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_G 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 IASDMTXXXX XXQLWLITHY 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 0.000 176.284 176.300 -0.027 0.000 1.140 0 M CA 0.000 55.301 55.300 0.002 0.000 0.988 0 M CB 0.000 32.600 32.600 -0.000 0.000 1.302 196 R N 1.377 121.868 120.500 -0.015 0.000 2.227 196 R HA -0.174 4.158 4.340 -0.014 0.000 0.246 196 R C 2.248 178.546 176.300 -0.003 0.000 1.119 196 R CA 3.202 59.302 56.100 0.000 0.000 0.930 196 R CB -2.489 27.818 30.300 0.011 0.000 0.912 196 R HN 1.409 9.679 8.270 -0.000 0.000 0.435 197 T N -2.145 112.416 114.554 0.012 0.000 3.341 197 T HA 0.487 4.828 4.350 -0.014 0.000 0.234 197 T C 1.014 175.770 174.700 0.094 0.000 0.890 197 T CA 0.197 62.331 62.100 0.057 0.000 0.952 197 T CB 0.432 69.349 68.868 0.081 0.000 1.146 197 T HN 0.240 8.480 8.240 -0.000 0.000 0.591 198 V N -0.142 119.771 119.914 -0.001 0.000 2.911 198 V HA 0.335 4.447 4.120 -0.014 0.000 0.237 198 V C 2.826 178.955 176.094 0.059 0.000 1.156 198 V CA 0.591 62.841 62.300 -0.084 0.000 1.180 198 V CB -0.966 30.588 31.823 -0.448 0.000 0.932 198 V HN 0.598 8.788 8.190 -0.000 0.000 0.483 199 A N 0.872 123.723 122.820 0.053 0.000 2.015 199 A HA -0.115 4.197 4.320 -0.014 0.000 0.219 199 A C 2.426 180.068 177.584 0.097 0.000 1.163 199 A CA 2.132 54.264 52.037 0.158 0.000 0.646 199 A CB -0.600 18.484 19.000 0.141 0.000 0.806 199 A HN 0.514 8.664 8.150 -0.000 0.000 0.448 200 R N -1.669 118.856 120.500 0.042 0.000 2.090 200 R HA 0.036 4.367 4.340 -0.014 0.000 0.228 200 R C 2.360 178.708 176.300 0.080 0.000 1.110 200 R CA 2.168 58.281 56.100 0.023 0.000 0.973 200 R CB -1.691 28.617 30.300 0.014 0.000 0.869 200 R HN 0.826 9.096 8.270 -0.000 0.000 0.440 201 Q N -0.141 119.751 119.800 0.154 0.000 2.354 201 Q HA 0.425 4.757 4.340 -0.014 0.000 0.203 201 Q C 1.363 177.479 176.000 0.193 0.000 0.933 201 Q CA 0.695 56.601 55.803 0.171 0.000 0.901 201 Q CB -0.376 28.529 28.738 0.279 0.000 1.007 201 Q HN 0.468 8.738 8.270 -0.000 0.000 0.495 202 V N 2.018 122.090 119.914 0.264 0.000 2.540 202 V HA 0.412 4.524 4.120 -0.014 0.000 0.297 202 V C 0.512 176.685 176.094 0.132 0.000 1.024 202 V CA 0.083 62.523 62.300 0.232 0.000 1.105 202 V CB 0.579 32.538 31.823 0.227 0.000 0.938 202 V HN 0.627 8.817 8.190 -0.000 0.000 0.482 203 A N 7.169 130.026 122.820 0.062 0.000 2.292 203 A HA 0.726 5.038 4.320 -0.014 0.000 0.319 203 A C -0.455 177.112 177.584 -0.029 0.000 1.206 203 A CA -0.653 51.388 52.037 0.006 0.000 0.835 203 A CB 0.451 19.441 19.000 -0.016 0.000 1.164 203 A HN 0.803 8.953 8.150 -0.000 0.000 0.505 204 L N 3.572 124.738 121.223 -0.095 0.000 2.290 204 L HA 0.318 4.650 4.340 -0.014 0.000 0.284 204 L C 0.583 177.452 176.870 -0.001 0.000 1.078 204 L CA -0.524 54.226 54.840 -0.150 0.000 0.815 204 L CB 1.093 42.822 42.059 -0.550 0.000 1.162 204 L HN 0.580 8.810 8.230 -0.000 0.000 0.435 205 V N 1.034 121.022 119.914 0.124 0.000 2.854 205 V HA 0.194 4.305 4.120 -0.014 0.000 0.236 205 V C 0.764 177.000 176.094 0.237 0.000 1.157 205 V CA 1.148 63.527 62.300 0.131 0.000 1.187 205 V CB 0.548 32.393 31.823 0.037 0.000 0.949 205 V HN 0.853 9.043 8.190 -0.000 0.000 0.488 206 E N -1.058 119.291 120.200 0.249 0.000 2.290 206 E HA 0.499 4.841 4.350 -0.014 0.000 0.274 206 E C -1.004 175.524 176.600 -0.120 0.000 0.889 206 E CA -0.221 56.227 56.400 0.080 0.000 0.760 206 E CB 1.150 30.853 29.700 0.005 0.000 1.206 206 E HN 0.290 8.650 8.360 -0.000 0.000 0.419 207 C N 3.491 122.398 119.300 -0.656 0.000 2.442 207 C HA 0.530 4.982 4.460 -0.014 0.000 0.362 207 C C 1.499 176.223 174.990 -0.443 0.000 1.242 207 C CA 0.454 58.844 59.018 -1.046 0.000 1.741 207 C CB -1.290 25.595 27.740 -1.425 0.000 2.378 207 C HN 1.077 9.307 8.230 -0.000 0.000 0.549 208 V N 4.206 123.964 119.914 -0.260 0.000 3.578 208 V HA 0.567 4.679 4.120 -0.014 0.000 0.290 208 V C 0.757 176.821 176.094 -0.051 0.000 1.376 208 V CA 0.702 62.957 62.300 -0.075 0.000 1.083 208 V CB -0.494 31.376 31.823 0.077 0.000 0.911 208 V HN 1.047 9.237 8.190 -0.000 0.000 0.433 209 G N -0.738 108.002 108.800 -0.101 0.000 2.703 209 G HA2 0.739 4.691 3.960 -0.014 0.000 0.294 209 G HA3 0.739 4.691 3.960 -0.014 0.000 0.294 209 G C -1.277 173.586 174.900 -0.062 0.000 1.451 209 G CA 0.020 45.115 45.100 -0.009 0.000 0.869 209 G HN 0.662 8.952 8.290 -0.000 0.000 0.516 210 K N -0.754 119.604 120.400 -0.070 0.000 2.542 210 K HA 1.005 5.317 4.320 -0.014 0.000 0.259 210 K C -0.017 176.376 176.600 -0.344 0.000 0.932 210 K CA 0.079 56.235 56.287 -0.218 0.000 0.820 210 K CB 1.751 34.148 32.500 -0.171 0.000 1.345 210 K HN 2.519 10.769 8.250 -0.000 0.000 0.432 211 G N -1.150 107.269 108.800 -0.634 0.000 2.427 211 G HA2 0.552 4.504 3.960 -0.014 0.000 0.306 211 G HA3 0.552 4.504 3.960 -0.014 0.000 0.306 211 G C 0.665 175.237 174.900 -0.547 0.000 1.280 211 G CA 0.981 45.723 45.100 -0.595 0.000 0.837 211 G HN 1.353 9.643 8.290 -0.000 0.000 0.482 212 R N -1.228 119.089 120.500 -0.306 0.000 2.189 212 R HA 0.096 4.428 4.340 -0.014 0.000 0.218 212 R C 2.221 178.481 176.300 -0.067 0.000 1.074 212 R CA 2.486 58.515 56.100 -0.118 0.000 0.991 212 R CB -1.628 28.674 30.300 0.004 0.000 0.883 212 R HN 1.138 9.408 8.270 -0.000 0.000 0.457 213 Y N -2.085 118.229 120.300 0.023 0.000 2.439 213 Y HA 0.357 4.898 4.550 -0.015 0.000 0.292 213 Y C 1.231 177.117 175.900 -0.024 0.000 1.130 213 Y CA -0.145 57.965 58.100 0.016 0.000 1.254 213 Y CB -0.189 38.250 38.460 -0.034 0.000 1.000 213 Y HN 0.509 8.789 8.280 -0.000 0.000 0.554 214 G N -0.156 108.446 108.800 -0.331 0.000 2.204 214 G HA2 0.033 3.985 3.960 -0.014 0.000 0.153 214 G HA3 0.033 3.985 3.960 -0.014 0.000 0.153 214 G C -1.352 173.393 174.900 -0.258 0.000 1.295 214 G CA -0.379 44.635 45.100 -0.144 0.000 1.257 214 G HN 0.312 8.602 8.290 -0.000 0.000 0.495 215 E N -1.224 118.979 120.200 0.005 0.000 2.356 215 E HA 0.581 4.923 4.350 -0.014 0.000 0.275 215 E C -1.378 175.314 176.600 0.153 0.000 0.904 215 E CA -0.825 55.600 56.400 0.042 0.000 0.757 215 E CB 3.175 32.908 29.700 0.055 0.000 1.232 215 E HN 0.428 8.788 8.360 -0.000 0.000 0.442 216 V N 1.876 121.852 119.914 0.104 0.000 2.495 216 V HA 0.441 4.553 4.120 -0.014 0.000 0.298 216 V C -1.191 174.910 176.094 0.011 0.000 1.031 216 V CA -0.684 61.675 62.300 0.098 0.000 0.871 216 V CB 0.876 32.753 31.823 0.090 0.000 0.988 216 V HN 0.596 8.786 8.190 -0.000 0.000 0.432 217 W N 2.946 124.210 121.300 -0.061 0.000 2.761 217 W HA 0.649 5.300 4.660 -0.015 0.000 0.340 217 W C 0.207 176.664 176.519 -0.105 0.000 1.072 217 W CA -0.714 56.579 57.345 -0.087 0.000 1.215 217 W CB 1.460 30.820 29.460 -0.165 0.000 1.420 217 W HN 0.367 8.547 8.180 -0.000 0.000 0.519 218 R N 1.596 122.143 120.500 0.078 0.000 2.340 218 R HA 0.617 4.949 4.340 -0.014 0.000 0.300 218 R C 0.086 176.319 176.300 -0.112 0.000 1.069 218 R CA -0.079 55.870 56.100 -0.253 0.000 0.984 218 R CB 0.291 30.287 30.300 -0.506 0.000 1.003 218 R HN 0.731 9.001 8.270 -0.000 0.000 0.459 219 G N 3.542 112.247 108.800 -0.159 0.000 2.533 219 G HA2 0.431 4.382 3.960 -0.014 0.000 0.304 219 G HA3 0.431 4.382 3.960 -0.014 0.000 0.304 219 G C -1.579 173.291 174.900 -0.049 0.000 1.263 219 G CA -0.665 44.394 45.100 -0.069 0.000 0.964 219 G HN 0.408 8.698 8.290 -0.000 0.000 0.479 220 L N 0.997 122.218 121.223 -0.002 0.000 2.296 220 L HA 0.562 4.894 4.340 -0.014 0.000 0.286 220 L C -1.562 175.372 176.870 0.107 0.000 1.023 220 L CA -0.614 54.239 54.840 0.023 0.000 0.812 220 L CB 1.573 43.618 42.059 -0.024 0.000 1.223 220 L HN 0.766 8.996 8.230 -0.000 0.000 0.421 221 W N 5.101 126.376 121.300 -0.042 0.000 2.647 221 W HA 0.340 4.992 4.660 -0.013 0.000 0.328 221 W C 0.142 176.676 176.519 0.026 0.000 1.018 221 W CA -0.476 56.850 57.345 -0.031 0.000 1.245 221 W CB 0.381 29.854 29.460 0.022 0.000 1.356 221 W HN 0.718 8.898 8.180 -0.000 0.000 0.443 222 H N 4.712 123.263 119.070 -0.865 0.000 2.415 222 H HA -0.146 4.402 4.556 -0.014 0.000 0.323 222 H C 1.485 176.577 175.328 -0.395 0.000 1.035 222 H CA 2.170 57.718 56.048 -0.832 0.000 1.098 222 H CB -0.766 28.095 29.762 -1.501 0.000 1.575 222 H HN 1.105 9.385 8.280 -0.000 0.000 0.387 223 G N -0.417 108.292 108.800 -0.152 0.000 2.417 223 G HA2 -0.356 3.595 3.960 -0.014 0.000 0.233 223 G HA3 -0.356 3.595 3.960 -0.014 0.000 0.233 223 G C 0.387 175.287 174.900 0.000 0.000 1.103 223 G CA 0.510 45.574 45.100 -0.060 0.000 0.647 223 G HN 0.613 8.903 8.290 -0.000 0.000 0.512 224 E N 0.797 121.035 120.200 0.063 0.000 2.345 224 E HA 0.626 4.968 4.350 -0.014 0.000 0.259 224 E C -0.158 176.506 176.600 0.106 0.000 1.117 224 E CA -0.081 56.384 56.400 0.109 0.000 0.913 224 E CB 1.048 30.863 29.700 0.192 0.000 1.057 224 E HN 0.157 8.517 8.360 -0.000 0.000 0.432 225 S N 0.632 116.377 115.700 0.075 0.000 2.508 225 S HA 0.433 4.895 4.470 -0.014 0.000 0.284 225 S C -0.520 174.118 174.600 0.063 0.000 1.192 225 S CA -0.837 57.373 58.200 0.015 0.000 1.070 225 S CB 0.901 64.090 63.200 -0.018 0.000 1.004 225 S HN 0.393 8.703 8.310 -0.000 0.000 0.493 226 V N 0.213 120.135 119.914 0.012 0.000 3.001 226 V HA 1.002 5.114 4.120 -0.014 0.000 0.314 226 V C -0.263 175.847 176.094 0.027 0.000 1.099 226 V CA -1.388 60.947 62.300 0.059 0.000 0.989 226 V CB 1.408 33.259 31.823 0.048 0.000 1.040 226 V HN 0.879 9.069 8.190 -0.000 0.000 0.434 227 A N 2.222 125.117 122.820 0.126 0.000 2.290 227 A HA 0.792 5.104 4.320 -0.014 0.000 0.310 227 A C -0.433 177.179 177.584 0.048 0.000 1.202 227 A CA -0.559 51.572 52.037 0.156 0.000 0.837 227 A CB 1.047 20.180 19.000 0.222 0.000 1.139 227 A HN 1.411 9.561 8.150 -0.000 0.000 0.509 228 V N 3.724 123.645 119.914 0.012 0.000 2.325 228 V HA 0.263 4.375 4.120 -0.014 0.000 0.280 228 V C 0.191 176.243 176.094 -0.071 0.000 1.016 228 V CA -0.586 61.648 62.300 -0.110 0.000 0.818 228 V CB 1.084 32.681 31.823 -0.376 0.000 1.019 228 V HN 0.905 9.095 8.190 -0.000 0.000 0.434 229 K N 5.643 126.043 120.400 -0.000 0.000 2.284 229 K HA 0.501 4.813 4.320 -0.014 0.000 0.287 229 K C -0.650 175.962 176.600 0.021 0.000 1.081 229 K CA -0.381 55.903 56.287 -0.005 0.000 0.910 229 K CB 0.500 32.961 32.500 -0.065 0.000 1.088 229 K HN 0.628 8.878 8.250 -0.000 0.000 0.478 230 I N 5.896 126.462 120.570 -0.008 0.000 2.304 230 I HA 0.176 4.338 4.170 -0.014 0.000 0.291 230 I C -0.207 176.024 176.117 0.189 0.000 1.018 230 I CA -0.660 60.701 61.300 0.103 0.000 1.260 230 I CB 0.462 38.488 38.000 0.043 