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 2oln_1_A DATA FIRST_RESID 3 DATA SEQUENCE ESYDVVVVGG GPVGLATAWQ VAERGHRVLV LERHTFFNEN GGTSGAERHW DATA SEQUENCE RLQYTQEDLF RLTLETLPLW RALESRCERR LIHEIGSLWF GDTDVVTNEG DATA SEQUENCE QISGTAAMMD KLSVRYEWLK ATDIERRFGF RGLPRDYEGF LQPDGGTIDV DATA SEQUENCE RGTLAALFTL AQAAGATLRA GETVTELVPD ADGVSVTTDR GTYRAGKVVL DATA SEQUENCE ACGPYTNDLL EPLGARLAYS VYEMAIAAYR QATPVTEAPF WFAFQQPTPQ DATA SEQUENCE DTNLFYGFGH NPWAPGEFVR CGPDFEVDPL DHPSAATGVA DRRQMDRLSG DATA SEQUENCE WLRDHLPTVD PDPVRTSTCL AVLPTDPERQ FFLGTARDLM THGEKLVVYG DATA SEQUENCE AGWAFKFVPL FGRICADLAV EDSTAYDISR LAPQS 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 3 E HA 0.000 4.350 4.350 -0.000 0.000 0.291 3 E C 0.000 176.672 176.600 0.120 0.000 1.382 3 E CA 0.000 56.441 56.400 0.068 0.000 0.976 3 E CB 0.000 29.854 29.700 0.256 0.000 0.812 4 S N 0.414 116.046 115.700 -0.113 0.000 2.549 4 S HA 0.729 5.189 4.470 -0.016 0.000 0.280 4 S C -1.576 172.795 174.600 -0.382 0.000 1.109 4 S CA -0.740 57.417 58.200 -0.071 0.000 0.905 4 S CB 0.937 64.109 63.200 -0.046 0.000 1.081 4 S HN 0.432 8.742 8.310 -0.000 0.000 0.477 5 Y N 0.195 120.527 120.300 0.053 0.000 2.581 5 Y HA 0.352 4.892 4.550 -0.016 0.000 0.345 5 Y C 0.784 176.695 175.900 0.018 0.000 1.036 5 Y CA -1.040 57.077 58.100 0.028 0.000 1.042 5 Y CB 1.184 39.645 38.460 0.002 0.000 1.289 5 Y HN 0.535 8.815 8.280 -0.000 0.000 0.471 6 D N 0.363 120.865 120.400 0.170 0.000 2.117 6 D HA -0.014 4.616 4.640 -0.016 0.000 0.198 6 D C -0.214 176.124 176.300 0.062 0.000 0.982 6 D CA 1.591 55.646 54.000 0.092 0.000 0.828 6 D CB 0.352 41.205 40.800 0.088 0.000 0.967 6 D HN 0.092 8.462 8.370 -0.000 0.000 0.464 7 V N 1.157 121.119 119.914 0.079 0.000 2.638 7 V HA 0.278 4.388 4.120 -0.016 0.000 0.306 7 V C -0.210 175.876 176.094 -0.013 0.000 1.052 7 V CA -0.826 61.484 62.300 0.017 0.000 0.885 7 V CB 2.847 34.659 31.823 -0.017 0.000 0.999 7 V HN -0.260 7.930 8.190 -0.000 0.000 0.424 8 V N 5.103 124.988 119.914 -0.047 0.000 2.398 8 V HA 0.467 4.577 4.120 -0.016 0.000 0.286 8 V C -0.172 175.861 176.094 -0.102 0.000 1.026 8 V CA -0.585 61.631 62.300 -0.139 0.000 0.868 8 V CB 1.945 33.675 31.823 -0.156 0.000 0.982 8 V HN 0.626 8.816 8.190 -0.000 0.000 0.443 9 V N 5.880 125.726 119.914 -0.113 0.000 2.370 9 V HA 0.343 4.454 4.120 -0.016 0.000 0.279 9 V C 0.001 176.057 176.094 -0.063 0.000 1.029 9 V CA -0.570 61.695 62.300 -0.058 0.000 0.870 9 V CB 1.741 33.546 31.823 -0.030 0.000 0.984 9 V HN 0.612 8.802 8.190 -0.000 0.000 0.451 10 V N 4.590 124.482 119.914 -0.037 0.000 2.334 10 V HA 0.830 4.940 4.120 -0.016 0.000 0.267 10 V C 0.661 176.749 176.094 -0.009 0.000 1.040 10 V CA 0.370 62.646 62.300 -0.040 0.000 0.866 10 V CB 0.334 32.138 31.823 -0.032 0.000 1.019 10 V HN 1.273 9.463 8.190 -0.000 0.000 0.468 11 G N 3.509 112.298 108.800 -0.018 0.000 3.055 11 G HA2 0.259 4.210 3.960 -0.016 0.000 0.685 11 G HA3 0.259 4.210 3.960 -0.016 0.000 0.685 11 G C 0.036 174.980 174.900 0.074 0.000 1.212 11 G CA -0.463 44.644 45.100 0.012 0.000 0.822 11 G HN 1.147 9.437 8.290 -0.000 0.000 0.610 12 G N 0.504 109.354 108.800 0.084 0.000 4.044 12 G HA2 0.682 4.632 3.960 -0.016 0.000 0.297 12 G HA3 0.682 4.632 3.960 -0.016 0.000 0.297 12 G C 0.894 175.956 174.900 0.269 0.000 1.101 12 G CA 0.992 46.252 45.100 0.267 0.000 0.884 12 G HN 1.332 9.622 8.290 -0.000 0.000 0.538 13 G N 0.838 109.759 108.800 0.202 0.000 2.553 13 G HA2 0.419 4.370 3.960 -0.016 0.000 0.278 13 G HA3 0.419 4.370 3.960 -0.016 0.000 0.278 13 G C -0.391 174.646 174.900 0.229 0.000 1.349 13 G CA -0.595 44.645 45.100 0.234 0.000 1.037 13 G HN 0.003 8.293 8.290 -0.000 0.000 0.508 14 P HA -0.091 4.329 4.420 -0.000 0.000 0.217 14 P C 1.972 179.307 177.300 0.057 0.000 1.150 14 P CA 0.933 64.111 63.100 0.130 0.000 0.832 14 P CB 0.010 31.741 31.700 0.052 0.000 0.787 15 V N 0.604 120.568 119.914 0.083 0.000 2.358 15 V HA -0.120 3.990 4.120 -0.016 0.000 0.246 15 V C 2.917 179.066 176.094 0.092 0.000 1.047 15 V CA 2.381 64.719 62.300 0.063 0.000 1.035 15 V CB -1.914 29.974 31.823 0.109 0.000 0.658 15 V HN 0.165 8.355 8.190 -0.000 0.000 0.452 16 G N -0.177 108.698 108.800 0.126 0.000 2.418 16 G HA2 -0.202 3.748 3.960 -0.016 0.000 0.217 16 G HA3 -0.202 3.748 3.960 -0.016 0.000 0.217 16 G C 1.601 176.560 174.900 0.097 0.000 1.158 16 G CA 0.916 46.081 45.100 0.109 0.000 0.771 16 G HN 0.451 8.741 8.290 -0.000 0.000 0.545 17 L N 0.560 121.854 121.223 0.118 0.000 2.056 17 L HA -0.027 4.303 4.340 -0.016 0.000 0.207 17 L C 3.423 180.364 176.870 0.117 0.000 1.078 17 L CA 0.980 55.877 54.840 0.095 0.000 0.749 17 L CB -0.412 41.718 42.059 0.118 0.000 0.901 17 L HN 0.310 8.540 8.230 -0.000 0.000 0.433 18 A N -0.417 122.472 122.820 0.115 0.000 1.902 18 A HA -0.199 4.111 4.320 -0.016 0.000 0.217 18 A C 2.358 180.028 177.584 0.143 0.000 1.181 18 A CA 2.327 54.475 52.037 0.185 0.000 0.623 18 A CB -0.901 18.139 19.000 0.067 0.000 0.818 18 A HN 0.380 8.530 8.150 -0.000 0.000 0.443 19 T N 0.324 114.917 114.554 0.065 0.000 2.708 19 T HA -0.050 4.290 4.350 -0.016 0.000 0.266 19 T C 2.247 176.958 174.700 0.019 0.000 1.037 19 T CA 1.734 63.843 62.100 0.016 0.000 1.146 19 T CB -0.498 68.381 68.868 0.018 0.000 0.865 19 T HN 0.607 8.847 8.240 -0.000 0.000 0.435 20 A N 0.785 123.632 122.820 0.045 0.000 1.902 20 A HA -0.124 4.187 4.320 -0.016 0.000 0.217 20 A C 2.037 179.670 177.584 0.082 0.000 1.181 20 A CA 1.741 53.797 52.037 0.032 0.000 0.623 20 A CB -1.175 17.825 19.000 0.001 0.000 0.818 20 A HN 0.701 8.851 8.150 -0.000 0.000 0.443 21 W N 0.874 122.130 121.300 -0.073 0.000 2.317 21 W HA -0.233 4.417 4.660 -0.017 0.000 0.318 21 W C 2.127 178.618 176.519 -0.048 0.000 1.227 21 W CA 2.219 59.521 57.345 -0.071 0.000 1.269 21 W CB -0.533 28.881 29.460 -0.077 0.000 1.155 21 W HN 0.352 8.532 8.180 -0.000 0.000 0.484 22 Q N 0.108 119.707 119.800 -0.336 0.000 2.084 22 Q HA -0.144 4.186 4.340 -0.016 0.000 0.202 22 Q C 2.335 178.197 176.000 -0.230 0.000 0.978 22 Q CA 2.095 57.594 55.803 -0.506 0.000 0.844 22 Q CB -1.196 27.305 28.738 -0.396 0.000 0.898 22 Q HN 0.348 8.618 8.270 -0.000 0.000 0.426 23 V N 1.145 121.003 119.914 -0.094 0.000 2.295 23 V HA -0.245 3.866 4.120 -0.016 0.000 0.246 23 V C 2.386 178.514 176.094 0.057 0.000 1.049 23 V CA 1.831 64.136 62.300 0.010 0.000 1.024 23 V CB -1.068 30.761 31.823 0.010 0.000 0.648 23 V HN 0.328 8.518 8.190 -0.000 0.000 0.447 24 A N -0.711 122.120 122.820 0.018 0.000 1.930 24 A HA -0.201 4.109 4.320 -0.016 0.000 0.217 24 A C 2.168 179.744 177.584 -0.013 0.000 1.175 24 A CA 1.574 53.624 52.037 0.023 0.000 0.627 24 A CB -0.433 18.588 19.000 0.036 0.000 0.815 24 A HN 0.590 8.740 8.150 -0.000 0.000 0.443 25 E N -0.417 119.752 120.200 -0.051 0.000 2.268 25 E HA -0.124 4.216 4.350 -0.016 0.000 0.195 25 E C 1.769 178.315 176.600 -0.090 0.000 0.995 25 E CA 0.566 56.926 56.400 -0.067 0.000 0.836 25 E CB -0.106 29.514 29.700 -0.133 0.000 0.763 25 E HN 0.550 8.910 8.360 -0.000 0.000 0.491 26 R N -0.563 119.886 120.500 -0.086 0.000 2.313 26 R HA 0.038 4.368 4.340 -0.016 0.000 0.199 26 R C 1.187 177.328 176.300 -0.264 0.000 0.958 26 R CA 0.530 56.576 56.100 -0.091 0.000 1.047 26 R CB 0.437 30.767 30.300 0.050 0.000 0.955 26 R HN 0.203 8.473 8.270 -0.000 0.000 0.481 27 G N 0.449 109.103 108.800 -0.244 0.000 2.179 27 G HA2 -0.237 3.713 3.960 -0.016 0.000 0.220 27 G HA3 -0.237 3.713 3.960 -0.016 0.000 0.220 27 G C -0.297 174.376 174.900 -0.378 0.000 0.990 27 G CA -0.283 44.640 45.100 -0.295 0.000 0.646 27 G HN 0.451 8.741 8.290 -0.000 0.000 0.517 28 H N 0.008 119.071 119.070 -0.012 0.000 2.488 28 H HA 0.689 5.235 4.556 -0.016 0.000 0.347 28 H C 0.792 176.135 175.328 0.026 0.000 1.174 28 H CA -0.386 55.664 56.048 0.002 0.000 1.307 28 H CB 0.569 30.330 29.762 -0.002 0.000 1.517 28 H HN 0.208 8.488 8.280 -0.000 0.000 0.554 29 R N 1.198 121.807 120.500 0.183 0.000 2.216 29 R HA 0.380 4.710 4.340 -0.016 0.000 0.332 29 R C -1.089 175.364 176.300 0.256 0.000 1.056 29 R CA -0.504 55.709 56.100 0.188 0.000 0.901 29 R CB 0.992 31.374 30.300 0.137 0.000 1.039 29 R HN 0.250 8.520 8.270 -0.000 0.000 0.456 30 V N 5.340 125.374 119.914 0.200 0.000 2.735 30 V HA 0.500 4.610 4.120 -0.016 0.000 0.310 30 V C -1.508 174.497 176.094 -0.148 0.000 1.061 30 V CA -1.078 61.253 62.300 0.052 0.000 0.913 30 V CB 2.093 33.925 31.823 0.014 0.000 1.005 30 V HN 0.564 8.754 8.190 -0.000 0.000 0.428 31 L N 6.804 127.755 121.223 -0.454 0.000 2.341 31 L HA 0.770 5.100 4.340 -0.016 0.000 0.278 31 L C -0.927 175.731 176.870 -0.353 0.000 1.005 31 L CA -0.062 54.385 54.840 -0.656 0.000 0.818 31 L CB 2.022 43.272 42.059 -1.349 0.000 1.259 31 L HN 0.489 8.719 8.230 -0.000 0.000 0.418 32 V N 6.369 126.154 119.914 -0.216 0.000 2.398 32 V HA 0.449 4.559 4.120 -0.016 0.000 0.286 32 V C -0.121 175.938 176.094 -0.058 0.000 1.026 32 V CA -0.497 61.754 62.300 -0.082 0.000 0.868 32 V CB 1.416 33.267 31.823 0.046 0.000 0.982 32 V HN 0.600 8.790 8.190 -0.000 0.000 0.443 33 L N 4.427 125.588 121.223 -0.105 0.000 2.287 33 L HA 0.654 4.984 4.340 -0.016 0.000 0.287 33 L C -0.296 176.499 176.870 -0.126 0.000 1.022 33 L CA -0.332 54.434 54.840 -0.124 0.000 0.814 33 L CB 1.665 43.620 42.059 -0.175 0.000 1.217 33 L HN 0.646 8.876 8.230 -0.000 0.000 0.420 34 E N 2.866 122.939 120.200 -0.211 0.000 2.199 34 E HA 0.275 4.615 4.350 -0.016 0.000 0.265 34 E C 0.585 176.989 176.600 -0.327 0.000 0.882 34 E CA -0.749 55.451 56.400 -0.334 0.000 0.759 34 E CB 1.276 30.544 29.700 -0.720 0.000 1.148 34 E HN 0.508 8.868 8.360 -0.000 0.000 0.412 35 R N 3.771 124.064 120.500 -0.345 0.000 2.115 35 R HA -0.018 4.312 4.340 -0.016 0.000 0.226 35 R C 0.455 176.506 176.300 -0.415 0.000 1.100 35 R CA 0.915 56.766 56.100 -0.415 0.000 0.980 35 R CB -0.221 29.719 30.300 -0.599 0.000 0.875 35 R HN 0.496 8.766 8.270 -0.000 0.000 0.445 36 H N 0.860 119.811 119.070 -0.197 0.000 4.199 36 H HA 0.271 4.816 4.556 -0.018 0.000 0.167 36 H C 0.224 175.420 175.328 -0.219 0.000 1.512 36 H CA 0.701 56.655 56.048 -0.157 0.000 1.274 36 H CB -0.132 29.567 29.762 -0.104 0.000 1.058 36 H HN 0.167 8.447 8.280 -0.000 0.000 0.560 37 T N -0.733 113.788 114.554 -0.054 0.000 2.912 37 T HA 0.472 4.812 4.350 -0.016 0.000 0.288 37 T C -0.243 174.268 174.700 -0.315 0.000 1.030 37 T CA -0.759 61.230 62.100 -0.185 0.000 1.020 37 T CB 0.908 69.748 68.868 -0.048 0.000 1.056 37 T HN 0.020 8.260 8.240 -0.000 0.000 0.480 38 F N 1.526 121.354 119.950 -0.204 0.000 2.553 38 F HA 0.349 4.867 4.527 -0.016 0.000 0.356 38 F C 1.071 176.555 175.800 -0.528 0.000 1.142 38 F CA -0.341 57.372 58.000 -0.479 0.000 1.322 38 F CB -0.634 37.884 39.000 -0.803 0.000 1.126 38 F HN 0.823 9.123 8.300 -0.000 0.000 0.599 39 F N -0.860 119.209 119.950 0.197 0.000 2.884 39 F HA -0.319 4.198 4.527 -0.017 0.000 0.294 39 F C 0.526 176.370 175.800 0.074 0.000 0.723 39 F CA 0.107 58.169 58.000 0.105 0.000 1.294 39 F CB -2.195 36.824 39.000 0.032 0.000 1.551 39 F HN 0.555 8.855 8.300 -0.000 0.000 0.363 40 N N 1.607 120.406 118.700 0.165 0.000 2.444 40 N HA 0.243 4.973 4.740 -0.016 0.000 0.255 40 N C 0.186 175.769 175.510 0.121 0.000 1.255 40 N CA -0.108 53.008 53.050 0.110 0.000 0.933 40 N CB 0.535 39.058 38.487 0.059 0.000 1.143 40 N HN 0.324 8.704 8.380 -0.000 0.000 0.453 41 E N -0.195 120.054 120.200 0.081 0.000 2.609 41 E HA 0.101 4.441 4.350 -0.016 0.000 0.208 41 E C -0.454 176.187 176.600 0.069 0.000 1.013 41 E CA 0.017 56.467 56.400 0.083 0.000 1.093 41 E CB -0.374 29.363 29.700 0.062 0.000 1.129 41 E HN 0.690 9.050 8.360 -0.000 0.000 0.450 42 N N -0.139 118.601 118.700 0.066 0.000 2.205 42 N HA 0.066 4.797 4.740 -0.016 0.000 0.201 42 N C 0.714 176.302 175.510 0.130 0.000 1.128 42 N CA -0.126 52.959 53.050 0.058 0.000 0.867 42 N CB 1.230 39.689 38.487 -0.045 0.000 0.996 42 N HN 0.068 8.448 8.380 -0.000 0.000 0.503 43 G N -0.348 108.549 108.800 0.162 0.000 3.194 43 G HA2 0.377 4.328 3.960 -0.016 0.000 0.160 43 G HA3 0.377 4.328 3.960 -0.016 0.000 0.160 43 G C 0.729 175.738 174.900 0.182 0.000 1.267 43 G CA -0.152 45.065 45.100 0.196 0.000 0.962 43 G HN 0.105 8.395 8.290 -0.000 0.000 0.612 44 G N -1.172 107.753 108.800 0.208 0.000 3.042 44 G HA2 0.328 4.278 3.960 -0.016 0.000 0.212 44 G HA3 0.328 4.278 3.960 -0.016 0.000 0.212 44 G C 0.323 175.381 174.900 0.263 0.000 1.166 44 G CA 0.673 45.915 45.100 0.235 0.000 0.767 44 G HN 0.484 8.774 8.290 -0.000 0.000 0.546 45 T N 1.179 115.877 114.554 0.240 0.000 3.444 45 T HA 0.424 4.764 4.350 -0.016 0.000 0.265 45 T C 0.163 174.955 174.700 0.154 0.000 1.537 45 T CA -0.378 61.862 62.100 0.233 0.000 1.530 45 T CB 0.585 69.646 68.868 0.321 0.000 0.958 45 T HN 0.259 8.498 8.240 -0.000 0.000 0.684 46 S N 0.753 116.526 115.700 0.122 0.000 2.565 46 S HA 0.910 5.370 4.470 -0.016 0.000 0.290 46 S C 0.515 175.144 174.600 0.048 0.000 1.150 46 S CA -0.013 58.240 58.200 0.089 0.000 1.058 46 S CB 1.541 64.800 63.200 0.098 0.000 1.032 46 S HN 1.104 9.414 8.310 -0.000 0.000 0.510 47 G N 0.674 109.493 108.800 0.031 0.000 2.712 47 G HA2 0.325 4.275 3.960 -0.016 0.000 0.683 47 G HA3 0.325 4.275 3.960 -0.016 0.000 0.683 47 G C 0.400 175.280 174.900 -0.035 0.000 1.320 47 G CA -0.269 44.836 45.100 0.009 0.000 0.847 47 G HN 1.733 10.023 8.290 -0.000 0.000 0.553 48 A N -0.617 122.193 122.820 -0.017 0.000 2.095 48 A HA 0.543 4.853 4.320 -0.016 0.000 0.212 48 A C 0.889 178.487 177.584 0.023 0.000 1.162 48 A CA 2.159 54.229 52.037 0.055 0.000 0.753 48 A CB -0.127 18.986 19.000 0.189 0.000 0.840 48 A HN 1.522 9.672 8.150 -0.000 0.000 0.468 49 E N 0.028 120.098 120.200 -0.217 0.000 2.288 49 E HA 0.733 5.073 4.350 -0.016 0.000 0.268 49 E C -0.915 175.113 176.600 -0.953 0.000 0.885 49 E CA -0.942 55.218 56.400 -0.401 