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 3cmv_1_D DATA FIRST_RESID 37 DATA SEQUENCE VETISTGSLS LDIALGAGGL PMGRIVEIYG PESSGKTTLT LQVIAAAQRE DATA SEQUENCE GKTCAFIDAE HALDPIYARK LGVDIDNLLC SQPDTGEQAL EICDALARSG DATA SEQUENCE AVDVIVVDSV AALTPKAEIE GEIGDSHMGL AARMMSQAMR KLAGNLKQSN DATA SEQUENCE TLLIFINQXX XXXXXXXXXX XXXXGGNALK FYASVRLDIR RIGAVKEGEN DATA SEQUENCE VVGSETRVKV VKNKIAAPFK QAEFQILYGE GINFYGELVD LGVKEKLIEK DATA SEQUENCE AGAWYSYKGE KIGQGKANAT AWLKDNPETA KEIEKKVREL LLXXXXXXXX DATA SEQUENCE XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX DATA SEQUENCE XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX DATA SEQUENCE XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX DATA SEQUENCE XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX DATA SEQUENCE XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX DATA SEQUENCE XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX DATA SEQUENCE XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX DATA SEQUENCE XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX DATA SEQUENCE XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX DATA SEQUENCE XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX DATA SEQUENCE XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX DATA SEQUENCE XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX DATA SEQUENCE XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX DATA SEQUENCE XXXXXXXXXX XXXXXXXXXK QKALAAALGQ IEKQFGKGSI MRLGEDRSMD DATA SEQUENCE VETISTGSLS LDIALGAGGL PMGRIVEIYG PESSGKTTLT LQVIAAAQRE DATA SEQUENCE GKTCAFIDAE HALDPIYARK LGVDIDNLLC SQPDTGEQAL EICDALARSG DATA SEQUENCE AVDVIVVDSV AALTPKAEIE GEIGDSHMGL AARMMSQAMR KLAGNLKQSN DATA SEQUENCE TLLIFINQXX XXXXXXXXXX XXXXGGNALK FYASVRLDIR RIGAVKEGEN DATA SEQUENCE VVGSETRVKV VKNKIAAPFK QAEFQILYGE GINFYGELVD LGVKEKLIEK DATA SEQUENCE AGAWYSYKGE KIGQGKANAT AWLKDNPETA KEIEKKVREL LLXXXXXXXX DATA SEQUENCE XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX DATA SEQUENCE XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX DATA SEQUENCE XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX DATA SEQUENCE XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX DATA SEQUENCE XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX DATA SEQUENCE XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX DATA SEQUENCE XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX DATA SEQUENCE XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX DATA SEQUENCE XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX DATA SEQUENCE XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX DATA SEQUENCE XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX DATA SEQUENCE XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX DATA SEQUENCE XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX DATA SEQUENCE XXXXXXXXXX XXXXXXXXXK QKALAAALGQ IEKQFGKGSI MRLGEDRSMD DATA SEQUENCE VETISTGSLS LDIALGAGGL PMGRIVEIYG PESSGKTTLT LQVIAAAQRE DATA SEQUENCE GKTCAFIDAE HALDPIYARK LGVDIDNLLC SQPDTGEQAL EICDALARSG DATA SEQUENCE AVDVIVVDSV AALTPKAEIE XXXXXXXXGL AARMMSQAMR KLAGNLKQSN DATA SEQUENCE TLLIFINQXX XXXXXXXXXX XXXXGGNALK FYASVRLDIR RIGAVKEGEN DATA SEQUENCE VVGSETRVKV VKNKIAAPFK QAEFQILYGE GINFYGELVD LGVKEKLIEK DATA SEQUENCE AGAWYSYKGE KIGQGKANAT AWLKDNPETA KEIEKKVREL LLXXXXXXXX DATA SEQUENCE XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX DATA SEQUENCE XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX DATA SEQUENCE XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX DATA SEQUENCE XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX DATA SEQUENCE XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX DATA SEQUENCE XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX DATA SEQUENCE XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX DATA SEQUENCE XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX DATA SEQUENCE XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX DATA SEQUENCE XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX DATA SEQUENCE XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX DATA SEQUENCE XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX DATA SEQUENCE XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX DATA SEQUENCE XXXXXXXXXX XXXXXXXXXK QKALAAALGQ IEKQFGKGSI MRLGEDRSMD DATA SEQUENCE VETISTGSLS LDIALGAGGL PMGRIVEIYG PESSGKTTLT LQVIAAAQRE DATA SEQUENCE GKTCAFIDAE HALDPIYARK LGVDIDNLLC SQPDTGEQAL EICDALARSG DATA SEQUENCE AVDVIVVDSV AALTPXXXXX XXXXXXXXXL AARMMSQAMR KLAGNLKQSN DATA SEQUENCE TLLIFINQXX XXXXXXXXXX XXXXGGNALK FYASVRLDIR RIGAVKEGEN DATA SEQUENCE VVGSETRVKV VKNKIAAPFK QAEFQILYGE GINFYGELVD LGVKEKLIEK DATA SEQUENCE AGAWYSYKGE KIGQGKANAT AWLKDNPETA KEIEKKVREL LL 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 37 V HA 0.000 nan 4.120 nan 0.000 0.244 37 V C 0.000 176.087 176.094 -0.011 0.000 1.182 37 V CA 0.000 62.295 62.300 -0.008 0.000 1.235 37 V CB 0.000 31.819 31.823 -0.006 0.000 1.184 38 E N 1.255 121.448 120.200 -0.012 0.000 2.331 38 E HA 0.635 4.985 4.350 -0.000 0.000 0.272 38 E C -0.798 175.790 176.600 -0.020 0.000 1.036 38 E CA 0.293 56.683 56.400 -0.016 0.000 0.864 38 E CB 1.568 31.259 29.700 -0.015 0.000 1.035 38 E HN 0.942 nan 8.360 nan 0.000 0.408 39 T N 0.274 114.812 114.554 -0.027 0.000 2.916 39 T HA 0.496 4.846 4.350 -0.000 0.000 0.298 39 T C -0.327 174.345 174.700 -0.046 0.000 1.031 39 T CA -0.884 61.195 62.100 -0.034 0.000 0.993 39 T CB 0.973 69.820 68.868 -0.036 0.000 1.045 39 T HN 0.151 nan 8.240 nan 0.000 0.454 40 I N 2.164 122.703 120.570 -0.051 0.000 2.377 40 I HA 0.379 4.549 4.170 -0.000 0.000 0.293 40 I C 0.915 176.980 176.117 -0.087 0.000 0.987 40 I CA -0.604 60.656 61.300 -0.066 0.000 1.185 40 I CB 1.669 39.636 38.000 -0.056 0.000 1.341 40 I HN 0.848 nan 8.210 nan 0.000 0.455 41 S N 3.317 118.948 115.700 -0.116 0.000 2.537 41 S HA 0.024 4.494 4.470 -0.000 0.000 0.286 41 S C 1.579 176.082 174.600 -0.161 0.000 1.299 41 S CA 0.003 58.108 58.200 -0.159 0.000 1.067 41 S CB 0.346 63.414 63.200 -0.220 0.000 0.864 41 S HN 0.805 nan 8.310 nan 0.000 0.494 42 T N 2.665 117.120 114.554 -0.165 0.000 2.962 42 T HA 0.184 4.534 4.350 -0.000 0.000 0.270 42 T C 1.580 176.167 174.700 -0.188 0.000 1.088 42 T CA 1.141 63.150 62.100 -0.152 0.000 1.127 42 T CB -0.527 68.251 68.868 -0.151 0.000 0.883 42 T HN 1.428 nan 8.240 nan 0.000 0.493 43 G N 0.512 109.158 108.800 -0.257 0.000 2.313 43 G HA2 -0.212 3.748 3.960 -0.000 0.000 0.215 43 G HA3 -0.212 3.748 3.960 -0.000 0.000 0.215 43 G C 0.309 175.010 174.900 -0.332 0.000 1.023 43 G CA 0.265 45.197 45.100 -0.280 0.000 0.626 43 G HN 1.086 nan 8.290 nan 0.000 0.503 44 S N 0.620 116.092 115.700 -0.380 0.000 2.565 44 S HA 0.706 5.176 4.470 -0.000 0.000 0.290 44 S C 1.399 175.819 174.600 -0.300 0.000 1.150 44 S CA -0.330 57.607 58.200 -0.437 0.000 1.058 44 S CB 1.281 63.966 63.200 -0.858 0.000 1.032 44 S HN 0.392 nan 8.310 nan 0.000 0.510 45 L N 3.775 124.885 121.223 -0.189 0.000 2.044 45 L HA 0.018 4.358 4.340 -0.000 0.000 0.205 45 L C 2.575 179.398 176.870 -0.079 0.000 1.075 45 L CA 2.469 57.242 54.840 -0.111 0.000 0.747 45 L CB -1.547 40.513 42.059 0.002 0.000 0.903 45 L HN 0.958 nan 8.230 nan 0.000 0.435 46 S N -1.095 114.574 115.700 -0.052 0.000 2.461 46 S HA -0.128 4.342 4.470 -0.000 0.000 0.228 46 S C 2.025 176.622 174.600 -0.006 0.000 1.005 46 S CA 0.438 58.641 58.200 0.004 0.000 0.942 46 S CB -0.503 62.739 63.200 0.069 0.000 0.776 46 S HN 0.403 nan 8.310 nan 0.000 0.514 47 L N 1.565 122.746 121.223 -0.070 0.000 2.017 47 L HA -0.135 4.205 4.340 -0.000 0.000 0.208 47 L C 1.832 178.674 176.870 -0.047 0.000 1.073 47 L CA 1.935 56.745 54.840 -0.050 0.000 0.745 47 L CB -0.520 41.465 42.059 -0.124 0.000 0.894 47 L HN 0.194 nan 8.230 nan 0.000 0.432 48 D N -0.001 120.351 120.400 -0.079 0.000 2.149 48 D HA -0.211 4.429 4.640 -0.000 0.000 0.198 48 D C 2.132 178.411 176.300 -0.034 0.000 0.990 48 D CA 1.411 55.371 54.000 -0.067 0.000 0.839 48 D CB -0.143 40.600 40.800 -0.094 0.000 0.948 48 D HN 0.359 nan 8.370 nan 0.000 0.460 49 I N 0.665 121.222 120.570 -0.021 0.000 2.202 49 I HA -0.227 3.943 4.170 -0.000 0.000 0.242 49 I C 2.279 178.404 176.117 0.014 0.000 1.091 49 I CA 1.153 62.454 61.300 0.001 0.000 1.368 49 I CB -0.128 37.880 38.000 0.015 0.000 1.058 49 I HN -0.041 nan 8.210 nan 0.000 0.410 50 A N 0.092 122.924 122.820 0.021 0.000 2.067 50 A HA -0.009 4.311 4.320 -0.000 0.000 0.217 50 A C 2.233 179.830 177.584 0.022 0.000 1.156 50 A CA 0.727 52.783 52.037 0.033 0.000 0.683 50 A CB -0.569 18.460 19.000 0.049 0.000 0.808 50 A HN 0.358 nan 8.150 nan 0.000 0.455 51 L N -1.303 119.924 121.223 0.007 0.000 2.131 51 L HA -0.044 4.296 4.340 -0.000 0.000 0.210 51 L C 2.123 178.994 176.870 0.001 0.000 1.092 51 L CA 1.251 56.089 54.840 -0.002 0.000 0.759 51 L CB -0.234 41.815 42.059 -0.016 0.000 0.903 51 L HN 0.591 nan 8.230 nan 0.000 0.435 52 G N -1.616 107.185 108.800 0.003 0.000 2.199 52 G HA2 -0.335 3.625 3.960 -0.000 0.000 0.254 52 G HA3 -0.335 3.625 3.960 -0.000 0.000 0.254 52 G C 0.822 175.721 174.900 -0.002 0.000 0.982 52 G CA 0.506 45.609 45.100 0.005 0.000 0.632 52 G HN 0.516 nan 8.290 nan 0.000 0.529 53 A N -0.213 122.601 122.820 -0.010 0.000 2.324 53 A HA 0.644 4.964 4.320 -0.000 0.000 0.220 53 A C 2.248 179.817 177.584 -0.024 0.000 1.209 53 A CA 1.620 53.648 52.037 -0.015 0.000 0.918 53 A CB -0.037 18.953 19.000 -0.016 0.000 0.959 53 A HN 2.342 nan 8.150 nan 0.000 0.507 54 G N -1.103 107.679 108.800 -0.030 0.000 2.272 54 G HA2 0.328 4.288 3.960 -0.000 0.000 0.280 54 G HA3 0.328 4.288 3.960 -0.000 0.000 0.280 54 G C 0.952 175.816 174.900 -0.060 0.000 1.067 54 G CA 0.673 45.746 45.100 -0.046 0.000 0.902 54 G HN 2.289 nan 8.290 nan 0.000 0.500 55 G N -1.742 107.024 108.800 -0.057 0.000 2.357 55 G HA2 0.417 4.376 3.960 -0.000 0.000 0.289 55 G HA3 0.417 4.376 3.960 -0.000 0.000 0.289 55 G C -0.819 174.054 174.900 -0.045 0.000 1.302 55 G CA -0.555 44.507 45.100 -0.063 0.000 0.936 55 G HN 0.999 nan 8.290 nan 0.000 0.513 56 L N 1.495 122.692 121.223 -0.043 0.000 2.257 56 L HA 0.380 4.720 4.340 -0.000 0.000 0.290 56 L C -2.069 174.788 176.870 -0.022 0.000 1.044 56 L CA -1.708 53.114 54.840 -0.029 0.000 0.810 56 L CB 1.720 43.764 42.059 -0.025 0.000 1.193 56 L HN 0.203 nan 8.230 nan 0.000 0.425 57 P HA -0.081 nan 4.420 nan 0.000 0.251 57 P C -0.137 177.159 177.300 -0.006 0.000 1.154 57 P CA 0.535 63.628 63.100 -0.011 0.000 0.805 57 P CB 0.132 31.827 31.700 -0.009 0.000 0.759 58 M N 2.787 122.382 119.600 -0.008 0.000 2.248 58 M HA 0.119 4.599 4.480 -0.000 0.000 0.345 58 M C 1.642 177.943 176.300 0.002 0.000 1.243 58 M CA 1.135 56.433 55.300 -0.005 0.000 1.090 58 M CB -0.512 32.083 32.600 -0.009 0.000 1.683 58 M HN 0.782 nan 8.290 nan 0.000 0.450 59 G N 2.862 111.667 108.800 0.008 0.000 2.175 59 G HA2 -0.182 3.778 3.960 -0.000 0.000 0.244 59 G HA3 -0.182 3.778 3.960 -0.000 0.000 0.244 59 G C 0.134 175.048 174.900 0.023 0.000 0.982 59 G CA -0.265 44.844 45.100 0.015 0.000 0.641 59 G HN 0.550 nan 8.290 nan 0.000 0.527 60 R N -0.640 119.876 120.500 0.026 0.000 2.919 60 R HA 0.752 5.092 4.340 -0.000 0.000 0.260 60 R C -0.080 176.257 176.300 0.061 0.000 1.067 60 R CA -1.162 54.960 56.100 0.036 0.000 1.003 60 R CB 0.881 31.192 30.300 0.019 0.000 1.192 60 R HN 0.198 nan 8.270 nan 0.000 0.488 61 I N 0.966 121.585 120.570 0.082 0.000 2.353 61 I HA 0.249 4.419 4.170 -0.000 0.000 0.293 61 I C -0.437 175.735 176.117 0.092 0.000 0.992 61 I CA -0.650 60.728 61.300 0.130 0.000 1.268 61 I CB 1.615 39.716 38.000 0.168 0.000 1.387 61 I HN -0.006 nan 8.210 nan 0.000 0.478 62 V N 6.530 126.514 119.914 0.116 0.000 2.483 62 V HA 0.296 4.416 4.120 -0.000 0.000 0.297 62 V C -0.289 175.866 176.094 0.101 0.000 1.027 62 V CA -0.645 61.695 62.300 0.066 0.000 0.855 62 V CB 1.798 33.643 31.823 0.037 0.000 0.995 62 V HN 0.676 nan 8.190 nan 0.000 0.424 63 E N 4.849 125.068 120.200 0.032 0.000 2.151 63 E HA 0.574 4.924 4.350 -0.000 0.000 0.275 63 E C -1.307 175.295 176.600 0.002 0.000 0.936 63 E CA -0.567 55.849 56.400 0.026 0.000 0.777 63 E CB 1.414 31.057 29.700 -0.096 0.000 1.108 63 E HN 0.630 nan 8.360 nan 0.000 0.401 64 I N 6.765 127.383 120.570 0.080 0.000 2.354 64 I HA 0.286 4.456 4.170 -0.000 0.000 0.286 64 I C -0.613 175.633 176.117 0.215 0.000 1.007 64 I CA -0.709 60.666 61.300 0.123 0.000 1.167 64 I CB 0.668 38.735 38.000 0.112 0.000 1.320 64 I HN 0.510 nan 8.210 nan 0.000 0.458 65 Y N 4.520 124.836 120.300 0.027 0.000 2.562 65 Y HA 0.975 5.525 4.550 -0.000 0.000 0.343 65 Y C -0.054 175.854 175.900 0.014 0.000 1.025 65 Y CA -1.081 57.030 58.100 0.019 0.000 1.082 65 Y CB 2.483 40.946 38.460 0.005 0.000 1.264 65 Y HN 0.605 nan 8.280 nan 0.000 0.478 66 G N 1.367 110.128 108.800 -0.064 0.000 2.358 66 G HA2 0.264 4.224 3.960 -0.000 0.000 0.303 66 G HA3 0.264 4.224 3.960 -0.000 0.000 0.303 66 G C -3.512 171.328 174.900 -0.099 0.000 1.537 66 G CA -1.400 43.593 45.100 -0.179 0.000 0.928 66 G HN 0.468 nan 8.290 nan 0.000 0.656 67 P HA 0.096 nan 4.420 nan 0.000 0.265 67 P C 0.637 177.917 177.300 -0.034 0.000 1.167 67 P CA 0.568 63.629 63.100 -0.066 0.000 0.760 67 P CB 0.291 31.953 31.700 -0.064 0.000 0.783 68 E N 1.210 121.396 120.200 -0.024 0.000 2.425 68 E HA 0.103 4.453 4.350 -0.000 0.000 0.258 68 E C -0.294 