0.000 1.390 230 I HN 0.449 8.659 8.210 -0.000 0.000 0.475 231 F N 3.986 124.055 119.950 0.199 0.000 2.389 231 F HA 0.207 4.727 4.527 -0.012 0.000 0.337 231 F C 1.256 177.133 175.800 0.129 0.000 1.112 231 F CA -0.212 57.907 58.000 0.198 0.000 1.192 231 F CB 1.173 40.303 39.000 0.216 0.000 1.185 231 F HN 0.480 8.780 8.300 -0.000 0.000 0.552 232 S N 0.517 116.384 115.700 0.279 0.000 2.617 232 S HA 0.146 4.608 4.470 -0.014 0.000 0.269 232 S C 0.841 175.544 174.600 0.172 0.000 1.292 232 S CA -0.632 57.669 58.200 0.169 0.000 1.010 232 S CB 1.395 64.656 63.200 0.101 0.000 0.944 232 S HN 0.613 8.923 8.310 -0.000 0.000 0.536 233 S N 1.361 117.125 115.700 0.106 0.000 2.399 233 S HA -0.065 4.397 4.470 -0.014 0.000 0.231 233 S C 2.407 177.057 174.600 0.084 0.000 1.022 233 S CA 1.219 59.465 58.200 0.076 0.000 0.983 233 S CB -0.789 62.438 63.200 0.046 0.000 0.803 233 S HN 0.914 9.224 8.310 -0.000 0.000 0.480 234 R N 1.031 121.586 120.500 0.091 0.000 2.316 234 R HA 0.074 4.405 4.340 -0.014 0.000 0.202 234 R C 1.205 177.584 176.300 0.133 0.000 1.029 234 R CA 1.452 57.607 56.100 0.092 0.000 1.018 234 R CB -0.761 29.585 30.300 0.077 0.000 0.888 234 R HN 0.360 8.630 8.270 -0.000 0.000 0.471 235 D N -1.152 119.364 120.400 0.193 0.000 2.599 235 D HA 0.112 4.744 4.640 -0.014 0.000 0.249 235 D C 0.799 177.279 176.300 0.300 0.000 1.313 235 D CA -0.190 53.976 54.000 0.276 0.000 0.815 235 D CB 0.163 41.193 40.800 0.384 0.000 1.077 235 D HN 0.566 8.936 8.370 -0.000 0.000 0.492 236 E N -0.159 120.155 120.200 0.190 0.000 2.171 236 E HA -0.203 4.139 4.350 -0.014 0.000 0.197 236 E C 1.551 178.270 176.600 0.198 0.000 0.997 236 E CA 0.908 57.388 56.400 0.134 0.000 0.810 236 E CB 0.202 29.935 29.700 0.054 0.000 0.738 236 E HN 0.422 8.782 8.360 -0.000 0.000 0.467 237 Q N -0.074 119.829 119.800 0.172 0.000 2.297 237 Q HA -0.055 4.277 4.340 -0.014 0.000 0.204 237 Q C 2.217 178.341 176.000 0.206 0.000 0.962 237 Q CA 0.725 56.640 55.803 0.187 0.000 0.879 237 Q CB 0.155 28.964 28.738 0.119 0.000 0.947 237 Q HN 0.150 8.420 8.270 -0.000 0.000 0.462 238 S N 0.385 116.205 115.700 0.200 0.000 2.368 238 S HA -0.144 4.318 4.470 -0.014 0.000 0.224 238 S C 1.265 175.899 174.600 0.057 0.000 1.029 238 S CA 0.827 59.146 58.200 0.199 0.000 0.988 238 S CB -0.353 63.074 63.200 0.379 0.000 0.838 238 S HN 0.571 8.881 8.310 -0.000 0.000 0.462 239 W N 1.556 122.559 121.300 -0.494 0.000 2.342 239 W HA -0.197 4.454 4.660 -0.015 0.000 0.297 239 W C 1.775 178.162 176.519 -0.220 0.000 1.213 239 W CA 1.220 58.068 57.345 -0.829 0.000 1.251 239 W CB -0.497 28.277 29.460 -1.142 0.000 1.136 239 W HN 0.269 8.449 8.180 -0.000 0.000 0.526 240 F N 1.640 121.524 119.950 -0.110 0.000 2.084 240 F HA -0.142 4.388 4.527 0.006 0.000 0.296 240 F C 2.637 178.255 175.800 -0.304 0.000 1.111 240 F CA 2.438 60.286 58.000 -0.254 0.000 1.224 240 F CB -0.947 38.078 39.000 0.042 0.000 0.991 240 F HN -0.203 8.097 8.300 -0.000 0.000 0.471 241 R N 0.919 121.336 120.500 -0.139 0.000 2.081 241 R HA -0.183 4.149 4.340 -0.014 0.000 0.235 241 R C 2.212 178.321 176.300 -0.317 0.000 1.131 241 R CA 2.132 58.101 56.100 -0.218 0.000 0.960 241 R CB -0.913 29.348 30.300 -0.066 0.000 0.856 241 R HN 0.500 8.770 8.270 -0.000 0.000 0.436 242 E N -1.439 118.603 120.200 -0.263 0.000 2.107 242 E HA -0.100 4.242 4.350 -0.014 0.000 0.191 242 E C 1.326 177.749 176.600 -0.295 0.000 0.982 242 E CA 1.520 57.785 56.400 -0.224 0.000 0.809 242 E CB 0.078 29.786 29.700 0.013 0.000 0.756 242 E HN 0.359 8.719 8.360 -0.000 0.000 0.459 243 T N 0.604 114.853 114.554 -0.508 0.000 2.777 243 T HA -0.151 4.191 4.350 -0.014 0.000 0.266 243 T C 1.617 175.995 174.700 -0.537 0.000 1.040 243 T CA 1.112 62.864 62.100 -0.581 0.000 1.141 243 T CB -0.135 68.152 68.868 -0.969 0.000 0.868 243 T HN 0.245 8.485 8.240 -0.000 0.000 0.444 244 E N 0.662 120.491 120.200 -0.618 0.000 2.031 244 E HA -0.117 4.225 4.350 -0.014 0.000 0.193 244 E C 2.233 178.598 176.600 -0.392 0.000 0.994 244 E CA 1.091 57.173 56.400 -0.529 0.000 0.800 244 E CB -0.193 29.141 29.700 -0.609 0.000 0.752 244 E HN 0.454 8.814 8.360 -0.000 0.000 0.447 245 I N 0.098 120.430 120.570 -0.398 0.000 2.179 245 I HA -0.286 3.876 4.170 -0.014 0.000 0.242 245 I C 2.229 178.110 176.117 -0.394 0.000 1.088 245 I CA 1.145 62.218 61.300 -0.379 0.000 1.357 245 I CB -0.349 37.389 38.000 -0.436 0.000 1.051 245 I HN 0.198 8.408 8.210 -0.000 0.000 0.409 246 Y N 0.868 120.869 120.300 -0.497 0.000 2.352 246 Y HA -0.143 4.398 4.550 -0.015 0.000 0.292 246 Y C 2.317 177.830 175.900 -0.645 0.000 1.136 246 Y CA 1.028 58.701 58.100 -0.711 0.000 1.227 246 Y CB -0.499 37.121 38.460 -1.400 0.000 0.991 246 Y HN 0.226 8.506 8.280 -0.000 0.000 0.545 247 N N -1.692 116.791 118.700 -0.362 0.000 2.424 247 N HA -0.039 4.692 4.740 -0.014 0.000 0.178 247 N C 1.373 176.800 175.510 -0.138 0.000 1.060 247 N CA 1.081 54.010 53.050 -0.202 0.000 0.901 247 N CB 0.105 38.486 38.487 -0.175 0.000 0.979 247 N HN 0.222 8.602 8.380 -0.000 0.000 0.451 248 T N -0.613 113.840 114.554 -0.168 0.000 2.978 248 T HA 0.237 4.579 4.350 -0.014 0.000 0.248 248 T C 0.395 175.029 174.700 -0.110 0.000 1.018 248 T CA 0.080 62.100 62.100 -0.133 0.000 1.026 248 T CB 1.045 69.816 68.868 -0.160 0.000 1.032 248 T HN -0.216 8.024 8.240 -0.000 0.000 0.485 249 V N 2.781 122.621 119.914 -0.124 0.000 2.417 249 V HA 0.471 4.583 4.120 -0.014 0.000 0.291 249 V C -0.555 175.508 176.094 -0.051 0.000 1.024 249 V CA -1.086 61.153 62.300 -0.101 0.000 0.861 249 V CB 1.776 33.515 31.823 -0.140 0.000 0.985 249 V HN 0.222 8.412 8.190 -0.000 0.000 0.436 250 L N 5.539 126.750 121.223 -0.020 0.000 2.536 250 L HA 0.242 4.574 4.340 -0.014 0.000 0.282 250 L C 0.443 177.355 176.870 0.071 0.000 1.147 250 L CA 0.737 55.594 54.840 0.030 0.000 0.936 250 L CB 0.200 42.278 42.059 0.031 0.000 1.279 250 L HN 0.649 8.879 8.230 -0.000 0.000 0.461 251 L N 3.373 124.664 121.223 0.113 0.000 2.920 251 L HA 0.337 4.669 4.340 -0.014 0.000 0.257 251 L C 0.819 177.852 176.870 0.272 0.000 1.150 251 L CA 0.088 55.046 54.840 0.195 0.000 0.959 251 L CB -0.433 41.686 42.059 0.101 0.000 1.321 251 L HN 0.588 8.818 8.230 -0.000 0.000 0.555 252 R N 1.378 121.997 120.500 0.200 0.000 2.523 252 R HA -0.036 4.296 4.340 -0.014 0.000 0.281 252 R C -1.022 175.366 176.300 0.146 0.000 0.969 252 R CA 0.892 57.093 56.100 0.169 0.000 1.093 252 R CB -0.403 29.970 30.300 0.121 0.000 0.917 252 R HN 0.390 8.660 8.270 -0.000 0.000 0.408 253 H N 2.762 121.822 119.070 -0.016 0.000 3.121 253 H HA 0.060 4.608 4.556 -0.014 0.000 0.337 253 H C -0.323 174.981 175.328 -0.040 0.000 1.198 253 H CA -0.519 55.441 56.048 -0.147 0.000 1.274 253 H CB 1.419 30.897 29.762 -0.474 0.000 1.954 253 H HN 0.576 8.856 8.280 -0.000 0.000 0.531 254 D N 2.197 122.427 120.400 -0.284 0.000 2.190 254 D HA -0.142 4.490 4.640 -0.014 0.000 0.200 254 D C 0.435 176.798 176.300 0.106 0.000 0.992 254 D CA 1.446 55.401 54.000 -0.075 0.000 0.854 254 D CB 0.126 40.827 40.800 -0.166 0.000 0.936 254 D HN 0.512 8.882 8.370 -0.000 0.000 0.462 255 N N -0.563 118.348 118.700 0.351 0.000 2.320 255 N HA 0.267 4.999 4.740 -0.014 0.000 0.237 255 N C -0.398 175.238 175.510 0.211 0.000 1.129 255 N CA -0.034 53.173 53.050 0.261 0.000 0.854 255 N CB 0.978 39.620 38.487 0.259 0.000 1.083 255 N HN 0.097 8.477 8.380 -0.000 0.000 0.504 256 I N 0.769 121.476 120.570 0.229 0.000 2.619 256 I HA 0.202 4.364 4.170 -0.014 0.000 0.292 256 I C -0.867 175.394 176.117 0.241 0.000 1.100 256 I CA -1.215 60.217 61.300 0.219 0.000 1.043 256 I CB 2.309 40.444 38.000 0.225 0.000 1.239 256 I HN -0.063 8.147 8.210 -0.000 0.000 0.420 257 L N 5.416 126.793 121.223 0.258 0.000 2.513 257 L HA 0.308 4.639 4.340 -0.014 0.000 0.272 257 L C 0.681 177.664 176.870 0.188 0.000 1.187 257 L CA 0.532 55.528 54.840 0.259 0.000 0.895 257 L CB 0.419 42.630 42.059 0.252 0.000 1.147 257 L HN 0.673 8.903 8.230 -0.000 0.000 0.483 258 G N 4.813 113.645 108.800 0.053 0.000 2.406 258 G HA2 0.191 4.143 3.960 -0.014 0.000 0.251 258 G HA3 0.191 4.143 3.960 -0.014 0.000 0.251 258 G C -0.829 173.803 174.900 -0.448 0.000 1.271 258 G CA -0.454 44.473 45.100 -0.289 0.000 0.859 258 G HN 0.659 8.949 8.290 -0.000 0.000 0.540 259 F N 2.771 122.387 119.950 -0.556 0.000 2.404 259 F HA 0.559 5.077 4.527 -0.015 0.000 0.339 259 F C 0.809 176.352 175.800 -0.427 0.000 1.105 259 F CA -0.901 56.708 58.000 -0.652 0.000 1.087 259 F CB 1.123 39.582 39.000 -0.901 0.000 1.143 259 F HN 0.305 8.605 8.300 -0.000 0.000 0.491 260 I N 3.524 123.472 120.570 -1.038 0.000 3.366 260 I HA 0.426 4.588 4.170 -0.014 0.000 0.267 260 I C 0.334 175.800 176.117 -1.084 0.000 1.149 260 I CA 0.074 60.879 61.300 -0.825 0.000 1.436 260 I CB 0.372 38.063 38.000 -0.515 0.000 1.379 260 I HN 0.643 8.853 8.210 -0.000 0.000 0.460 261 A N -0.190 121.888 122.820 -1.238 0.000 2.601 261 A HA 0.694 5.005 4.320 -0.014 0.000 0.291 261 A C -1.174 176.221 177.584 -0.314 0.000 1.075 261 A CA -0.323 51.273 52.037 -0.734 0.000 0.671 261 A CB 1.742 20.547 19.000 -0.326 0.000 1.277 261 A HN -0.042 8.108 8.150 -0.000 0.000 0.417 262 S N 0.173 115.929 115.700 0.094 0.000 2.571 262 S HA 0.713 5.175 4.470 -0.014 0.000 0.284 262 S C -1.778 173.024 174.600 0.338 0.000 1.128 262 S CA -0.382 58.018 58.200 0.334 0.000 0.970 262 S CB 1.486 64.878 63.200 0.320 0.000 1.039 262 S HN 0.767 9.077 8.310 -0.000 0.000 0.485 263 D N 2.040 122.716 120.400 0.460 0.000 2.579 263 D HA 0.432 5.064 4.640 -0.014 0.000 0.257 263 D C -1.375 175.044 176.300 0.199 0.000 1.176 263 D CA -0.396 53.761 54.000 0.262 0.000 0.914 263 D CB 2.000 42.842 40.800 0.070 0.000 1.431 263 D HN 0.597 8.967 8.370 -0.000 0.000 0.454 264 M N 1.891 121.492 119.600 0.002 0.000 2.067 264 M HA 0.419 4.891 4.480 -0.014 0.000 0.286 264 M C -1.527 174.634 176.300 -0.232 0.000 0.922 264 M CA -0.055 55.151 55.300 -0.156 0.000 0.937 264 M CB 1.120 33.667 32.600 -0.088 0.000 1.550 264 M HN 0.308 8.598 8.290 -0.000 0.000 0.433 273 L N 1.815 122.978 121.223 -0.100 0.000 2.296 273 L HA 0.793 5.125 4.340 -0.014 0.000 0.286 273 L C -0.894 176.149 176.870 0.287 0.000 1.023 273 L CA -0.627 53.970 54.840 -0.404 0.000 0.812 273 L CB 1.031 42.381 42.059 -1.181 0.000 1.223 273 L HN 0.905 9.135 8.230 -0.000 0.000 0.421 274 W N 3.945 125.309 121.300 0.107 0.000 2.689 274 W HA 0.556 5.207 4.660 -0.015 0.000 0.340 274 W C -0.536 176.331 176.519 0.581 0.000 1.060 274 W CA -0.812 56.737 57.345 0.340 0.000 1.218 274 W CB 1.610 