0.000 0.767 49 E CB 1.267 30.723 29.700 -0.407 0.000 1.220 49 E HN 0.089 8.449 8.360 -0.000 0.000 0.427 50 R N 0.561 120.641 120.500 -0.699 0.000 2.836 50 R HA 0.396 4.726 4.340 -0.016 0.000 0.269 50 R C -1.017 175.220 176.300 -0.105 0.000 1.010 50 R CA -1.043 54.725 56.100 -0.553 0.000 0.930 50 R CB 1.212 31.296 30.300 -0.360 0.000 1.218 50 R HN 0.738 9.008 8.270 -0.000 0.000 0.473 51 H N 1.016 120.051 119.070 -0.059 0.000 2.562 51 H HA 0.185 4.731 4.556 -0.017 0.000 0.314 51 H C -0.836 174.426 175.328 -0.109 0.000 1.079 51 H CA -0.247 55.690 56.048 -0.185 0.000 1.349 51 H CB 0.723 30.023 29.762 -0.771 0.000 1.432 51 H HN 0.456 8.736 8.280 -0.000 0.000 0.479 52 W N 8.915 129.871 121.300 -0.573 0.000 2.338 52 W HA 0.380 5.030 4.660 -0.017 0.000 0.307 52 W C -1.056 174.899 176.519 -0.940 0.000 1.167 52 W CA -0.839 56.133 57.345 -0.622 0.000 1.208 52 W CB 0.512 29.688 29.460 -0.473 0.000 1.228 52 W HN 0.806 8.986 8.180 -0.000 0.000 0.499 53 R N 4.572 124.092 120.500 -1.633 0.000 2.698 53 R HA 0.407 4.737 4.340 -0.016 0.000 0.275 53 R C -0.109 175.343 176.300 -1.413 0.000 1.001 53 R CA -0.942 54.334 56.100 -1.374 0.000 0.896 53 R CB 1.492 31.228 30.300 -0.941 0.000 1.218 53 R HN 0.530 8.800 8.270 -0.000 0.000 0.462 54 L N 0.296 120.943 121.223 -0.960 0.000 2.095 54 L HA -0.051 4.279 4.340 -0.016 0.000 0.204 54 L C 1.017 177.348 176.870 -0.899 0.000 1.080 54 L CA 0.738 55.184 54.840 -0.657 0.000 0.759 54 L CB -0.339 41.578 42.059 -0.238 0.000 0.914 54 L HN 0.698 8.928 8.230 -0.000 0.000 0.439 55 Q N 0.246 119.433 119.800 -1.023 0.000 2.314 55 Q HA 0.140 4.470 4.340 -0.016 0.000 0.258 55 Q C -1.634 173.831 176.000 -0.892 0.000 0.954 55 Q CA 0.185 55.156 55.803 -1.387 0.000 0.890 55 Q CB 1.302 29.495 28.738 -0.908 0.000 1.210 55 Q HN 0.159 8.429 8.270 -0.000 0.000 0.410 56 Y N 0.233 120.108 120.300 -0.707 0.000 2.534 56 Y HA 0.173 4.713 4.550 -0.018 0.000 0.345 56 Y C 0.988 176.977 175.900 0.149 0.000 1.031 56 Y CA -0.545 57.512 58.100 -0.072 0.000 1.022 56 Y CB 2.545 41.039 38.460 0.056 0.000 1.292 56 Y HN 0.670 8.950 8.280 -0.000 0.000 0.459 57 T N 0.326 115.110 114.554 0.384 0.000 2.821 57 T HA -0.095 4.245 4.350 -0.016 0.000 0.267 57 T C 0.126 175.008 174.700 0.304 0.000 1.046 57 T CA 1.033 63.319 62.100 0.310 0.000 1.139 57 T CB -0.155 68.864 68.868 0.252 0.000 0.871 57 T HN 0.398 8.638 8.240 -0.000 0.000 0.454 58 Q N 1.077 121.086 119.800 0.347 0.000 2.267 58 Q HA 0.310 4.641 4.340 -0.016 0.000 0.255 58 Q C 1.102 177.265 176.000 0.272 0.000 0.923 58 Q CA -0.113 55.844 55.803 0.256 0.000 0.925 58 Q CB 1.272 30.138 28.738 0.213 0.000 1.195 58 Q HN 0.350 8.620 8.270 -0.000 0.000 0.417 59 E N 2.116 122.434 120.200 0.198 0.000 2.077 59 E HA -0.258 4.082 4.350 -0.016 0.000 0.193 59 E C 0.703 177.395 176.600 0.154 0.000 0.989 59 E CA 1.637 58.138 56.400 0.168 0.000 0.800 59 E CB 0.311 30.061 29.700 0.083 0.000 0.746 59 E HN 0.816 9.176 8.360 -0.000 0.000 0.452 60 D N 0.634 121.101 120.400 0.111 0.000 2.144 60 D HA -0.216 4.415 4.640 -0.016 0.000 0.199 60 D C 2.098 178.438 176.300 0.067 0.000 0.984 60 D CA 1.033 55.079 54.000 0.076 0.000 0.834 60 D CB -0.657 40.172 40.800 0.048 0.000 0.955 60 D HN 0.339 8.709 8.370 -0.000 0.000 0.465 61 L N -1.122 120.125 121.223 0.041 0.000 2.109 61 L HA 0.034 4.364 4.340 -0.016 0.000 0.207 61 L C 2.588 179.486 176.870 0.047 0.000 1.086 61 L CA 0.611 55.379 54.840 -0.120 0.000 0.760 61 L CB -0.452 41.333 42.059 -0.456 0.000 0.910 61 L HN -0.030 8.200 8.230 -0.000 0.000 0.437 62 F N 0.895 120.884 119.950 0.065 0.000 2.134 62 F HA -0.239 4.278 4.527 -0.016 0.000 0.299 62 F C 2.774 178.644 175.800 0.116 0.000 1.097 62 F CA 1.084 59.173 58.000 0.149 0.000 1.264 62 F CB 0.075 39.164 39.000 0.147 0.000 1.001 62 F HN -0.061 8.239 8.300 -0.000 0.000 0.479 63 R N 0.247 120.929 120.500 0.302 0.000 2.096 63 R HA -0.167 4.163 4.340 -0.016 0.000 0.235 63 R C 2.108 178.544 176.300 0.226 0.000 1.127 63 R CA 1.427 57.647 56.100 0.199 0.000 0.968 63 R CB -0.448 29.922 30.300 0.117 0.000 0.861 63 R HN 0.384 8.654 8.270 -0.000 0.000 0.440 64 L N 0.196 121.540 121.223 0.202 0.000 2.093 64 L HA -0.145 4.185 4.340 -0.016 0.000 0.208 64 L C 2.724 179.832 176.870 0.398 0.000 1.085 64 L CA 1.685 56.644 54.840 0.198 0.000 0.755 64 L CB -0.938 41.095 42.059 -0.043 0.000 0.904 64 L HN 0.384 8.614 8.230 -0.000 0.000 0.435 65 T N -1.838 112.985 114.554 0.448 0.000 2.788 65 T HA -0.159 4.181 4.350 -0.016 0.000 0.268 65 T C 1.864 176.812 174.700 0.413 0.000 1.044 65 T CA 0.928 63.251 62.100 0.370 0.000 1.139 65 T CB -0.562 68.301 68.868 -0.008 0.000 0.867 65 T HN 0.215 8.455 8.240 -0.000 0.000 0.454 66 L N 0.708 122.148 121.223 0.362 0.000 2.131 66 L HA -0.027 4.303 4.340 -0.016 0.000 0.210 66 L C 2.862 179.906 176.870 0.290 0.000 1.092 66 L CA 1.598 56.631 54.840 0.322 0.000 0.759 66 L CB -0.568 41.650 42.059 0.264 0.000 0.903 66 L HN 0.367 8.597 8.230 -0.000 0.000 0.435 67 E N -0.937 119.432 120.200 0.282 0.000 2.358 67 E HA -0.097 4.243 4.350 -0.016 0.000 0.195 67 E C 1.890 178.633 176.600 0.239 0.000 1.010 67 E CA 1.089 57.648 56.400 0.266 0.000 0.856 67 E CB 0.103 30.000 29.700 0.327 0.000 0.795 67 E HN 0.404 8.764 8.360 -0.000 0.000 0.504 68 T N 1.119 115.847 114.554 0.291 0.000 3.035 68 T HA -0.031 4.310 4.350 -0.016 0.000 0.259 68 T C 1.688 176.540 174.700 0.255 0.000 1.078 68 T CA 0.071 62.319 62.100 0.245 0.000 1.132 68 T CB -0.013 69.088 68.868 0.388 0.000 0.900 68 T HN 0.025 8.265 8.240 -0.000 0.000 0.480 69 L N 3.022 124.462 121.223 0.362 0.000 2.013 69 L HA -0.047 4.283 4.340 -0.016 0.000 0.212 69 L C -0.803 176.142 176.870 0.125 0.000 1.073 69 L CA 2.136 57.105 54.840 0.215 0.000 0.753 69 L CB -1.304 40.944 42.059 0.316 0.000 0.890 69 L HN 0.125 8.355 8.230 -0.000 0.000 0.432 70 P HA -0.159 4.261 4.420 -0.000 0.000 0.220 70 P C 2.093 179.427 177.300 0.057 0.000 1.148 70 P CA 1.478 64.629 63.100 0.086 0.000 0.803 70 P CB -0.065 31.689 31.700 0.091 0.000 0.782 71 L N -2.780 118.459 121.223 0.028 0.000 2.109 71 L HA -0.051 4.279 4.340 -0.016 0.000 0.207 71 L C 2.691 179.495 176.870 -0.109 0.000 1.086 71 L CA 1.365 56.172 54.840 -0.054 0.000 0.760 71 L CB -1.042 40.936 42.059 -0.134 0.000 0.910 71 L HN -0.034 8.196 8.230 -0.000 0.000 0.437 72 W N 0.470 121.692 121.300 -0.131 0.000 2.355 72 W HA -0.153 4.496 4.660 -0.017 0.000 0.309 72 W C 2.823 179.249 176.519 -0.156 0.000 1.206 72 W CA 0.386 57.606 57.345 -0.208 0.000 1.284 72 W CB -0.142 29.061 29.460 -0.429 0.000 1.145 72 W HN -0.036 8.144 8.180 -0.000 0.000 0.502 73 R N 0.094 120.655 120.500 0.101 0.000 2.096 73 R HA -0.102 4.228 4.340 -0.016 0.000 0.235 73 R C 2.123 178.449 176.300 0.043 0.000 1.127 73 R CA 1.531 57.658 56.100 0.044 0.000 0.968 73 R CB -1.679 28.639 30.300 0.030 0.000 0.861 73 R HN 0.257 8.527 8.270 -0.000 0.000 0.440 74 A N 1.220 124.070 122.820 0.050 0.000 1.898 74 A HA -0.130 4.181 4.320 -0.016 0.000 0.216 74 A C 2.197 179.822 177.584 0.068 0.000 1.181 74 A CA 1.100 53.173 52.037 0.061 0.000 0.620 74 A CB -0.524 18.520 19.000 0.073 0.000 0.819 74 A HN 0.216 8.366 8.150 -0.000 0.000 0.442 75 L N 0.313 121.571 121.223 0.058 0.000 2.017 75 L HA -0.162 4.168 4.340 -0.016 0.000 0.208 75 L C 2.146 179.002 176.870 -0.025 0.000 1.073 75 L CA 2.485 57.321 54.840 -0.007 0.000 0.745 75 L CB -0.845 41.167 42.059 -0.079 0.000 0.894 75 L HN 0.538 8.768 8.230 -0.000 0.000 0.432 76 E N -0.917 119.294 120.200 0.020 0.000 2.097 76 E HA -0.224 4.116 4.350 -0.016 0.000 0.196 76 E C 2.184 178.772 176.600 -0.020 0.000 1.000 76 E CA 1.571 57.967 56.400 -0.007 0.000 0.804 76 E CB -0.203 29.490 29.700 -0.012 0.000 0.740 76 E HN 0.493 8.853 8.360 -0.000 0.000 0.454 77 S N 0.028 115.726 115.700 -0.004 0.000 2.383 77 S HA -0.061 4.399 4.470 -0.016 0.000 0.227 77 S C 1.792 176.388 174.600 -0.007 0.000 1.026 77 S CA 0.559 58.758 58.200 -0.002 0.000 0.981 77 S CB 0.030 63.238 63.200 0.013 0.000 0.818 77 S HN 0.160 8.470 8.310 -0.000 0.000 0.472 78 R N 0.974 121.469 120.500 -0.008 0.000 2.081 78 R HA -0.040 4.290 4.340 -0.016 0.000 0.235 78 R C 2.491 178.755 176.300 -0.061 0.000 1.131 78 R CA 1.484 57.571 56.100 -0.022 0.000 0.960 78 R CB -1.429 28.857 30.300 -0.023 0.000 0.856 78 R HN 0.675 8.945 8.270 -0.000 0.000 0.436 79 C N -0.596 118.654 119.300 -0.084 0.000 2.791 79 C HA 0.332 4.782 4.460 -0.016 0.000 0.270 79 C C 0.253 175.206 174.990 -0.061 0.000 1.257 79 C CA -0.555 58.409 59.018 -0.090 0.000 1.699 79 C CB -0.541 27.125 27.740 -0.122 0.000 1.904 79 C HN 0.519 8.749 8.230 -0.000 0.000 0.603 80 E N 0.223 120.397 120.200 -0.044 0.000 2.389 80 E HA -0.258 4.082 4.350 -0.016 0.000 0.243 80 E C 0.037 176.614 176.600 -0.037 0.000 1.154 80 E CA 0.750 57.130 56.400 -0.032 0.000 0.723 80 E CB -1.180 28.505 29.700 -0.024 0.000 1.261 80 E HN 0.883 9.243 8.360 -0.000 0.000 0.390 81 R N 0.690 121.161 120.500 -0.048 0.000 2.533 81 R HA 0.331 4.662 4.340 -0.016 0.000 0.288 81 R C -0.805 175.451 176.300 -0.074 0.000 1.039 81 R CA -0.788 55.278 56.100 -0.056 0.000 0.909 81 R CB 1.174 31.430 30.300 -0.074 0.000 1.195 81 R HN -0.032 8.238 8.270 -0.000 0.000 0.438 82 R N 4.141 124.587 120.500 -0.089 0.000 2.449 82 R HA 0.101 4.432 4.340 -0.016 0.000 0.296 82 R C 0.577 176.737 176.300 -0.232 0.000 1.047 82 R CA 0.261 56.251 56.100 -0.183 0.000 1.018 82 R CB 0.652 30.815 30.300 -0.229 0.000 0.962 82 R HN 0.591 8.861 8.270 -0.000 0.000 0.428 83 L N 3.239 124.309 121.223 -0.254 0.000 2.537 83 L HA 0.267 4.597 4.340 -0.016 0.000 0.224 83 L C 0.548 177.216 176.870 -0.338 0.000 1.065 83 L CA 0.243 54.941 54.840 -0.237 0.000 0.860 83 L CB 0.368 42.373 42.059 -0.090 0.000 1.086 83 L HN 0.508 8.738 8.230 -0.000 0.000 0.482 84 I N -0.308 119.977 120.570 -0.476 0.000 2.359 84 I HA 0.208 4.368 4.170 -0.016 0.000 0.294 84 I C -0.836 175.051 176.117 -0.383 0.000 0.987 84 I CA -0.455 60.578 61.300 -0.444 0.000 1.225 84 I CB 1.268 38.853 38.000 -0.690 0.000 1.366 84 I HN 0.046 8.256 8.210 -0.000 0.000 0.466 85 H N 4.104 123.182 119.070 0.013 0.000 2.708 85 H HA 0.267 4.813 4.556 -0.017 0.000 0.320 85 H C -0.864 174.548 175.328 0.139 0.000 0.991 85 H CA -0.631 55.482 56.048 0.108 0.000 1.243 85 H CB 0.916 30.800 29.762 0.203 0.000 1.446 85 H HN 0.461 8.741 8.280 -0.000 0.000 0.502 86 E N 4.026 124.348 120.200 0.204 0.000 1.972 86 E HA 0.051 4.392 4.350 -0.016 0.000 0.292 86 E C 0.910 177.648 176.600 0.230 0.000 1.193 86 E CA -0.086 56.439 56.400 0.209 0.000 1.228 86 E CB 0.036 29.833 29.700 0.162 0.000 1.167 86 E HN 0.703 9.063 8.360 -0.000 0.000 0.479 87 I N -1.606 119.127 120.570 0.272 0.000 3.251 87 I HA 0.239 4.399 4.170 -0.016 0.000 0.277 87 I C 0.909 177.190 176.117 0.273 0.000 1.268 87 I CA 0.082 61.545 61.300 0.272 0.000 1.449 87 I CB 0.022 38.202 38.000 0.300 0.000 1.083 87 I HN 0.295 8.505 8.210 -0.000 0.000 0.464 88 G N 0.922 109.890 108.800 0.281 0.000 2.587 88 G HA2 -0.060 3.890 3.960 -0.016 0.000 0.686 88 G HA3 -0.060 3.890 3.960 -0.016 0.000 0.686 88 G C -0.711 174.396 174.900 0.346 0.000 1.236 88 G CA -0.183 45.080 45.100 0.271 0.000 0.820 88 G HN 0.358 8.648 8.290 -0.000 0.000 0.645 89 S N -0.361 115.521 115.700 0.303 0.000 2.669 89 S HA 0.612 5.072 4.470 -0.016 0.000 0.315 89 S C -0.505 174.230 174.600 0.226 0.000 1.106 89 S CA -0.573 57.849 58.200 0.370 0.000 1.107 89 S CB 0.910 64.269 63.200 0.265 0.000 0.990 89 S HN 1.666 9.976 8.310 -0.000 0.000 0.471 90 L N 6.374 127.755 121.223 0.263 0.000 2.287 90 L HA 0.767 5.097 4.340 -0.016 0.000 0.287 90 L C -1.771 175.299 176.870 0.334 0.000 1.022 90 L CA -0.235 54.679 54.840 0.124 0.000 0.814 90 L CB 0.562 42.587 42.059 -0.058 0.000 1.217 90 L HN 0.686 8.916 8.230 -0.000 0.000 0.420 91 W N 7.133 128.267 121.300 -0.277 0.000 2.532 91 W HA 0.607 5.258 4.660 -0.015 0.000 0.321 91 W C -0.736 175.579 176.519 -0.339 0.000 1.037 91 W CA -1.060 56.104 57.345 -0.302 0.000 1.220 91 W CB 1.402 30.423 29.460 -0.732 0.000 1.361 91 W HN 0.471 8.651 8.180 -0.000 0.000 0.468 92 F N 0.797 120.708 119.950 -0.065 0.000 2.686 92 F HA 0.931 5.449 4.527 -0.015 0.000 0.311 92 F C 0.188 175.856 175.800 -0.221 0.000 1.128 92 F CA -0.713 57.140 58.000 -0.245 0.000 0.946 92 F CB 1.293 40.131 39.000 -0.270 0.000 1.336 92 F HN 0.702 9.002 8.300 -0.000 0.000 0.457 93 G N 0.711 109.332 108.800 -0.297 0.000 2.217 93 G HA2 0.066 4.016 3.960 -0.016 0.000 0.126 93 G HA3 0.066 4.016 3.960 -0.016 0.000 0.126 93 G C -1.880 172.579 174.900 -0.736 0.000 1.293 93 G CA -0.312 44.205 45.100 -0.972 0.000 1.219 93 G HN 0.985 9.275 8.290 -0.000 0.000 0.477 94 D N 1.740 121.804 120.400 -0.560 0.000 2.339 94 D HA 0.380 5.010 4.640 -0.016 0.000 0.256 94 D C 1.877 178.115 176.300 -0.103 0.000 1.214 94 D CA 0.742 54.645 54.000 -0.162 0.000 0.877 94 D CB 1.234 42.009 40.800 -0.041 0.000 1.111 94 D HN 0.604 8.974 8.370 -0.000 0.000 0.478 95 T N 0.410 114.952 114.554 -0.020 0.000 3.113 95 T HA -0.016 4.325 4.350 -0.016 0.000 0.256 95 T C 0.791 175.499 174.700 0.013 0.000 1.131 95 T CA 0.363 62.465 62.100 0.004 0.000 1.074 95 T CB 0.312 69.286 68.868 0.177 0.000 0.944 95 T HN 0.237 8.477 8.240 -0.000 0.000 0.516 96 D N 0.599 121.014 120.400 0.026 0.000 2.423 96 D HA 0.195 4.825 4.640 -0.016 0.000 0.208 96 D C 0.697 177.017 176.300 0.033 0.000 1.068 96 D CA -0.066 53.956 54.000 0.036 0.000 0.860 96 D CB 0.539 41.367 40.800 0.047 0.000 0.992 96 D HN 0.304 8.674 8.370 -0.000 0.000 0.504 97 V N 1.764 121.698 119.914 0.034 0.000 2.763 97 V HA 0.000 4.111 4.120 -0.016 0.000 0.306 97 V C -0.066 176.065 176.094 0.062 0.000 1.059 97 V CA 0.036 62.365 62.300 0.047 0.000 1.138 97 V CB 1.217 33.071 31.823 0.051 0.000 0.940 97 V HN -0.211 7.979 8.190 -0.000 0.000 0.489 98 V N 7.214 127.157 119.914 0.048 0.000 