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 1ad5_1_B DATA FIRST_RESID 82 DATA SEQUENCE EDIIVVALYD YEAIHHEDLS FQKGDQMVVL EESXGEWWKA RSLATRKEGY DATA SEQUENCE IPSNYVARVD SLETEEWFFK GISRKDAERQ LLAPGNMLGS FMIRDSETTK DATA SEQUENCE GSYSLSVRDY DPRQGDTVKH YKIRTLDNGG FYISPRSTFS TLQELVDHYK DATA SEQUENCE KGNDGLCQKL SVPCMSSKPQ KPWEXKDAWE IPRESLKLEK KLGAGQFGEV DATA SEQUENCE WMATYNKHTK VAVKTMKPGS MSVEAFLAEA NVMKTLQHDK LVKLHAVVTK DATA SEQUENCE EPIYIITEFM AKGSLLDFLK SDEGSKQPLP KLIDFSAQIA EGMAFIEQRN DATA SEQUENCE YIHRDLRAAN ILVSASLVCK IADFGLARVG XXXXXXXXXX AKFPIKWTAP DATA SEQUENCE EAINFGSFTI KSDVWSFGIL LMEIVTYGRI PYPGMSNPEV IRALERGYRM DATA SEQUENCE PRPENCPEEL YNIMMRCWKN RPEERPTFEY IQSVLDDFYT ATESQXQQQP 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 82 E HA 0.000 4.350 4.350 0.000 0.000 0.291 82 E C 0.000 176.591 176.600 -0.015 0.000 1.382 82 E CA 0.000 56.394 56.400 -0.011 0.000 0.976 82 E CB 0.000 29.695 29.700 -0.009 0.000 0.812 83 D N 0.719 121.109 120.400 -0.016 0.000 2.706 83 D HA 0.307 4.947 4.640 0.000 0.000 0.225 83 D C -1.982 174.307 176.300 -0.019 0.000 1.241 83 D CA -0.154 53.834 54.000 -0.020 0.000 0.784 83 D CB 1.133 41.923 40.800 -0.017 0.000 1.521 83 D HN 0.105 8.467 8.370 -0.013 0.000 0.461 84 I N -1.142 119.414 120.570 -0.024 0.000 2.336 84 I HA 0.434 4.604 4.170 0.000 0.000 0.292 84 I C -1.074 175.041 176.117 -0.002 0.000 0.991 84 I CA -0.568 60.723 61.300 -0.015 0.000 1.227 84 I CB 0.876 38.863 38.000 -0.022 0.000 1.366 84 I HN 0.373 8.563 8.210 -0.033 0.000 0.466 85 I N 4.457 125.027 120.570 0.001 0.000 2.474 85 I HA 0.825 4.995 4.170 0.000 0.000 0.294 85 I C -1.944 174.175 176.117 0.005 0.000 1.005 85 I CA -1.372 59.928 61.300 0.001 0.000 1.113 85 I CB 1.938 39.932 38.000 -0.010 0.000 1.289 85 I HN -0.021 8.188 8.210 -0.001 0.000 0.436 86 V N 1.971 121.888 119.914 0.005 0.000 2.994 86 V HA 0.859 4.979 4.120 0.000 0.000 0.318 86 V C -2.481 173.574 176.094 -0.065 0.000 1.085 86 V CA -3.112 59.184 62.300 -0.008 0.000 0.998 86 V CB 2.634 34.483 31.823 0.044 0.000 1.063 86 V HN 0.385 8.576 8.190 0.001 0.000 0.447 87 V N 0.646 120.504 119.914 -0.093 0.000 2.823 87 V HA 0.795 4.915 4.120 0.000 0.000 0.312 87 V C -2.002 174.000 176.094 -0.153 0.000 1.072 87 V CA -2.935 59.295 62.300 -0.117 0.000 0.937 87 V CB 4.624 36.389 31.823 -0.097 0.000 1.013 87 V HN 0.484 8.620 8.190 -0.089 0.000 0.430 88 A N 5.091 127.816 122.820 -0.159 0.000 2.409 88 A HA 0.501 4.821 4.320 0.000 0.000 0.267 88 A C -0.061 177.474 177.584 -0.082 0.000 1.127 88 A CA -0.308 51.667 52.037 -0.103 0.000 0.795 88 A CB 0.368 19.378 19.000 0.016 0.000 1.061 88 A HN 0.317 8.383 8.150 -0.141 0.000 0.502 89 L N 2.341 123.458 121.223 -0.177 0.000 2.375 89 L HA 0.065 4.405 4.340 0.000 0.000 0.215 89 L C -0.703 175.774 176.870 -0.656 0.000 1.108 89 L CA 1.284 55.795 54.840 -0.549 0.000 0.830 89 L CB 0.539 42.021 42.059 -0.961 0.000 0.959 89 L HN 0.557 8.626 8.230 -0.094 0.105 0.457 90 Y N -4.395 116.028 120.300 0.205 0.000 2.562 90 Y HA 0.031 4.581 4.550 0.000 0.000 0.345 90 Y C -1.807 174.306 175.900 0.355 0.000 1.045 90 Y CA -1.413 56.823 58.100 0.226 0.000 1.028 90 Y CB 2.747 41.302 38.460 0.157 0.000 1.297 90 Y HN -0.972 7.455 8.280 0.304 0.035 0.463 91 D N 1.053 121.677 120.400 0.374 0.000 2.423 91 D HA -0.071 4.569 4.640 0.000 0.000 0.238 91 D C -1.477 174.912 176.300 0.148 0.000 1.142 91 D CA 0.623 54.756 54.000 0.221 0.000 0.884 91 D CB 0.460 41.331 40.800 0.118 0.000 1.199 91 D HN -0.212 8.358 8.370 0.332 0.000 0.438 92 Y N 0.852 120.920 120.300 -0.387 0.000 2.504 92 Y HA 0.110 4.660 4.550 0.000 0.000 0.344 92 Y C -2.160 173.444 175.900 -0.493 0.000 1.023 92 Y CA -1.518 56.182 58.100 -0.665 0.000 1.020 92 Y CB 4.476 41.968 38.460 -1.612 0.000 1.282 92 Y HN 0.396 8.439 8.280 -0.223 0.104 0.454 93 E N 5.201 124.739 120.200 -1.102 0.000 2.141 93 E HA 0.271 4.621 4.350 0.000 0.000 0.259 93 E C -1.677 174.326 176.600 -0.995 0.000 0.883 93 E CA -2.490 53.451 56.400 -0.765 0.000 0.744 93 E CB -0.001 29.404 29.700 -0.491 0.000 1.150 93 E HN 0.347 7.823 8.360 -1.473 0.000 0.420 94 A N 4.403 126.859 122.820 -0.608 0.000 2.511 94 A HA -0.016 4.304 4.320 0.000 0.000 0.242 94 A C -0.690 176.633 177.584 -0.434 0.000 1.069 94 A CA 0.777 52.597 52.037 -0.362 0.000 0.763 94 A CB 0.681 19.629 19.000 -0.087 0.000 1.001 94 A HN 0.589 8.500 8.150 -0.398 0.000 0.498 95 I N 1.942 122.229 120.570 -0.473 0.000 4.541 95 I HA 0.156 4.326 4.170 0.000 0.000 0.337 95 I C -1.437 174.336 176.117 -0.574 0.000 1.338 95 I CA -0.335 60.571 61.300 -0.657 0.000 1.244 95 I CB 1.584 39.153 38.000 -0.719 0.000 1.417 95 I HN -0.006 8.353 8.210 -0.367 -0.369 0.501 96 H N -2.130 116.847 119.070 -0.154 0.000 3.043 96 H HA 0.387 4.943 4.556 0.000 0.000 0.302 96 H C 0.761 175.984 175.328 -0.175 0.000 1.506 96 H CA -1.253 54.685 56.048 -0.184 0.000 1.282 96 H CB 2.341 32.006 29.762 -0.162 0.000 1.914 96 H HN -0.476 7.901 8.280 -0.202 -0.219 0.625 97 H N 0.382 119.475 119.070 0.038 0.000 2.415 97 H HA -0.098 4.458 4.556 0.000 0.000 0.297 97 H C 0.634 175.970 175.328 0.012 0.000 1.048 97 H CA 2.519 58.568 56.048 0.002 0.000 1.365 97 H CB 0.724 30.478 29.762 -0.014 0.000 1.421 97 H HN 0.665 8.986 8.280 0.069 0.000 0.533 98 E N -2.517 117.775 120.200 0.152 0.000 2.624 98 E HA 0.185 4.535 4.350 0.000 0.000 0.210 98 E C -1.418 175.274 176.600 0.153 0.000 0.997 98 E CA -1.019 55.467 56.400 0.144 0.000 0.999 98 E CB 0.268 30.091 29.700 0.205 0.000 1.040 98 E HN 0.061 8.484 8.360 0.105 0.000 0.469 99 D N -1.481 119.000 120.400 0.135 0.000 2.340 99 D HA 0.393 5.033 4.640 0.000 0.000 0.251 99 D C -0.620 175.823 176.300 0.238 0.000 1.080 99 D CA -1.224 52.906 54.000 0.217 0.000 0.971 99 D CB 1.192 42.143 40.800 0.252 0.000 1.137 99 D HN -0.639 7.795 8.370 0.107 0.000 0.475 100 L N -1.513 119.911 121.223 0.335 0.000 2.322 100 L HA 0.211 4.551 4.340 0.000 0.000 0.281 100 L C -0.635 176.474 176.870 0.399 0.000 1.014 100 L CA -0.998 54.026 54.840 0.306 0.000 0.815 100 L CB 1.483 43.719 42.059 0.296 0.000 1.247 100 L HN 0.191 8.676 8.230 0.425 0.000 0.421 101 S N 2.389 118.211 115.700 0.204 0.000 2.585 101 S HA 0.170 4.640 4.470 0.000 0.000 0.273 101 S C -1.292 173.470 174.600 0.270 0.000 1.339 101 S CA 1.245 59.494 58.200 0.082 0.000 1.028 101 S CB 0.716 63.892 63.200 -0.041 0.000 0.906 101 S HN 0.283 8.672 8.310 0.130 0.000 0.528 102 F N -1.566 118.481 119.950 0.161 0.000 2.779 102 F HA 0.505 5.032 4.527 0.000 0.000 0.316 102 F C -2.322 173.550 175.800 0.122 0.000 1.164 102 F CA -1.463 56.611 58.000 0.125 0.000 0.924 102 F CB 1.431 40.508 39.000 0.128 0.000 1.348 102 F HN 0.033 8.187 8.300 -0.245 0.000 0.467 103 Q N -1.792 118.251 119.800 0.405 0.000 2.486 103 Q HA 0.564 4.904 4.340 0.000 0.000 0.274 103 Q C -0.662 175.517 176.000 0.298 0.000 1.076 103 Q CA -2.207 53.752 55.803 0.260 0.000 0.872 103 Q CB 3.411 32.238 28.738 0.148 0.000 1.383 103 Q HN -0.063 8.690 8.270 0.424 -0.229 0.478 104 K N 0.170 120.682 120.400 0.188 0.000 2.270 104 K HA -0.280 4.040 4.320 0.000 0.000 0.276 104 K C 0.684 177.323 176.600 0.064 0.000 1.023 104 K CA 0.922 57.280 56.287 0.118 0.000 0.955 104 K CB 0.601 33.143 32.500 0.071 0.000 0.975 104 K HN -0.223 8.259 8.250 0.150 -0.142 0.471 105 G N 5.591 114.400 108.800 0.015 0.000 2.253 105 G HA2 -0.440 3.520 3.960 0.000 0.000 0.251 105 G HA3 -0.440 3.520 3.960 0.000 0.000 0.251 105 G C -0.375 174.523 174.900 -0.003 0.000 0.998 105 G CA -0.030 45.066 45.100 -0.006 0.000 0.621 105 G HN 0.362 8.647 8.290 -0.007 0.000 0.524 106 D N 1.677 122.089 120.400 0.020 0.000 2.372 106 D HA 0.096 4.736 4.640 0.000 0.000 0.243 106 D C -1.448 174.823 176.300 -0.047 0.000 1.121 106 D CA 0.984 54.990 54.000 0.010 0.000 0.898 106 D CB 0.772 41.608 40.800 0.060 0.000 1.202 106 D HN -0.647 7.659 8.370 0.054 0.096 0.428 107 Q N -0.700 119.075 119.800 -0.042 0.000 2.399 107 Q HA 0.931 5.271 4.340 0.000 0.000 0.276 107 Q C -0.936 175.029 176.000 -0.059 0.000 1.098 107 Q CA -1.251 54.517 55.803 -0.059 0.000 0.827 107 Q CB 3.899 32.615 28.738 -0.037 0.000 1.386 107 Q HN 0.284 8.542 8.270 -0.020 0.000 0.443 108 M N -4.703 114.859 119.600 -0.063 0.000 2.534 108 M HA 0.644 5.124 4.480 0.000 0.000 0.280 108 M C -2.032 174.258 176.300 -0.018 0.000 1.217 108 M CA -0.626 54.647 55.300 -0.044 0.000 0.893 108 M CB 4.151 36.707 32.600 -0.073 0.000 1.730 108 M HN 0.156 8.407 8.290 -0.065 0.000 0.483 109 V N 1.010 120.920 119.914 -0.007 0.000 2.461 109 V HA 0.574 4.694 4.120 0.000 0.000 0.275 109 V C -0.478 175.623 176.094 0.011 0.000 1.047 109 V CA -0.021 62.278 62.300 -0.002 0.000 0.955 109 V CB -0.599 31.219 31.823 -0.009 0.000 0.988 109 V HN 0.240 8.425 8.190 -0.009 0.000 0.471 110 V N 5.064 124.986 119.914 0.013 0.000 2.481 110 V HA 0.671 4.791 4.120 0.000 0.000 0.286 110 V C -1.126 174.946 176.094 -0.038 0.000 1.042 110 V CA -1.327 60.984 62.300 0.019 0.000 0.928 110 V CB 0.916 32.745 31.823 0.011 0.000 0.986 110 V HN 0.371 8.562 8.190 0.002 0.000 0.462 111 L N 5.324 126.529 121.223 -0.029 0.000 2.500 111 L HA 0.364 4.704 4.340 0.000 0.000 0.219 111 L C 0.692 177.521 176.870 -0.069 0.000 1.057 111 L CA 1.236 56.048 54.840 -0.047 0.000 0.854 111 L CB 1.160 43.198 42.059 -0.035 0.000 1.078 111 L HN 0.966 9.096 8.230 0.009 0.106 0.480 112 E N -2.609 117.548 120.200 -0.072 0.000 2.366 112 E HA 0.164 4.514 4.350 0.000 0.000 0.278 112 E C -1.660 174.770 176.600 -0.284 0.000 0.923 112 E CA -0.937 55.402 56.400 -0.103 0.000 0.761 112 E CB 3.321 33.040 29.700 0.031 0.000 1.231 112 E HN -0.854 7.489 8.360 -0.028 0.000 0.443 113 E N 2.131 122.074 120.200 -0.427 0.000 2.464 113 E HA 0.185 4.535 4.350 0.000 0.000 0.260 113 E C -0.629 175.889 176.600 -0.136 0.000 1.318 113 E CA -1.228 54.689 56.400 -0.805 0.000 1.571 113 E CB -0.347 28.952 29.700 -0.667 0.000 1.525 113 E HN 0.398 8.595 8.360 -0.272 0.000 0.449 117 E N 2.971 123.257 120.200 0.142 0.000 2.299 117 E HA 0.054 4.404 4.350 0.000 0.000 0.193 117 E C -0.747 175.718 176.600 -0.226 0.000 0.998 117 E CA 0.081 56.440 56.400 -0.069 0.000 0.851 117 E CB 1.083 30.741 29.700 -0.070 0.000 0.795 117 E HN 0.008 8.478 8.360 0.183 0.000 0.492 118 W N -1.448 119.895 121.300 0.072 0.000 2.600 118 W HA 0.197 4.857 4.660 0.000 0.000 0.325 118 W C -1.482 175.268 176.519 0.385 0.000 1.034 118 W CA -1.336 56.069 57.345 0.101 0.000 1.226 118 W CB 2.066 31.527 29.460 0.002 0.000 1.379 118 W HN -0.901 7.447 8.180 0.357 0.046 0.466 119 W N 1.974 123.505 121.300 0.385 0.000 2.647 119 W HA 0.423 5.083 4.660 0.000 0.000 0.353 119 W C -1.466 175.261 176.519 0.347 0.000 1.080 119 W CA -3.355 54.171 57.345 0.300 0.000 1.208 119 W CB 3.096 32.649 29.460 0.155 0.000 1.396 119 W HN 0.865 9.236 8.180 0.492 0.104 0.573 120 K N 0.805 121.460 120.400 0.425 0.000 2.183 120 K HA 0.608 4.928 4.320 0.000 0.000 0.274 120 K C -1.804 174.846 176.600 0.084 0.000 1.009 120 K CA -0.936 55.411 56.287 0.100 0.000 0.888 120 K CB 1.896 34.352 32.500 -0.074 0.000 1.078 120 K HN -0.057 8.405 8.250 0.353 0.000 0.459 121 A N 4.903 127.748 122.820 0.041 0.000 2.569 121 A HA 0.810 5.130 4.320 0.000 0.000 0.290 121 A C -2.913 174.672 177.584 0.002 0.000 1.136 121 A CA -1.520 50.539 52.037 0.038 0.000 0.710 121 A CB 4.378 23.416 19.000 0.063 0.000 1.303 121 A HN 0.980 9.128 8.150 -0.003 0.000 0.413 122 R N -0.463 120.037 120.500 -0.001 0.000 2.393 122 R HA 0.498 4.838 4.340 0.000 0.000 0.315 122 R C -1.238 175.062 176.300 0.001 0.000 0.952 122 R CA -1.946 54.152 56.100 -0.004 0.000 0.842 122 R CB 2.663 32.958 30.300 -0.009 0.000 1.163 122 R HN 0.152 8.423 8.270 0.001 0.000 0.450 123 S N 6.131 121.840 115.700 0.014 0.000 2.455 123 S HA 0.112 4.582 4.470 0.000 0.000 0.278 123 S C 0.347 174.955 174.600 0.012 0.000 1.216 123 S CA -0.615 57.595 58.200 0.017 0.000 1.055 123 S CB 0.682 63.915 63.200 0.056 0.000 0.939 123 S HN 0.570 8.894 8.310 0.022 0.000 0.494 124 L N 7.923 129.147 121.223 0.002 0.000 2.191 124 L HA -0.222 4.118 4.340 0.000 0.000 0.212 124 L C 0.751 177.629 176.870 0.012 0.000 1.103 124 L CA 2.120 56.962 54.840 0.004 0.000 0.769 124 L CB -0.852 41.205 42.059 -0.003 0.000 0.908 124 L HN 0.716 8.941 8.230 -0.008 0.000 0.438 125 A N -2.533 120.301 122.820 0.022 0.000 1.898 125 A HA -0.084 4.236 4.320 0.000 0.000 0.216 125 A C 0.794 178.398 177.584 0.033 0.000 1.181 125 A CA 2.620 54.676 52.037 0.031 0.000 0.620 125 A CB 0.156 19.186 19.000 0.049 0.000 0.819 125 A HN -0.012 8.127 8.150 0.021 0.023 0.442 126 T N -7.555 107.022 114.554 0.039 0.000 3.054 126 T HA 0.286 4.636 4.350 0.000 0.000 0.255 126 T C 0.761 175.477 174.700 0.025 0.000 1.035 126 T CA -0.990 61.131 62.100 0.036 0.000 0.941 126 T CB 0.894 69.792 68.868 0.050 0.000 1.026 126 T HN -0.494 7.687 8.240 0.044 0.085 0.533 127 R N -2.319 118.193 120.500 0.020 0.000 4.000 127 R HA -0.384 3.956 4.340 0.000 0.000 0.348 127 R C -0.759 175.547 176.300 0.010 0.000 1.204 127 R CA 1.019 57.125 56.100 0.011 0.000 0.987 127 R CB -2.986 27.318 30.300 0.008 0.000 1.446 127 R HN 0.387 8.669 8.270 0.020 0.000 0.555 128 K N 0.035 120.446 120.400 0.019 0.000 2.143 128 K HA 0.087 4.407 4.320 0.000 0.000 0.272 128 K C -0.978 175.626 176.600 0.008 0.000 1.001 128 K CA -0.632 55.665 56.287 0.016 0.000 0.915 128 K CB 1.020 33.540 32.500 0.033 0.000 1.047 128 K HN -0.682 7.533 8.250 0.028 0.052 0.458 129 E N 1.207 121.399 120.200 -0.013 0.000 2.166 129 E HA 0.554 4.904 4.350 0.000 0.000 0.275 129 E C -0.585 175.973 176.600 -0.071 0.000 0.941 129 E CA -0.648 55.727 56.400 -0.040 0.000 0.784 129 E CB 2.406 32.074 29.700 -0.053 0.000 1.115 129 E HN 0.146 8.497 8.360 -0.015 0.000 0.399 130 G N 0.737 109.470 108.800 -0.112 0.000 2.321 130 G HA2 0.186 4.146 3.960 0.000 0.000 0.296 130 G HA3 0.186 4.146 3.960 0.000 0.000 0.296 130 G C -2.800 171.979 174.900 -0.201 0.000 1.287 130 G CA 0.686 45.672 45.100 -0.190 0.000 0.846 130 G HN 0.314 8.550 8.290 -0.091 0.000 0.508 131 Y N -2.449 117.919 120.300 0.114 0.000 2.307 131 Y HA 0.710 5.260 4.550 0.000 0.000 0.324 131 Y C -1.162 174.949 175.900 0.352 0.000 1.238 131 Y CA 0.312 58.530 58.100 0.197 0.000 1.280 131 Y CB 1.959 40.439 38.460 0.033 0.000 1.248 131 Y HN 0.088 8.401 8.280 0.055 0.000 0.508 132 I N 0.321 121.279 120.570 0.647 0.000 2.769 132 I HA 0.436 4.606 4.170 0.000 0.000 0.298 132 I C -2.742 173.537 176.117 0.271 0.000 1.128 132 I CA -4.234 57.315 61.300 0.416 0.000 1.031 132 I CB 4.676 42.811 38.000 0.225 0.000 1.235 132 I HN 0.663 9.330 8.210 0.761 0.000 0.423 133 P HA 0.309 4.729 4.420 0.000 0.000 0.281 133 P C 0.107 177.223 177.300 -0.306 0.000 1.286 133 P CA -0.715 62.067 63.100 -0.530 0.000 0.772 133 P CB -0.308 30.885 31.700 -0.846 0.000 0.862 134 S N 7.275 122.665 115.700 -0.516 0.000 2.368 134 S HA -0.487 3.983 4.470 0.000 0.000 0.226 134 S C 1.193 175.508 174.600 -0.475 0.000 1.044 134 S CA 3.929 61.621 58.200 -0.847 0.000 1.062 134 S CB -0.316 62.254 63.200 -1.051 0.000 0.931 134 S HN 0.521 8.403 8.310 -0.536 0.106 0.440 135 N N -0.730 117.823 118.700 -0.246 0.000 2.515 135 N HA -0.186 4.554 4.740 0.000 0.000 0.191 135 N C 0.366 175.858 175.510 -0.030 0.000 1.182 135 N CA 1.062 54.033 53.050 -0.132 0.000 0.879 135 N CB -0.931 37.479 38.487 -0.129 0.000 0.984 135 N HN 0.270 8.509 8.380 -0.236 0.000 0.453 136 Y N -2.015 118.256 120.300 -0.049 0.000 2.510 136 Y HA -0.059 4.491 4.550 0.000 0.000 0.273 136 Y C -0.814 175.102 