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 7cat_1_B DATA FIRST_RESID 3 DATA SEQUENCE NRDPASDQMK HWKEQRAAQK PDVLTTGGGN PVGDKLNSLT VGPRGPLLVQ DATA SEQUENCE DVVFTDEMAH FDRERIPERV VHAKGAGAFG YFEVTHDITR YSKAKVFEHI DATA SEQUENCE GKRTPIAVRF STVAGESGSA DTVRDPRGFA VKFYTEDGNW DLVGNNTPIF DATA SEQUENCE FIRDALLFPS FIHSQKRNPQ THLKDPDMVW DFWSLRPESL HQVSFLFSDR DATA SEQUENCE GIPDGHRHMD GYGSHTFKLV NADGEAVYCK FHYKTDQGIK NLSVEDAARL DATA SEQUENCE AHEDPDYGLR DLFNAIATGN YPSWTLYIQV MTFSEAEIFP FNPFDLTKVW DATA SEQUENCE PHGDYPLIPV GKLVLNRNPV NYFAEVEQLA FDPSNMPPGI EPSPDKMLQG DATA SEQUENCE RLFAYPDTHR HRLGPNYLQI PVNCPYRARV ANYQRDGPMC MMDNQGGAPN DATA SEQUENCE YYPNSFSAPE HQPSALEHRT HFSGDVQRFN SANDDNVTQV RTFYLKVLNE DATA SEQUENCE EQRKRLCENI AGHLKDAQLF IQKKAVKNFS DVHPEYGSRI QALLDKYN 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 N HA 0.000 4.740 4.740 -0.000 0.000 0.220 3 N C 0.000 175.533 175.510 0.039 0.000 1.280 3 N CA 0.000 53.076 53.050 0.043 0.000 0.885 3 N CB 0.000 38.524 38.487 0.061 0.000 1.341 4 R N 0.367 120.894 120.500 0.045 0.000 2.885 4 R HA 0.460 4.795 4.340 -0.008 0.000 0.260 4 R C -1.351 174.976 176.300 0.046 0.000 1.107 4 R CA -0.881 55.240 56.100 0.036 0.000 0.978 4 R CB 0.216 30.530 30.300 0.023 0.000 1.227 4 R HN 0.487 8.757 8.270 -0.000 0.000 0.473 5 D N 0.677 121.100 120.400 0.038 0.000 2.423 5 D HA -0.004 4.631 4.640 -0.008 0.000 0.238 5 D C -1.658 174.680 176.300 0.063 0.000 1.142 5 D CA -1.176 52.855 54.000 0.051 0.000 0.884 5 D CB 0.711 41.534 40.800 0.038 0.000 1.199 5 D HN 0.168 8.538 8.370 -0.000 0.000 0.438 6 P HA -0.153 4.267 4.420 -0.000 0.000 0.216 6 P C 1.445 178.832 177.300 0.145 0.000 1.150 6 P CA 2.173 65.356 63.100 0.140 0.000 0.837 6 P CB -0.076 31.749 31.700 0.208 0.000 0.786 7 A N -0.139 122.793 122.820 0.186 0.000 1.896 7 A HA -0.294 4.022 4.320 -0.008 0.000 0.220 7 A C 2.457 179.975 177.584 -0.108 0.000 1.206 7 A CA 2.770 54.787 52.037 -0.033 0.000 0.647 7 A CB -1.811 17.148 19.000 -0.069 0.000 0.828 7 A HN 0.191 8.341 8.150 -0.000 0.000 0.455 8 S N -0.541 115.124 115.700 -0.060 0.000 2.419 8 S HA -0.102 4.364 4.470 -0.008 0.000 0.233 8 S C 0.895 175.441 174.600 -0.089 0.000 1.016 8 S CA 1.292 59.453 58.200 -0.064 0.000 0.974 8 S CB -0.289 62.894 63.200 -0.028 0.000 0.786 8 S HN 0.577 8.887 8.310 -0.000 0.000 0.492 9 D N 0.546 120.855 120.400 -0.152 0.000 2.358 9 D HA 0.086 4.722 4.640 -0.008 0.000 0.224 9 D C 1.658 177.690 176.300 -0.447 0.000 1.123 9 D CA -0.034 53.794 54.000 -0.288 0.000 0.833 9 D CB -0.044 40.584 40.800 -0.288 0.000 0.946 9 D HN 0.262 8.632 8.370 -0.000 0.000 0.505 10 Q N 0.445 120.110 119.800 -0.226 0.000 1.975 10 Q HA -0.169 4.166 4.340 -0.008 0.000 0.205 10 Q C 1.795 177.818 176.000 0.039 0.000 0.990 10 Q CA 1.382 57.131 55.803 -0.091 0.000 0.845 10 Q CB -0.002 28.699 28.738 -0.061 0.000 0.913 10 Q HN 0.329 8.599 8.270 -0.000 0.000 0.420 11 M N 0.356 119.976 119.600 0.034 0.000 2.229 11 M HA -0.127 4.348 4.480 -0.008 0.000 0.264 11 M C 2.260 178.684 176.300 0.208 0.000 1.063 11 M CA 1.361 56.736 55.300 0.124 0.000 1.114 11 M CB -0.343 32.281 32.600 0.039 0.000 1.387 11 M HN 0.055 8.345 8.290 -0.000 0.000 0.420 12 K N -0.033 120.443 120.400 0.127 0.000 2.160 12 K HA -0.221 4.094 4.320 -0.008 0.000 0.206 12 K C 1.605 178.415 176.600 0.351 0.000 1.047 12 K CA 1.570 57.972 56.287 0.191 0.000 0.930 12 K CB 0.003 32.595 32.500 0.154 0.000 0.720 12 K HN 0.430 8.680 8.250 -0.000 0.000 0.450 13 H N -2.005 117.152 119.070 0.144 0.000 2.486 13 H HA -0.033 4.519 4.556 -0.008 0.000 0.287 13 H C 1.307 176.698 175.328 0.105 0.000 1.010 13 H CA 0.717 56.833 56.048 0.113 0.000 1.324 13 H CB -0.704 29.127 29.762 0.116 0.000 1.446 13 H HN 0.366 8.646 8.280 -0.000 0.000 0.537 14 W N 2.851 124.250 121.300 0.165 0.000 2.350 14 W HA -0.173 4.483 4.660 -0.007 0.000 0.289 14 W C 2.376 178.939 176.519 0.073 0.000 1.215 14 W CA 2.263 59.667 57.345 0.099 0.000 1.236 14 W CB 0.192 29.692 29.460 0.067 0.000 1.130 14 W HN 0.115 8.295 8.180 -0.000 0.000 0.541 15 K N 0.258 120.768 120.400 0.183 0.000 2.063 15 K HA -0.133 4.182 4.320 -0.008 0.000 0.204 15 K C 2.001 178.573 176.600 -0.047 0.000 1.039 15 K CA 1.350 57.695 56.287 0.096 0.000 0.957 15 K CB -0.671 31.974 32.500 0.242 0.000 0.764 15 K HN 0.051 8.301 8.250 -0.000 0.000 0.447 16 E N 0.746 120.960 120.200 0.023 0.000 2.208 16 E HA -0.274 4.071 4.350 -0.008 0.000 0.202 16 E C 1.828 178.378 176.600 -0.084 0.000 1.014 16 E CA 1.414 57.804 56.400 -0.016 0.000 0.819 16 E CB 0.096 29.798 29.700 0.004 0.000 0.735 16 E HN 0.366 8.726 8.360 -0.000 0.000 0.469 17 Q N 0.521 120.236 119.800 -0.141 0.000 2.444 17 Q HA -0.067 4.268 4.340 -0.008 0.000 0.206 17 Q C -0.584 175.268 176.000 -0.247 0.000 0.948 17 Q CA 0.155 55.843 55.803 -0.191 0.000 0.946 17 Q CB 0.204 28.814 28.738 -0.214 0.000 1.027 17 Q HN 0.138 8.408 8.270 -0.000 0.000 0.513 18 R N -1.459 118.888 120.500 -0.255 0.000 2.472 18 R HA 0.560 4.895 4.340 -0.008 0.000 0.294 18 R C -0.148 176.077 176.300 -0.125 0.000 1.243 18 R CA 0.002 55.966 56.100 -0.228 0.000 1.023 18 R CB 0.981 31.082 30.300 -0.331 0.000 1.157 18 R HN -0.039 8.231 8.270 -0.000 0.000 0.530 19 A N 2.236 125.001 122.820 -0.091 0.000 2.140 19 A HA 0.351 4.666 4.320 -0.008 0.000 0.209 19 A C 1.318 178.875 177.584 -0.045 0.000 1.181 19 A CA 0.414 52.418 52.037 -0.055 0.000 0.824 19 A CB 0.374 19.345 19.000 -0.048 0.000 0.879 19 A HN 0.699 8.849 8.150 -0.000 0.000 0.480 20 A N 0.259 123.043 122.820 -0.059 0.000 3.117 20 A HA 0.429 4.745 4.320 -0.008 0.000 0.255 20 A C 0.723 178.280 177.584 -0.045 0.000 1.583 20 A CA -0.172 51.837 52.037 -0.047 0.000 1.234 20 A CB -0.612 18.357 19.000 -0.052 0.000 1.076 20 A HN 0.628 8.778 8.150 -0.000 0.000 0.653 21 Q N 0.390 120.169 119.800 -0.034 0.000 2.665 21 Q HA 0.410 4.745 4.340 -0.008 0.000 0.189 21 Q C -0.383 175.618 176.000 0.001 0.000 1.118 21 Q CA -0.343 55.450 55.803 -0.018 0.000 0.849 21 Q CB 0.182 28.917 28.738 -0.006 0.000 3.715 21 Q HN 0.317 8.587 8.270 -0.000 0.000 0.439 22 K N 0.362 120.772 120.400 0.017 0.000 5.381 22 K HA -0.078 4.237 4.320 -0.008 0.000 0.853 22 K C -2.743 173.879 176.600 0.036 0.000 1.661 22 K CA 0.052 56.352 56.287 0.022 0.000 1.556 22 K CB -1.088 31.419 32.500 0.013 0.000 2.466 22 K HN 0.315 8.565 8.250 -0.000 0.000 0.269 23 P HA 0.012 4.432 4.420 -0.000 0.000 0.267 23 P C -0.297 177.038 177.300 0.057 0.000 1.201 23 P CA -0.030 63.116 63.100 0.076 0.000 0.775 23 P CB 0.482 32.229 31.700 0.079 0.000 0.854 24 D N 0.101 120.542 120.400 0.069 0.000 2.361 24 D HA 0.057 4.692 4.640 -0.008 0.000 0.239 24 D C -0.002 176.318 176.300 0.033 0.000 1.200 24 D CA -0.080 53.949 54.000 0.047 0.000 0.915 24 D CB 0.439 41.271 40.800 0.052 0.000 1.170 24 D HN -0.011 8.359 8.370 -0.000 0.000 0.444 25 V N 1.861 121.789 119.914 0.022 0.000 2.508 25 V HA -0.039 4.076 4.120 -0.008 0.000 0.281 25 V C 0.454 176.553 176.094 0.009 0.000 1.041 25 V CA -0.593 61.715 62.300 0.014 0.000 1.016 25 V CB 0.961 32.790 31.823 0.010 0.000 0.984 25 V HN 0.290 8.480 8.190 -0.000 0.000 0.478 26 L N 7.456 128.682 121.223 0.004 0.000 2.500 26 L HA 0.369 4.704 4.340 -0.008 0.000 0.272 26 L C 0.594 177.460 176.870 -0.007 0.000 1.149 26 L CA 0.779 55.616 54.840 -0.005 0.000 0.897 26 L CB 0.317 42.372 42.059 -0.007 0.000 1.178 26 L HN 0.967 9.197 8.230 -0.000 0.000 0.473 27 T N 0.902 115.448 114.554 -0.013 0.000 2.927 27 T HA 0.733 5.079 4.350 -0.008 0.000 0.286 27 T C 0.413 175.100 174.700 -0.022 0.000 1.040 27 T CA -0.076 62.016 62.100 -0.014 0.000 1.010 27 T CB 1.217 70.079 68.868 -0.011 0.000 1.177 27 T HN 0.740 8.980 8.240 -0.000 0.000 0.546 28 T N -2.144 112.400 114.554 -0.018 0.000 2.771 28 T HA 0.480 4.825 4.350 -0.008 0.000 0.290 28 T C 1.659 176.341 174.700 -0.031 0.000 1.005 28 T CA -0.061 62.026 62.100 -0.022 0.000 0.944 28 T CB 0.135 68.997 68.868 -0.010 0.000 1.147 28 T HN 0.929 9.169 8.240 -0.000 0.000 0.534 29 G N -1.130 107.649 108.800 -0.035 0.000 2.744 29 G HA2 0.244 4.199 3.960 -0.008 0.000 0.211 29 G HA3 0.244 4.199 3.960 -0.008 0.000 0.211 29 G C 1.295 176.182 174.900 -0.021 0.000 1.143 29 G CA 0.245 45.322 45.100 -0.040 0.000 0.788 29 G HN 0.984 9.274 8.290 -0.000 0.000 0.534 30 G N -0.454 108.339 108.800 -0.012 0.000 2.777 30 G HA2 0.363 4.318 3.960 -0.008 0.000 0.211 30 G HA3 0.363 4.318 3.960 -0.008 0.000 0.211 30 G C 1.167 176.064 174.900 -0.006 0.000 1.149 30 G CA 0.483 45.580 45.100 -0.006 0.000 0.785 30 G HN 1.305 9.595 8.290 -0.000 0.000 0.536 31 G N -0.443 108.352 108.800 -0.009 0.000 2.130 31 G HA2 -0.229 3.727 3.960 -0.008 0.000 0.216 31 G HA3 -0.229 3.727 3.960 -0.008 0.000 0.216 31 G C -0.127 174.770 174.900 -0.005 0.000 0.999 31 G CA -0.117 44.978 45.100 -0.008 0.000 0.686 31 G HN 0.600 8.890 8.290 -0.000 0.000 0.515 32 N N 1.997 120.695 118.700 -0.004 0.000 2.479 32 N HA 0.562 5.298 4.740 -0.008 0.000 0.285 32 N C -2.472 173.038 175.510 -0.001 0.000 1.075 32 N CA -1.485 51.565 53.050 -0.000 0.000 0.967 32 N CB 1.941 40.429 38.487 0.002 0.000 1.137 32 N HN 0.116 8.496 8.380 -0.000 0.000 0.472 33 P HA 0.109 4.529 4.420 -0.000 0.000 0.279 33 P C -0.741 176.561 177.300 0.003 0.000 1.239 33 P CA -0.260 62.841 63.100 0.002 0.000 0.789 33 P CB 1.129 32.830 31.700 0.003 0.000 0.933 34 V N 2.798 122.713 119.914 0.003 0.000 2.472 34 V HA 0.391 4.506 4.120 -0.008 0.000 0.290 34 V C 1.551 177.649 176.094 0.005 0.000 1.037 34 V CA 0.407 62.711 62.300 0.005 0.000 0.908 34 V CB 1.109 32.934 31.823 0.003 0.000 0.985 34 V HN 0.823 9.013 8.190 -0.000 0.000 0.454 35 G N 2.339 111.144 108.800 0.007 0.000 2.490 35 G HA2 0.049 4.004 3.960 -0.008 0.000 0.211 35 G HA3 0.049 4.004 3.960 -0.008 0.000 0.211 35 G C 0.119 175.022 174.900 0.006 0.000 1.159 35 G CA 0.327 45.431 45.100 0.006 0.000 0.819 35 G HN 0.606 8.896 8.290 -0.000 0.000 0.539 36 D N -0.932 119.473 120.400 0.008 0.000 2.855 36 D HA 0.314 4.949 4.640 -0.008 0.000 0.241 36 D C -0.316 175.990 176.300 0.011 0.000 1.277 36 D CA -0.466 53.538 54.000 0.006 0.000 0.918 36 D CB 1.903 42.706 40.800 0.005 0.000 1.462 36 D HN -0.016 8.354 8.370 -0.000 0.000 0.559 37 K N 3.120 123.525 120.400 0.007 0.000 2.387 37 K HA 0.257 4.572 4.320 -0.008 0.000 0.203 37 K C 0.886 177.491 176.600 0.008 0.000 1.030 37 K CA -0.046 56.248 56.287 0.011 0.000 1.099 37 K CB 0.599 33.099 32.500 0.001 0.000 0.863 37 K HN 0.396 8.646 8.250 -0.000 0.000 0.529 38 L N 0.029 121.254 121.223 0.004 0.000 2.693 38 L HA 0.206 4.541 4.340 -0.008 0.000 0.235 38 L C -0.683 176.186 176.870 -0.002 0.000 1.127 38 L CA 0.095 54.934 54.840 -0.002 0.000 0.914 38 L CB 0.319 42.373 42.059 -0.007 0.000 1.193 38 L HN -0.001 8.229 8.230 -0.000 0.000 0.502 39 N N -1.133 117.568 118.700 0.002 0.000 2.454 39 N HA 0.273 5.008 4.740 -0.008 0.000 0.291 39 N C -0.789 174.716 175.510 -0.009 0.000 1.079 39 N CA -0.269 52.776 53.050 -0.009 0.000 0.893 39 N CB 1.819 40.299 38.487 -0.012 0.000 1.512 39 N HN -0.130 8.250 8.380 -0.000 0.000 0.497 40 S N 1.026 116.706 115.700 -0.034 0.000 2.608 40 S HA 0.243 4.708 4.470 -0.008 0.000 0.261 40 S C -0.133 174.438 174.600 -0.048 0.000 1.314 40 S CA -0.604 57.562 58.200 -0.056 0.000 0.992 40 S CB 0.625 63.723 63.200 -0.171 0.000 0.935 40 S HN 0.415 8.725 8.310 -0.000 0.000 0.564 41 L N 2.680 123.878 121.223 -0.041 0.000 2.278 41 L HA 0.452 4.787 4.340 -0.008 0.000 0.287 41 L C 0.381 177.224 176.870 -0.044 0.000 1.072 41 L CA 0.532 55.355 54.840 -0.028 0.000 0.819 41 L CB 0.015 42.071 42.059 -0.006 0.000 1.176 41 L HN 0.975 9.205 8.230 -0.000 0.000 0.435 42 T N 1.290 115.821 114.554 -0.038 0.000 2.864 42 T HA 0.560 4.906 4.350 -0.008 0.000 0.289 42 T C -0.623 174.060 174.700 -0.028 0.000 1.082 42 T CA -0.674 61.401 62.100 -0.042 0.000 1.009 42 T CB 1.434 70.271 68.868 -0.052 0.000 1.234 42 T HN 0.418 8.658 8.240 -0.000 0.000 0.526 43 V N 1.121 121.019 119.914 -0.027 0.000 2.318 43 V HA 0.675 4.790 4.120 -0.008 0.000 0.271 43 V C 0.469 176.552 176.094 -0.019 0.000 1.030 43 V CA 1.070 63.358 62.300 -0.019 0.000 0.844 43 V CB -0.457 31.356 31.823 -0.016 0.000 1.015 43 V HN 1.965 10.155 8.190 -0.000 0.000 0.460 44 G N 7.293 116.083 108.800 -0.017 0.000 2.731 44 G HA2 -0.110 3.845 3.960 -0.008 0.000 0.686 44 G HA3 -0.110 3.845 3.960 -0.008 0.000 0.686 44 G C -1.638 173.250 174.900 -0.020 0.000 1.395 44 G CA -0.196 44.895 45.100 -0.016 0.000 0.870 44 G HN 0.661 8.951 8.290 -0.000 0.000 0.591 45 P HA -0.032 4.388 4.420 -0.000 0.000 0.230 45 P C 0.951 178.236 177.300 -0.024 0.000 1.158 45 P CA 1.046 64.133 63.100 -0.020 0.000 0.769 45 P CB 0.214 31.905 31.700 -0.016 0.000 0.807 46 R N -0.601 119.886 120.500 -0.023 0.000 2.642 46 R HA 0.322 4.657 4.340 -0.008 0.000 0.435 46 R C 0.865 177.149 176.300 -0.025 0.000 1.046 46 R CA -0.186 55.900 56.100 -0.024 0.000 1.103 46 R CB 1.116 31.404 30.300 -0.020 0.000 1.425 46 R HN 0.116 8.386 8.270 -0.000 0.000 0.586 47 G N 1.645 110.428 108.800 -0.028 0.000 2.557 47 G HA2 0.438 4.394 3.960 -0.008 0.000 0.302 47 G HA3 0.438 4.394 3.960 -0.008 0.000 0.302 47 G C -2.323 172.554 174.900 -0.038 0.000 1.311 47 G CA -0.872 44.212 45.100 -0.028 0.000 1.030 47 G HN -0.098 8.192 8.290 -0.000 0.000 0.509 48 P HA 0.312 4.732 4.420 -0.000 0.000 0.278 48 P C -1.001 176.264 177.300 -0.058 0.000 1.266 48 P CA -0.594 62.478 63.100 -0.046 0.000 0.807 48 P CB 1.598 33.278 31.700 -0.034 0.000 1.094 49 L N 1.684 122.859 121.223 -0.080 0.000 2.265 49 L HA 0.280 4.615 4.340 -0.008 0.000 0.288 49 L C -0.293 176.537 176.870 -0.067 0.000 1.058 49 L CA -0.460 54.316 54.840 -0.108 0.000 0.809 49 L CB -0.383 41.556 42.059 -0.200 0.000 1.179 49 L HN 0.220 8.450 8.230 -0.000 0.000 0.429 50 L N 5.563 126.757 121.223 -0.048 0.000 2.426 50 L HA 0.114 4.449 4.340 -0.008 0.000 0.271 50 L C 1.216 178.090 176.870 0.006 0.000 1.169 50 L CA -0.288 54.542 54.840 -0.016 0.000 0.836 50 L CB 1.381 43.434 42.059 -0.011 0.000 1.112 50 L HN 0.527 8.757 8.230 -0.000 0.000 0.465 51 V N 2.454 122.380 119.914 0.020 0.000 3.380 51 V HA -0.136 3.979 4.120 -0.008 0.000 0.268 51 V C 1.933 178.059 176.094 0.053 0.000 1.168 51 V CA 1.287 63.614 62.300 0.045 0.000 1.156 51 V CB -0.203 31.642 31.823 0.037 0.000 0.785 51 V HN 0.796 8.986 8.190 -0.000 0.000 0.487 52 Q N -0.899 118.924 119.800 0.038 0.000 2.451 52 Q HA -0.059 4.276 4.340 -0.008 0.000 0.206 52 Q C 0.848 176.876 176.000 0.047 0.000 0.947 52 Q CA 0.269 56.093 55.803 0.035 0.000 0.937 52 Q CB 0.093 28.845 28.738 0.022 0.000 1.025 52 Q HN 0.438 8.708 8.270 -0.000 0.000 0.511 53 D N 0.982 121.420 120.400 0.064 0.000 2.885 53 D HA -0.031 4.604 4.640 -0.008 0.000 0.234 53 D C 0.746 177.127 176.300 0.136 0.000 1.129 53 D CA -0.119 53.938 54.000 0.095 0.000 0.991 53 D CB 0.259 41.117 40.800 0.097 0.000 1.137 53 D HN 0.061 8.431 8.370 -0.000 0.000 0.459 54 V N 0.138 120.103 119.914 0.086 0.000 3.494 54 V HA -0.044 4.071 4.120 -0.008 0.000 0.272 54 V C 1.262 177.387 176.094 0.052 0.000 1.233 54 V CA 0.347 62.686 62.300 0.065 0.000 1.205 54 V CB -0.539 31.308 31.823 0.040 0.000 0.958 54 V HN 0.176 8.366 8.190 -0.000 0.000 0.495 55 V N -0.983 118.976 119.914 0.075 0.000 3.151 55 V HA 0.139 4.254 4.120 -0.008 0.000 0.241 55 V C 1.750 177.876 176.094 0.053 0.000 1.173 55 V CA 1.137 63.469 62.300 0.053 0.000 1.154 55 V CB 0.280 32.139 31.823 0.060 0.000 0.898 55 V HN 0.572 8.762 8.190 -0.000 0.000 0.473 56 F N 1.595 121.546 119.950 0.002 0.000 2.075 56 F HA -0.191 4.333 4.527 -0.004 0.000 0.297 56 F C 2.577 178.386 175.800 0.016 0.000 1.113 56 F CA 2.583 60.585 58.000 0.002 0.000 1.218 56 F CB -0.626 38.375 39.000 0.000 0.000 0.984 56 F HN 0.185 8.485 8.300 -0.000 0.000 0.472 57 T N -1.404 113.016 114.554 -0.223 0.000 2.896 57 T HA -0.139 4.207 4.350 -0.008 0.000 0.263 57 T C 1.775 176.363 174.700 -0.187 0.000 1.050 57 T CA 1.648 63.587 62.100 -0.270 0.000 1.140 57 T CB -0.692 68.172 68.868 -0.007 0.000 0.877 57 T HN 0.410 8.650 8.240 -0.000 0.000 0.457 58 D N 0.691 121.033 120.400 -0.097 0.000 2.126 58 D HA -0.176 4.459 4.640 -0.008 0.000 0.190 58 D C 2.109 178.377 176.300 -0.054 0.000 1.001 58 D CA 1.852 55.822 54.000 -0.049 0.000 0.841 58 D CB -0.288 40.495 40.800 -0.029 0.000 0.949 58 D HN 0.648 9.018 8.370 -0.000 0.000 0.446 59 E N -1.308 118.827 120.200 -0.109 0.000 2.107 59 E HA -0.164 4.182 4.350 -0.008 0.000 0.191 59 E C 1.931 178.482 176.600 -0.081 0.000 0.982 59 E CA 0.592 56.944 56.400 -0.080 0.000 0.809 59 E CB -0.063 29.580 29.700 -0.094 0.000 0.756 59 E HN 0.238 8.598 8.360 -0.000 0.000 0.459 60 M N 0.735 120.179 119.600 -0.261 0.000 2.156 60 M HA 0.034 4.509 4.480 -0.008 0.000 0.264 60 M C 2.015 178.275 176.300 -0.067 0.000 1.067 60 M CA 1.567 56.727 55.300 -0.234 0.000 1.131 60 M CB -0.427 31.748 32.600 -0.708 0.000 1.368 60 M HN 0.138 8.428 8.290 -0.000 0.000 0.416 61 A N -1.199 121.559 122.820 -0.104 0.000 1.940 61 A HA -0.234 4.081 4.320 -0.008 0.000 0.219 61 A C 2.333 179.889 177.584 -0.047 0.000 1.176 61 A CA 1.947 53.945 52.037 -0.064 0.000 0.631 61 A CB -1.233 17.737 19.000 -0.050 0.000 0.814 61 A HN 0.720 8.870 8.150 -0.000 0.000 0.446 62 H N -2.036 117.010 119.070 -0.039 0.000 2.372 62 H HA -0.095 4.460 4.556 -0.001 0.000 0.301 62 H C 1.930 177.264 175.328 0.010 0.000 1.065 62 H CA 1.721 57.755 56.048 -0.023 0.000 1.364 62 H CB -0.263 29.485 29.762 -0.023 0.000 1.406 62 H HN 0.487 8.767 8.280 -0.000 0.000 0.521 63 F N 2.464 122.381 119.950 -0.055 0.000 2.025 63 F HA -0.229 4.297 4.527 -0.001 0.000 0.297 63 F C 1.887 177.604 175.800 -0.138 0.000 1.132 63 F CA 1.906 59.858 58.000 -0.080 0.000 1.191 63 F CB -0.647 38.315 39.000 -0.063 0.000 0.963 63 F HN 0.048 8.348 8.300 -0.000 0.000 0.481 64 D N 0.142 120.400 120.400 -0.237 0.000 2.411 64 D HA -0.134 4.501 4.640 -0.008 0.000 0.226 64 D C 1.628 177.748 176.300 -0.298 0.000 0.988 64 D CA 0.958 54.762 54.000 -0.326 0.000 0.938 64 D CB -0.279 40.432 40.800 -0.148 0.000 0.883 64 D HN 0.440 8.810 8.370 -0.000 0.000 0.525 65 R N -0.513 119.795 120.500 -0.320 0.000 2.565 65 R HA 0.173 4.508 4.340 -0.008 0.000 0.347 65 R C 1.310 177.401 176.300 -0.347 0.000 1.010 65 R CA -0.138 55.775 56.100 -0.311 0.000 1.126 65 R CB 0.677 30.781 30.300 -0.326 0.000 1.331 65 R HN 0.085 8.355 8.270 -0.000 0.000 0.552 66 E N 0.581 120.567 120.200 -0.356 0.000 2.150 66 E HA -0.058 4.288 4.350 -0.008 0.000 0.193 66 E C 0.150 176.581 176.600 -0.281 0.000 0.985 66 E CA 0.859 57.060 56.400 -0.330 0.000 0.814 66 E CB 0.318 29.854 29.700 -0.274 0.000 0.752 66 E HN -0.012 8.348 8.360 -0.000 0.000 0.466 67 R N 1.100 121.488 120.500 -0.186 0.000 2.297 67 R HA 0.320 4.656 4.340 -0.008 0.000 0.308 67 R C 0.217 176.510 176.300 -0.012 0.000 1.029 67 R CA -0.371 55.684 56.100 -0.074 0.000 0.929 67 R CB 0.255 30.510 30.300 -0.075 0.000 1.046 67 R HN 0.156 8.426 8.270 -0.000 0.000 0.461 68 I N -0.312 120.309 120.570 0.085 0.000 2.863 68 I HA 0.618 4.783 4.170 -0.008 0.000 0.311 68 I C -2.037 174.109 176.117 0.048 0.000 1.026 68 I CA -2.798 58.544 61.300 0.070 0.000 1.077 68 I CB 1.324 39.413 38.000 0.148 0.000 1.262 68 I HN 0.257 8.467 8.210 -0.000 0.000 0.461 69 P HA 0.100 4.520 4.420 -0.000 0.000 0.268 69 P C -0.912 176.424 177.300 0.060 0.000 1.205 69 P CA -0.140 62.980 63.100 0.033 0.000 0.771 69 P CB 0.384 32.104 31.700 0.032 0.000 0.858 70 E N 2.375 122.619 120.200 0.073 0.000 2.371 70 E HA 0.188 4.533 4.350 -0.008 0.000 0.257 70 E C -0.431 176.216 176.600 0.078 0.000 1.134 70 E CA -0.820 55.630 56.400 0.083 0.000 0.919 70 E CB 0.573 30.322 29.700 0.083 0.000 1.025 70 E HN 0.251 8.611 8.360 -0.000 0.000 0.438 71 R N 0.695 121.245 120.500 0.084 0.000 2.640 71 R HA -0.026 4.310 4.340 -0.008 0.000 0.270 71 R C 1.014 177.353 176.300 0.066 0.000 1.024 71 R CA -0.085 56.063 56.100 0.080 0.000 1.085 71 R CB 0.605 30.973 30.300 0.113 0.000 0.963 71 R HN 0.510 8.780 8.270 -0.000 0.000 0.426 72 V N 3.409 123.347 119.914 0.040 0.000 2.594 72 V HA -0.122 3.994 4.120 -0.008 0.000 0.253 72 V C 0.474 176.590 176.094 0.037 0.000 1.069 72 V CA 1.619 63.933 62.300 0.024 0.000 1.082 72 V CB 0.220 32.041 31.823 -0.004 0.000 0.680 72 V HN 0.559 8.749 8.190 -0.000 0.000 0.469 73 V N -4.075 115.895 119.914 0.094 0.000 3.012 73 V HA 0.594 4.709 4.120 -0.008 0.000 0.307 73 V C -0.003 176.233 176.094 0.237 0.000 1.166 73 V CA -0.801 61.578 62.300 0.130 0.000 0.974 73 V CB 1.558 33.523 31.823 0.236 0.000 1.040 73 V HN 0.388 8.578 8.190 -0.000 0.000 0.428 74 H N 0.807 119.925 119.070 0.080 0.000 2.976 74 H HA -0.193 4.358 4.556 -0.009 0.000 0.273 74 H C 1.489 176.868 175.328 0.085 0.000 1.259 74 H CA 0.804 56.907 56.048 0.092 0.000 1.122 74 H CB -1.192 28.628 29.762 0.097 0.000 1.298 74 H HN 1.227 9.507 8.280 -0.000 0.000 0.379 75 A N 0.552 123.467 122.820 0.158 0.000 1.972 75 A HA -0.081 4.234 4.320 -0.008 0.000 0.219 75 A C 1.422 179.092 177.584 0.143 0.000 1.169 75 A CA 1.702 53.815 52.037 0.128 0.000 0.635 75 A CB 0.110 19.160 19.000 0.084 0.000 0.810 75 A HN 0.273 8.423 8.150 -0.000 0.000 0.446 76 K N -0.885 119.601 120.400 0.143 0.000 2.274 76 K HA 0.550 4.865 4.320 -0.008 0.000 0.262 76 K C -0.212 176.502 176.600 0.191 0.000 0.961 76 K CA 0.421 56.805 56.287 0.162 0.000 0.833 76 K CB 1.329 33.904 32.500 0.124 0.000 1.102 76 K HN 0.377 8.627 8.250 -0.000 0.000 0.436 77 G N 1.201 110.146 108.800 0.242 0.000 2.495 77 G HA2 0.647 4.602 3.960 -0.008 0.000 0.294 77 G HA3 0.647 4.602 3.960 -0.008 0.000 0.294 77 G C -1.847 173.254 174.900 0.336 0.000 1.397 77 G CA -0.412 44.828 45.100 0.234 0.000 0.790 77 G HN 0.715 9.005 8.290 -0.000 0.000 0.486 78 A N -1.357 121.609 122.820 0.244 0.000 2.454 78 A HA 1.018 5.334 4.320 -0.008 0.000 0.302 78 A C 0.170 177.833 177.584 0.132 0.000 1.079 78 A CA 0.116 52.334 52.037 0.301 0.000 0.731 78 A CB 1.850 21.098 19.000 0.414 0.000 1.299 78 A HN 2.148 10.298 8.150 -0.000 0.000 0.413 79 G N -1.122 107.726 108.800 0.080 0.000 2.798 79 G HA2 0.998 4.953 3.960 -0.008 0.000 0.286 79 G HA3 0.998 4.953 3.960 -0.008 0.000 0.286 79 G C -0.627 174.210 174.900 -0.103 0.000 1.389 79 G CA -0.122 44.902 45.100 -0.127 0.000 0.894 79 G HN 2.290 10.580 8.290 -0.000 0.000 0.488 80 A N -1.435 121.108 122.820 -0.462 0.000 2.517 80 A HA 0.611 4.926 4.320 -0.008 0.000 0.296 80 A C -1.991 175.146 177.584 -0.745 0.000 0.983 80 A CA -0.799 51.057 52.037 -0.301 0.000 0.634 80 A CB 0.094 19.108 19.000 0.024 0.000 1.341 80 A HN 0.927 9.077 8.150 -0.000 0.000 0.438 81 F N -0.051 119.910 119.950 0.017 0.000 2.575 81 F HA 0.899 5.420 4.527 -0.010 0.000 0.330 81 F C 1.103 176.902 175.800 -0.003 0.000 1.056 81 F CA 0.579 58.587 58.000 0.013 0.000 0.964 81 F CB 2.496 41.506 39.000 0.017 0.000 1.258 81 F HN 1.341 9.641 8.300 -0.000 0.000 0.484 82 G N 0.208 109.111 108.800 0.172 0.000 2.435 82 G HA2 0.436 4.391 3.960 -0.008 0.000 0.228 82 G HA3 0.436 4.391 3.960 -0.008 0.000 0.228 82 G C -2.286 172.712 174.900 0.164 0.000 1.198 82 G CA -0.483 44.658 45.100 0.069 0.000 0.948 82 G HN 0.871 9.161 8.290 -0.000 0.000 0.487 83 Y N -1.489 118.867 120.300 0.094 0.000 2.552 83 Y HA 0.790 5.335 4.550 -0.008 0.000 0.337 83 Y C -1.613 174.402 175.900 0.191 0.000 1.094 83 Y CA -2.209 55.969 58.100 0.130 0.000 1.028 83 Y CB 1.411 39.919 38.460 0.080 0.000 1.321 83 Y HN 0.801 9.081 8.280 -0.000 0.000 0.456 84 F N 3.103 123.205 119.950 0.253 0.000 2.408 84 F HA 0.615 5.137 4.527 -0.007 0.000 0.344 84 F C -0.488 175.502 175.800 0.317 0.000 1.112 84 F CA -0.542 57.605 58.000 0.246 0.000 1.096 84 F CB 1.356 40.571 39.000 0.357 0.000 1.129 84 F HN 0.782 9.082 8.300 -0.000 0.000 0.486 85 E N 5.823 125.690 120.200 -0.554 0.000 2.224 85 E HA 0.483 4.829 4.350 -0.008 0.000 0.265 85 E C -1.504 174.648 176.600 -0.747 0.000 0.878 85 E CA -0.923 55.212 56.400 -0.442 0.000 0.759 85 E CB 1.738 31.430 29.700 -0.013 0.000 1.164 85 E HN 0.562 8.922 8.360 -0.000 0.000 0.414 86 V N 3.637 123.242 119.914 -0.515 0.000 2.740 86 V HA 0.103 4.219 4.120 -0.008 0.000 0.303 86 V C 1.208 177.242 176.094 -0.100 0.000 1.054 86 V CA 0.919 63.082 62.300 -0.228 0.000 1.106 86 V CB 0.984 32.785 31.823 -0.037 0.000 0.957 86 V HN 0.991 9.181 8.190 -0.000 0.000 0.486 87 T N -0.850 113.725 114.554 0.035 0.000 3.080 87 T HA 0.282 4.627 4.350 -0.008 0.000 0.280 87 T C 0.107 174.767 174.700 -0.068 0.000 0.926 87 T CA -0.068 62.043 62.100 0.018 0.000 0.883 87 T CB 0.041 68.960 68.868 0.085 0.000 1.194 87 T HN 0.735 8.975 8.240 -0.000 0.000 0.541 88 H N 1.244 120.350 119.070 0.060 0.000 3.008 88 H HA 0.673 5.225 4.556 -0.008 0.000 0.354 88 H C -1.616 173.764 175.328 0.086 0.000 1.252 88 H CA -1.033 55.059 56.048 0.073 0.000 1.117 88 H CB 1.360 31.171 29.762 0.082 0.000 1.857 88 H HN 0.243 8.523 8.280 -0.000 0.000 0.547 89 D N 1.373 121.896 120.400 0.204 0.000 2.248 89 D HA 0.229 4.865 4.640 -0.008 0.000 0.246 89 D C 0.282 176.639 176.300 0.095 0.000 1.027 89 D CA -0.793 53.287 54.000 0.133 0.000 0.853 89 D CB 1.485 42.346 40.800 0.103 0.000 1.243 89 D HN 0.702 9.072 8.370 -0.000 0.000 0.462 90 I N -0.378 120.225 120.570 0.055 0.000 3.621 90 I HA 0.140 4.305 4.170 -0.008 0.000 0.325 90 I C 0.643 176.751 176.117 -0.016 0.000 1.554 90 I CA -0.525 60.800 61.300 0.043 0.000 1.053 90 I CB 0.200 38.212 38.000 0.021 0.000 1.302 90 I HN 0.260 8.470 8.210 -0.000 0.000 0.518 91 T N -0.415 114.130 114.554 -0.015 0.000 3.025 91 T HA -0.091 4.254 4.350 -0.008 0.000 0.270 91 T C 1.731 176.386 174.700 -0.075 0.000 1.126 91 T CA 1.378 63.474 62.100 -0.007 0.000 1.105 91 T CB -0.475 68.411 68.868 0.029 0.000 0.884 91 T HN 0.600 8.840 8.240 -0.000 0.000 0.522 92 R N 0.556 120.936 120.500 -0.199 0.000 2.066 92 R HA 0.051 4.386 4.340 -0.008 0.000 0.232 92 R C 2.077 178.215 176.300 -0.270 0.000 1.131 92 R CA 1.333 57.239 56.100 -0.323 0.000 0.955 92 R CB -1.074 28.906 30.300 -0.534 0.000 0.851 92 R HN 0.447 8.717 8.270 -0.000 0.000 0.432 93 Y N 0.615 120.880 120.300 -0.058 0.000 2.133 93 Y HA -0.012 4.534 4.550 -0.008 0.000 0.287 93 Y C 1.148 176.995 175.900 -0.088 0.000 1.134 93 Y CA 0.488 58.541 58.100 -0.079 0.000 1.133 93 Y CB 0.121 38.519 38.460 -0.103 0.000 0.987 93 Y HN 0.044 8.324 8.280 -0.000 0.000 0.502 94 S N -0.504 115.237 115.700 0.069 0.000 2.557 94 S HA 0.235 4.701 4.470 -0.008 0.000 0.291 94 S C 0.103 174.740 174.600 0.061 0.000 1.116 94 S CA -0.974 57.248 58.200 0.037 0.000 0.992 94 S CB 0.968 64.153 63.200 -0.024 0.000 1.028 94 S HN 0.304 8.614 8.310 -0.000 0.000 0.484 95 K N 2.342 122.772 120.400 0.051 0.000 2.417 95 K HA 0.389 4.704 4.320 -0.008 0.000 0.196 95 K C 0.520 177.154 176.600 0.057 0.000 1.023 95 K CA -0.223 56.093 56.287 0.049 0.000 1.122 95 K CB 0.123 32.636 32.500 0.022 0.000 0.850 95 K HN 0.437 8.687 8.250 -0.000 0.000 0.521 96 A N 2.349 125.222 122.820 0.088 0.000 2.492 96 A HA 0.073 4.388 4.320 -0.008 0.000 0.254 96 A C 0.788 178.376 177.584 0.006 0.000 1.091 96 A CA -0.296 51.745 52.037 0.005 0.000 0.768 96 A CB 0.322 19.282 19.000 -0.067 0.000 1.028 96 A HN 0.312 8.462 8.150 -0.000 0.000 0.498 97 K N 1.963 122.337 120.400 -0.044 0.000 2.052 97 K HA -0.202 4.113 4.320 -0.008 0.000 0.215 97 K C 1.742 178.298 176.600 -0.073 0.000 1.053 97 K CA 1.844 58.114 56.287 -0.028 0.000 0.934 97 K CB -0.494 31.988 32.500 -0.031 0.000 0.717 97 K HN 0.530 8.780 8.250 -0.000 0.000 0.450 98 V N 0.688 120.468 119.914 -0.223 0.000 2.511 98 V HA -0.250 3.865 4.120 -0.008 0.000 0.257 98 V C 1.511 177.480 176.094 -0.208 0.000 1.088 98 V CA 1.835 63.955 62.300 -0.301 0.000 1.098 98 V CB -0.473 30.961 31.823 -0.648 0.000 0.674 98 V HN 0.228 8.418 8.190 -0.000 0.000 0.470 99 F N -0.923 119.040 119.950 0.021 0.000 2.678 99 F HA 0.216 4.738 4.527 -0.007 0.000 0.305 99 F C 1.893 177.723 175.800 0.050 0.000 1.090 99 F CA 0.104 58.149 58.000 0.076 0.000 1.272 99 F CB -0.313 38.722 39.000 0.057 0.000 1.060 99 F HN 0.193 8.493 8.300 -0.000 0.000 0.576 100 E N 1.743 122.054 120.200 0.185 0.000 2.455 100 E HA -0.201 4.144 4.350 -0.008 0.000 0.202 100 E C -0.481 176.256 176.600 0.228 0.000 1.045 100 E CA 1.005 57.511 56.400 0.177 0.000 0.872 100 E CB -0.361 29.437 29.700 0.164 0.000 0.792 100 E HN 0.634 8.994 8.360 -0.000 0.000 0.542 101 H N -2.690 116.443 119.070 0.105 0.000 3.069 101 H HA 0.192 4.743 4.556 -0.008 0.000 0.294 101 H C -0.896 174.467 175.328 0.058 0.000 1.144 101 H CA -0.731 55.357 56.048 0.066 0.000 1.579 101 H CB -0.693 29.092 29.762 0.040 0.000 2.174 101 H HN -0.052 8.228 8.280 -0.000 0.000 0.456 102 I N 3.416 124.044 120.570 0.096 0.000 2.919 102 I HA 0.108 4.273 4.170 -0.008 0.000 0.303 102 I C 1.611 177.724 176.117 -0.007 0.000 1.221 102 I CA 2.295 63.612 61.300 0.028 0.000 1.444 102 I CB 0.184 38.208 38.000 0.038 0.000 1.331 102 I HN 1.201 9.411 8.210 -0.000 0.000 0.572 103 G N 4.998 113.751 108.800 -0.078 0.000 2.258 103 G HA2 -0.281 3.674 3.960 -0.008 0.000 0.233 103 G HA3 -0.281 3.674 3.960 -0.008 0.000 0.233 103 G C 0.531 175.342 174.900 -0.149 0.000 1.006 103 G CA 0.093 45.151 45.100 -0.070 0.000 0.620 103 G HN 0.630 8.920 8.290 -0.000 0.000 0.511 104 K N 1.157 121.353 120.400 -0.339 0.000 2.524 104 K HA 0.320 4.635 4.320 -0.008 0.000 0.279 104 K C 0.302 176.797 176.600 -0.174 0.000 0.993 104 K CA 0.276 56.346 56.287 -0.362 0.000 1.030 104 K CB 0.142 32.321 32.500 -0.534 0.000 0.891 104 K HN 0.350 8.600 8.250 -0.000 0.000 0.488 105 R N 2.451 122.899 120.500 -0.087 0.000 2.480 105 R HA 0.267 4.603 4.340 -0.008 0.000 0.306 105 R C -0.987 175.370 176.300 0.094 0.000 0.958 105 R CA -0.648 55.453 56.100 0.003 0.000 0.861 105 R CB 2.177 32.438 30.300 -0.065 0.000 1.171 105 R HN 0.564 8.834 8.270 -0.000 0.000 0.445 106 T N 4.295 118.982 114.554 0.222 0.000 2.856 106 T HA 0.400 4.745 4.350 -0.008 0.000 0.283 106 T C -2.549 172.347 174.700 0.327 0.000 1.008 106 T CA -1.879 60.375 62.100 0.257 0.000 0.997 106 T CB 2.033 71.093 68.868 0.319 0.000 0.992 106 T HN 0.267 8.507 8.240 -0.000 0.000 0.454 107 P HA 0.438 4.858 4.420 -0.000 0.000 0.275 107 P C -0.746 176.778 177.300 0.372 0.000 1.227 107 P CA -0.474 62.819 63.100 0.322 0.000 0.781 107 P CB 0.271 32.129 31.700 0.264 0.000 0.906 108 I N -1.287 119.443 120.570 0.267 0.000 2.865 108 I HA 0.898 5.063 4.170 -0.008 0.000 0.302 108 I C -1.297 174.867 176.117 0.078 0.000 1.140 108 I CA -1.468 59.858 61.300 0.044 0.000 1.021 108 I CB 2.495 40.321 38.000 -0.290 0.000 1.233 108 I HN 0.277 8.487 8.210 -0.000 0.000 0.427 109 A N 4.235 127.025 122.820 -0.049 0.000 2.322 109 A HA 0.957 5.272 4.320 -0.008 0.000 0.327 109 A C -0.956 176.411 177.584 -0.362 0.000 1.134 109 A CA -0.726 51.144 52.037 -0.279 0.000 0.831 109 A CB 1.861 20.790 19.000 -0.120 0.000 1.288 109 A HN 0.732 8.882 8.150 -0.000 0.000 0.472 110 V N 0.644 120.275 119.914 -0.472 0.000 2.817 110 V HA 0.508 4.623 4.120 -0.008 0.000 0.303 110 V C -0.465 175.264 176.094 -0.609 0.000 1.151 110 V CA -0.543 61.422 62.300 -0.558 0.000 0.929 110 V CB 1.888 33.311 31.823 -0.666 0.000 1.030 110 V HN 0.967 9.157 8.190 -0.000 0.000 0.427 111 R N 2.550 122.657 120.500 -0.654 0.000 2.534 111 R HA 0.748 5.083 4.340 -0.008 0.000 0.301 111 R C -1.560 174.255 176.300 -0.807 0.000 0.961 111 R CA -0.463 55.335 56.100 -0.503 0.000 0.871 111 R CB 1.614 31.815 30.300 -0.165 0.000 1.170 111 R HN 0.586 8.856 8.270 -0.000 0.000 0.446 112 F N 1.128 120.827 119.950 -0.418 0.000 2.440 112 F HA 0.554 5.076 4.527 -0.007 0.000 0.328 112 F C 0.496 176.104 175.800 -0.319 0.000 1.070 112 F CA -0.093 57.560 58.000 -0.578 0.000 1.011 112 F CB 2.090 40.313 39.000 -1.295 0.000 1.226 112 F HN 0.581 8.881 8.300 -0.000 0.000 0.491 113 S N -1.264 114.457 115.700 0.035 0.000 2.627 113 S HA 0.546 5.011 4.470 -0.008 0.000 0.268 113 S C -0.724 173.999 174.600 0.205 0.000 1.130 113 S CA -0.867 57.431 58.200 0.163 0.000 0.819 113 S CB 1.122 64.464 63.200 0.237 0.000 1.100 113 S HN 0.742 9.052 8.310 -0.000 0.000 0.465 114 T N -1.401 113.246 114.554 0.155 0.000 2.920 114 T HA 0.734 5.079 4.350 -0.008 0.000 0.292 114 T C 0.873 175.500 174.700 -0.122 0.000 1.093 114 T CA 0.030 62.177 62.100 0.078 0.000 0.944 114 T CB 0.250 69.170 68.868 0.087 0.000 1.605 114 T HN 0.814 9.054 8.240 -0.000 0.000 0.590 115 V N -0.575 119.229 119.914 -0.184 0.000 3.090 115 V HA 0.397 4.512 4.120 -0.008 0.000 0.237 115 V C 2.512 178.495 176.094 -0.185 0.000 1.209 115 V CA 0.647 62.715 62.300 -0.386 0.000 1.209 115 V CB -0.570 31.116 31.823 -0.229 0.000 0.971 115 V HN 0.998 9.188 8.190 -0.000 0.000 0.477 116 A N 0.468 123.222 122.820 -0.111 0.000 1.993 116 A HA 0.496 4.811 4.320 -0.008 0.000 0.207 116 A C 1.579 179.107 177.584 -0.093 0.000 1.224 116 A CA 0.784 52.744 52.037 -0.127 0.000 0.749 116 A CB -0.629 18.271 19.000 -0.167 0.000 0.884 116 A HN 0.524 8.674 8.150 -0.000 0.000 0.467 117 G N 1.283 110.050 108.800 -0.055 0.000 2.484 117 G HA2 0.385 4.340 3.960 -0.008 0.000 0.235 117 G HA3 0.385 4.340 3.960 -0.008 0.000 0.235 117 G C 0.042 174.936 174.900 -0.009 0.000 1.282 117 G CA -0.243 44.839 45.100 -0.029 0.000 0.857 117 G HN 0.516 8.806 8.290 -0.000 0.000 0.571 118 E N 1.334 121.531 120.200 -0.005 0.000 2.622 118 E HA 0.150 4.496 4.350 -0.008 0.000 0.255 118 E C 1.182 177.806 176.600 0.040 0.000 1.313 118 E CA -0.563 55.846 56.400 0.015 0.000 1.011 118 E CB 0.373 30.078 29.700 0.007 0.000 1.173 118 E HN 0.289 8.649 8.360 -0.000 0.000 0.601 119 S N -0.139 115.593 115.700 0.053 0.000 2.440 119 S HA -0.083 4.382 4.470 -0.008 0.000 0.238 119 S C 1.448 176.079 174.600 0.052 0.000 1.010 119 S CA 1.255 59.495 58.200 0.066 0.000 0.972 119 S CB -0.277 62.966 63.200 0.071 0.000 0.774 119 S HN 0.699 9.009 8.310 -0.000 0.000 0.501 120 G N 1.123 109.947 108.800 0.040 0.000 3.337 120 G HA2 0.239 4.194 3.960 -0.008 0.000 0.246 120 G HA3 0.239 4.194 3.960 -0.008 0.000 0.246 120 G C 0.435 175.356 174.900 0.036 0.000 1.131 120 G CA 0.041 45.162 45.100 0.034 0.000 0.773 120 G HN 0.526 8.816 8.290 -0.000 0.000 0.544 121 S N 0.055 115.779 115.700 0.039 0.000 2.612 121 S HA 0.601 5.066 4.470 -0.008 0.000 0.253 121 S C 0.485 175.116 174.600 0.051 0.000 1.346 121 S CA 0.081 58.304 58.200 0.038 0.000 0.976 121 S CB 1.204 64.422 63.200 0.029 0.000 0.949 121 S HN 0.687 8.996 8.310 -0.000 0.000 0.584 122 A N 0.004 122.854 122.820 0.050 0.000 2.306 122 A HA 0.491 4.807 4.320 -0.008 0.000 0.314 122 A C 0.545 178.172 177.584 0.072 0.000 1.164 122 A CA -0.693 51.379 52.037 0.058 0.000 0.822 122 A CB 0.253 19.282 19.000 0.048 0.000 1.130 122 A HN 0.805 8.955 8.150 -0.000 0.000 0.496 123 D N 0.906 121.362 120.400 0.093 0.000 2.097 123 D HA -0.084 4.551 4.640 -0.008 0.000 0.195 123 D C 1.298 177.655 176.300 0.096 0.000 0.989 123 D CA 2.320 56.395 54.000 0.125 0.000 0.827 123 D CB -0.128 40.770 40.800 0.164 0.000 0.966 123 D HN 0.637 9.007 8.370 -0.000 0.000 0.456 124 T N -0.116 114.465 114.554 0.045 0.000 4.058 124 T HA 0.368 4.713 4.350 -0.008 0.000 0.252 124 T C 0.334 175.037 174.700 0.004 0.000 1.264 124 T CA -0.650 61.445 62.100 -0.009 0.000 1.094 124 T CB -0.609 68.177 68.868 -0.137 0.000 1.316 124 T HN -0.025 8.215 8.240 -0.000 0.000 0.872 125 V N -0.596 119.339 119.914 0.035 0.000 2.815 125 V HA 0.673 4.788 4.120 -0.008 0.000 0.314 125 V C 0.085 176.202 176.094 0.038 0.000 1.064 125 V CA -1.874 60.448 62.300 0.036 0.000 0.952 125 V CB 1.831 33.678 31.823 0.039 0.000 1.020 125 V HN 0.612 8.802 8.190 -0.000 0.000 0.439 126 R N 2.335 122.851 120.500 0.027 0.000 2.421 126 R HA 0.494 4.829 4.340 -0.008 0.000 0.305 126 R C -0.927 175.376 176.300 0.004 0.000 1.039 