2.407 98 V HA 0.585 4.695 4.120 -0.016 0.000 0.278 98 V C 0.401 176.513 176.094 0.030 0.000 1.037 98 V CA 0.285 62.614 62.300 0.048 0.000 0.900 98 V CB 1.402 33.247 31.823 0.038 0.000 0.983 98 V HN 1.139 9.329 8.190 -0.000 0.000 0.459 99 T N 0.748 115.315 114.554 0.022 0.000 2.864 99 T HA 0.326 4.666 4.350 -0.016 0.000 0.289 99 T C 0.780 175.453 174.700 -0.045 0.000 1.082 99 T CA -0.365 61.711 62.100 -0.040 0.000 1.009 99 T CB 1.480 70.266 68.868 -0.137 0.000 1.234 99 T HN 0.550 8.790 8.240 -0.000 0.000 0.526 100 N N -0.175 118.508 118.700 -0.029 0.000 2.573 100 N HA -0.059 4.671 4.740 -0.016 0.000 0.187 100 N C 1.169 176.741 175.510 0.103 0.000 1.107 100 N CA 0.896 53.976 53.050 0.049 0.000 0.918 100 N CB -0.227 38.316 38.487 0.094 0.000 0.966 100 N HN 0.729 9.109 8.380 -0.000 0.000 0.448 101 E N -0.267 119.806 120.200 -0.211 0.000 2.318 101 E HA 0.255 4.596 4.350 -0.016 0.000 0.193 101 E C 0.643 177.030 176.600 -0.355 0.000 0.998 101 E CA 0.522 56.591 56.400 -0.552 0.000 0.859 101 E CB 0.062 28.727 29.700 -1.723 0.000 0.812 101 E HN 0.457 8.817 8.360 -0.000 0.000 0.492 102 G N -0.363 108.358 108.800 -0.131 0.000 2.298 102 G HA2 -0.109 3.841 3.960 -0.016 0.000 0.309 102 G HA3 -0.109 3.841 3.960 -0.016 0.000 0.309 102 G C -1.485 173.468 174.900 0.089 0.000 1.279 102 G CA -0.317 44.804 45.100 0.036 0.000 1.042 102 G HN 0.191 8.481 8.290 -0.000 0.000 0.480 103 Q N -0.539 119.307 119.800 0.076 0.000 2.285 103 Q HA 0.584 4.914 4.340 -0.016 0.000 0.269 103 Q C 0.884 176.861 176.000 -0.039 0.000 1.030 103 Q CA -0.848 54.951 55.803 -0.005 0.000 0.788 103 Q CB 1.855 30.627 28.738 0.056 0.000 1.266 103 Q HN 0.532 8.802 8.270 -0.000 0.000 0.438 104 I N 1.597 122.001 120.570 -0.277 0.000 2.142 104 I HA -0.312 3.848 4.170 -0.016 0.000 0.240 104 I C 2.224 178.472 176.117 0.219 0.000 1.078 104 I CA 1.866 63.147 61.300 -0.033 0.000 1.343 104 I CB -0.246 37.602 38.000 -0.254 0.000 1.046 104 I HN 0.724 8.934 8.210 -0.000 0.000 0.405 105 S N 0.998 116.787 115.700 0.147 0.000 2.356 105 S HA -0.132 4.328 4.470 -0.016 0.000 0.223 105 S C 2.208 176.875 174.600 0.113 0.000 1.032 105 S CA 1.158 59.450 58.200 0.153 0.000 1.005 105 S CB -1.501 61.759 63.200 0.100 0.000 0.867 105 S HN 0.485 8.795 8.310 -0.000 0.000 0.449 106 G N 1.210 110.073 108.800 0.105 0.000 2.422 106 G HA2 -0.109 3.841 3.960 -0.016 0.000 0.218 106 G HA3 -0.109 3.841 3.960 -0.016 0.000 0.218 106 G C 1.465 176.439 174.900 0.123 0.000 1.146 106 G CA 1.380 46.542 45.100 0.103 0.000 0.769 106 G HN 0.564 8.854 8.290 -0.000 0.000 0.547 107 T N 1.526 116.179 114.554 0.165 0.000 2.821 107 T HA 0.086 4.426 4.350 -0.016 0.000 0.267 107 T C 2.825 177.504 174.700 -0.034 0.000 1.046 107 T CA 1.297 63.484 62.100 0.145 0.000 1.139 107 T CB -0.292 68.742 68.868 0.276 0.000 0.871 107 T HN 0.359 8.599 8.240 -0.000 0.000 0.454 108 A N 1.591 124.362 122.820 -0.082 0.000 1.902 108 A HA 0.133 4.443 4.320 -0.016 0.000 0.217 108 A C 2.648 180.159 177.584 -0.122 0.000 1.181 108 A CA 1.816 53.659 52.037 -0.323 0.000 0.623 108 A CB -1.111 17.830 19.000 -0.099 0.000 0.818 108 A HN 0.501 8.651 8.150 -0.000 0.000 0.443 109 A N -1.291 121.523 122.820 -0.011 0.000 1.933 109 A HA -0.120 4.190 4.320 -0.016 0.000 0.218 109 A C 2.147 179.746 177.584 0.026 0.000 1.175 109 A CA 2.214 54.262 52.037 0.018 0.000 0.628 109 A CB -0.436 18.580 19.000 0.027 0.000 0.814 109 A HN 0.526 8.676 8.150 -0.000 0.000 0.444 110 M N -0.766 118.866 119.600 0.053 0.000 2.200 110 M HA 0.051 4.521 4.480 -0.016 0.000 0.265 110 M C 2.045 178.346 176.300 0.001 0.000 1.066 110 M CA 1.517 56.855 55.300 0.064 0.000 1.127 110 M CB -0.544 32.190 32.600 0.222 0.000 1.379 110 M HN 0.421 8.711 8.290 -0.000 0.000 0.420 111 M N -0.307 119.344 119.600 0.085 0.000 2.117 111 M HA -0.225 4.245 4.480 -0.016 0.000 0.262 111 M C 1.458 177.807 176.300 0.081 0.000 1.065 111 M CA 1.520 56.873 55.300 0.089 0.000 1.114 111 M CB -0.827 31.755 32.600 -0.030 0.000 1.361 111 M HN 0.180 8.470 8.290 -0.000 0.000 0.408 112 D N 0.550 121.018 120.400 0.113 0.000 2.104 112 D HA -0.182 4.448 4.640 -0.016 0.000 0.194 112 D C 1.827 178.135 176.300 0.012 0.000 0.994 112 D CA 1.337 55.395 54.000 0.097 0.000 0.830 112 D CB -0.390 40.462 40.800 0.086 0.000 0.959 112 D HN 0.348 8.718 8.370 -0.000 0.000 0.452 113 K N 0.331 120.717 120.400 -0.024 0.000 2.057 113 K HA -0.057 4.253 4.320 -0.016 0.000 0.207 113 K C 1.716 178.258 176.600 -0.096 0.000 1.049 113 K CA 0.786 57.041 56.287 -0.054 0.000 0.931 113 K CB -0.018 32.447 32.500 -0.058 0.000 0.714 113 K HN 0.130 8.380 8.250 -0.000 0.000 0.440 114 L N 0.751 121.869 121.223 -0.175 0.000 2.653 114 L HA 0.132 4.462 4.340 -0.016 0.000 0.231 114 L C 0.079 176.874 176.870 -0.125 0.000 1.153 114 L CA -0.213 54.490 54.840 -0.228 0.000 0.933 114 L CB 0.364 42.097 42.059 -0.544 0.000 1.175 114 L HN 0.075 8.305 8.230 -0.000 0.000 0.473 115 S N -0.104 115.564 115.700 -0.053 0.000 3.641 115 S HA -0.120 4.340 4.470 -0.016 0.000 0.346 115 S C 0.126 174.745 174.600 0.032 0.000 1.074 115 S CA 0.137 58.335 58.200 -0.003 0.000 1.026 115 S CB -1.372 61.823 63.200 -0.008 0.000 0.908 115 S HN 0.174 8.484 8.310 -0.000 0.000 0.479 116 V N 2.822 122.778 119.914 0.070 0.000 2.394 116 V HA 0.353 4.463 4.120 -0.016 0.000 0.282 116 V C 0.941 177.150 176.094 0.192 0.000 1.031 116 V CA -0.841 61.545 62.300 0.143 0.000 0.881 116 V CB 1.378 33.350 31.823 0.248 0.000 0.982 116 V HN 0.577 8.767 8.190 -0.000 0.000 0.451 117 R N 4.851 125.438 120.500 0.145 0.000 2.594 117 R HA 0.493 4.823 4.340 -0.016 0.000 0.272 117 R C -0.921 175.512 176.300 0.223 0.000 1.074 117 R CA -0.214 55.952 56.100 0.110 0.000 1.105 117 R CB 0.429 30.771 30.300 0.071 0.000 1.008 117 R HN 0.749 9.019 8.270 -0.000 0.000 0.472 118 Y N -2.436 117.889 120.300 0.041 0.000 2.677 118 Y HA 0.424 4.965 4.550 -0.016 0.000 0.334 118 Y C -1.709 174.278 175.900 0.145 0.000 1.196 118 Y CA -1.435 56.706 58.100 0.069 0.000 1.059 118 Y CB 1.441 39.871 38.460 -0.051 0.000 1.315 118 Y HN 0.639 8.919 8.280 -0.000 0.000 0.455 119 E N 2.321 122.721 120.200 0.332 0.000 2.158 119 E HA 0.107 4.447 4.350 -0.016 0.000 0.271 119 E C -1.548 175.339 176.600 0.478 0.000 0.911 119 E CA -0.763 55.804 56.400 0.279 0.000 0.767 119 E CB 1.713 31.551 29.700 0.230 0.000 1.120 119 E HN 0.652 9.012 8.360 -0.000 0.000 0.405 120 W N 5.844 127.311 121.300 0.278 0.000 2.315 120 W HA 0.364 5.014 4.660 -0.017 0.000 0.316 120 W C -1.433 175.225 176.519 0.230 0.000 1.211 120 W CA -0.339 57.203 57.345 0.328 0.000 1.201 120 W CB 0.645 30.270 29.460 0.275 0.000 1.184 120 W HN 0.458 8.638 8.180 -0.000 0.000 0.544 121 L N 6.606 127.639 121.223 -0.317 0.000 2.408 121 L HA 0.359 4.689 4.340 -0.016 0.000 0.268 121 L C 0.184 176.938 176.870 -0.193 0.000 0.986 121 L CA -1.127 53.634 54.840 -0.131 0.000 0.820 121 L CB 1.919 43.942 42.059 -0.060 0.000 1.303 121 L HN 0.229 8.459 8.230 -0.000 0.000 0.411 122 K N 1.013 121.425 120.400 0.020 0.000 2.148 122 K HA 0.495 4.805 4.320 -0.016 0.000 0.239 122 K C 0.914 177.522 176.600 0.013 0.000 1.018 122 K CA -0.239 56.085 56.287 0.063 0.000 0.923 122 K CB 1.135 33.707 32.500 0.120 0.000 1.117 122 K HN 0.666 8.916 8.250 -0.000 0.000 0.477 123 A N 0.505 123.349 122.820 0.040 0.000 1.917 123 A HA -0.202 4.108 4.320 -0.016 0.000 0.219 123 A C 2.230 179.802 177.584 -0.020 0.000 1.182 123 A CA 2.755 54.798 52.037 0.009 0.000 0.633 123 A CB -0.876 18.150 19.000 0.044 0.000 0.819 123 A HN 0.798 8.948 8.150 -0.000 0.000 0.448 124 T N -0.782 113.772 114.554 0.000 0.000 2.833 124 T HA -0.139 4.201 4.350 -0.016 0.000 0.269 124 T C 1.476 176.160 174.700 -0.026 0.000 1.054 124 T CA 1.792 63.884 62.100 -0.013 0.000 1.135 124 T CB -0.570 68.297 68.868 -0.001 0.000 0.869 124 T HN 0.500 8.740 8.240 -0.000 0.000 0.466 125 D N 0.671 121.061 120.400 -0.016 0.000 2.149 125 D HA 0.014 4.644 4.640 -0.016 0.000 0.201 125 D C 2.094 178.369 176.300 -0.042 0.000 0.972 125 D CA 0.911 54.894 54.000 -0.029 0.000 0.835 125 D CB -0.204 40.601 40.800 0.009 0.000 0.966 125 D HN 0.475 8.845 8.370 -0.000 0.000 0.476 126 I N 1.417 121.977 120.570 -0.017 0.000 2.179 126 I HA -0.227 3.933 4.170 -0.016 0.000 0.242 126 I C 2.371 178.531 176.117 0.071 0.000 1.088 126 I CA 1.145 62.468 61.300 0.039 0.000 1.357 126 I CB -0.206 37.614 38.000 -0.299 0.000 1.051 126 I HN -0.054 8.156 8.210 -0.000 0.000 0.409 127 E N 0.474 120.667 120.200 -0.012 0.000 2.047 127 E HA -0.250 4.090 4.350 -0.016 0.000 0.191 127 E C 2.314 178.883 176.600 -0.051 0.000 0.987 127 E CA 0.974 57.375 56.400 0.001 0.000 0.799 127 E CB -0.189 29.495 29.700 -0.027 0.000 0.752 127 E HN 0.373 8.733 8.360 -0.000 0.000 0.449 128 R N 1.150 121.598 120.500 -0.086 0.000 2.073 128 R HA -0.115 4.216 4.340 -0.016 0.000 0.234 128 R C 2.259 178.440 176.300 -0.200 0.000 1.134 128 R CA 1.378 57.405 56.100 -0.122 0.000 0.952 128 R CB 0.037 30.273 30.300 -0.107 0.000 0.850 128 R HN 0.031 8.301 8.270 -0.000 0.000 0.433 129 R N -1.186 119.109 120.500 -0.341 0.000 2.093 129 R HA -0.029 4.302 4.340 -0.016 0.000 0.224 129 R C 1.474 177.365 176.300 -0.681 0.000 1.101 129 R CA 1.251 56.964 56.100 -0.645 0.000 0.979 129 R CB 0.076 29.683 30.300 -1.155 0.000 0.877 129 R HN 0.245 8.515 8.270 -0.000 0.000 0.441 130 F N -1.908 118.026 119.950 -0.026 0.000 2.706 130 F HA 0.365 4.882 4.527 -0.016 0.000 0.308 130 F C 1.373 177.033 175.800 -0.234 0.000 1.095 130 F CA 0.334 58.302 58.000 -0.054 0.000 1.244 130 F CB 1.031 40.094 39.000 0.105 0.000 1.063 130 F HN 0.161 8.461 8.300 -0.000 0.000 0.582 131 G N 0.070 108.813 108.800 -0.095 0.000 2.176 131 G HA2 -0.272 3.679 3.960 -0.016 0.000 0.232 131 G HA3 -0.272 3.679 3.960 -0.016 0.000 0.232 131 G C 0.246 174.965 174.900 -0.302 0.000 0.986 131 G CA -0.581 44.389 45.100 -0.215 0.000 0.643 131 G HN 0.143 8.433 8.290 -0.000 0.000 0.522 132 F N 1.160 121.000 119.950 -0.183 0.000 2.539 132 F HA 0.655 5.172 4.527 -0.017 0.000 0.340 132 F C 1.325 177.011 175.800 -0.189 0.000 1.185 132 F CA 0.137 57.996 58.000 -0.235 0.000 1.333 132 F CB 0.544 39.364 39.000 -0.301 0.000 1.152 132 F HN -0.041 8.259 8.300 -0.000 0.000 0.602 133 R N -0.091 120.408 120.500 -0.001 0.000 2.740 133 R HA 0.433 4.764 4.340 -0.016 0.000 0.273 133 R C 0.272 176.589 176.300 0.027 0.000 0.998 133 R CA -0.647 55.428 56.100 -0.042 0.000 0.900 133 R CB 1.358 31.586 30.300 -0.120 0.000 1.223 133 R HN 0.778 9.048 8.270 -0.000 0.000 0.466 134 G N 1.004 109.801 108.800 -0.006 0.000 2.179 134 G HA2 -0.269 3.681 3.960 -0.016 0.000 0.257 134 G HA3 -0.269 3.681 3.960 -0.016 0.000 0.257 134 G C 0.075 174.979 174.900 0.007 0.000 1.010 134 G CA 0.371 45.488 45.100 0.028 0.000 0.736 134 G HN 0.335 8.625 8.290 -0.000 0.000 0.513 135 L N 0.445 121.624 121.223 -0.072 0.000 2.426 135 L HA 0.287 4.617 4.340 -0.016 0.000 0.271 135 L C -1.280 175.430 176.870 -0.266 0.000 1.169 135 L CA -1.774 52.939 54.840 -0.211 0.000 0.836 135 L CB 0.162 42.164 42.059 -0.095 0.000 1.112 135 L HN -0.058 8.172 8.230 -0.000 0.000 0.465 136 P HA -0.022 4.398 4.420 -0.000 0.000 0.265 136 P C 0.254 177.456 177.300 -0.163 0.000 1.187 136 P CA -0.137 62.740 63.100 -0.371 0.000 0.766 136 P CB 0.404 31.729 31.700 -0.625 0.000 0.820 137 R N 2.325 122.792 120.500 -0.055 0.000 2.189 137 R HA -0.115 4.215 4.340 -0.016 0.000 0.223 137 R C 0.455 176.803 176.300 0.080 0.000 1.092 137 R CA 1.565 57.672 56.100 0.012 0.000 0.989 137 R CB -0.584 29.725 30.300 0.014 0.000 0.876 137 R HN 0.385 8.655 8.270 -0.000 0.000 0.457 138 D N -0.783 119.688 120.400 0.118 0.000 2.328 138 D HA -0.064 4.566 4.640 -0.016 0.000 0.221 138 D C -0.358 176.139 176.300 0.328 0.000 1.072 138 D CA -0.334 53.784 54.000 0.197 0.000 0.850 138 D CB -0.302 40.607 40.800 0.182 0.000 0.922 138 D HN 0.076 8.446 8.370 -0.000 0.000 0.516 139 Y N 1.786 122.137 120.300 0.084 0.000 2.526 139 Y HA 0.326 4.866 4.550 -0.017 0.000 0.330 139 Y C 0.886 176.834 175.900 0.080 0.000 1.156 139 Y CA -0.596 57.567 58.100 0.105 0.000 1.419 139 Y CB 0.319 38.857 38.460 0.130 0.000 1.250 139 Y HN -0.002 8.278 8.280 -0.000 0.000 0.540 140 E N 0.515 120.792 120.200 0.129 0.000 2.445 140 E HA 0.777 5.117 4.350 -0.016 0.000 0.279 140 E C -0.343 176.096 176.600 -0.269 0.000 1.018 140 E CA -0.847 55.537 56.400 -0.026 0.000 0.816 140 E CB 2.492 32.300 29.700 0.181 0.000 1.356 140 E HN 0.673 9.033 8.360 -0.000 0.000 0.462 141 G N 0.043 108.389 108.800 -0.756 0.000 2.441 141 G HA2 0.474 4.424 3.960 -0.016 0.000 0.225 141 G HA3 0.474 4.424 3.960 -0.016 0.000 0.225 141 G C -1.975 172.337 174.900 -0.979 0.000 1.200 141 G CA -0.387 44.178 45.100 -0.891 0.000 0.947 141 G HN 0.471 8.761 8.290 -0.000 0.000 0.484 142 F N -1.617 118.111 119.950 -0.370 0.000 2.662 142 F HA 0.870 5.387 4.527 -0.017 0.000 0.312 142 F C -1.493 174.321 175.800 0.023 0.000 1.113 142 F CA -1.589 56.342 58.000 -0.116 0.000 0.951 142 F CB 1.815 40.856 39.000 0.067 0.000 1.344 142 F HN 0.589 8.889 8.300 -0.000 0.000 0.462 143 L N 2.711 124.165 121.223 0.385 0.000 2.305 143 L HA 0.506 4.836 4.340 -0.016 0.000 0.284 143 L C -0.859 176.248 176.870 0.396 0.000 1.013 143 L CA -0.331 54.700 54.840 0.317 0.000 0.819 143 L CB 1.405 43.637 42.059 0.288 0.000 1.227 143 L HN 0.731 8.961 8.230 -0.000 0.000 0.417 144 Q N 7.161 127.161 119.800 0.334 0.000 2.368 144 Q HA 0.400 4.730 4.340 -0.016 0.000 0.256 144 Q C -2.181 173.924 176.000 0.174 0.000 0.980 144 Q CA -2.060 53.872 55.803 0.214 0.000 0.887 144 Q CB 1.894 30.676 28.738 0.073 0.000 1.221 144 Q HN 0.483 8.753 8.270 -0.000 0.000 0.458 145 P HA 0.021 4.441 4.420 -0.000 0.000 0.241 145 P C -0.075 177.321 177.300 0.160 0.000 1.191 145 P CA 0.492 63.696 63.100 0.173 0.000 0.771 145 P CB 0.658 32.455 31.700 0.161 0.000 0.929 146 