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 3om1_1_B DATA FIRST_RESID 2 DATA SEQUENCE LSSLRMAAIL DDQTVcGRGE RLALALAREQ INGIXXXXXK ARVEVDIFEL DATA SEQUENCE QRDSQYETTD TMcQILPKGV VSVLGPSSSP ASASTVSHIC GEKEIPHIKV DATA SEQUENCE GPEETPXLQY LRFASVSLYP SNEDVSLAVS RILKSFNYPS ASLIcAKAEc DATA SEQUENCE LLRLEELVRG FLISKETLSV RMLDXSRDPT PLLKEIRDDK VSTIIIDANA DATA SEQUENCE SISHLVLRKA SELGMTSAFY KYILTTMDFP ILHLDGIVED SSNILGFSMF DATA SEQUENCE NTSHPFYPEF VRSLNMSWRE NcEASTYPGP ALSAALMFDA VHVVVSAVRE DATA SEQUENCE LNRSQEIGVK PLAcTSANIW PHGTSLMNYL RMVEYDGLTG RVEFNSKGQR DATA SEQUENCE TNYTLRILEK SRQGHREIGV WYSN 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 2 L HA 0.000 4.347 4.340 0.012 0.000 0.249 2 L C 0.000 176.867 176.870 -0.006 0.000 1.165 2 L CA 0.000 54.842 54.840 0.003 0.000 0.813 2 L CB 0.000 42.059 42.059 0.000 0.000 0.961 3 S N 2.007 117.705 115.700 -0.004 0.000 2.362 3 S HA -0.079 4.386 4.470 -0.008 0.000 0.221 3 S C 0.148 174.740 174.600 -0.014 0.000 1.032 3 S CA 0.844 59.039 58.200 -0.008 0.000 0.973 3 S CB 0.407 63.604 63.200 -0.006 0.000 0.849 3 S HN 0.238 8.547 8.310 -0.001 0.000 0.465 4 S N -0.249 115.441 115.700 -0.017 0.000 2.599 4 S HA 0.267 4.801 4.470 -0.024 -0.078 0.294 4 S C -1.306 173.278 174.600 -0.027 0.000 1.094 4 S CA -1.596 56.590 58.200 -0.023 0.000 0.931 4 S CB 3.184 66.370 63.200 -0.024 0.000 1.093 4 S HN -0.815 7.486 8.310 -0.015 0.000 0.488 5 L N 2.402 123.604 121.223 -0.034 0.000 2.352 5 L HA 0.209 4.531 4.340 -0.030 0.000 0.272 5 L C -1.915 174.927 176.870 -0.046 0.000 1.109 5 L CA -1.104 53.714 54.840 -0.037 0.000 0.952 5 L CB 0.663 42.696 42.059 -0.043 0.000 1.314 5 L HN 0.464 8.672 8.230 -0.036 0.000 0.427 6 R N 7.167 127.636 120.500 -0.052 0.000 2.265 6 R HA 0.495 4.995 4.340 -0.043 -0.186 0.319 6 R C -1.123 175.137 176.300 -0.067 0.000 1.006 6 R CA -1.031 55.038 56.100 -0.053 0.000 0.880 6 R CB 2.125 32.395 30.300 -0.050 0.000 1.077 6 R HN 0.030 8.267 8.270 -0.056 0.000 0.454 7 M N 2.621 122.195 119.600 -0.044 0.000 2.690 7 M HA 0.721 5.234 4.480 -0.068 -0.074 0.302 7 M C -2.630 173.676 176.300 0.010 0.000 1.234 7 M CA -1.319 53.958 55.300 -0.039 0.000 0.853 7 M CB 5.195 37.774 32.600 -0.034 0.000 1.748 7 M HN 0.235 8.506 8.290 -0.032 0.000 0.469 8 A N -2.617 120.217 122.820 0.023 0.000 2.356 8 A HA 0.988 5.589 4.320 0.173 -0.177 0.323 8 A C -2.233 175.412 177.584 0.102 0.000 1.119 8 A CA -2.328 49.775 52.037 0.110 0.000 0.790 8 A CB 3.504 22.544 19.000 0.067 0.000 1.273 8 A HN 0.105 8.249 8.150 -0.009 0.000 0.452 9 A N 0.977 123.899 122.820 0.169 0.000 2.356 9 A HA 0.899 5.462 4.320 0.109 -0.178 0.310 9 A C -2.158 175.537 177.584 0.186 0.000 1.075 9 A CA -1.928 50.192 52.037 0.138 0.000 0.746 9 A CB 3.054 22.120 19.000 0.109 0.000 1.221 9 A HN 0.641 8.933 8.150 0.236 0.000 0.443 10 I N 3.171 123.822 120.570 0.135 0.000 2.321 10 I HA 0.642 5.126 4.170 0.186 -0.203 0.291 10 I C -1.218 174.965 176.117 0.110 0.000 0.998 10 I CA -1.039 60.340 61.300 0.131 0.000 1.227 10 I CB 1.413 39.453 38.000 0.067 0.000 1.368 10 I HN 0.245 8.521 8.210 0.110 0.000 0.466 11 L N 6.094 127.381 121.223 0.107 0.000 2.341 11 L HA 0.501 4.894 4.340 0.088 0.000 0.278 11 L C -0.912 176.002 176.870 0.072 0.000 1.005 11 L CA -1.247 53.645 54.840 0.087 0.000 0.818 11 L CB 2.602 44.709 42.059 0.079 0.000 1.259 11 L HN 0.537 8.838 8.230 0.119 0.000 0.418 12 D N -0.720 119.720 120.400 0.065 0.000 2.440 12 D HA 0.098 4.920 4.640 0.051 -0.152 0.216 12 D C -0.196 176.135 176.300 0.051 0.000 1.150 12 D CA -1.666 52.366 54.000 0.054 0.000 0.832 12 D CB 0.233 41.062 40.800 0.048 0.000 0.992 12 D HN 0.329 8.740 8.370 0.069 0.000 0.502 13 D N -0.099 120.336 120.400 0.057 0.000 2.302 13 D HA -0.006 4.671 4.640 0.061 0.000 0.248 13 D C -0.205 176.117 176.300 0.036 0.000 1.094 13 D CA 0.190 54.225 54.000 0.057 0.000 0.897 13 D CB 1.388 42.233 40.800 0.075 0.000 1.200 13 D HN -0.120 8.216 8.370 0.062 0.072 0.429 14 Q N 2.692 122.507 119.800 0.025 0.000 2.299 14 Q HA 0.110 4.449 4.340 -0.001 0.000 0.246 14 Q C 1.026 177.015 176.000 -0.018 0.000 0.935 14 Q CA 0.070 55.871 55.803 -0.002 0.000 0.887 14 Q CB 1.238 29.965 28.738 -0.017 0.000 1.223 14 Q HN -0.026 8.263 8.270 0.031 0.000 0.439 15 T N -1.477 113.057 114.554 -0.033 0.000 2.904 15 T HA -0.187 4.146 4.350 -0.028 0.000 0.267 15 T C 0.354 174.998 174.700 -0.093 0.000 1.059 15 T CA 1.205 63.278 62.100 -0.045 0.000 1.137 15 T CB -0.202 68.642 68.868 -0.040 0.000 0.879 15 T HN 0.307 8.528 8.240 -0.031 0.000 0.467 16 V N 0.980 120.820 119.914 -0.123 0.000 2.398 16 V HA 0.018 3.997 4.120 -0.236 0.000 0.286 16 V C -0.709 175.207 176.094 -0.297 0.000 1.026 16 V CA -0.493 61.683 62.300 -0.206 0.000 0.868 16 V CB 1.287 33.010 31.823 -0.166 0.000 0.982 16 V HN -0.659 7.470 8.190 -0.101 0.000 0.443 17 c N 0.413 118.675 118.600 -0.563 0.000 4.358 17 c HA -0.255 3.287 4.570 -1.713 0.000 0.287 17 c C 0.088 173.941 174.090 -0.396 0.000 1.414 17 c CA 0.080 55.892 56.329 -0.861 0.000 1.949 17 c CB -2.928 39.273 42.510 -0.515 0.000 1.274 17 c HN 0.717 8.557 8.230 -0.649 0.000 0.793 18 G N -1.160 107.525 108.800 -0.192 0.000 2.531 18 G HA2 0.249 4.235 3.960 0.044 0.000 0.281 18 G HA3 0.249 4.452 3.960 0.016 -0.233 0.281 18 G C -0.564 174.450 174.900 0.191 0.000 1.382 18 G CA -0.678 44.436 45.100 0.024 0.000 1.045 18 G HN -0.523 7.605 8.290 -0.223 0.028 0.533 19 R N -1.068 119.542 120.500 0.184 0.000 2.310 19 R HA -0.047 4.467 4.340 0.289 0.000 0.202 19 R C 0.219 176.653 176.300 0.223 0.000 0.933 19 R CA 0.069 56.309 56.100 0.233 0.000 1.054 19 R CB 0.590 31.007 30.300 0.195 0.000 0.985 19 R HN -0.078 8.751 8.270 0.141 -0.475 0.489 20 G N -1.427 107.478 108.800 0.176 0.000 2.198 20 G HA2 -0.404 3.620 3.960 0.105 0.000 0.260 20 G HA3 -0.404 3.637 3.960 0.135 0.000 0.260 20 G C 0.264 175.253 174.900 0.148 0.000 1.025 20 G CA 0.455 45.637 45.100 0.137 0.000 0.769 20 G HN -0.335 8.049 8.290 0.148 -0.005 0.507 21 E N 0.336 120.632 120.200 0.159 0.000 2.110 21 E HA -0.482 4.006 4.350 0.230 0.000 0.193 21 E C 1.485 178.180 176.600 0.159 0.000 0.988 21 E CA 3.486 59.995 56.400 0.181 0.000 0.804 21 E CB -0.214 29.580 29.700 0.157 0.000 0.745 21 E HN -0.393 8.335 8.360 0.147 -0.281 0.458 22 R N -0.714 119.854 120.500 0.113 0.000 2.081 22 R HA -0.270 4.124 4.340 0.090 0.000 0.235 22 R C 1.628 177.989 176.300 0.102 0.000 1.131 22 R CA 3.244 59.397 56.100 0.089 0.000 0.960 22 R CB -0.498 29.834 30.300 0.052 0.000 0.856 22 R HN 0.005 8.334 8.270 0.099 0.000 0.436 23 L N -2.559 118.724 121.223 0.100 0.000 2.109 23 L HA -0.159 4.237 4.340 0.094 0.000 0.207 23 L C 1.200 178.184 176.870 0.190 0.000 1.086 23 L CA 2.570 57.472 54.840 0.103 0.000 0.760 23 L CB -0.604 41.484 42.059 0.048 0.000 0.910 23 L HN -0.417 7.867 8.230 0.090 0.000 0.437 24 A N -0.545 122.427 122.820 0.253 0.000 1.902 24 A HA -0.329 4.362 4.320 0.617 0.000 0.217 24 A C 2.111 179.981 177.584 0.477 0.000 1.181 24 A CA 3.165 55.504 52.037 0.503 0.000 0.623 24 A CB -0.878 18.488 19.000 0.610 0.000 0.818 24 A HN -0.222 8.057 8.150 0.215 0.000 0.443 25 L N -2.249 119.146 121.223 0.286 0.000 2.046 25 L HA -0.422 4.019 4.340 0.168 0.000 0.208 25 L C 2.050 179.003 176.870 0.140 0.000 1.077 25 L CA 3.136 58.083 54.840 0.179 0.000 0.747 25 L CB -0.361 41.769 42.059 0.118 0.000 0.896 25 L HN -0.379 7.998 8.230 0.245 0.000 0.432 26 A N -0.799 122.109 122.820 0.145 0.000 1.933 26 A HA -0.301 4.063 4.320 0.074 0.000 0.218 26 A C 2.124 179.804 177.584 0.160 0.000 1.175 26 A CA 3.055 55.160 52.037 0.113 0.000 0.628 26 A CB -0.858 18.199 19.000 0.094 0.000 0.814 26 A HN -0.549 7.692 8.150 0.152 0.000 0.444 27 L N -1.625 119.767 121.223 0.282 0.000 2.046 27 L HA -0.338 4.199 4.340 0.329 0.000 0.208 27 L C 2.513 179.586 176.870 0.339 0.000 1.077 27 L CA 2.840 57.922 54.840 0.404 0.000 0.747 27 L CB -0.384 42.074 42.059 0.664 0.000 0.896 27 L HN 0.048 8.468 8.230 0.317 0.000 0.432 28 A N -1.591 121.372 122.820 0.239 0.000 1.902 28 A HA -0.361 3.729 4.320 -0.383 0.000 0.217 28 A C 1.703 179.144 177.584 -0.239 0.000 1.181 28 A CA 3.111 54.984 52.037 -0.274 0.000 0.623 28 A CB -0.975 17.671 19.000 -0.589 0.000 0.818 28 A HN -0.277 8.073 8.150 0.332 0.000 0.443 29 R N -1.183 119.248 120.500 -0.114 0.000 2.083 29 R HA -0.416 3.829 4.340 -0.159 0.000 0.237 29 R C 1.549 177.812 176.300 -0.063 0.000 1.137 29 R CA 3.491 59.529 56.100 -0.103 0.000 0.951 29 R CB -0.109 30.164 30.300 -0.044 0.000 0.851 29 R HN -0.293 7.948 8.270 -0.048 0.000 0.434 30 E N -1.311 118.891 120.200 0.003 0.000 2.110 30 E HA -0.373 3.987 4.350 0.016 0.000 0.193 30 E C 2.080 178.691 176.600 0.020 0.000 0.988 30 E CA 2.979 59.396 56.400 0.029 0.000 0.804 30 E CB -0.316 29.432 29.700 0.080 0.000 0.745 30 E HN -0.357 8.024 8.360 0.035 0.000 0.458 31 Q N -0.328 119.477 119.800 0.008 0.000 2.046 31 Q HA -0.252 4.109 4.340 0.035 0.000 0.200 31 Q C 2.685 178.667 176.000 -0.030 0.000 0.975 31 Q CA 2.982 58.784 55.803 -0.002 0.000 0.836 31 Q CB 0.013 28.725 28.738 -0.044 0.000 0.896 31 Q HN -0.562 7.714 8.270 0.010 0.000 0.428 32 I N -1.672 118.829 120.570 -0.116 0.000 2.252 32 I HA -0.444 3.669 4.170 -0.095 0.000 0.245 32 I C 2.432 178.505 176.117 -0.073 0.000 1.102 32 I CA 3.643 64.862 61.300 -0.134 0.000 1.385 32 I CB -0.062 37.772 38.000 -0.277 0.000 1.064 32 I HN -0.262 7.844 8.210 -0.173 0.000 0.414 33 N N -0.684 117.978 118.700 -0.063 0.000 2.331 33 N HA -0.200 4.516 4.740 -0.040 0.000 0.180 33 N C 2.095 177.598 175.510 -0.012 0.000 1.019 33 N CA 2.369 55.397 53.050 -0.036 0.000 0.881 33 N CB -0.281 38.187 38.487 -0.031 0.000 0.972 33 N HN -0.102 8.235 8.380 -0.071 0.000 0.435 34 G N -0.742 108.059 108.800 0.001 0.000 2.484 34 G HA2 -0.162 3.809 3.960 0.018 0.000 0.218 34 G HA3 -0.162 3.817 3.960 0.031 0.000 0.218 34 G C -0.020 174.892 174.900 0.021 0.000 1.130 34 G CA 0.255 45.366 45.100 0.019 0.000 0.784 34 G HN -0.387 7.879 8.290 -0.002 0.022 0.543 42 A N 1.479 124.286 122.820 -0.023 0.000 2.331 42 A HA 0.170 4.477 4.320 -0.021 0.000 0.283 42 A C -0.932 176.634 177.584 -0.030 0.000 1.142 42 A CA -0.493 51.530 52.037 -0.024 0.000 0.812 42 A CB 1.546 20.531 19.000 -0.025 0.000 1.074 42 A HN 0.152 8.287 8.150 -0.025 0.000 0.497 43 R N 2.831 123.314 120.500 -0.028 0.000 2.340 43 R HA 0.057 4.487 4.340 -0.035 -0.111 0.300 43 R C -0.337 175.938 176.300 -0.042 0.000 1.069 43 R CA -0.560 55.520 56.100 -0.033 0.000 0.984 43 R CB 1.161 31.446 30.300 -0.025 0.000 1.003 43 R HN 0.250 8.506 8.270 -0.025 0.000 0.459 44 V N 7.879 127.760 119.914 -0.055 0.000 2.555 44 V HA -0.003 4.249 4.120 -0.064 -0.171 0.286 44 V C -0.927 175.135 176.094 -0.054 0.000 1.044 44 V CA 0.843 63.103 62.300 -0.067 0.000 1.026 44 V CB 0.536 32.297 31.823 -0.102 0.000 0.981 44 V HN 0.245 8.735 8.190 -0.059 -0.335 0.480 45 E N 7.573 127.745 120.200 -0.047 0.000 2.266 45 E HA 0.383 4.712 4.350 -0.035 0.000 0.268 45 E C -1.926 174.655 176.600 -0.031 0.000 0.879 45 E CA -2.378 54.001 56.400 -0.036 0.000 0.762 45 E CB 3.682 33.365 29.700 -0.029 0.000 1.199 45 E HN 0.028 8.359 8.360 -0.049 0.000 0.422 46 V N 5.039 124.940 119.914 -0.023 0.000 2.349 46 V HA 0.312 4.614 4.120 0.000 -0.182 0.284 46 V C -1.311 174.782 176.094 -0.001 0.000 1.014 46 V CA -1.443 60.853 62.300 -0.005 0.000 0.826 46 V CB 1.654 33.476 31.823 -0.002 0.000 1.009 46 V HN 0.308 8.483 8.190 -0.024 0.000 0.431 47 D N 8.407 128.824 120.400 0.027 0.000 2.312 47 D HA 0.115 4.704 4.640 -0.085 0.000 0.252 47 D C -1.381 174.920 176.300 0.002 0.000 1.150 47 D CA -0.024 53.973 54.000 -0.005 0.000 0.870 47 D CB 1.234 42.107 40.800 0.122 0.000 1.153 47 D HN -0.040 8.361 8.370 0.051 0.000 0.457 48 I N 1.212 121.664 120.570 -0.196 0.000 2.377 48 I HA 0.480 4.869 4.170 0.060 -0.182 0.293 48 I C -0.457 175.437 176.117 -0.373 0.000 0.987 48 I CA -0.713 60.516 61.300 -0.118 0.000 1.185 48 I CB 1.938 39.898 38.000 -0.067 0.000 1.341 48 I HN 0.133 8.181 8.210 -0.270 0.000 0.455 49 F N 6.562 126.512 119.950 -0.001 0.000 2.529 49 F HA 0.322 4.847 4.527 -0.004 0.000 0.320 49 F C -1.114 174.689 175.800 0.004 0.000 1.118 49 F CA -1.274 56.724 58.000 -0.003 0.000 0.915 49 F CB 3.731 42.724 39.000 -0.013 0.000 1.161 49 F HN 0.711 9.188 8.300 0.295 0.000 0.445 50 E N 2.533 122.818 120.200 0.141 0.000 2.231 50 E HA 0.510 5.080 4.350 0.086 -0.168 0.277 50 E C -0.981 175.675 176.600 0.093 0.000 0.999 50 E CA -1.122 55.332 56.400 0.090 0.000 0.827 50 E CB 2.193 31.920 29.700 0.045 0.000 1.101 50 E HN 0.161 8.592 8.360 0.118 0.000 0.393 51 L N 3.840 125.107 121.223 0.073 0.000 2.296 51 L HA 0.329 4.707 4.340 0.062 0.000 0.286 51 L C 0.552 177.450 176.870 0.047 0.000 1.023 51 L CA -1.015 53.861 54.840 0.060 0.000 0.812 51 L CB 1.481 43.572 42.059 0.053 0.000 1.223 51 L HN 0.252 8.524 8.230 0.070 0.000 0.421 52 Q N 2.510 122.336 119.800 0.043 0.000 2.245 52 Q HA -0.053 4.305 4.340 0.030 0.000 0.201 52 Q C 0.192 176.210 176.000 0.031 0.000 0.955 52 Q CA 