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 3glg_1_G DATA FIRST_RESID -9 DATA SEQUENCE GLEVLFQGPH MSYQVLARKW RPQTFADVVG QEHVLTALAN GLSLGRIHHA DATA SEQUENCE YLFSGTRGVG KTSIARLLAK GLNCETGITA TPCGVCDNCR EIEQGRFVDL DATA SEQUENCE IEIDAASRTK VEDTRDLLDN VQYAPARGRF KVYLIDEVHM LSRHSFNALL DATA SEQUENCE KTLEEPPEHV KFLLATADPQ KLPVTILSRC LQFHLKALDV EQIRHQLEHI DATA SEQUENCE LNEEHIAHEP RALQLLARAA EGSLRDALSL TDQAIASGDG QVSTQAVSAM DATA SEQUENCE LGTLDDDQAL SLVEAMVEAN GERVMALINE AAARGIEWEA LLVEMLGLLH DATA SEQUENCE RIAMVQLSPA ALGNDMAAIE LRMRELARTI PPTDIQLYYQ TLLIGRKELP DATA SEQUENCE YAPDRRMGVE MTLLRALAFH PRMPLPEP 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 -9 G HA2 0.000 3.960 3.960 -0.000 0.000 0.244 -9 G HA3 0.000 3.957 3.960 -0.005 0.000 0.244 -9 G C 0.000 174.928 174.900 0.047 0.000 0.946 -9 G CA 0.000 45.121 45.100 0.034 0.000 0.502 -8 L N 1.598 122.856 121.223 0.059 0.000 2.395 -8 L HA 0.366 4.702 4.340 -0.005 0.000 0.218 -8 L C 2.268 179.227 176.870 0.148 0.000 1.130 -8 L CA 1.766 56.659 54.840 0.088 0.000 0.826 -8 L CB -0.452 41.658 42.059 0.085 0.000 0.941 -8 L HN 0.603 8.833 8.230 -0.000 0.000 0.451 -7 E N -1.602 118.678 120.200 0.132 0.000 2.418 -7 E HA -0.123 4.224 4.350 -0.005 0.000 0.197 -7 E C 2.145 178.873 176.600 0.213 0.000 1.026 -7 E CA 0.658 57.170 56.400 0.186 0.000 0.862 -7 E CB -0.031 29.736 29.700 0.111 0.000 0.799 -7 E HN 0.304 8.664 8.360 -0.000 0.000 0.518 -6 V N 1.557 121.545 119.914 0.123 0.000 2.282 -6 V HA -0.310 3.807 4.120 -0.005 0.000 0.249 -6 V C 2.179 178.289 176.094 0.027 0.000 1.057 -6 V CA 1.710 64.052 62.300 0.070 0.000 1.032 -6 V CB -0.548 31.293 31.823 0.029 0.000 0.645 -6 V HN 0.364 8.554 8.190 -0.000 0.000 0.447 -5 L N -1.360 119.826 121.223 -0.062 0.000 2.263 -5 L HA -0.205 4.132 4.340 -0.005 0.000 0.216 -5 L C 2.117 178.657 176.870 -0.550 0.000 1.111 -5 L CA 1.693 56.303 54.840 -0.382 0.000 0.773 -5 L CB -0.620 41.047 42.059 -0.653 0.000 0.906 -5 L HN 0.335 8.565 8.230 -0.000 0.000 0.439 -4 F N -2.127 117.833 119.950 0.017 0.000 2.712 -4 F HA 0.165 4.689 4.527 -0.005 0.000 0.297 -4 F C 1.501 177.314 175.800 0.021 0.000 1.114 -4 F CA -0.550 57.459 58.000 0.016 0.000 1.305 -4 F CB 0.015 39.022 39.000 0.013 0.000 1.086 -4 F HN -0.099 8.201 8.300 -0.000 0.000 0.599 -3 Q N 1.292 121.199 119.800 0.178 0.000 2.386 -3 Q HA 0.216 4.553 4.340 -0.005 0.000 0.282 -3 Q C 0.669 176.717 176.000 0.080 0.000 1.050 -3 Q CA 0.488 56.363 55.803 0.120 0.000 0.918 -3 Q CB 0.897 29.703 28.738 0.114 0.000 1.266 -3 Q HN 0.378 8.648 8.270 -0.000 0.000 0.423 -2 G N 1.965 110.807 108.800 0.069 0.000 2.531 -2 G HA2 0.437 4.394 3.960 -0.005 0.000 0.281 -2 G HA3 0.437 4.394 3.960 -0.005 0.000 0.281 -2 G C -2.297 172.630 174.900 0.045 0.000 1.382 -2 G CA -0.928 44.200 45.100 0.046 0.000 1.045 -2 G HN 0.432 8.722 8.290 -0.000 0.000 0.533 -1 P HA 0.126 4.546 4.420 -0.000 0.000 0.271 -1 P C -0.287 177.039 177.300 0.043 0.000 1.220 -1 P CA -0.086 63.034 63.100 0.035 0.000 0.768 -1 P CB 0.350 32.055 31.700 0.009 0.000 0.848 0 H N 5.275 124.342 119.070 -0.005 0.000 3.082 0 H HA 0.107 4.660 4.556 -0.005 0.000 0.275 0 H C 0.159 175.469 175.328 -0.030 0.000 1.032 0 H CA 0.245 56.292 56.048 -0.002 0.000 1.477 0 H CB 0.338 30.103 29.762 0.005 0.000 1.520 0 H HN 0.393 8.673 8.280 -0.000 0.000 0.521 1 M N 2.714 122.182 119.600 -0.221 0.000 2.578 1 M HA 0.423 4.900 4.480 -0.005 0.000 0.321 1 M C -0.784 175.352 176.300 -0.273 0.000 1.182 1 M CA -1.034 54.130 55.300 -0.227 0.000 0.965 1 M CB 2.226 34.632 32.600 -0.323 0.000 1.694 1 M HN 0.384 8.674 8.290 -0.000 0.000 0.461 2 S N 1.426 117.001 115.700 -0.208 0.000 2.659 2 S HA 0.555 5.022 4.470 -0.005 0.000 0.312 2 S C -1.190 173.332 174.600 -0.129 0.000 1.114 2 S CA -0.695 57.450 58.200 -0.091 0.000 1.063 2 S CB 0.301 63.522 63.200 0.035 0.000 0.996 2 S HN 0.649 8.959 8.310 -0.000 0.000 0.478 3 Y N 2.005 122.302 120.300 -0.005 0.000 2.357 3 Y HA 0.245 4.792 4.550 -0.005 0.000 0.340 3 Y C 1.405 177.311 175.900 0.010 0.000 1.260 3 Y CA -0.463 57.640 58.100 0.006 0.000 1.425 3 Y CB 0.590 39.063 38.460 0.021 0.000 1.326 3 Y HN 0.569 8.849 8.280 -0.000 0.000 0.580 4 Q N 0.702 120.599 119.800 0.161 0.000 2.394 4 Q HA 0.234 4.571 4.340 -0.005 0.000 0.248 4 Q C -0.534 175.534 176.000 0.113 0.000 0.992 4 Q CA -0.629 55.226 55.803 0.088 0.000 0.888 4 Q CB 0.921 29.674 28.738 0.025 0.000 1.257 4 Q HN 0.404 8.674 8.270 -0.000 0.000 0.462 5 V N 3.131 123.093 119.914 0.080 0.000 2.763 5 V HA -0.138 3.979 4.120 -0.005 0.000 0.306 5 V C 1.722 177.877 176.094 0.102 0.000 1.059 5 V CA 0.417 62.765 62.300 0.081 0.000 1.138 5 V CB 0.255 32.112 31.823 0.057 0.000 0.940 5 V HN 0.781 8.971 8.190 -0.000 0.000 0.489 6 L N 3.386 124.683 121.223 0.123 0.000 2.046 6 L HA -0.170 4.167 4.340 -0.005 0.000 0.208 6 L C 2.600 179.583 176.870 0.188 0.000 1.077 6 L CA 1.897 56.858 54.840 0.202 0.000 0.747 6 L CB -0.679 41.470 42.059 0.149 0.000 0.896 6 L HN 0.920 9.150 8.230 -0.000 0.000 0.432 7 A N 0.201 123.084 122.820 0.105 0.000 1.948 7 A HA -0.242 4.075 4.320 -0.005 0.000 0.220 7 A C 2.364 179.992 177.584 0.073 0.000 1.177 7 A CA 1.748 53.833 52.037 0.079 0.000 0.636 7 A CB -0.425 18.602 19.000 0.045 0.000 0.815 7 A HN 0.386 8.536 8.150 -0.000 0.000 0.449 8 R N -0.904 119.630 120.500 0.056 0.000 2.052 8 R HA -0.009 4.328 4.340 -0.005 0.000 0.224 8 R C 2.410 178.706 176.300 -0.006 0.000 1.149 8 R CA 1.201 57.314 56.100 0.022 0.000 0.962 8 R CB -0.403 29.903 30.300 0.010 0.000 0.856 8 R HN 0.559 8.829 8.270 -0.000 0.000 0.433 9 K N 0.544 120.928 120.400 -0.028 0.000 2.015 9 K HA -0.198 4.119 4.320 -0.005 0.000 0.216 9 K C 1.109 177.545 176.600 -0.273 0.000 1.052 9 K CA 1.809 57.980 56.287 -0.193 0.000 0.937 9 K CB -0.158 32.174 32.500 -0.280 0.000 0.719 9 K HN 0.201 8.451 8.250 -0.000 0.000 0.446 10 W N 2.073 123.360 121.300 -0.021 0.000 3.466 10 W HA 0.127 4.785 4.660 -0.005 0.000 0.323 10 W C 0.208 176.692 176.519 -0.060 0.000 1.264 10 W CA -0.610 56.709 57.345 -0.044 0.000 1.750 10 W CB 0.040 29.468 29.460 -0.053 0.000 1.040 10 W HN 0.057 8.237 8.180 -0.000 0.000 0.742 11 R N 2.365 122.912 120.500 0.079 0.000 2.421 11 R HA 0.070 4.407 4.340 -0.005 0.000 0.305 11 R C -2.242 174.062 176.300 0.006 0.000 1.039 11 R CA -1.530 54.585 56.100 0.025 0.000 1.003 11 R CB 0.284 30.576 30.300 -0.014 0.000 0.959 11 R HN -0.170 8.100 8.270 -0.000 0.000 0.427 12 P HA -0.033 4.387 4.420 -0.000 0.000 0.263 12 P C -0.499 176.786 177.300 -0.025 0.000 1.195 12 P CA 0.212 63.307 63.100 -0.009 0.000 0.762 12 P CB 0.798 32.467 31.700 -0.053 0.000 0.799 13 Q N 0.363 120.157 119.800 -0.010 0.000 2.247 13 Q HA 0.145 4.481 4.340 -0.005 0.000 0.211 13 Q C 0.158 176.175 176.000 0.029 0.000 0.861 13 Q CA 0.631 56.428 55.803 -0.010 0.000 0.949 13 Q CB 0.503 29.223 28.738 -0.030 0.000 1.115 13 Q HN 0.376 8.646 8.270 -0.000 0.000 0.507 14 T N -0.270 114.317 114.554 0.055 0.000 2.893 14 T HA 0.402 4.749 4.350 -0.005 0.000 0.291 14 T C 0.551 175.361 174.700 0.185 0.000 1.028 14 T CA -0.605 61.565 62.100 0.116 0.000 0.995 14 T CB 1.030 69.941 68.868 0.071 0.000 1.051 14 T HN -0.052 8.188 8.240 -0.000 0.000 0.470 15 F N 1.352 121.264 119.950 -0.063 0.000 2.095 15 F HA -0.146 4.378 4.527 -0.005 0.000 0.298 15 F C 2.769 178.536 175.800 -0.055 0.000 1.104 15 F CA 1.229 59.188 58.000 -0.070 0.000 1.232 15 F CB -0.171 38.788 39.000 -0.069 0.000 0.987 15 F HN 0.735 9.035 8.300 -0.000 0.000 0.475 16 A N 0.167 123.080 122.820 0.155 0.000 1.927 16 A HA -0.285 4.032 4.320 -0.005 0.000 0.220 16 A C 1.703 179.302 177.584 0.026 0.000 1.185 16 A CA 2.322 54.401 52.037 0.069 0.000 0.639 16 A CB -0.933 18.104 19.000 0.061 0.000 0.820 16 A HN 0.325 8.475 8.150 -0.000 0.000 0.451 17 D N -0.631 119.785 120.400 0.027 0.000 2.309 17 D HA 0.014 4.651 4.640 -0.005 0.000 0.212 17 D C 0.497 176.770 176.300 -0.045 0.000 0.968 17 D CA 0.444 54.444 54.000 -0.000 0.000 0.882 17 D CB -0.357 40.459 40.800 0.026 0.000 0.918 17 D HN 0.217 8.587 8.370 -0.000 0.000 0.503 18 V N 1.353 121.222 119.914 -0.075 0.000 2.530 18 V HA 0.062 4.179 4.120 -0.005 0.000 0.282 18 V C 0.586 176.613 176.094 -0.111 0.000 1.048 18 V CA -0.592 61.633 62.300 -0.126 0.000 0.997 18 V CB 1.832 33.519 31.823 -0.226 0.000 0.987 18 V HN -0.196 7.994 8.190 -0.000 0.000 0.477 19 V N 5.899 125.750 119.914 -0.104 0.000 2.530 19 V HA 0.571 4.687 4.120 -0.005 0.000 0.282 19 V C 1.207 177.247 176.094 -0.090 0.000 1.048 19 V CA 0.993 63.239 62.300 -0.089 0.000 0.997 19 V CB 0.141 31.920 31.823 -0.074 0.000 0.987 19 V HN 1.294 9.484 8.190 -0.000 0.000 0.477 20 G N 4.024 112.779 108.800 -0.074 0.000 2.581 20 G HA2 -0.292 3.664 3.960 -0.005 0.000 0.291 20 G HA3 -0.292 3.664 3.960 -0.005 0.000 0.291 20 G C 0.209 175.059 174.900 -0.084 0.000 1.277 20 G CA 0.381 45.450 45.100 -0.053 0.000 0.959 20 G HN 1.023 9.313 8.290 -0.000 0.000 0.554 21 Q N -1.431 118.331 119.800 -0.064 0.000 2.481 21 Q HA -0.212 4.125 4.340 -0.005 0.000 0.258 21 Q C 1.314 177.142 176.000 -0.286 0.000 0.961 21 Q CA 2.098 57.783 55.803 -0.197 0.000 1.121 21 Q CB -1.845 26.759 28.738 -0.225 0.000 1.503 21 Q HN 0.969 9.239 8.270 -0.000 0.000 0.544 22 E N -0.112 120.031 120.200 -0.094 0.000 2.333 22 E HA -0.161 4.186 4.350 -0.005 0.000 0.198 22 E C 1.672 178.253 176.600 -0.031 0.000 1.007 22 E CA 1.336 57.706 56.400 -0.051 0.000 0.845 22 E CB -0.187 29.526 29.700 0.021 0.000 0.766 22 E HN 0.736 9.096 8.360 -0.000 0.000 0.507 23 H N -1.318 117.767 119.070 0.024 0.000 2.548 23 H HA 0.162 4.715 4.556 -0.005 0.000 0.265 23 H C 1.580 176.960 175.328 0.088 0.000 0.969 23 H CA 0.371 56.458 56.048 0.065 0.000 1.155 23 H CB 0.131 29.943 29.762 0.083 0.000 1.394 23 H HN 0.039 8.319 8.280 -0.000 0.000 0.570 24 V N 1.069 120.725 119.914 -0.431 0.000 2.627 24 V HA -0.073 4.044 4.120 -0.005 0.000 0.239 24 V C 2.799 178.689 176.094 -0.341 0.000 1.077 24 V CA 0.381 62.456 62.300 -0.375 0.000 1.103 24 V CB -0.284 31.300 31.823 -0.399 0.000 0.802 24 V HN 0.170 8.360 8.190 -0.000 0.000 0.482 25 L N 0.185 121.236 121.223 -0.287 0.000 1.997 25 L HA -0.265 4.072 4.340 -0.005 0.000 0.216 25 L C 2.615 179.488 176.870 0.006 0.000 1.074 25 L CA 2.335 57.071 54.840 -0.174 0.000 0.763 25 L CB -1.195 40.739 42.059 -0.209 0.000 0.890 25 L HN 0.354 8.584 8.230 -0.000 0.000 0.434 26 T N -0.343 114.216 114.554 0.007 0.000 2.720 26 T HA -0.197 4.149 4.350 -0.005 0.000 0.268 26 T C 1.905 176.652 174.700 0.078 0.000 1.037 26 T CA 1.467 63.603 62.100 0.060 0.000 1.144 26 T CB -0.221 68.685 68.868 0.064 0.000 0.864 26 T HN 0.490 8.730 8.240 -0.000 0.000 0.444 27 A N 0.716 123.579 122.820 0.072 0.000 1.968 27 A HA 0.150 4.466 4.320 -0.005 0.000 0.217 27 A C 2.289 179.947 177.584 0.123 0.000 1.169 27 A CA 0.783 52.901 52.037 0.134 0.000 0.638 27 A CB -0.597 18.553 19.000 0.251 0.000 0.812 27 A HN 0.447 8.597 8.150 -0.000 0.000 0.446 28 L N -0.730 120.503 121.223 0.016 0.000 2.017 28 L HA -0.206 4.131 4.340 -0.005 0.000 0.208 28 L C 3.160 180.111 176.870 0.135 0.000 1.073 28 L CA 1.137 56.031 54.840 0.090 0.000 0.745 28 L CB -0.762 41.334 42.059 0.060 0.000 0.894 28 L HN 0.463 8.693 8.230 -0.000 0.000 0.432 29 A N 0.787 123.694 122.820 0.144 0.000 1.849 29 A HA -0.283 4.034 4.320 -0.005 0.000 0.217 29 A C 1.975 179.596 177.584 0.061 0.000 1.202 29 A CA 2.413 54.495 52.037 0.076 0.000 0.629 29 A CB -0.865 18.188 19.000 0.088 0.000 0.834 29 A HN 0.451 8.601 8.150 -0.000 0.000 0.447 30 N N 0.065 118.815 118.700 0.084 0.000 2.205 30 N HA -0.095 4.642 4.740 -0.005 0.000 0.186 30 N C 1.685 177.260 175.510 0.108 0.000 1.015 30 N CA 1.414 54.515 53.050 0.085 0.000 0.862 30 N CB -0.750 37.791 38.487 0.090 0.000 0.986 30 N HN 0.533 8.913 8.380 -0.000 0.000 0.429 31 G N 0.635 109.526 108.800 0.151 0.000 2.394 31 G HA2 -0.103 3.854 3.960 -0.005 0.000 0.215 31 G HA3 -0.103 3.854 3.960 -0.005 0.000 0.215 31 G C 1.617 176.610 174.900 0.154 0.000 1.165 31 G CA 0.286 45.505 45.100 0.198 0.000 0.784 31 G HN 0.213 8.503 8.290 -0.000 0.000 0.535 32 L N 0.613 121.904 121.223 0.114 0.000 1.976 32 L HA -0.097 4.240 4.340 -0.005 0.000 0.209 32 L C 3.071 179.974 176.870 0.055 0.000 1.071 32 L CA 1.404 56.284 54.840 0.068 0.000 0.746 32 L CB -0.762 41.299 42.059 0.003 0.000 0.890 32 L HN 0.326 8.556 8.230 -0.000 0.000 0.432 33 S N 0.256 115.978 115.700 0.037 0.000 2.378 33 S HA -0.202 4.265 4.470 -0.005 0.000 0.229 33 S C 1.537 176.164 174.600 0.045 0.000 1.052 33 S CA 1.592 59.809 58.200 0.030 0.000 1.084 33 S CB -0.309 62.905 63.200 0.024 0.000 0.950 33 S HN 0.334 8.644 8.310 -0.000 0.000 0.440 34 L N 0.844 122.103 121.223 0.061 0.000 2.783 34 L HA 0.351 4.688 4.340 -0.005 0.000 0.236 34 L C 1.412 178.322 176.870 0.065 0.000 1.225 34 L CA 0.209 55.085 54.840 0.059 0.000 1.026 34 L CB -0.182 41.914 42.059 0.061 0.000 1.314 34 L HN 0.554 8.784 8.230 -0.000 0.000 0.489 35 G N 0.804 109.648 108.800 0.074 0.000 2.168 35 G HA2 -0.324 3.633 3.960 -0.005 0.000 0.257 35 G HA3 -0.324 3.633 3.960 -0.005 0.000 0.257 35 G C 0.466 175.416 174.900 0.084 0.000 0.997 35 G CA -0.053 45.095 45.100 0.080 0.000 0.708 35 G HN 0.474 8.764 8.290 -0.000 0.000 0.520 36 R N 0.480 121.038 120.500 0.098 0.000 2.755 36 R HA 0.328 4.665 4.340 -0.005 0.000 0.268 36 R C 0.185 176.572 176.300 0.146 0.000 1.295 36 R CA -0.482 55.662 56.100 0.073 0.000 1.379 36 R CB 0.324 30.671 30.300 0.080 0.000 1.170 36 R HN 0.261 8.531 8.270 -0.000 0.000 0.584 37 I N 2.990 123.643 120.570 0.139 0.000 2.312 37 I HA 0.220 4.387 4.170 -0.005 0.000 0.290 37 I C 0.408 176.670 