D N -0.059 120.425 120.400 0.140 0.000 2.350 146 D HA 0.063 4.693 4.640 -0.016 0.000 0.213 146 D C 1.403 177.813 176.300 0.183 0.000 1.031 146 D CA 0.317 54.412 54.000 0.159 0.000 0.861 146 D CB 0.287 41.180 40.800 0.156 0.000 0.926 146 D HN 0.153 8.523 8.370 -0.000 0.000 0.520 147 G N -0.227 108.630 108.800 0.095 0.000 2.616 147 G HA2 0.500 4.450 3.960 -0.016 0.000 0.268 147 G HA3 0.500 4.450 3.960 -0.016 0.000 0.268 147 G C 0.362 175.398 174.900 0.227 0.000 1.213 147 G CA 0.272 45.386 45.100 0.024 0.000 0.926 147 G HN 0.285 8.575 8.290 -0.000 0.000 0.523 148 G N -1.771 107.176 108.800 0.245 0.000 2.498 148 G HA2 0.468 4.418 3.960 -0.016 0.000 0.181 148 G HA3 0.468 4.418 3.960 -0.016 0.000 0.181 148 G C -0.950 174.174 174.900 0.373 0.000 1.169 148 G CA 0.017 45.333 45.100 0.360 0.000 0.992 148 G HN 0.844 9.134 8.290 -0.000 0.000 0.490 149 T N 0.801 115.551 114.554 0.327 0.000 2.856 149 T HA 0.676 5.017 4.350 -0.016 0.000 0.283 149 T C -0.330 174.506 174.700 0.227 0.000 1.008 149 T CA -0.124 62.154 62.100 0.296 0.000 0.997 149 T CB 1.420 70.465 68.868 0.295 0.000 0.992 149 T HN 0.470 8.710 8.240 -0.000 0.000 0.454 150 I N 2.163 122.791 120.570 0.097 0.000 2.404 150 I HA 0.274 4.434 4.170 -0.016 0.000 0.293 150 I C -0.066 176.008 176.117 -0.072 0.000 0.992 150 I CA -0.885 60.375 61.300 -0.066 0.000 1.149 150 I CB 1.453 39.370 38.000 -0.140 0.000 1.315 150 I HN 0.496 8.706 8.210 -0.000 0.000 0.446 151 D N 6.106 126.329 120.400 -0.296 0.000 2.383 151 D HA 0.090 4.720 4.640 -0.016 0.000 0.245 151 D C 0.869 176.956 176.300 -0.354 0.000 1.263 151 D CA 0.037 53.586 54.000 -0.751 0.000 0.936 151 D CB 1.186 41.280 40.800 -1.177 0.000 1.053 151 D HN 0.277 8.647 8.370 -0.000 0.000 0.507 152 V N 5.378 125.114 119.914 -0.296 0.000 2.261 152 V HA -0.228 3.882 4.120 -0.016 0.000 0.246 152 V C 2.497 178.551 176.094 -0.067 0.000 1.047 152 V CA 1.636 63.783 62.300 -0.254 0.000 1.015 152 V CB -0.344 31.221 31.823 -0.431 0.000 0.642 152 V HN 0.558 8.748 8.190 -0.000 0.000 0.446 153 R N 0.065 120.476 120.500 -0.148 0.000 2.115 153 R HA -0.041 4.289 4.340 -0.016 0.000 0.226 153 R C 2.441 178.617 176.300 -0.206 0.000 1.100 153 R CA 1.200 57.208 56.100 -0.154 0.000 0.980 153 R CB -0.708 29.496 30.300 -0.160 0.000 0.875 153 R HN 0.590 8.860 8.270 -0.000 0.000 0.445 154 G N 0.247 108.890 108.800 -0.261 0.000 2.408 154 G HA2 -0.226 3.724 3.960 -0.016 0.000 0.217 154 G HA3 -0.226 3.724 3.960 -0.016 0.000 0.217 154 G C 1.324 176.159 174.900 -0.108 0.000 1.150 154 G CA 1.024 45.985 45.100 -0.231 0.000 0.776 154 G HN 0.211 8.501 8.290 -0.000 0.000 0.542 155 T N 1.424 115.975 114.554 -0.006 0.000 2.708 155 T HA -0.033 4.307 4.350 -0.016 0.000 0.266 155 T C 2.437 177.198 174.700 0.103 0.000 1.037 155 T CA 0.902 63.078 62.100 0.126 0.000 1.146 155 T CB -0.226 68.877 68.868 0.391 0.000 0.865 155 T HN 0.147 8.387 8.240 -0.000 0.000 0.435 156 L N 0.777 122.092 121.223 0.153 0.000 2.042 156 L HA -0.128 4.203 4.340 -0.016 0.000 0.210 156 L C 3.054 180.042 176.870 0.198 0.000 1.076 156 L CA 1.352 56.335 54.840 0.237 0.000 0.749 156 L CB -0.691 41.569 42.059 0.334 0.000 0.893 156 L HN 0.249 8.479 8.230 -0.000 0.000 0.432 157 A N -0.096 122.675 122.820 -0.081 0.000 1.902 157 A HA -0.158 4.152 4.320 -0.016 0.000 0.217 157 A C 2.540 180.134 177.584 0.017 0.000 1.181 157 A CA 1.686 53.656 52.037 -0.111 0.000 0.623 157 A CB -0.699 18.142 19.000 -0.264 0.000 0.818 157 A HN 0.408 8.558 8.150 -0.000 0.000 0.443 158 A N -0.128 122.662 122.820 -0.050 0.000 1.883 158 A HA -0.081 4.229 4.320 -0.016 0.000 0.217 158 A C 2.188 179.664 177.584 -0.181 0.000 1.186 158 A CA 1.600 53.565 52.037 -0.121 0.000 0.624 158 A CB -0.657 18.250 19.000 -0.155 0.000 0.822 158 A HN 0.476 8.626 8.150 -0.000 0.000 0.444 159 L N -2.244 118.901 121.223 -0.130 0.000 2.056 159 L HA -0.137 4.193 4.340 -0.016 0.000 0.207 159 L C 2.495 179.325 176.870 -0.067 0.000 1.078 159 L CA 1.626 56.357 54.840 -0.182 0.000 0.749 159 L CB -0.586 41.444 42.059 -0.047 0.000 0.901 159 L HN 0.516 8.746 8.230 -0.000 0.000 0.433 160 F N 0.842 120.763 119.950 -0.048 0.000 2.095 160 F HA -0.281 4.236 4.527 -0.017 0.000 0.298 160 F C 2.499 178.237 175.800 -0.103 0.000 1.104 160 F CA 2.215 60.172 58.000 -0.072 0.000 1.232 160 F CB -0.319 38.742 39.000 0.101 0.000 0.987 160 F HN -0.061 8.239 8.300 -0.000 0.000 0.475 161 T N 1.438 116.077 114.554 0.142 0.000 2.708 161 T HA -0.179 4.161 4.350 -0.016 0.000 0.266 161 T C 2.090 176.714 174.700 -0.125 0.000 1.037 161 T CA 1.782 63.899 62.100 0.028 0.000 1.146 161 T CB -0.530 68.358 68.868 0.034 0.000 0.865 161 T HN 0.231 8.471 8.240 -0.000 0.000 0.435 162 L N 0.622 121.704 121.223 -0.236 0.000 2.056 162 L HA -0.065 4.266 4.340 -0.016 0.000 0.207 162 L C 3.021 179.804 176.870 -0.146 0.000 1.078 162 L CA 1.164 55.812 54.840 -0.319 0.000 0.749 162 L CB -0.630 40.896 42.059 -0.887 0.000 0.901 162 L HN 0.239 8.469 8.230 -0.000 0.000 0.433 163 A N -0.665 122.064 122.820 -0.151 0.000 1.877 163 A HA -0.247 4.063 4.320 -0.016 0.000 0.216 163 A C 2.236 179.741 177.584 -0.133 0.000 1.186 163 A CA 1.545 53.552 52.037 -0.049 0.000 0.620 163 A CB -0.469 18.460 19.000 -0.117 0.000 0.822 163 A HN 0.455 8.605 8.150 -0.000 0.000 0.443 164 Q N -0.911 118.724 119.800 -0.276 0.000 2.079 164 Q HA -0.105 4.225 4.340 -0.016 0.000 0.200 164 Q C 2.432 178.362 176.000 -0.117 0.000 0.974 164 Q CA 1.278 56.927 55.803 -0.256 0.000 0.840 164 Q CB -0.354 28.162 28.738 -0.370 0.000 0.898 164 Q HN 0.682 8.952 8.270 -0.000 0.000 0.430 165 A N 0.908 123.677 122.820 -0.084 0.000 2.019 165 A HA -0.073 4.237 4.320 -0.016 0.000 0.219 165 A C 2.096 179.679 177.584 -0.003 0.000 1.164 165 A CA 1.527 53.544 52.037 -0.033 0.000 0.644 165 A CB -0.401 18.585 19.000 -0.023 0.000 0.805 165 A HN 0.367 8.517 8.150 -0.000 0.000 0.449 166 A N -2.144 120.688 122.820 0.021 0.000 2.251 166 A HA 0.427 4.737 4.320 -0.016 0.000 0.209 166 A C 1.682 179.275 177.584 0.016 0.000 1.187 166 A CA 1.186 53.250 52.037 0.045 0.000 0.823 166 A CB -0.668 18.404 19.000 0.120 0.000 0.846 166 A HN 1.813 9.963 8.150 -0.000 0.000 0.486 167 G N -2.154 106.641 108.800 -0.007 0.000 2.179 167 G HA2 0.147 4.097 3.960 -0.016 0.000 0.220 167 G HA3 0.147 4.097 3.960 -0.016 0.000 0.220 167 G C 0.414 175.309 174.900 -0.008 0.000 0.990 167 G CA 0.091 45.187 45.100 -0.006 0.000 0.646 167 G HN 1.499 9.789 8.290 -0.000 0.000 0.517 168 A N 0.315 123.114 122.820 -0.035 0.000 2.445 168 A HA 0.618 4.928 4.320 -0.016 0.000 0.242 168 A C 0.729 178.259 177.584 -0.089 0.000 1.075 168 A CA 1.229 53.233 52.037 -0.055 0.000 0.777 168 A CB 0.306 19.252 19.000 -0.090 0.000 1.013 168 A HN 0.782 8.932 8.150 -0.000 0.000 0.493 169 T N 3.384 117.894 114.554 -0.074 0.000 2.728 169 T HA 0.463 4.803 4.350 -0.016 0.000 0.296 169 T C -0.234 174.390 174.700 -0.128 0.000 0.940 169 T CA 0.127 62.182 62.100 -0.075 0.000 1.013 169 T CB -0.180 68.684 68.868 -0.007 0.000 0.912 169 T HN 0.405 8.645 8.240 -0.000 0.000 0.484 170 L N 4.386 125.531 121.223 -0.131 0.000 2.295 170 L HA 0.551 4.882 4.340 -0.016 0.000 0.281 170 L C 0.367 177.339 176.870 0.169 0.000 1.018 170 L CA -0.653 54.129 54.840 -0.098 0.000 0.841 170 L CB 1.159 42.885 42.059 -0.555 0.000 1.218 170 L HN 0.393 8.623 8.230 -0.000 0.000 0.424 171 R N 2.810 123.459 120.500 0.249 0.000 2.388 171 R HA 0.728 5.058 4.340 -0.016 0.000 0.314 171 R C -0.619 175.735 176.300 0.090 0.000 0.959 171 R CA -0.207 55.991 56.100 0.165 0.000 0.851 171 R CB 1.654 31.980 30.300 0.043 0.000 1.168 171 R HN 0.728 8.998 8.270 -0.000 0.000 0.472 172 A N 1.898 124.746 122.820 0.046 0.000 2.261 172 A HA 0.637 4.947 4.320 -0.016 0.000 0.323 172 A C 0.758 178.281 177.584 -0.102 0.000 1.107 172 A CA -0.128 51.785 52.037 -0.206 0.000 0.883 172 A CB 0.846 19.676 19.000 -0.283 0.000 1.251 172 A HN 0.991 9.141 8.150 -0.000 0.000 0.502 173 G N -0.911 107.808 108.800 -0.134 0.000 2.179 173 G HA2 -0.196 3.754 3.960 -0.016 0.000 0.257 173 G HA3 -0.196 3.754 3.960 -0.016 0.000 0.257 173 G C -0.048 174.810 174.900 -0.070 0.000 1.010 173 G CA 0.881 45.935 45.100 -0.076 0.000 0.736 173 G HN 1.074 9.364 8.290 -0.000 0.000 0.513 174 E N 0.106 120.246 120.200 -0.100 0.000 2.241 174 E HA 0.556 4.897 4.350 -0.016 0.000 0.263 174 E C -0.507 176.027 176.600 -0.109 0.000 0.882 174 E CA -0.561 55.799 56.400 -0.067 0.000 0.769 174 E CB 1.150 30.840 29.700 -0.016 0.000 1.185 174 E HN 0.072 8.432 8.360 -0.000 0.000 0.415 175 T N 3.039 117.535 114.554 -0.098 0.000 2.767 175 T HA 0.256 4.596 4.350 -0.016 0.000 0.284 175 T C -0.275 174.383 174.700 -0.069 0.000 0.973 175 T CA -0.547 61.475 62.100 -0.129 0.000 0.996 175 T CB 1.113 69.895 68.868 -0.144 0.000 0.927 175 T HN 0.237 8.477 8.240 -0.000 0.000 0.456 176 V N 4.552 124.422 119.914 -0.074 0.000 2.508 176 V HA 0.172 4.282 4.120 -0.016 0.000 0.281 176 V C 1.662 177.743 176.094 -0.022 0.000 1.041 176 V CA 0.262 62.546 62.300 -0.028 0.000 1.016 176 V CB 0.773 32.576 31.823 -0.033 0.000 0.984 176 V HN 1.170 9.360 8.190 -0.000 0.000 0.478 177 T N 0.765 115.320 114.554 0.002 0.000 2.990 177 T HA 0.286 4.626 4.350 -0.016 0.000 0.250 177 T C 0.321 175.031 174.700 0.016 0.000 1.041 177 T CA 0.020 62.124 62.100 0.005 0.000 1.010 177 T CB 0.452 69.322 68.868 0.004 0.000 1.003 177 T HN 0.626 8.866 8.240 -0.000 0.000 0.499 178 E N 0.040 120.253 120.200 0.022 0.000 2.363 178 E HA 0.572 4.912 4.350 -0.016 0.000 0.281 178 E C -2.045 174.572 176.600 0.028 0.000 0.953 178 E CA -0.811 55.602 56.400 0.023 0.000 0.778 178 E CB 1.845 31.557 29.700 0.020 0.000 1.220 178 E HN 0.242 8.602 8.360 -0.000 0.000 0.431 179 L N 3.178 124.416 121.223 0.026 0.000 2.362 179 L HA 0.648 4.978 4.340 -0.016 0.000 0.275 179 L C -1.040 175.845 176.870 0.025 0.000 0.998 179 L CA -1.113 53.743 54.840 0.027 0.000 0.820 179 L CB 2.022 44.094 42.059 0.022 0.000 1.270 179 L HN 0.309 8.539 8.230 -0.000 0.000 0.415 180 V N 3.540 123.469 119.914 0.024 0.000 2.439 180 V HA 0.303 4.413 4.120 -0.016 0.000 0.277 180 V C -2.232 173.870 176.094 0.014 0.000 1.008 180 V CA -1.351 60.962 62.300 0.021 0.000 0.846 180 V CB 1.516 33.348 31.823 0.016 0.000 1.031 180 V HN 0.563 8.753 8.190 -0.000 0.000 0.441 181 P HA 0.444 4.864 4.420 -0.000 0.000 0.275 181 P C -1.146 176.120 177.300 -0.056 0.000 1.228 181 P CA 0.171 63.278 63.100 0.011 0.000 0.786 181 P CB 1.540 33.281 31.700 0.068 0.000 0.927 182 D N 0.043 120.308 120.400 -0.224 0.000 2.798 182 D HA 0.443 5.073 4.640 -0.016 0.000 0.308 182 D C 0.771 176.598 176.300 -0.788 0.000 1.187 182 D CA -0.925 52.738 54.000 -0.562 0.000 1.033 182 D CB -0.120 40.522 40.800 -0.263 0.000 1.445 182 D HN 0.143 8.513 8.370 -0.000 0.000 0.550 183 A N -0.781 121.585 122.820 -0.757 0.000 2.121 183 A HA -0.061 4.249 4.320 -0.016 0.000 0.218 183 A C 1.075 178.568 177.584 -0.151 0.000 1.154 183 A CA 1.286 53.110 52.037 -0.355 0.000 0.679 183 A CB -0.555 18.370 19.000 -0.126 0.000 0.795 183 A HN 0.552 8.702 8.150 -0.000 0.000 0.458 184 D N -1.635 118.678 120.400 -0.145 0.000 2.398 184 D HA 0.364 4.994 4.640 -0.016 0.000 0.210 184 D C 0.922 177.188 176.300 -0.057 0.000 1.094 184 D CA 1.064 55.019 54.000 -0.075 0.000 0.839 184 D CB 0.934 41.698 40.800 -0.059 0.000 0.963 184 D HN 0.495 8.865 8.370 -0.000 0.000 0.506 185 G N -0.008 108.751 108.800 -0.069 0.000 2.332 185 G HA2 0.121 4.071 3.960 -0.016 0.000 0.265 185 G HA3 0.121 4.071 3.960 -0.016 0.000 0.265 185 G C -1.768 173.111 174.900 -0.034 0.000 1.329 185 G CA -0.629 44.451 45.100 -0.033 0.000 0.949 185 G HN -0.013 8.277 8.290 -0.000 0.000 0.476 186 V N 0.303 120.216 119.914 -0.003 0.000 2.638 186 V HA 0.685 4.795 4.120 -0.016 0.000 0.306 186 V C 0.094 176.207 176.094 0.031 0.000 1.052 186 V CA -0.716 61.589 62.300 0.008 0.000 0.885 186 V CB 1.687 33.521 31.823 0.018 0.000 0.999 186 V HN 0.865 9.055 8.190 -0.000 0.000 0.424 187 S N 3.028 118.744 115.700 0.027 0.000 2.489 187 S HA 0.592 5.052 4.470 -0.016 0.000 0.277 187 S C -0.246 174.392 174.600 0.063 0.000 1.230 187 S CA -0.413 57.814 58.200 0.046 0.000 1.053 187 S CB 1.291 64.506 63.200 0.025 0.000 0.955 187 S HN 0.508 8.818 8.310 -0.000 0.000 0.488 188 V N 4.225 124.205 119.914 0.110 0.000 2.409 188 V HA 0.428 4.539 4.120 -0.016 0.000 0.291 188 V C 0.114 176.301 176.094 0.156 0.000 1.020 188 V CA -0.631 61.747 62.300 0.130 0.000 0.848 188 V CB 1.724 33.641 31.823 0.157 0.000 0.990 188 V HN 0.835 9.025 8.190 -0.000 0.000 0.430 189 T N 3.751 118.365 114.554 0.099 0.000 2.824 189 T HA 0.676 5.016 4.350 -0.016 0.000 0.280 189 T C 0.239 174.990 174.700 0.084 0.000 0.995 189 T CA -0.411 61.734 62.100 0.076 0.000 1.009 189 T CB 1.697 70.585 68.868 0.034 0.000 0.955 189 T HN 0.921 9.161 8.240 -0.000 0.000 0.452 190 T N -1.568 113.041 114.554 0.091 0.000 2.883 190 T HA 0.399 4.739 4.350 -0.016 0.000 0.284 190 T C 0.633 175.353 174.700 0.033 0.000 1.041 190 T CA -0.771 61.373 62.100 0.074 0.000 1.007 190 T CB 1.309 70.260 68.868 0.138 0.000 1.220 190 T HN 0.460 8.700 8.240 -0.000 0.000 0.552 191 D N -0.580 119.829 120.400 0.015 0.000 2.378 191 D HA -0.029 4.601 4.640 -0.016 0.000 0.227 191 D C 1.351 177.656 176.300 0.008 0.000 1.012 191 D CA 0.408 54.410 54.000 0.003 0.000 0.905 191 D CB -0.064 40.730 40.800 -0.010 0.000 0.895 191 D HN 0.607 8.977 8.370 -0.000 0.000 0.532 192 R N -0.877 119.637 120.500 0.024 0.000 2.394 192 R HA 0.458 4.788 4.340 -0.016 0.000 0.220 192 R C 0.946 177.241 176.300 -0.009 0.000 0.887 192 R CA 0.393 56.504 56.100 0.018 0.000 1.034 192 R CB 1.564 31.889 30.300 0.042 0.000 1.179 192 R HN 0.227 8.497 8.270 -0.000 0.000 0.561 193 G N -0.404 108.379 108.800 -0.028 0.000 2.356 193 G HA2 0.111 4.062 3.960 -0.016 0.000 0.281 193 G HA3 0.111 4.062 3.960 -0.016 0.000 