175.900 0.028 0.000 1.119 136 Y CA 2.461 60.672 58.100 0.184 0.000 1.286 136 Y CB 1.203 39.835 38.460 0.286 0.000 1.061 136 Y HN -0.529 7.772 8.280 0.188 0.093 0.542 137 V N -7.989 111.922 119.914 -0.006 0.000 3.126 137 V HA 0.792 4.912 4.120 0.000 0.000 0.314 137 V C -1.704 174.307 176.094 -0.137 0.000 1.138 137 V CA -3.308 58.921 62.300 -0.119 0.000 1.034 137 V CB 3.784 35.505 31.823 -0.169 0.000 1.075 137 V HN -0.581 7.527 8.190 -0.062 0.045 0.442 138 A N -0.492 122.262 122.820 -0.111 0.000 2.606 138 A HA 0.496 4.816 4.320 0.000 0.000 0.293 138 A C -1.805 175.758 177.584 -0.035 0.000 1.082 138 A CA -0.784 51.211 52.037 -0.071 0.000 0.685 138 A CB 3.401 22.337 19.000 -0.106 0.000 1.284 138 A HN 0.052 8.132 8.150 -0.118 0.000 0.408 139 R N 0.284 120.789 120.500 0.007 0.000 2.585 139 R HA -0.084 4.256 4.340 0.000 0.000 0.275 139 R C -0.013 176.264 176.300 -0.039 0.000 1.018 139 R CA 0.664 56.767 56.100 0.005 0.000 1.072 139 R CB 0.475 30.787 30.300 0.020 0.000 0.953 139 R HN 0.487 8.775 8.270 0.029 0.000 0.419 140 V N 2.887 122.778 119.914 -0.037 0.000 2.788 140 V HA -0.283 3.837 4.120 0.000 0.000 0.307 140 V C -0.275 175.784 176.094 -0.059 0.000 1.069 140 V CA 1.608 63.876 62.300 -0.054 0.000 1.173 140 V CB 0.341 32.140 31.823 -0.040 0.000 0.925 140 V HN -0.338 7.839 8.190 -0.022 0.000 0.492 141 D N 5.372 125.725 120.400 -0.079 0.000 2.720 141 D HA -0.238 4.402 4.640 0.000 0.000 0.229 141 D C -0.900 175.345 176.300 -0.091 0.000 1.198 141 D CA 1.386 55.335 54.000 -0.085 0.000 0.639 141 D CB -1.145 39.624 40.800 -0.052 0.000 1.003 141 D HN 0.335 8.652 8.370 -0.088 0.000 0.411 142 S N -3.603 112.021 115.700 -0.127 0.000 2.767 142 S HA 0.183 4.653 4.470 0.000 0.000 0.300 142 S C 1.277 175.726 174.600 -0.253 0.000 1.123 142 S CA -1.053 57.061 58.200 -0.145 0.000 0.992 142 S CB 2.846 65.973 63.200 -0.121 0.000 1.138 142 S HN -0.751 7.472 8.310 -0.139 0.004 0.550 143 L N -1.289 119.735 121.223 -0.332 0.000 2.089 143 L HA -0.193 4.147 4.340 0.000 0.000 0.213 143 L C 1.572 177.991 176.870 -0.752 0.000 1.079 143 L CA 3.077 57.540 54.840 -0.629 0.000 0.758 143 L CB -0.561 41.011 42.059 -0.813 0.000 0.891 143 L HN 0.295 8.377 8.230 -0.247 0.000 0.433 144 E N -3.231 116.686 120.200 -0.472 0.000 2.347 144 E HA -0.165 4.185 4.350 0.000 0.000 0.196 144 E C 1.356 177.771 176.600 -0.308 0.000 1.008 144 E CA 1.613 57.851 56.400 -0.271 0.000 0.852 144 E CB -0.379 29.234 29.700 -0.145 0.000 0.783 144 E HN -0.431 7.686 8.360 -0.360 0.026 0.505 145 T N -0.459 113.892 114.554 -0.337 0.000 3.035 145 T HA -0.038 4.312 4.350 0.000 0.000 0.268 145 T C 0.305 174.769 174.700 -0.395 0.000 1.109 145 T CA 1.865 63.776 62.100 -0.315 0.000 1.119 145 T CB 0.058 68.783 68.868 -0.238 0.000 0.900 145 T HN -0.453 7.406 8.240 -0.343 0.175 0.503 146 E N 0.121 119.974 120.200 -0.579 0.000 2.283 146 E HA 0.256 4.606 4.350 0.000 0.000 0.271 146 E C 0.728 176.896 176.600 -0.720 0.000 1.031 146 E CA -1.318 54.636 56.400 -0.742 0.000 0.868 146 E CB 0.934 29.856 29.700 -1.297 0.000 1.094 146 E HN -0.843 7.077 8.360 -0.634 0.061 0.401 147 E N 3.078 122.961 120.200 -0.529 0.000 2.209 147 E HA -0.265 4.085 4.350 0.000 0.000 0.196 147 E C -0.098 176.355 176.600 -0.246 0.000 0.993 147 E CA 2.880 59.089 56.400 -0.319 0.000 0.819 147 E CB -0.426 29.204 29.700 -0.115 0.000 0.745 147 E HN 0.670 8.758 8.360 -0.454 0.000 0.477 148 W N -8.932 112.332 121.300 -0.061 0.000 3.220 148 W HA 0.163 4.823 4.660 0.000 0.000 0.328 148 W C -0.989 175.622 176.519 0.153 0.000 1.205 148 W CA -3.152 54.209 57.345 0.026 0.000 1.773 148 W CB 0.025 29.533 29.460 0.079 0.000 1.086 148 W HN -0.684 6.908 8.180 -0.882 0.058 0.622 149 F N 2.225 122.057 119.950 -0.198 0.000 2.408 149 F HA 0.362 4.889 4.527 0.000 0.000 0.344 149 F C -1.741 173.877 175.800 -0.303 0.000 1.112 149 F CA -0.528 57.447 58.000 -0.041 0.000 1.096 149 F CB 1.798 40.566 39.000 -0.388 0.000 1.129 149 F HN -0.589 7.402 8.300 -0.431 0.051 0.486 150 F N 8.150 127.660 119.950 -0.733 0.000 2.445 150 F HA 0.199 4.726 4.527 0.000 0.000 0.348 150 F C -1.703 173.752 175.800 -0.575 0.000 1.125 150 F CA -1.334 56.396 58.000 -0.451 0.000 0.983 150 F CB 2.313 41.145 39.000 -0.281 0.000 1.198 150 F HN 0.720 8.648 8.300 -0.620 0.000 0.436 151 K N 4.863 125.174 120.400 -0.148 0.000 2.298 151 K HA -0.093 4.227 4.320 0.000 0.000 0.280 151 K C 0.786 177.392 176.600 0.011 0.000 1.032 151 K CA -0.118 56.186 56.287 0.029 0.000 0.958 151 K CB 0.133 32.724 32.500 0.152 0.000 0.978 151 K HN 0.325 8.523 8.250 -0.087 0.000 0.472 152 G N 6.375 115.194 108.800 0.032 0.000 2.225 152 G HA2 -0.315 3.645 3.960 0.000 0.000 0.267 152 G HA3 -0.315 3.645 3.960 0.000 0.000 0.267 152 G C -0.217 174.676 174.900 -0.012 0.000 1.024 152 G CA 0.432 45.544 45.100 0.020 0.000 0.784 152 G HN 0.056 8.592 8.290 0.057 -0.212 0.507 153 I N 2.462 123.019 120.570 -0.022 0.000 2.371 153 I HA 0.070 4.240 4.170 0.000 0.000 0.290 153 I C -0.483 175.607 176.117 -0.044 0.000 1.028 153 I CA -2.037 59.241 61.300 -0.036 0.000 1.345 153 I CB -0.081 37.899 38.000 -0.033 0.000 1.407 153 I HN -0.611 7.549 8.210 -0.032 0.032 0.501 154 S N 6.282 121.953 115.700 -0.049 0.000 2.580 154 S HA 0.126 4.596 4.470 0.000 0.000 0.274 154 S C 1.212 175.769 174.600 -0.072 0.000 1.329 154 S CA -0.667 57.502 58.200 -0.051 0.000 1.036 154 S CB 1.620 64.797 63.200 -0.039 0.000 0.919 154 S HN 0.363 8.641 8.310 -0.054 0.000 0.515 155 R N 4.561 124.994 120.500 -0.112 0.000 2.159 155 R HA -0.430 3.910 4.340 0.000 0.000 0.249 155 R C 1.900 178.144 176.300 -0.094 0.000 1.136 155 R CA 4.007 59.989 56.100 -0.196 0.000 0.951 155 R CB -0.314 29.804 30.300 -0.303 0.000 0.876 155 R HN 0.787 9.098 8.270 -0.107 -0.105 0.440 156 K N -3.225 117.142 120.400 -0.056 0.000 2.025 156 K HA -0.219 4.101 4.320 0.000 0.000 0.207 156 K C 2.333 178.922 176.600 -0.017 0.000 1.049 156 K CA 2.586 58.865 56.287 -0.013 0.000 0.933 156 K CB -0.736 31.761 32.500 -0.006 0.000 0.714 156 K HN -0.060 8.141 8.250 -0.063 0.012 0.438 157 D N -0.374 120.005 120.400 -0.035 0.000 2.263 157 D HA -0.206 4.434 4.640 0.000 0.000 0.208 157 D C 2.148 178.411 176.300 -0.062 0.000 0.971 157 D CA 3.045 57.018 54.000 -0.046 0.000 0.867 157 D CB -0.417 40.349 40.800 -0.057 0.000 0.929 157 D HN -0.647 7.699 8.370 -0.040 0.000 0.492 158 A N -0.121 122.662 122.820 -0.061 0.000 1.898 158 A HA -0.278 4.042 4.320 0.000 0.000 0.216 158 A C 1.860 179.408 177.584 -0.060 0.000 1.181 158 A CA 3.371 55.355 52.037 -0.087 0.000 0.620 158 A CB -0.675 18.305 19.000 -0.034 0.000 0.819 158 A HN 0.253 8.271 8.150 -0.052 0.100 0.442 159 E N -1.535 118.671 120.200 0.009 0.000 2.106 159 E HA -0.382 3.968 4.350 0.000 0.000 0.192 159 E C 2.812 179.389 176.600 -0.038 0.000 0.984 159 E CA 3.142 59.540 56.400 -0.003 0.000 0.806 159 E CB -0.185 29.533 29.700 0.029 0.000 0.750 159 E HN -0.431 7.861 8.360 0.036 0.090 0.458 160 R N -1.166 119.313 120.500 -0.036 0.000 2.081 160 R HA -0.319 4.021 4.340 0.000 0.000 0.235 160 R C 2.485 178.754 176.300 -0.053 0.000 1.131 160 R CA 3.198 59.274 56.100 -0.039 0.000 0.960 160 R CB -0.129 30.154 30.300 -0.028 0.000 0.856 160 R HN 0.093 8.269 8.270 -0.028 0.077 0.436 161 Q N -1.879 117.875 119.800 -0.076 0.000 2.079 161 Q HA -0.230 4.110 4.340 0.000 0.000 0.200 161 Q C 3.137 179.069 176.000 -0.114 0.000 0.974 161 Q CA 2.987 58.731 55.803 -0.098 0.000 0.840 161 Q CB 0.187 28.837 28.738 -0.148 0.000 0.898 161 Q HN -0.249 7.965 8.270 -0.080 0.009 0.430 162 L N -0.542 120.600 121.223 -0.135 0.000 2.291 162 L HA -0.196 4.144 4.340 0.000 0.000 0.214 162 L C 1.053 177.880 176.870 -0.073 0.000 1.120 162 L CA 2.533 57.299 54.840 -0.123 0.000 0.799 162 L CB 0.217 42.197 42.059 -0.132 0.000 0.925 162 L HN 0.112 8.261 8.230 -0.135 0.000 0.446 163 L N -4.165 117.022 121.223 -0.060 0.000 2.592 163 L HA 0.013 4.353 4.340 0.000 0.000 0.227 163 L C -0.178 176.673 176.870 -0.032 0.000 1.127 163 L CA -0.772 54.042 54.840 -0.043 0.000 0.884 163 L CB -0.502 41.530 42.059 -0.045 0.000 1.065 163 L HN -0.437 7.646 8.230 -0.065 0.108 0.457 164 A N -0.049 122.751 122.820 -0.033 0.000 2.351 164 A HA 0.246 4.566 4.320 0.000 0.000 0.257 164 A C -2.241 175.337 177.584 -0.011 0.000 1.087 164 A CA -2.316 49.710 52.037 -0.018 0.000 0.798 164 A CB -0.689 18.300 19.000 -0.019 0.000 1.033 164 A HN -0.635 7.303 8.150 -0.045 0.185 0.488 165 P HA -0.156 4.264 4.420 0.000 0.000 0.265 165 P C -0.276 177.027 177.300 0.005 0.000 1.187 165 P CA 1.702 64.805 63.100 0.004 0.000 0.766 165 P CB 0.288 31.995 31.700 0.012 0.000 0.820 166 G N 1.883 110.687 108.800 0.006 0.000 2.278 166 G HA2 -0.219 3.741 3.960 0.000 0.000 0.210 166 G HA3 -0.219 3.741 3.960 0.000 0.000 0.210 166 G C -0.605 174.301 174.900 0.010 0.000 1.000 166 G CA -0.314 44.793 45.100 0.010 0.000 0.635 166 G HN 0.318 8.611 8.290 0.004 0.000 0.495 167 N N 2.678 121.379 118.700 0.001 0.000 2.493 167 N HA 0.446 5.186 4.740 0.000 0.000 0.275 167 N C -1.580 173.934 175.510 0.006 0.000 1.186 167 N CA 0.006 53.055 53.050 -0.000 0.000 0.978 167 N CB 1.446 39.921 38.487 -0.021 0.000 1.184 167 N HN -0.570 7.723 8.380 -0.003 0.085 0.487 168 M N -3.363 116.246 119.600 0.016 0.000 3.372 168 M HA 0.286 4.766 4.480 0.000 0.000 0.292 168 M C -1.255 175.062 176.300 0.027 0.000 1.391 168 M CA -1.300 54.010 55.300 0.017 0.000 0.786 168 M CB 1.398 34.008 32.600 0.017 0.000 1.798 168 M HN 0.135 8.439 8.290 0.024 0.000 0.442 169 L N -0.366 120.873 121.223 0.026 0.000 2.525 169 L HA -0.321 4.019 4.340 0.000 0.000 0.278 169 L C 1.616 178.516 176.870 0.051 0.000 1.218 169 L CA 1.900 56.761 54.840 0.035 0.000 0.878 169 L CB -1.339 40.736 42.059 0.027 0.000 1.127 169 L HN 0.173 8.413 8.230 0.018 0.000 0.492 170 G N 2.791 111.625 108.800 0.057 0.000 2.234 170 G HA2 -0.504 3.456 3.960 0.000 0.000 0.260 170 G HA3 -0.504 3.456 3.960 0.000 0.000 0.260 170 G C 0.656 175.657 174.900 0.169 0.000 0.987 170 G CA 0.392 45.539 45.100 0.078 0.000 0.625 170 G HN 0.812 9.132 8.290 0.049 0.000 0.532 171 S N 4.133 119.918 115.700 0.141 0.000 2.575 171 S HA 0.076 4.546 4.470 0.000 0.000 0.295 171 S C -0.981 173.726 174.600 0.179 0.000 1.267 171 S CA 2.741 61.031 58.200 0.150 0.000 1.074 171 S CB 0.141 63.363 63.200 0.037 0.000 0.829 171 S HN -0.389 7.894 8.310 0.089 0.081 0.497 172 F N 0.574 120.517 119.950 -0.011 0.000 2.814 172 F HA 1.082 5.609 4.527 0.000 0.000 0.353 172 F C -2.664 173.125 175.800 -0.019 0.000 1.177 172 F CA -2.459 55.523 58.000 -0.031 0.000 1.036 172 F CB 3.295 42.279 39.000 -0.027 0.000 1.455 172 F HN 0.298 8.591 8.300 -0.012 0.000 0.520 173 M N -6.582 112.994 119.600 -0.040 0.000 2.605 173 M HA 0.540 5.020 4.480 0.000 0.000 0.281 173 M C -2.386 174.027 176.300 0.188 0.000 1.166 173 M CA 0.125 55.393 55.300 -0.054 0.000 0.875 173 M CB 4.136 36.477 32.600 -0.431 0.000 1.732 173 M HN -0.090 8.352 8.290 0.255 0.000 0.504 174 I N 0.391 121.142 120.570 0.303 0.000 2.562 174 I HA 0.903 5.073 4.170 0.000 0.000 0.301 174 I C -1.462 174.651 176.117 -0.006 0.000 1.003 174 I CA -1.390 60.040 61.300 0.217 0.000 1.127 174 I CB 2.671 40.848 38.000 0.294 0.000 1.304 174 I HN 0.925 9.415 8.210 0.467 0.000 0.446 175 R N 0.977 121.411 120.500 -0.110 0.000 2.741 175 R HA 0.533 4.873 4.340 0.000 0.000 0.274 175 R C -2.016 174.280 176.300 -0.007 0.000 1.029 175 R CA -1.351 54.521 56.100 -0.380 0.000 0.880 175 R CB 2.298 32.489 30.300 -0.181 0.000 1.264 175 R HN 0.562 8.867 8.270 0.057 0.000 0.465 176 D N 0.219 120.646 120.400 0.044 0.000 2.425 176 D HA 0.064 4.704 4.640 0.000 0.000 0.247 176 D C -0.481 175.917 176.300 0.164 0.000 1.147 176 D CA 1.113 55.301 54.000 0.314 0.000 0.879 176 D CB 0.122 41.073 40.800 0.253 0.000 1.179 176 D HN -0.117 8.164 8.370 -0.150 0.000 0.456 177 S N 2.481 118.277 115.700 0.160 0.000 2.531 177 S HA -0.057 4.413 4.470 0.000 0.000 0.279 177 S C 0.314 174.933 174.600 0.033 0.000 1.305 177 S CA 0.126 58.364 58.200 0.063 0.000 1.058 177 S CB 0.991 64.215 63.200 0.039 0.000 0.899 177 S HN 0.043 8.474 8.310 0.201 0.000 0.493 178 E N 7.664 127.864 120.200 -0.000 0.000 2.170 178 E HA -0.065 4.285 4.350 0.000 0.000 0.191 178 E C 0.539 177.136 176.600 -0.005 0.000 0.981 178 E CA 2.377 58.773 56.400 -0.006 0.000 0.830 178 E CB 0.262 29.941 29.700 -0.035 0.000 0.775 178 E HN 0.687 9.035 8.360 -0.020 0.000 0.470 179 T N -5.198 109.347 114.554 -0.014 0.000 2.988 179 T HA 0.184 4.534 4.350 0.000 0.000 0.240 179 T C 1.231 175.930 174.700 -0.001 0.000 1.014 179 T CA 0.865 62.960 62.100 -0.009 0.000 1.155 179 T CB 0.453 69.309 68.868 -0.020 0.000 0.872 179 T HN -0.248 7.978 8.240 -0.023 0.000 0.440 180 T N 6.739 121.292 114.554 -0.003 0.000 3.455 180 T HA 0.107 4.457 4.350 0.000 0.000 0.286 180 T C -0.829 173.869 174.700 -0.003 0.000 1.157 180 T CA 0.057 62.156 62.100 -0.001 0.000 1.090 180 T CB -1.158 67.708 68.868 -0.003 0.000 1.112 180 T HN -0.139 8.096 8.240 -0.008 0.000 0.779 181 K N 5.369 125.771 120.400 0.004 0.000 2.485 181 K HA -0.225 4.095 4.320 0.000 0.000 0.277 181 K C 1.944 178.537 176.600 -0.012 0.000 0.990 181 K CA 0.146 56.438 56.287 0.008 0.000 0.994 181 K CB -0.017 32.495 32.500 0.019 0.000 0.906 181 K HN -0.242 7.977 8.250 0.008 0.035 0.488 182 G N 3.800 112.590 108.800 -0.017 0.000 2.184 182 G HA2 -0.399 3.561 3.960 0.000 0.000 0.264 182 G HA3 -0.399 3.561 3.960 0.000 0.000 0.264 182 G C -0.530 174.242 174.900 -0.214 0.000 0.975 182 G CA 0.894 45.962 45.100 -0.053 0.000 0.642 182 G HN 0.768 9.065 8.290 0.012 0.000 0.536 183 S N 0.184 115.738 115.700 -0.244 0.000 2.801 183 S HA 0.572 5.042 4.470 0.000 0.000 0.312 183 S C -1.699 172.614 174.600 -0.477 0.000 1.112 183 S CA -1.390 56.574 58.200 -0.394 0.000 0.943 183 S CB 2.370 65.502 63.200 -0.113 0.000 1.269 183 S HN -0.753 7.404 8.310 -0.130 0.075 0.558 184 Y N -1.848 118.502 120.300 0.083 0.000 2.665 184 Y HA 0.647 5.197 4.550 0.000 0.000 0.336 184 Y C -1.220 174.710 175.900 0.049 0.000 1.085 184 Y CA -1.458 56.689 58.100 0.078 0.000 1.096 184 Y CB 3.349 41.857 38.460 0.079 0.000 1.301 184 Y HN -0.362 7.875 8.280 -0.071 0.000 0.493 185 S N -2.292 113.547 115.700 0.231 0.000 2.588 185 S HA 0.745 5.215 4.470 0.000 0.000 0.275 185 S C -2.520 172.164 174.600 0.140 0.000 1.130 185 S CA -0.731 57.553 58.200 0.141 0.000 0.855 185 S CB 3.712 66.959 63.200 0.078 0.000 1.116 185 S HN 0.557 9.022 8.310 0.258 0.000 0.472 186 L N 1.539 122.848 121.223 0.143 0.000 2.341 186 L HA 0.818 5.158 4.340 0.000 0.000 0.278 186 L C -2.191 174.785 176.870 0.176 0.000 1.005 186 L CA -1.496 53.429 54.840 0.142 0.000 0.818 186 L CB 2.604 44.710 42.059 0.078 0.000 1.259 186 L HN 0.644 8.966 8.230 0.153 0.000 0.418 187 S N 6.369 122.157 115.700 0.147 0.000 2.482 187 S HA 0.704 5.174 4.470 0.000 0.000 0.303 187 S C -2.004 172.619 174.600 0.039 0.000 1.091 187 S CA -0.875 57.364 58.200 0.064 0.000 1.057 187 S CB 2.183 65.441 63.200 0.097 0.000 1.031 187 S HN 0.384 8.782 8.310 0.146 0.000 0.485 188 V N 2.005 121.909 119.914 -0.017 0.000 2.709 188 V HA 0.416 4.536 4.120 0.000 0.000 0.308 188 V C -1.206 174.879 176.094 -0.014 0.000 1.062 188 V CA -1.404 60.920 62.300 0.040 0.000 0.901 188 V CB 3.136 35.000 31.823 0.069 0.000 1.003 188 V HN 0.504 8.620 8.190 -0.122 0.000 0.425 189 R N 4.304 124.809 120.500 0.009 0.000 2.345 189 R HA 0.088 4.428 4.340 0.000 0.000 0.331 189 R C -1.323 174.987 176.300 0.018 0.000 1.067 189 R CA 0.268 56.366 