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 3med_1_B DATA FIRST_RESID 6 DATA SEQUENCE ETVPVKLKPG MDGPKVKQWP LTEEKIKALV EICTEMEKEG KISKIGPENP DATA SEQUENCE YNTPVFAIKK XXSTKWRKLV DFRELNKRTQ DFWEVQLGIP HPAGLKKNKS DATA SEQUENCE VTVLDVGDAY FSVPLDEDFR KYTAFTIPSI NNETPGIRYQ YNVLPQGWKG DATA SEQUENCE SPAIFQSSMT KILEPFRKQN PDIVIYQYMD DLYVGSDLEI GQHRTKIEEL DATA SEQUENCE RQHLLRWGLT XXXXXXXXXX XXXXXXYELH PDKWTVQPIV LPEKDSWTVN DATA SEQUENCE DIQKLVGKLN WASQIYPGIK VRQLCKLLRG TKALTEVIPL TEEAELELAE DATA SEQUENCE NREILKEPVH GVYYDPSKDL IAEIQKQGQG QWTYQIYQEP FKNLKTGKYA DATA SEQUENCE RXXXXXTNDV KQLTEAVQKI TTESIVIWGK TPKFKLPIQK ETWETWWTEY DATA SEQUENCE WQATWIPEWE FVNTPPLVKL WYQL 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 6 E HA 0.000 4.350 4.350 -0.000 0.000 0.291 6 E C 0.000 176.656 176.600 0.094 0.000 1.382 6 E CA 0.000 56.448 56.400 0.080 0.000 0.976 6 E CB 0.000 29.744 29.700 0.073 0.000 0.812 7 T N -1.257 113.350 114.554 0.089 0.000 2.770 7 T HA 0.508 4.857 4.350 -0.001 0.000 0.283 7 T C 0.207 174.965 174.700 0.096 0.000 0.988 7 T CA -0.668 61.492 62.100 0.099 0.000 0.957 7 T CB 0.900 69.826 68.868 0.095 0.000 0.930 7 T HN 0.092 8.332 8.240 -0.000 0.000 0.443 8 V N 7.086 127.066 119.914 0.110 0.000 2.450 8 V HA 0.234 4.354 4.120 -0.001 0.000 0.281 8 V C -1.618 174.550 176.094 0.123 0.000 1.019 8 V CA -1.369 61.004 62.300 0.121 0.000 1.062 8 V CB -0.233 31.679 31.823 0.149 0.000 0.979 8 V HN 0.813 9.003 8.190 -0.000 0.000 0.477 9 P HA 0.128 4.548 4.420 -0.000 0.000 0.267 9 P C -0.746 176.617 177.300 0.105 0.000 1.205 9 P CA 0.124 63.287 63.100 0.104 0.000 0.765 9 P CB 0.856 32.618 31.700 0.103 0.000 0.828 10 V N 4.108 124.024 119.914 0.003 0.000 2.409 10 V HA 0.379 4.498 4.120 -0.001 0.000 0.291 10 V C 0.423 176.537 176.094 0.033 0.000 1.020 10 V CA -0.613 61.551 62.300 -0.227 0.000 0.848 10 V CB 1.540 32.815 31.823 -0.912 0.000 0.990 10 V HN 0.515 8.705 8.190 -0.000 0.000 0.430 11 K N 4.112 124.561 120.400 0.082 0.000 2.182 11 K HA 0.629 4.948 4.320 -0.001 0.000 0.262 11 K C -0.927 175.760 176.600 0.145 0.000 0.957 11 K CA -0.756 55.626 56.287 0.157 0.000 0.842 11 K CB 1.737 34.320 32.500 0.139 0.000 1.099 11 K HN 0.443 8.693 8.250 -0.000 0.000 0.438 12 L N 3.054 124.342 121.223 0.107 0.000 2.476 12 L HA 0.184 4.523 4.340 -0.001 0.000 0.255 12 L C 0.218 177.107 176.870 0.032 0.000 1.218 12 L CA 0.380 55.233 54.840 0.022 0.000 0.819 12 L CB 0.347 42.304 42.059 -0.170 0.000 1.119 12 L HN 0.623 8.853 8.230 -0.000 0.000 0.485 13 K N 2.892 123.302 120.400 0.016 0.000 2.451 13 K HA 0.122 4.441 4.320 -0.001 0.000 0.280 13 K C -2.174 174.430 176.600 0.006 0.000 1.020 13 K CA -1.287 55.006 56.287 0.010 0.000 1.008 13 K CB -0.040 32.459 32.500 -0.002 0.000 0.917 13 K HN 0.385 8.635 8.250 -0.000 0.000 0.478 14 P HA -0.052 4.368 4.420 -0.000 0.000 0.267 14 P C 0.548 177.855 177.300 0.013 0.000 1.205 14 P CA 0.492 63.601 63.100 0.016 0.000 0.765 14 P CB 0.832 32.542 31.700 0.017 0.000 0.828 15 G N 2.104 110.915 108.800 0.018 0.000 2.195 15 G HA2 -0.227 3.732 3.960 -0.001 0.000 0.246 15 G HA3 -0.227 3.732 3.960 -0.001 0.000 0.246 15 G C -0.002 174.910 174.900 0.020 0.000 0.984 15 G CA -0.085 45.027 45.100 0.020 0.000 0.633 15 G HN 0.492 8.782 8.290 -0.000 0.000 0.525 16 M N 0.733 120.339 119.600 0.010 0.000 2.404 16 M HA 0.560 5.039 4.480 -0.001 0.000 0.338 16 M C -0.358 175.937 176.300 -0.008 0.000 1.150 16 M CA -0.824 54.480 55.300 0.006 0.000 1.016 16 M CB 1.654 34.251 32.600 -0.005 0.000 1.672 16 M HN 0.094 8.384 8.290 -0.000 0.000 0.448 17 D N 0.792 121.205 120.400 0.021 0.000 2.437 17 D HA 0.502 5.142 4.640 -0.001 0.000 0.259 17 D C 0.047 176.319 176.300 -0.046 0.000 1.118 17 D CA -0.031 53.999 54.000 0.049 0.000 1.017 17 D CB 1.472 42.372 40.800 0.167 0.000 1.120 17 D HN 0.693 9.063 8.370 -0.000 0.000 0.541 18 G N 0.194 108.929 108.800 -0.108 0.000 2.716 18 G HA2 0.268 4.227 3.960 -0.001 0.000 0.251 18 G HA3 0.268 4.227 3.960 -0.001 0.000 0.251 18 G C -2.227 172.705 174.900 0.054 0.000 1.224 18 G CA -0.676 44.225 45.100 -0.332 0.000 0.891 18 G HN 0.393 8.683 8.290 -0.000 0.000 0.561 19 P HA 0.249 4.669 4.420 -0.000 0.000 0.275 19 P C -0.915 176.543 177.300 0.265 0.000 1.227 19 P CA -0.095 63.104 63.100 0.165 0.000 0.781 19 P CB 1.060 32.851 31.700 0.151 0.000 0.906 20 K N 1.879 122.399 120.400 0.201 0.000 2.954 20 K HA 0.339 4.659 4.320 -0.001 0.000 0.171 20 K C -0.778 175.898 176.600 0.126 0.000 1.079 20 K CA -0.552 55.834 56.287 0.164 0.000 0.908 20 K CB 1.097 33.674 32.500 0.128 0.000 1.142 20 K HN 0.208 8.458 8.250 -0.000 0.000 0.613 21 V N 1.460 121.449 119.914 0.125 0.000 2.481 21 V HA 0.228 4.348 4.120 -0.001 0.000 0.286 21 V C 0.405 176.547 176.094 0.080 0.000 1.042 21 V CA -0.868 61.504 62.300 0.120 0.000 0.928 21 V CB 1.633 33.539 31.823 0.138 0.000 0.986 21 V HN 0.414 8.604 8.190 -0.000 0.000 0.462 22 K N 2.693 123.156 120.400 0.105 0.000 2.368 22 K HA 0.158 4.478 4.320 -0.001 0.000 0.282 22 K C 0.060 176.661 176.600 0.002 0.000 1.035 22 K CA -0.342 55.993 56.287 0.081 0.000 0.973 22 K CB 0.552 33.133 32.500 0.134 0.000 0.957 22 K HN 0.697 8.947 8.250 -0.000 0.000 0.474 23 Q N 4.764 124.522 119.800 -0.069 0.000 2.297 23 Q HA 0.027 4.366 4.340 -0.001 0.000 0.267 23 Q C -1.035 174.924 176.000 -0.068 0.000 1.006 23 Q CA -0.019 55.657 55.803 -0.211 0.000 0.896 23 Q CB 0.457 29.126 28.738 -0.115 0.000 1.186 23 Q HN 0.322 8.592 8.270 -0.000 0.000 0.392 24 W N 5.099 126.424 121.300 0.043 0.000 2.150 24 W HA 0.288 4.947 4.660 -0.001 0.000 0.341 24 W C -1.971 174.531 176.519 -0.030 0.000 1.276 24 W CA -2.427 54.919 57.345 0.001 0.000 1.238 24 W CB -0.872 28.573 29.460 -0.025 0.000 1.128 24 W HN 0.565 8.745 8.180 -0.000 0.000 0.581 25 P HA 0.234 4.654 4.420 -0.000 0.000 0.271 25 P C -0.477 176.835 177.300 0.020 0.000 1.216 25 P CA 0.196 63.327 63.100 0.052 0.000 0.776 25 P CB 1.069 32.775 31.700 0.010 0.000 0.881 26 L N 1.637 122.849 121.223 -0.020 0.000 2.333 26 L HA 0.436 4.775 4.340 -0.001 0.000 0.269 26 L C 1.108 177.923 176.870 -0.093 0.000 1.010 26 L CA -0.906 53.899 54.840 -0.058 0.000 0.818 26 L CB 1.983 44.011 42.059 -0.051 0.000 1.306 26 L HN 0.369 8.599 8.230 -0.000 0.000 0.430 27 T N -3.190 111.290 114.554 -0.124 0.000 2.898 27 T HA 0.016 4.365 4.350 -0.001 0.000 0.301 27 T C 0.935 175.562 174.700 -0.122 0.000 1.049 27 T CA -0.423 61.607 62.100 -0.117 0.000 1.095 27 T CB 1.313 70.112 68.868 -0.114 0.000 0.976 27 T HN 0.806 9.046 8.240 -0.000 0.000 0.539 28 E N 0.897 121.040 120.200 -0.094 0.000 2.130 28 E HA -0.293 4.056 4.350 -0.001 0.000 0.196 28 E C 1.971 178.492 176.600 -0.132 0.000 0.998 28 E CA 1.835 58.180 56.400 -0.091 0.000 0.806 28 E CB -0.084 29.581 29.700 -0.059 0.000 0.738 28 E HN 0.933 9.293 8.360 -0.000 0.000 0.459 29 E N 0.459 120.573 120.200 -0.144 0.000 2.106 29 E HA -0.206 4.144 4.350 -0.001 0.000 0.192 29 E C 1.865 178.180 176.600 -0.476 0.000 0.984 29 E CA 0.980 57.261 56.400 -0.198 0.000 0.806 29 E CB -0.112 29.547 29.700 -0.069 0.000 0.750 29 E HN 0.184 8.544 8.360 -0.000 0.000 0.458 30 K N 0.469 120.574 120.400 -0.492 0.000 2.137 30 K HA 0.073 4.392 4.320 -0.001 0.000 0.202 30 K C 2.325 178.673 176.600 -0.420 0.000 1.052 30 K CA 0.787 56.672 56.287 -0.670 0.000 0.961 30 K CB -0.021 32.208 32.500 -0.452 0.000 0.741 30 K HN 0.180 8.430 8.250 -0.000 0.000 0.452 31 I N 1.862 122.278 120.570 -0.258 0.000 2.163 31 I HA -0.331 3.839 4.170 -0.001 0.000 0.243 31 I C 2.277 178.294 176.117 -0.167 0.000 1.085 31 I CA 1.525 62.727 61.300 -0.164 0.000 1.347 31 I CB -0.239 37.696 38.000 -0.108 0.000 1.044 31 I HN 0.154 8.364 8.210 -0.000 0.000 0.408 32 K N 0.788 121.076 120.400 -0.188 0.000 2.057 32 K HA -0.155 4.165 4.320 -0.001 0.000 0.207 32 K C 2.275 178.769 176.600 -0.178 0.000 1.049 32 K CA 1.525 57.723 56.287 -0.149 0.000 0.931 32 K CB -0.311 32.114 32.500 -0.124 0.000 0.714 32 K HN 0.318 8.568 8.250 -0.000 0.000 0.440 33 A N 1.663 124.285 122.820 -0.329 0.000 1.940 33 A HA -0.160 4.159 4.320 -0.001 0.000 0.219 33 A C 2.139 179.614 177.584 -0.182 0.000 1.176 33 A CA 1.335 53.177 52.037 -0.325 0.000 0.631 33 A CB -0.634 17.886 19.000 -0.800 0.000 0.814 33 A HN 0.176 8.326 8.150 -0.000 0.000 0.446 34 L N -0.141 120.966 121.223 -0.192 0.000 2.093 34 L HA -0.146 4.194 4.340 -0.001 0.000 0.208 34 L C 2.751 179.588 176.870 -0.056 0.000 1.085 34 L CA 1.442 56.216 54.840 -0.111 0.000 0.755 34 L CB -0.620 41.381 42.059 -0.096 0.000 0.904 34 L HN 0.498 8.728 8.230 -0.000 0.000 0.435 35 V N -2.425 117.462 119.914 -0.045 0.000 2.270 35 V HA -0.233 3.887 4.120 -0.001 0.000 0.245 35 V C 2.050 178.133 176.094 -0.019 0.000 1.043 35 V CA 1.485 63.781 62.300 -0.006 0.000 1.014 35 V CB -0.783 31.038 31.823 -0.004 0.000 0.645 35 V HN 0.420 8.610 8.190 -0.000 0.000 0.447 36 E N 0.666 120.849 120.200 -0.029 0.000 2.055 36 E HA -0.264 4.085 4.350 -0.001 0.000 0.209 36 E C 2.196 178.781 176.600 -0.024 0.000 1.036 36 E CA 2.589 58.978 56.400 -0.017 0.000 0.849 36 E CB -0.457 29.240 29.700 -0.006 0.000 0.767 36 E HN 0.691 9.051 8.360 -0.000 0.000 0.461 37 I N 0.560 121.112 120.570 -0.031 0.000 2.163 37 I HA -0.333 3.837 4.170 -0.001 0.000 0.243 37 I C 2.521 178.587 176.117 -0.086 0.000 1.085 37 I CA 0.883 62.161 61.300 -0.035 0.000 1.347 37 I CB -0.286 37.697 38.000 -0.028 0.000 1.044 37 I HN 0.294 8.504 8.210 -0.000 0.000 0.408 38 C N 0.374 119.600 119.300 -0.123 0.000 2.464 38 C HA -0.083 4.376 4.460 -0.001 0.000 0.278 38 C C 3.083 177.931 174.990 -0.237 0.000 1.375 38 C CA 1.399 60.254 59.018 -0.272 0.000 1.761 38 C CB -1.166 26.348 27.740 -0.375 0.000 1.944 38 C HN 0.630 8.860 8.230 -0.000 0.000 0.509 39 T N -0.212 114.293 114.554 -0.082 0.000 2.857 39 T HA -0.182 4.167 4.350 -0.001 0.000 0.266 39 T C 1.705 176.377 174.700 -0.047 0.000 1.048 39 T CA 1.669 63.755 62.100 -0.024 0.000 1.139 39 T CB -0.425 68.448 68.868 0.008 0.000 0.874 39 T HN 0.740 8.980 8.240 -0.000 0.000 0.455 40 E N 1.313 121.481 120.200 -0.054 0.000 2.106 40 E HA -0.127 4.222 4.350 -0.001 0.000 0.192 40 E C 2.223 178.778 176.600 -0.074 0.000 0.984 40 E CA 0.949 57.322 56.400 -0.044 0.000 0.806 40 E CB -0.377 29.309 29.700 -0.024 0.000 0.750 40 E HN 0.571 8.931 8.360 -0.000 0.000 0.458 41 M N 0.779 120.302 119.600 -0.129 0.000 2.296 41 M HA -0.129 4.350 4.480 -0.001 0.000 0.265 41 M C 2.150 178.336 176.300 -0.189 0.000 1.064 41 M CA 1.906 57.088 55.300 -0.196 0.000 1.109 41 M CB -0.130 32.295 32.600 -0.291 0.000 1.396 41 M HN 0.227 8.517 8.290 -0.000 0.000 0.430 42 E N 0.186 120.296 120.200 -0.150 0.000 2.166 42 E HA -0.029 4.320 4.350 -0.001 0.000 0.192 42 E C 1.695 178.269 176.600 -0.044 0.000 0.967 42 E CA 0.183 56.529 56.400 -0.091 0.000 0.840 42 E CB -0.186 29.507 29.700 -0.012 0.000 0.795 42 E HN 0.296 8.656 8.360 -0.000 0.000 0.470 43 K N 1.140 121.520 120.400 -0.033 0.000 2.034 43 K HA -0.224 4.096 4.320 -0.001 0.000 0.214 43 K C 1.938 178.523 176.600 -0.025 0.000 1.051 43 K CA 2.184 58.458 56.287 -0.021 0.000 0.931 43 K CB -0.220 32.270 32.500 -0.016 0.000 0.715 43 K HN 0.279 8.529 8.250 -0.000 0.000 0.446 44 E N -0.589 119.589 120.200 -0.038 0.000 2.515 44 E HA -0.050 4.300 4.350 -0.001 0.000 0.201 44 E C 0.868 177.444 176.600 -0.040 0.000 1.071 44 E CA 0.375 56.756 56.400 -0.032 0.000 0.880 44 E CB 0.004 29.682 29.700 -0.036 0.000 0.828 44 E HN 0.560 8.920 8.360 -0.000 0.000 0.540 45 G N 1.663 110.432 108.800 -0.052 0.000 2.160 45 G HA2 -0.365 3.594 3.960 -0.001 0.000 0.251 45 G HA3 -0.365 3.594 3.960 -0.001 0.000 0.251 45 G C 0.768 175.629 174.900 -0.065 0.000 1.008 45 G CA 0.788 45.862 45.100 -0.043 0.000 0.724 45 G HN 0.281 8.571 8.290 -0.000 0.000 0.514 46 K N -0.542 119.777 120.400 -0.134 0.000 2.167 46 K HA 0.243 4.562 4.320 -0.001 0.000 0.203 46 K C 1.479 177.954 176.600 -0.208 0.000 1.052 46 K CA 1.375 57.550 56.287 -0.187 0.000 0.956 46 K CB 0.122 32.380 32.500 -0.404 0.000 0.735 46 K HN 0.813 9.063 8.250 -0.000 0.000 0.451 47 I N -2.753 117.666 120.570 -0.251 0.000 2.785 47 I HA 0.397 4.567 4.170 -0.001 0.000 0.302 47 I C -0.962 175.110 176.117 -0.075 0.000 1.069 47 I CA -0.940 60.211 61.300 -0.249 0.000 1.045 47 I CB 2.496 40.230 38.000 -0.443 0.000 1.236 47 I HN -0.299 7.911 8.210 -0.000 0.000 0.429 48 S N 2.373 118.070 115.700 -0.004 0.000 2.542 48 S HA 0.489 4.958 4.470 -0.001 0.000 0.293 48 S C -0.540 174.079 174.600 0.032 0.000 1.089 48 S CA -0.850 57.370 58.200 0.034 0.000 0.961 48 S CB 1.811 65.002 63.200 -0.015 0.000 1.062 48 S HN 0.551 8.861 8.310 -0.000 0.000 0.483 49 K N 1.833 122.193 120.400 -0.067 0.000 2.414 49 K HA 0.309 4.629 4.320 -0.001 0.000 0.272 49 K C -0.022 176.448 176.600 -0.216 0.000 0.993 49 K CA 0.171 56.275 56.287 -0.305 0.000 0.964 49 K CB 0.100 32.414 32.500 -0.308 0.000 0.925 49 K HN 0.605 8.855 8.250 -0.000 0.000 0.487 50 I N -1.629 118.788 120.570 -0.256 0.000 3.002 50 I HA 0.663 4.832 4.170 -0.001 0.000 0.310 50 I C 0.288 176.306 176.117 -0.165 0.000 1.087 50 I CA -1.236 59.959 61.300 -0.176 0.000 1.017 50 I CB 2.104 40.011 38.000 -0.154 0.000 1.226 50 I HN 0.552 8.762 8.210 -0.000 0.000 0.443 51 G N 1.509 110.233 108.800 -0.127 0.000 2.537 51 G HA2 0.543 4.502 3.960 -0.001 0.000 0.297 51 G HA3 0.543 4.502 3.960 -0.001 0.000 0.297 51 G C -2.185 172.647 174.900 -0.113 0.000 1.310 51 G CA -1.313 43.718 45.100 -0.114 0.000 1.027 51 G HN 0.549 8.839 8.290 -0.000 0.000 0.505 52 P HA 0.026 4.446 4.420 -0.000 0.000 0.233 52 P C 1.392 178.627 177.300 -0.108 0.000 1.167 52 P CA 0.614 63.654 63.100 -0.100 0.000 0.770 52 P CB 0.311 31.959 31.700 -0.085 0.000 0.837 53 E N -0.862 119.276 120.200 -0.103 0.000 2.511 53 E HA -0.074 4.276 4.350 -0.001 0.000 0.196 53 E C 0.120 176.639 176.600 -0.135 0.000 1.066 53 E CA 0.360 56.696 56.400 -0.107 0.000 0.871 53 E CB -0.643 29.006 29.700 -0.084 0.000 0.863 53 E HN 0.104 8.464 8.360 -0.000 0.000 0.520 54 N N 2.358 120.975 118.700 -0.138 0.000 2.462 54 N HA 0.117 4.857 4.740 -0.001 0.000 0.242 54 N C -1.810 173.562 175.510 -0.229 0.000 1.010 54 N CA -2.005 50.949 53.050 -0.159 0.000 