176.117 0.242 0.000 1.008 37 I CA -0.983 60.480 61.300 0.272 0.000 1.226 37 I CB 0.464 38.563 38.000 0.167 0.000 1.371 37 I HN 0.353 8.563 8.210 -0.000 0.000 0.468 38 H N 4.235 123.462 119.070 0.261 0.000 2.671 38 H HA 0.156 4.709 4.556 -0.005 0.000 0.372 38 H C 1.026 176.491 175.328 0.229 0.000 1.227 38 H CA -0.192 55.922 56.048 0.111 0.000 1.426 38 H CB 0.302 29.887 29.762 -0.294 0.000 1.480 38 H HN 0.599 8.879 8.280 -0.000 0.000 0.611 39 H N -0.720 118.487 119.070 0.229 0.000 2.548 39 H HA 0.525 5.078 4.556 -0.005 0.000 0.268 39 H C -0.141 175.372 175.328 0.308 0.000 0.975 39 H CA 0.287 56.469 56.048 0.223 0.000 1.195 39 H CB 0.530 30.392 29.762 0.167 0.000 1.397 39 H HN 0.523 8.803 8.280 -0.000 0.000 0.572 40 A N 0.639 123.426 122.820 -0.055 0.000 2.485 40 A HA 0.441 4.757 4.320 -0.005 0.000 0.285 40 A C -1.927 175.631 177.584 -0.043 0.000 1.045 40 A CA -0.778 51.295 52.037 0.060 0.000 0.792 40 A CB 0.556 19.502 19.000 -0.090 0.000 1.307 40 A HN 0.205 8.355 8.150 -0.000 0.000 0.406 41 Y N 1.183 121.446 120.300 -0.061 0.000 2.387 41 Y HA 0.680 5.227 4.550 -0.005 0.000 0.336 41 Y C -0.064 175.689 175.900 -0.244 0.000 1.067 41 Y CA -1.209 56.769 58.100 -0.203 0.000 1.114 41 Y CB 1.980 40.325 38.460 -0.190 0.000 1.208 41 Y HN 0.636 8.916 8.280 -0.000 0.000 0.458 42 L N 4.094 125.158 121.223 -0.265 0.000 2.343 42 L HA 0.624 4.961 4.340 -0.005 0.000 0.278 42 L C -1.966 174.752 176.870 -0.253 0.000 0.996 42 L CA -0.790 53.951 54.840 -0.164 0.000 0.831 42 L CB 0.206 42.207 42.059 -0.097 0.000 1.232 42 L HN 0.355 8.585 8.230 -0.000 0.000 0.413 43 F N 3.841 123.891 119.950 0.167 0.000 2.411 43 F HA 0.724 5.248 4.527 -0.006 0.000 0.352 43 F C 0.657 176.523 175.800 0.110 0.000 1.123 43 F CA -0.123 57.967 58.000 0.149 0.000 1.044 43 F CB 1.808 40.870 39.000 0.104 0.000 1.135 43 F HN 0.635 8.935 8.300 -0.000 0.000 0.461 44 S N 1.573 117.427 115.700 0.257 0.000 2.704 44 S HA 1.027 5.493 4.470 -0.005 0.000 0.296 44 S C -0.325 174.285 174.600 0.015 0.000 1.138 44 S CA -0.408 57.898 58.200 0.175 0.000 0.875 44 S CB 1.988 65.326 63.200 0.230 0.000 1.151 44 S HN 1.447 9.757 8.310 -0.000 0.000 0.500 45 G N 0.223 109.004 108.800 -0.033 0.000 2.353 45 G HA2 0.341 4.298 3.960 -0.005 0.000 0.424 45 G HA3 0.341 4.298 3.960 -0.005 0.000 0.424 45 G C -0.473 174.407 174.900 -0.032 0.000 1.320 45 G CA -0.337 44.642 45.100 -0.201 0.000 0.995 45 G HN 1.388 9.678 8.290 -0.000 0.000 0.580 46 T N 0.030 114.565 114.554 -0.031 0.000 2.754 46 T HA 0.551 4.898 4.350 -0.005 0.000 0.286 46 T C 1.009 175.709 174.700 0.000 0.000 0.997 46 T CA -0.105 61.996 62.100 0.002 0.000 0.982 46 T CB 0.603 69.475 68.868 0.006 0.000 1.027 46 T HN 1.217 9.457 8.240 -0.000 0.000 0.529 47 R N 0.440 120.944 120.500 0.007 0.000 2.481 47 R HA 0.119 4.455 4.340 -0.005 0.000 0.291 47 R C 0.765 177.065 176.300 -0.001 0.000 0.934 47 R CA 0.691 56.796 56.100 0.008 0.000 1.116 47 R CB -1.644 28.661 30.300 0.009 0.000 0.895 47 R HN 1.435 9.705 8.270 -0.000 0.000 0.410 48 G N 2.125 110.923 108.800 -0.003 0.000 2.333 48 G HA2 -0.211 3.746 3.960 -0.005 0.000 0.296 48 G HA3 -0.211 3.746 3.960 -0.005 0.000 0.296 48 G C 0.100 174.985 174.900 -0.024 0.000 1.059 48 G CA 0.072 45.165 45.100 -0.011 0.000 1.050 48 G HN 0.553 8.843 8.290 -0.000 0.000 0.508 49 V N -1.075 118.818 119.914 -0.034 0.000 3.432 49 V HA 0.589 4.706 4.120 -0.005 0.000 0.298 49 V C 1.854 177.905 176.094 -0.072 0.000 1.464 49 V CA 0.971 63.243 62.300 -0.047 0.000 1.046 49 V CB 0.437 32.233 31.823 -0.045 0.000 0.887 49 V HN 1.916 10.106 8.190 -0.000 0.000 0.441 50 G N 0.256 109.008 108.800 -0.080 0.000 2.273 50 G HA2 -0.173 3.784 3.960 -0.005 0.000 0.162 50 G HA3 -0.173 3.784 3.960 -0.005 0.000 0.162 50 G C 0.845 175.651 174.900 -0.157 0.000 1.006 50 G CA 0.264 45.288 45.100 -0.126 0.000 0.704 50 G HN 0.291 8.581 8.290 -0.000 0.000 0.487 51 K N 0.220 120.562 120.400 -0.096 0.000 2.015 51 K HA -0.171 4.146 4.320 -0.005 0.000 0.216 51 K C 2.853 179.365 176.600 -0.148 0.000 1.052 51 K CA 2.504 58.750 56.287 -0.068 0.000 0.937 51 K CB -0.286 32.235 32.500 0.035 0.000 0.719 51 K HN 0.534 8.784 8.250 -0.000 0.000 0.446 52 T N -2.117 112.381 114.554 -0.095 0.000 3.054 52 T HA 0.055 4.402 4.350 -0.005 0.000 0.259 52 T C 2.007 176.610 174.700 -0.162 0.000 1.092 52 T CA 1.016 63.054 62.100 -0.103 0.000 1.121 52 T CB 0.130 68.981 68.868 -0.029 0.000 0.912 52 T HN -0.035 8.205 8.240 -0.000 0.000 0.489 53 S N 1.417 117.018 115.700 -0.164 0.000 2.356 53 S HA 0.063 4.530 4.470 -0.005 0.000 0.223 53 S C 1.886 176.329 174.600 -0.263 0.000 1.032 53 S CA 1.386 59.483 58.200 -0.172 0.000 1.005 53 S CB -0.426 62.686 63.200 -0.146 0.000 0.867 53 S HN 0.529 8.839 8.310 -0.000 0.000 0.449 54 I N 1.510 121.844 120.570 -0.393 0.000 2.315 54 I HA -0.168 3.999 4.170 -0.005 0.000 0.248 54 I C 2.726 178.467 176.117 -0.627 0.000 1.117 54 I CA 0.926 61.885 61.300 -0.569 0.000 1.404 54 I CB -0.749 36.823 38.000 -0.713 0.000 1.071 54 I HN 0.251 8.461 8.210 -0.000 0.000 0.419 55 A N 1.413 123.819 122.820 -0.691 0.000 1.903 55 A HA -0.252 4.065 4.320 -0.005 0.000 0.219 55 A C 2.378 179.840 177.584 -0.204 0.000 1.191 55 A CA 1.787 53.565 52.037 -0.433 0.000 0.638 55 A CB -0.701 18.188 19.000 -0.186 0.000 0.823 55 A HN 0.359 8.509 8.150 -0.000 0.000 0.451 56 R N -0.712 119.687 120.500 -0.168 0.000 2.189 56 R HA 0.043 4.380 4.340 -0.005 0.000 0.223 56 R C 1.886 178.131 176.300 -0.091 0.000 1.092 56 R CA 0.969 57.005 56.100 -0.108 0.000 0.989 56 R CB -0.365 29.882 30.300 -0.088 0.000 0.876 56 R HN 0.546 8.816 8.270 -0.000 0.000 0.457 57 L N -0.174 120.996 121.223 -0.089 0.000 2.084 57 L HA -0.106 4.230 4.340 -0.005 0.000 0.202 57 L C 2.202 179.136 176.870 0.106 0.000 1.074 57 L CA 0.417 55.297 54.840 0.067 0.000 0.757 57 L CB -0.463 41.686 42.059 0.149 0.000 0.918 57 L HN 0.132 8.362 8.230 -0.000 0.000 0.444 58 L N 0.650 121.898 121.223 0.041 0.000 2.197 58 L HA -0.238 4.099 4.340 -0.005 0.000 0.215 58 L C 2.503 179.331 176.870 -0.071 0.000 1.095 58 L CA 1.968 56.803 54.840 -0.008 0.000 0.764 58 L CB -0.631 41.376 42.059 -0.088 0.000 0.897 58 L HN 0.207 8.437 8.230 -0.000 0.000 0.436 59 A N -1.251 121.522 122.820 -0.079 0.000 1.898 59 A HA -0.149 4.168 4.320 -0.005 0.000 0.214 59 A C 2.302 179.801 177.584 -0.142 0.000 1.183 59 A CA 1.413 53.388 52.037 -0.103 0.000 0.622 59 A CB -0.324 18.614 19.000 -0.103 0.000 0.824 59 A HN 0.435 8.585 8.150 -0.000 0.000 0.444 60 K N -0.546 119.771 120.400 -0.139 0.000 2.002 60 K HA -0.090 4.227 4.320 -0.005 0.000 0.209 60 K C 2.017 178.536 176.600 -0.135 0.000 1.048 60 K CA 1.249 57.437 56.287 -0.166 0.000 0.930 60 K CB -0.496 31.933 32.500 -0.119 0.000 0.714 60 K HN 0.438 8.688 8.250 -0.000 0.000 0.438 61 G N 0.888 109.615 108.800 -0.121 0.000 2.498 61 G HA2 -0.181 3.776 3.960 -0.005 0.000 0.219 61 G HA3 -0.181 3.776 3.960 -0.005 0.000 0.219 61 G C 1.317 176.170 174.900 -0.077 0.000 1.119 61 G CA 0.315 45.325 45.100 -0.149 0.000 0.766 61 G HN 0.109 8.399 8.290 -0.000 0.000 0.552 62 L N -0.455 120.739 121.223 -0.048 0.000 2.446 62 L HA 0.176 4.513 4.340 -0.005 0.000 0.219 62 L C 1.475 178.442 176.870 0.162 0.000 1.116 62 L CA 0.539 55.406 54.840 0.045 0.000 0.844 62 L CB 0.105 42.147 42.059 -0.029 0.000 0.970 62 L HN 0.133 8.363 8.230 -0.000 0.000 0.457 63 N N -1.815 116.906 118.700 0.035 0.000 2.143 63 N HA 0.038 4.775 4.740 -0.005 0.000 0.229 63 N C 0.004 175.500 175.510 -0.023 0.000 1.294 63 N CA -0.150 52.923 53.050 0.037 0.000 0.883 63 N CB 0.451 38.914 38.487 -0.040 0.000 1.148 63 N HN 0.072 8.452 8.380 -0.000 0.000 0.511 64 C N 1.538 120.809 119.300 -0.049 0.000 2.597 64 C HA -0.007 4.450 4.460 -0.005 0.000 0.412 64 C C 2.092 177.072 174.990 -0.017 0.000 1.348 64 C CA 0.250 59.236 59.018 -0.054 0.000 1.769 64 C CB 0.067 27.768 27.740 -0.065 0.000 2.641 64 C HN 0.464 8.694 8.230 -0.000 0.000 0.612 65 E N 0.898 121.092 120.200 -0.010 0.000 2.204 65 E HA -0.170 4.177 4.350 -0.005 0.000 0.195 65 E C 2.123 178.721 176.600 -0.004 0.000 0.990 65 E CA 1.821 58.224 56.400 0.005 0.000 0.821 65 E CB 0.009 29.717 29.700 0.012 0.000 0.750 65 E HN 1.003 9.363 8.360 -0.000 0.000 0.477 66 T N -2.103 112.442 114.554 -0.014 0.000 2.951 66 T HA 0.132 4.479 4.350 -0.005 0.000 0.268 66 T C 0.899 175.591 174.700 -0.014 0.000 1.073 66 T CA 0.789 62.879 62.100 -0.016 0.000 1.134 66 T CB 0.345 69.198 68.868 -0.026 0.000 0.884 66 T HN 0.270 8.510 8.240 -0.000 0.000 0.479 67 G N 0.394 109.186 108.800 -0.012 0.000 2.346 67 G HA2 0.190 4.147 3.960 -0.005 0.000 0.294 67 G HA3 0.190 4.147 3.960 -0.005 0.000 0.294 67 G C -1.279 173.621 174.900 0.001 0.000 1.294 67 G CA -0.699 44.399 45.100 -0.003 0.000 0.962 67 G HN 0.436 8.726 8.290 -0.000 0.000 0.508 68 I N 1.517 122.101 120.570 0.024 0.000 2.421 68 I HA 0.459 4.626 4.170 -0.005 0.000 0.291 68 I C 0.587 176.697 176.117 -0.012 0.000 1.089 68 I CA 0.407 61.728 61.300 0.036 0.000 1.354 68 I CB 0.958 39.015 38.000 0.096 0.000 1.413 68 I HN 0.544 8.754 8.210 -0.000 0.000 0.513 69 T N 4.025 118.540 114.554 -0.065 0.000 2.982 69 T HA 0.460 4.807 4.350 -0.005 0.000 0.321 69 T C 0.623 175.184 174.700 -0.232 0.000 1.229 69 T CA -0.135 61.896 62.100 -0.114 0.000 1.044 69 T CB 1.701 70.506 68.868 -0.105 0.000 1.184 69 T HN 0.594 8.834 8.240 -0.000 0.000 0.477 70 A N 2.111 124.787 122.820 -0.240 0.000 2.067 70 A HA 0.129 4.446 4.320 -0.005 0.000 0.219 70 A C 1.380 178.635 177.584 -0.548 0.000 1.158 70 A CA 1.666 53.461 52.037 -0.403 0.000 0.661 70 A CB -0.518 18.367 19.000 -0.193 0.000 0.801 70 A HN 0.980 9.130 8.150 -0.000 0.000 0.452 71 T N -0.960 113.400 114.554 -0.323 0.000 3.350 71 T HA 0.427 4.774 4.350 -0.005 0.000 0.246 71 T C -2.596 171.986 174.700 -0.196 0.000 1.284 71 T CA -1.782 60.176 62.100 -0.237 0.000 1.329 71 T CB 0.296 69.092 68.868 -0.121 0.000 1.033 71 T HN 0.196 8.436 8.240 -0.000 0.000 0.632 72 P HA 0.025 4.445 4.420 -0.000 0.000 0.269 72 P C 1.279 178.519 177.300 -0.100 0.000 1.205 72 P CA -0.247 62.756 63.100 -0.162 0.000 0.780 72 P CB 0.606 32.204 31.700 -0.171 0.000 0.858 73 C N -1.268 117.988 119.300 -0.073 0.000 2.634 73 C HA 0.394 4.851 4.460 -0.005 0.000 0.268 73 C C 1.924 176.892 174.990 -0.036 0.000 1.322 73 C CA 0.523 59.512 59.018 -0.048 0.000 1.737 73 C CB -1.370 26.347 27.740 -0.038 0.000 1.976 73 C HN 0.751 8.981 8.230 -0.000 0.000 0.547 74 G N 1.031 109.805 108.800 -0.043 0.000 2.186 74 G HA2 -0.295 3.661 3.960 -0.005 0.000 0.266 74 G HA3 -0.295 3.661 3.960 -0.005 0.000 0.266 74 G C 0.817 175.699 174.900 -0.029 0.000 0.982 74 G CA 1.425 46.503 45.100 -0.037 0.000 0.670 74 G HN 1.654 9.944 8.290 -0.000 0.000 0.533 75 V N -2.730 117.168 119.914 -0.026 0.000 3.431 75 V HA 0.301 4.418 4.120 -0.005 0.000 0.255 75 V C 1.970 178.057 176.094 -0.011 0.000 1.403 75 V CA 0.749 63.039 62.300 -0.017 0.000 1.101 75 V CB -0.726 31.089 31.823 -0.013 0.000 0.891 75 V HN 1.330 9.520 8.190 -0.000 0.000 0.446 76 C N 1.168 120.460 119.300 -0.014 0.000 2.727 76 C HA 0.288 4.745 4.460 -0.005 0.000 0.401 76 C C 1.823 176.819 174.990 0.011 0.000 1.294 76 C CA 0.525 59.541 59.018 -0.002 0.000 2.134 76 C CB 0.250 27.987 27.740 -0.005 0.000 2.724 76 C HN 0.594 8.824 8.230 -0.000 0.000 0.677 77 D N 1.506 121.924 120.400 0.029 0.000 2.149 77 D HA -0.147 4.490 4.640 -0.005 0.000 0.194 77 D C 1.770 178.128 176.300 0.097 0.000 1.001 77 D CA 2.036 56.069 54.000 0.054 0.000 0.849 77 D CB -0.327 40.507 40.800 0.057 0.000 0.939 77 D HN 0.727 9.097 8.370 -0.000 0.000 0.449 78 N N -0.406 118.361 118.700 0.110 0.000 2.223 78 N HA -0.096 4.641 4.740 -0.005 0.000 0.185 78 N C 1.855 177.300 175.510 -0.107 0.000 1.016 78 N CA 0.574 53.688 53.050 0.107 0.000 0.863 78 N CB -0.522 38.005 38.487 0.067 0.000 0.983 78 N HN 0.252 8.632 8.380 -0.000 0.000 0.429 79 C N 0.101 119.356 119.300 -0.076 0.000 2.492 79 C HA 0.167 4.623 4.460 -0.005 0.000 0.279 79 C C 2.495 177.448 174.990 -0.062 0.000 1.335 79 C CA -0.010 58.947 59.018 -0.101 0.000 1.734 79 C CB -0.582 27.111 27.740 -0.078 0.000 2.027 79 C HN 0.442 8.672 8.230 -0.000 0.000 0.496 80 R N 0.714 121.199 120.500 -0.025 0.000 2.119 80 R HA -0.056 4.281 4.340 -0.005 0.000 0.222 80 R C 2.037 178.342 176.300 0.009 0.000 1.088 80 R CA 0.876 56.968 56.100 -0.013 0.000 0.984 80 R CB -0.215 30.082 30.300 -0.005 0.000 0.884 80 R HN 0.608 8.878 8.270 -0.000 0.000 0.447 81 E N 0.598 120.827 120.200 0.049 0.000 2.110 81 E HA -0.177 4.169 4.350 -0.005 0.000 0.193 81 E C 1.823 178.486 176.600 0.106 0.000 0.988 81 E CA 1.097 57.569 56.400 0.120 0.000 0.804 81 E CB 0.053 29.922 29.700 0.281 0.000 0.745 81 E HN 0.335 8.695 8.360 -0.000 0.000 0.458 82 I N 0.320 120.889 120.570 -0.000 0.000 2.333 82 I HA -0.173 3.994 4.170 -0.005 0.000 0.246 82 I C 2.516 178.612 176.117 -0.035 0.000 1.106 82 I CA 0.710 61.980 61.300 -0.050 0.000 1.411 82 I CB -0.237 37.628 38.000 -0.226 0.000 1.082 82 I HN 0.108 8.318 8.210 -0.000 0.000 0.420 83 E N 0.864 121.037 120.200 -0.045 0.000 2.097 83 E HA -0.274 4.073 4.350 -0.005 0.000 0.196 83 E C 2.237 178.820 176.600 -0.027 0.000 1.000 83 E CA 1.349 57.725 56.400 -0.040 0.000 0.804 83 E CB 0.164 29.838 29.700 -0.044 0.000 0.740 83 E HN 0.390 8.750 8.360 -0.000 0.000 0.454 84 Q N -1.231 118.562 119.800 -0.011 0.000 1.967 84 Q HA -0.088 4.249 4.340 -0.005 0.000 0.202 84 Q C 1.825 177.826 176.000 0.001 0.000 0.985 84 Q CA 1.920 57.721 55.803 -0.004 0.000 0.839 84 Q CB 0.066 28.809 28.738 0.009 0.000 0.906 84 Q HN 0.514 8.784 8.270 -0.000 0.000 0.423 85 G N -0.924 107.887 