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 2jiz_1_C DATA FIRST_RESID 16 DATA SEQUENCE ILGADTSVDL EETGRVLSIG DGIARVHGLR NVQAEEMVEF SSGLKGMSLN DATA SEQUENCE LEPDNVGVVV FGNDKLIKEG DIVKRTGAIV DVPVGEELLG RVVDALGNAI DATA SEQUENCE DGKGPIGSKA RRRVGLKAPG IIPRISVREP MQTGIKAVDS LVPIGRGQRE DATA SEQUENCE LIIGDRQTGK TSIAIDTIIN QKRFNDGTDE KKKLYCIYVA IGQKRSTVAQ DATA SEQUENCE LVKRLTDADA MKYTIVVSAT ASDAAPLQYL APYSGCSMGE YFRDNGKHAL DATA SEQUENCE IIYDDLSKQA VAYRQMSLLL RRPPGREAYP GDVFYLHSRL LERAAKMNDA DATA SEQUENCE FGGGSLTALP VIETQAGDVS AYIPTNVISI TDGQIFLETE LFYKGIRPAI DATA SEQUENCE NVGLSVSRVG SAAQTRAMKQ VAGTMKLELA QYREVAAFAQ FGSDLDAATQ DATA SEQUENCE QLLSRGVRLT ELLKQGQYSP MAIEEQVAVI YAGVRGYLDK LEPSKITKFE DATA SEQUENCE NAFLSHVISQ HQALLSKIRT DGKISEESDA KLKEIVTNFL AGFEA 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 16 I HA 0.000 4.170 4.170 0.000 0.000 0.288 16 I C 0.000 176.118 176.117 0.002 0.000 1.063 16 I CA 0.000 61.301 61.300 0.002 0.000 1.566 16 I CB 0.000 38.001 38.000 0.002 0.000 1.214 17 L N 4.623 125.847 121.223 0.002 0.000 2.399 17 L HA 0.771 5.108 4.340 -0.004 0.000 0.266 17 L C 0.940 177.811 176.870 0.002 0.000 1.114 17 L CA 0.429 55.270 54.840 0.002 0.000 0.804 17 L CB 1.391 43.452 42.059 0.002 0.000 1.146 17 L HN 0.673 8.903 8.230 0.000 0.000 0.451 18 G N 2.967 111.768 108.800 0.002 0.000 2.340 18 G HA2 0.409 4.366 3.960 -0.004 0.000 0.245 18 G HA3 0.409 4.366 3.960 -0.004 0.000 0.245 18 G C -0.168 174.734 174.900 0.003 0.000 1.294 18 G CA 0.047 45.148 45.100 0.002 0.000 0.896 18 G HN 1.019 9.309 8.290 0.000 0.000 0.522 19 A N 2.379 125.200 122.820 0.003 0.000 2.425 19 A HA 0.351 4.669 4.320 -0.004 0.000 0.242 19 A C 0.532 178.118 177.584 0.003 0.000 1.077 19 A CA -0.257 51.782 52.037 0.003 0.000 0.781 19 A CB 0.437 19.439 19.000 0.003 0.000 1.020 19 A HN 0.658 8.808 8.150 0.000 0.000 0.494 20 D N 1.282 121.685 120.400 0.004 0.000 2.365 20 D HA 0.225 4.862 4.640 -0.004 0.000 0.237 20 D C 1.192 177.495 176.300 0.004 0.000 1.190 20 D CA 0.556 54.558 54.000 0.004 0.000 0.867 20 D CB 0.650 41.453 40.800 0.005 0.000 1.050 20 D HN 0.500 8.870 8.370 0.000 0.000 0.491 21 T N -0.656 113.900 114.554 0.003 0.000 3.069 21 T HA -0.027 4.321 4.350 -0.004 0.000 0.252 21 T C 1.657 176.357 174.700 0.000 0.000 1.053 21 T CA 0.261 62.362 62.100 0.001 0.000 0.964 21 T CB -0.171 68.697 68.868 0.000 0.000 1.005 21 T HN 0.232 8.472 8.240 0.000 0.000 0.532 22 S N 0.682 116.383 115.700 0.001 0.000 2.500 22 S HA 0.021 4.488 4.470 -0.004 0.000 0.239 22 S C 1.167 175.766 174.600 -0.001 0.000 0.989 22 S CA 0.195 58.395 58.200 -0.000 0.000 0.951 22 S CB -0.443 62.758 63.200 0.002 0.000 0.759 22 S HN 0.348 8.658 8.310 0.000 0.000 0.523 23 V N 2.816 122.730 119.914 0.001 0.000 2.838 23 V HA 0.199 4.317 4.120 -0.004 0.000 0.363 23 V C -0.242 175.852 176.094 0.001 0.000 1.324 23 V CA -0.387 61.913 62.300 0.002 0.000 1.220 23 V CB -0.345 31.483 31.823 0.008 0.000 1.328 23 V HN 0.637 8.827 8.190 0.000 0.000 0.595 24 D N -0.434 119.964 120.400 -0.005 0.000 2.368 24 D HA 0.071 4.708 4.640 -0.004 0.000 0.240 24 D C 0.954 177.243 176.300 -0.019 0.000 1.169 24 D CA -0.089 53.906 54.000 -0.008 0.000 0.906 24 D CB 0.938 41.732 40.800 -0.010 0.000 1.187 24 D HN 0.191 8.561 8.370 0.000 0.000 0.435 25 L N 0.305 121.512 121.223 -0.027 0.000 2.645 25 L HA 0.098 4.436 4.340 -0.004 0.000 0.235 25 L C 1.552 178.378 176.870 -0.073 0.000 1.150 25 L CA 0.339 55.144 54.840 -0.060 0.000 0.911 25 L CB -0.518 41.491 42.059 -0.083 0.000 1.077 25 L HN 0.523 8.753 8.230 0.000 0.000 0.438 26 E N -0.255 119.915 120.200 -0.050 0.000 2.127 26 E HA -0.064 4.283 4.350 -0.004 0.000 0.191 26 E C 1.661 178.234 176.600 -0.045 0.000 0.964 26 E CA 0.462 56.834 56.400 -0.047 0.000 0.832 26 E CB 0.444 30.124 29.700 -0.033 0.000 0.790 26 E HN 0.239 8.599 8.360 0.000 0.000 0.465 27 E N -0.077 120.100 120.200 -0.038 0.000 2.460 27 E HA 0.059 4.406 4.350 -0.004 0.000 0.200 27 E C 0.474 177.047 176.600 -0.045 0.000 1.011 27 E CA 0.522 56.900 56.400 -0.037 0.000 0.912 27 E CB 0.987 30.671 29.700 -0.027 0.000 0.953 27 E HN 0.259 8.619 8.360 0.000 0.000 0.494 28 T N -2.691 111.834 114.554 -0.047 0.000 2.838 28 T HA 0.791 5.139 4.350 -0.004 0.000 0.292 28 T C 0.263 174.929 174.700 -0.057 0.000 1.113 28 T CA -0.538 61.531 62.100 -0.052 0.000 1.008 28 T CB 2.486 71.334 68.868 -0.033 0.000 1.259 28 T HN -0.003 8.237 8.240 0.000 0.000 0.520 29 G N -0.232 108.537 108.800 -0.052 0.000 2.788 29 G HA2 0.712 4.669 3.960 -0.004 0.000 0.293 29 G HA3 0.712 4.669 3.960 -0.004 0.000 0.293 29 G C -1.778 173.130 174.900 0.013 0.000 1.392 29 G CA -1.152 43.929 45.100 -0.032 0.000 0.810 29 G HN 0.803 9.093 8.290 0.000 0.000 0.508 30 R N -0.757 119.784 120.500 0.068 0.000 2.621 30 R HA 0.523 4.860 4.340 -0.004 0.000 0.284 30 R C -0.884 175.477 176.300 0.103 0.000 0.998 30 R CA -0.718 55.434 56.100 0.086 0.000 0.895 30 R CB 2.715 33.073 30.300 0.097 0.000 1.195 30 R HN 0.349 8.619 8.270 0.000 0.000 0.450 31 V N 5.164 125.140 119.914 0.104 0.000 2.529 31 V HA -0.019 4.099 4.120 -0.004 0.000 0.292 31 V C 1.364 177.504 176.094 0.077 0.000 1.028 31 V CA 0.497 62.865 62.300 0.113 0.000 1.074 31 V CB 0.687 32.598 31.823 0.147 0.000 0.958 31 V HN 0.737 8.927 8.190 0.000 0.000 0.481 32 L N 3.836 125.101 121.223 0.071 0.000 2.168 32 L HA 0.125 4.462 4.340 -0.004 0.000 0.203 32 L C 0.951 177.838 176.870 0.027 0.000 1.078 32 L CA 0.903 55.767 54.840 0.041 0.000 0.780 32 L CB 0.113 42.199 42.059 0.046 0.000 0.939 32 L HN 0.849 9.079 8.230 0.000 0.000 0.451 33 S N -1.161 114.559 115.700 0.034 0.000 2.570 33 S HA 0.658 5.125 4.470 -0.004 0.000 0.270 33 S C -1.049 173.564 174.600 0.021 0.000 1.149 33 S CA -0.762 57.450 58.200 0.019 0.000 0.837 33 S CB 2.705 65.911 63.200 0.010 0.000 1.124 33 S HN 0.011 8.321 8.310 0.000 0.000 0.465 34 I N 0.196 120.766 120.570 0.001 0.000 2.649 34 I HA 0.803 4.970 4.170 -0.004 0.000 0.289 34 I C -0.581 175.518 176.117 -0.029 0.000 1.222 34 I CA 0.346 61.636 61.300 -0.017 0.000 1.046 34 I CB 1.498 39.477 38.000 -0.036 0.000 1.272 34 I HN 1.280 9.490 8.210 0.000 0.000 0.425 35 G N 4.549 113.328 108.800 -0.035 0.000 2.733 35 G HA2 0.437 4.394 3.960 -0.004 0.000 0.297 35 G HA3 0.437 4.394 3.960 -0.004 0.000 0.297 35 G C -1.169 173.707 174.900 -0.040 0.000 1.452 35 G CA -0.512 44.567 45.100 -0.036 0.000 0.940 35 G HN 0.664 8.954 8.290 0.000 0.000 0.547 36 D N 0.112 120.488 120.400 -0.041 0.000 2.751 36 D HA -0.206 4.431 4.640 -0.004 0.000 0.233 36 D C 1.616 177.887 176.300 -0.048 0.000 1.149 36 D CA 2.608 56.584 54.000 -0.040 0.000 0.682 36 D CB -1.092 39.687 40.800 -0.036 0.000 1.068 36 D HN 2.172 10.542 8.370 0.000 0.000 0.429 37 G N -0.922 107.841 108.800 -0.061 0.000 2.162 37 G HA2 -0.304 3.653 3.960 -0.004 0.000 0.260 37 G HA3 -0.304 3.653 3.960 -0.004 0.000 0.260 37 G C 0.212 175.066 174.900 -0.077 0.000 0.976 37 G CA 0.326 45.380 45.100 -0.077 0.000 0.655 37 G HN 0.479 8.769 8.290 0.000 0.000 0.533 38 I N 1.238 121.773 120.570 -0.058 0.000 2.330 38 I HA 0.671 4.838 4.170 -0.004 0.000 0.289 38 I C 0.632 176.743 176.117 -0.011 0.000 1.001 38 I CA -1.169 60.109 61.300 -0.037 0.000 1.193 38 I CB 0.787 38.766 38.000 -0.036 0.000 1.345 38 I HN 0.313 8.523 8.210 0.000 0.000 0.461 39 A N 7.981 130.823 122.820 0.036 0.000 2.290 39 A HA 0.718 5.035 4.320 -0.004 0.000 0.310 39 A C 0.032 177.664 177.584 0.079 0.000 1.202 39 A CA -0.701 51.392 52.037 0.093 0.000 0.837 39 A CB 0.769 19.928 19.000 0.264 0.000 1.139 39 A HN 0.566 8.716 8.150 0.000 0.000 0.509 40 R N 1.781 122.319 120.500 0.063 0.000 2.295 40 R HA 0.499 4.836 4.340 -0.004 0.000 0.324 40 R C -1.270 175.072 176.300 0.070 0.000 0.968 40 R CA -0.435 55.695 56.100 0.051 0.000 0.837 40 R CB 1.326 31.646 30.300 0.034 0.000 1.133 40 R HN 0.437 8.707 8.270 0.000 0.000 0.450 41 V N 3.379 123.330 119.914 0.060 0.000 2.409 41 V HA 0.167 4.284 4.120 -0.004 0.000 0.291 41 V C -0.010 176.126 176.094 0.072 0.000 1.020 41 V CA -1.010 61.328 62.300 0.064 0.000 0.848 41 V CB 1.398 33.232 31.823 0.018 0.000 0.990 41 V HN 0.703 8.893 8.190 0.000 0.000 0.430 42 H N 3.440 122.511 119.070 0.003 0.000 2.652 42 H HA 0.601 5.154 4.556 -0.005 0.000 0.349 42 H C 0.714 176.037 175.328 -0.009 0.000 1.099 42 H CA 1.630 57.677 56.048 -0.002 0.000 1.417 42 H CB 1.027 30.790 29.762 0.002 0.000 1.457 42 H HN 1.096 9.376 8.280 0.000 0.000 0.568 43 G N 2.955 111.397 108.800 -0.596 0.000 2.520 43 G HA2 -0.257 3.701 3.960 -0.004 0.000 0.248 43 G HA3 -0.257 3.701 3.960 -0.004 0.000 0.248 43 G C 0.115 174.900 174.900 -0.191 0.000 1.161 43 G CA -0.297 44.560 45.100 -0.405 0.000 0.946 43 G HN 1.218 9.508 8.290 0.000 0.000 0.565 44 L N -0.119 121.026 121.223 -0.129 0.000 3.742 44 L HA -0.237 4.101 4.340 -0.004 0.000 0.431 44 L C 2.301 179.123 176.870 -0.081 0.000 1.220 44 L CA 0.876 55.661 54.840 -0.092 0.000 0.863 44 L CB -0.725 41.283 42.059 -0.084 0.000 1.751 44 L HN 0.637 8.867 8.230 0.000 0.000 0.922 45 R N -0.060 120.388 120.500 -0.087 0.000 2.159 45 R HA -0.093 4.245 4.340 -0.004 0.000 0.237 45 R C 1.459 177.731 176.300 -0.047 0.000 1.131 45 R CA 1.395 57.454 56.100 -0.069 0.000 0.982 45 R CB -0.457 29.802 30.300 -0.068 0.000 0.868 45 R HN 0.577 8.847 8.270 0.000 0.000 0.453 46 N N 0.564 119.238 118.700 -0.042 0.000 2.398 46 N HA -0.010 4.727 4.740 -0.004 0.000 0.188 46 N C 0.250 175.743 175.510 -0.028 0.000 1.122 46 N CA 0.122 53.153 53.050 -0.031 0.000 0.866 46 N CB 0.131 38.602 38.487 -0.027 0.000 0.970 46 N HN 0.054 8.434 8.380 0.000 0.000 0.462 47 V N -0.303 119.590 119.914 -0.034 0.000 2.872 47 V HA 0.051 4.168 4.120 -0.004 0.000 0.307 47 V C 0.496 176.579 176.094 -0.018 0.000 1.072 47 V CA -0.544 61.738 62.300 -0.029 0.000 1.148 47 V CB 0.325 32.126 31.823 -0.036 0.000 0.954 47 V HN 0.073 8.263 8.190 0.000 0.000 0.490 48 Q N 2.107 121.900 119.800 -0.011 0.000 2.227 48 Q HA 0.666 5.003 4.340 -0.004 0.000 0.245 48 Q C 0.247 176.247 176.000 0.001 0.000 0.926 48 Q CA -0.429 55.372 55.803 -0.003 0.000 0.895 48 Q CB 1.493 30.232 28.738 0.002 0.000 1.230 48 Q HN 1.113 9.383 8.270 0.000 0.000 0.450 49 A N 1.814 124.638 122.820 0.006 0.000 2.524 49 A HA 0.028 4.345 4.320 -0.004 0.000 0.250 49 A C 0.114 177.711 177.584 0.021 0.000 1.078 49 A CA 0.349 52.394 52.037 0.013 0.000 0.761 49 A CB -0.298 18.712 19.000 0.016 0.000 1.012 49 A HN 0.963 9.113 8.150 0.000 0.000 0.500 50 E N -0.536 119.681 120.200 0.029 0.000 3.763 50 E HA -0.198 4.150 4.350 -0.004 0.000 0.319 50 E C 0.161 176.793 176.600 0.053 0.000 0.804 50 E CA 1.172 57.600 56.400 0.046 0.000 1.196 50 E CB -1.419 28.304 29.700 0.039 0.000 1.607 50 E HN 0.942 9.302 8.360 0.000 0.000 0.431 51 E N 0.711 120.933 120.200 0.037 0.000 2.354 51 E HA 0.261 4.609 4.350 -0.004 0.000 0.269 51 E C -0.097 176.536 176.600 0.055 0.000 1.036 51 E CA -0.418 56.003 56.400 0.036 0.000 0.876 51 E CB 0.660 30.367 29.700 0.011 0.000 1.009 51 E HN 0.036 8.396 8.360 0.000 0.000 0.416 52 M N 5.192 124.834 119.600 0.070 0.000 2.200 52 M HA 0.155 4.633 4.480 -0.004 0.000 0.355 52 M C -1.015 175.304 176.300 0.032 0.000 1.283 52 M CA -0.236 55.123 55.300 0.098 0.000 1.124 52 M CB 0.886 33.553 32.600 0.111 0.000 1.625 52 M HN 0.350 8.640 8.290 0.000 0.000 0.463 53 V N 1.763 121.679 119.914 0.004 0.000 3.103 53 V HA 0.750 4.867 4.120 -0.004 0.000 0.318 53 V C -0.815 175.213 176.094 -0.110 0.000 1.114 53 V CA -0.821 61.421 62.300 -0.096 0.000 1.020 53 V CB 2.066 33.767 31.823 -0.204 0.000 1.085 53 V HN 0.832 9.022 8.190 0.000 0.000 0.446 54 E N 0.994 121.087 120.200 -0.178 0.000 2.234 54 E HA 0.567 4.914 4.350 -0.004 0.000 0.266 54 E C -1.751 174.722 176.600 -0.212 0.000 0.877 54 E CA -0.396 55.946 56.400 -0.096 0.000 0.758 54 E CB 2.409 32.102 29.700 -0.011 0.000 1.170 54 E HN 0.631 8.991 8.360 0.000 0.000 0.415 55 F N 0.886 120.855 119.950 0.031 0.000 2.377 55 F HA 0.064 4.588 4.527 -0.005 0.000 0.328 55 F C 1.931 177.744 175.800 0.023 0.000 1.094 55 F CA -0.293 57.721 58.000 0.023 0.000 1.093 55 F CB 1.380 40.392 39.000 0.021 0.000 1.214 55 F HN 0.500 8.800 8.300 0.000 0.000 0.518 56 S N -0.738 115.085 115.700 0.205 0.000 2.420 56 S HA -0.214 4.253 4.470 -0.004 0.000 0.237 56 S C 1.593 176.259 174.600 0.110 0.000 1.023 56 S CA 1.413 59.685 58.200 0.119 0.000 0.991 56 S CB -0.858 62.398 63.200 0.093 0.000 0.792 56 S HN 0.639 8.949 8.310 0.000 0.000 0.488 57 S N 0.613 116.394 115.700 0.136 0.000 2.522 57 S HA 0.448 4.915 4.470 -0.004 0.000 0.227 57 S C 1.697 176.351 174.600 0.090 0.000 0.986 57 S CA 0.353 58.606 58.200 0.089 0.000 0.929 57 S CB -0.411 62.822 63.200 0.055 0.000 0.769 57 S HN 1.263 9.573 8.310 0.000 0.000 0.529 58 G N 0.768 109.643 108.800 0.124 0.000 2.195 58 G HA2 -0.215 3.743 3.960 -0.004 0.000 0.224 58 G HA3 -0.215 3.743 3.960 -0.004 0.000 0.224 58 G C -0.022 174.962 174.900 0.140 0.000 0.990 58 G CA -0.153 45.013 45.100 0.110 0.000 0.639 58 G HN 0.457 8.747 8.290 0.000 0.000 0.514 59 L N 0.882 122.213 121.223 0.178 0.000 2.456 59 L HA 0.411 4.748 4.340 -0.004 0.000 0.272 59 L C 0.957 178.045 176.870 0.363 0.000 1.189 59 L CA 0.199 55.167 54.840 0.214 0.000 0.846 59 L CB 0.652 42.769 42.059 0.096 0.000 1.111 59 L HN 0.114 8.344 8.230 0.000 0.000 0.475 60 K N 0.996 121.595 120.400 0.332 0.000 2.139 60 K HA 0.791 5.109 4.320 -0.004 0.000 0.243 60 K C -0.150 176.714 176.600 0.440 0.000 0.983 60 K CA -0.602 55.904 56.287 0.365 0.000 0.890 60 K CB 1.885 34.573 32.500 0.312 0.000 1.090 60 K HN 0.717 8.967 8.250 0.000 0.000 0.445 61 G N 0.517 109.517 108.800 0.334 0.000 2.677 61 G HA2 0.503 4.461 3.960 -0.004 0.000 0.291 61 G HA3 0.503 4.461 3.960 -0.004 0.000 0.291 61 G C -1.855 173.065 174.900 0.032 0.000 1.435 61 G CA -0.756 44.404 45.100 0.101 0.000 0.826 61 G HN 0.473 8.763 8.290 0.000 0.000 0.491 62 M N 1.056 120.563 119.600 -0.156 0.000 2.311 62 M HA 0.525 5.002 4.480 -0.004 0.000 0.325 62 M C -0.400 175.882 176.300 -0.029 0.000 1.061 62 M CA -0.583 54.712 55.300 -0.007 0.000 0.957 62 M CB 1.716 34.346 32.600 0.050 0.000 1.646 62 M HN 0.363 8.653 8.290 0.000 0.000 0.434 63 S N 5.742 121.444 115.700 0.002 0.000 2.416 63 S HA 0.277 4.745 4.470 -0.004 0.000 0.302 63 S C 0.761 175.362 174.600 0.002 0.000 1.120 63 S CA -0.404 57.791 58.200 -0.008 0.000 1.067 63 S CB 0.041 63.234 63.200 -0.012 0.000 1.057 63 S HN 0.720 9.030 8.310 0.000 0.000 0.518 64 L N 2.249 123.468 121.223 -0.007 0.000 2.467 64 L HA 0.263 4.600 4.340 -0.004 0.000 0.213 64 L C 0.020 176.893 176.870 0.004 0.000 1.053 64 L CA 0.339 55.181 54.840 0.002 0.000 0.847 64 L CB 0.071 42.123 42.059 -0.013 0.000 1.075 64 L HN 0.371 8.601 8.230 0.000 0.000 0.479 65 N N 0.905 119.603 118.700 -0.004 0.000 2.444 65 N HA 0.423 5.160 4.740 -0.004 0.000 0.262 65 N C -1.091 174.418 175.510 -0.003 0.000 0.974 65 N CA -0.082 52.967 53.050 -0.002 0.000 0.933 65 N CB 1.433 39.916 38.487 -0.005 0.000 1.137 65 N HN -0.006 8.374 8.380 0.000 0.000 0.498 66 L N 2.073 123.295 121.223 -0.001 0.000 2.276 66 L HA 0.461 4.798 4.340 -0.004 0.000 0.286 66 L C 0.212 177.080 176.870 -0.003 0.000 1.024 66 L CA -0.435 54.402 54.840 -0.005 0.000 0.826 66 L CB 0.872 42.928 42.059 -0.005 0.000 1.211 66 L HN 0.386 8.616 8.230 0.000 0.000 0.422 67 E N 3.375 123.573 120.200 -0.003 0.000 2.249 67 E HA 0.336 4.683 4.350 -0.004 0.000 0.263 67 E C -1.696 174.904 176.600 -0.000 0.000 0.950 67 E CA -1.779 54.622 56.400 0.001 0.000 0.827 67 E CB 1.841 31.543 29.700 0.004 0.000 1.220 67 E HN 0.287 8.647 8.360 0.000 0.000 0.411 68 P HA -0.205 4.215 4.420 0.000 0.000 0.216 68 P C 0.432 177.736 177.300 0.007 0.000 1.154 68 P CA 1.509 64.611 63.100 0.003 0.000 0.865 68 P CB 0.144 31.848 31.700 0.007 0.000 0.789 69 D N -2.475 117.936 120.400 0.019 0.000 2.469 69 D HA 0.059 4.696 4.640 -0.004 0.000 0.213 69 D C 0.031 176.364 176.300 0.056 0.000 1.135 69 D CA -0.246 53.780 54.000 0.044 0.000 0.834 69 D CB -0.778 40.055 40.800 0.056 0.000 1.009 69 D HN 0.364 8.734 8.370 0.000 0.000 0.507 70 N N -1.369 117.347 118.700 0.027 0.000 2.710 70 N HA 0.391 5.128 4.740 -0.004 0.000 0.257 70 N C -1.882 173.631 175.510 0.004 0.000 1.327 70 N CA -0.976 52.090 53.050 0.027 0.000 0.861 70 N CB 1.816 40.328 38.487 0.041 0.000 1.532 70 N HN -0.215 8.165 8.380 0.000 0.000 0.499 71 V N 0.430 120.344 119.914 -0.001 0.000 2.394 71 V HA 0.698 4.816 4.120 -0.004 0.000 0.282 71 V C 0.806 176.902 176.094 0.004 0.000 1.031 71 V CA -0.583 61.713 62.300 -0.007 0.000 0.881 71 V CB 1.110 32.918 31.823 -0.024 0.000 0.982 71 V HN 0.867 9.057 8.190 0.000 0.000 0.451 72 G N 4.072 112.872 108.800 -0.000 0.000 2.356 72 G HA2 0.492 4.449 3.960 -0.004 0.000 0.300 72 G HA3 0.492 4.449 3.960 -0.004 0.000 0.300 72 G C -0.596 174.300 174.900 -0.006 0.000 1.107 72 G CA -0.148 44.951 45.100 -0.001 0.000 0.960 72 G HN 0.528 8.818 8.290 0.000 0.000 0.418 73 V N 3.372 123.293 119.914 0.012 0.000 2.435 73 V HA 0.325 4.443 4.120 -0.004 0.000 0.290 73 V C 0.057 176.147 176.094 -0.006 0.000 1.030 73 V CA -0.781 61.527 62.300 0.014 0.000 0.881 73 V CB 1.851 33.720 31.823 0.077 0.000 0.983 73 V HN 0.431 8.621 8.190 0.000 0.000 0.445 74 V N 5.714 125.572 119.914 -0.092 0.000 2.370 74 V HA 0.342 4.459 4.120 -0.004 0.000 0.279 74 V C -0.082 175.829 176.094 -0.304 0.000 1.029 74 V CA -0.351 61.837 62.300 -0.186 0.000 0.870 74 V CB 1.999 33.687 31.823 -0.224 0.000 0.984 74 V HN 0.649 8.839 8.190 0.000 0.000 0.451 75 V N 6.757 126.542 119.914 -0.215 0.000 2.385 75 V HA 0.296 4.413 4.120 -0.004 0.000 0.269 75 V C 0.231 176.235 176.094 -0.150 0.000 1.043 75 V CA -0.175 62.026 62.300 -0.165 0.000 0.906 75 V CB 0.881 32.603 31.823 -0.168 0.000 0.995 75 V HN 0.758 8.948 8.190 0.000 0.000 0.467 76 F N 4.652 124.661 119.950 0.099 0.000 2.705 76 F HA 0.524 5.049 4.527 -0.003 0.000 0.355 76 