1.321 57.144 55.803 0.034 0.000 0.870 52 Q CB 0.509 29.266 28.738 0.032 0.000 0.945 52 Q HN 0.486 8.784 8.270 0.047 0.000 0.461 53 R N -4.462 116.058 120.500 0.035 0.000 2.728 53 R HA 0.224 4.581 4.340 0.029 0.000 0.274 53 R C -2.522 173.798 176.300 0.034 0.000 1.030 53 R CA -1.549 54.569 56.100 0.031 0.000 0.876 53 R CB 0.875 31.191 30.300 0.027 0.000 1.259 53 R HN -0.777 7.517 8.270 0.039 0.000 0.468 54 D N 0.698 121.116 120.400 0.030 0.000 2.470 54 D HA 0.064 4.723 4.640 0.031 0.000 0.226 54 D C -0.902 175.419 176.300 0.035 0.000 1.196 54 D CA 0.283 54.301 54.000 0.030 0.000 0.979 54 D CB -0.766 40.049 40.800 0.024 0.000 1.059 54 D HN 0.098 8.484 8.370 0.027 0.000 0.515 55 S N 3.442 119.168 115.700 0.044 0.000 2.647 55 S HA 0.290 4.794 4.470 0.056 0.000 0.300 55 S C 0.466 175.107 174.600 0.068 0.000 1.129 55 S CA -1.722 56.514 58.200 0.061 0.000 1.029 55 S CB 1.641 64.888 63.200 0.078 0.000 1.007 55 S HN -0.465 7.871 8.310 0.044 0.000 0.484 56 Q N 8.956 128.798 119.800 0.069 0.000 2.119 56 Q HA -0.295 4.063 4.340 0.030 0.000 0.201 56 Q C 1.340 177.378 176.000 0.063 0.000 0.972 56 Q CA 3.224 59.058 55.803 0.051 0.000 0.847 56 Q CB 0.078 28.841 28.738 0.041 0.000 0.903 56 Q HN 0.770 9.081 8.270 0.068 0.000 0.433 57 Y N 0.604 120.902 120.300 -0.004 0.000 2.163 57 Y HA -0.393 4.154 4.550 -0.004 0.000 0.288 57 Y C 1.458 177.356 175.900 -0.004 0.000 1.136 57 Y CA 3.510 61.608 58.100 -0.004 0.000 1.147 57 Y CB -0.045 38.413 38.460 -0.002 0.000 0.987 57 Y HN -0.336 8.086 8.280 0.235 0.000 0.509 58 E N -1.624 118.702 120.200 0.210 0.000 2.152 58 E HA -0.262 4.170 4.350 0.137 0.000 0.192 58 E C 2.367 178.976 176.600 0.014 0.000 0.983 58 E CA 2.433 58.906 56.400 0.120 0.000 0.818 58 E CB 0.120 29.897 29.700 0.128 0.000 0.758 58 E HN -0.579 7.919 8.360 0.231 0.000 0.467 59 T N 2.624 117.179 114.554 0.002 0.000 2.833 59 T HA -0.310 4.022 4.350 -0.030 0.000 0.269 59 T C 1.710 176.359 174.700 -0.085 0.000 1.054 59 T CA 4.946 67.026 62.100 -0.034 0.000 1.135 59 T CB -0.177 68.678 68.868 -0.022 0.000 0.869 59 T HN -0.165 8.090 8.240 0.024 0.000 0.466 60 T N 3.790 118.275 114.554 -0.115 0.000 2.777 60 T HA -0.416 3.859 4.350 -0.125 0.000 0.266 60 T C 1.656 176.253 174.700 -0.173 0.000 1.040 60 T CA 5.305 67.311 62.100 -0.157 0.000 1.141 60 T CB -0.180 68.558 68.868 -0.217 0.000 0.868 60 T HN -0.458 7.702 8.240 -0.113 0.012 0.444 61 D N 0.958 121.249 120.400 -0.182 0.000 2.149 61 D HA -0.252 4.303 4.640 -0.140 0.000 0.198 61 D C 2.176 178.416 176.300 -0.100 0.000 0.990 61 D CA 3.550 57.473 54.000 -0.128 0.000 0.839 61 D CB -0.544 40.215 40.800 -0.069 0.000 0.948 61 D HN -0.590 7.660 8.370 -0.200 0.000 0.460 62 T N 2.456 116.951 114.554 -0.098 0.000 2.777 62 T HA -0.339 3.951 4.350 -0.100 0.000 0.266 62 T C 2.001 176.542 174.700 -0.266 0.000 1.040 62 T CA 4.172 66.190 62.100 -0.137 0.000 1.141 62 T CB 0.095 68.907 68.868 -0.092 0.000 0.868 62 T HN -0.538 7.555 8.240 -0.086 0.095 0.444 63 M N 0.894 120.361 119.600 -0.222 0.000 2.159 63 M HA -0.363 3.936 4.480 -0.301 0.000 0.263 63 M C 1.531 177.703 176.300 -0.214 0.000 1.063 63 M CA 2.151 57.307 55.300 -0.240 0.000 1.110 63 M CB -1.309 31.182 32.600 -0.180 0.000 1.374 63 M HN -0.213 7.970 8.290 -0.178 0.000 0.411 64 c N -3.667 114.834 118.600 -0.165 0.000 2.432 64 c HA -0.207 4.291 4.570 -0.120 0.000 0.282 64 c C 1.715 175.732 174.090 -0.121 0.000 1.388 64 c CA 1.926 58.178 56.329 -0.127 0.000 1.777 64 c CB -1.884 40.565 42.510 -0.101 0.000 1.882 64 c HN -0.389 7.748 8.230 -0.155 0.000 0.520 65 Q N -0.860 118.851 119.800 -0.148 0.000 2.187 65 Q HA -0.112 4.199 4.340 -0.047 0.000 0.199 65 Q C 1.078 176.963 176.000 -0.190 0.000 0.957 65 Q CA 2.110 57.848 55.803 -0.108 0.000 0.857 65 Q CB 0.266 28.988 28.738 -0.027 0.000 0.929 65 Q HN -0.701 7.346 8.270 -0.172 0.121 0.453 66 I N -1.311 119.010 120.570 -0.414 0.000 2.233 66 I HA -0.425 3.442 4.170 -0.505 0.000 0.243 66 I C 1.858 177.837 176.117 -0.229 0.000 1.093 66 I CA 3.475 64.489 61.300 -0.475 0.000 1.380 66 I CB 0.389 38.013 38.000 -0.627 0.000 1.067 66 I HN -0.651 7.197 8.210 -0.438 0.099 0.413 67 L N -1.297 119.806 121.223 -0.200 0.000 2.083 67 L HA -0.192 4.042 4.340 -0.178 0.000 0.209 67 L C -0.337 176.461 176.870 -0.120 0.000 1.083 67 L CA 5.308 60.053 54.840 -0.158 0.000 0.752 67 L CB -2.946 39.032 42.059 -0.134 0.000 0.899 67 L HN -0.544 7.561 8.230 -0.208 0.000 0.433 68 P HA -0.130 4.327 4.420 -0.056 -0.071 0.230 68 P C 0.184 177.456 177.300 -0.047 0.000 1.158 68 P CA 1.558 64.624 63.100 -0.057 0.000 0.769 68 P CB -0.530 31.148 31.700 -0.037 0.000 0.807 69 K N -5.266 115.105 120.400 -0.047 0.000 2.432 69 K HA 0.008 4.322 4.320 -0.009 0.000 0.196 69 K C 0.273 176.836 176.600 -0.062 0.000 1.038 69 K CA -0.307 55.966 56.287 -0.024 0.000 0.986 69 K CB 0.012 32.531 32.500 0.031 0.000 0.782 69 K HN -0.415 7.643 8.250 -0.061 0.155 0.485 70 G N 0.156 108.887 108.800 -0.114 0.000 2.694 70 G HA2 -0.373 3.589 3.960 -0.224 0.000 0.247 70 G HA3 -0.373 3.507 3.960 -0.134 0.000 0.247 70 G C -1.962 172.808 174.900 -0.216 0.000 0.989 70 G CA 0.415 45.412 45.100 -0.173 0.000 1.252 70 G HN -0.537 7.635 8.290 -0.123 0.045 0.483 71 V N -3.184 116.543 119.914 -0.313 0.000 2.960 71 V HA 0.655 4.792 4.120 -0.228 -0.154 0.315 71 V C -0.969 174.807 176.094 -0.530 0.000 1.087 71 V CA -3.186 58.933 62.300 -0.302 0.000 0.982 71 V CB 3.330 35.034 31.823 -0.200 0.000 1.039 71 V HN -0.583 7.393 8.190 -0.357 0.000 0.437 72 V N -4.762 114.923 119.914 -0.382 0.000 3.590 72 V HA 0.216 3.777 4.120 -0.932 0.000 0.265 72 V C -0.389 175.624 176.094 -0.135 0.000 1.239 72 V CA 0.293 62.358 62.300 -0.392 0.000 1.117 72 V CB 0.672 32.471 31.823 -0.040 0.000 0.818 72 V HN 0.404 8.451 8.190 -0.239 0.000 0.451 73 S N -2.248 113.380 115.700 -0.119 0.000 2.578 73 S HA 0.362 4.964 4.470 -0.018 -0.143 0.272 73 S C -2.196 172.376 174.600 -0.047 0.000 1.145 73 S CA -0.358 57.819 58.200 -0.039 0.000 0.835 73 S CB 3.567 66.768 63.200 0.001 0.000 1.104 73 S HN -0.763 7.459 8.310 -0.145 0.000 0.458 74 V N 1.310 121.218 119.914 -0.010 0.000 2.540 74 V HA 0.441 4.730 4.120 -0.014 -0.177 0.302 74 V C -1.917 174.245 176.094 0.112 0.000 1.035 74 V CA -1.338 60.962 62.300 -0.000 0.000 0.873 74 V CB 2.434 34.200 31.823 -0.094 0.000 0.992 74 V HN 0.377 8.577 8.190 0.016 0.000 0.428 75 L N 5.258 126.539 121.223 0.096 0.000 2.307 75 L HA 0.760 5.364 4.340 0.127 -0.187 0.284 75 L C 0.215 177.172 176.870 0.145 0.000 1.023 75 L CA -1.619 53.292 54.840 0.119 0.000 0.810 75 L CB 1.049 43.155 42.059 0.078 0.000 1.231 75 L HN 0.469 8.740 8.230 0.070 0.000 0.423 76 G N 2.362 111.263 108.800 0.169 0.000 2.681 76 G HA2 -0.303 3.725 3.960 0.112 0.000 0.220 76 G HA3 -0.303 3.730 3.960 0.121 0.000 0.220 76 G C -2.789 172.240 174.900 0.215 0.000 1.353 76 G CA -0.765 44.425 45.100 0.151 0.000 0.872 76 G HN -0.075 8.301 8.290 0.144 0.000 0.557 77 P HA 0.262 4.921 4.420 0.090 -0.185 0.274 77 P C 0.065 177.402 177.300 0.062 0.000 1.256 77 P CA -0.855 62.297 63.100 0.086 0.000 0.795 77 P CB 1.271 33.010 31.700 0.065 0.000 1.038 78 S N -2.413 113.318 115.700 0.052 0.000 2.478 78 S HA -0.045 4.431 4.470 0.010 0.000 0.222 78 S C 1.098 175.690 174.600 -0.012 0.000 1.008 78 S CA 1.677 59.893 58.200 0.026 0.000 0.928 78 S CB 0.339 63.578 63.200 0.064 0.000 0.781 78 S HN 0.347 8.695 8.310 0.063 0.000 0.518 79 S N -0.201 115.503 115.700 0.007 0.000 3.025 79 S HA 0.370 4.822 4.470 -0.029 0.000 0.251 79 S C -1.449 173.154 174.600 0.005 0.000 0.954 79 S CA -0.117 58.082 58.200 -0.002 0.000 1.092 79 S CB 1.274 64.489 63.200 0.024 0.000 1.079 79 S HN -0.250 8.325 8.310 0.023 -0.251 0.543 80 S N 1.341 117.044 115.700 0.005 0.000 2.312 80 S HA 0.543 5.020 4.470 0.012 0.000 0.173 80 S C -1.832 172.774 174.600 0.011 0.000 1.488 80 S CA -2.086 56.122 58.200 0.014 0.000 1.239 80 S CB 0.642 63.858 63.200 0.026 0.000 1.215 80 S HN -0.553 7.759 8.310 0.003 0.000 0.438 81 P HA -0.146 4.268 4.420 -0.010 0.000 0.216 81 P C 0.631 177.938 177.300 0.012 0.000 1.153 81 P CA 2.330 65.427 63.100 -0.004 0.000 0.848 81 P CB 0.464 32.155 31.700 -0.016 0.000 0.787 82 A N -2.970 119.859 122.820 0.015 0.000 1.883 82 A HA -0.276 4.055 4.320 0.018 0.000 0.217 82 A C 2.116 179.714 177.584 0.024 0.000 1.186 82 A CA 2.988 55.036 52.037 0.019 0.000 0.624 82 A CB -0.843 18.169 19.000 0.020 0.000 0.822 82 A HN -0.625 7.707 8.150 0.013 -0.174 0.444 83 S N -0.461 115.254 115.700 0.025 0.000 2.368 83 S HA -0.411 4.069 4.470 0.017 0.000 0.225 83 S C 2.003 176.620 174.600 0.027 0.000 1.030 83 S CA 3.283 61.496 58.200 0.022 0.000 0.999 83 S CB -0.080 63.135 63.200 0.024 0.000 0.844 83 S HN -0.365 8.240 8.310 0.024 -0.280 0.459 84 A N 1.311 124.162 122.820 0.052 0.000 1.972 84 A HA -0.278 4.124 4.320 0.137 0.000 0.219 84 A C 1.431 179.092 177.584 0.129 0.000 1.169 84 A CA 2.874 54.983 52.037 0.120 0.000 0.635 84 A CB -0.817 18.253 19.000 0.116 0.000 0.810 84 A HN -0.037 8.140 8.150 0.044 0.000 0.446 85 S N -1.883 113.859 115.700 0.071 0.000 2.383 85 S HA -0.344 4.172 4.470 0.077 0.000 0.227 85 S C 2.197 176.836 174.600 0.065 0.000 1.026 85 S CA 3.359 61.597 58.200 0.063 0.000 0.981 85 S CB -0.239 62.983 63.200 0.037 0.000 0.818 85 S HN -0.268 8.073 8.310 0.051 0.000 0.472 86 T N 4.848 119.424 114.554 0.038 0.000 2.746 86 T HA -0.414 3.975 4.350 0.066 0.000 0.267 86 T C 1.483 176.187 174.700 0.007 0.000 1.039 86 T CA 5.241 67.362 62.100 0.036 0.000 1.142 86 T CB -0.051 68.820 68.868 0.005 0.000 0.866 86 T HN -0.670 7.508 8.240 0.029 0.079 0.444 87 V N 1.864 121.727 119.914 -0.085 0.000 2.332 87 V HA -0.589 3.392 4.120 -0.232 0.000 0.248 87 V C 1.657 177.569 176.094 -0.303 0.000 1.055 87 V CA 4.825 66.958 62.300 -0.279 0.000 1.038 87 V CB -0.359 31.151 31.823 -0.522 0.000 0.651 87 V HN -0.257 7.894 8.190 -0.063 0.000 0.450 88 S N -0.411 115.227 115.700 -0.104 0.000 2.368 88 S HA -0.275 4.269 4.470 0.123 0.000 0.225 88 S C 2.066 176.692 174.600 0.043 0.000 1.030 88 S CA 3.484 61.738 58.200 0.089 0.000 0.999 88 S CB -0.568 62.746 63.200 0.191 0.000 0.844 88 S HN -0.329 7.977 8.310 -0.006 0.000 0.459 89 H N 3.327 122.390 119.070 -0.011 0.000 2.293 89 H HA -0.222 4.375 4.556 0.068 0.000 0.300 89 H C 2.358 177.705 175.328 0.031 0.000 1.082 89 H CA 3.713 59.788 56.048 0.044 0.000 1.308 89 H CB 0.116 29.927 29.762 0.081 0.000 1.375 89 H HN -0.594 7.794 8.280 0.180 0.000 0.495 90 I N -0.669 119.870 120.570 -0.052 0.000 2.315 90 I HA -0.417 3.646 4.170 -0.178 0.000 0.248 90 I C 1.974 178.017 176.117 -0.123 0.000 1.117 90 I CA 4.107 65.335 61.300 -0.119 0.000 1.404 90 I CB 0.020 37.979 38.000 -0.069 0.000 1.071 90 I HN -0.389 7.846 8.210 0.042 0.000 0.419 91 C N -0.374 118.858 119.300 -0.114 0.000 2.429 91 C HA -0.500 3.913 4.460 -0.078 0.000 0.277 91 C C 2.302 177.275 174.990 -0.030 0.000 1.262 91 C CA 5.329 64.299 59.018 -0.079 0.000 1.733 91 C CB -0.320 27.367 27.740 -0.088 0.000 2.010 91 C HN 0.213 8.367 8.230 -0.128 0.000 0.483 92 G N -1.584 107.194 108.800 -0.037 0.000 2.418 92 G HA2 -0.320 3.671 3.960 0.053 0.000 0.217 92 G HA3 -0.320 3.643 3.960 0.005 0.000 0.217 92 G C 1.537 176.439 174.900 0.002 0.000 1.158 92 G CA 1.691 46.796 45.100 0.008 0.000 0.771 92 G HN -0.069 8.188 8.290 -0.055 0.000 0.545 93 E N 0.496 120.642 120.200 -0.090 0.000 2.150 93 E HA -0.228 4.092 4.350 -0.050 0.000 0.193 93 E C 1.581 178.168 176.600 -0.021 0.000 0.985 93 E CA 2.054 58.406 56.400 -0.081 0.000 0.814 93 E CB 0.019 29.616 29.700 -0.170 0.000 0.752 93 E HN -0.581 7.681 8.360 -0.163 0.000 0.466 94 K N -3.998 116.395 120.400 -0.010 0.000 2.393 94 K HA 0.173 4.510 4.320 0.029 0.000 0.193 94 K C -0.850 175.814 176.600 0.107 0.000 1.026 94 K CA -1.249 55.056 56.287 0.030 0.000 1.064 94 K CB 0.590 33.088 32.500 -0.002 0.000 0.833 94 K HN -0.574 7.546 8.250 -0.029 0.112 0.521 95 E N -3.612 116.657 120.200 0.116 0.000 2.297 95 E HA -0.433 4.026 4.350 0.180 0.000 0.228 95 E C -2.072 174.696 176.600 0.279 0.000 1.213 95 E CA 0.773 57.285 56.400 0.187 0.000 0.712 95 E CB -2.317 27.493 29.700 0.183 0.000 1.202 95 E HN -0.340 7.903 8.360 0.084 0.168 0.376 96 I N -1.361 119.323 120.570 0.190 0.000 2.378 96 I HA 0.273 4.679 4.170 0.394 0.000 0.291 96 I C -2.705 173.470 176.117 0.097 0.000 0.992 96 I CA -3.292 58.124 61.300 0.194 0.000 1.154 96 I CB 1.586 39.594 38.000 0.014 0.000 1.315 96 I HN -0.636 7.641 8.210 0.112 0.000 0.448 97 P HA -0.026 4.490 4.420 -0.047 -0.124 0.264 97 P C -1.769 175.558 177.300 0.046 0.000 1.193 97 P CA -0.218 62.891 63.100 0.015 0.000 0.763 97 P CB 0.513 32.218 31.700 0.008 0.000 0.810 98 H N 6.232 125.242 119.070 -0.101 0.000 2.552 98 H HA 0.438 5.110 4.556 -0.073 -0.160 0.311 98 H C -1.076 174.188 175.328 -0.107 0.000 1.071 98 H CA -1.966 54.029 56.048 -0.089 0.000 1.307 98 H CB 2.287 32.000 29.762 -0.082 0.000 1.416 98 H HN -0.062 8.258 8.280 0.066 0.000 0.464 99 I N 8.092 128.664 120.570 0.004 0.000 2.330 99 I HA 0.321 