108.800 0.018 0.000 3.465 85 G HA2 -0.098 3.859 3.960 -0.005 0.000 0.219 85 G HA3 -0.098 3.859 3.960 -0.005 0.000 0.219 85 G C 0.236 175.159 174.900 0.039 0.000 0.984 85 G CA -0.483 44.629 45.100 0.020 0.000 0.864 85 G HN 0.134 8.424 8.290 -0.000 0.000 0.485 86 R N 0.414 120.945 120.500 0.051 0.000 2.423 86 R HA 0.548 4.885 4.340 -0.005 0.000 0.293 86 R C -1.607 174.757 176.300 0.106 0.000 1.196 86 R CA -0.566 55.565 56.100 0.051 0.000 1.262 86 R CB 0.392 30.701 30.300 0.014 0.000 1.116 86 R HN 0.138 8.408 8.270 -0.000 0.000 0.566 87 F N 2.710 122.641 119.950 -0.032 0.000 2.427 87 F HA 0.180 4.704 4.527 -0.005 0.000 0.348 87 F C 0.971 176.747 175.800 -0.041 0.000 1.125 87 F CA -0.791 57.190 58.000 -0.032 0.000 0.989 87 F CB 1.284 40.266 39.000 -0.030 0.000 1.165 87 F HN 0.089 8.389 8.300 -0.000 0.000 0.442 88 V N 3.698 123.279 119.914 -0.554 0.000 2.660 88 V HA -0.241 3.876 4.120 -0.005 0.000 0.257 88 V C 0.876 176.766 176.094 -0.340 0.000 1.088 88 V CA 2.011 64.074 62.300 -0.395 0.000 1.106 88 V CB -0.559 31.034 31.823 -0.384 0.000 0.686 88 V HN 0.714 8.904 8.190 -0.000 0.000 0.481 89 D N -0.608 119.519 120.400 -0.456 0.000 2.501 89 D HA 0.228 4.865 4.640 -0.005 0.000 0.224 89 D C -0.095 176.323 176.300 0.197 0.000 1.202 89 D CA -0.106 53.853 54.000 -0.067 0.000 0.829 89 D CB 1.101 41.904 40.800 0.005 0.000 1.023 89 D HN 0.295 8.665 8.370 -0.000 0.000 0.499 90 L N 1.702 123.106 121.223 0.302 0.000 2.337 90 L HA 0.427 4.764 4.340 -0.005 0.000 0.269 90 L C -0.846 176.023 176.870 -0.001 0.000 1.018 90 L CA -0.526 54.401 54.840 0.147 0.000 0.876 90 L CB 0.477 42.647 42.059 0.185 0.000 1.236 90 L HN -0.153 8.077 8.230 -0.000 0.000 0.436 91 I N 4.049 124.528 120.570 -0.151 0.000 2.281 91 I HA 0.236 4.403 4.170 -0.005 0.000 0.293 91 I C 0.405 176.485 176.117 -0.061 0.000 1.085 91 I CA 0.032 61.233 61.300 -0.164 0.000 1.257 91 I CB 0.541 38.303 38.000 -0.395 0.000 1.430 91 I HN 0.579 8.789 8.210 -0.000 0.000 0.489 92 E N 6.592 126.789 120.200 -0.004 0.000 2.014 92 E HA 0.284 4.631 4.350 -0.005 0.000 0.275 92 E C -0.769 175.859 176.600 0.047 0.000 0.997 92 E CA -0.887 55.533 56.400 0.033 0.000 0.804 92 E CB 0.708 30.423 29.700 0.026 0.000 1.090 92 E HN 0.375 8.735 8.360 -0.000 0.000 0.401 93 I N 4.183 124.802 120.570 0.081 0.000 2.371 93 I HA 0.004 4.170 4.170 -0.005 0.000 0.290 93 I C 0.184 176.335 176.117 0.056 0.000 1.028 93 I CA -0.492 60.854 61.300 0.078 0.000 1.345 93 I CB 1.191 39.263 38.000 0.120 0.000 1.407 93 I HN 0.417 8.627 8.210 -0.000 0.000 0.501 94 D N 6.497 126.916 120.400 0.033 0.000 2.483 94 D HA 0.217 4.854 4.640 -0.005 0.000 0.220 94 D C 0.926 177.225 176.300 -0.002 0.000 1.173 94 D CA -0.144 53.865 54.000 0.016 0.000 0.964 94 D CB 0.758 41.564 40.800 0.011 0.000 1.046 94 D HN 0.608 8.978 8.370 -0.000 0.000 0.517 95 A N 3.104 125.917 122.820 -0.012 0.000 2.216 95 A HA 0.111 4.427 4.320 -0.005 0.000 0.214 95 A C 1.948 179.478 177.584 -0.090 0.000 1.160 95 A CA 1.174 53.183 52.037 -0.047 0.000 0.725 95 A CB -0.087 18.881 19.000 -0.053 0.000 0.784 95 A HN 0.561 8.711 8.150 -0.000 0.000 0.472 96 A N -0.321 122.449 122.820 -0.082 0.000 2.030 96 A HA 0.122 4.438 4.320 -0.005 0.000 0.215 96 A C 2.120 179.676 177.584 -0.048 0.000 1.164 96 A CA 1.400 53.385 52.037 -0.088 0.000 0.697 96 A CB -0.279 18.677 19.000 -0.072 0.000 0.827 96 A HN 0.602 8.752 8.150 -0.000 0.000 0.457 97 S N -0.847 114.835 115.700 -0.031 0.000 2.535 97 S HA 0.257 4.724 4.470 -0.005 0.000 0.214 97 S C 0.695 175.283 174.600 -0.021 0.000 0.980 97 S CA -0.312 57.877 58.200 -0.019 0.000 0.907 97 S CB 0.289 63.484 63.200 -0.008 0.000 0.790 97 S HN 0.362 8.672 8.310 -0.000 0.000 0.510 98 R N 2.147 122.630 120.500 -0.028 0.000 2.513 98 R HA 0.299 4.635 4.340 -0.005 0.000 0.283 98 R C 0.068 176.339 176.300 -0.048 0.000 1.535 98 R CA 0.295 56.380 56.100 -0.025 0.000 1.315 98 R CB 0.857 31.153 30.300 -0.007 0.000 1.163 98 R HN 0.487 8.757 8.270 -0.000 0.000 0.573 99 T N -2.763 111.755 114.554 -0.060 0.000 2.954 99 T HA 0.211 4.558 4.350 -0.005 0.000 0.252 99 T C 0.711 175.357 174.700 -0.090 0.000 0.983 99 T CA -0.098 61.944 62.100 -0.096 0.000 0.941 99 T CB 0.778 69.586 68.868 -0.100 0.000 1.141 99 T HN 0.116 8.356 8.240 -0.000 0.000 0.500 100 K N 0.736 121.100 120.400 -0.060 0.000 2.187 100 K HA 0.388 4.705 4.320 -0.005 0.000 0.247 100 K C 0.985 177.558 176.600 -0.044 0.000 1.019 100 K CA -0.248 56.008 56.287 -0.052 0.000 0.893 100 K CB 0.828 33.303 32.500 -0.042 0.000 1.025 100 K HN -0.161 8.089 8.250 -0.000 0.000 0.500 101 V N 1.185 121.077 119.914 -0.036 0.000 2.407 101 V HA -0.164 3.953 4.120 -0.005 0.000 0.245 101 V C 2.131 178.224 176.094 -0.002 0.000 1.041 101 V CA 1.515 63.810 62.300 -0.008 0.000 1.040 101 V CB -0.420 31.418 31.823 0.026 0.000 0.671 101 V HN 0.784 8.974 8.190 -0.000 0.000 0.455 102 E N 0.178 120.373 120.200 -0.009 0.000 2.136 102 E HA -0.340 4.007 4.350 -0.005 0.000 0.208 102 E C 1.728 178.332 176.600 0.007 0.000 1.035 102 E CA 2.188 58.587 56.400 -0.000 0.000 0.838 102 E CB -0.075 29.621 29.700 -0.007 0.000 0.748 102 E HN 0.637 8.997 8.360 -0.000 0.000 0.459 103 D N -1.246 119.155 120.400 0.001 0.000 2.224 103 D HA -0.079 4.558 4.640 -0.005 0.000 0.205 103 D C 1.725 178.037 176.300 0.020 0.000 0.965 103 D CA 1.141 55.147 54.000 0.009 0.000 0.852 103 D CB -0.211 40.588 40.800 -0.002 0.000 0.947 103 D HN 0.145 8.515 8.370 -0.000 0.000 0.494 104 T N -0.089 114.471 114.554 0.011 0.000 2.939 104 T HA 0.031 4.378 4.350 -0.005 0.000 0.254 104 T C 1.918 176.639 174.700 0.036 0.000 1.041 104 T CA 0.296 62.408 62.100 0.019 0.000 1.142 104 T CB 0.157 69.019 68.868 -0.010 0.000 0.874 104 T HN 0.021 8.261 8.240 -0.000 0.000 0.452 105 R N 1.097 121.616 120.500 0.032 0.000 2.103 105 R HA -0.132 4.205 4.340 -0.005 0.000 0.242 105 R C 2.002 178.333 176.300 0.053 0.000 1.142 105 R CA 1.788 57.913 56.100 0.041 0.000 0.960 105 R CB -0.213 30.109 30.300 0.037 0.000 0.858 105 R HN 0.308 8.578 8.270 -0.000 0.000 0.439 106 D N 0.102 120.531 120.400 0.049 0.000 2.123 106 D HA -0.122 4.514 4.640 -0.005 0.000 0.200 106 D C 1.717 178.065 176.300 0.080 0.000 0.976 106 D CA 0.588 54.621 54.000 0.056 0.000 0.831 106 D CB -0.214 40.609 40.800 0.040 0.000 0.974 106 D HN 0.030 8.400 8.370 -0.000 0.000 0.469 107 L N 0.645 121.922 121.223 0.091 0.000 1.990 107 L HA -0.133 4.204 4.340 -0.005 0.000 0.213 107 L C 1.883 178.851 176.870 0.163 0.000 1.072 107 L CA 1.630 56.558 54.840 0.148 0.000 0.755 107 L CB -0.533 41.623 42.059 0.163 0.000 0.889 107 L HN 0.050 8.280 8.230 -0.000 0.000 0.432 108 L N -0.624 120.662 121.223 0.106 0.000 2.551 108 L HA -0.113 4.224 4.340 -0.005 0.000 0.228 108 L C 1.629 178.568 176.870 0.114 0.000 1.153 108 L CA 0.431 55.320 54.840 0.083 0.000 0.851 108 L CB -0.804 41.284 42.059 0.049 0.000 0.959 108 L HN 0.301 8.531 8.230 -0.000 0.000 0.451 109 D N -0.078 120.398 120.400 0.127 0.000 2.277 109 D HA -0.108 4.529 4.640 -0.005 0.000 0.208 109 D C 1.600 178.050 176.300 0.250 0.000 0.962 109 D CA 0.812 54.906 54.000 0.157 0.000 0.865 109 D CB -0.018 40.857 40.800 0.125 0.000 0.939 109 D HN 0.151 8.521 8.370 -0.000 0.000 0.510 110 N N -0.150 118.687 118.700 0.228 0.000 2.336 110 N HA -0.032 4.705 4.740 -0.005 0.000 0.189 110 N C 1.445 177.178 175.510 0.372 0.000 1.113 110 N CA -0.042 53.180 53.050 0.286 0.000 0.858 110 N CB 0.461 39.033 38.487 0.142 0.000 0.970 110 N HN -0.015 8.365 8.380 -0.000 0.000 0.471 111 V N 0.186 120.275 119.914 0.292 0.000 2.626 111 V HA -0.194 3.923 4.120 -0.005 0.000 0.252 111 V C 2.200 178.429 176.094 0.225 0.000 1.067 111 V CA 1.620 64.050 62.300 0.217 0.000 1.081 111 V CB -0.010 31.834 31.823 0.035 0.000 0.686 111 V HN 0.218 8.408 8.190 -0.000 0.000 0.468 112 Q N -0.041 119.912 119.800 0.254 0.000 2.083 112 Q HA -0.056 4.281 4.340 -0.005 0.000 0.198 112 Q C 0.364 176.477 176.000 0.189 0.000 0.969 112 Q CA 1.049 56.958 55.803 0.175 0.000 0.838 112 Q CB -0.448 28.286 28.738 -0.006 0.000 0.900 112 Q HN 0.699 8.969 8.270 -0.000 0.000 0.436 113 Y N 0.682 121.097 120.300 0.191 0.000 2.811 113 Y HA 0.155 4.702 4.550 -0.005 0.000 0.334 113 Y C 0.805 176.846 175.900 0.235 0.000 1.247 113 Y CA -0.257 57.936 58.100 0.155 0.000 1.526 113 Y CB 0.077 38.598 38.460 0.101 0.000 1.284 113 Y HN 0.181 8.461 8.280 -0.000 0.000 0.586 114 A N 5.753 128.714 122.820 0.235 0.000 2.366 114 A HA 0.309 4.626 4.320 -0.005 0.000 0.250 114 A C -2.211 175.512 177.584 0.232 0.000 1.099 114 A CA -1.366 50.781 52.037 0.182 0.000 0.794 114 A CB -0.488 18.497 19.000 -0.025 0.000 1.056 114 A HN 0.556 8.706 8.150 -0.000 0.000 0.499 115 P HA 0.322 4.742 4.420 -0.000 0.000 0.281 115 P C -0.273 177.054 177.300 0.045 0.000 1.252 115 P CA 0.121 63.298 63.100 0.130 0.000 0.778 115 P CB 1.424 33.217 31.700 0.156 0.000 0.895 116 A N 3.666 126.481 122.820 -0.009 0.000 2.415 116 A HA 0.163 4.480 4.320 -0.005 0.000 0.248 116 A C 1.552 179.089 177.584 -0.078 0.000 1.299 116 A CA 0.087 52.101 52.037 -0.038 0.000 0.899 116 A CB -0.344 18.628 19.000 -0.046 0.000 0.997 116 A HN 0.464 8.614 8.150 -0.000 0.000 0.506 117 R N -1.820 118.631 120.500 -0.081 0.000 3.578 117 R HA 0.151 4.488 4.340 -0.005 0.000 0.131 117 R C 0.964 177.283 176.300 0.032 0.000 0.722 117 R CA 0.874 56.925 56.100 -0.083 0.000 1.328 117 R CB 0.222 30.355 30.300 -0.278 0.000 1.650 117 R HN 0.409 8.679 8.270 -0.000 0.000 0.485 118 G N -0.167 108.701 108.800 0.114 0.000 2.887 118 G HA2 0.319 4.276 3.960 -0.005 0.000 0.277 118 G HA3 0.319 4.276 3.960 -0.005 0.000 0.277 118 G C 0.318 175.261 174.900 0.071 0.000 1.346 118 G CA -0.449 44.760 45.100 0.181 0.000 1.058 118 G HN 0.048 8.338 8.290 -0.000 0.000 0.535 119 R N -1.386 119.119 120.500 0.008 0.000 2.120 119 R HA 0.070 4.407 4.340 -0.005 0.000 0.234 119 R C -0.309 175.781 176.300 -0.350 0.000 1.123 119 R CA 0.991 56.941 56.100 -0.250 0.000 0.975 119 R CB -0.103 29.969 30.300 -0.380 0.000 0.866 119 R HN 0.249 8.519 8.270 -0.000 0.000 0.446 120 F N 0.028 120.047 119.950 0.115 0.000 2.578 120 F HA 0.342 4.866 4.527 -0.005 0.000 0.311 120 F C -0.273 175.583 175.800 0.093 0.000 1.094 120 F CA -1.405 56.658 58.000 0.105 0.000 0.923 120 F CB 1.849 40.891 39.000 0.069 0.000 1.230 120 F HN -0.360 7.940 8.300 -0.000 0.000 0.450 121 K N 2.547 123.120 120.400 0.289 0.000 2.250 121 K HA 0.495 4.812 4.320 -0.005 0.000 0.285 121 K C -1.184 175.439 176.600 0.039 0.000 1.097 121 K CA -0.186 56.166 56.287 0.109 0.000 0.913 121 K CB 0.518 33.063 32.500 0.076 0.000 1.179 121 K HN 0.426 8.676 8.250 -0.000 0.000 0.462 122 V N 6.045 125.953 119.914 -0.010 0.000 2.348 122 V HA 0.150 4.266 4.120 -0.005 0.000 0.270 122 V C -0.714 175.299 176.094 -0.135 0.000 1.037 122 V CA -0.696 61.578 62.300 -0.044 0.000 0.872 122 V CB 0.078 31.895 31.823 -0.010 0.000 1.002 122 V HN 0.535 8.725 8.190 -0.000 0.000 0.464 123 Y N 5.158 125.363 120.300 -0.157 0.000 2.350 123 Y HA 0.470 5.017 4.550 -0.005 0.000 0.340 123 Y C 0.073 176.011 175.900 0.064 0.000 1.006 123 Y CA -0.769 57.298 58.100 -0.056 0.000 1.166 123 Y CB 1.359 39.745 38.460 -0.123 0.000 1.168 123 Y HN 0.480 8.760 8.280 -0.000 0.000 0.502 124 L N 6.393 127.723 121.223 0.180 0.000 2.426 124 L HA 0.471 4.808 4.340 -0.005 0.000 0.255 124 L C -0.891 176.084 176.870 0.175 0.000 1.080 124 L CA -0.586 54.352 54.840 0.163 0.000 0.960 124 L CB -0.388 41.722 42.059 0.084 0.000 1.326 124 L HN 0.467 8.697 8.230 -0.000 0.000 0.441 125 I N 3.098 123.804 120.570 0.227 0.000 2.379 125 I HA 0.215 4.382 4.170 -0.005 0.000 0.290 125 I C -0.058 176.148 176.117 0.147 0.000 1.063 125 I CA -0.131 61.279 61.300 0.184 0.000 1.351 125 I CB 0.719 38.841 38.000 0.204 0.000 1.410 125 I HN 0.438 8.648 8.210 -0.000 0.000 0.505 126 D N 5.705 126.166 120.400 0.101 0.000 2.299 126 D HA 0.150 4.787 4.640 -0.005 0.000 0.243 126 D C 0.169 176.498 176.300 0.047 0.000 0.982 126 D CA -0.176 53.876 54.000 0.086 0.000 0.924 126 D CB 1.303 42.143 40.800 0.066 0.000 1.238 126 D HN 0.329 8.698 8.370 -0.000 0.000 0.484 127 E N 0.690 120.930 120.200 0.067 0.000 2.165 127 E HA -0.161 4.186 4.350 -0.005 0.000 0.203 127 E C 0.897 177.371 176.600 -0.209 0.000 1.335 127 E CA 0.245 56.654 56.400 0.014 0.000 0.708 127 E CB -1.471 28.246 29.700 0.029 0.000 1.105 127 E HN 0.283 8.643 8.360 -0.000 0.000 0.346 128 V N 1.205 121.110 119.914 -0.015 0.000 3.305 128 V HA -0.194 3.923 4.120 -0.005 0.000 0.269 128 V C 2.312 178.434 176.094 0.047 0.000 1.157 128 V CA 1.874 64.182 62.300 0.013 0.000 1.157 128 V CB -0.510 31.405 31.823 0.153 0.000 0.772 128 V HN 0.630 8.820 8.190 -0.000 0.000 0.498 129 H N -1.591 117.582 119.070 0.171 0.000 2.518 129 H HA -0.103 4.450 4.556 -0.005 0.000 0.289 129 H C 1.788 177.223 175.328 0.179 0.000 1.051 129 H CA 1.248 57.425 56.048 0.215 0.000 1.280 129 H CB -0.449 29.394 29.762 0.136 0.000 1.380 129 H HN 0.389 8.669 8.280 -0.000 0.000 0.566 130 M N 1.122 120.533 119.600 -0.315 0.000 2.562 130 M HA 0.158 4.635 4.480 -0.005 0.000 0.257 130 M C 0.942 177.141 176.300 -0.167 0.000 1.099 130 M CA 0.007 55.205 55.300 -0.171 0.000 1.099 130 M CB -0.399 32.054 32.600 -0.244 0.000 1.427 130 M HN 0.152 8.442 8.290 -0.000 0.000 0.489 131 L N 0.994 122.008 121.223 -0.349 0.000 2.467 131 L HA 0.033 4.370 4.340 -0.005 0.000 0.270 131 L C 1.082 177.643 176.870 -0.515 0.000 1.205 131 L CA -0.397 54.105 54.840 -0.563 0.000 0.828 131 L CB 0.389 41.849 42.059 -0.998 0.000 1.101 131 L HN 0.244 8.474 8.230 -0.000 0.000 0.479 132 S N 2.170 117.689 115.700 -0.303 0.000 2.617 132 S HA 0.229 4.696 