126 R CA 0.503 56.601 56.100 -0.003 0.000 1.003 126 R CB -0.026 30.237 30.300 -0.061 0.000 0.959 126 R HN 1.032 9.302 8.270 -0.000 0.000 0.427 127 D N 3.806 124.228 120.400 0.036 0.000 2.766 127 D HA 0.261 4.896 4.640 -0.008 0.000 0.244 127 D C -2.789 173.589 176.300 0.129 0.000 1.198 127 D CA -1.167 52.880 54.000 0.079 0.000 0.739 127 D CB 1.788 42.623 40.800 0.059 0.000 1.379 127 D HN 0.267 8.637 8.370 -0.000 0.000 0.437 128 P HA 0.385 4.805 4.420 -0.000 0.000 0.273 128 P C -0.984 176.440 177.300 0.206 0.000 1.258 128 P CA -0.152 63.084 63.100 0.226 0.000 0.802 128 P CB 0.423 32.329 31.700 0.344 0.000 1.040 129 R N -0.808 119.835 120.500 0.240 0.000 2.510 129 R HA 0.540 4.876 4.340 -0.008 0.000 0.287 129 R C -0.320 176.159 176.300 0.297 0.000 1.084 129 R CA -0.302 55.952 56.100 0.256 0.000 0.934 129 R CB 1.148 31.603 30.300 0.258 0.000 1.201 129 R HN 0.624 8.894 8.270 -0.000 0.000 0.431 130 G N 1.959 110.968 108.800 0.349 0.000 2.441 130 G HA2 0.311 4.267 3.960 -0.008 0.000 0.243 130 G HA3 0.311 4.267 3.960 -0.008 0.000 0.243 130 G C -1.044 173.933 174.900 0.129 0.000 1.281 130 G CA 0.226 45.475 45.100 0.249 0.000 0.854 130 G HN 0.437 8.727 8.290 -0.000 0.000 0.560 131 F N 2.442 122.268 119.950 -0.208 0.000 2.971 131 F HA 0.582 5.104 4.527 -0.009 0.000 0.373 131 F C 0.052 175.532 175.800 -0.533 0.000 1.288 131 F CA -1.841 55.928 58.000 -0.386 0.000 1.204 131 F CB 0.525 39.403 39.000 -0.204 0.000 1.852 131 F HN 0.677 8.977 8.300 -0.000 0.000 0.624 132 A N 3.248 125.798 122.820 -0.450 0.000 2.309 132 A HA 0.776 5.092 4.320 -0.008 0.000 0.298 132 A C -1.145 175.878 177.584 -0.936 0.000 1.165 132 A CA -0.437 51.045 52.037 -0.925 0.000 0.821 132 A CB 0.999 18.922 19.000 -1.795 0.000 1.102 132 A HN 0.358 8.508 8.150 -0.000 0.000 0.500 133 V N 2.926 122.321 119.914 -0.866 0.000 2.483 133 V HA 0.406 4.521 4.120 -0.008 0.000 0.297 133 V C -0.008 175.627 176.094 -0.765 0.000 1.027 133 V CA -0.688 61.100 62.300 -0.854 0.000 0.855 133 V CB 1.506 32.629 31.823 -1.166 0.000 0.995 133 V HN 0.934 9.124 8.190 -0.000 0.000 0.424 134 K N 4.124 124.225 120.400 -0.498 0.000 2.235 134 K HA 0.657 4.973 4.320 -0.008 0.000 0.266 134 K C -1.645 174.503 176.600 -0.753 0.000 0.980 134 K CA -0.455 55.524 56.287 -0.514 0.000 0.849 134 K CB 1.011 33.208 32.500 -0.505 0.000 1.098 134 K HN 0.482 8.732 8.250 -0.000 0.000 0.445 135 F N 3.627 123.236 119.950 -0.568 0.000 2.458 135 F HA 0.306 4.828 4.527 -0.008 0.000 0.336 135 F C -0.606 174.989 175.800 -0.340 0.000 1.114 135 F CA -0.724 57.055 58.000 -0.368 0.000 0.987 135 F CB 1.086 39.907 39.000 -0.297 0.000 1.130 135 F HN 0.422 8.722 8.300 -0.000 0.000 0.458 136 Y N 1.588 121.918 120.300 0.049 0.000 2.751 136 Y HA 0.292 4.836 4.550 -0.009 0.000 0.333 136 Y C 0.863 176.712 175.900 -0.086 0.000 1.122 136 Y CA -0.880 57.157 58.100 -0.105 0.000 1.367 136 Y CB 0.290 38.547 38.460 -0.339 0.000 1.242 136 Y HN 0.605 8.885 8.280 -0.000 0.000 0.505 137 T N -2.010 112.585 114.554 0.069 0.000 2.849 137 T HA 0.202 4.547 4.350 -0.008 0.000 0.276 137 T C 0.953 175.647 174.700 -0.010 0.000 0.971 137 T CA -0.552 61.565 62.100 0.028 0.000 0.949 137 T CB 1.107 69.971 68.868 -0.006 0.000 1.093 137 T HN 0.477 8.717 8.240 -0.000 0.000 0.545 138 E N -0.229 119.961 120.200 -0.017 0.000 2.385 138 E HA 0.131 4.476 4.350 -0.008 0.000 0.194 138 E C 0.677 177.264 176.600 -0.021 0.000 1.013 138 E CA 0.380 56.769 56.400 -0.020 0.000 0.866 138 E CB 0.071 29.765 29.700 -0.009 0.000 0.832 138 E HN 0.549 8.909 8.360 -0.000 0.000 0.500 139 D N 0.430 120.814 120.400 -0.026 0.000 2.460 139 D HA 0.277 4.912 4.640 -0.008 0.000 0.229 139 D C 0.462 176.750 176.300 -0.020 0.000 1.170 139 D CA 0.569 54.553 54.000 -0.027 0.000 0.827 139 D CB 0.183 40.958 40.800 -0.043 0.000 0.973 139 D HN 0.163 8.533 8.370 -0.000 0.000 0.496 140 G N 0.762 109.553 108.800 -0.016 0.000 2.685 140 G HA2 -0.236 3.719 3.960 -0.008 0.000 0.387 140 G HA3 -0.236 3.719 3.960 -0.008 0.000 0.387 140 G C -0.276 174.624 174.900 0.001 0.000 1.324 140 G CA -1.036 44.057 45.100 -0.011 0.000 0.878 140 G HN 0.176 8.466 8.290 -0.000 0.000 0.527 141 N N -0.687 118.003 118.700 -0.017 0.000 2.482 141 N HA 0.498 5.233 4.740 -0.008 0.000 0.260 141 N C -0.453 175.095 175.510 0.062 0.000 1.236 141 N CA 0.365 53.385 53.050 -0.051 0.000 0.938 141 N CB 0.803 39.188 38.487 -0.170 0.000 1.128 141 N HN 0.788 9.168 8.380 -0.000 0.000 0.448 142 W N 2.512 123.730 121.300 -0.136 0.000 2.587 142 W HA 0.368 5.023 4.660 -0.008 0.000 0.324 142 W C -1.617 174.865 176.519 -0.062 0.000 1.008 142 W CA -0.785 56.483 57.345 -0.128 0.000 1.265 142 W CB 0.644 29.964 29.460 -0.233 0.000 1.328 142 W HN 0.339 8.519 8.180 -0.000 0.000 0.432 143 D N 5.471 125.712 120.400 -0.265 0.000 2.168 143 D HA 0.298 4.933 4.640 -0.008 0.000 0.246 143 D C -0.953 175.002 176.300 -0.575 0.000 1.050 143 D CA -0.473 53.292 54.000 -0.391 0.000 0.857 143 D CB 2.529 43.247 40.800 -0.136 0.000 1.169 143 D HN 0.473 8.843 8.370 -0.000 0.000 0.453 144 L N 2.886 123.672 121.223 -0.729 0.000 2.387 144 L HA 0.208 4.543 4.340 -0.008 0.000 0.259 144 L C -1.056 175.493 176.870 -0.535 0.000 1.050 144 L CA -0.590 53.840 54.840 -0.682 0.000 0.922 144 L CB 1.072 42.563 42.059 -0.946 0.000 1.280 144 L HN 0.080 8.310 8.230 -0.000 0.000 0.449 145 V N 4.727 124.403 119.914 -0.396 0.000 2.276 145 V HA 0.513 4.628 4.120 -0.008 0.000 0.249 145 V C 1.139 177.079 176.094 -0.258 0.000 1.160 145 V CA 0.112 62.176 62.300 -0.393 0.000 1.042 145 V CB -0.328 31.252 31.823 -0.405 0.000 1.224 145 V HN 0.761 8.951 8.190 -0.000 0.000 0.496 146 G N 3.072 111.727 108.800 -0.243 0.000 2.552 146 G HA2 0.555 4.510 3.960 -0.008 0.000 0.318 146 G HA3 0.555 4.510 3.960 -0.008 0.000 0.318 146 G C -0.619 174.223 174.900 -0.098 0.000 1.240 146 G CA -0.578 44.445 45.100 -0.128 0.000 1.002 146 G HN 0.484 8.774 8.290 -0.000 0.000 0.493 147 N N -1.710 116.966 118.700 -0.042 0.000 2.653 147 N HA 0.187 4.923 4.740 -0.008 0.000 0.294 147 N C 0.504 176.077 175.510 0.105 0.000 1.305 147 N CA -0.651 52.443 53.050 0.074 0.000 0.827 147 N CB 1.570 40.101 38.487 0.074 0.000 1.415 147 N HN 0.657 9.037 8.380 -0.000 0.000 0.546 148 N N -2.031 116.789 118.700 0.200 0.000 2.313 148 N HA 0.026 4.762 4.740 -0.008 0.000 0.207 148 N C -0.375 175.354 175.510 0.366 0.000 1.141 148 N CA -0.139 53.071 53.050 0.267 0.000 0.830 148 N CB 0.508 39.163 38.487 0.280 0.000 1.008 148 N HN 0.208 8.588 8.380 -0.000 0.000 0.481 149 T N 0.407 115.087 114.554 0.211 0.000 2.876 149 T HA 0.329 4.674 4.350 -0.008 0.000 0.289 149 T C -2.197 172.312 174.700 -0.318 0.000 1.014 149 T CA -2.218 59.858 62.100 -0.039 0.000 0.986 149 T CB 1.859 70.724 68.868 -0.004 0.000 1.021 149 T HN -0.094 8.146 8.240 -0.000 0.000 0.458 150 P HA 0.169 4.589 4.420 -0.000 0.000 0.236 150 P C 0.483 177.519 177.300 -0.441 0.000 1.177 150 P CA 0.306 62.989 63.100 -0.696 0.000 0.773 150 P CB 0.005 31.136 31.700 -0.949 0.000 0.878 151 I N -5.626 114.689 120.570 -0.425 0.000 3.690 151 I HA 0.699 4.864 4.170 -0.008 0.000 0.280 151 I C -0.512 175.441 176.117 -0.273 0.000 1.145 151 I CA -1.451 59.585 61.300 -0.439 0.000 1.144 151 I CB 1.167 38.721 38.000 -0.744 0.000 1.378 151 I HN -0.256 7.954 8.210 -0.000 0.000 0.478 152 F N -1.538 118.098 119.950 -0.524 0.000 2.985 152 F HA 0.418 4.940 4.527 -0.008 0.000 0.322 152 F C -0.428 175.052 175.800 -0.533 0.000 1.187 152 F CA -0.769 56.929 58.000 -0.505 0.000 0.910 152 F CB 1.511 40.362 39.000 -0.248 0.000 1.411 152 F HN 0.363 8.663 8.300 -0.000 0.000 0.492 153 F N 1.989 121.405 119.950 -0.890 0.000 2.456 153 F HA 0.171 4.693 4.527 -0.008 0.000 0.298 153 F C 0.445 176.018 175.800 -0.378 0.000 1.104 153 F CA 0.728 58.282 58.000 -0.744 0.000 1.435 153 F CB -0.021 38.282 39.000 -1.162 0.000 1.078 153 F HN 0.092 8.392 8.300 -0.000 0.000 0.546 154 I N -2.574 118.002 120.570 0.010 0.000 2.894 154 I HA 0.452 4.617 4.170 -0.008 0.000 0.302 154 I C 0.077 176.286 176.117 0.152 0.000 1.188 154 I CA -1.147 60.224 61.300 0.117 0.000 1.014 154 I CB 2.363 40.493 38.000 0.216 0.000 1.242 154 I HN -0.179 8.031 8.210 -0.000 0.000 0.430 155 R N 0.254 120.820 120.500 0.111 0.000 2.397 155 R HA 0.362 4.697 4.340 -0.008 0.000 0.241 155 R C -0.465 175.903 176.300 0.113 0.000 0.914 155 R CA -0.263 55.898 56.100 0.101 0.000 1.071 155 R CB 0.213 30.552 30.300 0.066 0.000 1.116 155 R HN 0.603 8.873 8.270 -0.000 0.000 0.524 156 D N 0.133 120.616 120.400 0.138 0.000 2.696 156 D HA 0.298 4.933 4.640 -0.008 0.000 0.251 156 D C 0.487 176.883 176.300 0.161 0.000 1.188 156 D CA -0.402 53.672 54.000 0.124 0.000 0.876 156 D CB 1.994 42.857 40.800 0.105 0.000 1.334 156 D HN 0.009 8.379 8.370 -0.000 0.000 0.540 157 A N 3.971 126.867 122.820 0.125 0.000 1.948 157 A HA -0.191 4.124 4.320 -0.008 0.000 0.220 157 A C 1.947 179.650 177.584 0.197 0.000 1.177 157 A CA 0.868 52.991 52.037 0.143 0.000 0.636 157 A CB -0.345 18.692 19.000 0.062 0.000 0.815 157 A HN 0.575 8.725 8.150 -0.000 0.000 0.449 158 L N -0.194 121.115 121.223 0.143 0.000 2.197 158 L HA -0.166 4.169 4.340 -0.008 0.000 0.215 158 L C 1.992 178.958 176.870 0.160 0.000 1.095 158 L CA 1.592 56.506 54.840 0.123 0.000 0.764 158 L CB -0.646 41.461 42.059 0.081 0.000 0.897 158 L HN 0.497 8.727 8.230 -0.000 0.000 0.436 159 L N -3.350 118.007 121.223 0.225 0.000 2.592 159 L HA -0.066 4.270 4.340 -0.008 0.000 0.227 159 L C 2.224 179.287 176.870 0.322 0.000 1.127 159 L CA 0.210 55.222 54.840 0.287 0.000 0.884 159 L CB -0.801 41.473 42.059 0.358 0.000 1.065 159 L HN 0.145 8.375 8.230 -0.000 0.000 0.457 160 F N 2.842 122.893 119.950 0.169 0.000 2.084 160 F HA -0.061 4.459 4.527 -0.011 0.000 0.296 160 F C -0.232 175.579 175.800 0.019 0.000 1.111 160 F CA 1.625 59.739 58.000 0.190 0.000 1.224 160 F CB -0.987 38.130 39.000 0.195 0.000 0.991 160 F HN 0.030 8.330 8.300 -0.000 0.000 0.471 161 P HA -0.229 4.191 4.420 -0.000 0.000 0.216 161 P C 1.841 178.735 177.300 -0.677 0.000 1.167 161 P CA 2.709 65.537 63.100 -0.453 0.000 0.914 161 P CB -0.153 31.361 31.700 -0.310 0.000 0.793 162 S N -1.549 113.887 115.700 -0.441 0.000 2.359 162 S HA -0.207 4.259 4.470 -0.008 0.000 0.224 162 S C 1.636 175.783 174.600 -0.756 0.000 1.035 162 S CA 1.300 59.240 58.200 -0.432 0.000 1.018 162 S CB -1.314 61.803 63.200 -0.138 0.000 0.876 162 S HN 0.174 8.484 8.310 -0.000 0.000 0.448 163 F N 2.328 121.709 119.950 -0.947 0.000 2.027 163 F HA -0.233 4.290 4.527 -0.008 0.000 0.297 163 F C 1.987 177.289 175.800 -0.830 0.000 1.129 163 F CA 1.588 58.903 58.000 -1.142 0.000 1.195 163 F CB -0.227 38.466 39.000 -0.512 0.000 0.960 163 F HN 0.098 8.398 8.300 -0.000 0.000 0.485 164 I N 0.497 120.397 120.570 -1.116 0.000 2.179 164 I HA -0.311 3.855 4.170 -0.008 0.000 0.242 164 I C 2.425 178.179 176.117 -0.605 0.000 1.088 164 I CA 1.850 62.576 61.300 -0.955 0.000 1.357 164 I CB -1.892 35.628 38.000 -0.801 0.000 1.051 164 I HN 0.367 8.577 8.210 -0.000 0.000 0.409 165 H N 0.940 119.672 119.070 -0.564 0.000 2.255 165 H HA -0.219 4.331 4.556 -0.010 0.000 0.290 165 H C 2.416 177.455 175.328 -0.482 0.000 1.087 165 H CA 1.982 57.778 56.048 -0.420 0.000 1.213 165 H CB -0.131 29.442 29.762 -0.315 0.000 1.349 165 H HN 0.389 8.669 8.280 -0.000 0.000 0.487 166 S N 0.488 115.915 115.700 -0.455 0.000 2.500 166 S HA -0.131 4.334 4.470 -0.008 0.000 0.239 166 S C 1.720 175.964 174.600 -0.592 0.000 0.989 166 S CA 0.935 58.836 58.200 -0.499 0.000 0.951 166 S CB 0.062 62.921 63.200 -0.568 0.000 0.759 166 S HN 0.380 8.690 8.310 -0.000 0.000 0.523 167 Q N 0.150 119.531 119.800 -0.697 0.000 2.396 167 Q HA 0.258 4.593 4.340 -0.008 0.000 0.209 167 Q C 0.718 176.466 176.000 -0.420 0.000 0.906 167 Q CA 0.457 55.868 55.803 -0.654 0.000 0.927 167 Q CB 0.171 28.420 28.738 -0.815 0.000 1.069 167 Q HN 0.495 8.765 8.270 -0.000 0.000 0.523 168 K N 0.829 121.003 120.400 -0.377 0.000 2.711 168 K HA 0.336 4.651 4.320 -0.008 0.000 0.305 168 K C 0.562 177.003 176.600 -0.266 0.000 0.974 168 K CA -0.256 55.858 56.287 -0.288 0.000 1.394 168 K CB 0.070 32.416 32.500 -0.256 0.000 1.670 168 K HN -0.076 8.174 8.250 -0.000 0.000 0.748 169 R N 0.616 120.956 120.500 -0.267 0.000 2.732 169 R HA 0.259 4.594 4.340 -0.008 0.000 0.278 169 R C -0.198 175.979 176.300 -0.204 0.000 0.976 169 R CA -0.780 55.167 56.100 -0.255 0.000 0.963 169 R CB 0.755 30.814 30.300 -0.401 0.000 1.150 169 R HN 0.474 8.744 8.270 -0.000 0.000 0.478 170 N N 1.799 120.410 118.700 -0.149 0.000 2.412 170 N HA -0.020 4.716 4.740 -0.008 0.000 0.258 170 N C -1.695 173.769 175.510 -0.076 0.000 1.236 170 N CA -1.046 51.942 53.050 -0.104 0.000 0.882 170 N CB 0.791 39.237 38.487 -0.067 0.000 1.066 170 N HN 0.280 8.660 8.380 -0.000 0.000 0.465 171 P HA -0.218 4.202 4.420 -0.000 0.000 0.218 171 P C 0.616 177.901 177.300 -0.025 0.000 1.146 171 P CA 1.260 64.320 63.100 -0.067 0.000 0.813 171 P CB 0.196 31.842 31.700 -0.089 0.000 0.778 172 Q N -1.727 118.059 119.800 -0.022 0.000 2.200 172 Q HA -0.007 4.329 4.340 -0.008 0.000 0.197 172 Q C 1.755 177.758 176.000 0.005 0.000 0.953 172 Q CA 1.220 57.016 55.803 -0.012 0.000 0.851 172 Q CB -0.207 28.522 28.738 -0.015 0.000 0.938 172 Q HN 0.041 8.311 8.270 -0.000 0.000 0.488 173 T N -1.006 113.554 114.554 0.011 0.000 3.009 173 T HA -0.034 4.312 4.350 -0.008 0.000 0.258 173 T C -0.088 174.667 174.700 0.092 0.000 1.063 173 T CA 0.958 63.073 62.100 0.025 0.000 1.139 173 T CB -0.067 68.801 68.868 0.000 0.000 0.890 173 T HN 0.522 8.762 8.240 -0.000 0.000 0.471 174 H N -0.615 118.419 119.070 -0.060 0.000 3.237 174 H HA -0.110 4.440 4.556 -0.009 0.000 0.231 174 H C -0.448 174.844 175.328 -0.059 0.000 1.148 174 H CA 0.255 56.266 56.048 -0.062 0.000 1.155 174 H CB -2.074 27.658 29.762 -0.051 0.000 1.210 174 H HN 0.293 8.573 8.280 -0.000 0.000 0.317 175 L N 0.124 121.322 121.223 -0.042 0.000 2.387 175 L HA 0.415 4.750 4.340 -0.008 0.000 0.266 175 L C 0.747 177.548 176.870 -0.115 0.000 1.059 175 L CA -1.150 53.646 54.840 -0.072 0.000 0.801 175 L CB 0.780 42.817 42.059 -0.037 0.000 1.223 175 L HN -0.110 8.120 8.230 -0.000 0.000 0.456 176 K N 1.103 121.438 120.400 -0.109 0.000 2.322 176 K HA 0.219 4.534 4.320 -0.008 0.000 0.283 176 K C -0.810 175.737 176.600 -0.088 0.000 1.042 176 K CA 0.035 56.255 56.287 -0.112 0.000 0.958 176 K CB 0.340 32.790 32.500 -0.084 0.000 0.984 176 K HN 0.334 8.584 8.250 -0.000 0.000 0.473 177 D N 3.597 123.939 120.400 -0.096 0.000 2.620 177 D HA 0.275 4.910 4.640 -0.008 0.000 0.252 177 D C -2.196 174.074 176.300 -0.050 0.000 1.207 177 D CA -2.228 51.729 54.000 -0.072 0.000 0.884 177 D CB 1.787 42.536 40.800 -0.084 0.000 1.262 177 D HN 0.122 8.492 8.370 -0.000 0.000 0.552 178 P HA 0.051 4.471 4.420 -0.000 0.000 0.233 178 P C 0.427 177.811 177.300 0.139 0.000 1.167 178 P CA 0.452 63.626 63.100 0.123 0.000 0.770 178 P CB 0.676 32.425 31.700 0.082 0.000 0.837 179 D N -1.403 119.015 120.400 0.031 0.000 2.162 179 D HA 0.010 4.645 4.640 -0.008 0.000 0.205 179 D C 1.946 178.236 176.300 -0.017 0.000 0.964 179 D CA 1.127 55.122 54.000 -0.007 0.000 0.847 179 D CB -0.424 40.354 40.800 -0.037 0.000 0.988 179 D HN 0.097 8.467 8.370 -0.000 0.000 0.480 180 M N -0.144 119.422 119.600 -0.057 0.000 2.077 180 M HA -0.118 4.357 4.480 -0.008 0.000 0.261 180 M C 2.250 178.425 176.300 -0.208 0.000 1.070 180 M CA 0.880 56.112 55.300 -0.113 0.000 1.125 180 M CB -0.347 32.162 32.600 -0.152 0.000 1.339 180 M HN -0.111 8.179 8.290 -0.000 0.000 0.409 181 V N -0.304 119.429 119.914 -0.300 0.000 2.219 181 V HA -0.304 3.811 4.120 -0.008 0.000 0.248 181 V C 1.903 177.614 176.094 -0.639 0.000 1.053 181 V CA 2.335 64.224 62.300 -0.685 0.000 1.009 181 V CB -0.872 30.549 31.823 -0.669 0.000 0.636 181 V HN 0.582 8.772 8.190 -0.000 0.000 0.445 182 W N -0.336 120.896 121.300 -0.113 0.000 2.436 182 W HA -0.068 4.589 4.660 -0.006 0.000 0.284 182 W C 2.319 178.836 176.519 -0.004 0.000 1.225 182 W CA 0.802 58.166 57.345 0.032 0.000 1.271 182 W CB -0.303 29.203 29.460 0.076 0.000 1.114 182 W HN 0.303 8.483 8.180 -0.000 0.000 0.559 183 D N 0.137 120.611 120.400 0.124 0.000 2.120 183 D HA -0.284 4.351 4.640 -0.008 0.000 0.191 183 D C 1.799 178.170 176.300 0.118 0.000 0.994 183 D CA 1.696 55.739 54.000 0.072 0.000 0.838 183 D CB -0.742 40.081 40.800 0.038 0.000 0.976 183 D HN 0.052 8.422 8.370 -0.000 0.000 0.447 184 F N -0.085 119.827 119.950 -0.063 0.000 2.024 184 F HA -0.302 4.222 4.527 -0.006 0.000 0.296 184 F C 2.175 178.030 175.800 0.091 0.000 1.137 184 F CA 2.015 59.992 58.000 -0.039 0.000 1.200 184 F CB -0.387 38.511 39.000 -0.170 0.000 0.954 184 F HN 0.144 8.444 8.300 -0.000 0.000 0.497 185 W N 0.651 121.936 121.300 -0.025 0.000 2.308 185 W HA -0.246 4.410 4.660 -0.007 0.000 0.301 185 W C 3.017 179.468 176.519 -0.113 0.000 1.220 185 W CA 1.950 59.220 57.345 -0.125 0.000 1.240 185 W CB -1.775 27.541 29.460 -0.240 0.000 1.142 185 W HN 0.282 8.462 8.180 -0.000 0.000 0.521 186 S N -1.502 114.328 115.700 0.218 0.000 2.501 186 S HA -0.012 4.454 4.470 -0.008 0.000 0.220 186 S C 1.672 176.268 174.600 -0.007 0.000 0.997 186 S CA 0.575 58.835 58.200 0.101 0.000 0.919 186 S CB -0.316 62.975 63.200 0.152 0.000 0.778 186 S HN 0.061 8.371 8.310 -0.000 0.000 0.523 187 L N 0.906 122.102 121.223 -0.046 0.000 2.513 187 L HA 0.496 4.831 4.340 -0.008 0.000 0.222 187 L C 0.146 176.914 176.870 -0.170 0.000 1.096 187 L CA 0.437 55.224 54.840 -0.089 0.000 0.857 187 L CB 0.093 42.112 42.059 -0.067 0.000 1.026 187 L HN 0.110 8.340 8.230 -0.000 0.000 0.469 188 R N 0.026 120.384 120.500 -0.237 0.000 2.576 188 R HA 0.354 4.689 4.340 -0.008 0.000 0.283 188 R C -2.219 173.974 176.300 -0.177 0.000 1.493 188 R CA -1.455 54.488 56.100 -0.262 0.000 1.170 188 R CB 0.772 30.766 30.300 -0.510 0.000 1.189 188 R HN -0.064 8.206 8.270 -0.000 0.000 0.542 189 P HA -0.017 4.403 4.420 -0.000 0.000 0.255 189 P C 0.692 177.907 177.300 -0.142 0.000 1.248 189 P CA 0.297 63.304 63.100 -0.155 0.000 0.807 189 P CB 0.482 32.092 31.700 -0.150 0.000 1.150 190 E N 1.052 121.182 120.200 -0.116 0.000 2.396 190 E HA -0.127 4.218 4.350 -0.008 0.000 0.200 190 E C 1.374 177.899 176.600 -0.125 0.000 1.023 190 E CA 1.285 57.625 56.400 -0.101 0.000 0.857 190 E CB -0.698 28.960 29.700 -0.070 0.000 0.775 190 E HN 0.282 8.642 8.360 -0.000 0.000 0.525 191 S N 0.042 115.655 115.700 -0.144 0.000 2.593 191 S HA 0.093 4.558 4.470 -0.008 0.000 0.217 191 S C 1.874 176.325 174.600 -0.250 0.000 0.966 191 S CA -0.300 57.801 58.200 -0.165 0.000 0.914 191 S CB -0.268 62.852 63.200 -0.133 0.000 0.776 191 S HN 0.237 8.547 8.310 -0.000 0.000 0.523 192 L N 0.569 121.664 121.223 -0.214 0.000 2.156 192 L HA -0.008 4.327 4.340 -0.008 0.000 0.208 192 L C 2.714 179.554 176.870 -0.050 0.000 1.095 192 L CA 1.571 56.321 54.840 -0.149 0.000 0.770 192 L CB -0.510 41.465 42.059 -0.140 0.000 0.914 192 L HN 0.535 8.765 8.230 -0.000 0.000 0.439 193 H N -0.878 118.025 119.070 -0.278 0.000 2.270 193 H HA -0.261 4.291 4.556 -0.008 0.000 0.299 193 H C 2.305 177.213 175.328 -0.701 0.000 1.077 193 H CA 1.742 57.529 56.048 -0.436 0.000 1.294 193 H CB 0.414 29.888 29.762 -0.480 0.000 1.371 193 H HN 0.207 8.487 8.280 -0.000 0.000 0.491 194 Q N 0.331 119.713 119.800 -0.697 0.000 2.212 194 Q HA -0.041 4.294 4.340 -0.008 0.000 0.199 194 Q C 2.289 178.014 176.000 -0.460 0.000 0.950 194 Q CA 1.069 56.340 55.803 -0.887 0.000 0.863 194 Q CB -0.158 27.829 28.738 -1.252 0.000 0.944 194 Q HN 0.322 8.592 8.270 -0.000 0.000 0.465 195 V N 0.403 120.156 119.914 -0.269 0.000 2.469 195 V HA -0.256 3.859 4.120 -0.008 0.000 0.251 195 V C 2.085 178.356 176.094 0.295 0.000 1.064 195 V CA 1.992 64.268 62.300 -0.040 0.000 1.066 195 V CB -0.500 31.132 31.823 -0.318 0.000 0.667 195 V HN 0.386 8.576 8.190 -0.000 0.000 0.461 196 S N -0.802 115.034 115.700 0.227 0.000 2.371 196 S HA -0.031 4.435 4.470 -0.008 0.000 0.224 196 S C 1.768 176.654 174.600 0.477 0.000 1.029 196 S CA 1.149 59.616 58.200 0.445 0.000 0.978 196 S CB -0.354 63.148 63.200 0.504 0.000 0.833 196 S HN 0.596 8.906 8.310 -0.000 0.000 0.466 197 F N 0.951 120.817 119.950 -0.139 0.000 2.126 197 F HA -0.143 4.380 4.527 -0.008 0.000 0.299 197 F C 2.284 178.093 175.800 0.014 0.000 1.096 197 F CA 0.501 58.410 58.000 -0.151 0.000 1.255 197 F CB -0.233 38.562 39.000 -0.341 0.000 0.997 197 F HN 0.190 8.490 8.300 -0.000 0.000 0.479 198 L N -0.501 120.833 121.223 0.185 0.000 2.056 198 L HA -0.142 4.194 4.340 -0.008 0.000 0.207 198 L C 1.393 178.212 176.870 -0.085 0.000 1.078 198 L CA 1.678 56.532 54.840 0.022 0.000 0.749 198 L CB -0.594 41.438 42.059 -0.044 0.000 0.901 198 L HN -0.058 8.172 8.230 -0.000 0.000 0.433 199 F N -0.544 119.526 119.950 0.201 0.000 2.693 199 F HA 0.175 4.697 4.527 -0.008 0.000 0.303 199 F C 1.451 177.370 175.800 0.199 0.000 1.143 199 F CA 0.103 58.226 58.000 0.204 0.000 1.389 199 F CB -0.865 38.267 39.000 0.220 0.000 1.060 199 F HN 0.128 8.428 8.300 -0.000 0.000 0.535 200 S N -1.473 114.416 115.700 0.314 0.000 2.758 200 S HA 0.205 4.670 4.470 -0.008 0.000 0.292 200 S C 1.022 175.724 174.600 0.170 0.000 1.131 200 S CA -0.730 57.624 58.200 0.257 0.000 0.997 200 S CB 0.955 64.340 63.200 0.310 0.000 1.111 200 S HN 0.031 8.341 8.310 -0.000 0.000 0.552 201 D N 0.385 120.864 120.400 0.132 0.000 2.271 201 D HA -0.068 4.567 4.640 -0.008 0.000 0.207 201 D C 1.557 177.909 176.300 0.086 0.000 0.983 201 D CA 1.099 55.155 54.000 0.094 0.000 0.878 201 D CB -0.204 40.638 40.800 0.069 0.000 0.920 201 D HN 0.474 8.844 8.370 -0.000 0.000 0.479 202 R N 0.001 120.558 120.500 0.095 0.000 2.320 202 R HA 0.130 4.465 4.340 -0.008 0.000 0.211 202 R C 1.954 178.311 176.300 0.094 0.000 0.931 202 R CA 0.216 56.371 56.100 0.092 0.000 1.071 202 R CB 0.117 30.463 30.300 0.076 0.000 1.025 202 R HN 0.112 8.382 8.270 -0.000 0.000 0.495 203 G N 1.283 110.133 108.800 0.084 0.000 2.422 203 G HA2 -0.127 3.828 3.960 -0.008 0.000 0.218 203 G HA3 -0.127 3.828 3.960 -0.008 0.000 0.218 203 G C 0.813 175.746 174.900 0.055 0.000 1.146 203 G CA 0.423 45.551 45.100 0.047 0.000 0.769 203 G HN 0.180 8.470 8.290 -0.000 0.000 0.547 204 I N 1.581 122.187 120.570 0.061 0.000 2.495 204 I HA 0.277 4.442 4.170 -0.008 0.000 0.277 204 I C -2.653 173.505 176.117 0.068 0.000 1.045 204 I CA -2.135 59.201 61.300 0.059 0.000 1.135 204 I CB 2.409 40.428 38.000 0.032 0.000 1.241 204 I HN -0.149 8.061 8.210 -0.000 0.000 0.469 205 P HA -0.035 4.385 4.420 -0.000 0.000 0.269 205 P C -0.265 177.094 177.300 0.098 0.000 1.215 205 P CA -0.180 62.990 63.100 0.117 0.000 0.780 205 P CB 0.605 32.404 31.700 0.165 0.000 0.898 206 D N 2.452 122.918 120.400 0.110 0.000 2.545 206 D HA 0.266 4.901 4.640 -0.008 0.000 0.227 206 D C 0.810 177.261 176.300 0.251 0.000 1.150 206 D CA 0.889 54.974 54.000 0.141 0.000 1.046 206 D CB -1.264 39.584 40.800 0.080 0.000 1.098 206 D HN 0.571 8.941 8.370 -0.000 0.000 0.502 207 G N 2.900 111.814 108.800 0.191 0.000 2.796 207 G HA2 -0.261 3.694 3.960 -0.008 0.000 0.571 207 G HA3 -0.261 3.694 3.960 -0.008 0.000 0.571 207 G C 0.696 175.508 174.900 -0.147 0.000 1.370 207 G CA -0.464 44.612 45.100 -0.039 0.000 0.856 207 G HN 0.527 8.817 8.290 -0.000 0.000 0.538 208 H N 0.329 119.301 119.070 -0.163 0.000 2.502 208 H HA 0.059 4.611 4.556 -0.007 0.000 0.283 208 H C 2.718 177.889 175.328 -0.261 0.000 1.015 208 H CA 1.405 57.202 56.048 -0.418 0.000 1.298 208 H CB 0.129 29.076 29.762 -1.359 0.000 1.411 208 H HN 0.499 8.779 8.280 -0.000 0.000 0.556 209 R N 0.056 120.473 120.500 -0.138 0.000 2.276 209 R HA -0.004 4.331 4.340 -0.008 0.000 0.203 209 R C 0.183 176.272 176.300 -0.351 0.000 1.017 209 R CA 0.513 56.492 56.100 -0.201 0.000 1.010 209 R CB 0.159 30.220 30.300 -0.398 0.000 0.900 209 R HN 0.401 8.671 8.270 -0.000 0.000 0.469 210 H N -0.435 118.682 119.070 0.078 0.000 2.534 210 H HA 0.246 4.797 4.556 -0.008 0.000 0.250 210 H C -0.565 174.856 175.328 0.155 0.000 1.256 210 H CA -0.438 55.654 56.048 0.073 0.000 1.000 210 H CB 0.291 30.078 29.762 0.043 0.000 1.801 210 H HN 0.046 8.326 8.280 -0.000 0.000 0.569 211 M N -1.919 117.886 119.600 0.342 0.000 2.569 211 M HA 0.544 5.019 4.480 -0.008 0.000 0.279 211 M C -1.648 174.951 176.300 0.499 0.000 1.253 211 M CA -1.135 54.377 55.300 0.353 0.000 0.867 211 M CB 2.592 35.381 32.600 0.315 0.000 1.727 211 M HN -0.230 8.060 8.290 -0.000 0.000 0.467 212 D N 0.873 121.472 120.400 0.331 0.000 2.340 212 D HA 0.696 5.331 4.640 -0.008 0.000 0.251 212 D C -0.403 175.832 176.300 -0.108 0.000 1.080 212 D CA 0.064 54.142 54.000 0.130 0.000 0.971 212 D CB 1.895 42.612 40.800 -0.138 0.000 1.137 212 D HN 0.872 9.242 8.370 -0.000 0.000 0.475 213 G N -0.094 108.262 108.800 -0.740 0.000 2.495 213 G HA2 0.566 4.521 3.960 -0.008 0.000 0.318 213 G HA3 0.566 4.521 3.960 -0.008 0.000 0.318 213 G C -1.636 172.262 174.900 -1.670 0.000 1.257 213 G CA -0.393 43.821 45.100 -1.477 0.000 0.962 213 G HN 0.270 8.560 8.290 -0.000 0.000 0.483 214 Y N -0.164 119.623 120.300 -0.855 0.000 2.512 214 Y HA 0.495 5.040 4.550 -0.009 0.000 0.348 214 Y C 1.243 177.018 175.900 -0.208 0.000 0.990 214 Y CA -0.156 57.669 58.100 -0.458 0.000 1.033 214 Y CB 2.709 40.978 38.460 -0.319 0.000 1.259 214 Y HN 0.614 8.894 8.280 -0.000 0.000 0.461 215 G N -0.118 108.781 108.800 0.165 0.000 2.464 215 G HA2 0.052 4.008 3.960 -0.008 0.000 0.217 215 G HA3 0.052 4.008 3.960 -0.008 0.000 0.217 215 G C 0.975 175.983 174.900 0.180 0.000 1.138 215 G CA 0.936 46.195 45.100 0.266 0.000 0.793 215 G HN 0.720 9.010 8.290 -0.000 0.000 0.539 216 S N -0.957 114.734 115.700 -0.015 0.000 1.637 216 S HA -0.239 4.226 4.470 -0.008 0.000 0.232 216 S C 0.987 175.403 174.600 -0.308 0.000 0.808 216 S CA 1.438 59.492 58.200 -0.244 0.000 1.437 216 S CB -1.236 61.731 63.200 -0.388 0.000 1.838 216 S HN 0.701 9.011 8.310 -0.000 0.000 0.525 217 H N 1.443 120.452 119.070 -0.101 0.000 2.660 217 H HA 0.340 4.891 4.556 -0.008 0.000 0.374 217 H C 0.402 175.431 175.328 -0.498 0.000 1.291 217 H CA 0.869 56.706 56.048 -0.352 0.000 1.437 217 H CB 0.092 29.505 29.762 -0.583 0.000 1.509 217 H HN 0.326 8.606 8.280 -0.000 0.000 0.614 218 T N 2.743 117.019 114.554 -0.464 0.000 2.744 218 T HA 0.307 4.652 4.350 -0.008 0.000 0.291 218 T C 0.078 174.459 174.700 -0.532 0.000 0.957 218 T CA -0.334 61.543 62.100 -0.371 0.000 1.002 218 T CB -0.045 68.730 68.868 -0.155 0.000 0.919 218 T HN 0.199 8.439 8.240 -0.000 0.000 0.468 219 F N 1.611 121.656 119.950 0.159 0.000 2.450 219 F HA 0.674 5.196 4.527 -0.009 0.000 0.361 219 F C 0.661 176.654 175.800 0.322 0.000 1.092 219 F CA -1.189 56.956 58.000 0.242 0.000 1.105 219 F CB 0.943 40.144 39.000 0.335 0.000 1.458 219 F HN 0.255 8.555 8.300 -0.000 0.000 0.496 220 K N 0.843 121.513 120.400 0.451 0.000 2.443 220 K HA 0.605 4.921 4.320 -0.008 0.000 0.252 220 K C -2.061 174.647 176.600 0.180 0.000 0.933 220 K CA -0.362 56.117 56.287 0.320 0.000 0.792 220 K CB 1.244 33.920 32.500 0.294 0.000 1.185 220 K HN 0.611 8.861 8.250 -0.000 0.000 0.425 221 L N 4.221 125.493 121.223 0.082 0.000 2.329 221 L HA 0.603 4.939 4.340 -0.008 0.000 0.279 221 L C -1.013 175.833 176.870 -0.040 0.000 1.014 221 L CA -1.322 53.535 54.840 0.028 0.000 0.814 221 L CB 2.041 44.099 42.059 -0.001 0.000 1.257 221 L HN 0.438 8.668 8.230 -0.000 0.000 0.424 222 V N 3.201 123.089 119.914 -0.042 0.000 2.525 222 V HA 0.249 4.365 4.120 -0.008 0.000 0.299 222 V C -0.052 176.025 176.094 -0.028 0.000 1.034 222 V CA -0.864 61.385 62.300 -0.085 0.000 0.863 222 V CB 1.696 33.473 31.823 -0.076 0.000 0.999 222 V HN 0.901 9.091 8.190 -0.000 0.000 0.423 223 N N 3.917 122.600 118.700 -0.028 0.000 2.366 223 N HA 0.400 5.135 4.740 -0.008 0.000 0.277 223 N C 1.220 176.725 175.510 -0.009 0.000 1.275 223 N CA -0.133 52.909 53.050 -0.012 0.000 0.964 223 N CB 1.556 40.026 38.487 -0.029 0.000 1.167 223 N HN 0.551 8.931 8.380 -0.000 0.000 0.568 224 A N -0.400 122.416 122.820 -0.007 0.000 2.178 224 A HA -0.128 4.187 4.320 -0.008 0.000 0.218 224 A C 0.931 178.512 177.584 -0.005 0.000 1.157 224 A CA 1.151 53.187 52.037 -0.002 0.000 0.689 224 A CB -0.395 18.605 19.000 -0.001 0.000 0.787 224 A HN 0.728 8.878 8.150 -0.000 0.000 0.465 225 D N -1.616 118.776 120.400 -0.014 0.000 2.350 225 D HA 0.266 4.902 4.640 -0.008 0.000 0.213 225 D C 1.339 177.637 176.300 -0.004 0.000 1.031 225 D CA 1.106 55.099 54.000 -0.013 0.000 0.861 225 D CB 0.284 41.070 40.800 -0.024 0.000 0.926 225 D HN 0.573 8.943 8.370 -0.000 0.000 0.520 226 G N 1.062 109.867 108.800 0.010 0.000 2.168 226 G HA2 -0.229 3.727 3.960 -0.008 0.000 0.197 226 G HA3 -0.229 3.727 3.960 -0.008 0.000 0.197 226 G C -0.004 174.936 174.900 0.067 0.000 0.997 226 G CA -0.499 44.636 45.100 0.058 0.000 0.658 226 G HN 0.281 8.571 8.290 -0.000 0.000 0.513 227 E N 0.766 120.951 120.200 -0.024 0.000 2.200 227 E HA 0.647 4.992 4.350 -0.008 0.000 0.283 227 E C 0.442 176.924 176.600 -0.196 0.000 1.015 227 E CA 0.379 56.720 56.400 -0.098 0.000 0.819 227 E CB 1.239 30.890 29.700 -0.082 0.000 1.081 227 E HN 0.648 9.008 8.360 -0.000 0.000 0.397 228 A N 2.943 125.525 122.820 -0.397 0.000 2.354 228 A HA 0.812 5.127 4.320 -0.008 0.000 0.321 228 A C -1.011 176.283 177.584 -0.483 0.000 1.125 228 A CA -0.572 51.116 52.037 -0.582 0.000 0.799 228 A CB 1.557 19.823 19.000 -1.224 0.000 1.293 228 A HN 0.443 8.593 8.150 -0.000 0.000 0.452 229 V N 0.283 120.082 119.914 -0.192 0.000 3.147 229 V HA 0.383 4.498 4.120 -0.008 0.000 0.299 229 V C -1.791 174.362 176.094 0.098 0.000 1.302 229 V CA -0.537 61.784 62.300 0.035 0.000 1.015 229 V CB 2.198 34.050 31.823 0.048 0.000 1.086 229 V HN 0.836 9.026 8.190 -0.000 0.000 0.437 230 Y N 2.342 122.817 120.300 0.292 0.000 2.352 230 Y HA 0.733 5.278 4.550 -0.008 0.000 0.326 230 Y C 0.511 176.562 175.900 0.252 0.000 1.166 230 Y CA -0.484 57.776 58.100 0.265 0.000 1.182 230 Y CB 1.565 40.184 38.460 0.265 0.000 1.216 230 Y HN 0.931 9.211 8.280 -0.000 0.000 0.474 231 C N 0.819 120.343 119.300 0.373 0.000 3.291 231 C HA 0.850 5.305 4.460 -0.008 0.000 0.316 231 C C -1.545 173.356 174.990 -0.148 0.000 1.391 231 C CA -1.288 57.773 59.018 0.071 0.000 1.394 231 C CB 1.989 29.621 27.740 -0.181 0.000 1.744 231 C HN 0.859 9.089 8.230 -0.000 0.000 0.461 232 K N 0.721 120.971 120.400 -0.250 0.000 2.513 232 K HA 0.586 4.901 4.320 -0.008 0.000 0.251 232 K C -1.914 174.684 176.600 -0.003 0.000 0.939 232 K CA -0.108 56.070 56.287 -0.181 0.000 0.793 232 K CB 1.911 34.208 32.500 -0.337 0.000 1.241 232 K HN 0.639 8.889 8.250 -0.000 0.000 0.431 233 F N 2.350 122.434 119.950 0.224 0.000 2.421 233 F HA 0.346 4.869 4.527 -0.007 0.000 0.337 233 F C 0.619 176.552 175.800 0.222 0.000 1.105 233 F CA -0.262 57.912 58.000 0.290 0.000 1.049 233 F CB 1.074 40.202 39.000 0.212 0.000 1.139 233 F HN 0.286 8.586 8.300 -0.000 0.000 0.479 234 H N 3.444 122.790 119.070 0.460 0.000 2.689 234 H HA 0.257 4.808 4.556 -0.007 0.000 0.346 234 H C -1.501 174.020 175.328 0.323 0.000 1.037 234 H CA -0.829 55.374 56.048 0.258 0.000 1.234 234 H CB 1.766 31.700 29.762 0.287 0.000 1.572 234 H HN 0.675 8.955 8.280 -0.000 0.000 0.524 235 Y N 1.142 121.454 120.300 0.020 0.000 2.376 235 Y HA 0.425 4.970 4.550 -0.009 0.000 0.326 235 Y C -0.388 175.618 175.900 0.177 0.000 0.970 235 Y CA -1.277 56.866 58.100 0.071 0.000 1.248 235 Y CB 0.805 39.202 38.460 -0.104 0.000 1.117 235 Y HN 0.161 8.441 8.280 -0.000 0.000 0.476 236 K N 1.852 122.493 120.400 0.402 0.000 2.098 236 K HA 0.292 4.607 4.320 -0.008 0.000 0.261 236 K C -0.054 176.780 176.600 0.389 0.000 0.987 236 K CA -0.747 55.746 56.287 0.344 0.000 0.916 236 K CB 2.128 34.837 32.500 0.347 0.000 1.039 236 K HN 0.752 9.002 8.250 -0.000 0.000 0.455 237 T N 0.637 115.328 114.554 0.229 0.000 2.884 237 T HA 0.055 4.400 4.350 -0.008 0.000 0.298 237 T C 0.343 174.931 174.700 -0.188 0.000 0.998 237 T CA -0.365 61.601 62.100 -0.224 0.000 1.124 237 T CB 0.268 69.078 68.868 -0.096 0.000 0.931 237 T HN 0.318 8.558 8.240 -0.000 0.000 0.531 238 D N 3.316 123.510 120.400 -0.342 0.000 2.349 238 D HA 0.046 4.681 4.640 -0.008 0.000 0.215 238 D C 1.603 177.823 176.300 -0.133 0.000 1.016 238 D CA 0.545 54.458 54.000 -0.144 0.000 0.870 238 D CB 0.434 41.169 40.800 -0.109 0.000 0.917 238 D HN 0.598 8.968 8.370 -0.000 0.000 0.524 239 Q N 0.139 119.812 119.800 -0.211 0.000 2.398 239 Q HA 0.341 4.676 4.340 -0.008 0.000 0.204 239 Q C 1.079 177.122 176.000 0.073 0.000 0.932 239 Q CA 0.467 56.197 55.803 -0.122 0.000 0.916 239 Q CB 0.702 29.235 28.738 -0.343 0.000 1.024 239 Q HN 0.184 8.454 8.270 -0.000 0.000 0.504 240 G N -0.104 108.736 108.800 0.066 0.000 2.592 240 G HA2 -0.122 3.833 3.960 -0.008 0.000 0.684 240 G HA3 -0.122 3.833 3.960 -0.008 0.000 0.684 240 G C -1.055 173.950 174.900 0.174 0.000 1.291 240 G CA -0.909 44.260 45.100 0.115 0.000 0.891 240 G HN 0.011 8.301 8.290 -0.000 0.000 0.544 241 I N 0.618 121.260 120.570 0.120 0.000 2.488 241 I HA 0.693 4.859 4.170 -0.008 0.000 0.299 241 I C 0.529 176.676 176.117 0.049 0.000 0.984 241 I CA -0.184 61.191 61.300 0.124 0.000 1.250 241 I CB 1.528 39.587 38.000 0.097 0.000 1.389 241 I HN 0.692 8.902 8.210 -0.000 0.000 0.488 242 K N 4.297 124.713 120.400 0.027 0.000 2.579 242 K HA 0.342 4.657 4.320 -0.008 0.000 0.257 242 K C -1.630 174.961 176.600 -0.015 0.000 0.950 242 K CA -0.595 55.621 56.287 -0.117 0.000 0.862 242 K CB 1.825 34.050 32.500 -0.458 0.000 1.317 242 K HN 0.601 8.851 8.250 -0.000 0.000 0.436 243 N N 3.189 121.884 118.700 -0.009 0.000 2.328 243 N HA 0.523 5.258 4.740 -0.008 0.000 0.299 243 N C -0.942 174.566 175.510 -0.004 0.000 1.179 243 N CA -0.645 52.418 53.050 0.021 0.000 0.793 243 N CB 1.651 40.161 38.487 0.038 0.000 1.366 243 N HN 0.349 8.729 8.380 -0.000 0.000 0.493 244 L N 0.940 122.158 121.223 -0.008 0.000 2.295 244 L HA 0.374 4.710 4.340 -0.008 0.000 0.285 244 L C 0.936 177.797 176.870 -0.014 0.000 1.035 244 L CA -0.797 54.021 54.840 -0.037 0.000 0.806 244 L CB 1.233 43.237 42.059 -0.092 0.000 1.214 244 L HN 0.579 8.809 8.230 -0.000 0.000 0.426 245 S N 1.010 116.704 115.700 -0.010 0.000 2.549 245 S HA -0.042 4.423 4.470 -0.008 0.000 0.278 245 S C 1.306 175.911 174.600 0.009 0.000 1.344 245 S CA -0.144 58.061 58.200 0.009 0.000 1.025 245 S CB 0.913 64.117 63.200 0.007 0.000 0.851 245 S HN 0.627 8.937 8.310 -0.000 0.000 0.530 246 V N -0.360 119.574 119.914 0.033 0.000 2.913 246 V HA -0.063 4.052 4.120 -0.008 0.000 0.260 246 V C 2.053 178.164 176.094 0.028 0.000 1.098 246 V CA 2.040 64.363 62.300 0.040 0.000 1.121 246 V CB -1.154 30.713 31.823 0.073 0.000 0.714 246 V HN 1.014 9.204 8.190 -0.000 0.000 0.487 247 E N 0.675 120.888 120.200 0.022 0.000 2.051 247 E HA -0.189 4.156 4.350 -0.008 0.000 0.189 247 E C 1.846 178.442 176.600 -0.005 0.000 0.979 247 E CA 1.586 57.997 56.400 0.019 0.000 0.803 247 E CB -0.349 29.364 29.700 0.022 0.000 0.761 247 E HN 0.574 8.934 8.360 -0.000 0.000 0.451 248 D N -0.005 120.379 120.400 -0.026 0.000 2.182 248 D HA -0.125 4.510 4.640 -0.008 0.000 0.201 248 D C 1.673 177.909 176.300 -0.108 0.000 0.986 248 D CA 1.484 55.445 54.000 -0.066 0.000 0.847 248 D CB -0.225 40.533 40.800 -0.070 0.000 0.942 248 D HN 0.354 8.724 8.370 -0.000 0.000 0.467 249 A N 0.336 123.108 122.820 -0.081 0.000 1.930 249 A HA 0.176 4.491 4.320 -0.008 0.000 0.215 249 A C 2.245 179.794 177.584 -0.058 0.000 1.176 249 A CA 1.511 53.493 52.037 -0.093 0.000 0.632 249 A CB -0.520 18.448 19.000 -0.052 0.000 0.819 249 A HN 0.201 8.351 8.150 -0.000 0.000 0.445 250 A N -0.016 122.796 122.820 -0.013 0.000 1.877 250 A