56.100 -0.003 0.000 0.962 189 R CB 0.016 30.321 30.300 0.007 0.000 0.987 189 R HN 0.430 8.726 8.270 0.043 0.000 0.451 190 D N 5.212 125.618 120.400 0.011 0.000 2.592 190 D HA 0.217 4.857 4.640 0.000 0.000 0.259 190 D C -2.227 174.133 176.300 0.100 0.000 1.144 190 D CA -1.979 52.045 54.000 0.040 0.000 1.080 190 D CB 3.164 43.966 40.800 0.004 0.000 1.225 190 D HN 0.386 8.746 8.370 -0.017 0.000 0.619 191 Y N -0.872 119.414 120.300 -0.024 0.000 2.421 191 Y HA 0.398 4.948 4.550 0.000 0.000 0.339 191 Y C -2.177 173.710 175.900 -0.021 0.000 0.996 191 Y CA -1.020 57.065 58.100 -0.025 0.000 1.046 191 Y CB 3.158 41.607 38.460 -0.018 0.000 1.226 191 Y HN 0.116 8.476 8.280 0.132 0.000 0.445 192 D N 6.715 126.629 120.400 -0.810 0.000 2.732 192 D HA 0.476 5.116 4.640 0.000 0.000 0.229 192 D C -2.022 173.860 176.300 -0.696 0.000 1.152 192 D CA -1.948 51.701 54.000 -0.585 0.000 0.854 192 D CB 2.358 42.986 40.800 -0.286 0.000 1.590 192 D HN -0.235 7.539 8.370 -0.994 0.000 0.468 193 P HA -0.169 4.251 4.420 0.000 0.000 0.214 193 P C 0.035 177.232 177.300 -0.173 0.000 1.162 193 P CA 1.823 64.766 63.100 -0.262 0.000 0.879 193 P CB 0.546 32.177 31.700 -0.116 0.000 0.786 194 R N -1.634 118.787 120.500 -0.133 0.000 3.179 194 R HA 0.128 4.468 4.340 0.000 0.000 0.317 194 R C -0.803 175.453 176.300 -0.074 0.000 1.331 194 R CA -0.057 56.003 56.100 -0.066 0.000 1.184 194 R CB -1.142 29.134 30.300 -0.040 0.000 1.408 194 R HN 0.369 8.550 8.270 -0.147 0.000 0.598 195 Q N -1.551 118.174 119.800 -0.126 0.000 2.802 195 Q HA 0.218 4.558 4.340 0.000 0.000 0.296 195 Q C -1.535 174.430 176.000 -0.059 0.000 0.983 195 Q CA 0.060 55.796 55.803 -0.112 0.000 0.615 195 Q CB 1.792 30.440 28.738 -0.151 0.000 4.005 195 Q HN -0.274 7.811 8.270 -0.179 0.078 0.260 196 G N -2.304 106.459 108.800 -0.062 0.000 2.827 196 G HA2 0.171 4.131 3.960 0.000 0.000 0.202 196 G HA3 0.171 4.131 3.960 0.000 0.000 0.202 196 G C -2.711 172.305 174.900 0.194 0.000 1.185 196 G CA 0.402 45.585 45.100 0.139 0.000 0.920 196 G HN -0.073 8.124 8.290 -0.155 0.000 0.550 197 D N 1.016 121.512 120.400 0.160 0.000 2.264 197 D HA 0.345 4.985 4.640 0.000 0.000 0.250 197 D C -0.591 175.724 176.300 0.024 0.000 1.113 197 D CA 0.814 54.895 54.000 0.136 0.000 0.871 197 D CB 0.956 41.800 40.800 0.073 0.000 1.167 197 D HN -0.098 8.326 8.370 0.090 0.000 0.447 198 T N -1.711 112.840 114.554 -0.005 0.000 2.681 198 T HA 0.332 4.682 4.350 0.000 0.000 0.296 198 T C -2.310 172.341 174.700 -0.080 0.000 1.157 198 T CA -1.855 60.212 62.100 -0.055 0.000 1.025 198 T CB 3.331 72.152 68.868 -0.078 0.000 1.441 198 T HN 0.095 8.236 8.240 0.018 0.110 0.504 199 V N 0.375 120.211 119.914 -0.130 0.000 2.588 199 V HA 0.628 4.748 4.120 0.000 0.000 0.304 199 V C -0.919 174.958 176.094 -0.363 0.000 1.042 199 V CA -0.919 61.245 62.300 -0.226 0.000 0.877 199 V CB 1.524 33.202 31.823 -0.242 0.000 0.996 199 V HN 0.222 8.338 8.190 -0.123 0.000 0.425 200 K N 4.536 124.702 120.400 -0.390 0.000 2.221 200 K HA 0.535 4.855 4.320 0.000 0.000 0.243 200 K C -1.683 174.536 176.600 -0.634 0.000 0.968 200 K CA -2.020 53.998 56.287 -0.448 0.000 0.846 200 K CB 3.526 35.854 32.500 -0.288 0.000 1.141 200 K HN -0.004 8.079 8.250 -0.280 0.000 0.434 201 H N -0.639 118.211 119.070 -0.367 0.000 2.679 201 H HA 0.709 5.265 4.556 0.000 0.000 0.360 201 H C -1.075 173.939 175.328 -0.523 0.000 1.105 201 H CA -1.156 54.718 56.048 -0.291 0.000 1.196 201 H CB 3.155 32.824 29.762 -0.156 0.000 1.636 201 H HN 0.330 8.367 8.280 -0.405 0.000 0.531 202 Y N 0.999 121.317 120.300 0.030 0.000 2.352 202 Y HA 0.266 4.816 4.550 0.000 0.000 0.339 202 Y C -1.156 174.739 175.900 -0.008 0.000 0.992 202 Y CA -1.578 56.508 58.100 -0.023 0.000 1.100 202 Y CB 1.972 40.373 38.460 -0.098 0.000 1.192 202 Y HN 0.878 9.256 8.280 0.163 0.000 0.458 203 K N 2.850 123.298 120.400 0.080 0.000 2.258 203 K HA 0.388 4.708 4.320 0.000 0.000 0.264 203 K C -0.484 176.132 176.600 0.027 0.000 1.007 203 K CA -0.098 56.211 56.287 0.037 0.000 0.941 203 K CB 0.911 33.411 32.500 0.000 0.000 0.966 203 K HN 0.389 8.680 8.250 0.068 0.000 0.480 204 I N 2.856 123.444 120.570 0.029 0.000 2.569 204 I HA 0.268 4.438 4.170 0.000 0.000 0.296 204 I C -0.936 175.176 176.117 -0.008 0.000 1.028 204 I CA -1.268 60.043 61.300 0.019 0.000 1.082 204 I CB 2.740 40.818 38.000 0.131 0.000 1.264 204 I HN 0.151 8.389 8.210 0.047 0.000 0.429 205 R N 4.499 124.948 120.500 -0.084 0.000 2.854 205 R HA 0.482 4.822 4.340 0.000 0.000 0.271 205 R C -1.646 174.808 176.300 0.257 0.000 0.996 205 R CA -2.752 53.353 56.100 0.008 0.000 0.961 205 R CB 2.976 33.212 30.300 -0.106 0.000 1.182 205 R HN 0.303 8.450 8.270 -0.205 0.000 0.479 206 T N 2.705 117.399 114.554 0.232 0.000 2.892 206 T HA 0.394 4.744 4.350 0.000 0.000 0.311 206 T C -0.730 174.048 174.700 0.130 0.000 1.033 206 T CA -0.045 62.191 62.100 0.227 0.000 0.991 206 T CB 0.427 69.420 68.868 0.208 0.000 0.981 206 T HN 0.246 8.580 8.240 0.156 0.000 0.457 207 L N 7.499 128.775 121.223 0.089 0.000 2.051 207 L HA 0.148 4.488 4.340 0.000 0.000 0.202 207 L C 0.174 177.051 176.870 0.012 0.000 1.097 207 L CA 2.094 56.964 54.840 0.050 0.000 0.762 207 L CB 1.389 43.460 42.059 0.020 0.000 0.913 207 L HN 0.257 8.526 8.230 0.064 0.000 0.447 208 D N -4.767 115.619 120.400 -0.023 0.000 4.057 208 D HA -0.127 4.513 4.640 0.000 0.000 0.373 208 D C -0.141 176.131 176.300 -0.047 0.000 0.400 208 D CA 0.385 54.370 54.000 -0.026 0.000 0.785 208 D CB 0.136 40.929 40.800 -0.010 0.000 1.546 208 D HN -0.165 8.175 8.370 -0.049 0.000 0.160 209 N N 0.901 119.566 118.700 -0.058 0.000 3.115 209 N HA -0.014 4.726 4.740 0.000 0.000 0.305 209 N C 0.452 175.900 175.510 -0.103 0.000 1.305 209 N CA -0.461 52.549 53.050 -0.068 0.000 1.154 209 N CB -1.882 36.566 38.487 -0.066 0.000 1.454 209 N HN 0.153 8.503 8.380 -0.051 0.000 0.551 210 G N 0.068 108.790 108.800 -0.130 0.000 2.602 210 G HA2 -0.404 3.556 3.960 0.000 0.000 0.310 210 G HA3 -0.404 3.556 3.960 0.000 0.000 0.310 210 G C -0.462 174.203 174.900 -0.393 0.000 1.183 210 G CA 0.026 44.989 45.100 -0.228 0.000 0.979 210 G HN -0.234 7.934 8.290 -0.097 0.063 0.545 211 G N 1.755 110.324 108.800 -0.385 0.000 3.129 211 G HA2 -0.345 3.615 3.960 0.000 0.000 0.304 211 G HA3 -0.345 3.615 3.960 0.000 0.000 0.304 211 G C -1.480 173.272 174.900 -0.246 0.000 0.679 211 G CA -0.108 44.842 45.100 -0.250 0.000 0.812 211 G HN -0.132 7.988 8.290 -0.284 0.000 0.409 212 F N 4.278 124.416 119.950 0.313 0.000 2.556 212 F HA 0.914 5.441 4.527 0.000 0.000 0.314 212 F C -1.642 174.462 175.800 0.507 0.000 1.106 212 F CA -2.049 56.175 58.000 0.374 0.000 0.911 212 F CB 3.093 42.292 39.000 0.333 0.000 1.190 212 F HN 0.268 8.681 8.300 0.189 0.000 0.448 213 Y N -3.133 117.406 120.300 0.399 0.000 2.677 213 Y HA 0.553 5.103 4.550 0.000 0.000 0.334 213 Y C -2.532 173.532 175.900 0.274 0.000 1.196 213 Y CA -1.578 56.722 58.100 0.332 0.000 1.059 213 Y CB 1.473 40.050 38.460 0.194 0.000 1.315 213 Y HN -0.090 8.442 8.280 0.420 0.000 0.455 214 I N -0.042 120.617 120.570 0.148 0.000 4.049 214 I HA 0.176 4.346 4.170 0.000 0.000 0.237 214 I C -0.217 175.974 176.117 0.123 0.000 1.076 214 I CA 0.668 61.976 61.300 0.013 0.000 1.610 214 I CB 1.526 39.543 38.000 0.029 0.000 1.544 214 I HN 0.439 8.885 8.210 0.394 0.000 0.458 215 S N 0.084 115.947 115.700 0.272 0.000 2.465 215 S HA 0.396 4.866 4.470 0.000 0.000 0.279 215 S C -1.573 173.251 174.600 0.374 0.000 1.201 215 S CA -1.832 56.542 58.200 0.290 0.000 1.053 215 S CB 0.762 64.089 63.200 0.211 0.000 0.953 215 S HN -0.313 8.174 8.310 0.295 0.000 0.488 216 P HA -0.072 4.348 4.420 0.000 0.000 0.223 216 P C 0.041 177.339 177.300 -0.003 0.000 1.144 216 P CA 1.621 64.763 63.100 0.070 0.000 0.783 216 P CB 0.049 31.720 31.700 -0.048 0.000 0.771 217 R N -4.279 116.255 120.500 0.056 0.000 2.200 217 R HA -0.153 4.187 4.340 0.000 0.000 0.234 217 R C 0.321 176.609 176.300 -0.020 0.000 1.127 217 R CA 1.438 57.551 56.100 0.021 0.000 0.989 217 R CB -0.133 30.203 30.300 0.059 0.000 0.869 217 R HN 0.111 8.377 8.270 0.111 0.071 0.459 218 S N -1.573 114.120 115.700 -0.011 0.000 2.677 218 S HA 0.276 4.746 4.470 0.000 0.000 0.283 218 S C -2.033 172.389 174.600 -0.296 0.000 1.159 218 S CA -0.332 57.764 58.200 -0.173 0.000 1.001 218 S CB 2.616 65.838 63.200 0.036 0.000 1.032 218 S HN -0.398 7.912 8.310 0.076 0.046 0.487 219 T N 3.297 117.510 114.554 -0.568 0.000 2.885 219 T HA 0.779 5.129 4.350 0.000 0.000 0.285 219 T C -0.981 173.291 174.700 -0.714 0.000 1.019 219 T CA -0.980 60.869 62.100 -0.419 0.000 1.010 219 T CB 1.471 70.186 68.868 -0.255 0.000 1.022 219 T HN -0.199 7.689 8.240 -0.586 0.000 0.466 220 F N 1.428 121.466 119.950 0.146 0.000 2.685 220 F HA 0.438 4.965 4.527 0.000 0.000 0.315 220 F C -0.529 175.366 175.800 0.159 0.000 1.126 220 F CA -1.027 57.060 58.000 0.146 0.000 0.950 220 F CB 3.874 42.990 39.000 0.194 0.000 1.360 220 F HN 0.440 8.888 8.300 0.246 0.000 0.469 221 S N -1.613 114.310 115.700 0.371 0.000 2.741 221 S HA 0.050 4.520 4.470 0.000 0.000 0.245 221 S C -0.091 174.759 174.600 0.416 0.000 1.083 221 S CA 0.940 59.300 58.200 0.267 0.000 0.873 221 S CB 1.134 64.407 63.200 0.122 0.000 0.814 221 S HN 0.309 8.843 8.310 0.374 0.000 0.476 222 T N 6.146 120.899 114.554 0.331 0.000 3.416 222 T HA 0.053 4.403 4.350 0.000 0.000 0.247 222 T C 0.465 175.261 174.700 0.160 0.000 0.973 222 T CA 0.123 62.362 62.100 0.232 0.000 1.166 222 T CB -1.735 67.242 68.868 0.181 0.000 1.040 222 T HN -0.080 8.346 8.240 0.310 0.000 0.746 223 L N 5.218 126.555 121.223 0.191 0.000 2.043 223 L HA -0.483 3.857 4.340 0.000 0.000 0.212 223 L C 1.448 178.224 176.870 -0.157 0.000 1.075 223 L CA 4.357 59.206 54.840 0.015 0.000 0.752 223 L CB -0.325 41.760 42.059 0.045 0.000 0.891 223 L HN -0.463 7.908 8.230 0.287 0.031 0.432 224 Q N -2.830 116.995 119.800 0.042 0.000 2.135 224 Q HA -0.430 3.910 4.340 0.000 0.000 0.204 224 Q C 2.340 178.268 176.000 -0.121 0.000 0.981 224 Q CA 3.402 59.233 55.803 0.047 0.000 0.856 224 Q CB -0.710 28.154 28.738 0.210 0.000 0.902 224 Q HN 0.169 8.541 8.270 0.170 0.000 0.425 225 E N -0.299 119.809 120.200 -0.152 0.000 2.150 225 E HA -0.212 4.138 4.350 0.000 0.000 0.193 225 E C 2.177 178.432 176.600 -0.576 0.000 0.985 225 E CA 2.258 58.512 56.400 -0.244 0.000 0.814 225 E CB -1.044 28.584 29.700 -0.120 0.000 0.752 225 E HN -0.405 7.756 8.360 -0.093 0.143 0.466 226 L N -0.163 120.541 121.223 -0.865 0.000 1.990 226 L HA -0.397 3.943 4.340 0.000 0.000 0.213 226 L C 2.121 178.744 176.870 -0.412 0.000 1.072 226 L CA 3.394 57.672 54.840 -0.935 0.000 0.755 226 L CB -0.062 41.673 42.059 -0.540 0.000 0.889 226 L HN -0.325 7.430 8.230 -0.657 0.081 0.432 227 V N -4.060 115.607 119.914 -0.411 0.000 2.358 227 V HA -0.445 3.675 4.120 0.000 0.000 0.246 227 V C 1.749 177.673 176.094 -0.284 0.000 1.047 227 V CA 3.943 65.998 62.300 -0.410 0.000 1.035 227 V CB -1.082 30.381 31.823 -0.600 0.000 0.658 227 V HN -0.270 7.564 8.190 -0.458 0.082 0.452 228 D N -0.309 119.973 120.400 -0.196 0.000 2.264 228 D HA -0.243 4.397 4.640 0.000 0.000 0.208 228 D C 2.084 178.336 176.300 -0.080 0.000 0.966 228 D CA 3.545 57.483 54.000 -0.103 0.000 0.864 228 D CB -0.524 40.246 40.800 -0.051 0.000 0.933 228 D HN 0.025 8.267 8.370 -0.214 0.000 0.499 229 H N 1.931 120.840 119.070 -0.268 0.000 2.293 229 H HA -0.346 4.210 4.556 0.000 0.000 0.300 229 H C 2.113 177.256 175.328 -0.308 0.000 1.082 229 H CA 3.439 59.298 56.048 -0.315 0.000 1.308 229 H CB 0.621 30.095 29.762 -0.480 0.000 1.375 229 H HN -0.089 7.976 8.280 -0.153 0.123 0.495 230 Y N -2.870 117.243 120.300 -0.312 0.000 2.519 230 Y HA -0.067 4.483 4.550 0.000 0.000 0.287 230 Y C 2.036 177.741 175.900 -0.323 0.000 1.128 230 Y CA 1.725 59.580 58.100 -0.408 0.000 1.282 230 Y CB -0.099 38.070 38.460 -0.484 0.000 1.027 230 Y HN -0.476 7.680 8.280 -0.206 0.000 0.551 231 K N -0.019 120.283 120.400 -0.164 0.000 2.283 231 K HA -0.352 3.968 4.320 0.000 0.000 0.202 231 K C 1.524 178.084 176.600 -0.066 0.000 1.048 231 K CA 3.278 59.475 56.287 -0.149 0.000 0.948 231 K CB -0.249 32.175 32.500 -0.126 0.000 0.742 231 K HN 0.116 8.236 8.250 -0.183 0.021 0.458 232 K N -2.499 117.869 120.400 -0.054 0.000 2.021 232 K HA -0.132 4.188 4.320 0.000 0.000 0.205 232 K C 0.130 176.718 176.600 -0.019 0.000 1.047 232 K CA 0.722 56.996 56.287 -0.022 0.000 0.943 232 K CB 0.803 33.301 32.500 -0.003 0.000 0.725 232 K HN -0.850 7.197 8.250 -0.072 0.160 0.439 233 G N -4.423 104.360 108.800 -0.029 0.000 2.673 233 G HA2 0.017 3.977 3.960 0.000 0.000 0.292 233 G HA3 0.017 3.977 3.960 0.000 0.000 0.292 233 G C -2.745 172.150 174.900 -0.008 0.000 1.450 233 G CA -0.419 44.672 45.100 -0.015 0.000 0.837 233 G HN -0.887 7.372 8.290 -0.052 0.000 0.505 234 N N -0.043 118.654 118.700 -0.005 0.000 3.063 234 N HA -0.189 4.551 4.740 0.000 0.000 0.327 234 N C -1.152 174.366 175.510 0.013 0.000 1.225 234 N CA 0.196 53.240 53.050 -0.009 0.000 1.184 234 N CB -1.192 37.286 38.487 -0.016 0.000 1.438 234 N HN 0.259 8.635 8.380 -0.006 0.000 0.555 235 D N 1.058 121.497 120.400 0.066 0.000 2.429 235 D HA -0.153 4.487 4.640 0.000 0.000 0.253 235 D C 0.874 177.230 176.300 0.094 0.000 1.294 235 D CA 0.456 54.505 54.000 0.082 0.000 1.063 235 D CB -0.623 40.198 40.800 0.035 0.000 1.096 235 D HN -0.319 8.066 8.370 0.104 0.047 0.516 236 G N 5.350 114.163 108.800 0.022 0.000 2.347 236 G HA2 -0.400 3.560 3.960 0.000 0.000 0.247 236 G HA3 -0.400 3.560 3.960 0.000 0.000 0.247 236 G C -0.935 173.905 174.900 -0.100 0.000 1.037 236 G CA 0.255 45.350 45.100 -0.009 0.000 0.622 236 G HN 0.273 8.540 8.290 0.018 0.033 0.521 237 L N -0.643 120.433 121.223 -0.245 0.000 2.453 237 L HA -0.041 4.299 4.340 0.000 0.000 0.261 237 L C 1.498 178.296 176.870 -0.119 0.000 1.179 237 L CA -0.589 54.001 54.840 -0.417 0.000 0.813 237 L CB 0.495 42.134 42.059 -0.701 0.000 1.110 237 L HN -0.950 7.063 8.230 -0.193 0.101 0.466 238 C N -2.197 117.118 119.300 0.024 0.000 2.437 238 C HA -0.102 4.358 4.460 0.000 0.000 0.283 238 C C 0.245 175.245 174.990 0.016 0.000 1.424 238 C CA 0.158 59.210 59.018 0.056 0.000 1.782 238 C CB -0.597 27.207 27.740 0.107 0.000 1.833 238 C HN 0.471 8.796 8.230 0.160 0.000 0.532 239 Q N -2.350 117.438 119.800 -0.020 0.000 2.578 239 Q HA 0.110 4.450 4.340 0.000 0.000 0.284 239 Q C -2.120 173.844 176.000 -0.060 0.000 0.960 239 Q CA -0.802 54.989 55.803 -0.019 0.000 0.809 239 Q CB 2.333 31.075 28.738 0.007 0.000 1.462 239 Q HN -0.690 7.491 8.270 -0.062 0.052 0.392 240 K N 1.550 121.925 120.400 -0.042 0.000 2.349 240 K HA -0.014 4.306 4.320 0.000 0.000 0.288 240 K C -0.354 176.198 176.600 -0.080 0.000 1.058 240 K CA -0.306 55.947 56.287 -0.056 0.000 0.953 240 K CB 0.325 32.809 32.500 -0.026 0.000 0.997 240 K HN 0.159 8.398 8.250 -0.019 0.000 0.477 241 L N 7.849 128.966 121.223 -0.177 0.000 2.513 241 L HA -0.129 4.211 4.340 0.000 0.000 0.272 241 L C -0.095 176.708 176.870 -0.112 0.000 1.187 241 L CA 0.866 55.533 54.840 -0.288 0.000 0.895 241 L CB -0.472 41.074 42.059 -0.854 0.000 1.147 241 L HN 0.248 8.261 8.230 -0.187 0.106 0.483 242 S N 3.469 119.238 115.700 0.116 0.000 2.885 242 S HA 0.026 4.496 4.470 0.000 0.000 0.172 242 S C -0.790 174.001 174.600 0.318 0.000 0.703 242 S CA 0.388 58.684 58.200 0.161 0.000 0.820 242 S CB 1.626 64.895 63.200 0.114 0.000 0.766 242 S HN 0.106 8.403 8.310 0.211 0.140 0.605 243 V N 1.519 121.612 119.914 0.299 0.000 