4.470 -0.005 0.000 0.259 132 S C 1.157 175.758 174.600 0.003 0.000 1.301 132 S CA -0.804 57.344 58.200 -0.086 0.000 0.984 132 S CB 0.808 63.998 63.200 -0.016 0.000 0.954 132 S HN 0.507 8.817 8.310 -0.000 0.000 0.572 133 R N 0.370 120.968 120.500 0.162 0.000 2.096 133 R HA -0.151 4.186 4.340 -0.005 0.000 0.240 133 R C 2.060 178.449 176.300 0.149 0.000 1.139 133 R CA 2.071 58.297 56.100 0.209 0.000 0.952 133 R CB -1.115 29.276 30.300 0.152 0.000 0.854 133 R HN 0.751 9.021 8.270 -0.000 0.000 0.436 134 H N -0.284 118.804 119.070 0.029 0.000 2.395 134 H HA 0.061 4.614 4.556 -0.005 0.000 0.299 134 H C 2.234 177.555 175.328 -0.013 0.000 1.070 134 H CA 1.524 57.580 56.048 0.014 0.000 1.356 134 H CB 0.029 29.790 29.762 -0.002 0.000 1.401 134 H HN 0.054 8.334 8.280 -0.000 0.000 0.524 135 S N -0.427 115.297 115.700 0.041 0.000 2.423 135 S HA -0.087 4.380 4.470 -0.005 0.000 0.231 135 S C 1.707 176.256 174.600 -0.085 0.000 1.014 135 S CA 0.671 58.828 58.200 -0.072 0.000 0.965 135 S CB -0.216 62.879 63.200 -0.175 0.000 0.785 135 S HN 0.304 8.614 8.310 -0.000 0.000 0.495 136 F N 2.074 122.026 119.950 0.004 0.000 2.084 136 F HA -0.090 4.434 4.527 -0.005 0.000 0.296 136 F C 2.364 178.135 175.800 -0.048 0.000 1.111 136 F CA 0.611 58.594 58.000 -0.028 0.000 1.224 136 F CB -0.373 38.612 39.000 -0.025 0.000 0.991 136 F HN 0.122 8.422 8.300 -0.000 0.000 0.471 137 N N 0.680 119.468 118.700 0.148 0.000 2.091 137 N HA -0.229 4.508 4.740 -0.005 0.000 0.193 137 N C 1.753 177.277 175.510 0.023 0.000 1.021 137 N CA 1.532 54.604 53.050 0.037 0.000 0.862 137 N CB -0.730 37.733 38.487 -0.040 0.000 1.018 137 N HN 0.302 8.682 8.380 -0.000 0.000 0.429 138 A N 0.412 123.250 122.820 0.030 0.000 1.898 138 A HA -0.037 4.280 4.320 -0.005 0.000 0.216 138 A C 2.196 179.777 177.584 -0.006 0.000 1.181 138 A CA 0.882 52.928 52.037 0.015 0.000 0.620 138 A CB -0.673 18.341 19.000 0.024 0.000 0.819 138 A HN 0.245 8.395 8.150 -0.000 0.000 0.442 139 L N -0.510 120.709 121.223 -0.005 0.000 2.017 139 L HA -0.120 4.217 4.340 -0.005 0.000 0.208 139 L C 2.214 179.024 176.870 -0.101 0.000 1.073 139 L CA 2.097 56.895 54.840 -0.070 0.000 0.745 139 L CB -0.811 41.231 42.059 -0.028 0.000 0.894 139 L HN 0.329 8.559 8.230 -0.000 0.000 0.432 140 L N -0.024 121.179 121.223 -0.034 0.000 2.051 140 L HA -0.291 4.046 4.340 -0.005 0.000 0.214 140 L C 2.503 179.340 176.870 -0.054 0.000 1.076 140 L CA 2.011 56.820 54.840 -0.051 0.000 0.758 140 L CB -0.789 41.255 42.059 -0.025 0.000 0.890 140 L HN 0.320 8.550 8.230 -0.000 0.000 0.433 141 K N -1.545 118.833 120.400 -0.036 0.000 2.057 141 K HA -0.136 4.181 4.320 -0.005 0.000 0.207 141 K C 1.821 178.409 176.600 -0.020 0.000 1.049 141 K CA 1.907 58.181 56.287 -0.021 0.000 0.931 141 K CB -0.289 32.207 32.500 -0.008 0.000 0.714 141 K HN 0.432 8.682 8.250 -0.000 0.000 0.440 142 T N 1.369 115.900 114.554 -0.039 0.000 2.951 142 T HA -0.015 4.332 4.350 -0.005 0.000 0.268 142 T C 1.688 176.369 174.700 -0.032 0.000 1.073 142 T CA 0.773 62.861 62.100 -0.020 0.000 1.134 142 T CB 0.016 68.871 68.868 -0.023 0.000 0.884 142 T HN 0.097 8.337 8.240 -0.000 0.000 0.479 143 L N 0.320 121.467 121.223 -0.127 0.000 2.341 143 L HA 0.116 4.453 4.340 -0.005 0.000 0.214 143 L C 2.553 179.453 176.870 0.051 0.000 1.115 143 L CA 0.917 55.717 54.840 -0.067 0.000 0.820 143 L CB -0.275 41.683 42.059 -0.169 0.000 0.944 143 L HN 0.228 8.458 8.230 -0.000 0.000 0.452 144 E N 0.284 120.487 120.200 0.004 0.000 2.158 144 E HA -0.077 4.270 4.350 -0.005 0.000 0.191 144 E C 0.210 176.800 176.600 -0.016 0.000 0.982 144 E CA 0.645 57.045 56.400 -0.001 0.000 0.823 144 E CB 0.364 30.057 29.700 -0.011 0.000 0.766 144 E HN 0.436 8.796 8.360 -0.000 0.000 0.468 145 E N 1.326 121.528 120.200 0.003 0.000 3.167 145 E HA 0.185 4.532 4.350 -0.005 0.000 0.212 145 E C -2.549 174.080 176.600 0.047 0.000 1.143 145 E CA -1.714 54.690 56.400 0.007 0.000 1.002 145 E CB 1.175 30.883 29.700 0.013 0.000 1.315 145 E HN 0.069 8.429 8.360 -0.000 0.000 0.422 146 P HA 0.150 4.570 4.420 -0.000 0.000 0.271 146 P C -2.366 175.011 177.300 0.129 0.000 1.226 146 P CA -1.194 61.995 63.100 0.149 0.000 0.765 146 P CB -0.015 31.790 31.700 0.175 0.000 0.835 147 P HA 0.000 4.420 4.420 -0.000 0.000 0.270 147 P C 0.993 178.422 177.300 0.216 0.000 1.227 147 P CA 0.105 63.311 63.100 0.177 0.000 0.788 147 P CB 0.640 32.416 31.700 0.125 0.000 0.926 148 E N 0.716 121.113 120.200 0.329 0.000 2.076 148 E HA -0.172 4.175 4.350 -0.005 0.000 0.190 148 E C 1.517 178.389 176.600 0.452 0.000 0.979 148 E CA 1.386 57.981 56.400 0.325 0.000 0.807 148 E CB -0.518 29.325 29.700 0.239 0.000 0.761 148 E HN 0.515 8.875 8.360 -0.000 0.000 0.454 149 H N -1.108 118.105 119.070 0.239 0.000 2.547 149 H HA 0.181 4.734 4.556 -0.005 0.000 0.266 149 H C -0.058 175.516 175.328 0.409 0.000 0.988 149 H CA 0.022 56.251 56.048 0.302 0.000 1.147 149 H CB -0.841 29.004 29.762 0.139 0.000 1.365 149 H HN -0.110 8.170 8.280 -0.000 0.000 0.589 150 V N 2.392 122.323 119.914 0.028 0.000 2.435 150 V HA 0.321 4.438 4.120 -0.005 0.000 0.290 150 V C 0.027 176.085 176.094 -0.060 0.000 1.030 150 V CA -0.876 61.369 62.300 -0.092 0.000 0.881 150 V CB 1.963 33.630 31.823 -0.261 0.000 0.983 150 V HN 0.137 8.327 8.190 -0.000 0.000 0.445 151 K N 3.317 123.625 120.400 -0.153 0.000 2.328 151 K HA 0.651 4.968 4.320 -0.005 0.000 0.246 151 K C -1.435 175.041 176.600 -0.205 0.000 0.955 151 K CA -0.528 55.684 56.287 -0.124 0.000 0.817 151 K CB 2.516 34.891 32.500 -0.207 0.000 1.208 151 K HN 0.442 8.692 8.250 -0.000 0.000 0.432 152 F N 1.879 121.915 119.950 0.143 0.000 2.460 152 F HA 0.393 4.917 4.527 -0.005 0.000 0.341 152 F C 0.024 175.932 175.800 0.179 0.000 1.130 152 F CA -0.706 57.391 58.000 0.162 0.000 0.962 152 F CB 1.089 40.155 39.000 0.110 0.000 1.171 152 F HN 0.041 8.341 8.300 -0.000 0.000 0.436 153 L N 5.627 127.054 121.223 0.341 0.000 2.262 153 L HA 0.461 4.798 4.340 -0.005 0.000 0.288 153 L C -0.639 176.433 176.870 0.336 0.000 1.035 153 L CA -0.442 54.603 54.840 0.343 0.000 0.820 153 L CB 0.995 43.220 42.059 0.278 0.000 1.204 153 L HN 0.488 8.718 8.230 -0.000 0.000 0.424 154 L N 3.584 124.992 121.223 0.308 0.000 2.282 154 L HA 0.729 5.066 4.340 -0.005 0.000 0.288 154 L C 0.081 177.117 176.870 0.276 0.000 1.033 154 L CA -0.363 54.625 54.840 0.247 0.000 0.807 154 L CB 1.826 43.986 42.059 0.168 0.000 1.209 154 L HN 0.678 8.908 8.230 -0.000 0.000 0.423 155 A N 2.322 125.290 122.820 0.248 0.000 2.374 155 A HA 0.774 5.091 4.320 -0.005 0.000 0.305 155 A C -0.583 177.125 177.584 0.207 0.000 1.053 155 A CA -0.468 51.718 52.037 0.247 0.000 0.726 155 A CB 2.064 21.201 19.000 0.227 0.000 1.229 155 A HN 0.570 8.720 8.150 -0.000 0.000 0.431 156 T N 0.365 115.048 114.554 0.215 0.000 2.982 156 T HA 0.534 4.881 4.350 -0.005 0.000 0.321 156 T C 0.692 175.503 174.700 0.185 0.000 1.229 156 T CA 0.442 62.696 62.100 0.256 0.000 1.044 156 T CB 1.419 70.483 68.868 0.326 0.000 1.184 156 T HN 1.525 9.765 8.240 -0.000 0.000 0.477 157 A N 2.319 125.227 122.820 0.146 0.000 2.119 157 A HA 0.224 4.541 4.320 -0.005 0.000 0.216 157 A C 0.856 178.465 177.584 0.042 0.000 1.152 157 A CA 0.861 52.943 52.037 0.075 0.000 0.708 157 A CB -0.128 18.896 19.000 0.041 0.000 0.805 157 A HN 0.687 8.837 8.150 -0.000 0.000 0.460 158 D N -0.950 119.447 120.400 -0.005 0.000 2.434 158 D HA 0.249 4.886 4.640 -0.005 0.000 0.275 158 D C -2.013 174.304 176.300 0.029 0.000 1.172 158 D CA -1.953 52.022 54.000 -0.042 0.000 0.916 158 D CB 1.147 41.833 40.800 -0.189 0.000 1.041 158 D HN 0.079 8.449 8.370 -0.000 0.000 0.501 159 P HA -0.145 4.275 4.420 -0.000 0.000 0.223 159 P C 1.265 178.572 177.300 0.011 0.000 1.151 159 P CA 0.571 63.703 63.100 0.054 0.000 0.787 159 P CB 0.428 32.160 31.700 0.052 0.000 0.788 160 Q N 1.346 121.146 119.800 0.000 0.000 2.368 160 Q HA -0.156 4.181 4.340 -0.005 0.000 0.210 160 Q C 1.808 177.800 176.000 -0.014 0.000 0.982 160 Q CA 1.719 57.511 55.803 -0.018 0.000 0.884 160 Q CB -0.532 28.195 28.738 -0.019 0.000 0.933 160 Q HN 0.177 8.447 8.270 -0.000 0.000 0.460 161 K N -0.276 120.134 120.400 0.017 0.000 2.361 161 K HA 0.140 4.457 4.320 -0.005 0.000 0.196 161 K C -0.003 176.598 176.600 0.000 0.000 1.039 161 K CA 0.008 56.326 56.287 0.050 0.000 1.001 161 K CB 0.271 32.853 32.500 0.138 0.000 0.795 161 K HN 0.263 8.513 8.250 -0.000 0.000 0.495 162 L N 3.119 124.290 121.223 -0.086 0.000 2.380 162 L HA 0.171 4.508 4.340 -0.005 0.000 0.273 162 L C -2.173 174.481 176.870 -0.359 0.000 1.138 162 L CA -2.158 52.460 54.840 -0.370 0.000 0.832 162 L CB -0.284 41.608 42.059 -0.277 0.000 1.124 162 L HN -0.203 8.027 8.230 -0.000 0.000 0.454 163 P HA -0.105 4.315 4.420 -0.000 0.000 0.267 163 P C 0.731 177.895 177.300 -0.227 0.000 1.201 163 P CA -0.048 62.866 63.100 -0.311 0.000 0.775 163 P CB 0.723 32.218 31.700 -0.343 0.000 0.854 164 V N 2.125 121.949 119.914 -0.149 0.000 2.626 164 V HA -0.172 3.945 4.120 -0.005 0.000 0.252 164 V C 1.786 177.809 176.094 -0.119 0.000 1.067 164 V CA 2.653 64.882 62.300 -0.119 0.000 1.081 164 V CB -1.464 30.307 31.823 -0.087 0.000 0.686 164 V HN 0.801 8.991 8.190 -0.000 0.000 0.468 165 T N -2.829 111.650 114.554 -0.125 0.000 3.227 165 T HA 0.088 4.435 4.350 -0.005 0.000 0.257 165 T C 1.352 175.979 174.700 -0.122 0.000 1.162 165 T CA 1.344 63.380 62.100 -0.106 0.000 1.051 165 T CB -0.231 68.583 68.868 -0.090 0.000 0.953 165 T HN 0.560 8.800 8.240 -0.000 0.000 0.535 166 I N -1.194 119.279 120.570 -0.161 0.000 4.398 166 I HA 0.231 4.398 4.170 -0.005 0.000 0.310 166 I C 1.940 177.971 176.117 -0.143 0.000 1.232 166 I CA -0.093 61.111 61.300 -0.161 0.000 1.312 166 I CB 0.212 38.069 38.000 -0.239 0.000 1.347 166 I HN 0.145 8.355 8.210 -0.000 0.000 0.454 167 L N 1.279 122.411 121.223 -0.151 0.000 2.187 167 L HA -0.182 4.155 4.340 -0.005 0.000 0.213 167 L C 2.437 179.232 176.870 -0.124 0.000 1.100 167 L CA 1.759 56.519 54.840 -0.133 0.000 0.765 167 L CB -0.480 41.505 42.059 -0.124 0.000 0.904 167 L HN 0.321 8.551 8.230 -0.000 0.000 0.437 168 S N -1.304 114.332 115.700 -0.106 0.000 2.562 168 S HA 0.043 4.510 4.470 -0.005 0.000 0.221 168 S C 1.577 176.135 174.600 -0.069 0.000 0.975 168 S CA 0.063 58.212 58.200 -0.085 0.000 0.918 168 S CB 0.022 63.182 63.200 -0.067 0.000 0.772 168 S HN 0.358 8.668 8.310 -0.000 0.000 0.531 169 R N 0.202 120.654 120.500 -0.080 0.000 2.577 169 R HA 0.370 4.707 4.340 -0.005 0.000 0.344 169 R C -0.841 175.366 176.300 -0.156 0.000 1.037 169 R CA -0.053 56.017 56.100 -0.050 0.000 1.102 169 R CB 0.198 30.494 30.300 -0.007 0.000 1.313 169 R HN 0.369 8.639 8.270 -0.000 0.000 0.561 170 C N 0.989 120.173 119.300 -0.193 0.000 2.609 170 C HA 0.376 4.833 4.460 -0.005 0.000 0.313 170 C C -0.053 174.736 174.990 -0.336 0.000 1.175 170 C CA -1.255 57.602 59.018 -0.269 0.000 1.434 170 C CB 1.509 29.131 27.740 -0.196 0.000 2.005 170 C HN 0.273 8.503 8.230 -0.000 0.000 0.471 171 L N 3.344 124.267 121.223 -0.499 0.000 2.456 171 L HA 0.226 4.563 4.340 -0.005 0.000 0.277 171 L C 0.388 176.855 176.870 -0.671 0.000 1.124 171 L CA 1.030 55.473 54.840 -0.662 0.000 0.880 171 L CB 0.070 41.504 42.059 -1.042 0.000 1.192 171 L HN 0.781 9.011 8.230 -0.000 0.000 0.463 172 Q N 4.421 123.876 119.800 -0.575 0.000 2.303 172 Q HA 0.301 4.638 4.340 -0.005 0.000 0.257 172 Q C -1.561 174.134 176.000 -0.508 0.000 0.941 172 Q CA -0.550 54.997 55.803 -0.428 0.000 0.931 172 Q CB 0.722 29.323 28.738 -0.228 0.000 1.215 172 Q HN 0.555 8.825 8.270 -0.000 0.000 0.437 173 F N 2.900 122.738 119.950 -0.185 0.000 2.361 173 F HA 0.197 4.720 4.527 -0.006 0.000 0.364 173 F C -0.009 175.867 175.800 0.127 0.000 1.120 173 F CA -0.703 57.286 58.000 -0.017 0.000 1.102 173 F CB 0.864 39.857 39.000 -0.012 0.000 1.183 173 F HN 0.593 8.893 8.300 -0.000 0.000 0.476 174 H N 4.620 123.827 119.070 0.229 0.000 2.761 174 H HA 0.402 4.955 4.556 -0.005 0.000 0.284 174 H C -0.434 175.071 175.328 0.295 0.000 1.105 174 H CA -0.430 55.736 56.048 0.197 0.000 1.352 174 H CB 0.375 30.200 29.762 0.106 0.000 1.423 174 H HN 0.505 8.785 8.280 -0.000 0.000 0.464 175 L N 4.348 125.528 121.223 -0.071 0.000 2.461 175 L HA 0.168 4.505 4.340 -0.005 0.000 0.272 175 L C 0.628 177.410 176.870 -0.146 0.000 1.197 175 L CA 0.004 54.824 54.840 -0.034 0.000 0.836 175 L CB 0.551 42.575 42.059 -0.058 0.000 1.105 175 L HN 0.621 8.851 8.230 -0.000 0.000 0.477 176 K N 1.018 121.457 120.400 0.065 0.000 2.090 176 K HA 0.577 4.894 4.320 -0.005 0.000 0.249 176 K C -0.190 176.413 176.600 0.005 0.000 0.995 176 K CA -0.681 55.638 56.287 0.054 0.000 0.914 176 K CB 1.389 33.970 32.500 0.135 0.000 1.057 176 K HN 0.704 8.954 8.250 -0.000 0.000 0.462 177 A N 2.055 124.882 122.820 0.012 0.000 2.371 177 A HA 0.300 4.617 4.320 -0.005 0.000 0.257 177 A C -0.124 177.465 177.584 0.009 0.000 1.089 177 A CA -0.492 51.548 52.037 0.005 0.000 0.794 177 A CB -0.020 18.988 19.000 0.013 0.000 1.029 177 A HN 0.590 8.740 8.150 -0.000 0.000 0.488 178 L N 1.525 122.747 121.223 -0.002 0.000 2.371 178 L HA 0.239 4.576 4.340 -0.005 0.000 0.272 178 L C 0.333 177.203 176.870 0.000 0.000 1.124 178 L CA -0.675 54.163 54.840 -0.003 0.000 0.816 178 L CB 0.670 42.720 42.059 -0.015 0.000 1.129 178 L HN 0.832 9.062 8.230 -0.000 0.000 0.448 179 D N 1.081 121.483 120.400 0.003 0.000 2.362 179 D HA 0.104 4.741 4.640 -0.005 0.000 0.242 179 D C 1.040 177.341 176.300 0.001 0.000 1.132 179 D CA -0.457 53.545 54.000 0.004 0.000 0.907 179 D CB 1.556 42.360 40.800 0.007 0.000 1.195 179 D HN 0.268 8.638 8.370 -0.000 0.000 0.429 180 V N 