.246 41.947 42.059 0.223 0.000 1.078 586 L HN 0.318 8.548 8.230 -0.000 0.000 0.480 587 L N 2.373 123.644 121.223 0.080 0.000 2.559 587 L HA 0.027 4.367 4.340 -0.000 0.000 0.274 587 L C 0.543 177.427 176.870 0.022 0.000 1.205 587 L CA 0.405 55.275 54.840 0.051 0.000 0.907 587 L CB -0.689 41.403 42.059 0.054 0.000 1.153 587 L HN 0.644 8.874 8.230 -0.000 0.000 0.490 588 N N 1.460 120.158 118.700 -0.004 0.000 2.701 588 N HA -0.307 4.433 4.740 -0.000 0.000 0.257 588 N C -0.078 175.407 175.510 -0.041 0.000 0.969 588 N CA 1.165 54.194 53.050 -0.035 0.000 0.786 588 N CB -1.715 36.754 38.487 -0.030 0.000 0.917 588 N HN 0.788 9.168 8.380 -0.000 0.000 0.541 589 N N -0.171 118.503 118.700 -0.044 0.000 2.488 589 N HA 0.282 5.022 4.740 -0.000 0.000 0.274 589 N C -0.762 174.687 175.510 -0.102 0.000 1.111 589 N CA -0.367 52.657 53.050 -0.043 0.000 0.974 589 N CB 1.125 39.593 38.487 -0.031 0.000 1.089 589 N HN 0.200 8.580 8.380 -0.000 0.000 0.465 590 V N 3.842 123.710 119.914 -0.076 0.000 2.724 590 V HA 0.206 4.326 4.120 -0.000 0.000 0.341 590 V C -0.846 175.219 176.094 -0.048 0.000 1.254 590 V CA -0.408 61.824 62.300 -0.113 0.000 1.261 590 V CB -0.074 31.663 31.823 -0.144 0.000 1.445 590 V HN 0.657 8.847 8.190 -0.000 0.000 0.652 591 E N 4.688 124.894 120.200 0.010 0.000 2.001 591 E HA 0.327 4.677 4.350 -0.000 0.000 0.279 591 E C -2.346 174.313 176.600 0.099 0.000 1.045 591 E CA -1.735 54.728 56.400 0.105 0.000 0.833 591 E CB 1.121 30.987 29.700 0.277 0.000 1.077 591 E HN 0.493 8.853 8.360 -0.000 0.000 0.397 592 P HA 0.111 4.531 4.420 -0.000 0.000 0.269 592 P C -0.639 176.729 177.300 0.112 0.000 1.215 592 P CA -0.191 62.933 63.100 0.041 0.000 0.780 592 P CB 0.939 32.646 31.700 0.013 0.000 0.898 593 I N 0.775 121.416 120.570 0.118 0.000 2.752 593 I HA 0.291 4.461 4.170 -0.000 0.000 0.295 593 I C -0.893 175.302 176.117 0.130 0.000 1.219 593 I CA -0.490 60.908 61.300 0.164 0.000 1.030 593 I CB 2.147 40.320 38.000 0.289 0.000 1.259 593 I HN 0.389 8.599 8.210 -0.000 0.000 0.423 594 S N 7.951 123.715 115.700 0.107 0.000 2.438 594 S HA 0.733 5.203 4.470 -0.000 0.000 0.316 594 S C -1.006 173.638 174.600 0.073 0.000 1.084 594 S CA -0.718 57.540 58.200 0.098 0.000 1.107 594 S CB 0.639 63.886 63.200 0.079 0.000 0.981 594 S HN 0.467 8.777 8.310 -0.000 0.000 0.466 595 L N 3.589 124.839 121.223 0.045 0.000 2.325 595 L HA 0.516 4.856 4.340 -0.000 0.000 0.278 595 L C 0.081 177.029 176.870 0.130 0.000 1.023 595 L CA -0.817 53.964 54.840 -0.099 0.000 0.811 595 L CB 1.152 42.860 42.059 -0.585 0.000 1.249 595 L HN 0.750 8.980 8.230 -0.000 0.000 0.431 596 L N 3.786 125.190 121.223 0.301 0.000 2.418 596 L HA 0.105 