4.505 4.170 -0.201 -0.134 0.286 99 I C -1.189 174.788 176.117 -0.235 0.000 1.025 99 I CA -2.719 58.499 61.300 -0.136 0.000 1.197 99 I CB -1.225 36.753 38.000 -0.036 0.000 1.358 99 I HN 0.667 8.985 8.210 0.182 0.000 0.467 100 K N 7.424 127.605 120.400 -0.366 0.000 2.144 100 K HA 0.229 4.340 4.320 -0.348 0.000 0.270 100 K C -0.426 176.122 176.600 -0.087 0.000 1.005 100 K CA -0.204 55.894 56.287 -0.314 0.000 0.932 100 K CB 1.245 33.535 32.500 -0.350 0.000 1.021 100 K HN 0.542 8.578 8.250 -0.356 0.000 0.462 101 V N -4.816 115.081 119.914 -0.029 0.000 3.261 101 V HA 0.317 4.496 4.120 0.099 0.000 0.330 101 V C -2.048 174.079 176.094 0.054 0.000 1.461 101 V CA -1.410 60.927 62.300 0.062 0.000 1.127 101 V CB 0.806 32.679 31.823 0.083 0.000 1.044 101 V HN 0.247 8.409 8.190 -0.047 0.000 0.499 102 G N -1.151 107.596 108.800 -0.087 0.000 2.695 102 G HA2 0.434 4.083 3.960 -0.517 0.000 0.290 102 G HA3 0.434 4.440 3.960 -0.262 -0.204 0.290 102 G C -3.170 171.397 174.900 -0.556 0.000 1.410 102 G CA -1.755 43.127 45.100 -0.363 0.000 0.844 102 G HN -0.478 7.757 8.290 -0.091 0.000 0.478 103 P HA 0.032 4.182 4.420 -0.450 0.000 0.271 103 P C -1.332 175.834 177.300 -0.223 0.000 1.216 103 P CA -0.469 62.301 63.100 -0.550 0.000 0.776 103 P CB 0.750 32.156 31.700 -0.491 0.000 0.881 104 E N 3.342 123.477 120.200 -0.107 0.000 2.194 104 E HA -0.012 4.302 4.350 -0.060 0.000 0.284 104 E C -0.973 175.605 176.600 -0.037 0.000 1.035 104 E CA -0.176 56.190 56.400 -0.057 0.000 0.836 104 E CB 0.561 30.243 29.700 -0.030 0.000 1.070 104 E HN 0.316 8.631 8.360 -0.074 0.000 0.401 105 E N 2.229 122.411 120.200 -0.030 0.000 2.884 105 E HA 0.117 4.460 4.350 -0.012 0.000 0.221 105 E C -0.932 175.667 176.600 -0.001 0.000 1.137 105 E CA -0.768 55.622 56.400 -0.016 0.000 1.160 105 E CB -0.071 29.617 29.700 -0.020 0.000 1.385 105 E HN 0.355 8.697 8.360 -0.030 0.000 0.442 106 T N -1.211 113.346 114.554 0.005 0.000 3.732 106 T HA 0.250 4.588 4.350 -0.004 0.010 0.317 106 T C -1.687 173.019 174.700 0.009 0.000 0.896 106 T CA -1.267 60.835 62.100 0.004 0.000 0.976 106 T CB -0.276 68.597 68.868 0.009 0.000 1.195 106 T HN -0.412 7.834 8.240 0.009 0.000 0.594 110 Q N 2.756 122.590 119.800 0.055 0.000 2.124 110 Q HA -0.213 4.148 4.340 0.035 0.000 0.202 110 Q C 0.992 177.035 176.000 0.071 0.000 0.977 110 Q CA 2.439 58.281 55.803 0.064 0.000 0.850 110 Q CB -0.340 28.458 28.738 0.099 0.000 0.901 110 Q HN 0.711 9.046 8.270 0.108 0.000 0.429 111 Y N -5.535 114.799 120.300 0.057 0.000 2.439 111 Y HA -0.154 4.429 4.550 0.055 0.000 0.292 111 Y C 0.101 176.050 175.900 0.081 0.000 1.130 111 Y CA 0.253 58.391 58.100 0.063 0.000 1.254 111 Y CB -0.452 38.047 38.460 0.064 0.000 1.000 111 Y HN -0.312 8.132 8.280 0.306 0.020 0.554 112 L N -1.774 119.085 121.223 -0.608 0.000 2.805 112 L HA 0.115 4.306 4.340 -0.250 0.000 0.237 112 L C 0.825 177.622 176.870 -0.122 0.000 1.252 112 L CA -1.059 53.548 54.840 -0.388 0.000 1.064 112 L CB -1.131 40.624 42.059 -0.507 0.000 1.361 112 L HN -0.523 7.222 8.230 -0.771 0.023 0.474 113 R N 0.961 121.447 120.500 -0.024 0.000 2.120 113 R HA -0.275 4.066 4.340 0.000 0.000 0.234 113 R C 0.284 176.642 176.300 0.096 0.000 1.123 113 R CA 2.842 58.963 56.100 0.035 0.000 0.975 113 R CB -1.004 29.336 30.300 0.067 0.000 0.866 113 R HN -0.441 7.737 8.270 -0.003 0.090 0.446 114 F N -3.617 116.311 119.950 -0.037 0.000 2.714 114 F HA -0.030 4.479 4.527 -0.031 0.000 0.294 114 F C 0.369 176.152 175.800 -0.028 0.000 1.120 114 F CA -0.418 57.566 58.000 -0.027 0.000 1.398 114 F CB 0.500 39.493 39.000 -0.011 0.000 1.120 114 F HN -0.309 8.109 8.300 0.239 0.026 0.589 115 A N -1.695 121.109 122.820 -0.028 0.000 2.024 115 A HA -0.283 4.008 4.320 -0.050 0.000 0.220 115 A C -1.382 176.121 177.584 -0.135 0.000 1.164 115 A CA 2.188 54.184 52.037 -0.068 0.000 0.643 115 A CB 0.265 19.259 19.000 -0.011 0.000 0.806 115 A HN -0.533 7.635 8.150 0.030 0.000 0.451 116 S N -7.409 108.183 115.700 -0.179 0.000 2.618 116 S HA 0.808 5.325 4.470 -0.170 -0.149 0.277 116 S C -1.562 172.860 174.600 -0.297 0.000 1.138 116 S CA -1.611 56.471 58.200 -0.196 0.000 0.844 116 S CB 3.357 66.459 63.200 -0.162 0.000 1.127 116 S HN -0.920 7.239 8.310 -0.183 0.041 0.474 117 V N -6.702 112.989 119.914 -0.370 0.000 2.960 117 V HA 0.734 4.707 4.120 -0.445 -0.120 0.315 117 V C -1.926 173.955 176.094 -0.356 0.000 1.087 117 V CA -2.988 59.001 62.300 -0.519 0.000 0.982 117 V CB 3.030 34.212 31.823 -1.069 0.000 1.039 117 V HN 0.128 8.111 8.190 -0.345 0.000 0.437 118 S N 0.095 115.672 115.700 -0.205 0.000 2.532 118 S HA 0.510 5.089 4.470 -0.087 -0.162 0.299 118 S C -0.521 174.177 174.600 0.163 0.000 1.105 118 S CA -2.492 55.686 58.200 -0.036 0.000 1.018 118 S CB 2.409 65.600 63.200 -0.015 0.000 1.021 118 S HN 0.097 8.303 8.310 -0.173 0.000 0.483 119 L N 4.958 126.270 121.223 0.150 0.000 2.558 119 L HA 0.039 4.493 4.340 0.190 0.000 0.225 119 L C -0.710 176.177 176.870 0.029 0.000 1.128 119 L CA 0.215 55.138 54.840 0.139 0.000 0.868 119 L CB 0.333 42.465 42.059 0.122 0.000 1.006 119 L HN 0.294 8.580 8.230 0.094 0.000 0.454 120 Y N 1.120 121.387 120.300 -0.055 0.000 2.299 120 Y HA 0.132 4.621 4.550 -0.101 0.000 0.326 120 Y C -1.915 173.925 175.900 -0.099 0.000 1.164 120 Y CA -1.656 56.395 58.100 -0.081 0.000 1.234 120 Y CB 1.244 39.675 38.460 -0.048 0.000 1.219 120 Y HN -0.818 7.541 8.280 0.194 0.038 0.497 121 P HA -0.075 4.251 4.420 -0.156 0.000 0.264 121 P C -1.228 176.120 177.300 0.081 0.000 1.183 121 P CA 0.159 63.163 63.100 -0.160 0.000 0.763 121 P CB 0.301 31.856 31.700 -0.242 0.000 0.807 122 S N 3.240 119.009 115.700 0.115 0.000 2.569 122 S HA -0.259 4.284 4.470 0.121 0.000 0.274 122 S C 1.342 175.995 174.600 0.087 0.000 1.353 122 S CA -0.027 58.243 58.200 0.117 0.000 1.023 122 S CB 1.270 64.542 63.200 0.119 0.000 0.876 122 S HN 0.108 8.500 8.310 0.136 0.000 0.540 123 N N 3.014 121.759 118.700 0.076 0.000 2.104 123 N HA -0.352 4.418 4.740 0.050 0.000 0.190 123 N C 2.208 177.728 175.510 0.016 0.000 1.024 123 N CA 3.288 56.366 53.050 0.046 0.000 0.853 123 N CB -0.584 37.927 38.487 0.041 0.000 1.008 123 N HN 0.549 8.975 8.380 0.076 0.000 0.424 124 E N 0.031 120.251 120.200 0.034 0.000 2.085 124 E HA -0.409 3.953 4.350 0.021 0.000 0.194 124 E C 1.743 178.345 176.600 0.003 0.000 0.994 124 E CA 3.432 59.851 56.400 0.031 0.000 0.801 124 E CB -0.215 29.521 29.700 0.061 0.000 0.743 124 E HN 0.409 8.799 8.360 0.050 0.000 0.453 125 D N -0.273 120.139 120.400 0.020 0.000 2.117 125 D HA -0.214 4.443 4.640 0.029 0.000 0.198 125 D C 2.666 178.696 176.300 -0.451 0.000 0.982 125 D CA 3.240 57.202 54.000 -0.064 0.000 0.828 125 D CB -0.283 40.625 40.800 0.180 0.000 0.967 125 D HN -0.518 7.889 8.370 0.062 0.000 0.464 126 V N 0.212 119.932 119.914 -0.323 0.000 2.343 126 V HA -0.633 3.086 4.120 -0.668 0.000 0.247 126 V C 1.704 177.592 176.094 -0.344 0.000 1.051 126 V CA 4.633 66.680 62.300 -0.422 0.000 1.036 126 V CB -0.221 31.475 31.823 -0.210 0.000 0.654 126 V HN -0.457 7.625 8.190 -0.179 0.000 0.451 127 S N 0.780 116.372 115.700 -0.181 0.000 2.370 127 S HA -0.372 4.058 4.470 -0.066 0.000 0.226 127 S C 2.259 176.776 174.600 -0.137 0.000 1.033 127 S CA 3.903 62.044 58.200 -0.099 0.000 1.011 127 S CB -0.131 63.054 63.200 -0.025 0.000 0.852 127 S HN -0.508 7.722 8.310 -0.133 0.000 0.457 128 L N 0.242 121.353 121.223 -0.187 0.000 2.093 128 L HA -0.324 3.996 4.340 -0.033 0.000 0.208 128 L C 1.703 178.359 176.870 -0.356 0.000 1.085 128 L CA 2.953 57.712 54.840 -0.135 0.000 0.755 128 L CB -0.312 41.783 42.059 0.060 0.000 0.904 128 L HN -0.221 7.818 8.230 -0.188 0.077 0.435 129 A N -0.676 121.610 122.820 -0.891 0.000 1.898 129 A HA -0.290 3.190 4.320 -1.400 0.000 0.216 129 A C 2.092 179.485 177.584 -0.318 0.000 1.181 129 A CA 3.207 54.569 52.037 -1.125 0.000 0.620 129 A CB -0.869 17.141 19.000 -1.649 0.000 0.819 129 A HN -0.069 7.498 8.150 -0.973 0.000 0.442 130 V N -1.726 118.077 119.914 -0.185 0.000 2.407 130 V HA -0.567 3.628 4.120 0.125 0.000 0.248 130 V C 2.115 178.196 176.094 -0.022 0.000 1.055 130 V CA 4.223 66.534 62.300 0.018 0.000 1.049 130 V CB -0.259 31.590 31.823 0.044 0.000 0.662 130 V HN -0.099 7.923 8.190 -0.279 0.000 0.455 131 S N -0.040 115.645 115.700 -0.024 0.000 2.402 131 S HA -0.252 4.260 4.470 0.071 0.000 0.229 131 S C 1.849 176.466 174.600 0.027 0.000 1.021 131 S CA 3.399 61.622 58.200 0.038 0.000 0.974 131 S CB -0.592 62.641 63.200 0.054 0.000 0.800 131 S HN -0.263 7.930 8.310 -0.061 0.081 0.484 132 R N 2.412 122.912 120.500 0.000 0.000 2.081 132 R HA -0.245 4.123 4.340 0.047 0.000 0.235 132 R C 2.157 178.385 176.300 -0.120 0.000 1.131 132 R CA 2.346 58.457 56.100 0.018 0.000 0.960 132 R CB -0.928 29.462 30.300 0.150 0.000 0.856 132 R HN -0.390 7.776 8.270 -0.030 0.086 0.436 133 I N -0.810 119.646 120.570 -0.189 0.000 2.252 133 I HA -0.482 3.428 4.170 -0.434 0.000 0.245 133 I C 1.738 177.421 176.117 -0.723 0.000 1.102 133 I CA 3.817 64.846 61.300 -0.451 0.000 1.385 133 I CB -0.009 37.723 38.000 -0.448 0.000 1.064 133 I HN -0.762 7.287 8.210 -0.129 0.084 0.414 134 L N -2.148 118.828 121.223 -0.412 0.000 2.127 134 L HA -0.494 3.659 4.340 -0.312 0.000 0.211 134 L C 2.012 178.658 176.870 -0.372 0.000 1.089 134 L CA 3.204 57.886 54.840 -0.263 0.000 0.757 134 L CB -0.829 41.266 42.059 0.059 0.000 0.899 134 L HN -0.134 7.949 8.230 -0.244 0.000 0.434 135 K N -0.473 119.628 120.400 -0.499 0.000 2.097 135 K HA -0.349 2.776 4.320 -1.992 0.000 0.206 135 K C 2.427 178.706 176.600 -0.535 0.000 1.049 135 K CA 3.767 59.485 56.287 -0.948 0.000 0.933 135 K CB -0.352 31.846 32.500 -0.502 0.000 0.717 135 K HN -0.010 7.944 8.250 -0.320 0.104 0.442 136 S N -1.204 114.289 115.700 -0.345 0.000 2.474 136 S HA -0.085 4.311 4.470 -0.123 0.000 0.235 136 S C 0.643 175.283 174.600 0.067 0.000 0.997 136 S CA 2.299 60.403 58.200 -0.160 0.000 0.949 136 S CB -0.885 62.222 63.200 -0.154 0.000 0.766 136 S HN -0.464 7.528 8.310 -0.379 0.090 0.517 137 F N -0.322 119.523 119.950 -0.175 0.000 2.693 137 F HA 0.187 4.649 4.527 -0.109 0.000 0.303 137 F C -0.788 174.930 175.800 -0.137 0.000 1.097 137 F CA -1.604 56.318 58.000 -0.130 0.000 1.330 137 F CB -0.705 38.238 39.000 -0.096 0.000 1.067 137 F HN -0.834 7.198 8.300 -0.154 0.175 0.565 138 N N -3.582 115.085 118.700 -0.056 0.000 2.754 138 N HA -0.380 4.247 4.740 -0.187 0.000 0.248 138 N C -1.219 174.306 175.510 0.026 0.000 1.093 138 N CA 1.628 54.627 53.050 -0.084 0.000 0.699 138 N CB -1.142 37.350 38.487 0.009 0.000 1.016 138 N HN -0.506 7.607 8.380 -0.149 0.177 0.552 139 Y N -6.583 113.757 120.300 0.066 0.000 3.001 139 Y HA -0.354 4.262 4.550 0.021 -0.054 0.187 139 Y C -2.327 173.611 175.900 0.063 0.000 1.462 139 Y CA -0.281 57.836 58.100 0.028 0.000 0.936 139 Y CB -2.522 35.918 38.460 -0.034 0.000 1.337 139 Y HN -0.043 8.057 8.280 -0.300 0.000 0.428 140 P HA 0.094 4.605 4.420 0.153 0.000 0.279 140 P C -0.832 176.627 177.300 0.265 0.000 1.276 140 P CA -0.711 62.504 63.100 0.191 0.000 0.801 140 P CB 1.049 32.830 31.700 0.135 0.000 1.127 141 S N -0.555 115.271 115.700 0.210 0.000 2.589 141 S HA 0.112 4.914 4.470 0.380 -0.104 0.265 141 S C -0.784 173.907 174.600 0.151 0.000 1.342 141 S CA 1.208 59.547 58.200 0.232 0.000 1.005 141 S CB 0.873 64.156 63.200 0.137 0.000 0.909 141 S HN 0.211 8.613 8.310 0.153 0.000 0.555 142 A N -0.529 122.319 122.820 0.047 0.000 2.602 142 A HA 0.423 4.852 4.320 0.003 -0.107 0.290 142 A C -1.839 175.681 177.584 -0.106 0.000 1.114 142 A CA -0.721 51.300 52.037 -0.026 0.000 0.683 142 A CB 3.333 22.333 19.000 -0.000 0.000 1.281 142 A HN 0.177 8.321 8.150 -0.010 0.000 0.416 143 S N -1.849 113.806 115.700 -0.074 0.000 2.532 143 S HA 0.794 5.367 4.470 -0.096 -0.161 0.301 143 S C -1.677 172.881 174.600 -0.070 0.000 1.083 143 S CA -1.516 56.642 58.200 -0.071 0.000 1.025 143 S CB 3.208 66.397 63.200 -0.019 0.000 1.056 143 S HN 0.171 8.451 8.310 -0.050 0.000 0.494 144 L N 4.574 125.754 121.223 -0.071 0.000 2.356 144 L HA 0.721 5.230 4.340 -0.019 -0.180 0.277 144 L C -2.396 174.471 176.870 -0.006 0.000 0.996 144 L CA -1.142 53.674 54.840 -0.040 0.000 0.822 144 L CB 3.633 45.650 42.059 -0.071 0.000 1.256 144 L HN 0.569 8.752 8.230 -0.078 0.000 0.413 145 I N 6.403 126.988 120.570 0.026 0.000 2.339 145 I HA 0.536 4.904 4.170 0.025 -0.182 0.290 145 I C -1.287 174.852 176.117 0.038 0.000 0.994 145 I CA -1.346 59.975 61.300 0.036 0.000 1.191 145 I CB 1.491 39.525 38.000 0.057 0.000 1.343 145 I HN 0.595 8.828 8.210 0.039 0.000 0.458 146 c N 6.316 124.933 118.600 0.029 0.000 2.411 146 c HA 0.731 5.486 4.570 0.037 -0.163 0.330 146 c C 0.781 174.890 174.090 0.031 0.000 1.224 146 c CA -1.403 54.944 56.329 0.031 0.000 1.770 146 c CB 2.043 44.566 42.510 0.022 0.000 2.297 146 c HN 0.489 8.733 8.230 0.024 0.000 0.507 147 A N 2.824 125.666 122.820 0.035 0.000 1.902 147 A HA -0.236 4.104 4.320 0.033 0.000 0.217 147 A C -1.634 175.965 177.584 0.026 0.000 1.181 