31.180 29.460 0.184 0.000 1.410 274 W HN 0.111 8.291 8.180 -0.000 0.000 0.528 275 L N 4.944 126.605 121.223 0.729 0.000 2.376 275 L HA 0.551 4.883 4.340 -0.014 0.000 0.275 275 L C -1.046 175.985 176.870 0.270 0.000 0.987 275 L CA -0.810 54.356 54.840 0.544 0.000 0.828 275 L CB 1.208 43.683 42.059 0.695 0.000 1.249 275 L HN 0.364 8.594 8.230 -0.000 0.000 0.409 276 I N 4.242 124.873 120.570 0.102 0.000 2.377 276 I HA 0.495 4.657 4.170 -0.014 0.000 0.293 276 I C 0.456 176.463 176.117 -0.184 0.000 0.987 276 I CA -0.060 61.218 61.300 -0.037 0.000 1.185 276 I CB 2.091 40.054 38.000 -0.062 0.000 1.341 276 I HN 0.652 8.862 8.210 -0.000 0.000 0.455 277 T N 0.266 114.753 114.554 -0.112 0.000 2.778 277 T HA 0.460 4.802 4.350 -0.014 0.000 0.293 277 T C -0.269 174.395 174.700 -0.059 0.000 1.144 277 T CA -0.920 61.082 62.100 -0.163 0.000 1.010 277 T CB 0.759 69.583 68.868 -0.073 0.000 1.325 277 T HN 0.495 8.735 8.240 -0.000 0.000 0.515 278 H N -0.572 118.442 119.070 -0.093 0.000 2.929 278 H HA 0.250 4.798 4.556 -0.013 0.000 0.358 278 H C -1.056 174.152 175.328 -0.200 0.000 1.111 278 H CA -0.077 55.883 56.048 -0.147 0.000 1.409 278 H CB 0.291 29.940 29.762 -0.188 0.000 1.373 278 H HN 0.549 8.829 8.280 -0.000 0.000 0.610 279 Y N 1.340 121.499 120.300 -0.235 0.000 2.377 279 Y HA 0.239 4.781 4.550 -0.014 0.000 0.339 279 Y C -0.900 174.745 175.900 -0.424 0.000 1.011 279 Y CA -0.910 57.045 58.100 -0.242 0.000 1.093 279 Y CB 0.841 39.248 38.460 -0.088 0.000 1.201 279 Y HN 0.625 8.905 8.280 -0.000 0.000 0.455 280 H N 4.369 123.081 119.070 -0.597 0.000 2.646 280 H HA 0.254 4.802 4.556 -0.014 0.000 0.328 280 H C 0.503 175.384 175.328 -0.745 0.000 0.998 280 H CA -0.592 55.162 56.048 -0.490 0.000 1.225 280 H CB 1.657 31.272 29.762 -0.244 0.000 1.457 280 H HN 0.795 9.075 8.280 -0.000 0.000 0.505 281 E N 1.544 121.481 120.200 -0.438 0.000 2.085 281 E HA -0.211 4.131 4.350 -0.014 0.000 0.194 281 E C 0.775 177.313 176.600 -0.104 0.000 0.994 281 E CA 1.137 57.372 56.400 -0.275 0.000 0.801 281 E CB 0.060 29.692 29.700 -0.112 0.000 0.743 281 E HN 0.732 9.092 8.360 -0.000 0.000 0.453 282 H N -0.286 118.752 119.070 -0.053 0.000 2.518 282 H HA -0.001 4.546 4.556 -0.014 0.000 0.289 282 H C 1.246 176.585 175.328 0.017 0.000 1.051 282 H CA -0.027 56.037 56.048 0.027 0.000 1.280 282 H CB 0.140 29.904 29.762 0.002 0.000 1.380 282 H HN 0.269 8.549 8.280 -0.000 0.000 0.566 283 G N 0.223 109.049 108.800 0.043 0.000 2.553 283 G HA2 -0.325 3.627 3.960 -0.014 0.000 0.242 283 G HA3 -0.325 3.627 3.960 -0.014 0.000 0.242 283 G C 0.132 175.049 174.900 0.029 0.000 1.277 283 G CA -0.133 44.978 45.100 0.018 0.000 0.910 283 G HN 0.535 8.825 8.290 -0.000 0.000 0.576 284 S N -0.651 115.074 115.700 0.042 0.000 2.624 284 S HA 0.498 4.960 4.470 -0.014 0.000 0.263 284 S C 1.507 176.145 174.600 0.064 0.000 1.287 284 S CA 0.318 58.536 58.200 0.031 0.000 0.990 284 S CB 1.511 64.731 63.200 0.033 0.000 0.950 284 S HN 1.775 10.085 8.310 -0.000 0.000 0.561 285 L N 0.564 121.807 121.223 0.034 0.000 2.083 285 L HA -0.020 4.312 4.340 -0.014 0.000 0.209 285 L C 2.137 179.062 176.870 0.093 0.000 1.083 285 L CA 1.759 56.636 54.840 0.062 0.000 0.752 285 L CB -1.344 40.723 42.059 0.014 0.000 0.899 285 L HN 0.865 9.095 8.230 -0.000 0.000 0.433 286 Y N 0.518 120.789 120.300 -0.048 0.000 2.081 286 Y HA -0.325 4.218 4.550 -0.012 0.000 0.280 286 Y C 2.348 178.118 175.900 -0.217 0.000 1.163 286 Y CA 2.311 60.326 58.100 -0.142 0.000 1.135 286 Y CB -0.333 38.078 38.460 -0.081 0.000 0.970 286 Y HN 0.327 8.607 8.280 -0.000 0.000 0.498 287 D N -0.436 120.016 120.400 0.086 0.000 2.104 287 D HA -0.230 4.402 4.640 -0.014 0.000 0.194 287 D C 2.047 178.314 176.300 -0.056 0.000 0.994 287 D CA 1.668 55.673 54.000 0.009 0.000 0.830 287 D CB -0.748 40.111 40.800 0.100 0.000 0.959 287 D HN 0.405 8.775 8.370 -0.000 0.000 0.452 288 F N 1.540 121.403 119.950 -0.144 0.000 2.102 288 F HA -0.087 4.431 4.527 -0.014 0.000 0.298 288 F C 2.269 177.948 175.800 -0.202 0.000 1.105 288 F CA 1.019 58.919 58.000 -0.167 0.000 1.239 288 F CB -0.326 38.586 39.000 -0.147 0.000 0.991 288 F HN -0.142 8.158 8.300 -0.000 0.000 0.474 289 L N -0.230 120.909 121.223 -0.140 0.000 2.275 289 L HA -0.193 4.139 4.340 -0.014 0.000 0.215 289 L C 2.328 178.979 176.870 -0.366 0.000 1.119 289 L CA 0.997 55.700 54.840 -0.229 0.000 0.790 289 L CB -0.718 41.294 42.059 -0.078 0.000 0.919 289 L HN 0.259 8.489 8.230 -0.000 0.000 0.443 290 Q N 0.564 120.053 119.800 -0.518 0.000 2.020 290 Q HA -0.205 4.127 4.340 -0.014 0.000 0.202 290 Q C 2.583 178.411 176.000 -0.286 0.000 0.982 290 Q CA 2.820 58.341 55.803 -0.471 0.000 0.838 290 Q CB -0.043 28.416 28.738 -0.466 0.000 0.899 290 Q HN 0.418 8.688 8.270 -0.000 0.000 0.423 291 R N -0.664 119.661 120.500 -0.291 0.000 2.156 291 R HA 0.365 4.697 4.340 -0.014 0.000 0.207 291 R C 1.208 177.326 176.300 -0.304 0.000 1.040 291 R CA 1.315 57.266 56.100 -0.248 0.000 1.013 291 R CB -1.192 28.982 30.300 -0.210 0.000 0.931 291 R HN 0.450 8.720 8.270 -0.000 0.000 0.465 292 Q N 0.633 120.151 119.800 -0.470 0.000 2.274 292 Q HA 0.608 4.940 4.340 -0.014 0.000 0.260 292 Q C 0.213 175.978 176.000 -0.393 0.000 0.974 292 Q CA -0.212 55.269 55.803 -0.536 0.000 0.876 292 Q CB 0.951 29.033 28.738 -1.095 0.000 1.297 292 Q HN 0.790 9.060 8.270 -0.000 0.000 0.446 293 T N -0.917 113.476 114.554 -0.267 0.000 2.929 293 T HA 0.787 5.129 4.350 -0.014 0.000 0.284 293 T C -0.154 174.462 174.700 -0.139 0.000 1.014 293 T CA -0.653 61.342 62.100 -0.176 0.000 1.051 293 T CB 0.539 69.331 68.868 -0.128 0.000 1.028 293 T HN 0.582 8.822 8.240 -0.000 0.000 0.485 294 L N 1.884 123.055 121.223 -0.087 0.000 2.325 294 L HA 0.473 4.805 4.340 -0.014 0.000 0.281 294 L C 0.574 177.433 176.870 -0.017 0.000 1.004 294 L CA -0.978 53.844 54.840 -0.030 0.000 0.823 294 L CB 1.677 43.733 42.059 -0.005 0.000 1.236 294 L HN 0.817 9.047 8.230 -0.000 0.000 0.415 295 E N 5.047 125.252 120.200 0.009 0.000 2.415 295 E HA 0.040 4.382 4.350 -0.014 0.000 0.262 295 E C -1.760 174.863 176.600 0.040 0.000 1.038 295 E CA -1.315 55.100 56.400 0.024 0.000 0.921 295 E CB 1.325 31.052 29.700 0.046 0.000 0.950 295 E HN 0.323 8.683 8.360 -0.000 0.000 0.438 296 P HA -0.199 4.221 4.420 -0.000 0.000 0.216 296 P C 0.911 178.244 177.300 0.056 0.000 1.154 296 P CA 1.684 64.802 63.100 0.029 0.000 0.865 296 P CB -0.049 31.666 31.700 0.026 0.000 0.789 297 H N -0.839 118.229 119.070 -0.003 0.000 2.319 297 H HA -0.149 4.399 4.556 -0.013 0.000 0.299 297 H C 1.770 177.103 175.328 0.009 0.000 1.092 297 H CA 1.468 57.517 56.048 0.003 0.000 1.302 297 H CB -0.817 28.947 29.762 0.004 0.000 1.373 297 H HN -0.085 8.195 8.280 -0.000 0.000 0.497 298 L N 0.395 121.665 121.223 0.077 0.000 2.109 298 L HA 0.078 4.410 4.340 -0.014 0.000 0.207 298 L C 2.445 179.310 176.870 -0.010 0.000 1.086 298 L CA 1.851 56.711 54.840 0.034 0.000 0.760 298 L CB -1.495 40.630 42.059 0.110 0.000 0.910 298 L HN 0.415 8.645 8.230 -0.000 0.000 0.437 299 A N -0.368 122.452 122.820 -0.001 0.000 1.908 299 A HA -0.208 4.104 4.320 -0.014 0.000 0.218 299 A C 2.262 179.823 177.584 -0.038 0.000 1.181 299 A CA 1.981 54.010 52.037 -0.013 0.000 0.627 299 A CB -1.003 17.984 19.000 -0.021 0.000 0.818 299 A HN 0.485 8.635 8.150 -0.000 0.000 0.445 300 L N -0.475 120.708 121.223 -0.067 0.000 2.093 300 L HA -0.104 4.228 4.340 -0.014 0.000 0.208 300 L C 2.468 179.281 176.870 -0.096 0.000 1.085 300 L CA 2.317 57.111 54.840 -0.077 0.000 0.755 300 L CB -0.815 41.186 42.059 -0.096 0.000 0.904 300 L HN 0.582 8.812 8.230 -0.000 0.000 0.435 301 R N -0.458 119.949 120.500 -0.155 0.000 2.073 301 R HA -0.186 4.146 4.340 -0.014 0.000 0.234 301 R C 2.280 178.541 176.300 -0.066 0.000 1.134 301 R CA 1.426 57.444 56.100 -0.136 0.000 0.952 301 R CB -0.193 30.005 30.300 -0.170 0.000 0.850 301 R HN 0.270 8.540 8.270 -0.000 0.000 0.433 302 L N 0.654 121.845 121.223 -0.054 0.000 2.046 302 L HA -0.050 4.282 4.340 -0.014 0.000 0.208 302 L C 2.487 179.358 176.870 0.001 0.000 1.077 302 L CA 2.102 56.919 54.840 -0.038 0.000 0.747 302 L CB -1.041 40.998 42.059 -0.033 0.000 0.896 302 L HN 0.350 8.580 8.230 -0.000 0.000 0.432 303 A N -1.330 121.494 122.820 0.005 0.000 1.898 303 A HA -0.160 4.151 4.320 -0.014 0.000 0.216 303 A C 2.515 180.171 177.584 0.120 0.000 1.181 303 A CA 1.814 53.882 52.037 0.052 0.000 0.620 303 A CB -1.056 17.962 19.000 0.030 0.000 0.819 303 A HN 0.221 8.371 8.150 -0.000 0.000 0.442 304 V N 0.842 120.789 119.914 0.056 0.000 2.358 304 V HA -0.194 3.918 4.120 -0.014 0.000 0.246 304 V C 2.855 178.990 176.094 0.067 0.000 1.047 304 V CA 2.915 65.247 62.300 0.053 0.000 1.035 304 V CB -0.469 31.359 31.823 0.008 0.000 0.658 304 V HN 0.796 8.986 8.190 -0.000 0.000 0.452 305 S N 0.627 116.359 115.700 0.053 0.000 2.383 305 S HA -0.053 4.409 4.470 -0.014 0.000 0.227 305 S C 2.149 176.812 174.600 0.105 0.000 1.026 305 S CA 1.271 59.507 58.200 0.061 0.000 0.981 305 S CB -0.691 62.522 63.200 0.022 0.000 0.818 305 S HN 0.795 9.105 8.310 -0.000 0.000 0.472 306 A N 2.301 125.209 122.820 0.146 0.000 1.902 306 A HA 0.260 4.572 4.320 -0.014 0.000 0.217 306 A C 2.549 180.314 177.584 0.302 0.000 1.181 306 A CA 1.823 54.015 52.037 0.260 0.000 0.623 306 A CB -1.511 17.677 19.000 0.313 0.000 0.818 306 A HN 0.883 9.033 8.150 -0.000 0.000 0.443 307 A N -0.981 122.002 122.820 0.272 0.000 1.933 307 A HA -0.166 4.146 4.320 -0.014 0.000 0.218 307 A C 2.290 179.830 177.584 -0.073 0.000 1.175 307 A CA 1.688 53.718 52.037 -0.012 0.000 0.628 307 A CB -1.246 17.732 19.000 -0.037 0.000 0.814 307 A HN 0.617 8.767 8.150 -0.000 0.000 0.444 308 C N -1.058 118.250 119.300 0.014 0.000 2.432 308 C HA 0.023 4.475 4.460 -0.014 0.000 0.277 308 C C 3.016 177.972 174.990 -0.057 0.000 1.249 308 C CA 0.468 59.495 59.018 0.015 0.000 1.725 308 C CB -1.661 26.146 27.740 0.112 0.000 2.028 308 C HN 0.697 8.927 8.230 -0.000 0.000 0.477 309 G N 0.475 109.269 108.800 -0.011 0.000 2.514 309 G HA2 -0.264 3.688 3.960 -0.014 0.000 0.217 309 G HA3 -0.264 3.688 3.960 -0.014 0.000 0.217 309 G C 1.500 176.365 174.900 -0.059 0.000 1.198 309 G CA 1.224 46.303 45.100 -0.035 0.000 0.780 309 G HN 0.435 8.725 8.290 -0.000 0.000 0.565 310 L N 1.318 122.477 121.223 -0.106 0.000 2.083 310 L HA 0.168 4.500 4.340 -0.014 0.000 0.209 310 L C 3.146 179.781 176.870 -0.391 0.000 1.083 310 L CA 2.010 56.668 54.840 -0.304 0.000 0.752 310 L CB -0.703 41.024 42.059 -0.554 0.000 0.899 310 L