0.939 54 N CB 1.613 40.051 38.487 -0.082 0.000 1.127 54 N HN -0.075 8.305 8.380 -0.000 0.000 0.509 55 P HA 0.056 4.476 4.420 -0.000 0.000 0.251 55 P C -0.399 176.671 177.300 -0.383 0.000 1.223 55 P CA 0.358 63.201 63.100 -0.429 0.000 0.796 55 P CB 0.181 31.573 31.700 -0.513 0.000 1.068 56 Y N 0.928 121.221 120.300 -0.012 0.000 2.300 56 Y HA 0.486 5.035 4.550 -0.001 0.000 0.328 56 Y C 0.973 176.890 175.900 0.029 0.000 1.270 56 Y CA -0.383 57.734 58.100 0.027 0.000 1.352 56 Y CB 0.255 38.745 38.460 0.051 0.000 1.286 56 Y HN -0.127 8.153 8.280 -0.000 0.000 0.536 57 N N -0.623 118.213 118.700 0.227 0.000 2.367 57 N HA 0.487 5.226 4.740 -0.001 0.000 0.278 57 N C -1.697 173.907 175.510 0.156 0.000 1.117 57 N CA -0.582 52.561 53.050 0.154 0.000 0.867 57 N CB 1.591 40.126 38.487 0.080 0.000 1.649 57 N HN 0.704 9.084 8.380 -0.000 0.000 0.479 58 T N -0.225 114.416 114.554 0.145 0.000 2.893 58 T HA 0.683 5.032 4.350 -0.001 0.000 0.291 58 T C -2.981 171.677 174.700 -0.070 0.000 1.028 58 T CA -2.010 60.125 62.100 0.059 0.000 0.995 58 T CB 1.985 70.893 68.868 0.067 0.000 1.051 58 T HN 0.164 8.404 8.240 -0.000 0.000 0.470 59 P HA 0.417 4.837 4.420 -0.000 0.000 0.271 59 P C -0.934 176.122 177.300 -0.406 0.000 1.216 59 P CA -0.503 62.295 63.100 -0.502 0.000 0.776 59 P CB 0.907 32.010 31.700 -0.995 0.000 0.881 60 V N 5.233 124.942 119.914 -0.341 0.000 2.735 60 V HA 0.820 4.939 4.120 -0.001 0.000 0.310 60 V C -1.126 174.949 176.094 -0.033 0.000 1.061 60 V CA -0.480 61.652 62.300 -0.281 0.000 0.913 60 V CB 0.891 32.526 31.823 -0.313 0.000 1.005 60 V HN 0.521 8.711 8.190 -0.000 0.000 0.428 61 F N 3.489 123.318 119.950 -0.202 0.000 2.789 61 F HA 0.972 5.498 4.527 -0.001 0.000 0.319 61 F C -0.439 175.310 175.800 -0.085 0.000 1.168 61 F CA -1.003 56.925 58.000 -0.121 0.000 0.934 61 F CB 1.098 40.076 39.000 -0.036 0.000 1.375 61 F HN 0.665 8.965 8.300 -0.000 0.000 0.480 62 A N 1.323 124.182 122.820 0.065 0.000 2.330 62 A HA 0.875 5.194 4.320 -0.001 0.000 0.327 62 A C -0.697 177.071 177.584 0.305 0.000 1.155 62 A CA -0.664 51.416 52.037 0.072 0.000 0.803 62 A CB 0.775 19.710 19.000 -0.109 0.000 1.208 62 A HN 1.138 9.288 8.150 -0.000 0.000 0.477 63 I N -1.387 119.373 120.570 0.316 0.000 3.206 63 I HA 0.664 4.834 4.170 -0.001 0.000 0.313 63 I C -0.824 175.393 176.117 0.167 0.000 1.103 63 I CA -1.246 60.225 61.300 0.286 0.000 0.985 63 I CB 2.081 40.209 38.000 0.213 0.000 1.240 63 I HN 0.270 8.480 8.210 -0.000 0.000 0.464 64 K N 3.139 123.507 120.400 -0.053 0.000 2.234 64 K HA 0.387 4.707 4.320 -0.001 0.000 0.277 64 K C -0.469 176.063 176.600 -0.112 0.000 1.038 64 K CA -0.597 55.569 56.287 -0.201 0.000 0.888 64 K CB 1.486 33.791 32.500 -0.326 0.000 1.091 64 K HN 0.586 8.836 8.250 -0.000 0.000 0.467 69 T N 3.427 117.890 114.554 -0.152 0.000 2.992 69 T HA 0.431 4.780 4.350 -0.001 0.000 0.299 69 T C -0.162 174.419 174.700 -0.197 0.000 1.027 69 T CA 0.147 62.124 62.100 -0.204 0.000 1.001 69 T CB -0.224 68.558 68.868 -0.143 0.000 1.005 69 T HN 0.436 8.676 8.240 -0.000 0.000 0.599 70 K N 2.199 122.432 120.400 -0.279 0.000 2.592 70 K HA 0.155 4.474 4.320 -0.001 0.000 0.259 70 K C -1.653 174.824 176.600 -0.204 0.000 0.937 70 K CA -0.698 55.478 56.287 -0.186 0.000 0.874 70 K CB 1.230 33.687 32.500 -0.072 0.000 1.339 70 K HN 0.399 8.649 8.250 -0.000 0.000 0.425 71 W N 3.996 125.282 121.300 -0.023 0.000 2.238 71 W HA 0.327 4.986 4.660 -0.001 0.000 0.321 71 W C 0.706 177.204 176.519 -0.034 0.000 1.293 71 W CA -0.240 57.088 57.345 -0.029 0.000 1.204 71 W CB 0.773 30.216 29.460 -0.028 0.000 1.167 71 W HN 0.293 8.473 8.180 -0.000 0.000 0.553 72 R N 3.556 124.192 120.500 0.227 0.000 2.711 72 R HA 0.337 4.676 4.340 -0.001 0.000 0.284 72 R C -0.521 175.825 176.300 0.076 0.000 0.968 72 R CA -0.917 55.248 56.100 0.109 0.000 0.924 72 R CB 1.372 31.696 30.300 0.040 0.000 1.162 72 R HN 0.384 8.654 8.270 -0.000 0.000 0.465 73 K N 5.060 125.461 120.400 0.002 0.000 2.156 73 K HA 0.325 4.644 4.320 -0.001 0.000 0.271 73 K C -1.505 174.979 176.600 -0.194 0.000 0.995 73 K CA -0.414 55.808 56.287 -0.108 0.000 0.890 73 K CB 1.144 33.573 32.500 -0.117 0.000 1.073 73 K HN 0.571 8.821 8.250 -0.000 0.000 0.454 74 L N 4.815 125.786 121.223 -0.420 0.000 2.404 74 L HA 0.351 4.691 4.340 -0.001 0.000 0.272 74 L C -1.247 175.177 176.870 -0.743 0.000 0.980 74 L CA -0.976 53.532 54.840 -0.554 0.000 0.836 74 L CB 1.993 43.592 42.059 -0.767 0.000 1.238 74 L HN 0.403 8.633 8.230 -0.000 0.000 0.408 75 V N 2.781 122.398 119.914 -0.495 0.000 2.427 75 V HA 0.213 4.332 4.120 -0.001 0.000 0.286 75 V C -0.229 175.590 176.094 -0.460 0.000 1.034 75 V CA -0.609 61.324 62.300 -0.612 0.000 0.893 75 V CB 1.745 33.062 31.823 -0.842 0.000 0.982 75 V HN 0.605 8.795 8.190 -0.000 0.000 0.452 76 D N 3.764 123.996 120.400 -0.279 0.000 2.453 76 D HA 0.209 4.848 4.640 -0.001 0.000 0.223 76 D C 0.116 176.352 176.300 -0.107 0.000 1.183 76 D CA -0.275 53.737 54.000 0.020 0.000 0.933 76 D CB 0.204 41.211 40.800 0.345 0.000 1.038 76 D HN 0.352 8.722 8.370 -0.000 0.000 0.513 77 F N 2.055 122.086 119.950 0.136 0.000 2.676 77 F HA 0.268 4.795 4.527 -0.001 0.000 0.300 77 F C 2.093 177.982 175.800 0.148 0.000 1.160 77 F CA -0.259 57.824 58.000 0.139 0.000 1.401 77 F CB -0.070 39.032 39.000 0.170 0.000 1.037 77 F HN 0.259 8.559 8.300 -0.000 0.000 0.522 78 R N 0.102 120.749 120.500 0.245 0.000 2.117 78 R HA -0.223 4.116 4.340 -0.001 0.000 0.243 78 R C 2.064 178.482 176.300 0.196 0.000 1.143 78 R CA 1.711 57.915 56.100 0.174 0.000 0.968 78 R CB -0.089 30.245 30.300 0.056 0.000 0.863 78 R HN 0.201 8.471 8.270 -0.000 0.000 0.444 79 E N 0.809 121.131 120.200 0.204 0.000 2.051 79 E HA -0.090 4.259 4.350 -0.001 0.000 0.189 79 E C 1.841 178.568 176.600 0.212 0.000 0.979 79 E CA 0.734 57.245 56.400 0.185 0.000 0.803 79 E CB -0.264 29.537 29.700 0.168 0.000 0.761 79 E HN 0.170 8.530 8.360 -0.000 0.000 0.451 80 L N 0.723 122.104 121.223 0.263 0.000 2.043 80 L HA -0.255 4.085 4.340 -0.001 0.000 0.212 80 L C 1.640 178.720 176.870 0.350 0.000 1.075 80 L CA 1.741 56.726 54.840 0.243 0.000 0.752 80 L CB -0.515 41.694 42.059 0.249 0.000 0.891 80 L HN 0.233 8.463 8.230 -0.000 0.000 0.432 81 N N 0.540 119.491 118.700 0.418 0.000 2.069 81 N HA -0.238 4.501 4.740 -0.001 0.000 0.191 81 N C 1.732 177.578 175.510 0.560 0.000 1.031 81 N CA 1.411 54.762 53.050 0.501 0.000 0.852 81 N CB -0.249 38.405 38.487 0.280 0.000 1.018 81 N HN 0.299 8.679 8.380 -0.000 0.000 0.423 82 K N 0.460 121.075 120.400 0.358 0.000 2.211 82 K HA 0.016 4.335 4.320 -0.001 0.000 0.204 82 K C 1.736 178.448 176.600 0.186 0.000 1.047 82 K CA 0.967 57.409 56.287 0.258 0.000 0.935 82 K CB 0.120 32.723 32.500 0.172 0.000 0.728 82 K HN 0.191 8.441 8.250 -0.000 0.000 0.452 83 R N -0.717 119.894 120.500 0.186 0.000 2.290 83 R HA 0.030 4.370 4.340 -0.001 0.000 0.197 83 R C 1.557 177.926 176.300 0.115 0.000 0.913 83 R CA 1.240 57.397 56.100 0.096 0.000 1.040 83 R CB 0.430 30.744 30.300 0.025 0.000 0.992 83 R HN 0.275 8.545 8.270 -0.000 0.000 0.500 84 T N -2.623 112.088 114.554 0.263 0.000 3.014 84 T HA -0.018 4.331 4.350 -0.001 0.000 0.250 84 T C 1.717 176.501 174.700 0.140 0.000 1.060 84 T CA -0.175 62.109 62.100 0.308 0.000 1.040 84 T CB 0.390 69.627 68.868 0.616 0.000 0.971 84 T HN 0.066 8.306 8.240 -0.000 0.000 0.497 85 Q N 1.560 121.369 119.800 0.014 0.000 2.062 85 Q HA -0.394 3.946 4.340 -0.001 0.000 0.216 85 Q C 1.857 177.397 176.000 -0.766 0.000 1.052 85 Q CA 2.674 58.090 55.803 -0.645 0.000 0.910 85 Q CB -0.632 27.911 28.738 -0.325 0.000 1.043 85 Q HN 0.424 8.694 8.270 -0.000 0.000 0.425 86 D N -1.073 119.127 120.400 -0.334 0.000 2.248 86 D HA -0.219 4.420 4.640 -0.001 0.000 0.191 86 D C 1.520 177.703 176.300 -0.194 0.000 1.013 86 D CA 1.624 55.489 54.000 -0.225 0.000 0.883 86 D CB -0.358 40.392 40.800 -0.085 0.000 0.915 86 D HN 0.408 8.778 8.370 -0.000 0.000 0.448 87 F N 0.782 120.574 119.950 -0.263 0.000 2.060 87 F HA -0.137 4.390 4.527 -0.001 0.000 0.295 87 F C 2.320 178.029 175.800 -0.152 0.000 1.120 87 F CA 1.798 59.705 58.000 -0.155 0.000 1.205 87 F CB -0.676 38.290 39.000 -0.057 0.000 0.986 87 F HN 0.101 8.401 8.300 -0.000 0.000 0.470 88 W N 0.519 121.840 121.300 0.034 0.000 2.937 88 W HA 0.094 4.754 4.660 -0.001 0.000 0.245 88 W C 1.358 177.790 176.519 -0.146 0.000 1.306 88 W CA 0.771 58.018 57.345 -0.163 0.000 1.470 88 W CB -0.984 28.393 29.460 -0.138 0.000 1.132 88 W HN 0.308 8.488 8.180 -0.000 0.000 0.675 89 E N 1.412 121.375 120.200 -0.394 0.000 2.372 89 E HA -0.001 4.348 4.350 -0.001 0.000 0.201 89 E C 0.579 177.059 176.600 -0.199 0.000 0.938 89 E CA 0.732 56.928 56.400 -0.340 0.000 0.944 89 E CB 0.577 29.833 29.700 -0.740 0.000 0.937 89 E HN 0.034 8.394 8.360 -0.000 0.000 0.495 90 V N -0.524 119.253 119.914 -0.228 0.000 3.076 90 V HA 0.380 4.499 4.120 -0.001 0.000 0.374 90 V C -0.125 175.869 176.094 -0.166 0.000 1.303 90 V CA -0.630 61.573 62.300 -0.162 0.000 1.602 90 V CB 0.722 32.460 31.823 -0.140 0.000 1.167 90 V HN 0.010 8.200 8.190 -0.000 0.000 0.596 91 Q N 0.357 120.029 119.800 -0.214 0.000 2.379 91 Q HA 0.447 4.787 4.340 -0.001 0.000 0.184 91 Q C 0.135 176.015 176.000 -0.200 0.000 0.663 91 Q CA 0.523 56.198 55.803 -0.213 0.000 0.870 91 Q CB 1.006 29.560 28.738 -0.307 0.000 1.238 91 Q HN 0.560 8.830 8.270 -0.000 0.000 0.475 92 L N -0.755 120.304 121.223 -0.274 0.000 2.664 92 L HA 0.762 5.101 4.340 -0.001 0.000 0.253 92 L C -0.383 176.381 176.870 -0.177 0.000 1.293 92 L CA 0.199 54.926 54.840 -0.188 0.000 1.280 92 L CB 1.495 43.448 42.059 -0.176 0.000 1.993 92 L HN 0.453 8.683 8.230 -0.000 0.000 0.577 93 G N 0.646 109.386 108.800 -0.100 0.000 2.350 93 G HA2 0.123 4.082 3.960 -0.001 0.000 0.274 93 G HA3 0.123 4.082 3.960 -0.001 0.000 0.274 93 G C -1.520 173.411 174.900 0.050 0.000 1.621 93 G CA -0.865 44.224 45.100 -0.019 0.000 0.935 93 G HN 0.193 8.483 8.290 -0.000 0.000 0.694 94 I N 4.227 124.858 120.570 0.101 0.000 2.517 94 I HA 0.308 4.477 4.170 -0.001 0.000 0.285 94 I C -1.038 175.225 176.117 0.244 0.000 1.106 94 I CA -1.365 60.024 61.300 0.149 0.000 1.402 94 I CB 0.621 38.706 38.000 0.142 0.000 1.399 94 I HN 0.351 8.561 8.210 -0.000 0.000 0.535 95 P HA 0.141 4.561 4.420 -0.000 0.000 0.278 95 P C -1.054 176.386 177.300 0.233 0.000 1.238 95 P CA -0.248 62.967 63.100 0.193 0.000 0.794 95 P CB 0.613 32.377 31.700 0.107 0.000 0.955 96 H N 2.374 121.459 119.070 0.025 0.000 2.541 96 H HA 0.426 4.981 4.556 -0.001 0.000 0.316 96 H C -2.121 173.056 175.328 -0.252 0.000 1.043 96 H CA -1.989 53.899 56.048 -0.266 0.000 1.232 96 H CB 0.276 29.871 29.762 -0.279 0.000 1.406 96 H HN 0.178 8.458 8.280 -0.000 0.000 0.469 97 P HA 0.105 4.525 4.420 -0.000 0.000 0.266 97 P C 0.053 176.999 177.300 -0.590 0.000 1.215 97 P CA 0.005 62.795 63.100 -0.517 0.000 0.763 97 P CB 1.130 32.598 31.700 -0.387 0.000 0.806 98 A N 3.537 126.207 122.820 -0.250 0.000 2.119 98 A HA 0.073 4.392 4.320 -0.001 0.000 0.217 98 A C 1.954 179.455 177.584 -0.138 0.000 1.153 98 A CA 1.480 53.440 52.037 -0.127 0.000 0.692 98 A CB -0.818 18.161 19.000 -0.035 0.000 0.799 98 A HN 0.607 8.757 8.150 -0.000 0.000 0.458 99 G N -1.102 107.605 108.800 -0.156 0.000 3.088 99 G HA2 0.203 4.162 3.960 -0.001 0.000 0.217 99 G HA3 0.203 4.162 3.960 -0.001 0.000 0.217 99 G C 1.163 175.976 174.900 -0.145 0.000 1.159 99 G CA 0.497 45.524 45.100 -0.123 0.000 0.760 99 G HN 0.350 8.640 8.290 -0.000 0.000 0.550 100 L N 1.601 122.703 121.223 -0.201 0.000 2.081 100 L HA -0.052 4.288 4.340 -0.001 0.000 0.212 100 L C 2.605 179.360 176.870 -0.191 0.000 1.080 100 L CA 2.051 56.782 54.840 -0.183 0.000 0.754 100 L CB -0.083 41.824 42.059 -0.254 0.000 0.893 100 L HN 0.290 8.520 8.230 -0.000 0.000 0.433 101 K N -0.632 119.647 120.400 -0.201 0.000 2.459 101 K HA -0.077 4.242 4.320 -0.001 0.000 0.193 101 K C 1.428 177.883 176.600 -0.241 0.000 1.030 101 K CA 0.870 57.015 56.287 -0.237 0.000 1.026 101 K CB -0.044 32.342 32.500 -0.190 0.000 0.809 101 K HN 0.380 8.630 8.250 -0.000 0.000 0.504 102 K N 0.608 120.900 120.400 -0.180 0.000 2.361 102 K HA 0.128 4.447 4.320 -0.001 0.000 0.194 102 K C 0.095 176.607 176.600 -0.147 0.000 1.032 102 K CA -0.292 55.908 56.287 -0.145 0.000 1.048 102 K CB 0.222 32.664 32.500 -0.097 0.000 0.842 102 K HN 0.122 8.372 8.250 -0.000 0.000 0.526 103 N N 1.811 120.414 118.700 -0.160 0.000 2.381 103 N HA -0.023 4.717 4.740 -0.001 0.000 0.241 103 N C 0.725 176.137 175.510 -0.163 0.000 1.279 103 N CA 0.447 53.415 53.050 -0.135 0.000 0.896 103 N CB 0.794 39.212 38.487 -0.116 0.000 1.118 103 N HN 0.008 8.388 8.380 -0.000 0.000 0.438 104 K N 0.116 120.445 120.400 -0.119 0.000 2.103 104 K HA 0.060 4.379 4.320 -0.001 0.000 0.204 104 K C 0.145 176.696 176.600 -0.082 0.000 1.052 104 K CA 0.822 57.052 56.287 -0.095 0.000 0.945 104 K CB 0.185 32.647 32.500 -0.064 0.000 0.722 104 K HN 0.265 8.515 8.250 -0.000 0.000 0.443 105 S N 0.285 115.858 115.700 -0.210 0.000 2.571 105 S HA 0.359 4.829 4.470 -0.001 0.000 0.284 105 S C -1.688 172.660 174.600 -0.421 0.000 1.128 105 S CA -0.784 57.164 58.200 -0.420 0.000 0.970 105 S CB 2.141 64.885 63.200 -0.760 0.000 1.039 105 S HN 0.021 8.331 8.310 -0.000 0.000 0.485 106 V N 4.218 123.931 119.914 -0.335 0.000 2.577 106 V HA 0.735 4.855 4.120 -0.001 0.000 0.303 106 V C -0.598 175.447 176.094 -0.080 0.000 1.042 106 V CA -0.002 62.237 62.300 -0.101 0.000 0.872 106 V CB 1.825 33.613 31.823 -0.058 0.000 0.998 106 V HN 0.820 9.010 8.190 -0.000 0.000 0.423 107 T N 5.978 120.576 114.554 0.073 0.000 2.902 107 T HA 0.656 5.005 4.350 -0.001 0.000 0.283 107 T C -0.525 174.103 174.700 -0.121 0.000 1.009 107 T CA -0.330 61.763 62.100 -0.011 0.000 1.051 107 T CB 1.613 70.539 68.868 0.096 0.000 0.999 107 T HN 0.643 8.883 8.240 -0.000 0.000 0.474 108 V N 4.363 124.146 119.914 -0.218 0.000 2.417 108 V HA 0.561 4.680 4.120 -0.001 0.000 0.291 108 V C -0.409 175.594 176.094 -0.152 0.000 1.024 108 V CA -0.755 61.352 62.300 -0.322 0.000 0.861 108 V CB 1.182 32.803 31.823 -0.335 0.000 0.985 108 V HN 0.667 8.857 8.190 -0.000 0.000 0.436 109 L