2.018 121.933 119.914 0.002 0.000 2.311 180 V HA -0.287 3.830 4.120 -0.005 0.000 0.256 180 V C 2.169 178.265 176.094 0.003 0.000 1.077 180 V CA 2.426 64.726 62.300 -0.000 0.000 1.067 180 V CB -1.002 30.822 31.823 0.001 0.000 0.659 180 V HN 0.683 8.873 8.190 -0.000 0.000 0.451 181 E N 0.222 120.428 120.200 0.010 0.000 2.028 181 E HA -0.167 4.180 4.350 -0.005 0.000 0.190 181 E C 2.292 178.913 176.600 0.036 0.000 0.984 181 E CA 1.412 57.826 56.400 0.024 0.000 0.800 181 E CB -0.452 29.264 29.700 0.026 0.000 0.758 181 E HN 0.673 9.033 8.360 -0.000 0.000 0.448 182 Q N 0.119 119.929 119.800 0.017 0.000 2.118 182 Q HA -0.231 4.106 4.340 -0.005 0.000 0.211 182 Q C 2.390 178.397 176.000 0.011 0.000 0.998 182 Q CA 1.949 57.755 55.803 0.005 0.000 0.872 182 Q CB -0.419 28.313 28.738 -0.011 0.000 0.925 182 Q HN 0.417 8.687 8.270 -0.000 0.000 0.414 183 I N 0.086 120.655 120.570 -0.001 0.000 2.252 183 I HA -0.234 3.933 4.170 -0.005 0.000 0.245 183 I C 2.732 178.836 176.117 -0.021 0.000 1.102 183 I CA 0.872 62.162 61.300 -0.017 0.000 1.385 183 I CB -0.378 37.608 38.000 -0.023 0.000 1.064 183 I HN 0.215 8.425 8.210 -0.000 0.000 0.414 184 R N 0.178 120.671 120.500 -0.011 0.000 2.091 184 R HA -0.241 4.096 4.340 -0.005 0.000 0.238 184 R C 2.568 178.841 176.300 -0.045 0.000 1.136 184 R CA 1.615 57.694 56.100 -0.036 0.000 0.959 184 R CB -0.465 29.821 30.300 -0.024 0.000 0.856 184 R HN 0.418 8.688 8.270 -0.000 0.000 0.437 185 H N 0.364 119.394 119.070 -0.067 0.000 2.293 185 H HA -0.164 4.388 4.556 -0.006 0.000 0.300 185 H C 1.951 177.234 175.328 -0.074 0.000 1.082 185 H CA 2.245 58.256 56.048 -0.061 0.000 1.308 185 H CB 0.057 29.798 29.762 -0.036 0.000 1.375 185 H HN 0.226 8.506 8.280 -0.000 0.000 0.495 186 Q N 0.649 120.511 119.800 0.104 0.000 2.135 186 Q HA -0.081 4.256 4.340 -0.005 0.000 0.204 186 Q C 2.704 178.619 176.000 -0.142 0.000 0.981 186 Q CA 1.214 57.007 55.803 -0.018 0.000 0.856 186 Q CB -0.365 28.330 28.738 -0.072 0.000 0.902 186 Q HN 0.486 8.756 8.270 -0.000 0.000 0.425 187 L N -0.037 121.098 121.223 -0.148 0.000 1.994 187 L HA -0.214 4.123 4.340 -0.005 0.000 0.208 187 L C 2.506 179.203 176.870 -0.289 0.000 1.071 187 L CA 2.060 56.775 54.840 -0.208 0.000 0.745 187 L CB -0.662 41.292 42.059 -0.176 0.000 0.892 187 L HN 0.428 8.658 8.230 -0.000 0.000 0.431 188 E N -0.718 119.290 120.200 -0.320 0.000 2.070 188 E HA -0.308 4.039 4.350 -0.005 0.000 0.197 188 E C 2.238 178.650 176.600 -0.313 0.000 1.004 188 E CA 1.415 57.557 56.400 -0.430 0.000 0.805 188 E CB -0.091 29.361 29.700 -0.413 0.000 0.744 188 E HN 0.375 8.735 8.360 -0.000 0.000 0.451 189 H N 0.892 119.757 119.070 -0.342 0.000 2.287 189 H HA -0.206 4.347 4.556 -0.005 0.000 0.292 189 H C 2.262 177.343 175.328 -0.411 0.000 1.068 189 H CA 2.353 58.223 56.048 -0.297 0.000 1.192 189 H CB -0.717 28.908 29.762 -0.227 0.000 1.360 189 H HN 0.250 8.530 8.280 -0.000 0.000 0.516 190 I N 0.599 120.968 120.570 -0.335 0.000 2.091 190 I HA -0.367 3.800 4.170 -0.005 0.000 0.240 190 I C 3.093 178.995 176.117 -0.359 0.000 1.046 190 I CA 1.431 62.276 61.300 -0.759 0.000 1.306 190 I CB -0.491 36.918 38.000 -0.985 0.000 1.018 190 I HN 0.252 8.462 8.210 -0.000 0.000 0.404 191 L N 0.248 121.307 121.223 -0.274 0.000 2.043 191 L HA -0.294 4.043 4.340 -0.005 0.000 0.212 191 L C 2.416 179.250 176.870 -0.060 0.000 1.075 191 L CA 1.537 56.290 54.840 -0.144 0.000 0.752 191 L CB -0.765 41.184 42.059 -0.184 0.000 0.891 191 L HN 0.424 8.654 8.230 -0.000 0.000 0.432 192 N N -0.055 118.590 118.700 -0.093 0.000 2.039 192 N HA -0.228 4.509 4.740 -0.005 0.000 0.193 192 N C 1.781 177.153 175.510 -0.229 0.000 1.044 192 N CA 1.330 54.322 53.050 -0.096 0.000 0.847 192 N CB -0.247 38.171 38.487 -0.116 0.000 1.030 192 N HN 0.228 8.608 8.380 -0.000 0.000 0.422 193 E N 1.235 121.340 120.200 -0.159 0.000 2.097 193 E HA -0.142 4.205 4.350 -0.005 0.000 0.196 193 E C 1.306 177.893 176.600 -0.022 0.000 1.000 193 E CA 1.103 57.464 56.400 -0.066 0.000 0.804 193 E CB -0.017 29.838 29.700 0.257 0.000 0.740 193 E HN 0.313 8.673 8.360 -0.000 0.000 0.454 194 E N -0.243 120.016 120.200 0.099 0.000 2.478 194 E HA -0.107 4.240 4.350 -0.005 0.000 0.198 194 E C -0.376 176.329 176.600 0.176 0.000 1.046 194 E CA 0.461 56.976 56.400 0.191 0.000 0.870 194 E CB -0.101 29.711 29.700 0.186 0.000 0.818 194 E HN 0.406 8.766 8.360 -0.000 0.000 0.527 195 H N -0.698 118.426 119.070 0.089 0.000 2.935 195 H HA -0.148 4.405 4.556 -0.005 0.000 0.341 195 H C -0.348 174.997 175.328 0.029 0.000 1.161 195 H CA 0.672 56.753 56.048 0.055 0.000 1.135 195 H CB -1.987 27.810 29.762 0.058 0.000 1.605 195 H HN 0.166 8.446 8.280 -0.000 0.000 0.409 196 I N 0.386 121.012 120.570 0.094 0.000 2.569 196 I HA 0.468 4.635 4.170 -0.005 0.000 0.290 196 I C 0.637 176.800 176.117 0.076 0.000 1.088 196 I CA -0.730 60.608 61.300 0.063 0.000 1.047 196 I CB 2.042 40.061 38.000 0.031 0.000 1.237 196 I HN 0.447 8.657 8.210 -0.000 0.000 0.421 197 A N 4.840 127.671 122.820 0.019 0.000 2.462 197 A HA 0.520 4.837 4.320 -0.005 0.000 0.243 197 A C -0.599 176.984 177.584 -0.000 0.000 1.076 197 A CA 0.467 52.471 52.037 -0.055 0.000 0.773 197 A CB -0.221 18.747 19.000 -0.053 0.000 1.010 197 A HN 0.919 9.069 8.150 -0.000 0.000 0.493 198 H N -1.039 118.009 119.070 -0.038 0.000 3.085 198 H HA 0.596 5.149 4.556 -0.005 0.000 0.356 198 H C -1.282 174.022 175.328 -0.041 0.000 1.178 198 H CA -0.820 55.203 56.048 -0.043 0.000 1.214 198 H CB 0.511 30.239 29.762 -0.057 0.000 1.881 198 H HN 0.567 8.847 8.280 -0.000 0.000 0.538 199 E N 3.425 123.676 120.200 0.086 0.000 2.266 199 E HA 0.158 4.505 4.350 -0.005 0.000 0.277 199 E C -1.847 174.818 176.600 0.108 0.000 1.018 199 E CA -2.125 54.305 56.400 0.049 0.000 0.840 199 E CB 1.224 30.935 29.700 0.018 0.000 1.082 199 E HN 0.465 8.825 8.360 -0.000 0.000 0.395 200 P HA -0.251 4.169 4.420 -0.000 0.000 0.217 200 P C 1.198 178.513 177.300 0.025 0.000 1.158 200 P CA 1.478 64.613 63.100 0.058 0.000 0.887 200 P CB 0.179 31.893 31.700 0.024 0.000 0.792 201 R N -1.025 119.485 120.500 0.017 0.000 2.240 201 R HA 0.120 4.457 4.340 -0.005 0.000 0.203 201 R C 1.994 178.294 176.300 0.001 0.000 1.011 201 R CA 0.761 56.864 56.100 0.004 0.000 1.007 201 R CB -0.388 29.913 30.300 0.002 0.000 0.911 201 R HN 0.072 8.342 8.270 -0.000 0.000 0.468 202 A N 1.095 123.920 122.820 0.009 0.000 1.902 202 A HA -0.123 4.194 4.320 -0.005 0.000 0.217 202 A C 2.041 179.614 177.584 -0.017 0.000 1.181 202 A CA 1.017 53.055 52.037 0.002 0.000 0.623 202 A CB -0.394 18.616 19.000 0.016 0.000 0.818 202 A HN 0.290 8.440 8.150 -0.000 0.000 0.443 203 L N -1.115 120.090 121.223 -0.030 0.000 2.093 203 L HA -0.185 4.151 4.340 -0.005 0.000 0.208 203 L C 2.836 179.675 176.870 -0.051 0.000 1.085 203 L CA 1.555 56.354 54.840 -0.069 0.000 0.755 203 L CB -0.628 41.353 42.059 -0.129 0.000 0.904 203 L HN 0.534 8.764 8.230 -0.000 0.000 0.435 204 Q N 0.492 120.272 119.800 -0.033 0.000 2.124 204 Q HA -0.187 4.150 4.340 -0.005 0.000 0.202 204 Q C 2.392 178.380 176.000 -0.019 0.000 0.977 204 Q CA 1.299 57.088 55.803 -0.023 0.000 0.850 204 Q CB 0.056 28.786 28.738 -0.014 0.000 0.901 204 Q HN 0.533 8.803 8.270 -0.000 0.000 0.429 205 L N 0.201 121.414 121.223 -0.017 0.000 2.093 205 L HA -0.185 4.152 4.340 -0.005 0.000 0.208 205 L C 2.290 179.149 176.870 -0.018 0.000 1.085 205 L CA 0.639 55.471 54.840 -0.014 0.000 0.755 205 L CB -0.243 41.810 42.059 -0.010 0.000 0.904 205 L HN 0.336 8.566 8.230 -0.000 0.000 0.435 206 L N -0.557 120.651 121.223 -0.025 0.000 1.961 206 L HA -0.203 4.134 4.340 -0.005 0.000 0.210 206 L C 2.887 179.740 176.870 -0.028 0.000 1.072 206 L CA 1.339 56.162 54.840 -0.029 0.000 0.749 206 L CB -0.752 41.282 42.059 -0.042 0.000 0.889 206 L HN 0.218 8.448 8.230 -0.000 0.000 0.432 207 A N 0.020 122.821 122.820 -0.033 0.000 1.940 207 A HA -0.336 3.981 4.320 -0.005 0.000 0.221 207 A C 2.303 179.876 177.584 -0.017 0.000 1.190 207 A CA 2.429 54.450 52.037 -0.027 0.000 0.647 207 A CB -0.651 18.333 19.000 -0.028 0.000 0.821 207 A HN 0.328 8.478 8.150 -0.000 0.000 0.457 208 R N -0.187 120.305 120.500 -0.014 0.000 2.081 208 R HA -0.004 4.333 4.340 -0.005 0.000 0.235 208 R C 2.114 178.409 176.300 -0.008 0.000 1.131 208 R CA 1.823 57.918 56.100 -0.009 0.000 0.960 208 R CB -0.782 29.513 30.300 -0.007 0.000 0.856 208 R HN 0.434 8.704 8.270 -0.000 0.000 0.436 209 A N -0.293 122.521 122.820 -0.011 0.000 2.119 209 A HA 0.130 4.447 4.320 -0.005 0.000 0.217 209 A C 2.150 179.728 177.584 -0.010 0.000 1.153 209 A CA 1.173 53.204 52.037 -0.010 0.000 0.692 209 A CB -0.593 18.401 19.000 -0.011 0.000 0.799 209 A HN 0.425 8.575 8.150 -0.000 0.000 0.458 210 A N -0.718 122.095 122.820 -0.012 0.000 2.067 210 A HA 0.046 4.363 4.320 -0.005 0.000 0.219 210 A C 0.897 178.476 177.584 -0.008 0.000 1.158 210 A CA 1.103 53.133 52.037 -0.012 0.000 0.661 210 A CB -0.422 18.568 19.000 -0.016 0.000 0.801 210 A HN 0.593 8.743 8.150 -0.000 0.000 0.452 211 E N -2.814 117.383 120.200 -0.006 0.000 2.297 211 E HA -0.227 4.119 4.350 -0.005 0.000 0.228 211 E C 0.813 177.412 176.600 -0.001 0.000 1.213 211 E CA 0.419 56.818 56.400 -0.002 0.000 0.712 211 E CB -1.865 27.835 29.700 -0.001 0.000 1.202 211 E HN 1.498 9.858 8.360 -0.000 0.000 0.376 212 G N -0.504 108.294 108.800 -0.003 0.000 2.176 212 G HA2 -0.356 3.601 3.960 -0.005 0.000 0.253 212 G HA3 -0.356 3.601 3.960 -0.005 0.000 0.253 212 G C 0.162 175.058 174.900 -0.007 0.000 0.979 212 G CA 0.386 45.484 45.100 -0.003 0.000 0.641 212 G HN 0.656 8.946 8.290 -0.000 0.000 0.530 213 S N -0.153 115.541 115.700 -0.009 0.000 2.433 213 S HA 0.594 5.061 4.470 -0.005 0.000 0.310 213 S C 1.205 175.794 174.600 -0.017 0.000 1.097 213 S CA -0.401 57.792 58.200 -0.012 0.000 1.103 213 S CB 1.131 64.326 63.200 -0.008 0.000 0.992 213 S HN 0.594 8.904 8.310 -0.000 0.000 0.469 214 L N 5.577 126.787 121.223 -0.022 0.000 2.275 214 L HA 0.216 4.553 4.340 -0.005 0.000 0.215 214 L C 2.247 179.106 176.870 -0.019 0.000 1.119 214 L CA 1.496 56.319 54.840 -0.027 0.000 0.790 214 L CB -0.753 41.285 42.059 -0.035 0.000 0.919 214 L HN 0.781 9.011 8.230 -0.000 0.000 0.443 215 R N -0.586 119.907 120.500 -0.012 0.000 2.055 215 R HA -0.110 4.227 4.340 -0.005 0.000 0.226 215 R C 1.707 178.005 176.300 -0.004 0.000 1.135 215 R CA 1.490 57.588 56.100 -0.003 0.000 0.959 215 R CB -0.126 30.175 30.300 0.002 0.000 0.854 215 R HN 0.243 8.513 8.270 -0.000 0.000 0.431 216 D N 0.436 120.833 120.400 -0.005 0.000 2.280 216 D HA -0.190 4.447 4.640 -0.005 0.000 0.206 216 D C 1.443 177.736 176.300 -0.010 0.000 0.988 216 D CA 1.395 55.392 54.000 -0.005 0.000 0.886 216 D CB -0.051 40.746 40.800 -0.005 0.000 0.914 216 D HN 0.423 8.793 8.370 -0.000 0.000 0.473 217 A N 0.128 122.939 122.820 -0.016 0.000 1.843 217 A HA -0.022 4.295 4.320 -0.005 0.000 0.213 217 A C 2.161 179.729 177.584 -0.026 0.000 1.202 217 A CA 0.632 52.654 52.037 -0.025 0.000 0.607 217 A CB -0.722 18.257 19.000 -0.034 0.000 0.847 217 A HN 0.192 8.342 8.150 -0.000 0.000 0.445 218 L N -0.019 121.191 121.223 -0.021 0.000 2.191 218 L HA -0.140 4.197 4.340 -0.005 0.000 0.212 218 L C 2.730 179.602 176.870 0.002 0.000 1.103 218 L CA 1.253 56.086 54.840 -0.012 0.000 0.769 218 L CB -0.452 41.613 42.059 0.009 0.000 0.908 218 L HN 0.313 8.543 8.230 -0.000 0.000 0.438 219 S N 0.123 115.825 115.700 0.004 0.000 2.368 219 S HA -0.084 4.383 4.470 -0.005 0.000 0.224 219 S C 1.983 176.583 174.600 0.000 0.000 1.029 219 S CA 1.021 59.226 58.200 0.007 0.000 0.988 219 S CB -0.204 63.001 63.200 0.007 0.000 0.838 219 S HN 0.302 8.612 8.310 -0.000 0.000 0.462 220 L N 1.078 122.297 121.223 -0.007 0.000 2.131 220 L HA -0.123 4.214 4.340 -0.005 0.000 0.210 220 L C 2.556 179.417 176.870 -0.015 0.000 1.092 220 L CA 1.044 55.878 54.840 -0.011 0.000 0.759 220 L CB -0.858 41.192 42.059 -0.014 0.000 0.903 220 L HN 0.342 8.572 8.230 -0.000 0.000 0.435 221 T N -1.270 113.272 114.554 -0.021 0.000 2.668 221 T HA -0.185 4.162 4.350 -0.005 0.000 0.262 221 T C 1.488 176.178 174.700 -0.017 0.000 1.045 221 T CA 1.290 63.374 62.100 -0.027 0.000 1.152 221 T CB -0.226 68.615 68.868 -0.044 0.000 0.864 221 T HN 0.271 8.511 8.240 -0.000 0.000 0.419 222 D N 0.846 121.243 120.400 -0.006 0.000 2.157 222 D HA -0.167 4.470 4.640 -0.005 0.000 0.191 222 D C 2.208 178.507 176.300 -0.002 0.000 1.004 222 D CA 1.448 55.449 54.000 0.001 0.000 0.854 222 D CB -0.338 40.472 40.800 0.018 0.000 0.936 222 D HN 0.521 8.891 8.370 -0.000 0.000 0.446 223 Q N 0.211 120.011 119.800 0.000 0.000 2.050 223 Q HA -0.146 4.191 4.340 -0.005 0.000 0.202 223 Q C 2.095 178.093 176.000 -0.004 0.000 0.980 223 Q CA 1.801 57.604 55.803 0.001 0.000 0.840 223 Q CB -0.137 28.602 28.738 0.001 0.000 0.898 223 Q HN 0.194 8.464 8.270 -0.000 0.000 0.424 224 A N 1.385 124.200 122.820 -0.008 0.000 1.869 224 A HA -0.256 4.061 4.320 -0.005 0.000 0.218 224 A C 2.060 179.638 177.584 -0.010 0.000 1.203 224 A CA 1.971 54.003 52.037 -0.009 0.000 0.638 224 A CB -1.148 17.844 19.000 -0.014 0.000 0.831 224 A HN 0.563 8.713 8.150 -0.000 0.000 0.450 225 I N -0.302 120.258 120.570 -0.016 0.000 2.300 225 I HA -0.379 3.788 4.170 -0.005 0.000 0.252 225 I C 2.851 178.957 176.117 -0.018 0.000 1.119 225 I CA 1.150 62.436 61.300 -0.023 0.000 1.384 225 I CB -0.414 37.562 38.000 -0.040 0.000 1.062 225 I HN 0.435 8.645 8.210 -0.000 0.000 0.426 226 A N 0.502 123.317 122.820 -0.009 0.000 1.840 226 A HA -0.169 4.148 4.320 -0.005 0.000 0.214 226 A C 2.467 180.051 177.584 0.001 0.000 1.198 226 A CA 1.963 53.999 52.037 -0.001 