176.296 176.600 -0.016 0.000 1.151 68 E CA -0.461 55.932 56.400 -0.012 0.000 0.958 68 E CB -0.196 29.497 29.700 -0.010 0.000 0.968 68 E HN 0.254 nan 8.360 nan 0.000 0.451 69 S N 0.228 115.919 115.700 -0.015 0.000 3.550 69 S HA -0.176 4.294 4.470 -0.000 0.000 0.372 69 S C 0.371 174.958 174.600 -0.022 0.000 0.966 69 S CA 0.897 59.080 58.200 -0.028 0.000 1.229 69 S CB -1.779 61.398 63.200 -0.039 0.000 0.917 69 S HN 0.752 nan 8.310 nan 0.000 0.496 70 S N -1.097 114.598 115.700 -0.009 0.000 2.666 70 S HA 0.533 5.003 4.470 -0.000 0.000 0.239 70 S C 1.187 175.792 174.600 0.009 0.000 1.031 70 S CA 0.554 58.748 58.200 -0.009 0.000 1.015 70 S CB 1.106 64.297 63.200 -0.015 0.000 0.981 70 S HN 2.006 nan 8.310 nan 0.000 0.547 71 G N 1.560 110.377 108.800 0.028 0.000 2.148 71 G HA2 -0.256 3.704 3.960 -0.000 0.000 0.203 71 G HA3 -0.256 3.704 3.960 -0.000 0.000 0.203 71 G C 0.615 175.574 174.900 0.098 0.000 0.993 71 G CA 0.286 45.428 45.100 0.071 0.000 0.661 71 G HN 0.438 nan 8.290 nan 0.000 0.518 72 K N -0.272 120.174 120.400 0.077 0.000 2.001 72 K HA -0.075 4.245 4.320 -0.000 0.000 0.214 72 K C 2.657 179.317 176.600 0.099 0.000 1.050 72 K CA 2.411 58.751 56.287 0.089 0.000 0.934 72 K CB -0.350 32.194 32.500 0.073 0.000 0.718 72 K HN 0.268 nan 8.250 nan 0.000 0.443 73 T N 0.017 114.631 114.554 0.101 0.000 2.867 73 T HA -0.087 4.263 4.350 -0.000 0.000 0.268 73 T C 1.553 176.322 174.700 0.116 0.000 1.057 73 T CA 1.650 63.820 62.100 0.117 0.000 1.136 73 T CB -0.237 68.707 68.868 0.126 0.000 0.874 73 T HN 0.385 nan 8.240 nan 0.000 0.466 74 T N 2.446 117.087 114.554 0.145 0.000 2.643 74 T HA -0.029 4.321 4.350 -0.000 0.000 0.264 74 T C 1.893 176.635 174.700 0.071 0.000 1.045 74 T CA 1.008 63.188 62.100 0.134 0.000 1.155 74 T CB -0.647 68.344 68.868 0.205 0.000 0.863 74 T HN 0.230 nan 8.240 nan 0.000 0.420 75 L N 0.493 121.778 121.223 0.104 0.000 2.043 75 L HA -0.225 4.115 4.340 -0.000 0.000 0.212 75 L C 2.651 179.542 176.870 0.035 0.000 1.075 75 L CA 1.620 56.507 54.840 0.079 0.000 0.752 75 L CB -0.779 41.356 42.059 0.126 0.000 0.891 75 L HN 0.309 nan 8.230 nan 0.000 0.432 76 T N 0.122 114.708 114.554 0.054 0.000 2.580 76 T HA -0.253 4.097 4.350 -0.000 0.000 0.265 76 T C 1.691 176.398 174.700 0.013 0.000 1.063 76 T CA 1.897 64.026 62.100 0.048 0.000 1.170 76 T CB -0.346 68.577 68.868 0.091 0.000 0.863 76 T HN 0.182 nan 8.240 nan 0.000 0.418 77 L N 1.307 122.527 121.223 -0.006 0.000 2.447 77 L HA -0.061 4.279 4.340 -0.000 0.000 0.225 77 L C 2.583 179.397 176.870 -0.093 0.000 1.148 77 L CA 1.316 56.110 54.840 -0.077 0.000 0.808 77 L CB -0.525 41.456 42.059 -0.130 0.000 0.928 77 L HN 0.227 nan 8.230 nan 0.000 0.448 78 Q N -1.080 118.678 119.800 -0.069 0.000 2.212 78 Q HA -0.027 4.313 4.340 -0.000 0.000 0.199 78 Q C 2.365 178.311 176.000 -0.090 0.000 0.950 78 Q CA 1.558 57.309 55.803 -0.085 0.000 0.863 78 Q CB 0.002 28.695 28.738 -0.074 0.000 0.944 78 Q HN 0.579 nan 8.270 nan 0.000 0.465 79 V N -2.163 117.710 119.914 -0.069 0.000 2.591 79 V HA -0.087 4.033 4.120 -0.000 0.000 0.249 79 V C 2.102 178.158 176.094 -0.063 0.000 1.053 79 V CA 0.966 63.224 62.300 -0.070 0.000 1.068 79 V CB -0.742 31.051 31.823 -0.051 0.000 0.689 79 V HN 0.138 nan 8.190 nan 0.000 0.462 80 I N 1.249 121.785 120.570 -0.055 0.000 2.493 80 I HA -0.108 4.062 4.170 -0.000 0.000 0.254 80 I C 2.862 178.935 176.117 -0.073 0.000 1.160 80 I CA 1.347 62.613 61.300 -0.056 0.000 1.445 80 I CB -0.656 37.309 38.000 -0.058 0.000 1.086 80 I HN 0.392 nan 8.210 nan 0.000 0.433 81 A N 1.187 123.955 122.820 -0.086 0.000 1.832 81 A HA -0.081 4.239 4.320 -0.000 0.000 0.214 81 A C 2.605 180.139 177.584 -0.084 0.000 1.200 81 A CA 1.631 53.615 52.037 -0.089 0.000 0.610 81 A CB -0.979 17.962 19.000 -0.098 0.000 0.842 81 A HN 0.370 nan 8.150 nan 0.000 0.444 82 A N -0.383 122.378 122.820 -0.099 0.000 1.978 82 A HA 0.108 4.428 4.320 -0.000 0.000 0.220 82 A C 2.384 179.916 177.584 -0.086 0.000 1.170 82 A CA 2.299 54.270 52.037 -0.110 0.000 0.636 82 A CB -0.820 18.092 19.000 -0.147 0.000 0.810 82 A HN 1.080 nan 8.150 nan 0.000 0.448 83 A N -1.689 121.087 122.820 -0.072 0.000 1.975 83 A HA 0.011 4.331 4.320 -0.000 0.000 0.215 83 A C 2.043 179.599 177.584 -0.047 0.000 1.170 83 A CA 1.556 53.559 52.037 -0.056 0.000 0.656 83 A CB -0.307 18.665 19.000 -0.047 0.000 0.821 83 A HN 0.454 nan 8.150 nan 0.000 0.449 84 Q N -0.240 119.529 119.800 -0.051 0.000 2.291 84 Q HA 0.003 4.343 4.340 -0.000 0.000 0.205 84 Q C 1.754 177.729 176.000 -0.040 0.000 0.970 84 Q CA 1.124 56.901 55.803 -0.044 0.000 0.876 84 Q CB -0.215 28.492 28.738 -0.052 0.000 0.935 84 Q HN 0.575 nan 8.270 nan 0.000 0.455 85 R N -0.015 120.458 120.500 -0.045 0.000 2.555 85 R HA 0.118 4.458 4.340 -0.000 0.000 0.272 85 R C -0.292 175.986 176.300 -0.036 0.000 1.089 85 R CA 0.250 56.327 56.100 -0.039 0.000 1.126 85 R CB 0.209 30.483 30.300 -0.042 0.000 1.250 85 R HN 0.110 nan 8.270 nan 0.000 0.551 86 E N -1.530 118.650 120.200 -0.034 0.000 3.293 86 E HA 0.148 4.498 4.350 -0.000 0.000 0.174 86 E C 0.316 176.901 176.600 -0.024 0.000 0.958 86 E CA 0.218 56.600 56.400 -0.030 0.000 1.352 86 E CB 1.273 30.952 29.700 -0.035 0.000 1.066 86 E HN 0.450 nan 8.360 nan 0.000 0.448 87 G N 2.232 111.019 108.800 -0.021 0.000 5.155 87 G HA2 -0.386 3.574 3.960 -0.000 0.000 0.239 87 G HA3 -0.386 3.574 3.960 -0.000 0.000 0.239 87 G C 0.143 175.033 174.900 -0.017 0.000 1.409 87 G CA 0.109 45.200 45.100 -0.016 0.000 0.927 87 G HN 0.207 nan 8.290 nan 0.000 0.710 88 K N 3.288 123.678 120.400 -0.017 0.000 4.321 88 K HA -0.126 4.194 4.320 -0.000 0.000 0.255 88 K C 1.028 177.620 176.600 -0.014 0.000 0.855 88 K CA 1.545 57.823 56.287 -0.016 0.000 0.904 88 K CB -1.903 30.585 32.500 -0.021 0.000 1.921 88 K HN 1.228 nan 8.250 nan 0.000 0.419 89 T N -0.780 113.769 114.554 -0.008 0.000 2.916 89 T HA 0.207 4.557 4.350 -0.000 0.000 0.303 89 T C 0.645 175.344 174.700 -0.001 0.000 1.025 89 T CA -0.799 61.298 62.100 -0.005 0.000 1.142 89 T CB 0.806 69.674 68.868 0.001 0.000 0.947 89 T HN 0.454 nan 8.240 nan 0.000 0.544 90 C N 2.374 121.674 119.300 0.001 0.000 2.614 90 C HA 0.885 5.345 4.460 -0.000 0.000 0.320 90 C C 0.510 175.518 174.990 0.031 0.000 1.200 90 C CA -0.639 58.384 59.018 0.009 0.000 1.700 90 C CB 1.158 28.899 27.740 0.001 0.000 2.275 90 C HN 1.219 nan 8.230 nan 0.000 0.492 91 A N 1.780 124.624 122.820 0.040 0.000 2.330 91 A HA 0.824 5.144 4.320 -0.000 0.000 0.327 91 A C -1.205 176.451 177.584 0.119 0.000 1.155 91 A CA -0.230 51.843 52.037 0.061 0.000 0.803 91 A CB 0.650 19.659 19.000 0.015 0.000 1.208 91 A HN 0.802 nan 8.150 nan 0.000 0.477 92 F N 4.738 124.660 119.950 -0.047 0.000 2.434 92 F HA 0.453 4.980 4.527 -0.000 0.000 0.367 92 F C -0.573 175.204 175.800 -0.037 0.000 1.093 92 F CA -1.289 56.679 58.000 -0.054 0.000 1.085 92 F CB 0.900 39.869 39.000 -0.053 0.000 1.322 92 F HN 0.405 nan 8.300 nan 0.000 0.452 93 I N 4.091 124.418 120.570 -0.405 0.000 2.347 93 I HA 0.134 4.304 4.170 -0.000 0.000 0.294 93 I C -0.253 175.539 176.117 -0.542 0.000 1.090 93 I CA -0.033 61.054 61.300 -0.355 0.000 1.314 93 I CB 0.096 37.916 38.000 -0.299 0.000 1.423 93 I HN 0.489 nan 8.210 nan 0.000 0.503 94 D N 5.242 125.433 120.400 -0.348 0.000 2.381 94 D HA 0.606 5.246 4.640 -0.000 0.000 0.235 94 D C 0.363 176.556 176.300 -0.178 0.000 1.068 94 D CA -0.395 53.430 54.000 -0.292 0.000 0.832 94 D CB 1.796 42.655 40.800 0.098 0.000 1.101 94 D HN 0.591 nan 8.370 nan 0.000 0.515 95 A N 3.808 126.494 122.820 -0.224 0.000 2.456 95 A HA 0.121 4.441 4.320 -0.000 0.000 0.237 95 A C 1.498 178.860 177.584 -0.370 0.000 1.217 95 A CA -0.211 51.678 52.037 -0.247 0.000 0.962 95 A CB 0.189 19.182 19.000 -0.011 0.000 1.079 95 A HN 0.529 nan 8.150 nan 0.000 0.536 96 E N 0.124 120.192 120.200 -0.221 0.000 2.158 96 E HA -0.061 4.289 4.350 -0.000 0.000 0.191 96 E C -0.409 176.196 176.600 0.009 0.000 0.982 96 E CA 0.772 57.126 56.400 -0.076 0.000 0.823 96 E CB -0.331 29.389 29.700 0.034 0.000 0.766 96 E HN 0.794 nan 8.360 nan 0.000 0.468 97 H N -1.203 118.001 119.070 0.224 0.000 2.770 97 H HA -0.204 4.351 4.556 -0.000 0.000 0.309 97 H C 0.674 176.236 175.328 0.390 0.000 1.206 97 H CA 0.032 56.252 56.048 0.287 0.000 1.147 97 H CB -1.469 28.334 29.762 0.069 0.000 1.422 97 H HN 0.275 nan 8.280 nan 0.000 0.420 98 A N 0.679 123.783 122.820 0.473 0.000 2.984 98 A HA 0.494 4.814 4.320 -0.000 0.000 0.212 98 A C 0.937 178.679 177.584 0.264 0.000 2.164 98 A CA 0.134 52.359 52.037 0.313 0.000 0.982 98 A CB -0.105 19.009 19.000 0.189 0.000 1.352 98 A HN 0.811 nan 8.150 nan 0.000 0.491 99 L N 0.536 121.815 121.223 0.094 0.000 3.319 99 L HA -0.169 4.171 4.340 -0.000 0.000 0.534 99 L C -1.256 175.537 176.870 -0.128 0.000 1.001 99 L CA 0.666 55.414 54.840 -0.153 0.000 1.233 99 L CB -1.263 40.448 42.059 -0.579 0.000 1.030 99 L HN 0.547 nan 8.230 nan 0.000 0.588 100 D N 8.135 128.517 120.400 -0.030 0.000 2.380 100 D HA 0.362 5.002 4.640 -0.000 0.000 0.230 100 D C -1.362 174.925 176.300 -0.020 0.000 1.154 100 D CA -1.707 52.310 54.000 0.028 0.000 0.859 100 D CB 1.157 42.006 40.800 0.082 0.000 1.045 100 D HN 0.448 nan 8.370 nan 0.000 0.495 101 P HA -0.202 nan 4.420 nan 0.000 0.217 101 P C 1.544 178.826 177.300 -0.029 0.000 1.151 101 P CA 0.915 63.973 63.100 -0.069 0.000 0.849 101 P CB 0.397 32.096 31.700 -0.002 0.000 0.787 102 I N -1.460 119.126 120.570 0.026 0.000 2.233 102 I HA -0.209 3.961 4.170 -0.000 0.000 0.243 102 I C 2.742 178.898 176.117 0.065 0.000 1.093 102 I CA 1.231 62.556 61.300 0.042 0.000 1.380 102 I CB -1.953 36.084 38.000 0.062 0.000 1.067 102 I HN -0.065 nan 8.210 nan 0.000 0.413 103 Y N 2.217 122.493 120.300 -0.040 0.000 2.207 103 Y HA -0.266 4.284 4.550 -0.000 0.000 0.287 103 Y C 2.674 178.539 175.900 -0.059 0.000 1.156 103 Y CA 1.940 60.014 58.100 -0.043 0.000 1.182 103 Y CB 0.013 38.443 38.460 -0.050 0.000 0.979 103 Y HN 0.139 nan 8.280 nan 0.000 0.521 104 A N 0.504 123.246 122.820 -0.130 0.000 1.877 104 A HA -0.230 4.090 4.320 -0.000 0.000 0.216 104 A C 2.262 179.731 177.584 -0.191 0.000 1.186 104 A CA 1.816 53.717 52.037 -0.227 0.000 0.620 104 A CB -0.818 18.056 19.000 -0.210 0.000 0.822 104 A HN 0.545 nan 8.150 nan 0.000 0.443 105 R N -0.253 120.177 120.500 -0.117 0.000 2.091 105 R HA -0.140 4.199 4.340 -0.000 0.000 0.238 105 R C 1.973 178.221 176.300 -0.086 0.000 1.136 105 R CA 1.954 58.004 56.100 -0.084 0.000 0.959 105 R CB -0.184 30.090 30.300 -0.043 0.000 0.856 105 R HN 0.513 nan 8.270 nan 0.000 0.437 106 K N -0.139 120.205 120.400 -0.093 0.000 2.366 106 K HA -0.013 4.307 4.320 -0.000 0.000 0.198 106 K C 1.824 178.346 176.600 -0.129 0.000 1.044 106 K CA 0.543 56.783 56.287 -0.078 0.000 0.973 106 K CB 0.165 32.649 32.500 -0.027 0.000 0.767 106 K HN 0.199 nan 8.250 nan 0.000 0.475 107 L N -0.492 120.592 121.223 -0.232 0.000 2.240 107 L HA -0.000 4.340 4.340 -0.000 0.000 0.211 107 L C 0.973 177.760 176.870 -0.138 0.000 1.106 107 L CA 0.798 55.498 54.840 -0.233 0.000 0.793 107 L CB 0.107 41.947 42.059 -0.366 0.000 0.927 107 L HN 0.445 nan 8.230 nan 0.000 0.446 108 G N -0.066 108.661 108.800 -0.122 0.000 2.245 108 G HA2 -0.153 3.807 3.960 -0.000 0.000 0.130 108 G HA3 -0.153 3.807 3.960 -0.000 0.000 0.130 108 G C -0.321 174.527 174.900 -0.087 0.000 1.040 108 G CA -0.371 44.680 45.100 -0.082 0.000 0.713 108 G HN -0.001 nan 8.290 nan 0.000 0.488 109 V N 0.570 120.421 119.914 -0.106 0.000 2.439 109 V HA 0.453 4.573 4.120 -0.000 0.000 0.282 109 V C 0.369 176.412 176.094 -0.085 0.000 1.039 109 V CA -0.871 61.367 62.300 -0.104 0.000 0.913 109 V CB 1.850 33.589 31.823 -0.141 0.000 0.983 109 V HN 0.311 nan 8.190 nan 0.000 0.460 110 D N 4.056 124.416 120.400 -0.068 0.000 2.398 110 D HA 0.088 4.728 4.640 -0.000 0.000 0.250 110 D C 1.030 177.295 176.300 -0.059 0.000 1.287 110 D CA -0.071 53.898 54.000 -0.052 0.000 0.992 110 D CB 0.538 41.315 40.800 -0.039 0.000 1.071 110 D HN 0.296 nan 8.370 nan 0.000 0.514 111 I N 2.517 123.049 120.570 -0.065 0.000 2.252 111 I HA -0.224 3.946 4.170 -0.000 0.000 0.245 111 I C 1.404 177.495 176.117 -0.042 0.000 1.102 111 I CA 0.980 62.236 61.300 -0.073 0.000 1.385 111 I CB -0.740 37.215 38.000 -0.077 0.000 1.064 111 I HN 0.295 nan 8.210 nan 0.000 0.414 112 D N 0.363 120.748 120.400 -0.026 0.000 2.354 112 D HA -0.162 4.478 4.640 -0.000 0.000 0.216 112 D C 1.449 177.745 176.300 -0.006 0.000 0.970 112 D CA 0.813 54.807 54.000 -0.009 0.000 0.905 112 D CB -0.276 40.521 40.800 -0.005 0.000 0.903 112 D HN 0.291 nan 8.370 nan 0.000 0.508 113 N N 0.141 118.832 118.700 -0.015 0.000 2.416 113 N HA 0.082 4.822 4.740 -0.000 0.000 0.267 113 N C -1.040 174.463 175.510 -0.011 0.000 1.294 113 N CA -0.128 52.917 53.050 -0.009 0.000 0.891 113 N CB 0.634 39.114 38.487 -0.012 0.000 1.238 113 N HN 0.080 nan 8.380 nan 0.000 0.508 114 L N 1.878 123.093 121.223 -0.014 0.000 2.334 114 L HA 0.559 4.899 4.340 -0.000 0.000 0.276 114 L C -0.727 176.157 176.870 0.022 0.000 1.014 114 L CA -0.543 54.288 54.840 -0.014 0.000 0.815 114 L CB 2.038 44.058 42.059 -0.065 0.000 1.268 114 L HN 0.002 nan 8.230 nan 0.000 0.428 115 L N 4.474 125.725 121.223 0.047 0.000 2.282 115 L HA 0.469 4.809 4.340 -0.000 0.000 0.288 115 L C 0.003 176.957 176.870 0.140 0.000 1.033 115 L CA -0.658 54.228 54.840 0.077 0.000 0.807 115 L CB 1.386 43.481 42.059 0.059 0.000 