2.850 243 V HA 0.484 4.604 4.120 0.000 0.000 0.315 243 V C -2.337 173.831 176.094 0.122 0.000 1.064 243 V CA -3.564 58.883 62.300 0.244 0.000 0.979 243 V CB 1.523 33.424 31.823 0.130 0.000 1.039 243 V HN -0.072 8.269 8.190 0.252 0.000 0.452 244 P HA 0.026 4.446 4.420 0.000 0.000 0.271 244 P C -1.028 176.184 177.300 -0.146 0.000 1.233 244 P CA 0.084 62.974 63.100 -0.351 0.000 0.795 244 P CB 0.684 32.313 31.700 -0.119 0.000 0.936 245 C N -0.384 118.818 119.300 -0.163 0.000 2.652 245 C HA 0.059 4.519 4.460 0.000 0.000 0.412 245 C C 0.065 175.098 174.990 0.071 0.000 1.294 245 C CA -0.749 58.189 59.018 -0.132 0.000 2.127 245 C CB 0.230 27.682 27.740 -0.479 0.000 2.691 245 C HN -0.254 7.834 8.230 -0.238 0.000 0.615 246 M N 6.344 125.969 119.600 0.041 0.000 2.239 246 M HA -0.037 4.443 4.480 0.000 0.000 0.348 246 M C -0.188 176.205 176.300 0.156 0.000 1.239 246 M CA -0.606 54.743 55.300 0.083 0.000 1.114 246 M CB -0.533 32.093 32.600 0.043 0.000 1.641 246 M HN 0.057 8.623 8.290 -0.012 -0.283 0.453 247 S N 2.466 118.266 115.700 0.167 0.000 2.586 247 S HA 0.072 4.542 4.470 0.000 0.000 0.274 247 S C -0.163 174.496 174.600 0.099 0.000 1.281 247 S CA -0.154 58.162 58.200 0.193 0.000 1.035 247 S CB 0.801 64.092 63.200 0.152 0.000 0.962 247 S HN 0.118 8.504 8.310 0.126 0.000 0.512 248 S N 2.722 118.459 115.700 0.062 0.000 2.448 248 S HA 0.061 4.531 4.470 0.000 0.000 0.320 248 S C -0.920 173.593 174.600 -0.145 0.000 1.071 248 S CA -0.526 57.661 58.200 -0.023 0.000 1.113 248 S CB 1.017 64.206 63.200 -0.019 0.000 0.972 248 S HN 0.117 8.489 8.310 0.103 0.000 0.465 249 K N 6.191 126.453 120.400 -0.230 0.000 2.484 249 K HA 0.067 4.387 4.320 0.000 0.000 0.280 249 K C -2.107 174.221 176.600 -0.454 0.000 1.013 249 K CA -0.759 55.198 56.287 -0.551 0.000 1.029 249 K CB 0.229 32.521 32.500 -0.347 0.000 0.902 249 K HN 0.173 8.345 8.250 -0.131 0.000 0.481 250 P HA 0.035 4.455 4.420 0.000 0.000 0.274 250 P C -2.152 175.058 177.300 -0.149 0.000 1.246 250 P CA -0.510 62.371 63.100 -0.364 0.000 0.795 250 P CB 0.719 32.142 31.700 -0.462 0.000 1.006 251 Q N 0.823 120.602 119.800 -0.034 0.000 2.340 251 Q HA -0.051 4.289 4.340 0.000 0.000 0.249 251 Q C -0.562 175.529 176.000 0.152 0.000 0.957 251 Q CA -0.152 55.694 55.803 0.071 0.000 0.882 251 Q CB 1.035 29.824 28.738 0.086 0.000 1.235 251 Q HN 0.045 8.282 8.270 -0.055 0.000 0.439 252 K N 5.311 125.834 120.400 0.205 0.000 2.484 252 K HA 0.042 4.362 4.320 0.000 0.000 0.280 252 K C -1.747 174.951 176.600 0.164 0.000 1.013 252 K CA -1.107 55.314 56.287 0.224 0.000 1.029 252 K CB -0.730 31.919 32.500 0.249 0.000 0.902 252 K HN 0.278 8.640 8.250 0.187 0.000 0.481 253 P HA -0.080 4.340 4.420 0.000 0.000 0.269 253 P C -0.876 176.560 177.300 0.226 0.000 1.209 253 P CA -0.723 62.360 63.100 -0.029 0.000 0.776 253 P CB 0.769 32.172 31.700 -0.495 0.000 0.876 254 W N 2.348 123.654 121.300 0.011 0.000 2.112 254 W HA -0.102 4.558 4.660 0.000 0.000 0.349 254 W C -0.339 176.322 176.519 0.237 0.000 1.289 254 W CA -0.643 56.693 57.345 -0.016 0.000 1.256 254 W CB 1.501 30.864 29.460 -0.160 0.000 1.148 254 W HN 0.222 8.588 8.180 0.310 0.000 0.590 258 D N -1.076 119.349 120.400 0.042 0.000 3.039 258 D HA -0.309 4.331 4.640 0.000 0.000 0.222 258 D C -0.232 176.164 176.300 0.161 0.000 1.179 258 D CA 1.252 55.309 54.000 0.095 0.000 0.880 258 D CB -1.070 39.751 40.800 0.035 0.000 1.115 258 D HN 0.433 8.856 8.370 0.088 0.000 0.416 259 A N -1.021 121.917 122.820 0.196 0.000 3.260 259 A HA 0.288 4.608 4.320 0.000 0.000 0.268 259 A C -0.197 177.704 177.584 0.530 0.000 1.491 259 A CA -1.484 50.710 52.037 0.261 0.000 1.181 259 A CB -1.015 18.014 19.000 0.048 0.000 1.137 259 A HN -0.179 8.020 8.150 0.160 0.047 0.642 260 W N 1.380 122.822 121.300 0.237 0.000 2.488 260 W HA -0.154 4.506 4.660 0.000 0.000 0.304 260 W C -1.701 174.920 176.519 0.171 0.000 1.175 260 W CA 1.595 59.059 57.345 0.199 0.000 1.365 260 W CB 0.925 30.461 29.460 0.126 0.000 1.131 260 W HN -0.502 7.889 8.180 0.473 0.072 0.520 261 E N -0.975 119.189 120.200 -0.060 0.000 2.152 261 E HA 0.228 4.578 4.350 0.000 0.000 0.285 261 E C -0.825 175.764 176.600 -0.018 0.000 1.043 261 E CA 0.069 56.356 56.400 -0.189 0.000 0.839 261 E CB 0.385 30.072 29.700 -0.023 0.000 1.069 261 E HN -0.327 8.155 8.360 0.204 0.000 0.399 262 I N 6.470 127.026 120.570 -0.024 0.000 2.603 262 I HA 0.391 4.561 4.170 0.000 0.000 0.300 262 I C -2.202 173.947 176.117 0.053 0.000 1.017 262 I CA -4.459 56.899 61.300 0.097 0.000 1.098 262 I CB 2.680 40.800 38.000 0.199 0.000 1.279 262 I HN 0.256 8.401 8.210 -0.108 0.000 0.437 263 P HA 0.323 4.743 4.420 0.000 0.000 0.280 263 P C 0.205 177.518 177.300 0.021 0.000 1.244 263 P CA -0.785 62.327 63.100 0.019 0.000 0.784 263 P CB 1.120 32.828 31.700 0.014 0.000 0.913 264 R N 3.642 124.119 120.500 -0.039 0.000 2.120 264 R HA -0.408 3.932 4.340 0.000 0.000 0.234 264 R C 1.897 178.194 176.300 -0.005 0.000 1.123 264 R CA 3.809 59.879 56.100 -0.050 0.000 0.975 264 R CB -0.182 30.015 30.300 -0.171 0.000 0.866 264 R HN 0.737 8.965 8.270 -0.070 0.000 0.446 265 E N -0.526 119.660 120.200 -0.023 0.000 2.331 265 E HA -0.215 4.135 4.350 0.000 0.000 0.199 265 E C 1.066 177.648 176.600 -0.031 0.000 1.008 265 E CA 2.496 58.879 56.400 -0.028 0.000 0.843 265 E CB -0.889 28.789 29.700 -0.037 0.000 0.761 265 E HN 0.315 8.629 8.360 -0.032 0.028 0.507 266 S N -2.095 113.596 115.700 -0.014 0.000 2.607 266 S HA -0.106 4.364 4.470 0.000 0.000 0.224 266 S C -0.413 174.173 174.600 -0.024 0.000 0.969 266 S CA 1.842 59.989 58.200 -0.089 0.000 0.927 266 S CB 0.824 63.954 63.200 -0.116 0.000 0.772 266 S HN -0.250 8.017 8.310 0.024 0.058 0.533 267 L N 1.033 122.292 121.223 0.060 0.000 2.356 267 L HA 0.376 4.716 4.340 0.000 0.000 0.277 267 L C -1.289 175.608 176.870 0.045 0.000 0.996 267 L CA -0.809 54.098 54.840 0.112 0.000 0.822 267 L CB 1.896 44.073 42.059 0.197 0.000 1.256 267 L HN -0.475 7.688 8.230 0.043 0.092 0.413 268 K N 4.161 124.579 120.400 0.030 0.000 2.292 268 K HA 0.196 4.516 4.320 0.000 0.000 0.270 268 K C -1.336 175.276 176.600 0.020 0.000 1.062 268 K CA -1.292 54.997 56.287 0.004 0.000 0.916 268 K CB 0.812 33.307 32.500 -0.009 0.000 1.166 268 K HN 0.278 8.555 8.250 0.045 0.000 0.458 269 L N 5.597 126.798 121.223 -0.037 0.000 2.342 269 L HA -0.018 4.322 4.340 0.000 0.000 0.285 269 L C 0.100 177.057 176.870 0.145 0.000 1.095 269 L CA 0.621 55.443 54.840 -0.031 0.000 0.843 269 L CB -0.970 40.789 42.059 -0.500 0.000 1.201 269 L HN 0.596 8.773 8.230 -0.088 0.000 0.445 270 E N 4.586 124.967 120.200 0.301 0.000 2.290 270 E HA 0.045 4.395 4.350 0.000 0.000 0.197 270 E C -0.777 176.019 176.600 0.328 0.000 0.948 270 E CA 0.920 57.480 56.400 0.266 0.000 0.895 270 E CB 1.352 31.119 29.700 0.111 0.000 0.865 270 E HN 0.310 8.835 8.360 0.276 0.000 0.486 271 K N -0.224 120.337 120.400 0.269 0.000 2.581 271 K HA 0.187 4.507 4.320 0.000 0.000 0.249 271 K C -2.664 173.660 176.600 -0.459 0.000 0.966 271 K CA -1.132 55.111 56.287 -0.073 0.000 0.811 271 K CB 2.426 34.898 32.500 -0.046 0.000 1.223 271 K HN -0.527 7.941 8.250 0.362 0.000 0.438 272 K N 7.402 127.131 120.400 -1.119 0.000 2.378 272 K HA 0.039 4.359 4.320 0.000 0.000 0.288 272 K C -0.200 176.029 176.600 -0.618 0.000 1.057 272 K CA 0.797 56.202 56.287 -1.470 0.000 0.971 272 K CB -0.337 31.292 32.500 -1.452 0.000 0.975 272 K HN 0.522 8.184 8.250 -0.981 0.000 0.475 273 L N 5.882 126.847 121.223 -0.429 0.000 2.307 273 L HA 0.158 4.498 4.340 0.000 0.000 0.211 273 L C 0.523 177.294 176.870 -0.165 0.000 1.099 273 L CA 0.508 55.234 54.840 -0.191 0.000 0.816 273 L CB 0.677 42.698 42.059 -0.063 0.000 0.952 273 L HN 0.585 8.522 8.230 -0.489 0.000 0.455 274 G N -4.676 104.011 108.800 -0.189 0.000 2.667 274 G HA2 0.046 4.006 3.960 0.000 0.000 0.294 274 G HA3 0.046 4.006 3.960 0.000 0.000 0.294 274 G C -2.938 171.906 174.900 -0.094 0.000 1.467 274 G CA 0.563 45.593 45.100 -0.116 0.000 0.852 274 G HN -0.679 7.456 8.290 -0.258 0.000 0.521 275 A N -0.036 122.754 122.820 -0.050 0.000 3.218 275 A HA 0.449 4.769 4.320 0.000 0.000 0.321 275 A C 0.533 178.130 177.584 0.021 0.000 1.012 275 A CA -0.701 51.332 52.037 -0.006 0.000 0.948 275 A CB -0.379 18.620 19.000 -0.002 0.000 1.050 275 A HN 0.421 8.543 8.150 -0.046 0.000 0.492 276 G N -0.097 108.719 108.800 0.026 0.000 3.263 276 G HA2 -0.185 3.775 3.960 0.000 0.000 0.246 276 G HA3 -0.185 3.775 3.960 0.000 0.000 0.246 276 G C 0.025 175.003 174.900 0.131 0.000 0.982 276 G CA -0.054 45.075 45.100 0.048 0.000 1.897 276 G HN 0.501 8.800 8.290 0.015 0.000 0.624 277 Q N 1.176 121.057 119.800 0.135 0.000 2.454 277 Q HA -0.492 3.848 4.340 0.000 0.000 0.167 277 Q C 0.146 176.248 176.000 0.171 0.000 2.377 277 Q CA 2.218 58.126 55.803 0.175 0.000 0.877 277 Q CB -1.856 27.060 28.738 0.297 0.000 0.837 277 Q HN 0.079 8.329 8.270 0.084 0.071 0.783 278 F N -2.133 117.810 119.950 -0.011 0.000 2.682 278 F HA 0.234 4.761 4.527 0.000 0.000 0.308 278 F C -0.880 174.909 175.800 -0.019 0.000 1.093 278 F CA -1.194 56.798 58.000 -0.015 0.000 1.244 278 F CB 1.197 40.181 39.000 -0.027 0.000 1.052 278 F HN -0.054 8.454 8.300 0.484 0.083 0.573 279 G N -2.912 105.978 108.800 0.151 0.000 2.321 279 G HA2 0.051 4.011 3.960 0.000 0.000 0.296 279 G HA3 0.051 4.011 3.960 0.000 0.000 0.296 279 G C -2.747 172.200 174.900 0.079 0.000 1.287 279 G CA 0.417 45.570 45.100 0.088 0.000 0.846 279 G HN -0.526 7.857 8.290 0.154 0.000 0.508 280 E N -3.019 117.229 120.200 0.081 0.000 2.433 280 E HA 0.694 5.044 4.350 0.000 0.000 0.273 280 E C -1.715 174.943 176.600 0.097 0.000 0.950 280 E CA -1.939 54.520 56.400 0.098 0.000 0.796 280 E CB 4.825 34.660 29.700 0.226 0.000 1.330 280 E HN -0.332 8.067 8.360 0.065 0.000 0.455 281 V N -0.459 119.480 119.914 0.041 0.000 2.531 281 V HA 0.645 4.765 4.120 0.000 0.000 0.301 281 V C -1.737 174.366 176.094 0.015 0.000 1.034 281 V CA -0.830 61.502 62.300 0.054 0.000 0.865 281 V CB 2.372 34.193 31.823 -0.002 0.000 0.995 281 V HN 0.410 8.571 8.190 -0.047 0.000 0.424 282 W N 6.098 127.362 121.300 -0.060 0.000 2.666 282 W HA 0.636 5.296 4.660 0.000 0.000 0.334 282 W C -1.493 175.027 176.519 0.003 0.000 1.051 282 W CA -1.775 55.547 57.345 -0.039 0.000 1.224 282 W CB 3.633 33.043 29.460 -0.083 0.000 1.405 282 W HN 0.913 9.142 8.180 0.265 0.110 0.513 283 M N 3.938 123.655 119.600 0.196 0.000 2.200 283 M HA 0.444 4.924 4.480 0.000 0.000 0.355 283 M C -2.036 174.336 176.300 0.121 0.000 1.283 283 M CA -0.899 54.465 55.300 0.105 0.000 1.124 283 M CB 0.619 33.219 32.600 -0.001 0.000 1.625 283 M HN 0.696 9.042 8.290 0.093 0.000 0.463 284 A N 5.426 128.284 122.820 0.063 0.000 2.552 284 A HA 0.754 5.074 4.320 0.000 0.000 0.288 284 A C -2.336 175.287 177.584 0.065 0.000 1.193 284 A CA -0.637 51.454 52.037 0.090 0.000 0.713 284 A CB 3.958 23.034 19.000 0.126 0.000 1.305 284 A HN 0.561 8.719 8.150 0.013 0.000 0.424 285 T N 0.544 115.153 114.554 0.092 0.000 2.928 285 T HA 0.600 4.950 4.350 0.000 0.000 0.296 285 T C -2.252 172.550 174.700 0.170 0.000 1.000 285 T CA 0.237 62.397 62.100 0.101 0.000 0.989 285 T CB 2.503 71.380 68.868 0.014 0.000 1.005 285 T HN -0.052 8.241 8.240 0.087 0.000 0.442 286 Y N 6.792 127.157 120.300 0.107 0.000 2.341 286 Y HA 0.107 4.657 4.550 0.000 0.000 0.340 286 Y C -1.079 174.841 175.900 0.034 0.000 0.997 286 Y CA -0.936 57.234 58.100 0.118 0.000 1.149 286 Y CB 1.614 40.223 38.460 0.248 0.000 1.171 286 Y HN 0.560 9.057 8.280 0.362 0.000 0.494 287 N N 8.522 126.925 118.700 -0.495 0.000 2.699 287 N HA -0.508 4.232 4.740 0.000 0.000 0.256 287 N C -0.775 174.584 175.510 -0.251 0.000 0.993 287 N CA 1.459 54.239 53.050 -0.451 0.000 0.759 287 N CB -1.819 36.275 38.487 -0.654 0.000 0.906 287 N HN 0.761 8.842 8.380 -0.499 0.000 0.541 288 K N -7.078 113.171 120.400 -0.251 0.000 3.564 288 K HA -0.417 3.903 4.320 0.000 0.000 0.278 288 K C -0.131 176.156 176.600 -0.523 0.000 1.048 288 K CA 2.763 58.808 56.287 -0.405 0.000 1.109 288 K CB -1.285 30.853 32.500 -0.603 0.000 1.405 288 K HN 0.659 8.779 8.250 -0.197 0.012 0.452 289 H N -4.844 114.205 119.070 -0.035 0.000 3.233 289 H HA 0.231 4.787 4.556 0.000 0.000 0.263 289 H C -1.379 173.969 175.328 0.033 0.000 1.168 289 H CA -0.273 55.757 56.048 -0.031 0.000 1.159 289 H CB 2.203 31.904 29.762 -0.102 0.000 1.593 289 H HN -0.623 7.569 8.280 -0.026 0.072 0.580 290 T N 2.654 117.334 114.554 0.210 0.000 2.792 290 T HA 0.301 4.651 4.350 0.000 0.000 0.280 290 T C -1.634 173.207 174.700 0.235 0.000 0.990 290 T CA -0.528 61.732 62.100 0.267 0.000 0.960 290 T CB 0.967 70.076 68.868 0.401 0.000 0.939 290 T HN -0.503 7.851 8.240 0.190 0.000 0.439 291 K N 6.933 127.437 120.400 0.174 0.000 2.227 291 K HA 0.607 4.927 4.320 0.000 0.000 0.280 291 K C -1.374 175.333 176.600 0.178 0.000 1.041 291 K CA -0.718 55.620 56.287 0.085 0.000 0.905 291 K CB 1.112 33.589 32.500 -0.039 0.000 1.068 291 K HN 0.283 8.642 8.250 0.182 0.000 0.470 292 V N -0.479 119.534 119.914 0.165 0.000 3.156 292 V HA 0.893 5.013 4.120 0.000 0.000 0.310 292 V C -2.151 174.076 176.094 0.221 0.000 1.234 292 V CA -3.235 59.212 62.300 0.245 0.000 1.065 292 V CB 4.317 36.305 31.823 0.275 0.000 1.088 292 V HN -0.008 8.231 8.190 0.081 0.000 0.451 293 A N -1.868 121.089 122.820 0.228 0.000 2.350 293 A HA 0.905 5.225 4.320 0.000 0.000 0.324 293 A C -2.185 175.464 177.584 0.107 0.000 1.118 293 A CA -1.895 50.271 52.037 0.214 0.000 0.783 293 A CB 2.493 21.619 19.000 0.211 0.000 1.236 293 A HN 0.084 8.340 8.150 0.177 0.000 0.457 294 V N 1.796 121.762 119.914 0.086 0.000 2.483 294 V HA 0.417 4.537 4.120 0.000 0.000 0.297 294 V C -1.520 174.543 176.094 -0.051 0.000 1.027 294 V CA -1.179 61.114 62.300 -0.011 0.000 0.855 294 V CB 2.321 34.090 31.823 -0.090 0.000 0.995 294 V HN 0.960 9.124 8.190 0.135 0.107 0.424 295 K N 7.613 127.965 120.400 -0.079 0.000 2.227 295 K HA 0.543 4.863 4.320 0.000 0.000 0.280 295 K C -0.914 175.584 176.600 -0.171 0.000 1.041 295 K CA -1.026 55.215 56.287 -0.076 0.000 0.905 295 K CB 2.573 35.034 32.500 -0.065 0.000 1.068 295 K HN 0.446 8.656 8.250 -0.066 0.000 0.470 296 T N 4.414 118.862 114.554 -0.177 0.000 2.743 296 T HA 0.548 4.898 4.350 0.000 0.000 0.292 296 T C -0.151 174.537 174.700 -0.019 0.000 0.972 296 T CA -2.114 59.850 62.100 -0.226 0.000 0.967 296 T CB 0.482 69.148 68.868 -0.336 0.000 0.926 296 T HN 0.758 8.852 8.240 -0.065 0.106 0.459 297 M N 5.858 125.469 119.600 0.018 0.000 2.084 297 M HA 0.215 4.695 4.480 0.000 0.000 0.351 297 M C -0.100 176.213 176.300 0.022 0.000 1.240 297 M CA -2.526 52.771 55.300 -0.004 0.000 1.083 297 M CB -0.395 32.145 32.600 -0.101 0.000 1.593 297 M HN 0.849 9.185 8.290 0.077 0.000 0.463 298 K N 5.249 125.667 120.400 0.030 0.000 2.524 298 K HA -0.158 4.162 4.320 0.000 0.000 0.279 298 K C -0.587 176.009 176.600 -0.006 0.000 0.993 298 K CA 0.475 56.768 56.287 0.010 0.000 1.030 298 K CB -0.873 31.616 32.500 -0.019 0.000 0.891 298 K HN 0.014 8.293 8.250 0.047 0.000 0.488 299 P HA -0.174 4.246 4.420 0.000 0.000 0.218 299 P C 0.708 177.999 177.300 -0.014 0.000 1.148 299 P CA 2.247 65.338 63.100 -0.015 0.000 0.822 299 P CB 0.071 31.762 31.700 -0.016 0.000 0.784 300 G N -3.141 105.645 108.800 -0.023 0.000 2.459 300 G HA2 -0.189 3.771 3.960 0.000 0.000 0.217 300 G HA3 -0.189 3.771 3.960 0.000 0.000 0.217 300 G C 0.624 175.529 174.900 0.009 0.000 1.183 300 G CA 1.046 46.134 45.100 -0.020 0.000 0.776 300 