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 3my0_1_E DATA FIRST_RESID 0 DATA SEQUENCE MXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX DATA SEQUENCE XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX DATA SEQUENCE XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX DATA SEQUENCE XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXQRTVA DATA SEQUENCE RQVALVECVG KGRYGEVWRG LWHGESVAVK IFSSRDEQSW FRETEIYNTV DATA SEQUENCE LLRHDNILGF IASDMXXXXX XTQLWLITHY HEHGSLYDFL QRQTLEPHLA DATA SEQUENCE LRLAVSAACG LAHLHVEIFG TQGKPAIAHR DFKSRNVLVK SNLQCCIADL DATA SEQUENCE GLAVMHSQGS DYLDIGNNPR VGTKRYMAPE VLDEQIRTDC FESYKWTDIW DATA SEQUENCE AFGLVLWEIA RRTIVNGIVE DYRPPFYDVV PNDPSFEDMK KVVCVDQQTP DATA SEQUENCE TIPNRLAADP VLSGLAQMMR ECWYPNPSAR LTALRIKKTL QKIS 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 0 M HA 0.000 4.480 4.480 -0.000 0.000 0.227 0 M C 0.000 176.311 176.300 0.018 0.000 1.140 0 M CA 0.000 55.328 55.300 0.046 0.000 0.988 0 M CB 0.000 32.636 32.600 0.060 0.000 1.302 196 R N 1.015 121.503 120.500 -0.018 0.000 2.127 196 R HA 0.007 4.348 4.340 0.001 0.000 0.217 196 R C 2.038 178.333 176.300 -0.009 0.000 1.074 196 R CA 1.842 57.930 56.100 -0.020 0.000 0.991 196 R CB -1.452 28.842 30.300 -0.010 0.000 0.895 196 R HN 0.355 8.626 8.270 -0.000 0.000 0.450 197 T N -1.149 113.422 114.554 0.028 0.000 2.915 197 T HA -0.083 4.268 4.350 0.001 0.000 0.269 197 T C 2.009 176.782 174.700 0.121 0.000 1.071 197 T CA 1.206 63.358 62.100 0.087 0.000 1.132 197 T CB -0.459 68.488 68.868 0.132 0.000 0.878 197 T HN 0.134 8.374 8.240 -0.000 0.000 0.479 198 V N 2.688 122.597 119.914 -0.008 0.000 2.220 198 V HA -0.136 3.984 4.120 0.001 0.000 0.242 198 V C 3.141 179.172 176.094 -0.106 0.000 1.041 198 V CA 1.902 64.046 62.300 -0.259 0.000 0.990 198 V CB -1.509 29.962 31.823 -0.585 0.000 0.634 198 V HN 0.610 8.800 8.190 -0.000 0.000 0.452 199 A N -0.119 122.669 122.820 -0.054 0.000 2.186 199 A HA -0.150 4.171 4.320 0.001 0.000 0.219 199 A C 2.346 179.934 177.584 0.006 0.000 1.159 199 A CA 2.213 54.302 52.037 0.087 0.000 0.680 199 A CB -0.722 18.336 19.000 0.097 0.000 0.787 199 A HN 0.602 8.752 8.150 -0.000 0.000 0.467 200 R N -0.595 119.904 120.500 -0.003 0.000 2.100 200 R HA 0.041 4.382 4.340 0.001 0.000 0.220 200 R C 1.967 178.312 176.300 0.075 0.000 1.091 200 R CA 1.434 57.536 56.100 0.004 0.000 0.986 200 R CB -0.890 29.412 30.300 0.003 0.000 0.888 200 R HN 0.754 9.024 8.270 -0.000 0.000 0.444 201 Q N -0.112 119.775 119.800 0.146 0.000 2.354 201 Q HA 0.161 4.502 4.340 0.001 0.000 0.203 201 Q C 0.265 176.399 176.000 0.223 0.000 0.933 201 Q CA 0.145 56.064 55.803 0.192 0.000 0.901 201 Q CB 0.431 29.321 28.738 0.254 0.000 1.007 201 Q HN 0.371 8.641 8.270 -0.000 0.000 0.495 202 V N 1.956 122.016 119.914 0.245 0.000 2.599 202 V HA 0.053 4.174 4.120 0.001 0.000 0.300 202 V C 0.131 176.307 176.094 0.138 0.000 1.034 202 V CA -0.054 62.371 62.300 0.209 0.000 1.115 202 V CB 0.594 32.495 31.823 0.131 0.000 0.934 202 V HN 0.183 8.373 8.190 -0.000 0.000 0.485 203 A N 6.825 129.698 122.820 0.089 0.000 2.292 203 A HA 0.702 5.023 4.320 0.001 0.000 0.319 203 A C -0.480 177.097 177.584 -0.012 0.000 1.206 203 A CA -0.626 51.432 52.037 0.036 0.000 0.835 203 A CB 0.482 19.503 19.000 0.034 0.000 1.164 203 A HN 0.799 8.949 8.150 -0.000 0.000 0.505 204 L N 3.756 124.932 121.223 -0.078 0.000 2.290 204 L HA 0.279 4.620 4.340 0.001 0.000 0.284 204 L C 0.541 177.421 176.870 0.016 0.000 1.078 204 L CA -0.338 54.420 54.840 -0.137 0.000 0.815 204 L CB 1.415 43.156 42.059 -0.530 0.000 1.162 204 L HN 0.637 8.867 8.230 -0.000 0.000 0.435 205 V N 1.369 121.372 119.914 0.149 0.000 2.854 205 V HA 0.191 4.312 4.120 0.001 0.000 0.236 205 V C 0.678 176.923 176.094 0.251 0.000 1.157 205 V CA 1.001 63.392 62.300 0.152 0.000 1.187 205 V CB 0.682 32.535 31.823 0.049 0.000 0.949 205 V HN 0.828 9.018 8.190 -0.000 0.000 0.488 206 E N -1.001 119.351 120.200 0.254 0.000 2.290 206 E HA 0.505 4.856 4.350 0.001 0.000 0.274 206 E C -1.006 175.454 176.600 -0.234 0.000 0.889 206 E CA -0.180 56.245 56.400 0.042 0.000 0.760 206 E CB 1.134 30.820 29.700 -0.023 0.000 1.206 206 E HN 0.297 8.657 8.360 -0.000 0.000 0.419 207 C N 3.434 122.231 119.300 -0.839 0.000 2.373 207 C HA 0.556 5.017 4.460 0.001 0.000 0.354 207 C C 1.452 176.129 174.990 -0.521 0.000 1.249 207 C CA 0.461 58.741 59.018 -1.231 0.000 1.784 207 C CB -1.213 25.599 27.740 -1.546 0.000 2.408 207 C HN 1.125 9.355 8.230 -0.000 0.000 0.542 208 V N 4.189 123.914 119.914 -0.315 0.000 3.578 208 V HA 0.589 4.710 4.120 0.001 0.000 0.290 208 V C 0.715 176.769 176.094 -0.068 0.000 1.376 208 V CA 0.676 62.912 62.300 -0.106 0.000 1.083 208 V CB -0.478 31.375 31.823 0.051 0.000 0.911 208 V HN 1.091 9.281 8.190 -0.000 0.000 0.433 209 G N -0.732 107.998 108.800 -0.116 0.000 2.732 209 G HA2 0.738 4.699 3.960 0.001 0.000 0.296 209 G HA3 0.738 4.699 3.960 0.001 0.000 0.296 209 G C -1.273 173.593 174.900 -0.058 0.000 1.448 209 G CA 0.037 45.128 45.100 -0.014 0.000 0.911 209 G HN 0.684 8.974 8.290 -0.000 0.000 0.528 210 K N -0.742 119.618 120.400 -0.066 0.000 2.557 210 K HA 1.005 5.326 4.320 0.001 0.000 0.261 210 K C -0.029 176.371 176.600 -0.333 0.000 0.932 210 K CA 0.094 56.254 56.287 -0.211 0.000 0.829 210 K CB 1.722 34.124 32.500 -0.164 0.000 1.358 210 K HN 2.517 10.767 8.250 -0.000 0.000 0.430 211 G N -1.131 107.295 108.800 -0.623 0.000 2.427 211 G HA2 0.562 4.523 3.960 0.001 0.000 0.306 211 G HA3 0.562 4.523 3.960 0.001 0.000 0.306 211 G C 0.663 175.235 174.900 -0.546 0.000 1.280 211 G CA 0.972 45.714 45.100 -0.596 0.000 0.837 211 G HN 1.355 9.645 8.290 -0.000 0.000 0.482 212 R N -1.236 119.076 120.500 -0.313 0.000 2.189 212 R HA 0.091 4.432 4.340 0.001 0.000 0.218 212 R C 2.201 178.451 176.300 -0.082 0.000 1.074 212 R CA 2.472 58.494 56.100 -0.130 0.000 0.991 212 R CB -1.622 28.672 30.300 -0.010 0.000 0.883 212 R HN 1.124 9.394 8.270 -0.000 0.000 0.457 213 Y N -2.129 118.178 120.300 0.012 0.000 2.509 213 Y HA 0.365 4.915 4.550 0.002 0.000 0.293 213 Y C 1.228 177.105 175.900 -0.039 0.000 1.133 213 Y CA -0.175 57.927 58.100 0.003 0.000 1.283 213 Y CB -0.177 38.253 38.460 -0.049 0.000 1.001 213 Y HN 0.505 8.785 8.280 -0.000 0.000 0.555 214 G N -0.132 108.455 108.800 -0.354 0.000 2.204 214 G HA2 0.026 3.987 3.960 0.001 0.000 0.153 214 G HA3 0.026 3.987 3.960 0.001 0.000 0.153 214 G C -1.338 173.403 174.900 -0.264 0.000 1.295 214 G CA -0.374 44.631 45.100 -0.157 0.000 1.257 214 G HN 0.314 8.604 8.290 -0.000 0.000 0.495 215 E N -1.233 118.968 120.200 0.001 0.000 2.356 215 E HA 0.580 4.931 4.350 0.001 0.000 0.275 215 E C -1.364 175.336 176.600 0.167 0.000 0.904 215 E CA -0.828 55.608 56.400 0.060 0.000 0.757 215 E CB 3.172 32.933 29.700 0.102 0.000 1.232 215 E HN 0.432 8.792 8.360 -0.000 0.000 0.442 216 V N 1.868 121.854 119.914 0.120 0.000 2.495 216 V HA 0.434 4.555 4.120 0.001 0.000 0.298 216 V C -1.148 174.952 176.094 0.009 0.000 1.031 216 V CA -0.698 61.661 62.300 0.098 0.000 0.871 216 V CB 0.821 32.692 31.823 0.079 0.000 0.988 216 V HN 0.594 8.784 8.190 -0.000 0.000 0.432 217 W N 2.860 124.113 121.300 -0.078 0.000 2.706 217 W HA 0.665 5.326 4.660 0.001 0.000 0.346 217 W C 0.244 176.691 176.519 -0.119 0.000 1.071 217 W CA -0.735 56.549 57.345 -0.102 0.000 1.206 217 W CB 1.412 30.765 29.460 -0.179 0.000 1.413 217 W HN 0.372 8.552 8.180 -0.000 0.000 0.542 218 R N 1.458 121.991 120.500 0.055 0.000 2.265 218 R HA 0.622 4.963 4.340 0.001 0.000 0.314 218 R C 0.086 176.312 176.300 -0.123 0.000 1.053 218 R CA -0.124 55.807 56.100 -0.280 0.000 0.931 218 R CB 0.271 30.244 30.300 -0.545 0.000 1.024 218 R HN 0.713 8.983 8.270 -0.000 0.000 0.457 219 G N 3.729 112.426 108.800 -0.172 0.000 2.498 219 G HA2 0.507 4.468 3.960 0.001 0.000 0.312 219 G HA3 0.507 4.468 3.960 0.001 0.000 0.312 219 G C -1.222 173.643 174.900 -0.059 0.000 1.230 219 G CA -0.771 44.281 45.100 -0.079 0.000 0.968 219 G HN 0.453 8.743 8.290 -0.000 0.000 0.481 220 L N 0.496 121.722 121.223 0.005 0.000 2.313 220 L HA 0.515 4.856 4.340 0.001 0.000 0.283 220 L C -1.333 175.620 176.870 0.138 0.000 1.013 220 L CA -0.712 54.155 54.840 0.045 0.000 0.816 220 L CB 2.123 44.194 42.059 0.021 0.000 1.236 220 L HN 0.625 8.855 8.230 -0.000 0.000 0.419 221 W N 4.175 125.425 121.300 -0.083 0.000 2.587 221 W HA 0.374 5.035 4.660 0.001 0.000 0.324 221 W C 0.099 176.562 176.519 -0.094 0.000 1.008 221 W CA -0.444 56.805 57.345 -0.161 0.000 1.265 221 W CB 0.329 29.674 29.460 -0.191 0.000 1.328 221 W HN 0.598 8.778 8.180 -0.000 0.000 0.432 222 H N 4.606 123.389 119.070 -0.477 0.000 2.506 222 H HA -0.192 4.365 4.556 0.001 0.000 0.323 222 H C 1.491 176.682 175.328 -0.228 0.000 1.076 222 H CA 1.226 56.992 56.048 -0.470 0.000 1.108 222 H CB -0.908 28.357 29.762 -0.828 0.000 1.569 222 H HN 1.091 9.371 8.280 -0.000 0.000 0.399 223 G N -0.289 108.503 108.800 -0.012 0.000 2.417 223 G HA2 -0.359 3.602 3.960 0.001 0.000 0.233 223 G HA3 -0.359 3.602 3.960 0.001 0.000 0.233 223 G C 0.265 175.178 174.900 0.022 0.000 1.103 223 G CA 0.663 45.763 45.100 -0.001 0.000 0.647 223 G HN 0.596 8.886 8.290 -0.000 0.000 0.512 224 E N 1.032 121.264 120.200 0.054 0.000 2.314 224 E HA 0.678 5.029 4.350 0.001 0.000 0.262 224 E C -0.092 176.559 176.600 0.085 0.000 1.093 224 E CA -0.183 56.264 56.400 0.079 0.000 0.908 224 E CB 1.096 30.869 29.700 0.120 0.000 1.091 224 E HN 0.157 8.517 8.360 -0.000 0.000 0.425 225 S N 0.483 116.217 115.700 0.057 0.000 2.508 225 S HA 0.498 4.969 4.470 0.001 0.000 0.284 225 S C -0.487 174.141 174.600 0.047 0.000 1.192 225 S CA -0.874 57.328 58.200 0.003 0.000 1.070 225 S CB 0.731 63.922 63.200 -0.015 0.000 1.004 225 S HN 0.436 8.746 8.310 -0.000 0.000 0.493 226 V N 0.152 120.060 119.914 -0.010 0.000 2.962 226 V HA 0.995 5.116 4.120 0.001 0.000 0.313 226 V C -0.265 175.832 176.094 0.006 0.000 1.099 226 V CA -1.395 60.923 62.300 0.030 0.000 0.971 226 V CB 1.395 33.209 31.823 -0.015 0.000 1.028 226 V HN 0.881 9.071 8.190 -0.000 0.000 0.430 227 A N 2.410 125.290 122.820 0.101 0.000 2.301 227 A HA 0.795 5.116 4.320 0.001 0.000 0.298 227 A C -0.404 177.187 177.584 0.012 0.000 1.185 227 A CA -0.558 51.557 52.037 0.131 0.000 0.830 227 A CB 1.064 20.183 19.000 0.199 0.000 1.112 227 A HN 1.431 9.581 8.150 -0.000 0.000 0.508 228 V N 3.692 123.592 119.914 -0.022 0.000 2.349 228 V HA 0.268 4.389 4.120 0.001 0.000 0.284 228 V C 0.186 176.219 176.094 -0.102 0.000 1.014 228 V CA -0.582 61.630 62.300 -0.148 0.000 