F C 1.258 177.092 175.800 0.057 0.000 1.172 76 F CA 0.488 58.540 58.000 0.087 0.000 1.332 76 F CB 0.076 39.136 39.000 0.101 0.000 1.621 76 F HN 0.755 9.055 8.300 0.000 0.000 0.605 77 G N 0.020 108.917 108.800 0.161 0.000 2.344 77 G HA2 -0.061 3.897 3.960 -0.004 0.000 0.282 77 G HA3 -0.061 3.897 3.960 -0.004 0.000 0.282 77 G C -1.735 173.178 174.900 0.022 0.000 1.281 77 G CA -1.107 44.048 45.100 0.092 0.000 0.877 77 G HN 0.042 8.332 8.290 0.000 0.000 0.494 78 N N 1.019 119.721 118.700 0.002 0.000 2.513 78 N HA 0.209 4.947 4.740 -0.004 0.000 0.268 78 N C 0.531 175.995 175.510 -0.076 0.000 1.180 78 N CA 0.433 53.467 53.050 -0.026 0.000 0.948 78 N CB 1.466 39.944 38.487 -0.014 0.000 1.083 78 N HN 0.580 8.960 8.380 0.000 0.000 0.455 79 D N 2.492 122.837 120.400 -0.092 0.000 2.339 79 D HA -0.077 4.560 4.640 -0.004 0.000 0.217 79 D C 1.150 177.377 176.300 -0.122 0.000 1.050 79 D CA 0.403 54.313 54.000 -0.149 0.000 0.856 79 D CB -0.111 40.603 40.800 -0.143 0.000 0.922 79 D HN 0.728 9.098 8.370 0.000 0.000 0.518 80 K N 0.451 120.805 120.400 -0.078 0.000 2.280 80 K HA -0.085 4.233 4.320 -0.004 0.000 0.202 80 K C 1.392 177.959 176.600 -0.055 0.000 1.047 80 K CA 0.830 57.084 56.287 -0.056 0.000 0.942 80 K CB -0.317 32.163 32.500 -0.034 0.000 0.739 80 K HN 0.114 8.364 8.250 0.000 0.000 0.457 81 L N 1.217 122.399 121.223 -0.068 0.000 2.509 81 L HA 0.207 4.544 4.340 -0.004 0.000 0.222 81 L C 0.749 177.580 176.870 -0.065 0.000 1.123 81 L CA 0.230 55.040 54.840 -0.051 0.000 0.856 81 L CB -0.071 41.967 42.059 -0.035 0.000 0.985 81 L HN 0.109 8.339 8.230 0.000 0.000 0.456 82 I N 0.517 121.012 120.570 -0.126 0.000 2.496 82 I HA 0.098 4.265 4.170 -0.004 0.000 0.285 82 I C 0.227 176.309 176.117 -0.059 0.000 1.080 82 I CA 0.295 61.516 61.300 -0.132 0.000 1.404 82 I CB 0.335 38.150 38.000 -0.308 0.000 1.403 82 I HN 0.050 8.260 8.210 0.000 0.000 0.539 83 K N 5.296 125.690 120.400 -0.009 0.000 2.385 83 K HA 0.324 4.641 4.320 -0.004 0.000 0.248 83 K C -0.559 176.058 176.600 0.028 0.000 0.955 83 K CA -0.997 55.293 56.287 0.005 0.000 0.816 83 K CB 2.097 34.603 32.500 0.009 0.000 1.250 83 K HN 0.526 8.776 8.250 0.000 0.000 0.434 84 E N 0.372 120.584 120.200 0.020 0.000 2.608 84 E HA -0.117 4.230 4.350 -0.004 0.000 0.259 84 E C 0.583 177.203 176.600 0.033 0.000 0.951 84 E CA 1.569 57.986 56.400 0.027 0.000 0.945 84 E CB 0.108 29.816 29.700 0.013 0.000 0.916 84 E HN 0.810 9.170 8.360 0.000 0.000 0.477 85 G N 4.112 112.938 108.800 0.044 0.000 2.225 85 G HA2 -0.247 3.710 3.960 -0.004 0.000 0.254 85 G HA3 -0.247 3.710 3.960 -0.004 0.000 0.254 85 G C 0.004 174.939 174.900 0.058 0.000 0.988 85 G CA 0.196 45.322 45.100 0.042 0.000 0.625 85 G HN 0.661 8.951 8.290 0.000 0.000 0.527 86 D N 0.458 120.904 120.400 0.076 0.000 2.443 86 D HA 0.328 4.966 4.640 -0.004 0.000 0.234 86 D C 1.198 177.557 176.300 0.098 0.000 1.172 86 D CA 0.217 54.275 54.000 0.098 0.000 0.878 86 D CB 0.492 41.378 40.800 0.143 0.000 1.204 86 D HN 0.394 8.764 8.370 0.000 0.000 0.453 87 I N 1.279 121.896 120.570 0.078 0.000 2.474 87 I HA 0.119 4.286 4.170 -0.004 0.000 0.287 87 I C -0.113 176.005 176.117 0.003 0.000 1.048 87 I CA -0.432 60.891 61.300 0.039 0.000 1.383 87 I CB 0.970 38.986 38.000 0.025 0.000 1.412 87 I HN -0.074 8.136 8.210 0.000 0.000 0.531 88 V N 6.266 126.137 119.914 -0.073 0.000 2.540 88 V HA 0.441 4.558 4.120 -0.004 0.000 0.302 88 V C -0.322 175.674 176.094 -0.164 0.000 1.035 88 V CA -0.943 61.220 62.300 -0.229 0.000 0.873 88 V CB 1.721 33.334 31.823 -0.350 0.000 0.992 88 V HN 0.627 8.817 8.190 0.000 0.000 0.428 89 K N 3.257 123.554 120.400 -0.172 0.000 2.270 89 K HA 0.610 4.927 4.320 -0.004 0.000 0.255 89 K C -0.434 176.104 176.600 -0.103 0.000 0.936 89 K CA -0.872 55.353 56.287 -0.103 0.000 0.809 89 K CB 2.415 34.878 32.500 -0.062 0.000 1.131 89 K HN 0.552 8.802 8.250 0.000 0.000 0.427 90 R N 0.637 121.093 120.500 -0.073 0.000 2.679 90 R HA -0.024 4.313 4.340 -0.004 0.000 0.268 90 R C 1.128 177.407 176.300 -0.036 0.000 1.044 90 R CA 0.459 56.527 56.100 -0.054 0.000 1.105 90 R CB 0.298 30.574 30.300 -0.041 0.000 0.989 90 R HN 0.820 9.090 8.270 0.000 0.000 0.447 91 T N -1.759 112.781 114.554 -0.022 0.000 3.014 91 T HA 0.152 4.500 4.350 -0.004 0.000 0.250 91 T C 1.385 176.082 174.700 -0.005 0.000 1.060 91 T CA 0.378 62.473 62.100 -0.008 0.000 1.040 91 T CB 0.493 69.365 68.868 0.006 0.000 0.971 91 T HN 0.815 9.055 8.240 0.000 0.000 0.497 92 G N 1.357 110.153 108.800 -0.007 0.000 2.205 92 G HA2 -0.018 3.940 3.960 -0.004 0.000 0.261 92 G HA3 -0.018 3.940 3.960 -0.004 0.000 0.261 92 G C 0.209 175.110 174.900 0.002 0.000 0.980 92 G CA -0.105 44.993 45.100 -0.004 0.000 0.632 92 G HN 1.329 9.619 8.290 0.000 0.000 0.533 93 A N 0.869 123.693 122.820 0.007 0.000 2.318 93 A HA 0.741 5.059 4.320 -0.004 0.000 0.317 93 A C 0.337 177.934 177.584 0.021 0.000 1.159 93 A CA -0.717 51.328 52.037 0.012 0.000 0.799 93 A CB 0.819 19.826 19.000 0.012 0.000 1.194 93 A HN 0.553 8.703 8.150 0.000 0.000 0.479 94 I N 2.591 123.173 120.570 0.019 0.000 2.683 94 I HA -0.022 4.145 4.170 -0.004 0.000 0.286 94 I C 0.827 176.962 176.117 0.030 0.000 1.175 94 I CA 0.171 61.487 61.300 0.026 0.000 1.429 94 I CB 0.187 38.197 38.000 0.017 0.000 1.371 94 I HN 0.373 8.583 8.210 0.000 0.000 0.569 95 V N 7.314 127.259 119.914 0.052 0.000 2.678 95 V HA -0.133 3.984 4.120 -0.004 0.000 0.304 95 V C 0.325 176.426 176.094 0.011 0.000 1.086 95 V CA 0.593 62.923 62.300 0.051 0.000 1.246 95 V CB -0.400 31.485 31.823 0.103 0.000 0.861 95 V HN 0.977 9.167 8.190 0.000 0.000 0.491 96 D N 3.915 124.311 120.400 -0.006 0.000 2.592 96 D HA 0.732 5.370 4.640 -0.004 0.000 0.263 96 D C -0.647 175.632 176.300 -0.036 0.000 1.132 96 D CA -0.615 53.376 54.000 -0.017 0.000 0.996 96 D CB 2.104 42.898 40.800 -0.008 0.000 1.442 96 D HN 0.463 8.833 8.370 0.000 0.000 0.486 97 V N -4.644 115.250 119.914 -0.033 0.000 3.040 97 V HA 0.776 4.894 4.120 -0.004 0.000 0.312 97 V C -2.756 173.312 176.094 -0.044 0.000 1.115 97 V CA -2.254 60.020 62.300 -0.043 0.000 0.998 97 V CB 1.691 33.490 31.823 -0.039 0.000 1.042 97 V HN 0.640 8.830 8.190 0.000 0.000 0.433 98 P HA 0.420 4.840 4.420 0.000 0.000 0.272 98 P C -0.863 176.380 177.300 -0.095 0.000 1.223 98 P CA -0.054 63.004 63.100 -0.070 0.000 0.784 98 P CB 1.680 33.340 31.700 -0.066 0.000 0.923 99 V N 0.601 120.422 119.914 -0.156 0.000 3.087 99 V HA 0.804 4.921 4.120 -0.004 0.000 0.306 99 V C 0.144 175.942 176.094 -0.493 0.000 1.187 99 V CA 0.379 62.531 62.300 -0.247 0.000 0.999 99 V CB 2.004 33.735 31.823 -0.155 0.000 1.049 99 V HN 1.107 9.297 8.190 0.000 0.000 0.431 100 G N 2.930 111.226 108.800 -0.840 0.000 2.354 100 G HA2 0.014 3.971 3.960 -0.004 0.000 0.582 100 G HA3 0.014 3.971 3.960 -0.004 0.000 0.582 100 G C -0.048 174.442 174.900 -0.684 0.000 1.316 100 G CA 0.032 44.363 45.100 -1.283 0.000 0.995 100 G HN 0.672 8.962 8.290 0.000 0.000 0.573 101 E N -0.282 119.626 120.200 -0.487 0.000 2.338 101 E HA -0.033 4.314 4.350 -0.004 0.000 0.197 101 E C 2.006 178.581 176.600 -0.041 0.000 1.007 101 E CA 1.346 57.688 56.400 -0.097 0.000 0.849 101 E CB 0.047 29.746 29.700 -0.001 0.000 0.774 101 E HN 0.534 8.894 8.360 0.000 0.000 0.506 102 E N 0.153 120.291 120.200 -0.104 0.000 2.267 102 E HA -0.163 4.184 4.350 -0.004 0.000 0.197 102 E C 1.512 178.095 176.600 -0.029 0.000 0.998 102 E CA 0.652 57.018 56.400 -0.056 0.000 0.830 102 E CB -0.012 29.641 29.700 -0.078 0.000 0.751 102 E HN 0.271 8.631 8.360 0.000 0.000 0.491 103 L N 0.020 121.223 121.223 -0.033 0.000 2.395 103 L HA 0.035 4.373 4.340 -0.004 0.000 0.218 103 L C 0.416 177.320 176.870 0.056 0.000 1.130 103 L CA -0.047 54.797 54.840 0.006 0.000 0.826 103 L CB -0.116 41.943 42.059 -0.000 0.000 0.941 103 L HN 0.073 8.303 8.230 0.000 0.000 0.451 104 L N 0.544 121.823 121.223 0.093 0.000 2.513 104 L HA 0.125 4.462 4.340 -0.004 0.000 0.272 104 L C 1.379 178.293 176.870 0.073 0.000 1.187 104 L CA 0.651 55.566 54.840 0.126 0.000 0.895 104 L CB 0.019 42.195 42.059 0.196 0.000 1.147 104 L HN 0.349 8.579 8.230 0.000 0.000 0.483 105 G N 1.939 110.766 108.800 0.045 0.000 2.176 105 G HA2 -0.208 3.750 3.960 -0.004 0.000 0.253 105 G HA3 -0.208 3.750 3.960 -0.004 0.000 0.253 105 G C 0.251 175.154 174.900 0.004 0.000 0.979 105 G CA -0.409 44.695 45.100 0.008 0.000 0.641 105 G HN 0.474 8.764 8.290 0.000 0.000 0.530 106 R N -0.337 120.173 120.500 0.017 0.000 2.668 106 R HA 0.709 5.046 4.340 -0.004 0.000 0.279 106 R C -0.262 176.048 176.300 0.017 0.000 0.976 106 R CA -0.778 55.330 56.100 0.012 0.000 0.978 106 R CB 1.770 32.077 30.300 0.012 0.000 1.133 106 R HN 0.215 8.485 8.270 0.000 0.000 0.484 107 V N 2.580 122.502 119.914 0.014 0.000 2.384 107 V HA 0.458 4.576 4.120 -0.004 0.000 0.287 107 V C 0.205 176.311 176.094 0.020 0.000 1.020 107 V CA -0.759 61.554 62.300 0.022 0.000 0.850 107 V CB 1.502 33.336 31.823 0.018 0.000 0.987 107 V HN 0.614 8.804 8.190 0.000 0.000 0.436 108 V N 1.198 121.126 119.914 0.024 0.000 3.102 108 V HA 0.831 4.948 4.120 -0.004 0.000 0.312 108 V C -0.506 175.599 176.094 0.017 0.000 1.135 108 V CA -0.864 61.445 62.300 0.015 0.000 1.022 108 V CB 2.175 34.002 31.823 0.007 0.000 1.056 108 V HN 0.789 8.979 8.190 0.000 0.000 0.436 109 D N 1.852 122.258 120.400 0.009 0.000 2.478 109 D HA 0.512 5.149 4.640 -0.004 0.000 0.274 109 D C 1.187 177.484 176.300 -0.006 0.000 1.234 109 D CA 0.033 54.039 54.000 0.010 0.000 1.069 109 D CB 1.061 41.868 40.800 0.012 0.000 1.113 109 D HN 0.852 9.222 8.370 0.000 0.000 0.571 110 A N -0.744 122.069 122.820 -0.012 0.000 2.070 110 A HA -0.027 4.290 4.320 -0.004 0.000 0.220 110 A C 2.184 179.711 177.584 -0.095 0.000 1.159 110 A CA 0.814 52.827 52.037 -0.039 0.000 0.656 110 A CB -0.776 18.208 19.000 -0.026 0.000 0.800 110 A HN 0.535 8.685 8.150 0.000 0.000 0.453 111 L N -1.783 119.376 121.223 -0.105 0.000 2.592 111 L HA 0.219 4.556 4.340 -0.004 0.000 0.227 111 L C 1.635 178.460 176.870 -0.076 0.000 1.127 111 L CA 0.575 55.334 54.840 -0.134 0.000 0.884 111 L CB 0.036 42.009 42.059 -0.143 0.000 1.065 111 L HN 0.565 8.795 8.230 0.000 0.000 0.457 112 G N -0.229 108.542 108.800 -0.047 0.000 2.159 112 G HA2 -0.230 3.727 3.960 -0.004 0.000 0.227 112 G HA3 -0.230 3.727 3.960 -0.004 0.000 0.227 112 G C 0.021 174.907 174.900 -0.023 0.000 0.986 112 G CA -0.428 44.653 45.100 -0.033 0.000 0.651 112 G HN 0.331 8.621 8.290 0.000 0.000 0.523 113 N N 1.251 119.940 118.700 -0.018 0.000 2.497 113 N HA 0.517 5.254 4.740 -0.004 0.000 0.271 113 N C 0.685 176.194 175.510 -0.002 0.000 1.142 113 N CA 0.618 53.663 53.050 -0.008 0.000 0.965 113 N CB 1.359 39.845 38.487 -0.002 0.000 1.077 113 N HN 0.739 9.119 8.380 0.000 0.000 0.462 114 A N 2.190 125.010 122.820 -0.001 0.000 2.546 114 A HA 0.113 4.430 4.320 -0.004 0.000 0.243 114 A C 1.277 178.865 177.584 0.007 0.000 1.063 114 A CA 0.102 52.140 52.037 0.002 0.000 0.757 114 A CB -0.577 18.423 19.000 0.000 0.000 0.991 114 A HN 0.817 8.967 8.150 0.000 0.000 0.503 115 I N -0.830 119.745 120.570 0.010 0.000 4.147 115 I HA 0.243 4.411 4.170 -0.004 0.000 0.329 115 I C 0.348 176.471 176.117 0.010 0.000 1.424 115 I CA 0.004 61.311 61.300 0.012 0.000 1.127 115 I CB 0.521 38.531 38.000 0.018 0.000 1.128 115 I HN 0.439 8.649 8.210 0.000 0.000 0.417 116 D N 1.216 121.620 120.400 0.007 0.000 2.339 116 D HA 0.158 4.796 4.640 -0.004 0.000 0.217 116 D C 1.682 177.983 176.300 0.002 0.000 1.050 116 D CA 0.500 54.502 54.000 0.003 0.000 0.856 116 D CB 0.035 40.836 40.800 0.001 0.000 0.922 116 D HN 0.432 8.802 8.370 0.000 0.000 0.518 117 G N 0.795 109.596 108.800 0.003 0.000 2.153 117 G HA2 -0.361 3.596 3.960 -0.004 0.000 0.252 117 G HA3 -0.361 3.596 3.960 -0.004 0.000 0.252 117 G C 0.733 175.633 174.900 0.001 0.000 0.994 117 G CA 0.400 45.501 45.100 0.002 0.000 0.698 117 G HN 0.464 8.754 8.290 0.000 0.000 0.521 118 K N 0.256 120.656 120.400 0.000 0.000 2.440 118 K HA 0.469 4.786 4.320 -0.004 0.000 0.206 118 K C 1.251 177.851 176.600 -0.000 0.000 1.025 118 K CA 0.304 56.590 56.287 -0.001 0.000 1.135 118 K CB 0.567 33.066 32.500 -0.001 0.000 0.856 118 K HN 1.424 9.674 8.250 0.000 0.000 0.502 119 G N 2.452 111.252 108.800 0.000 0.000 2.710 119 G HA2 -0.179 3.779 3.960 -0.004 0.000 0.668 119 G HA3 -0.179 3.779 3.960 -0.004 0.000 0.668 119 G C -2.829 172.070 174.900 -0.002 0.000 1.320 119 G CA -1.318 43.781 45.100 -0.000 0.000 0.860 119 G HN -0.023 8.267 8.290 0.000 0.000 0.538 120 P HA 0.344 4.764 4.420 0.000 0.000 0.266 120 P C 0.502 177.796 177.300 -0.010 0.000 1.195 120 P CA -0.390 62.706 63.100 -0.006 0.000 0.768 120 P CB 0.356 32.052 31.700 -0.006 0.000 0.838 121 I N 2.209 122.771 120.570 -0.015 0.000 2.517 121 I HA 0.071 4.238 4.170 -0.004 0.000 0.285 121 I C 1.550 177.650 176.117 -0.028 0.000 1.106 121 I CA 0.354 61.641 61.300 -0.022 0.000 1.402 121 I CB 0.010 37.993 38.000 -0.029 0.000 1.399 121 I HN 0.494 8.704 8.210 0.000 0.000 0.535 122 G N 4.839 113.623 108.800 -0.028 0.000 3.471 122 G HA2 0.090 4.047 3.960 -0.004 0.000 0.254 122 G HA3 0.090 4.047 3.960 -0.004 0.000 0.254 122 G C 0.689 175.560 174.900 -0.047 0.000 1.199 122 G CA -0.227 44.855 45.100 -0.031 0.000 1.683 122 G HN 0.686 8.976 8.290 0.000 0.000 0.625 123 S N -0.571 115.093 115.700 -0.060 0.000 2.564 123 S HA 0.302 4.769 4.470 -0.004 0.000 0.278 123 S C 0.947 175.501 174.600 -0.078 0.000 1.333 123 S CA -0.253 57.893 58.200 -0.091 0.000 1.048 123 S CB 1.662 64.794 63.200 -0.113 0.000 0.900 123 S HN 0.290 8.600 8.310 0.000 0.000 0.505 124 K N 1.674 122.020 120.400 -0.091 0.000 2.373 124 K HA 0.443 4.760 4.320 -0.004 0.000 0.200 124 K C 0.153 176.717 176.600 -0.059 0.000 1.054 124 K CA 0.283 56.533 56.287 -0.062 0.000 1.065 124 K CB 0.973 33.443 32.500 -0.050 0.000 0.886 124 K HN 0.708 8.958 8.250 0.000 0.000 0.546 125 A N 0.875 123.643 122.820 -0.088 0.000 2.423 125 A HA 0.729 5.046 4.320 -0.004 0.000 0.304 125 A C -0.972 176.570 177.584 -0.071 0.000 1.104 125 A CA -0.787 51.211 52.037 -0.066 0.000 0.757 125 A CB 1.264 20.233 19.000 -0.051 0.000 1.313 125 A HN 0.068 8.218 8.150 0.000 0.000 0.423 126 R N -0.051 120.425 120.500 -0.040 0.000 2.854 126 R HA 0.771 5.108 4.340 -0.004 0.000 0.271 126 R C -0.880 175.411 176.300 -0.015 0.000 0.994 126 R CA -0.854 55.225 56.100 -0.034 0.000 0.945 126 R CB 2.569 32.853 30.300 -0.026 0.000 1.194 126 R HN 0.743 9.013 8.270 0.000 0.000 0.476 127 R N 0.964 121.457 120.500 -0.011 0.000 2.548 127 R HA 0.262 4.599 4.340 -0.004 0.000 0.280 127 R C -0.904 175.398 176.300 0.004 0.000 1.061 127 R CA -0.778 55.325 56.100 0.005 0.000 0.915 127 R CB 1.843 32.154 30.300 0.019 0.000 1.210 127 R HN 0.527 8.797 8.270 0.000 0.000 0.442 128 R N 1.838 122.342 120.500 0.007 0.000 2.538 128 R HA -0.033 4.305 4.340 -0.004 0.000 0.282 128 R C 1.514 177.817 176.300 0.005 0.000 1.009 128 R CA 0.280 56.382 56.100 0.004 0.000 1.063 128 R CB 0.679 30.982 30.300 0.005 0.000 0.945 128 R HN 0.525 8.795 8.270 0.000 0.000 0.414 129 V N 1.156 121.068 119.914 -0.005 0.000 2.809 129 V HA 0.038 4.155 4.120 -0.004 0.000 0.256 129 V C 1.268 177.348 176.094 -0.023 0.000 1.080 129 V CA 1.827 64.129 62.300 0.003 0.000 1.102 129 V CB -0.019 31.802 31.823 -0.004 0.000 0.705 129 V HN 0.851 9.041 8.190 0.000 0.000 0.475 130 G N 0.084 108.849 108.800 -0.058 0.000 3.337 130 G HA2 0.351 4.308 3.960 -0.004 0.000 0.246 130 G HA3 0.351 4.308 3.960 -0.004 0.000 0.246 130 G C 0.402 175.273 174.900 -0.047 0.000 1.131 130 G CA -0.492 44.545 45.100 -0.104 0.000 0.773 130 G HN 0.463 8.753 8.290 0.000 0.000 0.544 131 L N 0.903 122.119 121.223 -0.011 0.000 2.559 131 L HA 0.074 4.411 4.340 -0.004 0.000 0.282 131 L C 0.931 177.806 176.870 0.009 0.000 1.232 131 L CA -0.008 54.836 54.840 0.006 0.000 0.885 131 L CB 0.534 42.604 42.059 0.019 0.000 1.131 131 L HN 0.100 8.330 8.230 0.000 0.000 0.498 132 K N 2.904 123.312 120.400 0.014 0.000 2.382 132 K HA 0.316 4.633 4.320 -0.004 0.000 0.275 132 K C 0.060 176.669 176.600 0.015 0.000 1.009 132 K CA -0.342 55.957 56.287 0.020 0.000 0.970 132 K CB 0.889 33.406 32.500 0.028 0.000 0.934 132 K HN 0.642 8.892 8.250 0.000 0.000 0.479 133 A N 5.489 128.318 122.820 0.015 0.000 2.587 133 A HA 0.134 4.451 4.320 -0.004 0.000 0.233 133 A C -2.081 175.495 177.584 -0.014 0.000 1.049 133 A CA -0.841 51.199 52.037 0.005 0.000 0.754 133 A CB -0.643 18.361 19.000 0.008 0.000 0.977 133 A HN 0.647 8.797 8.150 0.000 0.000 0.509 134 P HA 0.221 4.641 4.420 0.000 0.000 0.267 134 P C 0.833 178.084 177.300 -0.083 0.000 1.200 134 P CA 0.609 63.654 63.100 -0.092 0.000 0.772 134 P CB 0.553 32.161 31.700 -0.153 0.000 0.855 135 G N 1.277 110.020 108.800 -0.094 0.000 2.485 135 G HA2 0.101 4.058 3.960 -0.004 0.000 0.260 135 G HA3 0.101 4.058 3.960 -0.004 0.000 0.260 135 G C 1.069 175.921 174.900 -0.080 0.000 1.459 135 G CA -0.528 44.533 45.100 -0.065 0.000 1.060 135 G HN 0.419 8.709 8.290 0.000 0.000 0.546 136 I N -0.072 120.465 120.570 -0.055 0.000 2.233 136 I HA -0.094 4.074 4.170 -0.004 0.000 0.243 136 I C 2.515 178.592 176.117 -0.066 0.000 1.093 136 I CA 0.579 61.850 61.300 -0.047 0.000 1.380 136 I CB -0.107 37.879 38.000 -0.022 0.000 1.067 136 I HN 0.231 8.441 8.210 0.000 0.000 0.413 137 I N 1.072 121.598 120.570 -0.073 0.000 2.286 137 I HA -0.113 4.054 4.170 -0.004 0.000 0.245 137 I C -0.300 175.738 176.117 -0.132 0.000 1.104 137 I CA 1.509 62.774 61.300 -0.058 0.000 1.397 137 I CB -2.613 35.385 38.000 -0.004 0.000 1.072 137 I HN 0.137 8.347 8.210 0.000 0.000 0.417 138 P HA -0.075 4.345 4.420 0.000 0.000 0.231 138 P C 0.237 177.320 177.300 -0.361 0.000 1.158 138 P CA 1.037 63.679 63.100 -0.763 0.000 0.763 138 P CB 0.026 30.948 31.700 -1.296 0.000 0.805 139 R N -0.643 119.749 120.500 -0.181 0.000 2.758 139 R HA 0.732 5.069 4.340 -0.004 0.000 0.265 139 R C -0.254 