G HN -0.221 8.033 8.290 -0.034 0.015 0.552 301 S N 1.113 116.826 115.700 0.022 0.000 2.490 301 S HA -0.401 4.069 4.470 0.000 0.000 0.291 301 S C -0.708 173.956 174.600 0.107 0.000 1.182 301 S CA 2.599 60.861 58.200 0.104 0.000 1.215 301 S CB 0.298 63.561 63.200 0.106 0.000 1.176 301 S HN -0.289 8.019 8.310 -0.003 0.000 0.440 302 M N -5.777 113.859 119.600 0.060 0.000 2.520 302 M HA 0.259 4.739 4.480 0.000 0.000 0.280 302 M C -1.724 174.623 176.300 0.078 0.000 1.232 302 M CA -0.861 54.487 55.300 0.079 0.000 0.892 302 M CB 3.745 36.398 32.600 0.088 0.000 1.728 302 M HN -0.775 7.534 8.290 0.032 0.000 0.475 303 S N 1.750 117.509 115.700 0.099 0.000 2.443 303 S HA 0.125 4.595 4.470 0.000 0.000 0.284 303 S C 1.144 175.819 174.600 0.125 0.000 1.206 303 S CA -0.225 58.030 58.200 0.091 0.000 1.074 303 S CB -0.407 62.843 63.200 0.084 0.000 0.963 303 S HN 0.447 8.822 8.310 0.108 0.000 0.501 304 V N 6.857 126.835 119.914 0.107 0.000 2.233 304 V HA -0.544 3.576 4.120 0.000 0.000 0.252 304 V C 1.613 177.813 176.094 0.177 0.000 1.063 304 V CA 4.163 66.549 62.300 0.142 0.000 1.032 304 V CB -1.273 30.603 31.823 0.087 0.000 0.645 304 V HN 0.548 8.782 8.190 0.074 0.000 0.446 305 E N -0.258 120.012 120.200 0.117 0.000 2.147 305 E HA -0.352 3.998 4.350 0.000 0.000 0.199 305 E C 2.236 178.893 176.600 0.095 0.000 1.005 305 E CA 3.245 59.703 56.400 0.096 0.000 0.810 305 E CB -1.381 28.360 29.700 0.069 0.000 0.736 305 E HN 0.557 8.973 8.360 0.093 0.000 0.460 306 A N -1.132 121.754 122.820 0.111 0.000 1.970 306 A HA -0.159 4.162 4.320 0.000 0.000 0.216 306 A C 2.051 179.703 177.584 0.113 0.000 1.170 306 A CA 2.345 54.441 52.037 0.099 0.000 0.645 306 A CB -0.705 18.357 19.000 0.103 0.000 0.816 306 A HN -0.312 7.776 8.150 0.121 0.135 0.447 307 F N 0.870 120.852 119.950 0.053 0.000 2.060 307 F HA -0.296 4.231 4.527 0.000 0.000 0.295 307 F C 1.095 176.944 175.800 0.082 0.000 1.120 307 F CA 2.578 60.612 58.000 0.057 0.000 1.205 307 F CB 0.270 39.297 39.000 0.043 0.000 0.986 307 F HN -0.167 8.204 8.300 0.289 0.102 0.470 308 L N -1.790 119.366 121.223 -0.111 0.000 2.051 308 L HA -0.587 3.753 4.340 0.000 0.000 0.214 308 L C 2.027 178.823 176.870 -0.123 0.000 1.076 308 L CA 3.158 57.911 54.840 -0.145 0.000 0.758 308 L CB -0.608 41.492 42.059 0.069 0.000 0.890 308 L HN 0.123 8.468 8.230 0.192 0.000 0.433 309 A N -1.768 121.017 122.820 -0.059 0.000 1.851 309 A HA -0.410 3.910 4.320 0.000 0.000 0.216 309 A C 1.954 179.500 177.584 -0.064 0.000 1.195 309 A CA 3.288 55.306 52.037 -0.031 0.000 0.622 309 A CB -1.067 17.938 19.000 0.008 0.000 0.831 309 A HN -0.306 7.836 8.150 -0.013 0.000 0.444 310 E N -1.239 118.911 120.200 -0.084 0.000 2.153 310 E HA -0.299 4.051 4.350 0.000 0.000 0.194 310 E C 2.159 178.705 176.600 -0.090 0.000 0.988 310 E CA 2.428 58.811 56.400 -0.028 0.000 0.811 310 E CB -0.231 29.483 29.700 0.023 0.000 0.746 310 E HN -0.407 7.902 8.360 -0.085 0.000 0.466 311 A N -1.525 121.121 122.820 -0.290 0.000 2.016 311 A HA -0.179 4.141 4.320 0.000 0.000 0.217 311 A C 2.108 179.657 177.584 -0.059 0.000 1.162 311 A CA 2.939 54.845 52.037 -0.219 0.000 0.662 311 A CB -0.624 18.077 19.000 -0.499 0.000 0.812 311 A HN 0.375 8.225 8.150 -0.465 0.020 0.450 312 N N -1.584 117.076 118.700 -0.067 0.000 2.396 312 N HA -0.177 4.563 4.740 0.000 0.000 0.180 312 N C 2.014 177.435 175.510 -0.149 0.000 1.028 312 N CA 3.496 56.469 53.050 -0.127 0.000 0.893 312 N CB 0.278 38.721 38.487 -0.072 0.000 0.967 312 N HN -0.271 7.971 8.380 -0.078 0.091 0.440 313 V N 1.199 121.049 119.914 -0.107 0.000 2.302 313 V HA -0.379 3.741 4.120 0.000 0.000 0.243 313 V C 1.820 177.795 176.094 -0.197 0.000 1.036 313 V CA 4.449 66.669 62.300 -0.133 0.000 1.020 313 V CB -0.440 31.341 31.823 -0.070 0.000 0.657 313 V HN -0.415 7.715 8.190 -0.077 0.013 0.453 314 M N -0.512 119.004 119.600 -0.141 0.000 2.108 314 M HA -0.504 3.976 4.480 0.000 0.000 0.257 314 M C 2.231 178.529 176.300 -0.004 0.000 1.071 314 M CA 4.279 59.549 55.300 -0.049 0.000 1.093 314 M CB -0.188 32.455 32.600 0.072 0.000 1.345 314 M HN 0.252 8.324 8.290 -0.087 0.166 0.403 315 K N -3.798 116.559 120.400 -0.072 0.000 2.360 315 K HA -0.211 4.109 4.320 0.000 0.000 0.201 315 K C 1.259 177.799 176.600 -0.099 0.000 1.046 315 K CA 2.218 58.443 56.287 -0.103 0.000 0.945 315 K CB -0.601 31.703 32.500 -0.327 0.000 0.750 315 K HN -0.113 8.073 8.250 -0.107 0.000 0.464 316 T N 0.062 114.546 114.554 -0.116 0.000 2.995 316 T HA 0.014 4.364 4.350 0.000 0.000 0.269 316 T C 0.520 175.218 174.700 -0.003 0.000 1.091 316 T CA 2.352 64.403 62.100 -0.082 0.000 1.128 316 T CB 0.177 68.976 68.868 -0.114 0.000 0.891 316 T HN -0.188 7.800 8.240 -0.145 0.165 0.492 317 L N 2.386 123.611 121.223 0.002 0.000 2.376 317 L HA 0.101 4.441 4.340 0.000 0.000 0.250 317 L C -0.911 176.015 176.870 0.095 0.000 1.335 317 L CA -1.383 53.554 54.840 0.160 0.000 1.214 317 L CB -2.798 39.249 42.059 -0.020 0.000 1.395 317 L HN -0.709 7.447 8.230 -0.045 0.047 0.424 318 Q N 2.567 122.414 119.800 0.079 0.000 2.344 318 Q HA 0.022 4.362 4.340 0.000 0.000 0.253 318 Q C -1.083 174.754 176.000 -0.271 0.000 1.050 318 Q CA -0.506 55.264 55.803 -0.054 0.000 0.912 318 Q CB -0.184 28.543 28.738 -0.018 0.000 1.258 318 Q HN -0.237 8.099 8.270 0.181 0.043 0.443 319 H N 5.800 124.589 119.070 -0.468 0.000 3.029 319 H HA 0.136 4.692 4.556 0.000 0.000 0.358 319 H C -0.800 174.313 175.328 -0.359 0.000 1.129 319 H CA -0.211 55.434 56.048 -0.671 0.000 1.230 319 H CB 3.949 32.944 29.762 -1.279 0.000 1.827 319 H HN -0.192 7.967 8.280 -0.201 0.000 0.530 320 D N 5.069 125.054 120.400 -0.692 0.000 2.228 320 D HA -0.307 4.333 4.640 0.000 0.000 0.203 320 D C 0.260 176.423 176.300 -0.229 0.000 0.988 320 D CA 2.572 56.335 54.000 -0.395 0.000 0.864 320 D CB 0.213 40.784 40.800 -0.381 0.000 0.928 320 D HN 0.409 8.241 8.370 -0.897 0.000 0.469 321 K N -3.675 116.672 120.400 -0.089 0.000 2.570 321 K HA 0.200 4.520 4.320 0.000 0.000 0.210 321 K C -1.155 175.468 176.600 0.038 0.000 1.048 321 K CA -1.895 54.417 56.287 0.040 0.000 1.167 321 K CB -0.880 31.684 32.500 0.107 0.000 0.892 321 K HN -0.517 7.660 8.250 -0.089 0.019 0.480 322 L N -2.119 119.112 121.223 0.015 0.000 2.409 322 L HA 0.561 4.901 4.340 0.000 0.000 0.262 322 L C -0.620 176.318 176.870 0.113 0.000 0.992 322 L CA -1.101 53.782 54.840 0.071 0.000 0.817 322 L CB 3.569 45.595 42.059 -0.055 0.000 1.350 322 L HN -0.514 7.634 8.230 -0.028 0.065 0.411 323 V N 2.248 122.290 119.914 0.213 0.000 2.585 323 V HA -0.192 3.928 4.120 0.000 0.000 0.296 323 V C 0.003 176.115 176.094 0.030 0.000 1.035 323 V CA 0.784 63.121 62.300 0.062 0.000 1.084 323 V CB -0.382 31.442 31.823 0.002 0.000 0.953 323 V HN 0.422 8.845 8.190 0.389 0.000 0.483 324 K N 6.702 127.036 120.400 -0.110 0.000 2.379 324 K HA -0.012 4.308 4.320 0.000 0.000 0.284 324 K C -1.124 175.268 176.600 -0.347 0.000 1.044 324 K CA -1.551 54.626 56.287 -0.184 0.000 0.974 324 K CB 0.002 32.364 32.500 -0.230 0.000 0.962 324 K HN -0.162 8.308 8.250 -0.123 -0.294 0.474 325 L N 5.787 126.906 121.223 -0.173 0.000 2.276 325 L HA 0.202 4.542 4.340 0.000 0.000 0.286 325 L C -0.703 176.081 176.870 -0.142 0.000 1.061 325 L CA -0.556 54.194 54.840 -0.149 0.000 0.807 325 L CB 0.969 43.036 42.059 0.013 0.000 1.177 325 L HN 0.128 8.329 8.230 -0.048 0.000 0.429 326 H N 6.782 125.715 119.070 -0.229 0.000 2.422 326 H HA 0.163 4.719 4.556 0.000 0.000 0.303 326 H C -0.987 174.082 175.328 -0.432 0.000 1.033 326 H CA 0.807 56.487 56.048 -0.613 0.000 1.335 326 H CB 1.976 30.872 29.762 -1.444 0.000 1.458 326 H HN 0.810 8.933 8.280 -0.261 0.000 0.556 327 A N -4.881 117.820 122.820 -0.199 0.000 2.586 327 A HA 0.465 4.785 4.320 0.000 0.000 0.290 327 A C -2.749 174.606 177.584 -0.382 0.000 1.086 327 A CA -0.468 51.415 52.037 -0.256 0.000 0.665 327 A CB 3.245 22.233 19.000 -0.019 0.000 1.279 327 A HN -0.584 7.449 8.150 -0.193 0.000 0.423 328 V N -6.832 112.731 119.914 -0.585 0.000 3.040 328 V HA 0.827 4.947 4.120 0.000 0.000 0.312 328 V C -1.770 174.219 176.094 -0.174 0.000 1.115 328 V CA -2.698 59.423 62.300 -0.298 0.000 0.998 328 V CB 3.666 35.324 31.823 -0.276 0.000 1.042 328 V HN 0.319 8.042 8.190 -0.779 0.000 0.433 329 V N 2.445 122.329 119.914 -0.050 0.000 2.347 329 V HA 0.428 4.548 4.120 0.000 0.000 0.280 329 V C 0.931 176.977 176.094 -0.080 0.000 1.021 329 V CA -0.711 61.543 62.300 -0.077 0.000 0.847 329 V CB 0.739 32.490 31.823 -0.121 0.000 0.990 329 V HN 0.485 8.572 8.190 0.009 0.108 0.444 330 T N 6.511 121.022 114.554 -0.072 0.000 2.962 330 T HA -0.144 4.206 4.350 0.000 0.000 0.270 330 T C -0.234 174.448 174.700 -0.029 0.000 1.088 330 T CA 2.154 64.241 62.100 -0.022 0.000 1.127 330 T CB -0.024 68.833 68.868 -0.019 0.000 0.883 330 T HN 0.405 8.594 8.240 -0.085 0.000 0.493 331 K N 0.175 120.528 120.400 -0.078 0.000 2.143 331 K HA 0.171 4.491 4.320 0.000 0.000 0.272 331 K C -0.425 176.107 176.600 -0.113 0.000 1.001 331 K CA -2.548 53.690 56.287 -0.082 0.000 0.915 331 K CB 0.211 32.655 32.500 -0.094 0.000 1.047 331 K HN -0.223 7.893 8.250 -0.112 0.066 0.458 332 E N 2.902 123.054 120.200 -0.081 0.000 2.414 332 E HA 0.017 4.367 4.350 0.000 0.000 0.263 332 E C -0.734 175.798 176.600 -0.114 0.000 1.000 332 E CA -0.918 55.432 56.400 -0.083 0.000 0.914 332 E CB -0.133 29.538 29.700 -0.048 0.000 0.948 332 E HN 0.263 8.589 8.360 -0.056 0.000 0.444 333 P HA 0.075 4.495 4.420 0.000 0.000 0.271 333 P C -1.229 176.024 177.300 -0.079 0.000 1.216 333 P CA -0.497 62.568 63.100 -0.058 0.000 0.776 333 P CB 0.665 32.389 31.700 0.040 0.000 0.881 334 I N 1.207 121.741 120.570 -0.061 0.000 2.648 334 I HA -0.090 4.080 4.170 0.000 0.000 0.284 334 I C -0.620 175.575 176.117 0.129 0.000 1.153 334 I CA -0.027 61.210 61.300 -0.105 0.000 1.426 334 I CB -0.662 37.118 38.000 -0.366 0.000 1.381 334 I HN 0.143 8.312 8.210 -0.068 0.000 0.571 335 Y N 5.198 125.404 120.300 -0.156 0.000 2.429 335 Y HA 0.631 5.181 4.550 0.000 0.000 0.342 335 Y C -0.870 174.969 175.900 -0.103 0.000 1.004 335 Y CA -2.829 55.203 58.100 -0.112 0.000 1.075 335 Y CB 2.960 41.378 38.460 -0.071 0.000 1.214 335 Y HN -0.371 7.947 8.280 0.063 0.000 0.455 336 I N 3.250 123.840 120.570 0.033 0.000 2.411 336 I HA 0.342 4.512 4.170 0.000 0.000 0.284 336 I C -1.440 174.670 176.117 -0.011 0.000 1.012 336 I CA -0.745 60.566 61.300 0.019 0.000 1.119 336 I CB 2.195 40.204 38.000 0.015 0.000 1.261 336 I HN 0.565 8.762 8.210 -0.022 0.000 0.448 337 I N 9.675 130.226 120.570 -0.031 0.000 2.312 337 I HA 0.477 4.647 4.170 0.000 0.000 0.290 337 I C -1.210 174.826 176.117 -0.134 0.000 1.008 337 I CA -1.095 60.174 61.300 -0.052 0.000 1.226 337 I CB 0.295 38.261 38.000 -0.057 0.000 1.371 337 I HN 0.832 9.014 8.210 -0.048 0.000 0.468 338 T N 4.267 118.751 114.554 -0.117 0.000 2.910 338 T HA 0.814 5.164 4.350 0.000 0.000 0.287 338 T C -0.581 174.022 174.700 -0.163 0.000 1.050 338 T CA -2.931 59.032 62.100 -0.229 0.000 1.011 338 T CB 2.809 71.578 68.868 -0.166 0.000 1.195 338 T HN 0.632 8.846 8.240 -0.045 0.000 0.540 339 E N 0.064 120.096 120.200 -0.279 0.000 2.404 339 E HA 0.046 4.396 4.350 0.000 0.000 0.261 339 E C -0.890 175.784 176.600 0.124 0.000 1.074 339 E CA -0.149 56.245 56.400 -0.011 0.000 0.917 339 E CB 0.600 30.267 29.700 -0.055 0.000 0.965 339 E HN -0.209 7.904 8.360 -0.410 0.000 0.433 340 F N 3.370 123.351 119.950 0.052 0.000 2.427 340 F HA 0.031 4.558 4.527 0.000 0.000 0.352 340 F C -0.829 174.976 175.800 0.009 0.000 1.100 340 F CA 0.330 58.349 58.000 0.031 0.000 1.191 340 F CB 0.907 39.943 39.000 0.060 0.000 1.128 340 F HN -0.150 8.376 8.300 0.377 0.000 0.533 341 M N 7.152 126.356 119.600 -0.659 0.000 2.036 341 M HA 0.203 4.683 4.480 0.000 0.000 0.337 341 M C -0.087 175.715 176.300 -0.830 0.000 1.012 341 M CA -2.292 52.683 55.300 -0.541 0.000 0.962 341 M CB -0.916 31.473 32.600 -0.351 0.000 1.423 341 M HN 0.296 8.104 8.290 -0.803 0.000 0.405 342 A N 7.503 129.987 122.820 -0.560 0.000 1.908 342 A HA -0.227 4.093 4.320 0.000 0.000 0.218 342 A C 1.042 178.495 177.584 -0.218 0.000 1.181 342 A CA 2.771 54.592 52.037 -0.360 0.000 0.627 342 A CB -0.140 18.843 19.000 -0.030 0.000 0.818 342 A HN 0.645 8.602 8.150 -0.323 0.000 0.445 343 K N -4.161 116.132 120.400 -0.178 0.000 2.458 343 K HA 0.027 4.347 4.320 0.000 0.000 0.194 343 K C 0.348 176.900 176.600 -0.079 0.000 1.024 343 K CA -0.772 55.472 56.287 -0.070 0.000 1.108 343 K CB -0.112 32.341 32.500 -0.078 0.000 0.846 343 K HN -0.355 7.759 8.250 -0.227 0.000 0.518 344 G N -0.441 108.248 108.800 -0.184 0.000 2.512 344 G HA2 -0.379 3.581 3.960 0.000 0.000 0.240 344 G HA3 -0.379 3.581 3.960 0.000 0.000 0.240 344 G C -1.366 173.453 174.900 -0.135 0.000 1.246 344 G CA -0.406 44.606 45.100 -0.146 0.000 0.919 344 G HN -0.332 7.726 8.290 -0.290 0.058 0.577 345 S N -0.029 115.622 115.700 -0.081 0.000 2.669 345 S HA 0.530 5.000 4.470 0.000 0.000 0.270 345 S C 1.058 175.622 174.600 -0.060 0.000 1.225 345 S CA -1.222 56.926 58.200 -0.087 0.000 0.991 345 S CB 2.207 65.367 63.200 -0.068 0.000 0.987 345 S HN -0.447 8.008 8.310 -0.046 -0.172 0.552 346 L N 1.217 122.385 121.223 -0.091 0.000 2.109 346 L HA -0.091 4.249 4.340 0.000 0.000 0.207 346 L C 1.135 178.030 176.870 0.042 0.000 1.086 346 L CA 2.779 57.574 54.840 -0.075 0.000 0.760 346 L CB -0.216 41.753 42.059 -0.150 0.000 0.910 346 L HN 0.609 8.774 8.230 -0.108 0.000 0.437 347 L N -0.620 120.617 121.223 0.023 0.000 1.989 347 L HA -0.495 3.845 4.340 0.000 0.000 0.211 347 L C 1.328 178.243 176.870 0.075 0.000 1.071 347 L CA 3.935 58.809 54.840 0.057 0.000 0.749 347 L CB -0.567 41.514 42.059 0.037 0.000 0.890 347 L HN -0.438 7.783 8.230 -0.015 0.000 0.431 348 D N -1.629 118.806 120.400 0.058 0.000 2.123 348 D HA -0.373 4.267 4.640 0.000 0.000 0.196 348 D C 1.889 178.250 176.300 0.101 0.000 0.992 348 D CA 2.855 56.891 54.000 0.059 0.000 0.833 348 D CB -0.159 40.665 40.800 0.039 0.000 0.954 348 D HN -0.374 8.016 8.370 0.033 0.000 0.455 349 F N -0.348 119.582 119.950 -0.033 0.000 2.102 349 F HA -0.268 4.259 4.527 0.000 0.000 0.298 349 F C 1.204 177.025 175.800 0.035 0.000 1.105 349 F CA 2.689 60.678 58.000 -0.020 0.000 1.239 349 F CB 0.952 39.909 39.000 -0.072 0.000 0.991 349 F HN -0.362 8.068 8.300 0.216 0.000 0.474 350 L N -1.405 119.912 121.223 0.157 0.000 2.083 350 L HA -0.498 3.842 4.340 0.000 0.000 0.209 350 L C 1.735 178.646 176.870 0.068 0.000 1.083 350 L CA 3.024 57.941 54.840 0.128 0.000 0.752 350 L CB -0.283 41.898 42.059 0.203 0.000 0.899 350 L HN 0.273 8.638 8.230 0.226 0.000 0.433 351 K N -3.346 117.080 120.400 0.044 0.000 2.525 351 K HA -0.201 4.119 4.320 0.000 0.000 0.192 351 K C -0.012 176.557 176.600 -0.051 0.000 1.029 351 K CA 1.160 57.456 56.287 0.015 0.000 1.029 351 K CB 0.010 32.528 32.500 0.030 0.000 0.814 351 K HN -0.547 7.726 8.250 0.060 0.013 0.503 352 S N 0.578 116.203 115.700 -0.125 0.000 2.552 352 S HA 0.058 4.528 4.470 0.000 0.000 0.271 352 S C 0.424 174.924 174.600 -0.167 0.000 1.168 352 S CA 0.067 58.178 58.200 -0.147 0.000 1.026 352 S CB 2.059 65.146 63.200 -0.188 0.000 1.120 352 S HN -0.295 7.712 8.310 -0.176 0.197 0.514 353 D N 0.259 120.573 120.400 -0.144 0.000 2.085 353 D HA -0.173 4.467 4.640 0.000 0.000 0.199 353 D C 1.895 178.104 176.300 -0.152 0.000 0.981 353 D CA 3.536 57.466 54.000 -0.117 0.000 0.834 353 D CB 0.255 41.013 40.800 -0.070 0.000 0.992 353 D HN 0.283 8.581 8.370 -0.120 0.000 