147 A CA 3.131 55.187 52.037 0.033 0.000 0.623 147 A CB 0.189 19.211 19.000 0.037 0.000 0.818 147 A HN 0.331 8.504 8.150 0.039 0.000 0.443 148 K N -8.033 112.381 120.400 0.024 0.000 2.533 148 K HA 0.666 5.275 4.320 0.018 -0.278 0.272 148 K C -0.215 176.395 176.600 0.017 0.000 0.985 148 K CA -2.289 54.010 56.287 0.019 0.000 0.876 148 K CB 2.874 35.384 32.500 0.017 0.000 1.452 148 K HN -0.778 7.487 8.250 0.025 0.000 0.439 149 A N 0.037 122.866 122.820 0.015 0.000 2.172 149 A HA -0.119 4.209 4.320 0.013 0.000 0.216 149 A C 1.213 178.806 177.584 0.015 0.000 1.154 149 A CA 2.289 54.334 52.037 0.014 0.000 0.701 149 A CB -0.269 18.738 19.000 0.012 0.000 0.789 149 A HN 0.875 9.033 8.150 0.014 0.000 0.465 150 E N -2.448 117.761 120.200 0.015 0.000 2.409 150 E HA -0.240 4.118 4.350 0.014 0.000 0.198 150 E C 1.153 177.763 176.600 0.016 0.000 1.024 150 E CA 2.480 58.889 56.400 0.014 0.000 0.861 150 E CB -0.899 28.808 29.700 0.011 0.000 0.788 150 E HN -0.021 8.302 8.360 0.014 0.046 0.521 151 c N -1.497 117.114 118.600 0.018 0.000 2.410 151 c HA -0.160 4.425 4.570 0.024 0.000 0.281 151 c C 1.694 175.797 174.090 0.022 0.000 1.318 151 c CA 1.922 58.264 56.329 0.022 0.000 1.776 151 c CB -1.591 40.933 42.510 0.024 0.000 1.942 151 c HN -0.270 7.923 8.230 0.018 0.048 0.508 152 L N -0.349 120.886 121.223 0.019 0.000 2.201 152 L HA -0.311 4.043 4.340 0.022 0.000 0.212 152 L C 1.642 178.527 176.870 0.025 0.000 1.105 152 L CA 2.352 57.205 54.840 0.021 0.000 0.775 152 L CB -0.424 41.646 42.059 0.019 0.000 0.913 152 L HN -0.539 7.675 8.230 0.017 0.026 0.440 153 L N -2.941 118.295 121.223 0.022 0.000 2.068 153 L HA -0.310 4.045 4.340 0.025 0.000 0.204 153 L C 2.929 179.813 176.870 0.024 0.000 1.076 153 L CA 2.592 57.446 54.840 0.023 0.000 0.753 153 L CB -0.473 41.598 42.059 0.019 0.000 0.910 153 L HN -0.634 7.481 8.230 0.020 0.127 0.439 154 R N -1.969 118.545 120.500 0.023 0.000 2.092 154 R HA -0.228 4.126 4.340 0.024 0.000 0.231 154 R C 1.667 177.983 176.300 0.028 0.000 1.119 154 R CA 2.924 59.039 56.100 0.025 0.000 0.970 154 R CB 0.418 30.733 30.300 0.024 0.000 0.864 154 R HN -0.734 7.549 8.270 0.021 0.000 0.440 155 L N -2.511 118.731 121.223 0.031 0.000 2.783 155 L HA 0.377 4.735 4.340 0.030 0.000 0.236 155 L C 0.102 176.999 176.870 0.045 0.000 1.225 155 L CA -0.962 53.900 54.840 0.036 0.000 1.026 155 L CB -1.083 41.001 42.059 0.041 0.000 1.314 155 L HN -0.178 8.070 8.230 0.030 0.000 0.489 156 E N 2.357 122.580 120.200 0.038 0.000 2.097 156 E HA -0.450 4.034 4.350 0.043 -0.108 0.196 156 E C 1.689 178.317 176.600 0.048 0.000 1.000 156 E CA 4.119 60.544 56.400 0.041 0.000 0.804 156 E CB -0.058 29.663 29.700 0.034 0.000 0.740 156 E HN -0.612 7.685 8.360 0.034 0.083 0.454 157 E N -1.057 119.169 120.200 0.042 0.000 2.106 157 E HA -0.256 4.116 4.350 0.036 0.000 0.192 157 E C 2.489 179.122 176.600 0.055 0.000 0.984 157 E CA 2.727 59.151 56.400 0.039 0.000 0.806 157 E CB -0.546 29.172 29.700 0.029 0.000 0.750 157 E HN -0.030 8.345 8.360 0.037 0.007 0.458 158 L N -0.073 121.196 121.223 0.077 0.000 2.046 158 L HA -0.257 4.156 4.340 0.122 0.000 0.208 158 L C 1.781 178.792 176.870 0.235 0.000 1.077 158 L CA 2.805 57.733 54.840 0.146 0.000 0.747 158 L CB -0.196 41.959 42.059 0.161 0.000 0.896 158 L HN -0.798 7.472 8.230 0.066 0.000 0.432 159 V N -0.794 119.220 119.914 0.167 0.000 2.343 159 V HA -0.661 3.585 4.120 0.209 0.000 0.247 159 V C 2.049 178.232 176.094 0.148 0.000 1.051 159 V CA 4.612 67.010 62.300 0.162 0.000 1.036 159 V CB -0.368 31.506 31.823 0.085 0.000 0.654 159 V HN -0.136 8.126 8.190 0.119 0.000 0.451 160 R N -1.374 119.182 120.500 0.093 0.000 2.096 160 R HA -0.337 4.038 4.340 0.059 0.000 0.235 160 R C 2.720 179.045 176.300 0.042 0.000 1.127 160 R CA 3.532 59.667 56.100 0.059 0.000 0.968 160 R CB -0.417 29.905 30.300 0.036 0.000 0.861 160 R HN -0.103 8.215 8.270 0.081 0.000 0.440 161 G N -1.518 107.298 108.800 0.026 0.000 2.418 161 G HA2 -0.251 3.657 3.960 -0.087 0.000 0.217 161 G HA3 -0.251 3.636 3.960 -0.122 0.000 0.217 161 G C 1.228 176.063 174.900 -0.110 0.000 1.158 161 G CA 1.738 46.793 45.100 -0.076 0.000 0.771 161 G HN -0.529 7.789 8.290 0.047 0.000 0.545 162 F N 0.493 120.440 119.950 -0.006 0.000 2.325 162 F HA -0.156 4.369 4.527 -0.004 0.000 0.299 162 F C 1.409 177.209 175.800 -0.001 0.000 1.090 162 F CA 3.351 61.350 58.000 0.000 0.000 1.392 162 F CB 0.092 39.100 39.000 0.013 0.000 1.053 162 F HN -0.738 7.715 8.300 0.256 0.000 0.521 163 L N -3.208 118.110 121.223 0.159 0.000 2.275 163 L HA -0.312 4.091 4.340 0.105 0.000 0.215 163 L C 1.053 177.954 176.870 0.051 0.000 1.119 163 L CA 1.913 56.810 54.840 0.094 0.000 0.790 163 L CB 0.018 42.119 42.059 0.069 0.000 0.919 163 L HN -0.275 7.927 8.230 0.150 0.118 0.443 164 I N -3.897 116.685 120.570 0.021 0.000 3.854 164 I HA 0.009 4.179 4.170 0.001 0.000 0.312 164 I C 0.483 176.582 176.117 -0.030 0.000 1.273 164 I CA -0.472 60.823 61.300 -0.009 0.000 1.298 164 I CB 0.241 38.224 38.000 -0.029 0.000 1.071 164 I HN -0.708 7.473 8.210 0.013 0.038 0.428 165 S N 1.073 116.745 115.700 -0.046 0.000 2.681 165 S HA 0.151 4.565 4.470 -0.093 0.000 0.270 165 S C 0.480 175.070 174.600 -0.018 0.000 1.209 165 S CA -1.036 57.116 58.200 -0.081 0.000 0.988 165 S CB 1.008 64.092 63.200 -0.192 0.000 1.006 165 S HN -0.652 7.638 8.310 -0.034 0.000 0.558 166 K N 0.246 120.634 120.400 -0.020 0.000 2.217 166 K HA -0.043 4.290 4.320 0.021 0.000 0.202 166 K C 0.440 177.074 176.600 0.057 0.000 1.051 166 K CA 0.898 57.195 56.287 0.017 0.000 0.952 166 K CB 0.036 32.542 32.500 0.010 0.000 0.736 166 K HN 0.225 8.448 8.250 -0.044 0.000 0.453 167 E N -0.189 120.053 120.200 0.071 0.000 2.383 167 E HA 0.038 4.473 4.350 0.142 0.000 0.264 167 E C -0.256 176.511 176.600 0.279 0.000 1.050 167 E CA -0.323 56.177 56.400 0.166 0.000 0.896 167 E CB 0.491 30.308 29.700 0.194 0.000 0.982 167 E HN -0.650 7.702 8.360 0.024 0.022 0.424 168 T N -2.985 111.712 114.554 0.239 0.000 2.944 168 T HA 0.243 4.706 4.350 0.188 0.000 0.284 168 T C -1.160 173.567 174.700 0.046 0.000 1.010 168 T CA -1.418 60.782 62.100 0.167 0.000 1.025 168 T CB 1.870 70.784 68.868 0.077 0.000 1.079 168 T HN 0.073 8.429 8.240 0.194 0.000 0.516 169 L N 2.719 123.860 121.223 -0.136 0.000 2.446 169 L HA 0.640 4.948 4.340 -0.437 -0.230 0.268 169 L C -1.310 175.441 176.870 -0.198 0.000 0.975 169 L CA -0.767 53.825 54.840 -0.413 0.000 0.848 169 L CB 2.291 43.808 42.059 -0.903 0.000 1.225 169 L HN 0.177 8.371 8.230 -0.059 0.000 0.410 170 S N 6.867 122.485 115.700 -0.136 0.000 2.430 170 S HA 0.297 4.733 4.470 -0.056 0.000 0.289 170 S C -1.161 173.396 174.600 -0.071 0.000 1.143 170 S CA -1.054 57.103 58.200 -0.071 0.000 1.067 170 S CB 0.302 63.483 63.200 -0.033 0.000 0.964 170 S HN 0.230 8.458 8.310 -0.136 0.000 0.485 171 V N 7.862 127.743 119.914 -0.054 0.000 2.398 171 V HA 0.427 4.695 4.120 -0.048 -0.177 0.286 171 V C -0.418 175.667 176.094 -0.016 0.000 1.026 171 V CA -0.939 61.336 62.300 -0.041 0.000 0.868 171 V CB 1.240 33.039 31.823 -0.039 0.000 0.982 171 V HN 0.499 8.662 8.190 -0.045 0.000 0.443 172 R N 7.378 127.874 120.500 -0.007 0.000 2.628 172 R HA 0.363 4.706 4.340 0.004 0.000 0.288 172 R C -1.771 174.535 176.300 0.010 0.000 0.980 172 R CA -1.541 54.562 56.100 0.004 0.000 0.891 172 R CB 3.532 33.837 30.300 0.009 0.000 1.188 172 R HN 0.552 8.817 8.270 -0.007 0.000 0.450 173 M N 2.934 122.541 119.600 0.011 0.000 2.300 173 M HA 0.288 4.948 4.480 0.016 -0.170 0.348 173 M C 0.322 176.632 176.300 0.017 0.000 1.151 173 M CA -1.347 53.962 55.300 0.015 0.000 1.046 173 M CB 1.248 33.855 32.600 0.013 0.000 1.647 173 M HN 0.397 8.693 8.290 0.010 0.000 0.451 174 L N 3.175 124.410 121.223 0.020 0.000 2.044 174 L HA -0.110 4.241 4.340 0.019 0.000 0.205 174 L C 0.536 177.416 176.870 0.018 0.000 1.075 174 L CA 1.710 56.562 54.840 0.020 0.000 0.747 174 L CB 0.141 42.214 42.059 0.024 0.000 0.903 174 L HN 0.352 8.595 8.230 0.022 0.000 0.435 178 R N 0.938 121.447 120.500 0.016 0.000 2.596 178 R HA 0.254 4.606 4.340 0.021 0.000 0.369 178 R C -1.558 174.753 176.300 0.018 0.000 1.042 178 R CA 0.440 56.551 56.100 0.019 0.000 1.120 178 R CB 0.271 30.582 30.300 0.018 0.000 1.353 178 R HN 0.163 8.441 8.270 0.014 0.000 0.564 179 D N -1.122 119.287 120.400 0.016 0.000 2.542 179 D HA 0.285 4.934 4.640 0.014 0.000 0.252 179 D C -1.458 174.850 176.300 0.013 0.000 1.222 179 D CA -2.469 51.539 54.000 0.013 0.000 0.895 179 D CB 2.366 43.173 40.800 0.011 0.000 1.207 179 D HN -0.503 7.876 8.370 0.015 0.000 0.558 180 P HA 0.089 4.519 4.420 0.015 0.000 0.233 180 P C 0.526 177.832 177.300 0.009 0.000 1.167 180 P CA 0.340 63.447 63.100 0.012 0.000 0.770 180 P CB 0.788 32.495 31.700 0.011 0.000 0.837 181 T N 0.721 115.277 114.554 0.005 0.000 2.624 181 T HA -0.381 3.968 4.350 -0.003 0.000 0.268 181 T C -0.205 174.498 174.700 0.005 0.000 1.041 181 T CA 7.070 69.171 62.100 0.002 0.000 1.159 181 T CB -1.831 67.037 68.868 0.001 0.000 0.863 181 T HN -0.440 7.915 8.240 0.005 -0.112 0.434 182 P HA -0.131 4.295 4.420 0.009 0.000 0.217 182 P C 0.824 178.131 177.300 0.013 0.000 1.150 182 P CA 2.629 65.735 63.100 0.010 0.000 0.832 182 P CB -0.417 31.289 31.700 0.010 0.000 0.787 183 L N -2.123 119.108 121.223 0.014 0.000 2.056 183 L HA -0.296 4.054 4.340 0.017 0.000 0.207 183 L C 1.550 178.433 176.870 0.021 0.000 1.078 183 L CA 3.014 57.864 54.840 0.017 0.000 0.749 183 L CB -0.115 41.955 42.059 0.019 0.000 0.901 183 L HN -0.665 7.560 8.230 0.013 0.012 0.433 184 L N -2.111 119.123 121.223 0.018 0.000 2.083 184 L HA -0.500 3.854 4.340 0.024 0.000 0.209 184 L C 2.097 178.977 176.870 0.016 0.000 1.083 184 L CA 3.247 58.097 54.840 0.016 0.000 0.752 184 L CB -0.542 41.518 42.059 0.001 0.000 0.899 184 L HN -0.283 7.956 8.230 0.014 0.000 0.433 185 K N -1.142 119.267 120.400 0.015 0.000 2.097 185 K HA -0.385 3.947 4.320 0.020 0.000 0.206 185 K C 2.515 179.133 176.600 0.029 0.000 1.049 185 K CA 3.956 60.255 56.287 0.020 0.000 0.933 185 K CB -0.389 32.120 32.500 0.014 0.000 0.717 185 K HN -0.341 7.916 8.250 0.012 0.000 0.442 186 E N -0.992 119.224 120.200 0.027 0.000 2.072 186 E HA -0.265 4.102 4.350 0.028 0.000 0.191 186 E C 2.540 179.165 176.600 0.043 0.000 0.985 186 E CA 2.722 59.140 56.400 0.030 0.000 0.801 186 E CB -0.078 29.636 29.700 0.023 0.000 0.750 186 E HN -0.817 7.557 8.360 0.024 0.000 0.452 187 I N -0.583 120.016 120.570 0.049 0.000 2.163 187 I HA -0.476 3.733 4.170 0.066 0.000 0.243 187 I C 1.823 178.012 176.117 0.120 0.000 1.085 187 I CA 3.898 65.242 61.300 0.073 0.000 1.347 187 I CB -0.176 37.863 38.000 0.066 0.000 1.044 187 I HN -0.640 7.595 8.210 0.041 0.000 0.408 188 R N -0.629 119.941 120.500 0.115 0.000 2.091 188 R HA -0.404 4.107 4.340 0.285 0.000 0.238 188 R C 2.694 179.062 176.300 0.113 0.000 1.136 188 R CA 3.474 59.673 56.100 0.166 0.000 0.959 188 R CB -0.235 30.132 30.300 0.112 0.000 0.856 188 R HN -0.275 8.043 8.270 0.080 0.000 0.437 189 D N -0.821 119.620 120.400 0.068 0.000 2.178 189 D HA -0.175 4.485 4.640 0.032 0.000 0.201 189 D C 1.190 177.518 176.300 0.046 0.000 0.980 189 D CA 2.801 56.827 54.000 0.043 0.000 0.842 189 D CB -0.679 40.139 40.800 0.031 0.000 0.948 189 D HN -0.389 8.017 8.370 0.061 0.000 0.472 190 D N -3.382 117.056 120.400 0.064 0.000 2.312 190 D HA -0.050 4.618 4.640 0.046 0.000 0.211 190 D C -0.775 175.572 176.300 0.078 0.000 0.964 190 D CA 0.438 54.475 54.000 0.062 0.000 0.877 190 D CB 0.302 41.139 40.800 0.060 0.000 0.924 190 D HN -0.644 7.642 8.370 0.073 0.128 0.515 191 K N -4.481 115.984 120.400 0.107 0.000 3.117 191 K HA -0.459 3.931 4.320 0.117 0.000 0.269 191 K C -1.264 175.469 176.600 0.221 0.000 1.098 191 K CA 0.833 57.195 56.287 0.125 0.000 0.785 191 K CB -2.790 29.733 32.500 0.038 0.000 1.242 191 K HN -0.520 7.663 8.250 0.120 0.138 0.491 192 V N -1.143 118.892 119.914 0.202 0.000 2.427 192 V HA 0.097 4.273 4.120 0.093 0.000 0.286 192 V C -0.526 175.591 176.094 0.039 0.000 1.034 192 V CA -0.912 61.455 62.300 0.112 0.000 0.893 192 V CB 0.932 32.792 31.823 0.062 0.000 0.982 192 V HN -0.653 7.637 8.190 0.196 0.018 0.452 193 S N 5.752 121.298 115.700 -0.256 0.000 2.371 193 S HA -0.107 3.770 4.470 -0.988 0.000 0.224 193 S C 0.228 174.613 174.600 -0.358 0.000 1.029 193 S CA 1.418 59.200 58.200 -0.697 0.000 0.978 193 S CB 0.447 63.020 63.200 -1.045 0.000 0.833 193 S HN 0.421 8.590 8.310 -0.236 0.000 0.466 194 T N 4.745 119.173 114.554 -0.210 0.000 2.771 194 T HA 0.382 4.814 4.350 -0.185 -0.193 0.291 194 T C -1.514 173.131 174.700 -0.093 0.000 0.954 194 T CA 1.316 63.341 62.100 -0.126 0.000 1.045 194 T CB 0.598 69.484 68.868 0.030 0.000 0.917 194 T HN -0.380 7.765 8.240 -0.159 0.000 0.484 195 I N 7.689 128.164 120.570 -0.159 0.000 2.439 195 I HA 0.430 4.731 4.170 -0.058 -0.166 0.285 195 I C -1.602 174.522 176.117 0.013 0.000 1.021 195 I CA -1.032 60.199 61.300 -0.115 0.000 1.091 195 I CB 2.749 40.593 38.000 -0.260 0.000 1.242 195 