1.209 115 L HN 0.657 nan 8.230 nan 0.000 0.423 116 C N 0.974 120.377 119.300 0.172 0.000 2.493 116 C HA 0.839 5.299 4.460 -0.000 0.000 0.326 116 C C 0.244 175.339 174.990 0.176 0.000 1.200 116 C CA -0.509 58.673 59.018 0.274 0.000 1.739 116 C CB 1.549 29.528 27.740 0.398 0.000 2.300 116 C HN 0.822 nan 8.230 nan 0.000 0.500 117 S N 3.666 119.445 115.700 0.131 0.000 2.594 117 S HA 0.397 4.867 4.470 -0.000 0.000 0.322 117 S C -0.525 174.121 174.600 0.076 0.000 1.085 117 S CA -0.330 57.901 58.200 0.052 0.000 1.116 117 S CB 1.000 64.179 63.200 -0.036 0.000 0.979 117 S HN 0.821 nan 8.310 nan 0.000 0.465 118 Q N 2.588 122.451 119.800 0.104 0.000 2.963 118 Q HA 0.259 4.599 4.340 -0.000 0.000 0.262 118 Q C -2.430 173.650 176.000 0.134 0.000 1.318 118 Q CA -1.711 54.180 55.803 0.147 0.000 1.089 118 Q CB -0.040 28.782 28.738 0.140 0.000 1.424 118 Q HN 0.446 nan 8.270 nan 0.000 0.560 119 P HA 0.030 nan 4.420 nan 0.000 0.272 119 P C 0.525 177.922 177.300 0.162 0.000 1.240 119 P CA -0.254 62.884 63.100 0.064 0.000 0.791 119 P CB 1.097 32.798 31.700 0.003 0.000 0.978 120 D N -0.894 119.556 120.400 0.082 0.000 2.305 120 D HA -0.008 4.632 4.640 -0.000 0.000 0.206 120 D C 0.109 176.404 176.300 -0.009 0.000 0.974 120 D CA 1.018 55.086 54.000 0.113 0.000 0.871 120 D CB 0.617 41.443 40.800 0.044 0.000 0.947 120 D HN 0.533 nan 8.370 nan 0.000 0.516 121 T N -5.421 109.056 114.554 -0.128 0.000 2.769 121 T HA 0.421 4.771 4.350 -0.000 0.000 0.306 121 T C 1.121 175.683 174.700 -0.230 0.000 1.400 121 T CA -0.205 61.710 62.100 -0.308 0.000 1.007 121 T CB 1.023 69.788 68.868 -0.171 0.000 1.392 121 T HN -0.193 nan 8.240 nan 0.000 0.500 122 G N 0.130 108.780 108.800 -0.251 0.000 2.408 122 G HA2 -0.060 3.900 3.960 -0.000 0.000 0.217 122 G HA3 -0.060 3.900 3.960 -0.000 0.000 0.217 122 G C 1.023 175.872 174.900 -0.086 0.000 1.150 122 G CA 1.039 46.058 45.100 -0.135 0.000 0.776 122 G HN 0.797 nan 8.290 nan 0.000 0.542 123 E N 0.081 120.231 120.200 -0.082 0.000 2.000 123 E HA -0.154 4.196 4.350 -0.000 0.000 0.199 123 E C 2.475 179.038 176.600 -0.062 0.000 1.011 123 E CA 1.447 57.818 56.400 -0.048 0.000 0.836 123 E CB -0.471 29.213 29.700 -0.026 0.000 0.778 123 E HN 0.532 nan 8.360 nan 0.000 0.462 124 Q N 0.063 119.818 119.800 -0.075 0.000 2.182 124 Q HA -0.334 4.006 4.340 -0.000 0.000 0.213 124 Q C 1.995 177.856 176.000 -0.232 0.000 1.000 124 Q CA 2.208 57.919 55.803 -0.153 0.000 0.889 124 Q CB -0.315 28.348 28.738 -0.125 0.000 0.932 124 Q HN 0.306 nan 8.270 nan 0.000 0.415 125 A N 0.890 123.618 122.820 -0.153 0.000 1.851 125 A HA -0.182 4.138 4.320 -0.000 0.000 0.216 125 A C 1.939 179.453 177.584 -0.117 0.000 1.195 125 A CA 1.501 53.457 52.037 -0.135 0.000 0.622 125 A CB -0.941 18.008 19.000 -0.085 0.000 0.831 125 A HN 0.511 nan 8.150 nan 0.000 0.444 126 L N -0.750 120.436 121.223 -0.063 0.000 2.786 126 L HA -0.077 4.263 4.340 -0.000 0.000 0.250 126 L C 1.735 178.592 176.870 -0.021 0.000 1.151 126 L CA 0.673 55.506 54.840 -0.012 0.000 0.910 126 L CB -0.286 41.786 42.059 0.022 0.000 1.082 126 L HN 0.574 nan 8.230 nan 0.000 0.433 127 E N -1.200 118.952 120.200 -0.080 0.000 2.441 127 E HA 0.079 4.429 4.350 -0.000 0.000 0.212 127 E C 2.017 178.550 176.600 -0.110 0.000 0.840 127 E CA -0.030 56.340 56.400 -0.051 0.000 1.143 127 E CB 0.467 30.168 29.700 0.002 0.000 1.153 127 E HN 0.383 nan 8.360 nan 0.000 0.539 128 I N 1.554 121.964 120.570 -0.265 0.000 2.286 128 I HA -0.251 3.919 4.170 -0.000 0.000 0.245 128 I C 2.622 178.676 176.117 -0.103 0.000 1.104 128 I CA 0.832 61.976 61.300 -0.260 0.000 1.397 128 I CB -0.286 37.513 38.000 -0.335 0.000 1.072 128 I HN 0.350 nan 8.210 nan 0.000 0.417 129 C N -0.508 118.732 119.300 -0.099 0.000 2.422 129 C HA -0.161 4.299 4.460 -0.000 0.000 0.279 129 C C 2.483 177.460 174.990 -0.020 0.000 1.305 129 C CA 0.519 59.495 59.018 -0.070 0.000 1.757 129 C CB -1.009 26.669 27.740 -0.103 0.000 1.962 129 C HN 0.505 nan 8.230 nan 0.000 0.499 130 D N 1.651 122.052 120.400 0.001 0.000 2.097 130 D HA -0.059 4.581 4.640 -0.000 0.000 0.197 130 D C 2.433 178.761 176.300 0.045 0.000 0.984 130 D CA 1.990 56.012 54.000 0.035 0.000 0.826 130 D CB -0.286 40.544 40.800 0.050 0.000 0.973 130 D HN 0.537 nan 8.370 nan 0.000 0.460 131 A N 0.540 123.395 122.820 0.058 0.000 1.978 131 A HA -0.116 4.204 4.320 -0.000 0.000 0.220 131 A C 2.535 180.154 177.584 0.059 0.000 1.170 131 A CA 0.956 53.046 52.037 0.088 0.000 0.636 131 A CB -0.660 18.436 19.000 0.160 0.000 0.810 131 A HN 0.348 nan 8.150 nan 0.000 0.448 132 L N -1.174 120.070 121.223 0.035 0.000 2.179 132 L HA -0.066 4.274 4.340 -0.000 0.000 0.208 132 L C 3.011 179.894 176.870 0.022 0.000 1.096 132 L CA 0.694 55.549 54.840 0.025 0.000 0.779 132 L CB -0.516 41.548 42.059 0.009 0.000 0.922 132 L HN 0.403 nan 8.230 nan 0.000 0.443 133 A N 0.463 123.297 122.820 0.023 0.000 1.908 133 A HA -0.218 4.102 4.320 -0.000 0.000 0.218 133 A C 2.419 180.020 177.584 0.029 0.000 1.181 133 A CA 1.550 53.603 52.037 0.026 0.000 0.627 133 A CB -0.445 18.576 19.000 0.034 0.000 0.818 133 A HN 0.319 nan 8.150 nan 0.000 0.445 134 R N -0.317 120.203 120.500 0.034 0.000 2.092 134 R HA -0.007 4.333 4.340 -0.000 0.000 0.231 134 R C 1.228 177.545 176.300 0.028 0.000 1.119 134 R CA 1.204 57.323 56.100 0.033 0.000 0.970 134 R CB -0.280 30.043 30.300 0.039 0.000 0.864 134 R HN 0.371 nan 8.270 nan 0.000 0.440 135 S N 0.368 116.085 115.700 0.029 0.000 2.967 135 S HA 0.107 4.577 4.470 -0.000 0.000 0.254 135 S C 1.112 175.724 174.600 0.019 0.000 1.089 135 S CA 0.385 58.600 58.200 0.025 0.000 1.183 135 S CB -0.052 63.166 63.200 0.030 0.000 0.848 135 S HN 0.663 nan 8.310 nan 0.000 0.477 136 G N 2.081 110.892 108.800 0.017 0.000 5.001 136 G HA2 -0.403 3.557 3.960 -0.000 0.000 0.306 136 G HA3 -0.403 3.557 3.960 -0.000 0.000 0.306 136 G C 0.577 175.483 174.900 0.010 0.000 1.491 136 G CA 0.240 45.348 45.100 0.013 0.000 1.324 136 G HN 1.047 nan 8.290 nan 0.000 0.829 137 A N 0.106 122.931 122.820 0.010 0.000 3.245 137 A HA 0.676 4.996 4.320 -0.000 0.000 0.282 137 A C -0.201 177.388 177.584 0.008 0.000 1.417 137 A CA 0.379 52.421 52.037 0.007 0.000 1.149 137 A CB 0.385 19.389 19.000 0.005 0.000 1.155 137 A HN 1.212 nan 8.150 nan 0.000 0.602 138 V N 1.273 121.192 119.914 0.008 0.000 2.447 138 V HA 0.205 4.325 4.120 -0.000 0.000 0.292 138 V C 0.020 176.116 176.094 0.003 0.000 1.021 138 V CA -0.470 61.834 62.300 0.007 0.000 0.850 138 V CB 1.552 33.381 31.823 0.011 0.000 1.005 138 V HN 0.735 nan 8.190 nan 0.000 0.426 139 D N 2.294 122.694 120.400 -0.001 0.000 2.202 139 D HA 0.055 4.695 4.640 -0.000 0.000 0.214 139 D C 0.433 176.729 176.300 -0.007 0.000 0.967 139 D CA 1.470 55.467 54.000 -0.004 0.000 0.871 139 D CB 1.240 42.035 40.800 -0.008 0.000 1.020 139 D HN 0.384 nan 8.370 nan 0.000 0.474 140 V N 1.226 121.134 119.914 -0.009 0.000 2.577 140 V HA 0.413 4.533 4.120 -0.000 0.000 0.303 140 V C -1.235 174.850 176.094 -0.015 0.000 1.042 140 V CA -0.713 61.579 62.300 -0.013 0.000 0.872 140 V CB 1.942 33.755 31.823 -0.016 0.000 0.998 140 V HN -0.081 nan 8.190 nan 0.000 0.423 141 I N 6.348 126.897 120.570 -0.035 0.000 2.412 141 I HA 0.559 4.729 4.170 -0.000 0.000 0.296 141 I C -0.760 175.289 176.117 -0.112 0.000 0.987 141 I CA -0.866 60.394 61.300 -0.066 0.000 1.180 141 I CB 2.077 40.023 38.000 -0.090 0.000 1.340 141 I HN 0.390 nan 8.210 nan 0.000 0.455 142 V N 6.909 126.755 119.914 -0.113 0.000 2.483 142 V HA 0.337 4.457 4.120 -0.000 0.000 0.297 142 V C -0.334 175.553 176.094 -0.345 0.000 1.027 142 V CA -0.624 61.581 62.300 -0.158 0.000 0.855 142 V CB 2.326 34.169 31.823 0.034 0.000 0.995 142 V HN 0.463 nan 8.190 nan 0.000 0.424 143 V N 1.798 121.447 119.914 -0.441 0.000 2.398 143 V HA 0.746 4.866 4.120 -0.000 0.000 0.286 143 V C -0.682 175.201 176.094 -0.353 0.000 1.026 143 V CA -0.517 61.491 62.300 -0.487 0.000 0.868 143 V CB 1.669 33.087 31.823 -0.676 0.000 0.982 143 V HN 0.849 nan 8.190 nan 0.000 0.443 144 D N 2.690 122.855 120.400 -0.391 0.000 2.336 144 D HA 0.560 5.200 4.640 -0.000 0.000 0.248 144 D C -0.729 175.460 176.300 -0.186 0.000 1.326 144 D CA 0.245 54.081 54.000 -0.274 0.000 0.973 144 D CB 1.784 42.334 40.800 -0.417 0.000 1.255 144 D HN 0.840 nan 8.370 nan 0.000 0.558 145 S N 2.077 117.731 115.700 -0.077 0.000 2.627 145 S HA 0.389 4.859 4.470 -0.000 0.000 0.283 145 S C 1.163 175.787 174.600 0.040 0.000 1.127 145 S CA -0.631 57.558 58.200 -0.018 0.000 0.863 145 S CB 1.373 64.581 63.200 0.013 0.000 1.121 145 S HN 0.056 nan 8.310 nan 0.000 0.479 146 V N 2.719 122.695 119.914 0.103 0.000 2.277 146 V HA -0.261 3.859 4.120 -0.000 0.000 0.253 146 V C 2.900 179.039 176.094 0.075 0.000 1.067 146 V CA 2.842 65.220 62.300 0.131 0.000 1.047 146 V CB -1.549 30.353 31.823 0.133 0.000 0.649 146 V HN 0.937 nan 8.190 nan 0.000 0.447 147 A N -0.411 122.445 122.820 0.061 0.000 1.933 147 A HA -0.025 4.295 4.320 -0.000 0.000 0.218 147 A C 2.215 179.833 177.584 0.057 0.000 1.175 147 A CA 1.953 54.019 52.037 0.049 0.000 0.628 147 A CB -0.584 18.441 19.000 0.041 0.000 0.814 147 A HN 0.672 nan 8.150 nan 0.000 0.444 148 A N -1.360 121.496 122.820 0.060 0.000 2.251 148 A HA 0.407 4.727 4.320 -0.000 0.000 0.209 148 A C 0.595 178.256 177.584 0.129 0.000 1.187 148 A CA 0.002 52.096 52.037 0.095 0.000 0.823 148 A CB -0.198 18.836 19.000 0.057 0.000 0.846 148 A HN 0.274 nan 8.150 nan 0.000 0.486 149 L N 2.664 123.930 121.223 0.071 0.000 2.416 149 L HA 0.112 4.451 4.340 -0.000 0.000 0.243 149 L C 0.848 177.721 176.870 0.004 0.000 1.373 149 L CA 0.458 55.319 54.840 0.036 0.000 1.227 149 L CB -1.284 40.800 42.059 0.042 0.000 1.428 149 L HN 0.358 nan 8.230 nan 0.000 0.425 150 T N -0.206 114.346 114.554 -0.003 0.000 2.761 150 T HA 0.403 4.753 4.350 -0.000 0.000 0.296 150 T C -2.313 172.313 174.700 -0.123 0.000 0.934 150 T CA -1.862 60.221 62.100 -0.029 0.000 1.091 150 T CB 0.514 69.410 68.868 0.046 0.000 0.896 150 T HN 0.102 nan 8.240 nan 0.000 0.515 151 P HA 0.034 nan 4.420 nan 0.000 0.266 151 P C 0.914 178.152 177.300 -0.103 0.000 1.186 151 P CA -0.287 62.766 63.100 -0.079 0.000 0.767 151 P CB 0.608 32.282 31.700 -0.044 0.000 0.820 152 K N 2.522 122.869 120.400 -0.088 0.000 2.152 152 K HA -0.211 4.109 4.320 -0.000 0.000 0.206 152 K C 1.767 178.337 176.600 -0.049 0.000 1.048 152 K CA 1.617 57.861 56.287 -0.072 0.000 0.933 152 K CB -0.474 32.006 32.500 -0.033 0.000 0.721 152 K HN 0.481 nan 8.250 nan 0.000 0.447 153 A N 1.484 124.280 122.820 -0.040 0.000 1.851 153 A HA -0.236 4.084 4.320 -0.000 0.000 0.216 153 A C 1.917 179.483 177.584 -0.030 0.000 1.195 153 A CA 1.842 53.861 52.037 -0.029 0.000 0.622 153 A CB -0.645 18.340 19.000 -0.026 0.000 0.831 153 A HN 0.440 nan 8.150 nan 0.000 0.444 154 E N -0.566 119.617 120.200 -0.028 0.000 2.085 154 E HA -0.191 4.159 4.350 -0.000 0.000 0.194 154 E C 1.951 178.532 176.600 -0.032 0.000 0.994 154 E CA 1.295 57.687 56.400 -0.013 0.000 0.801 154 E CB -0.299 29.403 29.700 0.003 0.000 0.743 154 E HN 0.715 nan 8.360 nan 0.000 0.453 155 I N 0.907 121.438 120.570 -0.064 0.000 2.113 155 I HA -0.268 3.902 4.170 -0.000 0.000 0.238 155 I C 2.283 178.323 176.117 -0.128 0.000 1.070 155 I CA 1.279 62.525 61.300 -0.090 0.000 1.332 155 I CB -0.297 37.624 38.000 -0.132 0.000 1.044 155 I HN 0.072 nan 8.210 nan 0.000 0.402 156 E N 0.385 120.525 120.200 -0.100 0.000 2.331 156 E HA -0.163 4.186 4.350 -0.000 0.000 0.199 156 E C 1.317 177.852 176.600 -0.108 0.000 1.008 156 E CA 0.793 57.133 56.400 -0.099 0.000 0.843 156 E CB -0.089 29.598 29.700 -0.021 0.000 0.761 156 E HN 0.704 nan 8.360 nan 0.000 0.507 157 G N 1.109 109.859 108.800 -0.083 0.000 2.134 157 G HA2 -0.243 3.717 3.960 -0.000 0.000 0.209 157 G HA3 -0.243 3.717 3.960 -0.000 0.000 0.209 157 G C -0.117 174.759 174.900 -0.040 0.000 0.993 157 G CA 0.232 45.288 45.100 -0.072 0.000 0.669 157 G HN 0.271 nan 8.290 nan 0.000 0.519 158 E N -0.989 119.194 120.200 -0.028 0.000 2.339 158 E HA 0.683 5.033 4.350 -0.000 0.000 0.262 158 E C 1.031 177.625 176.600 -0.010 0.000 0.934 158 E CA -1.237 55.154 56.400 -0.015 0.000 0.802 158 E CB 1.273 30.966 29.700 -0.012 0.000 1.275 158 E HN 0.395 nan 8.360 nan 0.000 0.427 159 I N 1.539 122.104 120.570 -0.008 0.000 2.818 159 I HA -0.256 3.914 4.170 -0.000 0.000 0.164 159 I C 0.686 176.791 176.117 -0.020 0.000 0.901 159 I CA 0.743 62.035 61.300 -0.014 0.000 2.707 159 I CB -0.670 37.315 38.000 -0.025 0.000 0.628 159 I HN 0.444 nan 8.210 nan 0.000 0.354 160 G N 4.482 113.276 108.800 -0.010 0.000 2.425 160 G HA2 0.360 4.320 3.960 -0.000 0.000 0.302 160 G HA3 0.360 4.320 3.960 -0.000 0.000 0.302 160 G C -0.068 174.675 174.900 -0.261 0.000 1.159 160 G CA -0.422 44.640 45.100 -0.063 0.000 0.865 160 G HN 0.747 nan 8.290 nan 0.000 0.515 161 D N -0.003 120.213 120.400 -0.307 0.000 2.970 161 D HA 0.040 4.680 4.640 -0.000 0.000 0.236 161 D C 2.234 178.306 176.300 -0.381 0.000 1.415 161 D CA 0.205 54.030 54.000 -0.291 0.000 1.279 161 D CB 0.587 41.299 40.800 -0.146 0.000 0.932 161 D HN 0.315 nan 8.370 nan 0.000 0.216 162 S N -0.720 114.854 115.700 -0.210 0.000 2.453 162 S HA -0.080 4.390 4.470 -0.000 0.000 0.231 162 S C -0.461 174.104 174.600 -0.060 0.000 1.005 162 S CA 0.617 58.740 58.200 -0.127 0.000 0.949 162 S CB -0.220 62.947 63.200 -0.054 0.000 0.774 162 S HN 0.264 nan 8.310 nan 0.000 0.510 163 H