0.826 228 V CB 1.115 32.687 31.823 -0.418 0.000 1.009 228 V HN 0.903 9.093 8.190 -0.000 0.000 0.431 229 K N 5.722 126.104 120.400 -0.031 0.000 2.284 229 K HA 0.507 4.828 4.320 0.001 0.000 0.287 229 K C -0.664 175.929 176.600 -0.011 0.000 1.081 229 K CA -0.403 55.864 56.287 -0.033 0.000 0.910 229 K CB 0.514 32.962 32.500 -0.087 0.000 1.088 229 K HN 0.629 8.879 8.250 -0.000 0.000 0.478 230 I N 5.856 126.397 120.570 -0.047 0.000 2.312 230 I HA 0.174 4.345 4.170 0.001 0.000 0.291 230 I C -0.196 176.010 176.117 0.148 0.000 1.031 230 I CA -0.641 60.693 61.300 0.056 0.000 1.293 230 I CB 0.430 38.421 38.000 -0.014 0.000 1.403 230 I HN 0.445 8.655 8.210 -0.000 0.000 0.484 231 F N 3.958 124.009 119.950 0.169 0.000 2.389 231 F HA 0.225 4.752 4.527 0.001 0.000 0.337 231 F C 1.238 177.105 175.800 0.111 0.000 1.112 231 F CA -0.176 57.930 58.000 0.176 0.000 1.192 231 F CB 1.216 40.332 39.000 0.192 0.000 1.185 231 F HN 0.476 8.776 8.300 -0.000 0.000 0.552 232 S N 0.355 116.215 115.700 0.268 0.000 2.632 232 S HA 0.156 4.627 4.470 0.001 0.000 0.267 232 S C 0.867 175.563 174.600 0.160 0.000 1.276 232 S CA -0.549 57.745 58.200 0.157 0.000 0.998 232 S CB 1.357 64.609 63.200 0.087 0.000 0.953 232 S HN 0.615 8.925 8.310 -0.000 0.000 0.547 233 S N 1.355 117.111 115.700 0.094 0.000 2.400 233 S HA -0.100 4.371 4.470 0.001 0.000 0.232 233 S C 2.399 177.044 174.600 0.075 0.000 1.025 233 S CA 1.324 59.563 58.200 0.065 0.000 0.993 233 S CB -0.897 62.325 63.200 0.037 0.000 0.808 233 S HN 0.928 9.238 8.310 -0.000 0.000 0.478 234 R N 1.012 121.562 120.500 0.083 0.000 2.316 234 R HA 0.078 4.419 4.340 0.001 0.000 0.202 234 R C 1.259 177.633 176.300 0.124 0.000 1.029 234 R CA 1.472 57.623 56.100 0.084 0.000 1.018 234 R CB -0.780 29.561 30.300 0.070 0.000 0.888 234 R HN 0.372 8.642 8.270 -0.000 0.000 0.471 235 D N -1.056 119.455 120.400 0.184 0.000 2.599 235 D HA 0.117 4.758 4.640 0.001 0.000 0.249 235 D C 0.801 177.276 176.300 0.291 0.000 1.313 235 D CA -0.190 53.971 54.000 0.268 0.000 0.815 235 D CB 0.169 41.194 40.800 0.375 0.000 1.077 235 D HN 0.574 8.944 8.370 -0.000 0.000 0.492 236 E N -0.139 120.169 120.200 0.180 0.000 2.171 236 E HA -0.258 4.093 4.350 0.001 0.000 0.197 236 E C 1.492 178.202 176.600 0.183 0.000 0.997 236 E CA 0.886 57.361 56.400 0.123 0.000 0.810 236 E CB 0.168 29.896 29.700 0.046 0.000 0.738 236 E HN 0.339 8.699 8.360 -0.000 0.000 0.467 237 Q N -0.023 119.872 119.800 0.158 0.000 2.297 237 Q HA -0.069 4.272 4.340 0.001 0.000 0.204 237 Q C 1.957 178.068 176.000 0.184 0.000 0.962 237 Q CA 0.913 56.817 55.803 0.168 0.000 0.879 237 Q CB 0.232 29.032 28.738 0.103 0.000 0.947 237 Q HN 0.053 8.323 8.270 -0.000 0.000 0.462 238 S N -0.351 115.458 115.700 0.182 0.000 2.368 238 S HA -0.156 4.315 4.470 0.001 0.000 0.224 238 S C 1.037 175.660 174.600 0.039 0.000 1.029 238 S CA 1.023 59.332 58.200 0.182 0.000 0.988 238 S CB -0.408 63.012 63.200 0.367 0.000 0.838 238 S HN 0.648 8.958 8.310 -0.000 0.000 0.462 239 W N 1.541 122.537 121.300 -0.507 0.000 2.338 239 W HA -0.189 4.472 4.660 0.002 0.000 0.304 239 W C 1.794 178.165 176.519 -0.247 0.000 1.212 239 W CA 1.218 58.045 57.345 -0.863 0.000 1.264 239 W CB -0.543 28.194 29.460 -1.205 0.000 1.142 239 W HN 0.267 8.447 8.180 -0.000 0.000 0.512 240 F N 1.707 121.571 119.950 -0.143 0.000 2.102 240 F HA -0.155 4.373 4.527 0.002 0.000 0.298 240 F C 2.604 178.201 175.800 -0.338 0.000 1.105 240 F CA 2.451 60.268 58.000 -0.305 0.000 1.239 240 F CB -0.896 38.107 39.000 0.006 0.000 0.991 240 F HN -0.195 8.105 8.300 -0.000 0.000 0.474 241 R N 0.855 121.257 120.500 -0.162 0.000 2.081 241 R HA -0.169 4.172 4.340 0.001 0.000 0.235 241 R C 2.226 178.321 176.300 -0.342 0.000 1.131 241 R CA 2.056 58.007 56.100 -0.249 0.000 0.960 241 R CB -0.828 29.416 30.300 -0.094 0.000 0.856 241 R HN 0.496 8.766 8.270 -0.000 0.000 0.436 242 E N -1.460 118.567 120.200 -0.288 0.000 2.107 242 E HA -0.100 4.251 4.350 0.001 0.000 0.191 242 E C 1.324 177.733 176.600 -0.319 0.000 0.982 242 E CA 1.508 57.760 56.400 -0.247 0.000 0.809 242 E CB 0.089 29.784 29.700 -0.008 0.000 0.756 242 E HN 0.340 8.700 8.360 -0.000 0.000 0.459 243 T N 0.313 114.543 114.554 -0.540 0.000 2.777 243 T HA -0.181 4.170 4.350 0.001 0.000 0.266 243 T C 1.989 176.349 174.700 -0.567 0.000 1.040 243 T CA 1.717 63.446 62.100 -0.618 0.000 1.141 243 T CB -0.435 67.814 68.868 -1.031 0.000 0.868 243 T HN 0.456 8.696 8.240 -0.000 0.000 0.444 244 E N 1.365 121.173 120.200 -0.653 0.000 2.023 244 E HA -0.116 4.235 4.350 0.001 0.000 0.196 244 E C 2.053 178.402 176.600 -0.417 0.000 1.003 244 E CA 1.526 57.592 56.400 -0.556 0.000 0.809 244 E CB -1.028 28.295 29.700 -0.627 0.000 0.755 244 E HN 0.635 8.995 8.360 -0.000 0.000 0.449 245 I N -0.872 119.445 120.570 -0.421 0.000 2.208 245 I HA -0.224 3.947 4.170 0.001 0.000 0.245 245 I C 2.663 178.539 176.117 -0.400 0.000 1.097 245 I CA 1.525 62.588 61.300 -0.396 0.000 1.363 245 I CB -0.251 37.481 38.000 -0.446 0.000 1.051 245 I HN 0.303 8.513 8.210 -0.000 0.000 0.413 246 Y N 0.794 120.789 120.300 -0.507 0.000 2.293 246 Y HA -0.171 4.379 4.550 0.001 0.000 0.291 246 Y C 2.212 177.725 175.900 -0.644 0.000 1.137 246 Y CA 1.429 59.101 58.100 -0.713 0.000 1.202 246 Y CB -0.723 36.902 38.460 -1.392 0.000 0.990 246 Y HN 0.244 8.524 8.280 -0.000 0.000 0.537 247 N N -1.884 116.588 118.700 -0.380 0.000 2.446 247 N HA -0.068 4.673 4.740 0.001 0.000 0.179 247 N C 1.246 176.665 175.510 -0.152 0.000 1.054 247 N CA 1.116 54.035 53.050 -0.218 0.000 0.905 247 N CB 0.164 38.536 38.487 -0.191 0.000 0.973 247 N HN 0.125 8.505 8.380 -0.000 0.000 0.448 248 T N -0.636 113.808 114.554 -0.183 0.000 2.978 248 T HA 0.199 4.550 4.350 0.001 0.000 0.248 248 T C 0.141 174.763 174.700 -0.130 0.000 1.018 248 T CA 0.147 62.156 62.100 -0.152 0.000 1.026 248 T CB 0.890 69.646 68.868 -0.187 0.000 1.032 248 T HN -0.198 8.042 8.240 -0.000 0.000 0.485 249 V N 2.653 122.483 119.914 -0.141 0.000 2.448 249 V HA 0.468 4.589 4.120 0.001 0.000 0.295 249 V C -0.569 175.487 176.094 -0.064 0.000 1.025 249 V CA -1.041 61.186 62.300 -0.121 0.000 0.859 249 V CB 1.820 33.545 31.823 -0.164 0.000 0.988 249 V HN 0.230 8.420 8.190 -0.000 0.000 0.431 250 L N 5.395 126.597 121.223 -0.035 0.000 2.536 250 L HA 0.214 4.555 4.340 0.001 0.000 0.282 250 L C 0.543 177.451 176.870 0.063 0.000 1.147 250 L CA 0.735 55.587 54.840 0.021 0.000 0.936 250 L CB 0.177 42.251 42.059 0.025 0.000 1.279 250 L HN 0.639 8.869 8.230 -0.000 0.000 0.461 251 L N 3.271 124.558 121.223 0.107 0.000 2.781 251 L HA 0.324 4.665 4.340 0.001 0.000 0.245 251 L C 1.062 178.103 176.870 0.286 0.000 1.118 251 L CA 0.164 55.117 54.840 0.188 0.000 0.918 251 L CB -0.313 41.803 42.059 0.094 0.000 1.246 251 L HN 0.580 8.810 8.230 -0.000 0.000 0.526 252 R N 0.874 121.502 120.500 0.214 0.000 2.523 252 R HA -0.023 4.318 4.340 0.001 0.000 0.281 252 R C -0.801 175.607 176.300 0.179 0.000 0.969 252 R CA 0.722 56.935 56.100 0.188 0.000 1.093 252 R CB -0.070 30.314 30.300 0.140 0.000 0.917 252 R HN 0.300 8.570 8.270 -0.000 0.000 0.408 253 H N 2.791 121.863 119.070 0.003 0.000 3.139 253 H HA 0.001 4.558 4.556 0.001 0.000 0.325 253 H C -0.366 174.944 175.328 -0.031 0.000 1.146 253 H CA -0.637 55.331 56.048 -0.133 0.000 1.351 253 H CB 1.450 30.936 29.762 -0.460 0.000 2.005 253 H HN 0.721 9.001 8.280 -0.000 0.000 0.517 254 D N 2.421 122.602 120.400 -0.365 0.000 2.203 254 D HA -0.154 4.487 4.640 0.001 0.000 0.199 254 D C 0.423 176.728 176.300 0.009 0.000 0.997 254 D CA 1.493 55.400 54.000 -0.154 0.000 0.863 254 D CB 0.155 40.821 40.800 -0.223 0.000 0.928 254 D HN 0.533 8.903 8.370 -0.000 0.000 0.458 255 N N -0.676 118.127 118.700 0.173 0.000 2.320 255 N HA 0.266 5.007 4.740 0.001 0.000 0.237 255 N C -0.398 175.259 175.510 0.245 0.000 1.129 255 N CA -0.045 53.142 53.050 0.229 0.000 0.854 255 N CB 1.036 39.685 38.487 0.270 0.000 1.083 255 N HN 0.094 8.474 8.380 -0.000 0.000 0.504 256 I N 0.808 121.525 120.570 0.244 0.000 2.619 256 I HA 0.194 4.365 4.170 0.001 0.000 0.292 256 I C -0.886 175.379 176.117 0.247 0.000 1.100 256 I CA -1.194 60.252 61.300 0.243 0.000 1.043 256 I CB 2.288 40.446 38.000 0.264 0.000 1.239 256 I HN -0.068 8.142 8.210 -0.000 0.000 0.420 257 L N 5.574 126.954 121.223 0.261 0.000 2.559 257 L HA 0.289 4.630 4.340 0.001 0.000 0.274 257 L C 0.735 177.714 176.870 0.181 0.000 1.205 257 L CA 0.542 55.535 54.840 0.255 0.000 0.907 257 L CB 0.366 42.575 42.059 0.250 0.000 1.153 257 L HN 0.684 8.914 8.230 -0.000 0.000 0.490 258 G N 4.911 113.729 108.800 0.030 0.000 2.365 258 G HA2 0.168 4.129 3.960 0.001 0.000 0.249 258 G HA3 0.168 4.129 3.960 0.001 0.000 0.249 258 G C -0.794 173.821 174.900 -0.476 0.000 1.288 258 G CA -0.440 44.457 45.100 -0.337 0.000 0.887 258 G HN 0.660 8.950 8.290 -0.000 0.000 0.524 259 F N 2.921 122.532 119.950 -0.565 0.000 2.404 259 F HA 0.557 5.085 4.527 0.001 0.000 0.339 259 F C 0.812 176.351 175.800 -0.435 0.000 1.105 259 F CA -0.927 56.670 58.000 -0.672 0.000 1.087 259 F CB 1.111 39.546 39.000 -0.942 0.000 1.143 259 F HN 0.308 8.608 8.300 -0.000 0.000 0.491 260 I N 3.645 123.559 120.570 -1.094 0.000 3.443 260 I HA 0.421 4.592 4.170 0.001 0.000 0.277 260 I C 0.379 175.823 176.117 -1.122 0.000 1.169 260 I CA 0.082 60.863 61.300 -0.865 0.000 1.419 260 I CB 0.352 38.007 38.000 -0.574 0.000 1.331 260 I HN 0.642 8.852 8.210 -0.000 0.000 0.458 261 A N -0.196 121.854 122.820 -1.283 0.000 2.601 261 A HA 0.708 5.029 4.320 0.001 0.000 0.291 261 A C -1.162 176.221 177.584 -0.335 0.000 1.075 261 A CA -0.333 51.252 52.037 -0.753 0.000 0.671 261 A CB 1.777 20.545 19.000 -0.387 0.000 1.277 261 A HN -0.048 8.102 8.150 -0.000 0.000 0.417 262 S N -0.860 114.889 115.700 0.082 0.000 2.571 262 S HA 0.745 5.216 4.470 0.001 0.000 0.284 262 S C -0.788 174.006 174.600 0.323 0.000 1.128 262 S CA 0.730 59.124 58.200 0.323 0.000 0.970 262 S CB 1.235 64.621 63.200 0.311 0.000 1.039 262 S HN 1.862 10.171 8.310 -0.000 0.000 0.485 263 D N 1.031 121.689 120.400 0.430 0.000 2.570 263 D HA 0.805 5.446 4.640 0.001 0.000 0.244 263 D C 0.076 176.470 176.300 0.157 0.000 1.178 263 D CA -0.037 54.101 54.000 0.230 0.000 0.881 263 D CB 1.372 42.185 40.800 0.023 0.000 1.453 263 D HN 1.024 9.394 8.370 -0.000 0.000 0.447 272 Q N 1.578 121.320 119.800 -0.096 0.000 2.193 272 Q HA 0.920 5.261 4.340 0.001 0.000 0.246 272 Q C -0.345 175.582 176.000 -0.122 0.000 0.959 272 Q CA -0.728 55.074 55.803 -0.001 0.000 0.904 272 Q CB 0.740 29.625 28.738 0.245 0.000 1.238 