0.457 354 E N -0.793 119.293 120.200 -0.190 0.000 2.208 354 E HA -0.227 4.123 4.350 0.000 0.000 0.193 354 E C 1.408 177.767 176.600 -0.402 0.000 0.988 354 E CA 1.389 57.679 56.400 -0.183 0.000 0.828 354 E CB 0.063 29.728 29.700 -0.059 0.000 0.763 354 E HN -0.109 8.145 8.360 -0.177 0.000 0.478 355 G N -2.026 106.332 108.800 -0.737 0.000 2.484 355 G HA2 -0.225 3.735 3.960 0.000 0.000 0.215 355 G HA3 -0.225 3.735 3.960 0.000 0.000 0.215 355 G C 1.534 176.359 174.900 -0.125 0.000 1.219 355 G CA 1.553 46.220 45.100 -0.721 0.000 0.791 355 G HN -0.162 7.712 8.290 -0.667 0.016 0.550 356 S N 1.794 117.407 115.700 -0.146 0.000 2.500 356 S HA -0.163 4.307 4.470 0.000 0.000 0.239 356 S C 1.337 175.838 174.600 -0.165 0.000 0.989 356 S CA 2.493 60.550 58.200 -0.238 0.000 0.951 356 S CB -0.019 63.016 63.200 -0.276 0.000 0.759 356 S HN -0.418 7.776 8.310 -0.193 0.000 0.523 357 K N -0.954 119.407 120.400 -0.066 0.000 2.459 357 K HA -0.063 4.257 4.320 0.000 0.000 0.193 357 K C -0.142 176.495 176.600 0.063 0.000 1.030 357 K CA 0.645 56.922 56.287 -0.016 0.000 1.026 357 K CB 0.308 32.800 32.500 -0.014 0.000 0.809 357 K HN -0.745 7.410 8.250 -0.090 0.041 0.504 358 Q N 0.610 120.503 119.800 0.155 0.000 2.293 358 Q HA 0.307 4.647 4.340 0.000 0.000 0.263 358 Q C -1.652 174.453 176.000 0.176 0.000 1.002 358 Q CA -2.781 53.130 55.803 0.180 0.000 0.910 358 Q CB -0.980 27.922 28.738 0.274 0.000 1.185 358 Q HN -0.550 7.772 8.270 0.189 0.061 0.401 359 P HA 0.039 4.459 4.420 0.000 0.000 0.272 359 P C 0.239 177.555 177.300 0.027 0.000 1.240 359 P CA -0.413 62.727 63.100 0.067 0.000 0.791 359 P CB 0.909 32.619 31.700 0.016 0.000 0.978 360 L N 0.882 122.135 121.223 0.049 0.000 2.013 360 L HA -0.230 4.110 4.340 0.000 0.000 0.212 360 L C -0.506 176.373 176.870 0.016 0.000 1.073 360 L CA 4.532 59.393 54.840 0.035 0.000 0.753 360 L CB -2.279 39.836 42.059 0.092 0.000 0.890 360 L HN 0.595 8.872 8.230 0.079 0.000 0.432 361 P HA -0.261 4.159 4.420 0.000 0.000 0.219 361 P C 2.005 179.218 177.300 -0.145 0.000 1.146 361 P CA 2.758 65.799 63.100 -0.098 0.000 0.808 361 P CB -0.970 30.485 31.700 -0.409 0.000 0.779 362 K N -1.603 118.672 120.400 -0.209 0.000 2.076 362 K HA -0.072 4.248 4.320 0.000 0.000 0.204 362 K C 2.353 178.575 176.600 -0.629 0.000 1.051 362 K CA 1.743 57.781 56.287 -0.414 0.000 0.949 362 K CB -0.180 32.090 32.500 -0.383 0.000 0.726 362 K HN -0.489 7.524 8.250 -0.154 0.144 0.443 363 L N -0.659 120.365 121.223 -0.332 0.000 2.131 363 L HA -0.317 4.023 4.340 0.000 0.000 0.210 363 L C 2.256 179.067 176.870 -0.099 0.000 1.092 363 L CA 3.191 57.929 54.840 -0.171 0.000 0.759 363 L CB -0.289 41.706 42.059 -0.107 0.000 0.903 363 L HN -0.170 7.867 8.230 -0.203 0.070 0.435 364 I N -0.972 119.525 120.570 -0.121 0.000 2.353 364 I HA -0.529 3.641 4.170 0.000 0.000 0.248 364 I C 1.541 177.623 176.117 -0.058 0.000 1.119 364 I CA 4.299 65.530 61.300 -0.115 0.000 1.417 364 I CB -0.368 37.542 38.000 -0.150 0.000 1.078 364 I HN 0.178 8.314 8.210 -0.112 0.007 0.421 365 D N 0.582 120.923 120.400 -0.098 0.000 2.178 365 D HA -0.281 4.359 4.640 0.000 0.000 0.201 365 D C 2.391 178.723 176.300 0.053 0.000 0.980 365 D CA 3.537 57.498 54.000 -0.065 0.000 0.842 365 D CB -0.203 40.498 40.800 -0.165 0.000 0.948 365 D HN -0.628 7.556 8.370 -0.164 0.088 0.472 366 F N -0.393 119.550 119.950 -0.011 0.000 2.084 366 F HA -0.210 4.317 4.527 0.000 0.000 0.296 366 F C 2.110 177.919 175.800 0.015 0.000 1.111 366 F CA 1.758 59.749 58.000 -0.016 0.000 1.224 366 F CB -0.512 38.471 39.000 -0.028 0.000 0.991 366 F HN -0.169 7.925 8.300 -0.157 0.112 0.471 367 S N -0.214 115.626 115.700 0.233 0.000 2.387 367 S HA -0.442 4.028 4.470 0.000 0.000 0.230 367 S C 2.231 176.995 174.600 0.274 0.000 1.035 367 S CA 4.140 62.474 58.200 0.224 0.000 1.014 367 S CB -0.365 62.909 63.200 0.123 0.000 0.836 367 S HN -0.038 8.392 8.310 0.200 0.000 0.466 368 A N 0.585 123.494 122.820 0.148 0.000 1.929 368 A HA -0.189 4.131 4.320 0.000 0.000 0.216 368 A C 1.910 179.546 177.584 0.087 0.000 1.176 368 A CA 3.030 55.121 52.037 0.091 0.000 0.628 368 A CB -0.873 18.155 19.000 0.046 0.000 0.816 368 A HN 0.407 8.403 8.150 0.113 0.222 0.444 369 Q N -0.585 119.283 119.800 0.114 0.000 2.084 369 Q HA -0.349 3.991 4.340 0.000 0.000 0.202 369 Q C 2.635 178.679 176.000 0.072 0.000 0.978 369 Q CA 3.181 59.037 55.803 0.089 0.000 0.844 369 Q CB 0.004 28.808 28.738 0.111 0.000 0.898 369 Q HN -0.433 7.834 8.270 0.147 0.092 0.426 370 I N -0.333 120.311 120.570 0.123 0.000 2.179 370 I HA -0.538 3.632 4.170 0.000 0.000 0.242 370 I C 1.469 177.601 176.117 0.024 0.000 1.088 370 I CA 3.708 65.080 61.300 0.120 0.000 1.357 370 I CB -0.352 37.808 38.000 0.267 0.000 1.051 370 I HN 0.076 8.390 8.210 0.174 0.000 0.409 371 A N -0.410 122.418 122.820 0.012 0.000 1.908 371 A HA -0.408 3.912 4.320 0.000 0.000 0.218 371 A C 1.915 179.391 177.584 -0.180 0.000 1.181 371 A CA 3.524 55.405 52.037 -0.260 0.000 0.627 371 A CB -1.145 17.695 19.000 -0.266 0.000 0.818 371 A HN 0.104 8.370 8.150 0.192 0.000 0.445 372 E N -1.714 118.438 120.200 -0.079 0.000 2.130 372 E HA -0.468 3.882 4.350 0.000 0.000 0.196 372 E C 2.998 179.497 176.600 -0.168 0.000 0.998 372 E CA 2.880 59.246 56.400 -0.057 0.000 0.806 372 E CB -0.240 29.484 29.700 0.041 0.000 0.738 372 E HN 0.195 8.537 8.360 -0.030 0.000 0.459 373 G N -0.685 108.007 108.800 -0.180 0.000 2.434 373 G HA2 -0.301 3.659 3.960 0.000 0.000 0.214 373 G HA3 -0.301 3.659 3.960 0.000 0.000 0.214 373 G C 1.355 176.065 174.900 -0.318 0.000 1.202 373 G CA 1.870 46.806 45.100 -0.273 0.000 0.788 373 G HN -0.406 7.731 8.290 -0.100 0.093 0.539 374 M N 2.037 121.387 119.600 -0.417 0.000 2.106 374 M HA -0.324 4.156 4.480 0.000 0.000 0.259 374 M C 2.465 178.407 176.300 -0.595 0.000 1.068 374 M CA 1.318 56.187 55.300 -0.719 0.000 1.100 374 M CB -1.025 30.749 32.600 -1.377 0.000 1.351 374 M HN 0.116 8.189 8.290 -0.362 0.000 0.404 375 A N -1.838 120.773 122.820 -0.348 0.000 2.015 375 A HA -0.185 4.135 4.320 0.000 0.000 0.219 375 A C 1.892 179.422 177.584 -0.090 0.000 1.163 375 A CA 2.762 54.736 52.037 -0.106 0.000 0.646 375 A CB -1.134 17.850 19.000 -0.027 0.000 0.806 375 A HN 0.383 8.326 8.150 -0.329 0.010 0.448 376 F N 0.528 120.276 119.950 -0.336 0.000 2.128 376 F HA -0.304 4.223 4.527 0.000 0.000 0.295 376 F C 1.124 176.777 175.800 -0.245 0.000 1.100 376 F CA 3.019 60.818 58.000 -0.336 0.000 1.260 376 F CB 0.532 39.134 39.000 -0.663 0.000 1.009 376 F HN -0.586 7.507 8.300 -0.139 0.123 0.476 377 I N -0.442 119.999 120.570 -0.215 0.000 2.208 377 I HA -0.693 3.477 4.170 0.000 0.000 0.245 377 I C 1.459 177.474 176.117 -0.171 0.000 1.097 377 I CA 4.566 65.737 61.300 -0.216 0.000 1.363 377 I CB -0.251 37.672 38.000 -0.127 0.000 1.051 377 I HN 0.205 8.351 8.210 -0.108 0.000 0.413 378 E N -0.762 119.360 120.200 -0.130 0.000 2.077 378 E HA -0.424 3.926 4.350 0.000 0.000 0.193 378 E C 2.912 179.467 176.600 -0.075 0.000 0.989 378 E CA 3.439 59.827 56.400 -0.021 0.000 0.800 378 E CB -0.339 29.415 29.700 0.090 0.000 0.746 378 E HN 0.186 8.265 8.360 -0.171 0.179 0.452 379 Q N -0.496 119.207 119.800 -0.162 0.000 2.172 379 Q HA -0.206 4.134 4.340 0.000 0.000 0.200 379 Q C 1.997 177.854 176.000 -0.239 0.000 0.964 379 Q CA 2.374 58.071 55.803 -0.176 0.000 0.855 379 Q CB 0.002 28.631 28.738 -0.181 0.000 0.918 379 Q HN -0.557 7.476 8.270 -0.199 0.118 0.444 380 R N -3.815 116.453 120.500 -0.387 0.000 2.319 380 R HA 0.049 4.389 4.340 0.000 0.000 0.204 380 R C -0.808 175.406 176.300 -0.144 0.000 0.954 380 R CA -1.257 54.637 56.100 -0.343 0.000 1.066 380 R CB -0.768 29.179 30.300 -0.588 0.000 0.991 380 R HN -0.114 7.850 8.270 -0.509 0.000 0.486 381 N N -5.035 113.620 118.700 -0.076 0.000 2.776 381 N HA -0.459 4.281 4.740 0.000 0.000 0.250 381 N C -0.999 174.562 175.510 0.085 0.000 1.112 381 N CA 1.638 54.691 53.050 0.005 0.000 0.733 381 N CB -1.163 37.328 38.487 0.006 0.000 1.097 381 N HN -0.439 7.678 8.380 -0.104 0.201 0.558 382 Y N 0.418 120.665 120.300 -0.087 0.000 2.565 382 Y HA 0.087 4.637 4.550 0.000 0.000 0.325 382 Y C -1.080 174.822 175.900 0.003 0.000 1.221 382 Y CA -0.320 57.751 58.100 -0.048 0.000 1.316 382 Y CB 2.106 40.515 38.460 -0.085 0.000 1.404 382 Y HN -0.192 8.137 8.280 0.082 0.000 0.527 383 I N 0.464 120.779 120.570 -0.424 0.000 2.582 383 I HA 0.145 4.315 4.170 0.000 0.000 0.292 383 I C -1.947 174.044 176.117 -0.210 0.000 1.066 383 I CA -1.123 60.060 61.300 -0.194 0.000 1.053 383 I CB 3.306 41.213 38.000 -0.154 0.000 1.241 383 I HN -0.077 7.337 8.210 -1.326 0.000 0.421 384 H N 8.512 127.570 119.070 -0.021 0.000 2.787 384 H HA 0.141 4.697 4.556 0.000 0.000 0.275 384 H C -0.946 174.393 175.328 0.018 0.000 1.183 384 H CA -0.525 55.570 56.048 0.078 0.000 1.290 384 H CB 0.395 30.235 29.762 0.130 0.000 1.438 384 H HN 0.367 9.081 8.280 0.201 -0.314 0.487 385 R N 3.982 124.368 120.500 -0.190 0.000 2.127 385 R HA -0.314 4.026 4.340 0.000 0.000 0.238 385 R C -0.710 175.577 176.300 -0.022 0.000 1.134 385 R CA 2.806 58.785 56.100 -0.202 0.000 0.975 385 R CB 0.471 30.477 30.300 -0.489 0.000 0.865 385 R HN -0.283 7.812 8.270 -0.291 0.000 0.447 386 D N -4.352 116.066 120.400 0.030 0.000 2.440 386 D HA 0.027 4.667 4.640 0.000 0.000 0.252 386 D C -1.930 174.540 176.300 0.283 0.000 1.180 386 D CA -1.668 52.413 54.000 0.135 0.000 0.894 386 D CB 0.233 40.975 40.800 -0.097 0.000 1.111 386 D HN -0.256 8.023 8.370 -0.151 0.000 0.544 387 L N 1.413 122.811 121.223 0.291 0.000 2.349 387 L HA 0.017 4.357 4.340 0.000 0.000 0.275 387 L C -1.290 175.596 176.870 0.026 0.000 1.115 387 L CA 0.468 55.371 54.840 0.105 0.000 0.820 387 L CB 0.838 42.996 42.059 0.164 0.000 1.135 387 L HN 0.041 8.471 8.230 0.335 0.000 0.445 388 R N -3.544 116.890 120.500 -0.110 0.000 2.765 388 R HA 0.150 4.490 4.340 0.000 0.000 0.277 388 R C -0.535 175.678 176.300 -0.146 0.000 1.028 388 R CA -1.186 54.782 56.100 -0.220 0.000 0.860 388 R CB 1.611 31.345 30.300 -0.944 0.000 1.270 388 R HN -0.269 7.939 8.270 -0.102 0.000 0.484 389 A N -0.200 122.587 122.820 -0.055 0.000 2.125 389 A HA -0.172 4.148 4.320 0.000 0.000 0.219 389 A C 0.884 178.421 177.584 -0.079 0.000 1.156 389 A CA 3.157 55.167 52.037 -0.045 0.000 0.671 389 A CB -0.542 18.467 19.000 0.015 0.000 0.794 389 A HN 0.588 9.094 8.150 0.048 -0.327 0.459 390 A N -2.793 119.947 122.820 -0.135 0.000 2.067 390 A HA -0.181 4.139 4.320 0.000 0.000 0.219 390 A C 1.017 178.522 177.584 -0.133 0.000 1.158 390 A CA 2.104 54.054 52.037 -0.145 0.000 0.661 390 A CB -0.424 18.435 19.000 -0.235 0.000 0.801 390 A HN 0.270 8.279 8.150 -0.183 0.031 0.452 391 N N -3.838 114.785 118.700 -0.128 0.000 2.238 391 N HA 0.143 4.883 4.740 0.000 0.000 0.222 391 N C -1.820 173.664 175.510 -0.043 0.000 1.133 391 N CA -0.550 52.459 53.050 -0.069 0.000 0.854 391 N CB 1.503 39.984 38.487 -0.009 0.000 1.041 391 N HN -0.099 8.016 8.380 -0.150 0.175 0.510 392 I N -0.156 120.369 120.570 -0.076 0.000 2.474 392 I HA 0.542 4.712 4.170 0.000 0.000 0.294 392 I C -2.096 173.949 176.117 -0.121 0.000 1.005 392 I CA -1.011 60.237 61.300 -0.086 0.000 1.113 392 I CB 2.561 40.500 38.000 -0.101 0.000 1.289 392 I HN -0.808 7.281 8.210 -0.091 0.067 0.436 393 L N 4.740 125.880 121.223 -0.138 0.000 2.303 393 L HA 0.784 5.124 4.340 0.000 0.000 0.266 393 L C -1.452 175.273 176.870 -0.243 0.000 1.011 393 L CA -1.338 53.394 54.840 -0.179 0.000 0.818 393 L CB 3.314 45.273 42.059 -0.167 0.000 1.326 393 L HN 0.772 8.826 8.230 -0.118 0.106 0.435 394 V N -1.205 118.534 119.914 -0.292 0.000 2.495 394 V HA 0.582 4.702 4.120 0.000 0.000 0.298 394 V C -0.853 175.071 176.094 -0.284 0.000 1.031 394 V CA -2.139 59.940 62.300 -0.369 0.000 0.871 394 V CB 1.197 32.663 31.823 -0.595 0.000 0.988 394 V HN 0.570 8.600 8.190 -0.267 0.000 0.432 395 S N 5.562 121.126 115.700 -0.226 0.000 2.634 395 S HA 0.242 4.712 4.470 0.000 0.000 0.261 395 S C 1.065 175.586 174.600 -0.131 0.000 1.271 395 S CA -0.539 57.567 58.200 -0.158 0.000 0.985 395 S CB 2.122 65.258 63.200 -0.106 0.000 0.968 395 S HN 0.187 8.363 8.310 -0.223 0.000 0.568 396 A N 0.739 123.518 122.820 -0.068 0.000 1.972 396 A HA -0.140 4.180 4.320 0.000 0.000 0.219 396 A C 0.689 178.261 177.584 -0.020 0.000 1.169 396 A CA 2.499 54.521 52.037 -0.026 0.000 0.635 396 A CB -0.506 18.504 19.000 0.016 0.000 0.810 396 A HN 0.589 8.709 8.150 -0.050 0.000 0.446 397 S N -2.974 112.709 115.700 -0.028 0.000 2.754 397 S HA -0.027 4.443 4.470 0.000 0.000 0.223 397 S C 0.002 174.591 174.600 -0.018 0.000 0.951 397 S CA -0.567 57.624 58.200 -0.014 0.000 0.954 397 S CB 0.107 63.298 63.200 -0.014 0.000 0.780 397 S HN -0.598 7.686 8.310 -0.034 0.006 0.509 398 L N -1.995 119.188 121.223 -0.067 0.000 3.717 398 L HA -0.353 3.987 4.340 0.000 0.000 0.411 398 L C -1.334 175.526 176.870 -0.017 0.000 1.233 398 L CA 0.484 55.278 54.840 -0.077 0.000 0.917 398 L CB -2.816 39.303 42.059 0.101 0.000 1.902 398 L HN -0.505 7.581 8.230 -0.103 0.082 0.894 399 V N -1.864 117.997 119.914 -0.088 0.000 2.439 399 V HA 0.182 4.301 4.120 0.000 0.000 0.282 399 V C -0.289 175.716 176.094 -0.148 0.000 1.039 399 V CA -0.920 61.343 62.300 -0.062 0.000 0.913 399 V CB 1.285 33.071 31.823 -0.062 0.000 0.983 399 V HN -0.670 7.447 8.190 -0.122 0.000 0.460 400 C N 9.232 128.452 119.300 -0.134 0.000 2.369 400 C HA 0.466 4.926 4.460 0.000 0.000 0.358 400 C C -0.703 174.223 174.990 -0.108 0.000 1.274 400 C CA -0.794 58.105 59.018 -0.199 0.000 1.935 400 C CB -1.044 26.563 27.740 -0.222 0.000 2.431 400 C HN 0.273 8.793 8.230 -0.039 -0.314 0.545 401 K N 4.047 124.384 120.400 -0.104 0.000 2.324 401 K HA 0.415 4.735 4.320 0.000 0.000 0.253 401 K C -1.123 175.474 176.600 -0.005 0.000 0.932 401 K CA -1.885 54.377 56.287 -0.043 0.000 0.799 401 K CB 3.741 36.215 32.500 -0.044 0.000 1.154 401 K HN 0.709 8.874 8.250 -0.142 0.000 0.425 402 I N 3.218 123.825 120.570 0.061 0.000 2.556 402 I HA 0.162 4.332 4.170 0.000 0.000 0.284 402 I C -1.339 174.972 176.117 0.324 0.000 1.114 402 I CA 0.575 61.961 61.300 0.143 0.000 1.418 402 I CB 0.078 38.149 38.000 0.118 0.000 1.394 402 I HN 0.359 8.501 8.210 0.049 0.097 0.552 403 A N 7.406 130.342 122.820 0.194 0.000 2.320 403 A HA 0.390 4.710 4.320 0.000 0.000 0.334 403 A C -2.019 175.547 177.584 -0.031 0.000 1.147 403 A CA -1.404 50.648 52.037 0.026 0.000 0.820 403 A CB 2.420 21.383 19.000 -0.061 0.000 1.218 403 A HN 0.959 9.191 8.150 0.137 0.000 0.482 404 D N -0.820 119.302 120.400 -0.464 0.000 4.478 404 D HA -0.305 4.335 4.640 0.000 0.000 0.238 404 D C -0.808 175.198 176.300 -0.490 0.000 1.056 404 D CA 1.469 55.180 54.000 -0.481 0.000 1.245 404 D CB -1.652 38.998 40.800 -0.251 0.000 0.794 404 D HN 0.337 8.353 8.370 -0.589 0.000 0.394 405 F N -0.513 119.376 119.950 -0.101 0.000 2.390 405 F HA 0.055 4.582 4.527 0.000 0.000 0.281 405 F C 0.675 176.388 175.800 -0.144 0.000 1.016 405 F CA 0.065 57.979 58.000 -0.143 0.000 1.286 405 F CB 0.853 40.007 39.000 0.256 0.000 1.134 405 F HN 0.062 7.890 8.300 -0.786 0.000 0.597 406 G N -2.869 106.043 108.800 0.187 0.000 2.353 406 G HA2 0.110 4.070 3.960 0.000 0.000 0.284 406 G HA3 0.110 4.070 3.960 0.000 0.000 0.284 406 G C -1.177 173.700 174.900 -0.039 0.000 1.172 406 G CA -0.522 44.625 45.100 0.078 0.000 0.854 406 G HN -0.447 7.973 8.290 0.216 0.000 0.485 407 L N 4.809 125.961 121.223 -0.118 0.000 2.353 407 L HA 0.176 4.516 4.340 0.000 0.000 0.270 407 L C -0.927 