HN 0.271 8.501 8.230 -0.000 0.000 0.433 311 A N -1.618 121.029 122.820 -0.287 0.000 1.902 311 A HA -0.294 4.018 4.320 -0.014 0.000 0.217 311 A C 2.397 179.934 177.584 -0.079 0.000 1.181 311 A CA 1.790 53.717 52.037 -0.183 0.000 0.623 311 A CB -1.056 17.873 19.000 -0.120 0.000 0.818 311 A HN 0.699 8.849 8.150 -0.000 0.000 0.443 312 H N -0.167 118.788 119.070 -0.192 0.000 2.353 312 H HA -0.055 4.492 4.556 -0.014 0.000 0.300 312 H C 1.964 177.233 175.328 -0.098 0.000 1.090 312 H CA 1.750 57.682 56.048 -0.193 0.000 1.327 312 H CB -0.128 29.352 29.762 -0.471 0.000 1.383 312 H HN 0.422 8.702 8.280 -0.000 0.000 0.508 313 L N -0.189 120.980 121.223 -0.089 0.000 2.017 313 L HA -0.223 4.109 4.340 -0.014 0.000 0.208 313 L C 2.687 179.598 176.870 0.069 0.000 1.073 313 L CA 1.502 56.328 54.840 -0.023 0.000 0.745 313 L CB -0.649 41.475 42.059 0.108 0.000 0.894 313 L HN 0.457 8.687 8.230 -0.000 0.000 0.432 314 H N -1.787 117.233 119.070 -0.082 0.000 2.395 314 H HA -0.018 4.530 4.556 -0.014 0.000 0.299 314 H C 0.717 176.017 175.328 -0.046 0.000 1.070 314 H CA 0.132 56.156 56.048 -0.040 0.000 1.356 314 H CB 0.386 30.099 29.762 -0.083 0.000 1.401 314 H HN 0.040 8.320 8.280 -0.000 0.000 0.524 315 V N 2.350 122.277 119.914 0.022 0.000 2.461 315 V HA 0.006 4.118 4.120 -0.014 0.000 0.275 315 V C 0.053 176.060 176.094 -0.145 0.000 1.047 315 V CA -0.264 62.012 62.300 -0.041 0.000 0.955 315 V CB 1.241 33.048 31.823 -0.027 0.000 0.988 315 V HN 0.289 8.479 8.190 -0.000 0.000 0.471 316 E N 5.577 125.653 120.200 -0.206 0.000 2.344 316 E HA 0.287 4.629 4.350 -0.014 0.000 0.270 316 E C -0.784 175.530 176.600 -0.476 0.000 1.021 316 E CA -0.297 55.858 56.400 -0.408 0.000 0.887 316 E CB 0.767 30.108 29.700 -0.597 0.000 0.997 316 E HN 0.667 9.027 8.360 -0.000 0.000 0.429 317 I N 4.597 124.925 120.570 -0.403 0.000 2.377 317 I HA 0.249 4.411 4.170 -0.014 0.000 0.293 317 I C -0.644 175.300 176.117 -0.289 0.000 0.987 317 I CA -0.638 60.516 61.300 -0.244 0.000 1.185 317 I CB 0.864 38.816 38.000 -0.080 0.000 1.341 317 I HN 0.433 8.643 8.210 -0.000 0.000 0.455 318 F N 3.524 123.471 119.950 -0.005 0.000 2.425 318 F HA 0.813 5.332 4.527 -0.013 0.000 0.331 318 F C 0.825 176.624 175.800 -0.002 0.000 1.085 318 F CA -0.290 57.706 58.000 -0.007 0.000 1.028 318 F CB 1.820 40.818 39.000 -0.003 0.000 1.177 318 F HN 0.590 8.890 8.300 -0.000 0.000 0.487 319 G N 0.989 109.904 108.800 0.191 0.000 2.355 319 G HA2 0.004 3.956 3.960 -0.014 0.000 0.619 319 G HA3 0.004 3.956 3.960 -0.014 0.000 0.619 319 G C 0.226 175.162 174.900 0.059 0.000 1.337 319 G CA -0.451 44.712 45.100 0.104 0.000 0.993 319 G HN 0.640 8.930 8.290 -0.000 0.000 0.599 320 T N 0.363 114.941 114.554 0.040 0.000 2.531 320 T HA -0.224 4.118 4.350 -0.014 0.000 0.261 320 T C 1.661 176.371 174.700 0.016 0.000 1.141 320 T CA 2.233 64.346 62.100 0.022 0.000 1.176 320 T CB -0.333 68.547 68.868 0.019 0.000 0.863 320 T HN 0.577 8.817 8.240 -0.000 0.000 0.424 321 Q N 1.650 121.463 119.800 0.022 0.000 2.620 321 Q HA 0.377 4.709 4.340 -0.014 0.000 0.333 321 Q C 0.683 176.693 176.000 0.017 0.000 1.017 321 Q CA -0.535 55.280 55.803 0.019 0.000 0.962 321 Q CB 0.275 29.029 28.738 0.027 0.000 1.297 321 Q HN 0.504 8.774 8.270 -0.000 0.000 0.419 322 G N 1.545 110.346 108.800 0.001 0.000 2.606 322 G HA2 0.521 4.473 3.960 -0.014 0.000 0.262 322 G HA3 0.521 4.473 3.960 -0.014 0.000 0.262 322 G C -0.600 174.262 174.900 -0.065 0.000 1.394 322 G CA -0.549 44.536 45.100 -0.026 0.000 1.044 322 G HN 0.264 8.554 8.290 -0.000 0.000 0.553 323 K N -0.617 119.704 120.400 -0.132 0.000 2.570 323 K HA 0.431 4.743 4.320 -0.014 0.000 0.256 323 K C -3.153 173.314 176.600 -0.221 0.000 0.939 323 K CA -1.437 54.758 56.287 -0.154 0.000 0.833 323 K CB 2.131 34.546 32.500 -0.141 0.000 1.318 323 K HN 0.350 8.600 8.250 -0.000 0.000 0.433 324 P HA 0.092 4.512 4.420 -0.000 0.000 0.273 324 P C -0.518 176.638 177.300 -0.239 0.000 1.250 324 P CA -0.424 62.534 63.100 -0.236 0.000 0.793 324 P CB 0.576 32.151 31.700 -0.208 0.000 1.011 325 A N 1.713 124.374 122.820 -0.265 0.000 2.450 325 A HA 0.423 4.735 4.320 -0.014 0.000 0.255 325 A C 0.237 177.768 177.584 -0.088 0.000 1.096 325 A CA -0.106 51.825 52.037 -0.175 0.000 0.778 325 A CB -0.829 18.057 19.000 -0.189 0.000 1.031 325 A HN 0.438 8.588 8.150 -0.000 0.000 0.494 326 I N 1.551 122.178 120.570 0.095 0.000 2.498 326 I HA 0.554 4.716 4.170 -0.014 0.000 0.290 326 I C 0.326 176.574 176.117 0.218 0.000 1.032 326 I CA -0.314 61.067 61.300 0.134 0.000 1.073 326 I CB 2.173 40.172 38.000 -0.002 0.000 1.251 326 I HN 0.676 8.886 8.210 -0.000 0.000 0.426 327 A N 4.195 127.119 122.820 0.174 0.000 2.330 327 A HA 0.404 4.716 4.320 -0.014 0.000 0.327 327 A C 0.470 178.113 177.584 0.098 0.000 1.155 327 A CA -0.431 51.622 52.037 0.026 0.000 0.803 327 A CB 0.646 19.492 19.000 -0.256 0.000 1.208 327 A HN 0.902 9.052 8.150 -0.000 0.000 0.477 328 H N 2.187 121.331 119.070 0.123 0.000 2.284 328 H HA -0.049 4.499 4.556 -0.013 0.000 0.304 328 H C 1.937 177.323 175.328 0.096 0.000 1.069 328 H CA 3.112 59.238 56.048 0.130 0.000 1.327 328 H CB 0.299 30.206 29.762 0.242 0.000 1.387 328 H HN 1.295 9.575 8.280 -0.000 0.000 0.498 329 R N 0.215 120.908 120.500 0.322 0.000 3.840 329 R HA -0.179 4.153 4.340 -0.014 0.000 0.464 329 R C 0.444 176.921 176.300 0.295 0.000 0.986 329 R CA 1.747 57.989 56.100 0.237 0.000 1.305 329 R CB -2.934 27.405 30.300 0.066 0.000 1.950 329 R HN 0.528 8.798 8.270 -0.000 0.000 0.526 330 D N -1.727 118.968 120.400 0.492 0.000 3.100 330 D HA 0.353 4.985 4.640 -0.014 0.000 0.350 330 D C -0.855 175.593 176.300 0.246 0.000 1.310 330 D CA -0.506 53.711 54.000 0.362 0.000 0.741 330 D CB -0.399 40.559 40.800 0.264 0.000 1.248 330 D HN 0.435 8.805 8.370 -0.000 0.000 0.527 331 F N 2.658 122.601 119.950 -0.013 0.000 2.472 331 F HA 0.327 4.846 4.527 -0.014 0.000 0.364 331 F C 0.385 175.991 175.800 -0.323 0.000 1.090 331 F CA 0.242 58.057 58.000 -0.307 0.000 1.188 331 F CB 0.190 39.100 39.000 -0.151 0.000 1.105 331 F HN 0.007 8.307 8.300 -0.000 0.000 0.536 332 K N 1.727 121.586 120.400 -0.900 0.000 2.578 332 K HA 0.343 4.655 4.320 -0.014 0.000 0.287 332 K C 0.000 176.203 176.600 -0.662 0.000 1.010 332 K CA -0.280 55.432 56.287 -0.958 0.000 0.889 332 K CB 1.124 32.985 32.500 -1.064 0.000 1.514 332 K HN 0.349 8.599 8.250 -0.000 0.000 0.424 333 S N 0.152 115.674 115.700 -0.296 0.000 2.423 333 S HA -0.097 4.365 4.470 -0.014 0.000 0.231 333 S C 1.611 176.164 174.600 -0.077 0.000 1.014 333 S CA 0.598 58.743 58.200 -0.092 0.000 0.965 333 S CB -0.400 62.916 63.200 0.194 0.000 0.785 333 S HN 0.601 8.911 8.310 -0.000 0.000 0.495 334 R N 1.332 121.766 120.500 -0.110 0.000 2.235 334 R HA 0.180 4.512 4.340 -0.014 0.000 0.213 334 R C 0.571 176.774 176.300 -0.162 0.000 1.059 334 R CA 0.732 56.754 56.100 -0.129 0.000 0.997 334 R CB -0.156 30.028 30.300 -0.193 0.000 0.884 334 R HN 0.346 8.616 8.270 -0.000 0.000 0.462 335 N N -0.072 118.486 118.700 -0.236 0.000 2.279 335 N HA 0.087 4.819 4.740 -0.014 0.000 0.226 335 N C -1.105 174.275 175.510 -0.218 0.000 1.126 335 N CA 0.202 53.132 53.050 -0.199 0.000 0.846 335 N CB 1.255 39.639 38.487 -0.171 0.000 1.050 335 N HN -0.124 8.256 8.380 -0.000 0.000 0.502 336 V N 1.440 121.223 119.914 -0.218 0.000 2.531 336 V HA 0.442 4.554 4.120 -0.014 0.000 0.301 336 V C 0.010 176.049 176.094 -0.091 0.000 1.034 336 V CA -0.769 61.436 62.300 -0.157 0.000 0.865 336 V CB 2.371 34.067 31.823 -0.211 0.000 0.995 336 V HN -0.026 8.164 8.190 -0.000 0.000 0.424 337 L N 4.205 125.386 121.223 -0.071 0.000 2.352 337 L HA 0.661 4.993 4.340 -0.014 0.000 0.269 337 L C -0.461 176.305 176.870 -0.173 0.000 1.034 337 L CA -0.757 54.031 54.840 -0.088 0.000 0.806 337 L CB 1.987 44.024 42.059 -0.037 0.000 1.244 337 L HN 0.354 8.584 8.230 -0.000 0.000 0.447 338 V N 1.861 121.658 119.914 -0.195 0.000 2.357 338 V HA 0.318 4.430 4.120 -0.014 0.000 0.284 338 V C 0.079 176.017 176.094 -0.260 0.000 1.018 338 V CA -0.918 61.211 62.300 -0.286 0.000 0.841 338 V CB 1.277 32.794 31.823 -0.511 0.000 0.991 338 V HN 0.642 8.832 8.190 -0.000 0.000 0.437 339 K N 2.272 122.480 120.400 -0.320 0.000 2.118 339 K HA 0.319 4.631 4.320 -0.014 0.000 0.240 339 K C 1.357 177.886 176.600 -0.118 0.000 1.035 339 K CA -0.273 55.844 56.287 -0.283 0.000 0.899 339 K CB 0.400 32.730 32.500 -0.284 0.000 1.085 339 K HN 0.571 8.821 8.250 -0.000 0.000 0.498 340 S N 1.182 116.827 115.700 -0.092 0.000 2.370 340 S HA -0.164 4.298 4.470 -0.014 0.000 0.226 340 S C 1.101 175.697 174.600 -0.007 0.000 1.033 340 S CA 1.883 60.036 58.200 -0.079 0.000 1.011 340 S CB -0.470 62.699 63.200 -0.051 0.000 0.852 340 S HN 0.674 8.984 8.310 -0.000 0.000 0.457 341 N N 1.571 120.259 118.700 -0.020 0.000 2.362 341 N HA 0.269 5.001 4.740 -0.014 0.000 0.211 341 N C 0.674 176.174 175.510 -0.018 0.000 1.170 341 N CA 0.637 53.684 53.050 -0.005 0.000 0.828 341 N CB -0.966 37.516 38.487 -0.009 0.000 1.034 341 N HN 0.348 8.728 8.380 -0.000 0.000 0.475 342 L N -2.165 119.035 121.223 -0.040 0.000 3.781 342 L HA -0.286 4.046 4.340 -0.014 0.000 0.426 342 L C 0.102 176.897 176.870 -0.124 0.000 1.197 342 L CA 1.675 56.447 54.840 -0.114 0.000 0.907 342 L CB -3.098 38.932 42.059 -0.048 0.000 1.812 342 L HN 0.606 8.836 8.230 -0.000 0.000 0.956 343 Q N -1.078 118.652 119.800 -0.117 0.000 2.301 343 Q HA 0.711 5.043 4.340 -0.014 0.000 0.267 343 Q C 0.128 176.048 176.000 -0.133 0.000 1.035 343 Q CA -0.247 55.497 55.803 -0.098 0.000 0.856 343 Q CB 2.393 31.096 28.738 -0.058 0.000 1.337 343 Q HN 0.783 9.053 8.270 -0.000 0.000 0.450 344 C N 0.962 120.209 119.300 -0.089 0.000 2.422 344 C HA 0.675 5.126 4.460 -0.014 0.000 0.364 344 C C 0.301 175.261 174.990 -0.051 0.000 1.251 344 C CA -0.786 58.180 59.018 -0.086 0.000 2.441 344 C CB -0.248 27.478 27.740 -0.024 0.000 2.393 344 C HN 0.929 9.159 8.230 -0.000 0.000 0.606 345 C N 0.954 120.221 119.300 -0.055 0.000 2.783 345 C HA 0.722 5.174 4.460 -0.014 0.000 0.312 345 C C -0.722 174.306 174.990 0.063 0.000 1.182 345 C CA -0.936 58.101 59.018 0.031 0.000 1.432 345 C CB -0.601 27.159 27.740 0.034 0.000 1.933 345 C HN 0.813 9.043 8.230 -0.000 0.000 0.473 346 I N 2.958 123.606 120.570 0.131 0.000 2.474 346 I HA 0.574 4.736 4.170 -0.014 0.000 0.287 346 I C 0.838 177.071 176.117 0.192 0.000 1.048 346 I CA 0.345 61.739 61.300 0.156 0.000 1.383 346 I CB 1.124 39.273 38.000 0.249 0.000 1.412 346 I HN 1.046 9.256 8.210 -0.000 0.000 0.531 