N -0.460 118.602 119.070 -0.013 0.000 3.631 163 H HA -0.116 4.440 4.556 -0.000 0.000 0.385 163 H C 0.330 175.651 175.328 -0.011 0.000 1.180 163 H CA 0.751 56.792 56.048 -0.013 0.000 1.265 163 H CB -1.850 27.905 29.762 -0.013 0.000 1.465 163 H HN 0.400 nan 8.280 nan 0.000 0.415 164 M N -0.235 119.425 119.600 0.100 0.000 2.302 164 M HA -0.207 4.273 4.480 -0.000 0.000 0.200 164 M C 1.095 177.413 176.300 0.030 0.000 0.366 164 M CA 1.514 56.843 55.300 0.049 0.000 0.440 164 M CB -1.182 31.443 32.600 0.041 0.000 1.475 164 M HN 0.746 nan 8.290 nan 0.000 0.905 165 G N -0.899 107.911 108.800 0.017 0.000 3.159 165 G HA2 0.324 4.284 3.960 -0.000 0.000 0.232 165 G HA3 0.324 4.284 3.960 -0.000 0.000 0.232 165 G C 1.012 175.902 174.900 -0.016 0.000 1.116 165 G CA -0.171 44.927 45.100 -0.003 0.000 0.767 165 G HN 0.519 nan 8.290 nan 0.000 0.547 166 L N 0.308 121.522 121.223 -0.015 0.000 2.270 166 L HA 0.147 4.487 4.340 -0.000 0.000 0.210 166 L C 3.061 179.916 176.870 -0.024 0.000 1.104 166 L CA 0.838 55.664 54.840 -0.023 0.000 0.804 166 L CB -0.019 42.025 42.059 -0.024 0.000 0.937 166 L HN 0.253 nan 8.230 nan 0.000 0.450 167 A N 0.198 123.008 122.820 -0.017 0.000 1.898 167 A HA 0.007 4.327 4.320 -0.000 0.000 0.214 167 A C 2.461 180.023 177.584 -0.036 0.000 1.183 167 A CA 1.156 53.180 52.037 -0.022 0.000 0.622 167 A CB -0.559 18.435 19.000 -0.010 0.000 0.824 167 A HN 0.308 nan 8.150 nan 0.000 0.444 168 A N -0.744 122.057 122.820 -0.032 0.000 2.186 168 A HA -0.107 4.213 4.320 -0.000 0.000 0.219 168 A C 2.141 179.692 177.584 -0.055 0.000 1.159 168 A CA 1.419 53.430 52.037 -0.044 0.000 0.680 168 A CB -0.357 18.626 19.000 -0.028 0.000 0.787 168 A HN 0.525 nan 8.150 nan 0.000 0.467 169 R N -2.076 118.395 120.500 -0.049 0.000 2.250 169 R HA 0.253 4.593 4.340 -0.000 0.000 0.194 169 R C 2.074 178.342 176.300 -0.054 0.000 0.927 169 R CA 0.539 56.609 56.100 -0.051 0.000 1.052 169 R CB -0.181 30.096 30.300 -0.040 0.000 1.055 169 R HN 0.634 nan 8.270 nan 0.000 0.537 170 M N 0.374 119.945 119.600 -0.049 0.000 2.229 170 M HA -0.133 4.347 4.480 -0.000 0.000 0.264 170 M C 1.621 177.883 176.300 -0.063 0.000 1.063 170 M CA 1.399 56.672 55.300 -0.046 0.000 1.114 170 M CB 0.158 32.735 32.600 -0.038 0.000 1.387 170 M HN 0.069 nan 8.290 nan 0.000 0.420 171 M N -0.378 119.172 119.600 -0.084 0.000 2.091 171 M HA -0.183 4.297 4.480 -0.000 0.000 0.259 171 M C 2.375 178.573 176.300 -0.169 0.000 1.076 171 M CA 1.728 56.948 55.300 -0.133 0.000 1.111 171 M CB -1.657 30.851 32.600 -0.154 0.000 1.291 171 M HN 0.328 nan 8.290 nan 0.000 0.417 172 S N -0.180 115.425 115.700 -0.159 0.000 2.444 172 S HA -0.229 4.241 4.470 -0.000 0.000 0.244 172 S C 1.632 176.148 174.600 -0.140 0.000 1.025 172 S CA 1.591 59.688 58.200 -0.172 0.000 0.995 172 S CB -0.073 63.061 63.200 -0.109 0.000 0.781 172 S HN 0.395 nan 8.310 nan 0.000 0.496 173 Q N 0.855 120.596 119.800 -0.099 0.000 1.447 173 Q HA 0.371 4.711 4.340 -0.000 0.000 0.583 173 Q C 1.655 177.624 176.000 -0.052 0.000 0.915 173 Q CA 1.303 57.070 55.803 -0.060 0.000 0.902 173 Q CB -0.551 28.163 28.738 -0.040 0.000 0.981 173 Q HN 0.395 nan 8.270 nan 0.000 0.359 174 A N 0.070 122.870 122.820 -0.033 0.000 2.150 174 A HA -0.021 4.299 4.320 -0.000 0.000 0.220 174 A C 1.193 178.770 177.584 -0.011 0.000 1.356 174 A CA 0.387 52.420 52.037 -0.006 0.000 1.145 174 A CB -0.736 18.272 19.000 0.013 0.000 0.826 174 A HN 0.512 nan 8.150 nan 0.000 0.524 175 M N -0.799 118.760 119.600 -0.068 0.000 2.412 175 M HA 0.153 4.633 4.480 -0.000 0.000 0.263 175 M C 1.978 178.295 176.300 0.028 0.000 1.122 175 M CA 1.147 56.373 55.300 -0.125 0.000 1.179 175 M CB -0.257 32.098 32.600 -0.408 0.000 1.335 175 M HN 0.368 nan 8.290 nan 0.000 0.465 176 R N 0.583 121.144 120.500 0.102 0.000 2.094 176 R HA -0.204 4.136 4.340 -0.000 0.000 0.239 176 R C 2.248 178.645 176.300 0.160 0.000 1.137 176 R CA 1.809 58.082 56.100 0.289 0.000 0.943 176 R CB -0.930 29.497 30.300 0.211 0.000 0.850 176 R HN 0.470 nan 8.270 nan 0.000 0.433 177 K N 0.520 120.976 120.400 0.095 0.000 2.113 177 K HA -0.123 4.197 4.320 -0.000 0.000 0.208 177 K C 2.204 178.851 176.600 0.079 0.000 1.047 177 K CA 1.169 57.500 56.287 0.072 0.000 0.928 177 K CB -0.100 32.432 32.500 0.053 0.000 0.716 177 K HN 0.124 nan 8.250 nan 0.000 0.446 178 L N -0.183 121.096 121.223 0.093 0.000 2.068 178 L HA -0.042 4.297 4.340 -0.000 0.000 0.204 178 L C 2.442 179.384 176.870 0.119 0.000 1.076 178 L CA 0.918 55.820 54.840 0.102 0.000 0.753 178 L CB -0.434 41.696 42.059 0.117 0.000 0.910 178 L HN 0.276 nan 8.230 nan 0.000 0.439 179 A N 0.059 122.980 122.820 0.168 0.000 1.985 179 A HA -0.274 4.046 4.320 -0.000 0.000 0.223 179 A C 2.165 179.800 177.584 0.085 0.000 1.189 179 A CA 2.290 54.427 52.037 0.167 0.000 0.658 179 A CB -1.177 17.966 19.000 0.237 0.000 0.820 179 A HN 0.523 nan 8.150 nan 0.000 0.464 180 G N -1.662 107.182 108.800 0.072 0.000 2.656 180 G HA2 -0.027 3.933 3.960 -0.000 0.000 0.211 180 G HA3 -0.027 3.933 3.960 -0.000 0.000 0.211 180 G C 1.117 176.041 174.900 0.040 0.000 1.137 180 G CA 0.538 45.664 45.100 0.043 0.000 0.802 180 G HN 0.637 nan 8.290 nan 0.000 0.527 181 N N -0.093 118.637 118.700 0.050 0.000 2.575 181 N HA 0.156 4.896 4.740 -0.000 0.000 0.192 181 N C 1.527 177.061 175.510 0.039 0.000 1.200 181 N CA 0.045 53.120 53.050 0.043 0.000 0.897 181 N CB 0.090 38.605 38.487 0.047 0.000 0.990 181 N HN 0.295 nan 8.380 nan 0.000 0.449 182 L N -0.583 120.665 121.223 0.041 0.000 2.515 182 L HA 0.149 4.489 4.340 -0.000 0.000 0.202 182 L C 1.606 178.491 176.870 0.025 0.000 1.056 182 L CA 0.226 55.088 54.840 0.036 0.000 0.847 182 L CB -0.092 41.996 42.059 0.050 0.000 1.131 182 L HN -0.116 nan 8.230 nan 0.000 0.484 183 K N 0.428 120.842 120.400 0.023 0.000 2.442 183 K HA -0.237 4.083 4.320 -0.000 0.000 0.199 183 K C 1.928 178.535 176.600 0.012 0.000 1.044 183 K CA 1.097 57.392 56.287 0.014 0.000 0.941 183 K CB -0.026 32.480 32.500 0.009 0.000 0.759 183 K HN 0.184 nan 8.250 nan 0.000 0.472 184 Q N 0.157 119.967 119.800 0.016 0.000 2.062 184 Q HA 0.000 4.340 4.340 -0.000 0.000 0.196 184 Q C 1.255 177.263 176.000 0.012 0.000 0.967 184 Q CA 1.725 57.537 55.803 0.014 0.000 0.832 184 Q CB 0.254 29.003 28.738 0.018 0.000 0.899 184 Q HN 0.057 nan 8.270 nan 0.000 0.442 185 S N 0.095 115.804 115.700 0.014 0.000 2.540 185 S HA 0.183 4.653 4.470 -0.000 0.000 0.218 185 S C 0.065 174.669 174.600 0.008 0.000 0.977 185 S CA 0.251 58.458 58.200 0.011 0.000 0.918 185 S CB 0.212 63.420 63.200 0.014 0.000 0.806 185 S HN 0.503 nan 8.310 nan 0.000 0.496 186 N N 1.609 120.313 118.700 0.008 0.000 2.713 186 N HA -0.130 4.610 4.740 -0.000 0.000 0.251 186 N C -0.804 174.709 175.510 0.005 0.000 1.117 186 N CA 0.920 53.973 53.050 0.005 0.000 0.770 186 N CB -1.868 36.619 38.487 0.000 0.000 1.137 186 N HN 0.321 nan 8.380 nan 0.000 0.566 187 T N 1.106 115.666 114.554 0.009 0.000 2.784 187 T HA 0.225 4.575 4.350 -0.000 0.000 0.291 187 T C 0.515 175.222 174.700 0.011 0.000 0.942 187 T CA -0.344 61.761 62.100 0.009 0.000 1.161 187 T CB 0.555 69.430 68.868 0.012 0.000 0.885 187 T HN 0.214 nan 8.240 nan 0.000 0.534 188 L N 5.938 127.163 121.223 0.004 0.000 2.265 188 L HA 0.581 4.921 4.340 -0.000 0.000 0.288 188 L C -0.846 176.024 176.870 -0.001 0.000 1.058 188 L CA -0.228 54.615 54.840 0.005 0.000 0.809 188 L CB 0.460 42.517 42.059 -0.003 0.000 1.179 188 L HN 0.592 nan 8.230 nan 0.000 0.429 189 L N 6.415 127.648 121.223 0.017 0.000 2.333 189 L HA 0.557 4.897 4.340 -0.000 0.000 0.280 189 L C -0.902 175.976 176.870 0.013 0.000 1.004 189 L CA -0.347 54.485 54.840 -0.013 0.000 0.820 189 L CB 1.476 43.551 42.059 0.027 0.000 1.247 189 L HN 0.651 nan 8.230 nan 0.000 0.416 190 I N 4.320 124.843 120.570 -0.079 0.000 2.382 190 I HA 0.304 4.474 4.170 -0.000 0.000 0.286 190 I C -0.961 175.084 176.117 -0.121 0.000 1.002 190 I CA -0.284 61.000 61.300 -0.027 0.000 1.135 190 I CB 1.338 39.328 38.000 -0.016 0.000 1.288 190 I HN 0.388 nan 8.210 nan 0.000 0.448 191 F N 7.111 127.050 119.950 -0.018 0.000 2.420 191 F HA 0.502 5.029 4.527 -0.000 0.000 0.342 191 F C 0.387 176.185 175.800 -0.004 0.000 1.113 191 F CA -0.695 57.292 58.000 -0.022 0.000 1.059 191 F CB 1.314 40.297 39.000 -0.028 0.000 1.128 191 F HN 0.215 nan 8.300 nan 0.000 0.475 192 I N 1.378 122.039 120.570 0.152 0.000 2.378 192 I HA 0.613 4.783 4.170 -0.000 0.000 0.291 192 I C -0.899 175.299 176.117 0.136 0.000 0.992 192 I CA -0.592 60.783 61.300 0.126 0.000 1.154 192 I CB 1.656 39.702 38.000 0.077 0.000 1.315 192 I HN 0.444 nan 8.210 nan 0.000 0.448 193 N N 3.908 122.698 118.700 0.150 0.000 2.697 193 N HA 0.500 5.240 4.740 -0.000 0.000 0.272 193 N C -1.396 174.187 175.510 0.122 0.000 1.381 193 N CA -0.501 52.634 53.050 0.143 0.000 0.797 193 N CB 2.220 40.808 38.487 0.168 0.000 1.523 193 N HN 0.738 nan 8.380 nan 0.000 0.518 212 G N 0.405 109.196 108.800 -0.016 0.000 2.681 212 G HA2 0.011 3.971 3.960 -0.000 0.000 0.210 212 G HA3 0.011 3.971 3.960 -0.000 0.000 0.210 212 G C 0.180 175.048 174.900 -0.053 0.000 3.399 212 G CA -0.197 44.877 45.100 -0.044 0.000 0.649 212 G HN 0.244 nan 8.290 nan 0.000 0.428 213 N N 0.490 119.176 118.700 -0.023 0.000 2.573 213 N HA -0.051 4.689 4.740 -0.000 0.000 0.187 213 N C 2.221 177.747 175.510 0.027 0.000 1.107 213 N CA 1.091 54.150 53.050 0.015 0.000 0.918 213 N CB 0.214 38.729 38.487 0.046 0.000 0.966 213 N HN 0.650 nan 8.380 nan 0.000 0.448 214 A N 1.141 123.925 122.820 -0.059 0.000 1.841 214 A HA -0.112 4.208 4.320 -0.000 0.000 0.214 214 A C 2.096 179.585 177.584 -0.158 0.000 1.195 214 A CA 0.650 52.606 52.037 -0.136 0.000 0.611 214 A CB -0.859 17.992 19.000 -0.249 0.000 0.835 214 A HN 0.309 nan 8.150 nan 0.000 0.443 215 L N 0.363 121.450 121.223 -0.226 0.000 2.137 215 L HA -0.243 4.097 4.340 -0.000 0.000 0.213 215 L C 2.305 179.101 176.870 -0.124 0.000 1.085 215 L CA 2.662 57.343 54.840 -0.265 0.000 0.760 215 L CB -0.520 41.297 42.059 -0.402 0.000 0.893 215 L HN 0.527 nan 8.230 nan 0.000 0.434 216 K N -1.262 119.091 120.400 -0.078 0.000 2.059 216 K HA -0.261 4.059 4.320 -0.000 0.000 0.212 216 K C 1.951 178.479 176.600 -0.120 0.000 1.050 216 K CA 2.312 58.526 56.287 -0.122 0.000 0.927 216 K CB -0.349 32.085 32.500 -0.110 0.000 0.714 216 K HN 0.381 nan 8.250 nan 0.000 0.447 217 F N -0.997 118.995 119.950 0.070 0.000 2.569 217 F HA 0.047 4.574 4.527 -0.000 0.000 0.295 217 F C 1.300 177.197 175.800 0.161 0.000 1.115 217 F CA 0.423 58.495 58.000 0.120 0.000 1.450 217 F CB 0.230 39.319 39.000 0.149 0.000 1.107 217 F HN 0.043 nan 8.300 nan 0.000 0.563 218 Y N -0.428 119.912 120.300 0.068 0.000 2.482 218 Y HA 0.361 4.911 4.550 -0.000 0.000 0.270 218 Y C 1.291 177.181 175.900 -0.017 0.000 1.152 218 Y CA -0.499 57.615 58.100 0.022 0.000 1.292 218 Y CB -0.131 38.328 38.460 -0.002 0.000 1.070 218 Y HN -0.139 nan 8.280 nan 0.000 0.528 219 A N 0.013 122.884 122.820 0.086 0.000 2.409 219 A HA 0.234 4.554 4.320 -0.000 0.000 0.262 219 A C 1.002 178.576 177.584 -0.017 0.000 1.113 219 A CA -0.119 51.924 52.037 0.009 0.000 0.790 219 A CB 0.409 19.371 19.000 -0.064 0.000 1.046 219 A HN 0.297 nan 8.150 nan 0.000 0.496 220 S N 0.769 116.465 115.700 -0.007 0.000 2.478 220 S HA 0.172 4.642 4.470 -0.000 0.000 0.222 220 S C 0.381 174.956 174.600 -0.042 0.000 1.008 220 S CA 0.443 58.630 58.200 -0.023 0.000 0.928 220 S CB 0.072 63.267 63.200 -0.008 0.000 0.781 220 S HN 0.561 nan 8.310 nan 0.000 0.518 221 V N 1.774 121.661 119.914 -0.045 0.000 2.851 221 V HA 0.464 4.584 4.120 -0.000 0.000 0.307 221 V C -1.109 174.934 176.094 -0.084 0.000 1.129 221 V CA -0.780 61.484 62.300 -0.061 0.000 0.932 221 V CB 2.290 34.092 31.823 -0.036 0.000 1.024 221 V HN 0.122 nan 8.190 nan 0.000 0.426 222 R N 4.516 124.941 120.500 -0.125 0.000 2.628 222 R HA 0.686 5.026 4.340 -0.000 0.000 0.288 222 R C -1.929 174.294 176.300 -0.129 0.000 0.980 222 R CA -0.910 55.081 56.100 -0.182 0.000 0.891 222 R CB 2.308 32.413 30.300 -0.324 0.000 1.188 222 R HN 0.322 nan 8.270 nan 0.000 0.450 223 L N 1.949 123.129 121.223 -0.071 0.000 2.362 223 L HA 0.312 4.652 4.340 -0.000 0.000 0.275 223 L C -0.346 176.670 176.870 0.244 0.000 0.998 223 L CA -0.536 54.340 54.840 0.060 0.000 0.820 223 L CB 1.617 43.724 42.059 0.080 0.000 1.270 223 L HN 0.545 nan 8.230 nan 0.000 0.415 224 D N 3.443 124.001 120.400 0.265 0.000 2.505 224 D HA 0.256 4.896 4.640 -0.000 0.000 0.242 224 D C -0.076 176.296 176.300 0.120 0.000 1.136 224 D CA -0.156 54.019 54.000 0.290 0.000 0.954 224 D CB 0.271 41.223 40.800 0.253 0.000 1.002 224 D HN 0.414 nan 8.370 nan 0.000 0.512 225 I N 2.190 122.828 120.570 0.112 0.000 2.529 225 I HA 0.305 4.475 4.170 -0.000 0.000 0.284 225 I C -0.230 175.886 176.117 -0.002 0.000 1.082 225 I CA -0.264 61.075 61.300 0.064 0.000 1.406 225 I CB 0.304 38.360 38.000 0.093 0.000 1.405 225 I HN 0.183 nan 8.210 nan 0.000 0.548 226 R N 6.613 127.095 120.500 -0.028 0.000 2.566 226 R HA 0.357 4.697 4.340 -0.000 0.000 0.271 226 R C -1.190 175.073 176.300 -0.062 0.000 1.071 226 R CA -0.894 55.177 56.100 -0.048 0.000 0.915 226 R CB 1.402 31.671 30.300 -0.052 0.000 1.228 226 R HN 0.667 nan 8.270 nan 0.000 0.449 227 R N 4.356 124.825 120.500 -0.051 0.000 2.267 227 R HA 0.221 4.561 4.340 -0.000 0.000 0.319 227 R C 0.787 177.062 176.300 -0.043 0.000 1.067 227 R CA 0.145 56.214 56.100 -0.051 0.000 0.936 227 R CB 0.359 30.643 30.300 -0.027 0.000 1.006 227 R HN 0.673 nan 8.270 nan 0.000 0.452 228 I N 0.548 121.089 120.570 -0.050 0.000 4.338 228 I HA 0.493 4.663 4.170 -0.000 0.000 0.329 228 I C 0.338 176.439 176.117 -0.028 0.000 1.378 228 I CA -0.281 60.997 61.300 -0.037 0.000 1.170 228 I CB 1.296 39.273 38.000 -0.039 0.000 1.206 228 I HN 0.630 nan 8.210 nan 0.000 0.432 229 G N 1.257 110.041 108.800 -0.027 0.000 3.111 229 G HA2 0.838 4.798 3.960 -0.000 0.000 0.158 229 G HA3 0.838 4.798 3.960 -0.000 0.000 0.158 229 G C -1.406 173.489 174.900 -0.009 0.000 1.161 229 G CA -0.204 44.885 45.100 -0.018 0.000 1.025 229 G HN 0.724 nan 8.290 nan 0.000 0.619 230 A N -1.877 120.938 122.820 -0.009 0.000 2.592 230 A HA 0.568 4.888 4.320 -0.000 0.000 0.300 230 A C -1.743 175.832 177.584 -0.015 0.000 0.994 230 A CA -0.176 51.857 52.037 -0.006 0.000 0.707 230 A CB 0.698 19.690 19.000 -0.013 0.000 1.273 230 A HN 1.577 nan 8.150 nan 0.000 0.413 231 V N 1.925 121.827 119.914 -0.020 0.000 2.555 231 V HA 0.601 4.721 4.120 -0.000 0.000 0.302 231 V C -0.040 176.026 176.094 -0.047 0.000 1.038 231 V CA -0.612 61.675 62.300 -0.022 0.000 0.887 231 V CB 1.781 33.603 31.823 -0.002 0.000 0.991 231 V HN 0.869 nan 8.190 nan 0.000 0.434 232 K N 2.418 122.795 120.400 -0.039 0.000 2.208 232 K HA 0.604 4.924 4.320 -0.000 0.000 0.247 232 K C -0.534 176.042 176.600 -0.039 0.000 0.953 232 K CA -0.686 55.572 56.287 -0.048 0.000 0.837 232 K CB 2.256 34.733 32.500 -0.040 0.000 1.131 232 K HN 0.611 nan 8.250 nan 0.000 0.431 233 E N 1.247 121.421 120.200 -0.044 0.000 2.698 233 E HA 0.135 4.485 4.350 -0.000 0.000 0.242 233 E C 0.426 177.007 176.600 -0.031 0.000 1.243 233 E CA -0.161 56.218 56.400 -0.035 0.000 1.483 233 E CB 0.395 30.073 29.700 -0.036 0.000 1.495 233 E HN 0.954 nan 8.360 nan 0.000 0.440 234 G N 1.944 110.728 108.800 -0.027 0.000 4.148 234 G HA2 -0.345 3.615 3.960 -0.000 0.000 0.221 234 G HA3 -0.345 3.615 3.960 -0.000 0.000 0.221 234 G C 0.842 175.726 174.900 -0.026 0.000 1.373 234 G CA 0.235 45.322 45.100 -0.023 0.000 0.940 234 G HN 0.446 nan 8.290 nan 0.000 0.610 235 E N 1.889 122.071 120.200 -0.030 0.000 2.812 235 E HA 0.279 4.629 4.350 -0.000 0.000 0.211 235 E C -0.024 176.551 176.600 -0.043 0.000 0.986 235 E CA -0.023 56.358 56.400 -0.032 0.000 1.119 235 E CB 0.219 29.904 29.700 -0.025 0.000 1.046 235 E HN 0.668 nan 8.360 nan 0.000 0.474 236 N N -1.138 117.528 118.700 -0.056 0.000 2.525 236 N HA 0.119 4.859 4.740 -0.000 0.000 0.270 236 N C 1.009 176.449 175.510 -0.116 0.000 1.321 236 N CA -0.371 52.631 53.050 -0.081 0.000 0.797 236 N CB 2.395 40.833 38.487 -0.081 0.000 1.529 236 N HN -0.180 nan 8.380 nan 0.000 0.491 237 V N -1.048 118.765 119.914 -0.167 0.000 2.244 237 V HA -0.127 3.993 4.120 -0.000 0.000 0.244 237 V C 1.813 177.693 176.094 -0.358 0.000 1.042 237 V CA 1.405 63.555 62.300 -0.250 0.000 1.006 237 V CB -0.966 30.680 31.823 -0.294 0.000 0.641 237 V HN 0.582 nan 8.190 nan 0.000 0.446 238 V N 1.277 120.905 119.914 -0.477 0.000 2.045 238 V HA -0.357 3.763 4.120 -0.000 0.000 0.178 238 V C 1.352 177.255 176.094 -0.317 0.000 0.952 238 V CA 2.095 64.113 62.300 -0.469 0.000 1.254 238 V CB -1.430 30.282 31.823 -0.184 0.000 1.417 238 V HN 1.103 nan 8.190 nan 0.000 0.581 239 G N -2.348 106.334 108.800 -0.197 0.000 2.552 239 G HA2 0.608 4.568 3.960 -0.000 0.000 0.318 239 G HA3 0.608 4.568 3.960 -0.000 0.000 0.318 239 G C -0.650 174.297 174.900 0.078 0.000 1.240 239 G CA 0.359 45.454 45.100 -0.008 0.000 1.002 239 G HN 0.579 nan 8.290 nan 0.000 0.493 240 S N -0.324 115.437 115.700 0.102 0.000 2.417 240 S HA 0.144 4.614 4.470 -0.000 0.000 0.189 240 S C -0.726 173.876 174.600 0.003 0.000 1.005 240 S CA -0.664 57.587 58.200 0.086 0.000 1.116 240 S CB 1.219 64.508 63.200 0.148 0.000 1.343 240 S HN 0.739 nan 8.310 nan 0.000 0.406 241 E N 2.247 122.434 120.200 -0.023 0.000 2.406 241 E HA 0.246 4.596 4.350 -0.000 0.000 0.258 241 E C -0.336 176.179 176.600 -0.142 0.000 1.043 241 E CA 0.627 56.984 56.400 -0.071 0.000 0.929 241 E CB 0.347 30.022 29.700 -0.041 0.000 0.969 241 E HN 0.390 nan 8.360 nan 0.000 0.462 242 T N 5.585 119.958 114.554 -0.301 0.000 2.885 242 T HA 0.486 4.836 4.350 -0.000 0.000 0.285 242 T C -0.553 173.874 174.700 -0.456 0.000 1.019 242 T CA -0.840 61.007 62.100 -0.421 0.000 1.010 242 T CB 1.248 69.740 68.868 -0.627 0.000 1.022 242 T HN 0.274 nan 8.240 nan 0.000 0.466 243 R N 2.364 122.711 120.500 -0.255 0.000 2.473 243 R HA 0.543 4.883 4.340 -0.000 0.000 0.303 243 R C -1.976 174.308 176.300 -0.026 0.000 1.002 243 R CA -0.401 55.632 56.100 -0.111 0.000 0.884 243 R CB 1.303 31.571 30.300 -0.055 0.000 1.173 243 R HN 0.484 nan 8.270 nan 0.000 0.464 244 V N 4.887 124.842 119.914 0.068 0.000 2.417 244 V HA 0.402 4.522 4.120 -0.000 0.000 0.291 244 V C -0.044 176.118 176.094 0.112 0.000 1.024 244 V CA -0.708 61.671 62.300 0.132 0.000 0.861 244 V CB 1.920 33.899 31.823 0.260 0.000 0.985 244 V HN 0.559 nan 8.190 nan 0.000 0.436 245 K N 3.498 123.953 120.400 0.093 0.000 2.221 245 K HA 0.649 4.969 4.320 -0.000 0.000 0.258 245 K C -1.130 175.500 176.600 0.050 0.000 0.944 245 K CA -0.584 55.746 56.287 0.071 0.000 0.823 245 K CB 1.947 34.486 32.500 0.065 0.000 1.113 245 K HN 0.458 nan 8.250 nan 0.000 0.431 246 V N 5.803 125.729 119.914 0.019 0.000 2.353 246 V HA 0.042 4.161 4.120 -0.000 0.000 0.264 246 V C 0.865 176.894 176.094 -0.109 0.000 1.049 246 V CA -0.211 62.073 62.300 -0.026 0.000 0.896 246 V CB 1.018 32.834 31.823 -0.011 0.000 1.025 246 V HN 0.724 nan 8.190 nan 0.000 0.475 247 V N 3.825 123.651 119.914 -0.147 0.000 2.492 247 V HA 0.157 4.277 4.120 -0.000 0.000 0.241 247 V C 0.903 176.814 176.094 -0.305 0.000 1.041 247 V CA 0.670 62.812 62.300 -0.264 0.000 1.057 247 V CB -0.155 31.544 31.823 -0.207 0.000 0.711 247 V HN 0.699 nan 8.190 nan 0.000 0.468 248 K N 1.546 121.809 120.400 -0.228 0.000 2.358 248 K HA 0.461 4.781 4.320 -0.000 0.000 0.260 248 K C -1.056 175.468 176.600 -0.127 0.000 0.956 248 K CA -0.325 55.843 56.287 -0.198 0.000 0.834 248 K CB 0.917 33.286 32.500 -0.218 0.000 1.102 248 K HN 0.194 nan 8.250 nan 0.000 0.431 249 N N 3.302 121.944 118.700 -0.096 0.000 2.594 249 N HA 0.182 4.922 4.740 -0.000 0.000 0.280 249 N C -0.928 174.564 175.510 -0.030 0.000 1.156 249 N CA -0.365 52.655 53.050 -0.051 0.000 0.831 249 N CB 1.152 39.620 38.487 -0.032 0.000 1.379 249 N HN 0.536 nan 8.380 nan 0.000 0.536 250 K N 2.163 122.547 120.400 -0.028 0.000 2.358 250 K HA 0.256 4.576 4.320 -0.000 0.000 0.197 250 K C 0.827 177.422 176.600 -0.008 0.000 1.025 250 K CA 0.083 56.361 56.287 -0.014 0.000 1.104 250 K CB 0.691 33.181 32.500 -0.017 0.000 0.855 250 K HN 0.378 nan 8.250 nan 0.000 0.531 251 I N 0.291 120.855 120.570 -0.010 0.000 2.731 251 I HA -0.032 4.138 4.170 -0.000 0.000 0.260 251 I C 1.133 177.249 176.117 -0.001 0.000 1.138 251 I CA 0.578 61.874 61.300 -0.007 0.000 1.461 251 I CB 0.406 38.400 38.000 -0.010 0.000 1.128 251 I HN 0.055 nan 8.210 nan 0.000 0.438 252 A N -0.556 122.265 122.820 0.002 0.000 2.770 252 A HA 0.872 5.192 4.320 -0.000 0.000 0.183 252 A C -0.550 177.048 177.584 0.022 0.000 1.077 252 A CA 0.239 52.282 52.037 0.011 0.000 1.468 252 A CB -0.482 18.525 19.000 0.010 0.000 2.037 252 A HN 0.016 nan 8.150 nan 0.000 0.730 253 A N 0.884 123.723 122.820 0.032 0.000 2.303 253 A HA 0.746 5.066 4.320 -0.000 0.000 0.320 253 A C -2.742 174.882 177.584 0.066 0.000 1.192 253 A CA -1.540 50.530 52.037 0.055 0.000 0.821 253 A CB 0.268 19.303 19.000 0.059 0.000 1.188 253 A HN 0.320 nan 8.150 nan 0.000 0.492 254 P HA 0.542 nan 4.420 nan 0.000 0.293 254 P C 0.170 177.584 177.300 0.189 0.000 1.298 254 P CA -0.210 62.925 63.100 0.058 0.000 0.757 254 P CB 0.083 31.781 31.700 -0.004 0.000 1.262 255 F N -4.543 115.411 119.950 0.007 0.000 2.666 255 F HA -0.250 4.277 4.527 -0.000 0.000 0.458 255 F C 0.702 176.514 175.800 0.021 0.000 0.561 255 F CA 1.216 59.224 58.000 0.014 0.000 1.129 255 F CB -1.571 37.436 39.000 0.012 0.000 1.751 255 F HN 0.191 nan 8.300 nan 0.000 0.275 256 K N 1.828 122.324 120.400 0.160 0.000 2.249 256 K HA 0.375 4.695 4.320 -0.000 0.000 0.280 256 K C 0.332 176.984 176.600 0.087 0.000 1.033 256 K CA -0.279 56.075 56.287 0.113 0.000 0.946 256 K CB 0.955 33.506 32.500 0.085 0.000 1.005 256 K HN 0.367 nan 8.250 nan 0.000 0.469 257 Q N 0.783 120.635 119.800 0.088 0.000 2.351 257 Q HA 0.769 5.109 4.340 -0.000 0.000 0.273 257 Q C -1.467 174.587 176.000 0.091 0.000 1.077 257 Q CA -1.215 54.639 55.803 0.085 0.000 0.843 257 Q CB 2.128 30.915 28.738 0.081 0.000 1.367 257 Q HN 0.523 nan 8.270 nan 0.000 0.449 258 A N 1.595 124.483 122.820 0.113 0.000 2.486 258 A HA 0.569 4.889 4.320 -0.000 0.000 0.300 258 A C -1.414 176.296 177.584 0.209 0.000 1.048 258 A CA -0.785 51.338 52.037 0.144 0.000 0.696 258 A CB 1.785 20.867 19.000 0.136 0.000 1.278 258 A HN 0.794 nan 8.150 nan 0.000 0.405 259 E N 0.606 120.929 120.200 0.205 0.000 2.227 259 E HA 0.775 5.125 4.350 -0.000 0.000 0.268 259 E C -0.902 175.883 176.600 0.308 0.000 0.907 259 E CA -0.458 56.042 56.400 0.167 0.000 0.786 259 E CB 2.108 31.851 29.700 0.073 0.000 1.191 259 E HN 0.697 nan 8.360 nan 0.000 0.411 260 F N -1.399 118.578 119.950 0.046 0.000 3.461 260 F HA 0.449 4.976 4.527 -0.000 0.000 0.328 260 F C -1.587 174.245 175.800 0.053 0.000 1.160 260 F CA -1.064 56.966 58.000 0.051 0.000 0.879 260 F CB 1.176 40.209 39.000 0.055 0.000 1.559 260 F HN 0.202 nan 8.300 nan 0.000 0.510 261 Q N 0.761 120.732 119.800 0.286 0.000 2.423 261 Q HA 0.724 5.064 4.340 -0.000 0.000 0.278 261 Q C -1.697 174.450 176.000 0.245 0.000 1.097 261 Q CA -0.922 54.965 55.803 0.140 0.000 0.809 261 Q CB 3.507 32.323 28.738 0.131 0.000 1.391 261 Q HN 0.587 nan 8.270 nan 0.000 0.428 262 I N 2.132 122.795 120.570 0.156 0.000 2.466 262 I HA 0.321 4.491 4.170 -0.000 0.000 0.289 262 I C -1.314 174.930 176.117 0.212 0.000 1.026 262 I CA -0.833 60.589 61.300 0.202 0.000 1.078 262 I CB 1.589 39.695 38.000 0.176 0.000 1.249 262 I HN 0.273 nan 8.210 nan 0.000 0.429 263 L N 6.373 127.729 121.223 0.222 0.000 2.307 263 L HA 0.356 4.696 4.340 -0.000 0.000 0.284 263 L C -0.507 176.559 176.870 0.326 0.000 1.023 263 L CA -0.239 54.748 54.840 0.244 0.000 0.810 263 L CB 0.742 42.900 42.059 0.166 0.000 1.231 263 L HN 0.337 nan 8.230 nan 0.000 0.423 264 Y N 3.697 124.048 120.300 0.084 0.000 2.854 264 Y HA 0.185 4.735 4.550 -0.000 0.000 0.372 264 Y C 1.506 177.475 175.900 0.115 0.000 1.330 264 Y CA 0.707 58.847 58.100 0.067 0.000 1.765 264 Y CB -0.028 38.443 38.460 0.017 0.000 1.277 264 Y HN 0.874 nan 8.280 nan 0.000 0.498 265 G N 2.766 111.767 108.800 0.336 0.000 2.130 265 G HA2 -0.272 3.688 3.960 -0.000 0.000 0.216 265 G HA3 -0.272 3.688 3.960 -0.000 0.000 0.216 265 G C 0.301 175.351 174.900 0.249 0.000 0.999 265 G CA 0.332 45.640 45.100 0.347 0.000 0.686 265 G HN 0.663 nan 8.290 nan 0.000 0.515 266 E N -1.670 118.669 120.200 0.232 0.000 2.640 266 E HA 0.427 4.777 4.350 -0.000 0.000 0.197 266 E C 1.242 177.882 176.600 0.067 0.000 0.925 266 E CA 0.837 57.304 56.400 0.111 0.000 1.604 266 E CB 0.825 30.589 29.700 0.106 0.000 1.769 266 E HN 1.774 nan 8.360 nan 0.000 0.965 267 G N 1.363 110.236 108.800 0.121 0.000 2.698 267 G HA2 -0.238 3.722 3.960 -0.000 0.000 0.225 267 G HA3 -0.238 3.722 3.960 -0.000 0.000 0.225 267 G C -0.217 174.762 174.900 0.131 0.000 1.345 267 G CA -0.382 44.770 45.100 0.086 0.000 0.871 267 G HN 0.151 nan 8.290 nan 0.000 0.540 268 I N 0.484 121.131 120.570 0.129 0.000 2.880 268 I HA 0.012 4.182 4.170 -0.000 0.000 0.296 268 I C 0.719 176.929 176.117 0.156 0.000 1.220 268 I CA 0.388 61.788 61.300 0.167 0.000 1.435 268 I CB 0.349 38.380 38.000 0.051 0.000 1.339 268 I HN 0.488 nan 8.210 nan 0.000 0.583 269 N N 5.571 124.375 118.700 0.173 0.000 2.816 269 N HA 0.199 4.939 4.740 -0.000 0.000 0.236 269 N C 0.471 176.033 175.510 0.088 0.000 1.076 269 N CA -0.581 52.540 53.050 0.119 0.000 0.902 269 N CB 0.294 38.851 38.487 0.117 0.000 1.149 269 N HN 0.468 nan 8.380 nan 0.000 0.506 270 F N 1.223 121.103 119.950 -0.116 0.000 2.407 270 F HA 0.076 4.603 4.527 -0.000 0.000 0.299 270 F C 0.720 176.430 175.800 -0.150 0.000 1.097 270 F CA 0.408 58.300 58.000 -0.181 0.000 1.422 270 F CB -0.314 38.523 39.000 -0.270 0.000 1.067 270 F HN 0.208 nan 8.300 nan 0.000 0.539 271 Y N 1.944 121.953 120.300 -0.486 0.000 2.200 271 Y HA 0.046 4.596 4.550 -0.000 0.000 0.290 271 Y C 2.800 178.609 175.900 -0.152 0.000 1.137 271 Y CA 0.975 58.854 58.100 -0.368 0.000 1.163 271 Y CB -1.252 36.966 38.460 -0.404 0.000 0.988 271 Y HN 0.189 nan 8.280 nan 0.000 0.518 272 G N 0.503 109.339 108.800 0.060 0.000 2.491 272 G HA2 -0.328 3.632 3.960 -0.000 0.000 0.218 272 G HA3 -0.328 3.632 3.960 -0.000 0.000 0.218 272 G C 1.460 176.396 174.900 0.060 0.000 1.180 272 G CA 1.412 46.543 45.100 0.051 0.000 0.774 272 G HN 0.602 nan 8.290 nan 0.000 0.562 273 E N 0.001 120.253 120.200 0.088 0.000 2.274 273 E HA 0.032 4.381 4.350 -0.000 0.000 0.194 273 E C 2.341 178.993 176.600 0.087 0.000 0.996 273 E CA 0.394 56.855 56.400 0.102 0.000 0.840 273 E CB -0.238 29.538 29.700 0.127 0.000 0.772 273 E HN 0.344 nan 8.360 nan 0.000 0.491 274 L N 1.715 122.983 121.223 0.076 0.000 1.994 274 L HA -0.164 4.176 4.340 -0.000 0.000 0.208 274 L C 2.340 179.257 176.870 0.080 0.000 1.071 274 L CA 1.408 