I HN 0.755 8.833 8.210 -0.221 0.000 0.439 196 I N 7.354 127.950 120.570 0.044 0.000 2.331 196 I HA 0.417 4.838 4.170 0.102 -0.190 0.292 196 I C -1.031 175.145 176.117 0.097 0.000 0.998 196 I CA -0.812 60.535 61.300 0.079 0.000 1.267 196 I CB 1.683 39.713 38.000 0.051 0.000 1.386 196 I HN 0.673 8.893 8.210 0.017 0.000 0.476 197 I N 7.450 128.098 120.570 0.129 0.000 2.355 197 I HA 0.318 4.696 4.170 0.103 -0.146 0.288 197 I C -2.065 174.114 176.117 0.103 0.000 0.999 197 I CA -0.956 60.416 61.300 0.120 0.000 1.163 197 I CB 1.909 39.995 38.000 0.143 0.000 1.316 197 I HN 0.543 8.837 8.210 0.141 0.000 0.454 198 D N 7.789 128.238 120.400 0.082 0.000 2.472 198 D HA 0.565 5.261 4.640 0.094 0.000 0.234 198 D C -1.987 174.357 176.300 0.073 0.000 1.088 198 D CA -1.962 52.085 54.000 0.079 0.000 0.882 198 D CB 1.947 42.784 40.800 0.062 0.000 1.037 198 D HN 0.190 8.603 8.370 0.072 0.000 0.520 199 A N 3.261 126.132 122.820 0.085 0.000 2.564 199 A HA 0.205 4.564 4.320 0.064 0.000 0.291 199 A C -2.885 174.753 177.584 0.089 0.000 1.102 199 A CA -0.584 51.498 52.037 0.075 0.000 0.660 199 A CB 3.104 22.146 19.000 0.069 0.000 1.283 199 A HN -0.449 7.760 8.150 0.100 0.000 0.430 200 N N -1.476 117.271 118.700 0.078 0.000 2.294 200 N HA -0.100 4.699 4.740 0.099 0.000 0.248 200 N C 1.446 177.012 175.510 0.093 0.000 1.300 200 N CA -0.690 52.412 53.050 0.087 0.000 0.925 200 N CB 0.372 38.902 38.487 0.072 0.000 1.188 200 N HN -0.125 8.295 8.380 0.067 0.000 0.512 201 A N -1.454 121.421 122.820 0.093 0.000 1.908 201 A HA -0.309 4.064 4.320 0.089 0.000 0.218 201 A C 1.756 179.388 177.584 0.080 0.000 1.181 201 A CA 3.384 55.470 52.037 0.081 0.000 0.627 201 A CB -0.629 18.409 19.000 0.063 0.000 0.818 201 A HN 0.721 8.927 8.150 0.094 0.000 0.445 202 S N -1.704 114.039 115.700 0.070 0.000 2.395 202 S HA -0.193 4.308 4.470 0.052 0.000 0.225 202 S C 1.900 176.558 174.600 0.096 0.000 1.027 202 S CA 2.793 61.033 58.200 0.066 0.000 0.965 202 S CB -0.681 62.546 63.200 0.045 0.000 0.812 202 S HN -0.653 7.791 8.310 0.068 -0.093 0.482 203 I N 2.622 123.240 120.570 0.080 0.000 2.353 203 I HA -0.242 3.970 4.170 0.071 0.000 0.248 203 I C 1.893 178.055 176.117 0.075 0.000 1.119 203 I CA 1.634 62.978 61.300 0.073 0.000 1.417 203 I CB -1.399 36.636 38.000 0.059 0.000 1.078 203 I HN -0.210 8.330 8.210 0.074 -0.286 0.421 204 S N 0.374 116.124 115.700 0.084 0.000 2.370 204 S HA -0.339 4.166 4.470 0.060 0.000 0.226 204 S C 2.173 176.801 174.600 0.045 0.000 1.033 204 S CA 3.835 62.077 58.200 0.071 0.000 1.011 204 S CB -0.664 62.593 63.200 0.096 0.000 0.852 204 S HN 0.034 8.397 8.310 0.089 0.000 0.457 205 H N 2.909 121.968 119.070 -0.019 0.000 2.353 205 H HA -0.243 4.273 4.556 -0.065 0.000 0.300 205 H C 2.015 177.321 175.328 -0.036 0.000 1.090 205 H CA 3.638 59.661 56.048 -0.042 0.000 1.327 205 H CB 0.280 30.022 29.762 -0.033 0.000 1.383 205 H HN -0.584 7.808 8.280 0.187 0.000 0.508 206 L N -0.716 120.579 121.223 0.120 0.000 2.046 206 L HA -0.335 4.057 4.340 0.086 0.000 0.208 206 L C 1.490 178.345 176.870 -0.025 0.000 1.077 206 L CA 3.095 57.972 54.840 0.061 0.000 0.747 206 L CB -0.410 41.694 42.059 0.075 0.000 0.896 206 L HN -0.451 7.798 8.230 0.161 0.077 0.432 207 V N -1.031 118.868 119.914 -0.025 0.000 2.343 207 V HA -0.597 3.510 4.120 -0.023 0.000 0.247 207 V C 1.961 177.987 176.094 -0.113 0.000 1.051 207 V CA 4.677 66.953 62.300 -0.040 0.000 1.036 207 V CB -0.200 31.621 31.823 -0.003 0.000 0.654 207 V HN -0.257 7.931 8.190 -0.002 0.000 0.451 208 L N -1.861 119.247 121.223 -0.193 0.000 2.093 208 L HA -0.365 3.756 4.340 -0.365 0.000 0.208 208 L C 1.991 178.697 176.870 -0.274 0.000 1.085 208 L CA 2.999 57.653 54.840 -0.309 0.000 0.755 208 L CB -0.626 41.217 42.059 -0.360 0.000 0.904 208 L HN -0.591 7.533 8.230 -0.177 0.000 0.435 209 R N -0.524 119.809 120.500 -0.277 0.000 2.081 209 R HA -0.385 3.818 4.340 -0.229 0.000 0.235 209 R C 2.330 178.557 176.300 -0.121 0.000 1.131 209 R CA 3.644 59.615 56.100 -0.215 0.000 0.960 209 R CB -0.218 29.971 30.300 -0.186 0.000 0.856 209 R HN -0.096 7.992 8.270 -0.303 0.000 0.436 210 K N -2.478 117.867 120.400 -0.093 0.000 2.155 210 K HA -0.109 4.184 4.320 -0.046 0.000 0.203 210 K C 2.248 178.809 176.600 -0.065 0.000 1.052 210 K CA 1.761 58.014 56.287 -0.058 0.000 0.948 210 K CB -0.460 32.020 32.500 -0.034 0.000 0.728 210 K HN -0.596 7.597 8.250 -0.095 0.000 0.448 211 A N -0.021 122.744 122.820 -0.092 0.000 1.902 211 A HA -0.239 4.037 4.320 -0.073 0.000 0.217 211 A C 1.636 179.162 177.584 -0.096 0.000 1.181 211 A CA 2.997 54.978 52.037 -0.094 0.000 0.623 211 A CB -0.953 17.979 19.000 -0.114 0.000 0.818 211 A HN -0.089 7.995 8.150 -0.111 0.000 0.443 212 S N -0.714 114.920 115.700 -0.111 0.000 2.359 212 S HA -0.329 4.098 4.470 -0.071 0.000 0.224 212 S C 2.759 177.331 174.600 -0.048 0.000 1.035 212 S CA 2.979 61.130 58.200 -0.082 0.000 1.018 212 S CB -0.139 63.002 63.200 -0.098 0.000 0.876 212 S HN -0.214 8.015 8.310 -0.136 0.000 0.448 213 E N -0.596 119.576 120.200 -0.047 0.000 2.204 213 E HA -0.171 4.166 4.350 -0.022 0.000 0.195 213 E C 0.979 177.567 176.600 -0.019 0.000 0.990 213 E CA 2.033 58.416 56.400 -0.027 0.000 0.821 213 E CB -0.048 29.638 29.700 -0.024 0.000 0.750 213 E HN -0.577 7.749 8.360 -0.056 0.000 0.477 214 L N -2.871 118.336 121.223 -0.027 0.000 2.611 214 L HA 0.105 4.439 4.340 -0.010 0.000 0.229 214 L C -0.131 176.734 176.870 -0.009 0.000 1.137 214 L CA -0.552 54.276 54.840 -0.019 0.000 0.901 214 L CB 0.280 42.322 42.059 -0.028 0.000 1.098 214 L HN -0.761 7.315 8.230 -0.039 0.131 0.456 215 G N -1.979 106.818 108.800 -0.004 0.000 2.160 215 G HA2 -0.416 3.562 3.960 0.031 0.000 0.251 215 G HA3 -0.416 3.569 3.960 0.043 0.000 0.251 215 G C 0.182 175.111 174.900 0.048 0.000 1.008 215 G CA 1.019 46.136 45.100 0.029 0.000 0.724 215 G HN -0.328 7.778 8.290 -0.012 0.177 0.514 216 M N -2.370 117.193 119.600 -0.062 0.000 2.493 216 M HA 0.115 4.394 4.480 -0.334 0.000 0.244 216 M C -0.386 175.860 176.300 -0.091 0.000 1.182 216 M CA 0.261 55.371 55.300 -0.317 0.000 0.981 216 M CB 0.408 32.678 32.600 -0.551 0.000 1.551 216 M HN -0.267 7.953 8.290 -0.074 0.025 0.476 217 T N -5.878 108.721 114.554 0.076 0.000 3.215 217 T HA 0.209 4.738 4.350 0.298 0.000 0.271 217 T C -0.322 174.504 174.700 0.209 0.000 1.012 217 T CA -2.380 59.816 62.100 0.159 0.000 0.899 217 T CB -0.474 68.394 68.868 0.001 0.000 1.089 217 T HN -0.253 7.963 8.240 0.050 0.054 0.552 218 S N 0.955 116.826 115.700 0.284 0.000 2.640 218 S HA 0.195 4.863 4.470 0.170 -0.097 0.262 218 S C 1.381 176.140 174.600 0.264 0.000 1.232 218 S CA -1.301 57.046 58.200 0.246 0.000 0.988 218 S CB 1.991 65.337 63.200 0.243 0.000 1.034 218 S HN -0.827 7.615 8.310 0.334 0.068 0.569 219 A N 0.839 123.759 122.820 0.167 0.000 2.019 219 A HA -0.122 4.416 4.320 0.084 -0.168 0.219 219 A C 0.624 178.241 177.584 0.056 0.000 1.164 219 A CA 2.079 54.175 52.037 0.097 0.000 0.644 219 A CB -0.565 18.470 19.000 0.058 0.000 0.805 219 A HN 0.618 8.854 8.150 0.142 0.000 0.449 220 F N -2.734 117.163 119.950 -0.089 0.000 2.161 220 F HA -0.270 4.106 4.527 -0.251 0.000 0.300 220 F C -0.815 174.747 175.800 -0.397 0.000 1.089 220 F CA 2.042 59.857 58.000 -0.308 0.000 1.282 220 F CB 0.589 39.279 39.000 -0.517 0.000 1.010 220 F HN -0.585 7.831 8.300 0.237 0.026 0.485 221 Y N -4.624 115.599 120.300 -0.128 0.000 2.352 221 Y HA 0.086 4.468 4.550 -0.526 -0.149 0.326 221 Y C -0.784 174.933 175.900 -0.305 0.000 1.166 221 Y CA -0.788 57.127 58.100 -0.308 0.000 1.182 221 Y CB 1.372 39.741 38.460 -0.152 0.000 1.216 221 Y HN -0.936 7.455 8.280 0.221 0.022 0.474 222 K N -0.327 119.898 120.400 -0.291 0.000 2.463 222 K HA 0.514 4.951 4.320 -0.066 -0.157 0.255 222 K C -1.466 175.025 176.600 -0.182 0.000 0.942 222 K CA -1.168 54.995 56.287 -0.207 0.000 0.814 222 K CB 2.858 35.085 32.500 -0.455 0.000 1.122 222 K HN -0.005 8.025 8.250 -0.367 0.000 0.425 223 Y N 3.393 123.744 120.300 0.086 0.000 2.342 223 Y HA 0.790 5.626 4.550 0.086 -0.234 0.334 223 Y C -0.119 175.825 175.900 0.073 0.000 1.067 223 Y CA -1.568 56.583 58.100 0.085 0.000 1.128 223 Y CB 3.211 41.715 38.460 0.073 0.000 1.200 223 Y HN 0.677 9.146 8.280 0.314 0.000 0.464 224 I N 1.748 122.427 120.570 0.181 0.000 2.418 224 I HA 0.313 4.606 4.170 -0.065 -0.162 0.287 224 I C -1.583 174.562 176.117 0.046 0.000 1.008 224 I CA -0.946 60.373 61.300 0.032 0.000 1.104 224 I CB 2.528 40.535 38.000 0.012 0.000 1.264 224 I HN 0.405 8.724 8.210 0.181 0.000 0.438 225 L N 6.468 127.664 121.223 -0.045 0.000 2.322 225 L HA 0.560 5.134 4.340 0.115 -0.165 0.279 225 L C 0.980 177.904 176.870 0.090 0.000 1.036 225 L CA -0.987 53.891 54.840 0.062 0.000 0.807 225 L CB 1.667 43.832 42.059 0.176 0.000 1.226 225 L HN 0.433 8.540 8.230 -0.206 0.000 0.433 226 T N -0.624 114.028 114.554 0.164 0.000 3.057 226 T HA -0.031 4.507 4.350 0.313 0.000 0.254 226 T C 0.124 174.958 174.700 0.224 0.000 1.094 226 T CA 0.772 63.001 62.100 0.216 0.000 1.088 226 T CB 0.409 69.361 68.868 0.140 0.000 0.934 226 T HN 0.099 8.427 8.240 0.146 0.000 0.497 227 T N 2.502 117.185 114.554 0.214 0.000 2.902 227 T HA -0.140 4.341 4.350 0.217 0.000 0.301 227 T C 1.181 176.027 174.700 0.244 0.000 1.012 227 T CA 0.024 62.257 62.100 0.221 0.000 1.151 227 T CB 0.778 69.765 68.868 0.199 0.000 0.946 227 T HN -0.482 7.880 8.240 0.202 0.000 0.542 228 M N 6.038 125.769 119.600 0.219 0.000 2.686 228 M HA -0.058 4.525 4.480 0.171 0.000 0.246 228 M C 0.275 176.696 176.300 0.202 0.000 1.096 228 M CA 0.125 55.524 55.300 0.165 0.000 1.076 228 M CB -1.013 31.603 32.600 0.028 0.000 1.504 228 M HN 0.387 8.825 8.290 0.246 0.000 0.524 229 D N 0.136 120.663 120.400 0.211 0.000 2.358 229 D HA 0.172 4.936 4.640 0.206 0.000 0.224 229 D C 0.867 177.248 176.300 0.135 0.000 1.123 229 D CA -0.188 53.920 54.000 0.180 0.000 0.833 229 D CB -0.554 40.332 40.800 0.143 0.000 0.946 229 D HN -0.531 7.908 8.370 0.210 0.057 0.505 230 F N 3.288 123.247 119.950 0.015 0.000 2.115 230 F HA -0.310 4.182 4.527 -0.058 0.000 0.300 230 F C -2.071 173.634 175.800 -0.159 0.000 1.092 230 F CA 5.417 63.378 58.000 -0.064 0.000 1.245 230 F CB -1.648 37.306 39.000 -0.076 0.000 0.995 230 F HN -0.729 7.708 8.300 0.347 0.071 0.481 231 P HA -0.172 3.941 4.420 -0.510 0.000 0.220 231 P C -0.398 176.746 177.300 -0.260 0.000 1.148 231 P CA 2.182 65.145 63.100 -0.229 0.000 0.803 231 P CB -0.322 31.372 31.700 -0.010 0.000 0.782 232 I N -9.901 110.509 120.570 -0.266 0.000 3.904 232 I HA 0.135 3.958 4.170 -0.578 0.000 0.333 232 I C -1.050 174.714 176.117 -0.588 0.000 1.361 232 I CA -1.244 59.802 61.300 -0.422 0.000 1.116 232 I CB 0.147 38.033 38.000 -0.189 0.000 1.028 232 I HN -0.669 7.418 8.210 -0.159 0.027 0.398 233 L N 3.415 124.321 121.223 -0.529 0.000 2.363 233 L HA 0.030 4.219 4.340 -0.251 0.000 0.286 233 L C -1.406 175.173 176.870 -0.486 0.000 1.106 233 L CA -0.767 53.831 54.840 -0.404 0.000 0.859 233 L CB -0.457 41.387 42.059 -0.358 0.000 1.223 233 L HN -0.786 6.990 8.230 -0.489 0.161 0.446 234 H N 3.973 123.007 119.070 -0.062 0.000 2.552 234 H HA 0.215 4.729 4.556 -0.071 0.000 0.311 234 H C -0.909 174.436 175.328 0.028 0.000 1.071 234 H CA -0.396 55.623 56.048 -0.047 0.000 1.307 234 H CB 0.756 30.476 29.762 -0.070 0.000 1.416 234 H HN 0.109 8.291 8.280 -0.164 0.000 0.464 235 L N 6.208 127.471 121.223 0.068 0.000 2.892 235 L HA 0.250 4.608 4.340 0.029 0.000 0.251 235 L C -1.035 175.835 176.870 0.001 0.000 1.339 235 L CA -1.349 53.492 54.840 0.002 0.000 0.900 235 L CB 0.497 42.496 42.059 -0.100 0.000 1.246 235 L HN 0.293 8.553 8.230 0.049 0.000 0.524 236 D N 1.078 121.501 120.400 0.037 0.000 2.304 236 D HA -0.034 4.609 4.640 0.005 0.000 0.250 236 D C 1.536 177.839 176.300 0.005 0.000 1.107 236 D CA 1.055 55.065 54.000 0.015 0.000 0.885 236 D CB 0.189 40.998 40.800 0.016 0.000 1.192 236 D HN -0.538 7.875 8.370 0.072 0.000 0.436 237 G N 3.508 112.304 108.800 -0.007 0.000 2.253 237 G HA2 -0.459 3.496 3.960 -0.010 0.000 0.251 237 G HA3 -0.459 3.497 3.960 -0.007 0.000 0.251 237 G C 0.015 174.894 174.900 -0.034 0.000 0.998 237 G CA 0.777 45.869 45.100 -0.013 0.000 0.621 237 G HN 0.724 9.010 8.290 -0.007 0.000 0.524 238 I N 0.559 121.095 120.570 -0.057 0.000 2.899 238 I HA -0.026 4.085 4.170 -0.097 0.000 0.257 238 I C -0.309 175.760 176.117 -0.080 0.000 1.115 238 I CA 0.692 61.932 61.300 -0.100 0.000 1.451 238 I CB 1.434 39.324 38.000 -0.184 0.000 1.251 238 I HN -0.870 7.209 8.210 -0.050 0.100 0.456 239 V N 0.465 120.341 119.914 -0.064 0.000 2.479 239 V HA -0.315 3.781 4.120 -0.039 0.000 0.281 239 V C -0.981 175.107 176.094 -0.009 0.000 1.031 239 V CA 1.558 63.837 62.300 -0.035 0.000 1.038 239 V CB -0.234 31.574 31.823 -0.024 0.000 0.981 239 V HN -0.547 7.605 8.190 -0.063 0.000 0.478 240 E N 8.184 128.389 120.200 0.008 0.000 2.232 240 E HA 0.115 4.473 4.350 0.013 0.000 0.265 240 E C 0.600 177.218 176.600 0.029 0.000 1.001 240 E CA -1.456 54.956 56.400 