N 3.174 124.285 121.223 -0.187 0.000 2.401 109 L HA 0.584 4.923 4.340 -0.001 0.000 0.266 109 L C -0.728 176.068 176.870 -0.123 0.000 0.991 109 L CA -0.625 54.145 54.840 -0.116 0.000 0.818 109 L CB 2.426 44.416 42.059 -0.115 0.000 1.321 109 L HN 0.519 8.749 8.230 -0.000 0.000 0.413 110 D N 2.057 122.393 120.400 -0.106 0.000 2.316 110 D HA 0.245 4.885 4.640 -0.001 0.000 0.245 110 D C 0.321 176.516 176.300 -0.175 0.000 1.171 110 D CA -0.088 53.836 54.000 -0.128 0.000 0.856 110 D CB 1.883 42.611 40.800 -0.119 0.000 1.090 110 D HN 0.356 8.726 8.370 -0.000 0.000 0.476 111 V N 1.844 121.622 119.914 -0.226 0.000 3.159 111 V HA 0.405 4.525 4.120 -0.001 0.000 0.333 111 V C 1.601 177.352 176.094 -0.572 0.000 1.424 111 V CA 0.285 62.397 62.300 -0.313 0.000 1.125 111 V CB 0.511 32.187 31.823 -0.245 0.000 1.075 111 V HN 0.450 8.640 8.190 -0.000 0.000 0.482 112 G N 0.770 109.250 108.800 -0.534 0.000 2.450 112 G HA2 -0.265 3.695 3.960 -0.001 0.000 0.220 112 G HA3 -0.265 3.695 3.960 -0.001 0.000 0.220 112 G C 0.952 175.322 174.900 -0.884 0.000 1.130 112 G CA 1.241 45.901 45.100 -0.734 0.000 0.760 112 G HN 0.556 8.846 8.290 -0.000 0.000 0.557 113 D N 0.452 120.441 120.400 -0.685 0.000 2.190 113 D HA -0.037 4.602 4.640 -0.001 0.000 0.200 113 D C 2.698 178.658 176.300 -0.566 0.000 0.992 113 D CA 1.175 54.771 54.000 -0.673 0.000 0.854 113 D CB -0.118 40.466 40.800 -0.361 0.000 0.936 113 D HN 0.306 8.676 8.370 -0.000 0.000 0.462 114 A N -0.495 121.953 122.820 -0.619 0.000 1.978 114 A HA -0.208 4.111 4.320 -0.001 0.000 0.220 114 A C 1.790 179.057 177.584 -0.529 0.000 1.170 114 A CA 1.146 52.839 52.037 -0.574 0.000 0.636 114 A CB -1.080 17.441 19.000 -0.798 0.000 0.810 114 A HN 0.489 8.639 8.150 -0.000 0.000 0.448 115 Y N -2.153 117.872 120.300 -0.457 0.000 2.421 115 Y HA -0.126 4.424 4.550 -0.001 0.000 0.292 115 Y C 1.806 177.798 175.900 0.152 0.000 1.136 115 Y CA -0.051 57.920 58.100 -0.215 0.000 1.255 115 Y CB -0.235 38.154 38.460 -0.119 0.000 0.991 115 Y HN 0.279 8.559 8.280 -0.000 0.000 0.552 116 F N -0.060 119.940 119.950 0.084 0.000 2.583 116 F HA -0.167 4.360 4.527 -0.001 0.000 0.297 116 F C 2.114 177.978 175.800 0.106 0.000 1.131 116 F CA 0.336 58.404 58.000 0.113 0.000 1.467 116 F CB -0.998 38.048 39.000 0.077 0.000 1.097 116 F HN -0.006 8.294 8.300 -0.000 0.000 0.586 117 S N -0.806 115.060 115.700 0.276 0.000 2.388 117 S HA 0.033 4.502 4.470 -0.001 0.000 0.223 117 S C 0.907 175.648 174.600 0.235 0.000 1.034 117 S CA 0.176 58.512 58.200 0.226 0.000 0.963 117 S CB 0.063 63.395 63.200 0.221 0.000 0.827 117 S HN -0.062 8.248 8.310 -0.000 0.000 0.481 118 V N 4.319 124.395 119.914 0.269 0.000 2.498 118 V HA 0.281 4.400 4.120 -0.001 0.000 0.279 118 V C -2.492 173.733 176.094 0.218 0.000 1.048 118 V CA -2.176 60.280 62.300 0.261 0.000 0.967 118 V CB 0.671 32.689 31.823 0.325 0.000 0.988 118 V HN 0.120 8.310 8.190 -0.000 0.000 0.473 119 P HA 0.167 4.587 4.420 -0.000 0.000 0.269 119 P C -0.705 176.685 177.300 0.150 0.000 1.209 119 P CA -0.301 62.888 63.100 0.149 0.000 0.776 119 P CB 0.558 32.330 31.700 0.120 0.000 0.876 120 L N 2.694 124.002 121.223 0.141 0.000 2.307 120 L HA 0.387 4.727 4.340 -0.001 0.000 0.282 120 L C -0.103 176.833 176.870 0.111 0.000 1.051 120 L CA -0.723 54.193 54.840 0.128 0.000 0.804 120 L CB 0.617 42.751 42.059 0.125 0.000 1.197 120 L HN 0.220 8.450 8.230 -0.000 0.000 0.431 121 D N 2.750 123.210 120.400 0.100 0.000 2.479 121 D HA -0.088 4.551 4.640 -0.001 0.000 0.257 121 D C 0.980 177.356 176.300 0.126 0.000 1.230 121 D CA 0.679 54.742 54.000 0.106 0.000 0.912 121 D CB 0.776 41.633 40.800 0.095 0.000 1.130 121 D HN 0.707 9.077 8.370 -0.000 0.000 0.515 122 E N 2.203 122.457 120.200 0.091 0.000 2.147 122 E HA -0.206 4.143 4.350 -0.001 0.000 0.199 122 E C 0.841 177.471 176.600 0.050 0.000 1.005 122 E CA 1.502 57.940 56.400 0.064 0.000 0.810 122 E CB 0.122 29.849 29.700 0.045 0.000 0.736 122 E HN 0.544 8.904 8.360 -0.000 0.000 0.460 123 D N -1.304 119.141 120.400 0.075 0.000 2.352 123 D HA -0.051 4.588 4.640 -0.001 0.000 0.232 123 D C 0.588 176.943 176.300 0.092 0.000 1.055 123 D CA 0.360 54.394 54.000 0.056 0.000 0.891 123 D CB 0.082 40.932 40.800 0.084 0.000 0.897 123 D HN 0.171 8.541 8.370 -0.000 0.000 0.529 124 F N 0.391 120.315 119.950 -0.044 0.000 2.740 124 F HA 0.162 4.689 4.527 -0.001 0.000 0.304 124 F C 1.888 177.610 175.800 -0.130 0.000 1.098 124 F CA -0.198 57.789 58.000 -0.021 0.000 1.258 124 F CB 0.437 39.413 39.000 -0.040 0.000 1.061 124 F HN -0.266 8.034 8.300 -0.000 0.000 0.598 125 R N 1.305 121.809 120.500 0.007 0.000 2.119 125 R HA -0.251 4.089 4.340 -0.001 0.000 0.246 125 R C 2.001 178.203 176.300 -0.163 0.000 1.146 125 R CA 2.122 58.207 56.100 -0.025 0.000 0.962 125 R CB -0.921 29.386 30.300 0.012 0.000 0.863 125 R HN 0.407 8.677 8.270 -0.000 0.000 0.442 126 K N -0.206 120.001 120.400 -0.321 0.000 2.360 126 K HA -0.134 4.185 4.320 -0.001 0.000 0.201 126 K C 1.009 177.401 176.600 -0.347 0.000 1.046 126 K CA 1.380 57.487 56.287 -0.300 0.000 0.945 126 K CB -0.180 32.130 32.500 -0.316 0.000 0.750 126 K HN 0.204 8.454 8.250 -0.000 0.000 0.464 127 Y N 2.047 122.067 120.300 -0.467 0.000 2.529 127 Y HA 0.006 4.555 4.550 -0.001 0.000 0.290 127 Y C 1.941 177.657 175.900 -0.307 0.000 1.177 127 Y CA 0.856 58.572 58.100 -0.640 0.000 1.305 127 Y CB 0.069 37.847 38.460 -1.136 0.000 1.047 127 Y HN 0.314 8.594 8.280 -0.000 0.000 0.522 128 T N -2.812 111.738 114.554 -0.007 0.000 3.145 128 T HA 0.503 4.853 4.350 -0.001 0.000 0.255 128 T C 0.847 175.809 174.700 0.437 0.000 1.039 128 T CA -0.067 62.185 62.100 0.254 0.000 0.928 128 T CB -0.498 68.522 68.868 0.254 0.000 1.029 128 T HN 0.162 8.402 8.240 -0.000 0.000 0.554 129 A N 1.828 124.798 122.820 0.249 0.000 2.565 129 A HA 0.521 4.840 4.320 -0.001 0.000 0.237 129 A C -0.029 177.721 177.584 0.276 0.000 1.053 129 A CA -0.264 51.876 52.037 0.172 0.000 0.755 129 A CB -0.575 18.485 19.000 0.100 0.000 0.980 129 A HN 0.824 8.974 8.150 -0.000 0.000 0.506 130 F N -0.809 119.198 119.950 0.095 0.000 2.664 130 F HA 0.829 5.355 4.527 -0.001 0.000 0.317 130 F C -0.381 175.438 175.800 0.032 0.000 1.108 130 F CA -0.858 57.165 58.000 0.038 0.000 0.957 130 F CB 1.348 40.349 39.000 0.003 0.000 1.365 130 F HN 0.346 8.646 8.300 -0.000 0.000 0.475 131 T N 2.415 117.081 114.554 0.188 0.000 2.848 131 T HA 0.565 4.914 4.350 -0.001 0.000 0.285 131 T C -0.610 174.166 174.700 0.125 0.000 0.995 131 T CA -0.449 61.683 62.100 0.054 0.000 0.970 131 T CB 1.500 70.368 68.868 0.000 0.000 0.976 131 T HN 0.577 8.817 8.240 -0.000 0.000 0.441 132 I N 5.675 126.303 120.570 0.097 0.000 2.291 132 I HA 0.279 4.448 4.170 -0.001 0.000 0.290 132 I C -1.909 174.215 176.117 0.012 0.000 1.050 132 I CA -2.277 59.070 61.300 0.078 0.000 1.245 132 I CB 1.088 39.154 38.000 0.109 0.000 1.405 132 I HN 0.302 8.512 8.210 -0.000 0.000 0.478 133 P HA 0.116 4.536 4.420 -0.000 0.000 0.274 133 P C -0.560 176.725 177.300 -0.025 0.000 1.246 133 P CA -0.281 62.808 63.100 -0.018 0.000 0.795 133 P CB 1.130 32.820 31.700 -0.016 0.000 1.006 134 S N 0.212 115.895 115.700 -0.028 0.000 2.568 134 S HA 0.527 4.996 4.470 -0.001 0.000 0.302 134 S C 0.111 174.693 174.600 -0.030 0.000 1.082 134 S CA -0.956 57.225 58.200 -0.031 0.000 1.009 134 S CB 0.454 63.635 63.200 -0.032 0.000 1.069 134 S HN 0.275 8.585 8.310 -0.000 0.000 0.500 135 I N 2.800 123.351 120.570 -0.033 0.000 2.710 135 I HA 0.101 4.270 4.170 -0.001 0.000 0.286 135 I C 1.137 177.239 176.117 -0.025 0.000 1.181 135 I CA 0.365 61.647 61.300 -0.031 0.000 1.430 135 I CB -0.190 37.790 38.000 -0.034 0.000 1.367 135 I HN 0.991 9.201 8.210 -0.000 0.000 0.577 136 N N 4.542 123.229 118.700 -0.022 0.000 2.708 136 N HA -0.301 4.438 4.740 -0.001 0.000 0.251 136 N C 0.048 175.548 175.510 -0.017 0.000 1.123 136 N CA 1.299 54.338 53.050 -0.018 0.000 0.739 136 N CB -1.390 37.087 38.487 -0.017 0.000 1.113 136 N HN 0.878 9.258 8.380 -0.000 0.000 0.561 137 N N -1.398 117.291 118.700 -0.018 0.000 2.721 137 N HA -0.251 4.488 4.740 -0.001 0.000 0.249 137 N C 0.185 175.682 175.510 -0.021 0.000 1.072 137 N CA 1.081 54.120 53.050 -0.019 0.000 0.710 137 N CB -0.793 37.685 38.487 -0.015 0.000 0.993 137 N HN 0.667 9.047 8.380 -0.000 0.000 0.547 138 E N -0.690 119.497 120.200 -0.023 0.000 2.230 138 E HA -0.006 4.343 4.350 -0.001 0.000 0.192 138 E C 0.808 177.393 176.600 -0.026 0.000 0.987 138 E CA 1.265 57.651 56.400 -0.023 0.000 0.841 138 E CB 0.346 30.033 29.700 -0.022 0.000 0.783 138 E HN 0.577 8.937 8.360 -0.000 0.000 0.481 139 T N -1.257 113.279 114.554 -0.030 0.000 2.906 139 T HA 0.486 4.836 4.350 -0.001 0.000 0.295 139 T C -2.875 171.801 174.700 -0.041 0.000 1.075 139 T CA -2.346 59.732 62.100 -0.036 0.000 1.005 139 T CB 1.845 70.690 68.868 -0.038 0.000 1.136 139 T HN -0.315 7.925 8.240 -0.000 0.000 0.498 140 P HA 0.359 4.779 4.420 -0.000 0.000 0.271 140 P C 0.633 177.895 177.300 -0.064 0.000 1.216 140 P CA -0.025 63.041 63.100 -0.056 0.000 0.776 140 P CB 0.103 31.765 31.700 -0.064 0.000 0.881 141 G N 2.922 111.685 108.800 -0.061 0.000 2.474 141 G HA2 0.256 4.216 3.960 -0.001 0.000 0.233 141 G HA3 0.256 4.216 3.960 -0.001 0.000 0.233 141 G C 0.182 175.022 174.900 -0.101 0.000 1.278 141 G CA -0.459 44.603 45.100 -0.063 0.000 0.861 141 G HN 0.572 8.862 8.290 -0.000 0.000 0.567 142 I N -0.356 120.150 120.570 -0.106 0.000 2.385 142 I HA 0.631 4.800 4.170 -0.001 0.000 0.294 142 I C -0.276 175.667 176.117 -0.290 0.000 0.988 142 I CA -0.891 60.284 61.300 -0.208 0.000 1.265 142 I CB 1.612 39.496 38.000 -0.193 0.000 1.388 142 I HN 0.257 8.467 8.210 -0.000 0.000 0.480 143 R N 5.241 125.447 120.500 -0.490 0.000 2.561 143 R HA 0.600 4.939 4.340 -0.001 0.000 0.297 143 R C -1.792 174.103 176.300 -0.676 0.000 0.969 143 R CA -0.792 55.036 56.100 -0.452 0.000 0.879 143 R CB 2.263 32.388 30.300 -0.291 0.000 1.178 143 R HN 0.662 8.932 8.270 -0.000 0.000 0.445 144 Y N 0.589 120.513 120.300 -0.627 0.000 2.553 144 Y HA 0.258 4.807 4.550 -0.001 0.000 0.347 144 Y C 0.323 175.888 175.900 -0.558 0.000 1.019 144 Y CA -0.933 56.785 58.100 -0.637 0.000 1.032 144 Y CB 2.325 40.261 38.460 -0.872 0.000 1.284 144 Y HN 0.467 8.747 8.280 -0.000 0.000 0.466 145 Q N 0.053 119.777 119.800 -0.127 0.000 2.418 145 Q HA 0.547 4.886 4.340 -0.001 0.000 0.276 145 Q C -1.758 174.254 176.000 0.020 0.000 1.081 145 Q CA -1.148 54.654 55.803 -0.003 0.000 0.864 145 Q CB 1.995 30.740 28.738 0.013 0.000 1.384 145 Q HN 0.662 8.932 8.270 -0.000 0.000 0.467 146 Y N 0.721 121.089 120.300 0.115 0.000 2.301 146 Y HA 0.183 4.733 4.550 -0.001 0.000 0.325 146 Y C 0.911 176.838 175.900 0.046 0.000 1.203 146 Y CA 0.046 58.206 58.100 0.100 0.000 1.255 146 Y CB 1.125 39.662 38.460 0.128 0.000 1.232 146 Y HN 0.697 8.977 8.280 -0.000 0.000 0.501 147 N N 0.722 119.524 118.700 0.171 0.000 2.322 147 N HA 0.062 4.801 4.740 -0.001 0.000 0.181 147 N C -0.502 175.109 175.510 0.167 0.000 1.088 147 N CA 0.481 53.606 53.050 0.126 0.000 0.885 147 N CB 0.801 39.324 38.487 0.059 0.000 1.013 147 N HN 0.366 8.746 8.380 -0.000 0.000 0.472 148 V N -2.009 118.054 119.914 0.248 0.000 3.126 148 V HA 0.504 4.624 4.120 -0.001 0.000 0.314 148 V C 0.194 176.448 176.094 0.267 0.000 1.138 148 V CA -1.204 61.244 62.300 0.247 0.000 1.034 148 V CB 1.631 33.602 31.823 0.248 0.000 1.075 148 V HN -0.124 8.066 8.190 -0.000 0.000 0.442 149 L N 3.581 124.951 121.223 0.245 0.000 2.660 149 L HA 0.213 4.552 4.340 -0.001 0.000 0.272 149 L C -1.991 174.993 176.870 0.189 0.000 1.194 149 L CA -0.711 54.247 54.840 0.197 0.000 0.945 149 L CB 0.068 42.214 42.059 0.145 0.000 1.212 149 L HN 0.558 8.788 8.230 -0.000 0.000 0.490 150 P HA 0.147 4.567 4.420 -0.000 0.000 0.282 150 P C -1.137 176.231 177.300 0.114 0.000 1.249 150 P CA -0.682 62.219 63.100 -0.332 0.000 0.806 150 P CB 0.848 31.905 31.700 -1.072 0.000 0.984 151 Q N 0.712 120.685 119.800 0.289 0.000 2.337 151 Q HA 0.380 4.719 4.340 -0.001 0.000 0.270 151 Q C 1.191 177.371 176.000 0.301 0.000 1.002 151 Q CA 0.657 56.635 55.803 0.292 0.000 0.888 151 Q CB 0.019 28.870 28.738 0.188 0.000 1.222 151 Q HN 0.875 9.145 8.270 -0.000 0.000 0.400 152 G N 1.568 110.533 108.800 0.276 0.000 2.279 152 G HA2 -0.256 3.703 3.960 -0.001 0.000 0.223 152 G HA3 -0.256 3.703 3.960 -0.001 0.000 0.223 152 G C -0.666 174.470 174.900 0.393 0.000 1.015 152 G CA -0.218 45.091 45.100 0.348 0.000 0.621 152 G HN 0.669 8.959 8.290 -0.000 0.000 0.506 153 W N 3.333 124.634 121.300 0.001 0.000 2.322 153 W HA 0.711 5.370 4.660 -0.001 0.000 0.307 153 W C 1.067 177.385 176.519 -0.336 0.000 1.220 153 W CA -0.687 56.473 57.345 -0.309 0.000 1.210 153 W CB 0.729 29.773 29.460 -0.693 0.000 1.223 153 W HN 0.034 8.214 8.180 -0.000 0.000 0.511 154 K N 3.433 123.360 120.400 -0.789 0.000 2.515 154 K HA -0.049 4.271 4.320 -0.001 0.000 0.196 154 K C 1.920 177.857 176.600 -1.105 0.000 1.038 154 K CA 0.942 56.573 56.287 -1.092 0.000 0.967 154 K CB -0.040 31.299 32.500 -1.935 0.000 0.780 154 K HN 0.790 9.040 8.250 -0.000 0.000 0.483 155 G N 0.535 108.166 108.800 -1.949 0.000 2.448 155 G HA2 -0.171 3.788 3.960 -0.001 0.000 0.218 155 G HA3 -0.171 3.788 3.960 -0.001 0.000 0.218 155 G C 1.461 175.756 174.900 -1.008 0.000 1.135 155 G CA 0.307 44.326 45.100 -1.802 0.000 0.784 155 G HN 0.155 8.445 8.290 -0.000 0.000 0.543 156 S N 1.653 116.813 115.700 -0.900 0.000 2.348 156 S HA -0.070 4.400 4.470 -0.001 0.000 0.221 156 S C 0.186 174.357 174.600 -0.715 0.000 1.033 156 S CA 1.520 59.283 58.200 -0.727 0.000 1.010 156 S CB -0.810 61.791 63.200 -0.998 0.000 0.891 156 S HN 0.390 8.700 8.310 -0.000 0.000 0.442 157 P HA 0.039 4.459 4.420 -0.000 0.000 0.219 157 P C 1.231 178.472 177.300 -0.098 0.000 1.150 157 P CA 1.293 64.279 63.100 -0.189 0.000 0.814 157 P CB -0.106 31.523 31.700 -0.119 0.000 0.787 158 A N 0.081 122.798 122.820 -0.172 0.000 1.902 158 A HA -0.124 4.195 4.320 -0.001 0.000 0.217 158 A C 2.338 179.871 177.584 -0.084 0.000 1.181 158 A CA 1.329 53.291 52.037 -0.124 0.000 0.623 158 A CB -1.454 17.448 19.000 -0.164 0.000 0.818 158 A HN 0.124 