0.281 193 G C -1.491 173.294 174.900 -0.190 0.000 1.246 193 G CA -0.265 44.757 45.100 -0.130 0.000 0.889 193 G HN -0.090 8.200 8.290 -0.000 0.000 0.486 194 T N -1.191 113.141 114.554 -0.369 0.000 2.896 194 T HA 0.782 5.123 4.350 -0.016 0.000 0.297 194 T C -1.876 172.494 174.700 -0.550 0.000 1.108 194 T CA -0.475 61.452 62.100 -0.288 0.000 1.004 194 T CB 1.411 70.208 68.868 -0.117 0.000 1.159 194 T HN 0.594 8.834 8.240 -0.000 0.000 0.499 195 Y N 0.743 121.070 120.300 0.046 0.000 2.588 195 Y HA 0.717 5.257 4.550 -0.017 0.000 0.343 195 Y C 0.183 176.118 175.900 0.059 0.000 1.065 195 Y CA -1.408 56.739 58.100 0.079 0.000 1.038 195 Y CB 1.513 40.049 38.460 0.125 0.000 1.297 195 Y HN 0.290 8.570 8.280 -0.000 0.000 0.467 196 R N 1.381 122.017 120.500 0.226 0.000 2.514 196 R HA 0.871 5.201 4.340 -0.016 0.000 0.301 196 R C -1.076 175.322 176.300 0.163 0.000 0.962 196 R CA -0.997 55.188 56.100 0.141 0.000 0.882 196 R CB 1.840 32.180 30.300 0.068 0.000 1.143 196 R HN 0.838 9.108 8.270 -0.000 0.000 0.452 197 A N 0.636 123.524 122.820 0.112 0.000 2.401 197 A HA 0.582 4.892 4.320 -0.016 0.000 0.310 197 A C 0.973 178.587 177.584 0.050 0.000 1.075 197 A CA -0.249 51.846 52.037 0.098 0.000 0.746 197 A CB 1.618 20.663 19.000 0.074 0.000 1.277 197 A HN 0.698 8.848 8.150 -0.000 0.000 0.425 198 G N 0.615 109.439 108.800 0.040 0.000 2.418 198 G HA2 0.081 4.032 3.960 -0.016 0.000 0.217 198 G HA3 0.081 4.032 3.960 -0.016 0.000 0.217 198 G C 0.615 175.515 174.900 0.000 0.000 1.158 198 G CA 0.900 46.006 45.100 0.011 0.000 0.771 198 G HN 0.652 8.942 8.290 -0.000 0.000 0.545 199 K N -1.035 119.364 120.400 -0.000 0.000 2.532 199 K HA 0.560 4.870 4.320 -0.016 0.000 0.265 199 K C -1.779 174.818 176.600 -0.005 0.000 0.948 199 K CA -0.701 55.581 56.287 -0.008 0.000 0.842 199 K CB 3.187 35.672 32.500 -0.025 0.000 1.392 199 K HN -0.084 8.166 8.250 -0.000 0.000 0.436 200 V N 1.888 121.799 119.914 -0.005 0.000 2.555 200 V HA 0.354 4.464 4.120 -0.016 0.000 0.302 200 V C -0.558 175.529 176.094 -0.011 0.000 1.038 200 V CA -0.930 61.364 62.300 -0.010 0.000 0.887 200 V CB 1.957 33.777 31.823 -0.004 0.000 0.991 200 V HN 0.453 8.643 8.190 -0.000 0.000 0.434 201 V N 5.923 125.829 119.914 -0.013 0.000 2.370 201 V HA 0.390 4.501 4.120 -0.016 0.000 0.279 201 V C -0.326 175.773 176.094 0.010 0.000 1.029 201 V CA -0.530 61.770 62.300 0.000 0.000 0.870 201 V CB 1.371 33.195 31.823 0.003 0.000 0.984 201 V HN 0.599 8.789 8.190 -0.000 0.000 0.451 202 L N 4.913 126.147 121.223 0.017 0.000 2.283 202 L HA 0.604 4.935 4.340 -0.016 0.000 0.287 202 L C 0.684 177.586 176.870 0.054 0.000 1.073 202 L CA 0.489 55.342 54.840 0.022 0.000 0.822 202 L CB 1.125 43.187 42.059 0.006 0.000 1.186 202 L HN 0.761 8.991 8.230 -0.000 0.000 0.436 203 A N 2.428 125.292 122.820 0.074 0.000 3.253 203 A HA 0.366 4.676 4.320 -0.016 0.000 0.290 203 A C 0.590 178.244 177.584 0.117 0.000 0.950 203 A CA -0.351 51.770 52.037 0.139 0.000 0.986 203 A CB -0.156 18.945 19.000 0.168 0.000 1.104 203 A HN 0.834 8.984 8.150 -0.000 0.000 0.481 204 C N -2.061 117.285 119.300 0.077 0.000 2.760 204 C HA 0.620 5.070 4.460 -0.016 0.000 0.293 204 C C 1.494 176.561 174.990 0.129 0.000 1.383 204 C CA -0.203 58.869 59.018 0.090 0.000 1.771 204 C CB -1.433 26.346 27.740 0.064 0.000 2.353 204 C HN 1.797 10.027 8.230 -0.000 0.000 0.578 205 G N 2.910 111.756 108.800 0.076 0.000 2.583 205 G HA2 -0.263 3.687 3.960 -0.016 0.000 0.292 205 G HA3 -0.263 3.687 3.960 -0.016 0.000 0.292 205 G C -1.077 173.767 174.900 -0.093 0.000 1.203 205 G CA 0.554 45.682 45.100 0.048 0.000 0.987 205 G HN 0.334 8.624 8.290 -0.000 0.000 0.554 206 P HA 0.081 4.501 4.420 -0.000 0.000 0.237 206 P C 0.728 177.894 177.300 -0.223 0.000 1.178 206 P CA 1.213 64.165 63.100 -0.247 0.000 0.766 206 P CB -0.105 31.425 31.700 -0.284 0.000 0.876 207 Y N -0.261 120.011 120.300 -0.046 0.000 2.471 207 Y HA 0.055 4.597 4.550 -0.012 0.000 0.286 207 Y C 2.326 178.248 175.900 0.036 0.000 1.188 207 Y CA 0.509 58.604 58.100 -0.010 0.000 1.286 207 Y CB -0.866 37.585 38.460 -0.015 0.000 1.072 207 Y HN -0.086 8.194 8.280 -0.000 0.000 0.517 208 T N -0.129 114.507 114.554 0.137 0.000 2.665 208 T HA -0.219 4.122 4.350 -0.016 0.000 0.268 208 T C 1.712 176.489 174.700 0.128 0.000 1.035 208 T CA 1.742 63.901 62.100 0.099 0.000 1.151 208 T CB -0.212 68.661 68.868 0.008 0.000 0.862 208 T HN 0.365 8.605 8.240 -0.000 0.000 0.438 209 N N 1.115 119.931 118.700 0.193 0.000 2.381 209 N HA -0.070 4.660 4.740 -0.016 0.000 0.182 209 N C 1.374 176.932 175.510 0.080 0.000 1.025 209 N CA 0.676 53.774 53.050 0.081 0.000 0.888 209 N CB -0.388 38.083 38.487 -0.027 0.000 0.965 209 N HN 0.386 8.766 8.380 -0.000 0.000 0.438 210 D N 0.396 120.880 120.400 0.141 0.000 2.144 210 D HA -0.075 4.555 4.640 -0.016 0.000 0.199 210 D C 1.875 178.229 176.300 0.089 0.000 0.984 210 D CA 0.691 54.781 54.000 0.149 0.000 0.834 210 D CB -0.061 40.887 40.800 0.247 0.000 0.955 210 D HN 0.298 8.668 8.370 -0.000 0.000 0.465 211 L N -0.257 121.012 121.223 0.077 0.000 2.375 211 L HA 0.098 4.428 4.340 -0.016 0.000 0.215 211 L C 2.202 179.089 176.870 0.028 0.000 1.108 211 L CA 0.142 55.009 54.840 0.046 0.000 0.830 211 L CB 0.072 42.154 42.059 0.039 0.000 0.959 211 L HN -0.001 8.229 8.230 -0.000 0.000 0.457 212 L N -0.682 120.555 121.223 0.023 0.000 2.209 212 L HA -0.058 4.272 4.340 -0.016 0.000 0.207 212 L C 2.300 179.167 176.870 -0.005 0.000 1.094 212 L CA 0.818 55.659 54.840 0.001 0.000 0.790 212 L CB -0.225 41.826 42.059 -0.015 0.000 0.932 212 L HN 0.244 8.474 8.230 -0.000 0.000 0.447 213 E N 0.370 120.570 120.200 -0.001 0.000 2.106 213 E HA -0.179 4.161 4.350 -0.016 0.000 0.192 213 E C -0.690 175.907 176.600 -0.005 0.000 0.984 213 E CA 0.953 57.347 56.400 -0.011 0.000 0.806 213 E CB -0.656 29.038 29.700 -0.011 0.000 0.750 213 E HN 0.442 8.802 8.360 -0.000 0.000 0.458 214 P HA -0.102 4.318 4.420 -0.000 0.000 0.226 214 P C 0.766 178.068 177.300 0.003 0.000 1.153 214 P CA 0.962 64.064 63.100 0.003 0.000 0.777 214 P CB 0.103 31.808 31.700 0.009 0.000 0.794 215 L N -2.394 118.831 121.223 0.003 0.000 2.592 215 L HA 0.301 4.631 4.340 -0.016 0.000 0.227 215 L C 1.340 178.207 176.870 -0.005 0.000 1.127 215 L CA 0.482 55.324 54.840 0.004 0.000 0.884 215 L CB -0.701 41.363 42.059 0.008 0.000 1.065 215 L HN 0.104 8.334 8.230 -0.000 0.000 0.457 216 G N 0.191 108.984 108.800 -0.011 0.000 2.141 216 G HA2 -0.203 3.747 3.960 -0.016 0.000 0.242 216 G HA3 -0.203 3.747 3.960 -0.016 0.000 0.242 216 G C 0.150 175.034 174.900 -0.027 0.000 0.982 216 G CA 0.073 45.163 45.100 -0.018 0.000 0.662 216 G HN 0.505 8.795 8.290 -0.000 0.000 0.527 217 A N -0.621 122.180 122.820 -0.031 0.000 2.384 217 A HA 0.991 5.301 4.320 -0.016 0.000 0.312 217 A C 0.054 177.602 177.584 -0.061 0.000 1.113 217 A CA -0.063 51.947 52.037 -0.046 0.000 0.779 217 A CB 1.617 20.590 19.000 -0.045 0.000 1.307 217 A HN 1.027 9.177 8.150 -0.000 0.000 0.436 218 R N 1.441 121.889 120.500 -0.087 0.000 2.522 218 R HA 0.503 4.833 4.340 -0.016 0.000 0.273 218 R C -2.030 174.166 176.300 -0.175 0.000 1.133 218 R CA -0.503 55.522 56.100 -0.125 0.000 0.969 218 R CB 1.075 31.302 30.300 -0.121 0.000 1.235 218 R HN 0.721 8.991 8.270 -0.000 0.000 0.433 219 L N 2.897 123.975 121.223 -0.242 0.000 2.343 219 L HA 0.580 4.910 4.340 -0.016 0.000 0.275 219 L C 0.494 177.163 176.870 -0.334 0.000 1.056 219 L CA -0.887 53.736 54.840 -0.362 0.000 0.804 219 L CB 1.785 43.526 42.059 -0.529 0.000 1.203 219 L HN 0.754 8.984 8.230 -0.000 0.000 0.440 220 A N 3.599 126.332 122.820 -0.145 0.000 3.004 220 A HA 0.412 4.723 4.320 -0.016 0.000 0.286 220 A C -0.725 176.982 177.584 0.206 0.000 1.632 220 A CA -0.244 51.795 52.037 0.003 0.000 1.339 220 A CB -0.954 18.097 19.000 0.085 0.000 1.136 220 A HN 0.577 8.727 8.150 -0.000 0.000 0.577 221 Y N -1.145 119.198 120.300 0.071 0.000 2.602 221 Y HA 0.845 5.394 4.550 -0.002 0.000 0.342 221 Y C -0.128 175.734 175.900 -0.064 0.000 1.029 221 Y CA -1.592 56.548 58.100 0.068 0.000 1.080 221 Y CB 1.026 39.546 38.460 0.101 0.000 1.284 221 Y HN 0.106 8.386 8.280 -0.000 0.000 0.485 222 S N 0.828 116.586 115.700 0.097 0.000 2.536 222 S HA 0.731 5.191 4.470 -0.016 0.000 0.298 222 S C -1.296 173.134 174.600 -0.283 0.000 1.083 222 S CA -0.821 57.265 58.200 -0.190 0.000 0.995 222 S CB 1.870 64.879 63.200 -0.318 0.000 1.058 222 S HN 0.562 8.872 8.310 -0.000 0.000 0.488 223 V N 3.071 122.731 119.914 -0.424 0.000 2.448 223 V HA 0.480 4.590 4.120 -0.016 0.000 0.295 223 V C -1.559 174.250 176.094 -0.475 0.000 1.025 223 V CA -0.580 61.533 62.300 -0.311 0.000 0.859 223 V CB 0.662 32.396 31.823 -0.148 0.000 0.988 223 V HN 0.860 9.050 8.190 -0.000 0.000 0.431 224 Y N 1.812 122.138 120.300 0.043 0.000 2.350 224 Y HA 0.435 4.977 4.550 -0.013 0.000 0.338 224 Y C 0.334 176.277 175.900 0.072 0.000 0.961 224 Y CA -0.696 57.441 58.100 0.061 0.000 1.100 224 Y CB 1.835 40.344 38.460 0.083 0.000 1.179 224 Y HN 0.633 8.913 8.280 -0.000 0.000 0.454 225 E N 4.923 125.244 120.200 0.201 0.000 1.941 225 E HA 0.247 4.588 4.350 -0.016 0.000 0.275 225 E C -0.893 175.797 176.600 0.151 0.000 1.113 225 E CA -0.239 56.249 56.400 0.147 0.000 0.878 225 E CB 0.333 30.092 29.700 0.099 0.000 1.070 225 E HN 0.593 8.953 8.360 -0.000 0.000 0.399 226 M N 2.916 122.611 119.600 0.158 0.000 2.188 226 M HA 0.340 4.810 4.480 -0.016 0.000 0.357 226 M C 0.080 176.426 176.300 0.077 0.000 1.204 226 M CA -0.620 54.750 55.300 0.117 0.000 1.095 226 M CB 1.596 34.291 32.600 0.158 0.000 1.604 226 M HN 0.439 8.729 8.290 -0.000 0.000 0.464 227 A N 5.048 127.879 122.820 0.018 0.000 2.440 227 A HA 0.664 4.975 4.320 -0.016 0.000 0.251 227 A C -0.376 177.207 177.584 -0.001 0.000 1.089 227 A CA -0.188 51.851 52.037 0.004 0.000 0.779 227 A CB 0.073 19.057 19.000 -0.027 0.000 1.022 227 A HN 0.863 9.013 8.150 -0.000 0.000 0.492 228 I N 0.971 121.554 120.570 0.022 0.000 2.647 228 I HA 0.664 4.824 4.170 -0.016 0.000 0.295 228 I C 0.187 176.303 176.117 -0.001 0.000 1.078 228 I CA -0.409 60.909 61.300 0.030 0.000 1.048 228 I CB 2.318 40.392 38.000 0.124 0.000 1.239 228 I HN 0.751 8.961 8.210 -0.000 0.000 0.421 229 A N 3.649 126.465 122.820 -0.008 0.000 2.539 229 A HA 0.923 5.233 4.320 -0.016 0.000 0.296 229 A C -1.217 176.289 177.584 -0.130 0.000 1.073 229 A CA -0.652 51.314 52.037 -0.118 0.000 0.700 229 A CB 1.766 20.649 19.000 -0.196 0.000 1.296 229 A HN 0.794 8.944 8.150 -0.000 0.000 0.405 230 A N 0.717 123.374 122.820 -0.271 0.000 2.292 230 A HA 0.757 5.067 4.320 -0.016 0.000 0.319 230 A C -1.323 176.039 177.584 -0.370 0.000 1.206 230 A CA -0.203 51.729 52.037 -0.176 0.000 0.835 230 A CB 0.190 19.077 19.000 -0.188 0.000 1.164 230 A HN 0.786 8.936 8.150 -0.000 0.000 0.505 231 Y N 0.871 121.232 120.300 0.101 0.000 2.462 231 Y HA 0.468 5.008 4.550 -0.017 0.000 0.346 231 Y C 0.520 176.551 175.900 0.219 0.000 0.976 231 Y CA -0.707 57.467 58.100 0.123 0.000 1.044 231 Y CB 1.834 40.338 38.460 0.073 0.000 1.230 231 Y HN 0.704 8.984 8.280 -0.000 0.000 0.455 232 R N 1.319 122.033 120.500 0.356 0.000 2.442 232 R HA 0.165 4.496 4.340 -0.016 0.000 0.291 232 R C -0.515 175.843 176.300 0.096 0.000 1.069 232 R CA -0.698 55.535 56.100 0.222 0.000 1.022 232 R CB 0.426 30.820 30.300 0.155 0.000 0.976 232 R HN 0.519 8.789 8.270 -0.000 0.000 0.443 233 Q N 2.158 121.954 119.800 -0.006 0.000 2.286 233 Q HA 0.123 4.454 4.340 -0.016 0.000 0.267 233 Q C 0.165 176.137 176.000 -0.046 0.000 1.028 233 Q CA 0.284 56.074 55.803 -0.022 0.000 0.901 233 Q CB 1.423 30.136 28.738 -0.042 0.000 1.183 233 Q HN 0.777 9.047 8.270 -0.000 0.000 0.392 234 A N 3.432 126.228 122.820 -0.040 0.000 1.956 234 A HA 0.161 4.472 4.320 -0.016 0.000 0.212 234 A C 0.373 177.922 177.584 -0.058 0.000 1.188 234 A CA 0.756 52.766 52.037 -0.045 0.000 0.675 234 A CB 0.389 19.364 19.000 -0.041 0.000 0.845 234 A HN 0.639 8.789 8.150 -0.000 0.000 0.455 235 T N 2.442 116.955 114.554 -0.068 0.000 2.786 235 T HA 0.525 4.865 4.350 -0.016 0.000 0.283 235 T C -2.955 171.703 174.700 -0.072 0.000 0.992 235 T CA -1.230 60.827 62.100 -0.072 0.000 0.954 235 T CB 1.708 70.525 68.868 -0.085 0.000 0.934 235 T HN 0.032 8.272 8.240 -0.000 0.000 0.440 236 P HA 0.287 4.707 4.420 -0.000 0.000 0.268 236 P C -0.665 176.595 177.300 -0.068 0.000 1.205 236 P CA -0.380 62.680 63.100 -0.067 0.000 0.771 236 P CB 0.453 32.116 31.700 -0.063 0.000 0.858 237 V N -1.144 118.730 119.914 -0.066 0.000 3.078 237 V HA 0.566 4.676 4.120 -0.016 0.000 0.311 237 V C 1.196 177.257 176.094 -0.054 0.000 1.138 237 V CA -0.235 62.029 62.300 -0.060 0.000 1.007 237 V CB 1.199 32.995 31.823 -0.045 0.000 1.045 237 V HN 0.616 8.806 8.190 -0.000 0.000 0.432 238 T N -1.207 113.317 114.554 -0.051 0.000 2.937 238 T HA 0.219 4.560 4.350 -0.016 0.000 0.260 238 T C 0.426 175.125 174.700 -0.002 0.000 1.051 238 T CA 0.809 62.885 62.100 -0.041 0.000 1.141 238 T CB -0.195 68.642 68.868 -0.051 0.000 0.879 238 T HN 0.798 9.038 8.240 -0.000 0.000 0.459 239 E N 0.605 120.832 120.200 0.045 0.000 2.210 239 E HA 0.645 4.985 4.350 -0.016 0.000 0.266 239 E C -1.381 175.372 176.600 0.254 0.000 0.883 239 E CA -0.867 55.641 56.400 0.180 0.000 0.761 239 E CB 2.109 31.976 29.700 0.278 0.000 1.156 239 E HN 0.327 8.687 8.360 -0.000 0.000 0.412 240 A N 4.493 127.451 122.820 0.230 0.000 3.370 240 A HA 0.353 4.663 4.320 -0.016 0.000 0.295 240 A C -2.511 175.236 177.584 0.271 0.000 1.030 240 A CA -1.158 51.017 52.037 0.231 0.000 0.883 240 A CB 0.197 19.298 19.000 0.169 0.000 1.191 240 A HN 0.313 8.463 8.150 -0.000 0.000 0.507 241 P HA 0.258 4.678 4.420 -0.000 0.000 0.274 241 P C 0.084 177.570 177.300 0.311 0.000 1.256 241 P CA -0.415 62.846 63.100 0.269 0.000 0.795 241 P CB 0.534 32.327 31.700 0.156 0.000 