272 Q HN 0.899 9.169 8.270 -0.000 0.000 0.469 273 L N 0.908 122.077 121.223 -0.089 0.000 2.287 273 L HA 0.614 4.955 4.340 0.001 0.000 0.287 273 L C -1.121 175.909 176.870 0.266 0.000 1.022 273 L CA -0.812 53.784 54.840 -0.407 0.000 0.814 273 L CB 1.141 42.501 42.059 -1.164 0.000 1.217 273 L HN 0.761 8.991 8.230 -0.000 0.000 0.420 274 W N 4.223 125.559 121.300 0.060 0.000 2.627 274 W HA 0.612 5.273 4.660 0.001 0.000 0.339 274 W C -0.761 176.085 176.519 0.545 0.000 1.058 274 W CA -0.983 56.541 57.345 0.298 0.000 1.223 274 W CB 1.700 31.245 29.460 0.141 0.000 1.389 274 W HN 0.117 8.297 8.180 -0.000 0.000 0.541 275 L N 4.419 126.063 121.223 0.701 0.000 2.376 275 L HA 0.639 4.980 4.340 0.001 0.000 0.275 275 L C -1.280 175.730 176.870 0.232 0.000 0.987 275 L CA -0.536 54.616 54.840 0.520 0.000 0.828 275 L CB 0.896 43.357 42.059 0.669 0.000 1.249 275 L HN 0.313 8.543 8.230 -0.000 0.000 0.409 276 I N 4.669 125.269 120.570 0.051 0.000 2.354 276 I HA 0.661 4.832 4.170 0.001 0.000 0.292 276 I C 0.284 176.258 176.117 -0.239 0.000 0.989 276 I CA -0.105 61.135 61.300 -0.099 0.000 1.188 276 I CB 1.931 39.834 38.000 -0.161 0.000 1.342 276 I HN 0.791 9.001 8.210 -0.000 0.000 0.457 277 T N 0.494 114.955 114.554 -0.154 0.000 2.804 277 T HA 0.459 4.810 4.350 0.001 0.000 0.290 277 T C -0.252 174.401 174.700 -0.078 0.000 1.099 277 T CA -0.890 61.096 62.100 -0.190 0.000 1.011 277 T CB 0.785 69.596 68.868 -0.095 0.000 1.291 277 T HN 0.501 8.741 8.240 -0.000 0.000 0.523 278 H N -0.472 118.533 119.070 -0.107 0.000 2.948 278 H HA 0.237 4.794 4.556 0.001 0.000 0.351 278 H C -1.043 174.158 175.328 -0.212 0.000 1.079 278 H CA -0.126 55.829 56.048 -0.156 0.000 1.407 278 H CB 0.285 29.932 29.762 -0.192 0.000 1.373 278 H HN 0.539 8.819 8.280 -0.000 0.000 0.605 279 Y N 1.670 121.827 120.300 -0.239 0.000 2.360 279 Y HA 0.230 4.781 4.550 0.001 0.000 0.337 279 Y C -0.856 174.785 175.900 -0.432 0.000 1.039 279 Y CA -0.909 57.045 58.100 -0.242 0.000 1.109 279 Y CB 0.770 39.170 38.460 -0.101 0.000 1.201 279 Y HN 0.626 8.906 8.280 -0.000 0.000 0.458 280 H N 4.416 123.104 119.070 -0.637 0.000 2.646 280 H HA 0.252 4.809 4.556 0.001 0.000 0.328 280 H C 0.526 175.399 175.328 -0.759 0.000 0.998 280 H CA -0.586 55.151 56.048 -0.518 0.000 1.225 280 H CB 1.639 31.248 29.762 -0.254 0.000 1.457 280 H HN 0.796 9.076 8.280 -0.000 0.000 0.505 281 E N 1.568 121.493 120.200 -0.458 0.000 2.085 281 E HA -0.211 4.139 4.350 0.001 0.000 0.194 281 E C 0.791 177.326 176.600 -0.108 0.000 0.994 281 E CA 1.139 57.370 56.400 -0.281 0.000 0.801 281 E CB 0.057 29.680 29.700 -0.127 0.000 0.743 281 E HN 0.733 9.093 8.360 -0.000 0.000 0.453 282 H N -0.268 118.770 119.070 -0.054 0.000 2.518 282 H HA -0.016 4.541 4.556 0.001 0.000 0.289 282 H C 1.262 176.597 175.328 0.012 0.000 1.051 282 H CA 0.021 56.082 56.048 0.022 0.000 1.280 282 H CB 0.116 29.874 29.762 -0.007 0.000 1.380 282 H HN 0.276 8.556 8.280 -0.000 0.000 0.566 283 G N 0.164 108.989 108.800 0.040 0.000 2.553 283 G HA2 -0.324 3.637 3.960 0.001 0.000 0.242 283 G HA3 -0.324 3.637 3.960 0.001 0.000 0.242 283 G C 0.122 175.035 174.900 0.022 0.000 1.277 283 G CA -0.123 44.985 45.100 0.012 0.000 0.910 283 G HN 0.536 8.826 8.290 -0.000 0.000 0.576 284 S N -0.623 115.099 115.700 0.036 0.000 2.624 284 S HA 0.515 4.985 4.470 0.001 0.000 0.263 284 S C 1.483 176.115 174.600 0.053 0.000 1.287 284 S CA 0.287 58.501 58.200 0.024 0.000 0.990 284 S CB 1.532 64.749 63.200 0.029 0.000 0.950 284 S HN 1.732 10.042 8.310 -0.000 0.000 0.561 285 L N 0.513 121.751 121.223 0.025 0.000 2.083 285 L HA -0.021 4.320 4.340 0.001 0.000 0.209 285 L C 2.121 179.038 176.870 0.078 0.000 1.083 285 L CA 1.745 56.617 54.840 0.053 0.000 0.752 285 L CB -1.383 40.683 42.059 0.011 0.000 0.899 285 L HN 0.864 9.094 8.230 -0.000 0.000 0.433 286 Y N 0.491 120.757 120.300 -0.056 0.000 2.081 286 Y HA -0.318 4.233 4.550 0.001 0.000 0.280 286 Y C 2.346 178.109 175.900 -0.229 0.000 1.163 286 Y CA 2.304 60.311 58.100 -0.154 0.000 1.135 286 Y CB -0.316 38.088 38.460 -0.092 0.000 0.970 286 Y HN 0.330 8.610 8.280 -0.000 0.000 0.498 287 D N -0.469 119.957 120.400 0.045 0.000 2.097 287 D HA -0.227 4.413 4.640 0.001 0.000 0.195 287 D C 2.066 178.317 176.300 -0.081 0.000 0.989 287 D CA 1.673 55.660 54.000 -0.020 0.000 0.827 287 D CB -0.768 40.083 40.800 0.085 0.000 0.966 287 D HN 0.402 8.772 8.370 -0.000 0.000 0.456 288 F N 1.611 121.465 119.950 -0.160 0.000 2.102 288 F HA -0.109 4.419 4.527 0.002 0.000 0.298 288 F C 2.279 177.950 175.800 -0.216 0.000 1.105 288 F CA 1.048 58.940 58.000 -0.180 0.000 1.239 288 F CB -0.347 38.557 39.000 -0.160 0.000 0.991 288 F HN -0.139 8.161 8.300 -0.000 0.000 0.474 289 L N -0.284 120.839 121.223 -0.168 0.000 2.275 289 L HA -0.197 4.144 4.340 0.001 0.000 0.215 289 L C 2.355 178.996 176.870 -0.382 0.000 1.119 289 L CA 1.018 55.707 54.840 -0.252 0.000 0.790 289 L CB -0.677 41.317 42.059 -0.108 0.000 0.919 289 L HN 0.249 8.479 8.230 -0.000 0.000 0.443 290 Q N 0.668 120.146 119.800 -0.537 0.000 2.020 290 Q HA -0.215 4.125 4.340 0.001 0.000 0.202 290 Q C 2.351 178.176 176.000 -0.291 0.000 0.982 290 Q CA 1.922 57.437 55.803 -0.480 0.000 0.838 290 Q CB 0.010 28.459 28.738 -0.482 0.000 0.899 290 Q HN 0.463 8.733 8.270 -0.000 0.000 0.423 291 R N -1.360 118.961 120.500 -0.298 0.000 2.156 291 R HA 0.170 4.511 4.340 0.001 0.000 0.207 291 R C 0.447 176.564 176.300 -0.304 0.000 1.040 291 R CA 0.799 56.749 56.100 -0.250 0.000 1.013 291 R CB -0.166 30.011 30.300 -0.204 0.000 0.931 291 R HN 0.159 8.429 8.270 -0.000 0.000 0.465 292 Q N 1.439 120.957 119.800 -0.470 0.000 2.235 292 Q HA 0.420 4.761 4.340 0.001 0.000 0.256 292 Q C -0.362 175.404 176.000 -0.389 0.000 0.951 292 Q CA -0.346 55.136 55.803 -0.534 0.000 0.890 292 Q CB 1.297 29.399 28.738 -1.059 0.000 1.279 292 Q HN 0.497 8.767 8.270 -0.000 0.000 0.444 293 T N -0.939 113.454 114.554 -0.268 0.000 2.929 293 T HA 0.780 5.131 4.350 0.001 0.000 0.284 293 T C -0.172 174.443 174.700 -0.143 0.000 1.014 293 T CA -0.629 61.363 62.100 -0.179 0.000 1.051 293 T CB 0.474 69.264 68.868 -0.130 0.000 1.028 293 T HN 0.606 8.846 8.240 -0.000 0.000 0.485 294 L N 1.966 123.133 121.223 -0.094 0.000 2.325 294 L HA 0.496 4.837 4.340 0.001 0.000 0.281 294 L C 0.511 177.367 176.870 -0.024 0.000 1.004 294 L CA -1.059 53.758 54.840 -0.039 0.000 0.823 294 L CB 1.575 43.626 42.059 -0.014 0.000 1.236 294 L HN 0.834 9.064 8.230 -0.000 0.000 0.415 295 E N 5.141 125.343 120.200 0.005 0.000 2.415 295 E HA 0.049 4.400 4.350 0.001 0.000 0.262 295 E C -1.787 174.832 176.600 0.033 0.000 1.038 295 E CA -1.227 55.187 56.400 0.023 0.000 0.921 295 E CB 1.156 30.887 29.700 0.052 0.000 0.950 295 E HN 0.331 8.691 8.360 -0.000 0.000 0.438 296 P HA -0.200 4.220 4.420 -0.000 0.000 0.216 296 P C 0.879 178.206 177.300 0.044 0.000 1.153 296 P CA 1.787 64.900 63.100 0.022 0.000 0.858 296 P CB -0.065 31.648 31.700 0.021 0.000 0.789 297 H N -0.590 118.477 119.070 -0.005 0.000 2.352 297 H HA -0.149 4.408 4.556 0.001 0.000 0.299 297 H C 1.759 177.091 175.328 0.008 0.000 1.097 297 H CA 1.492 57.541 56.048 0.001 0.000 1.311 297 H CB -0.863 28.901 29.762 0.002 0.000 1.377 297 H HN -0.070 8.210 8.280 -0.000 0.000 0.504 298 L N 0.438 121.648 121.223 -0.021 0.000 2.072 298 L HA 0.094 4.435 4.340 0.001 0.000 0.205 298 L C 2.450 179.281 176.870 -0.064 0.000 1.079 298 L CA 1.911 56.718 54.840 -0.056 0.000 0.752 298 L CB -1.479 40.623 42.059 0.071 0.000 0.906 298 L HN 0.395 8.625 8.230 -0.000 0.000 0.436 299 A N -0.368 122.432 122.820 -0.033 0.000 1.908 299 A HA -0.235 4.086 4.320 0.001 0.000 0.218 299 A C 2.264 179.816 177.584 -0.054 0.000 1.181 299 A CA 2.113 54.130 52.037 -0.033 0.000 0.627 299 A CB -1.061 17.918 19.000 -0.035 0.000 0.818 299 A HN 0.493 8.643 8.150 -0.000 0.000 0.445 300 L N -0.347 120.828 121.223 -0.080 0.000 2.093 300 L HA -0.057 4.284 4.340 0.001 0.000 0.208 300 L C 2.425 179.237 176.870 -0.097 0.000 1.085 300 L CA 2.242 57.036 54.840 -0.078 0.000 0.755 300 L CB -0.581 41.429 42.059 -0.082 0.000 0.904 300 L HN 0.491 8.721 8.230 -0.000 0.000 0.435 301 R N -0.830 119.565 120.500 -0.176 0.000 2.075 301 R HA -0.124 4.216 4.340 0.001 0.000 0.232 301 R C 2.265 178.517 176.300 -0.081 0.000 1.126 301 R CA 1.667 57.670 56.100 -0.161 0.000 0.963 301 R CB -0.323 29.835 30.300 -0.237 0.000 0.858 301 R HN 0.415 8.685 8.270 -0.000 0.000 0.435 302 L N 0.239 121.420 121.223 -0.071 0.000 2.046 302 L HA -0.124 4.217 4.340 0.001 0.000 0.208 302 L C 2.723 179.594 176.870 0.002 0.000 1.077 302 L CA 1.353 56.165 54.840 -0.047 0.000 0.747 302 L CB -0.542 41.491 42.059 -0.043 0.000 0.896 302 L HN 0.349 8.579 8.230 -0.000 0.000 0.432 303 A N -0.732 122.093 122.820 0.008 0.000 1.902 303 A HA -0.181 4.140 4.320 0.001 0.000 0.217 303 A C 2.388 180.054 177.584 0.137 0.000 1.181 303 A CA 1.856 53.930 52.037 0.061 0.000 0.623 303 A CB -0.894 18.128 19.000 0.037 0.000 0.818 303 A HN 0.214 8.364 8.150 -0.000 0.000 0.443 304 V N 0.821 120.776 119.914 0.069 0.000 2.358 304 V HA -0.190 3.931 4.120 0.001 0.000 0.246 304 V C 2.840 178.984 176.094 0.084 0.000 1.047 304 V CA 2.886 65.227 62.300 0.070 0.000 1.035 304 V CB -0.474 31.363 31.823 0.023 0.000 0.658 304 V HN 0.786 8.976 8.190 -0.000 0.000 0.452 305 S N 0.704 116.443 115.700 0.065 0.000 2.383 305 S HA -0.060 4.410 4.470 0.001 0.000 0.227 305 S C 2.156 176.830 174.600 0.124 0.000 1.026 305 S CA 1.263 59.505 58.200 0.070 0.000 0.981 305 S CB -0.722 62.491 63.200 0.023 0.000 0.818 305 S HN 0.791 9.101 8.310 -0.000 0.000 0.472 306 A N 2.435 125.355 122.820 0.167 0.000 1.883 306 A HA 0.223 4.544 4.320 0.001 0.000 0.217 306 A C 2.561 180.348 177.584 0.339 0.000 1.186 306 A CA 1.907 54.120 52.037 0.293 0.000 0.624 306 A CB -1.550 17.659 19.000 0.349 0.000 0.822 306 A HN 0.867 9.017 8.150 -0.000 0.000 0.444 307 A N -0.931 122.074 122.820 0.309 0.000 1.940 307 A HA -0.178 4.143 4.320 0.001 0.000 0.219 307 A C 2.296 179.861 177.584 -0.032 0.000 1.176 307 A CA 1.745 53.794 52.037 0.020 0.000 0.631 307 A CB -1.281 17.714 19.000 -0.007 0.000 0.814 307 A HN 0.639 8.789 8.150 -0.000 0.000 0.446 308 C N -1.074 118.261 119.300 0.057 0.000 2.432 308 C HA 0.029 4.489 4.460 0.001 0.000 0.277 308 C C 3.014 178.032 174.990 0.046 0.000 1.249 308 C CA 0.427 59.489 59.018 0.073 0.000 1.725 308 C CB -1.691 26.140 27.740 0.152 0.000 2.028 308 C HN 0.692 8.921 8.230 -0.000 0.000 0.477 309 G N 0.479 109.337 108.800 0.096 0.000 2.491 309 G HA2 -0.250 3.711 3.960 0.001 