4.445 4.340 -0.000 0.000 0.274 596 L C 0.375 177.449 176.870 0.341 0.000 1.135 596 L CA -0.548 54.475 54.840 0.305 0.000 0.870 596 L CB -0.001 42.281 42.059 0.372 0.000 1.154 596 L HN 0.664 8.894 8.230 -0.000 0.000 0.462 597 N N 2.844 121.687 118.700 0.239 0.000 2.412 597 N HA 0.107 4.846 4.740 -0.000 0.000 0.254 597 N C 1.008 176.711 175.510 0.322 0.000 1.232 597 N CA 0.450 53.640 53.050 0.234 0.000 0.880 597 N CB 0.758 39.339 38.487 0.157 0.000 1.076 597 N HN 0.821 9.201 8.380 -0.000 0.000 0.458 598 G N -0.596 108.366 108.800 0.270 0.000 2.253 598 G HA2 -0.192 3.768 3.960 -0.000 0.000 0.251 598 G HA3 -0.192 3.768 3.960 -0.000 0.000 0.251 598 G C 0.239 175.235 174.900 0.159 0.000 0.998 598 G CA 0.436 45.684 45.100 0.247 0.000 0.621 598 G HN 1.145 9.435 8.290 -0.000 0.000 0.524 599 A N 0.021 122.989 122.820 0.248 0.000 2.332 599 A HA 0.703 5.023 4.320 -0.000 0.000 0.258 599 A C 0.499 178.097 177.584 0.024 0.000 1.087 599 A CA 1.099 53.169 52.037 0.054 0.000 0.802 599 A CB 0.534 19.624 19.000 0.150 0.000 1.042 599 A HN 0.747 8.897 8.150 -0.000 0.000 0.489 600 T N 1.666 116.109 114.554 -0.186 0.000 2.771 600 T HA 0.555 4.905 4.350 -0.000 0.000 0.281 600 T C -1.240 173.290 174.700 -0.283 0.000 0.982 600 T CA 0.329 62.362 62.100 -0.112 0.000 0.978 600 T CB 0.147 68.961 68.868 -0.090 0.000 0.930 600 T HN 0.398 8.638 8.240 -0.000 0.000 0.447 601 Y N 1.713 122.019 120.300 0.009 0.000 2.485 601 Y HA 0.650 5.200 4.550 -0.000 0.000 0.345 601 Y C 0.088 176.003 175.900 0.025 0.000 0.998 601 Y CA -1.290 56.829 58.100 0.031 0.000 1.059 601 Y CB 1.423 39.905 38.460 0.037 0.000 1.234 601 Y HN 0.470 8.750 8.280 -0.000 0.000 0.461 602 I N 3.061 123.749 120.570 0.196 0.000 2.436 602 I HA 0.275 4.445 4.170 -0.000 0.000 0.289 602 I C -1.327 174.894 176.117 0.173 0.000 1.010 602 I CA -0.652 60.730 61.300 0.136 0.000 1.098 602 I CB 1.569 39.606 38.000 0.061 0.000 1.266 602 I HN 0.470 8.680 8.210 -0.000 0.000 0.434 603 F N 6.590 126.503 119.950 -0.060 0.000 2.426 603 F HA 0.493 5.020 4.527 -0.000 0.000 0.348 603 F C 0.122 175.872 175.800 -0.082 0.000 1.124 603 F CA -0.523 57.397 58.000 -0.133 0.000 1.008 603 F CB 0.937 39.733 39.000 -0.339 0.000 1.139 603 F HN 0.366 8.666 8.300 -0.000 0.000 0.452 604 R N 5.765 126.145 120.500 -0.199 0.000 2.338 604 R HA 0.653 4.993 4.340 -0.000 0.000 0.317 604 R C -1.922 174.356 176.300 -0.036 0.000 0.968 604 R CA -0.522 55.509 56.100 -0.116 0.000 0.849 604 R CB 1.406 31.603 30.300 -0.172 0.000 1.128 604 R HN 0.538 8.808 8.270 -0.000 0.000 0.448 605 V N 5.326 125.317 119.914 0.129 0.000 2.357 605 V HA 0.272 4.392 4.120 -0.000 0.000 0.284 605 V C -0.138 176.104 