347 A N 3.891 126.820 122.820 0.182 0.000 2.437 347 A HA 0.614 4.926 4.320 -0.014 0.000 0.288 347 A C -0.545 177.201 177.584 0.269 0.000 1.201 347 A CA -0.404 51.761 52.037 0.213 0.000 0.795 347 A CB 1.132 20.214 19.000 0.137 0.000 1.359 347 A HN 0.763 8.913 8.150 -0.000 0.000 0.435 348 D N -1.722 118.791 120.400 0.188 0.000 3.830 348 D HA -0.105 4.527 4.640 -0.014 0.000 0.247 348 D C -0.664 175.593 176.300 -0.072 0.000 1.073 348 D CA 0.361 54.428 54.000 0.113 0.000 1.116 348 D CB -0.973 39.887 40.800 0.100 0.000 0.909 348 D HN 0.308 8.678 8.370 -0.000 0.000 0.418 349 L N 2.092 123.252 121.223 -0.105 0.000 2.685 349 L HA 0.367 4.699 4.340 -0.014 0.000 0.233 349 L C 2.471 179.220 176.870 -0.202 0.000 1.173 349 L CA 0.844 55.512 54.840 -0.286 0.000 0.961 349 L CB 0.255 42.091 42.059 -0.372 0.000 1.217 349 L HN 0.498 8.728 8.230 -0.000 0.000 0.478 350 G N -0.635 108.122 108.800 -0.073 0.000 2.462 350 G HA2 -0.177 3.775 3.960 -0.014 0.000 0.220 350 G HA3 -0.177 3.775 3.960 -0.014 0.000 0.220 350 G C 1.325 176.211 174.900 -0.023 0.000 1.121 350 G CA 0.473 45.580 45.100 0.011 0.000 0.758 350 G HN 0.381 8.671 8.290 -0.000 0.000 0.559 351 L N 0.424 121.603 121.223 -0.074 0.000 2.808 351 L HA 0.423 4.755 4.340 -0.014 0.000 0.246 351 L C 1.480 178.275 176.870 -0.125 0.000 1.153 351 L CA -0.565 54.237 54.840 -0.063 0.000 0.956 351 L CB 0.287 42.340 42.059 -0.011 0.000 1.270 351 L HN 0.212 8.442 8.230 -0.000 0.000 0.528 352 A N 0.823 123.540 122.820 -0.172 0.000 2.466 352 A HA 0.402 4.714 4.320 -0.014 0.000 0.238 352 A C -0.057 177.433 177.584 -0.157 0.000 1.074 352 A CA 0.008 51.941 52.037 -0.172 0.000 0.774 352 A CB 0.397 19.278 19.000 -0.198 0.000 1.015 352 A HN 0.108 8.258 8.150 -0.000 0.000 0.498 353 V N -0.146 119.687 119.914 -0.134 0.000 2.914 353 V HA 0.877 4.989 4.120 -0.014 0.000 0.314 353 V C -0.365 175.750 176.094 0.036 0.000 1.084 353 V CA -0.962 61.265 62.300 -0.122 0.000 0.963 353 V CB 1.659 33.310 31.823 -0.286 0.000 1.025 353 V HN 0.924 9.114 8.190 -0.000 0.000 0.432 354 M N 3.246 122.809 119.600 -0.061 0.000 2.631 354 M HA 0.686 5.158 4.480 -0.014 0.000 0.288 354 M C -1.315 174.741 176.300 -0.407 0.000 1.260 354 M CA -0.524 54.665 55.300 -0.185 0.000 0.842 354 M CB 2.575 35.069 32.600 -0.178 0.000 1.743 354 M HN 1.074 9.364 8.290 -0.000 0.000 0.461 355 H N 0.181 118.793 119.070 -0.765 0.000 3.140 355 H HA 0.442 4.990 4.556 -0.014 0.000 0.336 355 H C -2.246 172.757 175.328 -0.541 0.000 1.142 355 H CA -0.466 55.127 56.048 -0.758 0.000 1.308 355 H CB 1.738 30.716 29.762 -1.305 0.000 1.970 355 H HN 0.667 8.947 8.280 -0.000 0.000 0.521 356 S N 4.438 119.843 115.700 -0.493 0.000 2.498 356 S HA 0.101 4.563 4.470 -0.014 0.000 0.317 356 S C 1.195 175.698 174.600 -0.161 0.000 1.090 356 S CA -0.698 57.370 58.200 -0.221 0.000 1.089 356 S CB 2.017 65.109 63.200 -0.180 0.000 0.997 356 S HN 0.720 9.030 8.310 -0.000 0.000 0.470 357 Q N 2.931 122.821 119.800 0.151 0.000 2.248 357 Q HA -0.156 4.176 4.340 -0.014 0.000 0.208 357 Q C 1.735 177.812 176.000 0.129 0.000 0.984 357 Q CA 1.534 57.477 55.803 0.233 0.000 0.875 357 Q CB -0.362 28.573 28.738 0.327 0.000 0.910 357 Q HN 0.972 9.242 8.270 -0.000 0.000 0.433 358 G N -0.886 107.976 108.800 0.103 0.000 2.708 358 G HA2 0.060 4.012 3.960 -0.014 0.000 0.210 358 G HA3 0.060 4.012 3.960 -0.014 0.000 0.210 358 G C 0.338 175.229 174.900 -0.015 0.000 1.141 358 G CA 0.715 45.853 45.100 0.063 0.000 0.788 358 G HN 0.417 8.707 8.290 -0.000 0.000 0.531 359 S N 0.696 116.354 115.700 -0.071 0.000 2.888 359 S HA 0.322 4.784 4.470 -0.014 0.000 0.145 359 S C -0.595 173.911 174.600 -0.156 0.000 0.705 359 S CA -0.725 57.423 58.200 -0.087 0.000 0.891 359 S CB -0.502 62.647 63.200 -0.085 0.000 1.592 359 S HN 0.020 8.330 8.310 -0.000 0.000 0.514 360 D N 2.537 122.859 120.400 -0.131 0.000 2.736 360 D HA 0.366 4.998 4.640 -0.014 0.000 0.228 360 D C -0.064 176.177 176.300 -0.098 0.000 1.077 360 D CA 0.462 54.337 54.000 -0.210 0.000 1.096 360 D CB -0.773 40.070 40.800 0.072 0.000 1.138 360 D HN 0.708 9.078 8.370 -0.000 0.000 0.461 361 Y N -0.108 119.993 120.300 -0.332 0.000 2.587 361 Y HA 0.540 5.081 4.550 -0.015 0.000 0.337 361 Y C -1.347 174.465 175.900 -0.147 0.000 1.065 361 Y CA -1.841 56.163 58.100 -0.160 0.000 1.126 361 Y CB 1.103 39.482 38.460 -0.135 0.000 1.279 361 Y HN -0.011 8.269 8.280 -0.000 0.000 0.489 362 L N 4.575 125.312 121.223 -0.809 0.000 2.335 362 L HA 0.324 4.656 4.340 -0.014 0.000 0.268 362 L C -0.793 175.559 176.870 -0.863 0.000 1.037 362 L CA -0.235 54.259 54.840 -0.576 0.000 0.895 362 L CB 0.131 42.086 42.059 -0.173 0.000 1.266 362 L HN 0.729 8.959 8.230 -0.000 0.000 0.439 363 D N 5.017 124.928 120.400 -0.816 0.000 2.367 363 D HA 0.220 4.851 4.640 -0.014 0.000 0.255 363 D C -0.223 175.931 176.300 -0.244 0.000 1.300 363 D CA 0.332 54.053 54.000 -0.465 0.000 0.959 363 D CB 0.564 41.247 40.800 -0.194 0.000 1.064 363 D HN 0.413 8.783 8.370 -0.000 0.000 0.509 364 I N 1.407 121.863 120.570 -0.189 0.000 2.530 364 I HA 0.722 4.884 4.170 -0.014 0.000 0.297 364 I C 1.205 177.291 176.117 -0.052 0.000 1.011 364 I CA -0.568 60.657 61.300 -0.125 0.000 1.107 364 I CB 1.426 39.352 38.000 -0.123 0.000 1.285 364 I HN 0.405 8.615 8.210 -0.000 0.000 0.436 365 G N 1.473 110.252 108.800 -0.034 0.000 2.529 365 G HA2 0.422 4.374 3.960 -0.014 0.000 0.277 365 G HA3 0.422 4.374 3.960 -0.014 0.000 0.277 365 G C 0.658 175.576 174.900 0.030 0.000 1.383 365 G CA 0.583 45.700 45.100 0.027 0.000 1.050 365 G HN 1.911 10.201 8.290 -0.000 0.000 0.526 366 N N -0.638 118.095 118.700 0.055 0.000 2.204 366 N HA 0.134 4.866 4.740 -0.014 0.000 0.219 366 N C 0.688 176.223 175.510 0.042 0.000 1.151 366 N CA -0.281 52.793 53.050 0.041 0.000 0.867 366 N CB 0.070 38.578 38.487 0.035 0.000 1.043 366 N HN 0.446 8.826 8.380 -0.000 0.000 0.516 367 N N 1.763 120.494 118.700 0.051 0.000 2.447 367 N HA 0.093 4.825 4.740 -0.014 0.000 0.263 367 N C -1.523 174.019 175.510 0.053 0.000 1.226 367 N CA -1.361 51.726 53.050 0.061 0.000 0.906 367 N CB 1.617 40.146 38.487 0.071 0.000 1.060 367 N HN 0.183 8.563 8.380 -0.000 0.000 0.468 368 P HA 0.010 4.430 4.420 -0.000 0.000 0.225 368 P C 0.283 177.618 177.300 0.058 0.000 1.156 368 P CA 0.383 63.511 63.100 0.047 0.000 0.787 368 P CB 0.318 32.043 31.700 0.042 0.000 0.802 369 R N 0.828 121.374 120.500 0.076 0.000 2.698 369 R HA 0.207 4.539 4.340 -0.014 0.000 0.266 369 R C -0.077 176.277 176.300 0.089 0.000 1.026 369 R CA 0.100 56.255 56.100 0.091 0.000 1.102 369 R CB 0.265 30.633 30.300 0.115 0.000 0.978 369 R HN -0.065 8.205 8.270 -0.000 0.000 0.436 370 V N 0.947 120.922 119.914 0.102 0.000 3.166 370 V HA 0.675 4.787 4.120 -0.014 0.000 0.317 370 V C 0.667 176.846 176.094 0.140 0.000 1.136 370 V CA -0.812 61.558 62.300 0.117 0.000 1.035 370 V CB 1.224 33.119 31.823 0.120 0.000 1.110 370 V HN 0.883 9.073 8.190 -0.000 0.000 0.450 371 G N 0.357 109.254 108.800 0.161 0.000 2.647 371 G HA2 0.347 4.299 3.960 -0.014 0.000 0.234 371 G HA3 0.347 4.299 3.960 -0.014 0.000 0.234 371 G C 0.179 175.194 174.900 0.192 0.000 1.252 371 G CA 0.128 45.340 45.100 0.186 0.000 0.846 371 G HN 0.973 9.263 8.290 -0.000 0.000 0.589 372 T N 1.581 116.256 114.554 0.202 0.000 2.867 372 T HA 0.054 4.396 4.350 -0.014 0.000 0.297 372 T C 1.534 176.387 174.700 0.255 0.000 0.989 372 T CA 0.016 62.249 62.100 0.222 0.000 1.159 372 T CB 1.042 70.054 68.868 0.239 0.000 0.928 372 T HN 0.502 8.742 8.240 -0.000 0.000 0.538 373 K N 2.246 122.767 120.400 0.202 0.000 2.063 373 K HA -0.096 4.216 4.320 -0.014 0.000 0.208 373 K C 2.341 179.005 176.600 0.107 0.000 1.048 373 K CA 1.135 57.511 56.287 0.148 0.000 0.928 373 K CB -0.098 32.474 32.500 0.120 0.000 0.713 373 K HN 0.428 8.678 8.250 -0.000 0.000 0.442 374 R N -0.785 119.800 120.500 0.142 0.000 2.159 374 R HA -0.161 4.171 4.340 -0.014 0.000 0.237 374 R C 0.869 177.201 176.300 0.054 0.000 1.131 374 R CA 1.526 57.657 56.100 0.051 0.000 0.982 374 R CB -0.031 30.299 30.300 0.050 0.000 0.868 374 R HN 0.309 8.579 8.270 -0.000 0.000 0.453 375 Y N -0.903 119.538 120.300 0.235 0.000 2.507 375 Y HA 0.258 4.800 4.550 -0.014 0.000 0.254 375 Y C 0.275 176.398 175.900 0.371 0.000 1.171 375 Y CA -0.458 57.859 58.100 0.362 0.000 1.238 375 Y CB 0.488 39.141 38.460 0.322 0.000 1.148 375 Y HN -0.085 8.195 8.280 -0.000 0.000 0.525 376 M N 0.970 120.734 119.600 0.274 0.000 2.219 376 M HA 0.296 4.768 4.480 -0.014 0.000 0.353 376 M C 0.628 176.781 176.300 -0.245 0.000 1.304 376 M CA -0.267 55.076 55.300 0.073 0.000 1.115 376 M CB 0.658 33.255 32.600 -0.004 0.000 1.664 376 M HN 0.227 8.517 8.290 -0.000 0.000 0.459 377 A N 5.409 127.932 122.820 -0.494 0.000 2.327 377 A HA 0.314 4.626 4.320 -0.014 0.000 0.255 377 A C -1.781 175.321 177.584 -0.804 0.000 1.099 377 A CA -1.238 50.069 52.037 -1.217 0.000 0.801 377 A CB -0.435 18.137 19.000 -0.713 0.000 1.062 377 A HN 0.608 8.758 8.150 -0.000 0.000 0.496 378 P HA -0.196 4.224 4.420 -0.000 0.000 0.215 378 P C 1.259 178.378 177.300 -0.302 0.000 1.153 378 P CA 1.709 64.516 63.100 -0.489 0.000 0.853 378 P CB 0.004 31.471 31.700 -0.388 0.000 0.788 379 E N -0.171 119.876 120.200 -0.256 0.000 2.268 379 E HA -0.085 4.257 4.350 -0.014 0.000 0.195 379 E C 1.707 178.248 176.600 -0.097 0.000 0.995 379 E CA 1.124 57.441 56.400 -0.139 0.000 0.836 379 E CB -1.201 28.442 29.700 -0.095 0.000 0.763 379 E HN 0.121 8.481 8.360 -0.000 0.000 0.491 380 V N 1.351 121.196 119.914 -0.116 0.000 2.535 380 V HA -0.123 3.988 4.120 -0.014 0.000 0.246 380 V C 2.511 178.604 176.094 -0.002 0.000 1.045 380 V CA 0.971 63.254 62.300 -0.028 0.000 1.058 380 V CB -0.391 31.432 31.823 0.000 0.000 0.689 380 V HN 0.163 8.353 8.190 -0.000 0.000 0.461 381 L N -0.495 120.643 121.223 -0.141 0.000 2.156 381 L HA -0.071 4.261 4.340 -0.014 0.000 0.208 381 L C 2.179 178.985 176.870 -0.108 0.000 1.095 381 L CA 1.167 55.853 54.840 -0.256 0.000 0.770 381 L CB -0.520 41.269 42.059 -0.451 0.000 0.914 381 L HN 0.296 8.526 8.230 -0.000 0.000 0.439 382 D N 0.545 120.892 120.400 -0.088 0.000 2.269 382 D HA -0.127 4.505 4.640 -0.014 0.000 0.208 382 D C 0.543 176.857 176.300 0.023 0.000 0.963 382 D CA 0.531 54.509 54.000 -0.037 0.000 0.864 382 D CB 0.203 40.966 40.800 -0.063 0.000 0.936 382 D HN 0.353 8.723 8.370 -0.000 0.000 0.505 383 E N -0.470 119.757 120.200 0.046 0.000 2.791 383 E HA -0.279 4.063 4.350 -0.014 0.000 0.271 383 E C 0.903 177.513 176.600 0.017 0.000 1.044 383 E CA 