HA -0.180 4.135 4.320 -0.008 0.000 0.216 250 A C 2.252 179.854 177.584 0.029 0.000 1.186 250 A CA 1.732 53.789 52.037 0.033 0.000 0.620 250 A CB -0.526 18.507 19.000 0.055 0.000 0.822 250 A HN 0.511 8.661 8.150 -0.000 0.000 0.443 251 R N -0.619 119.855 120.500 -0.043 0.000 2.080 251 R HA -0.083 4.252 4.340 -0.008 0.000 0.236 251 R C 2.103 178.168 176.300 -0.392 0.000 1.137 251 R CA 1.763 57.745 56.100 -0.198 0.000 0.943 251 R CB -0.441 29.776 30.300 -0.139 0.000 0.846 251 R HN 0.539 8.809 8.270 -0.000 0.000 0.431 252 L N -0.016 121.061 121.223 -0.242 0.000 2.141 252 L HA -0.115 4.220 4.340 -0.008 0.000 0.209 252 L C 2.568 179.355 176.870 -0.139 0.000 1.094 252 L CA 1.024 55.733 54.840 -0.219 0.000 0.763 252 L CB -0.428 41.434 42.059 -0.328 0.000 0.908 252 L HN 0.336 8.566 8.230 -0.000 0.000 0.437 253 A N -0.248 122.519 122.820 -0.089 0.000 2.019 253 A HA -0.231 4.085 4.320 -0.008 0.000 0.219 253 A C 2.151 179.768 177.584 0.055 0.000 1.164 253 A CA 1.822 53.858 52.037 -0.001 0.000 0.644 253 A CB -0.723 18.295 19.000 0.029 0.000 0.805 253 A HN 0.693 8.843 8.150 -0.000 0.000 0.449 254 H N -3.059 116.014 119.070 0.005 0.000 2.439 254 H HA 0.193 4.744 4.556 -0.008 0.000 0.299 254 H C 1.712 177.050 175.328 0.017 0.000 1.033 254 H CA 0.658 56.712 56.048 0.011 0.000 1.348 254 H CB -0.280 29.487 29.762 0.008 0.000 1.449 254 H HN 0.410 8.690 8.280 -0.000 0.000 0.544 255 E N 0.966 120.949 120.200 -0.362 0.000 2.106 255 E HA -0.119 4.226 4.350 -0.008 0.000 0.192 255 E C -0.184 176.389 176.600 -0.045 0.000 0.984 255 E CA 1.027 57.298 56.400 -0.215 0.000 0.806 255 E CB 0.251 29.751 29.700 -0.333 0.000 0.750 255 E HN 0.397 8.757 8.360 -0.000 0.000 0.458 256 D N -1.520 118.872 120.400 -0.013 0.000 2.752 256 D HA 0.101 4.736 4.640 -0.008 0.000 0.242 256 D C -2.205 174.143 176.300 0.080 0.000 1.295 256 D CA -1.399 52.635 54.000 0.056 0.000 0.846 256 D CB 0.979 41.849 40.800 0.117 0.000 1.454 256 D HN -0.160 8.210 8.370 -0.000 0.000 0.535 257 P HA -0.098 4.322 4.420 -0.000 0.000 0.219 257 P C 0.337 177.691 177.300 0.089 0.000 1.144 257 P CA 1.084 64.223 63.100 0.066 0.000 0.806 257 P CB 0.446 32.178 31.700 0.054 0.000 0.771 258 D N -2.938 117.518 120.400 0.093 0.000 2.402 258 D HA 0.023 4.658 4.640 -0.008 0.000 0.216 258 D C 1.432 177.795 176.300 0.105 0.000 1.128 258 D CA -0.540 53.514 54.000 0.089 0.000 0.833 258 D CB -0.464 40.357 40.800 0.035 0.000 0.971 258 D HN 0.121 8.491 8.370 -0.000 0.000 0.503 259 Y N 2.193 122.491 120.300 -0.004 0.000 2.038 259 Y HA -0.374 4.171 4.550 -0.008 0.000 0.266 259 Y C 2.296 178.170 175.900 -0.043 0.000 1.220 259 Y CA 2.551 60.638 58.100 -0.022 0.000 1.107 259 Y CB -0.446 37.995 38.460 -0.031 0.000 0.932 259 Y HN 0.077 8.357 8.280 -0.000 0.000 0.500 260 G N 0.242 109.048 108.800 0.011 0.000 2.432 260 G HA2 -0.196 3.759 3.960 -0.008 0.000 0.219 260 G HA3 -0.196 3.759 3.960 -0.008 0.000 0.219 260 G C 1.448 176.289 174.900 -0.098 0.000 1.135 260 G CA 1.151 46.114 45.100 -0.229 0.000 0.767 260 G HN 0.412 8.702 8.290 -0.000 0.000 0.550 261 L N 0.056 121.316 121.223 0.061 0.000 2.044 261 L HA 0.047 4.383 4.340 -0.008 0.000 0.205 261 L C 2.755 179.678 176.870 0.089 0.000 1.075 261 L CA 1.378 56.307 54.840 0.149 0.000 0.747 261 L CB -1.294 40.862 42.059 0.162 0.000 0.903 261 L HN 0.265 8.495 8.230 -0.000 0.000 0.435 262 R N 0.426 120.925 120.500 -0.002 0.000 2.096 262 R HA -0.235 4.100 4.340 -0.008 0.000 0.240 262 R C 2.182 178.466 176.300 -0.027 0.000 1.139 262 R CA 2.259 58.347 56.100 -0.020 0.000 0.952 262 R CB -0.298 29.956 30.300 -0.078 0.000 0.854 262 R HN 0.424 8.694 8.270 -0.000 0.000 0.436 263 D N 0.330 120.615 120.400 -0.191 0.000 2.081 263 D HA -0.212 4.423 4.640 -0.008 0.000 0.194 263 D C 1.999 178.259 176.300 -0.066 0.000 0.986 263 D CA 1.308 55.184 54.000 -0.208 0.000 0.837 263 D CB -0.301 40.246 40.800 -0.420 0.000 0.985 263 D HN 0.259 8.629 8.370 -0.000 0.000 0.448 264 L N 0.077 121.275 121.223 -0.041 0.000 2.034 264 L HA -0.247 4.089 4.340 -0.008 0.000 0.217 264 L C 2.602 179.549 176.870 0.129 0.000 1.077 264 L CA 1.710 56.580 54.840 0.050 0.000 0.769 264 L CB -0.943 41.184 42.059 0.113 0.000 0.890 264 L HN 0.128 8.358 8.230 -0.000 0.000 0.435 265 F N 0.910 120.889 119.950 0.050 0.000 2.069 265 F HA -0.299 4.223 4.527 -0.008 0.000 0.298 265 F C 2.411 178.251 175.800 0.067 0.000 1.113 265 F CA 2.109 60.157 58.000 0.081 0.000 1.214 265 F CB -0.186 38.858 39.000 0.075 0.000 0.978 265 F HN 0.229 8.529 8.300 -0.000 0.000 0.474 266 N N 0.762 119.580 118.700 0.196 0.000 2.058 266 N HA -0.160 4.575 4.740 -0.008 0.000 0.191 266 N C 1.893 177.414 175.510 0.018 0.000 1.037 266 N CA 1.360 54.473 53.050 0.105 0.000 0.848 266 N CB -1.090 37.450 38.487 0.087 0.000 1.021 266 N HN 0.397 8.777 8.380 -0.000 0.000 0.422 267 A N 2.172 124.993 122.820 0.001 0.000 1.953 267 A HA -0.225 4.090 4.320 -0.008 0.000 0.212 267 A C 2.186 179.768 177.584 -0.003 0.000 1.250 267 A CA 2.088 54.116 52.037 -0.016 0.000 0.726 267 A CB -1.336 17.657 19.000 -0.012 0.000 0.837 267 A HN 0.305 8.455 8.150 -0.000 0.000 0.481 268 I N -0.340 120.268 120.570 0.064 0.000 2.231 268 I HA -0.422 3.743 4.170 -0.008 0.000 0.251 268 I C 2.734 178.902 176.117 0.085 0.000 1.076 268 I CA 1.747 63.151 61.300 0.174 0.000 1.347 268 I CB -0.676 37.382 38.000 0.097 0.000 1.038 268 I HN 0.472 8.682 8.210 -0.000 0.000 0.429 269 A N 0.600 123.382 122.820 -0.063 0.000 1.968 269 A HA -0.141 4.174 4.320 -0.008 0.000 0.217 269 A C 2.292 179.875 177.584 -0.001 0.000 1.169 269 A CA 1.940 53.932 52.037 -0.075 0.000 0.638 269 A CB -0.790 18.148 19.000 -0.103 0.000 0.812 269 A HN 0.559 8.709 8.150 -0.000 0.000 0.446 270 T N -4.910 109.631 114.554 -0.022 0.000 3.107 270 T HA 0.422 4.767 4.350 -0.008 0.000 0.249 270 T C 1.258 175.881 174.700 -0.128 0.000 1.096 270 T CA 1.062 63.138 62.100 -0.040 0.000 1.012 270 T CB 0.221 69.070 68.868 -0.032 0.000 0.977 270 T HN 1.639 9.879 8.240 -0.000 0.000 0.527 271 G N 1.779 110.450 108.800 -0.214 0.000 2.175 271 G HA2 -0.259 3.696 3.960 -0.008 0.000 0.244 271 G HA3 -0.259 3.696 3.960 -0.008 0.000 0.244 271 G C 0.091 174.469 174.900 -0.869 0.000 0.982 271 G CA -0.032 44.708 45.100 -0.600 0.000 0.641 271 G HN 0.659 8.949 8.290 -0.000 0.000 0.527 272 N N 0.546 118.972 118.700 -0.456 0.000 3.245 272 N HA 0.320 5.055 4.740 -0.008 0.000 0.296 272 N C -0.031 175.396 175.510 -0.138 0.000 1.254 272 N CA -0.518 52.358 53.050 -0.291 0.000 1.190 272 N CB -0.196 38.207 38.487 -0.139 0.000 1.460 272 N HN 0.455 8.835 8.380 -0.000 0.000 0.538 273 Y N 2.089 122.377 120.300 -0.020 0.000 2.754 273 Y HA 0.082 4.627 4.550 -0.008 0.000 0.349 273 Y C -1.449 174.418 175.900 -0.055 0.000 1.179 273 Y CA -2.149 55.943 58.100 -0.014 0.000 1.538 273 Y CB -0.145 38.324 38.460 0.016 0.000 1.200 273 Y HN 0.359 8.639 8.280 -0.000 0.000 0.522 274 P HA 0.004 4.424 4.420 -0.000 0.000 0.268 274 P C -0.521 176.724 177.300 -0.091 0.000 1.205 274 P CA 0.029 63.043 63.100 -0.145 0.000 0.771 274 P CB 1.408 32.994 31.700 -0.190 0.000 0.858 275 S N 1.864 117.387 115.700 -0.295 0.000 2.632 275 S HA 0.763 5.229 4.470 -0.008 0.000 0.289 275 S C -1.476 172.984 174.600 -0.233 0.000 1.115 275 S CA -0.773 57.397 58.200 -0.049 0.000 0.889 275 S CB 1.734 64.939 63.200 0.008 0.000 1.116 275 S HN 0.549 8.859 8.310 -0.000 0.000 0.486 276 W N 0.477 121.868 121.300 0.152 0.000 3.129 276 W HA 0.388 5.044 4.660 -0.006 0.000 0.333 276 W C -1.123 175.488 176.519 0.155 0.000 1.141 276 W CA -0.597 56.867 57.345 0.197 0.000 1.224 276 W CB 2.394 32.052 29.460 0.331 0.000 1.393 276 W HN 0.631 8.811 8.180 -0.000 0.000 0.499 277 T N 3.557 118.288 114.554 0.295 0.000 2.767 277 T HA 0.320 4.665 4.350 -0.008 0.000 0.288 277 T C -0.424 174.303 174.700 0.045 0.000 0.963 277 T CA -0.454 61.699 62.100 0.088 0.000 1.019 277 T CB 1.224 70.035 68.868 -0.095 0.000 0.923 277 T HN 0.215 8.455 8.240 -0.000 0.000 0.468 278 L N 5.061 126.328 121.223 0.073 0.000 2.265 278 L HA 0.510 4.845 4.340 -0.008 0.000 0.288 278 L C -1.434 175.402 176.870 -0.056 0.000 1.058 278 L CA -0.179 54.766 54.840 0.175 0.000 0.809 278 L CB -0.008 42.250 42.059 0.332 0.000 1.179 278 L HN 0.549 8.779 8.230 -0.000 0.000 0.429 279 Y N 5.025 125.511 120.300 0.310 0.000 2.549 279 Y HA 0.657 5.202 4.550 -0.008 0.000 0.339 279 Y C -0.023 176.020 175.900 0.238 0.000 1.053 279 Y CA -0.902 57.322 58.100 0.207 0.000 1.105 279 Y CB 1.702 40.236 38.460 0.123 0.000 1.258 279 Y HN 0.540 8.820 8.280 -0.000 0.000 0.478 280 I N -0.678 120.055 120.570 0.272 0.000 2.498 280 I HA 0.609 4.774 4.170 -0.008 0.000 0.290 280 I C -1.265 174.886 176.117 0.058 0.000 1.032 280 I CA -1.006 60.342 61.300 0.080 0.000 1.073 280 I CB 2.023 39.922 38.000 -0.169 0.000 1.251 280 I HN 0.503 8.713 8.210 -0.000 0.000 0.426 281 Q N 4.116 123.967 119.800 0.085 0.000 2.222 281 Q HA 0.638 4.973 4.340 -0.008 0.000 0.252 281 Q C -0.882 175.216 176.000 0.162 0.000 0.926 281 Q CA -0.867 55.039 55.803 0.173 0.000 0.899 281 Q CB 3.156 32.092 28.738 0.330 0.000 1.250 281 Q HN 0.673 8.943 8.270 -0.000 0.000 0.441 282 V N 3.207 123.211 119.914 0.149 0.000 2.680 282 V HA 0.712 4.828 4.120 -0.008 0.000 0.309 282 V C -1.312 174.883 176.094 0.169 0.000 1.052 282 V CA -0.750 61.583 62.300 0.055 0.000 0.908 282 V CB 1.819 33.429 31.823 -0.355 0.000 1.001 282 V HN 0.893 9.083 8.190 -0.000 0.000 0.431 283 M N 5.690 125.348 119.600 0.096 0.000 2.124 283 M HA 0.449 4.924 4.480 -0.008 0.000 0.280 283 M C -0.341 176.024 176.300 0.109 0.000 0.954 283 M CA -0.126 55.123 55.300 -0.085 0.000 0.958 283 M CB 1.623 33.674 32.600 -0.916 0.000 1.611 283 M HN 0.764 9.054 8.290 -0.000 0.000 0.449 284 T N 3.100 117.734 114.554 0.135 0.000 2.791 284 T HA 0.094 4.439 4.350 -0.008 0.000 0.323 284 T C 0.761 175.657 174.700 0.327 0.000 1.082 284 T CA 0.325 62.544 62.100 0.197 0.000 1.084 284 T CB 0.281 69.227 68.868 0.131 0.000 0.992 284 T HN 0.537 8.777 8.240 -0.000 0.000 0.547 285 F N 0.709 120.668 119.950 0.014 0.000 2.451 285 F HA 0.005 4.527 4.527 -0.008 0.000 0.299 285 F C 2.638 178.494 175.800 0.094 0.000 1.101 285 F CA 0.490 58.535 58.000 0.075 0.000 1.436 285 F CB -0.769 38.243 39.000 0.019 0.000 1.074 285 F HN 0.405 8.705 8.300 -0.000 0.000 0.553 286 S N -0.544 115.293 115.700 0.229 0.000 2.404 286 S HA -0.072 4.393 4.470 -0.008 0.000 0.223 286 S C 1.824 176.478 174.600 0.089 0.000 1.040 286 S CA 0.581 58.860 58.200 0.133 0.000 0.957 286 S CB -0.144 63.115 63.200 0.099 0.000 0.826 286 S HN 0.424 8.734 8.310 -0.000 0.000 0.491 287 E N 2.215 122.465 120.200 0.083 0.000 2.153 287 E HA -0.095 4.250 4.350 -0.008 0.000 0.194 287 E C 2.176 178.776 176.600 0.001 0.000 0.988 287 E CA 1.019 57.456 56.400 0.062 0.000 0.811 287 E CB -0.283 29.478 29.700 0.102 0.000 0.746 287 E HN 0.492 8.852 8.360 -0.000 0.000 0.466 288 A N 2.056 124.857 122.820 -0.031 0.000 1.902 288 A HA -0.202 4.113 4.320 -0.008 0.000 0.217 288 A C 1.988 179.555 177.584 -0.028 0.000 1.181 288 A CA 1.131 53.093 52.037 -0.125 0.000 0.623 288 A CB -0.305 18.662 19.000 -0.054 0.000 0.818 288 A HN 0.116 8.266 8.150 -0.000 0.000 0.443 289 E N -1.358 118.868 120.200 0.043 0.000 2.409 289 E HA -0.070 4.275 4.350 -0.008 0.000 0.198 289 E C 0.809 177.429 176.600 0.033 0.000 1.024 289 E CA 0.735 57.166 56.400 0.051 0.000 0.861 289 E CB -0.015 29.724 29.700 0.065 0.000 0.788 289 E HN 0.649 9.009 8.360 -0.000 0.000 0.521 290 I N -0.694 119.897 120.570 0.034 0.000 4.403 290 I HA 0.026 4.191 4.170 -0.008 0.000 0.331 290 I C 0.302 176.426 176.117 0.012 0.000 1.327 290 I CA -0.280 61.029 61.300 0.016 0.000 1.175 290 I CB 0.586 38.595 38.000 0.015 0.000 1.165 290 I HN -0.067 8.143 8.210 -0.000 0.000 0.413 291 F N 4.863 124.730 119.950 -0.137 0.000 2.608 291 F HA 0.092 4.615 4.527 -0.008 0.000 0.380 291 F C -1.083 174.602 175.800 -0.191 0.000 1.083 291 F CA -1.333 56.560 58.000 -0.178 0.000 1.266 291 F CB 0.598 39.432 39.000 -0.276 0.000 1.076 291 F HN -0.012 8.288 8.300 -0.000 0.000 0.574 292 P HA -0.077 4.343 4.420 -0.000 0.000 0.236 292 P C -0.745 176.073 177.300 -0.803 0.000 1.172 292 P CA 1.134 63.797 63.100 -0.729 0.000 0.759 292 P CB -0.288 30.860 31.700 -0.920 0.000 0.843 293 F N -1.123 118.527 119.950 -0.499 0.000 2.664 293 F HA 0.322 4.845 4.527 -0.007 0.000 0.329 293 F C 0.725 176.570 175.800 0.075 0.000 1.090 293 F CA -1.815 56.058 58.000 -0.212 0.000 0.978 293 F CB 0.221 39.103 39.000 -0.197 0.000 1.378 293 F HN -0.344 7.956 8.300 -0.000 0.000 0.495 294 N N 3.926 122.822 118.700 0.327 0.000 2.416 294 N HA 0.088 4.823 4.740 -0.008 0.000 0.271 294 N C -1.665 173.951 175.510 0.177 0.000 1.245 294 N CA -1.255 51.912 53.050 0.195 0.000 0.940 294 N CB 0.863 39.447 38.487 0.162 0.000 1.175 294 N HN 0.220 8.600 8.380 -0.000 0.000 0.483 295 P HA -0.168 4.252 4.420 -0.000 0.000 0.220 295 P C -0.054 176.959 177.300 -0.478 0.000 1.144 295 P CA 1.241 64.045 63.100 -0.493 0.000 0.800 295 P CB -0.029 31.032 31.700 -1.065 0.000 0.772 296 F N -0.136 119.811 119.950 -0.005 0.000 2.730 296 F HA 0.273 4.796 4.527 -0.008 0.000 0.295 296 F C 0.604 176.383 175.800 -0.034 0.000 1.143 296 F CA -1.029 56.924 58.000 -0.079 0.000 1.367 296 F CB -0.488 38.436 39.000 -0.127 0.000 0.970 296 F HN -0.158 8.142 8.300 -0.000 0.000 0.514 297 D N 0.891 121.344 120.400 0.087 0.000 2.414 297 D HA 0.152 4.787 4.640 -0.008 0.000 0.232 297 D C 0.962 177.253 176.300 -0.015 0.000 1.070 297 D CA -0.157 53.878 54.000 0.058 0.000 0.839 297 D CB 1.026 41.866 40.800 0.067 0.000 1.079 297 D HN 0.165 8.535 8.370 -0.000 0.000 0.521 298 L N 2.999 124.212 121.223 -0.016 0.000 2.353 298 L HA -0.098 4.237 4.340 -0.008 0.000 0.220 298 L C 1.544 178.328 176.870 -0.142 0.000 1.133 298 L CA 1.403 56.191 54.840 -0.087 0.000 0.798 298 L CB -0.218 41.828 42.059 -0.022 0.000 0.922 298 L HN 0.547 8.777 8.230 -0.000 0.000 0.445 299 T N -3.619 110.868 114.554 -0.112 0.000 3.272 299 T HA 0.085 4.430 4.350 -0.008 0.000 0.250 299 T C 0.483 175.122 174.700 -0.102 0.000 1.082 299 T CA -0.156 61.848 62.100 -0.160 0.000 0.968 299 T CB -0.115 68.683 68.868 -0.117 0.000 1.015 299 T HN 0.116 8.356 8.240 -0.000 0.000 0.563 300 K N 1.480 121.803 120.400 -0.128 0.000 2.427 300 K HA 0.577 4.892 4.320 -0.008 0.000 0.252 300 K C -0.568 175.992 176.600 -0.067 0.000 0.931 300 K CA -0.950 55.291 56.287 -0.077 0.000 0.793 300 K CB 2.966 35.423 32.500 -0.072 0.000 1.211 300 K HN 0.167 8.417 8.250 -0.000 0.000 0.426 301 V N -1.313 118.619 119.914 0.030 0.000 2.966 301 V HA 0.583 4.698 4.120 -0.008 0.000 0.317 301 V C -0.978 175.276 176.094 0.266 0.000 1.070 301 V CA -0.842 61.465 62.300 0.011 0.000 1.008 301 V CB 1.017 32.861 31.823 0.035 0.000 1.070 301 V HN 0.603 8.793 8.190 -0.000 0.000 0.457 302 W N 1.618 122.899 121.300 -0.031 0.000 2.314 302 W HA 0.592 5.248 4.660 -0.007 0.000 0.310 302 W C -2.542 174.014 176.519 0.062 0.000 1.075 302 W CA -2.879 54.434 57.345 -0.053 0.000 1.253 302 W CB 0.141 29.357 29.460 -0.406 0.000 1.238 302 W HN 0.433 8.613 8.180 -0.000 0.000 0.440 303 P HA 0.021 4.441 4.420 -0.000 0.000 0.267 303 P C 0.389 177.837 177.300 0.247 0.000 1.205 303 P CA 0.363 63.611 63.100 0.246 0.000 0.765 303 P CB 0.637 32.522 31.700 0.308 0.000 0.828 304 H N 1.051 120.270 119.070 0.247 0.000 2.524 304 H HA 0.005 4.556 4.556 -0.008 0.000 0.282 304 H C 2.123 177.508 175.328 0.095 0.000 1.016 304 H CA 1.240 57.384 56.048 0.160 0.000 1.270 304 H CB -0.422 29.384 29.762 0.073 0.000 1.394 304 H HN 0.555 8.835 8.280 -0.000 0.000 0.568 305 G N 0.544 109.462 108.800 0.197 0.000 2.394 305 G HA2 -0.209 3.747 3.960 -0.008 0.000 0.215 305 G HA3 -0.209 3.747 3.960 -0.008 0.000 0.215 305 G C 1.246 176.153 174.900 0.013 0.000 1.165 305 G CA 0.790 45.945 45.100 0.091 0.000 0.784 305 G HN 0.291 8.581 8.290 -0.000 0.000 0.535 306 D N -0.118 120.286 120.400 0.006 0.000 2.084 306 D HA -0.014 4.621 4.640 -0.008 0.000 0.196 306 D C 0.178 176.149 176.300 -0.549 0.000 0.985 306 D CA 0.855 54.698 54.000 -0.262 0.000 0.826 306 D CB -0.089 40.618 40.800 -0.155 0.000 0.978 306 D HN 0.430 8.800 8.370 -0.000 0.000 0.456 307 Y N 0.450 120.824 120.300 0.123 0.000 2.837 307 Y HA 0.328 4.873 4.550 -0.007 0.000 0.356 307 Y C -2.244 173.744 175.900 0.145 0.000 1.035 307 Y CA -2.560 55.617 58.100 0.128 0.000 1.165 307 Y CB 1.065 39.634 38.460 0.181 0.000 1.147 307 Y HN -0.121 8.159 8.280 -0.000 0.000 0.628 308 P HA -0.057 4.363 4.420 -0.000 0.000 0.267 308 P C -0.189 177.155 177.300 0.073 0.000 1.201 308 P CA 0.164 63.323 63.100 0.098 0.000 0.775 308 P CB 1.003 32.727 31.700 0.040 0.000 0.854 309 L N 2.643 123.847 121.223 -0.032 0.000 2.371 309 L HA 0.382 4.717 4.340 -0.008 0.000 0.272 309 L C 0.508 177.398 176.870 0.033 0.000 1.124 309 L CA -0.367 54.426 54.840 -0.078 0.000 0.816 309 L CB 0.059 41.865 42.059 -0.421 0.000 1.129 309 L HN 0.247 8.477 8.230 -0.000 0.000 0.448 310 I N 3.806 124.464 120.570 0.147 0.000 2.382 310 I HA 0.325 4.490 4.170 -0.008 0.000 0.286 310 I C -2.224 174.024 176.117 0.218 0.000 1.002 310 I CA -2.092 59.305 61.300 0.162 0.000 1.135 310 I CB 1.652 39.718 38.000 0.111 0.000 1.288 310 I HN 0.272 8.482 8.210 -0.000 0.000 0.448 311 P HA 0.059 4.479 4.420 -0.000 0.000 0.269 311 P C 0.359 177.579 177.300 -0.133 0.000 1.209 311 P CA 0.043 63.025 63.100 -0.197 0.000 0.776 311 P CB 1.228 32.558 31.700 -0.616 0.000 0.876 312 V N 0.613 120.529 119.914 0.003 0.000 3.251 312 V HA 0.495 4.610 4.120 -0.008 0.000 0.239 312 V C 0.810 177.122 176.094 0.364 0.000 1.332 312 V CA 0.979 63.417 62.300 0.229 0.000 1.224 312 V CB 0.194 32.208 31.823 0.318 0.000 1.004 312 V HN 0.843 9.033 8.190 -0.000 0.000 0.464 313 G N -0.199 108.786 108.800 0.308 0.000 2.317 313 G HA2 0.415 4.371 3.960 -0.008 