0.020 0.000 0.870 240 E CB 1.389 31.109 29.700 0.032 0.000 1.175 240 E HN -0.151 8.217 8.360 0.014 0.000 0.407 241 D N 1.953 122.369 120.400 0.027 0.000 2.221 241 D HA -0.191 4.464 4.640 0.026 0.000 0.204 241 D C 0.363 176.685 176.300 0.037 0.000 0.982 241 D CA 2.843 56.860 54.000 0.028 0.000 0.857 241 D CB -0.281 40.532 40.800 0.022 0.000 0.934 241 D HN 0.508 8.892 8.370 0.023 0.000 0.475 242 S N -5.056 110.672 115.700 0.046 0.000 2.556 242 S HA -0.008 4.490 4.470 0.046 0.000 0.216 242 S C -0.449 174.196 174.600 0.075 0.000 0.970 242 S CA -0.039 58.194 58.200 0.055 0.000 0.912 242 S CB 0.193 63.429 63.200 0.060 0.000 0.790 242 S HN -0.197 8.104 8.310 0.047 0.037 0.504 243 S N 3.510 119.258 115.700 0.080 0.000 2.572 243 S HA -0.077 4.599 4.470 0.145 -0.120 0.279 243 S C -0.004 174.663 174.600 0.112 0.000 1.341 243 S CA 1.312 59.578 58.200 0.111 0.000 1.043 243 S CB 0.533 63.784 63.200 0.085 0.000 0.887 243 S HN -0.651 7.541 8.310 0.066 0.158 0.516 244 N N 4.962 123.753 118.700 0.152 0.000 2.706 244 N HA 0.233 5.041 4.740 0.113 0.000 0.240 244 N C -2.073 173.573 175.510 0.226 0.000 1.039 244 N CA -0.522 52.609 53.050 0.136 0.000 0.888 244 N CB 1.346 39.862 38.487 0.049 0.000 1.128 244 N HN 0.242 8.740 8.380 0.197 0.000 0.512 245 I N 3.621 124.316 120.570 0.208 0.000 2.448 245 I HA 0.164 4.519 4.170 0.308 0.000 0.281 245 I C -2.191 174.068 176.117 0.237 0.000 1.027 245 I CA -0.604 60.849 61.300 0.255 0.000 1.111 245 I CB 1.681 39.798 38.000 0.196 0.000 1.236 245 I HN 0.412 8.728 8.210 0.177 0.000 0.452 246 L N 6.073 127.327 121.223 0.052 0.000 2.334 246 L HA 1.066 5.447 4.340 -0.258 -0.195 0.273 246 L C -0.513 175.806 176.870 -0.918 0.000 1.013 246 L CA -1.877 52.782 54.840 -0.301 0.000 0.816 246 L CB 2.931 44.854 42.059 -0.228 0.000 1.278 246 L HN 0.256 8.535 8.230 0.081 0.000 0.431 247 G N -1.494 106.327 108.800 -1.633 0.000 2.650 247 G HA2 0.619 3.631 3.960 -1.580 0.000 0.310 247 G HA3 0.619 2.979 3.960 -2.668 0.000 0.310 247 G C -2.600 171.416 174.900 -1.474 0.000 1.270 247 G CA 0.417 44.347 45.100 -1.950 0.000 0.810 247 G HN 0.116 7.589 8.290 -1.361 0.000 0.493 248 F N -2.654 117.007 119.950 -0.482 0.000 2.593 248 F HA 0.994 5.616 4.527 -0.188 -0.208 0.320 248 F C -1.565 174.210 175.800 -0.042 0.000 1.060 248 F CA -2.132 55.751 58.000 -0.196 0.000 0.940 248 F CB 4.910 43.813 39.000 -0.161 0.000 1.268 248 F HN 0.028 8.070 8.300 -0.430 0.000 0.475 249 S N -2.213 113.607 115.700 0.200 0.000 2.547 249 S HA 0.476 5.062 4.470 0.193 0.000 0.281 249 S C -0.362 174.311 174.600 0.122 0.000 1.118 249 S CA -2.413 55.893 58.200 0.177 0.000 0.947 249 S CB 2.214 65.522 63.200 0.181 0.000 1.053 249 S HN 0.106 8.538 8.310 0.202 0.000 0.482 250 M N 5.302 124.923 119.600 0.035 0.000 2.509 250 M HA 0.165 4.648 4.480 0.005 0.000 0.250 250 M C 0.257 176.514 176.300 -0.072 0.000 1.132 250 M CA 1.435 56.698 55.300 -0.061 0.000 1.080 250 M CB 1.148 33.617 32.600 -0.219 0.000 1.408 250 M HN 0.760 9.055 8.290 0.009 0.000 0.484 251 F N 0.686 120.645 119.950 0.016 0.000 2.518 251 F HA -0.153 4.537 4.527 -0.005 -0.166 0.359 251 F C 0.044 175.799 175.800 -0.075 0.000 1.118 251 F CA 1.271 59.263 58.000 -0.013 0.000 1.287 251 F CB 0.544 39.559 39.000 0.024 0.000 1.132 251 F HN -0.823 7.619 8.300 0.237 0.000 0.587 252 N N 3.409 122.175 118.700 0.111 0.000 2.678 252 N HA 0.274 5.011 4.740 -0.005 0.000 0.231 252 N C 0.732 176.175 175.510 -0.110 0.000 1.038 252 N CA -1.875 51.184 53.050 0.014 0.000 0.932 252 N CB -0.225 38.287 38.487 0.042 0.000 1.176 252 N HN 0.113 8.571 8.380 0.130 0.000 0.511 253 T N 1.876 116.229 114.554 -0.335 0.000 3.098 253 T HA -0.081 3.307 4.350 -1.604 0.000 0.266 253 T C 0.986 175.515 174.700 -0.285 0.000 1.145 253 T CA 2.224 63.848 62.100 -0.794 0.000 1.092 253 T CB -0.423 68.009 68.868 -0.727 0.000 0.908 253 T HN 0.561 8.653 8.240 -0.246 0.000 0.526 254 S N 0.530 116.174 115.700 -0.093 0.000 2.548 254 S HA -0.037 4.435 4.470 0.004 0.000 0.215 254 S C -0.616 174.022 174.600 0.063 0.000 0.976 254 S CA 0.558 58.757 58.200 -0.002 0.000 0.908 254 S CB 0.638 63.832 63.200 -0.010 0.000 0.781 254 S HN -0.637 7.804 8.310 -0.084 -0.181 0.519 255 H N 5.386 124.465 119.070 0.015 0.000 3.001 255 H HA 0.047 4.621 4.556 0.030 0.000 0.334 255 H C -0.255 175.150 175.328 0.127 0.000 1.034 255 H CA 0.466 56.550 56.048 0.060 0.000 1.420 255 H CB 1.213 31.018 29.762 0.072 0.000 1.405 255 H HN -0.738 7.541 8.280 0.181 0.110 0.593 256 P HA -0.215 4.253 4.420 0.079 0.000 0.218 256 P C -0.245 177.238 177.300 0.305 0.000 1.148 256 P CA 2.258 65.404 63.100 0.076 0.000 0.822 256 P CB 0.166 31.852 31.700 -0.023 0.000 0.784 257 F N -4.564 115.611 119.950 0.376 0.000 2.789 257 F HA -0.031 4.625 4.527 0.216 0.000 0.300 257 F C 0.134 176.066 175.800 0.219 0.000 1.132 257 F CA -0.934 57.244 58.000 0.296 0.000 1.404 257 F CB 1.010 40.189 39.000 0.299 0.000 1.114 257 F HN -0.665 8.178 8.300 0.939 0.020 0.584 258 Y N 1.778 122.179 120.300 0.168 0.000 2.128 258 Y HA -0.358 4.201 4.550 0.016 0.000 0.284 258 Y C -1.811 174.069 175.900 -0.034 0.000 1.154 258 Y CA 6.240 64.366 58.100 0.042 0.000 1.149 258 Y CB -2.466 36.042 38.460 0.081 0.000 0.976 258 Y HN -0.360 8.180 8.280 0.520 0.052 0.505 259 P HA -0.234 4.034 4.420 -0.254 0.000 0.217 259 P C 1.732 178.858 177.300 -0.289 0.000 1.151 259 P CA 3.094 66.087 63.100 -0.179 0.000 0.828 259 P CB -0.574 31.113 31.700 -0.022 0.000 0.788 260 E N -1.308 118.666 120.200 -0.378 0.000 2.106 260 E HA -0.264 3.889 4.350 -0.327 0.000 0.192 260 E C 2.039 178.302 176.600 -0.563 0.000 0.984 260 E CA 2.905 59.001 56.400 -0.506 0.000 0.806 260 E CB -0.346 28.921 29.700 -0.721 0.000 0.750 260 E HN -0.528 7.614 8.360 -0.364 0.000 0.458 261 F N 0.758 120.204 119.950 -0.841 0.000 2.075 261 F HA -0.354 3.929 4.527 -0.407 0.000 0.297 261 F C 1.465 177.057 175.800 -0.347 0.000 1.113 261 F CA 3.722 61.410 58.000 -0.519 0.000 1.218 261 F CB 0.319 39.060 39.000 -0.431 0.000 0.984 261 F HN -0.184 7.737 8.300 -0.633 0.000 0.472 262 V N 0.261 119.965 119.914 -0.351 0.000 2.287 262 V HA -0.640 3.334 4.120 -0.244 0.000 0.248 262 V C 2.136 178.088 176.094 -0.236 0.000 1.053 262 V CA 4.217 66.330 62.300 -0.312 0.000 1.027 262 V CB -0.187 31.389 31.823 -0.412 0.000 0.646 262 V HN -0.086 7.852 8.190 -0.419 0.000 0.447 263 R N -1.160 119.190 120.500 -0.251 0.000 2.075 263 R HA -0.383 3.838 4.340 -0.198 0.000 0.232 263 R C 2.279 178.430 176.300 -0.248 0.000 1.126 263 R CA 3.691 59.661 56.100 -0.217 0.000 0.963 263 R CB -0.156 30.042 30.300 -0.171 0.000 0.858 263 R HN -0.216 7.892 8.270 -0.270 0.000 0.435 264 S N 0.406 115.954 115.700 -0.252 0.000 2.356 264 S HA -0.221 4.154 4.470 -0.158 0.000 0.223 264 S C 2.137 176.586 174.600 -0.253 0.000 1.032 264 S CA 3.941 62.017 58.200 -0.207 0.000 1.005 264 S CB -0.463 62.645 63.200 -0.154 0.000 0.867 264 S HN -0.325 7.822 8.310 -0.273 0.000 0.449 265 L N 0.546 121.560 121.223 -0.347 0.000 2.141 265 L HA -0.217 3.993 4.340 -0.216 0.000 0.209 265 L C 1.892 178.423 176.870 -0.565 0.000 1.094 265 L CA 2.383 57.035 54.840 -0.314 0.000 0.763 265 L CB -1.313 40.596 42.059 -0.250 0.000 0.908 265 L HN -0.429 7.558 8.230 -0.405 0.000 0.437 266 N N 0.585 118.740 118.700 -0.909 0.000 2.058 266 N HA -0.309 2.949 4.740 -2.471 0.000 0.191 266 N C 2.338 177.529 175.510 -0.531 0.000 1.037 266 N CA 3.227 55.498 53.050 -1.299 0.000 0.848 266 N CB -0.012 38.034 38.487 -0.735 0.000 1.021 266 N HN -0.396 7.586 8.380 -0.664 0.000 0.422 267 M N -1.087 118.325 119.600 -0.313 0.000 2.117 267 M HA -0.391 4.005 4.480 -0.140 0.000 0.262 267 M C 2.082 178.319 176.300 -0.106 0.000 1.065 267 M CA 4.180 59.382 55.300 -0.163 0.000 1.114 267 M CB -0.107 32.420 32.600 -0.122 0.000 1.361 267 M HN -0.056 8.049 8.290 -0.309 0.000 0.408 268 S N -0.484 115.149 115.700 -0.112 0.000 2.368 268 S HA -0.337 4.103 4.470 -0.051 0.000 0.225 268 S C 1.946 176.541 174.600 -0.009 0.000 1.030 268 S CA 2.774 60.941 58.200 -0.056 0.000 0.999 268 S CB 0.032 63.203 63.200 -0.049 0.000 0.844 268 S HN -0.511 7.707 8.310 -0.153 0.000 0.459 269 W N 2.562 123.734 121.300 -0.213 0.000 2.355 269 W HA -0.179 4.437 4.660 -0.073 0.000 0.309 269 W C 1.604 178.060 176.519 -0.105 0.000 1.206 269 W CA 3.440 60.702 57.345 -0.138 0.000 1.284 269 W CB -0.107 29.262 29.460 -0.150 0.000 1.145 269 W HN -0.313 7.883 8.180 0.028 0.000 0.502 270 R N -3.948 116.677 120.500 0.208 0.000 2.120 270 R HA -0.337 4.149 4.340 0.244 0.000 0.234 270 R C 1.778 178.104 176.300 0.042 0.000 1.123 270 R CA 3.445 59.629 56.100 0.141 0.000 0.975 270 R CB -0.290 30.034 30.300 0.039 0.000 0.866 270 R HN -0.330 8.000 8.270 0.100 0.000 0.446 271 E N -4.599 115.599 120.200 -0.003 0.000 2.230 271 E HA -0.125 4.212 4.350 -0.021 0.000 0.192 271 E C 0.738 177.307 176.600 -0.053 0.000 0.987 271 E CA 1.859 58.242 56.400 -0.028 0.000 0.841 271 E CB 0.445 30.124 29.700 -0.034 0.000 0.783 271 E HN -0.598 7.729 8.360 -0.006 0.029 0.481 272 N N -3.257 115.387 118.700 -0.093 0.000 2.210 272 N HA 0.001 4.682 4.740 -0.098 0.000 0.203 272 N C -0.770 174.622 175.510 -0.197 0.000 1.175 272 N CA 0.081 53.053 53.050 -0.130 0.000 0.894 272 N CB 1.657 40.064 38.487 -0.134 0.000 1.041 272 N HN -0.644 7.675 8.380 -0.103 0.000 0.506 273 c N 2.788 121.224 118.600 -0.273 0.000 2.647 273 c HA 0.267 4.657 4.570 -0.299 0.000 0.273 273 c C -1.298 172.711 174.090 -0.134 0.000 1.088 273 c CA -1.087 55.018 56.329 -0.374 0.000 1.529 273 c CB -1.605 40.306 42.510 -0.999 0.000 1.810 273 c HN -0.071 8.016 8.230 -0.239 0.000 0.422 274 E N 4.966 125.133 120.200 -0.056 0.000 2.385 274 E HA -0.160 4.227 4.350 0.061 0.000 0.194 274 E C 0.727 177.355 176.600 0.047 0.000 1.013 274 E CA 1.931 58.343 56.400 0.021 0.000 0.866 274 E CB -0.127 29.575 29.700 0.003 0.000 0.832 274 E HN 0.544 8.858 8.360 -0.076 0.000 0.500 275 A N -0.745 122.086 122.820 0.019 0.000 2.119 275 A HA -0.024 4.316 4.320 0.033 0.000 0.216 275 A C -0.067 177.572 177.584 0.092 0.000 1.152 275 A CA 0.792 52.850 52.037 0.035 0.000 0.708 275 A CB 0.282 19.283 19.000 0.000 0.000 0.805 275 A HN 0.337 8.436 8.150 -0.024 0.036 0.460 276 S N -3.294 112.518 115.700 0.186 0.000 2.627 276 S HA 0.276 4.866 4.470 0.199 0.000 0.283 276 S C -1.666 173.216 174.600 0.471 0.000 1.127 276 S CA -0.992 57.391 58.200 0.306 0.000 0.863 276 S CB 2.267 65.707 63.200 0.399 0.000 1.121 276 S HN -0.303 8.090 8.310 0.198 0.036 0.479 277 T N 4.037 118.743 114.554 0.252 0.000 2.771 277 T HA 0.128 4.540 4.350 0.102 0.000 0.291 277 T C -1.088 173.414 174.700 -0.330 0.000 0.954 277 T CA -0.314 61.813 62.100 0.044 0.000 1.045 277 T CB 0.600 69.435 68.868 -0.055 0.000 0.917 277 T HN 0.249 8.594 8.240 0.176 0.000 0.484 278 Y N 9.285 129.032 120.300 -0.922 0.000 2.729 278 Y HA -0.083 2.841 4.550 -2.711 0.000 0.331 278 Y C -1.007 174.433 175.900 -0.767 0.000 1.208 278 Y CA -0.625 56.541 58.100 -1.556 0.000 1.521 278 Y CB 0.411 38.197 38.460 -1.124 0.000 1.233 278 Y HN 0.312 8.337 8.280 -0.425 0.000 0.539 279 P HA 0.210 4.390 4.420 -0.399 0.000 0.257 279 P C -1.718 175.232 177.300 -0.583 0.000 1.241 279 P CA -0.214 62.565 63.100 -0.534 0.000 0.816 279 P CB 2.353 33.912 31.700 -0.235 0.000 1.150 280 G N -1.584 106.357 108.800 -1.432 0.000 2.408 280 G HA2 -0.171 3.211 3.960 -0.964 0.000 0.682 280 G HA3 -0.171 3.497 3.960 -0.487 0.000 0.682 280 G C -2.913 171.632 174.900 -0.592 0.000 1.303 280 G CA -0.711 43.838 45.100 -0.919 0.000 0.966 280 G HN -0.565 6.132 8.290 -2.580 0.046 0.560 281 P HA 0.059 4.542 4.420 0.106 0.000 0.280 281 P C -1.562 175.878 177.300 0.234 0.000 1.244 281 P CA -0.654 62.485 63.100 0.065 0.000 0.784 281 P CB 1.242 33.039 31.700 0.162 0.000 0.913 282 A N 2.047 125.042 122.820 0.291 0.000 2.425 282 A HA -0.148 4.464 4.320 0.274 -0.128 0.249 282 A C 0.850 178.703 177.584 0.449 0.000 1.084 282 A CA -0.348 51.880 52.037 0.318 0.000 0.781 282 A CB 1.206 20.359 19.000 0.254 0.000 1.019 282 A HN -0.170 8.140 8.150 0.266 0.000 0.490 283 L N 3.288 124.726 121.223 0.358 0.000 2.083 283 L HA -0.260 4.100 4.340 0.033 0.000 0.209 283 L C 1.280 178.249 176.870 0.165 0.000 1.083 283 L CA 3.159 58.093 54.840 0.155 0.000 0.752 283 L CB 0.227 42.307 42.059 0.036 0.000 0.899 283 L HN 0.132 8.874 8.230 0.316 -0.322 0.433 284 S N -2.782 113.048 115.700 0.217 0.000 2.423 284 S HA -0.332 4.251 4.470 0.187 0.000 0.231 284 S C 1.432 176.176 174.600 0.240 0.000 1.014 284 S CA 2.716 61.038 58.200 0.203 0.000 0.965 284 S CB -0.512 62.793 63.200 0.175 0.000 0.785 284 S HN 0.027 8.461 8.310 0.227 0.012 0.495 285 A N 1.670 124.681 122.820 0.317 0.000 1.898 285 A HA -0.209 4.329 4.320 0.363 0.000 0.216 285 A C 1.540 179.445 177.584 0.535 0.000 1.181 285 A CA 2.670 54.964 52.037 0.428 0.000 0.620 285 A CB -0.894 18.380 19.000 0.457 0.000 0.819 285 A HN -0.578 7.757 8.150 0.326 0.011 0.442 286 A N -1.722 121.366 122.820 0.447 0.000 1.933 286 A HA -0.331 3.923 4.320 -0.110 0.000 0.218 286 A