176.094 0.247 0.000 1.018 605 V CA -0.704 61.742 62.300 0.244 0.000 0.841 605 V CB 1.409 33.438 31.823 0.343 0.000 0.991 605 V HN 0.682 8.872 8.190 -0.000 0.000 0.437 606 K N 4.536 125.094 120.400 0.265 0.000 2.264 606 K HA 0.518 4.838 4.320 -0.000 0.000 0.277 606 K C -0.708 175.997 176.600 0.175 0.000 1.067 606 K CA -0.449 56.013 56.287 0.293 0.000 0.900 606 K CB 1.422 34.120 32.500 0.330 0.000 1.124 606 K HN 0.511 8.761 8.250 -0.000 0.000 0.469 607 V N 3.988 123.977 119.914 0.126 0.000 2.637 607 V HA 0.007 4.127 4.120 -0.000 0.000 0.296 607 V C 1.377 177.517 176.094 0.076 0.000 1.046 607 V CA 0.391 62.752 62.300 0.100 0.000 1.066 607 V CB 1.191 33.057 31.823 0.071 0.000 0.968 607 V HN 1.050 9.240 8.190 -0.000 0.000 0.483 608 T N -0.062 114.541 114.554 0.081 0.000 2.964 608 T HA 0.215 4.565 4.350 -0.000 0.000 0.250 608 T C 0.262 174.996 174.700 0.057 0.000 0.982 608 T CA 0.074 62.214 62.100 0.067 0.000 0.959 608 T CB 0.236 69.149 68.868 0.075 0.000 1.141 608 T HN 0.776 9.016 8.240 -0.000 0.000 0.494 609 E N 0.845 121.082 120.200 0.062 0.000 2.290 609 E HA 0.507 4.857 4.350 -0.000 0.000 0.274 609 E C -1.721 174.913 176.600 0.057 0.000 0.889 609 E CA -1.139 55.294 56.400 0.054 0.000 0.760 609 E CB 2.014 31.745 29.700 0.052 0.000 1.206 609 E HN 0.117 8.477 8.360 -0.000 0.000 0.419 610 L N 4.505 125.760 121.223 0.052 0.000 2.407 610 L HA 0.378 4.718 4.340 -0.000 0.000 0.261 610 L C -0.315 176.591 176.870 0.062 0.000 1.108 610 L CA -0.031 54.842 54.840 0.055 0.000 0.995 610 L CB -0.360 41.729 42.059 0.050 0.000 1.349 610 L HN 0.663 8.893 8.230 -0.000 0.000 0.423 611 N N 2.011 120.748 118.700 0.063 0.000 2.333 611 N HA 0.055 4.795 4.740 -0.000 0.000 0.178 611 N C 0.222 175.777 175.510 0.075 0.000 1.018 611 N CA 0.323 53.411 53.050 0.062 0.000 0.882 611 N CB 0.176 38.696 38.487 0.055 0.000 0.984 611 N HN 0.539 8.919 8.380 -0.000 0.000 0.434 612 N N -1.048 117.703 118.700 0.085 0.000 2.284 612 N HA 0.030 4.770 4.740 -0.000 0.000 0.289 612 N C -0.431 175.164 175.510 0.141 0.000 1.179 612 N CA -0.446 52.671 53.050 0.111 0.000 0.774 612 N CB 1.296 39.837 38.487 0.091 0.000 1.548 612 N HN -0.084 8.296 8.380 -0.000 0.000 0.473 613 Y N 1.959 122.298 120.300 0.066 0.000 2.165 613 Y HA 0.026 4.576 4.550 -0.000 0.000 0.286 613 Y C 0.128 176.070 175.900 0.069 0.000 1.155 613 Y CA 1.488 59.633 58.100 0.075 0.000 1.164 613 Y CB 0.041 38.546 38.460 0.074 0.000 0.978 613 Y HN 0.432 8.712 8.280 -0.000 0.000 0.513 614 N N 0.857 119.567 118.700 0.017 0.000 2.430 614 N HA 0.201 4.941 4.740 -0.000 0.000 0.292 614 N C -1.119 174.405 175.510 0.023 0.000 1.051 614 N CA -0.349 52.677 53.050 -0.040 0.000 0.917 