0.000 0.608 226 A CB -0.863 18.141 19.000 0.007 0.000 0.839 226 A HN 0.414 8.564 8.150 -0.000 0.000 0.443 227 S N -0.003 115.698 115.700 0.001 0.000 2.440 227 S HA -0.066 4.401 4.470 -0.005 0.000 0.238 227 S C 1.724 176.324 174.600 0.000 0.000 1.010 227 S CA 1.045 59.245 58.200 0.001 0.000 0.972 227 S CB -0.510 62.690 63.200 0.000 0.000 0.774 227 S HN 0.769 9.079 8.310 -0.000 0.000 0.501 228 G N 0.536 109.335 108.800 -0.002 0.000 2.985 228 G HA2 0.098 4.055 3.960 -0.005 0.000 0.209 228 G HA3 0.098 4.055 3.960 -0.005 0.000 0.209 228 G C 0.092 174.990 174.900 -0.003 0.000 1.165 228 G CA 0.066 45.164 45.100 -0.003 0.000 0.776 228 G HN 0.364 8.654 8.290 -0.000 0.000 0.541 229 D N -0.682 119.717 120.400 -0.002 0.000 2.689 229 D HA -0.151 4.486 4.640 -0.005 0.000 0.237 229 D C 1.513 177.809 176.300 -0.006 0.000 1.148 229 D CA 1.665 55.666 54.000 0.000 0.000 0.656 229 D CB -1.331 39.472 40.800 0.005 0.000 1.050 229 D HN 0.951 9.321 8.370 -0.000 0.000 0.426 230 G N -0.722 108.068 108.800 -0.016 0.000 2.238 230 G HA2 -0.263 3.693 3.960 -0.005 0.000 0.217 230 G HA3 -0.263 3.693 3.960 -0.005 0.000 0.217 230 G C 0.182 175.071 174.900 -0.019 0.000 0.996 230 G CA 0.285 45.369 45.100 -0.026 0.000 0.632 230 G HN 0.514 8.804 8.290 -0.000 0.000 0.503 231 Q N 0.003 119.797 119.800 -0.010 0.000 2.309 231 Q HA 0.600 4.937 4.340 -0.005 0.000 0.264 231 Q C -0.601 175.401 176.000 0.003 0.000 1.008 231 Q CA -0.695 55.106 55.803 -0.004 0.000 0.853 231 Q CB 2.808 31.542 28.738 -0.007 0.000 1.314 231 Q HN 0.120 8.390 8.270 -0.000 0.000 0.448 232 V N 3.065 122.991 119.914 0.019 0.000 2.270 232 V HA 0.161 4.278 4.120 -0.005 0.000 0.263 232 V C -0.192 175.919 176.094 0.029 0.000 1.066 232 V CA -0.222 62.092 62.300 0.025 0.000 0.857 232 V CB 0.359 32.206 31.823 0.040 0.000 1.099 232 V HN 0.756 8.946 8.190 -0.000 0.000 0.476 233 S N 2.199 117.906 115.700 0.012 0.000 2.593 233 S HA 0.388 4.855 4.470 -0.005 0.000 0.297 233 S C 1.106 175.709 174.600 0.006 0.000 1.112 233 S CA -0.464 57.741 58.200 0.008 0.000 1.043 233 S CB 1.703 64.903 63.200 -0.000 0.000 1.054 233 S HN 0.485 8.795 8.310 -0.000 0.000 0.516 234 T N 2.167 116.724 114.554 0.005 0.000 2.684 234 T HA -0.186 4.161 4.350 -0.005 0.000 0.267 234 T C 1.857 176.557 174.700 -0.000 0.000 1.036 234 T CA 2.104 64.205 62.100 0.002 0.000 1.148 234 T CB -0.648 68.221 68.868 0.002 0.000 0.863 234 T HN 0.789 9.029 8.240 -0.000 0.000 0.436 235 Q N 1.037 120.837 119.800 -0.001 0.000 2.224 235 Q HA -0.220 4.116 4.340 -0.005 0.000 0.213 235 Q C 2.456 178.455 176.000 -0.002 0.000 0.998 235 Q CA 1.855 57.657 55.803 -0.002 0.000 0.895 235 Q CB -0.406 28.330 28.738 -0.003 0.000 0.926 235 Q HN 0.603 8.873 8.270 -0.000 0.000 0.417 236 A N -0.001 122.818 122.820 -0.001 0.000 1.901 236 A HA 0.048 4.365 4.320 -0.005 0.000 0.210 236 A C 2.308 179.891 177.584 -0.002 0.000 1.208 236 A CA 0.472 52.508 52.037 -0.001 0.000 0.644 236 A CB -0.320 18.679 19.000 -0.001 0.000 0.863 236 A HN 0.162 8.312 8.150 -0.000 0.000 0.454 237 V N 1.013 120.926 119.914 -0.002 0.000 2.307 237 V HA -0.230 3.887 4.120 -0.005 0.000 0.245 237 V C 3.046 179.137 176.094 -0.005 0.000 1.045 237 V CA 2.418 64.716 62.300 -0.005 0.000 1.024 237 V CB -0.763 31.056 31.823 -0.006 0.000 0.651 237 V HN 0.795 8.985 8.190 -0.000 0.000 0.449 238 S N 1.119 116.817 115.700 -0.004 0.000 2.380 238 S HA -0.286 4.181 4.470 -0.005 0.000 0.229 238 S C 2.097 176.695 174.600 -0.003 0.000 1.043 238 S CA 1.997 60.195 58.200 -0.003 0.000 1.038 238 S CB -0.634 62.565 63.200 -0.003 0.000 0.872 238 S HN 0.627 8.937 8.310 -0.000 0.000 0.456 239 A N 2.563 125.381 122.820 -0.003 0.000 1.852 239 A HA -0.138 4.179 4.320 -0.005 0.000 0.217 239 A C 2.458 180.040 177.584 -0.003 0.000 1.215 239 A CA 2.186 54.221 52.037 -0.002 0.000 0.641 239 A CB -1.226 17.773 19.000 -0.001 0.000 0.838 239 A HN 0.682 8.832 8.150 -0.000 0.000 0.450 240 M N -0.694 118.904 119.600 -0.003 0.000 2.144 240 M HA -0.160 4.316 4.480 -0.005 0.000 0.260 240 M C 1.886 178.183 176.300 -0.006 0.000 1.067 240 M CA 1.763 57.060 55.300 -0.004 0.000 1.095 240 M CB -0.319 32.279 32.600 -0.004 0.000 1.365 240 M HN 0.457 8.747 8.290 -0.000 0.000 0.406 241 L N -0.989 120.230 121.223 -0.006 0.000 2.291 241 L HA -0.036 4.301 4.340 -0.005 0.000 0.214 241 L C 2.471 179.337 176.870 -0.007 0.000 1.120 241 L CA 0.810 55.646 54.840 -0.007 0.000 0.799 241 L CB -0.827 41.228 42.059 -0.007 0.000 0.925 241 L HN 0.440 8.670 8.230 -0.000 0.000 0.446 242 G N -1.003 107.794 108.800 -0.006 0.000 2.464 242 G HA2 -0.174 3.783 3.960 -0.005 0.000 0.217 242 G HA3 -0.174 3.783 3.960 -0.005 0.000 0.217 242 G C 1.541 176.436 174.900 -0.007 0.000 1.138 242 G CA 0.864 45.961 45.100 -0.005 0.000 0.793 242 G HN 0.203 8.493 8.290 -0.000 0.000 0.539 243 T N 1.216 115.766 114.554 -0.007 0.000 2.685 243 T HA -0.103 4.244 4.350 -0.005 0.000 0.268 243 T C 1.872 176.565 174.700 -0.013 0.000 1.034 243 T CA 0.945 63.040 62.100 -0.009 0.000 1.149 243 T CB -0.160 68.704 68.868 -0.007 0.000 0.860 243 T HN 0.168 8.408 8.240 -0.000 0.000 0.449 244 L N 0.610 121.826 121.223 -0.012 0.000 2.818 244 L HA 0.272 4.609 4.340 -0.005 0.000 0.243 244 L C -0.100 176.760 176.870 -0.016 0.000 1.185 244 L CA -0.342 54.489 54.840 -0.014 0.000 0.988 244 L CB 0.210 42.262 42.059 -0.011 0.000 1.292 244 L HN -0.044 8.186 8.230 -0.000 0.000 0.519 245 D N 0.907 121.297 120.400 -0.016 0.000 2.382 245 D HA -0.021 4.615 4.640 -0.005 0.000 0.259 245 D C 0.793 177.080 176.300 -0.021 0.000 1.224 245 D CA 0.261 54.252 54.000 -0.015 0.000 0.894 245 D CB 1.297 42.090 40.800 -0.012 0.000 1.127 245 D HN 0.045 8.415 8.370 -0.000 0.000 0.487 246 D N 1.802 122.190 120.400 -0.019 0.000 2.144 246 D HA -0.148 4.489 4.640 -0.005 0.000 0.200 246 D C 1.373 177.662 176.300 -0.018 0.000 0.978 246 D CA 0.529 54.517 54.000 -0.021 0.000 0.833 246 D CB 0.147 40.938 40.800 -0.015 0.000 0.961 246 D HN 0.420 8.790 8.370 -0.000 0.000 0.470 247 D N 0.797 121.190 120.400 -0.011 0.000 3.048 247 D HA -0.269 4.368 4.640 -0.005 0.000 0.192 247 D C 1.808 178.105 176.300 -0.003 0.000 1.125 247 D CA 1.593 55.589 54.000 -0.006 0.000 0.878 247 D CB -0.258 40.540 40.800 -0.004 0.000 0.924 247 D HN 0.109 8.479 8.370 -0.000 0.000 0.496 248 Q N -0.333 119.464 119.800 -0.006 0.000 2.274 248 Q HA -0.267 4.070 4.340 -0.005 0.000 0.217 248 Q C 2.017 178.024 176.000 0.012 0.000 1.008 248 Q CA 2.614 58.419 55.803 0.003 0.000 0.925 248 Q CB -0.551 28.186 28.738 -0.001 0.000 0.957 248 Q HN 0.487 8.757 8.270 -0.000 0.000 0.416 249 A N -0.486 122.338 122.820 0.007 0.000 1.878 249 A HA -0.032 4.285 4.320 -0.005 0.000 0.213 249 A C 1.938 179.527 177.584 0.009 0.000 1.192 249 A CA 0.975 53.020 52.037 0.013 0.000 0.619 249 A CB -0.650 18.357 19.000 0.011 0.000 0.837 249 A HN 0.359 8.509 8.150 -0.000 0.000 0.446 250 L N -0.105 121.124 121.223 0.009 0.000 2.079 250 L HA -0.120 4.217 4.340 -0.005 0.000 0.210 250 L C 2.392 179.265 176.870 0.004 0.000 1.081 250 L CA 2.607 57.453 54.840 0.010 0.000 0.752 250 L CB -0.737 41.329 42.059 0.012 0.000 0.896 250 L HN 0.279 8.509 8.230 -0.000 0.000 0.433 251 S N -1.075 114.627 115.700 0.003 0.000 2.383 251 S HA -0.069 4.397 4.470 -0.005 0.000 0.227 251 S C 1.933 176.529 174.600 -0.007 0.000 1.026 251 S CA 1.258 59.458 58.200 -0.000 0.000 0.981 251 S CB -0.311 62.890 63.200 0.002 0.000 0.818 251 S HN 0.514 8.824 8.310 -0.000 0.000 0.472 252 L N 0.619 121.839 121.223 -0.006 0.000 2.156 252 L HA -0.040 4.297 4.340 -0.005 0.000 0.208 252 L C 2.249 179.091 176.870 -0.048 0.000 1.095 252 L CA 0.604 55.433 54.840 -0.019 0.000 0.770 252 L CB -0.404 41.654 42.059 -0.001 0.000 0.914 252 L HN 0.210 8.440 8.230 -0.000 0.000 0.439 253 V N 0.089 119.980 119.914 -0.039 0.000 2.233 253 V HA -0.324 3.793 4.120 -0.005 0.000 0.247 253 V C 2.327 178.384 176.094 -0.062 0.000 1.050 253 V CA 2.010 64.275 62.300 -0.060 0.000 1.010 253 V CB -0.513 31.300 31.823 -0.016 0.000 0.637 253 V HN 0.463 8.653 8.190 -0.000 0.000 0.444 254 E N 0.324 120.508 120.200 -0.026 0.000 2.086 254 E HA -0.299 4.048 4.350 -0.005 0.000 0.205 254 E C 2.148 178.730 176.600 -0.031 0.000 1.027 254 E CA 1.695 58.086 56.400 -0.015 0.000 0.830 254 E CB -0.402 29.296 29.700 -0.003 0.000 0.751 254 E HN 0.608 8.968 8.360 -0.000 0.000 0.456 255 A N 0.496 123.291 122.820 -0.041 0.000 2.168 255 A HA -0.055 4.262 4.320 -0.005 0.000 0.215 255 A C 1.950 179.479 177.584 -0.091 0.000 1.152 255 A CA 0.771 52.777 52.037 -0.051 0.000 0.716 255 A CB -0.301 18.676 19.000 -0.038 0.000 0.794 255 A HN 0.253 8.403 8.150 -0.000 0.000 0.465 256 M N -0.946 118.579 119.600 -0.125 0.000 2.216 256 M HA -0.025 4.451 4.480 -0.005 0.000 0.264 256 M C 1.813 177.971 176.300 -0.236 0.000 1.080 256 M CA 1.438 56.615 55.300 -0.204 0.000 1.153 256 M CB -0.071 32.368 32.600 -0.269 0.000 1.356 256 M HN 0.145 8.435 8.290 -0.000 0.000 0.432 257 V N 1.458 121.271 119.914 -0.169 0.000 2.332 257 V HA -0.279 3.838 4.120 -0.005 0.000 0.248 257 V C 1.741 177.913 176.094 0.131 0.000 1.055 257 V CA 2.137 64.476 62.300 0.066 0.000 1.038 257 V CB -0.800 31.081 31.823 0.096 0.000 0.651 257 V HN 0.551 8.741 8.190 -0.000 0.000 0.450 258 E N -0.422 119.784 120.200 0.010 0.000 2.516 258 E HA 0.186 4.533 4.350 -0.005 0.000 0.199 258 E C 1.436 177.993 176.600 -0.072 0.000 1.069 258 E CA 0.595 56.998 56.400 0.006 0.000 0.876 258 E CB -0.121 29.578 29.700 -0.001 0.000 0.843 258 E HN 0.575 8.935 8.360 -0.000 0.000 0.530 259 A N 1.211 123.894 122.820 -0.230 0.000 3.172 259 A HA -0.262 4.055 4.320 -0.005 0.000 0.263 259 A C 0.488 177.975 177.584 -0.163 0.000 1.215 259 A CA 0.915 52.753 52.037 -0.333 0.000 1.065 259 A CB -2.330 16.482 19.000 -0.314 0.000 1.148 259 A HN 0.353 8.503 8.150 -0.000 0.000 0.904 260 N N 0.583 119.219 118.700 -0.106 0.000 2.498 260 N HA 0.404 5.141 4.740 -0.005 0.000 0.277 260 N C 1.384 176.857 175.510 -0.061 0.000 1.208 260 N CA 1.137 54.148 53.050 -0.065 0.000 1.029 260 N CB 0.107 38.568 38.487 -0.043 0.000 1.403 260 N HN 0.491 8.871 8.380 -0.000 0.000 0.500 261 G N 1.686 110.450 108.800 -0.059 0.000 2.471 261 G HA2 -0.262 3.695 3.960 -0.005 0.000 0.219 261 G HA3 -0.262 3.695 3.960 -0.005 0.000 0.219 261 G C 1.296 176.177 174.900 -0.032 0.000 1.125 261 G CA 0.632 45.703 45.100 -0.048 0.000 0.775 261 G HN 0.627 8.917 8.290 -0.000 0.000 0.548 262 E N 0.575 120.760 120.200 -0.026 0.000 2.072 262 E HA -0.053 4.294 4.350 -0.005 0.000 0.190 262 E C 2.347 178.938 176.600 -0.014 0.000 0.982 262 E CA 0.852 57.242 56.400 -0.017 0.000 0.803 262 E CB -0.304 29.388 29.700 -0.013 0.000 0.755 262 E HN 0.372 8.732 8.360 -0.000 0.000 0.453 263 R N -0.063 120.427 120.500 -0.017 0.000 2.148 263 R HA -0.050 4.286 4.340 -0.005 0.000 0.227 263 R C 1.986 178.278 176.300 -0.014 0.000 1.103 263 R CA 1.181 57.273 56.100 -0.013 0.000 0.983 263 R CB -0.084 30.206 30.300 -0.016 0.000 0.874 263 R HN 0.177 8.447 8.270 -0.000 0.000 0.451 264 V N 0.617 120.517 119.914 -0.024 0.000 2.379 264 V HA -0.200 3.917 4.120 -0.005 0.000 0.245 264 V C 2.187 178.276 176.094 -0.009 0.000 1.044 264 V CA 1.462 63.747 62.300 -0.024 0.000 1.036 264 V CB -0.169 31.628 31.823 -0.044 0.000 0.664 264 V HN 0.372 8.562 8.190 -0.000 0.000 0.453 265 M N -0.698 118.895 119.600 -0.011 0.000 2.541 265 M HA 0.135 4.612 4.480 -0.005 0.000 0.252 265 M C 2.121 178.428 176.300 0.012 0.000 1.125 265 M CA 1.208 56.505 55.300 -0.005 0.000 1.091 265 M CB -0.793 31.799 32.600 -0.015 0.000 1.420 265 M HN 0.392 8.682 8.290 -0.000 0.000 0.486 266 A N 0.228 123.055 122.820 0.011 0.000 2.021 266 A HA 0.055 4.371 4.320 -0.005 0.000 0.216 266 A C 2.175 179.778 177.584 0.032 0.000 1.163 266 A CA 0.606 52.654 52.037 0.019 0.000 0.676 266 A CB -0.417 18.590 19.000 0.010 0.000 0.818 266 A HN 0.397 8.547 8.150 -0.000 0.000 0.453 267 L N -0.469 120.773 121.223 0.031 0.000 2.109 267 L HA -0.070 4.266 4.340 -0.005 0.000 0.207 267 L C 2.308 179.229 176.870 0.084 0.000 1.086 267 L CA 0.938 55.803 54.840 0.042 0.000 0.760 267 L CB -0.357 41.719 42.059 0.028 0.000 0.910 267 L HN 0.372 8.602 8.230 -0.000 0.000 0.437 268 I N -0.104 120.524 120.570 0.097 0.000 2.361 268 I HA -0.298 3.869 4.170 -0.005 0.000 0.251 268 I C 2.278 178.539 176.117 0.240 0.000 1.133 268 I CA 0.956 62.365 61.300 0.182 0.000 1.413 268 I CB -0.282 37.764 38.000 0.077 0.000 1.073 268 I HN 0.381 8.591 8.210 -0.000 0.000 0.424 269 N N 0.785 119.566 118.700 0.134 0.000 2.207 269 N HA -0.188 4.549 4.740 -0.005 0.000 0.182 269 N C 1.771 177.340 175.510 0.099 0.000 1.020 269 N CA 1.085 54.208 53.050 0.121 0.000 0.858 269 N CB 0.063 38.591 38.487 0.068 0.000 0.991 269 N HN 0.339 8.719 8.380 -0.000 0.000 0.427 270 E N 0.485 120.726 120.200 0.068 0.000 2.097 270 E HA -0.164 4.183 4.350 -0.005 0.000 0.196 270 E C 1.746 178.359 176.600 0.022 0.000 1.000 270 E CA 1.409 57.831 56.400 0.036 0.000 0.804 270 E CB -0.088 29.627 29.700 0.025 0.000 0.740 270 E HN 0.367 8.727 8.360 -0.000 0.000 0.454 271 A N 0.784 123.632 122.820 0.046 0.000 1.933 271 A HA -0.096 4.220 4.320 -0.005 0.000 0.218 271 A C 2.367 179.862 177.584 -0.148 0.000 1.175 271 A CA 1.760 53.771 52.037 -0.043 0.000 0.628 271 A CB -0.749 18.259 19.000 0.013 0.000 0.814 271 A HN 0.422 8.572 8.150 -0.000 0.000 0.444 272 A N -0.195 122.637 122.820 0.020 0.000 1.930 272 A HA 0.220 4.537 4.320 -0.005 0.000 0.217 272 A C 2.481 180.050 177.584 -0.025 0.000 1.175 272 A CA 1.907 53.959 52.037 0.025 0.000 0.627 272 A CB -0.952 18.204 19.000 0.259 0.000 0.815 272 A HN 0.956 9.106 8.150 -0.000 