175.890 176.870 -0.088 0.000 1.003 407 L CA -1.262 53.501 54.840 -0.129 0.000 0.862 407 L CB 0.403 42.321 42.059 -0.234 0.000 1.221 407 L HN 0.256 8.387 8.230 -0.166 0.000 0.430 408 A N 6.111 128.928 122.820 -0.004 0.000 3.154 408 A HA 0.270 4.590 4.320 0.000 0.000 0.310 408 A C -1.983 175.642 177.584 0.068 0.000 1.093 408 A CA -0.354 51.712 52.037 0.048 0.000 1.006 408 A CB -0.113 18.951 19.000 0.107 0.000 1.084 408 A HN 0.344 8.507 8.150 0.022 0.000 0.549 409 R N -1.428 119.093 120.500 0.034 0.000 2.810 409 R HA 0.864 5.204 4.340 0.000 0.000 0.245 409 R C -0.733 175.637 176.300 0.117 0.000 1.168 409 R CA -0.740 55.405 56.100 0.076 0.000 1.096 409 R CB 1.241 31.538 30.300 -0.005 0.000 1.259 409 R HN -0.493 7.778 8.270 0.001 0.000 0.518 410 V N -1.332 118.693 119.914 0.185 0.000 2.532 410 V HA 0.357 4.477 4.120 0.000 0.000 0.294 410 V C -0.864 175.344 176.094 0.190 0.000 1.036 410 V CA 0.465 62.860 62.300 0.158 0.000 0.876 410 V CB 1.087 32.974 31.823 0.108 0.000 1.012 410 V HN 0.182 8.522 8.190 0.250 0.000 0.432 423 K N 2.007 122.534 120.400 0.212 0.000 3.127 423 K HA 0.247 4.567 4.320 0.000 0.000 0.236 423 K C -1.709 175.036 176.600 0.241 0.000 1.271 423 K CA -0.460 55.949 56.287 0.204 0.000 1.224 423 K CB -1.589 31.004 32.500 0.155 0.000 1.482 423 K HN 0.058 8.440 8.250 0.221 0.000 0.435 424 F N 2.575 122.600 119.950 0.124 0.000 2.399 424 F HA 0.321 4.848 4.527 0.000 0.000 0.334 424 F C -1.148 174.763 175.800 0.185 0.000 1.097 424 F CA -4.527 53.544 58.000 0.118 0.000 1.076 424 F CB 2.960 42.024 39.000 0.108 0.000 1.162 424 F HN -0.824 7.644 8.300 0.392 0.067 0.495 425 P HA 0.128 4.548 4.420 0.000 0.000 0.286 425 P C 0.084 177.798 177.300 0.690 0.000 1.577 425 P CA -0.058 63.321 63.100 0.465 0.000 0.805 425 P CB -1.920 29.831 31.700 0.085 0.000 1.706 426 I N -1.859 119.057 120.570 0.578 0.000 2.147 426 I HA -0.583 3.587 4.170 0.000 0.000 0.245 426 I C 1.534 177.784 176.117 0.221 0.000 1.059 426 I CA 3.438 64.944 61.300 0.344 0.000 1.320 426 I CB -1.311 36.795 38.000 0.176 0.000 1.021 426 I HN 0.034 8.510 8.210 0.611 0.100 0.415 427 K N -0.167 120.322 120.400 0.149 0.000 2.211 427 K HA -0.311 4.009 4.320 0.000 0.000 0.204 427 K C 2.006 178.627 176.600 0.035 0.000 1.047 427 K CA 3.179 59.455 56.287 -0.019 0.000 0.935 427 K CB -0.585 31.702 32.500 -0.355 0.000 0.728 427 K HN 0.018 8.376 8.250 0.218 0.023 0.452 428 W N -3.698 117.788 121.300 0.311 0.000 3.278 428 W HA 0.174 4.834 4.660 0.000 0.000 0.308 428 W C -0.821 175.907 176.519 0.347 0.000 1.253 428 W CA -0.138 57.409 57.345 0.338 0.000 1.759 428 W CB 0.632 30.238 29.460 0.243 0.000 1.093 428 W HN -0.032 8.333 8.180 0.553 0.146 0.648 429 T N 1.542 116.317 114.554 0.370 0.000 2.795 429 T HA 0.312 4.662 4.350 0.000 0.000 0.282 429 T C -1.125 173.362 174.700 -0.355 0.000 0.980 429 T CA -0.405 61.790 62.100 0.159 0.000 1.012 429 T CB 1.185 70.208 68.868 0.259 0.000 0.936 429 T HN -0.297 7.951 8.240 0.302 0.173 0.457 430 A N 6.333 128.817 122.820 -0.560 0.000 2.511 430 A HA 0.264 4.584 4.320 0.000 0.000 0.242 430 A C -0.392 176.745 177.584 -0.745 0.000 1.069 430 A CA -1.904 49.454 52.037 -1.133 0.000 0.763 430 A CB -0.878 17.835 19.000 -0.479 0.000 1.001 430 A HN 0.258 8.303 8.150 -0.175 0.000 0.498 431 P HA -0.394 4.026 4.420 0.000 0.000 0.220 431 P C 0.926 178.098 177.300 -0.214 0.000 1.155 431 P CA 2.959 65.818 63.100 -0.401 0.000 0.880 431 P CB 0.195 31.689 31.700 -0.343 0.000 0.790 432 E N -3.676 116.417 120.200 -0.178 0.000 2.150 432 E HA -0.279 4.071 4.350 0.000 0.000 0.193 432 E C 1.748 178.285 176.600 -0.105 0.000 0.985 432 E CA 3.214 59.583 56.400 -0.051 0.000 0.814 432 E CB -1.336 28.310 29.700 -0.089 0.000 0.752 432 E HN 0.331 8.552 8.360 -0.231 0.000 0.466 433 A N -0.252 122.382 122.820 -0.311 0.000 1.843 433 A HA -0.123 4.197 4.320 0.000 0.000 0.213 433 A C 2.005 179.408 177.584 -0.302 0.000 1.202 433 A CA 2.536 54.249 52.037 -0.541 0.000 0.607 433 A CB -0.569 17.867 19.000 -0.940 0.000 0.847 433 A HN -0.439 7.484 8.150 -0.333 0.026 0.445 434 I N -2.175 118.257 120.570 -0.230 0.000 2.367 434 I HA -0.553 3.617 4.170 0.000 0.000 0.256 434 I C 1.086 177.092 176.117 -0.184 0.000 1.132 434 I CA 3.122 64.320 61.300 -0.169 0.000 1.397 434 I CB -0.056 37.838 38.000 -0.176 0.000 1.074 434 I HN -0.065 7.983 8.210 -0.270 0.000 0.435 435 N N -1.130 117.460 118.700 -0.185 0.000 2.622 435 N HA 0.005 4.745 4.740 0.000 0.000 0.213 435 N C 0.976 176.281 175.510 -0.343 0.000 1.037 435 N CA 1.995 54.867 53.050 -0.296 0.000 0.999 435 N CB 0.790 39.072 38.487 -0.342 0.000 1.342 435 N HN -0.634 7.626 8.380 -0.148 0.031 0.465 436 F N -1.978 117.899 119.950 -0.122 0.000 2.693 436 F HA 0.217 4.744 4.527 0.000 0.000 0.303 436 F C 0.550 176.300 175.800 -0.083 0.000 1.097 436 F CA -0.095 57.852 58.000 -0.089 0.000 1.330 436 F CB 0.363 39.316 39.000 -0.079 0.000 1.067 436 F HN -0.087 8.199 8.300 0.154 0.106 0.565 437 G N 0.525 109.327 108.800 0.003 0.000 2.258 437 G HA2 -0.517 3.443 3.960 0.000 0.000 0.274 437 G HA3 -0.517 3.443 3.960 0.000 0.000 0.274 437 G C -0.421 174.468 174.900 -0.020 0.000 1.021 437 G CA 0.546 45.649 45.100 0.004 0.000 0.798 437 G HN 0.100 8.208 8.290 -0.065 0.143 0.507 438 S N 1.251 116.876 115.700 -0.125 0.000 2.448 438 S HA -0.029 4.441 4.470 0.000 0.000 0.279 438 S C -1.167 173.279 174.600 -0.257 0.000 1.195 438 S CA 0.910 59.065 58.200 -0.075 0.000 1.051 438 S CB 0.504 63.670 63.200 -0.057 0.000 0.948 438 S HN -0.766 7.442 8.310 -0.113 0.034 0.493 439 F N 5.992 125.973 119.950 0.052 0.000 2.467 439 F HA 0.244 4.771 4.527 0.000 0.000 0.336 439 F C -0.468 175.358 175.800 0.043 0.000 1.123 439 F CA -0.426 57.608 58.000 0.056 0.000 0.964 439 F CB 3.044 42.074 39.000 0.051 0.000 1.136 439 F HN -0.064 8.401 8.300 0.274 0.000 0.447 440 T N 1.140 115.822 114.554 0.213 0.000 2.804 440 T HA 0.464 4.814 4.350 0.000 0.000 0.290 440 T C 0.710 175.527 174.700 0.195 0.000 1.099 440 T CA -1.808 60.384 62.100 0.153 0.000 1.011 440 T CB 2.419 71.344 68.868 0.095 0.000 1.291 440 T HN 0.685 9.051 8.240 0.210 0.000 0.523 441 I N -1.229 119.444 120.570 0.173 0.000 2.361 441 I HA -0.300 3.870 4.170 0.000 0.000 0.251 441 I C 1.688 177.950 176.117 0.243 0.000 1.133 441 I CA 2.103 63.553 61.300 0.250 0.000 1.413 441 I CB -1.455 36.686 38.000 0.236 0.000 1.073 441 I HN 0.400 8.688 8.210 0.130 0.000 0.424 442 K N -1.027 119.461 120.400 0.148 0.000 2.097 442 K HA -0.238 4.082 4.320 0.000 0.000 0.205 442 K C 2.362 179.080 176.600 0.197 0.000 1.050 442 K CA 3.239 59.596 56.287 0.116 0.000 0.938 442 K CB -1.026 31.522 32.500 0.079 0.000 0.718 442 K HN 0.423 8.730 8.250 0.124 0.018 0.442 443 S N -0.654 115.168 115.700 0.203 0.000 2.402 443 S HA -0.260 4.210 4.470 0.000 0.000 0.229 443 S C 1.935 176.766 174.600 0.385 0.000 1.021 443 S CA 3.333 61.672 58.200 0.233 0.000 0.974 443 S CB -0.519 62.749 63.200 0.114 0.000 0.800 443 S HN -0.547 7.775 8.310 0.176 0.093 0.484 444 D N 2.598 123.243 120.400 0.409 0.000 2.144 444 D HA -0.194 4.446 4.640 0.000 0.000 0.199 444 D C 2.243 178.900 176.300 0.596 0.000 0.984 444 D CA 3.015 57.327 54.000 0.520 0.000 0.834 444 D CB -0.225 40.901 40.800 0.543 0.000 0.955 444 D HN -0.538 7.971 8.370 0.362 0.078 0.465 445 V N 0.628 120.746 119.914 0.341 0.000 2.332 445 V HA -0.368 3.752 4.120 0.000 0.000 0.248 445 V C 1.685 177.976 176.094 0.327 0.000 1.055 445 V CA 4.329 66.642 62.300 0.022 0.000 1.038 445 V CB -0.828 30.847 31.823 -0.246 0.000 0.651 445 V HN 0.120 8.295 8.190 0.279 0.183 0.450 446 W N -0.610 120.835 121.300 0.242 0.000 2.333 446 W HA -0.461 4.199 4.660 0.000 0.000 0.316 446 W C 1.603 178.386 176.519 0.440 0.000 1.215 446 W CA 3.367 60.929 57.345 0.362 0.000 1.278 446 W CB -0.253 29.378 29.460 0.284 0.000 1.154 446 W HN -0.260 8.159 8.180 0.519 0.073 0.486 447 S N -0.850 115.306 115.700 0.760 0.000 2.383 447 S HA -0.419 4.051 4.470 0.000 0.000 0.229 447 S C 2.247 177.162 174.600 0.526 0.000 1.030 447 S CA 4.033 62.629 58.200 0.661 0.000 1.002 447 S CB -0.703 62.842 63.200 0.574 0.000 0.829 447 S HN -0.308 8.378 8.310 0.720 0.056 0.467 448 F N 2.030 122.214 119.950 0.390 0.000 2.216 448 F HA -0.255 4.272 4.527 0.000 0.000 0.300 448 F C 1.379 177.290 175.800 0.185 0.000 1.085 448 F CA 3.046 61.228 58.000 0.303 0.000 1.326 448 F CB -0.108 39.142 39.000 0.416 0.000 1.027 448 F HN 0.438 9.016 8.300 0.674 0.126 0.497 449 G N -0.463 108.443 108.800 0.176 0.000 2.421 449 G HA2 -0.378 3.582 3.960 0.000 0.000 0.216 449 G HA3 -0.378 3.582 3.960 0.000 0.000 0.216 449 G C 1.336 176.316 174.900 0.134 0.000 1.171 449 G CA 2.224 47.274 45.100 -0.084 0.000 0.775 449 G HN -0.325 8.043 8.290 0.331 0.121 0.543 450 I N 2.084 122.901 120.570 0.413 0.000 2.226 450 I HA -0.318 3.852 4.170 0.000 0.000 0.245 450 I C 1.726 177.936 176.117 0.155 0.000 1.100 450 I CA 2.143 63.618 61.300 0.291 0.000 1.374 450 I CB -0.957 37.174 38.000 0.219 0.000 1.057 450 I HN -0.462 8.028 8.210 0.466 0.000 0.413 451 L N 0.410 121.709 121.223 0.127 0.000 2.141 451 L HA -0.218 4.122 4.340 0.000 0.000 0.209 451 L C 1.789 178.549 176.870 -0.184 0.000 1.094 451 L CA 3.208 58.061 54.840 0.022 0.000 0.763 451 L CB -0.643 41.391 42.059 -0.041 0.000 0.908 451 L HN -0.027 8.224 8.230 0.165 0.078 0.437 452 L N -1.458 119.540 121.223 -0.376 0.000 2.042 452 L HA -0.527 3.813 4.340 0.000 0.000 0.210 452 L C 2.043 178.818 176.870 -0.159 0.000 1.076 452 L CA 3.173 57.800 54.840 -0.354 0.000 0.749 452 L CB -0.591 41.239 42.059 -0.381 0.000 0.893 452 L HN 0.252 8.023 8.230 -0.411 0.212 0.432 453 M N -0.696 118.864 119.600 -0.067 0.000 2.059 453 M HA -0.454 4.026 4.480 0.000 0.000 0.259 453 M C 1.619 177.911 176.300 -0.013 0.000 1.072 453 M CA 2.761 58.060 55.300 -0.003 0.000 1.117 453 M CB -0.635 32.006 32.600 0.068 0.000 1.320 453 M HN -0.309 7.870 8.290 -0.042 0.086 0.408 454 E N -0.515 119.696 120.200 0.019 0.000 2.136 454 E HA -0.469 3.881 4.350 0.000 0.000 0.202 454 E C 2.707 179.308 176.600 0.002 0.000 1.019 454 E CA 3.217 59.650 56.400 0.054 0.000 0.819 454 E CB -0.359 29.427 29.700 0.144 0.000 0.739 454 E HN -0.091 8.293 8.360 0.040 0.000 0.458 455 I N -1.542 119.000 120.570 -0.047 0.000 2.142 455 I HA -0.396 3.774 4.170 0.000 0.000 0.240 455 I C 2.356 178.353 176.117 -0.200 0.000 1.078 455 I CA 4.194 65.442 61.300 -0.086 0.000 1.343 455 I CB -0.051 37.905 38.000 -0.074 0.000 1.046 455 I HN 0.047 8.118 8.210 -0.059 0.104 0.405 456 V N -0.680 119.138 119.914 -0.160 0.000 2.667 456 V HA -0.272 3.848 4.120 0.000 0.000 0.252 456 V C 1.457 177.463 176.094 -0.147 0.000 1.065 456 V CA 2.729 64.918 62.300 -0.185 0.000 1.083 456 V CB -0.736 31.035 31.823 -0.087 0.000 0.692 456 V HN -0.278 7.752 8.190 -0.109 0.094 0.468 457 T N -4.959 109.571 114.554 -0.040 0.000 3.273 457 T HA 0.226 4.576 4.350 0.000 0.000 0.254 457 T C 0.029 174.855 174.700 0.211 0.000 1.002 457 T CA -1.516 60.646 62.100 0.103 0.000 0.913 457 T CB -0.769 68.148 68.868 0.082 0.000 1.056 457 T HN -0.071 8.148 8.240 -0.035 0.000 0.576 458 Y N -0.673 119.657 120.300 0.050 0.000 3.001 458 Y HA -0.563 3.987 4.550 0.000 0.000 0.199 458 Y C 0.335 176.265 175.900 0.049 0.000 1.320 458 Y CA 0.472 58.602 58.100 0.051 0.000 0.974 458 Y CB -3.153 35.324 38.460 0.028 0.000 1.291 458 Y HN -0.111 7.809 8.280 -0.296 0.182 0.465 459 G N -4.013 104.873 108.800 0.145 0.000 2.175 459 G HA2 -0.568 3.392 3.960 0.000 0.000 0.265 459 G HA3 -0.568 3.392 3.960 0.000 0.000 0.265 459 G C -0.511 174.468 174.900 0.132 0.000 0.979 459 G CA -0.123 45.057 45.100 0.134 0.000 0.663 459 G HN 0.500 8.842 8.290 0.088 0.000 0.533 460 R N 1.295 121.869 120.500 0.124 0.000 2.458 460 R HA -0.070 4.270 4.340 0.000 0.000 0.303 460 R C -0.014 176.337 176.300 0.085 0.000 1.013 460 R CA 0.337 56.496 56.100 0.098 0.000 1.026 460 R CB 0.405 30.757 30.300 0.088 0.000 0.948 460 R HN -0.110 8.043 8.270 0.141 0.202 0.417 461 I N 7.508 128.133 120.570 0.092 0.000 2.880 461 I HA -0.212 3.958 4.170 0.000 0.000 0.296 461 I C -0.255 175.862 176.117 0.001 0.000 1.220 461 I CA -1.746 59.610 61.300 0.092 0.000 1.435 461 I CB -1.651 36.418 38.000 0.114 0.000 1.339 461 I HN 0.295 8.561 8.210 0.093 0.000 0.583 462 P HA -0.213 4.207 4.420 0.000 0.000 0.225 462 P C -1.345 175.839 177.300 -0.193 0.000 0.928 462 P CA 1.698 64.636 63.100 -0.269 0.000 1.055 462 P CB 0.325 31.733 31.700 -0.487 0.000 0.635 463 Y N -5.111 115.115 120.300 -0.123 0.000 2.504 463 Y HA 0.173 4.723 4.550 0.000 0.000 0.351 463 Y C -1.768 174.123 175.900 -0.014 0.000 0.988 463 Y CA -2.855 55.225 58.100 -0.033 0.000 1.239 463 Y CB -0.795 37.655 38.460 -0.017 0.000 1.128 463 Y HN -0.101 8.354 8.280 0.292 0.000 0.525 464 P HA -0.058 4.362 4.420 0.000 0.000 0.271 464 P C 0.457 177.798 177.300 0.068 0.000 1.233 464 P CA 0.313 63.455 63.100 0.071 0.000 0.764 464 P CB -0.035 31.697 31.700 0.053 0.000 0.825 465 G N 4.808 113.642 108.800 0.057 0.000 2.396 465 G HA2 -0.398 3.562 3.960 0.000 0.000 0.242 465 G HA3 -0.398 3.562 3.960 0.000 0.000 0.242 465 G C -0.194 174.724 174.900 0.031 0.000 1.069 465 G CA 0.537 45.660 45.100 0.039 0.000 0.633 465 G HN 0.383 8.708 8.290 0.059 0.000 0.517 466 M N 3.369 122.992 119.600 0.038 0.000 2.982 466 M HA -0.147 4.333 4.480 0.000 0.000 0.293 466 M C -0.371 175.922 176.300 -0.013 0.000 1.611 466 M CA -0.363 54.938 55.300 0.001 0.000 1.576 466 M CB -0.804 31.791 32.600 -0.008 0.000 1.555 466 M HN -0.713 7.528 8.290 0.071 0.091 0.485 467 S N 6.874 122.567 115.700 -0.011 0.000 2.711 467 S HA -0.308 4.162 4.470 0.000 0.000 0.335 467 S C 0.540 175.123 174.600 -0.027 0.000 1.175 467 S CA 1.360 59.556 58.200 -0.007 0.000 1.372 467 S CB -1.220 61.978 63.200 -0.002 0.000 1.337 467 S HN 0.076 8.477 8.310 -0.009 -0.095 0.572 468 N N 7.232 125.915 118.700 -0.028 0.000 2.141 468 N HA -0.460 4.280 4.740 0.000 0.000 0.140 468 N C -1.003 174.462 175.510 -0.075 0.000 0.202 468 N CA 4.271 57.295 53.050 -0.044 0.000 1.563 468 N CB -2.166 36.327 38.487 0.009 0.000 1.157 468 N HN 0.205 8.542 8.380 -0.016 0.034 0.472 469 P HA -0.147 4.273 4.420 0.000 0.000 0.225 469 P C 1.289 178.536 177.300 -0.088 0.000 1.148 469 P CA 2.182 65.237 63.100 -0.075 0.000 0.779 469 P CB -0.281 31.384 31.700 -0.058 0.000 0.780 470 E N -1.286 118.862 120.200 -0.087 0.000 2.070 470 E HA -0.416 3.934 4.350 0.000 0.000 0.197 470 E C 2.418 178.935 176.600 -0.138 0.000 1.004 470 E CA 3.481 59.823 56.400 -0.098 0.000 0.805 470 E CB -0.393 29.255 29.700 -0.087 0.000 0.744 470 E HN 0.041 8.328 8.360 -0.072 0.029 0.451 471 V N -0.770 119.029 119.914 -0.191 0.000 2.427 471 V HA -0.309 3.811 4.120 0.000 0.000 0.248 471 V C 2.033 177.987 176.094 -0.233 0.000 1.051 471 V CA 3.718 65.831 62.300 -0.312 0.000 1.048 471 V CB -0.817 30.681 31.823 -0.541 0.000 0.666 471 V HN -0.391 7.607 8.190 -0.171 0.089 0.456 472 I N -3.914 116.554 120.570 -0.170 0.000 2.286 472 I HA -0.477 3.693 4.170 0.000 0.000 0.248 472 I C 1.483 177.541 176.117 -0.099 0.000 1.115 472 I CA 3.669 64.889 61.300 -0.134 0.000 1.392 472 I CB -0.481 37.449 38.000 -0.116 0.000 1.065 472 I HN -0.743 7.278 8.210 -0.153 0.098 0.418 473 R N -1.133 119.315 120.500 -0.087 0.000 2.100 473 R HA -0.144 4.196 4.340 0.000 0.000 0.220 473 R C 2.088 178.362 176.300 -0.044 0.000 1.091 473 R CA 2.430 58.493 56.100 -0.060 0.000 0.986 473 R CB -0.786 29.479 30.300 -0.058 0.000 0.888 473 R HN -0.486 7.727 8.270 -0.096 0.000 0.444 