56.296 54.840 0.080 0.000 0.745 274 L CB -0.608 41.492 42.059 0.068 0.000 0.892 274 L HN 0.049 nan 8.230 nan 0.000 0.431 275 V N 0.201 120.150 119.914 0.058 0.000 2.231 275 V HA -0.401 3.719 4.120 -0.000 0.000 0.250 275 V C 2.341 178.497 176.094 0.103 0.000 1.058 275 V CA 2.231 64.560 62.300 0.049 0.000 1.022 275 V CB -1.027 30.753 31.823 -0.070 0.000 0.640 275 V HN 0.464 nan 8.190 nan 0.000 0.445 276 D N -0.252 120.204 120.400 0.093 0.000 2.190 276 D HA -0.146 4.494 4.640 -0.000 0.000 0.200 276 D C 1.897 178.266 176.300 0.115 0.000 0.992 276 D CA 1.152 55.223 54.000 0.119 0.000 0.854 276 D CB -0.190 40.672 40.800 0.102 0.000 0.936 276 D HN 0.279 nan 8.370 nan 0.000 0.462 277 L N 0.221 121.506 121.223 0.102 0.000 2.131 277 L HA 0.095 4.435 4.340 -0.000 0.000 0.206 277 L C 2.553 179.484 176.870 0.102 0.000 1.087 277 L CA 1.182 56.078 54.840 0.094 0.000 0.767 277 L CB -1.226 40.883 42.059 0.083 0.000 0.917 277 L HN 0.027 nan 8.230 nan 0.000 0.441 278 G N -1.205 107.665 108.800 0.117 0.000 2.443 278 G HA2 -0.121 3.839 3.960 -0.000 0.000 0.219 278 G HA3 -0.121 3.839 3.960 -0.000 0.000 0.219 278 G C 1.658 176.645 174.900 0.145 0.000 1.131 278 G CA 0.877 46.058 45.100 0.135 0.000 0.775 278 G HN 0.233 nan 8.290 nan 0.000 0.547 279 V N 0.672 120.678 119.914 0.154 0.000 2.237 279 V HA -0.144 3.976 4.120 -0.000 0.000 0.245 279 V C 2.698 178.852 176.094 0.101 0.000 1.046 279 V CA 2.119 64.506 62.300 0.145 0.000 1.007 279 V CB -0.349 31.575 31.823 0.169 0.000 0.638 279 V HN 0.304 nan 8.190 nan 0.000 0.445 280 K N -0.260 120.195 120.400 0.091 0.000 2.283 280 K HA -0.106 4.214 4.320 -0.000 0.000 0.202 280 K C 1.030 177.670 176.600 0.066 0.000 1.048 280 K CA 0.856 57.186 56.287 0.071 0.000 0.948 280 K CB 0.083 32.623 32.500 0.067 0.000 0.742 280 K HN 0.399 nan 8.250 nan 0.000 0.458 281 E N 1.131 121.377 120.200 0.077 0.000 2.405 281 E HA 0.029 4.379 4.350 -0.000 0.000 0.214 281 E C 0.034 176.681 176.600 0.077 0.000 1.101 281 E CA -0.132 56.311 56.400 0.071 0.000 1.254 281 E CB 0.671 30.415 29.700 0.072 0.000 1.240 281 E HN 0.135 nan 8.360 nan 0.000 0.439 282 K N -0.999 119.446 120.400 0.074 0.000 6.581 282 K HA -0.293 4.027 4.320 -0.000 0.000 0.456 282 K C 1.649 178.306 176.600 0.094 0.000 0.402 282 K CA 1.586 57.915 56.287 0.070 0.000 1.893 282 K CB -1.912 30.620 32.500 0.052 0.000 0.843 282 K HN 0.264 nan 8.250 nan 0.000 0.751 283 L N 0.847 122.141 121.223 0.118 0.000 2.123 283 L HA -0.142 4.198 4.340 -0.000 0.000 0.217 283 L C 1.385 178.401 176.870 0.243 0.000 1.081 283 L CA 1.616 56.561 54.840 0.174 0.000 0.772 283 L CB -0.255 41.925 42.059 0.202 0.000 0.890 283 L HN 0.242 nan 8.230 nan 0.000 0.437 284 I N -0.884 119.818 120.570 0.220 0.000 2.412 284 I HA 0.175 4.345 4.170 -0.000 0.000 0.296 284 I C -0.137 176.082 176.117 0.170 0.000 0.987 284 I CA -0.389 61.060 61.300 0.249 0.000 1.180 284 I CB 1.646 39.806 38.000 0.267 0.000 1.340 284 I HN -0.035 nan 8.210 nan 0.000 0.455 285 E N 5.396 125.683 120.200 0.144 0.000 2.166 285 E HA 0.288 4.638 4.350 -0.000 0.000 0.275 285 E C -0.746 175.852 176.600 -0.003 0.000 0.941 285 E CA -0.838 55.599 56.400 0.062 0.000 0.784 285 E CB 1.931 31.656 29.700 0.042 0.000 1.115 285 E HN 0.293 nan 8.360 nan 0.000 0.399 286 K N 2.172 122.518 120.400 -0.091 0.000 2.268 286 K HA 0.355 4.675 4.320 -0.000 0.000 0.276 286 K C -0.762 175.743 176.600 -0.159 0.000 1.080 286 K CA -0.256 55.869 56.287 -0.270 0.000 0.910 286 K CB 0.813 33.127 32.500 -0.309 0.000 1.163 286 K HN 0.565 nan 8.250 nan 0.000 0.465 287 A N 3.826 126.570 122.820 -0.126 0.000 3.181 287 A HA 0.399 4.719 4.320 -0.000 0.000 0.293 287 A C 0.927 178.490 177.584 -0.035 0.000 1.346 287 A CA 0.297 52.304 52.037 -0.050 0.000 1.018 287 A CB -0.443 18.555 19.000 -0.004 0.000 1.093 287 A HN 1.082 nan 8.150 nan 0.000 0.629 288 G N 0.105 108.857 108.800 -0.080 0.000 5.347 288 G HA2 -0.164 3.795 3.960 -0.000 0.000 0.299 288 G HA3 -0.164 3.795 3.960 -0.000 0.000 0.299 288 G C 1.403 176.275 174.900 -0.045 0.000 1.492 288 G CA 0.867 45.940 45.100 -0.045 0.000 0.991 288 G HN 1.591 nan 8.290 nan 0.000 0.749 289 A N -1.089 121.756 122.820 0.042 0.000 1.969 289 A HA 0.524 4.844 4.320 -0.000 0.000 0.205 289 A C 0.744 178.405 177.584 0.129 0.000 1.364 289 A CA 0.862 52.951 52.037 0.087 0.000 0.756 289 A CB -0.099 18.981 19.000 0.133 0.000 0.988 289 A HN 0.691 nan 8.150 nan 0.000 0.490 290 W N 0.514 121.811 121.300 -0.005 0.000 2.446 290 W HA 0.449 5.109 4.660 -0.000 0.000 0.316 290 W C -0.554 175.970 176.519 0.008 0.000 1.376 290 W CA 0.307 57.672 57.345 0.032 0.000 1.300 290 W CB -0.267 29.191 29.460 -0.003 0.000 1.351 290 W HN 0.268 nan 8.180 nan 0.000 0.530 291 Y N 2.228 122.587 120.300 0.099 0.000 2.301 291 Y HA 0.347 4.897 4.550 -0.000 0.000 0.328 291 Y C 0.904 176.857 175.900 0.087 0.000 1.242 291 Y CA 0.315 58.458 58.100 0.072 0.000 1.323 291 Y CB 1.109 39.580 38.460 0.018 0.000 1.266 291 Y HN 0.171 nan 8.280 nan 0.000 0.527 292 S N 0.907 116.739 115.700 0.220 0.000 2.599 292 S HA 0.372 4.842 4.470 -0.000 0.000 0.294 292 S C -1.830 172.910 174.600 0.233 0.000 1.094 292 S CA -0.606 57.694 58.200 0.167 0.000 0.931 292 S CB 1.083 64.344 63.200 0.102 0.000 1.093 292 S HN 0.490 nan 8.310 nan 0.000 0.488 293 Y N 2.244 122.569 120.300 0.042 0.000 2.470 293 Y HA 0.406 4.956 4.550 -0.000 0.000 0.352 293 Y C -0.549 175.382 175.900 0.052 0.000 0.967 293 Y CA -0.794 57.345 58.100 0.065 0.000 1.121 293 Y CB -0.506 38.009 38.460 0.091 0.000 1.149 293 Y HN 0.793 nan 8.280 nan 0.000 0.641 294 K N 2.260 122.604 120.400 -0.093 0.000 4.868 294 K HA -0.200 4.120 4.320 -0.000 0.000 0.314 294 K C 1.074 177.619 176.600 -0.092 0.000 0.932 294 K CA 1.041 57.249 56.287 -0.132 0.000 0.998 294 K CB -1.212 31.151 32.500 -0.228 0.000 1.704 294 K HN 1.096 nan 8.250 nan 0.000 0.426 295 G N 0.806 109.583 108.800 -0.039 0.000 2.900 295 G HA2 -0.350 3.610 3.960 -0.000 0.000 0.223 295 G HA3 -0.350 3.610 3.960 -0.000 0.000 0.223 295 G C -0.091 174.805 174.900 -0.007 0.000 1.293 295 G CA 0.218 45.301 45.100 -0.027 0.000 0.792 295 G HN 0.483 nan 8.290 nan 0.000 0.527 296 E N 2.803 123.008 120.200 0.008 0.000 2.059 296 E HA 0.195 4.545 4.350 -0.000 0.000 0.262 296 E C 0.460 177.069 176.600 0.015 0.000 1.230 296 E CA 0.256 56.677 56.400 0.036 0.000 0.951 296 E CB 0.130 29.896 29.700 0.111 0.000 1.038 296 E HN 0.472 nan 8.360 nan 0.000 0.425 297 K N 2.934 123.335 120.400 0.002 0.000 2.401 297 K HA 0.053 4.373 4.320 -0.000 0.000 0.278 297 K C 1.499 178.004 176.600 -0.158 0.000 1.018 297 K CA 0.081 56.390 56.287 0.036 0.000 0.981 297 K CB 0.687 33.283 32.500 0.162 0.000 0.933 297 K HN 0.506 nan 8.250 nan 0.000 0.477 298 I N -1.630 118.801 120.570 -0.232 0.000 3.718 298 I HA 0.335 4.505 4.170 -0.000 0.000 0.297 298 I C 0.751 176.554 176.117 -0.524 0.000 1.220 298 I CA -0.171 60.706 61.300 -0.705 0.000 1.381 298 I CB 0.794 38.377 38.000 -0.695 0.000 1.238 298 I HN 0.607 nan 8.210 nan 0.000 0.448 299 G N 1.149 109.775 108.800 -0.291 0.000 2.328 299 G HA2 0.226 4.186 3.960 -0.000 0.000 0.295 299 G HA3 0.226 4.186 3.960 -0.000 0.000 0.295 299 G C -2.107 172.448 174.900 -0.574 0.000 1.413 299 G CA -0.616 44.236 45.100 -0.413 0.000 0.817 299 G HN 0.211 nan 8.290 nan 0.000 0.546 300 Q N 0.287 119.649 119.800 -0.732 0.000 2.347 300 Q HA 0.531 4.871 4.340 -0.000 0.000 0.262 300 Q C 0.538 176.361 176.000 -0.294 0.000 0.980 300 Q CA 0.580 55.937 55.803 -0.744 0.000 0.867 300 Q CB 0.905 29.081 28.738 -0.938 0.000 1.242 300 Q HN 2.324 nan 8.270 nan 0.000 0.453 301 G N 2.970 111.720 108.800 -0.083 0.000 2.698 301 G HA2 -0.266 3.694 3.960 -0.000 0.000 0.225 301 G HA3 -0.266 3.694 3.960 -0.000 0.000 0.225 301 G C -0.110 174.767 174.900 -0.039 0.000 1.345 301 G CA -0.027 45.090 45.100 0.029 0.000 0.871 301 G HN 0.668 nan 8.290 nan 0.000 0.540 302 K N -0.086 120.277 120.400 -0.062 0.000 2.361 302 K HA 0.364 4.684 4.320 -0.000 0.000 0.196 302 K C 2.764 179.260 176.600 -0.174 0.000 1.039 302 K CA 1.434 57.584 56.287 -0.228 0.000 1.001 302 K CB -0.285 32.157 32.500 -0.098 0.000 0.795 302 K HN 0.788 nan 8.250 nan 0.000 0.495 303 A N 1.431 124.184 122.820 -0.112 0.000 1.898 303 A HA -0.122 4.198 4.320 -0.000 0.000 0.216 303 A C 1.704 179.225 177.584 -0.106 0.000 1.181 303 A CA 1.374 53.356 52.037 -0.091 0.000 0.620 303 A CB -0.291 18.669 19.000 -0.068 0.000 0.819 303 A HN 0.269 nan 8.150 nan 0.000 0.442 304 N N -0.401 118.218 118.700 -0.135 0.000 2.405 304 N HA 0.106 4.846 4.740 -0.000 0.000 0.175 304 N C 1.773 177.215 175.510 -0.113 0.000 1.051 304 N CA 1.016 53.989 53.050 -0.128 0.000 0.899 304 N CB -0.157 38.224 38.487 -0.176 0.000 1.000 304 N HN 0.426 nan 8.380 nan 0.000 0.451 305 A N 0.419 123.126 122.820 -0.188 0.000 1.898 305 A HA -0.071 4.249 4.320 -0.000 0.000 0.216 305 A C 2.288 179.815 177.584 -0.095 0.000 1.181 305 A CA 1.655 53.575 52.037 -0.195 0.000 0.620 305 A CB -0.818 17.860 19.000 -0.536 0.000 0.819 305 A HN 0.205 nan 8.150 nan 0.000 0.442 306 T N 0.336 114.811 114.554 -0.133 0.000 2.737 306 T HA 0.040 4.390 4.350 -0.000 0.000 0.265 306 T C 2.131 176.757 174.700 -0.123 0.000 1.038 306 T CA 1.362 63.402 62.100 -0.100 0.000 1.144 306 T CB -0.427 68.393 68.868 -0.080 0.000 0.866 306 T HN 0.557 nan 8.240 nan 0.000 0.434 307 A N -0.286 122.478 122.820 -0.093 0.000 2.225 307 A HA -0.046 4.274 4.320 -0.000 0.000 0.215 307 A C 1.870 179.420 177.584 -0.058 0.000 1.164 307 A CA 0.926 52.907 52.037 -0.093 0.000 0.710 307 A CB -0.801 18.160 19.000 -0.065 0.000 0.780 307 A HN 0.740 nan 8.150 nan 0.000 0.473 308 W N -0.296 120.876 121.300 -0.214 0.000 2.580 308 W HA 0.152 4.812 4.660 -0.000 0.000 0.287 308 W C 1.284 177.655 176.519 -0.247 0.000 1.175 308 W CA 0.818 58.048 57.345 -0.193 0.000 1.409 308 W CB -0.181 29.192 29.460 -0.144 0.000 1.101 308 W HN 0.146 nan 8.180 nan 0.000 0.558 309 L N 1.437 122.446 121.223 -0.357 0.000 2.549 309 L HA -0.140 4.200 4.340 -0.000 0.000 0.230 309 L C 2.281 178.606 176.870 -0.909 0.000 1.162 309 L CA 1.084 55.546 54.840 -0.630 0.000 0.834 309 L CB -0.655 41.224 42.059 -0.299 0.000 0.947 309 L HN 0.001 nan 8.230 nan 0.000 0.452 310 K N -0.153 119.736 120.400 -0.852 0.000 2.076 310 K HA -0.110 4.210 4.320 -0.000 0.000 0.204 310 K C 1.476 177.768 176.600 -0.513 0.000 1.051 310 K CA 1.026 56.823 56.287 -0.816 0.000 0.949 310 K CB 0.167 32.343 32.500 -0.541 0.000 0.726 310 K HN 0.187 nan 8.250 nan 0.000 0.443 311 D N 0.522 120.648 120.400 -0.457 0.000 2.224 311 D HA -0.059 4.581 4.640 -0.000 0.000 0.205 311 D C 0.146 176.203 176.300 -0.405 0.000 0.965 311 D CA 0.847 54.635 54.000 -0.353 0.000 0.852 311 D CB 0.037 40.679 40.800 -0.263 0.000 0.947 311 D HN 0.122 nan 8.370 nan 0.000 0.494 312 N N 0.959 119.287 118.700 -0.620 0.000 2.699 312 N HA 0.123 4.863 4.740 -0.000 0.000 0.232 312 N C -1.947 173.330 175.510 -0.388 0.000 1.027 312 N CA -1.063 51.651 53.050 -0.561 0.000 0.920 312 N CB 2.355 40.279 38.487 -0.939 0.000 1.148 312 N HN -0.027 nan 8.380 nan 0.000 0.509 313 P HA -0.056 nan 4.420 nan 0.000 0.213 313 P C 0.980 178.237 177.300 -0.071 0.000 1.169 313 P CA 1.057 64.093 63.100 -0.108 0.000 0.885 313 P CB 0.564 32.227 31.700 -0.061 0.000 0.779 314 E N -0.432 119.728 120.200 -0.067 0.000 2.097 314 E HA -0.170 4.180 4.350 -0.000 0.000 0.196 314 E C 1.947 178.527 176.600 -0.033 0.000 1.000 314 E CA 2.100 58.480 56.400 -0.033 0.000 0.804 314 E CB -0.745 28.942 29.700 -0.020 0.000 0.740 314 E HN 0.406 nan 8.360 nan 0.000 0.454 315 T N -0.749 113.758 114.554 -0.078 0.000 2.867 315 T HA 0.002 4.352 4.350 -0.000 0.000 0.268 315 T C 2.013 176.656 174.700 -0.096 0.000 1.057 315 T CA 0.880 62.936 62.100 -0.075 0.000 1.136 315 T CB -0.131 68.670 68.868 -0.111 0.000 0.874 315 T HN 0.172 nan 8.240 nan 0.000 0.466 316 A N 2.450 125.207 122.820 -0.106 0.000 1.832 316 A HA -0.009 4.311 4.320 -0.000 0.000 0.214 316 A C 2.381 179.982 177.584 0.029 0.000 1.200 316 A CA 1.646 53.663 52.037 -0.034 0.000 0.610 316 A CB -0.800 18.225 19.000 0.041 0.000 0.842 316 A HN 0.482 nan 8.150 nan 0.000 0.444 317 K N -0.472 119.956 120.400 0.047 0.000 2.207 317 K HA -0.274 4.046 4.320 -0.000 0.000 0.208 317 K C 2.051 178.677 176.600 0.042 0.000 1.046 317 K CA 1.951 58.270 56.287 0.054 0.000 0.929 317 K CB -0.143 32.382 32.500 0.040 0.000 0.720 317 K HN 0.726 nan 8.250 nan 0.000 0.463 318 E N 0.580 120.803 120.200 0.037 0.000 2.028 318 E HA -0.172 4.178 4.350 -0.000 0.000 0.191 318 E C 1.909 178.548 176.600 0.064 0.000 0.988 318 E CA 1.226 57.657 56.400 0.053 0.000 0.799 318 E CB 0.011 29.753 29.700 0.069 0.000 0.755 318 E HN 0.257 nan 8.360 nan 0.000 0.447 319 I N 0.988 121.595 120.570 0.061 0.000 2.315 319 I HA -0.223 3.947 4.170 -0.000 0.000 0.248 319 I C 2.567 178.726 176.117 0.071 0.000 1.117 319 I CA 1.039 62.386 61.300 0.079 0.000 1.404 319 I CB -0.437 37.599 38.000 0.060 0.000 1.071 319 I HN 0.233 nan 8.210 nan 0.000 0.419 320 E N 1.874 122.113 120.200 0.065 0.000 2.082 320 E HA -0.365 3.985 4.350 -0.000 0.000 0.215 320 E C 2.209 178.834 176.600 0.042 0.000 1.048 320 E CA 2.181 58.618 56.400 0.063 0.000 0.869 320 E CB -0.070 29.671 29.700 0.070 0.000 0.773 320 E HN 0.332 nan 8.360 nan 0.000 0.466 321 K N 0.196 120.618 120.400 0.036 0.000 2.009 321 K HA -0.188 4.132 4.320 -0.000 0.000 0.210 321 K C 2.231 178.852 176.600 0.035 