176.026 176.300 -0.033 0.000 1.016 139 R CA -0.975 55.071 56.100 -0.090 0.000 1.040 139 R CB 1.592 31.848 30.300 -0.074 0.000 1.152 139 R HN -0.026 8.244 8.270 0.000 0.000 0.503 140 I N -0.547 120.017 120.570 -0.009 0.000 2.969 140 I HA 0.225 4.392 4.170 -0.004 0.000 0.307 140 I C -0.486 175.633 176.117 0.003 0.000 1.149 140 I CA -0.665 60.638 61.300 0.004 0.000 1.008 140 I CB 2.554 40.565 38.000 0.019 0.000 1.232 140 I HN 0.566 8.776 8.210 0.000 0.000 0.435 141 S N 3.012 118.714 115.700 0.003 0.000 2.573 141 S HA 0.038 4.506 4.470 -0.004 0.000 0.297 141 S C -0.267 174.334 174.600 0.002 0.000 1.280 141 S CA -0.435 57.767 58.200 0.002 0.000 1.061 141 S CB 0.237 63.438 63.200 0.002 0.000 0.812 141 S HN 0.338 8.648 8.310 0.000 0.000 0.500 142 V N 5.398 125.312 119.914 0.000 0.000 2.493 142 V HA 0.072 4.190 4.120 -0.004 0.000 0.292 142 V C 1.076 177.163 176.094 -0.011 0.000 1.016 142 V CA 0.794 63.091 62.300 -0.004 0.000 1.097 142 V CB 0.228 32.049 31.823 -0.004 0.000 0.947 142 V HN 0.853 9.043 8.190 0.000 0.000 0.479 143 R N 1.959 122.448 120.500 -0.020 0.000 2.582 143 R HA 0.247 4.584 4.340 -0.004 0.000 0.285 143 R C 0.016 176.288 176.300 -0.047 0.000 0.940 143 R CA -0.235 55.850 56.100 -0.026 0.000 1.072 143 R CB 0.805 31.095 30.300 -0.017 0.000 1.527 143 R HN 0.693 8.963 8.270 0.000 0.000 0.538 144 E N 2.113 122.272 120.200 -0.069 0.000 2.175 144 E HA 0.268 4.616 4.350 -0.004 0.000 0.278 144 E C -2.597 173.927 176.600 -0.127 0.000 0.969 144 E CA -2.384 53.947 56.400 -0.115 0.000 0.796 144 E CB 1.422 31.016 29.700 -0.175 0.000 1.104 144 E HN -0.172 8.188 8.360 0.000 0.000 0.395 145 P HA -0.010 4.410 4.420 0.000 0.000 0.268 145 P C -0.685 176.510 177.300 -0.176 0.000 1.204 145 P CA 0.037 63.062 63.100 -0.125 0.000 0.768 145 P CB 0.428 32.060 31.700 -0.113 0.000 0.842 146 M N 3.902 123.427 119.600 -0.125 0.000 2.131 146 M HA 0.145 4.622 4.480 -0.004 0.000 0.345 146 M C -0.653 175.607 176.300 -0.066 0.000 1.060 146 M CA -0.471 54.754 55.300 -0.126 0.000 1.011 146 M CB 0.290 32.838 32.600 -0.085 0.000 1.328 146 M HN 0.311 8.601 8.290 0.000 0.000 0.396 147 Q N 2.490 122.255 119.800 -0.058 0.000 2.293 147 Q HA 0.149 4.487 4.340 -0.004 0.000 0.263 147 Q C 1.281 177.327 176.000 0.076 0.000 1.002 147 Q CA 0.184 56.011 55.803 0.039 0.000 0.910 147 Q CB 0.733 29.549 28.738 0.129 0.000 1.185 147 Q HN 0.751 9.021 8.270 0.000 0.000 0.401 148 T N -1.344 113.240 114.554 0.050 0.000 3.014 148 T HA 0.072 4.419 4.350 -0.004 0.000 0.263 148 T C 1.298 176.028 174.700 0.049 0.000 1.078 148 T CA 0.648 62.777 62.100 0.048 0.000 1.135 148 T CB 0.036 68.921 68.868 0.029 0.000 0.895 148 T HN 0.839 9.079 8.240 0.000 0.000 0.480 149 G N 1.487 110.317 108.800 0.050 0.000 2.162 149 G HA2 -0.222 3.736 3.960 -0.004 0.000 0.260 149 G HA3 -0.222 3.736 3.960 -0.004 0.000 0.260 149 G C 0.024 174.933 174.900 0.016 0.000 0.976 149 G CA 0.227 45.346 45.100 0.032 0.000 0.655 149 G HN 0.683 8.973 8.290 0.000 0.000 0.533 150 I N 0.799 121.377 120.570 0.015 0.000 2.297 150 I HA 0.267 4.434 4.170 -0.004 0.000 0.291 150 I C 1.566 177.689 176.117 0.009 0.000 1.033 150 I CA -0.762 60.540 61.300 0.004 0.000 1.253 150 I CB 1.275 39.275 38.000 -0.001 0.000 1.396 150 I HN -0.010 8.200 8.210 0.000 0.000 0.476 151 K N 4.398 124.803 120.400 0.008 0.000 2.034 151 K HA -0.256 4.061 4.320 -0.004 0.000 0.214 151 K C 2.104 178.711 176.600 0.012 0.000 1.051 151 K CA 1.951 58.246 56.287 0.013 0.000 0.931 151 K CB -0.237 32.272 32.500 0.014 0.000 0.715 151 K HN 0.800 9.050 8.250 0.000 0.000 0.446 152 A N 0.927 123.751 122.820 0.006 0.000 1.940 152 A HA -0.135 4.183 4.320 -0.004 0.000 0.219 152 A C 2.395 179.987 177.584 0.013 0.000 1.176 152 A CA 1.610 53.652 52.037 0.008 0.000 0.631 152 A CB -0.574 18.428 19.000 0.003 0.000 0.814 152 A HN 0.103 8.253 8.150 0.000 0.000 0.446 153 V N 0.154 120.076 119.914 0.013 0.000 2.302 153 V HA -0.158 3.959 4.120 -0.004 0.000 0.243 153 V C 2.061 178.164 176.094 0.016 0.000 1.036 153 V CA 2.091 64.401 62.300 0.016 0.000 1.020 153 V CB -0.737 31.096 31.823 0.016 0.000 0.657 153 V HN 0.444 8.634 8.190 0.000 0.000 0.453 154 D N 0.318 120.728 120.400 0.016 0.000 2.219 154 D HA -0.100 4.538 4.640 -0.004 0.000 0.205 154 D C 2.394 178.703 176.300 0.015 0.000 0.970 154 D CA 1.625 55.635 54.000 0.015 0.000 0.851 154 D CB -0.057 40.755 40.800 0.021 0.000 0.943 154 D HN 0.596 8.966 8.370 0.000 0.000 0.488 155 S N -0.599 115.111 115.700 0.016 0.000 2.387 155 S HA 0.047 4.515 4.470 -0.004 0.000 0.221 155 S C 2.045 176.653 174.600 0.014 0.000 1.041 155 S CA 0.235 58.444 58.200 0.015 0.000 0.959 155 S CB -0.335 62.875 63.200 0.016 0.000 0.843 155 S HN 0.178 8.488 8.310 0.000 0.000 0.488 156 L N 1.343 122.576 121.223 0.015 0.000 2.253 156 L HA 0.311 4.649 4.340 -0.004 0.000 0.205 156 L C 0.726 177.608 176.870 0.020 0.000 1.078 156 L CA 0.363 55.214 54.840 0.018 0.000 0.805 156 L CB 0.272 42.344 42.059 0.022 0.000 0.963 156 L HN 0.410 8.640 8.230 0.000 0.000 0.459 157 V N -2.747 117.179 119.914 0.020 0.000 2.468 157 V HA 0.411 4.528 4.120 -0.004 0.000 0.256 157 V C -2.677 173.427 176.094 0.016 0.000 0.998 157 V CA -1.760 60.553 62.300 0.022 0.000 1.114 157 V CB -0.103 31.738 31.823 0.030 0.000 1.378 157 V HN -0.075 8.115 8.190 0.000 0.000 0.573 158 P HA 0.372 4.792 4.420 0.000 0.000 0.271 158 P C -0.288 177.012 177.300 0.000 0.000 1.216 158 P CA 0.253 63.356 63.100 0.005 0.000 0.776 158 P CB 1.674 33.375 31.700 0.001 0.000 0.881 159 I N 1.529 122.096 120.570 -0.005 0.000 2.412 159 I HA 0.521 4.689 4.170 -0.004 0.000 0.296 159 I C 1.044 177.145 176.117 -0.027 0.000 0.987 159 I CA -0.508 60.785 61.300 -0.011 0.000 1.180 159 I CB 1.983 39.979 38.000 -0.007 0.000 1.340 159 I HN 0.347 8.557 8.210 0.000 0.000 0.455 160 G N 4.277 113.060 108.800 -0.028 0.000 2.537 160 G HA2 0.561 4.518 3.960 -0.004 0.000 0.323 160 G HA3 0.561 4.518 3.960 -0.004 0.000 0.323 160 G C -0.689 174.184 174.900 -0.045 0.000 1.207 160 G CA -0.900 44.173 45.100 -0.044 0.000 0.976 160 G HN 0.520 8.810 8.290 0.000 0.000 0.487 161 R N -0.102 120.358 120.500 -0.066 0.000 2.296 161 R HA 0.430 4.767 4.340 -0.004 0.000 0.323 161 R C 1.043 177.346 176.300 0.005 0.000 1.067 161 R CA 1.045 57.115 56.100 -0.050 0.000 0.946 161 R CB 0.752 30.975 30.300 -0.129 0.000 0.991 161 R HN 1.081 9.351 8.270 0.000 0.000 0.448 162 G N 1.898 110.712 108.800 0.024 0.000 2.192 162 G HA2 -0.260 3.697 3.960 -0.004 0.000 0.193 162 G HA3 -0.260 3.697 3.960 -0.004 0.000 0.193 162 G C 0.113 175.024 174.900 0.018 0.000 0.999 162 G CA -0.396 44.723 45.100 0.031 0.000 0.659 162 G HN 0.557 8.847 8.290 0.000 0.000 0.503 163 Q N 0.121 119.927 119.800 0.009 0.000 2.306 163 Q HA 0.666 5.003 4.340 -0.004 0.000 0.241 163 Q C -0.096 175.911 176.000 0.012 0.000 0.948 163 Q CA -0.563 55.244 55.803 0.008 0.000 0.886 163 Q CB 0.474 29.213 28.738 0.000 0.000 1.227 163 Q HN 0.287 8.557 8.270 0.000 0.000 0.457 164 R N 2.018 122.526 120.500 0.014 0.000 2.338 164 R HA 0.330 4.667 4.340 -0.004 0.000 0.317 164 R C -1.305 175.003 176.300 0.013 0.000 0.968 164 R CA -0.501 55.609 56.100 0.017 0.000 0.849 164 R CB 1.537 31.848 30.300 0.019 0.000 1.128 164 R HN 0.492 8.762 8.270 0.000 0.000 0.448 165 E N 2.610 122.817 120.200 0.012 0.000 2.241 165 E HA 0.306 4.654 4.350 -0.004 0.000 0.263 165 E C -1.474 175.135 176.600 0.015 0.000 0.882 165 E CA -0.920 55.488 56.400 0.014 0.000 0.769 165 E CB 1.011 30.719 29.700 0.013 0.000 1.185 165 E HN 0.373 8.733 8.360 0.000 0.000 0.415 166 L N 5.611 126.844 121.223 0.016 0.000 2.380 166 L HA 0.476 4.814 4.340 -0.004 0.000 0.273 166 L C -1.031 175.859 176.870 0.034 0.000 1.138 166 L CA 0.088 54.937 54.840 0.015 0.000 0.832 166 L CB 0.610 42.672 42.059 0.005 0.000 1.124 166 L HN 0.635 8.865 8.230 0.000 0.000 0.454 167 I N 6.865 127.455 120.570 0.033 0.000 2.339 167 I HA 0.443 4.611 4.170 -0.004 0.000 0.290 167 I C -0.337 175.821 176.117 0.068 0.000 0.994 167 I CA -0.257 61.075 61.300 0.053 0.000 1.191 167 I CB 1.284 39.310 38.000 0.042 0.000 1.343 167 I HN 0.581 8.791 8.210 0.000 0.000 0.458 168 I N 5.070 125.713 120.570 0.122 0.000 2.722 168 I HA 0.876 5.044 4.170 -0.004 0.000 0.295 168 I C -0.513 175.780 176.117 0.295 0.000 1.161 168 I CA 0.040 61.440 61.300 0.167 0.000 1.032 168 I CB 2.135 40.210 38.000 0.125 0.000 1.244 168 I HN 0.735 8.945 8.210 0.000 0.000 0.421 169 G N 4.831 113.778 108.800 0.245 0.000 2.328 169 G HA2 0.143 4.100 3.960 -0.004 0.000 0.299 169 G HA3 0.143 4.100 3.960 -0.004 0.000 0.299 169 G C -1.847 173.125 174.900 0.119 0.000 1.435 169 G CA -0.860 44.377 45.100 0.228 0.000 0.865 169 G HN 0.545 8.835 8.290 0.000 0.000 0.601 170 D N 0.250 120.700 120.400 0.083 0.000 2.335 170 D HA 0.275 4.912 4.640 -0.004 0.000 0.236 170 D C 1.446 177.746 176.300 0.001 0.000 1.297 170 D CA 0.129 54.157 54.000 0.046 0.000 0.906 170 D CB 0.341 41.159 40.800 0.030 0.000 1.164 170 D HN 0.714 9.084 8.370 0.000 0.000 0.469 171 R N 0.582 121.083 120.500 0.001 0.000 2.638 171 R HA -0.060 4.278 4.340 -0.004 0.000 0.268 171 R C -0.107 176.143 176.300 -0.084 0.000 1.006 171 R CA -0.066 56.022 56.100 -0.021 0.000 1.088 171 R CB 0.064 30.363 30.300 -0.002 0.000 0.950 171 R HN 0.229 8.499 8.270 0.000 0.000 0.419 172 Q N -0.080 119.657 119.800 -0.106 0.000 2.481 172 Q HA -0.165 4.172 4.340 -0.004 0.000 0.272 172 Q C 0.401 176.147 176.000 -0.423 0.000 1.157 172 Q CA 1.803 57.481 55.803 -0.207 0.000 0.935 172 Q CB -1.865 26.768 28.738 -0.175 0.000 1.338 172 Q HN 1.008 9.278 8.270 0.000 0.000 0.494 173 T N -5.219 109.147 114.554 -0.313 0.000 3.060 173 T HA 0.425 4.772 4.350 -0.004 0.000 0.249 173 T C 1.207 175.795 174.700 -0.188 0.000 1.079 173 T CA 0.845 62.724 62.100 -0.368 0.000 1.013 173 T CB 0.985 69.731 68.868 -0.203 0.000 0.975 173 T HN 0.812 9.052 8.240 0.000 0.000 0.518 174 G N 1.503 110.235 108.800 -0.114 0.000 2.145 174 G HA2 -0.191 3.766 3.960 -0.004 0.000 0.145 174 G HA3 -0.191 3.766 3.960 -0.004 0.000 0.145 174 G C 0.667 175.573 174.900 0.011 0.000 1.017 174 G CA 0.113 45.217 45.100 0.006 0.000 0.682 174 G HN 0.467 8.757 8.290 0.000 0.000 0.504 175 K N -0.171 120.232 120.400 0.004 0.000 1.985 175 K HA -0.053 4.264 4.320 -0.004 0.000 0.210 175 K C 2.559 179.188 176.600 0.048 0.000 1.047 175 K CA 1.902 58.206 56.287 0.028 0.000 0.932 175 K CB -0.438 32.081 32.500 0.032 0.000 0.716 175 K HN 0.253 8.503 8.250 0.000 0.000 0.439 176 T N 1.275 115.867 114.554 0.063 0.000 2.737 176 T HA -0.146 4.202 4.350 -0.004 0.000 0.269 176 T C 2.102 176.847 174.700 0.075 0.000 1.040 176 T CA 1.713 63.874 62.100 0.102 0.000 1.142 176 T CB -0.255 68.684 68.868 0.118 0.000 0.861 176 T HN 0.164 8.404 8.240 0.000 0.000 0.456 177 S N 0.928 116.652 115.700 0.039 0.000 2.382 177 S HA -0.033 4.434 4.470 -0.004 0.000 0.228 177 S C 2.029 176.626 174.600 -0.005 0.000 1.027 177 S CA 0.612 58.814 58.200 0.002 0.000 0.991 177 S CB -0.339 62.834 63.200 -0.045 0.000 0.823 177 S HN 0.353 8.663 8.310 0.000 0.000 0.469 178 I N 2.113 122.689 120.570 0.011 0.000 2.118 178 I HA -0.231 3.937 4.170 -0.004 0.000 0.241 178 I C 2.758 178.895 176.117 0.034 0.000 1.070 178 I CA 1.592 62.901 61.300 0.015 0.000 1.327 178 I CB -1.749 36.265 38.000 0.023 0.000 1.034 178 I HN 0.260 8.470 8.210 0.000 0.000 0.405 179 A N 1.121 123.976 122.820 0.058 0.000 1.877 179 A HA -0.171 4.146 4.320 -0.004 0.000 0.216 179 A C 2.229 179.861 177.584 0.081 0.000 1.186 179 A CA 1.333 53.421 52.037 0.084 0.000 0.620 179 A CB -0.585 18.500 19.000 0.142 0.000 0.822 179 A HN 0.282 8.432 8.150 0.000 0.000 0.443 180 I N 0.568 121.177 120.570 0.065 0.000 2.179 180 I HA -0.211 3.957 4.170 -0.004 0.000 0.242 180 I C 1.883 178.041 176.117 0.070 0.000 1.088 180 I CA 1.768 63.098 61.300 0.050 0.000 1.357 180 I CB -1.689 36.350 38.000 0.066 0.000 1.051 180 I HN 0.264 8.474 8.210 0.000 0.000 0.409 181 D N 0.370 120.802 120.400 0.053 0.000 2.182 181 D HA -0.137 4.500 4.640 -0.004 0.000 0.201 181 D C 2.190 178.523 176.300 0.055 0.000 0.986 181 D CA 1.415 55.443 54.000 0.046 0.000 0.847 181 D CB -0.059 40.736 40.800 -0.008 0.000 0.942 181 D HN 0.267 8.637 8.370 0.000 0.000 0.467 182 T N 0.137 114.724 114.554 0.056 0.000 2.777 182 T HA -0.030 4.317 4.350 -0.004 0.000 0.266 182 T C 2.143 176.897 174.700 0.091 0.000 1.040 182 T CA 0.463 62.601 62.100 0.064 0.000 1.141 182 T CB -0.106 68.794 68.868 0.052 0.000 0.868 182 T HN 0.152 8.392 8.240 0.000 0.000 0.444 183 I N 0.681 121.313 120.570 0.103 0.000 2.142 183 I HA -0.146 4.021 4.170 -0.004 0.000 0.240 183 I C 2.279 178.522 176.117 0.211 0.000 1.078 183 I CA 1.414 62.809 61.300 0.158 0.000 1.343 183 I CB -0.381 37.685 38.000 0.111 0.000 1.046 183 I HN 0.190 8.400 8.210 0.000 0.000 0.405 184 I N 0.833 121.484 120.570 0.135 0.000 2.264 184 I HA -0.338 3.830 4.170 -0.004 0.000 0.248 184 I C 2.223 178.403 176.117 0.105 0.000 1.111 184 I CA 1.491 62.867 61.300 0.126 0.000 1.382 184 I CB -0.506 37.546 38.000 0.087 0.000 1.060 184 I HN 0.324 8.534 8.210 0.000 0.000 0.418 185 N N 0.510 119.252 118.700 0.070 0.000 2.272 185 N HA -0.210 4.528 4.740 -0.004 0.000 0.185 185 N C 1.744 177.218 175.510 -0.060 0.000 1.014 185 N CA 1.130 54.185 53.050 0.007 0.000 0.870 185 N CB 0.057 38.574 38.487 0.050 0.000 0.975 185 N HN 0.260 8.640 8.380 0.000 0.000 0.433 186 Q N 0.151 119.963 119.800 0.020 0.000 2.436 186 Q HA -0.050 4.287 4.340 -0.004 0.000 0.209 186 Q C 1.598 177.413 176.000 -0.309 0.000 0.965 186 Q CA 0.452 56.238 55.803 -0.028 0.000 0.910 186 Q CB -0.137 28.540 28.738 -0.102 0.000 0.980 186 Q HN 0.499 8.769 8.270 0.000 0.000 0.491 187 K N 1.662 121.929 120.400 -0.221 0.000 2.160 187 K HA -0.196 4.121 4.320 -0.004 0.000 0.206 187 K C 1.980 178.422 176.600 -0.264 0.000 1.047 187 K CA 1.414 57.600 56.287 -0.167 0.000 0.930 187 K CB 0.072 32.598 32.500 0.043 0.000 0.720 187 K HN 0.221 8.471 8.250 0.000 0.000 0.450 188 R N -0.661 119.576 120.500 -0.438 0.000 2.189 188 R HA -0.085 4.253 4.340 -0.004 0.000 0.218 188 R C 1.642 177.636 176.300 -0.510 0.000 1.074 188 R CA 1.332 57.130 56.100 -0.503 0.000 0.991 188 R CB -0.391 29.549 30.300 -0.599 0.000 0.883 188 R HN 0.151 8.421 8.270 0.000 0.000 0.457 189 F N 0.997 120.849 119.950 -0.163 0.000 2.317 189 F HA 0.182 4.707 4.527 -0.005 0.000 0.293 189 F C 1.765 177.438 175.800 -0.212 0.000 1.085 189 F CA 0.018 57.912 58.000 -0.175 0.000 1.390 189 F CB -0.217 38.665 39.000 -0.197 0.000 1.077 189 F HN -0.033 8.267 8.300 0.000 0.000 0.517 190 N N 0.129 118.729 118.700 -0.167 0.000 2.396 190 N HA -0.109 4.628 4.740 -0.004 0.000 0.180 190 N C 0.804 176.237 175.510 -0.128 0.000 1.028 190 N CA 1.012 53.904 53.050 -0.262 0.000 0.893 190 N CB -0.390 37.741 38.487 -0.594 0.000 0.967 190 N HN 0.213 8.593 8.380 0.000 0.000 0.440 191 D N -0.288 120.052 120.400 -0.101 0.000 2.340 191 D HA 0.104 4.742 4.640 -0.004 0.000 0.220 191 D C 1.145 177.423 176.300 -0.037 0.000 1.039 191 D CA 0.165 54.135 54.000 -0.049 0.000 0.866 191 D CB 0.017 40.787 40.800 -0.050 0.000 0.913 191 D HN 0.140 8.510 8.370 0.000 0.000 0.523 192 G N -0.343 108.434 108.800 -0.037 0.000 2.525 192 G HA2 0.321 4.278 3.960 -0.004 0.000 0.287 192 G HA3 0.321 4.278 3.960 -0.004 0.000 0.287 192 G C 0.924 175.826 174.900 0.004 0.000 1.350 192 G CA 0.189 45.280 45.100 -0.014 0.000 1.039 192 G HN 0.146 8.436 8.290 0.000 0.000 0.513 193 T N -3.249 111.313 114.554 0.012 0.000 3.040 193 T HA 0.140 4.487 4.350 -0.004 0.000 0.266 193 T C 0.198 174.912 174.700 0.023 0.000 1.005 193 T CA 0.101 62.211 62.100 0.017 0.000 0.906 193 T CB 0.450 69.325 68.868 0.012 0.000 1.082 193 T HN 0.298 8.538 8.240 0.000 0.000 0.531 194 D N 2.081 122.497 120.400 0.027 0.000 2.422 194 D HA 0.213 4.850 4.640 -0.004 0.000 0.227 194 D C 1.125 177.443 176.300 0.030 0.000 1.190 194 D CA -0.213 53.802 54.000 0.026 0.000 0.905 194 D CB 1.255 42.068 40.800 0.022 0.000 1.034 194 D HN 0.272 8.642 8.370 0.000 0.000 0.507 195 E N 3.029 123.254 120.200 0.042 0.000 2.130 195 E HA -0.217 4.130 4.350 -0.004 0.000 0.196 195 E C 1.267 177.916 176.600 0.082 0.000 0.998 195 E CA 1.525 57.964 56.400 0.065 0.000 0.806 195 E CB 0.246 29.992 29.700 0.075 0.000 0.738 195 E HN 0.378 8.738 8.360 0.000 0.000 0.459 196 K N -0.200 120.243 120.400 0.071 0.000 2.283 196 K HA -0.029 4.288 4.320 -0.004 0.000 0.202 196 K C 1.895 178.507 176.600 0.021 0.000 1.048 196 K CA 0.865 57.216 56.287 0.107 0.000 0.948 196 K CB 0.072 32.619 32.500 0.079 0.000 0.742 196 K HN -0.006 8.244 8.250 0.000 0.000 0.458 197 K N 1.029 121.394 120.400 -0.059 0.000 2.418 197 K HA 0.029 4.346 4.320 -0.004 0.000 0.195 197 K C -0.023 176.444 176.600 -0.222 0.000 1.035 197 K CA 0.289 56.452 56.287 -0.207 0.000 1.003 197 K CB 0.292 32.690 32.500 -0.170 0.000 0.793 197 K HN 0.089 8.339 8.250 0.000 0.000 0.494 198 K N 1.206 121.550 120.400 -0.093 0.000 2.355 198 K HA 0.084 4.402 4.320 -0.004 0.000 0.270 198 K C -0.543 175.920 176.600 -0.229 0.000 1.003 198 K CA -0.092 56.086 56.287 -0.181 0.000 0.957 198 K CB 0.596 32.961 32.500 -0.225 0.000 0.939 198 K HN -0.138 8.112 8.250 0.000 0.000 0.482 199 L N 3.674 124.669 121.223 -0.381 0.000 2.446 199 L HA 0.293 4.630 4.340 -0.004 0.000 0.268 199 L C -1.668 174.944 176.870 -0.429 0.000 0.975 199 L CA -0.411 54.260 54.840 -0.283 0.000 0.848 199 L CB 0.820 42.774 42.059 -0.174 0.000 1.225 199 L HN 0.436 8.666 8.230 0.000 0.000 0.410 200 Y N 3.330 123.490 120.300 -0.233 0.000 2.304 200 Y HA 0.485 5.032 4.550 -0.005 0.000 0.328 200 Y C 0.484 176.287 175.900 -0.162 0.000 1.123 200 Y CA -0.094 57.843 58.100 -0.271 0.000 1.218 200 Y CB 1.021 39.011 38.460 -0.783 0.000 1.207 200 Y HN 0.511 8.791 8.280 0.000 0.000 0.495 201 C N 4.640 124.034 119.300 0.156 0.000 2.435 201 C HA 0.714 5.171 4.460 -0.004 0.000 0.333 201 C C -0.128 174.922 