8.274 8.150 -0.000 0.000 0.443 159 I N -2.432 118.117 120.570 -0.035 0.000 2.333 159 I HA -0.117 4.052 4.170 -0.001 0.000 0.246 159 I C 2.166 178.340 176.117 0.095 0.000 1.106 159 I CA 0.988 62.319 61.300 0.052 0.000 1.411 159 I CB -0.214 37.854 38.000 0.114 0.000 1.082 159 I HN 0.361 8.571 8.210 -0.000 0.000 0.420 160 F N 1.706 121.629 119.950 -0.045 0.000 2.604 160 F HA -0.143 4.383 4.527 -0.001 0.000 0.298 160 F C 2.390 178.204 175.800 0.023 0.000 1.131 160 F CA 0.990 59.015 58.000 0.043 0.000 1.457 160 F CB -0.396 38.708 39.000 0.173 0.000 1.095 160 F HN 0.082 8.382 8.300 -0.000 0.000 0.574 161 Q N -0.308 119.493 119.800 0.002 0.000 1.998 161 Q HA -0.306 4.033 4.340 -0.001 0.000 0.209 161 Q C 2.506 178.403 176.000 -0.171 0.000 1.002 161 Q CA 2.645 58.413 55.803 -0.060 0.000 0.858 161 Q CB -0.704 28.006 28.738 -0.046 0.000 0.932 161 Q HN 0.352 8.621 8.270 -0.000 0.000 0.416 162 S N -0.638 114.970 115.700 -0.153 0.000 2.399 162 S HA -0.229 4.240 4.470 -0.001 0.000 0.235 162 S C 1.907 176.353 174.600 -0.258 0.000 1.063 162 S CA 1.921 60.025 58.200 -0.161 0.000 1.070 162 S CB -0.346 62.790 63.200 -0.107 0.000 0.904 162 S HN 0.540 8.850 8.310 -0.000 0.000 0.456 163 S N 0.123 115.551 115.700 -0.453 0.000 2.461 163 S HA 0.094 4.564 4.470 -0.001 0.000 0.228 163 S C 1.629 175.811 174.600 -0.697 0.000 1.005 163 S CA 1.028 58.858 58.200 -0.616 0.000 0.942 163 S CB -0.194 62.447 63.200 -0.931 0.000 0.776 163 S HN 0.567 8.877 8.310 -0.000 0.000 0.514 164 M N 2.369 121.599 119.600 -0.618 0.000 2.193 164 M HA -0.060 4.420 4.480 -0.001 0.000 0.265 164 M C 2.207 178.348 176.300 -0.266 0.000 1.071 164 M CA 1.607 56.692 55.300 -0.358 0.000 1.140 164 M CB -0.910 31.625 32.600 -0.109 0.000 1.369 164 M HN 0.366 8.656 8.290 -0.000 0.000 0.423 165 T N -1.938 112.490 114.554 -0.209 0.000 2.867 165 T HA -0.137 4.213 4.350 -0.001 0.000 0.268 165 T C 1.920 176.515 174.700 -0.176 0.000 1.057 165 T CA 1.512 63.523 62.100 -0.147 0.000 1.136 165 T CB -0.519 68.292 68.868 -0.096 0.000 0.874 165 T HN 0.472 8.712 8.240 -0.000 0.000 0.466 166 K N 1.040 121.300 120.400 -0.233 0.000 2.002 166 K HA -0.007 4.312 4.320 -0.001 0.000 0.209 166 K C 2.292 178.673 176.600 -0.365 0.000 1.048 166 K CA 1.513 57.660 56.287 -0.234 0.000 0.930 166 K CB -0.430 31.939 32.500 -0.220 0.000 0.714 166 K HN 0.405 8.655 8.250 -0.000 0.000 0.438 167 I N 1.117 121.291 120.570 -0.659 0.000 2.423 167 I HA -0.277 3.892 4.170 -0.001 0.000 0.254 167 I C 1.748 177.624 176.117 -0.401 0.000 1.151 167 I CA 1.126 61.894 61.300 -0.887 0.000 1.421 167 I CB -0.006 37.394 38.000 -1.000 0.000 1.079 167 I HN 0.210 8.420 8.210 -0.000 0.000 0.431 168 L N -0.519 120.547 121.223 -0.261 0.000 2.590 168 L HA 0.052 4.391 4.340 -0.001 0.000 0.227 168 L C 2.376 179.211 176.870 -0.058 0.000 1.099 168 L CA 0.014 54.763 54.840 -0.151 0.000 0.872 168 L CB -0.333 41.655 42.059 -0.118 0.000 1.088 168 L HN 0.176 8.406 8.230 -0.000 0.000 0.479 169 E N 2.109 122.271 120.200 -0.063 0.000 2.038 169 E HA -0.202 4.147 4.350 -0.001 0.000 0.195 169 E C -0.673 175.930 176.600 0.004 0.000 1.000 169 E CA 1.781 58.167 56.400 -0.023 0.000 0.803 169 E CB -0.888 28.799 29.700 -0.022 0.000 0.750 169 E HN 0.271 8.631 8.360 -0.000 0.000 0.448 170 P HA -0.170 4.250 4.420 -0.000 0.000 0.215 170 P C 1.721 179.028 177.300 0.012 0.000 1.153 170 P CA 1.200 64.338 63.100 0.063 0.000 0.853 170 P CB -0.535 31.267 31.700 0.169 0.000 0.788 171 F N 0.995 120.801 119.950 -0.241 0.000 2.234 171 F HA -0.084 4.443 4.527 -0.001 0.000 0.299 171 F C 2.466 178.164 175.800 -0.171 0.000 1.087 171 F CA 1.299 59.092 58.000 -0.345 0.000 1.340 171 F CB -0.272 38.315 39.000 -0.689 0.000 1.031 171 F HN -0.289 8.011 8.300 -0.000 0.000 0.500 172 R N 0.243 120.750 120.500 0.011 0.000 2.062 172 R HA -0.134 4.205 4.340 -0.001 0.000 0.229 172 R C 2.331 178.572 176.300 -0.100 0.000 1.128 172 R CA 1.410 57.491 56.100 -0.030 0.000 0.960 172 R CB -0.446 29.867 30.300 0.022 0.000 0.855 172 R HN 0.204 8.474 8.270 -0.000 0.000 0.432 173 K N 1.029 121.387 120.400 -0.071 0.000 2.113 173 K HA -0.235 4.085 4.320 -0.001 0.000 0.208 173 K C 1.787 178.327 176.600 -0.099 0.000 1.047 173 K CA 1.690 57.939 56.287 -0.063 0.000 0.928 173 K CB 0.118 32.600 32.500 -0.030 0.000 0.716 173 K HN 0.242 8.492 8.250 -0.000 0.000 0.446 174 Q N -0.527 119.177 119.800 -0.161 0.000 2.398 174 Q HA 0.064 4.403 4.340 -0.001 0.000 0.204 174 Q C -0.326 175.523 176.000 -0.252 0.000 0.932 174 Q CA 0.363 56.057 55.803 -0.182 0.000 0.916 174 Q CB 0.538 29.170 28.738 -0.177 0.000 1.024 174 Q HN 0.271 8.541 8.270 -0.000 0.000 0.504 175 N N 0.629 119.123 118.700 -0.343 0.000 2.690 175 N HA 0.159 4.898 4.740 -0.001 0.000 0.255 175 N C -2.509 172.891 175.510 -0.184 0.000 1.195 175 N CA -1.036 51.835 53.050 -0.297 0.000 0.790 175 N CB 1.669 39.869 38.487 -0.477 0.000 1.216 175 N HN -0.067 8.313 8.380 -0.000 0.000 0.528 176 P HA -0.066 4.354 4.420 -0.000 0.000 0.218 176 P C 0.251 177.523 177.300 -0.047 0.000 1.149 176 P CA 1.262 64.321 63.100 -0.068 0.000 0.817 176 P CB 0.353 32.021 31.700 -0.053 0.000 0.785 177 D N -1.046 119.325 120.400 -0.049 0.000 2.395 177 D HA 0.161 4.800 4.640 -0.001 0.000 0.226 177 D C 0.475 176.771 176.300 -0.007 0.000 1.146 177 D CA 0.165 54.149 54.000 -0.026 0.000 0.830 177 D CB -0.003 40.782 40.800 -0.025 0.000 0.958 177 D HN 0.241 8.611 8.370 -0.000 0.000 0.501 178 I N 0.901 121.470 120.570 -0.002 0.000 2.412 178 I HA 0.226 4.396 4.170 -0.001 0.000 0.296 178 I C -0.140 176.018 176.117 0.069 0.000 0.987 178 I CA -0.950 60.382 61.300 0.053 0.000 1.180 178 I CB 2.294 40.355 38.000 0.101 0.000 1.340 178 I HN -0.365 7.845 8.210 -0.000 0.000 0.455 179 V N 7.273 127.230 119.914 0.073 0.000 2.427 179 V HA 0.476 4.596 4.120 -0.001 0.000 0.286 179 V C -0.014 176.142 176.094 0.103 0.000 1.034 179 V CA -0.446 61.890 62.300 0.061 0.000 0.893 179 V CB 1.822 33.654 31.823 0.015 0.000 0.982 179 V HN 0.463 8.653 8.190 -0.000 0.000 0.452 180 I N 5.258 125.896 120.570 0.113 0.000 2.503 180 I HA 0.356 4.525 4.170 -0.001 0.000 0.282 180 I C -1.548 174.685 176.117 0.193 0.000 1.059 180 I CA -0.547 60.832 61.300 0.132 0.000 1.081 180 I CB 1.652 39.701 38.000 0.081 0.000 1.210 180 I HN 0.643 8.853 8.210 -0.000 0.000 0.450 181 Y N 6.500 126.866 120.300 0.110 0.000 2.364 181 Y HA 0.437 4.987 4.550 -0.001 0.000 0.340 181 Y C -0.488 175.564 175.900 0.254 0.000 0.975 181 Y CA -0.660 57.516 58.100 0.126 0.000 1.089 181 Y CB 1.616 40.103 38.460 0.044 0.000 1.192 181 Y HN 0.556 8.836 8.280 -0.000 0.000 0.454 182 Q N 5.324 124.911 119.800 -0.355 0.000 2.241 182 Q HA 0.371 4.711 4.340 -0.001 0.000 0.254 182 Q C -2.189 173.515 176.000 -0.492 0.000 0.917 182 Q CA -0.796 54.859 55.803 -0.246 0.000 0.919 182 Q CB 1.265 29.962 28.738 -0.067 0.000 1.237 182 Q HN 0.802 9.072 8.270 -0.000 0.000 0.434 183 Y N 6.075 126.238 120.300 -0.229 0.000 2.362 183 Y HA 0.244 4.793 4.550 -0.001 0.000 0.326 183 Y C -0.056 175.908 175.900 0.106 0.000 1.083 183 Y CA -0.555 57.477 58.100 -0.113 0.000 1.073 183 Y CB 0.845 39.273 38.460 -0.054 0.000 1.211 183 Y HN 0.911 9.191 8.280 -0.000 0.000 0.433 184 M N 1.590 120.909 119.600 -0.467 0.000 7.319 184 M HA -0.379 4.100 4.480 -0.001 0.000 0.312 184 M C 0.046 176.409 176.300 0.105 0.000 0.480 184 M CA 2.263 57.447 55.300 -0.194 0.000 1.311 184 M CB -1.239 31.348 32.600 -0.022 0.000 0.421 184 M HN 0.751 9.041 8.290 -0.000 0.000 0.740 185 D N 1.264 121.775 120.400 0.186 0.000 2.340 185 D HA 0.217 4.857 4.640 -0.001 0.000 0.217 185 D C -0.206 176.111 176.300 0.029 0.000 1.081 185 D CA 0.428 54.495 54.000 0.112 0.000 0.842 185 D CB 0.029 40.861 40.800 0.053 0.000 0.934 185 D HN 0.352 8.722 8.370 -0.000 0.000 0.511 186 D N 0.561 121.035 120.400 0.124 0.000 2.340 186 D HA 0.332 4.971 4.640 -0.001 0.000 0.240 186 D C -0.447 175.857 176.300 0.007 0.000 1.001 186 D CA -0.651 53.368 54.000 0.031 0.000 0.888 186 D CB 2.628 43.456 40.800 0.047 0.000 1.310 186 D HN -0.124 8.246 8.370 -0.000 0.000 0.474 187 L N 1.660 122.811 121.223 -0.119 0.000 2.322 187 L HA 0.321 4.660 4.340 -0.001 0.000 0.281 187 L C -1.404 175.356 176.870 -0.184 0.000 1.014 187 L CA -0.567 54.232 54.840 -0.068 0.000 0.815 187 L CB 0.910 42.921 42.059 -0.079 0.000 1.247 187 L HN 0.246 8.476 8.230 -0.000 0.000 0.421 188 Y N 3.956 124.290 120.300 0.057 0.000 2.331 188 Y HA 0.595 5.144 4.550 -0.001 0.000 0.338 188 Y C -0.267 175.677 175.900 0.074 0.000 0.976 188 Y CA -0.749 57.406 58.100 0.091 0.000 1.137 188 Y CB 1.658 40.230 38.460 0.187 0.000 1.172 188 Y HN 0.206 8.486 8.280 -0.000 0.000 0.478 189 V N 3.232 123.224 119.914 0.130 0.000 2.444 189 V HA 0.836 4.956 4.120 -0.001 0.000 0.294 189 V C 0.161 176.358 176.094 0.172 0.000 1.022 189 V CA -0.756 61.611 62.300 0.111 0.000 0.850 189 V CB 1.451 33.284 31.823 0.017 0.000 0.992 189 V HN 0.902 9.092 8.190 -0.000 0.000 0.426 190 G N 2.653 111.551 108.800 0.164 0.000 2.519 190 G HA2 0.842 4.802 3.960 -0.001 0.000 0.307 190 G HA3 0.842 4.802 3.960 -0.001 0.000 0.307 190 G C -0.679 174.320 174.900 0.165 0.000 1.266 190 G CA -0.119 45.078 45.100 0.162 0.000 0.970 190 G HN 1.033 9.323 8.290 -0.000 0.000 0.481 191 S N -0.748 115.050 115.700 0.164 0.000 2.672 191 S HA 0.523 4.992 4.470 -0.001 0.000 0.271 191 S C -1.061 173.568 174.600 0.049 0.000 1.171 191 S CA -0.724 57.555 58.200 0.132 0.000 0.817 191 S CB 2.109 65.454 63.200 0.242 0.000 1.150 191 S HN 0.302 8.612 8.310 -0.000 0.000 0.478 192 D N 0.441 120.862 120.400 0.036 0.000 2.402 192 D HA 0.290 4.930 4.640 -0.001 0.000 0.216 192 D C 0.115 176.429 176.300 0.024 0.000 1.128 192 D CA -0.116 53.887 54.000 0.004 0.000 0.833 192 D CB -0.004 40.789 40.800 -0.012 0.000 0.971 192 D HN 0.227 8.597 8.370 -0.000 0.000 0.503 193 L N 1.767 123.032 121.223 0.071 0.000 2.503 193 L HA -0.020 4.319 4.340 -0.001 0.000 0.287 193 L C 1.217 178.123 176.870 0.061 0.000 1.252 193 L CA -0.062 54.825 54.840 0.078 0.000 0.835 193 L CB -0.212 41.925 42.059 0.131 0.000 1.099 193 L HN 0.156 8.386 8.230 -0.000 0.000 0.516 194 E N 0.604 120.833 120.200 0.049 0.000 2.404 194 E HA 0.024 4.374 4.350 -0.001 0.000 0.261 194 E C 1.035 177.678 176.600 0.072 0.000 1.074 194 E CA -0.132 56.290 56.400 0.037 0.000 0.917 194 E CB 0.285 30.000 29.700 0.025 0.000 0.965 194 E HN 0.441 8.801 8.360 -0.000 0.000 0.433 195 I N 2.946 123.548 120.570 0.054 0.000 2.264 195 I HA -0.099 4.070 4.170 -0.001 0.000 0.248 195 I C 1.780 177.974 176.117 0.128 0.000 1.111 195 I CA 2.369 63.724 61.300 0.093 0.000 1.382 195 I CB -0.761 37.272 38.000 0.056 0.000 1.060 195 I HN 0.795 9.005 8.210 -0.000 0.000 0.418 196 G N -0.648 108.202 108.800 0.084 0.000 2.418 196 G HA2 -0.253 3.706 3.960 -0.001 0.000 0.217 196 G HA3 -0.253 3.706 3.960 -0.001 0.000 0.217 196 G C 1.550 176.499 174.900 0.082 0.000 1.158 196 G CA 0.755 45.899 45.100 0.075 0.000 0.771 196 G HN 0.546 8.836 8.290 -0.000 0.000 0.545 197 Q N -0.873 118.977 119.800 0.084 0.000 2.172 197 Q HA -0.058 4.281 4.340 -0.001 0.000 0.200 197 Q C 2.197 178.256 176.000 0.099 0.000 0.964 197 Q CA 1.150 56.998 55.803 0.075 0.000 0.855 197 Q CB -0.168 28.607 28.738 0.061 0.000 0.918 197 Q HN 0.734 9.004 8.270 -0.000 0.000 0.444 198 H N 1.060 120.155 119.070 0.042 0.000 2.293 198 H HA -0.032 4.523 4.556 -0.001 0.000 0.300 198 H C 1.942 177.303 175.328 0.055 0.000 1.082 198 H CA 1.692 57.770 56.048 0.050 0.000 1.308 198 H CB 0.232 30.023 29.762 0.048 0.000 1.375 198 H HN -0.009 8.271 8.280 -0.000 0.000 0.495 199 R N -0.781 119.789 120.500 0.118 0.000 2.127 199 R HA -0.107 4.233 4.340 -0.001 0.000 0.238 199 R C 2.219 178.521 176.300 0.004 0.000 1.134 199 R CA 1.794 57.925 56.100 0.051 0.000 0.975 199 R CB -0.181 30.175 30.300 0.094 0.000 0.865 199 R HN 0.380 8.650 8.270 -0.000 0.000 0.447 200 T N 0.675 115.242 114.554 0.022 0.000 2.812 200 T HA -0.051 4.299 4.350 -0.001 0.000 0.264 200 T C 1.607 176.327 174.700 0.035 0.000 1.042 200 T CA 0.823 62.940 62.100 0.029 0.000 1.140 200 T CB 0.050 68.941 68.868 0.037 0.000 0.870 200 T HN 0.058 8.298 8.240 -0.000 0.000 0.445 201 K N 0.989 121.401 120.400 0.020 0.000 2.211 201 K HA 0.075 4.394 4.320 -0.001 0.000 0.203 201 K C 2.128 178.768 176.600 0.068 0.000 1.050 201 K CA 0.581 56.920 56.287 0.088 0.000 0.945 201 K CB -0.407 32.131 32.500 0.064 0.000 0.732 201 K HN 0.316 8.566 8.250 -0.000 0.000 0.451 202 I N 1.241 121.759 120.570 -0.086 0.000 2.202 202 I HA -0.196 3.973 4.170 -0.001 0.000 0.242 202 I C 2.305 178.387 176.117 -0.059 0.000 1.091 202 I CA 1.158 62.385 61.300 -0.121 0.000 1.368 202 I CB -0.805 37.107 38.000 -0.146 0.000 1.058 202 I HN 0.173 8.383 8.210 -0.000 0.000 0.410 203 E N 0.951 121.143 120.200 -0.014 0.000 2.077 203 E HA -0.255 4.094 4.350 -0.001 0.000 0.193 203 E C 2.041 178.666 176.600 0.041 0.000 0.989 203 E CA 1.210 57.615 56.400 0.008 0.000 0.800 203 E CB -0.081 29.630 29.700 0.018 0.000 0.746 203 E HN 0.486 8.846 8.360 -0.000 0.000 0.452 204 E N 0.353 120.612 120.200 0.097 0.000 2.049 204 E HA -0.199 4.150 4.350 -0.001 0.000 0.198 204 E C 2.334 179.084 176.600 0.249 0.000 1.007 204 E CA 1.177 57.699 56.400 0.203 0.000 0.809 204 E CB -0.255 29.635 29.700 0.316 0.000 0.749 204 E HN 0.228 8.588 8.360 -0.000 0.000 0.450 205 L N 0.592 121.832 121.223 0.029 0.000 2.046 205 L HA -0.181 4.158 4.340 -0.001 0.000 0.208 205 L C 2.556 179.353 176.870 -0.121 0.000 1.077 205 L CA 1.376 55.979 54.840 -0.396 0.000 0.747 205 L CB -0.270 41.279 42.059 -0.850 0.000 0.896 205 L HN 0.197 8.427 8.230 -0.000 0.000 0.432 206 R N -0.744 119.714 120.500 -0.070 0.000 2.159 206 R HA -0.191 4.148 4.340 -0.001 0.000 0.237 206 R C 2.193 178.503 176.300 0.018 0.000 1.131 206 R CA 1.223 57.303 56.100 -0.034 0.000 0.982 206 R CB -0.032 30.251 30.300 -0.028 0.000 0.868 206 R HN 0.525 8.795 8.270 -0.000 0.000 0.453 207 Q N -0.685 119.139 119.800 0.041 0.000 2.123 207 Q HA -0.101 4.239 4.340 -0.001 0.000 0.199 207 Q C 1.959 177.977 176.000 0.031 0.000 0.966 207 Q CA 1.227 57.038 55.803 0.013 0.000 0.845 207 Q CB -0.216 28.501 28.738 -0.035 0.000 