0.000 0.218 309 G HA3 -0.250 3.711 3.960 0.001 0.000 0.218 309 G C 1.512 176.429 174.900 0.029 0.000 1.180 309 G CA 1.164 46.317 45.100 0.089 0.000 0.774 309 G HN 0.436 8.726 8.290 -0.000 0.000 0.562 310 L N 1.288 122.486 121.223 -0.041 0.000 2.093 310 L HA 0.179 4.520 4.340 0.001 0.000 0.208 310 L C 3.129 179.797 176.870 -0.337 0.000 1.085 310 L CA 1.982 56.670 54.840 -0.252 0.000 0.755 310 L CB -0.680 41.072 42.059 -0.511 0.000 0.904 310 L HN 0.263 8.493 8.230 -0.000 0.000 0.435 311 A N -1.635 121.045 122.820 -0.233 0.000 1.902 311 A HA -0.289 4.032 4.320 0.001 0.000 0.217 311 A C 2.401 179.956 177.584 -0.048 0.000 1.181 311 A CA 1.767 53.719 52.037 -0.141 0.000 0.623 311 A CB -1.051 17.898 19.000 -0.085 0.000 0.818 311 A HN 0.696 8.846 8.150 -0.000 0.000 0.443 312 H N -0.167 118.799 119.070 -0.173 0.000 2.353 312 H HA -0.042 4.515 4.556 0.001 0.000 0.300 312 H C 1.943 177.209 175.328 -0.104 0.000 1.090 312 H CA 1.648 57.569 56.048 -0.212 0.000 1.327 312 H CB -0.106 29.326 29.762 -0.550 0.000 1.383 312 H HN 0.421 8.701 8.280 -0.000 0.000 0.508 313 L N -0.182 120.991 121.223 -0.084 0.000 1.994 313 L HA -0.226 4.115 4.340 0.001 0.000 0.208 313 L C 2.671 179.589 176.870 0.079 0.000 1.071 313 L CA 1.531 56.359 54.840 -0.019 0.000 0.745 313 L CB -0.685 41.447 42.059 0.122 0.000 0.892 313 L HN 0.456 8.686 8.230 -0.000 0.000 0.431 314 H N -1.746 117.292 119.070 -0.053 0.000 2.389 314 H HA -0.018 4.539 4.556 0.001 0.000 0.299 314 H C 0.706 176.037 175.328 0.004 0.000 1.081 314 H CA 0.151 56.201 56.048 0.002 0.000 1.345 314 H CB 0.396 30.136 29.762 -0.038 0.000 1.393 314 H HN 0.038 8.318 8.280 -0.000 0.000 0.520 315 V N 2.400 122.353 119.914 0.065 0.000 2.461 315 V HA 0.003 4.124 4.120 0.001 0.000 0.275 315 V C -0.002 176.039 176.094 -0.089 0.000 1.047 315 V CA -0.318 61.991 62.300 0.016 0.000 0.955 315 V CB 1.199 33.039 31.823 0.028 0.000 0.988 315 V HN 0.308 8.498 8.190 -0.000 0.000 0.471 316 E N 6.210 126.334 120.200 -0.127 0.000 2.324 316 E HA 0.223 4.574 4.350 0.001 0.000 0.271 316 E C -0.599 175.769 176.600 -0.388 0.000 1.028 316 E CA -0.241 55.954 56.400 -0.342 0.000 0.890 316 E CB 0.644 30.049 29.700 -0.492 0.000 1.004 316 E HN 0.686 9.046 8.360 -0.000 0.000 0.431 317 I N 5.270 125.629 120.570 -0.353 0.000 2.353 317 I HA 0.215 4.385 4.170 0.001 0.000 0.293 317 I C -0.465 175.493 176.117 -0.264 0.000 0.992 317 I CA -0.584 60.608 61.300 -0.180 0.000 1.268 317 I CB 0.672 38.630 38.000 -0.070 0.000 1.387 317 I HN 0.492 8.702 8.210 -0.000 0.000 0.478 318 F N 3.634 123.573 119.950 -0.017 0.000 2.422 318 F HA 0.740 5.268 4.527 0.001 0.000 0.333 318 F C 0.893 176.684 175.800 -0.014 0.000 1.095 318 F CA 0.030 58.017 58.000 -0.022 0.000 1.038 318 F CB 1.769 40.759 39.000 -0.017 0.000 1.156 318 F HN 0.646 8.946 8.300 -0.000 0.000 0.483 319 G N 1.332 110.231 108.800 0.164 0.000 2.483 319 G HA2 -0.167 3.794 3.960 0.001 0.000 0.521 319 G HA3 -0.167 3.794 3.960 0.001 0.000 0.521 319 G C 0.378 175.300 174.900 0.037 0.000 1.278 319 G CA -0.410 44.746 45.100 0.093 0.000 0.965 319 G HN 0.661 8.951 8.290 -0.000 0.000 0.504 320 T N 0.338 114.910 114.554 0.029 0.000 2.570 320 T HA 0.034 4.385 4.350 0.001 0.000 0.266 320 T C 2.304 177.005 174.700 0.003 0.000 1.071 320 T CA 3.955 66.062 62.100 0.012 0.000 1.172 320 T CB -0.598 68.279 68.868 0.015 0.000 0.864 320 T HN 1.729 9.969 8.240 -0.000 0.000 0.421 321 Q N 1.301 121.109 119.800 0.013 0.000 3.135 321 Q HA 0.573 4.914 4.340 0.001 0.000 0.344 321 Q C 0.258 176.263 176.000 0.009 0.000 1.321 321 Q CA -0.039 55.771 55.803 0.012 0.000 1.050 321 Q CB -0.028 28.724 28.738 0.024 0.000 1.498 321 Q HN 0.643 8.913 8.270 -0.000 0.000 0.503 322 G N 0.006 108.795 108.800 -0.018 0.000 3.107 322 G HA2 0.740 4.701 3.960 0.001 0.000 0.232 322 G HA3 0.740 4.701 3.960 0.001 0.000 0.232 322 G C -0.485 174.362 174.900 -0.087 0.000 1.339 322 G CA -0.389 44.682 45.100 -0.047 0.000 1.033 322 G HN 0.600 8.890 8.290 -0.000 0.000 0.567 323 K N 0.068 120.375 120.400 -0.154 0.000 2.569 323 K HA 0.345 4.666 4.320 0.001 0.000 0.259 323 K C -3.175 173.267 176.600 -0.264 0.000 0.932 323 K CA -1.261 54.917 56.287 -0.183 0.000 0.833 323 K CB 3.035 35.442 32.500 -0.156 0.000 1.340 323 K HN 0.338 8.588 8.250 -0.000 0.000 0.429 324 P HA 0.126 4.546 4.420 -0.000 0.000 0.274 324 P C -0.631 176.498 177.300 -0.285 0.000 1.256 324 P CA -0.382 62.531 63.100 -0.311 0.000 0.795 324 P CB 0.613 32.137 31.700 -0.293 0.000 1.038 325 A N 1.386 124.020 122.820 -0.310 0.000 2.450 325 A HA 0.446 4.767 4.320 0.001 0.000 0.255 325 A C 0.207 177.739 177.584 -0.087 0.000 1.096 325 A CA -0.165 51.765 52.037 -0.178 0.000 0.778 325 A CB -0.811 18.093 19.000 -0.160 0.000 1.031 325 A HN 0.433 8.583 8.150 -0.000 0.000 0.494 326 I N 1.574 122.213 120.570 0.116 0.000 2.498 326 I HA 0.555 4.726 4.170 0.001 0.000 0.290 326 I C 0.349 176.612 176.117 0.243 0.000 1.032 326 I CA -0.337 61.054 61.300 0.151 0.000 1.073 326 I CB 2.154 40.155 38.000 0.001 0.000 1.251 326 I HN 0.679 8.889 8.210 -0.000 0.000 0.426 327 A N 4.148 127.078 122.820 0.184 0.000 2.317 327 A HA 0.405 4.726 4.320 0.001 0.000 0.327 327 A C 0.430 178.080 177.584 0.111 0.000 1.178 327 A CA -0.424 51.636 52.037 0.038 0.000 0.817 327 A CB 0.686 19.538 19.000 -0.248 0.000 1.189 327 A HN 0.898 9.048 8.150 -0.000 0.000 0.489 328 H N 2.112 121.265 119.070 0.137 0.000 2.317 328 H HA -0.021 4.536 4.556 0.001 0.000 0.304 328 H C 1.960 177.352 175.328 0.108 0.000 1.067 328 H CA 2.934 59.067 56.048 0.141 0.000 1.352 328 H CB 0.308 30.224 29.762 0.257 0.000 1.398 328 H HN 1.280 9.560 8.280 -0.000 0.000 0.510 329 R N 0.239 120.941 120.500 0.337 0.000 3.785 329 R HA -0.187 4.153 4.340 0.001 0.000 0.476 329 R C 0.506 176.990 176.300 0.307 0.000 0.905 329 R CA 1.813 58.063 56.100 0.250 0.000 1.412 329 R CB -2.926 27.423 30.300 0.081 0.000 2.077 329 R HN 0.521 8.791 8.270 -0.000 0.000 0.504 330 D N -1.730 118.971 120.400 0.503 0.000 2.997 330 D HA 0.362 5.003 4.640 0.001 0.000 0.362 330 D C -0.847 175.586 176.300 0.221 0.000 1.298 330 D CA -0.533 53.679 54.000 0.353 0.000 0.756 330 D CB -0.406 40.545 40.800 0.252 0.000 1.216 330 D HN 0.440 8.810 8.370 -0.000 0.000 0.496 331 F N 2.627 122.568 119.950 -0.015 0.000 2.472 331 F HA 0.318 4.846 4.527 0.001 0.000 0.364 331 F C 0.406 176.069 175.800 -0.230 0.000 1.090 331 F CA 0.241 58.075 58.000 -0.275 0.000 1.188 331 F CB 0.190 39.127 39.000 -0.105 0.000 1.105 331 F HN 0.005 8.305 8.300 -0.000 0.000 0.536 332 K N 1.676 121.576 120.400 -0.834 0.000 2.578 332 K HA 0.348 4.669 4.320 0.001 0.000 0.287 332 K C 0.063 176.283 176.600 -0.633 0.000 1.010 332 K CA -0.269 55.488 56.287 -0.884 0.000 0.889 332 K CB 1.133 32.897 32.500 -1.226 0.000 1.514 332 K HN 0.349 8.599 8.250 -0.000 0.000 0.424 333 S N 0.042 115.581 115.700 -0.268 0.000 2.423 333 S HA -0.099 4.372 4.470 0.001 0.000 0.231 333 S C 1.617 176.167 174.600 -0.084 0.000 1.014 333 S CA 0.564 58.719 58.200 -0.076 0.000 0.965 333 S CB -0.392 62.934 63.200 0.211 0.000 0.785 333 S HN 0.594 8.904 8.310 -0.000 0.000 0.495 334 R N 1.266 121.684 120.500 -0.137 0.000 2.189 334 R HA 0.180 4.521 4.340 0.001 0.000 0.218 334 R C 0.558 176.751 176.300 -0.179 0.000 1.074 334 R CA 0.716 56.729 56.100 -0.145 0.000 0.991 334 R CB -0.160 30.011 30.300 -0.216 0.000 0.883 334 R HN 0.356 8.626 8.270 -0.000 0.000 0.457 335 N N -0.030 118.517 118.700 -0.255 0.000 2.279 335 N HA 0.083 4.824 4.740 0.001 0.000 0.226 335 N C -1.093 174.283 175.510 -0.223 0.000 1.126 335 N CA 0.202 53.125 53.050 -0.213 0.000 0.846 335 N CB 1.238 39.609 38.487 -0.193 0.000 1.050 335 N HN -0.126 8.254 8.380 -0.000 0.000 0.502 336 V N 1.511 121.292 119.914 -0.222 0.000 2.531 336 V HA 0.431 4.552 4.120 0.001 0.000 0.301 336 V C 0.018 176.055 176.094 -0.095 0.000 1.034 336 V CA -0.769 61.435 62.300 -0.160 0.000 0.865 336 V CB 2.272 33.971 31.823 -0.208 0.000 0.995 336 V HN -0.026 8.164 8.190 -0.000 0.000 0.424 337 L N 4.335 125.513 121.223 -0.076 0.000 2.375 337 L HA 0.656 4.997 4.340 0.001 0.000 0.268 337 L C -0.423 176.339 176.870 -0.180 0.000 1.058 337 L CA -0.739 54.044 54.840 -0.095 0.000 0.803 337 L CB 1.969 44.001 42.059 -0.046 0.000 1.212 337 L HN 0.362 8.592 8.230 -0.000 0.000 0.451 338 V N 2.013 121.806 119.914 -0.202 0.000 2.357 338 V HA 0.319 4.440 4.120 0.001 0.000 0.284 338 V C 0.071 176.012 176.094 -0.256 0.000 1.018 338 V CA -0.916 61.208 62.300 -0.294 0.000 0.841 338 V CB 1.253 32.766 31.823 -0.516 0.000 0.991 338 V HN 0.644 8.834 8.190 -0.000 0.000 0.437 339 K N 2.269 122.479 120.400 -0.316 0.000 2.118 339 K HA 0.331 4.652 4.320 0.001 0.000 0.240 339 K C 1.353 177.894 176.600 -0.097 0.000 1.035 339 K CA -0.292 55.833 56.287 -0.271 0.000 0.899 339 K CB 0.471 32.804 32.500 -0.278 0.000 1.085 339 K HN 0.572 8.822 8.250 -0.000 0.000 0.498 340 S N 1.214 116.872 115.700 -0.071 0.000 2.387 340 S HA -0.176 4.295 4.470 0.001 0.000 0.230 340 S C 1.128 175.731 174.600 0.004 0.000 1.035 340 S CA 1.944 60.106 58.200 -0.063 0.000 1.014 340 S CB -0.479 62.695 63.200 -0.043 0.000 0.836 340 S HN 0.683 8.993 8.310 -0.000 0.000 0.466 341 N N 1.781 120.472 118.700 -0.014 0.000 2.362 341 N HA 0.143 4.884 4.740 0.001 0.000 0.211 341 N C 0.114 175.611 175.510 -0.022 0.000 1.170 341 N CA -0.012 53.035 53.050 -0.004 0.000 0.828 341 N CB -1.016 37.465 38.487 -0.009 0.000 1.034 341 N HN 0.363 8.743 8.380 -0.000 0.000 0.475 342 L N -3.012 118.184 121.223 -0.045 0.000 3.737 342 L HA -0.315 4.026 4.340 0.001 0.000 0.418 342 L C 0.373 177.160 176.870 -0.139 0.000 1.216 342 L CA 0.973 55.737 54.840 -0.127 0.000 0.915 342 L CB -2.759 39.263 42.059 -0.061 0.000 1.834 342 L HN 0.634 8.864 8.230 -0.000 0.000 0.943 343 Q N -0.862 118.862 119.800 -0.126 0.000 2.301 343 Q HA 0.636 4.977 4.340 0.001 0.000 0.267 343 Q C -0.021 175.895 176.000 -0.140 0.000 1.035 343 Q CA -0.066 55.673 55.803 -0.107 0.000 0.856 343 Q CB 1.875 30.573 28.738 -0.067 0.000 1.337 343 Q HN 0.344 8.614 8.270 -0.000 0.000 0.450 344 C N 1.040 120.284 119.300 -0.094 0.000 2.443 344 C HA 0.842 5.303 4.460 0.001 0.000 0.369 344 C C 0.826 175.787 174.990 -0.049 0.000 1.241 344 C CA -0.426 58.540 59.018 -0.087 0.000 2.413 344 C CB -0.174 27.555 27.740 -0.019 0.000 2.451 344 C HN 1.121 9.351 8.230 -0.000 0.000 0.595 345 C N 1.399 120.665 119.300 -0.057 0.000 2.783 345 C HA 0.728 5.189 4.460 0.001 0.000 0.312 345 C C -0.689 174.344 174.990 0.072 0.000 1.182 345 C CA -0.937 58.102 59.018 0.034 0.000 1.432 345 C CB -0.614 