174.990 0.100 0.000 1.202 201 C CA -1.118 57.974 59.018 0.124 0.000 1.830 201 C CB 0.350 28.206 27.740 0.194 0.000 2.326 201 C HN 0.645 8.875 8.230 0.000 0.000 0.507 202 I N 2.027 122.635 120.570 0.063 0.000 2.512 202 I HA 0.253 4.421 4.170 -0.004 0.000 0.287 202 I C -1.328 174.809 176.117 0.034 0.000 1.069 202 I CA -0.458 60.874 61.300 0.053 0.000 1.056 202 I CB 1.342 39.360 38.000 0.030 0.000 1.229 202 I HN 0.632 8.842 8.210 0.000 0.000 0.429 203 Y N 7.036 127.308 120.300 -0.047 0.000 2.356 203 Y HA 0.553 5.100 4.550 -0.004 0.000 0.334 203 Y C -0.791 175.084 175.900 -0.041 0.000 0.958 203 Y CA -0.648 57.418 58.100 -0.057 0.000 1.196 203 Y CB 1.263 39.703 38.460 -0.033 0.000 1.137 203 Y HN 0.262 8.542 8.280 0.000 0.000 0.485 204 V N 6.356 125.994 119.914 -0.459 0.000 2.350 204 V HA 0.642 4.760 4.120 -0.004 0.000 0.276 204 V C 0.063 175.896 176.094 -0.434 0.000 1.028 204 V CA -0.652 61.480 62.300 -0.280 0.000 0.860 204 V CB 0.773 32.542 31.823 -0.090 0.000 0.990 204 V HN 0.910 9.100 8.190 0.000 0.000 0.453 205 A N 6.782 129.482 122.820 -0.202 0.000 2.260 205 A HA 0.867 5.184 4.320 -0.004 0.000 0.308 205 A C -0.685 176.888 177.584 -0.019 0.000 1.254 205 A CA -0.320 51.666 52.037 -0.086 0.000 0.874 205 A CB 0.146 19.224 19.000 0.132 0.000 1.153 205 A HN 0.746 8.896 8.150 0.000 0.000 0.527 206 I N 1.846 122.408 120.570 -0.014 0.000 2.447 206 I HA 0.596 4.763 4.170 -0.004 0.000 0.287 206 I C 1.060 177.205 176.117 0.046 0.000 1.023 206 I CA 0.491 61.805 61.300 0.023 0.000 1.083 206 I CB 1.897 39.906 38.000 0.014 0.000 1.245 206 I HN 1.003 9.213 8.210 0.000 0.000 0.434 207 G N 3.537 112.374 108.800 0.061 0.000 2.205 207 G HA2 -0.236 3.721 3.960 -0.004 0.000 0.261 207 G HA3 -0.236 3.721 3.960 -0.004 0.000 0.261 207 G C 0.362 175.299 174.900 0.062 0.000 0.980 207 G CA -0.199 44.941 45.100 0.067 0.000 0.632 207 G HN 0.588 8.878 8.290 0.000 0.000 0.533 208 Q N 0.493 120.332 119.800 0.064 0.000 2.443 208 Q HA 0.421 4.758 4.340 -0.004 0.000 0.232 208 Q C 0.757 176.793 176.000 0.060 0.000 1.026 208 Q CA 0.242 56.085 55.803 0.067 0.000 0.924 208 Q CB 0.499 29.289 28.738 0.086 0.000 1.256 208 Q HN 0.646 8.916 8.270 0.000 0.000 0.519 209 K N 0.382 120.815 120.400 0.054 0.000 2.218 209 K HA 0.165 4.482 4.320 -0.004 0.000 0.276 209 K C 0.500 177.127 176.600 0.046 0.000 1.022 209 K CA -0.431 55.883 56.287 0.046 0.000 0.946 209 K CB 1.130 33.653 32.500 0.038 0.000 1.000 209 K HN 0.467 8.717 8.250 0.000 0.000 0.468 210 R N 1.147 121.672 120.500 0.040 0.000 2.103 210 R HA -0.190 4.147 4.340 -0.004 0.000 0.242 210 R C 2.132 178.451 176.300 0.030 0.000 1.142 210 R CA 2.405 58.528 56.100 0.037 0.000 0.960 210 R CB -0.304 30.015 30.300 0.031 0.000 0.858 210 R HN 0.980 9.250 8.270 0.000 0.000 0.439 211 S N -1.124 114.591 115.700 0.025 0.000 2.399 211 S HA -0.114 4.353 4.470 -0.004 0.000 0.231 211 S C 1.861 176.471 174.600 0.017 0.000 1.022 211 S CA 1.649 59.859 58.200 0.018 0.000 0.983 211 S CB -0.306 62.903 63.200 0.016 0.000 0.803 211 S HN 0.252 8.562 8.310 0.000 0.000 0.480 212 T N 2.101 116.671 114.554 0.027 0.000 2.821 212 T HA 0.038 4.386 4.350 -0.004 0.000 0.267 212 T C 1.864 176.579 174.700 0.025 0.000 1.046 212 T CA 1.283 63.400 62.100 0.028 0.000 1.139 212 T CB -0.442 68.453 68.868 0.044 0.000 0.871 212 T HN 0.310 8.550 8.240 0.000 0.000 0.454 213 V N 1.727 121.666 119.914 0.041 0.000 2.427 213 V HA -0.130 3.987 4.120 -0.004 0.000 0.248 213 V C 2.857 178.951 176.094 -0.001 0.000 1.051 213 V CA 1.589 63.915 62.300 0.043 0.000 1.048 213 V CB -1.165 30.708 31.823 0.083 0.000 0.666 213 V HN 0.499 8.689 8.190 0.000 0.000 0.456 214 A N -0.881 121.940 122.820 0.002 0.000 1.902 214 A HA -0.239 4.078 4.320 -0.004 0.000 0.217 214 A C 2.211 179.776 177.584 -0.032 0.000 1.181 214 A CA 1.543 53.572 52.037 -0.013 0.000 0.623 214 A CB -0.474 18.523 19.000 -0.005 0.000 0.818 214 A HN 0.497 8.647 8.150 0.000 0.000 0.443 215 Q N -0.812 118.971 119.800 -0.028 0.000 2.135 215 Q HA -0.150 4.187 4.340 -0.004 0.000 0.204 215 Q C 2.090 178.050 176.000 -0.068 0.000 0.981 215 Q CA 1.100 56.879 55.803 -0.040 0.000 0.856 215 Q CB -0.490 28.235 28.738 -0.023 0.000 0.902 215 Q HN 0.592 8.862 8.270 0.000 0.000 0.425 216 L N 0.816 121.990 121.223 -0.082 0.000 2.005 216 L HA -0.112 4.225 4.340 -0.004 0.000 0.207 216 L C 2.426 179.199 176.870 -0.162 0.000 1.072 216 L CA 1.936 56.688 54.840 -0.146 0.000 0.744 216 L CB -1.354 40.574 42.059 -0.218 0.000 0.895 216 L HN 0.178 8.408 8.230 0.000 0.000 0.433 217 V N -0.787 119.050 119.914 -0.129 0.000 2.515 217 V HA -0.215 3.902 4.120 -0.004 0.000 0.250 217 V C 2.633 178.666 176.094 -0.102 0.000 1.058 217 V CA 1.996 64.227 62.300 -0.115 0.000 1.064 217 V CB -0.732 31.046 31.823 -0.075 0.000 0.675 217 V HN 0.484 8.674 8.190 0.000 0.000 0.461 218 K N 1.524 121.871 120.400 -0.087 0.000 2.103 218 K HA -0.201 4.116 4.320 -0.004 0.000 0.207 218 K C 2.294 178.830 176.600 -0.106 0.000 1.048 218 K CA 2.266 58.503 56.287 -0.083 0.000 0.930 218 K CB -0.598 31.861 32.500 -0.068 0.000 0.716 218 K HN 0.553 8.803 8.250 0.000 0.000 0.444 219 R N 0.403 120.827 120.500 -0.125 0.000 2.075 219 R HA 0.044 4.382 4.340 -0.004 0.000 0.232 219 R C 2.052 178.264 176.300 -0.147 0.000 1.126 219 R CA 1.599 57.604 56.100 -0.159 0.000 0.963 219 R CB -0.569 29.631 30.300 -0.167 0.000 0.858 219 R HN 0.322 8.592 8.270 0.000 0.000 0.435 220 L N -0.184 120.953 121.223 -0.142 0.000 2.141 220 L HA -0.087 4.250 4.340 -0.004 0.000 0.209 220 L C 2.042 178.824 176.870 -0.147 0.000 1.094 220 L CA 1.656 56.406 54.840 -0.150 0.000 0.763 220 L CB -0.569 41.384 42.059 -0.176 0.000 0.908 220 L HN 0.322 8.552 8.230 0.000 0.000 0.437 221 T N -1.015 113.464 114.554 -0.124 0.000 2.701 221 T HA -0.156 4.192 4.350 -0.004 0.000 0.263 221 T C 1.397 176.042 174.700 -0.091 0.000 1.040 221 T CA 1.364 63.402 62.100 -0.103 0.000 1.147 221 T CB -0.238 68.580 68.868 -0.082 0.000 0.865 221 T HN 0.264 8.504 8.240 0.000 0.000 0.426 222 D N 1.579 121.923 120.400 -0.094 0.000 2.265 222 D HA -0.007 4.630 4.640 -0.004 0.000 0.208 222 D C 1.871 178.120 176.300 -0.084 0.000 0.977 222 D CA 0.879 54.827 54.000 -0.088 0.000 0.871 222 D CB -0.270 40.468 40.800 -0.104 0.000 0.925 222 D HN 0.447 8.817 8.370 0.000 0.000 0.485 223 A N 0.087 122.851 122.820 -0.092 0.000 2.275 223 A HA 0.038 4.355 4.320 -0.004 0.000 0.212 223 A C 0.507 178.058 177.584 -0.054 0.000 1.201 223 A CA 0.262 52.257 52.037 -0.069 0.000 0.843 223 A CB 0.140 19.101 19.000 -0.065 0.000 0.873 223 A HN 0.001 8.151 8.150 0.000 0.000 0.492 224 D N -2.466 117.892 120.400 -0.071 0.000 2.723 224 D HA -0.207 4.430 4.640 -0.004 0.000 0.236 224 D C 0.720 176.951 176.300 -0.115 0.000 1.138 224 D CA 1.025 54.986 54.000 -0.065 0.000 0.676 224 D CB -1.221 39.568 40.800 -0.017 0.000 1.069 224 D HN 0.532 8.902 8.370 0.000 0.000 0.430 225 A N -0.770 121.897 122.820 -0.255 0.000 2.259 225 A HA 0.153 4.470 4.320 -0.004 0.000 0.213 225 A C 2.027 179.126 177.584 -0.808 0.000 1.209 225 A CA 0.298 51.942 52.037 -0.655 0.000 0.910 225 A CB 0.052 18.830 19.000 -0.370 0.000 0.946 225 A HN 0.247 8.397 8.150 0.000 0.000 0.497 226 M N 1.463 120.827 119.600 -0.394 0.000 2.149 226 M HA -0.181 4.296 4.480 -0.004 0.000 0.261 226 M C 2.084 178.242 176.300 -0.237 0.000 1.064 226 M CA 2.008 57.148 55.300 -0.266 0.000 1.102 226 M CB -0.912 31.600 32.600 -0.147 0.000 1.369 226 M HN 0.690 8.980 8.290 0.000 0.000 0.408 227 K N 0.022 120.294 120.400 -0.213 0.000 2.360 227 K HA -0.180 4.137 4.320 -0.004 0.000 0.201 227 K C 0.755 177.401 176.600 0.077 0.000 1.046 227 K CA 1.514 57.776 56.287 -0.042 0.000 0.940 227 K CB -0.602 31.913 32.500 0.024 0.000 0.748 227 K HN 0.528 8.778 8.250 0.000 0.000 0.465 228 Y N -0.641 119.695 120.300 0.059 0.000 2.706 228 Y HA 0.473 5.020 4.550 -0.005 0.000 0.255 228 Y C -0.663 175.290 175.900 0.090 0.000 1.163 228 Y CA -1.114 57.046 58.100 0.101 0.000 1.174 228 Y CB 0.133 38.586 38.460 -0.012 0.000 1.200 228 Y HN -0.208 8.072 8.280 0.000 0.000 0.544 229 T N 2.542 117.097 114.554 0.002 0.000 2.861 229 T HA 0.590 4.937 4.350 -0.004 0.000 0.287 229 T C -0.535 174.199 174.700 0.056 0.000 1.003 229 T CA -0.454 61.660 62.100 0.024 0.000 0.977 229 T CB 1.879 70.686 68.868 -0.101 0.000 0.996 229 T HN 0.167 8.407 8.240 0.000 0.000 0.448 230 I N 2.309 122.936 120.570 0.095 0.000 2.336 230 I HA 0.436 4.603 4.170 -0.004 0.000 0.292 230 I C -0.371 175.799 176.117 0.087 0.000 0.991 230 I CA -1.006 60.346 61.300 0.087 0.000 1.227 230 I CB 1.509 39.575 38.000 0.111 0.000 1.366 230 I HN 0.230 8.440 8.210 0.000 0.000 0.466 231 V N 7.397 127.357 119.914 0.077 0.000 2.333 231 V HA 0.253 4.370 4.120 -0.004 0.000 0.274 231 V C 0.053 176.198 176.094 0.084 0.000 1.028 231 V CA -0.613 61.756 62.300 0.114 0.000 0.851 231 V CB 1.566 33.451 31.823 0.102 0.000 1.000 231 V HN 0.411 8.601 8.190 0.000 0.000 0.456 232 V N 4.400 124.358 119.914 0.074 0.000 2.350 232 V HA 0.417 4.535 4.120 -0.004 0.000 0.276 232 V C 0.353 176.474 176.094 0.045 0.000 1.028 232 V CA -0.045 62.281 62.300 0.042 0.000 0.860 232 V CB 1.537 33.373 31.823 0.023 0.000 0.990 232 V HN 0.814 9.004 8.190 0.000 0.000 0.453 233 S N 4.208 119.937 115.700 0.047 0.000 2.566 233 S HA 0.748 5.216 4.470 -0.004 0.000 0.324 233 S C -0.128 174.499 174.600 0.045 0.000 1.081 233 S CA -0.261 57.973 58.200 0.056 0.000 1.105 233 S CB 0.947 64.188 63.200 0.069 0.000 0.981 233 S HN 1.007 9.317 8.310 0.000 0.000 0.464 234 A N 4.508 127.355 122.820 0.046 0.000 2.536 234 A HA 0.607 4.924 4.320 -0.004 0.000 0.329 234 A C 0.499 178.120 177.584 0.062 0.000 1.321 234 A CA -0.660 51.411 52.037 0.056 0.000 0.804 234 A CB 0.021 19.058 19.000 0.062 0.000 1.126 234 A HN 0.798 8.948 8.150 0.000 0.000 0.480 235 T N -1.100 113.491 114.554 0.062 0.000 2.833 235 T HA 0.569 4.917 4.350 -0.004 0.000 0.292 235 T C 1.582 176.319 174.700 0.061 0.000 1.031 235 T CA 0.070 62.207 62.100 0.061 0.000 0.937 235 T CB 0.856 69.757 68.868 0.056 0.000 1.256 235 T HN 0.948 9.188 8.240 0.000 0.000 0.551 236 A N 0.592 123.446 122.820 0.056 0.000 2.019 236 A HA -0.030 4.288 4.320 -0.004 0.000 0.219 236 A C 2.425 180.038 177.584 0.050 0.000 1.164 236 A CA 1.870 53.939 52.037 0.053 0.000 0.644 236 A CB -1.306 17.723 19.000 0.047 0.000 0.805 236 A HN 1.032 9.182 8.150 0.000 0.000 0.449 237 S N -0.667 115.061 115.700 0.046 0.000 2.548 237 S HA 0.077 4.545 4.470 -0.004 0.000 0.215 237 S C -0.098 174.531 174.600 0.049 0.000 0.976 237 S CA -0.242 57.983 58.200 0.042 0.000 0.908 237 S CB -0.216 63.004 63.200 0.034 0.000 0.781 237 S HN 0.369 8.679 8.310 0.000 0.000 0.519 238 D N 3.042 123.478 120.400 0.060 0.000 2.382 238 D HA 0.507 5.144 4.640 -0.004 0.000 0.245 238 D C 0.374 176.725 176.300 0.086 0.000 1.120 238 D CA 0.244 54.289 54.000 0.074 0.000 0.890 238 D CB 1.182 42.032 40.800 0.083 0.000 1.201 238 D HN 0.450 8.820 8.370 0.000 0.000 0.433 239 A N 1.860 124.737 122.820 0.094 0.000 2.531 239 A HA 0.313 4.630 4.320 -0.004 0.000 0.236 239 A C 1.526 179.189 177.584 0.132 0.000 1.062 239 A CA 0.413 52.507 52.037 0.095 0.000 0.760 239 A CB 0.184 19.239 19.000 0.092 0.000 0.995 239 A HN 0.648 8.798 8.150 0.000 0.000 0.501 240 A N 3.612 126.496 122.820 0.106 0.000 1.915 240 A HA -0.137 4.180 4.320 -0.004 0.000 0.220 240 A C -0.090 177.626 177.584 0.219 0.000 1.198 240 A CA 2.306 54.423 52.037 0.134 0.000 0.647 240 A CB -1.832 17.214 19.000 0.077 0.000 0.825 240 A HN 0.657 8.807 8.150 0.000 0.000 0.456 241 P HA -0.122 4.298 4.420 0.000 0.000 0.218 241 P C 1.387 179.050 177.300 0.605 0.000 1.148 241 P CA 0.871 64.187 63.100 0.359 0.000 0.822 241 P CB -0.121 31.627 31.700 0.081 0.000 0.784 242 L N -1.059 120.434 121.223 0.449 0.000 2.044 242 L HA -0.172 4.165 4.340 -0.004 0.000 0.205 242 L C 2.631 179.633 176.870 0.219 0.000 1.075 242 L CA 1.509 56.539 54.840 0.316 0.000 0.747 242 L CB -0.961 41.231 42.059 0.220 0.000 0.903 242 L HN -0.022 8.208 8.230 0.000 0.000 0.435 243 Q N -0.970 118.958 119.800 0.214 0.000 2.124 243 Q HA -0.261 4.076 4.340 -0.004 0.000 0.202 243 Q C 2.123 178.244 176.000 0.202 0.000 0.977 243 Q CA 1.936 57.841 55.803 0.170 0.000 0.850 243 Q CB -0.339 28.494 28.738 0.159 0.000 0.901 243 Q HN 0.501 8.771 8.270 0.000 0.000 0.429 244 Y N 0.978 121.384 120.300 0.176 0.000 2.181 244 Y HA -0.234 4.315 4.550 -0.003 0.000 0.288 244 Y C 1.893 177.944 175.900 0.252 0.000 1.146 244 Y CA 1.210 59.438 58.100 0.212 0.000 1.164 244 Y CB -0.158 38.455 38.460 0.255 0.000 0.982 244 Y HN 0.076 8.356 8.280 0.000 0.000 0.515 245 L N 0.456 121.734 121.223 0.091 0.000 2.179 245 L HA 0.106 4.444 4.340 -0.004 0.000 0.208 245 L C 2.545 179.413 176.870 -0.003 0.000 1.096 245 L CA 1.567 56.418 54.840 0.017 0.000 0.779 245 L CB -1.076 41.035 42.059 0.086 0.000 0.922 245 L HN 0.297 8.527 8.230 0.000 0.000 0.443 246 A N 0.549 123.361 122.820 -0.013 0.000 1.903 246 A HA -0.194 4.123 4.320 -0.004 0.000 0.219 246 A C -0.018 177.526 177.584 -0.066 0.000 1.191 246 A CA 2.306 54.326 52.037 -0.028 0.000 0.638 246 A CB -2.094 16.904 19.000 -0.003 0.000 0.823 246 A HN 0.399 8.549 8.150 0.000 0.000 0.451 247 P HA -0.158 4.262 4.420 0.000 0.000 0.215 247 P C 0.939 178.043 177.300 -0.326 0.000 1.153 247 P CA 1.369 64.279 63.100 -0.316 0.000 0.853 247 P CB -0.245 30.976 31.700 -0.798 0.000 0.788 248 Y N -0.501 119.685 120.300 -0.189 0.000 2.224 248 Y HA -0.137 4.410 4.550 -0.005 0.000 0.289 248 Y C 2.587 178.444 175.900 -0.072 0.000 1.146 248 Y CA 1.198 59.205 58.100 -0.156 0.000 1.182 248 Y CB -1.193 37.130 38.460 -0.229 0.000 0.983 248 Y HN -0.069 8.211 8.280 0.000 0.000 0.524 249 S N -0.007 115.732 115.700 0.064 0.000 2.348 249 S HA -0.169 4.299 4.470 -0.004 0.000 0.221 249 S C 2.457 177.085 174.600 0.046 0.000 1.033 249 S CA 1.215 59.433 58.200 0.030 0.000 1.010 249 S CB -1.111 62.082 63.200 -0.011 0.000 0.891 249 S HN 0.651 8.961 8.310 0.000 0.000 0.442 250 G N 0.344 109.178 108.800 0.057 0.000 2.440 250 G HA2 -0.300 3.657 3.960 -0.004 0.000 0.218 250 G HA3 -0.300 3.657 3.960 -0.004 0.000 0.218 250 G C 1.730 176.698 174.900 0.114 0.000 1.154 250 G CA 1.134 46.282 45.100 0.079 0.000 0.767 250 G HN 0.575 8.865 8.290 0.000 0.000 0.552 251 C N 0.532 119.924 119.300 0.153 0.000 2.413 251 C HA -0.058 4.399 4.460 -0.004 0.000 0.276 251 C C 3.323 178.386 174.990 0.123 0.000 1.236 251 C CA 1.806 60.921 59.018 0.162 0.000 1.735 251 C CB -1.000 26.824 27.740 0.140 0.000 2.031 251 C HN 0.388 8.618 8.230 0.000 0.000 0.474 252 S N 0.495 116.253 115.700 0.098 0.000 2.370 252 S HA -0.196 4.272 4.470 -0.004 0.000 0.226 252 S C 1.746 176.399 174.600 0.089 0.000 1.033 252 S CA 2.068 60.316 58.200 0.080 0.000 1.011 252 S CB -0.408 62.823 63.200 0.052 0.000 0.852 252 S HN 0.654 8.964 8.310 0.000 0.000 0.457 253 M N 0.867 120.519 119.600 0.085 0.000 2.149 253 M HA -0.099 4.378 4.480 -0.004 0.000 0.261 253 M C 2.438 178.872 176.300 0.224 0.000 1.064 253 M CA 1.616 56.975 55.300 0.098 0.000 1.102 253 M CB -0.883 31.773 32.600 0.093 0.000 1.369 253 M HN 0.470 8.760 8.290 0.000 0.000 0.408 254 G N -0.111 108.831 108.800 0.237 0.000 2.403 254 G HA2 -0.141 3.816 3.960 -0.004 0.000 0.216 254 G HA3 -0.141 3.816 3.960 -0.004 0.000 0.216 254 G C 1.313 176.385 174.900 0.288 0.000 1.154 254 G CA 0.340 45.632 45.100 0.320 0.000 0.784 254 G HN 0.485 8.775 8.290 0.000 0.000 0.538 255 E N -0.563 119.742 120.200 0.176 0.000 2.265 255 E HA -0.147 4.200 4.350 -0.004 0.000 0.196 255 E C 1.885 178.528 176.600 0.072 0.000 0.996 255 E CA 0.569 57.038 56.400 0.114 0.000 0.832 255 E CB -0.208 29.541 29.700 0.083 0.000 0.756 255 E HN 0.643 9.003 8.360 0.000 0.000 0.491 256 Y N 0.324 120.579 120.300 -0.075 0.000 2.181 256 Y HA -0.265 4.283 4.550 -0.005 0.000 0.288 256 Y C 1.594 177.311 175.900 -0.306 0.000 1.146 256 Y CA 1.609 59.564 58.100 -0.241 0.000 1.164 256 Y CB -0.256 37.958 38.460 -0.410 0.000 0.982 256 Y HN -0.057 8.223 8.280 0.000 0.000 0.515 257 F N 0.085 119.986 119.950 -0.082 0.000 2.163 257 F HA -0.047 4.478 4.527 -0.005 0.000 0.297 257 F C 2.748 178.440 175.800 -0.180 0.000 1.094 257 F CA 1.526 59.417 58.000 -0.182 0.000 1.290 257 F CB -0.658 38.333 39.000 -0.015 0.000 1.017 257 F HN -0.117 8.183 8.300 0.000 0.000 0.483 258 R N 0.663 121.222 120.500 0.098 0.000 2.117 258 R HA -0.188 4.149 4.340 -0.004 0.000 0.243 258 R C 0.916 177.199 176.300 -0.029 0.000 1.143 258 R CA 2.147 58.268 56.100 0.034 0.000 0.968 258 R CB -0.376 29.962 30.300 0.064 0.000 0.863 258 R HN 0.176 8.446 8.270 0.000 0.000 0.444 259 D N -0.526 119.833 120.400 -0.070 0.000 2.339 259 D HA 0.037 4.674 4.640 -0.004 0.000 0.217 259 D C 0.125 176.346 176.300 -0.131 0.000 1.050 259 D CA 0.393 54.359 54.000 -0.056 0.000 0.856 259 D CB 0.238 41.018 40.800 -0.033 0.000 0.922 259 D HN 0.208 8.578 8.370 0.000 0.000 0.518 260 N N -0.151 118.411 118.700 -0.231 0.000 2.338 260 N HA 0.180 4.918 4.740 -0.004 0.000 0.251 260 N C 0.809 176.209 175.510 -0.182 0.000 1.199 260 N CA 0.126 53.015 53.050 -0.270 0.000 0.879 260 N CB 1.646 39.816 38.487 -0.528 0.000 1.159 260 N HN 0.089 8.469 8.380 0.000 0.000 0.514 261 G N 1.029 109.745 108.800 -0.140 0.000 2.159 261 G HA2 -0.294 3.663 3.960 -0.004 0.000 0.256 261 G HA3 -0.294 3.663 3.960 -0.004 0.000 0.256 261 G C 0.190 174.978 174.900 -0.186 0.000 0.977 261 G CA 0.441 45.463 45.100 -0.129 0.000 0.652 261 G HN 0.314 8.604 8.290 0.000 0.000 0.531 262 K N -0.745 119.549 120.400 -0.176 0.000 2.280 262 K HA 0.726 5.043 4.320 -0.004 0.000 0.234 262 K C -0.500 175.936 176.600 -0.273 0.000 1.028 262 K CA -0.895 55.328 56.287 -0.108 0.000 0.882 262 K CB 0.965 33.587 32.500 0.204 0.000 1.194 262 K HN 0.378 8.628 8.250 0.000 0.000 0.458 263 H N -0.503 118.667 119.070 0.165 0.000 2.529 263 H HA 0.589 5.142 4.556 -0.005 0.000 0.348 263 