0.907 207 Q HN 0.610 8.880 8.270 -0.000 0.000 0.439 208 H N 0.161 119.264 119.070 0.056 0.000 2.293 208 H HA -0.105 4.450 4.556 -0.001 0.000 0.300 208 H C 2.071 177.499 175.328 0.166 0.000 1.082 208 H CA 0.978 57.096 56.048 0.117 0.000 1.308 208 H CB 0.074 29.863 29.762 0.045 0.000 1.375 208 H HN 0.109 8.389 8.280 -0.000 0.000 0.495 209 L N 1.141 122.471 121.223 0.178 0.000 2.043 209 L HA -0.186 4.154 4.340 -0.001 0.000 0.212 209 L C 2.566 179.555 176.870 0.198 0.000 1.075 209 L CA 1.007 55.923 54.840 0.128 0.000 0.752 209 L CB -1.199 40.867 42.059 0.011 0.000 0.891 209 L HN 0.303 8.533 8.230 -0.000 0.000 0.432 210 L N -0.657 120.647 121.223 0.135 0.000 2.187 210 L HA -0.202 4.138 4.340 -0.001 0.000 0.213 210 L C 2.200 179.139 176.870 0.114 0.000 1.100 210 L CA 1.443 56.339 54.840 0.093 0.000 0.765 210 L CB -0.524 41.563 42.059 0.046 0.000 0.904 210 L HN 0.238 8.468 8.230 -0.000 0.000 0.437 211 R N -1.751 118.857 120.500 0.180 0.000 2.323 211 R HA -0.086 4.254 4.340 -0.001 0.000 0.198 211 R C 0.594 176.853 176.300 -0.069 0.000 0.988 211 R CA 0.610 56.742 56.100 0.053 0.000 1.041 211 R CB -0.325 29.993 30.300 0.031 0.000 0.926 211 R HN 0.420 8.690 8.270 -0.000 0.000 0.476 212 W N -0.751 120.575 121.300 0.043 0.000 2.499 212 W HA 0.484 5.143 4.660 -0.001 0.000 0.362 212 W C 0.003 176.555 176.519 0.055 0.000 0.945 212 W CA 0.006 57.392 57.345 0.067 0.000 1.721 212 W CB 0.520 30.042 29.460 0.102 0.000 1.156 212 W HN 0.036 8.216 8.180 -0.000 0.000 0.547 213 G N 2.818 111.731 108.800 0.188 0.000 3.409 213 G HA2 0.188 4.148 3.960 -0.001 0.000 0.686 213 G HA3 0.188 4.148 3.960 -0.001 0.000 0.686 213 G C -1.437 173.493 174.900 0.050 0.000 1.017 213 G CA -0.363 44.796 45.100 0.098 0.000 0.854 213 G HN 0.467 8.757 8.290 -0.000 0.000 0.508 214 L N 1.795 123.024 121.223 0.010 0.000 3.076 214 L HA 0.653 4.992 4.340 -0.001 0.000 0.240 214 L C 0.419 177.272 176.870 -0.028 0.000 0.982 214 L CA 0.272 55.093 54.840 -0.032 0.000 1.030 214 L CB 1.148 43.194 42.059 -0.021 0.000 1.560 214 L HN 1.419 9.649 8.230 -0.000 0.000 0.432 233 E N 2.168 122.328 120.200 -0.068 0.000 2.129 233 E HA 0.457 4.806 4.350 -0.001 0.000 0.268 233 E C -1.541 174.840 176.600 -0.364 0.000 0.900 233 E CA -0.943 55.329 56.400 -0.213 0.000 0.755 233 E CB 2.111 31.773 29.700 -0.063 0.000 1.117 233 E HN 0.359 8.719 8.360 -0.000 0.000 0.410 234 L N 2.714 123.646 121.223 -0.485 0.000 2.344 234 L HA 0.307 4.647 4.340 -0.001 0.000 0.272 234 L C 0.054 176.439 176.870 -0.809 0.000 1.035 234 L CA -0.595 54.009 54.840 -0.393 0.000 0.807 234 L CB 0.736 42.723 42.059 -0.120 0.000 1.237 234 L HN 0.562 8.792 8.230 -0.000 0.000 0.442 235 H N 2.742 121.732 119.070 -0.134 0.000 2.348 235 H HA 0.227 4.782 4.556 -0.001 0.000 0.232 235 H C -1.848 173.112 175.328 -0.613 0.000 1.419 235 H CA -1.340 54.541 56.048 -0.279 0.000 1.416 235 H CB 0.848 30.526 29.762 -0.140 0.000 1.510 235 H HN 0.396 8.676 8.280 -0.000 0.000 0.507 236 P HA -0.150 4.270 4.420 -0.000 0.000 0.220 236 P C 1.076 177.759 177.300 -1.030 0.000 1.148 236 P CA 1.104 62.977 63.100 -2.046 0.000 0.803 236 P CB 0.322 31.028 31.700 -1.657 0.000 0.782 237 D N -0.056 120.032 120.400 -0.520 0.000 2.378 237 D HA -0.115 4.524 4.640 -0.001 0.000 0.227 237 D C 1.070 177.283 176.300 -0.146 0.000 1.012 237 D CA 0.649 54.496 54.000 -0.255 0.000 0.905 237 D CB -0.485 40.212 40.800 -0.172 0.000 0.895 237 D HN 0.212 8.582 8.370 -0.000 0.000 0.532 238 K N -0.506 119.799 120.400 -0.160 0.000 2.413 238 K HA 0.083 4.403 4.320 -0.001 0.000 0.204 238 K C -0.335 176.382 176.600 0.195 0.000 1.041 238 K CA -0.592 55.705 56.287 0.016 0.000 1.082 238 K CB 0.506 33.032 32.500 0.043 0.000 0.871 238 K HN 0.036 8.286 8.250 -0.000 0.000 0.535 239 W N 3.384 124.707 121.300 0.039 0.000 2.419 239 W HA 0.120 4.780 4.660 -0.001 0.000 0.312 239 W C 0.788 177.330 176.519 0.037 0.000 1.323 239 W CA -0.595 56.778 57.345 0.046 0.000 1.293 239 W CB -0.107 29.372 29.460 0.033 0.000 1.324 239 W HN -0.025 8.155 8.180 -0.000 0.000 0.512 240 T N -0.518 114.190 114.554 0.256 0.000 2.924 240 T HA 0.655 5.005 4.350 -0.001 0.000 0.291 240 T C -0.083 174.692 174.700 0.125 0.000 1.045 240 T CA -0.985 61.211 62.100 0.159 0.000 1.015 240 T CB 1.645 70.582 68.868 0.114 0.000 1.103 240 T HN 0.273 8.513 8.240 -0.000 0.000 0.496 241 V N -0.123 119.852 119.914 0.102 0.000 2.811 241 V HA 0.473 4.592 4.120 -0.001 0.000 0.302 241 V C 0.240 176.367 176.094 0.055 0.000 1.063 241 V CA -0.767 61.580 62.300 0.078 0.000 1.088 241 V CB 0.617 32.502 31.823 0.103 0.000 0.982 241 V HN 0.957 9.147 8.190 -0.000 0.000 0.485 242 Q N 5.222 125.031 119.800 0.015 0.000 2.389 242 Q HA 0.447 4.787 4.340 -0.001 0.000 0.244 242 Q C -2.522 173.520 176.000 0.070 0.000 1.056 242 Q CA -1.873 53.943 55.803 0.021 0.000 0.908 242 Q CB 0.556 29.273 28.738 -0.035 0.000 1.273 242 Q HN 0.715 8.985 8.270 -0.000 0.000 0.471 243 P HA 0.002 4.422 4.420 -0.000 0.000 0.268 243 P C -0.436 176.922 177.300 0.096 0.000 1.208 243 P CA 0.106 63.249 63.100 0.073 0.000 0.777 243 P CB 0.493 32.212 31.700 0.031 0.000 0.875 244 I N 1.839 122.468 120.570 0.097 0.000 2.587 244 I HA 0.022 4.191 4.170 -0.001 0.000 0.284 244 I C 0.545 176.672 176.117 0.018 0.000 1.134 244 I CA -0.118 61.230 61.300 0.081 0.000 1.410 244 I CB 0.019 38.043 38.000 0.041 0.000 1.392 244 I HN 0.081 8.291 8.210 -0.000 0.000 0.545 245 V N 6.101 126.038 119.914 0.038 0.000 2.532 245 V HA 0.540 4.660 4.120 -0.001 0.000 0.295 245 V C -0.216 175.900 176.094 0.037 0.000 1.041 245 V CA -0.888 61.430 62.300 0.029 0.000 0.926 245 V CB 1.579 33.423 31.823 0.036 0.000 0.992 245 V HN 0.460 8.650 8.190 -0.000 0.000 0.457 246 L N 5.338 126.585 121.223 0.041 0.000 2.282 246 L HA 0.539 4.878 4.340 -0.001 0.000 0.288 246 L C -1.942 174.996 176.870 0.114 0.000 1.033 246 L CA -1.708 53.180 54.840 0.079 0.000 0.807 246 L CB 1.618 43.714 42.059 0.062 0.000 1.209 246 L HN 0.523 8.753 8.230 -0.000 0.000 0.423 247 P HA 0.064 4.484 4.420 -0.000 0.000 0.268 247 P C -0.719 176.683 177.300 0.170 0.000 1.208 247 P CA -0.167 62.995 63.100 0.103 0.000 0.777 247 P CB 1.121 32.849 31.700 0.048 0.000 0.875 248 E N 1.868 122.102 120.200 0.057 0.000 2.158 248 E HA 0.346 4.695 4.350 -0.001 0.000 0.271 248 E C -0.700 175.818 176.600 -0.138 0.000 0.911 248 E CA -0.545 55.903 56.400 0.079 0.000 0.767 248 E CB 1.269 31.012 29.700 0.072 0.000 1.120 248 E HN 0.295 8.655 8.360 -0.000 0.000 0.405 249 K N 2.669 122.879 120.400 -0.317 0.000 2.426 249 K HA 0.151 4.470 4.320 -0.001 0.000 0.254 249 K C 0.368 176.743 176.600 -0.376 0.000 0.936 249 K CA -0.511 55.410 56.287 -0.612 0.000 0.801 249 K CB 1.567 33.227 32.500 -1.400 0.000 1.139 249 K HN 0.383 8.633 8.250 -0.000 0.000 0.424 250 D N 0.888 121.151 120.400 -0.230 0.000 2.653 250 D HA -0.307 4.332 4.640 -0.001 0.000 0.199 250 D C 0.588 176.805 176.300 -0.138 0.000 1.042 250 D CA 1.585 55.502 54.000 -0.139 0.000 0.876 250 D CB -0.034 40.690 40.800 -0.126 0.000 1.010 250 D HN 0.250 8.620 8.370 -0.000 0.000 0.473 251 S N -2.399 113.157 115.700 -0.240 0.000 2.599 251 S HA 0.555 5.024 4.470 -0.001 0.000 0.294 251 S C -2.064 172.366 174.600 -0.283 0.000 1.094 251 S CA -1.035 57.082 58.200 -0.138 0.000 0.931 251 S CB 0.800 63.964 63.200 -0.061 0.000 1.093 251 S HN 0.355 8.665 8.310 -0.000 0.000 0.488 252 W N 1.697 122.996 121.300 -0.002 0.000 2.683 252 W HA 0.461 5.121 4.660 -0.001 0.000 0.329 252 W C 0.269 176.788 176.519 -0.001 0.000 1.037 252 W CA -0.586 56.758 57.345 -0.001 0.000 1.232 252 W CB 1.795 31.254 29.460 -0.001 0.000 1.390 252 W HN 0.767 8.947 8.180 -0.000 0.000 0.465 253 T N -1.733 112.965 114.554 0.239 0.000 2.912 253 T HA 0.322 4.671 4.350 -0.001 0.000 0.280 253 T C 0.882 175.674 174.700 0.153 0.000 0.989 253 T CA -0.744 61.444 62.100 0.146 0.000 0.995 253 T CB 1.256 70.175 68.868 0.085 0.000 1.077 253 T HN 0.212 8.452 8.240 -0.000 0.000 0.531 254 V N 1.564 121.535 119.914 0.095 0.000 2.252 254 V HA -0.249 3.871 4.120 -0.001 0.000 0.249 254 V C 2.859 179.002 176.094 0.081 0.000 1.056 254 V CA 2.392 64.735 62.300 0.072 0.000 1.022 254 V CB -1.274 30.578 31.823 0.047 0.000 0.641 254 V HN 1.044 9.234 8.190 -0.000 0.000 0.445 255 N N 0.061 118.806 118.700 0.075 0.000 2.094 255 N HA -0.252 4.488 4.740 -0.001 0.000 0.191 255 N C 1.530 177.102 175.510 0.104 0.000 1.023 255 N CA 1.846 54.939 53.050 0.071 0.000 0.857 255 N CB -0.120 38.397 38.487 0.049 0.000 1.013 255 N HN 0.494 8.874 8.380 -0.000 0.000 0.426 256 D N 0.652 121.142 120.400 0.150 0.000 2.178 256 D HA -0.081 4.558 4.640 -0.001 0.000 0.201 256 D C 1.975 178.456 176.300 0.302 0.000 0.980 256 D CA 0.718 54.866 54.000 0.247 0.000 0.842 256 D CB -0.122 40.875 40.800 0.328 0.000 0.948 256 D HN 0.469 8.839 8.370 -0.000 0.000 0.472 257 I N 0.514 121.210 120.570 0.210 0.000 2.406 257 I HA -0.191 3.979 4.170 -0.001 0.000 0.249 257 I C 2.348 178.491 176.117 0.043 0.000 1.122 257 I CA 0.635 61.975 61.300 0.066 0.000 1.431 257 I CB -0.170 37.826 38.000 -0.007 0.000 1.087 257 I HN -0.077 8.133 8.210 -0.000 0.000 0.424 258 Q N 0.910 120.749 119.800 0.065 0.000 2.050 258 Q HA -0.193 4.147 4.340 -0.001 0.000 0.202 258 Q C 2.200 178.253 176.000 0.088 0.000 0.980 258 Q CA 1.210 57.050 55.803 0.061 0.000 0.840 258 Q CB -0.111 28.663 28.738 0.060 0.000 0.898 258 Q HN 0.321 8.591 8.270 -0.000 0.000 0.424 259 K N 0.701 121.167 120.400 0.109 0.000 2.074 259 K HA -0.185 4.134 4.320 -0.001 0.000 0.209 259 K C 2.092 178.776 176.600 0.140 0.000 1.048 259 K CA 0.889 57.259 56.287 0.137 0.000 0.926 259 K CB -0.579 31.997 32.500 0.127 0.000 0.713 259 K HN 0.162 8.412 8.250 -0.000 0.000 0.444 260 L N 1.085 122.378 121.223 0.116 0.000 2.046 260 L HA -0.128 4.212 4.340 -0.001 0.000 0.208 260 L C 2.155 179.029 176.870 0.006 0.000 1.077 260 L CA 1.432 56.310 54.840 0.064 0.000 0.747 260 L CB -0.505 41.550 42.059 -0.007 0.000 0.896 260 L HN -0.129 8.101 8.230 -0.000 0.000 0.432 261 V N -0.088 119.827 119.914 0.001 0.000 2.548 261 V HA -0.117 4.002 4.120 -0.001 0.000 0.249 261 V C 2.562 178.650 176.094 -0.010 0.000 1.055 261 V CA 1.395 63.684 62.300 -0.019 0.000 1.065 261 V CB -1.392 30.423 31.823 -0.014 0.000 0.681 261 V HN 0.615 8.805 8.190 -0.000 0.000 0.462 262 G N -0.079 108.751 108.800 0.051 0.000 2.511 262 G HA2 -0.341 3.619 3.960 -0.001 0.000 0.216 262 G HA3 -0.341 3.619 3.960 -0.001 0.000 0.216 262 G C 1.611 176.413 174.900 -0.163 0.000 1.218 262 G CA 1.212 46.358 45.100 0.078 0.000 0.788 262 G HN 0.462 8.752 8.290 -0.000 0.000 0.560 263 K N -0.519 119.825 120.400 -0.094 0.000 2.074 263 K HA -0.078 4.241 4.320 -0.001 0.000 0.209 263 K C 2.473 178.924 176.600 -0.248 0.000 1.048 263 K CA 1.035 57.146 56.287 -0.294 0.000 0.926 263 K CB -0.232 32.278 32.500 0.017 0.000 0.713 263 K HN 0.177 8.427 8.250 -0.000 0.000 0.444 264 L N 1.727 122.869 121.223 -0.135 0.000 2.083 264 L HA -0.176 4.163 4.340 -0.001 0.000 0.209 264 L C 2.130 178.921 176.870 -0.131 0.000 1.083 264 L CA 1.922 56.695 54.840 -0.113 0.000 0.752 264 L CB -1.602 40.406 42.059 -0.085 0.000 0.899 264 L HN 0.428 8.658 8.230 -0.000 0.000 0.433 265 N N -0.917 117.689 118.700 -0.156 0.000 2.188 265 N HA -0.256 4.483 4.740 -0.001 0.000 0.184 265 N C 2.013 177.412 175.510 -0.185 0.000 1.018 265 N CA 1.234 54.199 53.050 -0.142 0.000 0.858 265 N CB -0.393 38.028 38.487 -0.110 0.000 0.989 265 N HN 0.475 8.855 8.380 -0.000 0.000 0.426 266 W N 1.322 122.263 121.300 -0.599 0.000 2.378 266 W HA -0.014 4.646 4.660 -0.001 0.000 0.313 266 W C 1.837 178.155 176.519 -0.335 0.000 1.197 266 W CA 1.645 58.594 57.345 -0.661 0.000 1.304 266 W CB -0.834 27.799 29.460 -1.379 0.000 1.148 266 W HN 0.189 8.369 8.180 -0.000 0.000 0.494 267 A N 0.543 123.268 122.820 -0.158 0.000 2.076 267 A HA -0.218 4.101 4.320 -0.001 0.000 0.220 267 A C 2.132 179.681 177.584 -0.058 0.000 1.160 267 A CA 2.166 54.148 52.037 -0.091 0.000 0.653 267 A CB -1.119 17.844 19.000 -0.062 0.000 0.801 267 A HN 0.381 8.531 8.150 -0.000 0.000 0.455 268 S N -1.024 114.607 115.700 -0.115 0.000 2.387 268 S HA -0.116 4.353 4.470 -0.001 0.000 0.226 268 S C 1.915 176.458 174.600 -0.095 0.000 1.026 268 S CA 0.963 59.119 58.200 -0.073 0.000 0.972 268 S CB -0.299 62.855 63.200 -0.077 0.000 0.814 268 S HN 0.613 8.923 8.310 -0.000 0.000 0.477 269 Q N 0.018 119.719 119.800 -0.165 0.000 2.541 269 Q HA 0.122 4.461 4.340 -0.001 0.000 0.215 269 Q C 1.343 177.259 176.000 -0.139 0.000 0.977 269 Q CA 0.656 56.373 55.803 -0.144 0.000 0.934 269 Q CB 0.071 28.743 28.738 -0.110 0.000 0.988 269 Q HN 0.625 8.895 8.270 -0.000 0.000 0.521 270 I N -2.460 118.009 120.570 -0.169 0.000 3.650 270 I HA -0.020 4.150 4.170 -0.001 0.000 0.261 270 I C -0.177 175.824 176.117 -0.194 0.000 1.154 270 I CA -0.026 61.153 61.300 -0.203 0.000 1.418 270 I CB 0.432 38.258 38.000 -0.291 0.000 1.539 270 I HN -0.089 8.121 8.210 -0.000 0.000 0.449 271 Y N 4.494 124.729 120.300 -0.107 0.000 2.504 271 Y HA 0.248 4.797 4.550 -0.001 0.000 0.351 271 Y C -2.103 173.772 175.900 -0.042 0.000 0.988 271 Y CA -2.592 55.477 58.100 -0.052 0.000 1.239 271 Y CB -0.055 38.383 38.460 -0.037 0.000 1.128 271 Y HN 0.002 8.282 8.280 -0.000 0.000 0.525 272 P HA 0.088 4.508 4.420 -0.000 0.000 0.267 272 P C 0.847 178.200 177.300 0.088 0.000 1.205 272 P CA 0.947 64.081 63.100 0.057 0.000 0.765 272 P CB 1.226 32.946 31.700 0.033 0.000 0.828 273 G N 2.932 111.763 108.800 0.052 0.000 2.316 273 G HA2 -0.171 3.789 3.960 -0.001 0.000 0.203 273 G HA3 -0.171 3.789 3.960 -0.001 0.000 0.203 273 G C 0.123 175.033 174.900 0.018 0.000 0.999 273 G CA -0.523 44.602 45.100 0.041 0.000 0.649 273 G HN 0.463 8.753 8.290 -0.000 0.000 0.489 274 I N 1.959 122.539 120.570 0.016 0.000 2.668 274 I HA 0.250 4.419 4.170 -0.001 0.000 0.285 274 I C 0.426 176.528 176.117 -0.025 0.000 1.168 274 I CA 0.827 62.119 61.300 -0.014 0.000 1.424 274 I CB 0.551 38.537 38.000 -0.023 0.000 1.377 274 I HN 0.166 8.376 8.210 -0.000 0.000 0.560 275 K N 5.195 125.575 120.400 -0.034 0.000 2.397 275 K HA 0.426 4.746 4.320 -0.001 0.000 0.253 275 K C 0.363 176.934 176.600 -0.048 0.000 0.932 275 K CA -0.528 55.738 56.287 -0.036 0.000 0.795 275 K CB 2.751 35.233 32.500 -0.030 0.000 1.159 275 K HN 0.477 8.727 8.250 -0.000 0.000 0.424 276 V N -0.031 119.854 119.914 -0.049 0.000 3.477 276 V HA 0.150 4.269 4.120 -0.001 0.000 0.297 276 V C 1.771 177.833 176.094 -0.053 0.000 1.433 276 V CA 0.050 62.315 62.300 -0.057 0.000 1.052 276 V CB 0.051 31.841 31.823 -0.055 0.000 0.895 276 V HN 0.794 8.984 8.190 -0.000 0.000 0.438 277 R N 0.729 121.203 120.500 -0.044 0.000 2.097 277 R HA -0.265 4.074 4.340 -0.001 0.000 0.236 277 R C 2.264 178.537 176.300 -0.045 0.000 1.135 277 R CA 2.715 58.792 56.100 -0.039 0.000 0.934 277 R CB -0.330 29.951 30.300 -0.032 0.000 0.846 277 R HN 0.533 8.803 8.270 -0.000 0.000 0.431 278 Q N -0.094 119.676 119.800 -0.051 0.000 2.364 278 Q HA -0.081 4.258 4.340 -0.001 0.000 0.209 278 Q C 1.593 177.549 176.000 -0.074 0.000 0.977 278 Q CA 0.867 56.637 55.803 -0.056 0.000 0.885 278 Q CB 0.058 28.762 28.738 -0.057 0.000 0.941 278 Q HN 0.290 8.560 8.270 -0.000 0.000 0.464 279 L N -0.946 120.226 121.223 -0.084 0.000 2.121 279 L HA -0.019 4.321 4.340 -0.001 0.000 0.200 279 L C 1.868 178.683 176.870 -0.091 0.000 1.077 279 L CA 1.231 56.003 54.840 -0.114 0.000 0.766 279 L CB -0.784 41.196 42.059 -0.132 0.000 0.931 279 L HN 0.486 8.716 8.230 -0.000 0.000 0.452 280 C N -1.538 117.723 119.300 -0.066 0.000 2.525 280 C HA 0.029 4.488 4.460 -0.001 0.000 0.279 280 C C 2.387 177.355 174.990 -0.038 0.000 1.437 280 C CA -0.374 58.617 59.018 -0.046 0.000 1.704 280 C CB -1.745 25.976 27.740 -0.032 0.000 1.672 280 C HN 0.423 8.653 8.230 -0.000 0.000 0.582 281 K N 1.082 121.455 120.400 -0.045 0.000 2.002 281 K HA -0.021 4.299 4.320 -0.001 0.000 0.209 281 K C 2.044 178.623 176.600 -0.036 0.000 1.048 281 K CA 1.554 57.819 56.287 -0.037 0.000 0.930 281 K CB -0.240 32.236 32.500 -0.041 0.000 0.714 281 K HN 0.610 8.860 8.250 -0.000 0.000 0.438 282 L N 1.047 122.241 121.223 -0.049 0.000 2.127 282 L HA -0.147 4.192 4.340 -0.001 0.000 0.211 282 L C 0.958 177.812 176.870 -0.026 0.000 1.089 282 L CA 0.663 55.477 54.840 -0.044 0.000 0.757 282 L CB -0.401 41.617 42.059 -0.070 0.000 0.899 282 L HN 0.155 8.385 8.230 -0.000 0.000 0.434 283 L N 1.446 122.653 121.223 -0.026 0.000 2.395 283 L HA 0.146 4.486 4.340 -0.001 0.000 0.268 283 L C 0.209 177.075 176.870 -0.007 0.000 1.223 283 L CA -0.199 54.635 54.840 -0.011 0.000 1.093 283 L CB -0.214 41.840 42.059 -0.009 0.000 1.349 283 L HN 0.110 8.340 8.230 -0.000 0.000 0.427 284 R N 1.411 121.909 120.500 -0.004 0.000 2.778 284 R HA 0.809 5.148 4.340 -0.001 0.000 0.277 284 R C 0.486 176.787 176.300 0.002 0.000 0.977 284 R CA 0.482 56.581 56.100 -0.002 0.000 0.950 284 R CB 1.613 31.911 30.300 -0.005 0.000 1.165 284 R HN 0.492 8.762 8.270 -0.000 0.000 0.474 285 G N 0.977 109.778 108.800 0.002 0.000 2.536 285 G HA2 -0.264 3.696 3.960 -0.001 0.000 0.280 285 G HA3 -0.264 3.696 3.960 -0.001 0.000 0.280 285 G C -0.793 174.111 174.900 0.006 0.000 1.152 285 G CA 0.375 45.478 45.100 0.004 0.000 0.970 285 G HN 0.752 9.042 8.290 -0.000 0.000 0.549 286 T N 1.744 116.303 114.554 0.008 0.000 3.298 286 T HA 0.475 4.824 4.350 -0.001 0.000 0.318 286 T C -0.139 174.567 174.700 0.011 0.000 1.165 286 T CA -0.402 61.703 62.100 0.009 0.000 1.557 286 T CB 0.729 69.602 68.868 0.008 0.000 0.898 286 T HN 0.635 8.875 8.240 -0.000 0.000 0.585 287 K N 1.413 121.821 120.400 0.013 0.000 2.098 287 K HA 0.777 5.096 4.320 -0.001 0.000 0.257 287 K C 0.470 177.080 176.600 0.016 0.000 0.999 287 K CA -0.751 55.545 56.287 0.015 0.000 0.924 287 K CB 1.196 33.706 32.500 0.017 0.000 1.028 287 K HN 0.508 8.758 8.250 -0.000 0.000 0.466 288 A N 1.865 124.695 122.820 0.016 0.000 2.425 288 A HA 0.044 4.364 4.320 -0.001 0.000 0.249 288 A C 0.997 178.594 177.584 0.020 0.000 1.084 288 A CA -0.322 51.725 52.037 0.016 0.000 0.781 288 A CB 0.132 19.140 19.000 0.013 0.000 1.019 288 A HN 0.651 8.801 8.150 -0.000 0.000 0.490 289 L N 2.176 123.411 121.223 0.020 0.000 2.127 289 L HA -0.130 4.210 4.340 -0.001 0.000 0.211 289 L C 2.717 179.604 176.870 0.028 0.000 1.089 289 L CA 2.791 57.646 54.840 0.025 0.000 0.757 289 L CB -0.852 41.219 42.059 0.020 0.000 0.899 289 L HN 0.945 9.175 8.230 -0.000 0.000 0.434 290 T N -4.352 110.215 114.554 0.022 0.000 3.107 290 T HA 0.028 4.377 4.350 -0.001 0.000 0.249 290 T C 0.802 175.516 174.700 0.024 0.000 1.096 290 T CA -0.366 61.746 62.100 0.020 0.000 1.012 290 T CB -0.271 68.604 68.868 0.011 0.000 0.977 290 T HN 0.320 8.560 8.240 -0.000 0.000 0.527 291 E N 1.476 121.693 120.200 0.028 0.000 2.414 291 E HA 0.237 4.587 4.350 -0.001 0.000 0.263 291 E C -0.499 176.127 176.600 0.044 0.000 1.000 291 E CA -0.468 55.950 56.400 0.030 0.000 0.914 291 E CB 0.975 30.691 29.700 0.027 0.000 0.948 291 E HN 0.245 8.605 8.360 -0.000 0.000 0.444 292 V N 6.610 126.550 119.914 0.044 0.000 2.407 292 V HA 0.357 4.476 4.120 -0.001 0.000 0.278 292 V C -0.827 175.308 176.094 0.069 0.000 1.037 292 V CA -0.631 61.708 62.300 0.064 0.000 0.900 292 V CB 0.912 32.765 31.823 0.050 0.000 0.983 292 V HN 0.526 8.716 8.190 -0.000 0.000 0.459 293 I N 8.744 129.373 120.570 0.097 0.000 2.433 293 I HA 0.537 4.707 4.170 -0.001 0.000 0.292 293 I C -2.165 174.002 176.117 0.083 0.000 1.001 293 I CA -2.755 58.589 61.300 0.072 0.000 1.119 293 I CB 1.685 39.717 38.000 0.053 0.000 1.289 293 I HN 0.541 8.751 8.210 -0.000 0.000 0.438 294 P HA 0.176 4.596 4.420 -0.000 0.000 0.268 294 P C -0.807 176.510 177.300 0.028 0.000 1.205 294 P CA -0.457 62.673 63.100 0.051 0.000 0.771 294 P CB 0.431 32.149 31.700 0.029 0.000 0.858 295 L N 2.095 123.348 121.223 0.050 0.000 2.416 295 L HA 0.395 4.734 4.340 -0.001 0.000 0.272 295 L C 1.284 178.143 176.870 -0.019 0.000 1.161 295 L CA 0.272 55.108 54.840 -0.006 0.000 0.845 295 L CB -0.834 41.263 42.059 0.062 0.000 1.119 295 L HN 0.431 8.661 8.230 -0.000 0.000 0.464 296 T N -1.921 112.601 114.554 -0.053 0.000 2.918 296 T HA 0.524 4.873 4.350 -0.001 0.000 0.286 296 T C 0.855 175.531 174.700 -0.040 0.000 1.026 296 T CA -0.526 61.551 62.100 -0.038 0.000 1.031 296 T CB 1.807 70.650 68.868 -0.042 0.000 1.046 296 T HN 0.665 8.905 8.240 -0.000 0.000 0.479 297 E N 1.926 122.111 120.200 -0.025 0.000 2.019 297 E HA -0.262 4.087 4.350 -0.001 0.000 0.208 297 E C 1.655 178.236 176.600 -0.032 0.000 1.030 297 E CA 1.890 58.277 56.400 -0.022 0.000 0.856 297 E CB -0.807 28.884 29.700 -0.015 0.000 0.781 297 E HN 0.857 9.217 8.360 -0.000 0.000 0.471 298 E N 0.543 120.723 120.200 -0.033 0.000 2.209 298 E HA -0.163 4.187 4.350 -0.001 0.000 0.196 298 E C 1.980 178.549 176.600 -0.052 0.000 0.993 298 E CA 0.902 57.280 56.400 -0.036 0.000 0.819 298 E CB -0.201 29.480 29.700 -0.032 0.000 0.745 298 E HN 0.406 8.766 8.360 -0.000 0.000 0.477 299 A N 1.590 124.370 122.820 -0.068 0.000 1.840 299 A HA -0.201 4.118 4.320 -0.001 0.000 0.214 299 A C 1.909 179.429 177.584 -0.107 0.000 1.198 299 A CA 1.200 53.176 52.037 -0.102 0.000 0.608 299 A CB -0.407 18.513 19.000 -0.133 0.000 0.839 299 A HN 0.124 8.274 8.150 -0.000 0.000 0.443 300 E N -0.202 119.943 120.200 -0.091 0.000 2.219 300 E HA -0.184 4.165 4.350 -0.001 0.000 0.198 300 E C 1.883 178.457 176.600 -0.043 0.000 0.998 300 E CA 0.990 57.351 56.400 -0.065 0.000 0.818 300 E CB -0.214 29.469 29.700 -0.028 0.000 0.741 300 E HN 0.553 8.913 8.360 -0.000 0.000 0.477 301 L N 1.061 122.260 121.223 -0.040 0.000 2.095 301 L HA -0.104 4.236 4.340 -0.001 0.000 0.204 301 L C 2.139 178.987 176.870 -0.036 0.000 1.080 301 L CA 1.783 56.605 54.840 -0.030 0.000 0.759 301 L CB -0.457 41.587 42.059 -0.025 0.000 0.914 301 L HN 0.114 8.344 8.230 -0.000 0.000 0.439 302 E N -0.243 119.926 120.200 -0.050 0.000 2.153 302 E HA -0.262 4.088 4.350 -0.001 0.000 0.194 302 E C 2.230 178.794 176.600 -0.060 0.000 0.988 302 E CA 1.082 57.450 56.400 -0.054 0.000 0.811 302 E CB 0.052 29.712 29.700 -0.066 0.000 0.746 302 E HN 0.418 8.778 8.360 -0.000 0.000 0.466 303 L N 0.403 121.583 121.223 -0.071 0.000 2.072 303 L HA -0.008 4.332 4.340 -0.001 0.000 0.205 303 L C 2.189 179.039 176.870 -0.034 0.000 1.079 303 L CA 1.899 56.699 54.840 -0.068 0.000 0.752 303 L CB -0.583 41.422 42.059 -0.090 0.000 0.906 303 L HN 0.139 8.369 8.230 -0.000 0.000 0.436 304 A N -0.775 122.031 122.820 -0.023 0.000 1.855 304 A HA -0.209 4.110 4.320 -0.001 0.000 0.215 304 A C 2.147 179.721 177.584 -0.016 0.000 1.191 304 A CA 1.719 53.750 52.037 -0.010 0.000 0.613 304 A CB -0.677 18.320 19.000 -0.004 0.000 0.829 304 A HN 0.543 8.693 8.150 -0.000 0.000 0.442 305 E N -0.092 120.096 120.200 -0.020 0.000 2.160 305 E HA -0.184 4.166 4.350 -0.001 0.000 0.195 305 E C 1.632 178.217 176.600 -0.026 0.000 0.991 305 E CA 1.015 57.404 56.400 -0.019 0.000 0.810 305 E CB -0.223 29.465 29.700 -0.019 0.000 0.742 305 E HN 0.524 8.884 8.360 -0.000 0.000 0.466 306 N N 0.738 119.416 118.700 -0.037 0.000 2.270 306 N HA -0.081 4.659 4.740 -0.001 0.000 0.181 306 N C 1.703 177.175 175.510 -0.063 0.000 1.016 306 N CA 0.688 53.707 53.050 -0.052 0.000 0.870 306 N CB -0.037 38.413 38.487 -0.062 0.000 0.979 306 N HN 0.167 8.547 8.380 -0.000 0.000 0.431 307 R N 1.122 121.596 120.500 -0.044 0.000 2.081 307 R HA -0.093 4.246 4.340 -0.001 0.000 0.235 307 R C 2.013 178.292 176.300 -0.035 0.000 1.131 307 R CA 0.898 56.975 56.100 -0.038 0.000 0.960 307 R CB -0.245 30.048 30.300 -0.013 0.000 0.856 307 R HN 0.401 8.671 8.270 -0.000 0.000 0.436 308 E N 1.270 121.457 120.200 -0.022 0.000 2.097 308 E HA -0.239 4.110 4.350 -0.001 0.000 0.196 308 E C 1.861 178.455 176.600 -0.011 0.000 1.000 308 E CA 1.530 57.923 56.400 -0.010 0.000 0.804 308 E CB -0.063 29.634 29.700 -0.005 0.000 0.740 308 E HN 0.354 8.714 8.360 -0.000 0.000 0.454 309 I N 0.548 121.103 120.570 -0.024 0.000 2.286 309 I HA -0.223 3.946 4.170 -0.001 0.000 0.245 309 I C 2.226 178.309 176.117 -0.057 0.000 1.104 309 I CA 0.341 61.638 61.300 -0.006 0.000 1.397 309 I CB -0.201 37.798 38.000 -0.002 0.000 1.072 309 I HN 0.186 8.396 8.210 -0.000 0.000 0.417 310 L N 1.181 122.292 121.223 -0.187 0.000 2.362 310 L HA -0.135 4.204 4.340 -0.001 0.000 0.219 310 L C 2.372 179.168 176.870 -0.123 0.000 1.134 310 L CA 1.527 56.149 54.840 -0.364 0.000 0.807 310 L CB -1.313 40.546 42.059 -0.333 0.000 0.927 310 L HN 0.315 8.545 8.230 -0.000 0.000 0.447 311 K N -0.376 120.002 120.400 -0.036 0.000 2.097 311 K HA -0.098 4.221 4.320 -0.001 0.000 0.205 311 K C 0.679 177.317 176.600 0.064 0.000 1.050 311 K CA 0.838 57.135 56.287 0.017 0.000 0.938 311 K CB 0.413 32.922 32.500 0.015 0.000 0.718 311 K HN 0.226 8.476 8.250 -0.000 0.000 0.442 312 E N 0.698 120.953 120.200 0.091 0.000 2.302 312 E HA 0.270 4.619 4.350 -0.001 0.000 0.255 312 E C -2.327 174.379 176.600 0.176 0.000 1.099 312 E CA -2.237 54.230 56.400 0.112 0.000 0.929 312 E CB 0.303 30.053 29.700 0.083 0.000 1.203 312 E HN 0.071 8.431 8.360 -0.000 0.000 0.459 313 P HA 0.053 4.473 4.420 -0.000 0.000 0.272 313 P C -0.587 176.762 177.300 0.080 0.000 1.230 313 P CA -0.257 62.903 63.100 0.099 0.000 0.788 313 P CB 0.400 32.132 31.700 0.053 0.000 0.949 314 V N 2.784 122.672 119.914 -0.044 0.000 2.421 314 V HA -0.027 4.093 4.120 -0.001 0.000 0.271 314 V C 0.730 176.778 176.094 -0.078 0.000 1.031 314 V CA -0.017 62.163 62.300 -0.200 0.000 1.032 314 V CB -1.004 30.568 31.823 -0.417 0.000 1.009 314 V HN 0.537 8.727 8.190 -0.000 0.000 0.477 315 H N 4.286 123.291 119.070 -0.107 0.000 3.091 315 H HA 0.395 4.950 4.556 -0.001 0.000 0.289 315 H C 1.069 176.334 175.328 -0.105 0.000 0.995 315 H CA 0.661 56.664 56.048 -0.074 0.000 1.461 315 H CB 0.304 30.060 29.762 -0.010 0.000 1.510 315 H HN 0.919 9.199 8.280 -0.000 0.000 0.546 316 G N 3.363 112.073 108.800 -0.150 0.000 2.192 316 G HA2 -0.189 3.770 3.960 -0.001 0.000 0.193 316 G HA3 -0.189 3.770 3.960 -0.001 0.000 0.193 316 G C -0.515 174.269 174.900 -0.193 0.000 0.999 316 G CA 0.036 45.018 45.100 -0.197 0.000 0.659 316 G HN 0.656 8.946 8.290 -0.000 0.000 0.503 317 V N 1.305 120.989 119.914 -0.383 0.000 2.394 317 V HA 0.757 4.876 4.120 -0.001 0.000 0.282 317 V C -0.288 175.450 176.094 -0.594 0.000 1.031 317 V CA -0.671 61.439 62.300 -0.316 0.000 0.881 317 V CB 0.901 32.600 31.823 -0.208 0.000 0.982 317 V HN 0.260 8.450 8.190 -0.000 0.000 0.451 318 Y N 2.425 122.747 120.300 0.038 0.000 2.545 318 Y HA 0.487 5.037 4.550 -0.001 0.000 0.348 318 Y C -0.346 175.604 175.900 0.084 0.000 1.002 318 Y CA -1.079 57.070 58.100 0.082 0.000 1.039 318 Y CB 1.680 40.174 38.460 0.057 0.000 1.271 318 Y HN 0.624 8.904 8.280 -0.000 0.000 0.467 319 Y N 2.470 122.880 120.300 0.184 0.000 2.442 319 Y HA 0.188 4.737 4.550 -0.001 0.000 0.330 319 Y C -0.344 175.584 175.900 0.045 0.000 1.129 319 Y CA -0.402 57.723 58.100 0.041 0.000 1.365 319 Y CB 0.479 39.009 38.460 0.116 0.000 1.233 319 Y HN 0.539 8.819 8.280 -0.000 0.000 0.529 320 D N 8.241 128.206 120.400 -0.725 0.000 2.414 320 D HA 0.309 4.949 4.640 -0.001 0.000 0.232 320 D C -2.285 173.416 176.300 -0.998 0.000 1.070 320 D CA -2.639 50.989 54.000 -0.620 0.000 0.839 320 D CB 1.986 42.597 40.800 -0.315 0.000 1.079 320 D HN 0.318 8.688 8.370 -0.000 0.000 0.521 321 P HA -0.079 4.341 4.420 -0.000 0.000 0.226 321 P C 0.862 178.024 177.300 -0.232 0.000 1.146 321 P CA 0.847 63.666 63.100 -0.468 0.000 0.773 321 P CB 0.239 31.897 31.700 -0.071 0.000 0.772 322 S N -3.096 112.459 115.700 -0.241 0.000 2.540 322 S HA 0.197 4.666 4.470 -0.001 0.000 0.218 322 S C 0.653 175.174 174.600 -0.133 0.000 0.977 322 S CA -0.254 57.863 58.200 -0.139 0.000 0.918 322 S CB -0.217 62.915 63.200 -0.113 0.000 0.806 322 S HN 0.009 8.319 8.310 -0.000 0.000 0.496 323 K N 1.720 122.006 120.400 -0.189 0.000 2.156 323 K HA 0.398 4.717 4.320 -0.001 0.000 0.254 323 K C -1.117 175.411 176.600 -0.120 0.000 0.950 323 K CA -0.851 55.350 56.287 -0.144 0.000 0.849 323 K CB 0.797 33.202 32.500 -0.158 0.000 1.100 323 K HN 0.141 8.391 8.250 -0.000 0.000 0.434 324 D N 1.810 122.157 120.400 -0.089 0.000 2.423 324 D HA 0.029 4.669 4.640 -0.001 0.000 0.238 324 D C -0.023 176.185 176.300 -0.153 0.000 1.142 324 D CA 0.325 