C 1.862 179.511 177.584 0.108 0.000 1.175 286 A CA 2.778 54.880 52.037 0.108 0.000 0.628 286 A CB -0.580 18.385 19.000 -0.058 0.000 0.814 286 A HN -0.650 7.778 8.150 0.462 0.000 0.444 287 L N -1.965 119.325 121.223 0.110 0.000 2.093 287 L HA -0.394 3.994 4.340 0.079 0.000 0.208 287 L C 2.367 179.338 176.870 0.167 0.000 1.085 287 L CA 2.963 57.870 54.840 0.111 0.000 0.755 287 L CB -0.332 41.790 42.059 0.105 0.000 0.904 287 L HN 0.080 8.378 8.230 0.114 0.000 0.435 288 M N -1.373 118.355 119.600 0.212 0.000 2.086 288 M HA -0.394 4.180 4.480 0.157 0.000 0.261 288 M C 2.322 178.765 176.300 0.238 0.000 1.067 288 M CA 2.566 57.991 55.300 0.208 0.000 1.116 288 M CB -0.900 31.836 32.600 0.227 0.000 1.348 288 M HN -0.377 8.052 8.290 0.232 0.000 0.407 289 F N 1.514 121.566 119.950 0.170 0.000 2.069 289 F HA -0.398 4.257 4.527 0.213 0.000 0.298 289 F C 1.796 177.706 175.800 0.183 0.000 1.113 289 F CA 3.795 61.904 58.000 0.182 0.000 1.214 289 F CB 0.067 39.142 39.000 0.124 0.000 0.978 289 F HN -0.350 8.246 8.300 0.493 0.000 0.474 290 D N -0.919 119.680 120.400 0.332 0.000 2.144 290 D HA -0.318 4.479 4.640 0.261 0.000 0.199 290 D C 2.208 178.529 176.300 0.035 0.000 0.984 290 D CA 3.030 57.174 54.000 0.239 0.000 0.834 290 D CB -0.516 40.475 40.800 0.319 0.000 0.955 290 D HN -0.357 8.233 8.370 0.367 0.000 0.465 291 A N -0.171 122.688 122.820 0.065 0.000 1.902 291 A HA -0.248 4.092 4.320 0.033 0.000 0.217 291 A C 2.067 179.620 177.584 -0.051 0.000 1.181 291 A CA 3.158 55.209 52.037 0.023 0.000 0.623 291 A CB -0.668 18.363 19.000 0.052 0.000 0.818 291 A HN -0.128 8.087 8.150 0.109 0.000 0.443 292 V N -0.883 118.983 119.914 -0.080 0.000 2.343 292 V HA -0.565 3.478 4.120 -0.127 0.000 0.247 292 V C 2.320 178.250 176.094 -0.273 0.000 1.051 292 V CA 4.560 66.757 62.300 -0.172 0.000 1.036 292 V CB -0.036 31.652 31.823 -0.225 0.000 0.654 292 V HN -0.531 7.630 8.190 -0.048 0.000 0.451 293 H N -0.832 118.004 119.070 -0.389 0.000 2.387 293 H HA -0.305 4.032 4.556 -0.365 0.000 0.299 293 H C 2.538 177.573 175.328 -0.489 0.000 1.090 293 H CA 4.766 60.520 56.048 -0.489 0.000 1.332 293 H CB -0.250 29.069 29.762 -0.739 0.000 1.386 293 H HN -0.824 7.357 8.280 -0.166 0.000 0.516 294 V N 0.175 119.875 119.914 -0.356 0.000 2.295 294 V HA -0.558 3.423 4.120 -0.232 0.000 0.246 294 V C 1.494 177.546 176.094 -0.069 0.000 1.049 294 V CA 4.713 66.898 62.300 -0.191 0.000 1.024 294 V CB -0.184 31.628 31.823 -0.018 0.000 0.648 294 V HN -0.146 7.844 8.190 -0.333 0.000 0.447 295 V N -0.181 119.689 119.914 -0.072 0.000 2.295 295 V HA -0.559 3.555 4.120 -0.009 0.000 0.246 295 V C 1.998 178.062 176.094 -0.050 0.000 1.049 295 V CA 4.726 67.002 62.300 -0.040 0.000 1.024 295 V CB -0.256 31.541 31.823 -0.043 0.000 0.648 295 V HN -0.436 7.701 8.190 -0.089 0.000 0.447 296 V N -0.710 119.142 119.914 -0.102 0.000 2.343 296 V HA -0.623 3.448 4.120 -0.080 0.000 0.247 296 V C 1.563 177.618 176.094 -0.065 0.000 1.051 296 V CA 4.804 67.044 62.300 -0.100 0.000 1.036 296 V CB -0.476 31.248 31.823 -0.165 0.000 0.654 296 V HN -0.368 7.737 8.190 -0.142 0.000 0.451 297 S N -0.555 115.110 115.700 -0.059 0.000 2.359 297 S HA -0.442 4.027 4.470 -0.002 0.000 0.224 297 S C 1.945 176.555 174.600 0.017 0.000 1.035 297 S CA 3.564 61.759 58.200 -0.008 0.000 1.018 297 S CB -0.174 63.033 63.200 0.012 0.000 0.876 297 S HN -0.150 8.106 8.310 -0.090 0.000 0.448 298 A N 1.321 124.161 122.820 0.033 0.000 1.898 298 A HA -0.215 4.176 4.320 0.119 0.000 0.216 298 A C 1.889 179.465 177.584 -0.014 0.000 1.181 298 A CA 2.869 54.950 52.037 0.073 0.000 0.620 298 A CB -0.503 18.566 19.000 0.114 0.000 0.819 298 A HN -0.494 7.670 8.150 0.024 0.000 0.442 299 V N -1.208 118.693 119.914 -0.021 0.000 2.358 299 V HA -0.565 3.523 4.120 -0.054 0.000 0.246 299 V C 2.259 178.292 176.094 -0.101 0.000 1.047 299 V CA 4.363 66.635 62.300 -0.047 0.000 1.035 299 V CB -0.239 31.581 31.823 -0.004 0.000 0.658 299 V HN -0.183 8.002 8.190 -0.009 0.000 0.452 300 R N -1.741 118.713 120.500 -0.077 0.000 2.115 300 R HA -0.326 3.965 4.340 -0.082 0.000 0.230 300 R C 2.258 178.490 176.300 -0.113 0.000 1.111 300 R CA 3.174 59.227 56.100 -0.080 0.000 0.976 300 R CB -0.389 29.882 30.300 -0.048 0.000 0.870 300 R HN -0.288 7.948 8.270 -0.057 0.000 0.445 301 E N -0.572 119.552 120.200 -0.126 0.000 2.047 301 E HA -0.184 4.108 4.350 -0.096 0.000 0.191 301 E C 2.814 179.132 176.600 -0.470 0.000 0.987 301 E CA 2.262 58.562 56.400 -0.167 0.000 0.799 301 E CB -0.443 29.253 29.700 -0.007 0.000 0.752 301 E HN -0.720 7.585 8.360 -0.093 0.000 0.449 302 L N 0.709 121.473 121.223 -0.766 0.000 2.079 302 L HA -0.316 3.064 4.340 -1.600 0.000 0.210 302 L C 1.194 177.801 176.870 -0.439 0.000 1.081 302 L CA 2.755 57.017 54.840 -0.963 0.000 0.752 302 L CB -0.185 41.484 42.059 -0.650 0.000 0.896 302 L HN 0.015 7.881 8.230 -0.607 0.000 0.433 303 N N -4.177 114.354 118.700 -0.281 0.000 2.520 303 N HA -0.206 4.573 4.740 -0.178 -0.146 0.185 303 N C 1.129 176.560 175.510 -0.132 0.000 1.068 303 N CA 1.643 54.588 53.050 -0.176 0.000 0.911 303 N CB 0.201 38.613 38.487 -0.124 0.000 0.961 303 N HN -0.366 7.753 8.380 -0.263 0.103 0.446 304 R N -2.278 118.139 120.500 -0.138 0.000 2.200 304 R HA -0.073 4.230 4.340 -0.061 0.000 0.208 304 R C 1.081 177.347 176.300 -0.057 0.000 1.033 304 R CA 1.980 58.033 56.100 -0.078 0.000 1.000 304 R CB 0.348 30.616 30.300 -0.054 0.000 0.906 304 R HN -0.522 7.481 8.270 -0.181 0.159 0.462 305 S N -2.761 112.893 115.700 -0.077 0.000 2.512 305 S HA 0.073 4.541 4.470 -0.003 0.000 0.216 305 S C -0.318 174.268 174.600 -0.024 0.000 1.006 305 S CA 0.483 58.670 58.200 -0.020 0.000 0.915 305 S CB 1.424 64.650 63.200 0.044 0.000 0.824 305 S HN -0.529 7.700 8.310 -0.135 0.000 0.497 306 Q N -1.774 117.986 119.800 -0.066 0.000 2.685 306 Q HA 0.249 4.572 4.340 -0.028 0.000 0.301 306 Q C -2.663 173.279 176.000 -0.097 0.000 0.924 306 Q CA -0.740 55.030 55.803 -0.054 0.000 0.755 306 Q CB 1.764 30.487 28.738 -0.025 0.000 1.470 306 Q HN -0.605 7.602 8.270 -0.105 0.000 0.434 307 E N -0.413 119.738 120.200 -0.083 0.000 2.115 307 E HA 0.281 4.567 4.350 -0.107 0.000 0.282 307 E C -1.122 175.305 176.600 -0.289 0.000 0.987 307 E CA -1.388 54.946 56.400 -0.111 0.000 0.797 307 E CB 0.828 30.509 29.700 -0.032 0.000 1.086 307 E HN 0.142 8.478 8.360 -0.040 0.000 0.397 308 I N 1.970 122.349 120.570 -0.318 0.000 2.385 308 I HA 0.239 3.747 4.170 -1.102 0.000 0.294 308 I C -0.066 175.942 176.117 -0.182 0.000 0.988 308 I CA -0.559 60.444 61.300 -0.494 0.000 1.265 308 I CB 1.552 39.403 38.000 -0.247 0.000 1.388 308 I HN 0.201 8.285 8.210 -0.210 0.000 0.480 309 G N 5.953 114.728 108.800 -0.041 0.000 2.620 309 G HA2 0.373 4.404 3.960 0.118 0.000 0.301 309 G HA3 0.373 4.460 3.960 0.211 0.000 0.301 309 G C -2.919 172.233 174.900 0.419 0.000 1.347 309 G CA -0.774 44.442 45.100 0.193 0.000 0.971 309 G HN 0.086 8.283 8.290 -0.156 0.000 0.488 310 V N 1.101 121.152 119.914 0.230 0.000 2.732 310 V HA 0.232 4.449 4.120 0.162 0.000 0.310 310 V C -1.354 174.778 176.094 0.063 0.000 1.053 310 V CA -1.005 61.357 62.300 0.102 0.000 0.957 310 V CB 1.434 33.205 31.823 -0.088 0.000 1.018 310 V HN 0.356 8.629 8.190 0.139 0.000 0.452 311 K N 5.714 126.106 120.400 -0.013 0.000 2.464 311 K HA 0.490 4.824 4.320 0.023 0.000 0.253 311 K C -2.388 174.181 176.600 -0.053 0.000 0.933 311 K CA -3.344 52.951 56.287 0.013 0.000 0.801 311 K CB 1.008 33.562 32.500 0.091 0.000 1.271 311 K HN -0.001 8.171 8.250 -0.130 0.000 0.430 312 P HA -0.063 4.317 4.420 -0.068 0.000 0.267 312 P C -0.990 176.286 177.300 -0.039 0.000 1.205 312 P CA -0.176 62.896 63.100 -0.046 0.000 0.765 312 P CB 0.140 31.824 31.700 -0.026 0.000 0.828 313 L N 2.052 123.240 121.223 -0.059 0.000 2.333 313 L HA 0.165 4.491 4.340 -0.024 0.000 0.269 313 L C -0.944 175.897 176.870 -0.049 0.000 1.010 313 L CA -1.805 53.008 54.840 -0.044 0.000 0.818 313 L CB 3.334 45.362 42.059 -0.051 0.000 1.306 313 L HN -0.364 7.715 8.230 -0.080 0.102 0.430 314 A N -0.586 122.212 122.820 -0.036 0.000 2.305 314 A HA 0.427 4.719 4.320 -0.047 0.000 0.322 314 A C 0.346 177.903 177.584 -0.044 0.000 1.187 314 A CA -1.685 50.329 52.037 -0.039 0.000 0.825 314 A CB 2.260 21.244 19.000 -0.027 0.000 1.164 314 A HN 0.308 8.442 8.150 -0.026 0.000 0.498 315 c N 0.368 118.934 118.600 -0.056 0.000 2.422 315 c HA -0.226 4.306 4.570 -0.064 0.000 0.279 315 c C 1.295 175.359 174.090 -0.043 0.000 1.305 315 c CA 1.568 57.861 56.329 -0.060 0.000 1.757 315 c CB -1.535 40.929 42.510 -0.076 0.000 1.962 315 c HN 0.689 8.882 8.230 -0.061 0.000 0.499 316 T N -3.594 110.938 114.554 -0.035 0.000 3.107 316 T HA -0.031 4.305 4.350 -0.023 0.000 0.249 316 T C 0.307 174.997 174.700 -0.017 0.000 1.096 316 T CA -0.372 61.713 62.100 -0.024 0.000 1.012 316 T CB -0.397 68.458 68.868 -0.023 0.000 0.977 316 T HN -0.190 8.010 8.240 -0.036 0.019 0.527 317 S N 2.132 117.822 115.700 -0.017 0.000 2.655 317 S HA 0.107 4.572 4.470 -0.009 0.000 0.265 317 S C 0.855 175.450 174.600 -0.008 0.000 1.240 317 S CA -0.921 57.272 58.200 -0.011 0.000 0.986 317 S CB 1.942 65.137 63.200 -0.009 0.000 0.985 317 S HN -0.690 7.564 8.310 -0.021 0.044 0.562 318 A N -0.184 122.633 122.820 -0.004 0.000 2.238 318 A HA 0.099 4.416 4.320 -0.005 0.000 0.210 318 A C -0.010 177.576 177.584 0.002 0.000 1.179 318 A CA -0.163 51.872 52.037 -0.003 0.000 0.827 318 A CB -0.144 18.855 19.000 -0.003 0.000 0.856 318 A HN 0.516 8.664 8.150 -0.004 0.000 0.488 319 N N 0.409 119.112 118.700 0.005 0.000 2.479 319 N HA -0.004 4.745 4.740 0.015 0.000 0.257 319 N C -1.472 174.056 175.510 0.031 0.000 1.232 319 N CA 0.786 53.846 53.050 0.016 0.000 0.920 319 N CB 0.898 39.395 38.487 0.018 0.000 1.105 319 N HN -0.500 7.829 8.380 0.003 0.052 0.444 320 I N -5.121 115.478 120.570 0.049 0.000 3.170 320 I HA 0.304 4.618 4.170 0.090 -0.090 0.312 320 I C -1.447 174.770 176.117 0.166 0.000 1.085 320 I CA -1.993 59.361 61.300 0.089 0.000 0.999 320 I CB 3.081 41.122 38.000 0.069 0.000 1.233 320 I HN -0.212 8.022 8.210 0.041 0.000 0.467 321 W N 3.300 124.590 121.300 -0.016 0.000 2.437 321 W HA 0.389 5.037 4.660 -0.019 0.000 0.312 321 W C -1.279 175.212 176.519 -0.048 0.000 1.242 321 W CA -2.198 55.139 57.345 -0.014 0.000 1.340 321 W CB -0.557 28.915 29.460 0.020 0.000 1.327 321 W HN -0.037 8.341 8.180 0.330 0.000 0.476 322 P HA -0.192 4.070 4.420 -0.264 0.000 0.219 322 P C -0.592 176.294 177.300 -0.691 0.000 1.146 322 P CA 1.650 64.487 63.100 -0.439 0.000 0.808 322 P CB 0.105 31.496 31.700 -0.515 0.000 0.779 323 H N -6.915 111.594 119.070 -0.935 0.000 2.551 323 H HA 0.136 4.354 4.556 -0.563 0.000 0.271 323 H C 1.129 175.871 175.328 -0.976 0.000 0.984 323 H CA 0.836 56.294 56.048 -0.983 0.000 1.164 323 H CB -0.258 28.809 29.762 -1.157 0.000 1.437 323 H HN 0.036 7.342 8.280 -1.567 0.033 0.550 324 G N -0.433 107.944 108.800 -0.705 0.000 2.418 324 G HA2 -0.298 3.583 3.960 -0.131 0.000 0.217 324 G HA3 -0.298 4.052 3.960 0.156 -0.297 0.217 324 G C 0.442 175.373 174.900 0.052 0.000 1.158 324 G CA 2.286 47.308 45.100 -0.130 0.000 0.771 324 G HN -0.351 7.513 8.290 -0.629 0.049 0.545 325 T N 2.176 116.795 114.554 0.109 0.000 2.746 325 T HA -0.394 4.364 4.350 0.680 0.000 0.267 325 T C 1.666 176.514 174.700 0.246 0.000 1.039 325 T CA 4.250 66.540 62.100 0.317 0.000 1.142 325 T CB -0.119 68.817 68.868 0.113 0.000 0.866 325 T HN 0.091 8.347 8.240 0.027 0.000 0.444 326 S N 1.909 117.664 115.700 0.092 0.000 2.368 326 S HA -0.211 4.353 4.470 0.157 0.000 0.224 326 S C 1.738 176.473 174.600 0.225 0.000 1.029 326 S CA 3.442 61.729 58.200 0.145 0.000 0.988 326 S CB -0.588 62.682 63.200 0.115 0.000 0.838 326 S HN -0.173 8.143 8.310 0.010 0.000 0.462 327 L N 2.509 123.792 121.223 0.099 0.000 2.083 327 L HA -0.215 4.238 4.340 0.187 0.000 0.209 327 L C 1.076 178.021 176.870 0.125 0.000 1.083 327 L CA 2.753 57.670 54.840 0.128 0.000 0.752 327 L CB -0.321 41.791 42.059 0.089 0.000 0.899 327 L HN -0.238 7.983 8.230 -0.014 0.000 0.433 328 M N -0.543 119.087 119.600 0.050 0.000 2.175 328 M HA -0.437 3.949 4.480 -0.157 0.000 0.264 328 M C 1.424 177.719 176.300 -0.008 0.000 1.063 328 M CA 2.659 57.885 55.300 -0.123 0.000 1.119 328 M CB -0.633 31.603 32.600 -0.607 0.000 1.377 328 M HN -0.064 8.270 8.290 0.073 0.000 0.415 329 N N -0.298 118.471 118.700 0.114 0.000 2.084 329 N HA -0.337 4.439 4.740 0.060 0.000 0.190 329 N C 2.546 178.021 175.510 -0.058 0.000 1.030 329 N CA 3.058 56.127 53.050 0.031 0.000 0.849 329 N CB -0.317 38.146 38.487 -0.040 0.000 1.012 329 N HN -0.574 7.831 8.380 0.176 0.081 0.423 330 Y N -0.988 119.339 120.300 0.044 0.000 2.242 330 Y HA -0.307 4.274 4.550 0.052 0.000 0.291 330 Y C 2.931 178.865 175.900 0.057 0.000 1.137 330 Y CA 3.324 61.451 58.100 0.045 0.000 1.181 330 Y CB 0.124 38.602 38.460 0.030 0.000 0.989 330 Y HN -0.589 7.842 8.280 0.251 0.000 0.527 331 L N -0.532 120.790 121.223 0.165 0.000 2.042 331 L HA -0.380 4.052 4.340 0.154 