H C -1.126 174.234 175.328 0.054 0.000 1.079 263 H CA -0.762 55.335 56.048 0.082 0.000 1.198 263 H CB 1.960 31.723 29.762 0.002 0.000 1.521 263 H HN 0.609 8.889 8.280 0.000 0.000 0.514 264 A N 2.600 125.500 122.820 0.133 0.000 2.380 264 A HA 0.667 4.984 4.320 -0.004 0.000 0.315 264 A C -1.531 176.075 177.584 0.036 0.000 1.101 264 A CA -0.703 51.353 52.037 0.030 0.000 0.771 264 A CB 1.296 20.328 19.000 0.054 0.000 1.287 264 A HN 0.539 8.689 8.150 0.000 0.000 0.436 265 L N 1.556 122.781 121.223 0.004 0.000 2.362 265 L HA 0.817 5.155 4.340 -0.004 0.000 0.275 265 L C -1.085 175.757 176.870 -0.046 0.000 0.998 265 L CA -0.454 54.378 54.840 -0.013 0.000 0.820 265 L CB 1.383 43.440 42.059 -0.004 0.000 1.270 265 L HN 0.686 8.916 8.230 0.000 0.000 0.415 266 I N 4.964 125.456 120.570 -0.129 0.000 2.465 266 I HA 0.567 4.734 4.170 -0.004 0.000 0.291 266 I C -1.327 174.518 176.117 -0.453 0.000 1.014 266 I CA -0.541 60.582 61.300 -0.296 0.000 1.093 266 I CB 1.526 39.290 38.000 -0.393 0.000 1.267 266 I HN 0.618 8.828 8.210 0.000 0.000 0.431 267 I N 7.938 128.244 120.570 -0.440 0.000 2.378 267 I HA 0.283 4.450 4.170 -0.004 0.000 0.291 267 I C -1.161 174.599 176.117 -0.596 0.000 0.992 267 I CA -0.097 60.958 61.300 -0.408 0.000 1.154 267 I CB 1.268 39.185 38.000 -0.138 0.000 1.315 267 I HN 0.347 8.557 8.210 0.000 0.000 0.448 268 Y N 4.073 124.241 120.300 -0.219 0.000 2.593 268 Y HA 0.402 4.950 4.550 -0.004 0.000 0.331 268 Y C -0.104 175.646 175.900 -0.251 0.000 0.986 268 Y CA -0.676 57.268 58.100 -0.261 0.000 1.262 268 Y CB 0.798 39.108 38.460 -0.250 0.000 1.098 268 Y HN 0.412 8.692 8.280 0.000 0.000 0.506 269 D N 3.719 123.996 120.400 -0.206 0.000 2.438 269 D HA 0.180 4.818 4.640 -0.004 0.000 0.257 269 D C -1.219 175.029 176.300 -0.086 0.000 1.148 269 D CA -0.386 53.518 54.000 -0.160 0.000 0.902 269 D CB 0.343 40.997 40.800 -0.244 0.000 1.062 269 D HN 0.689 9.059 8.370 0.000 0.000 0.518 270 D N 0.232 120.615 120.400 -0.029 0.000 2.592 270 D HA 0.260 4.897 4.640 -0.004 0.000 0.263 270 D C 0.656 176.935 176.300 -0.035 0.000 1.132 270 D CA -0.726 53.258 54.000 -0.026 0.000 0.996 270 D CB 1.035 41.835 40.800 0.000 0.000 1.442 270 D HN 0.088 8.458 8.370 0.000 0.000 0.486 271 L N 0.134 121.305 121.223 -0.087 0.000 2.509 271 L HA 0.059 4.396 4.340 -0.004 0.000 0.222 271 L C 1.688 178.567 176.870 0.015 0.000 1.123 271 L CA 0.246 54.989 54.840 -0.162 0.000 0.856 271 L CB -0.239 41.482 42.059 -0.564 0.000 0.985 271 L HN 0.403 8.633 8.230 0.000 0.000 0.456 272 S N 0.345 116.066 115.700 0.036 0.000 2.355 272 S HA -0.150 4.317 4.470 -0.004 0.000 0.222 272 S C 1.922 176.613 174.600 0.153 0.000 1.031 272 S CA 1.254 59.515 58.200 0.102 0.000 0.993 272 S CB -0.025 63.223 63.200 0.080 0.000 0.859 272 S HN 0.371 8.681 8.310 0.000 0.000 0.453 273 K N 1.021 121.489 120.400 0.114 0.000 2.148 273 K HA -0.049 4.268 4.320 -0.004 0.000 0.204 273 K C 2.448 179.141 176.600 0.154 0.000 1.050 273 K CA 0.787 57.148 56.287 0.123 0.000 0.942 273 K CB -0.127 32.425 32.500 0.087 0.000 0.724 273 K HN 0.301 8.551 8.250 0.000 0.000 0.446 274 Q N 0.723 120.611 119.800 0.147 0.000 2.079 274 Q HA -0.135 4.202 4.340 -0.004 0.000 0.200 274 Q C 2.045 178.223 176.000 0.296 0.000 0.974 274 Q CA 1.582 57.497 55.803 0.187 0.000 0.840 274 Q CB -0.061 28.740 28.738 0.105 0.000 0.898 274 Q HN 0.317 8.587 8.270 0.000 0.000 0.430 275 A N 0.001 123.018 122.820 0.328 0.000 1.972 275 A HA -0.107 4.210 4.320 -0.004 0.000 0.219 275 A C 2.218 180.099 177.584 0.496 0.000 1.169 275 A CA 1.335 53.606 52.037 0.390 0.000 0.635 275 A CB -0.529 18.632 19.000 0.269 0.000 0.810 275 A HN 0.283 8.433 8.150 0.000 0.000 0.446 276 V N -0.302 119.840 119.914 0.381 0.000 2.358 276 V HA -0.229 3.888 4.120 -0.004 0.000 0.246 276 V C 3.018 179.203 176.094 0.153 0.000 1.047 276 V CA 1.876 64.310 62.300 0.223 0.000 1.035 276 V CB -1.075 30.847 31.823 0.166 0.000 0.658 276 V HN 0.608 8.798 8.190 0.000 0.000 0.452 277 A N -0.984 121.958 122.820 0.203 0.000 1.930 277 A HA -0.231 4.086 4.320 -0.004 0.000 0.217 277 A C 2.167 179.884 177.584 0.221 0.000 1.175 277 A CA 1.817 53.969 52.037 0.191 0.000 0.627 277 A CB -0.690 18.447 19.000 0.229 0.000 0.815 277 A HN 0.615 8.765 8.150 0.000 0.000 0.443 278 Y N 0.670 121.074 120.300 0.174 0.000 2.163 278 Y HA -0.195 4.354 4.550 -0.002 0.000 0.288 278 Y C 2.433 178.356 175.900 0.038 0.000 1.136 278 Y CA 1.936 60.104 58.100 0.114 0.000 1.147 278 Y CB -0.622 37.980 38.460 0.236 0.000 0.987 278 Y HN 0.346 8.626 8.280 0.000 0.000 0.509 279 R N 0.361 120.839 120.500 -0.037 0.000 2.112 279 R HA -0.312 4.026 4.340 -0.004 0.000 0.242 279 R C 2.507 178.689 176.300 -0.196 0.000 1.137 279 R CA 2.344 58.322 56.100 -0.204 0.000 0.944 279 R CB -0.614 29.535 30.300 -0.251 0.000 0.857 279 R HN 0.606 8.876 8.270 0.000 0.000 0.435 280 Q N 0.126 119.863 119.800 -0.104 0.000 2.045 280 Q HA -0.274 4.063 4.340 -0.004 0.000 0.206 280 Q C 2.220 178.156 176.000 -0.107 0.000 0.991 280 Q CA 2.390 58.142 55.803 -0.085 0.000 0.851 280 Q CB -0.189 28.531 28.738 -0.030 0.000 0.911 280 Q HN 0.511 8.781 8.270 0.000 0.000 0.418 281 M N -0.419 119.115 119.600 -0.109 0.000 2.117 281 M HA -0.183 4.295 4.480 -0.004 0.000 0.262 281 M C 2.322 178.513 176.300 -0.183 0.000 1.065 281 M CA 1.901 57.121 55.300 -0.134 0.000 1.114 281 M CB -0.143 32.369 32.600 -0.148 0.000 1.361 281 M HN 0.270 8.560 8.290 0.000 0.000 0.408 282 S N 0.486 116.013 115.700 -0.288 0.000 2.368 282 S HA -0.108 4.359 4.470 -0.004 0.000 0.225 282 S C 1.771 176.258 174.600 -0.188 0.000 1.030 282 S CA 1.184 59.204 58.200 -0.300 0.000 0.999 282 S CB -0.388 62.489 63.200 -0.539 0.000 0.844 282 S HN 0.560 8.870 8.310 0.000 0.000 0.459 283 L N 0.882 122.001 121.223 -0.174 0.000 2.046 283 L HA -0.092 4.245 4.340 -0.004 0.000 0.208 283 L C 2.321 179.137 176.870 -0.091 0.000 1.077 283 L CA 1.126 55.894 54.840 -0.120 0.000 0.747 283 L CB -0.496 41.495 42.059 -0.114 0.000 0.896 283 L HN 0.343 8.573 8.230 0.000 0.000 0.432 284 L N -0.756 120.413 121.223 -0.091 0.000 2.217 284 L HA -0.164 4.173 4.340 -0.004 0.000 0.211 284 L C 2.213 179.046 176.870 -0.063 0.000 1.107 284 L CA 0.682 55.481 54.840 -0.069 0.000 0.783 284 L CB -0.266 41.753 42.059 -0.066 0.000 0.919 284 L HN 0.259 8.489 8.230 0.000 0.000 0.442 285 L N -0.290 120.888 121.223 -0.075 0.000 2.622 285 L HA -0.019 4.319 4.340 -0.004 0.000 0.233 285 L C 0.739 177.580 176.870 -0.048 0.000 1.156 285 L CA 0.105 54.909 54.840 -0.060 0.000 0.866 285 L CB -0.136 41.882 42.059 -0.069 0.000 0.980 285 L HN 0.295 8.525 8.230 0.000 0.000 0.448 286 R N -0.762 119.706 120.500 -0.052 0.000 3.936 286 R HA -0.144 4.194 4.340 -0.004 0.000 0.366 286 R C -0.194 176.083 176.300 -0.039 0.000 1.158 286 R CA 0.513 56.588 56.100 -0.041 0.000 0.969 286 R CB -2.243 28.040 30.300 -0.029 0.000 1.504 286 R HN 0.409 8.679 8.270 0.000 0.000 0.538 287 R N 1.874 122.344 120.500 -0.051 0.000 2.296 287 R HA 0.213 4.550 4.340 -0.004 0.000 0.323 287 R C -2.022 174.251 176.300 -0.046 0.000 1.067 287 R CA -1.567 54.506 56.100 -0.044 0.000 0.946 287 R CB 0.354 30.621 30.300 -0.055 0.000 0.991 287 R HN -0.130 8.140 8.270 0.000 0.000 0.448 288 P HA -0.009 4.411 4.420 0.000 0.000 0.264 288 P C -2.177 175.109 177.300 -0.023 0.000 1.183 288 P CA -0.749 62.337 63.100 -0.024 0.000 0.763 288 P CB 0.048 31.741 31.700 -0.012 0.000 0.807 289 P HA 0.160 4.580 4.420 0.000 0.000 0.272 289 P C 0.235 177.539 177.300 0.006 0.000 1.223 289 P CA 0.154 63.241 63.100 -0.021 0.000 0.784 289 P CB 0.897 32.576 31.700 -0.036 0.000 0.923 290 G N 1.419 110.242 108.800 0.039 0.000 3.135 290 G HA2 0.351 4.308 3.960 -0.004 0.000 0.159 290 G HA3 0.351 4.308 3.960 -0.004 0.000 0.159 290 G C -0.567 174.362 174.900 0.049 0.000 1.244 290 G CA -0.874 44.255 45.100 0.049 0.000 0.965 290 G HN 0.530 8.820 8.290 0.000 0.000 0.599 291 R N 0.499 121.011 120.500 0.020 0.000 2.538 291 R HA 0.104 4.442 4.340 -0.004 0.000 0.282 291 R C 0.143 176.509 176.300 0.109 0.000 1.009 291 R CA 0.958 57.014 56.100 -0.074 0.000 1.063 291 R CB -0.196 29.843 30.300 -0.435 0.000 0.945 291 R HN 0.719 8.989 8.270 0.000 0.000 0.414 292 E N 2.452 122.707 120.200 0.092 0.000 2.883 292 E HA -0.354 3.994 4.350 -0.004 0.000 0.271 292 E C 0.385 177.066 176.600 0.134 0.000 1.049 292 E CA 0.486 57.008 56.400 0.202 0.000 0.817 292 E CB -1.192 28.755 29.700 0.412 0.000 1.407 292 E HN 0.892 9.252 8.360 0.000 0.000 0.434 293 A N -2.452 120.401 122.820 0.055 0.000 3.396 293 A HA -0.320 3.997 4.320 -0.004 0.000 0.267 293 A C 0.236 177.772 177.584 -0.082 0.000 1.139 293 A CA 1.823 53.831 52.037 -0.049 0.000 1.115 293 A CB -1.982 16.945 19.000 -0.122 0.000 1.133 293 A HN 0.432 8.582 8.150 0.000 0.000 0.920 294 Y N 0.242 120.580 120.300 0.064 0.000 2.379 294 Y HA 0.416 4.964 4.550 -0.004 0.000 0.337 294 Y C -1.397 174.527 175.900 0.041 0.000 1.238 294 Y CA -1.176 56.962 58.100 0.064 0.000 1.405 294 Y CB 0.015 38.573 38.460 0.162 0.000 1.310 294 Y HN 0.170 8.450 8.280 0.000 0.000 0.569 295 P HA -0.026 4.394 4.420 0.000 0.000 0.270 295 P C 0.672 178.092 177.300 0.199 0.000 1.227 295 P CA 0.428 63.575 63.100 0.078 0.000 0.788 295 P CB 0.598 32.271 31.700 -0.045 0.000 0.926 296 G N 1.134 110.031 108.800 0.161 0.000 2.470 296 G HA2 -0.184 3.774 3.960 -0.004 0.000 0.220 296 G HA3 -0.184 3.774 3.960 -0.004 0.000 0.220 296 G C 0.531 175.570 174.900 0.232 0.000 1.121 296 G CA 0.591 45.797 45.100 0.177 0.000 0.766 296 G HN 0.637 8.927 8.290 0.000 0.000 0.553 297 D N 0.167 120.732 120.400 0.274 0.000 2.615 297 D HA 0.100 4.737 4.640 -0.004 0.000 0.236 297 D C 1.610 178.120 176.300 0.351 0.000 1.233 297 D CA -0.536 53.661 54.000 0.328 0.000 0.829 297 D CB 0.166 41.173 40.800 0.344 0.000 1.024 297 D HN 0.053 8.423 8.370 0.000 0.000 0.490 298 V N -0.035 120.067 119.914 0.313 0.000 2.720 298 V HA -0.142 3.975 4.120 -0.004 0.000 0.256 298 V C 1.661 177.752 176.094 -0.004 0.000 1.082 298 V CA 1.337 63.738 62.300 0.168 0.000 1.101 298 V CB -0.849 31.043 31.823 0.114 0.000 0.693 298 V HN 0.309 8.499 8.190 0.000 0.000 0.479 299 F N 0.073 120.018 119.950 -0.008 0.000 2.113 299 F HA -0.171 4.353 4.527 -0.005 0.000 0.297 299 F C 2.128 177.965 175.800 0.062 0.000 1.103 299 F CA 2.256 60.251 58.000 -0.008 0.000 1.248 299 F CB -0.692 38.326 39.000 0.029 0.000 0.999 299 F HN 0.324 8.624 8.300 0.000 0.000 0.475 300 Y N 0.922 121.189 120.300 -0.056 0.000 2.224 300 Y HA -0.197 4.350 4.550 -0.005 0.000 0.289 300 Y C 2.165 177.946 175.900 -0.199 0.000 1.146 300 Y CA 1.597 59.609 58.100 -0.147 0.000 1.182 300 Y CB -0.949 37.549 38.460 0.063 0.000 0.983 300 Y HN 0.268 8.548 8.280 0.000 0.000 0.524 301 L N -0.124 120.919 121.223 -0.299 0.000 1.997 301 L HA -0.314 4.023 4.340 -0.004 0.000 0.216 301 L C 2.210 178.890 176.870 -0.315 0.000 1.074 301 L CA 2.572 57.154 54.840 -0.431 0.000 0.763 301 L CB -0.805 40.926 42.059 -0.546 0.000 0.890 301 L HN 0.382 8.612 8.230 0.000 0.000 0.434 302 H N -2.031 116.847 119.070 -0.321 0.000 2.482 302 H HA -0.005 4.549 4.556 -0.004 0.000 0.286 302 H C 2.373 177.456 175.328 -0.408 0.000 1.017 302 H CA 0.688 56.518 56.048 -0.363 0.000 1.322 302 H CB 0.111 29.688 29.762 -0.310 0.000 1.426 302 H HN 0.555 8.835 8.280 0.000 0.000 0.546 303 S N 1.683 117.115 115.700 -0.447 0.000 2.355 303 S HA -0.214 4.254 4.470 -0.004 0.000 0.222 303 S C 2.146 176.616 174.600 -0.217 0.000 1.031 303 S CA 1.098 59.020 58.200 -0.462 0.000 0.993 303 S CB -0.192 62.508 63.200 -0.833 0.000 0.859 303 S HN 0.541 8.851 8.310 0.000 0.000 0.453 304 R N 0.661 121.022 120.500 -0.232 0.000 2.115 304 R HA 0.058 4.396 4.340 -0.004 0.000 0.230 304 R C 2.323 178.571 176.300 -0.087 0.000 1.111 304 R CA 1.263 57.270 56.100 -0.153 0.000 0.976 304 R CB -0.808 29.289 30.300 -0.338 0.000 0.870 304 R HN 0.452 8.722 8.270 0.000 0.000 0.445 305 L N 1.324 122.485 121.223 -0.104 0.000 1.994 305 L HA -0.054 4.283 4.340 -0.004 0.000 0.208 305 L C 2.117 178.902 176.870 -0.141 0.000 1.071 305 L CA 1.686 56.430 54.840 -0.159 0.000 0.745 305 L CB -0.293 41.487 42.059 -0.465 0.000 0.892 305 L HN 0.241 8.471 8.230 0.000 0.000 0.431 306 L N -0.884 120.252 121.223 -0.145 0.000 2.270 306 L HA -0.029 4.308 4.340 -0.004 0.000 0.210 306 L C 2.447 179.303 176.870 -0.022 0.000 1.104 306 L CA 0.326 55.125 54.840 -0.069 0.000 0.804 306 L CB -0.604 41.404 42.059 -0.085 0.000 0.937 306 L HN 0.270 8.500 8.230 0.000 0.000 0.450 307 E N 0.738 120.919 120.200 -0.031 0.000 2.209 307 E HA -0.218 4.129 4.350 -0.004 0.000 0.196 307 E C 2.120 178.724 176.600 0.006 0.000 0.993 307 E CA 1.045 57.442 56.400 -0.005 0.000 0.819 307 E CB -0.022 29.680 29.700 0.003 0.000 0.745 307 E HN 0.495 8.855 8.360 0.000 0.000 0.477 308 R N 0.275 120.781 120.500 0.010 0.000 2.236 308 R HA 0.084 4.421 4.340 -0.004 0.000 0.208 308 R C 0.879 177.205 176.300 0.043 0.000 1.036 308 R CA 0.355 56.471 56.100 0.027 0.000 1.001 308 R CB 0.096 30.419 30.300 0.039 0.000 0.896 308 R HN -0.072 8.198 8.270 0.000 0.000 0.464 309 A N 1.332 124.182 122.820 0.049 0.000 2.454 309 A HA 0.586 4.903 4.320 -0.004 0.000 0.260 309 A C -0.208 177.395 177.584 0.031 0.000 1.106 309 A CA 0.057 52.125 52.037 0.051 0.000 0.780 309 A CB 0.338 19.372 19.000 0.057 0.000 1.044 309 A HN 0.297 8.447 8.150 0.000 0.000 0.498 310 A N 2.444 125.283 122.820 0.031 0.000 2.608 310 A HA 0.684 5.001 4.320 -0.004 0.000 0.292 310 A C -0.810 176.789 177.584 0.026 0.000 1.066 310 A CA -0.772 51.274 52.037 0.016 0.000 0.676 310 A CB 1.053 20.049 19.000 -0.006 0.000 1.277 310 A HN 0.899 9.049 8.150 0.000 0.000 0.413 311 K N 1.833 122.245 120.400 0.019 0.000 2.240 311 K HA 0.617 4.934 4.320 -0.004 0.000 0.271 311 K C -0.546 176.062 176.600 0.014 0.000 1.018 311 K CA -0.279 56.029 56.287 0.035 0.000 0.874 311 K CB 0.460 32.979 32.500 0.033 0.000 1.098 311 K HN 0.591 8.841 8.250 0.000 0.000 0.458 312 M N 3.257 122.874 119.600 0.028 0.000 2.274 312 M HA 0.218 4.695 4.480 -0.004 0.000 0.344 312 M C 0.190 176.523 176.300 0.056 0.000 1.161 312 M CA -0.833 54.479 55.300 0.019 0.000 1.126 312 M CB 0.475 33.108 32.600 0.056 0.000 1.522 312 M HN 0.765 9.055 8.290 0.000 0.000 0.461 313 N N 1.190 119.928 118.700 0.064 0.000 2.354 313 N HA 0.037 4.775 4.740 -0.004 0.000 0.246 313 N C 0.089 175.676 175.510 0.128 0.000 1.285 313 N CA -0.136 52.971 53.050 0.093 0.000 0.925 313 N CB 0.442 38.984 38.487 0.092 0.000 1.174 313 N HN 0.412 8.792 8.380 0.000 0.000 0.478 314 D N -0.295 120.160 120.400 0.092 0.000 2.178 314 D HA -0.102 4.536 4.640 -0.004 0.000 0.201 314 D C 1.640 177.979 176.300 0.063 0.000 0.980 314 D CA 1.661 55.701 54.000 0.068 0.000 0.842 314 D CB -0.550 40.277 40.800 0.045 0.000 0.948 314 D HN 0.725 9.095 8.370 0.000 0.000 0.472 315 A N -0.306 122.569 122.820 0.092 0.000 2.019 315 A HA -0.120 4.198 4.320 -0.004 0.000 0.219 315 A C 1.538 179.083 177.584 -0.064 0.000 1.164 315 A CA 0.772 52.827 52.037 0.030 0.000 0.644 315 A CB -0.600 18.441 19.000 0.068 0.000 0.805 315 A HN 0.168 8.318 8.150 0.000 0.000 0.449 316 F N -1.073 118.868 119.950 -0.016 0.000 2.660 316 F HA 0.382 4.906 4.527 -0.004 0.000 0.302 316 F C 1.754 177.531 175.800 -0.038 0.000 1.103 316 F CA 0.620 58.606 58.000 -0.024 0.000 1.340 316 F CB 0.512 39.501 39.000 -0.018 0.000 1.048 316 F HN 0.356 8.656 8.300 0.000 0.000 0.551 317 G N -0.680 108.163 108.800 0.072 0.000 2.218 317 G HA2 -0.105 3.853 3.960 -0.004 0.000 0.216 317 G HA3 -0.105 3.853 3.960 -0.004 0.000 0.216 317 G C 1.269 176.177 174.900 0.013 0.000 0.994 317 G CA -0.123 44.985 45.100 0.012 0.000 0.637 317 G HN 0.968 9.258 8.290 0.000 0.000 0.505 318 G N -0.484 108.347 108.800 0.052 0.000 2.189 318 G HA2 0.147 4.105 3.960 -0.004 0.000 0.267 318 G HA3 0.147 4.105 3.960 -0.004 0.000 0.267 318 G C 1.542 176.455 174.900 0.022 0.000 0.975 318 G CA 1.195 46.328 45.100 0.055 0.000 0.644 318 G HN 2.104 10.394 8.290 0.000 0.000 0.537 319 G N -0.480 108.274 108.800 -0.076 0.000 2.653 319 G HA2 0.712 4.670 3.960 -0.004 0.000 0.265 319 G HA3 0.712 4.670 3.960 -0.004 0.000 0.265 319 G C 0.319 175.194 174.900 -0.042 0.000 1.237 319 G CA 1.048 46.001 45.100 -0.246 0.000 0.946 319 G HN 1.869 10.159 8.290 0.000 0.000 0.522 320 S N -1.830 113.876 115.700 0.011 0.000 2.588 320 S HA 0.616 5.083 4.470 -0.004 0.000 0.269 320 S C -1.549 173.125 174.600 0.122 0.000 1.157 320 S CA -0.812 57.468 58.200 0.134 0.000 0.824 320 S CB 1.855 65.209 63.200 0.257 0.000 1.126 320 S HN 1.273 9.583 8.310 0.000 0.000 0.464 321 L N 1.150 122.431 121.223 0.096 0.000 2.438 321 L HA 0.784 5.122 4.340 -0.004 0.000 0.270 321 L C -0.948 175.956 176.870 0.058 0.000 0.972 321 L CA 0.216 55.109 54.840 0.087 0.000 0.831 321 L CB 2.066 44.180 42.059 0.092 0.000 1.273 321 L HN 0.931 9.161 8.230 0.000 0.000 0.405 322 T N 3.986 118.563 114.554 0.037 0.000 2.824 322 T HA 0.871 5.219 4.350 -0.004 0.000 0.280 322 T C -0.510 174.184 174.700 -0.011 0.000 0.995 322 T CA -0.266 61.842 62.100 0.013 0.000 1.009 322 T CB 1.568 70.436 68.868 -0.000 0.000 0.955 322 T HN 0.822 9.062 8.240 0.000 0.000 0.452 323 A N 3.100 125.917 122.820 -0.005 0.000 2.343 323 A HA 0.757 5.075 4.320 -0.004 0.000 0.316 323 A C -0.684 176.885 177.584 -0.025 0.000 1.104 323 A CA -0.768 51.252 52.037 -0.029 0.000 0.768 323 A CB 0.613 19.663 19.000 0.084 0.000 1.213 323 A HN 0.849 8.999 8.150 0.000 0.000 0.456 324 L N 4.432 125.610 121.223 -0.074 0.000 2.387 324 L HA 0.354 4.691 4.340 -0.004 0.000 0.259 324 L C -2.327 174.526 176.870 -0.029 0.000 1.050 324 L CA -1.783 53.036 54.840 -0.035 0.000 0.922 324 L CB 1.222 43.264 42.059 -0.028 0.000 1.280 324 L HN 0.471 8.701 8.230 0.000 0.000 0.449 325 P HA 0.187 4.607 4.420 0.000 0.000 0.274 325 P C -0.549 176.750 177.300 -0.001 0.000 1.237 325 P CA -0.228 62.912 63.100 0.066 0.000 0.793 325 P CB 