614 N CB 1.740 40.264 38.487 0.063 0.000 1.164 614 N HN 0.253 8.633 8.380 -0.000 0.000 0.484 615 I N 2.724 123.317 120.570 0.038 0.000 2.353 615 I HA 0.339 4.509 4.170 -0.000 0.000 0.293 615 I C -0.499 175.724 176.117 0.176 0.000 0.992 615 I CA -0.619 60.749 61.300 0.114 0.000 1.268 615 I CB 0.680 38.765 38.000 0.142 0.000 1.387 615 I HN 0.292 8.502 8.210 -0.000 0.000 0.478 616 I N 7.753 128.431 120.570 0.179 0.000 2.377 616 I HA 0.255 4.425 4.170 -0.000 0.000 0.293 616 I C -0.835 175.453 176.117 0.284 0.000 0.987 616 I CA -0.498 60.930 61.300 0.213 0.000 1.185 616 I CB 1.399 39.470 38.000 0.118 0.000 1.341 616 I HN 0.468 8.678 8.210 -0.000 0.000 0.455 617 F N 5.803 125.828 119.950 0.126 0.000 2.444 617 F HA 0.407 4.934 4.527 -0.000 0.000 0.342 617 F C -0.416 175.436 175.800 0.086 0.000 1.121 617 F CA -0.688 57.284 58.000 -0.046 0.000 0.997 617 F CB 1.175 39.830 39.000 -0.576 0.000 1.130 617 F HN 0.369 8.669 8.300 -0.000 0.000 0.454 618 D N 4.883 124.921 120.400 -0.602 0.000 2.440 618 D HA 0.469 5.109 4.640 -0.000 0.000 0.239 618 D C -1.112 174.785 176.300 -0.671 0.000 1.084 618 D CA -0.361 53.355 54.000 -0.472 0.000 0.843 618 D CB 1.538 42.150 40.800 -0.313 0.000 1.097 618 D HN 0.669 9.039 8.370 -0.000 0.000 0.531 619 A N 4.520 127.149 122.820 -0.318 0.000 2.506 619 A HA 0.254 4.574 4.320 -0.000 0.000 0.320 619 A C -0.781 176.805 177.584 0.003 0.000 1.424 619 A CA -0.571 51.414 52.037 -0.087 0.000 1.044 619 A CB -0.447 18.735 19.000 0.303 0.000 1.140 619 A HN 0.622 8.772 8.150 -0.000 0.000 0.538 620 Y N 2.307 122.414 120.300 -0.322 0.000 2.359 620 Y HA 0.321 4.871 4.550 -0.000 0.000 0.334 620 Y C 0.855 176.494 175.900 -0.436 0.000 1.058 620 Y CA 0.180 58.090 58.100 -0.316 0.000 1.244 620 Y CB 0.490 38.737 38.460 -0.356 0.000 1.187 620 Y HN 0.648 8.928 8.280 -0.000 0.000 0.510 621 R N 6.142 126.193 120.500 -0.748 0.000 2.239 621 R HA 0.147 4.487 4.340 -0.000 0.000 0.332 621 R C 0.473 176.339 176.300 -0.724 0.000 0.988 621 R CA -0.288 55.234 56.100 -0.963 0.000 0.859 621 R CB 0.257 30.123 30.300 -0.723 0.000 1.148 621 R HN 0.878 9.148 8.270 -0.000 0.000 0.482 622 N N 1.338 119.761 118.700 -0.462 0.000 2.105 622 N HA -0.097 4.643 4.740 -0.000 0.000 0.190 622 N C 0.230 175.638 175.510 -0.170 0.000 1.066 622 N CA 1.364 54.319 53.050 -0.158 0.000 0.861 622 N CB -0.008 38.462 38.487 -0.028 0.000 1.048 622 N HN 0.633 9.013 8.380 -0.000 0.000 0.442 623 S N 0.000 115.614 115.700 -0.143 0.000 2.498 623 S HA 0.000 4.470 4.470 -0.000 0.000 0.327 623 S CA 0.000 58.140 58.200 -0.100 0.000 1.107 623 S CB 0.000 63.161 63.200 -0.065 0.000 0.593 623 S HN 0.000 8.310 8.310 -0.000 0.000 0.517