0.000 0.293 313 G HA3 0.415 4.371 3.960 -0.008 0.000 0.293 313 G C -2.108 172.885 174.900 0.156 0.000 1.287 313 G CA -0.590 44.572 45.100 0.104 0.000 0.850 313 G HN -0.090 8.200 8.290 -0.000 0.000 0.515 314 K N -0.612 119.786 120.400 -0.004 0.000 2.340 314 K HA 0.731 5.046 4.320 -0.008 0.000 0.244 314 K C -1.430 175.299 176.600 0.214 0.000 0.973 314 K CA -0.892 55.474 56.287 0.132 0.000 0.828 314 K CB 2.309 34.854 32.500 0.075 0.000 1.226 314 K HN 0.264 8.514 8.250 -0.000 0.000 0.437 315 L N 2.371 123.750 121.223 0.260 0.000 2.353 315 L HA 0.354 4.689 4.340 -0.008 0.000 0.270 315 L C -1.050 175.906 176.870 0.143 0.000 1.003 315 L CA -0.762 54.217 54.840 0.233 0.000 0.862 315 L CB 1.366 43.615 42.059 0.317 0.000 1.221 315 L HN 0.232 8.462 8.230 -0.000 0.000 0.430 316 V N 5.097 124.894 119.914 -0.196 0.000 2.459 316 V HA 0.483 4.598 4.120 -0.008 0.000 0.295 316 V C -0.378 175.577 176.094 -0.230 0.000 1.029 316 V CA -0.777 61.361 62.300 -0.271 0.000 0.874 316 V CB 2.121 33.576 31.823 -0.613 0.000 0.985 316 V HN 0.340 8.530 8.190 -0.000 0.000 0.438 317 L N 5.631 126.854 121.223 -0.001 0.000 2.280 317 L HA 0.542 4.877 4.340 -0.008 0.000 0.287 317 L C 0.602 177.425 176.870 -0.079 0.000 1.023 317 L CA 0.262 55.124 54.840 0.037 0.000 0.819 317 L CB 1.216 43.409 42.059 0.222 0.000 1.212 317 L HN 0.846 9.076 8.230 -0.000 0.000 0.420 318 N N 3.322 121.916 118.700 -0.176 0.000 2.232 318 N HA 0.116 4.851 4.740 -0.008 0.000 0.240 318 N C -0.199 175.180 175.510 -0.218 0.000 1.307 318 N CA -0.371 52.368 53.050 -0.518 0.000 0.859 318 N CB 0.738 38.690 38.487 -0.891 0.000 1.260 318 N HN 0.555 8.935 8.380 -0.000 0.000 0.501 319 R N 0.488 120.988 120.500 -0.001 0.000 2.522 319 R HA 0.355 4.691 4.340 -0.008 0.000 0.283 319 R C -1.547 174.859 176.300 0.176 0.000 1.074 319 R CA -0.478 55.667 56.100 0.075 0.000 0.925 319 R CB 0.995 31.342 30.300 0.079 0.000 1.205 319 R HN -0.073 8.197 8.270 -0.000 0.000 0.436 320 N N 3.675 122.430 118.700 0.092 0.000 2.508 320 N HA 0.385 5.120 4.740 -0.008 0.000 0.285 320 N C -2.444 173.227 175.510 0.269 0.000 1.144 320 N CA -1.596 51.529 53.050 0.124 0.000 0.978 320 N CB 1.204 39.545 38.487 -0.242 0.000 1.180 320 N HN 0.438 8.818 8.380 -0.000 0.000 0.484 321 P HA 0.054 4.474 4.420 -0.000 0.000 0.269 321 P C 0.732 178.207 177.300 0.292 0.000 1.209 321 P CA -0.231 63.076 63.100 0.344 0.000 0.776 321 P CB 0.831 32.767 31.700 0.394 0.000 0.876 322 V N 1.072 121.087 119.914 0.167 0.000 2.599 322 V HA -0.007 4.108 4.120 -0.008 0.000 0.245 322 V C 0.821 177.026 176.094 0.185 0.000 1.046 322 V CA 1.436 63.840 62.300 0.175 0.000 1.065 322 V CB -0.831 31.054 31.823 0.102 0.000 0.703 322 V HN 0.577 8.767 8.190 -0.000 0.000 0.464 323 N N -1.455 117.348 118.700 0.172 0.000 2.504 323 N HA 0.281 5.016 4.740 -0.008 0.000 0.280 323 N C 0.033 175.690 175.510 0.246 0.000 1.052 323 N CA -0.541 52.624 53.050 0.192 0.000 0.887 323 N CB 1.223 39.801 38.487 0.152 0.000 1.323 323 N HN 0.202 8.582 8.380 -0.000 0.000 0.509 324 Y N 3.798 124.193 120.300 0.159 0.000 2.070 324 Y HA -0.218 4.326 4.550 -0.010 0.000 0.279 324 Y C 1.693 177.683 175.900 0.150 0.000 1.134 324 Y CA 1.750 59.946 58.100 0.161 0.000 1.113 324 Y CB -0.214 38.331 38.460 0.142 0.000 0.981 324 Y HN 0.675 8.955 8.280 -0.000 0.000 0.487 325 F N 0.548 120.706 119.950 0.346 0.000 2.027 325 F HA -0.383 4.133 4.527 -0.019 0.000 0.297 325 F C 2.333 178.195 175.800 0.103 0.000 1.129 325 F CA 2.487 60.619 58.000 0.220 0.000 1.195 325 F CB -0.808 38.285 39.000 0.156 0.000 0.960 325 F HN 0.114 8.414 8.300 -0.000 0.000 0.485 326 A N -0.898 121.977 122.820 0.092 0.000 2.014 326 A HA -0.082 4.233 4.320 -0.008 0.000 0.218 326 A C 1.797 179.341 177.584 -0.067 0.000 1.163 326 A CA 1.694 53.721 52.037 -0.015 0.000 0.652 326 A CB -0.530 18.531 19.000 0.100 0.000 0.808 326 A HN 0.649 8.799 8.150 -0.000 0.000 0.449 327 E N -1.518 118.666 120.200 -0.027 0.000 2.539 327 E HA 0.172 4.517 4.350 -0.008 0.000 0.215 327 E C 0.873 177.481 176.600 0.013 0.000 0.965 327 E CA 0.377 56.805 56.400 0.047 0.000 1.019 327 E CB 0.912 30.694 29.700 0.136 0.000 1.059 327 E HN 0.363 8.723 8.360 -0.000 0.000 0.496 328 V N 0.005 119.776 119.914 -0.239 0.000 3.250 328 V HA -0.005 4.110 4.120 -0.008 0.000 0.240 328 V C 1.937 177.794 176.094 -0.395 0.000 1.275 328 V CA 0.651 62.692 62.300 -0.432 0.000 1.206 328 V CB 0.531 31.879 31.823 -0.792 0.000 0.976 328 V HN 0.017 8.207 8.190 -0.000 0.000 0.467 329 E N 1.317 121.294 120.200 -0.372 0.000 2.107 329 E HA -0.148 4.197 4.350 -0.008 0.000 0.191 329 E C 1.972 178.394 176.600 -0.297 0.000 0.982 329 E CA 1.354 57.621 56.400 -0.221 0.000 0.809 329 E CB -0.114 29.536 29.700 -0.083 0.000 0.756 329 E HN 0.644 9.004 8.360 -0.000 0.000 0.459 330 Q N -0.103 119.454 119.800 -0.404 0.000 2.365 330 Q HA 0.165 4.500 4.340 -0.008 0.000 0.203 330 Q C -0.085 175.776 176.000 -0.231 0.000 0.929 330 Q CA -0.245 55.366 55.803 -0.320 0.000 0.948 330 Q CB 0.316 28.845 28.738 -0.348 0.000 1.043 330 Q HN 0.290 8.560 8.270 -0.000 0.000 0.505 331 L N 1.306 122.389 121.223 -0.235 0.000 2.367 331 L HA 0.258 4.593 4.340 -0.008 0.000 0.275 331 L C -0.404 176.234 176.870 -0.387 0.000 1.129 331 L CA -0.420 54.221 54.840 -0.331 0.000 0.839 331 L CB 0.725 42.579 42.059 -0.342 0.000 1.133 331 L HN 0.035 8.265 8.230 -0.000 0.000 0.453 332 A N 5.694 128.203 122.820 -0.519 0.000 2.360 332 A HA 0.545 4.860 4.320 -0.008 0.000 0.309 332 A C -1.013 176.242 177.584 -0.550 0.000 1.311 332 A CA -0.464 51.167 52.037 -0.677 0.000 0.805 332 A CB 0.143 18.662 19.000 -0.802 0.000 1.144 332 A HN 0.543 8.693 8.150 -0.000 0.000 0.486 333 F N 1.907 121.786 119.950 -0.119 0.000 2.404 333 F HA 0.337 4.860 4.527 -0.007 0.000 0.358 333 F C -0.005 175.858 175.800 0.105 0.000 1.120 333 F CA -0.139 57.819 58.000 -0.071 0.000 1.144 333 F CB 1.270 40.181 39.000 -0.149 0.000 1.133 333 F HN 0.420 8.720 8.300 -0.000 0.000 0.495 334 D N 5.810 126.307 120.400 0.161 0.000 2.381 334 D HA 0.219 4.854 4.640 -0.008 0.000 0.235 334 D C -1.840 174.412 176.300 -0.080 0.000 1.068 334 D CA -1.662 52.397 54.000 0.098 0.000 0.832 334 D CB 1.946 42.853 40.800 0.180 0.000 1.101 334 D HN 0.202 8.572 8.370 -0.000 0.000 0.515 335 P HA -0.176 4.244 4.420 -0.000 0.000 0.218 335 P C 1.384 178.671 177.300 -0.022 0.000 1.146 335 P CA 1.218 64.206 63.100 -0.187 0.000 0.813 335 P CB 0.324 31.827 31.700 -0.329 0.000 0.778 336 S N -2.273 113.434 115.700 0.012 0.000 2.603 336 S HA -0.041 4.425 4.470 -0.008 0.000 0.229 336 S C 0.888 175.529 174.600 0.068 0.000 0.972 336 S CA 0.264 58.497 58.200 0.055 0.000 0.935 336 S CB -1.180 62.058 63.200 0.063 0.000 0.769 336 S HN 0.158 8.468 8.310 -0.000 0.000 0.536 337 N N 1.271 120.011 118.700 0.067 0.000 3.229 337 N HA 0.352 5.087 4.740 -0.008 0.000 0.275 337 N C -1.248 174.353 175.510 0.152 0.000 1.225 337 N CA -0.062 53.032 53.050 0.074 0.000 1.119 337 N CB 0.215 38.721 38.487 0.032 0.000 1.392 337 N HN 0.405 8.785 8.380 -0.000 0.000 0.520 338 M N 2.574 122.241 119.600 0.112 0.000 2.190 338 M HA 0.404 4.879 4.480 -0.008 0.000 0.312 338 M C -2.375 173.917 176.300 -0.012 0.000 0.990 338 M CA -1.737 53.614 55.300 0.084 0.000 0.927 338 M CB 2.472 35.114 32.600 0.071 0.000 1.571 338 M HN 0.136 8.426 8.290 -0.000 0.000 0.427 339 P HA 0.419 4.839 4.420 -0.000 0.000 0.284 339 P C -2.831 174.398 177.300 -0.118 0.000 1.258 339 P CA -1.692 61.350 63.100 -0.097 0.000 0.824 339 P CB 0.126 31.755 31.700 -0.120 0.000 1.038 340 P HA -0.040 4.380 4.420 -0.000 0.000 0.257 340 P C 1.000 178.263 177.300 -0.061 0.000 1.144 340 P CA 1.751 64.826 63.100 -0.041 0.000 0.761 340 P CB -0.575 31.113 31.700 -0.020 0.000 0.734 341 G N 1.875 110.651 108.800 -0.040 0.000 2.231 341 G HA2 -0.173 3.783 3.960 -0.008 0.000 0.206 341 G HA3 -0.173 3.783 3.960 -0.008 0.000 0.206 341 G C -0.141 174.740 174.900 -0.032 0.000 0.996 341 G CA -0.350 44.733 45.100 -0.029 0.000 0.645 341 G HN 0.472 8.762 8.290 -0.000 0.000 0.498 342 I N 0.410 120.937 120.570 -0.071 0.000 2.689 342 I HA 0.835 5.000 4.170 -0.008 0.000 0.299 342 I C -0.241 175.903 176.117 0.046 0.000 1.059 342 I CA -1.000 60.274 61.300 -0.042 0.000 1.055 342 I CB 2.296 40.145 38.000 -0.251 0.000 1.243 342 I HN 0.268 8.478 8.210 -0.000 0.000 0.425 343 E N 5.262 125.566 120.200 0.173 0.000 2.431 343 E HA 0.401 4.746 4.350 -0.008 0.000 0.287 343 E C -2.938 173.830 176.600 0.280 0.000 1.032 343 E CA -1.475 55.037 56.400 0.188 0.000 0.839 343 E CB 2.268 32.050 29.700 0.136 0.000 1.218 343 E HN 0.232 8.592 8.360 -0.000 0.000 0.424 344 P HA 0.138 4.558 4.420 -0.000 0.000 0.274 344 P C -0.625 176.739 177.300 0.107 0.000 1.231 344 P CA -0.285 62.912 63.100 0.162 0.000 0.790 344 P CB 1.231 32.973 31.700 0.070 0.000 0.951 345 S N 1.289 116.988 115.700 -0.002 0.000 2.758 345 S HA 0.520 4.985 4.470 -0.008 0.000 0.292 345 S C -2.053 172.377 174.600 -0.283 0.000 1.131 345 S CA -1.504 56.640 58.200 -0.094 0.000 0.997 345 S CB 0.384 63.495 63.200 -0.149 0.000 1.111 345 S HN 0.189 8.499 8.310 -0.000 0.000 0.552 346 P HA 0.139 4.559 4.420 -0.000 0.000 0.245 346 P C -0.358 176.716 177.300 -0.376 0.000 1.212 346 P CA 0.133 62.921 63.100 -0.519 0.000 0.774 346 P CB -0.237 31.093 31.700 -0.618 0.000 0.999 347 D N 0.818 121.048 120.400 -0.284 0.000 2.854 347 D HA -0.133 4.502 4.640 -0.008 0.000 0.243 347 D C 1.104 177.342 176.300 -0.103 0.000 1.243 347 D CA 0.671 54.618 54.000 -0.087 0.000 0.883 347 D CB 0.542 41.290 40.800 -0.086 0.000 1.145 347 D HN 0.049 8.419 8.370 -0.000 0.000 0.555 348 K N 3.345 123.722 120.400 -0.039 0.000 2.074 348 K HA -0.168 4.147 4.320 -0.008 0.000 0.209 348 K C 2.079 178.665 176.600 -0.025 0.000 1.048 348 K CA 1.152 57.423 56.287 -0.027 0.000 0.926 348 K CB 0.024 32.536 32.500 0.021 0.000 0.713 348 K HN 0.492 8.742 8.250 -0.000 0.000 0.444 349 M N 0.204 119.810 119.600 0.011 0.000 2.159 349 M HA -0.119 4.356 4.480 -0.008 0.000 0.263 349 M C 2.176 178.401 176.300 -0.125 0.000 1.063 349 M CA 1.137 56.455 55.300 0.031 0.000 1.110 349 M CB -0.711 31.990 32.600 0.169 0.000 1.374 349 M HN 0.173 8.463 8.290 -0.000 0.000 0.411 350 L N 0.808 121.815 121.223 -0.361 0.000 2.072 350 L HA -0.128 4.207 4.340 -0.008 0.000 0.205 350 L C 2.306 179.019 176.870 -0.262 0.000 1.079 350 L CA 1.758 56.227 54.840 -0.617 0.000 0.752 350 L CB -0.777 40.803 42.059 -0.799 0.000 0.906 350 L HN 0.285 8.515 8.230 -0.000 0.000 0.436 351 Q N -0.417 119.280 119.800 -0.171 0.000 2.226 351 Q HA -0.075 4.260 4.340 -0.008 0.000 0.204 351 Q C 1.976 177.961 176.000 -0.025 0.000 0.975 351 Q CA 1.381 57.129 55.803 -0.091 0.000 0.866 351 Q CB -0.410 28.268 28.738 -0.100 0.000 0.915 351 Q HN 0.684 8.954 8.270 -0.000 0.000 0.440 352 G N 0.781 109.574 108.800 -0.013 0.000 2.459 352 G HA2 -0.147 3.808 3.960 -0.008 0.000 0.213 352 G HA3 -0.147 3.808 3.960 -0.008 0.000 0.213 352 G C 1.503 176.474 174.900 0.118 0.000 1.155 352 G CA -0.129 45.006 45.100 0.058 0.000 0.811 352 G HN 0.205 8.495 8.290 -0.000 0.000 0.534 353 R N -0.336 120.192 120.500 0.045 0.000 2.105 353 R HA -0.033 4.303 4.340 -0.008 0.000 0.239 353 R C 2.314 178.685 176.300 0.117 0.000 1.135 353 R CA 0.668 56.848 56.100 0.133 0.000 0.967 353 R CB -0.533 29.770 30.300 0.006 0.000 0.861 353 R HN 0.202 8.472 8.270 -0.000 0.000 0.442 354 L N 0.135 121.393 121.223 0.059 0.000 2.064 354 L HA -0.232 4.103 4.340 -0.008 0.000 0.216 354 L C 2.019 178.978 176.870 0.149 0.000 1.077 354 L CA 1.779 56.669 54.840 0.083 0.000 0.766 354 L CB -0.753 41.344 42.059 0.064 0.000 0.890 354 L HN 0.159 8.389 8.230 -0.000 0.000 0.435 355 F N -0.657 119.320 119.950 0.046 0.000 2.274 355 F HA 0.156 4.680 4.527 -0.006 0.000 0.288 355 F C 2.284 178.114 175.800 0.050 0.000 1.069 355 F CA 0.915 58.941 58.000 0.044 0.000 1.343 355 F CB -0.415 38.596 39.000 0.019 0.000 1.089 355 F HN -0.050 8.250 8.300 -0.000 0.000 0.517 356 A N -0.131 122.613 122.820 -0.126 0.000 1.978 356 A HA -0.197 4.118 4.320 -0.008 0.000 0.220 356 A C 1.971 179.333 177.584 -0.370 0.000 1.170 356 A CA 1.879 53.731 52.037 -0.308 0.000 0.636 356 A CB -1.567 17.375 19.000 -0.097 0.000 0.810 356 A HN 0.654 8.804 8.150 -0.000 0.000 0.448 357 Y N -0.124 119.992 120.300 -0.307 0.000 2.206 357 Y HA -0.038 4.509 4.550 -0.006 0.000 0.292 357 Y C -0.192 175.390 175.900 -0.530 0.000 1.123 357 Y CA 1.339 59.211 58.100 -0.381 0.000 1.142 357 Y CB -0.664 37.709 38.460 -0.144 0.000 1.006 357 Y HN 0.298 8.578 8.280 -0.000 0.000 0.518 358 P HA -0.109 4.311 4.420 -0.000 0.000 0.225 358 P C 0.572 177.756 177.300 -0.194 0.000 1.156 358 P CA 1.749 64.856 63.100 0.012 0.000 0.787 358 P CB 0.074 31.865 31.700 0.152 0.000 0.802 359 D N -0.589 119.573 120.400 -0.396 0.000 2.117 359 D HA -0.128 4.507 4.640 -0.008 0.000 0.198 359 D C 1.956 178.078 176.300 -0.296 0.000 0.982 359 D CA 1.437 55.177 54.000 -0.432 0.000 0.828 359 D CB -0.522 39.797 40.800 -0.802 0.000 0.967 359 D HN -0.021 8.349 8.370 -0.000 0.000 0.464 360 T N -2.260 112.064 114.554 -0.383 0.000 3.081 360 T HA 0.029 4.374 4.350 -0.008 0.000 0.255 360 T C 1.326 175.894 174.700 -0.221 0.000 1.113 360 T CA 0.559 62.497 62.100 -0.270 0.000 1.082 360 T CB -0.306 68.361 68.868 -0.335 0.000 0.939 360 T HN 0.290 8.530 8.240 -0.000 0.000 0.506 361 H N 0.188 119.064 119.070 -0.324 0.000 2.428 361 H HA 0.165 4.713 4.556 -0.013 0.000 0.296 361 H C 2.356 177.357 175.328 -0.545 0.000 1.062 361 H CA 0.743 56.413 56.048 -0.630 0.000 1.350 361 H CB 0.288 29.262 29.762 -1.313 0.000 1.403 361 H HN 0.229 8.509 8.280 -0.000 0.000 0.533 362 R N -0.561 119.834 120.500 -0.176 0.000 2.276 362 R HA -0.072 4.264 4.340 -0.008 0.000 0.203 362 R C 1.522 177.852 176.300 0.049 0.000 1.017 362 R CA 0.951 57.065 56.100 0.024 0.000 1.010 362 R CB 0.042 30.392 30.300 0.084 0.000 0.900 362 R HN 0.472 8.742 8.270 -0.000 0.000 0.469 363 H N 0.416 119.450 119.070 -0.060 0.000 2.334 363 H HA 0.148 4.709 4.556 0.009 0.000 0.315 363 H C 2.158 177.469 175.328 -0.027 0.000 1.056 363 H CA 0.863 56.887 56.048 -0.039 0.000 1.418 363 H CB 0.137 29.865 29.762 -0.056 0.000 1.464 363 H HN -0.119 8.161 8.280 -0.000 0.000 0.587 364 R N -0.259 120.110 120.500 -0.218 0.000 2.088 364 R HA -0.111 4.225 4.340 -0.008 0.000 0.232 364 R C 1.573 177.799 176.300 -0.123 0.000 1.136 364 R CA 2.148 58.139 56.100 -0.183 0.000 0.926 364 R CB -0.255 30.039 30.300 -0.009 0.000 0.837 364 R HN 0.336 8.606 8.270 -0.000 0.000 0.429 365 L N -1.477 119.702 121.223 -0.074 0.000 2.121 365 L HA 0.345 4.680 4.340 -0.008 0.000 0.200 365 L C 1.013 177.899 176.870 0.028 0.000 1.077 365 L CA 1.862 56.691 54.840 -0.018 0.000 0.766 365 L CB -0.405 41.641 42.059 -0.021 0.000 0.931 365 L HN 0.587 8.817 8.230 -0.000 0.000 0.452 366 G N -3.031 105.810 108.800 0.067 0.000 2.345 366 G HA2 0.143 4.098 3.960 -0.008 0.000 0.310 366 G HA3 0.143 4.098 3.960 -0.008 0.000 0.310 366 G C -2.413 172.608 174.900 0.202 0.000 1.476 366 G CA -0.375 44.782 45.100 0.095 0.000 0.978 366 G HN -0.166 8.124 8.290 -0.000 0.000 0.656 367 P HA -0.121 4.299 4.420 -0.000 0.000 0.218 367 P C 0.861 178.254 177.300 0.155 0.000 1.152 367 P CA 1.557 64.749 63.100 0.153 0.000 0.857 367 P CB -0.004 31.749 31.700 0.088 0.000 0.787 368 N N -1.936 116.830 118.700 0.109 0.000 2.535 368 N HA 0.086 4.821 4.740 -0.008 0.000 0.294 368 N C 0.395 175.885 175.510 -0.033 0.000 1.408 368 N CA -0.377 52.672 53.050 -0.001 0.000 0.927 368 N CB -0.219 38.262 38.487 -0.010 0.000 1.276 368 N HN 0.269 8.649 8.380 -0.000 0.000 0.505 369 Y N -1.496 118.794 120.300 -0.016 0.000 2.632 369 Y HA 0.205 4.747 4.550 -0.013 0.000 0.301 369 Y C 0.878 176.738 175.900 -0.067 0.000 1.172 369 Y CA 0.137 58.210 58.100 -0.045 0.000 1.328 369 Y CB -0.084 38.345 38.460 -0.052 0.000 1.016 369 Y HN 0.163 8.443 8.280 -0.000 0.000 0.529 370 L N 0.260 121.096 121.223 -0.646 0.000 2.592 370 L HA 0.099 4.434 4.340 -0.008 0.000 0.227 370 L C 1.452 178.193 176.870 -0.215 0.000 1.127 370 L CA 0.422 54.966 54.840 -0.494 0.000 0.884 370 L CB -0.010 41.722 42.059 -0.544 0.000 1.065 370 L HN 0.328 8.558 8.230 -0.000 0.000 0.457 371 Q N -0.402 119.309 119.800 -0.148 0.000 2.282 371 Q HA 0.137 4.472 4.340 -0.008 0.000 0.206 371 Q C -0.151 175.821 176.000 -0.048 0.000 0.878 371 Q CA -0.255 55.502 55.803 -0.076 0.000 0.944 371 Q CB 0.874 29.576 28.738 -0.059 0.000 1.100 371 Q HN 0.224 8.494 8.270 -0.000 0.000 0.509 372 I N 2.824 123.365 120.570 -0.047 0.000 2.578 372 I HA -0.003 4.162 4.170 -0.008 0.000 0.286 372 I C -1.538 174.561 176.117 -0.030 0.000 1.126 372 I CA -2.289 58.994 61.300 -0.028 0.000 1.380 372 I CB 0.172 38.158 38.000 -0.024 0.000 1.408 372 I HN -0.072 8.138 8.210 -0.000 0.000 0.532 373 P HA -0.317 4.103 4.420 -0.000 0.000 0.227 373 P C 1.852 179.132 177.300 -0.032 0.000 1.106 373 P CA 1.481 64.546 63.100 -0.058 0.000 0.998 373 P CB 0.080 31.730 31.700 -0.083 0.000 0.769 374 V N -1.103 118.800 119.914 -0.018 0.000 2.913 374 V HA -0.116 3.999 4.120 -0.008 0.000 0.260 374 V C 1.409 177.593 176.094 0.150 0.000 1.098 374 V CA 1.882 64.219 62.300 0.063 0.000 1.121 374 V CB -0.956 30.907 31.823 0.067 0.000 0.714 374 V HN 0.119 8.309 8.190 -0.000 0.000 0.487 375 N N -1.069 117.662 118.700 0.052 0.000 2.236 375 N HA 0.110 4.846 4.740 -0.008 0.000 0.196 375 N C 0.260 175.786 175.510 0.027 0.000 1.114 375 N CA 0.295 53.336 53.050 -0.016 0.000 0.859 375 N CB 0.023 38.457 38.487 -0.088 0.000 0.982 375 N HN 0.468 8.848 8.380 -0.000 0.000 0.493 376 C N 3.737 123.109 119.300 0.120 0.000 2.514 376 C HA 0.318 4.774 4.460 -0.008 0.000 0.392 376 C C -2.033 173.103 174.990 0.244 0.000 1.294 376 C CA -1.496 57.592 59.018 0.117 0.000 1.957 376 C CB 0.263 28.060 27.740 0.095 0.000 2.541 376 C HN 0.200 8.430 8.230 -0.000 