2.040 33.748 31.700 0.012 0.000 0.977 326 V N 3.282 123.185 119.914 -0.019 0.000 2.604 326 V HA 0.424 4.542 4.120 -0.004 0.000 0.305 326 V C 0.189 176.266 176.094 -0.028 0.000 1.043 326 V CA -0.587 61.706 62.300 -0.011 0.000 0.888 326 V CB 1.815 33.639 31.823 0.001 0.000 0.995 326 V HN 0.407 8.597 8.190 0.000 0.000 0.429 327 I N 3.350 123.917 120.570 -0.004 0.000 2.498 327 I HA 0.432 4.600 4.170 -0.004 0.000 0.290 327 I C -0.095 176.045 176.117 0.037 0.000 1.032 327 I CA -0.394 60.905 61.300 -0.001 0.000 1.073 327 I CB 2.134 40.123 38.000 -0.018 0.000 1.251 327 I HN 0.778 8.988 8.210 0.000 0.000 0.426 328 E N 5.127 125.353 120.200 0.043 0.000 2.146 328 E HA 0.389 4.737 4.350 -0.004 0.000 0.282 328 E C -0.529 176.113 176.600 0.070 0.000 0.989 328 E CA -0.362 56.075 56.400 0.060 0.000 0.799 328 E CB 1.209 30.942 29.700 0.056 0.000 1.088 328 E HN 0.699 9.059 8.360 0.000 0.000 0.397 329 T N 1.912 116.521 114.554 0.092 0.000 2.881 329 T HA 0.326 4.673 4.350 -0.004 0.000 0.278 329 T C -0.020 174.736 174.700 0.094 0.000 0.982 329 T CA -0.995 61.163 62.100 0.096 0.000 0.989 329 T CB 1.493 70.443 68.868 0.138 0.000 1.058 329 T HN 0.356 8.596 8.240 0.000 0.000 0.529 330 Q N 0.207 120.060 119.800 0.090 0.000 2.316 330 Q HA 0.557 4.894 4.340 -0.004 0.000 0.264 330 Q C 0.512 176.564 176.000 0.087 0.000 0.987 330 Q CA -0.220 55.633 55.803 0.082 0.000 0.852 330 Q CB 1.439 30.224 28.738 0.079 0.000 1.287 330 Q HN 1.235 9.505 8.270 0.000 0.000 0.448 331 A N 2.031 124.899 122.820 0.081 0.000 2.799 331 A HA -0.178 4.140 4.320 -0.004 0.000 0.287 331 A C 1.112 178.761 177.584 0.108 0.000 1.484 331 A CA 1.628 53.715 52.037 0.082 0.000 0.813 331 A CB -2.133 16.908 19.000 0.069 0.000 1.009 331 A HN 1.638 9.788 8.150 0.000 0.000 0.545 332 G N -1.467 107.420 108.800 0.145 0.000 2.143 332 G HA2 -0.167 3.791 3.960 -0.004 0.000 0.248 332 G HA3 -0.167 3.791 3.960 -0.004 0.000 0.248 332 G C -0.100 174.953 174.900 0.255 0.000 0.991 332 G CA 0.993 46.237 45.100 0.240 0.000 0.689 332 G HN 1.656 9.946 8.290 0.000 0.000 0.522 333 D N 0.778 121.261 120.400 0.138 0.000 2.524 333 D HA 0.437 5.075 4.640 -0.004 0.000 0.222 333 D C 1.854 178.133 176.300 -0.035 0.000 1.142 333 D CA 0.146 54.180 54.000 0.056 0.000 0.973 333 D CB 0.470 41.302 40.800 0.054 0.000 1.025 333 D HN 0.467 8.837 8.370 0.000 0.000 0.519 334 V N 0.933 120.723 119.914 -0.208 0.000 3.078 334 V HA -0.058 4.060 4.120 -0.004 0.000 0.265 334 V C 1.803 177.774 176.094 -0.206 0.000 1.122 334 V CA 0.822 62.900 62.300 -0.370 0.000 1.141 334 V CB -0.452 30.844 31.823 -0.879 0.000 0.735 334 V HN 0.287 8.477 8.190 0.000 0.000 0.498 335 S N 0.230 115.858 115.700 -0.120 0.000 2.603 335 S HA 0.489 4.957 4.470 -0.004 0.000 0.220 335 S C 1.274 175.869 174.600 -0.008 0.000 0.967 335 S CA 0.392 58.557 58.200 -0.058 0.000 0.920 335 S CB -0.268 62.912 63.200 -0.033 0.000 0.773 335 S HN 0.848 9.158 8.310 0.000 0.000 0.529 336 A N 0.455 123.278 122.820 0.004 0.000 2.366 336 A HA 0.347 4.664 4.320 -0.004 0.000 0.250 336 A C 0.901 178.540 177.584 0.091 0.000 1.099 336 A CA -0.194 51.878 52.037 0.059 0.000 0.794 336 A CB -0.237 18.803 19.000 0.067 0.000 1.056 336 A HN 0.384 8.534 8.150 0.000 0.000 0.499 337 Y N 0.771 121.070 120.300 -0.001 0.000 2.014 337 Y HA -0.264 4.283 4.550 -0.004 0.000 0.270 337 Y C 1.785 177.677 175.900 -0.014 0.000 1.145 337 Y CA 2.596 60.694 58.100 -0.004 0.000 1.106 337 Y CB -0.679 37.785 38.460 0.007 0.000 0.968 337 Y HN 0.477 8.757 8.280 0.000 0.000 0.484 338 I N 0.369 120.792 120.570 -0.245 0.000 2.179 338 I HA -0.209 3.958 4.170 -0.004 0.000 0.242 338 I C -0.721 175.287 176.117 -0.180 0.000 1.088 338 I CA 1.504 62.581 61.300 -0.372 0.000 1.357 338 I CB -1.796 36.007 38.000 -0.330 0.000 1.051 338 I HN 0.220 8.430 8.210 0.000 0.000 0.409 339 P HA -0.175 4.245 4.420 0.000 0.000 0.215 339 P C 1.749 179.010 177.300 -0.065 0.000 1.157 339 P CA 2.235 65.294 63.100 -0.068 0.000 0.868 339 P CB -0.377 31.285 31.700 -0.063 0.000 0.788 340 T N -3.845 110.674 114.554 -0.058 0.000 2.867 340 T HA -0.105 4.243 4.350 -0.004 0.000 0.268 340 T C 1.733 176.427 174.700 -0.009 0.000 1.057 340 T CA 1.079 63.160 62.100 -0.033 0.000 1.136 340 T CB -1.144 67.717 68.868 -0.011 0.000 0.874 340 T HN -0.055 8.185 8.240 0.000 0.000 0.466 341 N N 1.569 120.242 118.700 -0.045 0.000 2.037 341 N HA -0.094 4.643 4.740 -0.004 0.000 0.196 341 N C 1.933 177.527 175.510 0.139 0.000 1.034 341 N CA 1.499 54.584 53.050 0.057 0.000 0.861 341 N CB -0.869 37.580 38.487 -0.063 0.000 1.039 341 N HN 0.370 8.750 8.380 0.000 0.000 0.427 342 V N 1.213 121.150 119.914 0.039 0.000 2.379 342 V HA -0.095 4.023 4.120 -0.004 0.000 0.245 342 V C 2.246 178.350 176.094 0.017 0.000 1.044 342 V CA 0.917 63.225 62.300 0.014 0.000 1.036 342 V CB -0.423 31.370 31.823 -0.050 0.000 0.664 342 V HN 0.212 8.402 8.190 0.000 0.000 0.453 343 I N 1.564 122.138 120.570 0.006 0.000 2.194 343 I HA -0.269 3.898 4.170 -0.004 0.000 0.246 343 I C 2.535 178.677 176.117 0.041 0.000 1.093 343 I CA 2.034 63.339 61.300 0.008 0.000 1.355 343 I CB -0.471 37.517 38.000 -0.020 0.000 1.046 343 I HN 0.483 8.693 8.210 0.000 0.000 0.413 344 S N 0.080 115.827 115.700 0.078 0.000 2.603 344 S HA 0.033 4.500 4.470 -0.004 0.000 0.229 344 S C 1.588 176.306 174.600 0.197 0.000 0.972 344 S CA 0.536 58.809 58.200 0.120 0.000 0.935 344 S CB -0.474 62.791 63.200 0.108 0.000 0.769 344 S HN 0.458 8.768 8.310 0.000 0.000 0.536 345 I N 1.413 122.073 120.570 0.150 0.000 2.947 345 I HA 0.064 4.231 4.170 -0.004 0.000 0.263 345 I C 1.421 177.565 176.117 0.046 0.000 1.130 345 I CA 0.592 61.950 61.300 0.097 0.000 1.448 345 I CB -0.403 37.589 38.000 -0.013 0.000 1.222 345 I HN 0.340 8.550 8.210 0.000 0.000 0.453 346 T N -1.228 113.342 114.554 0.026 0.000 2.813 346 T HA 0.067 4.414 4.350 -0.004 0.000 0.297 346 T C 0.230 174.944 174.700 0.022 0.000 1.036 346 T CA -0.490 61.620 62.100 0.016 0.000 1.044 346 T CB 0.592 69.464 68.868 0.007 0.000 0.993 346 T HN 0.060 8.300 8.240 0.000 0.000 0.535 347 D N 1.335 121.746 120.400 0.018 0.000 3.038 347 D HA 0.411 5.048 4.640 -0.004 0.000 0.243 347 D C 1.010 177.320 176.300 0.017 0.000 1.245 347 D CA 0.437 54.447 54.000 0.018 0.000 0.871 347 D CB -0.688 40.120 40.800 0.014 0.000 1.089 347 D HN 1.020 9.390 8.370 0.000 0.000 0.464 348 G N 1.192 110.003 108.800 0.018 0.000 2.381 348 G HA2 0.108 4.065 3.960 -0.004 0.000 0.672 348 G HA3 0.108 4.065 3.960 -0.004 0.000 0.672 348 G C -1.580 173.334 174.900 0.023 0.000 1.324 348 G CA -1.002 44.110 45.100 0.020 0.000 0.975 348 G HN 0.194 8.484 8.290 0.000 0.000 0.593 349 Q N -0.638 119.181 119.800 0.032 0.000 2.377 349 Q HA 0.666 5.003 4.340 -0.004 0.000 0.279 349 Q C -1.526 174.518 176.000 0.074 0.000 1.049 349 Q CA -0.953 54.877 55.803 0.045 0.000 0.825 349 Q CB 1.942 30.699 28.738 0.032 0.000 1.401 349 Q HN 0.920 9.190 8.270 0.000 0.000 0.404 350 I N 2.728 123.351 120.570 0.089 0.000 2.328 350 I HA 0.341 4.508 4.170 -0.004 0.000 0.287 350 I C -0.862 175.366 176.117 0.185 0.000 1.012 350 I CA -0.769 60.596 61.300 0.108 0.000 1.195 350 I CB 0.848 38.890 38.000 0.069 0.000 1.350 350 I HN 0.483 8.693 8.210 0.000 0.000 0.464 351 F N 8.229 128.189 119.950 0.017 0.000 2.415 351 F HA 0.606 5.130 4.527 -0.004 0.000 0.348 351 F C -0.885 174.929 175.800 0.024 0.000 1.119 351 F CA -0.997 57.014 58.000 0.019 0.000 1.069 351 F CB 0.730 39.742 39.000 0.020 0.000 1.124 351 F HN 0.180 8.480 8.300 0.000 0.000 0.472 352 L N 5.715 126.753 121.223 -0.308 0.000 2.325 352 L HA 0.576 4.913 4.340 -0.004 0.000 0.278 352 L C -0.700 175.782 176.870 -0.645 0.000 1.023 352 L CA -0.739 53.878 54.840 -0.371 0.000 0.811 352 L CB 1.902 43.885 42.059 -0.128 0.000 1.249 352 L HN 0.533 8.763 8.230 0.000 0.000 0.431 353 E N -0.127 119.803 120.200 -0.451 0.000 2.272 353 E HA 0.212 4.559 4.350 -0.004 0.000 0.269 353 E C 0.235 176.758 176.600 -0.127 0.000 0.877 353 E CA -0.406 55.790 56.400 -0.340 0.000 0.755 353 E CB 2.298 31.793 29.700 -0.341 0.000 1.192 353 E HN 0.750 9.110 8.360 0.000 0.000 0.422 354 T N -0.787 113.715 114.554 -0.086 0.000 2.699 354 T HA -0.288 4.059 4.350 -0.004 0.000 0.268 354 T C 1.566 176.338 174.700 0.121 0.000 1.036 354 T CA 1.642 63.726 62.100 -0.027 0.000 1.147 354 T CB -0.082 68.827 68.868 0.070 0.000 0.862 354 T HN 0.561 8.801 8.240 0.000 0.000 0.446 355 E N 1.014 121.279 120.200 0.109 0.000 2.033 355 E HA -0.151 4.197 4.350 -0.004 0.000 0.199 355 E C 2.299 178.965 176.600 0.110 0.000 1.011 355 E CA 1.503 57.981 56.400 0.130 0.000 0.815 355 E CB -0.318 29.426 29.700 0.074 0.000 0.755 355 E HN 0.579 8.939 8.360 0.000 0.000 0.451 356 L N -0.042 121.209 121.223 0.046 0.000 1.989 356 L HA -0.206 4.131 4.340 -0.004 0.000 0.211 356 L C 2.582 179.470 176.870 0.029 0.000 1.071 356 L CA 1.486 56.339 54.840 0.023 0.000 0.749 356 L CB -0.658 41.389 42.059 -0.021 0.000 0.890 356 L HN 0.240 8.470 8.230 0.000 0.000 0.431 357 F N 0.033 119.896 119.950 -0.144 0.000 2.065 357 F HA -0.340 4.184 4.527 -0.004 0.000 0.298 357 F C 2.382 178.050 175.800 -0.220 0.000 1.112 357 F CA 1.850 59.704 58.000 -0.242 0.000 1.212 357 F CB -0.381 38.377 39.000 -0.403 0.000 0.975 357 F HN -0.062 8.238 8.300 0.000 0.000 0.476 358 Y N -0.234 120.215 120.300 0.249 0.000 2.373 358 Y HA -0.096 4.451 4.550 -0.005 0.000 0.293 358 Y C 2.160 178.079 175.900 0.032 0.000 1.129 358 Y CA 0.868 59.053 58.100 0.142 0.000 1.226 358 Y CB -0.286 38.264 38.460 0.151 0.000 1.000 358 Y HN -0.032 8.248 8.280 0.000 0.000 0.549 359 K N -0.483 120.006 120.400 0.147 0.000 2.439 359 K HA 0.013 4.331 4.320 -0.004 0.000 0.197 359 K C 1.447 178.053 176.600 0.010 0.000 1.041 359 K CA 0.846 57.175 56.287 0.070 0.000 0.970 359 K CB -0.094 32.437 32.500 0.053 0.000 0.773 359 K HN 0.453 8.703 8.250 0.000 0.000 0.479 360 G N 0.741 109.508 108.800 -0.055 0.000 2.179 360 G HA2 -0.170 3.787 3.960 -0.004 0.000 0.220 360 G HA3 -0.170 3.787 3.960 -0.004 0.000 0.220 360 G C 0.002 174.823 174.900 -0.131 0.000 0.990 360 G CA -0.462 44.570 45.100 -0.114 0.000 0.646 360 G HN 0.096 8.386 8.290 0.000 0.000 0.517 361 I N 2.133 122.641 120.570 -0.103 0.000 2.460 361 I HA 0.311 4.478 4.170 -0.004 0.000 0.297 361 I C 0.738 176.761 176.117 -0.158 0.000 1.139 361 I CA 0.523 61.768 61.300 -0.092 0.000 1.340 361 I CB -0.642 37.333 38.000 -0.042 0.000 1.444 361 I HN 0.174 8.384 8.210 0.000 0.000 0.557 362 R N 7.551 127.942 120.500 -0.182 0.000 2.514 362 R HA 0.406 4.744 4.340 -0.004 0.000 0.296 362 R C -2.614 173.610 176.300 -0.128 0.000 1.012 362 R CA -1.630 54.338 56.100 -0.220 0.000 0.897 362 R CB 2.554 32.602 30.300 -0.419 0.000 1.184 362 R HN 0.271 8.541 8.270 0.000 0.000 0.440 363 P HA 0.011 4.431 4.420 0.000 0.000 0.269 363 P C -0.315 176.960 177.300 -0.042 0.000 1.209 363 P CA -0.173 62.896 63.100 -0.052 0.000 0.776 363 P CB 0.925 32.608 31.700 -0.029 0.000 0.876 364 A N 4.078 126.896 122.820 -0.003 0.000 3.019 364 A HA 0.225 4.542 4.320 -0.004 0.000 0.262 364 A C 0.735 178.285 177.584 -0.056 0.000 1.509 364 A CA -0.428 51.603 52.037 -0.011 0.000 1.159 364 A CB -1.424 17.629 19.000 0.089 0.000 1.042 364 A HN 0.468 8.618 8.150 0.000 0.000 0.641 365 I N 1.272 121.819 120.570 -0.038 0.000 2.452 365 I HA 0.027 4.194 4.170 -0.004 0.000 0.287 365 I C 0.514 176.618 176.117 -0.022 0.000 1.079 365 I CA -0.355 60.928 61.300 -0.028 0.000 1.387 365 I CB 0.557 38.560 38.000 0.005 0.000 1.404 365 I HN 0.349 8.559 8.210 0.000 0.000 0.522 366 N N 6.403 125.085 118.700 -0.030 0.000 2.401 366 N HA 0.069 4.806 4.740 -0.004 0.000 0.255 366 N C 0.695 176.259 175.510 0.090 0.000 1.110 366 N CA 0.018 53.090 53.050 0.036 0.000 0.949 366 N CB 1.494 40.030 38.487 0.082 0.000 1.110 366 N HN 0.410 8.790 8.380 0.000 0.000 0.490 367 V N 4.101 124.058 119.914 0.071 0.000 2.307 367 V HA -0.119 3.998 4.120 -0.004 0.000 0.245 367 V C 2.385 178.525 176.094 0.076 0.000 1.045 367 V CA 2.184 64.526 62.300 0.069 0.000 1.024 367 V CB -0.983 30.878 31.823 0.064 0.000 0.651 367 V HN 0.777 8.967 8.190 0.000 0.000 0.449 368 G N -0.259 108.588 108.800 0.077 0.000 2.442 368 G HA2 -0.212 3.745 3.960 -0.004 0.000 0.219 368 G HA3 -0.212 3.745 3.960 -0.004 0.000 0.219 368 G C 1.532 176.479 174.900 0.079 0.000 1.141 368 G CA 0.920 46.061 45.100 0.069 0.000 0.763 368 G HN 0.486 8.776 8.290 0.000 0.000 0.554 369 L N 0.706 122.003 121.223 0.123 0.000 2.509 369 L HA 0.177 4.514 4.340 -0.004 0.000 0.222 369 L C 0.922 177.864 176.870 0.120 0.000 1.123 369 L CA -0.202 54.716 54.840 0.131 0.000 0.856 369 L CB 0.093 42.295 42.059 0.237 0.000 0.985 369 L HN 0.043 8.273 8.230 0.000 0.000 0.456 370 S N -0.052 115.726 115.700 0.129 0.000 2.610 370 S HA 0.569 5.036 4.470 -0.004 0.000 0.273 370 S C -0.229 174.408 174.600 0.062 0.000 1.274 370 S CA -0.591 57.671 58.200 0.104 0.000 1.023 370 S CB 2.070 65.333 63.200 0.106 0.000 0.962 370 S HN 0.073 8.383 8.310 0.000 0.000 0.523 371 V N -0.959 118.984 119.914 0.049 0.000 3.178 371 V HA 0.840 4.957 4.120 -0.004 0.000 0.302 371 V C -0.528 175.583 176.094 0.029 0.000 1.262 371 V CA -0.873 61.447 62.300 0.034 0.000 1.030 371 V CB 1.686 33.524 31.823 0.025 0.000 1.074 371 V HN 0.722 8.912 8.190 0.000 0.000 0.438 372 S N 1.161 116.875 115.700 0.023 0.000 2.475 372 S HA 0.586 5.054 4.470 -0.004 0.000 0.298 372 S C 0.489 175.098 174.600 0.015 0.000 1.119 372 S CA -0.757 57.454 58.200 0.017 0.000 1.085 372 S CB 1.594 64.802 63.200 0.014 0.000 1.028 372 S HN 0.837 9.147 8.310 0.000 0.000 0.489 373 R N 3.051 123.559 120.500 0.013 0.000 2.334 373 R HA 0.206 4.544 4.340 -0.004 0.000 0.216 373 R C 0.776 177.081 176.300 0.009 0.000 0.905 373 R CA 0.201 56.308 56.100 0.012 0.000 1.064 373 R CB 0.159 30.468 30.300 0.014 0.000 1.046 373 R HN 0.493 8.763 8.270 0.000 0.000 0.508 374 V N -0.467 119.451 119.914 0.007 0.000 3.212 374 V HA 0.186 4.303 4.120 -0.004 0.000 0.244 374 V C 1.422 177.517 176.094 0.002 0.000 1.151 374 V CA 0.921 63.222 62.300 0.003 0.000 1.119 374 V CB 0.246 32.068 31.823 -0.001 0.000 0.838 374 V HN 0.588 8.778 8.190 0.000 0.000 0.470 375 G N 1.595 110.397 108.800 0.004 0.000 2.582 375 G HA2 -0.402 3.555 3.960 -0.004 0.000 0.288 375 G HA3 -0.402 3.555 3.960 -0.004 0.000 0.288 375 G C 1.189 176.089 174.900 0.000 0.000 1.247 375 G CA 1.162 46.264 45.100 0.004 0.000 0.972 375 G HN 0.944 9.234 8.290 0.000 0.000 0.557 376 S N 0.228 115.928 115.700 0.001 0.000 2.474 376 S HA 0.251 4.718 4.470 -0.004 0.000 0.235 376 S C 2.609 177.206 174.600 -0.005 0.000 0.997 376 S CA 1.676 59.876 58.200 -0.001 0.000 0.949 376 S CB -0.423 62.777 63.200 0.001 0.000 0.766 376 S HN 2.099 10.409 8.310 0.000 0.000 0.517 377 A N 1.603 124.420 122.820 -0.005 0.000 2.032 377 A HA 0.207 4.524 4.320 -0.004 0.000 0.221 377 A C 2.237 179.811 177.584 -0.016 0.000 1.165 377 A CA 1.602 53.634 52.037 -0.009 0.000 0.645 377 A CB -1.064 17.932 19.000 -0.007 0.000 0.807 377 A HN 0.991 9.141 8.150 0.000 0.000 0.453 378 A N -1.630 121.180 122.820 -0.016 0.000 2.345 378 A HA 0.354 4.672 4.320 -0.004 0.000 0.225 378 A C 0.750 178.317 177.584 -0.028 0.000 1.243 378 A CA -0.163 51.859 52.037 -0.026 0.000 0.875 378 A CB 0.033 19.020 19.000 -0.022 0.000 0.929 378 A HN 0.608 8.758 8.150 0.000 0.000 0.502 379 Q N 0.491 120.280 119.800 -0.019 0.000 2.266 379 Q HA 0.431 4.768 4.340 -0.004 0.000 0.261 379 Q C -0.060 175.931 176.000 -0.016 0.000 0.985 379 Q CA -0.547 55.248 55.803 -0.014 0.000 0.873 379 Q CB 1.664 30.400 28.738 -0.003 0.000 1.306 379 Q HN 0.456 8.726 8.270 0.000 0.000 0.447 380 T N -1.540 113.006 114.554 -0.013 0.000 2.903 380 T HA 0.039 4.386 4.350 -0.004 0.000 0.314 380 T C 0.946 175.646 174.700 -0.000 0.000 1.078 380 T CA -0.336 61.758 62.100 -0.010 0.000 1.114 380 T CB 0.918 69.783 68.868 -0.005 0.000 0.987 380 T HN 0.774 9.014 8.240 0.000 0.000 0.548 381 R N 1.695 122.195 120.500 0.001 0.000 2.117 381 R HA -0.127 4.210 4.340 -0.004 0.000 0.243 381 R C 2.495 178.805 176.300 0.017 0.000 1.143 381 R CA 1.902 58.007 56.100 0.007 0.000 0.968 381 R CB -1.125 29.178 30.300 0.006 0.000 0.863 381 R HN 0.847 9.117 8.270 0.000 0.000 0.444 382 A N 0.512 123.343 122.820 0.019 0.000 1.883 382 A HA -0.208 4.109 4.320 -0.004 0.000 0.217 382 A C 2.147 179.757 177.584 0.042 0.000 1.186 382 A CA 1.766 53.822 52.037 0.032 0.000 0.624 382 A CB -0.602 18.412 19.000 0.024 0.000 0.822 382 A HN 0.513 8.663 8.150 0.000 0.000 0.444 383 M N 0.117 119.736 119.600 0.031 0.000 2.132 383 M HA -0.078 4.400 4.480 -0.004 0.000 0.263 383 M C 1.940 178.257 176.300 0.028 0.000 1.065 383 M CA 2.265 57.585 55.300 0.033 0.000 1.122 383 M CB -0.503 32.111 32.600 0.023 0.000 1.365 383 M HN 0.425 8.715 8.290 0.000 0.000 0.411 384 K N -0.547 119.865 120.400 0.020 0.000 2.103 384 K HA -0.224 4.094 4.320 -0.004 0.000 0.207 384 K C 1.986 178.598 176.600 0.020 0.000 1.048 384 K CA 1.821 58.117 56.287 0.015 0.000 0.930 384 K CB -0.180 32.326 32.500 0.010 0.000 0.716 384 K HN 0.570 8.820 8.250 0.000 0.000 0.444 385 Q N 0.051 119.870 119.800 0.031 0.000 2.084 385 Q HA -0.140 4.197 4.340 -0.004 0.000 0.202 385 Q C 2.123 178.147 176.000 0.040 0.000 0.978 385 Q CA 1.924 57.750 55.803 0.039 0.000 0.844 385 Q CB 0.038 28.811 28.738 0.059 0.000 0.898 385 Q HN 0.409 8.679 8.270 0.000 0.000 0.426 386 V N -3.980 115.966 119.914 0.054 0.000 2.878 386 V HA 0.244 4.361 4.120 -0.004 0.000 0.250 386 V C 1.527 177.629 176.094 0.014 0.000 1.075 386 V CA 1.195 63.523 62.300 0.046 0.000 1.096 386 V CB 0.092 31.975 31.823 0.100 0.000 0.724 386 V HN 0.196 8.386 8.190 0.000 0.000 0.467 387 A N 0.439 123.268 122.820 0.016 0.000 2.382 387 A HA 0.528 4.845 4.320 -0.004 0.000 0.228 387 A C 2.052 179.637 177.584 0.001 0.000 1.217 387 A CA 0.666 52.707 52.037 0.007 0.000 0.923 387 A CB -0.417 18.590 19.000 0.013 0.000 0.979 387 A HN 