0.544 56.977 56.400 0.055 0.000 0.814 383 E CB -1.767 27.978 29.700 0.074 0.000 1.400 383 E HN 0.539 8.899 8.360 -0.000 0.000 0.423 384 Q N 0.508 120.304 119.800 -0.006 0.000 2.319 384 Q HA 0.137 4.469 4.340 -0.014 0.000 0.202 384 Q C 0.563 176.549 176.000 -0.022 0.000 0.896 384 Q CA -0.176 55.618 55.803 -0.015 0.000 0.942 384 Q CB 0.026 28.749 28.738 -0.025 0.000 1.083 384 Q HN 0.407 8.677 8.270 -0.000 0.000 0.510 385 I N 0.478 121.031 120.570 -0.028 0.000 2.692 385 I HA 0.272 4.434 4.170 -0.014 0.000 0.284 385 I C 0.397 176.480 176.117 -0.056 0.000 1.159 385 I CA -0.150 61.120 61.300 -0.050 0.000 1.423 385 I CB 0.250 38.201 38.000 -0.082 0.000 1.380 385 I HN 0.105 8.315 8.210 -0.000 0.000 0.580 386 R N 2.918 123.375 120.500 -0.072 0.000 2.220 386 R HA 0.404 4.736 4.340 -0.014 0.000 0.340 386 R C 0.933 177.151 176.300 -0.137 0.000 1.076 386 R CA 0.051 56.112 56.100 -0.065 0.000 0.920 386 R CB -1.154 29.128 30.300 -0.031 0.000 1.062 386 R HN 0.897 9.167 8.270 -0.000 0.000 0.469 387 T N -2.095 112.415 114.554 -0.073 0.000 3.160 387 T HA -0.080 4.262 4.350 -0.014 0.000 0.257 387 T C 0.392 175.143 174.700 0.086 0.000 1.147 387 T CA 0.889 62.979 62.100 -0.016 0.000 1.064 387 T CB -0.001 68.930 68.868 0.104 0.000 0.949 387 T HN 0.711 8.951 8.240 -0.000 0.000 0.526 388 D N -0.234 120.190 120.400 0.040 0.000 2.463 388 D HA 0.258 4.890 4.640 -0.014 0.000 0.224 388 D C -0.219 176.122 176.300 0.068 0.000 1.174 388 D CA -0.777 53.269 54.000 0.075 0.000 0.829 388 D CB -0.731 40.103 40.800 0.057 0.000 0.993 388 D HN 0.358 8.728 8.370 -0.000 0.000 0.497 389 C N 0.347 119.656 119.300 0.014 0.000 2.364 389 C HA 0.471 4.923 4.460 -0.014 0.000 0.324 389 C C 1.015 175.989 174.990 -0.026 0.000 1.234 389 C CA -1.008 58.007 59.018 -0.005 0.000 1.417 389 C CB -0.717 26.991 27.740 -0.052 0.000 2.101 389 C HN 0.382 8.612 8.230 -0.000 0.000 0.466 390 F N 3.840 123.728 119.950 -0.103 0.000 2.186 390 F HA 0.082 4.600 4.527 -0.015 0.000 0.299 390 F C 2.010 177.630 175.800 -0.301 0.000 1.090 390 F CA 2.670 60.611 58.000 -0.098 0.000 1.307 390 F CB -0.317 38.548 39.000 -0.225 0.000 1.019 390 F HN 0.781 9.081 8.300 -0.000 0.000 0.489 391 E N 0.106 119.981 120.200 -0.542 0.000 2.097 391 E HA -0.218 4.124 4.350 -0.014 0.000 0.196 391 E C 2.192 178.045 176.600 -1.245 0.000 1.000 391 E CA 1.735 57.514 56.400 -1.035 0.000 0.804 391 E CB -1.410 27.685 29.700 -1.009 0.000 0.740 391 E HN 0.530 8.890 8.360 -0.000 0.000 0.454 392 S N -0.048 115.251 115.700 -0.668 0.000 2.372 392 S HA -0.178 4.284 4.470 -0.014 0.000 0.227 392 S C 2.015 176.428 174.600 -0.311 0.000 1.044 392 S CA 1.614 59.650 58.200 -0.272 0.000 1.050 392 S CB -0.542 62.470 63.200 -0.313 0.000 0.901 392 S HN 0.710 9.020 8.310 -0.000 0.000 0.447 393 Y N 1.641 121.737 120.300 -0.341 0.000 2.242 393 Y HA -0.011 4.532 4.550 -0.013 0.000 0.291 393 Y C 2.334 178.021 175.900 -0.354 0.000 1.137 393 Y CA 0.603 58.530 58.100 -0.288 0.000 1.181 393 Y CB -0.386 37.882 38.460 -0.321 0.000 0.989 393 Y HN 0.156 8.436 8.280 -0.000 0.000 0.527 394 K N -0.947 119.110 120.400 -0.572 0.000 2.063 394 K HA -0.219 4.093 4.320 -0.014 0.000 0.208 394 K C 1.829 178.361 176.600 -0.113 0.000 1.048 394 K CA 1.534 57.449 56.287 -0.619 0.000 0.928 394 K CB -0.403 31.488 32.500 -1.016 0.000 0.713 394 K HN 0.349 8.599 8.250 -0.000 0.000 0.442 395 W N 0.999 122.261 121.300 -0.064 0.000 2.392 395 W HA -0.108 4.544 4.660 -0.013 0.000 0.279 395 W C 2.393 178.991 176.519 0.133 0.000 1.225 395 W CA 1.639 59.008 57.345 0.039 0.000 1.233 395 W CB -1.164 28.300 29.460 0.007 0.000 1.122 395 W HN 0.272 8.452 8.180 -0.000 0.000 0.561 396 T N -2.815 111.923 114.554 0.307 0.000 2.942 396 T HA -0.120 4.222 4.350 -0.014 0.000 0.265 396 T C 1.347 176.274 174.700 0.378 0.000 1.062 396 T CA 1.392 63.679 62.100 0.313 0.000 1.139 396 T CB -0.333 68.671 68.868 0.227 0.000 0.883 396 T HN -0.184 8.056 8.240 -0.000 0.000 0.468 397 D N 1.582 122.166 120.400 0.307 0.000 2.104 397 D HA -0.059 4.573 4.640 -0.014 0.000 0.194 397 D C 2.100 178.552 176.300 0.254 0.000 0.994 397 D CA 0.865 55.034 54.000 0.282 0.000 0.830 397 D CB -0.244 40.729 40.800 0.288 0.000 0.959 397 D HN 0.321 8.691 8.370 -0.000 0.000 0.452 398 I N 0.309 121.045 120.570 0.277 0.000 2.179 398 I HA -0.223 3.938 4.170 -0.014 0.000 0.242 398 I C 2.413 178.750 176.117 0.366 0.000 1.088 398 I CA 0.715 62.153 61.300 0.229 0.000 1.357 398 I CB -1.217 36.923 38.000 0.234 0.000 1.051 398 I HN 0.314 8.524 8.210 -0.000 0.000 0.409 399 W N 2.646 124.126 121.300 0.299 0.000 2.289 399 W HA -0.362 4.290 4.660 -0.013 0.000 0.331 399 W C 2.598 179.421 176.519 0.506 0.000 1.283 399 W CA 2.976 60.570 57.345 0.414 0.000 1.252 399 W CB -0.539 29.125 29.460 0.340 0.000 1.153 399 W HN 0.186 8.366 8.180 -0.000 0.000 0.467 400 A N -0.065 123.185 122.820 0.717 0.000 1.986 400 A HA -0.262 4.050 4.320 -0.014 0.000 0.220 400 A C 1.939 179.892 177.584 0.614 0.000 1.171 400 A CA 1.817 54.278 52.037 0.707 0.000 0.640 400 A CB -1.536 17.875 19.000 0.686 0.000 0.811 400 A HN 0.484 8.634 8.150 -0.000 0.000 0.451 401 F N 0.870 120.981 119.950 0.269 0.000 2.146 401 F HA 0.016 4.535 4.527 -0.014 0.000 0.298 401 F C 2.355 178.249 175.800 0.156 0.000 1.096 401 F CA 1.486 59.555 58.000 0.114 0.000 1.275 401 F CB -0.632 38.219 39.000 -0.249 0.000 1.008 401 F HN 0.231 8.531 8.300 -0.000 0.000 0.480 402 G N 0.933 109.888 108.800 0.259 0.000 2.469 402 G HA2 -0.277 3.675 3.960 -0.014 0.000 0.219 402 G HA3 -0.277 3.675 3.960 -0.014 0.000 0.219 402 G C 1.716 176.793 174.900 0.295 0.000 1.150 402 G CA 1.364 46.454 45.100 -0.017 0.000 0.763 402 G HN 0.440 8.730 8.290 -0.000 0.000 0.561 403 L N 0.127 121.625 121.223 0.458 0.000 2.083 403 L HA -0.067 4.265 4.340 -0.014 0.000 0.209 403 L C 2.956 180.055 176.870 0.381 0.000 1.083 403 L CA 0.362 55.418 54.840 0.360 0.000 0.752 403 L CB -0.495 41.672 42.059 0.179 0.000 0.899 403 L HN 0.096 8.326 8.230 -0.000 0.000 0.433 404 V N 0.025 120.134 119.914 0.324 0.000 2.427 404 V HA -0.250 3.862 4.120 -0.014 0.000 0.248 404 V C 2.426 178.552 176.094 0.053 0.000 1.051 404 V CA 1.370 63.786 62.300 0.193 0.000 1.048 404 V CB -0.312 31.572 31.823 0.102 0.000 0.666 404 V HN 0.338 8.528 8.190 -0.000 0.000 0.456 405 L N -1.455 119.724 121.223 -0.073 0.000 2.012 405 L HA -0.240 4.092 4.340 -0.014 0.000 0.210 405 L C 2.339 179.246 176.870 0.062 0.000 1.073 405 L CA 2.391 57.185 54.840 -0.076 0.000 0.748 405 L CB -0.599 41.392 42.059 -0.113 0.000 0.891 405 L HN 0.521 8.751 8.230 -0.000 0.000 0.431 406 W N 1.535 122.836 121.300 0.001 0.000 2.304 406 W HA -0.281 4.371 4.660 -0.014 0.000 0.315 406 W C 2.473 178.989 176.519 -0.005 0.000 1.233 406 W CA 2.194 59.561 57.345 0.036 0.000 1.261 406 W CB -0.142 29.392 29.460 0.123 0.000 1.150 406 W HN 0.132 8.312 8.180 -0.000 0.000 0.494 407 E N -0.193 120.158 120.200 0.252 0.000 2.085 407 E HA -0.270 4.072 4.350 -0.014 0.000 0.194 407 E C 2.107 178.675 176.600 -0.052 0.000 0.994 407 E CA 1.938 58.386 56.400 0.080 0.000 0.801 407 E CB -0.554 29.327 29.700 0.302 0.000 0.743 407 E HN 0.409 8.769 8.360 -0.000 0.000 0.453 408 I N 1.059 121.618 120.570 -0.018 0.000 2.202 408 I HA -0.257 3.905 4.170 -0.014 0.000 0.242 408 I C 2.615 178.661 176.117 -0.119 0.000 1.091 408 I CA 0.916 62.191 61.300 -0.041 0.000 1.368 408 I CB -0.379 37.604 38.000 -0.029 0.000 1.058 408 I HN 0.079 8.289 8.210 -0.000 0.000 0.410 409 A N 0.947 123.665 122.820 -0.169 0.000 1.883 409 A HA -0.275 4.036 4.320 -0.014 0.000 0.217 409 A C 2.428 179.834 177.584 -0.297 0.000 1.186 409 A CA 2.003 53.916 52.037 -0.207 0.000 0.624 409 A CB -0.770 18.107 19.000 -0.205 0.000 0.822 409 A HN 0.370 8.520 8.150 -0.000 0.000 0.444 410 R N -1.108 119.087 120.500 -0.507 0.000 2.139 410 R HA -0.144 4.188 4.340 -0.014 0.000 0.243 410 R C 1.715 177.817 176.300 -0.330 0.000 1.145 410 R CA 1.792 57.562 56.100 -0.551 0.000 0.976 410 R CB -0.110 29.642 30.300 -0.914 0.000 0.866 410 R HN 0.295 8.565 8.270 -0.000 0.000 0.449 411 R N -0.031 120.324 120.500 -0.242 0.000 2.427 411 R HA 0.146 4.478 4.340 -0.014 0.000 0.262 411 R C -0.873 175.353 176.300 -0.122 0.000 0.943 411 R CA 0.223 56.230 56.100 -0.155 0.000 1.081 411 R CB 0.534 30.778 30.300 -0.094 0.000 1.166 411 R HN 0.029 8.299 8.270 -0.000 0.000 0.534 412 T N 0.705 115.185 114.554 -0.124 0.000 2.795 412 T HA 0.416 4.758 4.350 -0.014 0.000 0.282 412 T C 0.129 174.778 174.700 -0.083 0.000 0.980 412 T CA -0.478 61.569 62.100 -0.088 0.000 1.012 412 T CB 1.435 70.256 68.868 -0.077 0.000 0.936 412 T HN 0.027 8.267 8.240 -0.000 0.000 0.457 413 I N 3.365 123.896 120.570 -0.064 0.000 2.337 413 I HA 0.335 4.496 4.170 -0.014 0.000 0.291 413 I C -0.132 175.958 176.117 -0.045 0.000 1.046 413 I CA -0.561 60.704 61.300 -0.058 0.000 1.324 413 I CB 0.479 38.448 38.000 -0.051 0.000 1.409 413 I HN 0.232 8.442 8.210 -0.000 0.000 0.494 414 V N 5.759 125.645 119.914 -0.047 0.000 2.769 414 V HA 0.294 4.406 4.120 -0.014 0.000 0.312 414 V C 0.692 176.767 176.094 -0.032 0.000 1.058 414 V CA -0.831 61.447 62.300 -0.036 0.000 0.952 414 V CB 1.676 33.477 31.823 -0.038 0.000 1.019 414 V HN 0.837 9.027 8.190 -0.000 0.000 0.445 415 N N 2.529 121.214 118.700 -0.025 0.000 2.608 415 N HA -0.259 4.473 4.740 -0.014 0.000 0.246 415 N C 1.055 176.551 175.510 -0.024 0.000 1.162 415 N CA 1.726 54.763 53.050 -0.021 0.000 0.736 415 N CB -0.858 37.617 38.487 -0.019 0.000 1.078 415 N HN 1.482 9.862 8.380 -0.000 0.000 0.554 416 G N -1.906 106.878 108.800 -0.027 0.000 2.192 416 G HA2 -0.185 3.767 3.960 -0.014 0.000 0.193 416 G HA3 -0.185 3.767 3.960 -0.014 0.000 0.193 416 G C -0.192 174.687 174.900 -0.035 0.000 0.999 416 G CA 0.147 45.230 45.100 -0.029 0.000 0.659 416 G HN 0.533 8.823 8.290 -0.000 0.000 0.503 417 I N -0.293 120.253 120.570 -0.041 0.000 3.006 417 I HA 0.877 5.039 4.170 -0.014 0.000 0.306 417 I C -1.277 174.804 176.117 -0.060 0.000 1.250 417 I CA -1.400 59.872 61.300 -0.047 0.000 0.996 417 I CB 2.382 40.358 38.000 -0.041 0.000 1.261 417 I HN 0.656 8.866 8.210 -0.000 0.000 0.442 418 V N 5.584 125.456 119.914 -0.069 0.000 2.817 418 V HA 0.532 4.644 4.120 -0.014 0.000 0.303 418 V C -1.014 175.020 176.094 -0.100 0.000 1.151 418 V CA -0.432 61.815 62.300 -0.090 0.000 0.929 418 V CB 1.986 33.754 31.823 -0.092 0.000 1.030 418 V HN 0.800 8.990 8.190 -0.000 0.000 0.427 419 E N 3.009 123.132 120.200 -0.128 0.000 2.390 419 E HA 0.215 4.557 4.350 -0.014 0.000 0.261 