0.000 0.443 273 A N -0.134 122.683 122.820 -0.004 0.000 1.835 273 A HA -0.190 4.127 4.320 -0.005 0.000 0.215 273 A C 2.222 179.777 177.584 -0.047 0.000 1.199 273 A CA 1.740 53.768 52.037 -0.015 0.000 0.615 273 A CB -0.662 18.337 19.000 -0.001 0.000 0.838 273 A HN 0.498 8.648 8.150 -0.000 0.000 0.444 274 R N -0.615 119.849 120.500 -0.061 0.000 2.226 274 R HA -0.135 4.202 4.340 -0.005 0.000 0.246 274 R C 1.115 177.350 176.300 -0.108 0.000 1.161 274 R CA 1.229 57.283 56.100 -0.076 0.000 0.997 274 R CB -0.561 29.689 30.300 -0.082 0.000 0.870 274 R HN 1.084 9.354 8.270 -0.000 0.000 0.465 275 G N 0.239 108.951 108.800 -0.146 0.000 2.203 275 G HA2 -0.218 3.739 3.960 -0.005 0.000 0.231 275 G HA3 -0.218 3.739 3.960 -0.005 0.000 0.231 275 G C 0.148 174.893 174.900 -0.258 0.000 1.058 275 G CA -0.002 44.997 45.100 -0.168 0.000 0.781 275 G HN 0.265 8.555 8.290 -0.000 0.000 0.496 276 I N 0.127 120.454 120.570 -0.406 0.000 3.045 276 I HA 0.081 4.248 4.170 -0.005 0.000 0.288 276 I C 1.025 176.804 176.117 -0.563 0.000 1.238 276 I CA 0.481 61.486 61.300 -0.492 0.000 1.396 276 I CB 0.754 38.373 38.000 -0.634 0.000 1.355 276 I HN 0.349 8.559 8.210 -0.000 0.000 0.601 277 E N 3.752 123.728 120.200 -0.374 0.000 2.146 277 E HA 0.067 4.414 4.350 -0.005 0.000 0.282 277 E C -0.093 176.380 176.600 -0.212 0.000 0.989 277 E CA -0.427 55.815 56.400 -0.262 0.000 0.799 277 E CB 0.720 30.346 29.700 -0.124 0.000 1.088 277 E HN 0.429 8.789 8.360 -0.000 0.000 0.397 278 W N 3.032 124.320 121.300 -0.021 0.000 2.381 278 W HA -0.115 4.541 4.660 -0.006 0.000 0.301 278 W C 2.061 178.564 176.519 -0.027 0.000 1.205 278 W CA 0.792 58.124 57.345 -0.023 0.000 1.285 278 W CB 0.113 29.560 29.460 -0.022 0.000 1.133 278 W HN 0.683 8.863 8.180 -0.000 0.000 0.521 279 E N 0.614 120.926 120.200 0.186 0.000 2.267 279 E HA -0.200 4.146 4.350 -0.005 0.000 0.197 279 E C 2.098 178.732 176.600 0.057 0.000 0.998 279 E CA 1.238 57.696 56.400 0.096 0.000 0.830 279 E CB -0.120 29.610 29.700 0.049 0.000 0.751 279 E HN 0.217 8.578 8.360 -0.000 0.000 0.491 280 A N 0.634 123.476 122.820 0.037 0.000 1.898 280 A HA -0.083 4.233 4.320 -0.005 0.000 0.214 280 A C 2.039 179.629 177.584 0.010 0.000 1.183 280 A CA 0.839 52.878 52.037 0.002 0.000 0.622 280 A CB -0.560 18.419 19.000 -0.035 0.000 0.824 280 A HN 0.362 8.512 8.150 -0.000 0.000 0.444 281 L N 0.138 121.380 121.223 0.031 0.000 1.971 281 L HA -0.190 4.147 4.340 -0.005 0.000 0.215 281 L C 2.369 179.274 176.870 0.058 0.000 1.072 281 L CA 1.828 56.700 54.840 0.054 0.000 0.758 281 L CB -0.596 41.548 42.059 0.141 0.000 0.889 281 L HN 0.430 8.660 8.230 -0.000 0.000 0.433 282 L N -1.400 119.869 121.223 0.078 0.000 2.010 282 L HA -0.335 4.002 4.340 -0.005 0.000 0.219 282 L C 2.402 179.268 176.870 -0.006 0.000 1.077 282 L CA 1.907 56.767 54.840 0.032 0.000 0.773 282 L CB -0.680 41.398 42.059 0.030 0.000 0.892 282 L HN 0.210 8.440 8.230 -0.000 0.000 0.436 283 V N -0.740 119.173 119.914 -0.002 0.000 2.515 283 V HA -0.255 3.862 4.120 -0.005 0.000 0.250 283 V C 2.365 178.454 176.094 -0.009 0.000 1.058 283 V CA 1.674 63.964 62.300 -0.016 0.000 1.064 283 V CB -0.463 31.353 31.823 -0.011 0.000 0.675 283 V HN 0.481 8.671 8.190 -0.000 0.000 0.461 284 E N -0.422 119.778 120.200 0.000 0.000 2.204 284 E HA -0.172 4.175 4.350 -0.005 0.000 0.194 284 E C 2.241 178.849 176.600 0.014 0.000 0.989 284 E CA 1.062 57.466 56.400 0.007 0.000 0.824 284 E CB 0.001 29.703 29.700 0.004 0.000 0.756 284 E HN 0.546 8.906 8.360 -0.000 0.000 0.477 285 M N 0.083 119.686 119.600 0.005 0.000 2.115 285 M HA -0.120 4.357 4.480 -0.005 0.000 0.261 285 M C 2.424 178.721 176.300 -0.004 0.000 1.079 285 M CA 1.005 56.306 55.300 0.003 0.000 1.143 285 M CB -0.346 32.249 32.600 -0.009 0.000 1.332 285 M HN 0.168 8.458 8.290 -0.000 0.000 0.421 286 L N -0.060 121.119 121.223 -0.072 0.000 2.103 286 L HA -0.233 4.104 4.340 -0.005 0.000 0.215 286 L C 2.539 179.461 176.870 0.086 0.000 1.080 286 L CA 1.564 56.309 54.840 -0.158 0.000 0.764 286 L CB -1.254 40.642 42.059 -0.271 0.000 0.890 286 L HN 0.467 8.697 8.230 -0.000 0.000 0.435 287 G N -0.622 108.221 108.800 0.072 0.000 2.408 287 G HA2 -0.103 3.854 3.960 -0.005 0.000 0.215 287 G HA3 -0.103 3.854 3.960 -0.005 0.000 0.215 287 G C 1.582 176.569 174.900 0.145 0.000 1.156 287 G CA 0.178 45.342 45.100 0.106 0.000 0.793 287 G HN 0.178 8.468 8.290 -0.000 0.000 0.535 288 L N 0.122 121.409 121.223 0.107 0.000 1.994 288 L HA -0.053 4.284 4.340 -0.005 0.000 0.208 288 L C 2.960 179.920 176.870 0.150 0.000 1.071 288 L CA 0.837 55.741 54.840 0.106 0.000 0.745 288 L CB -0.768 41.331 42.059 0.067 0.000 0.892 288 L HN 0.192 8.422 8.230 -0.000 0.000 0.431 289 L N -0.700 120.634 121.223 0.185 0.000 1.997 289 L HA -0.335 4.002 4.340 -0.005 0.000 0.216 289 L C 2.674 179.706 176.870 0.269 0.000 1.074 289 L CA 1.907 56.899 54.840 0.253 0.000 0.763 289 L CB -0.925 41.353 42.059 0.366 0.000 0.890 289 L HN 0.360 8.590 8.230 -0.000 0.000 0.434 290 H N 0.017 119.244 119.070 0.262 0.000 2.265 290 H HA -0.262 4.294 4.556 -0.000 0.000 0.295 290 H C 2.388 177.761 175.328 0.074 0.000 1.084 290 H CA 2.174 58.307 56.048 0.142 0.000 1.261 290 H CB 0.038 29.906 29.762 0.177 0.000 1.360 290 H HN -0.020 8.260 8.280 -0.000 0.000 0.487 291 R N 0.633 121.290 120.500 0.261 0.000 2.139 291 R HA -0.104 4.233 4.340 -0.005 0.000 0.243 291 R C 2.218 178.557 176.300 0.065 0.000 1.145 291 R CA 1.807 58.003 56.100 0.161 0.000 0.976 291 R CB -0.800 29.580 30.300 0.133 0.000 0.866 291 R HN 0.587 8.857 8.270 -0.000 0.000 0.449 292 I N -0.429 120.178 120.570 0.062 0.000 2.277 292 I HA -0.097 4.070 4.170 -0.005 0.000 0.243 292 I C 2.173 178.290 176.117 -0.001 0.000 1.094 292 I CA 1.123 62.446 61.300 0.039 0.000 1.393 292 I CB -0.418 37.620 38.000 0.063 0.000 1.078 292 I HN 0.181 8.391 8.210 -0.000 0.000 0.417 293 A N 0.691 123.492 122.820 -0.032 0.000 2.139 293 A HA -0.194 4.123 4.320 -0.005 0.000 0.221 293 A C 2.276 179.790 177.584 -0.116 0.000 1.159 293 A CA 1.634 53.619 52.037 -0.087 0.000 0.662 293 A CB -0.543 18.365 19.000 -0.154 0.000 0.796 293 A HN 0.439 8.589 8.150 -0.000 0.000 0.463 294 M N -1.298 118.234 119.600 -0.114 0.000 2.534 294 M HA 0.040 4.517 4.480 -0.005 0.000 0.263 294 M C 1.354 177.630 176.300 -0.039 0.000 1.152 294 M CA 0.668 55.913 55.300 -0.092 0.000 1.145 294 M CB -0.036 32.511 32.600 -0.087 0.000 1.333 294 M HN 0.111 8.401 8.290 -0.000 0.000 0.477 295 V N 0.917 120.819 119.914 -0.020 0.000 3.541 295 V HA -0.106 4.011 4.120 -0.005 0.000 0.272 295 V C 1.759 177.848 176.094 -0.009 0.000 1.215 295 V CA 1.010 63.307 62.300 -0.006 0.000 1.176 295 V CB -1.297 30.530 31.823 0.007 0.000 0.854 295 V HN 0.533 8.723 8.190 -0.000 0.000 0.496 296 Q N -0.603 119.184 119.800 -0.021 0.000 2.376 296 Q HA 0.105 4.442 4.340 -0.005 0.000 0.206 296 Q C 1.723 177.708 176.000 -0.025 0.000 0.921 296 Q CA 0.601 56.392 55.803 -0.021 0.000 0.911 296 Q CB 0.205 28.927 28.738 -0.026 0.000 1.032 296 Q HN 0.493 8.763 8.270 -0.000 0.000 0.510 297 L N -0.325 120.879 121.223 -0.032 0.000 2.354 297 L HA 0.100 4.436 4.340 -0.005 0.000 0.212 297 L C 0.843 177.701 176.870 -0.019 0.000 1.091 297 L CA 0.464 55.286 54.840 -0.029 0.000 0.828 297 L CB 0.416 42.452 42.059 -0.039 0.000 0.973 297 L HN 0.008 8.238 8.230 -0.000 0.000 0.461 298 S N -3.228 112.462 115.700 -0.016 0.000 2.552 298 S HA 0.465 4.932 4.470 -0.005 0.000 0.272 298 S C -2.550 172.048 174.600 -0.005 0.000 1.150 298 S CA -0.878 57.316 58.200 -0.009 0.000 0.849 298 S CB 1.404 64.599 63.200 -0.007 0.000 1.113 298 S HN -0.230 8.080 8.310 -0.000 0.000 0.458 299 P HA 0.116 4.536 4.420 -0.000 0.000 0.219 299 P C 1.428 178.730 177.300 0.003 0.000 1.150 299 P CA 1.640 64.741 63.100 0.002 0.000 0.814 299 P CB -0.168 31.533 31.700 0.001 0.000 0.787 300 A N -0.020 122.801 122.820 0.002 0.000 2.216 300 A HA 0.065 4.382 4.320 -0.005 0.000 0.214 300 A C 2.100 179.688 177.584 0.007 0.000 1.160 300 A CA 1.334 53.373 52.037 0.003 0.000 0.725 300 A CB -1.328 17.672 19.000 0.001 0.000 0.784 300 A HN 0.201 8.351 8.150 -0.000 0.000 0.472 301 A N -0.875 121.950 122.820 0.008 0.000 2.206 301 A HA 0.338 4.655 4.320 -0.005 0.000 0.211 301 A C 0.856 178.453 177.584 0.023 0.000 1.158 301 A CA 0.126 52.172 52.037 0.015 0.000 0.761 301 A CB -0.218 18.789 19.000 0.010 0.000 0.801 301 A HN 0.431 8.581 8.150 -0.000 0.000 0.473 302 L N 0.693 121.927 121.223 0.018 0.000 2.276 302 L HA 0.420 4.757 4.340 -0.005 0.000 0.286 302 L C 1.030 177.911 176.870 0.017 0.000 1.061 302 L CA -0.698 54.155 54.840 0.021 0.000 0.807 302 L CB 1.312 43.382 42.059 0.018 0.000 1.177 302 L HN 0.340 8.570 8.230 -0.000 0.000 0.429 303 G N 1.558 110.369 108.800 0.019 0.000 2.606 303 G HA2 -0.067 3.890 3.960 -0.005 0.000 0.252 303 G HA3 -0.067 3.890 3.960 -0.005 0.000 0.252 303 G C 0.808 175.715 174.900 0.012 0.000 1.206 303 G CA -0.387 44.722 45.100 0.015 0.000 0.861 303 G HN 0.720 9.010 8.290 -0.000 0.000 0.561 304 N N -0.184 118.521 118.700 0.009 0.000 2.137 304 N HA -0.153 4.584 4.740 -0.005 0.000 0.190 304 N C 1.717 177.235 175.510 0.013 0.000 1.017 304 N CA 1.269 54.325 53.050 0.010 0.000 0.859 304 N CB -0.130 38.360 38.487 0.006 0.000 1.002 304 N HN 0.649 9.029 8.380 -0.000 0.000 0.428 305 D N 0.341 120.749 120.400 0.013 0.000 2.087 305 D HA -0.154 4.482 4.640 -0.005 0.000 0.192 305 D C 1.843 178.152 176.300 0.014 0.000 0.993 305 D CA 1.021 55.029 54.000 0.014 0.000 0.828 305 D CB -0.014 40.794 40.800 0.013 0.000 0.968 305 D HN 0.160 8.530 8.370 -0.000 0.000 0.448 306 M N 0.651 120.260 119.600 0.016 0.000 2.358 306 M HA -0.088 4.389 4.480 -0.005 0.000 0.264 306 M C 2.353 178.662 176.300 0.014 0.000 1.064 306 M CA 0.864 56.174 55.300 0.017 0.000 1.093 306 M CB -1.274 31.337 32.600 0.020 0.000 1.401 306 M HN 0.065 8.355 8.290 -0.000 0.000 0.440 307 A N 1.099 123.927 122.820 0.014 0.000 1.941 307 A HA -0.336 3.981 4.320 -0.005 0.000 0.233 307 A C 2.426 180.017 177.584 0.011 0.000 1.649 307 A CA 3.352 55.396 52.037 0.012 0.000 0.726 307 A CB -1.311 17.696 19.000 0.013 0.000 0.843 307 A HN 0.564 8.714 8.150 -0.000 0.000 0.511 308 A N -1.524 121.302 122.820 0.009 0.000 1.930 308 A HA 0.168 4.484 4.320 -0.005 0.000 0.215 308 A C 2.117 179.706 177.584 0.008 0.000 1.176 308 A CA 1.295 53.336 52.037 0.007 0.000 0.632 308 A CB -0.415 18.588 19.000 0.005 0.000 0.819 308 A HN 0.545 8.695 8.150 -0.000 0.000 0.445 309 I N -0.250 120.326 120.570 0.010 0.000 2.676 309 I HA -0.195 3.972 4.170 -0.005 0.000 0.259 309 I C 2.391 178.516 176.117 0.014 0.000 1.194 309 I CA 1.215 62.522 61.300 0.012 0.000 1.473 309 I CB -0.061 37.948 38.000 0.014 0.000 1.096 309 I HN 0.577 8.787 8.210 -0.000 0.000 0.443 310 E N 1.114 121.322 120.200 0.014 0.000 2.023 310 E HA -0.305 4.042 4.350 -0.005 0.000 0.196 310 E C 2.255 178.863 176.600 0.014 0.000 1.003 310 E CA 1.601 58.010 56.400 0.015 0.000 0.809 310 E CB -0.128 29.580 29.700 0.014 0.000 0.755 310 E HN 0.296 8.656 8.360 -0.000 0.000 0.449 311 L N 1.603 122.834 121.223 0.012 0.000 1.997 311 L HA -0.236 4.101 4.340 -0.005 0.000 0.216 311 L C 2.448 179.326 176.870 0.014 0.000 1.074 311 L CA 2.033 56.880 54.840 0.012 0.000 0.763 311 L CB -0.688 41.377 42.059 0.010 0.000 0.890 311 L HN 0.098 8.328 8.230 -0.000 0.000 0.434 312 R N -1.531 118.978 120.500 0.014 0.000 2.113 312 R HA -0.231 4.106 4.340 -0.005 0.000 0.244 312 R C 2.242 178.554 176.300 0.020 0.000 1.142 312 R CA 2.142 58.252 56.100 0.015 0.000 0.953 312 R CB -0.452 29.856 30.300 0.014 0.000 0.860 312 R HN 0.389 8.659 8.270 -0.000 0.000 0.438 313 M N 0.171 119.784 119.600 0.021 0.000 2.086 313 M HA -0.173 4.304 4.480 -0.005 0.000 0.261 313 M C 2.174 178.490 176.300 0.025 0.000 1.067 313 M CA 1.733 57.049 55.300 0.026 0.000 1.116 313 M CB -0.730 31.887 32.600 0.028 0.000 1.348 313 M HN 0.164 8.454 8.290 -0.000 0.000 0.407 314 R N -0.228 120.284 120.500 0.021 0.000 2.127 314 R HA -0.197 4.140 4.340 -0.005 0.000 0.238 314 R C 2.075 178.387 176.300 0.019 0.000 1.134 314 R CA 1.515 57.626 56.100 0.018 0.000 0.975 314 R CB -0.375 29.933 30.300 0.014 0.000 0.865 314 R HN 0.378 8.648 8.270 -0.000 0.000 0.447 315 E N 1.056 121.269 120.200 0.020 0.000 2.076 315 E HA -0.117 4.230 4.350 -0.005 0.000 0.190 315 E C 1.798 178.415 176.600 0.028 0.000 0.979 315 E CA 0.517 56.930 56.400 0.022 0.000 0.807 315 E CB -0.110 29.602 29.700 0.020 0.000 0.761 315 E HN 0.095 8.455 8.360 -0.000 0.000 0.454 316 L N 0.213 121.455 121.223 0.032 0.000 2.079 316 L HA -0.141 4.196 4.340 -0.005 0.000 0.210 316 L C 2.172 179.069 176.870 0.045 0.000 1.081 316 L CA 2.021 56.886 54.840 0.042 0.000 0.752 316 L CB -0.696 41.389 42.059 0.043 0.000 0.896 316 L HN 0.258 8.488 8.230 -0.000 0.000 0.433 317 A N -0.684 122.157 122.820 0.036 0.000 1.855 317 A HA -0.206 4.111 4.320 -0.005 0.000 0.215 317 A C 2.382 179.982 177.584 0.027 0.000 1.191 317 A CA 1.685 53.741 52.037 0.031 0.000 0.613 317 A CB -0.536 18.477 19.000 0.022 0.000 0.829 317 A HN 0.414 8.564 8.150 -0.000 0.000 0.442 318 R N -0.356 120.158 120.500 0.023 0.000 2.094 318 R HA -0.118 4.219 4.340 -0.005 0.000 0.239 318 R C 1.342 177.657 176.300 0.024 0.000 1.137 318 R CA 1.780 57.892 56.100 0.019 0.000 0.943 318 R CB -0.915 29.395 30.300 0.017 0.000 0.850 318 R HN 0.645 8.915 8.270 -0.000 0.000 0.433 319 T N -0.639 113.934 114.554 0.031 0.000 3.591 319 T HA 0.470 4.817 4.350 -0.005 0.000 0.232 319 T C 0.222 174.954 174.700 0.054 0.000 1.116 319 T CA -0.160 61.962 62.100 0.038 0.000 1.063 319 T CB -0.642 68.248 68.868 0.037 0.000 