0.596 8.746 8.150 0.000 0.000 0.515 388 G N 0.788 109.589 108.800 0.001 0.000 2.503 388 G HA2 -0.275 3.682 3.960 -0.004 0.000 0.221 388 G HA3 -0.275 3.682 3.960 -0.004 0.000 0.221 388 G C 1.469 176.367 174.900 -0.003 0.000 1.131 388 G CA 2.106 47.206 45.100 0.000 0.000 0.756 388 G HN 0.815 9.105 8.290 0.000 0.000 0.572 389 T N -3.272 111.277 114.554 -0.009 0.000 3.044 389 T HA 0.325 4.672 4.350 -0.004 0.000 0.260 389 T C 2.038 176.732 174.700 -0.009 0.000 1.019 389 T CA 0.501 62.596 62.100 -0.010 0.000 0.921 389 T CB 0.152 69.011 68.868 -0.016 0.000 1.053 389 T HN 0.153 8.393 8.240 0.000 0.000 0.533 390 M N 1.048 120.641 119.600 -0.011 0.000 2.159 390 M HA 0.045 4.522 4.480 -0.004 0.000 0.263 390 M C 2.367 178.669 176.300 0.003 0.000 1.063 390 M CA 1.491 56.784 55.300 -0.012 0.000 1.110 390 M CB -0.147 32.443 32.600 -0.016 0.000 1.374 390 M HN 0.154 8.444 8.290 0.000 0.000 0.411 391 K N 0.238 120.643 120.400 0.010 0.000 2.057 391 K HA -0.127 4.191 4.320 -0.004 0.000 0.206 391 K C 1.810 178.425 176.600 0.026 0.000 1.050 391 K CA 1.238 57.538 56.287 0.021 0.000 0.935 391 K CB -0.144 32.368 32.500 0.021 0.000 0.715 391 K HN 0.392 8.642 8.250 0.000 0.000 0.439 392 L N 0.634 121.868 121.223 0.019 0.000 2.056 392 L HA -0.161 4.176 4.340 -0.004 0.000 0.207 392 L C 2.565 179.452 176.870 0.027 0.000 1.078 392 L CA 1.274 56.126 54.840 0.020 0.000 0.749 392 L CB -0.443 41.622 42.059 0.011 0.000 0.901 392 L HN 0.374 8.604 8.230 0.000 0.000 0.433 393 E N 0.648 120.861 120.200 0.022 0.000 2.085 393 E HA -0.236 4.111 4.350 -0.004 0.000 0.194 393 E C 2.333 178.976 176.600 0.071 0.000 0.994 393 E CA 1.131 57.548 56.400 0.028 0.000 0.801 393 E CB 0.020 29.719 29.700 -0.001 0.000 0.743 393 E HN 0.468 8.828 8.360 0.000 0.000 0.453 394 L N 0.024 121.290 121.223 0.072 0.000 2.156 394 L HA -0.065 4.272 4.340 -0.004 0.000 0.208 394 L C 2.570 179.538 176.870 0.162 0.000 1.095 394 L CA 0.691 55.615 54.840 0.141 0.000 0.770 394 L CB -0.313 41.802 42.059 0.094 0.000 0.914 394 L HN 0.193 8.423 8.230 0.000 0.000 0.439 395 A N -0.573 122.301 122.820 0.090 0.000 1.877 395 A HA -0.215 4.103 4.320 -0.004 0.000 0.216 395 A C 2.238 179.848 177.584 0.043 0.000 1.186 395 A CA 1.237 53.309 52.037 0.058 0.000 0.620 395 A CB -0.391 18.633 19.000 0.039 0.000 0.822 395 A HN 0.341 8.491 8.150 0.000 0.000 0.443 396 Q N -1.530 118.301 119.800 0.051 0.000 2.124 396 Q HA -0.204 4.133 4.340 -0.004 0.000 0.202 396 Q C 1.939 177.972 176.000 0.055 0.000 0.977 396 Q CA 1.873 57.697 55.803 0.036 0.000 0.850 396 Q CB -0.584 28.174 28.738 0.033 0.000 0.901 396 Q HN 0.881 9.151 8.270 0.000 0.000 0.429 397 Y N 1.509 121.804 120.300 -0.008 0.000 2.097 397 Y HA -0.235 4.313 4.550 -0.004 0.000 0.282 397 Y C 2.249 178.148 175.900 -0.001 0.000 1.152 397 Y CA 1.828 59.923 58.100 -0.007 0.000 1.136 397 Y CB -0.271 38.181 38.460 -0.013 0.000 0.975 397 Y HN -0.053 8.227 8.280 0.000 0.000 0.498 398 R N 0.142 120.416 120.500 -0.377 0.000 2.096 398 R HA -0.162 4.176 4.340 -0.004 0.000 0.235 398 R C 2.422 178.562 176.300 -0.266 0.000 1.127 398 R CA 1.346 57.177 56.100 -0.448 0.000 0.968 398 R CB -0.365 29.835 30.300 -0.165 0.000 0.861 398 R HN 0.398 8.668 8.270 0.000 0.000 0.440 399 E N 0.716 120.834 120.200 -0.138 0.000 2.051 399 E HA -0.157 4.191 4.350 -0.004 0.000 0.192 399 E C 1.880 178.446 176.600 -0.057 0.000 0.991 399 E CA 1.575 57.931 56.400 -0.073 0.000 0.799 399 E CB 0.051 29.725 29.700 -0.043 0.000 0.748 399 E HN 0.126 8.486 8.360 0.000 0.000 0.449 400 V N 1.465 121.339 119.914 -0.067 0.000 2.427 400 V HA -0.194 3.923 4.120 -0.004 0.000 0.248 400 V C 2.654 178.721 176.094 -0.045 0.000 1.051 400 V CA 1.651 63.953 62.300 0.002 0.000 1.048 400 V CB -1.002 30.836 31.823 0.024 0.000 0.666 400 V HN 0.335 8.525 8.190 0.000 0.000 0.456 401 A N 0.128 122.824 122.820 -0.208 0.000 1.972 401 A HA -0.056 4.261 4.320 -0.004 0.000 0.219 401 A C 2.388 179.854 177.584 -0.197 0.000 1.169 401 A CA 1.985 53.875 52.037 -0.245 0.000 0.635 401 A CB -0.582 18.130 19.000 -0.481 0.000 0.810 401 A HN 0.561 8.711 8.150 0.000 0.000 0.446 402 A N -1.378 121.347 122.820 -0.159 0.000 1.898 402 A HA 0.079 4.396 4.320 -0.004 0.000 0.214 402 A C 1.998 179.493 177.584 -0.149 0.000 1.183 402 A CA 1.356 53.318 52.037 -0.124 0.000 0.622 402 A CB -0.634 18.328 19.000 -0.063 0.000 0.824 402 A HN 0.644 8.794 8.150 0.000 0.000 0.444 403 F N 1.089 120.908 119.950 -0.219 0.000 2.234 403 F HA 0.047 4.572 4.527 -0.005 0.000 0.299 403 F C 2.228 177.728 175.800 -0.500 0.000 1.087 403 F CA 1.058 58.914 58.000 -0.239 0.000 1.340 403 F CB -0.159 38.785 39.000 -0.093 0.000 1.031 403 F HN 0.206 8.506 8.300 0.000 0.000 0.500 404 A N -0.217 122.344 122.820 -0.432 0.000 2.206 404 A HA -0.092 4.226 4.320 -0.004 0.000 0.211 404 A C 2.086 179.261 177.584 -0.682 0.000 1.158 404 A CA 0.777 52.506 52.037 -0.513 0.000 0.761 404 A CB -0.880 18.014 19.000 -0.176 0.000 0.801 404 A HN 0.599 8.749 8.150 0.000 0.000 0.473 405 Q N -0.010 119.329 119.800 -0.768 0.000 2.142 405 Q HA -0.229 4.109 4.340 -0.004 0.000 0.213 405 Q C -0.020 175.739 176.000 -0.402 0.000 1.004 405 Q CA 1.826 57.318 55.803 -0.518 0.000 0.883 405 Q CB -0.414 28.077 28.738 -0.413 0.000 0.939 405 Q HN 0.774 9.044 8.270 0.000 0.000 0.413 406 F N 0.494 120.365 119.950 -0.132 0.000 2.651 406 F HA 0.386 4.910 4.527 -0.005 0.000 0.347 406 F C 0.745 176.485 175.800 -0.101 0.000 1.284 406 F CA -0.450 57.483 58.000 -0.110 0.000 1.175 406 F CB -0.593 38.330 39.000 -0.128 0.000 1.542 406 F HN -0.107 8.193 8.300 0.000 0.000 0.661 407 G N 2.436 111.243 108.800 0.012 0.000 2.515 407 G HA2 0.292 4.249 3.960 -0.004 0.000 0.290 407 G HA3 0.292 4.249 3.960 -0.004 0.000 0.290 407 G C -0.069 174.852 174.900 0.035 0.000 0.795 407 G CA 0.173 45.271 45.100 -0.003 0.000 1.866 407 G HN 0.853 9.143 8.290 0.000 0.000 0.476 408 S N 1.389 117.119 115.700 0.051 0.000 2.546 408 S HA 0.458 4.925 4.470 -0.004 0.000 0.274 408 S C -0.524 174.101 174.600 0.042 0.000 1.121 408 S CA -0.653 57.575 58.200 0.047 0.000 0.887 408 S CB 1.814 65.047 63.200 0.055 0.000 1.094 408 S HN 0.679 8.989 8.310 0.000 0.000 0.474 409 D N 1.562 121.981 120.400 0.032 0.000 7.932 409 D HA -0.177 4.460 4.640 -0.004 0.000 0.126 409 D C -0.598 175.727 176.300 0.042 0.000 1.199 409 D CA 0.926 54.945 54.000 0.032 0.000 0.846 409 D CB -1.110 39.708 40.800 0.029 0.000 1.666 409 D HN 0.592 8.962 8.370 0.000 0.000 0.958 410 L N 1.713 122.957 121.223 0.035 0.000 2.307 410 L HA 0.331 4.669 4.340 -0.004 0.000 0.284 410 L C 0.897 177.789 176.870 0.038 0.000 1.023 410 L CA -1.408 53.459 54.840 0.044 0.000 0.810 410 L CB 1.192 43.272 42.059 0.034 0.000 1.231 410 L HN 0.366 8.596 8.230 0.000 0.000 0.423 411 D N 2.272 122.699 120.400 0.045 0.000 2.352 411 D HA 0.006 4.643 4.640 -0.004 0.000 0.238 411 D C 1.044 177.358 176.300 0.024 0.000 1.286 411 D CA 0.056 54.076 54.000 0.033 0.000 0.923 411 D CB 0.925 41.747 40.800 0.035 0.000 1.146 411 D HN 0.548 8.918 8.370 0.000 0.000 0.471 412 A N 0.590 123.419 122.820 0.016 0.000 1.908 412 A HA -0.008 4.309 4.320 -0.004 0.000 0.218 412 A C 2.241 179.830 177.584 0.007 0.000 1.181 412 A CA 2.726 54.768 52.037 0.008 0.000 0.627 412 A CB -1.155 17.847 19.000 0.003 0.000 0.818 412 A HN 0.732 8.882 8.150 0.000 0.000 0.445 413 A N -0.316 122.510 122.820 0.011 0.000 1.873 413 A HA -0.097 4.220 4.320 -0.004 0.000 0.215 413 A C 2.475 180.070 177.584 0.018 0.000 1.186 413 A CA 2.585 54.627 52.037 0.009 0.000 0.616 413 A CB -1.376 17.629 19.000 0.009 0.000 0.823 413 A HN 0.775 8.925 8.150 0.000 0.000 0.442 414 T N -2.705 111.868 114.554 0.032 0.000 2.857 414 T HA -0.157 4.190 4.350 -0.004 0.000 0.266 414 T C 1.969 176.698 174.700 0.047 0.000 1.048 414 T CA 1.482 63.611 62.100 0.048 0.000 1.139 414 T CB -0.347 68.561 68.868 0.067 0.000 0.874 414 T HN 0.507 8.747 8.240 0.000 0.000 0.455 415 Q N 0.480 120.300 119.800 0.033 0.000 2.084 415 Q HA -0.198 4.139 4.340 -0.004 0.000 0.202 415 Q C 2.550 178.558 176.000 0.014 0.000 0.978 415 Q CA 1.763 57.581 55.803 0.024 0.000 0.844 415 Q CB -0.214 28.533 28.738 0.014 0.000 0.898 415 Q HN 0.579 8.849 8.270 0.000 0.000 0.426 416 Q N 0.140 119.941 119.800 0.002 0.000 2.084 416 Q HA -0.178 4.159 4.340 -0.004 0.000 0.202 416 Q C 1.838 177.826 176.000 -0.019 0.000 0.978 416 Q CA 1.405 57.197 55.803 -0.019 0.000 0.844 416 Q CB -0.497 28.225 28.738 -0.026 0.000 0.898 416 Q HN 0.440 8.710 8.270 0.000 0.000 0.426 417 L N -0.273 120.957 121.223 0.011 0.000 2.042 417 L HA -0.118 4.219 4.340 -0.004 0.000 0.210 417 L C 1.975 178.892 176.870 0.077 0.000 1.076 417 L CA 1.718 56.580 54.840 0.037 0.000 0.749 417 L CB -0.683 41.420 42.059 0.074 0.000 0.893 417 L HN 0.395 8.625 8.230 0.000 0.000 0.432 418 L N -1.343 119.952 121.223 0.119 0.000 2.027 418 L HA -0.193 4.144 4.340 -0.004 0.000 0.206 418 L C 2.484 179.374 176.870 0.034 0.000 1.074 418 L CA 1.467 56.426 54.840 0.198 0.000 0.745 418 L CB -0.718 41.431 42.059 0.149 0.000 0.898 418 L HN 0.227 8.457 8.230 0.000 0.000 0.433 419 S N -0.517 115.172 115.700 -0.018 0.000 2.370 419 S HA -0.230 4.237 4.470 -0.004 0.000 0.226 419 S C 2.008 176.525 174.600 -0.138 0.000 1.033 419 S CA 1.394 59.555 58.200 -0.066 0.000 1.011 419 S CB -0.265 62.902 63.200 -0.056 0.000 0.852 419 S HN 0.258 8.568 8.310 0.000 0.000 0.457 420 R N 1.527 121.931 120.500 -0.161 0.000 2.070 420 R HA -0.013 4.325 4.340 -0.004 0.000 0.233 420 R C 2.386 178.477 176.300 -0.349 0.000 1.137 420 R CA 1.914 57.887 56.100 -0.212 0.000 0.945 420 R CB -1.350 28.846 30.300 -0.174 0.000 0.845 420 R HN 0.364 8.634 8.270 0.000 0.000 0.430 421 G N -0.387 108.058 108.800 -0.590 0.000 2.446 421 G HA2 -0.260 3.697 3.960 -0.004 0.000 0.217 421 G HA3 -0.260 3.697 3.960 -0.004 0.000 0.217 421 G C 1.505 175.779 174.900 -1.043 0.000 1.168 421 G CA 0.989 45.297 45.100 -1.320 0.000 0.771 421 G HN 0.306 8.596 8.290 0.000 0.000 0.551 422 V N 0.271 119.812 119.914 -0.623 0.000 2.594 422 V HA -0.066 4.051 4.120 -0.004 0.000 0.253 422 V C 2.917 178.920 176.094 -0.151 0.000 1.069 422 V CA 2.157 64.344 62.300 -0.187 0.000 1.082 422 V CB -0.302 31.518 31.823 -0.005 0.000 0.680 422 V HN 0.382 8.572 8.190 0.000 0.000 0.469 423 R N -0.929 119.458 120.500 -0.189 0.000 2.080 423 R HA 0.122 4.460 4.340 -0.004 0.000 0.222 423 R C 2.223 178.444 176.300 -0.132 0.000 1.107 423 R CA 1.087 57.103 56.100 -0.139 0.000 0.980 423 R CB -0.258 29.954 30.300 -0.146 0.000 0.879 423 R HN 0.405 8.675 8.270 0.000 0.000 0.439 424 L N 0.167 121.286 121.223 -0.172 0.000 2.042 424 L HA -0.200 4.137 4.340 -0.004 0.000 0.210 424 L C 2.174 178.990 176.870 -0.089 0.000 1.076 424 L CA 1.457 56.218 54.840 -0.131 0.000 0.749 424 L CB -0.799 41.168 42.059 -0.153 0.000 0.893 424 L HN 0.251 8.481 8.230 0.000 0.000 0.432 425 T N -0.823 113.671 114.554 -0.100 0.000 2.699 425 T HA -0.185 4.163 4.350 -0.004 0.000 0.268 425 T C 1.777 176.462 174.700 -0.025 0.000 1.036 425 T CA 1.330 63.408 62.100 -0.036 0.000 1.147 425 T CB -0.159 68.712 68.868 0.005 0.000 0.862 425 T HN 0.311 8.551 8.240 0.000 0.000 0.446 426 E N 0.970 121.150 120.200 -0.033 0.000 2.106 426 E HA 0.018 4.365 4.350 -0.004 0.000 0.192 426 E C 2.268 178.863 176.600 -0.009 0.000 0.984 426 E CA 0.653 57.043 56.400 -0.017 0.000 0.806 426 E CB -0.403 29.288 29.700 -0.015 0.000 0.750 426 E HN 0.477 8.837 8.360 0.000 0.000 0.458 427 L N 0.187 121.400 121.223 -0.016 0.000 2.217 427 L HA -0.064 4.273 4.340 -0.004 0.000 0.211 427 L C 2.115 178.987 176.870 0.004 0.000 1.107 427 L CA 0.509 55.350 54.840 0.002 0.000 0.783 427 L CB -0.152 41.905 42.059 -0.003 0.000 0.919 427 L HN 0.062 8.292 8.230 0.000 0.000 0.442 428 L N -0.781 120.437 121.223 -0.008 0.000 2.592 428 L HA 0.047 4.385 4.340 -0.004 0.000 0.227 428 L C 0.630 177.492 176.870 -0.014 0.000 1.127 428 L CA 0.038 54.874 54.840 -0.007 0.000 0.884 428 L CB -0.225 41.831 42.059 -0.006 0.000 1.065 428 L HN 0.072 8.302 8.230 0.000 0.000 0.457 429 K N 1.264 121.653 120.400 -0.018 0.000 2.270 429 K HA 0.303 4.621 4.320 -0.004 0.000 0.276 429 K C -0.212 176.370 176.600 -0.029 0.000 1.023 429 K CA 0.170 56.437 56.287 -0.033 0.000 0.955 429 K CB 0.852 33.332 32.500 -0.034 0.000 0.975 429 K HN -0.019 8.231 8.250 0.000 0.000 0.471 430 Q N 0.515 120.287 119.800 -0.048 0.000 2.386 430 Q HA 0.321 4.659 4.340 -0.004 0.000 0.274 430 Q C -0.743 175.215 176.000 -0.071 0.000 1.011 430 Q CA -0.621 55.155 55.803 -0.045 0.000 0.867 430 Q CB 1.859 30.575 28.738 -0.036 0.000 1.409 430 Q HN 0.812 9.082 8.270 0.000 0.000 0.395 431 G N 1.296 110.059 108.800 -0.063 0.000 2.553 431 G HA2 0.247 4.204 3.960 -0.004 0.000 0.278 431 G HA3 0.247 4.204 3.960 -0.004 0.000 0.278 431 G C -0.678 174.145 174.900 -0.128 0.000 1.349 431 G CA -0.134 44.915 45.100 -0.084 0.000 1.037 431 G HN 0.562 8.852 8.290 0.000 0.000 0.508 432 Q N -1.912 117.769 119.800 -0.197 0.000 2.215 432 Q HA 0.418 4.755 4.340 -0.004 0.000 0.256 432 Q C -0.539 175.294 176.000 -0.279 0.000 0.972 432 Q CA -0.649 54.894 55.803 -0.434 0.000 0.889 432 Q CB 1.174 29.378 28.738 -0.890 0.000 1.281 432 Q HN 0.638 8.908 8.270 0.000 0.000 0.456 433 Y N -1.347 118.949 120.300 -0.005 0.000 4.907 433 Y HA -0.274 4.273 4.550 -0.005 0.000 0.246 433 Y C 0.068 175.959 175.900 -0.014 0.000 0.968 433 Y CA 0.396 58.490 58.100 -0.011 0.000 1.961 433 Y CB -1.474 36.978 38.460 -0.013 0.000 1.487 433 Y HN 0.324 8.604 8.280 0.000 0.000 0.575 434 S N 1.065 116.810 115.700 0.075 0.000 2.062 434 S HA 0.268 4.735 4.470 -0.004 0.000 0.163 434 S C -2.255 172.350 174.600 0.008 0.000 1.612 434 S CA -0.931 57.292 58.200 0.039 0.000 1.251 434 S CB 0.746 63.963 63.200 0.028 0.000 1.174 434 S HN 0.064 8.374 8.310 0.000 0.000 0.428 435 P HA 0.143 4.563 4.420 0.000 0.000 0.268 435 P C -0.491 176.800 177.300 -0.015 0.000 1.205 435 P CA -0.034 63.065 63.100 -0.002 0.000 0.771 435 P CB 0.480 32.186 31.700 0.009 0.000 0.858 436 M N 1.643 121.237 119.600 -0.010 0.000 2.318 436 M HA 0.429 4.907 4.480 -0.004 0.000 0.347 436 M C 0.606 176.896 176.300 -0.016 0.000 1.175 436 M CA -0.758 54.533 55.300 -0.015 0.000 1.075 436 M CB 1.602 34.200 32.600 -0.004 0.000 1.614 436 M HN 0.359 8.649 8.290 0.000 0.000 0.456 437 A N 2.152 124.951 122.820 -0.035 0.000 2.462 437 A HA 0.111 4.428 4.320 -0.004 0.000 0.243 437 A C 1.016 178.602 177.584 0.003 0.000 1.076 437 A CA -0.381 51.637 52.037 -0.031 0.000 0.773 437 A CB 0.032 18.997 19.000 -0.058 0.000 1.010 437 A HN 0.932 9.082 8.150 0.000 0.000 0.493 438 I N 1.341 121.932 120.570 0.035 0.000 2.194 438 I HA -0.260 3.907 4.170 -0.004 0.000 0.246 438 I C 2.484 178.613 176.117 0.021 0.000 1.093 438 I CA 2.499 63.821 61.300 0.038 0.000 1.355 438 I CB -0.327 37.705 38.000 0.053 0.000 1.046 438 I HN 0.857 9.067 8.210 0.000 0.000 0.413 439 E N 0.222 120.425 120.200 0.006 0.000 2.150 439 E HA -0.250 4.098 4.350 -0.004 0.000 0.193 439 E C 1.844 178.435 176.600 -0.015 0.000 0.985 439 E CA 1.471 57.865 56.400 -0.009 0.000 0.814 439 E CB -0.716 28.968 29.700 -0.027 0.000 0.752 439 E HN 0.650 9.010 8.360 0.000 0.000 0.466 440 E N 0.906 121.094 120.200 -0.020 0.000 2.072 440 E HA -0.142 4.205 4.350 -0.004 0.000 0.191 440 E C 2.326 178.940 176.600 0.025 0.000 0.985 440 E CA 1.106 57.495 56.400 -0.019 0.000 0.801 440 E CB -0.031 29.647 29.700 -0.036 0.000 0.750 440 E HN 0.382 8.742 8.360 0.000 0.000 0.452 441 Q N 0.187 120.003 119.800 0.027 0.000 2.084 441 Q HA -0.153 4.184 4.340 -0.004 0.000 0.202 441 Q C 2.344 178.384 176.000 0.067 0.000 0.978 441 Q CA 1.294 57.123 55.803 0.044 0.000 0.844 441 Q CB -0.015 28.744 28.738 0.035 0.000 0.898 441 Q HN 0.167 8.437 8.270 0.000 0.000 0.426 442 V N 0.808 120.758 119.914 0.061 0.000 2.358 442 V HA -0.244 3.873 4.120 -0.004 0.000 0.246 442 V C 2.257 178.430 176.094 0.132 0.000 1.047 442 V CA 1.693 64.044 62.300 0.085 0.000 1.035 442 V CB -0.864 30.994 31.823 0.057 0.000 0.658 442 V HN 0.392 8.582 8.190 0.000 0.000 0.452 443 A N -0.336 122.543 122.820 0.099 0.000 1.908 443 A HA -0.176 4.141 4.320 -0.004 0.000 0.218 443 A C 2.390 180.166 177.584 0.319 0.000 1.181 443 A CA 2.266 54.396 52.037 0.154 0.000 0.627 443 A CB -0.650 18.409 19.000 0.098 0.000 0.818 443 A HN 0.335 8.485 8.150 0.000 0.000 0.445 444 V N -0.011 120.057 119.914 0.258 0.000 2.283 444 V HA -0.222 3.895 4.120 -0.004 0.000 0.243 444 V C 2.418 178.604 176.094 0.152 0.000 1.039 444 V CA 1.950 64.384 62.300 0.223 0.000 1.016 444 V CB -0.633 31.291 31.823 0.168 0.000 0.650 444 V HN 0.572 8.762 8.190 0.000 0.000 0.449 445 I N -0.786 119.862 120.570 0.130 0.000 2.264 445 I HA -0.318 3.849 4.170 -0.004 0.000 0.248 445 I C 2.385 178.568 176.117 0.110 0.000 1.111 445 I CA 2.052 63.405 61.300 0.089 0.000 1.382 445 I CB -0.475 37.566 38.000 0.068 0.000 1.060 445 I HN 0.408 8.618 8.210 0.000 0.000 0.418 446 Y N 1.793 122.118 120.300 0.041 0.000 2.128 446 Y HA -0.364 4.183 4.550 -0.005 0.000 0.284 446 Y C 2.571 178.510 175.900 0.065 0.000 1.154 446 Y CA 1.770 59.903 58.100 0.055 0.000 1.149 446 Y CB -0.285 38.227 38.460 0.087 0.000 0.976 446 Y HN 0.128 8.408 8.280 0.000 0.000 0.505 447 A N 0.099 123.095 122.820 0.295 0.000 1.978 447 A HA -0.151 4.166 4.320 -0.004 0.000 0.220 447 A C 2.367 179.948 177.584 -0.004 0.000 1.170 447 A CA 1.906 54.046 52.037 0.170 0.000 0.636 447 A CB -1.642 17.338 19.000 -0.033 0.000 0.810 447 A HN 0.651 8.801 8.150 0.000 0.000 0.448 448 G N -0.596 108.170 108.800 -0.056 0.000 2.408 448 G HA2 0.022 3.979 3.960 -0.004 0.000 0.213 448 G HA3 0.022 3.979 3.960 -0.004 0.000 0.213 448 G C 1.546 176.343 174.900 -0.172 0.000 1.177 448 G CA 1.325 46.352 45.100 -0.121 0.000 0.802 448 G HN 0.943 9.233 8.290 0.000 0.000 0.533 449 V N -1.553 118.263 119.914 -0.163 0.000 2.809 449 V HA 0.140 4.257 4.120 -0.004 0.000 0.256 449 V C 2.245 