0.000 0.210 331 L C 2.281 179.251 176.870 0.167 0.000 1.076 331 L CA 3.227 58.132 54.840 0.109 0.000 0.749 331 L CB -0.468 41.566 42.059 -0.041 0.000 0.893 331 L HN 0.396 8.713 8.230 0.144 0.000 0.432 332 R N -4.484 116.071 120.500 0.093 0.000 2.323 332 R HA -0.162 4.359 4.340 0.302 0.000 0.198 332 R C 0.665 177.078 176.300 0.188 0.000 0.988 332 R CA 1.814 58.016 56.100 0.170 0.000 1.041 332 R CB -0.027 30.314 30.300 0.068 0.000 0.926 332 R HN -0.610 7.684 8.270 0.040 0.000 0.476 333 M N -2.917 116.767 119.600 0.141 0.000 2.333 333 M HA 0.038 4.571 4.480 0.087 0.000 0.257 333 M C 0.118 176.499 176.300 0.134 0.000 1.078 333 M CA 0.427 55.787 55.300 0.100 0.000 1.005 333 M CB 1.367 33.977 32.600 0.017 0.000 1.444 333 M HN -0.745 7.443 8.290 0.134 0.182 0.496 334 V N 1.151 121.182 119.914 0.195 0.000 2.673 334 V HA -0.281 3.935 4.120 0.160 0.000 0.303 334 V C -1.273 174.885 176.094 0.107 0.000 1.046 334 V CA 1.366 63.770 62.300 0.173 0.000 1.126 334 V CB 0.538 32.495 31.823 0.224 0.000 0.934 334 V HN -0.913 7.321 8.190 0.252 0.107 0.487 335 E N 6.018 126.282 120.200 0.107 0.000 2.220 335 E HA 0.528 5.039 4.350 0.033 -0.141 0.256 335 E C -1.520 175.167 176.600 0.145 0.000 0.881 335 E CA -1.221 55.224 56.400 0.075 0.000 0.766 335 E CB 1.499 31.229 29.700 0.050 0.000 1.187 335 E HN 0.249 8.683 8.360 0.123 0.000 0.419 336 Y N 5.815 126.102 120.300 -0.023 0.000 2.457 336 Y HA 0.211 4.775 4.550 0.023 0.000 0.343 336 Y C -2.911 172.990 175.900 0.001 0.000 0.994 336 Y CA -1.008 57.095 58.100 0.004 0.000 1.031 336 Y CB 3.833 42.304 38.460 0.019 0.000 1.246 336 Y HN 0.200 8.549 8.280 0.116 0.000 0.449 337 D N 7.123 127.155 120.400 -0.613 0.000 2.428 337 D HA 0.139 4.546 4.640 -0.388 0.000 0.221 337 D C -0.820 174.996 176.300 -0.807 0.000 1.123 337 D CA -0.106 53.575 54.000 -0.533 0.000 0.869 337 D CB 0.421 41.083 40.800 -0.230 0.000 1.032 337 D HN 0.132 8.233 8.370 -0.447 0.000 0.506 338 G N 1.587 109.974 108.800 -0.689 0.000 2.667 338 G HA2 0.474 4.115 3.960 -0.531 0.000 0.310 338 G HA3 0.474 4.431 3.960 -0.347 -0.205 0.310 338 G C 0.188 174.922 174.900 -0.276 0.000 1.259 338 G CA -1.758 43.047 45.100 -0.492 0.000 1.019 338 G HN 0.214 8.216 8.290 -0.479 0.000 0.496 339 L N -1.244 119.717 121.223 -0.437 0.000 2.187 339 L HA -0.235 3.872 4.340 -0.388 0.000 0.213 339 L C 1.216 178.001 176.870 -0.142 0.000 1.100 339 L CA 2.581 57.211 54.840 -0.351 0.000 0.765 339 L CB 0.266 42.074 42.059 -0.419 0.000 0.904 339 L HN 0.069 8.365 8.230 -0.351 -0.276 0.437 340 T N -8.413 106.037 114.554 -0.173 0.000 3.223 340 T HA 0.185 4.472 4.350 -0.282 -0.106 0.259 340 T C 0.114 174.741 174.700 -0.122 0.000 1.015 340 T CA -1.222 60.750 62.100 -0.214 0.000 0.908 340 T CB 0.063 68.782 68.868 -0.249 0.000 1.054 340 T HN -0.440 7.947 8.240 -0.143 -0.233 0.567 341 G N 1.500 110.252 108.800 -0.081 0.000 2.545 341 G HA2 -0.474 3.470 3.960 -0.027 0.000 0.216 341 G HA3 -0.474 3.475 3.960 -0.018 0.000 0.216 341 G C -2.066 172.785 174.900 -0.082 0.000 1.314 341 G CA -0.590 44.482 45.100 -0.046 0.000 0.906 341 G HN -0.507 7.568 8.290 -0.081 0.167 0.563 342 R N 2.370 122.845 120.500 -0.043 0.000 2.442 342 R HA 0.062 4.462 4.340 -0.110 -0.126 0.291 342 R C -0.357 175.892 176.300 -0.085 0.000 1.069 342 R CA 0.271 56.331 56.100 -0.066 0.000 1.022 342 R CB 0.305 30.593 30.300 -0.019 0.000 0.976 342 R HN 0.161 8.429 8.270 -0.003 0.000 0.443 343 V N 7.460 127.308 119.914 -0.111 0.000 2.313 343 V HA 0.167 4.118 4.120 -0.283 0.000 0.278 343 V C -2.048 173.850 176.094 -0.328 0.000 1.017 343 V CA -0.183 61.994 62.300 -0.205 0.000 0.823 343 V CB 0.718 32.532 31.823 -0.014 0.000 1.010 343 V HN 0.847 8.978 8.190 -0.098 0.000 0.443 344 E N 5.720 125.634 120.200 -0.477 0.000 2.393 344 E HA 0.637 4.914 4.350 -0.418 -0.177 0.273 344 E C -1.346 174.872 176.600 -0.636 0.000 0.918 344 E CA -2.321 53.812 56.400 -0.444 0.000 0.773 344 E CB 5.110 34.723 29.700 -0.144 0.000 1.275 344 E HN -0.007 8.095 8.360 -0.431 0.000 0.451 345 F N -1.789 118.188 119.950 0.044 0.000 2.546 345 F HA 0.753 5.504 4.527 0.035 -0.203 0.320 345 F C 0.174 175.996 175.800 0.037 0.000 1.076 345 F CA -1.482 56.538 58.000 0.033 0.000 0.928 345 F CB 3.076 42.086 39.000 0.015 0.000 1.189 345 F HN 0.313 8.607 8.300 -0.011 0.000 0.465 346 N N 1.800 120.642 118.700 0.237 0.000 2.495 346 N HA 0.150 4.964 4.740 0.124 0.000 0.294 346 N C 0.778 176.367 175.510 0.131 0.000 1.276 346 N CA -1.109 52.030 53.050 0.148 0.000 0.973 346 N CB 0.708 39.265 38.487 0.118 0.000 1.143 346 N HN 0.273 8.807 8.380 0.256 0.000 0.589 347 S N -3.919 111.837 115.700 0.094 0.000 2.603 347 S HA -0.142 4.380 4.470 0.087 0.000 0.229 347 S C 0.472 175.119 174.600 0.077 0.000 0.972 347 S CA 2.105 60.354 58.200 0.082 0.000 0.935 347 S CB -0.600 62.639 63.200 0.066 0.000 0.769 347 S HN 0.314 8.674 8.310 0.084 0.000 0.536 348 K N -0.258 120.187 120.400 0.074 0.000 2.374 348 K HA 0.061 4.413 4.320 0.053 0.000 0.196 348 K C 0.200 176.816 176.600 0.026 0.000 1.023 348 K CA -0.156 56.164 56.287 0.055 0.000 1.103 348 K CB 0.529 33.063 32.500 0.058 0.000 0.848 348 K HN -0.410 8.118 8.250 0.085 -0.227 0.528 349 G N -0.057 108.762 108.800 0.031 0.000 2.143 349 G HA2 -0.487 3.415 3.960 -0.097 0.000 0.248 349 G HA3 -0.487 3.378 3.960 -0.158 0.000 0.248 349 G C -1.246 173.683 174.900 0.048 0.000 0.991 349 G CA 0.606 45.668 45.100 -0.063 0.000 0.689 349 G HN -0.027 8.186 8.290 0.069 0.118 0.522 350 Q N -0.840 119.059 119.800 0.165 0.000 2.230 350 Q HA 0.207 4.654 4.340 0.180 0.000 0.248 350 Q C 0.115 176.298 176.000 0.304 0.000 0.915 350 Q CA -1.188 54.739 55.803 0.207 0.000 0.900 350 Q CB 1.725 30.552 28.738 0.149 0.000 1.229 350 Q HN -0.429 8.185 8.270 0.149 -0.255 0.439 351 R N 2.339 122.963 120.500 0.207 0.000 2.585 351 R HA 0.032 4.542 4.340 -0.074 -0.214 0.275 351 R C 0.124 176.539 176.300 0.192 0.000 1.018 351 R CA 0.709 56.816 56.100 0.011 0.000 1.072 351 R CB -0.021 30.023 30.300 -0.427 0.000 0.953 351 R HN 0.314 8.677 8.270 0.155 0.000 0.419 352 T N 0.130 114.784 114.554 0.167 0.000 2.865 352 T HA 0.163 4.700 4.350 0.311 0.000 0.294 352 T C -1.151 173.664 174.700 0.191 0.000 1.119 352 T CA -1.879 60.355 62.100 0.223 0.000 1.007 352 T CB 2.473 71.409 68.868 0.113 0.000 1.225 352 T HN -0.027 8.232 8.240 0.032 0.000 0.515 353 N N 1.659 120.407 118.700 0.080 0.000 2.725 353 N HA -0.401 4.315 4.740 -0.040 0.000 0.251 353 N C -2.184 173.375 175.510 0.082 0.000 1.031 353 N CA 1.382 54.444 53.050 0.020 0.000 0.720 353 N CB -1.773 36.718 38.487 0.006 0.000 0.930 353 N HN 0.078 8.475 8.380 0.028 0.000 0.543 354 Y N -7.326 112.936 120.300 -0.064 0.000 2.698 354 Y HA 0.442 4.957 4.550 -0.058 0.000 0.332 354 Y C -2.167 173.683 175.900 -0.083 0.000 1.119 354 Y CA -3.053 55.009 58.100 -0.062 0.000 1.109 354 Y CB 2.476 40.900 38.460 -0.061 0.000 1.308 354 Y HN -0.487 7.734 8.280 -0.098 0.000 0.499 355 T N -2.934 111.568 114.554 -0.086 0.000 2.906 355 T HA 0.725 4.939 4.350 -0.469 -0.145 0.295 355 T C -1.293 173.420 174.700 0.021 0.000 1.075 355 T CA -2.084 59.863 62.100 -0.255 0.000 1.005 355 T CB 3.128 71.782 68.868 -0.358 0.000 1.136 355 T HN -0.088 8.231 8.240 0.131 0.000 0.498 356 L N 1.337 122.596 121.223 0.059 0.000 2.325 356 L HA 0.508 5.041 4.340 0.131 -0.115 0.281 356 L C -0.907 176.033 176.870 0.117 0.000 1.004 356 L CA -1.292 53.634 54.840 0.144 0.000 0.823 356 L CB 2.466 44.607 42.059 0.138 0.000 1.236 356 L HN 0.353 8.609 8.230 0.044 0.000 0.415 357 R N 2.780 123.337 120.500 0.094 0.000 2.491 357 R HA 0.013 4.368 4.340 0.025 0.000 0.283 357 R C -0.489 175.874 176.300 0.106 0.000 1.072 357 R CA 0.554 56.695 56.100 0.068 0.000 1.048 357 R CB 0.665 30.998 30.300 0.056 0.000 0.983 357 R HN 0.149 8.474 8.270 0.092 0.000 0.450 358 I N 3.995 124.593 120.570 0.047 0.000 2.321 358 I HA 0.366 4.598 4.170 -0.166 -0.161 0.291 358 I C -1.277 174.785 176.117 -0.092 0.000 0.998 358 I CA -0.472 60.784 61.300 -0.073 0.000 1.227 358 I CB 0.767 38.730 38.000 -0.062 0.000 1.368 358 I HN 0.458 8.585 8.210 0.035 0.104 0.466 359 L N 6.195 127.311 121.223 -0.179 0.000 2.342 359 L HA 0.767 5.305 4.340 0.048 -0.169 0.271 359 L C -1.376 175.489 176.870 -0.009 0.000 1.008 359 L CA -1.926 52.902 54.840 -0.020 0.000 0.818 359 L CB 3.199 45.302 42.059 0.072 0.000 1.296 359 L HN 0.641 8.662 8.230 -0.348 0.000 0.427 360 E N 0.963 121.244 120.200 0.136 0.000 2.222 360 E HA 0.592 5.217 4.350 0.168 -0.175 0.267 360 E C -0.720 176.036 176.600 0.260 0.000 0.884 360 E CA -2.291 54.213 56.400 0.174 0.000 0.764 360 E CB 4.069 33.831 29.700 0.104 0.000 1.169 360 E HN 0.319 8.771 8.360 0.154 0.000 0.413 361 K N 6.300 126.868 120.400 0.280 0.000 2.382 361 K HA 0.071 4.638 4.320 0.181 -0.137 0.275 361 K C -0.363 176.304 176.600 0.112 0.000 1.009 361 K CA -0.324 56.065 56.287 0.169 0.000 0.970 361 K CB -0.030 32.517 32.500 0.078 0.000 0.934 361 K HN -0.055 8.389 8.250 0.325 0.000 0.479 362 S N 0.749 116.498 115.700 0.080 0.000 2.811 362 S HA 0.321 4.821 4.470 0.050 0.000 0.311 362 S C 1.145 175.760 174.600 0.025 0.000 1.152 362 S CA -1.398 56.831 58.200 0.048 0.000 0.864 362 S CB 2.298 65.522 63.200 0.041 0.000 1.226 362 S HN 0.111 8.357 8.310 0.081 0.113 0.541 363 R N -1.243 119.266 120.500 0.015 0.000 2.115 363 R HA -0.269 4.074 4.340 0.006 0.000 0.239 363 R C 1.831 178.129 176.300 -0.004 0.000 1.133 363 R CA 2.849 58.952 56.100 0.005 0.000 0.935 363 R CB -1.632 28.669 30.300 0.003 0.000 0.853 363 R HN 0.447 8.728 8.270 0.017 0.000 0.433 364 Q N -1.299 118.494 119.800 -0.013 0.000 2.432 364 Q HA -0.049 4.274 4.340 -0.028 0.000 0.205 364 Q C 0.089 176.063 176.000 -0.043 0.000 0.945 364 Q CA 0.665 56.449 55.803 -0.030 0.000 0.924 364 Q CB 0.134 28.848 28.738 -0.039 0.000 1.016 364 Q HN 0.221 8.484 8.270 -0.012 0.000 0.503 365 G N -2.301 106.478 108.800 -0.035 0.000 2.070 365 G HA2 -0.109 3.865 3.960 0.022 0.000 0.076 365 G HA3 -0.109 3.766 3.960 -0.142 0.000 0.076 365 G C -2.743 172.161 174.900 0.007 0.000 0.735 365 G CA 0.423 45.494 45.100 -0.048 0.000 1.158 365 G HN -0.378 7.865 8.290 -0.016 0.037 0.393 366 H N -1.328 117.753 119.070 0.018 0.000 3.008 366 H HA 0.970 5.693 4.556 0.052 -0.136 0.354 366 H C -1.578 173.780 175.328 0.050 0.000 1.252 366 H CA -1.517 54.559 56.048 0.046 0.000 1.117 366 H CB 3.102 32.908 29.762 0.074 0.000 1.857 366 H HN -0.017 7.964 8.280 -0.499 0.000 0.547 367 R N -2.255 118.372 120.500 0.212 0.000 2.744 367 R HA 0.300 4.709 4.340 0.115 0.000 0.279 367 R C -2.129 174.264 176.300 0.155 0.000 0.977 367 R CA -1.536 54.647 56.100 0.138 0.000 0.906 367 R CB 3.117 33.460 30.300 0.072 0.000 1.197 367 R HN 0.566 8.978 8.270 0.237 0.000 0.463 368 E N 4.442 124.713 120.200 0.119 0.000 2.259 368 E HA 0.078 4.616 4.350 0.086 -0.137 0.281 368 E C 0.128 176.759 176.600 0.053 0.000 1.037 368 E CA 0.580 57.030 56.400 0.083 0.000 0.854 368 E CB 0.575 30.316 29.700 0.068 0.000 1.051 368 E HN 0.360 8.783 8.360 0.104 0.000 0.409 369 I N 0.832 121.423 120.570 0.036 0.000 4.154 369 I HA 0.540 4.729 4.170 0.032 0.000 0.334 369 I C -0.545 175.584 176.117 0.019 0.000 1.371 369 I CA -0.751 60.566 61.300 0.027 0.000 1.110 369 I CB 1.112 39.127 38.000 0.026 0.000 1.085 369 I HN 0.524 8.749 8.210 0.027 0.000 0.398 370 G N -0.336 108.473 108.800 0.016 0.000 2.313 370 G HA2 0.046 4.020 3.960 0.024 0.000 0.296 370 G HA3 0.046 4.019 3.960 0.021 0.000 0.296 370 G C -3.252 171.652 174.900 0.007 0.000 1.356 370 G CA 0.523 45.634 45.100 0.018 0.000 0.833 370 G HN -0.770 7.530 8.290 0.016 0.000 0.552 371 V N -0.727 119.180 119.914 -0.012 0.000 2.686 371 V HA 0.359 4.578 4.120 -0.068 -0.140 0.306 371 V C -1.448 174.575 176.094 -0.118 0.000 1.065 371 V CA -0.956 61.271 62.300 -0.121 0.000 0.894 371 V CB 3.485 35.110 31.823 -0.329 0.000 1.004 371 V HN 0.183 8.379 8.190 0.010 0.000 0.424 372 W N 8.200 129.344 121.300 -0.259 0.000 2.390 372 W HA 0.264 4.849 4.660 -0.124 0.000 0.312 372 W C -2.264 174.007 176.519 -0.413 0.000 1.123 372 W CA -1.017 56.195 57.345 -0.221 0.000 1.202 372 W CB 2.493 31.875 29.460 -0.130 0.000 1.251 372 W HN 0.650 8.897 8.180 0.111 0.000 0.511 373 Y N 6.949 126.632 120.300 -1.028 0.000 2.341 373 Y HA 0.167 4.236 4.550 -0.803 0.000 0.337 373 Y C 0.649 175.509 175.900 -1.734 0.000 1.014 373 Y CA -0.948 56.534 58.100 -1.030 0.000 1.111 373 Y CB 1.189 39.294 38.460 -0.591 0.000 1.194 373 Y HN 0.173 7.938 8.280 -0.859 0.000 0.462 374 S N 4.053 118.919 115.700 -1.390 0.000 2.474 374 S HA -0.297 3.211 4.470 -1.603 0.000 0.235 374 S C -0.266 174.013 174.600 -0.534 0.000 0.997 374 S CA 1.332 58.842 58.200 -1.149 0.000 0.949 374 S CB 0.201 62.898 63.200 -0.838 0.000 0.766 374 S HN 0.300 7.938 8.310 -1.120 0.000 0.517 375 N N 0.000 118.451 118.700 -0.416 0.000 1.763 375 N HA 0.000 4.632 4.740 -0.180 0.000 0.220 375 N CA 0.000 52.909 53.050 -0.235 0.000 0.885 375 N CB 0.000 38.385 38.487 -0.170 0.000 1.341 375 N HN 0.000 8.070 8.380 -0.430 0.052 0.667