54.272 54.000 -0.088 0.000 0.884 324 D CB 0.670 41.426 40.800 -0.073 0.000 1.199 324 D HN 0.202 8.572 8.370 -0.000 0.000 0.438 325 L N 2.479 123.588 121.223 -0.189 0.000 2.312 325 L HA 0.283 4.622 4.340 -0.001 0.000 0.281 325 L C 0.069 176.705 176.870 -0.390 0.000 1.070 325 L CA -0.646 53.998 54.840 -0.327 0.000 0.805 325 L CB 0.894 42.726 42.059 -0.380 0.000 1.174 325 L HN 0.115 8.345 8.230 -0.000 0.000 0.434 326 I N 2.580 122.817 120.570 -0.554 0.000 2.493 326 I HA 0.587 4.756 4.170 -0.001 0.000 0.298 326 I C 0.114 175.756 176.117 -0.792 0.000 0.998 326 I CA -0.598 60.286 61.300 -0.693 0.000 1.137 326 I CB 1.713 39.139 38.000 -0.957 0.000 1.310 326 I HN 0.576 8.786 8.210 -0.000 0.000 0.445 327 A N 5.784 128.202 122.820 -0.670 0.000 2.353 327 A HA 0.639 4.958 4.320 -0.001 0.000 0.299 327 A C -0.471 176.981 177.584 -0.221 0.000 1.089 327 A CA -0.638 51.083 52.037 -0.527 0.000 0.736 327 A CB 1.099 19.543 19.000 -0.927 0.000 1.195 327 A HN 0.725 8.875 8.150 -0.000 0.000 0.447 328 E N 1.856 122.074 120.200 0.030 0.000 2.204 328 E HA 0.589 4.938 4.350 -0.001 0.000 0.276 328 E C -0.990 175.726 176.600 0.194 0.000 0.974 328 E CA -0.424 56.070 56.400 0.157 0.000 0.815 328 E CB 2.046 31.908 29.700 0.271 0.000 1.119 328 E HN 0.622 8.982 8.360 -0.000 0.000 0.393 329 I N 2.063 122.758 120.570 0.208 0.000 2.569 329 I HA 0.229 4.398 4.170 -0.001 0.000 0.296 329 I C -0.694 175.576 176.117 0.255 0.000 1.028 329 I CA -0.925 60.537 61.300 0.270 0.000 1.082 329 I CB 1.856 40.024 38.000 0.281 0.000 1.264 329 I HN 0.307 8.517 8.210 -0.000 0.000 0.429 330 Q N 4.229 124.184 119.800 0.259 0.000 2.340 330 Q HA 0.365 4.705 4.340 -0.001 0.000 0.268 330 Q C -0.732 175.334 176.000 0.109 0.000 1.031 330 Q CA -0.789 55.113 55.803 0.164 0.000 0.804 330 Q CB 2.393 31.185 28.738 0.091 0.000 1.286 330 Q HN 0.323 8.593 8.270 -0.000 0.000 0.448 331 K N 2.027 122.387 120.400 -0.067 0.000 2.378 331 K HA 0.033 4.353 4.320 -0.001 0.000 0.288 331 K C 0.101 176.443 176.600 -0.430 0.000 1.057 331 K CA 0.115 56.048 56.287 -0.589 0.000 0.971 331 K CB 0.608 32.778 32.500 -0.550 0.000 0.975 331 K HN 0.568 8.818 8.250 -0.000 0.000 0.475 332 Q N 2.369 121.871 119.800 -0.495 0.000 2.384 332 Q HA 0.128 4.468 4.340 -0.001 0.000 0.207 332 Q C 0.479 176.313 176.000 -0.277 0.000 0.904 332 Q CA 0.588 56.223 55.803 -0.281 0.000 0.933 332 Q CB 0.916 29.550 28.738 -0.173 0.000 1.077 332 Q HN 1.006 9.276 8.270 -0.000 0.000 0.522 333 G N 1.241 109.807 108.800 -0.391 0.000 2.690 333 G HA2 -0.179 3.781 3.960 -0.001 0.000 0.686 333 G HA3 -0.179 3.781 3.960 -0.001 0.000 0.686 333 G C -0.595 174.188 174.900 -0.196 0.000 1.277 333 G CA -0.370 44.574 45.100 -0.260 0.000 0.799 333 G HN 0.119 8.409 8.290 -0.000 0.000 0.613 334 Q N -1.831 117.897 119.800 -0.121 0.000 2.481 334 Q HA -0.081 4.258 4.340 -0.001 0.000 0.272 334 Q C 2.105 178.084 176.000 -0.035 0.000 1.157 334 Q CA 3.117 58.882 55.803 -0.064 0.000 0.935 334 Q CB -1.831 26.872 28.738 -0.058 0.000 1.338 334 Q HN 2.874 11.144 8.270 -0.000 0.000 0.494 335 G N -1.228 107.561 108.800 -0.018 0.000 2.143 335 G HA2 -0.337 3.623 3.960 -0.001 0.000 0.248 335 G HA3 -0.337 3.623 3.960 -0.001 0.000 0.248 335 G C -0.145 174.848 174.900 0.154 0.000 0.991 335 G CA 0.468 45.650 45.100 0.136 0.000 0.689 335 G HN 0.468 8.758 8.290 -0.000 0.000 0.522 336 Q N -1.226 118.530 119.800 -0.072 0.000 2.293 336 Q HA 0.676 5.015 4.340 -0.001 0.000 0.261 336 Q C -0.852 175.026 176.000 -0.203 0.000 0.960 336 Q CA -0.725 55.073 55.803 -0.008 0.000 0.882 336 Q CB 1.377 30.089 28.738 -0.043 0.000 1.275 336 Q HN 0.378 8.648 8.270 -0.000 0.000 0.445 337 W N 1.080 122.477 121.300 0.161 0.000 2.883 337 W HA 0.473 5.133 4.660 -0.001 0.000 0.335 337 W C -0.396 176.237 176.519 0.191 0.000 1.083 337 W CA -0.644 56.813 57.345 0.187 0.000 1.233 337 W CB 1.926 31.537 29.460 0.252 0.000 1.412 337 W HN 0.561 8.741 8.180 -0.000 0.000 0.490 338 T N -0.165 114.583 114.554 0.323 0.000 2.945 338 T HA 0.835 5.184 4.350 -0.001 0.000 0.286 338 T C -1.122 173.716 174.700 0.230 0.000 1.025 338 T CA -0.625 61.583 62.100 0.181 0.000 1.039 338 T CB 1.784 70.700 68.868 0.080 0.000 1.068 338 T HN 0.481 8.721 8.240 -0.000 0.000 0.497 339 Y N -0.872 119.446 120.300 0.030 0.000 2.609 339 Y HA 0.776 5.325 4.550 -0.001 0.000 0.336 339 Y C -1.590 174.259 175.900 -0.086 0.000 1.129 339 Y CA -1.414 56.685 58.100 -0.002 0.000 1.040 339 Y CB 1.321 39.827 38.460 0.076 0.000 1.310 339 Y HN 0.659 8.939 8.280 -0.000 0.000 0.460 340 Q N 2.427 122.324 119.800 0.163 0.000 2.389 340 Q HA 0.719 5.058 4.340 -0.001 0.000 0.277 340 Q C -1.546 174.592 176.000 0.229 0.000 1.082 340 Q CA -0.619 55.257 55.803 0.122 0.000 0.810 340 Q CB 3.384 32.125 28.738 0.004 0.000 1.374 340 Q HN 0.763 9.033 8.270 -0.000 0.000 0.422 341 I N 2.927 123.618 120.570 0.202 0.000 2.406 341 I HA 0.567 4.736 4.170 -0.001 0.000 0.290 341 I C -1.224 174.920 176.117 0.044 0.000 0.999 341 I CA -1.026 60.278 61.300 0.006 0.000 1.124 341 I CB 0.869 38.880 38.000 0.018 0.000 1.289 341 I HN 0.658 8.868 8.210 -0.000 0.000 0.441 342 Y N 2.708 122.941 120.300 -0.110 0.000 2.625 342 Y HA 0.503 5.052 4.550 -0.001 0.000 0.338 342 Y C -0.074 175.746 175.900 -0.133 0.000 1.123 342 Y CA -0.931 57.111 58.100 -0.097 0.000 1.046 342 Y CB 1.152 39.605 38.460 -0.012 0.000 1.299 342 Y HN 0.418 8.698 8.280 -0.000 0.000 0.464 343 Q N 0.116 119.932 119.800 0.027 0.000 2.387 343 Q HA 0.223 4.563 4.340 -0.001 0.000 0.208 343 Q C -0.518 175.549 176.000 0.113 0.000 0.935 343 Q CA 0.451 56.231 55.803 -0.038 0.000 0.891 343 Q CB 0.680 29.356 28.738 -0.103 0.000 1.007 343 Q HN 0.648 8.918 8.270 -0.000 0.000 0.548 344 E N 1.563 121.853 120.200 0.151 0.000 2.166 344 E HA 0.290 4.639 4.350 -0.001 0.000 0.275 344 E C -2.565 174.117 176.600 0.137 0.000 0.941 344 E CA -2.291 54.187 56.400 0.130 0.000 0.784 344 E CB 1.598 31.309 29.700 0.019 0.000 1.115 344 E HN -0.036 8.324 8.360 -0.000 0.000 0.399 345 P HA -0.100 4.320 4.420 -0.000 0.000 0.260 345 P C -0.328 176.987 177.300 0.024 0.000 1.172 345 P CA 0.583 63.560 63.100 -0.204 0.000 0.760 345 P CB 0.058 31.712 31.700 -0.077 0.000 0.773 346 F N 0.378 120.018 119.950 -0.516 0.000 2.427 346 F HA -0.236 4.290 4.527 -0.001 0.000 0.567 346 F C 0.762 176.401 175.800 -0.269 0.000 0.511 346 F CA 0.938 58.716 58.000 -0.370 0.000 1.311 346 F CB -1.810 36.935 39.000 -0.426 0.000 2.049 346 F HN 0.328 8.628 8.300 -0.000 0.000 0.259 347 K N 2.236 122.629 120.400 -0.011 0.000 2.083 347 K HA 0.181 4.500 4.320 -0.001 0.000 0.246 347 K C -0.194 176.412 176.600 0.009 0.000 1.160 347 K CA 0.004 56.263 56.287 -0.047 0.000 1.060 347 K CB -0.604 31.874 32.500 -0.036 0.000 1.417 347 K HN 0.352 8.602 8.250 -0.000 0.000 0.329 348 N N 2.660 121.348 118.700 -0.020 0.000 2.431 348 N HA -0.046 4.693 4.740 -0.001 0.000 0.265 348 N C 0.666 176.210 175.510 0.058 0.000 1.184 348 N CA -0.499 52.592 53.050 0.069 0.000 0.943 348 N CB 0.553 39.087 38.487 0.077 0.000 1.080 348 N HN 0.196 8.576 8.380 -0.000 0.000 0.477 349 L N 2.420 123.707 121.223 0.106 0.000 2.109 349 L HA 0.112 4.451 4.340 -0.001 0.000 0.207 349 L C 0.795 177.814 176.870 0.249 0.000 1.086 349 L CA 1.670 56.600 54.840 0.150 0.000 0.760 349 L CB -0.740 41.370 42.059 0.086 0.000 0.910 349 L HN 0.577 8.807 8.230 -0.000 0.000 0.437 350 K N -2.233 118.314 120.400 0.245 0.000 2.575 350 K HA 0.384 4.703 4.320 -0.001 0.000 0.279 350 K C -1.281 175.415 176.600 0.160 0.000 0.969 350 K CA -0.471 55.959 56.287 0.239 0.000 0.868 350 K CB 1.939 34.648 32.500 0.348 0.000 1.457 350 K HN -0.190 8.060 8.250 -0.000 0.000 0.426 351 T N 0.385 114.973 114.554 0.057 0.000 2.933 351 T HA 0.787 5.137 4.350 -0.001 0.000 0.305 351 T C -1.091 173.395 174.700 -0.356 0.000 1.092 351 T CA -0.092 61.930 62.100 -0.129 0.000 1.008 351 T CB 1.470 70.333 68.868 -0.007 0.000 1.102 351 T HN 0.799 9.039 8.240 -0.000 0.000 0.469 352 G N 2.473 110.709 108.800 -0.939 0.000 2.645 352 G HA2 0.731 4.690 3.960 -0.001 0.000 0.292 352 G HA3 0.731 4.690 3.960 -0.001 0.000 0.292 352 G C -1.788 172.628 174.900 -0.806 0.000 1.415 352 G CA -0.990 43.524 45.100 -0.975 0.000 0.785 352 G HN 0.903 9.193 8.290 -0.000 0.000 0.483 353 K N -1.679 118.595 120.400 -0.210 0.000 2.433 353 K HA 0.793 5.112 4.320 -0.001 0.000 0.252 353 K C -2.042 174.781 176.600 0.372 0.000 1.015 353 K CA -1.130 55.223 56.287 0.109 0.000 0.860 353 K CB 2.783 35.328 32.500 0.076 0.000 1.359 353 K HN 0.676 8.926 8.250 -0.000 0.000 0.452 354 Y N 0.016 120.486 120.300 0.283 0.000 2.479 354 Y HA 0.604 5.153 4.550 -0.001 0.000 0.338 354 Y C -2.104 173.954 175.900 0.264 0.000 1.055 354 Y CA -0.455 57.794 58.100 0.249 0.000 1.023 354 Y CB 2.311 40.906 38.460 0.226 0.000 1.287 354 Y HN 0.962 9.242 8.280 -0.000 0.000 0.447 355 A N 6.564 129.049 122.820 -0.559 0.000 2.393 355 A HA 0.844 5.163 4.320 -0.001 0.000 0.306 355 A C -0.398 176.932 177.584 -0.423 0.000 1.050 355 A CA -0.439 51.423 52.037 -0.292 0.000 0.724 355 A CB 1.449 20.380 19.000 -0.114 0.000 1.248 355 A HN 1.149 9.299 8.150 -0.000 0.000 0.424 363 N N 1.515 120.195 118.700 -0.034 0.000 2.443 363 N HA 0.384 5.124 4.740 -0.001 0.000 0.269 363 N C -0.355 175.143 175.510 -0.021 0.000 0.985 363 N CA -0.213 52.789 53.050 -0.080 0.000 0.921 363 N CB 1.770 40.132 38.487 -0.208 0.000 1.195 363 N HN 0.410 8.790 8.380 -0.000 0.000 0.492 364 D N 2.009 122.447 120.400 0.064 0.000 2.123 364 D HA -0.156 4.483 4.640 -0.001 0.000 0.196 364 D C 1.801 178.187 176.300 0.145 0.000 0.992 364 D CA 1.479 55.620 54.000 0.235 0.000 0.833 364 D CB 0.307 41.251 40.800 0.240 0.000 0.954 364 D HN 0.511 8.881 8.370 -0.000 0.000 0.455 365 V N -0.827 119.107 119.914 0.034 0.000 3.052 365 V HA 0.034 4.153 4.120 -0.001 0.000 0.254 365 V C 1.997 178.023 176.094 -0.114 0.000 1.100 365 V CA 1.225 63.566 62.300 0.068 0.000 1.112 365 V CB -0.217 31.706 31.823 0.167 0.000 0.738 365 V HN 0.004 8.194 8.190 -0.000 0.000 0.469 366 K N 0.090 120.238 120.400 -0.420 0.000 2.057 366 K HA -0.212 4.108 4.320 -0.001 0.000 0.207 366 K C 2.279 178.667 176.600 -0.353 0.000 1.049 366 K CA 2.117 57.935 56.287 -0.781 0.000 0.931 366 K CB -0.224 31.673 32.500 -1.005 0.000 0.714 366 K HN 0.631 8.881 8.250 -0.000 0.000 0.440 367 Q N 0.685 120.337 119.800 -0.248 0.000 2.046 367 Q HA -0.118 4.221 4.340 -0.001 0.000 0.200 367 Q C 2.231 177.855 176.000 -0.627 0.000 0.975 367 Q CA 1.427 57.076 55.803 -0.257 0.000 0.836 367 Q CB -0.112 28.622 28.738 -0.007 0.000 0.896 367 Q HN 0.344 8.614 8.270 -0.000 0.000 0.428 368 L N 0.285 121.075 121.223 -0.721 0.000 2.013 368 L HA -0.268 4.072 4.340 -0.001 0.000 0.212 368 L C 2.179 178.890 176.870 -0.265 0.000 1.073 368 L CA 1.601 56.027 54.840 -0.691 0.000 0.753 368 L CB -0.475 41.414 42.059 -0.283 0.000 0.890 368 L HN 0.343 8.573 8.230 -0.000 0.000 0.432 369 T N -0.607 113.962 114.554 0.025 0.000 2.746 369 T HA -0.207 4.143 4.350 -0.001 0.000 0.267 369 T C 1.628 176.291 174.700 -0.062 0.000 1.039 369 T CA 1.538 63.769 62.100 0.218 0.000 1.142 369 T CB -0.123 68.912 68.868 0.279 0.000 0.866 369 T HN 0.446 8.686 8.240 -0.000 0.000 0.444 370 E N 0.870 120.921 120.200 -0.247 0.000 2.077 370 E HA -0.075 4.275 4.350 -0.001 0.000 0.193 370 E C 2.577 178.828 176.600 -0.582 0.000 0.989 370 E CA 0.998 57.182 56.400 -0.360 0.000 0.800 370 E CB -0.202 29.306 29.700 -0.320 0.000 0.746 370 E HN 0.474 8.834 8.360 -0.000 0.000 0.452 371 A N 1.087 123.408 122.820 -0.832 0.000 1.877 371 A HA -0.150 4.170 4.320 -0.001 0.000 0.216 371 A C 2.539 179.876 177.584 -0.412 0.000 1.186 371 A CA 1.243 52.785 52.037 -0.826 0.000 0.620 371 A CB -0.744 17.814 19.000 -0.736 0.000 0.822 371 A HN 0.112 8.262 8.150 -0.000 0.000 0.443 372 V N -0.120 119.594 119.914 -0.333 0.000 2.332 372 V HA -0.351 3.768 4.120 -0.001 0.000 0.248 372 V C 2.665 178.680 176.094 -0.132 0.000 1.055 372 V CA 2.392 64.472 62.300 -0.367 0.000 1.038 372 V CB -0.964 30.623 31.823 -0.393 0.000 0.651 372 V HN 0.645 8.835 8.190 -0.000 0.000 0.450 373 Q N -0.364 119.369 119.800 -0.112 0.000 2.084 373 Q HA -0.235 4.104 4.340 -0.001 0.000 0.202 373 Q C 2.428 178.487 176.000 0.098 0.000 0.978 373 Q CA 1.811 57.627 55.803 0.021 0.000 0.844 373 Q CB -0.228 28.345 28.738 -0.276 0.000 0.898 373 Q HN 0.603 8.873 8.270 -0.000 0.000 0.426 374 K N 0.880 121.247 120.400 -0.057 0.000 2.026 374 K HA -0.178 4.141 4.320 -0.001 0.000 0.208 374 K C 1.911 178.458 176.600 -0.089 0.000 1.048 374 K CA 1.319 57.587 56.287 -0.032 0.000 0.929 374 K CB -0.117 32.340 32.500 -0.071 0.000 0.713 374 K HN 0.159 8.409 8.250 -0.000 0.000 0.439 375 I N 0.885 121.362 120.570 -0.154 0.000 2.252 375 I HA -0.239 3.930 4.170 -0.001 0.000 0.245 375 I C 2.183 178.287 176.117 -0.021 0.000 1.102 375 I CA 1.332 62.504 61.300 -0.214 0.000 1.385 375 I CB -0.334 37.528 38.000 -0.231 0.000 1.064 375 I HN 0.250 8.460 8.210 -0.000 0.000 0.414 376 T N -0.105 114.530 114.554 0.136 0.000 2.720 376 T HA -0.190 4.160 4.350 -0.001 0.000 0.268 376 T C 1.920 176.541 174.700 -0.132 0.000 1.037 376 T CA 2.095 64.194 62.100 -0.002 0.000 1.144 376 T CB -0.361 68.390 68.868 -0.195 0.000 0.864 376 T HN 0.353 8.593 8.240 -0.000 0.000 0.444 377 T N 1.896 116.475 114.554 0.041 0.000 2.777 377 T HA -0.072 4.277 4.350 -0.001 0.000 0.266 377 T C 1.975 176.699 174.700 0.040 0.000 1.040 377 T CA 1.130 63.328 62.100 0.163 0.000 1.141 377 T CB -0.236 68.851 68.868 0.366 0.000 0.868 377 T HN 0.543 8.783 8.240 -0.000 0.000 0.444 378 E N 0.807 120.938 120.200 -0.116 0.000 2.077 378 E HA -0.103 4.246 4.350 -0.001 0.000 0.193 378 E C 2.453 178.941 176.600 -0.186 0.000 0.989 378 E CA 1.106 57.334 56.400 -0.288 0.000 0.800 378 E CB -0.183 29.105 29.700 -0.686 0.000 0.746 378 E HN 0.324 8.684 8.360 -0.000 0.000 0.452 379 S N 0.757 116.379 115.700 -0.131 0.000 2.368 379 S HA -0.137 4.332 4.470 -0.001 0.000 0.225 379 S C 2.027 176.537 174.600 -0.151 0.000 1.030 379 S CA 0.791 58.988 58.200 -0.007 0.000 0.999 379 S CB -0.206 63.047 63.200 0.088 0.000 0.844 379 S HN 0.179 8.489 8.310 -0.000 0.000 0.459 380 I N 1.082 