0.000 1.049 321 K CA 1.866 58.169 56.287 0.026 0.000 0.929 321 K CB -0.026 32.488 32.500 0.025 0.000 0.714 321 K HN 0.029 nan 8.250 nan 0.000 0.440 322 K N 0.122 120.552 120.400 0.050 0.000 2.281 322 K HA -0.129 4.191 4.320 -0.000 0.000 0.203 322 K C 1.843 178.475 176.600 0.052 0.000 1.046 322 K CA 1.185 57.505 56.287 0.055 0.000 0.938 322 K CB 0.075 32.621 32.500 0.075 0.000 0.737 322 K HN 0.041 nan 8.250 nan 0.000 0.458 323 V N 0.599 120.545 119.914 0.053 0.000 2.346 323 V HA -0.160 3.960 4.120 -0.000 0.000 0.244 323 V C 2.155 178.269 176.094 0.033 0.000 1.037 323 V CA 1.255 63.585 62.300 0.049 0.000 1.029 323 V CB -0.448 31.408 31.823 0.054 0.000 0.663 323 V HN 0.244 nan 8.190 nan 0.000 0.454 324 R N 0.271 120.785 120.500 0.023 0.000 2.113 324 R HA -0.246 4.094 4.340 -0.000 0.000 0.244 324 R C 2.268 178.575 176.300 0.012 0.000 1.142 324 R CA 2.214 58.320 56.100 0.009 0.000 0.953 324 R CB -0.326 29.973 30.300 -0.003 0.000 0.860 324 R HN 0.618 nan 8.270 nan 0.000 0.438 325 E N 0.142 120.352 120.200 0.017 0.000 2.347 325 E HA -0.096 4.254 4.350 -0.000 0.000 0.196 325 E C 1.512 178.124 176.600 0.020 0.000 1.008 325 E CA 0.480 56.890 56.400 0.016 0.000 0.852 325 E CB 0.119 29.829 29.700 0.018 0.000 0.783 325 E HN 0.314 nan 8.360 nan 0.000 0.505 326 L N 0.274 121.512 121.223 0.025 0.000 2.591 326 L HA 0.046 4.386 4.340 -0.000 0.000 0.228 326 L C 1.334 178.220 176.870 0.026 0.000 1.133 326 L CA 0.243 55.100 54.840 0.028 0.000 0.880 326 L CB 0.264 42.344 42.059 0.035 0.000 1.033 326 L HN 0.154 nan 8.230 nan 0.000 0.450 327 L N -2.553 118.684 121.223 0.023 0.000 2.678 327 L HA 0.157 4.497 4.340 -0.000 0.000 0.187 327 L C 0.482 177.362 176.870 0.017 0.000 1.073 327 L CA -0.418 54.435 54.840 0.022 0.000 0.883 327 L CB 0.002 42.076 42.059 0.025 0.000 1.501 327 L HN -0.111 nan 8.230 nan 0.000 0.488 1007 Q N 0.436 120.239 119.800 0.005 0.000 2.403 1007 Q HA 0.178 4.518 4.340 -0.000 0.000 0.203 1007 Q C -0.042 175.963 176.000 0.007 0.000 0.932 1007 Q CA 0.558 56.365 55.803 0.005 0.000 0.945 1007 Q CB 0.335 29.076 28.738 0.005 0.000 1.045 1007 Q HN 0.152 nan 8.270 nan 0.000 0.511 1008 K N -0.787 119.618 120.400 0.007 0.000 2.438 1008 K HA 0.272 4.592 4.320 -0.000 0.000 0.205 1008 K C 0.966 177.572 176.600 0.009 0.000 1.033 1008 K CA 0.024 56.316 56.287 0.008 0.000 1.089 1008 K CB 0.932 33.437 32.500 0.007 0.000 0.857 1008 K HN 0.020 nan 8.250 nan 0.000 0.522 1009 A N 0.708 123.534 122.820 0.009 0.000 2.067 1009 A HA -0.026 4.294 4.320 -0.000 0.000 0.217 1009 A C 1.802 179.394 177.584 0.014 0.000 1.156 1009 A CA 0.767 52.811 52.037 0.011 0.000 0.683 1009 A CB -0.004 19.002 19.000 0.009 0.000 0.808 1009 A HN 0.224 nan 8.150 nan 0.000 0.455 1010 L N -0.714 120.517 121.223 0.013 0.000 2.121 1010 L HA 0.284 4.624 4.340 -0.000 0.000 0.200 1010 L C 2.688 179.569 176.870 0.018 0.000 1.132 1010 L CA 1.662 56.512 54.840 0.016 0.000 0.782 1010 L CB -0.817 41.250 42.059 0.014 0.000 0.940 1010 L HN 0.236 nan 8.230 nan 0.000 0.458 1011 A N -0.280 122.550 122.820 0.016 0.000 1.997 1011 A HA -0.263 4.057 4.320 -0.000 0.000 0.221 1011 A C 2.280 179.874 177.584 0.017 0.000 1.172 1011 A CA 2.359 54.406 52.037 0.016 0.000 0.645 1011 A CB -1.275 17.733 19.000 0.013 0.000 0.813 1011 A HN 0.659 nan 8.150 nan 0.000 0.454 1012 A N -0.622 122.207 122.820 0.015 0.000 1.855 1012 A HA 0.355 4.675 4.320 -0.000 0.000 0.213 1012 A C 2.418 180.013 177.584 0.019 0.000 1.195 1012 A CA 1.537 53.582 52.037 0.015 0.000 0.610 1012 A CB -0.963 18.044 19.000 0.011 0.000 0.837 1012 A HN 1.141 nan 8.150 nan 0.000 0.444 1013 A N -0.691 122.142 122.820 0.021 0.000 2.172 1013 A HA 0.177 4.497 4.320 -0.000 0.000 0.216 1013 A C 2.002 179.609 177.584 0.037 0.000 1.154 1013 A CA 0.867 52.921 52.037 0.028 0.000 0.701 1013 A CB -0.455 18.561 19.000 0.027 0.000 0.789 1013 A HN 0.476 nan 8.150 nan 0.000 0.465 1014 L N -1.156 120.088 121.223 0.035 0.000 2.013 1014 L HA -0.015 4.325 4.340 -0.000 0.000 0.204 1014 L C 2.837 179.734 176.870 0.046 0.000 1.081 1014 L CA 1.090 55.955 54.840 0.042 0.000 0.751 1014 L CB -1.023 41.058 42.059 0.035 0.000 0.901 1014 L HN 0.439 nan 8.230 nan 0.000 0.440 1015 G N -0.899 107.922 108.800 0.035 0.000 2.581 1015 G HA2 -0.294 3.666 3.960 -0.000 0.000 0.223 1015 G HA3 -0.294 3.666 3.960 -0.000 0.000 0.223 1015 G C 1.447 176.366 174.900 0.031 0.000 1.094 1015 G CA 0.505 45.623 45.100 0.031 0.000 0.736 1015 G HN 0.367 nan 8.290 nan 0.000 0.588 1016 Q N -0.185 119.635 119.800 0.033 0.000 2.020 1016 Q HA -0.082 4.258 4.340 -0.000 0.000 0.202 1016 Q C 2.727 178.757 176.000 0.049 0.000 0.982 1016 Q CA 1.050 56.870 55.803 0.028 0.000 0.838 1016 Q CB -0.249 28.506 28.738 0.029 0.000 0.899 1016 Q HN 0.496 nan 8.270 nan 0.000 0.423 1017 I N 0.888 121.516 120.570 0.098 0.000 2.614 1017 I HA -0.149 4.021 4.170 -0.000 0.000 0.258 1017 I C 2.030 178.276 176.117 0.215 0.000 1.189 1017 I CA 0.970 62.392 61.300 0.202 0.000 1.462 1017 I CB -1.157 36.960 38.000 0.195 0.000 1.092 1017 I HN 0.219 nan 8.210 nan 0.000 0.442 1018 E N 1.363 121.634 120.200 0.119 0.000 2.015 1018 E HA -0.217 4.133 4.350 -0.000 0.000 0.191 1018 E C 2.155 178.796 176.600 0.068 0.000 0.991 1018 E CA 0.955 57.413 56.400 0.096 0.000 0.802 1018 E CB -0.103 29.634 29.700 0.060 0.000 0.759 1018 E HN 0.379 nan 8.360 nan 0.000 0.447 1019 K N 1.011 121.428 120.400 0.028 0.000 2.152 1019 K HA -0.219 4.101 4.320 -0.000 0.000 0.206 1019 K C 2.147 178.712 176.600 -0.057 0.000 1.048 1019 K CA 1.267 57.549 56.287 -0.008 0.000 0.933 1019 K CB -0.015 32.475 32.500 -0.017 0.000 0.721 1019 K HN 0.072 nan 8.250 nan 0.000 0.447 1020 Q N -1.047 118.692 119.800 -0.101 0.000 2.167 1020 Q HA -0.101 4.239 4.340 -0.000 0.000 0.202 1020 Q C 0.297 175.965 176.000 -0.553 0.000 0.970 1020 Q CA 1.215 56.814 55.803 -0.339 0.000 0.855 1020 Q CB 0.224 28.713 28.738 -0.415 0.000 0.911 1020 Q HN 0.240 nan 8.270 nan 0.000 0.438 1021 F N -0.655 119.296 119.950 0.003 0.000 2.764 1021 F HA 0.383 4.910 4.527 0.000 0.000 0.310 1021 F C 0.274 176.073 175.800 -0.002 0.000 1.124 1021 F CA 0.244 58.245 58.000 0.002 0.000 1.252 1021 F CB 1.358 40.361 39.000 0.006 0.000 1.010 1021 F HN 0.022 nan 8.300 nan 0.000 0.518 1022 G N 1.236 110.099 108.800 0.105 0.000 2.879 1022 G HA2 -0.205 3.755 3.960 -0.000 0.000 0.686 1022 G HA3 -0.205 3.755 3.960 -0.000 0.000 0.686 1022 G C -0.652 174.288 174.900 0.068 0.000 1.115 1022 G CA -1.276 43.864 45.100 0.067 0.000 0.770 1022 G HN 0.117 nan 8.290 nan 0.000 0.601 1023 K N 0.912 121.335 120.400 0.039 0.000 2.419 1023 K HA 0.519 4.839 4.320 -0.000 0.000 0.282 1023 K C 1.010 177.631 176.600 0.036 0.000 1.056 1023 K CA 1.493 57.800 56.287 0.034 0.000 1.035 1023 K CB 0.701 33.213 32.500 0.019 0.000 0.921 1023 K HN 2.276 nan 8.250 nan 0.000 0.472 1024 G N 2.450 111.277 108.800 0.044 0.000 2.905 1024 G HA2 -0.159 3.801 3.960 -0.000 0.000 0.245 1024 G HA3 -0.159 3.801 3.960 -0.000 0.000 0.245 1024 G C -0.001 174.929 174.900 0.050 0.000 1.004 1024 G CA -0.005 45.120 45.100 0.042 0.000 1.089 1024 G HN 0.672 nan 8.290 nan 0.000 0.456 1025 S N 0.576 116.313 115.700 0.061 0.000 3.051 1025 S HA 0.574 5.044 4.470 -0.000 0.000 0.250 1025 S C 0.049 174.680 174.600 0.051 0.000 0.906 1025 S CA 0.337 58.571 58.200 0.057 0.000 1.234 1025 S CB 0.168 63.406 63.200 0.062 0.000 1.175 1025 S HN 1.996 nan 8.310 nan 0.000 0.635 1026 I N 1.540 122.146 120.570 0.059 0.000 2.800 1026 I HA 0.608 4.778 4.170 -0.000 0.000 0.294 1026 I C -2.277 173.878 176.117 0.063 0.000 1.538 1026 I CA -0.943 60.394 61.300 0.061 0.000 1.010 1026 I CB 1.929 39.958 38.000 0.048 0.000 1.381 1026 I HN 0.378 nan 8.210 nan 0.000 0.462 1027 M N 4.427 124.069 119.600 0.070 0.000 2.790 1027 M HA 0.504 4.984 4.480 -0.000 0.000 0.272 1027 M C -1.668 174.669 176.300 0.062 0.000 1.168 1027 M CA -1.013 54.323 55.300 0.060 0.000 0.829 1027 M CB 1.914 34.546 32.600 0.054 0.000 1.675 1027 M HN 0.512 nan 8.290 nan 0.000 0.505 1028 R N 0.669 121.196 120.500 0.046 0.000 2.643 1028 R HA 0.347 4.687 4.340 -0.000 0.000 0.270 1028 R C 0.669 176.995 176.300 0.042 0.000 1.061 1028 R CA -0.151 55.971 56.100 0.036 0.000 1.107 1028 R CB 0.679 30.993 30.300 0.024 0.000 0.999 1028 R HN 0.624 nan 8.270 nan 0.000 0.460 1029 L N 1.147 122.392 121.223 0.037 0.000 2.068 1029 L HA 0.033 4.373 4.340 -0.000 0.000 0.204 1029 L C 1.599 178.490 176.870 0.035 0.000 1.076 1029 L CA 1.142 56.011 54.840 0.047 0.000 0.753 1029 L CB -0.227 41.855 42.059 0.038 0.000 0.910 1029 L HN 0.788 nan 8.230 nan 0.000 0.439 1030 G N 1.095 109.908 108.800 0.021 0.000 2.916 1030 G HA2 0.207 4.167 3.960 -0.000 0.000 0.280 1030 G HA3 0.207 4.167 3.960 -0.000 0.000 0.280 1030 G C -0.335 174.575 174.900 0.017 0.000 0.758 1030 G CA -0.015 45.095 45.100 0.016 0.000 1.993 1030 G HN 0.207 nan 8.290 nan 0.000 0.564 1031 E N 0.709 120.921 120.200 0.020 0.000 2.292 1031 E HA 0.170 4.520 4.350 -0.000 0.000 0.272 1031 E C -0.585 176.025 176.600 0.015 0.000 0.881 1031 E CA -0.619 55.791 56.400 0.018 0.000 0.754 1031 E CB 1.947 31.660 29.700 0.022 0.000 1.201 1031 E HN 0.245 nan 8.360 nan 0.000 0.425 1032 D N 0.874 121.281 120.400 0.012 0.000 2.340 1032 D HA 0.010 4.650 4.640 -0.000 0.000 0.220 1032 D C -0.008 176.297 176.300 0.008 0.000 1.039 1032 D CA 0.242 54.248 54.000 0.010 0.000 0.866 1032 D CB 0.270 41.075 40.800 0.009 0.000 0.913 1032 D HN -0.080 nan 8.370 nan 0.000 0.523 1033 R N 1.446 121.952 120.500 0.011 0.000 2.309 1033 R HA 0.160 4.500 4.340 -0.000 0.000 0.331 1033 R C -0.516 175.789 176.300 0.008 0.000 1.116 1033 R CA 0.057 56.163 56.100 0.010 0.000 0.970 1033 R CB 0.067 30.375 30.300 0.013 0.000 1.024 1033 R HN 0.079 nan 8.270 nan 0.000 0.472 1034 S N 4.007 119.709 115.700 0.004 0.000 2.530 1034 S HA 0.349 4.819 4.470 -0.000 0.000 0.322 1034 S C 0.409 175.008 174.600 -0.001 0.000 1.085 1034 S CA -1.094 57.105 58.200 -0.000 0.000 1.096 1034 S CB 1.244 64.441 63.200 -0.005 0.000 0.988 1034 S HN 0.424 nan 8.310 nan 0.000 0.466 1035 M N 1.732 121.332 119.600 -0.000 0.000 2.252 1035 M HA 0.189 4.669 4.480 -0.000 0.000 0.329 1035 M C -0.172 176.125 176.300 -0.005 0.000 1.101 1035 M CA 0.080 55.380 55.300 -0.001 0.000 1.117 1035 M CB -0.339 32.261 32.600 0.000 0.000 1.563 1035 M HN 0.517 nan 8.290 nan 0.000 0.445 1036 D N 2.207 122.604 120.400 -0.005 0.000 2.845 1036 D HA 0.283 4.923 4.640 -0.000 0.000 0.235 1036 D C -0.564 175.731 176.300 -0.009 0.000 1.158 1036 D CA -0.082 53.914 54.000 -0.007 0.000 0.990 1036 D CB 0.099 40.895 40.800 -0.006 0.000 1.094 1036 D HN 0.443 nan 8.370 nan 0.000 0.486 1037 V N -1.502 118.405 119.914 -0.012 0.000 2.743 1037 V HA 0.396 4.516 4.120 -0.000 0.000 0.301 1037 V C 0.625 176.708 176.094 -0.018 0.000 1.057 1037 V CA -1.041 61.250 62.300 -0.014 0.000 1.006 1037 V CB 1.694 33.507 31.823 -0.015 0.000 1.024 1037 V HN 0.071 nan 8.190 nan 0.000 0.473 1038 E N 2.056 122.245 120.200 -0.019 0.000 2.415 1038 E HA 0.247 4.597 4.350 -0.000 0.000 0.263 1038 E C 0.045 176.628 176.600 -0.027 0.000 0.995 1038 E CA 0.308 56.695 56.400 -0.022 0.000 0.915 1038 E CB 0.916 30.604 29.700 -0.020 0.000 0.951 1038 E HN 1.005 nan 8.360 nan 0.000 0.449 1039 T N 1.095 115.631 114.554 -0.030 0.000 2.797 1039 T HA 0.525 4.875 4.350 -0.000 0.000 0.279 1039 T C -0.189 174.486 174.700 -0.041 0.000 0.991 1039 T CA -0.902 61.175 62.100 -0.037 0.000 0.979 1039 T CB 0.860 69.706 68.868 -0.038 0.000 0.943 1039 T HN 0.150 nan 8.240 nan 0.000 0.444 1040 I N 2.722 123.263 120.570 -0.049 0.000 2.418 1040 I HA 0.332 4.502 4.170 -0.000 0.000 0.287 1040 I C 0.706 176.781 176.117 -0.069 0.000 1.008 1040 I CA -0.573 60.695 61.300 -0.053 0.000 1.104 1040 I CB 1.713 39.684 38.000 -0.049 0.000 1.264 1040 I HN 0.843 nan 8.210 nan 0.000 0.438 1041 S N 3.532 119.185 115.700 -0.078 0.000 2.537 1041 S HA 0.026 4.496 4.470 -0.000 0.000 0.286 1041 S C 1.585 176.112 174.600 -0.122 0.000 1.299 1041 S CA 0.088 58.223 58.200 -0.108 0.000 1.067 1041 S CB 0.386 63.514 63.200 -0.120 0.000 0.864 1041 S HN 0.782 nan 8.310 nan 0.000 0.494 1042 T N 2.414 116.880 114.554 -0.146 0.000 3.035 1042 T HA 0.236 4.586 4.350 -0.000 0.000 0.268 1042 T C 1.541 176.132 174.700 -0.182 0.000 1.109 1042 T CA 0.934 62.946 62.100 -0.146 0.000 1.119 1042 T CB -0.366 68.409 68.868 -0.155 0.000 0.900 1042 T HN 1.347 nan 8.240 nan 0.000 0.503 1043 G N 0.605 109.261 108.800 -0.241 0.000 2.284 1043 G HA2 -0.200 3.760 3.960 -0.000 0.000 0.216 1043 G HA3 -0.200 3.760 3.960 -0.000 0.000 0.216 1043 G C 0.299 174.919 174.900 -0.466 0.000 1.009 1043 G CA 0.161 45.079 45.100 -0.304 0.000 0.625 1043 G HN 1.111 nan 8.290 nan 0.000 0.501 1044 S N 1.326 116.735 115.700 -0.485 0.000 2.433 1044 S HA 0.668 5.138 4.470 -0.000 0.000 0.310 1044 S C 1.753 176.077 174.600 -0.460 0.000 1.097 1044 S CA -0.436 57.386 58.200 -0.629 0.000 1.103 1044 S CB 0.748 63.355 63.200 -0.989 0.000 0.992 1044 S HN 0.337 nan 8.310 nan 0.000 0.469 1045 L N 4.154 125.117 121.223 -0.434 0.000 1.990 1045 L HA -0.129 4.211 4.340 -0.000 0.000 0.213 1045 L C 2.856 179.600 176.870 -0.209 0.000 1.072 1045 L CA 2.377 57.048 54.840 -0.282 0.000 0.755 1045 L CB -1.570 40.351 42.059 -0.231 0.000 0.889 1045 L HN 0.927 nan 8.230 nan 0.000 0.432 1046 S N -0.687 114.887 115.700 -0.211 0.000 2.442 1046 S HA -0.180 4.290 4.470 -0.000 0.000 0.236 1046 S C 