419 E C -0.542 175.968 176.600 -0.150 0.000 1.076 419 E CA -0.035 56.279 56.400 -0.144 0.000 0.905 419 E CB 1.112 30.698 29.700 -0.189 0.000 0.984 419 E HN 0.981 9.341 8.360 -0.000 0.000 0.427 420 D N 0.031 120.347 120.400 -0.139 0.000 2.362 420 D HA -0.070 4.562 4.640 -0.014 0.000 0.242 420 D C -0.311 175.897 176.300 -0.153 0.000 1.132 420 D CA -0.301 53.629 54.000 -0.116 0.000 0.907 420 D CB 0.250 40.994 40.800 -0.092 0.000 1.195 420 D HN 0.350 8.720 8.370 -0.000 0.000 0.429 421 Y N 1.132 121.307 120.300 -0.209 0.000 2.620 421 Y HA 0.341 4.882 4.550 -0.014 0.000 0.330 421 Y C 0.384 176.154 175.900 -0.217 0.000 1.186 421 Y CA 0.683 58.649 58.100 -0.224 0.000 1.467 421 Y CB 0.063 38.382 38.460 -0.235 0.000 1.262 421 Y HN 0.681 8.961 8.280 -0.000 0.000 0.550 422 R N 6.555 126.454 120.500 -1.001 0.000 2.725 422 R HA 0.632 4.964 4.340 -0.014 0.000 0.277 422 R C -3.236 172.634 176.300 -0.718 0.000 0.987 422 R CA -1.781 53.857 56.100 -0.769 0.000 0.901 422 R CB 0.534 30.304 30.300 -0.883 0.000 1.207 422 R HN 0.593 8.863 8.270 -0.000 0.000 0.463 423 P HA 0.361 4.781 4.420 -0.000 0.000 0.276 423 P C -2.711 174.682 177.300 0.156 0.000 1.252 423 P CA -1.758 61.404 63.100 0.103 0.000 0.802 423 P CB 0.273 32.138 31.700 0.276 0.000 1.035 424 P HA 0.061 4.481 4.420 -0.000 0.000 0.266 424 P C -0.280 176.802 177.300 -0.364 0.000 1.195 424 P CA 0.431 63.172 63.100 -0.599 0.000 0.768 424 P CB -0.360 30.939 31.700 -0.667 0.000 0.838 425 F N -0.158 119.489 119.950 -0.505 0.000 3.034 425 F HA -0.271 4.248 4.527 -0.013 0.000 0.286 425 F C 1.361 177.008 175.800 -0.255 0.000 0.804 425 F CA 0.722 58.487 58.000 -0.392 0.000 1.161 425 F CB -3.067 35.745 39.000 -0.312 0.000 1.317 425 F HN 0.433 8.733 8.300 -0.000 0.000 0.453 426 Y N 0.600 120.870 120.300 -0.050 0.000 2.241 426 Y HA -0.166 4.375 4.550 -0.014 0.000 0.286 426 Y C 1.859 177.770 175.900 0.018 0.000 1.166 426 Y CA 1.611 59.718 58.100 0.012 0.000 1.203 426 Y CB -0.749 37.725 38.460 0.024 0.000 0.977 426 Y HN 0.326 8.606 8.280 -0.000 0.000 0.529 427 D N 0.533 120.523 120.400 -0.684 0.000 2.350 427 D HA -0.040 4.592 4.640 -0.014 0.000 0.213 427 D C 1.448 177.616 176.300 -0.219 0.000 1.031 427 D CA 0.958 54.663 54.000 -0.491 0.000 0.861 427 D CB -0.391 39.967 40.800 -0.736 0.000 0.926 427 D HN 0.493 8.863 8.370 -0.000 0.000 0.520 428 V N -2.227 117.593 119.914 -0.157 0.000 3.485 428 V HA 0.345 4.457 4.120 -0.014 0.000 0.280 428 V C 0.346 176.399 176.094 -0.067 0.000 1.495 428 V CA 0.352 62.598 62.300 -0.091 0.000 1.018 428 V CB 0.275 32.053 31.823 -0.075 0.000 0.818 428 V HN 0.102 8.292 8.190 -0.000 0.000 0.436 429 V N -2.485 117.404 119.914 -0.042 0.000 3.007 429 V HA 0.820 4.931 4.120 -0.014 0.000 0.311 429 V C -2.757 173.343 176.094 0.010 0.000 1.120 429 V CA -1.959 60.321 62.300 -0.033 0.000 0.980 429 V CB 1.531 33.312 31.823 -0.071 0.000 1.033 429 V HN 0.161 8.351 8.190 -0.000 0.000 0.429 430 P HA 0.237 4.657 4.420 -0.000 0.000 0.273 430 P C 0.591 177.926 177.300 0.060 0.000 1.250 430 P CA -0.212 62.911 63.100 0.038 0.000 0.793 430 P CB 0.540 32.257 31.700 0.028 0.000 1.011 431 N N 0.361 119.106 118.700 0.076 0.000 2.258 431 N HA -0.185 4.546 4.740 -0.014 0.000 0.187 431 N C 0.351 175.913 175.510 0.087 0.000 1.012 431 N CA 1.633 54.741 53.050 0.096 0.000 0.870 431 N CB -0.273 38.273 38.487 0.098 0.000 0.977 431 N HN 0.605 8.985 8.380 -0.000 0.000 0.434 432 D N -0.070 120.370 120.400 0.066 0.000 2.738 432 D HA 0.130 4.762 4.640 -0.014 0.000 0.246 432 D C -2.341 173.993 176.300 0.056 0.000 1.270 432 D CA -1.301 52.738 54.000 0.064 0.000 0.833 432 D CB -0.106 40.726 40.800 0.055 0.000 1.040 432 D HN 0.083 8.453 8.370 -0.000 0.000 0.487 433 P HA -0.094 4.326 4.420 -0.000 0.000 0.257 433 P C 0.259 177.576 177.300 0.028 0.000 1.162 433 P CA 0.406 63.515 63.100 0.015 0.000 0.762 433 P CB 0.835 32.528 31.700 -0.011 0.000 0.753 434 S N 3.142 118.858 115.700 0.027 0.000 2.576 434 S HA 0.078 4.540 4.470 -0.014 0.000 0.276 434 S C 1.087 175.733 174.600 0.078 0.000 1.339 434 S CA -0.643 57.598 58.200 0.069 0.000 1.039 434 S CB 0.250 63.488 63.200 0.064 0.000 0.902 434 S HN 0.391 8.701 8.310 -0.000 0.000 0.516 435 F N 2.690 122.631 119.950 -0.014 0.000 2.050 435 F HA -0.271 4.249 4.527 -0.011 0.000 0.294 435 F C 2.821 178.593 175.800 -0.047 0.000 1.113 435 F CA 3.251 61.236 58.000 -0.025 0.000 1.225 435 F CB -1.193 37.799 39.000 -0.013 0.000 0.953 435 F HN 0.860 9.160 8.300 -0.000 0.000 0.501 436 E N -0.045 120.263 120.200 0.180 0.000 2.118 436 E HA -0.233 4.109 4.350 -0.014 0.000 0.195 436 E C 1.793 178.347 176.600 -0.076 0.000 0.992 436 E CA 1.645 58.080 56.400 0.059 0.000 0.804 436 E CB -1.195 28.570 29.700 0.108 0.000 0.741 436 E HN 0.625 8.985 8.360 -0.000 0.000 0.458 437 D N -0.184 120.177 120.400 -0.065 0.000 2.104 437 D HA -0.143 4.489 4.640 -0.014 0.000 0.194 437 D C 2.014 178.196 176.300 -0.196 0.000 0.994 437 D CA 1.559 55.497 54.000 -0.103 0.000 0.830 437 D CB -0.131 40.627 40.800 -0.071 0.000 0.959 437 D HN 0.318 8.688 8.370 -0.000 0.000 0.452 438 M N 0.482 119.925 119.600 -0.262 0.000 2.156 438 M HA -0.067 4.405 4.480 -0.014 0.000 0.264 438 M C 2.093 178.150 176.300 -0.406 0.000 1.067 438 M CA 0.868 55.941 55.300 -0.378 0.000 1.131 438 M CB -0.886 31.485 32.600 -0.383 0.000 1.368 438 M HN -0.028 8.262 8.290 -0.000 0.000 0.416 439 K N 0.819 120.950 120.400 -0.448 0.000 2.044 439 K HA -0.245 4.067 4.320 -0.014 0.000 0.210 439 K C 2.123 178.578 176.600 -0.242 0.000 1.049 439 K CA 1.821 57.877 56.287 -0.385 0.000 0.927 439 K CB -0.101 32.176 32.500 -0.372 0.000 0.713 439 K HN 0.228 8.478 8.250 -0.000 0.000 0.443 440 K N 0.277 120.561 120.400 -0.194 0.000 2.026 440 K HA -0.120 4.192 4.320 -0.014 0.000 0.208 440 K C 1.931 178.436 176.600 -0.158 0.000 1.048 440 K CA 1.501 57.703 56.287 -0.142 0.000 0.929 440 K CB 0.003 32.438 32.500 -0.108 0.000 0.713 440 K HN 0.012 8.262 8.250 -0.000 0.000 0.439 441 V N 0.535 120.321 119.914 -0.213 0.000 2.323 441 V HA -0.177 3.935 4.120 -0.014 0.000 0.244 441 V C 2.242 178.199 176.094 -0.228 0.000 1.041 441 V CA 1.415 63.577 62.300 -0.229 0.000 1.025 441 V CB 0.184 31.808 31.823 -0.331 0.000 0.656 441 V HN 0.193 8.383 8.190 -0.000 0.000 0.451 442 V N -1.596 118.138 119.914 -0.300 0.000 2.535 442 V HA -0.140 3.972 4.120 -0.014 0.000 0.246 442 V C 2.210 178.208 176.094 -0.160 0.000 1.045 442 V CA 1.803 63.964 62.300 -0.231 0.000 1.058 442 V CB -0.001 31.632 31.823 -0.317 0.000 0.689 442 V HN 0.613 8.803 8.190 -0.000 0.000 0.461 443 C N -1.583 117.610 119.300 -0.179 0.000 2.543 443 C HA 0.138 4.590 4.460 -0.014 0.000 0.289 443 C C 2.636 177.570 174.990 -0.094 0.000 1.368 443 C CA 0.111 59.047 59.018 -0.137 0.000 1.778 443 C CB -0.052 27.596 27.740 -0.154 0.000 2.155 443 C HN 0.336 8.566 8.230 -0.000 0.000 0.529 444 V N 1.778 121.634 119.914 -0.096 0.000 2.283 444 V HA -0.153 3.959 4.120 -0.014 0.000 0.243 444 V C 1.772 177.832 176.094 -0.056 0.000 1.039 444 V CA 2.264 64.523 62.300 -0.068 0.000 1.016 444 V CB -0.586 31.197 31.823 -0.066 0.000 0.650 444 V HN 0.471 8.661 8.190 -0.000 0.000 0.449 445 D N -1.041 119.320 120.400 -0.066 0.000 2.355 445 D HA 0.013 4.645 4.640 -0.014 0.000 0.218 445 D C 1.390 177.670 176.300 -0.033 0.000 1.004 445 D CA 0.286 54.257 54.000 -0.049 0.000 0.880 445 D CB -0.133 40.632 40.800 -0.059 0.000 0.911 445 D HN 0.467 8.837 8.370 -0.000 0.000 0.528 446 Q N 0.059 119.839 119.800 -0.033 0.000 2.457 446 Q HA -0.267 4.065 4.340 -0.014 0.000 0.283 446 Q C -0.375 175.641 176.000 0.028 0.000 1.234 446 Q CA 0.378 56.182 55.803 0.002 0.000 0.877 446 Q CB -1.352 27.392 28.738 0.011 0.000 1.250 446 Q HN 0.246 8.516 8.270 -0.000 0.000 0.481 447 Q N 0.117 119.927 119.800 0.017 0.000 2.299 447 Q HA 0.538 4.870 4.340 -0.014 0.000 0.246 447 Q C -0.349 175.712 176.000 0.102 0.000 0.935 447 Q CA 0.704 56.532 55.803 0.042 0.000 0.887 447 Q CB 1.070 29.832 28.738 0.039 0.000 1.223 447 Q HN 0.369 8.639 8.270 -0.000 0.000 0.439 448 T N 0.593 115.123 114.554 -0.040 0.000 2.906 448 T HA 0.657 4.999 4.350 -0.014 0.000 0.295 448 T C -2.623 171.713 174.700 -0.606 0.000 1.075 448 T CA -2.209 59.675 62.100 -0.361 0.000 1.005 448 T CB 1.279 69.906 68.868 -0.402 0.000 1.136 448 T HN 0.383 8.623 8.240 -0.000 0.000 0.498 449 P HA 0.165 4.585 4.420 -0.000 0.000 0.264 449 P C 0.322 177.331 177.300 -0.486 0.000 1.193 449 P CA -0.012 62.379 63.100 -1.182 0.000 0.763 449 P CB 0.044 30.554 31.700 -1.983 0.000 0.810 450 T N 2.486 116.913 114.554 -0.212 0.000 2.784 450 T HA 0.226 4.568 4.350 -0.014 0.000 0.291 450 T C 0.342 175.189 174.700 0.244 0.000 0.942 450 T CA -0.477 61.642 62.100 0.032 0.000 1.161 450 T CB -0.651 68.239 68.868 0.036 0.000 0.885 450 T HN 0.152 8.392 8.240 -0.000 0.000 0.534 451 I N 6.703 127.414 120.570 0.235 0.000 2.517 451 I HA 0.214 4.375 4.170 -0.014 0.000 0.285 451 I C -1.720 174.485 176.117 0.148 0.000 1.106 451 I CA -2.047 59.405 61.300 0.253 0.000 1.402 451 I CB 0.431 38.548 38.000 0.195 0.000 1.399 451 I HN 0.507 8.717 8.210 -0.000 0.000 0.535 452 P HA 0.150 4.570 4.420 -0.000 0.000 0.276 452 P C 0.139 177.457 177.300 0.031 0.000 1.235 452 P CA -0.315 62.818 63.100 0.056 0.000 0.772 452 P CB 0.488 32.193 31.700 0.008 0.000 0.871 453 N N 2.202 120.919 118.700 0.028 0.000 2.348 453 N HA -0.149 4.583 4.740 -0.014 0.000 0.185 453 N C 1.639 177.152 175.510 0.005 0.000 1.019 453 N CA 0.767 53.828 53.050 0.018 0.000 0.880 453 N CB -0.267 38.230 38.487 0.018 0.000 0.965 453 N HN 0.436 8.816 8.380 -0.000 0.000 0.437 454 R N 0.481 120.979 120.500 -0.004 0.000 2.117 454 R HA -0.113 4.219 4.340 -0.014 0.000 0.243 454 R C 1.593 177.882 176.300 -0.019 0.000 1.143 454 R CA 1.057 57.148 56.100 -0.015 0.000 0.968 454 R CB -0.167 30.116 30.300 -0.028 0.000 0.863 454 R HN 0.045 8.315 8.270 -0.000 0.000 0.444 455 L N 0.507 121.718 121.223 -0.020 0.000 2.079 455 L HA -0.116 4.216 4.340 -0.014 0.000 0.210 455 L C 2.337 179.197 176.870 -0.016 0.000 1.081 455 L CA 1.908 56.733 54.840 -0.025 0.000 0.752 455 L CB -0.875 41.169 42.059 -0.025 0.000 0.896 455 L HN 0.252 8.482 8.230 -0.000 0.000 0.433 456 A N -0.860 121.955 122.820 -0.008 0.000 2.285 456 A HA 0.008 4.320 4.320 -0.014 0.000 0.214 456 A C 2.011 179.592 177.584 -0.006 0.000 1.188 456 A CA 1.525 53.559 52.037 -0.005 0.000 0.707 456 A CB -0.694 18.306 19.000 0.001 0.000 0.771 456 A HN 0.379 8.529 8.150 -0.000 0.000 0.488 457 A N -1.328 121.486 122.820 -0.009 