178.173 176.094 -0.276 0.000 1.080 449 V CA 1.110 63.299 62.300 -0.185 0.000 1.102 449 V CB -0.402 31.342 31.823 -0.131 0.000 0.705 449 V HN 0.098 8.288 8.190 0.000 0.000 0.475 450 R N 0.971 121.229 120.500 -0.404 0.000 2.310 450 R HA 0.293 4.630 4.340 -0.004 0.000 0.202 450 R C 1.859 177.702 176.300 -0.762 0.000 0.933 450 R CA 0.672 56.409 56.100 -0.605 0.000 1.054 450 R CB -0.165 29.654 30.300 -0.803 0.000 0.985 450 R HN 0.849 9.119 8.270 0.000 0.000 0.489 451 G N 0.429 108.921 108.800 -0.513 0.000 2.157 451 G HA2 -0.328 3.629 3.960 -0.004 0.000 0.248 451 G HA3 -0.328 3.629 3.960 -0.004 0.000 0.248 451 G C 0.572 175.254 174.900 -0.364 0.000 0.979 451 G CA 0.265 45.122 45.100 -0.405 0.000 0.650 451 G HN 0.451 8.741 8.290 0.000 0.000 0.529 452 Y N -0.071 120.133 120.300 -0.161 0.000 2.616 452 Y HA 0.311 4.858 4.550 -0.004 0.000 0.296 452 Y C 2.468 178.245 175.900 -0.204 0.000 1.154 452 Y CA 0.915 58.929 58.100 -0.144 0.000 1.325 452 Y CB 0.123 38.519 38.460 -0.106 0.000 1.007 452 Y HN 0.366 8.646 8.280 0.000 0.000 0.542 453 L N -0.840 120.298 121.223 -0.140 0.000 2.766 453 L HA 0.087 4.424 4.340 -0.004 0.000 0.242 453 L C 0.807 177.569 176.870 -0.180 0.000 1.136 453 L CA -0.042 54.651 54.840 -0.244 0.000 0.933 453 L CB 0.090 41.953 42.059 -0.327 0.000 1.241 453 L HN 0.044 8.274 8.230 0.000 0.000 0.522 454 D N 1.285 121.598 120.400 -0.144 0.000 2.265 454 D HA -0.147 4.491 4.640 -0.004 0.000 0.208 454 D C 1.575 177.821 176.300 -0.090 0.000 0.977 454 D CA 1.327 55.255 54.000 -0.121 0.000 0.871 454 D CB 0.196 40.925 40.800 -0.119 0.000 0.925 454 D HN 0.238 8.608 8.370 0.000 0.000 0.485 455 K N -0.453 119.899 120.400 -0.079 0.000 2.373 455 K HA 0.145 4.462 4.320 -0.004 0.000 0.202 455 K C 0.038 176.607 176.600 -0.051 0.000 1.025 455 K CA -0.435 55.820 56.287 -0.053 0.000 1.115 455 K CB 0.837 33.317 32.500 -0.034 0.000 0.858 455 K HN -0.007 8.243 8.250 0.000 0.000 0.525 456 L N 2.083 123.255 121.223 -0.085 0.000 2.305 456 L HA 0.138 4.476 4.340 -0.004 0.000 0.281 456 L C 0.034 176.876 176.870 -0.046 0.000 1.085 456 L CA -0.098 54.698 54.840 -0.073 0.000 0.813 456 L CB 0.837 42.792 42.059 -0.172 0.000 1.157 456 L HN 0.052 8.282 8.230 0.000 0.000 0.436 457 E N 6.407 126.606 120.200 -0.002 0.000 2.558 457 E HA -0.036 4.312 4.350 -0.004 0.000 0.255 457 E C -1.698 174.905 176.600 0.005 0.000 0.968 457 E CA -1.025 55.379 56.400 0.007 0.000 0.939 457 E CB 0.922 30.638 29.700 0.028 0.000 0.921 457 E HN 0.544 8.904 8.360 0.000 0.000 0.477 458 P HA -0.205 4.215 4.420 0.000 0.000 0.217 458 P C 1.150 178.458 177.300 0.014 0.000 1.148 458 P CA 1.490 64.584 63.100 -0.011 0.000 0.828 458 P CB 0.129 31.822 31.700 -0.012 0.000 0.783 459 S N -1.164 114.553 115.700 0.029 0.000 2.507 459 S HA -0.050 4.418 4.470 -0.004 0.000 0.235 459 S C 1.584 176.231 174.600 0.078 0.000 0.988 459 S CA 0.823 59.050 58.200 0.045 0.000 0.944 459 S CB -0.729 62.494 63.200 0.039 0.000 0.762 459 S HN 0.205 8.515 8.310 0.000 0.000 0.526 460 K N 0.391 120.852 120.400 0.103 0.000 2.356 460 K HA 0.297 4.614 4.320 -0.004 0.000 0.195 460 K C 1.486 178.201 176.600 0.190 0.000 1.037 460 K CA 0.056 56.462 56.287 0.199 0.000 1.014 460 K CB -0.061 32.609 32.500 0.283 0.000 0.815 460 K HN 0.271 8.521 8.250 0.000 0.000 0.507 461 I N 1.553 122.175 120.570 0.086 0.000 2.145 461 I HA -0.313 3.855 4.170 -0.004 0.000 0.244 461 I C 1.952 178.147 176.117 0.132 0.000 1.075 461 I CA 1.810 63.145 61.300 0.058 0.000 1.332 461 I CB -1.346 36.653 38.000 -0.003 0.000 1.033 461 I HN 0.166 8.376 8.210 0.000 0.000 0.410 462 T N 0.587 115.205 114.554 0.108 0.000 2.746 462 T HA -0.201 4.146 4.350 -0.004 0.000 0.267 462 T C 2.006 176.787 174.700 0.134 0.000 1.039 462 T CA 1.421 63.581 62.100 0.101 0.000 1.142 462 T CB -0.134 68.774 68.868 0.067 0.000 0.866 462 T HN 0.305 8.545 8.240 0.000 0.000 0.444 463 K N 0.078 120.593 120.400 0.192 0.000 2.057 463 K HA -0.101 4.216 4.320 -0.004 0.000 0.207 463 K C 2.113 178.873 176.600 0.265 0.000 1.049 463 K CA 1.223 57.673 56.287 0.272 0.000 0.931 463 K CB -0.317 32.413 32.500 0.383 0.000 0.714 463 K HN 0.362 8.612 8.250 0.000 0.000 0.440 464 F N 2.221 122.118 119.950 -0.088 0.000 2.102 464 F HA -0.219 4.305 4.527 -0.005 0.000 0.298 464 F C 2.343 178.067 175.800 -0.127 0.000 1.105 464 F CA 2.146 59.795 58.000 -0.585 0.000 1.239 464 F CB -0.329 38.195 39.000 -0.793 0.000 0.991 464 F HN 0.192 8.492 8.300 0.000 0.000 0.474 465 E N 0.253 120.479 120.200 0.042 0.000 2.049 465 E HA -0.294 4.054 4.350 -0.004 0.000 0.198 465 E C 1.968 178.556 176.600 -0.019 0.000 1.007 465 E CA 1.748 58.164 56.400 0.026 0.000 0.809 465 E CB -0.342 29.427 29.700 0.116 0.000 0.749 465 E HN 0.418 8.778 8.360 0.000 0.000 0.450 466 N N 0.324 119.035 118.700 0.019 0.000 2.166 466 N HA -0.142 4.595 4.740 -0.004 0.000 0.186 466 N C 1.623 177.143 175.510 0.017 0.000 1.019 466 N CA 1.347 54.411 53.050 0.024 0.000 0.856 466 N CB -0.402 38.117 38.487 0.053 0.000 0.993 466 N HN 0.310 8.690 8.380 0.000 0.000 0.426 467 A N 0.338 123.193 122.820 0.058 0.000 1.897 467 A HA -0.078 4.240 4.320 -0.004 0.000 0.215 467 A C 2.084 179.670 177.584 0.003 0.000 1.181 467 A CA 0.693 52.828 52.037 0.162 0.000 0.620 467 A CB -0.838 18.404 19.000 0.404 0.000 0.821 467 A HN 0.270 8.420 8.150 0.000 0.000 0.443 468 F N 0.165 119.811 119.950 -0.506 0.000 2.102 468 F HA -0.147 4.378 4.527 -0.005 0.000 0.298 468 F C 1.819 177.312 175.800 -0.512 0.000 1.105 468 F CA 1.553 58.971 58.000 -0.970 0.000 1.239 468 F CB -0.304 38.023 39.000 -1.121 0.000 0.991 468 F HN 0.172 8.472 8.300 0.000 0.000 0.474 469 L N 0.577 121.602 121.223 -0.329 0.000 2.017 469 L HA -0.192 4.146 4.340 -0.004 0.000 0.208 469 L C 2.910 179.614 176.870 -0.277 0.000 1.073 469 L CA 2.266 56.925 54.840 -0.302 0.000 0.745 469 L CB -1.461 40.535 42.059 -0.106 0.000 0.894 469 L HN 0.408 8.638 8.230 0.000 0.000 0.432 470 S N -2.149 113.453 115.700 -0.164 0.000 2.399 470 S HA -0.285 4.182 4.470 -0.004 0.000 0.231 470 S C 2.067 176.597 174.600 -0.117 0.000 1.022 470 S CA 1.273 59.411 58.200 -0.103 0.000 0.983 470 S CB -0.827 62.359 63.200 -0.022 0.000 0.803 470 S HN 0.670 8.980 8.310 0.000 0.000 0.480 471 H N 2.408 121.306 119.070 -0.286 0.000 2.299 471 H HA 0.004 4.557 4.556 -0.004 0.000 0.302 471 H C 2.170 177.312 175.328 -0.309 0.000 1.078 471 H CA 2.322 58.198 56.048 -0.288 0.000 1.323 471 H CB -0.651 28.854 29.762 -0.427 0.000 1.381 471 H HN 0.304 8.584 8.280 0.000 0.000 0.498 472 V N -0.824 118.688 119.914 -0.670 0.000 2.407 472 V HA -0.160 3.958 4.120 -0.004 0.000 0.248 472 V C 2.488 178.369 176.094 -0.354 0.000 1.055 472 V CA 1.936 63.900 62.300 -0.560 0.000 1.049 472 V CB -0.932 30.481 31.823 -0.682 0.000 0.662 472 V HN 0.428 8.618 8.190 0.000 0.000 0.455 473 I N 1.377 121.765 120.570 -0.304 0.000 2.179 473 I HA -0.218 3.949 4.170 -0.004 0.000 0.242 473 I C 2.940 178.945 176.117 -0.187 0.000 1.088 473 I CA 2.146 63.323 61.300 -0.205 0.000 1.357 473 I CB -0.394 37.510 38.000 -0.159 0.000 1.051 473 I HN 0.502 8.712 8.210 0.000 0.000 0.409 474 S N -0.270 115.312 115.700 -0.198 0.000 2.377 474 S HA -0.196 4.271 4.470 -0.004 0.000 0.223 474 S C 1.964 176.429 174.600 -0.225 0.000 1.030 474 S CA 1.361 59.462 58.200 -0.165 0.000 0.970 474 S CB 0.058 63.193 63.200 -0.108 0.000 0.830 474 S HN 0.384 8.694 8.310 0.000 0.000 0.473 475 Q N -0.736 118.846 119.800 -0.364 0.000 2.396 475 Q HA 0.262 4.599 4.340 -0.004 0.000 0.220 475 Q C -0.015 175.547 176.000 -0.730 0.000 0.900 475 Q CA 0.605 56.083 55.803 -0.542 0.000 0.925 475 Q CB 0.440 28.746 28.738 -0.720 0.000 1.065 475 Q HN 0.745 9.015 8.270 0.000 0.000 0.535 476 H N -0.755 118.127 119.070 -0.314 0.000 2.591 476 H HA 0.190 4.743 4.556 -0.004 0.000 0.241 476 H C 0.251 175.457 175.328 -0.203 0.000 1.292 476 H CA -0.205 55.695 56.048 -0.248 0.000 1.022 476 H CB 0.813 30.401 29.762 -0.289 0.000 1.875 476 H HN 0.040 8.320 8.280 0.000 0.000 0.570 477 Q N 1.143 120.873 119.800 -0.117 0.000 2.291 477 Q HA -0.030 4.307 4.340 -0.004 0.000 0.206 477 Q C 1.995 177.953 176.000 -0.070 0.000 0.976 477 Q CA 1.493 57.237 55.803 -0.099 0.000 0.875 477 Q CB 0.048 28.724 28.738 -0.102 0.000 0.927 477 Q HN 0.629 8.899 8.270 0.000 0.000 0.450 478 A N -0.078 122.708 122.820 -0.056 0.000 1.929 478 A HA -0.060 4.257 4.320 -0.004 0.000 0.216 478 A C 2.016 179.578 177.584 -0.035 0.000 1.176 478 A CA 0.953 52.966 52.037 -0.040 0.000 0.628 478 A CB -0.621 18.360 19.000 -0.031 0.000 0.816 478 A HN 0.474 8.624 8.150 0.000 0.000 0.444 479 L N -0.337 120.867 121.223 -0.030 0.000 2.027 479 L HA -0.131 4.206 4.340 -0.004 0.000 0.206 479 L C 2.453 179.280 176.870 -0.072 0.000 1.074 479 L CA 1.484 56.291 54.840 -0.056 0.000 0.745 479 L CB -0.375 41.632 42.059 -0.086 0.000 0.898 479 L HN 0.418 8.648 8.230 0.000 0.000 0.433 480 L N -0.249 120.926 121.223 -0.080 0.000 2.083 480 L HA -0.209 4.128 4.340 -0.004 0.000 0.209 480 L C 3.043 179.878 176.870 -0.059 0.000 1.083 480 L CA 1.350 56.141 54.840 -0.081 0.000 0.752 480 L CB -0.972 41.028 42.059 -0.098 0.000 0.899 480 L HN 0.406 8.636 8.230 0.000 0.000 0.433 481 S N 0.379 116.047 115.700 -0.053 0.000 2.356 481 S HA -0.260 4.207 4.470 -0.004 0.000 0.223 481 S C 2.150 176.731 174.600 -0.032 0.000 1.032 481 S CA 1.942 60.117 58.200 -0.041 0.000 1.005 481 S CB -0.284 62.916 63.200 0.000 0.000 0.867 481 S HN 0.099 8.409 8.310 0.000 0.000 0.449 482 K N 0.912 121.292 120.400 -0.034 0.000 2.057 482 K HA 0.136 4.453 4.320 -0.004 0.000 0.207 482 K C 1.709 178.293 176.600 -0.026 0.000 1.049 482 K CA 1.056 57.326 56.287 -0.028 0.000 0.931 482 K CB -0.523 31.959 32.500 -0.029 0.000 0.714 482 K HN 0.584 8.834 8.250 0.000 0.000 0.440 483 I N -0.064 120.485 120.570 -0.034 0.000 2.226 483 I HA -0.263 3.904 4.170 -0.004 0.000 0.245 483 I C 2.568 178.675 176.117 -0.017 0.000 1.100 483 I CA 1.165 62.448 61.300 -0.028 0.000 1.374 483 I CB -0.241 37.735 38.000 -0.041 0.000 1.057 483 I HN 0.179 8.389 8.210 0.000 0.000 0.413 484 R N 0.508 120.998 120.500 -0.018 0.000 2.073 484 R HA -0.155 4.182 4.340 -0.004 0.000 0.234 484 R C 2.267 178.566 176.300 -0.002 0.000 1.134 484 R CA 2.160 58.257 56.100 -0.005 0.000 0.952 484 R CB -0.251 30.044 30.300 -0.008 0.000 0.850 484 R HN 0.260 8.530 8.270 0.000 0.000 0.433 485 T N 0.816 115.366 114.554 -0.008 0.000 2.732 485 T HA -0.076 4.271 4.350 -0.004 0.000 0.261 485 T C 1.093 175.790 174.700 -0.006 0.000 1.040 485 T CA 1.444 63.540 62.100 -0.006 0.000 1.145 485 T CB -0.290 68.572 68.868 -0.010 0.000 0.866 485 T HN 0.291 8.531 8.240 0.000 0.000 0.427 486 D N 0.525 120.920 120.400 -0.008 0.000 2.264 486 D HA 0.097 4.734 4.640 -0.004 0.000 0.208 486 D C 1.737 178.034 176.300 -0.005 0.000 0.966 486 D CA 1.037 55.033 54.000 -0.006 0.000 0.864 486 D CB -0.579 40.217 40.800 -0.007 0.000 0.933 486 D HN 0.526 8.896 8.370 0.000 0.000 0.499 487 G N 0.881 109.678 108.800 -0.004 0.000 2.155 487 G HA2 -0.324 3.634 3.960 -0.004 0.000 0.257 487 G HA3 -0.324 3.634 3.960 -0.004 0.000 0.257 487 G C 0.218 175.118 174.900 0.001 0.000 0.983 487 G CA 0.962 46.060 45.100 -0.003 0.000 0.676 487 G HN 0.567 8.857 8.290 0.000 0.000 0.528 488 K N -1.432 118.969 120.400 0.002 0.000 2.578 488 K HA 0.723 5.040 4.320 -0.004 0.000 0.287 488 K C -0.863 175.742 176.600 0.007 0.000 1.010 488 K CA -1.423 54.869 56.287 0.009 0.000 0.889 488 K CB 1.190 33.696 32.500 0.009 0.000 1.514 488 K HN 0.111 8.361 8.250 0.000 0.000 0.424 489 I N 2.915 123.497 120.570 0.021 0.000 2.287 489 I HA 0.104 4.272 4.170 -0.004 0.000 0.290 489 I C 0.341 176.473 176.117 0.026 0.000 1.069 489 I CA -0.484 60.828 61.300 0.020 0.000 1.237 489 I CB 1.270 39.303 38.000 0.055 0.000 1.418 489 I HN 0.765 8.975 8.210 0.000 0.000 0.481 490 S N 3.659 119.365 115.700 0.011 0.000 2.608 490 S HA 0.172 4.640 4.470 -0.004 0.000 0.261 490 S C 0.977 175.590 174.600 0.022 0.000 1.314 490 S CA -0.467 57.741 58.200 0.014 0.000 0.992 490 S CB 1.108 64.310 63.200 0.004 0.000 0.935 490 S HN 0.644 8.954 8.310 0.000 0.000 0.564 491 E N 0.306 120.520 120.200 0.024 0.000 2.153 491 E HA -0.200 4.147 4.350 -0.004 0.000 0.194 491 E C 1.943 178.558 176.600 0.025 0.000 0.988 491 E CA 1.396 57.814 56.400 0.031 0.000 0.811 491 E CB -0.097 29.619 29.700 0.026 0.000 0.746 491 E HN 0.880 9.240 8.360 0.000 0.000 0.466 492 E N 0.334 120.541 120.200 0.012 0.000 2.046 492 E HA -0.127 4.221 4.350 -0.004 0.000 0.190 492 E C 2.012 178.605 176.600 -0.011 0.000 0.982 492 E CA 1.191 57.592 56.400 0.003 0.000 0.800 492 E CB 0.095 29.795 29.700 -0.001 0.000 0.756 492 E HN -0.030 8.330 8.360 0.000 0.000 0.449 493 S N 0.629 116.317 115.700 -0.020 0.000 2.382 493 S HA -0.174 4.294 4.470 -0.004 0.000 0.228 493 S C 1.518 176.077 174.600 -0.068 0.000 1.027 493 S CA 1.293 59.462 58.200 -0.052 0.000 0.991 493 S CB -0.365 62.803 63.200 -0.054 0.000 0.823 493 S HN 0.380 8.690 8.310 0.000 0.000 0.469 494 D N 1.533 121.930 120.400 -0.005 0.000 2.097 494 D HA -0.029 4.608 4.640 -0.004 0.000 0.195 494 D C 2.058 178.398 176.300 0.068 0.000 0.989 494 D CA 1.364 55.404 54.000 0.067 0.000 0.827 494 D CB -0.389 40.494 40.800 0.139 0.000 0.966 494 D HN 0.301 8.671 8.370 0.000 0.000 0.456 495 A N 0.455 123.301 122.820 0.043 0.000 1.908 495 A HA -0.200 4.117 4.320 -0.004 0.000 0.218 495 A C 2.192 179.774 177.584 -0.004 0.000 1.181 495 A CA 1.768 53.826 52.037 0.034 0.000 0.627 495 A CB -0.458 18.557 19.000 0.025 0.000 0.818 495 A HN 0.226 8.376 8.150 0.000 0.000 0.445 496 K N -0.611 119.764 120.400 -0.041 0.000 2.057 496 K HA 0.057 4.375 4.320 -0.004 0.000 0.206 496 K C 1.872 178.385 176.600 -0.145 0.000 1.050 496 K CA 1.110 57.344 56.287 -0.088 0.000 0.935 496 K CB -0.280 32.162 32.500 -0.097 0.000 0.715 496 K HN 0.447 8.697 8.250 0.000 0.000 0.439 497 L N 1.050 122.168 121.223 -0.175 0.000 2.027 497 L HA -0.191 4.147 4.340 -0.004 0.000 0.206 497 L C 2.564 179.377 176.870 -0.095 0.000 1.074 497 L CA 1.257 55.947 54.840 -0.248 0.000 0.745 497 L CB -0.296 41.374 42.059 -0.649 0.000 0.898 497 L HN 0.172 8.402 8.230 0.000 0.000 0.433 498 K N 0.295 120.699 120.400 0.006 0.000 2.044 498 K HA -0.299 4.019 4.320 -0.004 0.000 0.210 498 K C 2.035 178.549 176.600 -0.144 0.000 1.049 498 K CA 2.098 58.341 56.287 -0.073 0.000 0.927 498 K CB -0.083 32.448 32.500 0.053 0.000 0.713 498 K HN 0.288 8.538 8.250 0.000 0.000 0.443 499 E N 0.368 120.531 120.200 -0.062 0.000 2.106 499 E HA -0.174 4.173 4.350 -0.004 0.000 0.192 499 E C 1.988 178.590 176.600 0.004 0.000 0.984 499 E CA 1.102 57.485 56.400 -0.028 0.000 0.806 499 E CB -0.029 29.665 29.700 -0.011 0.000 0.750 499 E HN 0.380 8.740 8.360 0.000 0.000 0.458 500 I N 0.702 121.262 120.570 -0.018 0.000 2.163 500 I HA -0.217 3.950 4.170 -0.004 0.000 0.240 500 I C 2.700 178.959 176.117 0.236 0.000 1.081 500 I CA 1.112 62.455 61.300 0.071 0.000 1.353 500 I CB -0.445 37.487 38.000 -0.112 0.000 1.054 500 I HN 0.154 8.364 8.210 0.000 0.000 0.407 501 V N 0.182 120.198 119.914 0.171 0.000 2.427 501 V HA -0.213 3.904 4.120 -0.004 0.000 0.248 501 V C 2.541 178.696 176.094 0.102 0.000 1.051 501 V CA 2.401 64.800 62.300 0.165 0.000 1.048 501 V CB -1.142 30.656 31.823 -0.042 0.000 0.666 501 V HN 0.632 8.822 8.190 0.000 0.000 0.456 502 T N -0.958 113.550 114.554 -0.075 0.000 2.674 502 T HA -0.197 4.151 4.350 -0.004 0.000 0.265 502 T C 1.894 176.642 174.700 0.080 0.000 1.039 502 T CA 1.843 63.919 62.100 -0.039 0.000 1.150 502 T CB -0.890 67.915 68.868 -0.105 0.000 0.864 502 T HN 0.553 8.793 8.240 0.000 0.000 0.427 503 N N 0.651 119.414 118.700 0.105 0.000 2.142 503 N HA 0.006 4.744 4.740 -0.004 0.000 0.186 503 N C 1.602 177.216 175.510 0.173 0.000 1.023 503 N CA 1.115 54.239 53.050 0.123 0.000 0.852 503 N CB -0.524 38.031 38.487 0.114 0.000 0.998 503 N HN 0.448 8.828 8.380 0.000 0.000 0.424 504 F N 2.383 122.401 119.950 0.114 0.000 2.102 504 F HA -0.092 4.432 4.527 -0.004 0.000 0.298 504 F C 2.329 178.272 175.800 0.238 0.000 1.105 504 F CA 0.970 59.048 58.000 0.131 0.000 1.239 504 F CB -0.384 38.723 39.000 0.179 0.000 0.991 504 F HN -0.049 8.251 8.300 0.000 0.000 0.474 505 L N 0.070 121.560 121.223 0.445 0.000 2.042 505 L HA -0.239 4.098 4.340 -0.004 0.000 0.210 505 L C 2.529 179.516 176.870 0.196 0.000 1.076 505 L CA 1.855 56.926 54.840 0.384 0.000 0.749 505 L CB -1.038 41.141 42.059 0.200 0.000 0.893 505 L HN 0.340 8.570 8.230 0.000 0.000 0.432 506 A N -0.287 122.603 122.820 0.116 0.000 1.902 506 A HA -0.138 4.179 4.320 -0.004 0.000 0.217 506 A C 2.300 179.895 177.584 0.019 0.000 1.181 506 A CA 1.598 53.672 52.037 0.061 0.000 0.623 506 A CB -1.197 17.831 19.000 0.047 0.000 0.818 506 A HN 0.531 8.681 8.150 0.000 0.000 0.443 507 G N -1.254 107.527 108.800 -0.031 0.000 2.421 507 G HA2 -0.245 3.712 3.960 -0.004 0.000 0.216 507 G HA3 -0.245 3.712 3.960 -0.004 0.000 0.216 507 G C 1.472 176.298 174.900 -0.123 0.000 1.171 507 G CA 1.099 46.134 45.100 -0.109 0.000 0.775 507 G HN 0.496 8.786 8.290 0.000 0.000 0.543 508 F N 1.422 121.183 119.950 -0.315 0.000 2.192 508 F HA -0.046 4.478 4.527 -0.004 0.000 0.301 508 F C 2.446 178.202 175.800 -0.073 0.000 1.079 508 F CA 1.797 59.666 58.000 -0.218 0.000 1.303 508 F CB 0.169 39.102 39.000 -0.112 0.000 1.024 508 F HN 0.204 8.504 8.300 0.000 0.000 0.494 509 E N 0.397 120.643 120.200 0.076 0.000 2.479 509 E HA 0.168 4.515 4.350 -0.004 0.000 0.193 509 E C 1.016 177.585 176.600 -0.052 0.000 1.049 509 E CA 0.074 56.485 56.400 0.019 0.000 0.870 509 E CB 0.012 29.766 29.700 0.091 0.000 0.944 509 E HN 0.384 8.744 8.360 0.000 0.000 0.492 510 A N 0.000 122.772 122.820 -0.079 0.000 2.254 510 A HA 0.000 4.317 4.320 -0.004 0.000 0.244 510 A CA 0.000 51.996 52.037 -0.069 0.000 0.836 510 A CB 0.000 18.957 19.000 -0.072 0.000 0.831 510 A HN 0.000 8.150 8.150 0.000 0.000 0.486