1.038 242 F N 2.411 122.468 119.950 0.179 0.000 2.602 242 F HA 0.191 4.708 4.527 -0.017 0.000 0.367 242 F C 0.026 175.893 175.800 0.112 0.000 1.126 242 F CA 0.329 58.348 58.000 0.032 0.000 1.321 242 F CB 0.178 39.035 39.000 -0.238 0.000 1.094 242 F HN 0.331 8.631 8.300 -0.000 0.000 0.594 243 W N 6.229 126.920 121.300 -1.015 0.000 3.033 243 W HA 0.618 5.268 4.660 -0.016 0.000 0.336 243 W C -2.565 173.450 176.519 -0.840 0.000 1.173 243 W CA -1.805 55.202 57.345 -0.564 0.000 1.185 243 W CB 0.849 30.308 29.460 -0.002 0.000 1.425 243 W HN 0.616 8.796 8.180 -0.000 0.000 0.536 244 F N 2.180 121.964 119.950 -0.277 0.000 2.573 244 F HA 0.622 5.138 4.527 -0.018 0.000 0.316 244 F C -0.773 174.709 175.800 -0.530 0.000 1.148 244 F CA -0.659 57.054 58.000 -0.478 0.000 0.940 244 F CB 1.693 40.368 39.000 -0.541 0.000 1.214 244 F HN 0.588 8.888 8.300 -0.000 0.000 0.448 245 A N 6.446 128.856 122.820 -0.684 0.000 2.260 245 A HA 0.552 4.862 4.320 -0.016 0.000 0.312 245 A C -1.364 175.894 177.584 -0.545 0.000 1.321 245 A CA -0.299 51.251 52.037 -0.812 0.000 0.928 245 A CB -0.310 18.299 19.000 -0.652 0.000 1.158 245 A HN 0.657 8.807 8.150 -0.000 0.000 0.542 246 F N 1.984 121.655 119.950 -0.465 0.000 2.421 246 F HA 0.381 4.899 4.527 -0.016 0.000 0.358 246 F C 0.970 176.579 175.800 -0.317 0.000 1.115 246 F CA 0.586 58.407 58.000 -0.299 0.000 1.160 246 F CB 0.997 39.802 39.000 -0.324 0.000 1.123 246 F HN 0.577 8.877 8.300 -0.000 0.000 0.508 247 Q N 2.277 122.040 119.800 -0.061 0.000 2.456 247 Q HA 0.309 4.640 4.340 -0.016 0.000 0.284 247 Q C -1.064 174.944 176.000 0.014 0.000 1.061 247 Q CA -1.435 54.371 55.803 0.005 0.000 0.799 247 Q CB 2.392 31.182 28.738 0.086 0.000 1.445 247 Q HN 0.436 8.706 8.270 -0.000 0.000 0.411 248 Q N 2.028 121.861 119.800 0.054 0.000 2.395 248 Q HA 0.195 4.525 4.340 -0.016 0.000 0.271 248 Q C -2.067 173.933 176.000 -0.000 0.000 1.026 248 Q CA -1.113 54.709 55.803 0.031 0.000 0.900 248 Q CB -0.003 28.767 28.738 0.052 0.000 1.266 248 Q HN 0.362 8.632 8.270 -0.000 0.000 0.430 249 P HA 0.025 4.445 4.420 -0.000 0.000 0.273 249 P C -0.225 177.042 177.300 -0.055 0.000 1.250 249 P CA -0.080 62.973 63.100 -0.078 0.000 0.793 249 P CB 0.490 32.136 31.700 -0.089 0.000 1.011 250 T N -3.358 111.142 114.554 -0.091 0.000 2.923 250 T HA 0.419 4.760 4.350 -0.016 0.000 0.281 250 T C -1.852 172.803 174.700 -0.074 0.000 0.995 250 T CA -1.895 60.168 62.100 -0.061 0.000 0.985 250 T CB 0.244 69.079 68.868 -0.055 0.000 1.114 250 T HN 0.112 8.352 8.240 -0.000 0.000 0.548 251 P HA -0.030 4.390 4.420 -0.000 0.000 0.219 251 P C 1.439 178.700 177.300 -0.064 0.000 1.146 251 P CA 0.835 63.908 63.100 -0.044 0.000 0.808 251 P CB 0.141 31.828 31.700 -0.022 0.000 0.779 252 Q N -0.488 119.259 119.800 -0.087 0.000 2.373 252 Q HA 0.087 4.417 4.340 -0.016 0.000 0.210 252 Q C 0.283 176.161 176.000 -0.203 0.000 0.913 252 Q CA 0.958 56.697 55.803 -0.105 0.000 0.911 252 Q CB 0.064 28.759 28.738 -0.071 0.000 1.040 252 Q HN 0.469 8.739 8.270 -0.000 0.000 0.521 253 D N -3.475 116.732 120.400 -0.322 0.000 2.665 253 D HA 0.139 4.769 4.640 -0.016 0.000 0.287 253 D C 0.072 176.032 176.300 -0.566 0.000 1.266 253 D CA -0.406 53.225 54.000 -0.616 0.000 0.830 253 D CB 0.235 40.291 40.800 -1.240 0.000 1.356 253 D HN -0.258 8.112 8.370 -0.000 0.000 0.437 254 T N -0.839 113.316 114.554 -0.664 0.000 3.055 254 T HA 0.026 4.366 4.350 -0.016 0.000 0.265 254 T C 0.849 175.341 174.700 -0.346 0.000 1.111 254 T CA 0.785 62.666 62.100 -0.365 0.000 1.118 254 T CB -0.787 67.952 68.868 -0.214 0.000 0.909 254 T HN 0.725 8.965 8.240 -0.000 0.000 0.501 255 N N 0.486 118.877 118.700 -0.515 0.000 2.776 255 N HA -0.148 4.582 4.740 -0.016 0.000 0.249 255 N C -0.982 174.280 175.510 -0.413 0.000 1.111 255 N CA -0.074 52.787 53.050 -0.316 0.000 0.711 255 N CB -1.178 37.240 38.487 -0.115 0.000 1.065 255 N HN 0.392 8.772 8.380 -0.000 0.000 0.556 256 L N 0.844 121.709 121.223 -0.596 0.000 2.329 256 L HA 0.670 5.000 4.340 -0.016 0.000 0.279 256 L C -0.523 175.544 176.870 -1.338 0.000 1.014 256 L CA -0.652 53.715 54.840 -0.789 0.000 0.814 256 L CB 1.220 42.973 42.059 -0.510 0.000 1.257 256 L HN -0.051 8.179 8.230 -0.000 0.000 0.424 257 F N 1.543 120.927 119.950 -0.942 0.000 2.588 257 F HA 0.616 5.135 4.527 -0.014 0.000 0.310 257 F C -0.402 174.642 175.800 -1.261 0.000 1.082 257 F CA -0.782 56.618 58.000 -0.999 0.000 0.929 257 F CB 1.947 40.339 39.000 -1.013 0.000 1.254 257 F HN 0.356 8.656 8.300 -0.000 0.000 0.455 258 Y N -0.677 118.877 120.300 -1.243 0.000 2.655 258 Y HA 0.951 5.490 4.550 -0.017 0.000 0.336 258 Y C -0.911 173.771 175.900 -2.031 0.000 1.154 258 Y CA -2.013 54.994 58.100 -1.822 0.000 1.055 258 Y CB 1.775 39.418 38.460 -1.360 0.000 1.295 258 Y HN 0.764 9.044 8.280 -0.000 0.000 0.465 259 G N 0.486 107.820 108.800 -2.443 0.000 2.719 259 G HA2 0.437 4.387 3.960 -0.016 0.000 0.298 259 G HA3 0.437 4.387 3.960 -0.016 0.000 0.298 259 G C -1.157 173.207 174.900 -0.894 0.000 1.433 259 G CA -0.882 43.340 45.100 -1.463 0.000 1.034 259 G HN 0.759 9.049 8.290 -0.000 0.000 0.517 260 F N 1.787 121.655 119.950 -0.136 0.000 2.699 260 F HA 0.234 4.751 4.527 -0.017 0.000 0.298 260 F C 2.020 177.902 175.800 0.136 0.000 1.154 260 F CA 1.063 59.154 58.000 0.151 0.000 1.457 260 F CB 0.202 39.302 39.000 0.167 0.000 1.106 260 F HN 0.911 9.211 8.300 -0.000 0.000 0.585 261 G N -0.039 108.892 108.800 0.218 0.000 2.741 261 G HA2 -0.348 3.602 3.960 -0.016 0.000 0.222 261 G HA3 -0.348 3.602 3.960 -0.016 0.000 0.222 261 G C -0.582 174.434 174.900 0.193 0.000 1.364 261 G CA -0.459 44.791 45.100 0.250 0.000 0.866 261 G HN 0.475 8.765 8.290 -0.000 0.000 0.555 262 H N 0.827 119.954 119.070 0.095 0.000 3.064 262 H HA 0.319 4.865 4.556 -0.016 0.000 0.329 262 H C 0.753 176.010 175.328 -0.119 0.000 1.020 262 H CA 0.887 56.934 56.048 -0.002 0.000 1.402 262 H CB 0.490 30.260 29.762 0.013 0.000 1.379 262 H HN 0.662 8.942 8.280 -0.000 0.000 0.594 263 N N 5.758 123.915 118.700 -0.906 0.000 2.485 263 N HA 0.151 4.881 4.740 -0.016 0.000 0.243 263 N C -2.222 172.493 175.510 -1.325 0.000 0.987 263 N CA -2.001 50.393 53.050 -1.093 0.000 0.940 263 N CB 1.410 39.368 38.487 -0.881 0.000 1.122 263 N HN 0.487 8.867 8.380 -0.000 0.000 0.509 264 P HA 0.124 4.544 4.420 -0.000 0.000 0.245 264 P C 0.433 177.551 177.300 -0.304 0.000 1.206 264 P CA 0.405 63.186 63.100 -0.532 0.000 0.781 264 P CB -0.143 31.392 31.700 -0.274 0.000 0.994 265 W N -1.496 119.645 121.300 -0.266 0.000 2.975 265 W HA 0.663 5.312 4.660 -0.017 0.000 0.316 265 W C 0.023 176.485 176.519 -0.094 0.000 1.131 265 W CA -0.251 57.006 57.345 -0.147 0.000 1.624 265 W CB -0.539 28.840 29.460 -0.135 0.000 1.038 265 W HN -0.210 7.970 8.180 -0.000 0.000 0.571 266 A N 2.390 124.952 122.820 -0.431 0.000 2.295 266 A HA 0.735 5.045 4.320 -0.016 0.000 0.318 266 A C -2.107 175.425 177.584 -0.087 0.000 1.134 266 A CA -1.475 50.444 52.037 -0.197 0.000 0.827 266 A CB -0.104 18.721 19.000 -0.291 0.000 1.136 266 A HN 0.018 8.168 8.150 -0.000 0.000 0.493 267 P HA 0.476 4.896 4.420 -0.000 0.000 0.272 267 P C 0.696 178.018 177.300 0.037 0.000 1.230 267 P CA 1.240 64.356 63.100 0.028 0.000 0.788 267 P CB 0.388 32.126 31.700 0.064 0.000 0.949 268 G N 0.849 109.629 108.800 -0.033 0.000 2.645 268 G HA2 -0.152 3.798 3.960 -0.016 0.000 0.239 268 G HA3 -0.152 3.798 3.960 -0.016 0.000 0.239 268 G C -0.728 173.991 174.900 -0.302 0.000 1.331 268 G CA -0.342 44.636 45.100 -0.203 0.000 0.890 268 G HN 0.639 8.929 8.290 -0.000 0.000 0.572 269 E N 0.086 119.903 120.200 -0.640 0.000 3.386 269 E HA 0.527 4.867 4.350 -0.016 0.000 0.236 269 E C -1.038 175.246 176.600 -0.527 0.000 1.227 269 E CA -0.290 55.864 56.400 -0.410 0.000 0.970 269 E CB -0.057 29.500 29.700 -0.237 0.000 1.343 269 E HN 0.343 8.703 8.360 -0.000 0.000 0.397 270 F N 0.689 120.625 119.950 -0.024 0.000 2.480 270 F HA 0.545 5.062 4.527 -0.016 0.000 0.329 270 F C 0.507 176.305 175.800 -0.002 0.000 1.091 270 F CA -1.234 56.763 58.000 -0.006 0.000 0.972 270 F CB 1.718 40.700 39.000 -0.030 0.000 1.150 270 F HN -0.059 8.241 8.300 -0.000 0.000 0.467 271 V N 0.291 120.358 119.914 0.255 0.000 2.823 271 V HA 0.680 4.790 4.120 -0.016 0.000 0.312 271 V C -0.695 175.539 176.094 0.233 0.000 1.072 271 V CA -1.049 61.368 62.300 0.196 0.000 0.937 271 V CB 1.938 33.872 31.823 0.185 0.000 1.013 271 V HN 0.717 8.907 8.190 -0.000 0.000 0.430 272 R N 1.726 122.352 120.500 0.210 0.000 2.407 272 R HA 0.757 5.088 4.340 -0.016 0.000 0.303 272 R C -1.153 175.194 176.300 0.079 0.000 0.981 272 R CA -0.147 56.081 56.100 0.213 0.000 0.905 272 R CB 1.440 31.926 30.300 0.310 0.000 1.099 272 R HN 0.991 9.261 8.270 -0.000 0.000 0.459 273 C N 0.373 119.665 119.300 -0.013 0.000 3.080 273 C HA 0.912 5.362 4.460 -0.016 0.000 0.307 273 C C 0.365 175.028 174.990 -0.546 0.000 1.311 273 C CA -0.735 58.036 59.018 -0.411 0.000 1.533 273 C CB 2.170 29.783 27.740 -0.212 0.000 1.970 273 C HN 0.936 9.166 8.230 -0.000 0.000 0.467 274 G N 0.844 108.946 108.800 -1.164 0.000 2.646 274 G HA2 0.762 4.712 3.960 -0.016 0.000 0.291 274 G HA3 0.762 4.712 3.960 -0.016 0.000 0.291 274 G C -3.519 170.871 174.900 -0.849 0.000 1.445 274 G CA -0.764 43.819 45.100 -0.862 0.000 0.814 274 G HN 0.464 8.754 8.290 -0.000 0.000 0.495 275 P HA 0.331 4.751 4.420 -0.000 0.000 0.284 275 P C -1.252 175.699 177.300 -0.581 0.000 1.258 275 P CA -0.329 62.239 63.100 -0.887 0.000 0.824 275 P CB 2.011 32.779 31.700 -1.555 0.000 1.038 276 D N 2.379 122.477 120.400 -0.504 0.000 2.458 276 D HA 0.282 4.912 4.640 -0.016 0.000 0.258 276 D C -1.331 174.982 176.300 0.021 0.000 1.134 276 D CA -0.409 53.503 54.000 -0.146 0.000 0.915 276 D CB -0.725 40.023 40.800 -0.087 0.000 1.028 276 D HN 0.203 8.573 8.370 -0.000 0.000 0.508 277 F N 1.406 121.221 119.950 -0.225 0.000 2.449 277 F HA 0.277 4.793 4.527 -0.018 0.000 0.342 277 F C 0.898 176.458 175.800 -0.399 0.000 1.127 277 F CA -1.013 56.827 58.000 -0.266 0.000 0.975 277 F CB 1.740 40.622 39.000 -0.197 0.000 1.146 277 F HN 0.042 8.342 8.300 -0.000 0.000 0.444 278 E N 3.839 123.851 120.200 -0.314 0.000 2.110 278 E HA 0.176 4.517 4.350 -0.016 0.000 0.300 278 E C -0.588 175.854 176.600 -0.263 0.000 1.278 278 E CA -0.299 55.663 56.400 -0.731 0.000 1.365 278 E CB 0.519 29.961 29.700 -0.430 0.000 1.283 278 E HN 0.392 8.752 8.360 -0.000 0.000 0.490 279 V N -2.472 117.396 119.914 -0.077 0.000 3.040 279 V HA 0.377 4.487 4.120 -0.016 0.000 0.312 279 V C -0.533 175.724 176.094 0.271 0.000 1.115 279 V CA -1.226 61.146 62.300 0.120 0.000 0.998 279 V CB 2.014 33.866 31.823 0.049 0.000 1.042 279 V HN 0.258 8.448 8.190 -0.000 0.000 0.433 280 D N 0.655 121.171 120.400 0.193 0.000 2.737 280 D HA -0.103 4.527 4.640 -0.016 0.000 0.238 280 D C -2.108 174.296 176.300 0.172 0.000 1.157 280 D CA 1.087 55.180 54.000 0.155 0.000 0.694 280 D CB -1.242 39.637 40.800 0.132 0.000 1.021 280 D HN 0.829 9.199 8.370 -0.000 0.000 0.420 281 P HA 0.031 4.451 4.420 -0.000 0.000 0.268 281 P C 0.683 177.934 177.300 -0.081 0.000 1.205 281 P CA -0.242 62.789 63.100 -0.115 0.000 0.771 281 P CB 0.830 32.406 31.700 -0.206 0.000 0.858 282 L N 2.880 124.034 121.223 -0.116 0.000 2.380 282 L HA 0.078 4.408 4.340 -0.016 0.000 0.273 282 L C 1.623 178.451 176.870 -0.070 0.000 1.138 282 L CA -0.285 54.517 54.840 -0.064 0.000 0.832 282 L CB 0.105 42.123 42.059 -0.068 0.000 1.124 282 L HN 0.310 8.540 8.230 -0.000 0.000 0.454 283 D N -0.066 120.321 120.400 -0.021 0.000 2.144 283 D HA -0.119 4.511 4.640 -0.016 0.000 0.199 283 D C 0.540 176.865 176.300 0.041 0.000 0.984 283 D CA 1.653 55.651 54.000 -0.002 0.000 0.834 283 D CB 0.161 40.975 40.800 0.023 0.000 0.955 283 D HN 0.440 8.810 8.370 -0.000 0.000 0.465 284 H N -1.900 117.129 119.070 -0.068 0.000 3.046 284 H HA 0.115 4.657 4.556 -0.022 0.000 0.363 284 H C -2.206 173.060 175.328 -0.103 0.000 1.203 284 H CA -1.272 54.729 56.048 -0.080 0.000 1.169 284 H CB 2.671 32.412 29.762 -0.035 0.000 1.851 284 H HN -0.304 7.976 8.280 -0.000 0.000 0.546 285 P HA -0.134 4.286 4.420 -0.000 0.000 0.225 285 P C 1.312 178.541 177.300 -0.118 0.000 1.148 285 P CA 1.386 64.212 63.100 -0.456 0.000 0.779 285 P CB 0.065 31.213 31.700 -0.919 0.000 0.780 286 S N -0.323 115.438 115.700 0.102 0.000 2.469 286 S HA -0.050 4.410 4.470 -0.016 0.000 0.238 286 S C 1.946 176.638 174.600 0.155 0.000 0.998 286 S CA 0.920 59.275 58.200 0.259 0.000 0.957 286 S CB -1.147 62.303 63.200 0.416 0.000 0.764 286 S HN 0.142 8.452 8.310 -0.000 0.000 0.514 287 A N 1.263 124.152 122.820 0.114 0.000 2.167 287 A HA 0.646 4.956 4.320 -0.016 0.000 0.214 287 A C 1.272 178.889 177.584 0.055 0.000 1.151 287 A CA 0.403 52.485 52.037 0.074 0.000 0.735 287 A CB -0.981 18.055 19.000 0.060 0.000 0.802 287 A HN 0.851 9.001 8.150 -0.000 0.000 0.467 288 A N 0.066 122.915 122.820 0.048 0.000 2.531 288 A HA 0.359 4.669 4.320 -0.016 0.000 0.236 288 A C 1.471 179.087 177.584 0.052 0.000 1.062 288 A CA 0.732 52.798 52.037 0.048 0.000 0.760 288 A CB 0.009 19.038 19.000 0.048 0.000 0.995 288 A HN 0.758 8.908 8.150 -0.000 0.000 0.501 289 T N -0.833 113.749 114.554 0.048 0.000 3.037 289 T HA 0.389 4.729 4.350 -0.016 0.000 0.252 289 T C 1.464 176.186 174.700 0.035 0.000 1.073 289 T CA 1.047 63.172 62.100 0.041 0.000 1.091 289 T CB -0.116 68.775 68.868 0.039 0.000 0.935 289 T HN 2.398 10.638 8.240 -0.000 0.000 0.488 290 G N 0.963 109.787 108.800 0.039 0.000 2.155 290 G HA2 -0.213 3.737 3.960 -0.016 0.000 0.257 290 G HA3 -0.213 3.737 3.960 -0.016 0.000 0.257 290 G C 0.026 174.941 174.900 0.025 0.000 0.983 290 G CA 0.212 45.331 45.100 0.032 0.000 0.676 290 G HN 0.811 9.101 8.290 -0.000 0.000 0.528 291 V N 0.642 120.572 119.914 0.026 0.000 2.444 291 V HA 0.773 4.883 4.120 -0.016 0.000 