0.000 2.545 457 A HA 0.412 4.724 4.320 -0.014 0.000 0.263 457 A C -0.005 177.574 177.584 -0.009 0.000 1.202 457 A CA 0.145 52.178 52.037 -0.008 0.000 0.959 457 A CB 0.173 19.168 19.000 -0.008 0.000 1.124 457 A HN 0.310 8.460 8.150 -0.000 0.000 0.543 458 D N -0.518 119.875 120.400 -0.011 0.000 2.408 458 D HA 0.486 5.118 4.640 -0.014 0.000 0.243 458 D C -1.882 174.414 176.300 -0.008 0.000 1.075 458 D CA -1.818 52.176 54.000 -0.010 0.000 0.832 458 D CB 2.128 42.919 40.800 -0.016 0.000 1.162 458 D HN -0.129 8.241 8.370 -0.000 0.000 0.515 459 P HA -0.207 4.213 4.420 -0.000 0.000 0.216 459 P C 1.341 178.638 177.300 -0.005 0.000 1.157 459 P CA 0.659 63.758 63.100 -0.002 0.000 0.880 459 P CB 0.313 32.016 31.700 0.004 0.000 0.791 460 V N -0.593 119.319 119.914 -0.003 0.000 2.221 460 V HA -0.207 3.905 4.120 -0.014 0.000 0.242 460 V C 2.444 178.528 176.094 -0.017 0.000 1.041 460 V CA 1.693 63.988 62.300 -0.008 0.000 0.995 460 V CB -1.304 30.516 31.823 -0.005 0.000 0.635 460 V HN 0.029 8.219 8.190 -0.000 0.000 0.448 461 L N 0.971 122.181 121.223 -0.022 0.000 2.353 461 L HA -0.138 4.193 4.340 -0.014 0.000 0.220 461 L C 2.636 179.488 176.870 -0.031 0.000 1.133 461 L CA 1.460 56.280 54.840 -0.032 0.000 0.798 461 L CB -0.686 41.349 42.059 -0.041 0.000 0.922 461 L HN 0.579 8.809 8.230 -0.000 0.000 0.445 462 S N -0.167 115.519 115.700 -0.023 0.000 2.368 462 S HA -0.101 4.361 4.470 -0.014 0.000 0.224 462 S C 2.112 176.695 174.600 -0.027 0.000 1.029 462 S CA 0.918 59.105 58.200 -0.021 0.000 0.988 462 S CB -0.792 62.400 63.200 -0.014 0.000 0.838 462 S HN 0.397 8.707 8.310 -0.000 0.000 0.462 463 G N 2.181 110.966 108.800 -0.025 0.000 2.421 463 G HA2 -0.048 3.904 3.960 -0.014 0.000 0.216 463 G HA3 -0.048 3.904 3.960 -0.014 0.000 0.216 463 G C 1.510 176.384 174.900 -0.043 0.000 1.171 463 G CA 0.942 46.025 45.100 -0.029 0.000 0.775 463 G HN 0.493 8.783 8.290 -0.000 0.000 0.543 464 L N 0.695 121.894 121.223 -0.040 0.000 2.042 464 L HA -0.166 4.166 4.340 -0.014 0.000 0.210 464 L C 3.442 180.259 176.870 -0.087 0.000 1.076 464 L CA 1.186 55.995 54.840 -0.051 0.000 0.749 464 L CB -0.568 41.465 42.059 -0.044 0.000 0.893 464 L HN 0.345 8.575 8.230 -0.000 0.000 0.432 465 A N -0.351 122.426 122.820 -0.072 0.000 1.883 465 A HA -0.298 4.014 4.320 -0.014 0.000 0.217 465 A C 2.210 179.722 177.584 -0.120 0.000 1.186 465 A CA 1.999 53.990 52.037 -0.076 0.000 0.624 465 A CB -0.555 18.424 19.000 -0.034 0.000 0.822 465 A HN 0.392 8.542 8.150 -0.000 0.000 0.444 466 Q N -0.677 119.066 119.800 -0.095 0.000 2.119 466 Q HA -0.032 4.300 4.340 -0.014 0.000 0.201 466 Q C 1.976 177.873 176.000 -0.172 0.000 0.972 466 Q CA 1.944 57.684 55.803 -0.104 0.000 0.847 466 Q CB -0.394 28.309 28.738 -0.058 0.000 0.903 466 Q HN 0.675 8.945 8.270 -0.000 0.000 0.433 467 M N -1.107 118.394 119.600 -0.164 0.000 2.175 467 M HA -0.130 4.342 4.480 -0.014 0.000 0.264 467 M C 2.031 178.116 176.300 -0.358 0.000 1.063 467 M CA 1.255 56.438 55.300 -0.196 0.000 1.119 467 M CB -0.098 32.443 32.600 -0.100 0.000 1.377 467 M HN 0.316 8.606 8.290 -0.000 0.000 0.415 468 M N -0.585 118.741 119.600 -0.456 0.000 2.073 468 M HA -0.283 4.189 4.480 -0.014 0.000 0.258 468 M C 2.154 177.722 176.300 -1.220 0.000 1.070 468 M CA 1.939 56.663 55.300 -0.961 0.000 1.103 468 M CB -0.481 31.603 32.600 -0.860 0.000 1.321 468 M HN 0.179 8.469 8.290 -0.000 0.000 0.405 469 R N 0.064 120.167 120.500 -0.662 0.000 2.096 469 R HA -0.179 4.153 4.340 -0.014 0.000 0.240 469 R C 1.716 177.604 176.300 -0.687 0.000 1.139 469 R CA 1.653 57.488 56.100 -0.443 0.000 0.952 469 R CB -0.441 29.731 30.300 -0.214 0.000 0.854 469 R HN 0.531 8.801 8.270 -0.000 0.000 0.436 470 E N -0.534 119.250 120.200 -0.695 0.000 2.502 470 E HA -0.041 4.301 4.350 -0.014 0.000 0.194 470 E C 1.338 177.584 176.600 -0.591 0.000 1.062 470 E CA 0.108 55.977 56.400 -0.885 0.000 0.867 470 E CB 0.224 29.680 29.700 -0.407 0.000 0.888 470 E HN 0.361 8.721 8.360 -0.000 0.000 0.510 471 C N 0.000 118.968 119.300 -0.554 0.000 2.563 471 C HA 0.032 4.483 4.460 -0.014 0.000 0.268 471 C C 1.137 176.070 174.990 -0.096 0.000 1.365 471 C CA -0.325 58.492 59.018 -0.335 0.000 1.754 471 C CB -0.546 26.922 27.740 -0.454 0.000 1.932 471 C HN 0.586 8.816 8.230 -0.000 0.000 0.536 472 W N -0.666 120.505 121.300 -0.215 0.000 3.123 472 W HA 0.375 5.027 4.660 -0.014 0.000 0.383 472 W C -0.083 176.554 176.519 0.198 0.000 1.102 472 W CA -1.297 55.998 57.345 -0.082 0.000 1.865 472 W CB -1.291 27.982 29.460 -0.312 0.000 1.111 472 W HN 0.233 8.413 8.180 -0.000 0.000 0.621 473 Y N 2.667 123.145 120.300 0.297 0.000 2.721 473 Y HA 0.030 4.572 4.550 -0.014 0.000 0.329 473 Y C -0.839 175.183 175.900 0.204 0.000 1.211 473 Y CA -2.083 56.130 58.100 0.189 0.000 1.512 473 Y CB -0.410 38.092 38.460 0.070 0.000 1.249 473 Y HN -0.141 8.139 8.280 -0.000 0.000 0.549 474 P HA -0.168 4.252 4.420 -0.000 0.000 0.216 474 P C 0.169 177.502 177.300 0.056 0.000 1.150 474 P CA 1.399 64.596 63.100 0.163 0.000 0.837 474 P CB 0.205 31.965 31.700 0.100 0.000 0.786 475 N N -0.187 118.524 118.700 0.019 0.000 2.402 475 N HA 0.052 4.784 4.740 -0.014 0.000 0.252 475 N C -1.748 173.674 175.510 -0.148 0.000 1.118 475 N CA -2.029 50.972 53.050 -0.081 0.000 0.945 475 N CB 0.142 38.562 38.487 -0.111 0.000 1.147 475 N HN -0.110 8.270 8.380 -0.000 0.000 0.495 476 P HA -0.162 4.258 4.420 -0.000 0.000 0.216 476 P C 0.732 177.417 177.300 -1.025 0.000 1.150 476 P CA 1.377 64.220 63.100 -0.428 0.000 0.843 476 P CB 0.103 31.603 31.700 -0.333 0.000 0.787 477 S N -1.232 113.828 115.700 -1.067 0.000 2.522 477 S HA 0.114 4.576 4.470 -0.014 0.000 0.227 477 S C 1.905 176.237 174.600 -0.446 0.000 0.986 477 S CA 0.661 58.195 58.200 -1.110 0.000 0.929 477 S CB -0.882 61.897 63.200 -0.703 0.000 0.769 477 S HN 0.117 8.427 8.310 -0.000 0.000 0.529 478 A N 1.454 124.109 122.820 -0.275 0.000 2.167 478 A HA 0.202 4.514 4.320 -0.014 0.000 0.214 478 A C 1.231 178.914 177.584 0.166 0.000 1.151 478 A CA -0.102 51.902 52.037 -0.054 0.000 0.735 478 A CB -0.170 18.762 19.000 -0.113 0.000 0.802 478 A HN 0.450 8.600 8.150 -0.000 0.000 0.467 479 R N -0.403 120.132 120.500 0.059 0.000 2.582 479 R HA 0.446 4.778 4.340 -0.014 0.000 0.271 479 R C -0.409 175.953 176.300 0.103 0.000 1.078 479 R CA -0.487 55.677 56.100 0.105 0.000 1.127 479 R CB 0.460 30.811 30.300 0.085 0.000 1.038 479 R HN 0.313 8.583 8.270 -0.000 0.000 0.500 480 L N 1.429 122.683 121.223 0.052 0.000 2.483 480 L HA 0.055 4.387 4.340 -0.014 0.000 0.275 480 L C 1.083 177.999 176.870 0.076 0.000 1.220 480 L CA 0.078 54.942 54.840 0.040 0.000 0.833 480 L CB 0.417 42.452 42.059 -0.039 0.000 1.102 480 L HN 0.774 9.004 8.230 -0.000 0.000 0.490 481 T N -1.040 113.555 114.554 0.069 0.000 2.874 481 T HA 0.378 4.720 4.350 -0.014 0.000 0.281 481 T C 1.039 175.698 174.700 -0.068 0.000 0.994 481 T CA -0.250 61.888 62.100 0.064 0.000 1.015 481 T CB 1.583 70.496 68.868 0.074 0.000 1.028 481 T HN 0.637 8.877 8.240 -0.000 0.000 0.523 482 A N 0.744 123.489 122.820 -0.124 0.000 1.933 482 A HA 0.019 4.331 4.320 -0.014 0.000 0.218 482 A C 2.123 179.573 177.584 -0.223 0.000 1.175 482 A CA 1.204 53.048 52.037 -0.322 0.000 0.628 482 A CB -0.971 17.735 19.000 -0.489 0.000 0.814 482 A HN 0.747 8.897 8.150 -0.000 0.000 0.444 483 L N -0.360 120.798 121.223 -0.109 0.000 2.046 483 L HA -0.091 4.241 4.340 -0.014 0.000 0.208 483 L C 2.364 179.198 176.870 -0.060 0.000 1.077 483 L CA 2.249 57.051 54.840 -0.064 0.000 0.747 483 L CB -0.832 41.218 42.059 -0.015 0.000 0.896 483 L HN 0.399 8.629 8.230 -0.000 0.000 0.432 484 R N -0.634 119.835 120.500 -0.052 0.000 2.092 484 R HA -0.066 4.266 4.340 -0.014 0.000 0.231 484 R C 2.245 178.505 176.300 -0.067 0.000 1.119 484 R CA 1.602 57.678 56.100 -0.040 0.000 0.970 484 R CB -0.346 29.943 30.300 -0.018 0.000 0.864 484 R HN 0.445 8.715 8.270 -0.000 0.000 0.440 485 I N 0.407 120.904 120.570 -0.122 0.000 2.142 485 I HA -0.304 3.858 4.170 -0.014 0.000 0.240 485 I C 2.426 178.475 176.117 -0.113 0.000 1.078 485 I CA 1.369 62.581 61.300 -0.148 0.000 1.343 485 I CB -0.382 37.437 38.000 -0.301 0.000 1.046 485 I HN 0.217 8.427 8.210 -0.000 0.000 0.405 486 K N 1.600 121.918 120.400 -0.135 0.000 2.015 486 K HA -0.283 4.029 4.320 -0.014 0.000 0.216 486 K C 2.149 178.726 176.600 -0.038 0.000 1.052 486 K CA 2.013 58.254 56.287 -0.076 0.000 0.937 486 K CB -0.075 32.382 32.500 -0.072 0.000 0.719 486 K HN 0.198 8.448 8.250 -0.000 0.000 0.446 487 K N -0.367 120.013 120.400 -0.034 0.000 2.032 487 K HA -0.118 4.194 4.320 -0.014 0.000 0.209 487 K C 2.227 178.819 176.600 -0.014 0.000 1.048 487 K CA 2.091 58.368 56.287 -0.015 0.000 0.927 487 K CB -0.251 32.243 32.500 -0.010 0.000 0.712 487 K HN 0.263 8.513 8.250 -0.000 0.000 0.441 488 T N 1.919 116.461 114.554 -0.021 0.000 2.652 488 T HA -0.135 4.207 4.350 -0.014 0.000 0.267 488 T C 1.914 176.607 174.700 -0.012 0.000 1.039 488 T CA 1.323 63.413 62.100 -0.017 0.000 1.153 488 T CB -0.266 68.587 68.868 -0.024 0.000 0.863 488 T HN 0.067 8.307 8.240 -0.000 0.000 0.428 489 L N 0.721 121.938 121.223 -0.010 0.000 2.093 489 L HA -0.094 4.238 4.340 -0.014 0.000 0.208 489 L C 2.839 179.706 176.870 -0.005 0.000 1.085 489 L CA 1.300 56.138 54.840 -0.003 0.000 0.755 489 L CB -0.609 41.457 42.059 0.011 0.000 0.904 489 L HN 0.249 8.479 8.230 -0.000 0.000 0.435 490 Q N -0.142 119.655 119.800 -0.004 0.000 2.197 490 Q HA -0.269 4.063 4.340 -0.014 0.000 0.207 490 Q C 2.106 178.106 176.000 0.001 0.000 0.984 490 Q CA 1.492 57.294 55.803 -0.001 0.000 0.869 490 Q CB -0.084 28.655 28.738 0.002 0.000 0.906 490 Q HN 0.365 8.635 8.270 -0.000 0.000 0.426 491 K N 0.115 120.515 120.400 0.000 0.000 2.439 491 K HA -0.040 4.272 4.320 -0.014 0.000 0.197 491 K C 1.549 178.151 176.600 0.003 0.000 1.041 491 K CA 0.489 56.777 56.287 0.002 0.000 0.970 491 K CB 0.183 32.684 32.500 0.001 0.000 0.773 491 K HN 0.266 8.516 8.250 -0.000 0.000 0.479 492 I N -0.457 120.114 120.570 0.001 0.000 2.716 492 I HA -0.086 4.076 4.170 -0.014 0.000 0.259 492 I C 1.431 177.553 176.117 0.009 0.000 1.172 492 I CA 0.056 61.358 61.300 0.003 0.000 1.478 492 I CB 0.172 38.170 38.000 -0.003 0.000 1.104 492 I HN -0.059 8.151 8.210 -0.000 0.000 0.439 493 S N 0.000 115.703 115.700 0.006 0.000 2.498 493 S HA 0.000 4.462 4.470 -0.014 0.000 0.327 493 S CA 0.000 58.209 58.200 0.015 0.000 1.107 493 S CB 0.000 63.200 63.200 -0.000 0.000 0.593 493 S HN 0.000 8.310 8.310 -0.000 0.000 0.517