0.000 0.569 377 P HA 0.126 4.546 4.420 -0.000 0.000 0.252 377 P C -0.288 177.049 177.300 0.063 0.000 1.727 377 P CA 0.147 63.310 63.100 0.104 0.000 1.134 377 P CB -0.506 31.206 31.700 0.019 0.000 1.876 378 Y N 1.571 121.927 120.300 0.093 0.000 2.420 378 Y HA 0.201 4.745 4.550 -0.009 0.000 0.292 378 Y C 1.766 177.662 175.900 -0.007 0.000 1.119 378 Y CA 0.258 58.349 58.100 -0.014 0.000 1.229 378 Y CB -0.587 37.817 38.460 -0.093 0.000 1.026 378 Y HN -0.069 8.211 8.280 -0.000 0.000 0.554 379 R N 1.765 121.989 120.500 -0.460 0.000 2.328 379 R HA 0.374 4.709 4.340 -0.008 0.000 0.206 379 R C -0.258 175.985 176.300 -0.096 0.000 0.990 379 R CA 0.160 56.108 56.100 -0.254 0.000 1.085 379 R CB -0.746 29.371 30.300 -0.305 0.000 0.998 379 R HN 0.585 8.855 8.270 -0.000 0.000 0.484 380 A N -0.912 121.874 122.820 -0.057 0.000 2.507 380 A HA 0.717 5.032 4.320 -0.008 0.000 0.284 380 A C -1.165 176.410 177.584 -0.015 0.000 1.281 380 A CA -0.726 51.294 52.037 -0.029 0.000 0.744 380 A CB 1.320 20.303 19.000 -0.027 0.000 1.332 380 A HN 0.129 8.279 8.150 -0.000 0.000 0.454 381 R N 0.596 121.085 120.500 -0.018 0.000 2.468 381 R HA 0.504 4.839 4.340 -0.008 0.000 0.302 381 R C -1.829 174.450 176.300 -0.035 0.000 1.041 381 R CA -0.293 55.794 56.100 -0.022 0.000 0.899 381 R CB 1.322 31.609 30.300 -0.022 0.000 1.167 381 R HN 0.518 8.788 8.270 -0.000 0.000 0.483 382 V N 3.652 123.543 119.914 -0.039 0.000 2.439 382 V HA 0.363 4.479 4.120 -0.008 0.000 0.271 382 V C 0.269 176.314 176.094 -0.082 0.000 1.040 382 V CA -0.091 62.175 62.300 -0.056 0.000 1.002 382 V CB 0.950 32.741 31.823 -0.053 0.000 1.000 382 V HN 0.794 8.984 8.190 -0.000 0.000 0.477 383 A N 6.345 129.099 122.820 -0.110 0.000 2.411 383 A HA 0.787 5.102 4.320 -0.008 0.000 0.285 383 A C -0.180 177.255 177.584 -0.248 0.000 1.129 383 A CA -0.656 51.279 52.037 -0.171 0.000 0.736 383 A CB 0.902 19.805 19.000 -0.163 0.000 1.186 383 A HN 0.937 9.087 8.150 -0.000 0.000 0.445 384 N N -0.008 118.493 118.700 -0.330 0.000 3.588 384 N HA 0.330 5.065 4.740 -0.008 0.000 0.340 384 N C -0.876 174.296 175.510 -0.563 0.000 1.609 384 N CA -0.576 52.249 53.050 -0.375 0.000 0.811 384 N CB 0.590 39.000 38.487 -0.128 0.000 2.184 384 N HN 0.272 8.652 8.380 -0.000 0.000 0.577 385 Y N 0.064 120.330 120.300 -0.057 0.000 2.557 385 Y HA 0.220 4.765 4.550 -0.009 0.000 0.247 385 Y C 0.178 176.084 175.900 0.011 0.000 1.164 385 Y CA -0.583 57.510 58.100 -0.012 0.000 1.218 385 Y CB 0.466 38.928 38.460 0.003 0.000 1.210 385 Y HN 0.272 8.552 8.280 -0.000 0.000 0.529 386 Q N 1.457 121.298 119.800 0.068 0.000 2.288 386 Q HA 0.521 4.856 4.340 -0.008 0.000 0.254 386 Q C -0.323 175.691 176.000 0.022 0.000 0.932 386 Q CA -0.333 55.501 55.803 0.051 0.000 0.902 386 Q CB 1.516 30.273 28.738 0.032 0.000 1.203 386 Q HN 0.090 8.360 8.270 -0.000 0.000 0.415 387 R N 1.606 122.127 120.500 0.035 0.000 2.836 387 R HA 0.417 4.752 4.340 -0.008 0.000 0.269 387 R C -0.571 175.743 176.300 0.024 0.000 1.010 387 R CA -0.586 55.529 56.100 0.025 0.000 0.930 387 R CB 1.016 31.340 30.300 0.038 0.000 1.218 387 R HN 0.782 9.052 8.270 -0.000 0.000 0.473 388 D N -0.353 120.058 120.400 0.017 0.000 3.496 388 D HA -0.155 4.480 4.640 -0.008 0.000 0.238 388 D C 0.248 176.559 176.300 0.019 0.000 1.707 388 D CA 2.085 56.097 54.000 0.019 0.000 1.150 388 D CB -0.890 39.925 40.800 0.025 0.000 0.759 388 D HN 0.882 9.252 8.370 -0.000 0.000 0.936 389 G N -1.242 107.572 108.800 0.024 0.000 2.705 389 G HA2 0.105 4.060 3.960 -0.008 0.000 0.686 389 G HA3 0.105 4.060 3.960 -0.008 0.000 0.686 389 G C -2.844 172.071 174.900 0.025 0.000 1.285 389 G CA -0.399 44.718 45.100 0.028 0.000 0.800 389 G HN 0.489 8.779 8.290 -0.000 0.000 0.611 390 P HA 0.257 4.677 4.420 -0.000 0.000 0.267 390 P C 1.010 178.325 177.300 0.026 0.000 1.201 390 P CA 0.224 63.340 63.100 0.027 0.000 0.775 390 P CB 0.240 31.959 31.700 0.031 0.000 0.854 391 M N -1.240 118.373 119.600 0.023 0.000 2.169 391 M HA -0.198 4.277 4.480 -0.008 0.000 0.196 391 M C -0.066 176.243 176.300 0.015 0.000 0.355 391 M CA 0.462 55.775 55.300 0.022 0.000 0.396 391 M CB -2.544 30.073 32.600 0.030 0.000 1.125 391 M HN 0.427 8.717 8.290 -0.000 0.000 0.939 392 C N 1.723 121.030 119.300 0.011 0.000 2.459 392 C HA 0.218 4.673 4.460 -0.008 0.000 0.358 392 C C 1.852 176.841 174.990 -0.001 0.000 1.162 392 C CA -0.655 58.364 59.018 0.002 0.000 1.559 392 C CB -0.218 27.524 27.740 0.003 0.000 2.132 392 C HN 0.604 8.834 8.230 -0.000 0.000 0.536 393 M N 4.564 124.161 119.600 -0.006 0.000 2.193 393 M HA 0.048 4.523 4.480 -0.008 0.000 0.265 393 M C 1.541 177.834 176.300 -0.012 0.000 1.071 393 M CA 1.555 56.851 55.300 -0.007 0.000 1.140 393 M CB -0.850 31.743 32.600 -0.010 0.000 1.369 393 M HN 0.647 8.937 8.290 -0.000 0.000 0.423 394 M N 0.882 120.471 119.600 -0.018 0.000 1.703 394 M HA -0.010 4.466 4.480 -0.008 0.000 0.141 394 M C 1.309 177.599 176.300 -0.017 0.000 1.136 394 M CA 0.437 55.725 55.300 -0.020 0.000 0.771 394 M CB -1.001 31.583 32.600 -0.027 0.000 0.942 394 M HN 0.192 8.482 8.290 -0.000 0.000 0.416 395 D N -0.399 119.989 120.400 -0.019 0.000 2.349 395 D HA -0.088 4.548 4.640 -0.008 0.000 0.224 395 D C 0.429 176.718 176.300 -0.018 0.000 1.029 395 D CA 0.181 54.171 54.000 -0.017 0.000 0.879 395 D CB -0.852 39.937 40.800 -0.018 0.000 0.906 395 D HN 0.833 9.203 8.370 -0.000 0.000 0.528 396 N N 0.919 119.606 118.700 -0.021 0.000 2.714 396 N HA -0.309 4.426 4.740 -0.008 0.000 0.250 396 N C -0.703 174.790 175.510 -0.028 0.000 1.117 396 N CA 0.718 53.755 53.050 -0.021 0.000 0.719 396 N CB -0.733 37.747 38.487 -0.011 0.000 1.081 396 N HN 0.355 8.735 8.380 -0.000 0.000 0.557 397 Q N -3.291 116.488 119.800 -0.036 0.000 2.503 397 Q HA -0.227 4.108 4.340 -0.008 0.000 0.267 397 Q C 0.861 176.838 176.000 -0.039 0.000 1.030 397 Q CA 0.952 56.726 55.803 -0.049 0.000 1.041 397 Q CB -1.949 26.743 28.738 -0.076 0.000 1.406 397 Q HN 0.898 9.168 8.270 -0.000 0.000 0.524 398 G N -0.689 108.095 108.800 -0.026 0.000 2.552 398 G HA2 -0.289 3.666 3.960 -0.008 0.000 0.265 398 G HA3 -0.289 3.666 3.960 -0.008 0.000 0.265 398 G C 0.467 175.358 174.900 -0.015 0.000 1.234 398 G CA 0.167 45.255 45.100 -0.019 0.000 0.944 398 G HN 0.873 9.163 8.290 -0.000 0.000 0.568 399 G N 0.381 109.172 108.800 -0.014 0.000 3.371 399 G HA2 0.639 4.595 3.960 -0.008 0.000 0.248 399 G HA3 0.639 4.595 3.960 -0.008 0.000 0.248 399 G C 0.703 175.594 174.900 -0.015 0.000 1.161 399 G CA 1.265 46.357 45.100 -0.012 0.000 0.796 399 G HN 1.851 10.141 8.290 -0.000 0.000 0.539 400 A N 1.320 124.128 122.820 -0.019 0.000 2.488 400 A HA 0.542 4.857 4.320 -0.008 0.000 0.249 400 A C -1.842 175.742 177.584 -0.000 0.000 1.083 400 A CA -0.937 51.087 52.037 -0.021 0.000 0.768 400 A CB -0.014 18.952 19.000 -0.056 0.000 1.017 400 A HN 0.197 8.347 8.150 -0.000 0.000 0.496 401 P HA -0.108 4.312 4.420 -0.000 0.000 0.259 401 P C 0.348 177.740 177.300 0.154 0.000 1.155 401 P CA 0.858 63.997 63.100 0.064 0.000 0.759 401 P CB 0.157 31.856 31.700 -0.002 0.000 0.753 402 N N 2.127 120.980 118.700 0.255 0.000 2.230 402 N HA 0.017 4.752 4.740 -0.008 0.000 0.202 402 N C -0.332 175.458 175.510 0.467 0.000 1.119 402 N CA -0.570 52.682 53.050 0.337 0.000 0.851 402 N CB 0.039 38.653 38.487 0.212 0.000 0.990 402 N HN 0.466 8.846 8.380 -0.000 0.000 0.497 403 Y N -2.092 118.359 120.300 0.251 0.000 2.524 403 Y HA 0.645 5.189 4.550 -0.009 0.000 0.344 403 Y C -1.669 174.139 175.900 -0.154 0.000 1.012 403 Y CA -1.717 56.415 58.100 0.054 0.000 1.068 403 Y CB 1.045 39.529 38.460 0.040 0.000 1.249 403 Y HN -0.102 8.178 8.280 -0.000 0.000 0.468 404 Y N 4.772 124.754 120.300 -0.529 0.000 2.346 404 Y HA 0.602 5.147 4.550 -0.008 0.000 0.332 404 Y C -2.485 173.267 175.900 -0.248 0.000 0.985 404 Y CA -2.595 55.105 58.100 -0.666 0.000 1.112 404 Y CB 1.497 39.286 38.460 -1.119 0.000 1.170 404 Y HN 0.792 9.072 8.280 -0.000 0.000 0.447 405 P HA 0.435 4.855 4.420 -0.000 0.000 0.281 405 P C -1.673 175.412 177.300 -0.358 0.000 1.281 405 P CA -0.591 62.026 63.100 -0.805 0.000 0.811 405 P CB 1.776 33.032 31.700 -0.741 0.000 1.154 406 N N -2.116 116.407 118.700 -0.295 0.000 2.484 406 N HA 0.103 4.838 4.740 -0.008 0.000 0.269 406 N C -0.663 174.829 175.510 -0.030 0.000 1.237 406 N CA -0.769 52.202 53.050 -0.132 0.000 0.838 406 N CB 1.196 39.419 38.487 -0.440 0.000 1.593 406 N HN 0.202 8.582 8.380 -0.000 0.000 0.485 407 S N 0.560 116.249 115.700 -0.017 0.000 2.763 407 S HA 0.228 4.693 4.470 -0.008 0.000 0.237 407 S C -0.530 173.810 174.600 -0.433 0.000 0.966 407 S CA -0.270 57.747 58.200 -0.305 0.000 1.017 407 S CB -1.055 61.826 63.200 -0.530 0.000 0.780 407 S HN 0.515 8.825 8.310 -0.000 0.000 0.476 408 F N 0.353 120.302 119.950 -0.002 0.000 2.837 408 F HA 0.301 4.824 4.527 -0.007 0.000 0.328 408 F C 0.912 176.721 175.800 0.015 0.000 1.173 408 F CA -0.625 57.384 58.000 0.014 0.000 1.160 408 F CB -0.139 38.882 39.000 0.034 0.000 1.115 408 F HN 0.064 8.364 8.300 -0.000 0.000 0.512 409 S N 0.268 116.054 115.700 0.143 0.000 3.482 409 S HA -0.155 4.310 4.470 -0.008 0.000 0.294 409 S C 0.654 175.312 174.600 0.096 0.000 1.244 409 S CA 0.224 58.480 58.200 0.094 0.000 0.911 409 S CB -1.663 61.578 63.200 0.067 0.000 1.070 409 S HN 0.601 8.911 8.310 -0.000 0.000 0.614 410 A N 1.641 124.542 122.820 0.136 0.000 2.346 410 A HA 0.610 4.925 4.320 -0.008 0.000 0.252 410 A C -1.602 176.059 177.584 0.129 0.000 1.089 410 A CA -1.090 51.013 52.037 0.110 0.000 0.797 410 A CB -0.309 18.778 19.000 0.146 0.000 1.047 410 A HN 0.233 8.383 8.150 -0.000 0.000 0.494 411 P HA 0.063 4.483 4.420 -0.000 0.000 0.268 411 P C -0.437 176.907 177.300 0.073 0.000 1.189 411 P CA 0.515 63.593 63.100 -0.037 0.000 0.771 411 P CB 0.318 31.888 31.700 -0.216 0.000 0.822 412 E N 0.598 120.813 120.200 0.024 0.000 2.343 412 E HA 0.257 4.602 4.350 -0.008 0.000 0.270 412 E C -0.273 176.330 176.600 0.004 0.000 0.895 412 E CA -0.672 55.749 56.400 0.034 0.000 0.767 412 E CB 1.278 31.028 29.700 0.083 0.000 1.248 412 E HN 0.602 8.962 8.360 -0.000 0.000 0.440 413 H N -0.254 118.876 119.070 0.100 0.000 2.547 413 H HA 0.402 4.953 4.556 -0.008 0.000 0.362 413 H C -0.391 174.977 175.328 0.066 0.000 1.181 413 H CA -0.733 55.349 56.048 0.057 0.000 1.376 413 H CB 0.549 30.356 29.762 0.075 0.000 1.488 413 H HN 0.301 8.581 8.280 -0.000 0.000 0.583 414 Q N 2.514 122.454 119.800 0.234 0.000 2.347 414 Q HA 0.315 4.650 4.340 -0.008 0.000 0.265 414 Q C -2.344 173.694 176.000 0.064 0.000 1.024 414 Q CA -1.987 53.895 55.803 0.130 0.000 0.731 414 Q CB 1.698 30.487 28.738 0.085 0.000 1.245 414 Q HN 0.437 8.707 8.270 -0.000 0.000 0.472 415 P HA -0.210 4.210 4.420 -0.000 0.000 0.217 415 P C 0.853 178.156 177.300 0.005 0.000 1.148 415 P CA 1.635 64.735 63.100 -0.000 0.000 0.828 415 P CB 0.242 31.950 31.700 0.013 0.000 0.783 416 S N -1.582 114.129 115.700 0.019 0.000 2.595 416 S HA 0.083 4.548 4.470 -0.008 0.000 0.235 416 S C 1.500 176.109 174.600 0.016 0.000 0.974 416 S CA 0.664 58.874 58.200 0.016 0.000 0.942 416 S CB -0.767 62.444 63.200 0.018 0.000 0.766 416 S HN 0.117 8.427 8.310 -0.000 0.000 0.536 417 A N 0.528 123.357 122.820 0.015 0.000 2.503 417 A HA 0.543 4.858 4.320 -0.008 0.000 0.263 417 A C 0.500 178.093 177.584 0.016 0.000 1.258 417 A CA -0.565 51.482 52.037 0.016 0.000 0.936 417 A CB -0.048 18.963 19.000 0.018 0.000 1.070 417 A HN 0.503 8.653 8.150 -0.000 0.000 0.522 418 L N 1.121 122.349 121.223 0.009 0.000 2.483 418 L HA 0.108 4.443 4.340 -0.008 0.000 0.275 418 L C 0.442 177.334 176.870 0.037 0.000 1.220 418 L CA -0.309 54.536 54.840 0.009 0.000 0.833 418 L CB 0.438 42.493 42.059 -0.007 0.000 1.102 418 L HN 0.363 8.593 8.230 -0.000 0.000 0.490 419 E N -0.203 120.027 120.200 0.050 0.000 2.376 419 E HA 0.110 4.456 4.350 -0.008 0.000 0.254 419 E C -0.625 176.049 176.600 0.123 0.000 1.213 419 E CA -0.317 56.138 56.400 0.090 0.000 0.945 419 E CB 0.255 30.011 29.700 0.094 0.000 1.057 419 E HN 0.438 8.798 8.360 -0.000 0.000 0.479 420 H N 0.276 119.376 119.070 0.050 0.000 2.668 420 H HA 0.197 4.749 4.556 -0.008 0.000 0.303 420 H C -0.207 175.158 175.328 0.062 0.000 1.074 420 H CA -0.568 55.505 56.048 0.041 0.000 1.406 420 H CB 0.619 30.402 29.762 0.034 0.000 1.442 420 H HN 0.207 8.487 8.280 -0.000 0.000 0.482 421 R N 4.033 124.345 120.500 -0.313 0.000 2.538 421 R HA 0.124 4.459 4.340 -0.008 0.000 0.282 421 R C -0.644 175.412 176.300 -0.407 0.000 1.009 421 R CA 0.798 56.744 56.100 -0.257 0.000 1.063 421 R CB 0.296 30.474 30.300 -0.203 0.000 0.945 421 R HN 0.821 9.091 8.270 -0.000 0.000 0.414 422 T N 2.310 116.784 114.554 -0.133 0.000 2.840 422 T HA 0.163 4.509 4.350 -0.008 0.000 0.317 422 T C -1.893 172.750 174.700 -0.096 0.000 1.401 422 T CA -0.693 61.364 62.100 -0.072 0.000 1.028 422 T CB 1.109 70.033 68.868 0.093 0.000 1.317 422 T HN 0.702 8.942 8.240 -0.000 0.000 0.495 423 H N 2.598 121.463 119.070 -0.342 0.000 2.529 423 H HA 0.646 5.197 4.556 -0.008 0.000 0.348 423 H C -1.783 173.238 175.328 -0.513 0.000 1.079 423 H CA -0.573 55.318 56.048 -0.262 0.000 1.198 423 H CB 0.864 30.538 29.762 -0.147 0.000 1.521 423 H HN 0.506 8.786 8.280 -0.000 0.000 0.514 424 F N 1.866 121.438 119.950 -0.630 0.000 2.561 424 F HA 0.255 4.778 4.527 -0.007 0.000 0.313 424 F C -0.010 175.530 175.800 -0.434 0.000 1.126 424 F CA -0.661 57.117 58.000 -0.370 0.000 0.918 424 F CB 2.423 41.311 39.000 -0.185 0.000 1.199 424 F HN 0.331 8.631 8.300 -0.000 0.000 0.444 425 S N 1.930 117.612 115.700 -0.031 0.000 2.659 425 S HA 0.893 5.358 4.470 -0.008 0.000 0.312 425 S C -0.384 174.248 174.600 0.053 0.000 1.114 425 S CA -0.095 58.118 58.200 0.022 0.000 1.063 425 S CB 0.973 64.243 63.200 0.117 0.000 0.996 425 S HN 1.151 9.461 8.310 -0.000 0.000 0.478 426 G N 2.961 111.790 108.800 0.049 0.000 2.321 426 G HA2 0.325 4.280 3.960 -0.008 0.000 0.296 426 G HA3 0.325 4.280 3.960 -0.008 0.000 0.296 426 G C -2.275 172.679 174.900 0.090 0.000 1.287 426 G CA -0.722 44.410 45.100 0.054 0.000 0.846 426 G HN 0.512 8.802 8.290 -0.000 0.000 0.508 427 D N 0.074 120.568 120.400 0.157 0.000 2.210 427 D HA 0.437 5.072 4.640 -0.008 0.000 0.249 427 D C 0.350 176.793 176.300 0.238 0.000 1.078 427 D CA -0.133 53.980 54.000 0.188 0.000 0.875 427 D CB 2.042 42.981 40.800 0.231 0.000 1.175 427 D HN 0.166 8.536 8.370 -0.000 0.000 0.440 428 V N 3.643 123.633 119.914 0.127 0.000 2.364 428 V HA 0.130 4.245 4.120 -0.008 0.000 0.252 428 V C 0.430 176.549 176.094 0.040 0.000 1.075 428 V CA 0.430 62.787 62.300 0.095 0.000 1.033 428 V CB -0.305 31.541 31.823 0.039 0.000 1.116 428 V HN 0.481 8.671 8.190 -0.000 0.000 0.488 429 Q N 4.797 124.616 119.800 0.031 0.000 2.707 429 Q HA 0.573 4.908 4.340 -0.008 0.000 0.307 429 Q C -1.143 174.616 176.000 -0.401 0.000 0.934 429 Q CA -1.071 54.547 55.803 -0.308 0.000 0.753 429 Q CB 1.997 30.419 28.738 -0.526 0.000 1.478 429 Q HN 0.587 8.857 8.270 -0.000 0.000 0.458 430 R N 1.298 121.487 120.500 -0.518 0.000 2.272 430 R HA 0.364 4.700 4.340 -0.008 0.000 0.323 430 R C -1.294 174.768 176.300 -0.397 0.000 1.002 430 R CA -0.288 55.643 56.100 -0.282 0.000 0.900 430 R CB 0.583 30.792 30.300 -0.152 0.000 1.151 430 R HN 0.312 8.582 8.270 -0.000 0.000 0.507 431 F N 1.573 121.525 119.950 0.004 0.000 2.420 431 F HA 0.160 4.682 4.527 -0.008 0.000 0.352 431 F C 1.274 177.084 175.800 0.017 0.000 1.108 431 F CA -0.563 57.445 58.000 0.012 0.000 1.162 431 F CB 0.442 39.452 39.000 0.016 0.000 1.118 431 F HN 0.344 8.644 8.300 -0.000 0.000 0.510 432 N N 0.954 119.726 118.700 0.120 0.000 2.344 432 N HA -0.003 4.732 4.740 -0.008 0.000 0.236 432 N C 0.405 175.983 175.510 0.113 0.000 1.279 432 N CA 0.595 53.697 53.050 0.087 0.000 0.882 432 N CB 0.726 39.247 38.487 0.058 0.000 1.110 432 N HN 0.673 9.053 8.380 -0.000 0.000 0.436 433 S N -1.056 114.693 115.700 0.081 0.000 2.800 433 S HA 0.244 4.709 4.470 -0.008 0.000 0.266 433 S C 1.073 175.701 174.600 0.046 0.000 1.029 433 S CA 0.042 58.287 58.200 0.075 0.000 1.302 433 S CB -0.045 63.204 63.200 0.082 0.000 1.212 433 S HN 0.530 8.840 8.310 -0.000 0.000 0.683 434 A N 2.737 125.577 122.820 0.034 0.000 2.066 434 A HA 0.087 4.402 4.320 -0.008 0.000 0.218 434 A C 1.692 179.279 177.584 0.005 0.000 1.157 434 A CA 1.075 53.118 52.037 0.009 0.000 0.670 434 A CB -0.404 18.595 19.000 -0.001 0.000 0.804 434 A HN 0.470 8.620 8.150 -0.000 0.000 0.453 435 N N 0.772 119.485 118.700 0.021 0.000 2.280 435 N HA 0.033 4.768 4.740 -0.008 0.000 0.192 435 N C -0.702 174.824 175.510 0.027 0.000 1.109 435 N CA 0.005 53.066 53.050 0.018 0.000 0.855 435 N CB 0.046 38.544 38.487 0.019 0.000 0.974 435 N HN 0.399 8.779 8.380 -0.000 0.000 0.482 436 D N 1.117 121.537 120.400 0.034 0.000 2.341 436 D HA -0.095 4.540 4.640 -0.008 0.000 0.235 436 D C 0.364 176.680 176.300 0.027 0.000 1.265 436 D CA 0.388 54.416 54.000 0.045 0.000 0.888 436 D CB 0.550 41.382 40.800 0.054 0.000 1.192 436 D HN 0.038 8.408 8.370 -0.000 0.000 0.462 437 D N -0.160 120.267 120.400 0.046 0.000 2.412 437 D HA -0.041 4.595 4.640 -0.008 0.000 0.257 437 D C 0.138 176.410 176.300 -0.046 0.000 1.217 437 D CA 0.338 54.358 54.000 0.033 0.000 0.897 437 D CB -0.134 40.748 40.800 0.137 0.000 1.132 437 D HN 0.255 8.625 8.370 -0.000 0.000 0.493 438 N N 2.171 120.844 118.700 -0.045 0.000 2.236 438 N HA 0.029 4.764 4.740 -0.008 0.000 0.196 438 N C 1.101 176.559 175.510 -0.085 0.000 1.114 438 N CA 0.091 53.094 53.050 -0.078 0.000 0.859 438 N CB 1.060 39.504 38.487 -0.071 0.000 0.982 438 N HN 0.359 8.739 8.380 -0.000 0.000 0.493 439 V N -4.284 115.596 119.914 -0.057 0.000 3.305 439 V HA 0.153 4.268 4.120 -0.008 0.000 0.247 439 V C 1.725 177.804 176.094 -0.024 0.000 1.426 439 V CA 0.253 62.537 62.300 -0.027 0.000 1.162 439 V CB -0.093 31.751 