1.227 319 T HN 0.020 8.260 8.240 -0.000 0.000 0.685 320 I N 0.775 121.375 120.570 0.050 0.000 2.842 320 I HA 0.352 4.519 4.170 -0.005 0.000 0.297 320 I C -2.852 173.285 176.117 0.033 0.000 1.380 320 I CA -2.736 58.602 61.300 0.064 0.000 1.018 320 I CB 3.027 41.087 38.000 0.101 0.000 1.311 320 I HN 0.031 8.241 8.210 -0.000 0.000 0.439 321 P HA 0.301 4.721 4.420 -0.000 0.000 0.286 321 P C -2.326 174.959 177.300 -0.025 0.000 1.321 321 P CA -1.604 61.487 63.100 -0.014 0.000 0.790 321 P CB 0.394 32.071 31.700 -0.038 0.000 0.897 322 P HA -0.140 4.280 4.420 -0.000 0.000 0.231 322 P C 1.287 178.557 177.300 -0.050 0.000 1.158 322 P CA 1.347 64.429 63.100 -0.031 0.000 0.763 322 P CB -0.222 31.458 31.700 -0.032 0.000 0.805 323 T N -5.360 109.158 114.554 -0.059 0.000 3.035 323 T HA -0.019 4.328 4.350 -0.005 0.000 0.259 323 T C 1.481 176.116 174.700 -0.109 0.000 1.078 323 T CA 0.672 62.728 62.100 -0.072 0.000 1.132 323 T CB -0.603 68.227 68.868 -0.064 0.000 0.900 323 T HN -0.099 8.141 8.240 -0.000 0.000 0.480 324 D N 1.338 121.652 120.400 -0.142 0.000 2.103 324 D HA 0.107 4.743 4.640 -0.005 0.000 0.199 324 D C 2.070 178.195 176.300 -0.292 0.000 0.978 324 D CA 0.583 54.413 54.000 -0.283 0.000 0.829 324 D CB -0.336 40.300 40.800 -0.274 0.000 0.981 324 D HN 0.352 8.722 8.370 -0.000 0.000 0.464 325 I N 0.488 121.012 120.570 -0.077 0.000 2.118 325 I HA -0.340 3.827 4.170 -0.005 0.000 0.241 325 I C 2.296 178.462 176.117 0.082 0.000 1.070 325 I CA 1.341 62.687 61.300 0.077 0.000 1.327 325 I CB -0.185 37.867 38.000 0.085 0.000 1.034 325 I HN 0.046 8.256 8.210 -0.000 0.000 0.405 326 Q N 0.606 120.406 119.800 -0.001 0.000 2.437 326 Q HA -0.199 4.138 4.340 -0.005 0.000 0.210 326 Q C 1.824 177.852 176.000 0.048 0.000 0.972 326 Q CA 1.035 56.844 55.803 0.010 0.000 0.903 326 Q CB -0.054 28.643 28.738 -0.069 0.000 0.967 326 Q HN 0.442 8.712 8.270 -0.000 0.000 0.486 327 L N -0.827 120.370 121.223 -0.044 0.000 2.007 327 L HA -0.103 4.234 4.340 -0.005 0.000 0.205 327 L C 1.437 178.330 176.870 0.038 0.000 1.073 327 L CA 1.725 56.522 54.840 -0.072 0.000 0.744 327 L CB -0.799 41.126 42.059 -0.222 0.000 0.898 327 L HN 0.233 8.463 8.230 -0.000 0.000 0.435 328 Y N -1.025 119.337 120.300 0.104 0.000 2.053 328 Y HA -0.346 4.200 4.550 -0.006 0.000 0.277 328 Y C 2.612 178.580 175.900 0.113 0.000 1.159 328 Y CA 1.975 60.138 58.100 0.106 0.000 1.125 328 Y CB -1.624 36.904 38.460 0.113 0.000 0.969 328 Y HN 0.262 8.542 8.280 -0.000 0.000 0.492 329 Y N 1.037 121.457 120.300 0.200 0.000 2.096 329 Y HA -0.424 4.124 4.550 -0.003 0.000 0.278 329 Y C 2.456 178.405 175.900 0.082 0.000 1.192 329 Y CA 2.420 60.593 58.100 0.122 0.000 1.143 329 Y CB -0.397 38.121 38.460 0.097 0.000 0.963 329 Y HN 0.280 8.560 8.280 -0.000 0.000 0.505 330 Q N -1.337 118.626 119.800 0.271 0.000 2.170 330 Q HA -0.165 4.172 4.340 -0.005 0.000 0.203 330 Q C 2.038 178.077 176.000 0.065 0.000 0.976 330 Q CA 2.100 57.999 55.803 0.160 0.000 0.858 330 Q CB -0.244 28.549 28.738 0.091 0.000 0.907 330 Q HN 0.485 8.755 8.270 -0.000 0.000 0.433 331 T N 1.029 115.621 114.554 0.063 0.000 2.812 331 T HA -0.040 4.307 4.350 -0.005 0.000 0.264 331 T C 1.881 176.583 174.700 0.004 0.000 1.042 331 T CA 0.661 62.778 62.100 0.029 0.000 1.140 331 T CB -0.162 68.754 68.868 0.080 0.000 0.870 331 T HN 0.143 8.383 8.240 -0.000 0.000 0.445 332 L N 0.215 121.428 121.223 -0.016 0.000 2.056 332 L HA -0.011 4.325 4.340 -0.005 0.000 0.207 332 L C 2.492 179.301 176.870 -0.100 0.000 1.078 332 L CA 0.726 55.524 54.840 -0.070 0.000 0.749 332 L CB -0.506 41.482 42.059 -0.119 0.000 0.901 332 L HN 0.203 8.433 8.230 -0.000 0.000 0.433 333 L N 0.097 121.238 121.223 -0.137 0.000 2.083 333 L HA -0.196 4.141 4.340 -0.005 0.000 0.209 333 L C 2.243 179.098 176.870 -0.025 0.000 1.083 333 L CA 1.739 56.524 54.840 -0.092 0.000 0.752 333 L CB -0.325 41.703 42.059 -0.051 0.000 0.899 333 L HN 0.102 8.332 8.230 -0.000 0.000 0.433 334 I N -1.132 119.431 120.570 -0.012 0.000 2.202 334 I HA -0.173 3.993 4.170 -0.005 0.000 0.242 334 I C 2.512 178.631 176.117 0.003 0.000 1.091 334 I CA 1.166 62.466 61.300 -0.000 0.000 1.368 334 I CB -1.142 36.851 38.000 -0.011 0.000 1.058 334 I HN 0.350 8.560 8.210 -0.000 0.000 0.410 335 G N 0.828 109.624 108.800 -0.008 0.000 2.505 335 G HA2 -0.334 3.623 3.960 -0.005 0.000 0.220 335 G HA3 -0.334 3.623 3.960 -0.005 0.000 0.220 335 G C 1.747 176.647 174.900 -0.000 0.000 1.145 335 G CA 1.118 46.215 45.100 -0.005 0.000 0.761 335 G HN 0.275 8.565 8.290 -0.000 0.000 0.571 336 R N 0.492 120.987 120.500 -0.008 0.000 2.096 336 R HA -0.076 4.260 4.340 -0.005 0.000 0.229 336 R C 2.615 178.923 176.300 0.013 0.000 1.134 336 R CA 1.879 57.977 56.100 -0.004 0.000 0.917 336 R CB -0.352 29.939 30.300 -0.016 0.000 0.832 336 R HN 0.272 8.542 8.270 -0.000 0.000 0.430 337 K N 0.026 120.442 120.400 0.026 0.000 2.242 337 K HA -0.220 4.097 4.320 -0.005 0.000 0.206 337 K C 1.901 178.572 176.600 0.118 0.000 1.045 337 K CA 1.976 58.299 56.287 0.060 0.000 0.930 337 K CB -0.063 32.471 32.500 0.058 0.000 0.726 337 K HN 0.445 8.695 8.250 -0.000 0.000 0.462 338 E N 0.169 120.428 120.200 0.098 0.000 2.340 338 E HA -0.053 4.293 4.350 -0.005 0.000 0.194 338 E C 1.802 178.466 176.600 0.106 0.000 0.996 338 E CA -0.019 56.472 56.400 0.152 0.000 0.869 338 E CB 0.122 29.870 29.700 0.080 0.000 0.835 338 E HN 0.117 8.477 8.360 -0.000 0.000 0.493 339 L N 1.804 123.038 121.223 0.019 0.000 2.079 339 L HA -0.122 4.215 4.340 -0.005 0.000 0.210 339 L C -1.065 175.756 176.870 -0.083 0.000 1.081 339 L CA 1.775 56.600 54.840 -0.025 0.000 0.752 339 L CB -0.566 41.482 42.059 -0.018 0.000 0.896 339 L HN 0.063 8.293 8.230 -0.000 0.000 0.433 340 P HA -0.076 4.344 4.420 -0.000 0.000 0.237 340 P C 0.416 177.464 177.300 -0.420 0.000 1.178 340 P CA 1.364 64.257 63.100 -0.345 0.000 0.766 340 P CB -0.055 31.314 31.700 -0.551 0.000 0.876 341 Y N -0.468 119.829 120.300 -0.006 0.000 2.558 341 Y HA 0.402 4.948 4.550 -0.006 0.000 0.273 341 Y C 1.621 177.512 175.900 -0.015 0.000 1.100 341 Y CA -0.394 57.701 58.100 -0.008 0.000 1.276 341 Y CB -0.718 37.738 38.460 -0.008 0.000 1.196 341 Y HN -0.219 8.061 8.280 -0.000 0.000 0.527 342 A N 2.227 125.105 122.820 0.097 0.000 2.586 342 A HA -0.032 4.285 4.320 -0.005 0.000 0.231 342 A C -1.515 176.073 177.584 0.008 0.000 1.055 342 A CA -0.663 51.391 52.037 0.030 0.000 0.756 342 A CB -0.323 18.668 19.000 -0.015 0.000 0.988 342 A HN 0.198 8.348 8.150 -0.000 0.000 0.509 343 P HA 0.048 4.468 4.420 -0.000 0.000 0.222 343 P C -0.084 177.204 177.300 -0.020 0.000 1.153 343 P CA 1.293 64.390 63.100 -0.004 0.000 0.798 343 P CB 0.226 31.922 31.700 -0.007 0.000 0.796 344 D N -1.908 118.463 120.400 -0.049 0.000 2.896 344 D HA 0.193 4.830 4.640 -0.005 0.000 0.241 344 D C 1.015 177.245 176.300 -0.117 0.000 1.188 344 D CA -0.656 53.306 54.000 -0.064 0.000 0.879 344 D CB 1.393 42.145 40.800 -0.081 0.000 1.553 344 D HN -0.356 8.014 8.370 -0.000 0.000 0.515 345 R N 2.148 122.594 120.500 -0.091 0.000 2.091 345 R HA -0.128 4.209 4.340 -0.005 0.000 0.238 345 R C 1.899 177.904 176.300 -0.492 0.000 1.136 345 R CA 0.975 57.001 56.100 -0.123 0.000 0.959 345 R CB -0.124 30.243 30.300 0.112 0.000 0.856 345 R HN 0.477 8.747 8.270 -0.000 0.000 0.437 346 R N 0.912 120.964 120.500 -0.747 0.000 2.082 346 R HA -0.111 4.226 4.340 -0.005 0.000 0.234 346 R C 2.411 178.307 176.300 -0.673 0.000 1.136 346 R CA 1.794 57.162 56.100 -1.221 0.000 0.935 346 R CB -0.258 29.616 30.300 -0.709 0.000 0.842 346 R HN 0.102 8.372 8.270 -0.000 0.000 0.430 347 M N 0.001 119.385 119.600 -0.361 0.000 2.108 347 M HA -0.174 4.303 4.480 -0.005 0.000 0.257 347 M C 2.284 178.462 176.300 -0.203 0.000 1.071 347 M CA 1.959 57.126 55.300 -0.223 0.000 1.093 347 M CB -0.661 31.861 32.600 -0.130 0.000 1.345 347 M HN 0.538 8.828 8.290 -0.000 0.000 0.403 348 G N -0.194 108.484 108.800 -0.203 0.000 2.545 348 G HA2 -0.217 3.740 3.960 -0.005 0.000 0.217 348 G HA3 -0.217 3.740 3.960 -0.005 0.000 0.217 348 G C 1.431 176.237 174.900 -0.157 0.000 1.218 348 G CA 1.167 46.182 45.100 -0.142 0.000 0.787 348 G HN 0.329 8.619 8.290 -0.000 0.000 0.571 349 V N 0.745 120.511 119.914 -0.246 0.000 2.332 349 V HA -0.216 3.901 4.120 -0.005 0.000 0.248 349 V C 2.716 178.706 176.094 -0.174 0.000 1.055 349 V CA 2.479 64.664 62.300 -0.192 0.000 1.038 349 V CB -0.575 31.109 31.823 -0.231 0.000 0.651 349 V HN 0.508 8.698 8.190 -0.000 0.000 0.450 350 E N -0.669 119.384 120.200 -0.246 0.000 2.021 350 E HA -0.264 4.083 4.350 -0.005 0.000 0.200 350 E C 2.230 178.779 176.600 -0.086 0.000 1.015 350 E CA 1.686 57.989 56.400 -0.161 0.000 0.824 350 E CB -0.225 29.369 29.700 -0.177 0.000 0.762 350 E HN 0.357 8.717 8.360 -0.000 0.000 0.454 351 M N 0.343 119.897 119.600 -0.077 0.000 2.446 351 M HA -0.099 4.378 4.480 -0.005 0.000 0.263 351 M C 1.972 178.268 176.300 -0.007 0.000 1.066 351 M CA 1.159 56.441 55.300 -0.031 0.000 1.087 351 M CB -0.489 32.095 32.600 -0.027 0.000 1.406 351 M HN 0.138 8.428 8.290 -0.000 0.000 0.459 352 T N 0.724 115.263 114.554 -0.024 0.000 2.937 352 T HA 0.067 4.414 4.350 -0.005 0.000 0.260 352 T C 1.965 176.672 174.700 0.011 0.000 1.051 352 T CA 0.626 62.722 62.100 -0.006 0.000 1.141 352 T CB 0.130 68.986 68.868 -0.021 0.000 0.879 352 T HN 0.298 8.538 8.240 -0.000 0.000 0.459 353 L N 0.558 121.777 121.223 -0.007 0.000 2.044 353 L HA 0.036 4.373 4.340 -0.005 0.000 0.205 353 L C 2.425 179.310 176.870 0.025 0.000 1.075 353 L CA 1.090 55.930 54.840 0.000 0.000 0.747 353 L CB -0.604 41.441 42.059 -0.024 0.000 0.903 353 L HN 0.252 8.482 8.230 -0.000 0.000 0.435 354 L N -0.399 120.834 121.223 0.017 0.000 2.079 354 L HA -0.253 4.084 4.340 -0.005 0.000 0.210 354 L C 2.845 179.774 176.870 0.099 0.000 1.081 354 L CA 1.274 56.135 54.840 0.035 0.000 0.752 354 L CB -0.482 41.587 42.059 0.016 0.000 0.896 354 L HN 0.258 8.488 8.230 -0.000 0.000 0.433 355 R N 0.065 120.641 120.500 0.127 0.000 2.062 355 R HA -0.161 4.176 4.340 -0.005 0.000 0.231 355 R C 2.412 178.890 176.300 0.296 0.000 1.136 355 R CA 1.358 57.601 56.100 0.239 0.000 0.948 355 R CB -0.322 30.058 30.300 0.132 0.000 0.845 355 R HN 0.326 8.596 8.270 -0.000 0.000 0.430 356 A N 1.015 123.949 122.820 0.190 0.000 1.958 356 A HA -0.202 4.115 4.320 -0.005 0.000 0.221 356 A C 2.140 179.890 177.584 0.277 0.000 1.178 356 A CA 1.499 53.676 52.037 0.234 0.000 0.642 356 A CB -0.540 18.538 19.000 0.131 0.000 0.816 356 A HN 0.373 8.523 8.150 -0.000 0.000 0.453 357 L N -1.602 119.725 121.223 0.174 0.000 2.102 357 L HA -0.043 4.294 4.340 -0.005 0.000 0.202 357 L C 3.083 180.035 176.870 0.137 0.000 1.076 357 L CA 0.844 55.751 54.840 0.110 0.000 0.761 357 L CB -0.521 41.542 42.059 0.006 0.000 0.921 357 L HN 0.412 8.642 8.230 -0.000 0.000 0.444 358 A N -0.243 122.635 122.820 0.097 0.000 1.972 358 A HA -0.171 4.145 4.320 -0.005 0.000 0.219 358 A C 1.576 179.033 177.584 -0.211 0.000 1.169 358 A CA 1.452 53.446 52.037 -0.072 0.000 0.635 358 A CB -0.604 18.305 19.000 -0.152 0.000 0.810 358 A HN 0.400 8.550 8.150 -0.000 0.000 0.446 359 F N -0.693 119.322 119.950 0.108 0.000 2.639 359 F HA 0.179 4.702 4.527 -0.007 0.000 0.300 359 F C 0.933 176.816 175.800 0.139 0.000 1.109 359 F CA -0.502 57.556 58.000 0.097 0.000 1.335 359 F CB -0.257 38.786 39.000 0.073 0.000 1.014 359 F HN 0.283 8.583 8.300 -0.000 0.000 0.537 360 H N 2.616 121.797 119.070 0.184 0.000 3.004 360 H HA -0.001 4.552 4.556 -0.004 0.000 0.316 360 H C -1.642 173.750 175.328 0.106 0.000 1.014 360 H CA -1.018 55.143 56.048 0.188 0.000 1.454 360 H CB 1.382 31.240 29.762 0.159 0.000 1.472 360 H HN 0.043 8.323 8.280 -0.000 0.000 0.571 361 P HA -0.125 4.295 4.420 -0.000 0.000 0.213 361 P C 1.592 178.782 177.300 -0.183 0.000 1.170 361 P CA 0.800 63.786 63.100 -0.191 0.000 0.893 361 P CB 0.385 31.938 31.700 -0.245 0.000 0.784 362 R N -0.722 119.562 120.500 -0.359 0.000 2.070 362 R HA 0.052 4.389 4.340 -0.005 0.000 0.233 362 R C 1.123 177.491 176.300 0.113 0.000 1.137 362 R CA 1.279 57.318 56.100 -0.102 0.000 0.945 362 R CB -0.968 29.303 30.300 -0.049 0.000 0.845 362 R HN 0.321 8.591 8.270 -0.000 0.000 0.430 363 M N 1.070 120.911 119.600 0.402 0.000 1.949 363 M HA 0.300 4.776 4.480 -0.005 0.000 0.234 363 M C -2.370 174.081 176.300 0.252 0.000 0.855 363 M CA -1.729 53.736 55.300 0.276 0.000 0.800 363 M CB 2.263 34.975 32.600 0.188 0.000 1.697 363 M HN -0.197 8.093 8.290 -0.000 0.000 0.357 364 P HA 0.124 4.544 4.420 -0.000 0.000 0.278 364 P C -0.891 176.428 177.300 0.032 0.000 1.270 364 P CA -0.550 62.605 63.100 0.091 0.000 0.800 364 P CB 0.594 32.307 31.700 0.022 0.000 1.142 365 L N 1.595 122.809 121.223 -0.015 0.000 2.295 365 L HA 0.469 4.806 4.340 -0.005 0.000 0.285 365 L C -2.133 174.711 176.870 -0.044 0.000 1.035 365 L CA -2.086 52.734 54.840 -0.033 0.000 0.806 365 L CB 0.264 42.296 42.059 -0.045 0.000 1.214 365 L HN 0.278 8.508 8.230 -0.000 0.000 0.426 366 P HA 0.078 4.498 4.420 -0.000 0.000 0.267 366 P C -1.085 176.194 177.300 -0.034 0.000 1.209 366 P CA -0.032 63.052 63.100 -0.028 0.000 0.763 366 P CB 0.649 32.338 31.700 -0.019 0.000 0.816 367 E N 3.887 124.066 120.200 -0.035 0.000 2.179 367 E HA 0.376 4.723 4.350 -0.005 0.000 0.275 367 E C -1.545 175.041 176.600 -0.024 0.000 0.945 367 E CA -1.767 54.612 56.400 -0.035 0.000 0.792 367 E CB 1.048 30.721 29.700 -0.044 0.000 1.125 367 E HN 0.422 8.782 8.360 -0.000 0.000 0.397 368 P HA 0.000 4.420 4.420 -0.000 0.000 0.216 368 P CA 0.000 63.091 63.100 -0.015 0.000 0.800 368 P CB 0.000 31.692 31.700 -0.013 0.000 0.726