27.145 27.740 0.031 0.000 1.933 345 C HN 0.815 9.045 8.230 -0.000 0.000 0.473 346 I N 2.977 123.636 120.570 0.149 0.000 2.474 346 I HA 0.575 4.746 4.170 0.001 0.000 0.287 346 I C 0.830 177.067 176.117 0.200 0.000 1.048 346 I CA 0.334 61.738 61.300 0.172 0.000 1.383 346 I CB 1.124 39.291 38.000 0.278 0.000 1.412 346 I HN 1.041 9.251 8.210 -0.000 0.000 0.531 347 A N 3.875 126.805 122.820 0.183 0.000 2.437 347 A HA 0.615 4.936 4.320 0.001 0.000 0.288 347 A C -0.523 177.217 177.584 0.259 0.000 1.201 347 A CA -0.399 51.762 52.037 0.206 0.000 0.795 347 A CB 1.179 20.255 19.000 0.128 0.000 1.359 347 A HN 0.772 8.922 8.150 -0.000 0.000 0.435 348 D N -1.575 118.933 120.400 0.179 0.000 3.515 348 D HA -0.104 4.537 4.640 0.001 0.000 0.247 348 D C -0.679 175.575 176.300 -0.076 0.000 1.084 348 D CA 0.351 54.415 54.000 0.107 0.000 1.030 348 D CB -1.036 39.821 40.800 0.096 0.000 0.946 348 D HN 0.305 8.675 8.370 -0.000 0.000 0.420 349 L N 1.893 123.042 121.223 -0.123 0.000 2.653 349 L HA 0.371 4.712 4.340 0.001 0.000 0.232 349 L C 2.470 179.212 176.870 -0.214 0.000 1.169 349 L CA 0.860 55.517 54.840 -0.305 0.000 0.951 349 L CB 0.190 42.013 42.059 -0.393 0.000 1.181 349 L HN 0.487 8.717 8.230 -0.000 0.000 0.460 350 G N -0.673 108.079 108.800 -0.080 0.000 2.448 350 G HA2 -0.173 3.788 3.960 0.001 0.000 0.219 350 G HA3 -0.173 3.788 3.960 0.001 0.000 0.219 350 G C 1.335 176.215 174.900 -0.034 0.000 1.127 350 G CA 0.444 45.545 45.100 0.001 0.000 0.766 350 G HN 0.386 8.676 8.290 -0.000 0.000 0.552 351 L N 0.420 121.597 121.223 -0.077 0.000 2.728 351 L HA 0.418 4.759 4.340 0.001 0.000 0.238 351 L C 1.507 178.301 176.870 -0.127 0.000 1.143 351 L CA -0.544 54.257 54.840 -0.066 0.000 0.937 351 L CB 0.265 42.319 42.059 -0.008 0.000 1.225 351 L HN 0.213 8.443 8.230 -0.000 0.000 0.507 352 A N 0.821 123.534 122.820 -0.179 0.000 2.466 352 A HA 0.394 4.714 4.320 0.001 0.000 0.238 352 A C -0.020 177.468 177.584 -0.160 0.000 1.074 352 A CA 0.040 51.971 52.037 -0.176 0.000 0.774 352 A CB 0.364 19.240 19.000 -0.207 0.000 1.015 352 A HN 0.113 8.263 8.150 -0.000 0.000 0.498 353 V N -0.277 119.559 119.914 -0.131 0.000 3.102 353 V HA 0.923 5.044 4.120 0.001 0.000 0.312 353 V C -0.339 175.790 176.094 0.059 0.000 1.135 353 V CA -1.004 61.228 62.300 -0.113 0.000 1.022 353 V CB 1.647 33.302 31.823 -0.279 0.000 1.056 353 V HN 0.999 9.189 8.190 -0.000 0.000 0.436 354 M N 1.705 121.299 119.600 -0.010 0.000 2.924 354 M HA 0.740 5.221 4.480 0.001 0.000 0.271 354 M C -1.147 174.953 176.300 -0.334 0.000 1.280 354 M CA -0.523 54.672 55.300 -0.174 0.000 0.813 354 M CB 2.456 34.936 32.600 -0.200 0.000 1.658 354 M HN 1.220 9.510 8.290 -0.000 0.000 0.467 355 H N -0.847 117.819 119.070 -0.673 0.000 3.041 355 H HA 0.459 5.016 4.556 0.002 0.000 0.293 355 H C -2.223 172.799 175.328 -0.511 0.000 1.166 355 H CA -0.442 55.258 56.048 -0.580 0.000 1.529 355 H CB 1.193 30.552 29.762 -0.672 0.000 2.050 355 H HN 0.640 8.920 8.280 -0.000 0.000 0.505 356 S N 2.449 117.649 115.700 -0.833 0.000 2.767 356 S HA 0.139 4.610 4.470 0.001 0.000 0.300 356 S C 0.585 174.737 174.600 -0.747 0.000 1.123 356 S CA -0.747 57.067 58.200 -0.643 0.000 0.992 356 S CB 1.724 64.696 63.200 -0.380 0.000 1.138 356 S HN 0.761 9.071 8.310 -0.000 0.000 0.550 357 Q N -0.095 119.494 119.800 -0.352 0.000 2.280 357 Q HA 0.201 4.542 4.340 0.001 0.000 0.202 357 Q C 0.848 176.803 176.000 -0.074 0.000 0.903 357 Q CA 0.025 55.755 55.803 -0.122 0.000 0.948 357 Q CB -0.263 28.550 28.738 0.125 0.000 1.058 357 Q HN 0.887 9.157 8.270 -0.000 0.000 0.493 358 G N -1.177 107.538 108.800 -0.142 0.000 3.104 358 G HA2 0.223 4.184 3.960 0.001 0.000 0.237 358 G HA3 0.223 4.184 3.960 0.001 0.000 0.237 358 G C 0.378 175.228 174.900 -0.084 0.000 1.035 358 G CA 0.505 45.555 45.100 -0.083 0.000 0.844 358 G HN 0.254 8.544 8.290 -0.000 0.000 0.531 359 S N 1.282 116.902 115.700 -0.134 0.000 2.112 359 S HA 0.503 4.974 4.470 0.001 0.000 0.151 359 S C -0.873 173.743 174.600 0.027 0.000 1.723 359 S CA -0.596 57.592 58.200 -0.021 0.000 1.263 359 S CB 0.054 63.241 63.200 -0.022 0.000 1.194 359 S HN 0.019 8.329 8.310 -0.000 0.000 0.419 360 D N 3.179 123.606 120.400 0.045 0.000 2.455 360 D HA 0.486 5.127 4.640 0.001 0.000 0.234 360 D C -0.110 176.458 176.300 0.447 0.000 1.224 360 D CA 0.832 54.917 54.000 0.142 0.000 0.999 360 D CB -0.811 40.061 40.800 0.121 0.000 1.072 360 D HN 0.713 9.083 8.370 -0.000 0.000 0.514 361 Y N -1.663 118.815 120.300 0.296 0.000 2.993 361 Y HA 0.137 4.688 4.550 0.001 0.000 0.413 361 Y C -1.905 174.117 175.900 0.204 0.000 1.115 361 Y CA -1.767 56.477 58.100 0.239 0.000 1.316 361 Y CB 0.092 38.613 38.460 0.100 0.000 1.601 361 Y HN -0.007 8.273 8.280 -0.000 0.000 0.503 362 L N 3.400 124.588 121.223 -0.059 0.000 2.418 362 L HA 0.300 4.641 4.340 0.001 0.000 0.274 362 L C -0.169 176.504 176.870 -0.328 0.000 1.135 362 L CA 0.434 55.206 54.840 -0.113 0.000 0.870 362 L CB 0.332 42.422 42.059 0.052 0.000 1.154 362 L HN 0.596 8.826 8.230 -0.000 0.000 0.462 363 D N 5.082 125.330 120.400 -0.254 0.000 2.312 363 D HA 0.523 5.163 4.640 0.001 0.000 0.252 363 D C -0.490 175.714 176.300 -0.160 0.000 1.150 363 D CA 0.593 54.456 54.000 -0.228 0.000 0.870 363 D CB 0.792 41.468 40.800 -0.207 0.000 1.153 363 D HN 0.585 8.955 8.370 -0.000 0.000 0.457 364 I N 1.774 122.259 120.570 -0.141 0.000 2.690 364 I HA 0.604 4.775 4.170 0.001 0.000 0.286 364 I C 0.818 176.889 176.117 -0.076 0.000 1.313 364 I CA -0.498 60.731 61.300 -0.119 0.000 1.070 364 I CB 1.064 38.994 38.000 -0.116 0.000 1.323 364 I HN 0.504 8.714 8.210 -0.000 0.000 0.432 365 G N 2.042 110.807 108.800 -0.059 0.000 2.447 365 G HA2 0.495 4.456 3.960 0.001 0.000 0.269 365 G HA3 0.495 4.456 3.960 0.001 0.000 0.269 365 G C 0.715 175.614 174.900 -0.002 0.000 1.455 365 G CA 0.784 45.878 45.100 -0.009 0.000 1.061 365 G HN 2.207 10.497 8.290 -0.000 0.000 0.545 366 N N -0.617 118.095 118.700 0.020 0.000 2.235 366 N HA 0.158 4.899 4.740 0.001 0.000 0.231 366 N C 0.606 176.128 175.510 0.019 0.000 1.177 366 N CA -0.255 52.803 53.050 0.014 0.000 0.874 366 N CB 0.114 38.606 38.487 0.008 0.000 1.097 366 N HN 0.433 8.813 8.380 -0.000 0.000 0.518 367 N N 1.830 120.546 118.700 0.027 0.000 2.447 367 N HA 0.107 4.848 4.740 0.001 0.000 0.263 367 N C -1.469 174.061 175.510 0.033 0.000 1.226 367 N CA -1.380 51.693 53.050 0.039 0.000 0.906 367 N CB 1.618 40.134 38.487 0.049 0.000 1.060 367 N HN 0.191 8.571 8.380 -0.000 0.000 0.468 368 P HA -0.010 4.410 4.420 -0.000 0.000 0.225 368 P C 0.230 177.553 177.300 0.038 0.000 1.156 368 P CA 0.702 63.819 63.100 0.029 0.000 0.787 368 P CB 0.075 31.789 31.700 0.024 0.000 0.802 369 R N 1.052 121.585 120.500 0.057 0.000 2.640 369 R HA 0.368 4.709 4.340 0.001 0.000 0.270 369 R C 0.486 176.830 176.300 0.073 0.000 1.024 369 R CA 0.359 56.503 56.100 0.073 0.000 1.085 369 R CB -1.245 29.112 30.300 0.096 0.000 0.963 369 R HN 0.194 8.464 8.270 -0.000 0.000 0.426 370 V N -0.604 119.362 119.914 0.087 0.000 3.158 370 V HA 0.943 5.064 4.120 0.001 0.000 0.315 370 V C 0.900 177.075 176.094 0.135 0.000 1.148 370 V CA -0.498 61.866 62.300 0.107 0.000 1.042 370 V CB 1.726 33.613 31.823 0.107 0.000 1.101 370 V HN 1.317 9.507 8.190 -0.000 0.000 0.448 371 G N 0.628 109.524 108.800 0.161 0.000 2.647 371 G HA2 0.358 4.319 3.960 0.001 0.000 0.234 371 G HA3 0.358 4.319 3.960 0.001 0.000 0.234 371 G C 0.180 175.189 174.900 0.182 0.000 1.252 371 G CA 0.227 45.435 45.100 0.179 0.000 0.846 371 G HN 1.066 9.356 8.290 -0.000 0.000 0.589 372 T N 1.507 116.166 114.554 0.175 0.000 2.902 372 T HA 0.063 4.414 4.350 0.001 0.000 0.301 372 T C 1.541 176.379 174.700 0.229 0.000 1.012 372 T CA 0.084 62.294 62.100 0.183 0.000 1.151 372 T CB 0.987 69.947 68.868 0.153 0.000 0.946 372 T HN 0.537 8.777 8.240 -0.000 0.000 0.542 373 K N 2.413 122.930 120.400 0.195 0.000 2.103 373 K HA -0.114 4.207 4.320 0.001 0.000 0.207 373 K C 2.324 178.995 176.600 0.119 0.000 1.048 373 K CA 1.012 57.388 56.287 0.147 0.000 0.930 373 K CB -0.047 32.523 32.500 0.117 0.000 0.716 373 K HN 0.391 8.641 8.250 -0.000 0.000 0.444 374 R N -0.256 120.359 120.500 0.192 0.000 2.159 374 R HA -0.139 4.202 4.340 0.001 0.000 0.237 374 R C 0.851 177.241 176.300 0.149 0.000 1.131 374 R CA 1.452 57.636 56.100 0.140 0.000 0.982 374 R CB 0.013 30.430 30.300 0.194 0.000 0.868 374 R HN 0.347 8.617 8.270 -0.000 0.000 0.453 375 Y N -0.955 119.466 120.300 0.202 0.000 2.507 375 Y HA 0.246 4.797 4.550 0.002 0.000 0.254 375 Y C 0.285 176.392 175.900 0.345 0.000 1.171 375 Y CA -0.636 57.654 58.100 0.317 0.000 1.238 375 Y CB 0.502 39.135 38.460 0.289 0.000 1.148 375 Y HN -0.073 8.207 8.280 -0.000 0.000 0.525 376 M N 1.133 120.898 119.600 0.275 0.000 2.219 376 M HA 0.262 4.743 4.480 0.001 0.000 0.353 376 M C 0.626 176.804 176.300 -0.203 0.000 1.304 376 M CA -0.208 55.141 55.300 0.082 0.000 1.115 376 M CB 0.594 33.184 32.600 -0.016 0.000 1.664 376 M HN 0.258 8.548 8.290 -0.000 0.000 0.459 377 A N 5.785 128.337 122.820 -0.447 0.000 2.366 377 A HA 0.288 4.609 4.320 0.001 0.000 0.250 377 A C -1.812 175.270 177.584 -0.837 0.000 1.099 377 A CA -1.191 50.114 52.037 -1.219 0.000 0.794 377 A CB -0.487 18.068 19.000 -0.741 0.000 1.056 377 A HN 0.632 8.782 8.150 -0.000 0.000 0.499 378 P HA -0.191 4.229 4.420 -0.000 0.000 0.215 378 P C 1.275 178.384 177.300 -0.318 0.000 1.153 378 P CA 1.685 64.469 63.100 -0.526 0.000 0.853 378 P CB 0.002 31.440 31.700 -0.436 0.000 0.788 379 E N -0.123 119.914 120.200 -0.272 0.000 2.268 379 E HA -0.089 4.262 4.350 0.001 0.000 0.195 379 E C 1.727 178.271 176.600 -0.093 0.000 0.995 379 E CA 1.163 57.477 56.400 -0.143 0.000 0.836 379 E CB -1.252 28.388 29.700 -0.101 0.000 0.763 379 E HN 0.117 8.477 8.360 -0.000 0.000 0.491 380 V N 1.456 121.304 119.914 -0.111 0.000 2.407 380 V HA -0.141 3.979 4.120 0.001 0.000 0.245 380 V C 2.561 178.691 176.094 0.061 0.000 1.041 380 V CA 1.069 63.368 62.300 -0.001 0.000 1.040 380 V CB -0.426 31.412 31.823 0.025 0.000 0.671 380 V HN 0.166 8.356 8.190 -0.000 0.000 0.455 381 L N -0.413 120.732 121.223 -0.130 0.000 2.156 381 L HA -0.085 4.256 4.340 0.001 0.000 0.208 381 L C 2.177 179.007 176.870 -0.067 0.000 1.095 381 L CA 1.133 55.792 54.840 -0.300 0.000 0.770 381 L CB -0.540 41.186 42.059 -0.555 0.000 0.914 381 L HN 0.294 8.524 8.230 -0.000 0.000 0.439 382 D N 0.459 120.821 120.400 -0.063 0.000 2.269 382 D HA -0.130 4.511 4.640 0.001 0.000 0.208 382 D C 0.668 176.995 176.300 0.045 0.000 0.963 382 D CA 0.526 54.517 54.000 -0.015 0.000 0.864 382 D CB 0.162 40.930 40.800 -0.053 0.000 0.936 382 D HN 0.292 8.662 8.370 -0.000 0.000 0.505 383 E N -2.561 117.684 120.200 0.075 0.000 2.791 383 E HA -0.276 4.075 4.350 0.001 0.000 0.271 383 E C 0.931 177.545 176.600 0.023 0.000 1.044 383 E CA 0.701 57.141 56.400 0.067 0.000 0.814 383 E CB -1.792 27.951 29.700 0.071 0.000 1.400 383 E HN 0.466 8.826 8.360 -0.000 0.000 0.423 384 Q N -0.919 118.881 119.800 0.000 0.000 2.319 384 Q HA 0.546 4.887 4.340 0.001 0.000 0.202 384 Q C 0.974 176.961 176.000 -0.021 0.000 0.896 384 Q CA 0.849 56.645 55.803 -0.013 0.000 0.942 384 Q CB -0.171 28.553 28.738 -0.024 0.000 1.083 384 Q HN 0.591 8.861 8.270 -0.000 0.000 0.510 385 I N 0.489 121.043 120.570 -0.027 0.000 2.634 385 I HA 0.721 4.892 4.170 0.001 0.000 0.284 385 I C 0.859 176.937 176.117 -0.064 0.000 1.124 385 I CA -0.413 60.855 61.300 -0.054 0.000 1.417 385 I CB -0.314 37.638 38.000 -0.080 0.000 1.396 385 I HN 0.707 8.917 8.210 -0.000 0.000 0.571 386 R N 3.550 124.000 120.500 -0.083 0.000 2.220 386 R HA 0.489 4.830 4.340 0.001 0.000 0.340 386 R C 1.052 177.263 176.300 -0.149 0.000 1.076 386 R CA 0.137 56.193 56.100 -0.074 0.000 0.920 386 R CB -1.131 29.147 30.300 -0.037 0.000 1.062 386 R HN 1.509 9.779 8.270 -0.000 0.000 0.469 387 T N -2.093 112.420 114.554 -0.069 0.000 3.160 387 T HA -0.078 4.273 4.350 0.001 0.000 0.257 387 T C 0.384 175.150 174.700 0.110 0.000 1.147 387 T CA 0.877 62.980 62.100 0.004 0.000 1.064 387 T CB 0.029 68.968 68.868 0.118 0.000 0.949 387 T HN 0.705 8.945 8.240 -0.000 0.000 0.526 388 D N -0.112 120.322 120.400 0.056 0.000 2.463 388 D HA 0.249 4.890 4.640 0.001 0.000 0.224 388 D C -0.185 176.159 176.300 0.073 0.000 1.174 388 D CA -0.788 53.272 54.000 0.099 0.000 0.829 388 D CB -0.736 40.120 40.800 0.093 0.000 0.993 388 D HN 0.374 8.744 8.370 -0.000 0.000 0.497 389 C N 0.347 119.650 119.300 0.005 0.000 2.364 389 C HA 0.482 4.943 4.460 0.001 0.000 0.324 389 C C 1.060 176.005 174.990 -0.075 0.000 1.234 389 C CA -1.018 57.976 59.018 -0.041 0.000 1.417 389 C CB -0.815 26.882 27.740 -0.072 0.000 2.101 389 C HN 0.362 8.592 8.230 -0.000 0.000 0.466 390 F N 3.954 123.785 119.950 -0.197 0.000 2.186 390 F HA 0.076 4.604 4.527 0.002 0.000 0.299 390 F C 2.018 177.635 175.800 -0.305 0.000 1.090 390 F CA 2.720 60.620 58.000 -0.166 0.000 1.307 390 F CB -0.292 38.500 39.000 -0.346 0.000 1.019 390 F HN 0.780 9.080 8.300 -0.000 0.000 0.489 391 E N 0.077 119.969 120.200 -0.514 0.000 2.130 391 E HA -0.216 4.135 4.350 0.001 0.000 0.196 391 E C 2.183 178.036 176.600 -1.246 0.000 0.998 391 E CA 1.715 57.516 56.400 -0.997 0.000 0.806 391 E CB -1.398 27.715 29.700 -0.979 0.000 0.738 391 E HN 0.536 8.896 8.360 -0.000 0.000 0.459 392 S N -0.046 115.244 115.700 -0.683 0.000 2.365 392 S HA -0.171 4.300 4.470 0.001 0.000 0.225 392 S C 2.016 176.420 174.600 -0.326 0.000 1.039 392 S CA 1.587 59.612 58.200 -0.292 0.000 1.033 392 S CB -0.539 62.461 63.200 -0.333 0.000 0.887 392 S HN 0.713 9.023 8.310 -0.000 0.000 0.447 393 Y N 1.684 121.780 120.300 -0.341 0.000 2.242 393 Y HA -0.007 4.544 4.550 0.001 0.000 0.291 393 Y C 2.316 178.006 175.900 -0.349 0.000 1.137 393 Y CA 0.570 58.495 58.100 -0.291 0.000 1.181 393 Y CB -0.371 37.888 38.460 -0.335 0.000 0.989 393 Y HN 0.163 8.443 8.280 -0.000 0.000 0.527 394 K N -0.984 119.082 120.400 -0.556 0.000 2.057 394 K HA -0.208 4.113 4.320 0.001 0.000 0.207 394 K C 1.792 178.339 176.600 -0.087 0.000 1.049 394 K CA 1.468 57.404 56.287 -0.584 0.000 0.931 394 K CB -0.386 31.528 32.500 -0.976 0.000 0.714 394 K HN 0.348 8.598 8.250 -0.000 0.000 0.440 395 W N 0.999 122.274 121.300 -0.042 0.000 2.425 395 W HA -0.095 4.566 4.660 0.002 0.000 0.277 395 W C 2.350 178.957 176.519 0.146 0.000 1.231 395 W CA 1.583 58.963 57.345 0.059 0.000 1.248 395 W CB -1.114 28.360 29.460 0.023 0.000 1.117 395 W HN 0.261 8.441 8.180 -0.000 0.000 0.568 396 T N -2.981 111.761 114.554 0.312 0.000 2.978 396 T HA -0.103 4.247 4.350 0.001 0.000 0.262 396 T C 1.319 176.248 174.700 0.382 0.000 1.063 396 T CA 1.315 63.602 62.100 0.312 0.000 1.140 396 T CB -0.256 68.746 68.868 0.223 0.000 0.886 396 T HN -0.194 8.046 8.240 -0.000 0.000 0.470 397 D N 1.592 122.183 120.400 0.319 0.000 2.104 397 D HA -0.041 4.600 4.640 0.001 0.000 0.194 397 D C 2.106 178.562 176.300 0.261 0.000 0.994 397 D CA 0.780 54.955 54.000 0.292 0.000 0.830 397 D CB -0.219 40.757 40.800 0.293 0.000 0.959 397 D HN 0.320 8.690 8.370 -0.000 0.000 0.452 398 I N 0.409 121.157 120.570 0.296 0.000 2.142 398 I HA -0.232 3.938 4.170 0.001 0.000 0.240 398 I C 2.435 178.803 176.117 0.419 0.000 1.078 398 I CA 0.787 62.247 61.300 0.266 0.000 1.343 398 I CB -1.275 36.890 38.000 0.276 0.000 1.046 398 I HN 0.315 8.525 8.210 -0.000 0.000 0.405 399 W N 2.608 124.100 121.300 0.320 0.000 2.289 399 W HA -0.359 4.301 4.660 0.001 0.000 0.331 399 W C 2.600 179.398 176.519 0.466 0.000 1.283 399 W CA 2.964 60.547 57.345 0.398 0.000 1.252 399 W CB -0.502 29.133 29.460 0.292 0.000 1.153 399 W HN 0.190 8.370 8.180 -0.000 0.000 0.467 400 A N 0.039 123.266 122.820 0.678 0.000 1.948 400 A HA -0.267 4.054 4.320 0.001 0.000 0.220 400 A C 1.955 179.913 177.584 0.624 0.000 1.177 400 A CA 1.841 54.284 52.037 0.675 0.000 0.636 400 A CB -1.586 17.852 19.000 0.729 0.000 0.815 400 A HN 0.480 8.630 8.150 -0.000 0.000 0.449 401 F N 0.923 121.055 119.950 0.303 0.000 2.102 401 F HA -0.015 4.512 4.527 0.002 0.000 0.298 401 F C 2.366 178.302 175.800 0.225 0.000 1.105 401 F CA 1.578 59.678 58.000 0.167 0.000 1.239 401 F CB -0.655 38.227 39.000 -0.196 0.000 0.991 401 F HN 0.230 8.530 8.300 -0.000 0.000 0.474 402 G N 0.837 109.861 108.800 0.373 0.000 2.469 402 G HA2 -0.280 3.681 3.960 0.001 0.000 0.219 402 G HA3 -0.280 3.681 3.960 0.001 0.000 0.219 402 G C 1.732 176.892 174.900 0.433 0.000 1.150 402 G CA 1.332 46.555 45.100 0.205 0.000 0.763 402 G HN 0.441 8.731 8.290 -0.000 0.000 0.561 403 L N 0.123 121.625 121.223 0.465 0.000 2.083 403 L HA -0.084 4.257 4.340 0.001 0.000 0.209 403 L C 2.957 180.016 176.870 0.315 0.000 1.083 403 L CA 0.438 55.426 54.840 0.248 0.000 0.752 403 L CB -0.412 41.611 42.059 -0.060 0.000 0.899 403 L HN 0.108 8.338 8.230 -0.000 0.000 0.433 404 V N -0.201 119.891 119.914 0.296 0.000 2.548 404 V HA -0.234 3.886 4.120 0.001 0.000 0.249 404 V C 2.372 178.499 176.094 0.056 0.000 1.055 404 V CA 1.262 63.685 62.300 0.205 0.000 1.065 404 V CB -0.280 31.637 31.823 0.157 0.000 0.681 404 V HN 0.336 8.526 8.190 -0.000 0.000 0.462 405 L N -1.412 119.776 121.223 -0.059 0.000 2.012 405 L HA -0.230 4.110 4.340 0.001 0.000 0.210 405 L C 2.340 179.240 176.870 0.050 0.000 1.073 405 L CA 2.350 57.147 54.840 -0.072 0.000 0.748 405 L CB -0.578 41.420 42.059 -0.102 0.000 0.891 405 L HN 0.516 8.746 8.230 -0.000 0.000 0.431 406 W N 1.537 122.833 121.300 -0.007 0.000 2.304 406 W HA -0.276 4.384 4.660 0.001 0.000 0.315 406 W C 2.464 178.969 176.519 -0.023 0.000 1.233 406 W CA 2.162 59.519 57.345 0.020 0.000 1.261 406 W CB -0.135 29.402 29.460 0.128 0.000 1.150 406 W HN 0.131 8.311 8.180 -0.000 0.000 0.494 407 E N -0.192 120.139 120.200 0.219 0.000 2.085 407 E HA -0.269 4.082 4.350 0.001 0.000 0.194 407 E C 2.117 178.671 176.600 -0.077 0.000 0.994 407 E CA 1.921 58.349 56.400 0.045 0.000 0.801 407 E CB -0.548 29.321 29.700 0.283 0.000 0.743 407 E HN 0.404 8.764 8.360 -0.000 0.000 0.453 408 I N 1.025 121.573 120.570 -0.036 0.000 2.202 408 I HA -0.254 3.917 4.170 0.001 0.000 0.242 408 I C 2.610 178.646 176.117 -0.135 0.000 1.091 408 I CA 0.916 62.183 61.300 -0.055 0.000 1.368 408 I CB -0.367 37.610 38.000 -0.038 0.000 1.058 408 I HN 0.080 8.290 8.210 -0.000 0.000 0.410 409 A N 0.927 123.634 122.820 -0.188 0.000 1.883 409 A HA -0.271 4.050 4.320 0.001 0.000 0.217 409 A C 2.424 179.820 177.584 -0.314 0.000 1.186 409 A CA 1.964 53.867 52.037 -0.223 0.000 0.624 409 A CB -0.754 18.114 19.000 -0.220 0.000 0.822 409 A HN 0.371 8.521 8.150 -0.000 0.000 0.444 410 R N -1.049 119.135 120.500 -0.526 0.000 2.139 410 R HA -0.142 4.199 4.340 0.001 0.000 0.243 410 R C 1.714 177.806 176.300 -0.347 0.000 1.145 410 R CA 1.764 57.517 56.100 -0.578 0.000 0.976 410 R CB -0.124 29.603 30.300 -0.955 0.000 0.866 410 R HN 0.284 8.554 8.270 -0.000 0.000 0.449 411 R N 0.100 120.445 120.500 -0.259 0.000 2.426 411 R HA 0.139 4.480 4.340 0.001 0.000 0.263 411 R C -0.832 175.388 176.300 -0.133 0.000 0.961 411 R CA 0.257 56.257 56.100 -0.168 0.000 1.086 411 R CB 0.403 30.638 30.300 -0.107 0.000 1.186 411 R HN 0.049 8.319 8.270 -0.000 0.000 0.537 412 T N 0.405 114.878 114.554 -0.136 0.000 2.829 412 T HA 0.409 4.760 4.350 0.001 0.000 0.282 412 T C 0.067 174.714 174.700 -0.087 0.000 0.990 412 T CA -0.510 61.531 62.100 -0.097 0.000 1.028 412 T CB 1.494 70.310 68.868 -0.088 0.000 0.951 412 T HN -0.007 8.233 8.240 -0.000 0.000 0.460 413 I N 3.174 123.705 120.570 -0.066 0.000 2.363 413 I HA 0.351 4.522 4.170 0.001 0.000 0.292 413 I C 0.087 176.176 176.117 -0.047 0.000 1.075 413 I CA -0.350 60.916 61.300 -0.058 0.000 1.333 413 I CB 0.525 38.496 38.000 -0.048 0.000 1.415 413 I HN 0.235 8.445 8.210 -0.000 0.000 0.502 414 V N 7.223 127.107 119.914 -0.050 0.000 2.604 414 V HA 0.435 4.556 4.120 0.001 0.000 0.305 414 V C 0.177 176.250 176.094 -0.035 0.000 1.043 414 V CA -0.527 61.750 62.300 -0.039 0.000 0.888 414 V CB 1.578 33.376 31.823 -0.041 0.000 0.995 414 V HN 0.902 9.092 8.190 -0.000 0.000 0.429 415 N N 4.470 123.153 118.700 -0.028 0.000 2.696 415 N HA -0.210 4.531 4.740 0.001 0.000 0.249 415 N C 1.099 176.593 175.510 -0.027 0.000 1.090 415 N CA 1.907 54.942 53.050 -0.024 0.000 0.716 415 N CB -1.444 37.029 38.487 -0.023 0.000 1.020 415 N HN 1.889 10.268 8.380 -0.000 0.000 0.548 416 G N -1.973 106.809 108.800 -0.030 0.000 2.205 416 G HA2 -0.337 3.624 3.960 0.001 0.000 0.261 416 G HA3 -0.337 3.624 3.960 0.001 0.000 0.261 416 G C 0.038 174.914 174.900 -0.040 0.000 0.980 416 G CA 0.584 45.664 45.100 -0.032 0.000 0.632 416 G HN 0.470 8.760 8.290 -0.000 0.000 0.533 417 I N 0.158 120.702 120.570 -0.044 0.000 2.441 417 I HA 0.693 4.864 4.170 0.001 0.000 0.295 417 I C -0.067 176.010 176.117 -0.066 0.000 0.994 417 I CA -1.103 60.167 61.300 -0.050 0.000 1.144 417 I CB 2.183 40.157 38.000 -0.044 0.000 1.314 417 I HN 0.037 8.247 8.210 -0.000 0.000 0.445 418 V N 5.881 125.750 119.914 -0.074 0.000 2.525 418 V HA 0.421 4.542 4.120 0.001 0.000 0.299 418 V C -0.298 175.733 176.094 -0.104 0.000 1.034 418 V CA -0.415 61.828 62.300 -0.096 0.000 0.863 418 V CB 