474 A N 0.703 123.487 122.820 -0.060 0.000 2.024 474 A HA -0.220 4.100 4.320 0.000 0.000 0.220 474 A C 2.013 179.635 177.584 0.063 0.000 1.164 474 A CA 2.890 54.912 52.037 -0.025 0.000 0.643 474 A CB -0.772 18.186 19.000 -0.070 0.000 0.806 474 A HN 0.025 8.120 8.150 -0.091 0.000 0.451 475 L N -3.786 117.457 121.223 0.033 0.000 2.240 475 L HA -0.211 4.129 4.340 0.000 0.000 0.211 475 L C 2.883 179.791 176.870 0.064 0.000 1.106 475 L CA 2.819 57.707 54.840 0.079 0.000 0.793 475 L CB -0.760 41.323 42.059 0.039 0.000 0.927 475 L HN -0.236 7.964 8.230 -0.029 0.013 0.446 476 E N 0.416 120.630 120.200 0.022 0.000 2.106 476 E HA -0.234 4.116 4.350 0.000 0.000 0.192 476 E C 1.726 178.349 176.600 0.039 0.000 0.984 476 E CA 2.392 58.804 56.400 0.020 0.000 0.806 476 E CB -0.773 28.925 29.700 -0.003 0.000 0.750 476 E HN -0.412 7.843 8.360 -0.002 0.103 0.458 477 R N -2.842 117.684 120.500 0.043 0.000 2.323 477 R HA -0.011 4.329 4.340 0.000 0.000 0.198 477 R C 0.601 176.955 176.300 0.090 0.000 0.988 477 R CA -0.256 55.876 56.100 0.054 0.000 1.041 477 R CB 0.016 30.339 30.300 0.039 0.000 0.926 477 R HN -0.127 8.157 8.270 0.032 0.005 0.476 478 G N -1.422 107.446 108.800 0.112 0.000 2.148 478 G HA2 -0.426 3.534 3.960 0.000 0.000 0.254 478 G HA3 -0.426 3.534 3.960 0.000 0.000 0.254 478 G C -0.475 174.534 174.900 0.182 0.000 0.981 478 G CA 0.051 45.232 45.100 0.136 0.000 0.670 478 G HN -0.317 7.832 8.290 0.101 0.202 0.528 479 Y N 0.687 121.030 120.300 0.072 0.000 2.379 479 Y HA -0.148 4.402 4.550 0.000 0.000 0.337 479 Y C -1.115 174.848 175.900 0.105 0.000 1.238 479 Y CA 0.173 58.323 58.100 0.083 0.000 1.405 479 Y CB 0.935 39.436 38.460 0.068 0.000 1.310 479 Y HN -0.425 8.022 8.280 0.279 0.000 0.569 480 R N 5.761 125.975 120.500 -0.477 0.000 2.698 480 R HA 0.230 4.570 4.340 0.000 0.000 0.275 480 R C -1.818 173.954 176.300 -0.879 0.000 1.001 480 R CA -1.811 54.015 56.100 -0.456 0.000 0.896 480 R CB 3.190 33.450 30.300 -0.067 0.000 1.218 480 R HN 0.526 8.387 8.270 -0.681 0.000 0.462 481 M N 3.991 123.231 119.600 -0.601 0.000 2.249 481 M HA 0.055 4.535 4.480 0.000 0.000 0.340 481 M C -1.209 175.048 176.300 -0.071 0.000 1.166 481 M CA -0.773 54.295 55.300 -0.387 0.000 1.115 481 M CB -0.268 32.156 32.600 -0.294 0.000 1.606 481 M HN 0.334 8.264 8.290 -0.601 0.000 0.448 482 P HA -0.063 4.357 4.420 0.000 0.000 0.271 482 P C -1.445 175.768 177.300 -0.144 0.000 1.233 482 P CA -0.236 62.837 63.100 -0.044 0.000 0.789 482 P CB 0.428 32.122 31.700 -0.010 0.000 0.951 483 R N 0.431 120.651 120.500 -0.466 0.000 2.296 483 R HA 0.137 4.477 4.340 0.000 0.000 0.323 483 R C -1.383 174.778 176.300 -0.232 0.000 1.067 483 R CA -1.838 53.903 56.100 -0.598 0.000 0.946 483 R CB 0.112 29.845 30.300 -0.945 0.000 0.991 483 R HN 0.141 8.140 8.270 -0.452 0.000 0.448 484 P HA 0.029 4.449 4.420 0.000 0.000 0.265 484 P C 0.304 177.578 177.300 -0.044 0.000 1.193 484 P CA -0.253 62.821 63.100 -0.043 0.000 0.765 484 P CB 0.736 32.437 31.700 0.000 0.000 0.823 485 E N 1.655 121.842 120.200 -0.022 0.000 2.472 485 E HA -0.260 4.090 4.350 0.000 0.000 0.200 485 E C -0.167 176.438 176.600 0.008 0.000 1.046 485 E CA 1.978 58.370 56.400 -0.015 0.000 0.871 485 E CB -0.652 29.044 29.700 -0.006 0.000 0.806 485 E HN 0.555 8.907 8.360 -0.013 0.000 0.533 486 N N -4.385 114.332 118.700 0.029 0.000 2.280 486 N HA -0.081 4.659 4.740 0.000 0.000 0.192 486 N C -0.534 175.005 175.510 0.050 0.000 1.109 486 N CA -0.350 52.732 53.050 0.054 0.000 0.855 486 N CB -0.217 38.329 38.487 0.098 0.000 0.974 486 N HN -0.384 7.946 8.380 0.028 0.066 0.482 487 C N 4.545 123.861 119.300 0.025 0.000 2.303 487 C HA 0.522 4.982 4.460 0.000 0.000 0.341 487 C C -1.751 173.264 174.990 0.041 0.000 1.244 487 C CA -3.248 55.786 59.018 0.026 0.000 1.765 487 C CB -0.366 27.380 27.740 0.010 0.000 2.379 487 C HN -0.086 8.077 8.230 0.006 0.071 0.530 488 P HA -0.003 4.417 4.420 0.000 0.000 0.267 488 P C 0.323 177.693 177.300 0.116 0.000 1.200 488 P CA 0.034 63.196 63.100 0.102 0.000 0.772 488 P CB 0.820 32.622 31.700 0.170 0.000 0.855 489 E N 3.212 123.462 120.200 0.084 0.000 2.085 489 E HA -0.324 4.026 4.350 0.000 0.000 0.194 489 E C 2.079 178.765 176.600 0.145 0.000 0.994 489 E CA 3.872 60.336 56.400 0.106 0.000 0.801 489 E CB -0.341 29.394 29.700 0.059 0.000 0.743 489 E HN 0.608 9.000 8.360 0.053 0.000 0.453 490 E N -2.887 117.384 120.200 0.119 0.000 2.338 490 E HA -0.214 4.136 4.350 0.000 0.000 0.197 490 E C 2.120 178.863 176.600 0.238 0.000 1.007 490 E CA 2.421 58.895 56.400 0.123 0.000 0.849 490 E CB -0.768 28.921 29.700 -0.019 0.000 0.774 490 E HN 0.441 8.835 8.360 0.099 0.025 0.506 491 L N 0.147 121.517 121.223 0.244 0.000 2.168 491 L HA -0.143 4.197 4.340 0.000 0.000 0.203 491 L C 0.752 177.609 176.870 -0.022 0.000 1.078 491 L CA 2.073 56.946 54.840 0.055 0.000 0.780 491 L CB -0.066 41.960 42.059 -0.054 0.000 0.939 491 L HN -0.322 7.898 8.230 0.247 0.158 0.451 492 Y N 0.380 120.628 120.300 -0.086 0.000 2.165 492 Y HA -0.561 3.989 4.550 0.000 0.000 0.286 492 Y C 1.469 177.255 175.900 -0.189 0.000 1.155 492 Y CA 3.782 61.793 58.100 -0.149 0.000 1.164 492 Y CB -0.284 38.124 38.460 -0.088 0.000 0.978 492 Y HN -0.106 8.296 8.280 0.203 0.000 0.513 493 N N -0.794 117.813 118.700 -0.155 0.000 2.120 493 N HA -0.358 4.382 4.740 0.000 0.000 0.188 493 N C 2.144 177.484 175.510 -0.284 0.000 1.024 493 N CA 3.651 56.564 53.050 -0.227 0.000 0.852 493 N CB 0.067 38.523 38.487 -0.053 0.000 1.003 493 N HN 0.116 8.516 8.380 0.042 0.005 0.424 494 I N 0.218 120.669 120.570 -0.199 0.000 2.208 494 I HA -0.470 3.700 4.170 0.000 0.000 0.245 494 I C 1.974 177.837 176.117 -0.422 0.000 1.097 494 I CA 2.501 63.683 61.300 -0.196 0.000 1.363 494 I CB -1.114 36.831 38.000 -0.092 0.000 1.051 494 I HN -0.762 7.312 8.210 -0.106 0.072 0.413 495 M N -0.401 118.815 119.600 -0.640 0.000 2.073 495 M HA -0.579 3.901 4.480 0.000 0.000 0.258 495 M C 2.540 177.864 176.300 -1.626 0.000 1.070 495 M CA 4.319 58.887 55.300 -1.221 0.000 1.103 495 M CB -0.062 31.715 32.600 -1.371 0.000 1.321 495 M HN -0.114 7.804 8.290 -0.508 0.066 0.405 496 M N -2.889 115.987 119.600 -1.207 0.000 2.106 496 M HA -0.409 4.071 4.480 0.000 0.000 0.259 496 M C 2.134 178.144 176.300 -0.483 0.000 1.068 496 M CA 2.634 57.468 55.300 -0.776 0.000 1.100 496 M CB -1.009 31.189 32.600 -0.669 0.000 1.351 496 M HN -0.089 7.522 8.290 -1.132 0.000 0.404 497 R N -3.716 116.530 120.500 -0.422 0.000 2.115 497 R HA -0.163 4.177 4.340 0.000 0.000 0.230 497 R C 2.946 179.101 176.300 -0.242 0.000 1.111 497 R CA 2.504 58.452 56.100 -0.253 0.000 0.976 497 R CB 0.241 30.438 30.300 -0.173 0.000 0.870 497 R HN -0.135 7.773 8.270 -0.457 0.089 0.445 498 C N -1.001 118.066 119.300 -0.388 0.000 2.440 498 C HA -0.129 4.331 4.460 0.000 0.000 0.278 498 C C 2.243 177.148 174.990 -0.141 0.000 1.295 498 C CA 2.948 61.806 59.018 -0.266 0.000 1.738 498 C CB -1.305 26.236 27.740 -0.332 0.000 1.987 498 C HN -0.137 7.695 8.230 -0.527 0.082 0.492 499 W N -2.531 118.472 121.300 -0.495 0.000 3.466 499 W HA 0.030 4.690 4.660 0.000 0.000 0.323 499 W C -0.894 175.468 176.519 -0.261 0.000 1.264 499 W CA -2.686 54.138 57.345 -0.869 0.000 1.750 499 W CB -1.970 26.910 29.460 -0.967 0.000 1.040 499 W HN -0.200 7.478 8.180 -0.666 0.103 0.742 500 K N 2.124 122.592 120.400 0.114 0.000 2.228 500 K HA -0.132 4.188 4.320 0.000 0.000 0.284 500 K C 1.342 178.095 176.600 0.255 0.000 1.088 500 K CA -0.906 55.458 56.287 0.129 0.000 0.941 500 K CB -1.226 31.301 32.500 0.044 0.000 1.158 500 K HN -0.938 7.248 8.250 0.075 0.109 0.438 501 N N 5.640 124.525 118.700 0.309 0.000 2.297 501 N HA -0.477 4.263 4.740 0.000 0.000 0.198 501 N C -0.652 174.964 175.510 0.176 0.000 0.934 501 N CA 2.519 55.741 53.050 0.286 0.000 0.936 501 N CB 0.488 39.087 38.487 0.186 0.000 1.065 501 N HN -0.058 8.473 8.380 0.295 0.026 0.645 502 R N -2.447 118.124 120.500 0.119 0.000 2.207 502 R HA 0.288 4.628 4.340 0.000 0.000 0.334 502 R C -0.900 175.443 176.300 0.071 0.000 1.013 502 R CA -2.629 53.511 56.100 0.067 0.000 0.858 502 R CB 0.168 30.489 30.300 0.034 0.000 1.094 502 R HN -0.249 8.038 8.270 0.118 0.053 0.457 503 P HA -0.190 4.230 4.420 0.000 0.000 0.217 503 P C 0.710 178.035 177.300 0.041 0.000 1.150 503 P CA 2.541 65.686 63.100 0.076 0.000 0.832 503 P CB 0.077 31.807 31.700 0.050 0.000 0.787 504 E N -2.805 117.404 120.200 0.015 0.000 2.516 504 E HA -0.140 4.210 4.350 0.000 0.000 0.199 504 E C 1.342 177.933 176.600 -0.015 0.000 1.069 504 E CA 1.940 58.339 56.400 -0.003 0.000 0.876 504 E CB -2.037 27.657 29.700 -0.010 0.000 0.843 504 E HN 0.422 8.789 8.360 0.011 0.000 0.530 505 E N -0.617 119.579 120.200 -0.006 0.000 2.481 505 E HA 0.091 4.441 4.350 0.000 0.000 0.198 505 E C -0.347 176.232 176.600 -0.035 0.000 1.027 505 E CA -0.896 55.489 56.400 -0.024 0.000 0.900 505 E CB 0.835 30.529 29.700 -0.010 0.000 0.993 505 E HN -0.402 7.783 8.360 0.015 0.184 0.482 506 R N -0.088 120.401 120.500 -0.018 0.000 2.459 506 R HA 0.291 4.631 4.340 0.000 0.000 0.281 506 R C -2.108 174.138 176.300 -0.089 0.000 1.050 506 R CA -2.233 53.846 56.100 -0.036 0.000 1.055 506 R CB -0.212 30.101 30.300 0.021 0.000 1.045 506 R HN -0.456 7.631 8.270 -0.002 0.181 0.495 507 P HA 0.064 4.484 4.420 0.000 0.000 0.274 507 P C -1.344 175.866 177.300 -0.151 0.000 1.246 507 P CA -0.586 62.440 63.100 -0.123 0.000 0.795 507 P CB 0.537 32.217 31.700 -0.034 0.000 1.006 508 T N -6.339 108.164 114.554 -0.085 0.000 2.904 508 T HA 0.156 4.505 4.350 0.000 0.000 0.290 508 T C 1.284 175.925 174.700 -0.099 0.000 1.018 508 T CA -0.947 61.100 62.100 -0.087 0.000 1.075 508 T CB 1.160 70.032 68.868 0.007 0.000 0.986 508 T HN -0.324 7.890 8.240 -0.044 0.000 0.523 509 F N 1.676 121.597 119.950 -0.048 0.000 2.408 509 F HA -0.270 4.257 4.527 0.000 0.000 0.300 509 F C 1.464 177.204 175.800 -0.100 0.000 1.090 509 F CA 3.319 61.239 58.000 -0.134 0.000 1.427 509 F CB -0.310 38.596 39.000 -0.156 0.000 1.070 509 F HN 0.149 8.610 8.300 -0.038 -0.183 0.549 510 E N 0.422 120.698 120.200 0.126 0.000 2.072 510 E HA -0.394 3.956 4.350 0.000 0.000 0.191 510 E C 1.853 178.497 176.600 0.073 0.000 0.985 510 E CA 3.098 59.545 56.400 0.078 0.000 0.801 510 E CB -0.188 29.555 29.700 0.072 0.000 0.750 510 E HN -0.377 8.164 8.360 0.125 -0.106 0.452 511 Y N 0.148 120.428 120.300 -0.034 0.000 2.184 511 Y HA -0.281 4.269 4.550 0.000 0.000 0.290 511 Y C 2.211 178.084 175.900 -0.045 0.000 1.129 511 Y CA 3.096 61.170 58.100 -0.043 0.000 1.144 511 Y CB 0.105 38.528 38.460 -0.063 0.000 0.995 511 Y HN -0.527 7.752 8.280 0.173 0.105 0.513 512 I N -0.522 119.987 120.570 -0.102 0.000 2.208 512 I HA -0.673 3.497 4.170 0.000 0.000 0.245 512 I C 1.376 177.379 176.117 -0.191 0.000 1.097 512 I CA 4.287 65.468 61.300 -0.198 0.000 1.363 512 I CB -0.343 37.547 38.000 -0.183 0.000 1.051 512 I HN 0.143 8.372 8.210 0.031 0.000 0.413 513 Q N -0.304 119.423 119.800 -0.122 0.000 2.084 513 Q HA -0.402 3.938 4.340 0.000 0.000 0.202 513 Q C 2.432 178.372 176.000 -0.100 0.000 0.978 513 Q CA 3.775 59.525 55.803 -0.088 0.000 0.844 513 Q CB -0.091 28.619 28.738 -0.047 0.000 0.898 513 Q HN 0.019 8.245 8.270 -0.073 0.000 0.426 514 S N -0.043 115.577 115.700 -0.134 0.000 2.382 514 S HA -0.296 4.174 4.470 0.000 0.000 0.228 514 S C 2.258 176.765 174.600 -0.155 0.000 1.027 514 S CA 3.650 61.775 58.200 -0.125 0.000 0.991 514 S CB -0.341 62.792 63.200 -0.112 0.000 0.823 514 S HN -0.325 7.831 8.310 -0.130 0.076 0.469 515 V N 3.479 123.226 119.914 -0.279 0.000 2.283 515 V HA -0.249 3.871 4.120 0.000 0.000 0.243 515 V C 1.155 177.248 176.094 -0.002 0.000 1.039 515 V CA 3.903 66.071 62.300 -0.219 0.000 1.016 515 V CB -0.424 31.142 31.823 -0.428 0.000 0.650 515 V HN -0.373 7.565 8.190 -0.378 0.025 0.449 516 L N -4.193 117.005 121.223 -0.042 0.000 2.056 516 L HA -0.298 4.042 4.340 0.000 0.000 0.207 516 L C 2.438 179.330 176.870 0.036 0.000 1.078 516 L CA 2.408 57.234 54.840 -0.022 0.000 0.749 516 L CB -0.273 41.756 42.059 -0.051 0.000 0.901 516 L HN -0.054 8.109 8.230 -0.112 0.000 0.433 517 D N -0.220 120.188 120.400 0.014 0.000 2.133 517 D HA -0.266 4.374 4.640 0.000 0.000 0.195 517 D C 0.843 177.184 176.300 0.068 0.000 0.997 517 D CA 3.572 57.591 54.000 0.032 0.000 0.840 517 D CB -0.108 40.694 40.800 0.004 0.000 0.947 517 D HN 0.102 8.460 8.370 -0.021 0.000 0.452 518 D N -2.292 118.143 120.400 0.058 0.000 3.008 518 D HA 0.216 4.856 4.640 0.000 0.000 0.312 518 D C 0.918 177.263 176.300 0.075 0.000 1.361 518 D CA -0.911 53.128 54.000 0.065 0.000 0.858 518 D CB -0.574 40.233 40.800 0.011 0.000 1.098 518 D HN -0.707 7.680 8.370 0.027 0.000 0.482 519 F N 2.097 122.000 119.950 -0.080 0.000 2.365 519 F HA -0.267 4.260 4.527 0.000 0.000 0.300 519 F C -0.298 175.289 175.800 -0.356 0.000 1.090 519 F CA 2.934 60.800 58.000 -0.225 0.000 1.408 519 F CB 0.528 39.368 39.000 -0.265 0.000 1.060 519 F HN -0.535 7.763 8.300 0.258 0.157 0.534 520 Y N -4.996 115.351 120.300 0.079 0.000 2.584 520 Y HA 0.178 4.728 4.550 0.000 0.000 0.254 520 Y C -1.033 174.841 175.900 -0.043 0.000 1.177 520 Y CA -0.181 57.913 58.100 -0.009 0.000 1.216 520 Y CB 0.325 38.803 38.460 0.030 0.000 1.172 520 Y HN -0.386 8.043 8.280 0.293 0.026 0.529 521 T N 1.724 116.306 114.554 0.046 0.000 2.848 521 T HA 0.180 4.530 4.350 0.000 0.000 0.285 521 T C -1.478 173.201 174.700 -0.034 0.000 0.995 521 T CA -0.803 61.306 62.100 0.016 0.000 0.970 521 T CB 2.029 70.918 68.868 0.036 0.000 0.976 521 T HN -0.750 7.320 8.240 0.010 0.176 0.441 522 A N 4.632 127.428 122.820 -0.040 0.000 2.440 522 A HA 0.220 4.540 4.320 0.000 0.000 0.251 522 A C 1.455 179.017 177.584 -0.037 0.000 1.089 522 A CA -0.392 51.614 52.037 -0.051 0.000 0.779 522 A CB 0.698 19.671 19.000 -0.046 0.000 1.022 522 A HN 0.258 8.391 8.150 -0.029 0.000 0.492 523 T N 4.284 118.816 114.554 -0.038 0.000 2.822 523 T HA -0.345 4.005 4.350 0.000 0.000 0.270 523 T C 2.019 176.703 174.700 -0.026 0.000 1.064 523 T CA 3.444 65.527 62.100 -0.029 0.000 1.131 523 T CB -0.424 68.429 68.868 -0.025 0.000 0.858 523 T HN 0.571 8.784 8.240 -0.045 0.000 0.483 524 E N 0.168 120.352 120.200 -0.027 0.000 2.152 524 E HA -0.052 4.298 4.350 0.000 0.000 0.192 524 E C 0.648 177.231 176.600 -0.029 0.000 0.983 524 E CA 1.893 58.278 56.400 -0.025 0.000 0.818 524 E CB -0.065 29.621 29.700 -0.023 0.000 0.758 524 E HN 0.352 8.684 8.360 -0.029 0.010 0.467 525 S N -1.374 114.307 115.700 -0.032 0.000 2.622 525 S HA 0.221 4.691 4.470 0.000 0.000 0.236 525 S C -0.667 173.911 174.600 -0.036 0.000 0.956 525 S CA -0.064 58.113 58.200 -0.039 0.000 0.971 525 S CB 0.436 63.613 63.200 -0.039 0.000 0.782 525 S HN -0.577 7.590 8.310 -0.031 0.125 0.468 529 Q N 2.234 122.030 119.800 -0.007 0.000 2.311 529 Q HA -0.138 4.202 4.340 0.000 0.000 0.272 529 Q C 0.081 176.134 176.000 0.088 0.000 1.012 529 Q CA -0.064 55.760 55.803 0.034 0.000 0.891 529 Q CB 0.443 29.199 28.738 0.030 0.000 1.201 529 Q HN 0.162 8.423 8.270 -0.016 0.000 0.391 530 Q N 4.758 124.614 119.800 0.093 0.000 2.308 530 Q HA -0.082 4.258 4.340 0.000 0.000 0.313 530 Q C -1.406 174.661 176.000 0.112 0.000 1.075 530 Q CA -0.878 54.996 55.803 0.118 0.000 0.995 530 Q CB 0.459 29.257 28.738 0.100 0.000 1.107 530 Q HN 0.186 8.497 8.270 0.068 0.000 0.380 531 P HA 0.000 4.420 4.420 0.000 0.000 0.216 531 P CA 0.000 63.156 63.100 0.093 0.000 0.800 531 P CB 0.000 31.744 31.700 0.074 0.000 0.726