0.294 291 V C 0.806 176.916 176.094 0.026 0.000 1.022 291 V CA -0.744 61.568 62.300 0.021 0.000 0.850 291 V CB 1.386 33.220 31.823 0.019 0.000 0.992 291 V HN 1.188 9.378 8.190 -0.000 0.000 0.426 292 A N 3.239 126.071 122.820 0.019 0.000 2.567 292 A HA 0.143 4.453 4.320 -0.016 0.000 0.240 292 A C 0.329 177.930 177.584 0.029 0.000 1.053 292 A CA 0.173 52.223 52.037 0.022 0.000 0.755 292 A CB -0.248 18.755 19.000 0.006 0.000 0.978 292 A HN 1.009 9.159 8.150 -0.000 0.000 0.507 293 D N 1.436 121.860 120.400 0.041 0.000 2.493 293 D HA 0.058 4.688 4.640 -0.016 0.000 0.240 293 D C 1.415 177.747 176.300 0.053 0.000 1.142 293 D CA 0.099 54.131 54.000 0.053 0.000 0.872 293 D CB 0.599 41.442 40.800 0.072 0.000 1.173 293 D HN 0.472 8.842 8.370 -0.000 0.000 0.467 294 R N 3.128 123.661 120.500 0.054 0.000 2.081 294 R HA -0.132 4.199 4.340 -0.016 0.000 0.235 294 R C 2.092 178.437 176.300 0.075 0.000 1.131 294 R CA 1.044 57.176 56.100 0.055 0.000 0.960 294 R CB -0.273 30.055 30.300 0.047 0.000 0.856 294 R HN 0.570 8.840 8.270 -0.000 0.000 0.436 295 R N 1.042 121.597 120.500 0.091 0.000 2.081 295 R HA -0.140 4.190 4.340 -0.016 0.000 0.235 295 R C 2.233 178.633 176.300 0.166 0.000 1.131 295 R CA 1.531 57.705 56.100 0.123 0.000 0.960 295 R CB -0.017 30.359 30.300 0.127 0.000 0.856 295 R HN 0.292 8.562 8.270 -0.000 0.000 0.436 296 Q N -0.574 119.315 119.800 0.148 0.000 2.096 296 Q HA -0.183 4.147 4.340 -0.016 0.000 0.204 296 Q C 2.117 178.154 176.000 0.063 0.000 0.982 296 Q CA 1.581 57.441 55.803 0.094 0.000 0.850 296 Q CB -0.027 28.704 28.738 -0.013 0.000 0.901 296 Q HN 0.327 8.597 8.270 -0.000 0.000 0.422 297 M N 0.530 120.168 119.600 0.063 0.000 2.175 297 M HA -0.131 4.339 4.480 -0.016 0.000 0.264 297 M C 1.344 177.704 176.300 0.100 0.000 1.063 297 M CA 1.275 56.617 55.300 0.070 0.000 1.119 297 M CB -0.738 31.892 32.600 0.050 0.000 1.377 297 M HN 0.114 8.404 8.290 -0.000 0.000 0.415 298 D N -0.211 120.252 120.400 0.104 0.000 2.117 298 D HA -0.115 4.515 4.640 -0.016 0.000 0.197 298 D C 2.225 178.608 176.300 0.137 0.000 0.987 298 D CA 0.877 54.940 54.000 0.105 0.000 0.829 298 D CB -0.119 40.739 40.800 0.096 0.000 0.961 298 D HN 0.197 8.567 8.370 -0.000 0.000 0.460 299 R N 0.221 120.843 120.500 0.203 0.000 2.066 299 R HA -0.083 4.247 4.340 -0.016 0.000 0.232 299 R C 2.315 178.756 176.300 0.235 0.000 1.131 299 R CA 0.393 56.677 56.100 0.307 0.000 0.955 299 R CB -1.039 29.586 30.300 0.541 0.000 0.851 299 R HN 0.233 8.503 8.270 -0.000 0.000 0.432 300 L N 0.935 122.278 121.223 0.200 0.000 1.994 300 L HA -0.101 4.230 4.340 -0.016 0.000 0.208 300 L C 2.104 178.985 176.870 0.019 0.000 1.071 300 L CA 1.903 56.793 54.840 0.083 0.000 0.745 300 L CB -0.738 41.371 42.059 0.083 0.000 0.892 300 L HN 0.008 8.238 8.230 -0.000 0.000 0.431 301 S N -0.190 115.564 115.700 0.090 0.000 2.402 301 S HA -0.074 4.386 4.470 -0.016 0.000 0.229 301 S C 1.857 176.458 174.600 0.002 0.000 1.021 301 S CA 0.959 59.202 58.200 0.072 0.000 0.974 301 S CB -0.890 62.407 63.200 0.161 0.000 0.800 301 S HN 0.719 9.029 8.310 -0.000 0.000 0.484 302 G N -0.377 108.437 108.800 0.023 0.000 2.408 302 G HA2 -0.218 3.732 3.960 -0.016 0.000 0.217 302 G HA3 -0.218 3.732 3.960 -0.016 0.000 0.217 302 G C 1.116 175.980 174.900 -0.060 0.000 1.150 302 G CA 0.469 45.562 45.100 -0.012 0.000 0.776 302 G HN 0.595 8.885 8.290 -0.000 0.000 0.542 303 W N 1.084 122.230 121.300 -0.257 0.000 2.381 303 W HA 0.073 4.724 4.660 -0.015 0.000 0.301 303 W C 2.346 178.716 176.519 -0.247 0.000 1.205 303 W CA 0.966 58.125 57.345 -0.311 0.000 1.285 303 W CB -0.154 28.788 29.460 -0.864 0.000 1.133 303 W HN 0.104 8.284 8.180 -0.000 0.000 0.521 304 L N 0.349 121.566 121.223 -0.009 0.000 2.046 304 L HA -0.228 4.103 4.340 -0.016 0.000 0.208 304 L C 2.733 179.435 176.870 -0.280 0.000 1.077 304 L CA 1.769 56.526 54.840 -0.138 0.000 0.747 304 L CB -1.019 40.898 42.059 -0.236 0.000 0.896 304 L HN -0.003 8.227 8.230 -0.000 0.000 0.432 305 R N 0.216 120.572 120.500 -0.240 0.000 2.091 305 R HA -0.202 4.128 4.340 -0.016 0.000 0.238 305 R C 1.780 177.879 176.300 -0.334 0.000 1.136 305 R CA 2.119 58.081 56.100 -0.230 0.000 0.959 305 R CB -0.132 30.073 30.300 -0.157 0.000 0.856 305 R HN 0.367 8.637 8.270 -0.000 0.000 0.437 306 D N -1.119 118.976 120.400 -0.508 0.000 2.162 306 D HA -0.072 4.558 4.640 -0.016 0.000 0.205 306 D C 1.478 177.278 176.300 -0.834 0.000 0.964 306 D CA 1.070 54.632 54.000 -0.729 0.000 0.847 306 D CB -0.007 40.178 40.800 -1.026 0.000 0.988 306 D HN 0.424 8.794 8.370 -0.000 0.000 0.480 307 H N -0.973 117.703 119.070 -0.656 0.000 2.740 307 H HA 0.243 4.789 4.556 -0.017 0.000 0.265 307 H C 0.166 175.184 175.328 -0.517 0.000 0.978 307 H CA -0.034 55.575 56.048 -0.731 0.000 1.198 307 H CB 1.460 30.294 29.762 -1.546 0.000 1.467 307 H HN -0.018 8.262 8.280 -0.000 0.000 0.511 308 L N 2.936 123.914 121.223 -0.408 0.000 2.502 308 L HA 0.329 4.659 4.340 -0.016 0.000 0.249 308 L C -2.300 174.364 176.870 -0.344 0.000 1.446 308 L CA -1.567 52.997 54.840 -0.460 0.000 0.887 308 L CB 1.377 43.118 42.059 -0.530 0.000 1.126 308 L HN -0.230 8.000 8.230 -0.000 0.000 0.509 309 P HA 0.006 4.426 4.420 -0.000 0.000 0.242 309 P C 1.150 178.339 177.300 -0.185 0.000 1.197 309 P CA 0.677 63.646 63.100 -0.218 0.000 0.765 309 P CB -0.205 31.378 31.700 -0.195 0.000 0.936 310 T N -2.843 111.581 114.554 -0.217 0.000 3.035 310 T HA 0.023 4.363 4.350 -0.016 0.000 0.268 310 T C 0.930 175.558 174.700 -0.120 0.000 1.109 310 T CA 0.257 62.257 62.100 -0.167 0.000 1.119 310 T CB -1.041 67.710 68.868 -0.194 0.000 0.900 310 T HN 0.058 8.298 8.240 -0.000 0.000 0.503 311 V N -1.004 118.835 119.914 -0.125 0.000 2.732 311 V HA 0.578 4.688 4.120 -0.016 0.000 0.310 311 V C -0.578 175.494 176.094 -0.036 0.000 1.053 311 V CA -1.474 60.794 62.300 -0.053 0.000 0.957 311 V CB 1.685 33.481 31.823 -0.045 0.000 1.018 311 V HN 0.112 8.302 8.190 -0.000 0.000 0.452 312 D N 4.896 125.322 120.400 0.044 0.000 2.339 312 D HA 0.292 4.923 4.640 -0.016 0.000 0.256 312 D C -1.581 174.814 176.300 0.159 0.000 1.214 312 D CA -2.042 51.999 54.000 0.068 0.000 0.877 312 D CB 1.824 42.673 40.800 0.081 0.000 1.111 312 D HN 0.572 8.942 8.370 -0.000 0.000 0.478 313 P HA 0.049 4.469 4.420 -0.000 0.000 0.255 313 P C -0.239 177.219 177.300 0.263 0.000 1.301 313 P CA -0.118 63.059 63.100 0.128 0.000 0.817 313 P CB 0.290 31.973 31.700 -0.029 0.000 1.259 314 D N 2.514 123.031 120.400 0.195 0.000 2.411 314 D HA 0.196 4.826 4.640 -0.016 0.000 0.225 314 D C -2.077 174.250 176.300 0.047 0.000 1.156 314 D CA -2.679 51.390 54.000 0.115 0.000 0.874 314 D CB 0.720 41.553 40.800 0.055 0.000 1.034 314 D HN 0.122 8.492 8.370 -0.000 0.000 0.502 315 P HA -0.038 4.382 4.420 -0.000 0.000 0.269 315 P C 1.029 178.181 177.300 -0.247 0.000 1.209 315 P CA -0.317 62.507 63.100 -0.459 0.000 0.776 315 P CB 1.271 32.608 31.700 -0.605 0.000 0.876 316 V N 0.260 120.019 119.914 -0.258 0.000 3.235 316 V HA 0.243 4.353 4.120 -0.016 0.000 0.259 316 V C 0.940 176.901 176.094 -0.222 0.000 1.133 316 V CA 0.795 62.982 62.300 -0.188 0.000 1.128 316 V CB -0.778 30.939 31.823 -0.178 0.000 0.757 316 V HN 0.563 8.753 8.190 -0.000 0.000 0.469 317 R N 0.104 120.451 120.500 -0.254 0.000 2.663 317 R HA 0.566 4.896 4.340 -0.016 0.000 0.267 317 R C -1.197 174.990 176.300 -0.188 0.000 1.038 317 R CA 0.324 56.306 56.100 -0.198 0.000 0.886 317 R CB 2.146 32.328 30.300 -0.197 0.000 1.249 317 R HN 0.439 8.709 8.270 -0.000 0.000 0.463 318 T N -0.772 113.707 114.554 -0.125 0.000 2.906 318 T HA 0.778 5.118 4.350 -0.016 0.000 0.295 318 T C -0.601 174.070 174.700 -0.049 0.000 1.075 318 T CA -0.389 61.656 62.100 -0.091 0.000 1.005 318 T CB 1.777 70.602 68.868 -0.072 0.000 1.136 318 T HN 0.735 8.975 8.240 -0.000 0.000 0.498 319 S N 0.144 115.832 115.700 -0.020 0.000 2.727 319 S HA 0.883 5.344 4.470 -0.016 0.000 0.278 319 S C -0.616 174.002 174.600 0.029 0.000 1.186 319 S CA -0.405 57.799 58.200 0.007 0.000 0.836 319 S CB 1.254 64.463 63.200 0.014 0.000 1.186 319 S HN 1.582 9.892 8.310 -0.000 0.000 0.499 320 T N -2.149 112.434 114.554 0.048 0.000 2.901 320 T HA 0.802 5.142 4.350 -0.016 0.000 0.293 320 T C -0.739 174.018 174.700 0.096 0.000 1.084 320 T CA -0.796 61.346 62.100 0.070 0.000 1.008 320 T CB 1.143 70.050 68.868 0.065 0.000 1.170 320 T HN 1.530 9.770 8.240 -0.000 0.000 0.509 321 C N 2.241 121.616 119.300 0.125 0.000 2.880 321 C HA 0.652 5.102 4.460 -0.016 0.000 0.320 321 C C -1.176 173.917 174.990 0.172 0.000 1.176 321 C CA -0.938 58.173 59.018 0.155 0.000 1.390 321 C CB 0.201 28.055 27.740 0.191 0.000 1.846 321 C HN 1.035 9.265 8.230 -0.000 0.000 0.478 322 L N 5.282 126.604 121.223 0.165 0.000 2.283 322 L HA 0.532 4.862 4.340 -0.016 0.000 0.287 322 L C 0.858 177.842 176.870 0.190 0.000 1.073 322 L CA -0.013 54.916 54.840 0.149 0.000 0.822 322 L CB 0.856 42.968 42.059 0.088 0.000 1.186 322 L HN 0.885 9.115 8.230 -0.000 0.000 0.436 323 A N 4.463 127.423 122.820 0.234 0.000 2.331 323 A HA 0.644 4.955 4.320 -0.016 0.000 0.283 323 A C -0.292 177.351 177.584 0.098 0.000 1.142 323 A CA -0.375 51.805 52.037 0.239 0.000 0.812 323 A CB 0.921 20.132 19.000 0.353 0.000 1.074 323 A HN 0.449 8.599 8.150 -0.000 0.000 0.497 324 V N 4.255 124.157 119.914 -0.020 0.000 2.409 324 V HA 0.438 4.548 4.120 -0.016 0.000 0.290 324 V C -0.387 175.610 176.094 -0.162 0.000 1.017 324 V CA -0.091 62.149 62.300 -0.100 0.000 0.841 324 V CB 0.677 32.377 31.823 -0.204 0.000 1.003 324 V HN 0.767 8.957 8.190 -0.000 0.000 0.426 325 L N 5.974 127.150 121.223 -0.079 0.000 2.370 325 L HA 0.609 4.939 4.340 -0.016 0.000 0.266 325 L C -2.633 174.235 176.870 -0.003 0.000 1.002 325 L CA -2.144 52.599 54.840 -0.162 0.000 0.818 325 L CB 3.221 45.184 42.059 -0.162 0.000 1.325 325 L HN 0.356 8.586 8.230 -0.000 0.000 0.418 326 P HA 0.045 4.465 4.420 -0.000 0.000 0.266 326 P C 0.329 177.642 177.300 0.022 0.000 1.195 326 P CA 0.052 63.125 63.100 -0.044 0.000 0.768 326 P CB 0.657 32.174 31.700 -0.304 0.000 0.838 327 T N -0.222 114.382 114.554 0.082 0.000 2.821 327 T HA -0.113 4.227 4.350 -0.016 0.000 0.267 327 T C 0.627 175.346 174.700 0.030 0.000 1.046 327 T CA 1.275 63.411 62.100 0.060 0.000 1.139 327 T CB -0.563 68.334 68.868 0.049 0.000 0.871 327 T HN 0.503 8.743 8.240 -0.000 0.000 0.454 328 D N 2.303 122.712 120.400 0.016 0.000 2.339 328 D HA 0.074 4.704 4.640 -0.016 0.000 0.256 328 D C -1.461 174.822 176.300 -0.028 0.000 1.214 328 D CA -2.405 51.593 54.000 -0.002 0.000 0.877 328 D CB 1.370 42.171 40.800 0.001 0.000 1.111 328 D HN 0.092 8.462 8.370 -0.000 0.000 0.478 329 P HA -0.092 4.327 4.420 -0.000 0.000 0.234 329 P C 0.788 178.076 177.300 -0.021 0.000 1.167 329 P CA 0.500 63.585 63.100 -0.024 0.000 0.763 329 P CB 0.439 32.134 31.700 -0.008 0.000 0.835 330 E N 0.187 120.377 120.200 -0.017 0.000 2.427 330 E HA -0.050 4.290 4.350 -0.016 0.000 0.196 330 E C 1.005 177.589 176.600 -0.027 0.000 1.028 330 E CA 0.070 56.466 56.400 -0.007 0.000 0.864 330 E CB -0.118 29.583 29.700 0.003 0.000 0.813 330 E HN 0.082 8.442 8.360 -0.000 0.000 0.514 331 R N -0.177 120.276 120.500 -0.078 0.000 2.460 331 R HA 0.193 4.523 4.340 -0.016 0.000 0.303 331 R C 0.026 176.201 176.300 -0.208 0.000 0.968 331 R CA -0.282 55.730 56.100 -0.148 0.000 0.889 331 R CB 0.867 31.015 30.300 -0.254 0.000 1.123 331 R HN -0.054 8.216 8.270 -0.000 0.000 0.455 332 Q N 2.073 121.742 119.800 -0.218 0.000 2.423 332 Q HA 0.309 4.639 4.340 -0.016 0.000 0.231 332 Q C -0.826 174.712 176.000 -0.769 0.000 0.894 332 Q CA 0.833 56.386 55.803 -0.417 0.000 0.938 332 Q CB 0.724 29.319 28.738 -0.239 0.000 1.079 332 Q HN 0.461 8.731 8.270 -0.000 0.000 0.552 333 F N -1.167 118.709 119.950 -0.124 0.000 2.613 333 F HA 0.494 5.012 4.527 -0.015 0.000 0.310 333 F C -1.037 174.608 175.800 -0.258 0.000 1.085 333 F CA -1.164 56.794 58.000 -0.069 0.000 0.945 333 F CB 1.642 40.704 39.000 0.103 0.000 1.298 333 F HN -0.243 8.057 8.300 -0.000 0.000 0.455 334 F N 3.431 123.479 119.950 0.165 0.000 2.361 334 F HA 0.649 5.165 4.527 -0.019 0.000 0.364 334 F C -0.760 175.055 175.800 0.024 0.000 1.117 334 F CA -0.815 57.207 58.000 0.037 0.000 1.071 334 F CB 1.591 40.564 39.000 -0.045 0.000 1.188 334 F HN 0.168 8.468 8.300 -0.000 0.000 0.464 335 L N 3.760 125.060 121.223 0.129 0.000 2.580 335 L HA 0.902 5.232 4.340 -0.016 0.000 0.266 335 L C -0.568 176.276 176.870 -0.045 0.000 0.955 335 L CA 0.095 54.919 54.840 -0.026 0.000 0.886 335 L CB 1.576 43.429 42.059 -0.343 0.000 1.263 335 L HN 0.678 8.908 8.230 -0.000 0.000 0.406 336 G N 1.527 110.310 108.800 -0.028 0.000 2.333 336 G HA2 0.412 4.362 3.960 -0.016 0.000 0.288 336 G HA3 0.412 4.362 3.960 -0.016 0.000 0.288 336 G C -0.881 174.010 174.900 -0.015 0.000 1.286 336 G CA 0.015 45.100 45.100 -0.024 0.000 0.865 336 G HN 0.807 9.097 8.290 -0.000 0.000 0.506 337 T N -2.081 112.465 114.554 -0.012 0.000 2.897 337 T HA 0.653 4.993 4.350 -0.016 0.000 0.278 337 T C 1.167 175.861 174.700 -0.009 0.000 0.981 337 T CA 0.738 62.832 62.100 -0.011 0.000 0.973 337 T CB 1.706 70.568 68.868 -0.010 0.000 1.092 337 T HN 1.874 10.114 8.240 -0.000 0.000 0.543 338 A N -0.142 122.672 122.820 -0.011 0.000 2.370 338 A HA 0.259 4.569 4.320 -0.016 0.000 0.238 338 A C 2.153 179.729 177.584 -0.013 0.000 1.289 338 A CA 0.003 52.031 52.037 -0.015 0.000 0.885 338 A CB -0.871 18.120 19.000 -0.015 0.000 0.961 338 A HN 0.949 9.099 8.150 -0.000 0.000 0.499 339 R N 0.353 120.846 120.500 -0.011 0.000 2.119 339 R HA -0.196 4.135 4.340 -0.016 0.000 0.246 339 R C 0.481 176.768 176.300 -0.022 0.000 1.146 339 R CA 2.166 58.257 56.100 -0.015 0.000 0.962 339 R CB -0.114 30.179 30.300 -0.012 0.000 0.863 339 R HN 0.357 8.627 8.270 -0.000 0.000 0.442 340 D N -0.238 120.152 120.400 -0.017 0.000 2.349 340 D HA 0.010 4.640 4.640 -0.016 0.000 0.224 340 D C 1.387 177.674 176.300 -0.022 0.000 1.029 340 D CA 0.520 54.510 54.000 -0.017 0.000 0.879 340 D CB 0.347 41.143 40.800 -0.006 0.000 0.906 340 D HN 0.353 8.723 8.370 -0.000 0.000 0.528 341 L N -0.733 120.474 121.223 -0.026 0.000 2.515 341 L HA 0.284 4.614 4.340 -0.016 0.000 0.223 341 L C 0.871 177.722 176.870 -0.031 0.000 1.079 341 L CA 0.236 55.057 54.840 -0.031 0.000 0.857 341 L CB 0.042 42.078 42.059 -0.038 0.000 1.050 341 L HN -0.022 8.208 8.230 -0.000 0.000 0.476 342 M N -3.003 116.578 119.600 -0.032 0.000 2.694 342 M HA 0.362 4.832 4.480 -0.016 0.000 0.276 342 M C -1.058 175.206 176.300 -0.061 0.000 1.167 342 M CA -0.608 54.671 55.300 -0.035 0.000 0.849 342 M CB 1.457 34.049 32.600 -0.014 0.000 1.705 342 M HN -0.359 7.931 8.290 -0.000 0.000 0.504 343 T N 1.434 115.929 114.554 -0.098 0.000 2.930 343 T HA 0.206 4.547 4.350 -0.016 0.000 0.306 343 T C 0.386 174.951 174.700 -0.223 0.000 1.045 343 T CA 0.724 62.678 62.100 -0.244 0.000 1.134 343 T CB -0.224 68.446 68.868 -0.330 0.000 0.961 343 T HN 0.866 9.106 8.240 -0.000 0.000 0.545 344 H N -0.044 119.022 119.070 -0.007 0.000 3.179 344 H HA -0.181 4.365 4.556 -0.017 0.000 0.250 344 H C 1.681 177.004 175.328 -0.009 0.000 1.142 344 H CA 0.851 56.895 56.048 -0.007 0.000 1.165 344 H CB -1.699 28.060 29.762 -0.005 0.000 1.253 344 H HN 0.862 9.142 8.280 -0.000 0.000 0.325 345 G N 1.285 110.107 108.800 0.036 0.000 2.470 345 G HA2 -0.245 3.705 3.960 -0.016 0.000 0.220 345 G HA3 -0.245 3.705 3.960 -0.016 0.000 0.220 345 G C 1.594 176.505 174.900 0.020 0.000 1.121 345 G CA 0.862 45.976 45.100 0.023 0.000 0.766 345 G HN 0.644 8.934 8.290 -0.000 0.000 0.553 346 E N 1.442 121.655 120.200 0.022 0.000 2.333 346 E HA -0.140 4.200 4.350 -0.016 0.000 0.198 346 E C 1.606 178.216 176.600 0.017 0.000 1.007 346 E CA 0.805 57.213 56.400 0.014 0.000 0.845 346 E CB -0.339 29.368 29.700 0.012 0.000 0.766 346 E HN 0.366 8.726 8.360 -0.000 0.000 0.507 347 K N 0.504 120.925 120.400 0.034 0.000 2.487 347 K HA 0.193 4.503 4.320 -0.016 0.000 0.192 347 K C 0.399 177.006 176.600 0.012 0.000 1.027 347 K CA 0.166 56.466 56.287 0.022 0.000 1.054 347 K CB 0.249 32.767 32.500 0.031 0.000 0.824 347 K HN 0.166 8.416 8.250 -0.000 0.000 0.510 348 L N 1.835 123.066 121.223 0.012 0.000 2.298 348 L HA 0.309 4.639 4.340 -0.016 0.000 0.284 348 L C -0.458 176.410 176.870 -0.003 0.000 1.013 348 L CA -0.889 53.953 54.840 0.004 0.000 0.824 348 L CB 1.791 43.854 42.059 0.006 0.000 1.221 348 L HN -0.271 7.959 8.230 -0.000 0.000 0.418 349 V N 4.417 124.327 119.914 -0.006 0.000 2.465 349 V HA 0.396 4.506 4.120 -0.016 0.000 0.279 349 V C 0.146 176.241 176.094 0.002 0.000 1.045 349 V CA -0.484 61.811 62.300 -0.008 0.000 0.938 349 V CB 1.995 33.810 31.823 -0.014 0.000 0.986 349 V HN 0.435 8.625 8.190 -0.000 0.000 0.467 350 V N 5.168 125.083 119.914 0.002 0.000 2.588 350 V HA 0.393 4.504 4.120 -0.016 0.000 0.304 350 V C -1.170 174.949 176.094 0.042 0.000 1.042 350 V CA -0.802 61.501 62.300 0.004 0.000 0.877 350 V CB 1.799 33.604 31.823 -0.031 0.000 0.996 350 V HN 0.768 8.958 8.190 -0.000 0.000 0.425 351 Y N 3.119 123.407 120.300 -0.019 0.000 2.328 351 Y HA 0.727 5.269 4.550 -0.013 0.000 0.333 351 Y C 0.622 176.549 175.900 0.045 0.000 0.958 351 Y CA -0.438 57.661 58.100 -0.002 0.000 1.167 351 Y CB 1.898 40.359 38.460 0.001 0.000 1.151 351 Y HN 0.627 8.907 8.280 -0.000 0.000 0.470 352 G N 3.249 111.537 108.800 -0.854 0.000 2.801 352 G HA2 0.558 4.508 3.960 -0.016 0.000 0.213 352 G HA3 0.558 4.508 3.960 -0.016 0.000 0.213 352 G C -0.424 174.222 174.900 -0.423 0.000 1.052 352 G CA 0.267 45.079 45.100 -0.481 0.000 0.868 352 G HN 1.092 9.382 8.290 -0.000 0.000 0.589 353 A N -1.536 121.028 122.820 -0.426 0.000 2.550 353 A HA 0.783 5.093 4.320 -0.016 0.000 0.295 353 A C -0.098 177.534 177.584 0.080 0.000 1.001 353 A CA 0.238 52.192 52.037 -0.138 0.000 0.660 353 A CB 0.510 19.521 19.000 0.019 0.000 1.308 353 A HN 2.000 10.150 8.150 -0.000 0.000 0.426 354 G N -1.385 107.394 108.800 -0.036 0.000 2.354 354 G HA2 0.250 4.200 3.960 -0.016 0.000 0.582 354 G HA3 0.250 4.200 3.960 -0.016 0.000 0.582 354 G C -1.084 173.885 174.900 0.114 0.000 1.316 354 G CA -0.376 44.585 45.100 -0.232 0.000 0.995 354 G HN 1.486 9.776 8.290 -0.000 0.000 0.573 355 W N 1.134 122.566 121.300 0.219 0.000 2.072 355 W HA 0.526 5.179 4.660 -0.012 0.000 0.413 355 W C 0.971 177.870 176.519 0.634 0.000 0.865 355 W CA -0.125 57.438 57.345 0.363 0.000 1.579 355 W CB 1.002 30.587 29.460 0.209 0.000 1.720 355 W HN 0.920 9.100 8.180 -0.000 0.000 0.301 356 A N 1.628 124.935 122.820 0.812 0.000 2.390 356 A HA 0.067 4.377 4.320 -0.016 0.000 0.232 356 A C 1.315 179.045 177.584 0.244 0.000 1.233 356 A CA -0.264 52.103 52.037 0.550 0.000 0.907 356 A CB -0.382 18.862 19.000 0.406 0.000 0.967 356 A HN 0.587 8.737 8.150 -0.000 0.000 0.512 357 F N 2.116 122.220 119.950 0.256 0.000 2.134 357 F HA -0.223 4.294 4.527 -0.018 0.000 0.299 357 F C 2.444 178.386 175.800 0.235 0.000 1.097 357 F CA 2.213 60.337 58.000 0.207 0.000 1.264 357 F CB 0.117 39.232 39.000 0.192 0.000 1.001 357 F HN 0.361 8.661 8.300 -0.000 0.000 0.479 358 K N -1.106 119.479 120.400 0.307 0.000 2.281 358 K HA -0.200 4.110 4.320 -0.016 0.000 0.203 358 K C 1.226 177.934 176.600 0.180 0.000 1.046 358 K CA 1.711 58.181 56.287 0.304 0.000 0.938 358 K CB -0.810 31.673 32.500 -0.029 0.000 0.737 358 K HN 0.265 8.515 8.250 -0.000 0.000 0.458 359 F N 0.786 120.668 119.950 -0.114 0.000 2.727 359 F HA 0.167 4.684 4.527 -0.017 0.000 0.302 359 F C 1.746 177.109 175.800 -0.730 0.000 1.097 359 F CA -0.702 56.926 58.000 -0.620 0.000 1.330 359 F CB 0.201 38.237 39.000 -1.606 0.000 1.084 359 F HN -0.234 8.066 8.300 -0.000 0.000 0.578 360 V N 1.780 121.443 119.914 -0.419 0.000 2.282 360 V HA -0.248 3.862 4.120 -0.016 0.000 0.249 360 V C -0.226 175.602 176.094 -0.442 0.000 1.057 360 V CA 2.200 64.218 62.300 -0.470 0.000 1.032 360 V CB -1.344 30.108 31.823 -0.617 0.000 0.645 360 V HN 0.171 8.361 8.190 -0.000 0.000 0.447 361 P HA -0.112 4.308 4.420 -0.000 0.000 0.217 361 P C 1.829 178.947 177.300 -0.302 0.000 1.150 361 P CA 1.054 63.870 63.100 -0.475 0.000 0.832 361 P CB -0.016 31.220 31.700 -0.773 0.000 0.787 362 L N -1.583 119.456 121.223 -0.306 0.000 2.005 362 L HA -0.065 4.265 4.340 -0.016 0.000 0.207 362 L C 2.110 178.924 176.870 -0.092 0.000 1.072 362 L CA 1.975 56.668 54.840 -0.245 0.000 0.744 362 L CB -1.290 40.635 42.059 -0.223 0.000 0.895 362 L HN -0.182 8.048 8.230 -0.000 0.000 0.433 363 F N 0.327 120.091 119.950 -0.310 0.000 2.234 363 F HA 0.040 4.557 4.527 -0.017 0.000 0.299 363 F C 2.501 178.165 175.800 -0.226 0.000 1.087 363 F CA 0.660 58.472 58.000 -0.313 0.000 1.340 363 F CB -1.866 36.882 39.000 -0.419 0.000 1.031 363 F HN 0.214 8.514 8.300 -0.000 0.000 0.500 364 G N -0.232 108.558 108.800 -0.016 0.000 2.418 364 G HA2 -0.296 3.654 3.960 -0.016 0.000 0.217 364 G HA3 -0.296 3.654 3.960 -0.016 0.000 0.217 364 G C 1.905 176.756 174.900 -0.081 0.000 1.158 364 G CA 0.790 45.867 45.100 -0.038 0.000 0.771 364 G HN 0.280 8.570 8.290 -0.000 0.000 0.545 365 R N 0.039 120.467 120.500 -0.120 0.000 2.081 365 R HA 0.044 4.375 4.340 -0.016 0.000 0.235 365 R C 2.526 178.786 176.300 -0.068 0.000 1.131 365 R CA 1.229 57.254 56.100 -0.125 0.000 0.960 365 R CB -0.332 29.894 30.300 -0.123 0.000 0.856 365 R HN 0.421 8.691 8.270 -0.000 0.000 0.436 366 I N 0.024 120.552 120.570 -0.071 0.000 2.252 366 I HA -0.331 3.829 4.170 -0.016 0.000 0.245 366 I C 2.376 178.456 176.117 -0.061 0.000 1.102 366 I CA 0.934 62.203 61.300 -0.052 0.000 1.385 366 I CB -0.213 37.716 38.000 -0.119 0.000 1.064 366 I HN 0.353 8.563 8.210 -0.000 0.000 0.414 367 C N 0.701 119.960 119.300 -0.068 0.000 2.429 367 C HA -0.127 4.323 4.460 -0.016 0.000 0.277 367 C C 3.192 178.152 174.990 -0.050 0.000 1.262 367 C CA 0.888 59.876 59.018 -0.050 0.000 1.733 367 C CB -1.215 26.511 27.740 -0.024 0.000 2.010 367 C HN 0.596 8.826 8.230 -0.000 0.000 0.483 368 A N 0.977 123.760 122.820 -0.061 0.000 1.877 368 A HA -0.211 4.099 4.320 -0.016 0.000 0.216 368 A C 1.782 179.323 177.584 -0.071 0.000 1.186 368 A CA 2.241 54.234 52.037 -0.073 0.000 0.620 368 A CB -0.653 18.289 19.000 -0.096 0.000 0.822 368 A HN 0.534 8.684 8.150 -0.000 0.000 0.443 369 D N 0.189 120.557 120.400 -0.053 0.000 2.106 369 D HA -0.159 4.471 4.640 -0.016 0.000 0.191 369 D C 1.933 178.206 176.300 -0.046 0.000 0.997 369 D CA 1.355 55.332 54.000 -0.039 0.000 0.834 369 D CB -0.452 40.345 40.800 -0.004 0.000 0.956 369 D HN 0.464 8.834 8.370 -0.000 0.000 0.448 370 L N 0.386 121.583 121.223 -0.043 0.000 2.093 370 L HA -0.100 4.230 4.340 -0.016 0.000 0.208 370 L C 2.491 179.330 176.870 -0.052 0.000 1.085 370 L CA 1.024 55.839 54.840 -0.042 0.000 0.755 370 L CB -0.360 41.676 42.059 -0.038 0.000 0.904 370 L HN -0.018 8.212 8.230 -0.000 0.000 0.435 371 A N -0.826 121.956 122.820 -0.063 0.000 1.897 371 A HA -0.070 4.241 4.320 -0.016 0.000 0.215 371 A C 2.194 179.707 177.584 -0.117 0.000 1.181 371 A CA 1.518 53.509 52.037 -0.077 0.000 0.620 371 A CB -0.332 18.622 19.000 -0.076 0.000 0.821 371 A HN 0.202 8.352 8.150 -0.000 0.000 0.443 372 V N -0.241 119.582 119.914 -0.152 0.000 3.379 372 V HA 0.023 4.133 4.120 -0.016 0.000 0.249 372 V C 1.570 177.580 176.094 -0.139 0.000 1.184 372 V CA 1.218 63.378 62.300 -0.234 0.000 1.106 372 V CB -0.130 31.457 31.823 -0.392 0.000 0.826 372 V HN 0.639 8.829 8.190 -0.000 0.000 0.465 373 E N -1.066 119.082 120.200 -0.086 0.000 2.526 373 E HA 0.086 4.426 4.350 -0.016 0.000 0.208 373 E C -0.094 176.481 176.600 -0.041 0.000 0.997 373 E CA 0.341 56.710 56.400 -0.051 0.000 0.961 373 E CB 0.435 30.113 29.700 -0.038 0.000 1.030 373 E HN 0.438 8.798 8.360 -0.000 0.000 0.483 374 D N 1.289 121.664 120.400 -0.043 0.000 3.070 374 D HA -0.160 4.470 4.640 -0.016 0.000 0.220 374 D C -0.392 175.892 176.300 -0.026 0.000 1.176 374 D CA 1.768 55.748 54.000 -0.032 0.000 0.924 374 D CB -1.543 39.242 40.800 -0.026 0.000 1.124 374 D HN 0.384 8.754 8.370 -0.000 0.000 0.411 375 S N -3.237 112.447 115.700 -0.027 0.000 2.565 375 S HA 0.713 5.173 4.470 -0.016 0.000 0.269 375 S C -0.683 173.906 174.600 -0.019 0.000 1.153 375 S CA -0.548 57.639 58.200 -0.023 0.000 0.835 375 S CB 3.251 66.436 63.200 -0.025 0.000 1.122 375 S HN 0.065 8.375 8.310 -0.000 0.000 0.462 376 T N -0.205 114.343 114.554 -0.011 0.000 2.900 376 T HA 0.697 5.037 4.350 -0.016 0.000 0.295 376 T C 0.973 175.656 174.700 -0.028 0.000 1.044 376 T CA -0.002 62.104 62.100 0.011 0.000 0.995 376 T CB 1.392 70.302 68.868 0.070 0.000 1.072 376 T HN 1.207 9.447 8.240 -0.000 0.000 0.473 377 A N 2.980 125.736 122.820 -0.106 0.000 2.119 377 A HA 0.236 4.546 4.320 -0.016 0.000 0.216 377 A C 0.186 177.611 177.584 -0.265 0.000 1.152 377 A CA 0.665 52.567 52.037 -0.224 0.000 0.708 377 A CB -0.570 18.221 19.000 -0.349 0.000 0.805 377 A HN 0.778 8.928 8.150 -0.000 0.000 0.460 378 Y N 0.171 120.449 120.300 -0.036 0.000 2.326 378 Y HA 0.320 4.860 4.550 -0.016 0.000 0.333 378 Y C 0.407 176.282 175.900 -0.042 0.000 1.240 378 Y CA -0.776 57.302 58.100 -0.036 0.000 1.365 378 Y CB 0.376 38.809 38.460 -0.045 0.000 1.289 378 Y HN 0.147 8.427 8.280 -0.000 0.000 0.548 379 D N 3.597 124.068 120.400 0.119 0.000 2.411 379 D HA 0.161 4.791 4.640 -0.016 0.000 0.225 379 D C 0.035 176.351 176.300 0.027 0.000 1.156 379 D CA -0.182 53.847 54.000 0.049 0.000 0.874 379 D CB -0.171 40.649 40.800 0.034 0.000 1.034 379 D HN 0.553 8.923 8.370 -0.000 0.000 0.502 380 I N 0.773 121.344 120.570 0.003 0.000 3.833 380 I HA 0.178 4.338 4.170 -0.016 0.000 0.328 380 I C 1.317 177.419 176.117 -0.024 0.000 1.554 380 I CA -0.463 60.813 61.300 -0.041 0.000 1.116 380 I CB 0.235 38.180 38.000 -0.091 0.000 1.182 380 I HN 0.152 8.362 8.210 -0.000 0.000 0.459 381 S N 1.520 117.217 115.700 -0.006 0.000 2.387 381 S HA -0.262 4.198 4.470 -0.016 0.000 0.230 381 S C 2.100 176.704 174.600 0.007 0.000 1.035 381 S CA 1.504 59.705 58.200 0.001 0.000 1.014 381 S CB -0.555 62.648 63.200 0.005 0.000 0.836 381 S HN 0.690 9.000 8.310 -0.000 0.000 0.466 382 R N 0.847 121.353 120.500 0.009 0.000 2.189 382 R HA 0.195 4.525 4.340 -0.016 0.000 0.218 382 R C 1.828 178.140 176.300 0.019 0.000 1.074 382 R CA 0.828 56.939 56.100 0.018 0.000 0.991 382 R CB -0.298 30.017 30.300 0.024 0.000 0.883 382 R HN 0.498 8.768 8.270 -0.000 0.000 0.457 383 L N 0.704 121.935 121.223 0.012 0.000 2.554 383 L HA 0.206 4.536 4.340 -0.016 0.000 0.226 383 L C 0.892 177.795 176.870 0.055 0.000 1.137 383 L CA -0.307 54.546 54.840 0.022 0.000 0.863 383 L CB -0.384 41.661 42.059 -0.022 0.000 0.985 383 L HN 0.084 8.314 8.230 -0.000 0.000 0.451 384 A N 1.118 123.968 122.820 0.049 0.000 2.540 384 A HA 0.240 4.550 4.320 -0.016 0.000 0.239 384 A C -2.020 175.657 177.584 0.154 0.000 1.061 384 A CA -0.914 51.166 52.037 0.070 0.000 0.758 384 A CB -0.594 18.430 19.000 0.040 0.000 0.991 384 A HN 0.005 8.155 8.150 -0.000 0.000 0.502 385 P HA 0.019 4.439 4.420 -0.000 0.000 0.263 385 P C -0.555 176.851 177.300 0.178 0.000 1.168 385 P CA 0.712 63.940 63.100 0.213 0.000 0.759 385 P CB 0.271 31.976 31.700 0.008 0.000 0.782 386 Q N 1.540 121.501 119.800 0.269 0.000 2.309 386 Q HA 0.406 4.736 4.340 -0.016 0.000 0.270 386 Q C -0.155 175.883 176.000 0.064 0.000 1.023 386 Q CA -0.486 55.479 55.803 0.270 0.000 0.758 386 Q CB 1.396 30.395 28.738 0.435 0.000 1.247 386 Q HN 0.457 8.727 8.270 -0.000 0.000 0.455 387 S N 0.000 115.706 115.700 0.010 0.000 2.498 387 S HA 0.000 4.460 4.470 -0.016 0.000 0.327 387 S CA 0.000 58.171 58.200 -0.049 0.000 1.107 387 S CB 0.000 63.179 63.200 -0.035 0.000 0.593 387 S HN 0.000 8.310 8.310 -0.000 0.000 0.517