121.486 120.570 -0.277 0.000 2.264 380 I HA -0.144 4.026 4.170 -0.001 0.000 0.248 380 I C 2.163 178.077 176.117 -0.338 0.000 1.111 380 I CA 1.040 62.067 61.300 -0.455 0.000 1.382 380 I CB -0.291 37.339 38.000 -0.617 0.000 1.060 380 I HN 0.227 8.437 8.210 -0.000 0.000 0.418 381 V N 0.675 120.447 119.914 -0.237 0.000 2.591 381 V HA -0.167 3.952 4.120 -0.001 0.000 0.249 381 V C 2.110 178.128 176.094 -0.126 0.000 1.053 381 V CA 1.456 63.666 62.300 -0.149 0.000 1.068 381 V CB -0.129 31.713 31.823 0.031 0.000 0.689 381 V HN 0.323 8.513 8.190 -0.000 0.000 0.462 382 I N -1.753 118.599 120.570 -0.364 0.000 2.339 382 I HA -0.088 4.081 4.170 -0.001 0.000 0.245 382 I C 2.053 177.627 176.117 -0.905 0.000 1.096 382 I CA 1.339 62.217 61.300 -0.704 0.000 1.408 382 I CB -0.141 37.055 38.000 -1.339 0.000 1.092 382 I HN 0.369 8.579 8.210 -0.000 0.000 0.423 383 W N 0.203 121.126 121.300 -0.628 0.000 2.865 383 W HA 0.377 5.037 4.660 -0.001 0.000 0.300 383 W C 1.287 177.121 176.519 -1.142 0.000 1.096 383 W CA 0.590 57.356 57.345 -0.965 0.000 1.524 383 W CB -0.228 28.654 29.460 -0.963 0.000 0.991 383 W HN 0.264 8.444 8.180 -0.000 0.000 0.571 384 G N 2.847 111.169 108.800 -0.797 0.000 2.198 384 G HA2 -0.282 3.678 3.960 -0.001 0.000 0.257 384 G HA3 -0.282 3.678 3.960 -0.001 0.000 0.257 384 G C 0.078 174.907 174.900 -0.119 0.000 1.042 384 G CA 0.896 45.756 45.100 -0.399 0.000 0.791 384 G HN 0.335 8.625 8.290 -0.000 0.000 0.502 385 K N -1.710 118.588 120.400 -0.170 0.000 2.579 385 K HA 0.689 5.008 4.320 -0.001 0.000 0.284 385 K C -0.776 175.749 176.600 -0.126 0.000 0.990 385 K CA -0.915 55.342 56.287 -0.050 0.000 0.880 385 K CB 0.887 33.451 32.500 0.108 0.000 1.488 385 K HN 0.044 8.294 8.250 -0.000 0.000 0.425 386 T N 3.094 117.612 114.554 -0.061 0.000 2.845 386 T HA 0.390 4.740 4.350 -0.001 0.000 0.288 386 T C -2.339 172.317 174.700 -0.073 0.000 0.980 386 T CA -1.191 60.853 62.100 -0.093 0.000 1.071 386 T CB 1.102 69.944 68.868 -0.045 0.000 0.941 386 T HN 0.435 8.675 8.240 -0.000 0.000 0.487 387 P HA 0.328 4.748 4.420 -0.000 0.000 0.279 387 P C -0.789 176.364 177.300 -0.245 0.000 1.252 387 P CA -0.811 62.101 63.100 -0.313 0.000 0.811 387 P CB 0.806 32.158 31.700 -0.580 0.000 1.035 388 K N 1.537 121.793 120.400 -0.239 0.000 2.258 388 K HA 0.359 4.678 4.320 -0.001 0.000 0.284 388 K C -1.240 175.246 176.600 -0.192 0.000 1.051 388 K CA -0.107 56.114 56.287 -0.110 0.000 0.923 388 K CB -0.191 32.253 32.500 -0.095 0.000 1.046 388 K HN 0.149 8.399 8.250 -0.000 0.000 0.474 389 F N 2.977 122.881 119.950 -0.076 0.000 2.399 389 F HA 0.359 4.885 4.527 -0.001 0.000 0.334 389 F C 0.333 176.049 175.800 -0.140 0.000 1.097 389 F CA -0.460 57.481 58.000 -0.098 0.000 1.076 389 F CB 1.605 40.557 39.000 -0.079 0.000 1.162 389 F HN 0.371 8.671 8.300 -0.000 0.000 0.495 390 K N 4.283 124.707 120.400 0.040 0.000 2.299 390 K HA 0.428 4.748 4.320 -0.001 0.000 0.268 390 K C -1.030 175.560 176.600 -0.017 0.000 1.075 390 K CA -0.163 56.123 56.287 -0.002 0.000 0.936 390 K CB 0.666 33.202 32.500 0.060 0.000 1.228 390 K HN 0.491 8.741 8.250 -0.000 0.000 0.454 391 L N 5.669 126.790 121.223 -0.170 0.000 2.264 391 L HA 0.309 4.648 4.340 -0.001 0.000 0.289 391 L C -1.828 175.031 176.870 -0.019 0.000 1.044 391 L CA -2.074 52.635 54.840 -0.220 0.000 0.807 391 L CB 1.172 42.836 42.059 -0.657 0.000 1.192 391 L HN 0.376 8.606 8.230 -0.000 0.000 0.425 392 P HA 0.209 4.629 4.420 -0.000 0.000 0.230 392 P C -0.529 176.867 177.300 0.160 0.000 1.791 392 P CA 0.436 63.617 63.100 0.135 0.000 1.020 392 P CB 0.378 32.184 31.700 0.178 0.000 1.977 393 I N -0.584 120.085 120.570 0.164 0.000 2.947 393 I HA 0.204 4.373 4.170 -0.001 0.000 0.301 393 I C -1.118 175.068 176.117 0.115 0.000 1.453 393 I CA -1.220 60.182 61.300 0.170 0.000 0.984 393 I CB 2.946 41.079 38.000 0.221 0.000 1.333 393 I HN -0.114 8.096 8.210 -0.000 0.000 0.475 394 Q N 5.243 125.070 119.800 0.045 0.000 2.289 394 Q HA 0.061 4.400 4.340 -0.001 0.000 0.273 394 Q C 0.875 176.684 176.000 -0.318 0.000 1.029 394 Q CA -0.035 55.722 55.803 -0.077 0.000 0.896 394 Q CB 1.159 29.887 28.738 -0.018 0.000 1.182 394 Q HN 0.545 8.815 8.270 -0.000 0.000 0.385 395 K N 3.753 123.736 120.400 -0.694 0.000 2.049 395 K HA -0.297 4.022 4.320 -0.001 0.000 0.219 395 K C 1.032 177.287 176.600 -0.575 0.000 1.056 395 K CA 2.627 58.126 56.287 -1.313 0.000 0.946 395 K CB 0.045 32.067 32.500 -0.798 0.000 0.723 395 K HN 0.754 9.004 8.250 -0.000 0.000 0.453 396 E N -0.380 119.653 120.200 -0.279 0.000 2.077 396 E HA -0.101 4.249 4.350 -0.001 0.000 0.193 396 E C 2.100 178.667 176.600 -0.056 0.000 0.989 396 E CA 1.864 58.184 56.400 -0.134 0.000 0.800 396 E CB -0.514 29.139 29.700 -0.077 0.000 0.746 396 E HN 0.393 8.753 8.360 -0.000 0.000 0.452 397 T N 0.659 115.220 114.554 0.011 0.000 2.652 397 T HA -0.201 4.148 4.350 -0.001 0.000 0.267 397 T C 1.325 176.177 174.700 0.254 0.000 1.039 397 T CA 1.370 63.576 62.100 0.177 0.000 1.153 397 T CB -0.463 68.513 68.868 0.181 0.000 0.863 397 T HN 0.421 8.661 8.240 -0.000 0.000 0.428 398 W N 2.056 123.346 121.300 -0.017 0.000 2.358 398 W HA -0.133 4.526 4.660 -0.000 0.000 0.303 398 W C 2.155 178.728 176.519 0.091 0.000 1.208 398 W CA 1.576 58.943 57.345 0.035 0.000 1.274 398 W CB -0.318 29.120 29.460 -0.036 0.000 1.138 398 W HN 0.245 8.425 8.180 -0.000 0.000 0.515 399 E N 0.327 120.575 120.200 0.080 0.000 2.085 399 E HA -0.181 4.168 4.350 -0.001 0.000 0.194 399 E C 2.121 178.617 176.600 -0.174 0.000 0.994 399 E CA 2.836 59.228 56.400 -0.012 0.000 0.801 399 E CB -0.625 29.015 29.700 -0.100 0.000 0.743 399 E HN 0.102 8.462 8.360 -0.000 0.000 0.453 400 T N -1.190 113.218 114.554 -0.242 0.000 2.684 400 T HA -0.165 4.184 4.350 -0.001 0.000 0.267 400 T C 1.292 175.562 174.700 -0.716 0.000 1.036 400 T CA 1.756 63.531 62.100 -0.542 0.000 1.148 400 T CB -0.407 68.021 68.868 -0.733 0.000 0.863 400 T HN 0.377 8.617 8.240 -0.000 0.000 0.436 401 W N 0.164 121.322 121.300 -0.236 0.000 2.915 401 W HA 0.266 4.926 4.660 -0.001 0.000 0.276 401 W C 2.163 178.445 176.519 -0.395 0.000 1.215 401 W CA -1.097 56.098 57.345 -0.251 0.000 1.514 401 W CB -0.046 29.379 29.460 -0.059 0.000 1.017 401 W HN 0.312 8.492 8.180 -0.000 0.000 0.598 402 W N 1.331 122.319 121.300 -0.520 0.000 2.342 402 W HA -0.194 4.466 4.660 -0.000 0.000 0.297 402 W C 1.570 177.925 176.519 -0.274 0.000 1.213 402 W CA 2.095 59.016 57.345 -0.706 0.000 1.251 402 W CB -1.972 26.493 29.460 -1.658 0.000 1.136 402 W HN -0.077 8.103 8.180 -0.000 0.000 0.526 403 T N -1.156 112.612 114.554 -1.309 0.000 2.946 403 T HA -0.202 4.147 4.350 -0.001 0.000 0.271 403 T C 1.451 175.918 174.700 -0.389 0.000 1.104 403 T CA 1.488 62.987 62.100 -1.002 0.000 1.114 403 T CB -0.466 67.734 68.868 -1.113 0.000 0.867 403 T HN 0.045 8.285 8.240 -0.000 0.000 0.513 404 E N 0.528 120.444 120.200 -0.473 0.000 2.338 404 E HA -0.021 4.329 4.350 -0.001 0.000 0.197 404 E C 0.483 176.633 176.600 -0.752 0.000 1.007 404 E CA 0.879 56.899 56.400 -0.632 0.000 0.849 404 E CB -0.013 29.157 29.700 -0.882 0.000 0.774 404 E HN 0.840 9.200 8.360 -0.000 0.000 0.506 405 Y N -2.977 117.367 120.300 0.073 0.000 2.540 405 Y HA 0.142 4.692 4.550 -0.001 0.000 0.257 405 Y C 0.659 176.634 175.900 0.126 0.000 1.090 405 Y CA -1.088 57.055 58.100 0.071 0.000 1.242 405 Y CB -0.170 38.317 38.460 0.045 0.000 1.325 405 Y HN -0.003 8.277 8.280 -0.000 0.000 0.544 406 W N 3.867 125.247 121.300 0.134 0.000 2.223 406 W HA 0.086 4.745 4.660 -0.001 0.000 0.334 406 W C 0.259 176.828 176.519 0.084 0.000 1.334 406 W CA 1.098 58.563 57.345 0.200 0.000 1.246 406 W CB 0.836 30.537 29.460 0.400 0.000 1.184 406 W HN 0.246 8.427 8.180 -0.000 0.000 0.563 407 Q N 3.097 122.646 119.800 -0.419 0.000 2.113 407 Q HA 0.186 4.526 4.340 -0.001 0.000 0.225 407 Q C 0.288 176.005 176.000 -0.471 0.000 0.786 407 Q CA -0.214 55.398 55.803 -0.318 0.000 0.989 407 Q CB 1.273 29.840 28.738 -0.284 0.000 1.174 407 Q HN 0.403 8.673 8.270 -0.000 0.000 0.470 408 A N -0.097 122.199 122.820 -0.872 0.000 2.271 408 A HA 0.388 4.707 4.320 -0.001 0.000 0.288 408 A C 0.801 178.194 177.584 -0.318 0.000 1.094 408 A CA -0.155 51.333 52.037 -0.914 0.000 0.828 408 A CB 0.697 18.511 19.000 -1.977 0.000 1.091 408 A HN 0.097 8.247 8.150 -0.000 0.000 0.493 409 T N 0.629 114.920 114.554 -0.438 0.000 3.044 409 T HA 0.117 4.467 4.350 -0.001 0.000 0.250 409 T C 0.331 175.112 174.700 0.136 0.000 1.081 409 T CA 0.189 62.245 62.100 -0.074 0.000 1.040 409 T CB -0.187 68.643 68.868 -0.063 0.000 0.962 409 T HN 0.690 8.930 8.240 -0.000 0.000 0.506 410 W N 0.868 122.413 121.300 0.408 0.000 2.497 410 W HA 0.763 5.423 4.660 -0.001 0.000 0.359 410 W C -1.127 175.708 176.519 0.527 0.000 1.131 410 W CA -1.386 56.191 57.345 0.387 0.000 1.280 410 W CB 0.553 30.233 29.460 0.367 0.000 1.319 410 W HN -0.160 8.020 8.180 -0.000 0.000 0.626 411 I N 2.899 123.895 120.570 0.711 0.000 2.499 411 I HA 0.233 4.403 4.170 -0.001 0.000 0.288 411 I C -2.020 174.212 176.117 0.191 0.000 1.048 411 I CA -2.396 59.144 61.300 0.400 0.000 1.062 411 I CB 2.117 40.100 38.000 -0.028 0.000 1.238 411 I HN -0.015 8.195 8.210 -0.000 0.000 0.426 412 P HA 0.190 4.610 4.420 -0.000 0.000 0.274 412 P C -0.704 176.413 177.300 -0.305 0.000 1.246 412 P CA -0.274 62.868 63.100 0.071 0.000 0.795 412 P CB 0.839 32.746 31.700 0.345 0.000 1.006 413 E N -0.021 120.069 120.200 -0.184 0.000 2.319 413 E HA 0.378 4.728 4.350 -0.001 0.000 0.268 413 E C -0.810 175.693 176.600 -0.162 0.000 1.050 413 E CA -0.146 56.047 56.400 -0.344 0.000 0.878 413 E CB 0.531 30.142 29.700 -0.149 0.000 1.066 413 E HN 0.449 8.809 8.360 -0.000 0.000 0.406 414 W N 0.295 121.499 121.300 -0.161 0.000 3.213 414 W HA 0.472 5.131 4.660 -0.001 0.000 0.318 414 W C -1.032 175.196 176.519 -0.485 0.000 1.248 414 W CA -0.896 56.255 57.345 -0.324 0.000 1.187 414 W CB 0.114 29.251 29.460 -0.540 0.000 1.403 414 W HN 0.342 8.522 8.180 -0.000 0.000 0.556 415 E N 0.664 120.721 120.200 -0.239 0.000 2.370 415 E HA 0.774 5.123 4.350 -0.001 0.000 0.259 415 E C -1.495 174.635 176.600 -0.783 0.000 0.947 415 E CA -1.184 54.986 56.400 -0.383 0.000 0.809 415 E CB 2.078 31.726 29.700 -0.086 0.000 1.300 415 E HN 0.245 8.605 8.360 -0.000 0.000 0.419 416 F N 0.485 120.430 119.950 -0.008 0.000 2.520 416 F HA 0.585 5.111 4.527 -0.001 0.000 0.322 416 F C -0.295 175.509 175.800 0.006 0.000 1.103 416 F CA -0.968 57.004 58.000 -0.048 0.000 0.926 416 F CB 1.841 40.805 39.000 -0.060 0.000 1.154 416 F HN 0.237 8.537 8.300 -0.000 0.000 0.453 417 V N -0.624 119.390 119.914 0.167 0.000 3.188 417 V HA 0.581 4.701 4.120 -0.001 0.000 0.305 417 V C -1.469 174.693 176.094 0.112 0.000 1.232 417 V CA -0.984 61.391 62.300 0.125 0.000 1.043 417 V CB 2.320 34.205 31.823 0.103 0.000 1.068 417 V HN 0.754 8.944 8.190 -0.000 0.000 0.439 418 N N 1.493 120.249 118.700 0.093 0.000 2.437 418 N HA 0.363 5.103 4.740 -0.001 0.000 0.259 418 N C -0.421 175.127 175.510 0.064 0.000 0.983 418 N CA -0.373 52.721 53.050 0.073 0.000 0.937 418 N CB 1.717 40.239 38.487 0.057 0.000 1.122 418 N HN 0.893 9.273 8.380 -0.000 0.000 0.499 419 T N 3.404 117.992 114.554 0.056 0.000 2.871 419 T HA 0.075 4.424 4.350 -0.001 0.000 0.296 419 T C -2.188 172.515 174.700 0.004 0.000 0.998 419 T CA -0.480 61.645 62.100 0.042 0.000 1.162 419 T CB 0.122 69.005 68.868 0.026 0.000 0.947 419 T HN 0.249 8.489 8.240 -0.000 0.000 0.536 420 P HA 0.110 4.530 4.420 -0.000 0.000 0.262 420 P C -1.550 175.663 177.300 -0.145 0.000 1.199 420 P CA -1.378 61.699 63.100 -0.038 0.000 0.763 420 P CB 0.243 31.949 31.700 0.010 0.000 0.790 421 P HA -0.157 4.263 4.420 -0.000 0.000 0.220 421 P C 1.166 178.233 177.300 -0.388 0.000 1.144 421 P CA 1.359 64.331 63.100 -0.212 0.000 0.800 421 P CB 0.145 31.749 31.700 -0.160 0.000 0.772 422 L N -1.069 119.820 121.223 -0.557 0.000 2.095 422 L HA -0.075 4.265 4.340 -0.001 0.000 0.204 422 L C 2.721 178.729 176.870 -1.437 0.000 1.080 422 L CA 0.890 55.035 54.840 -1.159 0.000 0.759 422 L CB -1.070 40.141 42.059 -1.413 0.000 0.914 422 L HN -0.185 8.045 8.230 -0.000 0.000 0.439 423 V N 0.676 120.060 119.914 -0.883 0.000 2.278 423 V HA -0.386 3.734 4.120 -0.001 0.000 0.251 423 V C 2.625 178.504 176.094 -0.358 0.000 1.062 423 V CA 2.247 64.194 62.300 -0.588 0.000 1.038 423 V CB -0.691 31.004 31.823 -0.214 0.000 0.646 423 V HN 0.493 8.683 8.190 -0.000 0.000 0.447 424 K N -0.276 119.958 120.400 -0.278 0.000 2.044 424 K HA -0.257 4.062 4.320 -0.001 0.000 0.210 424 K C 2.181 178.655 176.600 -0.210 0.000 1.049 424 K CA 2.108 58.298 56.287 -0.162 0.000 0.927 424 K CB -0.310 32.093 32.500 -0.161 0.000 0.713 424 K HN 0.349 8.599 8.250 -0.000 0.000 0.443 425 L N 0.530 121.518 121.223 -0.392 0.000 2.046 425 L HA -0.143 4.196 4.340 -0.001 0.000 0.208 425 L C 1.987 178.699 176.870 -0.263 0.000 1.077 425 L CA 1.610 56.233 54.840 -0.362 0.000 0.747 425 L CB -0.614 41.138 42.059 -0.511 0.000 0.896 425 L HN 0.365 8.595 8.230 -0.000 0.000 0.432 426 W N -1.288 119.773 121.300 -0.399 0.000 2.467 426 W HA -0.116 4.544 4.660 -0.001 0.000 0.275 426 W C 1.893 178.108 176.519 -0.506 0.000 1.239 426 W CA 0.528 57.539 57.345 -0.557 0.000 1.266 426 W CB -0.965 27.849 29.460 -1.077 0.000 1.112 426 W HN 0.233 8.413 8.180 -0.000 0.000 0.576 427 Y N 1.106 121.384 120.300 -0.037 0.000 2.468 427 Y HA 0.057 4.607 4.550 -0.001 0.000 0.268 427 Y C 1.503 177.396 175.900 -0.012 0.000 1.177 427 Y CA -0.294 57.806 58.100 -0.001 0.000 1.265 427 Y CB -0.987 37.472 38.460 -0.001 0.000 1.103 427 Y HN 0.055 8.335 8.280 -0.000 0.000 0.522 428 Q N 0.587 120.431 119.800 0.074 0.000 2.315 428 Q HA 0.343 4.682 4.340 -0.001 0.000 0.289 428 Q C 0.022 176.051 176.000 0.048 0.000 1.044 428 Q CA 0.088 55.910 55.803 0.031 0.000 0.920 428 Q CB 0.668 29.397 28.738 -0.016 0.000 1.214 428 Q HN 0.261 8.531 8.270 -0.000 0.000 0.392 429 L N 0.000 121.243 121.223 0.034 0.000 2.949 429 L HA 0.000 4.339 4.340 -0.001 0.000 0.249 429 L CA 0.000 54.860 54.840 0.034 0.000 0.813 429 L CB 0.000 42.077 42.059 0.030 0.000 0.961 429 L HN 0.000 8.230 8.230 -0.000 0.000 0.502