1.695 33.460 31.823 -0.096 0.000 0.999 418 V HN 0.686 8.876 8.190 -0.000 0.000 0.423 419 E N 3.492 123.613 120.200 -0.132 0.000 2.404 419 E HA 0.249 4.600 4.350 0.001 0.000 0.261 419 E C 0.341 176.850 176.600 -0.151 0.000 1.074 419 E CA 0.774 57.087 56.400 -0.145 0.000 0.917 419 E CB 0.962 30.549 29.700 -0.187 0.000 0.965 419 E HN 0.964 9.324 8.360 -0.000 0.000 0.433 420 D N 1.466 121.786 120.400 -0.134 0.000 2.382 420 D HA 0.028 4.669 4.640 0.001 0.000 0.240 420 D C -0.111 176.102 176.300 -0.146 0.000 1.146 420 D CA -0.128 53.806 54.000 -0.110 0.000 0.897 420 D CB 0.172 40.924 40.800 -0.080 0.000 1.197 420 D HN 0.421 8.791 8.370 -0.000 0.000 0.432 421 Y N 0.533 120.709 120.300 -0.206 0.000 2.620 421 Y HA 0.408 4.958 4.550 0.001 0.000 0.330 421 Y C 0.774 176.546 175.900 -0.212 0.000 1.186 421 Y CA 0.925 58.889 58.100 -0.227 0.000 1.467 421 Y CB 0.060 38.376 38.460 -0.240 0.000 1.262 421 Y HN 0.834 9.114 8.280 -0.000 0.000 0.550 422 R N 6.627 126.499 120.500 -1.046 0.000 2.725 422 R HA 0.627 4.968 4.340 0.001 0.000 0.277 422 R C -3.242 172.581 176.300 -0.795 0.000 0.987 422 R CA -1.811 53.806 56.100 -0.805 0.000 0.901 422 R CB 0.537 30.272 30.300 -0.940 0.000 1.207 422 R HN 0.593 8.863 8.270 -0.000 0.000 0.463 423 P HA 0.348 4.768 4.420 -0.000 0.000 0.276 423 P C -2.711 174.659 177.300 0.117 0.000 1.252 423 P CA -1.760 61.385 63.100 0.075 0.000 0.802 423 P CB 0.270 32.136 31.700 0.276 0.000 1.035 424 P HA 0.039 4.459 4.420 -0.000 0.000 0.265 424 P C -0.292 176.822 177.300 -0.310 0.000 1.193 424 P CA 0.509 63.257 63.100 -0.586 0.000 0.765 424 P CB -0.388 30.900 31.700 -0.688 0.000 0.823 425 F N -0.099 119.581 119.950 -0.450 0.000 3.034 425 F HA -0.270 4.258 4.527 0.001 0.000 0.286 425 F C 1.389 177.061 175.800 -0.213 0.000 0.804 425 F CA 0.753 58.543 58.000 -0.350 0.000 1.161 425 F CB -3.083 35.742 39.000 -0.292 0.000 1.317 425 F HN 0.450 8.750 8.300 -0.000 0.000 0.453 426 Y N 0.580 120.848 120.300 -0.055 0.000 2.315 426 Y HA -0.177 4.374 4.550 0.001 0.000 0.288 426 Y C 1.911 177.822 175.900 0.019 0.000 1.154 426 Y CA 1.515 59.622 58.100 0.011 0.000 1.229 426 Y CB -0.574 37.899 38.460 0.022 0.000 0.980 426 Y HN 0.363 8.643 8.280 -0.000 0.000 0.540 427 D N 0.873 120.807 120.400 -0.778 0.000 2.339 427 D HA -0.034 4.607 4.640 0.001 0.000 0.217 427 D C 1.316 177.466 176.300 -0.250 0.000 1.050 427 D CA 0.981 54.645 54.000 -0.560 0.000 0.856 427 D CB -0.108 40.227 40.800 -0.775 0.000 0.922 427 D HN 0.527 8.897 8.370 -0.000 0.000 0.518 428 V N -2.428 117.387 119.914 -0.165 0.000 3.426 428 V HA 0.304 4.424 4.120 0.001 0.000 0.279 428 V C 0.358 176.416 176.094 -0.060 0.000 1.544 428 V CA 0.231 62.477 62.300 -0.089 0.000 1.017 428 V CB 0.335 32.119 31.823 -0.065 0.000 0.821 428 V HN 0.091 8.281 8.190 -0.000 0.000 0.432 429 V N -2.176 117.718 119.914 -0.033 0.000 3.007 429 V HA 0.829 4.950 4.120 0.001 0.000 0.311 429 V C -2.772 173.332 176.094 0.017 0.000 1.120 429 V CA -1.915 60.371 62.300 -0.023 0.000 0.980 429 V CB 1.625 33.416 31.823 -0.053 0.000 1.033 429 V HN 0.164 8.354 8.190 -0.000 0.000 0.429 430 P HA 0.224 4.644 4.420 -0.000 0.000 0.272 430 P C 0.566 177.904 177.300 0.063 0.000 1.240 430 P CA 0.124 63.248 63.100 0.040 0.000 0.791 430 P CB 0.446 32.164 31.700 0.030 0.000 0.978 431 N N 0.898 119.643 118.700 0.075 0.000 2.103 431 N HA -0.265 4.476 4.740 0.001 0.000 0.200 431 N C -0.091 175.473 175.510 0.091 0.000 1.016 431 N CA 1.881 54.987 53.050 0.093 0.000 0.890 431 N CB -1.388 37.150 38.487 0.084 0.000 1.075 431 N HN 0.428 8.808 8.380 -0.000 0.000 0.506 432 D N 0.818 121.261 120.400 0.071 0.000 2.477 432 D HA 0.354 4.995 4.640 0.001 0.000 0.239 432 D C -2.509 173.826 176.300 0.060 0.000 1.102 432 D CA -1.384 52.658 54.000 0.070 0.000 0.901 432 D CB 0.987 41.824 40.800 0.060 0.000 1.026 432 D HN 0.316 8.686 8.370 -0.000 0.000 0.515 433 P HA 0.202 4.622 4.420 -0.000 0.000 0.297 433 P C -0.414 176.911 177.300 0.043 0.000 1.331 433 P CA -0.644 62.477 63.100 0.035 0.000 0.803 433 P CB 1.367 33.075 31.700 0.012 0.000 0.929 434 S N 2.519 118.245 115.700 0.043 0.000 2.585 434 S HA 0.087 4.558 4.470 0.001 0.000 0.273 434 S C 1.129 175.779 174.600 0.084 0.000 1.339 434 S CA -0.530 57.717 58.200 0.079 0.000 1.028 434 S CB 0.192 63.436 63.200 0.072 0.000 0.906 434 S HN 0.359 8.669 8.310 -0.000 0.000 0.528 435 F N 2.295 122.238 119.950 -0.012 0.000 2.106 435 F HA -0.256 4.271 4.527 0.001 0.000 0.299 435 F C 2.798 178.571 175.800 -0.045 0.000 1.082 435 F CA 2.815 60.800 58.000 -0.025 0.000 1.244 435 F CB -0.970 38.022 39.000 -0.013 0.000 0.997 435 F HN 0.893 9.193 8.300 -0.000 0.000 0.486 436 E N -0.307 119.968 120.200 0.126 0.000 2.107 436 E HA -0.180 4.171 4.350 0.001 0.000 0.191 436 E C 1.817 178.378 176.600 -0.063 0.000 0.982 436 E CA 1.458 57.881 56.400 0.038 0.000 0.809 436 E CB -1.022 28.717 29.700 0.066 0.000 0.756 436 E HN 0.499 8.859 8.360 -0.000 0.000 0.459 437 D N -0.039 120.324 120.400 -0.061 0.000 2.123 437 D HA -0.141 4.500 4.640 0.001 0.000 0.196 437 D C 2.003 178.194 176.300 -0.182 0.000 0.992 437 D CA 1.485 55.427 54.000 -0.097 0.000 0.833 437 D CB -0.121 40.637 40.800 -0.069 0.000 0.954 437 D HN 0.298 8.668 8.370 -0.000 0.000 0.455 438 M N 0.408 119.861 119.600 -0.244 0.000 2.156 438 M HA -0.064 4.417 4.480 0.001 0.000 0.264 438 M C 2.106 178.173 176.300 -0.387 0.000 1.067 438 M CA 0.877 55.955 55.300 -0.370 0.000 1.131 438 M CB -0.887 31.475 32.600 -0.397 0.000 1.368 438 M HN -0.030 8.260 8.290 -0.000 0.000 0.416 439 K N 0.797 120.959 120.400 -0.395 0.000 2.044 439 K HA -0.250 4.071 4.320 0.001 0.000 0.210 439 K C 2.137 178.609 176.600 -0.212 0.000 1.049 439 K CA 1.907 58.000 56.287 -0.324 0.000 0.927 439 K CB -0.090 32.261 32.500 -0.249 0.000 0.713 439 K HN 0.219 8.469 8.250 -0.000 0.000 0.443 440 K N 0.207 120.505 120.400 -0.170 0.000 2.026 440 K HA -0.124 4.197 4.320 0.001 0.000 0.208 440 K C 1.914 178.429 176.600 -0.141 0.000 1.048 440 K CA 1.548 57.760 56.287 -0.125 0.000 0.929 440 K CB -0.009 32.433 32.500 -0.096 0.000 0.713 440 K HN 0.018 8.268 8.250 -0.000 0.000 0.439 441 V N 0.606 120.404 119.914 -0.193 0.000 2.270 441 V HA -0.190 3.931 4.120 0.001 0.000 0.245 441 V C 2.285 178.258 176.094 -0.202 0.000 1.043 441 V CA 1.518 63.695 62.300 -0.205 0.000 1.014 441 V CB 0.050 31.689 31.823 -0.307 0.000 0.645 441 V HN 0.195 8.385 8.190 -0.000 0.000 0.447 442 V N -1.474 118.272 119.914 -0.281 0.000 2.535 442 V HA -0.147 3.974 4.120 0.001 0.000 0.246 442 V C 2.224 178.230 176.094 -0.147 0.000 1.045 442 V CA 1.814 63.985 62.300 -0.215 0.000 1.058 442 V CB -0.064 31.570 31.823 -0.315 0.000 0.689 442 V HN 0.623 8.813 8.190 -0.000 0.000 0.461 443 C N -1.547 117.653 119.300 -0.167 0.000 2.543 443 C HA 0.130 4.591 4.460 0.001 0.000 0.289 443 C C 2.632 177.573 174.990 -0.083 0.000 1.368 443 C CA 0.109 59.051 59.018 -0.126 0.000 1.778 443 C CB -0.131 27.525 27.740 -0.141 0.000 2.155 443 C HN 0.337 8.567 8.230 -0.000 0.000 0.529 444 V N 1.821 121.685 119.914 -0.084 0.000 2.283 444 V HA -0.151 3.969 4.120 0.001 0.000 0.243 444 V C 1.794 177.861 176.094 -0.045 0.000 1.039 444 V CA 2.250 64.516 62.300 -0.058 0.000 1.016 444 V CB -0.621 31.169 31.823 -0.055 0.000 0.650 444 V HN 0.468 8.658 8.190 -0.000 0.000 0.449 445 D N -0.945 119.423 120.400 -0.053 0.000 2.355 445 D HA -0.014 4.627 4.640 0.001 0.000 0.218 445 D C 1.355 177.645 176.300 -0.017 0.000 1.004 445 D CA 0.252 54.231 54.000 -0.036 0.000 0.880 445 D CB -0.167 40.606 40.800 -0.044 0.000 0.911 445 D HN 0.490 8.860 8.370 -0.000 0.000 0.528 446 Q N -0.030 119.760 119.800 -0.017 0.000 2.453 446 Q HA -0.267 4.074 4.340 0.001 0.000 0.294 446 Q C -0.445 175.585 176.000 0.050 0.000 1.295 446 Q CA 0.263 56.078 55.803 0.020 0.000 0.853 446 Q CB -1.105 27.648 28.738 0.026 0.000 1.193 446 Q HN 0.264 8.534 8.270 -0.000 0.000 0.461 447 Q N 0.407 120.234 119.800 0.044 0.000 2.259 447 Q HA 0.452 4.793 4.340 0.001 0.000 0.249 447 Q C -0.330 175.758 176.000 0.148 0.000 0.914 447 Q CA 0.610 56.458 55.803 0.076 0.000 0.904 447 Q CB 1.166 29.947 28.738 0.073 0.000 1.213 447 Q HN 0.327 8.597 8.270 -0.000 0.000 0.428 448 T N 0.715 115.274 114.554 0.010 0.000 2.906 448 T HA 0.634 4.985 4.350 0.001 0.000 0.295 448 T C -2.617 171.764 174.700 -0.532 0.000 1.061 448 T CA -2.315 59.611 62.100 -0.290 0.000 1.000 448 T CB 1.323 70.061 68.868 -0.216 0.000 1.103 448 T HN 0.370 8.610 8.240 -0.000 0.000 0.486 449 P HA 0.144 4.564 4.420 -0.000 0.000 0.258 449 P C 0.084 177.161 177.300 -0.371 0.000 1.187 449 P CA 0.131 62.568 63.100 -1.105 0.000 0.767 449 P CB -0.306 30.245 31.700 -1.916 0.000 0.770 450 T N 4.846 119.301 114.554 -0.165 0.000 2.867 450 T HA -0.002 4.349 4.350 0.001 0.000 0.290 450 T C 0.706 175.589 174.700 0.306 0.000 1.025 450 T CA 0.641 62.787 62.100 0.076 0.000 1.146 450 T CB -0.399 68.521 68.868 0.088 0.000 1.024 450 T HN 0.206 8.446 8.240 -0.000 0.000 0.519 451 I N 6.017 126.755 120.570 0.279 0.000 2.339 451 I HA 0.292 4.463 4.170 0.001 0.000 0.290 451 I C -2.015 174.199 176.117 0.161 0.000 0.994 451 I CA -2.573 58.910 61.300 0.305 0.000 1.191 451 I CB 1.319 39.438 38.000 0.198 0.000 1.343 451 I HN 0.379 8.589 8.210 -0.000 0.000 0.458 452 P HA 0.168 4.588 4.420 -0.000 0.000 0.271 452 P C 0.304 177.618 177.300 0.025 0.000 1.233 452 P CA -0.214 62.917 63.100 0.052 0.000 0.764 452 P CB 0.415 32.113 31.700 -0.002 0.000 0.825 453 N N 2.741 121.457 118.700 0.027 0.000 2.139 453 N HA -0.255 4.486 4.740 0.001 0.000 0.199 453 N C 1.687 177.197 175.510 -0.001 0.000 1.003 453 N CA 1.366 54.424 53.050 0.013 0.000 0.892 453 N CB -0.407 38.088 38.487 0.014 0.000 1.039 453 N HN 0.463 8.843 8.380 -0.000 0.000 0.461 454 R N 0.501 120.997 120.500 -0.007 0.000 2.134 454 R HA -0.180 4.161 4.340 0.001 0.000 0.248 454 R C 1.980 178.264 176.300 -0.027 0.000 1.143 454 R CA 1.469 57.556 56.100 -0.021 0.000 0.957 454 R CB -0.519 29.761 30.300 -0.033 0.000 0.867 454 R HN 0.110 8.380 8.270 -0.000 0.000 0.441 455 L N 0.403 121.608 121.223 -0.031 0.000 2.137 455 L HA -0.207 4.133 4.340 0.001 0.000 0.213 455 L C 2.358 179.211 176.870 -0.028 0.000 1.085 455 L CA 2.095 56.913 54.840 -0.037 0.000 0.760 455 L CB -0.710 41.325 42.059 -0.040 0.000 0.893 455 L HN 0.383 8.613 8.230 -0.000 0.000 0.434 456 A N -1.412 121.397 122.820 -0.019 0.000 2.216 456 A HA 0.064 4.385 4.320 0.001 0.000 0.214 456 A C 2.364 179.940 177.584 -0.013 0.000 1.160 456 A CA 1.321 53.349 52.037 -0.015 0.000 0.725 456 A CB -0.596 18.399 19.000 -0.008 0.000 0.784 456 A HN 0.402 8.552 8.150 -0.000 0.000 0.472 457 A N -0.132 122.678 122.820 -0.015 0.000 1.887 457 A HA 0.347 4.668 4.320 0.001 0.000 0.212 457 A C 1.313 178.888 177.584 -0.014 0.000 1.198 457 A CA 1.003 53.032 52.037 -0.013 0.000 0.628 457 A CB -1.083 17.909 19.000 -0.014 0.000 0.847 457 A HN 0.608 8.758 8.150 -0.000 0.000 0.449 458 D N 0.855 121.243 120.400 -0.019 0.000 2.458 458 D HA 0.345 4.986 4.640 0.001 0.000 0.243 458 D C -1.270 175.022 176.300 -0.014 0.000 1.146 458 D CA -0.789 53.201 54.000 -0.017 0.000 0.877 458 D CB -0.253 40.533 40.800 -0.024 0.000 1.176 458 D HN 0.228 8.598 8.370 -0.000 0.000 0.461 459 P HA -0.157 4.263 4.420 -0.000 0.000 0.216 459 P C 1.678 178.973 177.300 -0.007 0.000 1.153 459 P CA 0.646 63.743 63.100 -0.005 0.000 0.858 459 P CB 0.318 32.019 31.700 0.001 0.000 0.789 460 V N -0.536 119.374 119.914 -0.007 0.000 2.379 460 V HA -0.091 4.030 4.120 0.001 0.000 0.243 460 V C 2.579 178.660 176.094 -0.022 0.000 1.035 460 V CA 1.154 63.448 62.300 -0.010 0.000 1.035 460 V CB -1.072 30.748 31.823 -0.005 0.000 0.673 460 V HN -0.008 8.182 8.190 -0.000 0.000 0.457 461 L N 0.123 121.328 121.223 -0.029 0.000 2.456 461 L HA -0.096 4.245 4.340 0.001 0.000 0.224 461 L C 2.512 179.355 176.870 -0.046 0.000 1.148 461 L CA 1.342 56.155 54.840 -0.044 0.000 0.825 461 L CB -0.337 41.691 42.059 -0.053 0.000 0.937 461 L HN 0.397 8.627 8.230 -0.000 0.000 0.450 462 S N -0.128 115.551 115.700 -0.036 0.000 2.404 462 S HA -0.030 4.440 4.470 0.001 0.000 0.223 462 S C 2.004 176.580 174.600 -0.041 0.000 1.040 462 S CA 0.916 59.094 58.200 -0.035 0.000 0.957 462 S CB -0.124 63.062 63.200 -0.024 0.000 0.826 462 S HN 0.437 8.747 8.310 -0.000 0.000 0.491 463 G N 1.444 110.225 108.800 -0.032 0.000 2.509 463 G HA2 -0.000 3.961 3.960 0.001 0.000 0.218 463 G HA3 -0.000 3.961 3.960 0.001 0.000 0.218 463 G C 1.374 176.248 174.900 -0.044 0.000 1.124 463 G CA 0.466 45.547 45.100 -0.033 0.000 0.776 463 G HN 0.496 8.786 8.290 -0.000 0.000 0.547 464 L N 0.217 121.411 121.223 -0.048 0.000 2.072 464 L HA 0.018 4.359 4.340 0.001 0.000 0.205 464 L C 3.367 180.170 176.870 -0.112 0.000 1.079 464 L CA 0.922 55.724 54.840 -0.064 0.000 0.752 464 L CB -0.413 41.612 42.059 -0.056 0.000 0.906 464 L HN 0.312 8.542 8.230 -0.000 0.000 0.436 465 A N -0.298 122.460 122.820 -0.102 0.000 1.883 465 A HA -0.300 4.021 4.320 0.001 0.000 0.217 465 A C 2.173 179.652 177.584 -0.174 0.000 1.186 465 A CA 1.997 53.959 52.037 -0.124 0.000 0.624 465 A CB -0.529 18.428 19.000 -0.071 0.000 0.822 465 A HN 0.383 8.533 8.150 -0.000 0.000 0.444 466 Q N -0.733 118.990 119.800 -0.129 0.000 2.119 466 Q HA -0.001 4.340 4.340 0.001 0.000 0.201 466 Q C 1.970 177.854 176.000 -0.193 0.000 0.972 466 Q CA 1.854 57.579 55.803 -0.130 0.000 0.847 466 Q CB -0.379 28.317 28.738 -0.070 0.000 0.903 466 Q HN 0.672 8.942 8.270 -0.000 0.000 0.433 467 M N -1.091 118.402 119.600 -0.179 0.000 2.175 467 M HA -0.122 4.359 4.480 0.001 0.000 0.264 467 M C 2.038 178.121 176.300 -0.362 0.000 1.063 467 M CA 1.246 56.428 55.300 -0.196 0.000 1.119 467 M CB -0.086 32.458 32.600 -0.094 0.000 1.377 467 M HN 0.313 8.603 8.290 -0.000 0.000 0.415 468 M N -0.718 118.594 119.600 -0.481 0.000 2.065 468 M HA -0.279 4.202 4.480 0.001 0.000 0.259 468 M C 2.180 177.688 176.300 -1.320 0.000 1.069 468 M CA 1.926 56.627 55.300 -0.998 0.000 1.110 468 M CB -0.349 31.668 32.600 -0.972 0.000 1.328 468 M HN 0.145 8.435 8.290 -0.000 0.000 0.405 469 R N -0.081 119.949 120.500 -0.783 0.000 2.091 469 R HA -0.165 4.176 4.340 0.001 0.000 0.238 469 R C 1.706 177.540 176.300 -0.777 0.000 1.136 469 R CA 1.575 57.336 56.100 -0.564 0.000 0.959 469 R CB -0.249 29.878 30.300 -0.289 0.000 0.856 469 R HN 0.505 8.775 8.270 -0.000 0.000 0.437 470 E N -0.852 118.905 120.200 -0.738 0.000 2.481 470 E HA -0.064 4.287 4.350 0.001 0.000 0.195 470 E C 1.375 177.647 176.600 -0.546 0.000 1.047 470 E CA 0.171 56.043 56.400 -0.880 0.000 0.867 470 E CB 0.251 29.730 29.700 -0.368 0.000 0.858 470 E HN 0.370 8.730 8.360 -0.000 0.000 0.513 471 C N 0.007 119.013 119.300 -0.490 0.000 2.563 471 C HA 0.028 4.489 4.460 0.001 0.000 0.268 471 C C 1.075 176.115 174.990 0.082 0.000 1.365 471 C CA -0.328 58.569 59.018 -0.202 0.000 1.754 471 C CB -0.582 27.012 27.740 -0.244 0.000 1.932 471 C HN 0.577 8.807 8.230 -0.000 0.000 0.536 472 W N -0.733 120.433 121.300 -0.223 0.000 3.102 472 W HA 0.384 5.044 4.660 0.001 0.000 0.401 472 W C -0.068 176.563 176.519 0.186 0.000 1.070 472 W CA -1.468 55.810 57.345 -0.111 0.000 1.921 472 W CB -1.468 27.767 29.460 -0.375 0.000 1.118 472 W HN 0.221 8.401 8.180 -0.000 0.000 0.647 473 Y N 2.683 123.177 120.300 0.324 0.000 2.717 473 Y HA 0.035 4.586 4.550 0.001 0.000 0.330 473 Y C -0.801 175.234 175.900 0.226 0.000 1.217 473 Y CA -1.943 56.281 58.100 0.206 0.000 1.506 473 Y CB -0.359 38.150 38.460 0.082 0.000 1.268 473 Y HN -0.152 8.128 8.280 -0.000 0.000 0.561 474 P HA -0.165 4.255 4.420 -0.000 0.000 0.216 474 P C 0.182 177.519 177.300 0.062 0.000 1.150 474 P CA 1.368 64.569 63.100 0.169 0.000 0.837 474 P CB 0.213 31.979 31.700 0.109 0.000 0.786 475 N N -0.166 118.553 118.700 0.032 0.000 2.399 475 N HA 0.046 4.787 4.740 0.001 0.000 0.259 475 N C -1.726 173.703 175.510 -0.136 0.000 1.160 475 N CA -2.000 51.006 53.050 -0.072 0.000 0.946 475 N CB 0.139 38.563 38.487 -0.106 0.000 1.156 475 N HN -0.092 8.288 8.380 -0.000 0.000 0.489 476 P HA -0.149 4.271 4.420 -0.000 0.000 0.217 476 P C 0.791 177.472 177.300 -1.030 0.000 1.148 476 P CA 1.342 64.204 63.100 -0.397 0.000 0.828 476 P CB 0.123 31.657 31.700 -0.275 0.000 0.783 477 S N -1.189 113.846 115.700 -1.108 0.000 2.522 477 S HA 0.106 4.577 4.470 0.001 0.000 0.227 477 S C 1.904 176.227 174.600 -0.461 0.000 0.986 477 S CA 0.666 58.172 58.200 -1.157 0.000 0.929 477 S CB -0.914 61.841 63.200 -0.741 0.000 0.769 477 S HN 0.115 8.425 8.310 -0.000 0.000 0.529 478 A N 1.429 124.080 122.820 -0.281 0.000 2.167 478 A HA 0.207 4.527 4.320 0.001 0.000 0.214 478 A C 1.228 178.914 177.584 0.170 0.000 1.151 478 A CA -0.121 51.869 52.037 -0.077 0.000 0.735 478 A CB -0.177 18.723 19.000 -0.167 0.000 0.802 478 A HN 0.460 8.610 8.150 -0.000 0.000 0.467 479 R N -0.445 120.108 120.500 0.089 0.000 2.582 479 R HA 0.454 4.795 4.340 0.001 0.000 0.271 479 R C -0.409 175.980 176.300 0.149 0.000 1.078 479 R CA -0.495 55.704 56.100 0.164 0.000 1.127 479 R CB 0.463 30.850 30.300 0.145 0.000 1.038 479 R HN 0.310 8.580 8.270 -0.000 0.000 0.500 480 L N 1.373 122.658 121.223 0.103 0.000 2.467 480 L HA 0.066 4.406 4.340 0.001 0.000 0.270 480 L C 1.081 178.018 176.870 0.111 0.000 1.205 480 L CA 0.034 54.922 54.840 0.079 0.000 0.828 480 L CB 0.460 42.521 42.059 0.002 0.000 1.101 480 L HN 0.776 9.006 8.230 -0.000 0.000 0.479 481 T N -1.061 113.553 114.554 0.100 0.000 2.874 481 T HA 0.370 4.721 4.350 0.001 0.000 0.281 481 T C 1.059 175.735 174.700 -0.039 0.000 0.994 481 T CA -0.242 61.915 62.100 0.095 0.000 1.015 481 T CB 1.549 70.481 68.868 0.107 0.000 1.028 481 T HN 0.638 8.878 8.240 -0.000 0.000 0.523 482 A N 0.717 123.478 122.820 -0.098 0.000 1.933 482 A HA 0.007 4.328 4.320 0.001 0.000 0.218 482 A C 2.152 179.618 177.584 -0.197 0.000 1.175 482 A CA 1.143 53.000 52.037 -0.300 0.000 0.628 482 A CB -0.983 17.743 19.000 -0.456 0.000 0.814 482 A HN 0.712 8.862 8.150 -0.000 0.000 0.444 483 L N -0.320 120.854 121.223 -0.082 0.000 2.017 483 L HA -0.110 4.231 4.340 0.001 0.000 0.208 483 L C 2.398 179.247 176.870 -0.035 0.000 1.073 483 L CA 2.294 57.111 54.840 -0.038 0.000 0.745 483 L CB -0.953 41.113 42.059 0.011 0.000 0.894 483 L HN 0.427 8.657 8.230 -0.000 0.000 0.432 484 R N -0.453 120.032 120.500 -0.026 0.000 2.092 484 R HA -0.078 4.263 4.340 0.001 0.000 0.231 484 R C 2.205 178.480 176.300 -0.041 0.000 1.119 484 R CA 1.535 57.625 56.100 -0.016 0.000 0.970 484 R CB -0.458 29.846 30.300 0.007 0.000 0.864 484 R HN 0.460 8.730 8.270 -0.000 0.000 0.440 485 I N 0.309 120.824 120.570 -0.092 0.000 2.163 485 I HA -0.280 3.891 4.170 0.001 0.000 0.240 485 I C 2.356 178.426 176.117 -0.078 0.000 1.081 485 I CA 1.482 62.715 61.300 -0.112 0.000 1.353 485 I CB -0.389 37.459 38.000 -0.253 0.000 1.054 485 I HN 0.211 8.421 8.210 -0.000 0.000 0.407 486 K N 1.707 122.046 120.400 -0.101 0.000 2.032 486 K HA -0.287 4.034 4.320 0.001 0.000 0.218 486 K C 2.116 178.708 176.600 -0.014 0.000 1.054 486 K CA 2.070 58.330 56.287 -0.045 0.000 0.941 486 K CB -0.107 32.368 32.500 -0.041 0.000 0.720 486 K HN 0.144 8.394 8.250 -0.000 0.000 0.449 487 K N -0.350 120.043 120.400 -0.013 0.000 2.032 487 K HA -0.124 4.197 4.320 0.001 0.000 0.209 487 K C 2.261 178.863 176.600 0.003 0.000 1.048 487 K CA 2.120 58.408 56.287 0.002 0.000 0.927 487 K CB -0.285 32.219 32.500 0.005 0.000 0.712 487 K HN 0.299 8.549 8.250 -0.000 0.000 0.441 488 T N 2.008 116.560 114.554 -0.003 0.000 2.622 488 T HA -0.137 4.214 4.350 0.001 0.000 0.266 488 T C 1.904 176.605 174.700 0.003 0.000 1.047 488 T CA 1.299 63.398 62.100 -0.001 0.000 1.159 488 T CB -0.328 68.536 68.868 -0.008 0.000 0.863 488 T HN 0.094 8.334 8.240 -0.000 0.000 0.422 489 L N 0.871 122.098 121.223 0.006 0.000 2.127 489 L HA -0.187 4.154 4.340 0.001 0.000 0.211 489 L C 2.920 179.797 176.870 0.011 0.000 1.089 489 L CA 1.366 56.214 54.840 0.013 0.000 0.757 489 L CB -0.654 41.424 42.059 0.031 0.000 0.899 489 L HN 0.352 8.582 8.230 -0.000 0.000 0.434 490 Q N 0.055 119.863 119.800 0.012 0.000 1.975 490 Q HA -0.261 4.080 4.340 0.001 0.000 0.205 490 Q C 2.256 178.265 176.000 0.014 0.000 0.990 490 Q CA 1.648 57.459 55.803 0.014 0.000 0.845 490 Q CB -0.220 28.527 28.738 0.016 0.000 0.913 490 Q HN 0.408 8.678 8.270 -0.000 0.000 0.420 491 K N 0.407 120.815 120.400 0.012 0.000 2.127 491 K HA -0.233 4.087 4.320 0.001 0.000 0.212 491 K C 2.044 178.652 176.600 0.013 0.000 1.050 491 K CA 1.696 57.990 56.287 0.012 0.000 0.929 491 K CB -0.453 32.053 32.500 0.010 0.000 0.715 491 K HN 0.241 8.491 8.250 -0.000 0.000 0.457 492 I N 0.761 121.337 120.570 0.011 0.000 2.264 492 I HA -0.238 3.933 4.170 0.001 0.000 0.248 492 I C 1.410 177.539 176.117 0.020 0.000 1.111 492 I CA 0.771 62.078 61.300 0.012 0.000 1.382 492 I CB -0.309 37.695 38.000 0.007 0.000 1.060 492 I HN 0.117 8.327 8.210 -0.000 0.000 0.418 493 S N 0.000 115.713 115.700 0.022 0.000 2.498 493 S HA 0.000 4.471 4.470 0.001 0.000 0.327 493 S CA 0.000 58.220 58.200 0.033 0.000 1.107 493 S CB 0.000 63.219 63.200 0.032 0.000 0.593 493 S HN 0.000 8.310 8.310 -0.000 0.000 0.517