31.823 0.035 0.000 0.961 439 V HN -0.064 8.126 8.190 -0.000 0.000 0.449 440 T N 1.453 116.009 114.554 0.003 0.000 2.428 440 T HA -0.334 4.011 4.350 -0.008 0.000 0.248 440 T C 1.846 176.546 174.700 -0.000 0.000 1.284 440 T CA 3.095 65.228 62.100 0.055 0.000 1.217 440 T CB -0.732 68.242 68.868 0.177 0.000 0.864 440 T HN 0.660 8.900 8.240 -0.000 0.000 0.402 441 Q N 0.362 120.105 119.800 -0.095 0.000 2.224 441 Q HA -0.184 4.151 4.340 -0.008 0.000 0.213 441 Q C 2.544 178.400 176.000 -0.241 0.000 0.998 441 Q CA 1.890 57.584 55.803 -0.182 0.000 0.895 441 Q CB -0.935 27.573 28.738 -0.384 0.000 0.926 441 Q HN 0.482 8.752 8.270 -0.000 0.000 0.417 442 V N 0.584 120.290 119.914 -0.346 0.000 2.237 442 V HA -0.305 3.811 4.120 -0.008 0.000 0.245 442 V C 2.339 178.551 176.094 0.196 0.000 1.046 442 V CA 2.227 64.468 62.300 -0.097 0.000 1.007 442 V CB -0.800 31.007 31.823 -0.027 0.000 0.638 442 V HN 0.304 8.494 8.190 -0.000 0.000 0.445 443 R N 0.434 121.029 120.500 0.157 0.000 2.133 443 R HA -0.270 4.065 4.340 -0.008 0.000 0.245 443 R C 2.604 178.993 176.300 0.148 0.000 1.137 443 R CA 2.710 58.923 56.100 0.188 0.000 0.947 443 R CB -0.825 29.556 30.300 0.136 0.000 0.865 443 R HN 0.714 8.984 8.270 -0.000 0.000 0.437 444 T N -1.066 113.563 114.554 0.126 0.000 2.674 444 T HA -0.218 4.127 4.350 -0.008 0.000 0.265 444 T C 1.716 176.505 174.700 0.148 0.000 1.039 444 T CA 1.451 63.614 62.100 0.104 0.000 1.150 444 T CB -0.586 68.351 68.868 0.114 0.000 0.864 444 T HN 0.361 8.601 8.240 -0.000 0.000 0.427 445 F N 1.097 121.111 119.950 0.108 0.000 2.048 445 F HA -0.264 4.259 4.527 -0.007 0.000 0.296 445 F C 2.148 178.036 175.800 0.146 0.000 1.109 445 F CA 2.198 60.304 58.000 0.178 0.000 1.214 445 F CB -1.139 38.053 39.000 0.321 0.000 0.963 445 F HN 0.396 8.696 8.300 -0.000 0.000 0.491 446 Y N -0.245 120.012 120.300 -0.072 0.000 2.439 446 Y HA -0.072 4.474 4.550 -0.008 0.000 0.292 446 Y C 1.864 177.588 175.900 -0.292 0.000 1.130 446 Y CA 1.012 58.918 58.100 -0.323 0.000 1.254 446 Y CB 0.025 38.303 38.460 -0.304 0.000 1.000 446 Y HN 0.173 8.453 8.280 -0.000 0.000 0.554 447 L N 0.017 121.087 121.223 -0.255 0.000 2.357 447 L HA -0.010 4.325 4.340 -0.008 0.000 0.211 447 L C 1.475 178.198 176.870 -0.244 0.000 1.075 447 L CA 0.693 55.327 54.840 -0.344 0.000 0.830 447 L CB -0.043 41.852 42.059 -0.273 0.000 0.996 447 L HN 0.182 8.412 8.230 -0.000 0.000 0.467 448 K N -1.393 118.910 120.400 -0.161 0.000 2.438 448 K HA 0.212 4.527 4.320 -0.008 0.000 0.206 448 K C 1.204 177.750 176.600 -0.090 0.000 1.081 448 K CA 0.317 56.542 56.287 -0.103 0.000 1.053 448 K CB 0.976 33.454 32.500 -0.036 0.000 0.908 448 K HN 0.029 8.279 8.250 -0.000 0.000 0.556 449 V N 1.433 121.258 119.914 -0.149 0.000 3.621 449 V HA 0.240 4.356 4.120 -0.008 0.000 0.263 449 V C 0.536 176.490 176.094 -0.234 0.000 1.272 449 V CA 0.136 62.360 62.300 -0.127 0.000 1.080 449 V CB 0.355 32.169 31.823 -0.014 0.000 0.816 449 V HN 0.323 8.513 8.190 -0.000 0.000 0.451 450 L N 0.294 121.319 121.223 -0.330 0.000 2.401 450 L HA 0.600 4.935 4.340 -0.008 0.000 0.266 450 L C 0.154 176.888 176.870 -0.227 0.000 0.991 450 L CA -0.662 53.995 54.840 -0.305 0.000 0.818 450 L CB 2.024 43.772 42.059 -0.519 0.000 1.321 450 L HN 0.248 8.478 8.230 -0.000 0.000 0.413 451 N N 1.972 120.581 118.700 -0.151 0.000 2.284 451 N HA 0.077 4.812 4.740 -0.008 0.000 0.266 451 N C 0.476 175.906 175.510 -0.133 0.000 1.321 451 N CA 0.272 53.248 53.050 -0.123 0.000 0.933 451 N CB -0.070 38.370 38.487 -0.078 0.000 1.067 451 N HN 0.725 9.105 8.380 -0.000 0.000 0.447 452 E N -1.623 118.524 120.200 -0.089 0.000 2.364 452 E HA 0.112 4.457 4.350 -0.008 0.000 0.203 452 E C 1.375 177.952 176.600 -0.038 0.000 0.888 452 E CA 0.154 56.508 56.400 -0.078 0.000 0.989 452 E CB -0.167 29.494 29.700 -0.066 0.000 0.985 452 E HN 0.429 8.789 8.360 -0.000 0.000 0.499 453 E N 1.091 121.274 120.200 -0.028 0.000 2.023 453 E HA -0.182 4.163 4.350 -0.008 0.000 0.196 453 E C 1.973 178.578 176.600 0.009 0.000 1.003 453 E CA 1.196 57.593 56.400 -0.006 0.000 0.809 453 E CB -0.176 29.520 29.700 -0.006 0.000 0.755 453 E HN 0.328 8.688 8.360 -0.000 0.000 0.449 454 Q N 0.001 119.800 119.800 -0.001 0.000 2.077 454 Q HA -0.162 4.173 4.340 -0.008 0.000 0.206 454 Q C 2.301 178.322 176.000 0.034 0.000 0.989 454 Q CA 1.643 57.452 55.803 0.010 0.000 0.853 454 Q CB -0.116 28.602 28.738 -0.034 0.000 0.907 454 Q HN 0.153 8.423 8.270 -0.000 0.000 0.418 455 R N 0.435 120.944 120.500 0.015 0.000 2.115 455 R HA -0.129 4.206 4.340 -0.008 0.000 0.230 455 R C 2.299 178.669 176.300 0.117 0.000 1.111 455 R CA 1.473 57.633 56.100 0.101 0.000 0.976 455 R CB -0.147 30.162 30.300 0.015 0.000 0.870 455 R HN 0.274 8.543 8.270 -0.000 0.000 0.445 456 K N 0.595 121.033 120.400 0.064 0.000 2.116 456 K HA -0.077 4.238 4.320 -0.008 0.000 0.203 456 K C 2.047 178.694 176.600 0.077 0.000 1.052 456 K CA 0.865 57.191 56.287 0.064 0.000 0.952 456 K CB -0.055 32.468 32.500 0.039 0.000 0.729 456 K HN -0.038 8.212 8.250 -0.000 0.000 0.446 457 R N 0.692 121.240 120.500 0.079 0.000 2.061 457 R HA -0.079 4.256 4.340 -0.008 0.000 0.230 457 R C 2.531 178.911 176.300 0.134 0.000 1.140 457 R CA 1.582 57.742 56.100 0.099 0.000 0.940 457 R CB -0.593 29.759 30.300 0.087 0.000 0.839 457 R HN 0.335 8.605 8.270 -0.000 0.000 0.429 458 L N 0.212 121.521 121.223 0.145 0.000 2.261 458 L HA -0.189 4.146 4.340 -0.008 0.000 0.216 458 L C 1.837 178.800 176.870 0.154 0.000 1.114 458 L CA 1.608 56.565 54.840 0.194 0.000 0.777 458 L CB -0.434 41.748 42.059 0.205 0.000 0.910 458 L HN 0.163 8.393 8.230 -0.000 0.000 0.440 459 C N -0.014 119.352 119.300 0.111 0.000 2.544 459 C HA -0.003 4.452 4.460 -0.008 0.000 0.280 459 C C 2.526 177.553 174.990 0.063 0.000 1.295 459 C CA 0.707 59.757 59.018 0.054 0.000 1.702 459 C CB -0.755 27.021 27.740 0.060 0.000 2.090 459 C HN 0.630 8.860 8.230 -0.000 0.000 0.493 460 E N 1.594 121.856 120.200 0.104 0.000 2.070 460 E HA -0.198 4.147 4.350 -0.008 0.000 0.197 460 E C 1.826 178.538 176.600 0.186 0.000 1.004 460 E CA 1.448 57.936 56.400 0.147 0.000 0.805 460 E CB -0.202 29.581 29.700 0.139 0.000 0.744 460 E HN 0.588 8.948 8.360 -0.000 0.000 0.451 461 N N 0.948 119.769 118.700 0.203 0.000 2.039 461 N HA -0.163 4.572 4.740 -0.008 0.000 0.193 461 N C 2.017 177.703 175.510 0.295 0.000 1.044 461 N CA 1.137 54.368 53.050 0.301 0.000 0.847 461 N CB -0.521 38.186 38.487 0.368 0.000 1.030 461 N HN 0.168 8.548 8.380 -0.000 0.000 0.422 462 I N 1.405 122.046 120.570 0.119 0.000 2.091 462 I HA -0.330 3.835 4.170 -0.008 0.000 0.240 462 I C 2.343 178.396 176.117 -0.106 0.000 1.046 462 I CA 1.740 62.881 61.300 -0.266 0.000 1.306 462 I CB -0.505 37.249 38.000 -0.411 0.000 1.018 462 I HN 0.119 8.329 8.210 -0.000 0.000 0.404 463 A N 0.830 123.628 122.820 -0.037 0.000 1.969 463 A HA -0.067 4.248 4.320 -0.008 0.000 0.218 463 A C 2.417 180.010 177.584 0.015 0.000 1.169 463 A CA 1.587 53.627 52.037 0.006 0.000 0.635 463 A CB -1.353 17.725 19.000 0.131 0.000 0.810 463 A HN 0.513 8.663 8.150 -0.000 0.000 0.445 464 G N -1.688 107.154 108.800 0.070 0.000 2.485 464 G HA2 -0.309 3.646 3.960 -0.008 0.000 0.221 464 G HA3 -0.309 3.646 3.960 -0.008 0.000 0.221 464 G C 1.584 176.477 174.900 -0.012 0.000 1.115 464 G CA 1.355 46.421 45.100 -0.056 0.000 0.751 464 G HN 0.691 8.981 8.290 -0.000 0.000 0.567 465 H N -0.622 118.491 119.070 0.071 0.000 2.506 465 H HA 0.158 4.709 4.556 -0.008 0.000 0.289 465 H C 2.273 177.682 175.328 0.136 0.000 1.009 465 H CA 0.472 56.636 56.048 0.194 0.000 1.303 465 H CB 0.107 30.178 29.762 0.514 0.000 1.453 465 H HN 0.221 8.501 8.280 -0.000 0.000 0.526 466 L N 2.704 123.988 121.223 0.102 0.000 2.141 466 L HA -0.101 4.234 4.340 -0.008 0.000 0.209 466 L C 2.484 179.193 176.870 -0.269 0.000 1.094 466 L CA 1.996 56.577 54.840 -0.431 0.000 0.763 466 L CB -0.732 40.906 42.059 -0.703 0.000 0.908 466 L HN 0.302 8.532 8.230 -0.000 0.000 0.437 467 K N -1.292 119.002 120.400 -0.177 0.000 2.218 467 K HA -0.185 4.130 4.320 -0.008 0.000 0.205 467 K C 0.887 177.411 176.600 -0.127 0.000 1.046 467 K CA 1.864 58.063 56.287 -0.147 0.000 0.933 467 K CB -0.500 31.842 32.500 -0.263 0.000 0.728 467 K HN 0.363 8.613 8.250 -0.000 0.000 0.454 468 D N 0.870 121.191 120.400 -0.132 0.000 2.339 468 D HA 0.120 4.756 4.640 -0.008 0.000 0.217 468 D C 0.563 176.826 176.300 -0.062 0.000 1.050 468 D CA 0.356 54.295 54.000 -0.102 0.000 0.856 468 D CB 0.410 41.132 40.800 -0.130 0.000 0.922 468 D HN 0.422 8.792 8.370 -0.000 0.000 0.518 469 A N 0.543 123.329 122.820 -0.057 0.000 2.280 469 A HA 0.237 4.552 4.320 -0.008 0.000 0.268 469 A C 0.591 178.125 177.584 -0.083 0.000 1.111 469 A CA -0.374 51.634 52.037 -0.048 0.000 0.814 469 A CB 0.540 19.527 19.000 -0.021 0.000 1.093 469 A HN -0.027 8.123 8.150 -0.000 0.000 0.498 470 Q N -0.537 119.192 119.800 -0.118 0.000 2.421 470 Q HA 0.143 4.478 4.340 -0.008 0.000 0.255 470 Q C 0.921 176.872 176.000 -0.082 0.000 1.013 470 Q CA -0.419 55.337 55.803 -0.077 0.000 0.895 470 Q CB 0.533 29.227 28.738 -0.072 0.000 1.271 470 Q HN 0.656 8.926 8.270 -0.000 0.000 0.460 471 L N 1.819 123.059 121.223 0.028 0.000 2.083 471 L HA -0.208 4.128 4.340 -0.008 0.000 0.209 471 L C 2.180 179.101 176.870 0.086 0.000 1.083 471 L CA 1.638 56.502 54.840 0.040 0.000 0.752 471 L CB -0.820 41.277 42.059 0.063 0.000 0.899 471 L HN 0.799 9.029 8.230 -0.000 0.000 0.433 472 F N 0.203 120.154 119.950 0.003 0.000 2.027 472 F HA -0.276 4.246 4.527 -0.008 0.000 0.297 472 F C 2.379 178.185 175.800 0.010 0.000 1.129 472 F CA 1.401 59.404 58.000 0.006 0.000 1.195 472 F CB -1.295 37.711 39.000 0.010 0.000 0.960 472 F HN -0.120 8.180 8.300 -0.000 0.000 0.485 473 I N 0.681 121.030 120.570 -0.369 0.000 2.145 473 I HA -0.349 3.817 4.170 -0.008 0.000 0.244 473 I C 2.727 178.770 176.117 -0.124 0.000 1.075 473 I CA 1.965 63.087 61.300 -0.296 0.000 1.332 473 I CB -0.876 36.894 38.000 -0.382 0.000 1.033 473 I HN 0.385 8.595 8.210 -0.000 0.000 0.410 474 Q N 0.600 120.321 119.800 -0.132 0.000 1.975 474 Q HA -0.271 4.064 4.340 -0.008 0.000 0.205 474 Q C 2.257 178.216 176.000 -0.068 0.000 0.990 474 Q CA 1.698 57.422 55.803 -0.133 0.000 0.845 474 Q CB -0.198 28.472 28.738 -0.113 0.000 0.913 474 Q HN 0.216 8.486 8.270 -0.000 0.000 0.420 475 K N 1.100 121.491 120.400 -0.015 0.000 2.030 475 K HA -0.258 4.057 4.320 -0.008 0.000 0.222 475 K C 1.849 178.453 176.600 0.006 0.000 1.056 475 K CA 1.967 58.261 56.287 0.013 0.000 0.957 475 K CB -0.410 32.123 32.500 0.055 0.000 0.727 475 K HN 0.079 8.329 8.250 -0.000 0.000 0.452 476 K N -0.366 120.046 120.400 0.021 0.000 1.985 476 K HA -0.124 4.192 4.320 -0.008 0.000 0.210 476 K C 1.960 178.538 176.600 -0.036 0.000 1.047 476 K CA 1.586 57.878 56.287 0.010 0.000 0.932 476 K CB -0.433 32.093 32.500 0.043 0.000 0.716 476 K HN 0.162 8.412 8.250 -0.000 0.000 0.439 477 A N 0.603 123.398 122.820 -0.040 0.000 1.882 477 A HA -0.251 4.064 4.320 -0.008 0.000 0.220 477 A C 2.323 179.845 177.584 -0.104 0.000 1.253 477 A CA 2.493 54.471 52.037 -0.097 0.000 0.664 477 A CB -1.276 17.632 19.000 -0.154 0.000 0.838 477 A HN 0.222 8.372 8.150 -0.000 0.000 0.460 478 V N 0.203 120.110 119.914 -0.013 0.000 2.407 478 V HA -0.262 3.853 4.120 -0.008 0.000 0.248 478 V C 2.551 178.656 176.094 0.019 0.000 1.055 478 V CA 2.337 64.673 62.300 0.059 0.000 1.049 478 V CB -0.652 31.178 31.823 0.011 0.000 0.662 478 V HN 0.612 8.802 8.190 -0.000 0.000 0.455 479 K N 0.300 120.687 120.400 -0.021 0.000 1.991 479 K HA -0.247 4.068 4.320 -0.008 0.000 0.212 479 K C 2.087 178.657 176.600 -0.051 0.000 1.049 479 K CA 2.027 58.300 56.287 -0.024 0.000 0.932 479 K CB -0.297 32.189 32.500 -0.022 0.000 0.717 479 K HN 0.455 8.705 8.250 -0.000 0.000 0.441 480 N N 0.605 119.231 118.700 -0.124 0.000 2.037 480 N HA -0.202 4.533 4.740 -0.008 0.000 0.196 480 N C 1.764 177.143 175.510 -0.218 0.000 1.034 480 N CA 1.559 54.482 53.050 -0.212 0.000 0.861 480 N CB -0.739 37.532 38.487 -0.360 0.000 1.039 480 N HN 0.143 8.523 8.380 -0.000 0.000 0.427 481 F N 1.215 121.047 119.950 -0.198 0.000 2.171 481 F HA -0.041 4.481 4.527 -0.008 0.000 0.300 481 F C 2.638 178.332 175.800 -0.178 0.000 1.090 481 F CA 0.646 58.424 58.000 -0.369 0.000 1.293 481 F CB -0.730 37.915 39.000 -0.592 0.000 1.013 481 F HN -0.036 8.264 8.300 -0.000 0.000 0.486 482 S N -0.230 115.516 115.700 0.077 0.000 2.356 482 S HA -0.194 4.271 4.470 -0.008 0.000 0.223 482 S C 1.661 176.304 174.600 0.071 0.000 1.032 482 S CA 1.463 59.700 58.200 0.062 0.000 1.005 482 S CB -0.390 62.827 63.200 0.028 0.000 0.867 482 S HN 0.304 8.614 8.310 -0.000 0.000 0.449 483 D N 0.689 121.115 120.400 0.042 0.000 2.228 483 D HA -0.105 4.530 4.640 -0.008 0.000 0.203 483 D C 1.859 178.221 176.300 0.104 0.000 0.988 483 D CA 1.129 55.158 54.000 0.048 0.000 0.864 483 D CB -0.339 40.465 40.800 0.005 0.000 0.928 483 D HN 0.413 8.783 8.370 -0.000 0.000 0.469 484 V N -2.058 117.954 119.914 0.163 0.000 3.052 484 V HA 0.075 4.190 4.120 -0.008 0.000 0.254 484 V C 0.290 176.617 176.094 0.388 0.000 1.100 484 V CA 0.899 63.350 62.300 0.252 0.000 1.112 484 V CB 0.068 32.073 31.823 0.303 0.000 0.738 484 V HN 0.302 8.492 8.190 -0.000 0.000 0.469 485 H N -0.481 118.753 119.070 0.274 0.000 3.027 485 H HA 0.180 4.731 4.556 -0.008 0.000 0.290 485 H C -2.749 172.740 175.328 0.268 0.000 1.190 485 H CA -0.137 56.084 56.048 0.288 0.000 1.637 485 H CB 2.148 32.160 29.762 0.416 0.000 2.214 485 H HN -0.053 8.227 8.280 -0.000 0.000 0.451 486 P HA -0.189 4.231 4.420 -0.000 0.000 0.218 486 P C 1.100 178.321 177.300 -0.131 0.000 1.148 486 P CA 1.308 64.286 63.100 -0.202 0.000 0.822 486 P CB 0.308 31.872 31.700 -0.227 0.000 0.784 487 E N -0.938 119.152 120.200 -0.182 0.000 2.230 487 E HA -0.152 4.193 4.350 -0.008 0.000 0.192 487 E C 2.015 178.798 176.600 0.305 0.000 0.987 487 E CA 0.129 56.595 56.400 0.111 0.000 0.841 487 E CB -0.455 29.367 29.700 0.203 0.000 0.783 487 E HN 0.267 8.627 8.360 -0.000 0.000 0.481 488 Y N 0.649 121.094 120.300 0.242 0.000 2.128 488 Y HA -0.214 4.331 4.550 -0.008 0.000 0.284 488 Y C 2.234 178.082 175.900 -0.087 0.000 1.154 488 Y CA 1.239 59.310 58.100 -0.047 0.000 1.149 488 Y CB -0.187 38.136 38.460 -0.229 0.000 0.976 488 Y HN 0.189 8.469 8.280 -0.000 0.000 0.505 489 G N -0.603 108.269 108.800 0.120 0.000 2.433 489 G HA2 -0.311 3.645 3.960 -0.008 0.000 0.216 489 G HA3 -0.311 3.645 3.960 -0.008 0.000 0.216 489 G C 1.635 176.541 174.900 0.010 0.000 1.186 489 G CA 1.226 46.344 45.100 0.031 0.000 0.779 489 G HN 0.496 8.786 8.290 -0.000 0.000 0.543 490 S N -0.044 115.673 115.700 0.027 0.000 2.528 490 S HA 0.150 4.615 4.470 -0.008 0.000 0.219 490 S C 2.051 176.663 174.600 0.019 0.000 0.985 490 S CA 0.157 58.365 58.200 0.012 0.000 0.914 490 S CB 0.062 63.266 63.200 0.006 0.000 0.776 490 S HN 0.414 8.724 8.310 -0.000 0.000 0.526 491 R N 0.913 121.442 120.500 0.048 0.000 2.090 491 R HA 0.220 4.555 4.340 -0.008 0.000 0.228 491 R C 2.002 178.303 176.300 0.003 0.000 1.110 491 R CA 1.297 57.424 56.100 0.046 0.000 0.973 491 R CB -0.481 29.879 30.300 0.101 0.000 0.869 491 R HN 0.415 8.685 8.270 -0.000 0.000 0.440 492 I N 0.696 121.250 120.570 -0.027 0.000 2.163 492 I HA -0.276 3.889 4.170 -0.008 0.000 0.240 492 I C 2.599 178.682 176.117 -0.057 0.000 1.081 492 I CA 1.253 62.503 61.300 -0.083 0.000 1.353 492 I CB -0.258 37.610 38.000 -0.220 0.000 1.054 492 I HN 0.129 8.339 8.210 -0.000 0.000 0.407 493 Q N 1.173 120.948 119.800 -0.042 0.000 2.077 493 Q HA -0.225 4.111 4.340 -0.008 0.000 0.206 493 Q C 2.176 178.156 176.000 -0.033 0.000 0.989 493 Q CA 2.459 58.244 55.803 -0.031 0.000 0.853 493 Q CB -0.383 28.343 28.738 -0.020 0.000 0.907 493 Q HN 0.502 8.772 8.270 -0.000 0.000 0.418 494 A N 0.228 123.028 122.820 -0.033 0.000 1.869 494 A HA -0.252 4.063 4.320 -0.008 0.000 0.218 494 A C 2.134 179.669 177.584 -0.082 0.000 1.203 494 A CA 1.929 53.938 52.037 -0.047 0.000 0.638 494 A CB -1.114 17.865 19.000 -0.035 0.000 0.831 494 A HN 0.481 8.631 8.150 -0.000 0.000 0.450 495 L N -1.065 120.102 121.223 -0.093 0.000 2.046 495 L HA -0.154 4.181 4.340 -0.008 0.000 0.208 495 L C 2.638 179.402 176.870 -0.177 0.000 1.077 495 L CA 1.029 55.758 54.840 -0.185 0.000 0.747 495 L CB -0.422 41.577 42.059 -0.100 0.000 0.896 495 L HN 0.404 8.634 8.230 -0.000 0.000 0.432 496 L N -0.561 120.654 121.223 -0.012 0.000 2.093 496 L HA -0.223 4.112 4.340 -0.008 0.000 0.208 496 L C 2.119 179.016 176.870 0.044 0.000 1.085 496 L CA 1.013 55.906 54.840 0.089 0.000 0.755 496 L CB -0.420 41.653 42.059 0.023 0.000 0.904 496 L HN 0.273 8.504 8.230 -0.000 0.000 0.435 497 D N 0.193 120.581 120.400 -0.019 0.000 2.117 497 D HA -0.220 4.415 4.640 -0.008 0.000 0.197 497 D C 2.031 178.310 176.300 -0.035 0.000 0.987 497 D CA 1.303 55.291 54.000 -0.021 0.000 0.829 497 D CB -0.029 40.752 40.800 -0.032 0.000 0.961 497 D HN 0.309 8.679 8.370 -0.000 0.000 0.460 498 K N -0.854 119.480 120.400 -0.111 0.000 2.439 498 K HA -0.104 4.211 4.320 -0.008 0.000 0.197 498 K C 1.256 177.781 176.600 -0.126 0.000 1.041 498 K CA 0.832 57.026 56.287 -0.155 0.000 0.970 498 K CB -0.047 32.306 32.500 -0.245 0.000 0.773 498 K HN 0.100 8.350 8.250 -0.000 0.000 0.479 499 Y N 1.019 121.310 120.300 -0.015 0.000 2.266 499 Y HA 0.176 4.721 4.550 -0.007 0.000 0.294 499 Y C 1.067 176.958 175.900 -0.015 0.000 1.127 499 Y CA -0.394 57.697 58.100 -0.014 0.000 1.140 499 Y CB -0.637 37.811 38.460 -0.020 0.000 1.071 499 Y HN 0.078 8.358 8.280 -0.000 0.000 0.525 500 N N 0.000 118.801 118.700 0.168 0.000 1.763 500 N HA 0.000 4.735 4.740 -0.008 0.000 0.220 500 N CA 0.000 53.097 53.050 0.079 0.000 0.885 500 N CB 0.000 38.521 38.487 0.056 0.000 1.341 500 N HN 0.000 8.380 8.380 -0.000 0.000 0.667