1.925 176.460 174.600 -0.107 0.000 1.007 1046 S CA 0.866 58.996 58.200 -0.116 0.000 0.965 1046 S CB -0.522 62.653 63.200 -0.042 0.000 0.773 1046 S HN 0.393 nan 8.310 nan 0.000 0.504 1047 L N 1.397 122.506 121.223 -0.190 0.000 2.034 1047 L HA -0.063 4.277 4.340 -0.000 0.000 0.203 1047 L C 2.109 178.911 176.870 -0.114 0.000 1.074 1047 L CA 1.722 56.481 54.840 -0.135 0.000 0.748 1047 L CB -0.527 41.423 42.059 -0.181 0.000 0.905 1047 L HN 0.153 nan 8.230 nan 0.000 0.439 1048 D N 0.285 120.600 120.400 -0.143 0.000 2.170 1048 D HA -0.270 4.370 4.640 -0.000 0.000 0.193 1048 D C 2.105 178.358 176.300 -0.079 0.000 1.004 1048 D CA 1.707 55.640 54.000 -0.111 0.000 0.860 1048 D CB -0.276 40.449 40.800 -0.125 0.000 0.931 1048 D HN 0.368 nan 8.370 nan 0.000 0.448 1049 I N 0.867 121.392 120.570 -0.075 0.000 2.127 1049 I HA -0.277 3.893 4.170 -0.000 0.000 0.241 1049 I C 2.381 178.479 176.117 -0.031 0.000 1.075 1049 I CA 1.463 62.736 61.300 -0.046 0.000 1.334 1049 I CB -0.158 37.820 38.000 -0.038 0.000 1.040 1049 I HN -0.046 nan 8.210 nan 0.000 0.405 1050 A N -0.020 122.782 122.820 -0.031 0.000 2.119 1050 A HA -0.008 4.312 4.320 -0.000 0.000 0.216 1050 A C 2.255 179.821 177.584 -0.031 0.000 1.152 1050 A CA 0.683 52.711 52.037 -0.017 0.000 0.708 1050 A CB -0.594 18.405 19.000 -0.002 0.000 0.805 1050 A HN 0.367 nan 8.150 nan 0.000 0.460 1051 L N -1.467 119.728 121.223 -0.047 0.000 2.042 1051 L HA -0.103 4.237 4.340 -0.000 0.000 0.210 1051 L C 2.292 179.137 176.870 -0.043 0.000 1.076 1051 L CA 1.529 56.336 54.840 -0.056 0.000 0.749 1051 L CB -0.288 41.732 42.059 -0.065 0.000 0.893 1051 L HN 0.607 nan 8.230 nan 0.000 0.432 1052 G N -1.876 106.904 108.800 -0.034 0.000 2.399 1052 G HA2 -0.336 3.624 3.960 -0.000 0.000 0.216 1052 G HA3 -0.336 3.624 3.960 -0.000 0.000 0.216 1052 G C 1.047 175.932 174.900 -0.025 0.000 1.096 1052 G CA 0.423 45.510 45.100 -0.022 0.000 0.650 1052 G HN 0.447 nan 8.290 nan 0.000 0.512 1053 A N 0.480 123.280 122.820 -0.032 0.000 2.072 1053 A HA 0.541 4.861 4.320 -0.000 0.000 0.216 1053 A C 2.489 180.051 177.584 -0.036 0.000 1.156 1053 A CA 2.171 54.190 52.037 -0.031 0.000 0.701 1053 A CB -0.511 18.469 19.000 -0.033 0.000 0.816 1053 A HN 2.596 nan 8.150 nan 0.000 0.458 1054 G N -2.123 106.650 108.800 -0.046 0.000 2.203 1054 G HA2 0.400 4.360 3.960 -0.000 0.000 0.231 1054 G HA3 0.400 4.360 3.960 -0.000 0.000 0.231 1054 G C 0.762 175.623 174.900 -0.065 0.000 1.058 1054 G CA 0.310 45.377 45.100 -0.055 0.000 0.781 1054 G HN 2.282 nan 8.290 nan 0.000 0.496 1055 G N -1.579 107.179 108.800 -0.069 0.000 2.347 1055 G HA2 0.439 4.399 3.960 -0.000 0.000 0.321 1055 G HA3 0.439 4.399 3.960 -0.000 0.000 0.321 1055 G C -0.526 174.335 174.900 -0.064 0.000 1.412 1055 G CA -0.564 44.493 45.100 -0.072 0.000 0.990 1055 G HN 0.987 nan 8.290 nan 0.000 0.637 1056 L N 1.842 123.026 121.223 -0.064 0.000 2.367 1056 L HA 0.334 4.674 4.340 -0.000 0.000 0.275 1056 L C -1.496 175.344 176.870 -0.050 0.000 1.129 1056 L CA -1.621 53.184 54.840 -0.059 0.000 0.839 1056 L CB 1.165 43.188 42.059 -0.061 0.000 1.133 1056 L HN 0.328 nan 8.230 nan 0.000 0.453 1057 P HA -0.062 nan 4.420 nan 0.000 0.257 1057 P C -0.172 177.106 177.300 -0.037 0.000 1.227 1057 P CA 0.050 63.127 63.100 -0.039 0.000 0.981 1057 P CB 0.236 31.914 31.700 -0.037 0.000 1.044 1058 M N 2.665 122.245 119.600 -0.034 0.000 2.336 1058 M HA 0.014 4.494 4.480 -0.000 0.000 0.371 1058 M C 1.469 177.752 176.300 -0.028 0.000 1.542 1058 M CA 1.486 56.768 55.300 -0.031 0.000 0.959 1058 M CB -0.975 31.608 32.600 -0.027 0.000 2.033 1058 M HN 0.778 nan 8.290 nan 0.000 0.472 1059 G N 3.590 112.373 108.800 -0.030 0.000 2.130 1059 G HA2 -0.170 3.790 3.960 -0.000 0.000 0.216 1059 G HA3 -0.170 3.790 3.960 -0.000 0.000 0.216 1059 G C -0.002 174.883 174.900 -0.025 0.000 0.999 1059 G CA -0.412 44.673 45.100 -0.025 0.000 0.686 1059 G HN 0.588 nan 8.290 nan 0.000 0.515 1060 R N -0.987 119.494 120.500 -0.031 0.000 2.922 1060 R HA 0.707 5.047 4.340 -0.000 0.000 0.256 1060 R C -0.257 176.025 176.300 -0.030 0.000 1.138 1060 R CA -1.012 55.073 56.100 -0.026 0.000 0.995 1060 R CB 0.960 31.243 30.300 -0.027 0.000 1.226 1060 R HN 0.183 nan 8.270 nan 0.000 0.481 1061 I N 1.493 122.061 120.570 -0.004 0.000 2.321 1061 I HA 0.284 4.454 4.170 -0.000 0.000 0.291 1061 I C -0.354 175.772 176.117 0.015 0.000 0.998 1061 I CA -0.851 60.455 61.300 0.010 0.000 1.227 1061 I CB 1.752 39.820 38.000 0.115 0.000 1.368 1061 I HN 0.009 nan 8.210 nan 0.000 0.466 1062 V N 6.145 126.049 119.914 -0.016 0.000 2.378 1062 V HA 0.276 4.396 4.120 -0.000 0.000 0.288 1062 V C -0.009 176.109 176.094 0.040 0.000 1.016 1062 V CA -0.656 61.636 62.300 -0.013 0.000 0.840 1062 V CB 1.617 33.412 31.823 -0.047 0.000 0.994 1062 V HN 0.709 nan 8.190 nan 0.000 0.431 1063 E N 5.246 125.476 120.200 0.050 0.000 2.109 1063 E HA 0.482 4.832 4.350 -0.000 0.000 0.278 1063 E C -1.093 175.493 176.600 -0.024 0.000 0.954 1063 E CA -0.578 55.875 56.400 0.088 0.000 0.779 1063 E CB 1.048 30.809 29.700 0.103 0.000 1.093 1063 E HN 0.682 nan 8.360 nan 0.000 0.401 1064 I N 6.579 127.153 120.570 0.006 0.000 2.306 1064 I HA 0.183 4.353 4.170 -0.000 0.000 0.288 1064 I C -0.491 175.654 176.117 0.045 0.000 1.036 1064 I CA -0.961 60.311 61.300 -0.046 0.000 1.221 1064 I CB -0.113 37.880 38.000 -0.011 0.000 1.385 1064 I HN 0.432 nan 8.210 nan 0.000 0.472 1065 Y N 4.286 124.588 120.300 0.004 0.000 2.496 1065 Y HA 0.969 5.519 4.550 -0.000 0.000 0.331 1065 Y C 0.039 175.938 175.900 -0.001 0.000 1.140 1065 Y CA -2.498 55.601 58.100 -0.001 0.000 1.166 1065 Y CB 1.426 39.877 38.460 -0.015 0.000 1.249 1065 Y HN 0.572 nan 8.280 nan 0.000 0.479 1066 G N 1.537 110.538 108.800 0.335 0.000 2.433 1066 G HA2 0.376 4.336 3.960 -0.000 0.000 0.306 1066 G HA3 0.376 4.336 3.960 -0.000 0.000 0.306 1066 G C -3.492 171.454 174.900 0.078 0.000 1.627 1066 G CA -1.346 43.878 45.100 0.207 0.000 0.893 1066 G HN 0.491 nan 8.290 nan 0.000 0.648 1067 P HA -0.048 nan 4.420 nan 0.000 0.263 1067 P C 0.813 178.119 177.300 0.009 0.000 1.145 1067 P CA 0.732 63.836 63.100 0.008 0.000 0.755 1067 P CB 0.249 31.952 31.700 0.006 0.000 0.746 1068 E N 1.935 122.135 120.200 -0.001 0.000 2.534 1068 E HA -0.035 4.314 4.350 -0.000 0.000 0.264 1068 E C -0.192 176.402 176.600 -0.010 0.000 0.981 1068 E CA 0.063 56.461 56.400 -0.004 0.000 0.948 1068 E CB -0.364 29.330 29.700 -0.010 0.000 0.934 1068 E HN 0.344 nan 8.360 nan 0.000 0.459 1069 S N 1.067 116.758 115.700 -0.016 0.000 3.587 1069 S HA -0.216 4.254 4.470 -0.000 0.000 0.337 1069 S C 0.831 175.411 174.600 -0.035 0.000 1.119 1069 S CA 0.951 59.129 58.200 -0.036 0.000 0.976 1069 S CB -2.058 61.119 63.200 -0.038 0.000 0.922 1069 S HN 0.761 nan 8.310 nan 0.000 0.503 1070 S N -0.213 115.476 115.700 -0.019 0.000 2.439 1070 S HA 0.461 4.931 4.470 -0.000 0.000 0.224 1070 S C 1.731 176.312 174.600 -0.031 0.000 1.029 1070 S CA 0.713 58.903 58.200 -0.016 0.000 0.946 1070 S CB 0.360 63.566 63.200 0.009 0.000 0.797 1070 S HN 1.840 nan 8.310 nan 0.000 0.504 1071 G N 2.030 110.817 108.800 -0.022 0.000 2.425 1071 G HA2 -0.195 3.765 3.960 -0.000 0.000 0.177 1071 G HA3 -0.195 3.765 3.960 -0.000 0.000 0.177 1071 G C 0.857 175.774 174.900 0.028 0.000 0.999 1071 G CA 0.155 45.246 45.100 -0.014 0.000 0.723 1071 G HN 0.490 nan 8.290 nan 0.000 0.491 1072 K N -0.097 120.323 120.400 0.033 0.000 2.034 1072 K HA -0.168 4.152 4.320 -0.000 0.000 0.214 1072 K C 1.968 178.605 176.600 0.063 0.000 1.051 1072 K CA 2.044 58.362 56.287 0.052 0.000 0.931 1072 K CB -0.903 31.631 32.500 0.057 0.000 0.715 1072 K HN 0.157 nan 8.250 nan 0.000 0.446 1073 T N 0.750 115.342 114.554 0.063 0.000 2.833 1073 T HA -0.077 4.273 4.350 -0.000 0.000 0.269 1073 T C 1.715 176.475 174.700 0.100 0.000 1.054 1073 T CA 1.817 63.969 62.100 0.086 0.000 1.135 1073 T CB -0.403 68.519 68.868 0.091 0.000 0.869 1073 T HN 0.454 nan 8.240 nan 0.000 0.466 1074 T N 2.265 116.887 114.554 0.113 0.000 2.652 1074 T HA -0.055 4.295 4.350 -0.000 0.000 0.267 1074 T C 1.860 176.619 174.700 0.099 0.000 1.039 1074 T CA 1.247 63.448 62.100 0.169 0.000 1.153 1074 T CB -0.581 68.404 68.868 0.195 0.000 0.863 1074 T HN 0.295 nan 8.240 nan 0.000 0.428 1075 L N 0.516 121.795 121.223 0.093 0.000 2.079 1075 L HA -0.178 4.162 4.340 -0.000 0.000 0.210 1075 L C 2.553 179.440 176.870 0.029 0.000 1.081 1075 L CA 1.486 56.365 54.840 0.065 0.000 0.752 1075 L CB -0.679 41.435 42.059 0.091 0.000 0.896 1075 L HN 0.262 nan 8.230 nan 0.000 0.433 1076 T N -0.011 114.570 114.554 0.045 0.000 2.674 1076 T HA -0.180 4.170 4.350 -0.000 0.000 0.265 1076 T C 1.705 176.421 174.700 0.025 0.000 1.039 1076 T CA 1.649 63.775 62.100 0.043 0.000 1.150 1076 T CB -0.208 68.709 68.868 0.081 0.000 0.864 1076 T HN 0.171 nan 8.240 nan 0.000 0.427 1077 L N 1.226 122.462 121.223 0.022 0.000 2.362 1077 L HA 0.005 4.345 4.340 -0.000 0.000 0.219 1077 L C 2.565 179.404 176.870 -0.053 0.000 1.134 1077 L CA 1.346 56.169 54.840 -0.029 0.000 0.807 1077 L CB -0.541 41.497 42.059 -0.034 0.000 0.927 1077 L HN 0.225 nan 8.230 nan 0.000 0.447 1078 Q N -1.009 118.768 119.800 -0.039 0.000 2.212 1078 Q HA -0.052 4.288 4.340 -0.000 0.000 0.199 1078 Q C 2.316 178.275 176.000 -0.069 0.000 0.950 1078 Q CA 1.572 57.336 55.803 -0.064 0.000 0.863 1078 Q CB 0.010 28.710 28.738 -0.064 0.000 0.944 1078 Q HN 0.565 nan 8.270 nan 0.000 0.465 1079 V N -1.337 118.544 119.914 -0.054 0.000 2.307 1079 V HA -0.193 3.927 4.120 -0.000 0.000 0.245 1079 V C 2.259 178.323 176.094 -0.049 0.000 1.045 1079 V CA 1.240 63.507 62.300 -0.056 0.000 1.024 1079 V CB -0.980 30.815 31.823 -0.047 0.000 0.651 1079 V HN 0.153 nan 8.190 nan 0.000 0.449 1080 I N 1.341 121.886 120.570 -0.041 0.000 2.315 1080 I HA -0.261 3.909 4.170 -0.000 0.000 0.251 1080 I C 2.896 178.979 176.117 -0.056 0.000 1.125 1080 I CA 1.651 62.925 61.300 -0.044 0.000 1.392 1080 I CB -0.726 37.244 38.000 -0.050 0.000 1.065 1080 I HN 0.402 nan 8.210 nan 0.000 0.424 1081 A N 1.034 123.815 122.820 -0.065 0.000 1.835 1081 A HA -0.178 4.142 4.320 -0.000 0.000 0.215 1081 A C 2.580 180.132 177.584 -0.054 0.000 1.199 1081 A CA 2.027 54.024 52.037 -0.067 0.000 0.615 1081 A CB -1.073 17.882 19.000 -0.076 0.000 0.838 1081 A HN 0.410 nan 8.150 nan 0.000 0.444 1082 A N -0.593 122.193 122.820 -0.057 0.000 1.972 1082 A HA 0.181 4.501 4.320 -0.000 0.000 0.219 1082 A C 2.400 179.959 177.584 -0.042 0.000 1.169 1082 A CA 2.100 54.107 52.037 -0.051 0.000 0.635 1082 A CB -0.841 18.119 19.000 -0.067 0.000 0.810 1082 A HN 1.096 nan 8.150 nan 0.000 0.446 1083 A N -1.248 121.546 122.820 -0.043 0.000 1.970 1083 A HA -0.085 4.235 4.320 -0.000 0.000 0.216 1083 A C 2.052 179.617 177.584 -0.031 0.000 1.170 1083 A CA 1.232 53.247 52.037 -0.036 0.000 0.645 1083 A CB -0.336 18.643 19.000 -0.035 0.000 0.816 1083 A HN 0.585 nan 8.150 nan 0.000 0.447 1084 Q N -1.120 118.659 119.800 -0.034 0.000 2.378 1084 Q HA 0.029 4.369 4.340 -0.000 0.000 0.205 1084 Q C 1.854 177.837 176.000 -0.028 0.000 0.954 1084 Q CA 0.547 56.331 55.803 -0.032 0.000 0.901 1084 Q CB 0.070 28.784 28.738 -0.039 0.000 0.981 1084 Q HN 0.585 nan 8.270 nan 0.000 0.483 1085 R N 0.347 120.830 120.500 -0.028 0.000 2.317 1085 R HA 0.033 4.373 4.340 -0.000 0.000 0.208 1085 R C 0.235 176.524 176.300 -0.019 0.000 0.914 1085 R CA 0.273 56.359 56.100 -0.023 0.000 1.060 1085 R CB 0.533 30.820 30.300 -0.022 0.000 1.015 1085 R HN 0.090 nan 8.270 nan 0.000 0.498 1086 E N -0.673 119.515 120.200 -0.020 0.000 2.830 1086 E HA 0.148 4.498 4.350 -0.000 0.000 0.225 1086 E C 0.284 176.875 176.600 -0.016 0.000 1.109 1086 E CA 0.064 56.454 56.400 -0.017 0.000 1.392 1086 E CB 1.005 30.693 29.700 -0.019 0.000 1.349 1086 E HN 0.456 nan 8.360 nan 0.000 0.433 1087 G N 1.646 110.437 108.800 -0.015 0.000 2.451 1087 G HA2 -0.389 3.571 3.960 -0.000 0.000 0.253 1087 G HA3 -0.389 3.571 3.960 -0.000 0.000 0.253 1087 G C 0.499 175.392 174.900 -0.013 0.000 1.033 1087 G CA 0.567 45.660 45.100 -0.013 0.000 0.633 1087 G HN 0.324 nan 8.290 nan 0.000 0.537 1088 K N 1.600 121.991 120.400 -0.015 0.000 2.380 1088 K HA 0.439 4.759 4.320 -0.000 0.000 0.267 1088 K C 0.424 177.016 176.600 -0.014 0.000 0.990 1088 K CA 0.928 57.207 56.287 -0.014 0.000 0.946 1088 K CB 0.417 32.906 32.500 -0.017 0.000 0.937 1088 K HN 0.441 nan 8.250 nan 0.000 0.491 1089 T N -1.196 113.352 114.554 -0.010 0.000 2.841 1089 T HA 0.537 4.887 4.350 -0.000 0.000 0.283 1089 T C -0.222 174.476 174.700 -0.003 0.000 1.000 1089 T CA -0.971 61.125 62.100 -0.007 0.000 0.977 1089 T CB 0.621 69.488 68.868 -0.002 0.000 0.979 1089 T HN 0.572 nan 8.240 nan 0.000 0.446 1090 C N 1.650 120.950 119.300 -0.001 0.000 2.667 1090 C HA 0.986 5.446 4.460 -0.000 0.000 0.323 1090 C C 0.566 175.575 174.990 0.031 0.000 1.214 1090 C CA -1.022 58.000 59.018 0.007 0.000 1.721 1090 C CB 1.030 28.770 27.740 0.000 0.000 2.275 1090 C HN 1.223 nan 8.230 nan 0.000 0.491 1091 A N 0.816 123.661 122.820 0.042 0.000 2.325 1091 A HA 0.858 5.178 4.320 -0.000 0.000 0.333 1091 A C -1.287 176.387 177.584 0.149 0.000 1.155 1091 A CA -0.197 51.882 52.037 0.070 0.000 0.814 1091 A CB 0.708 19.723 19.000 0.025 0.000 1.206 1091 A HN 0.863 nan 8.150 nan 0.000 0.482 1092 F N 3.744 123.674 119.950 -0.033 0.000 2.610 1092 F HA 0.472 4.999 4.527 -0.000 0.000 0.355 1092 F C -0.981 174.814 175.800 -0.009 0.000 1.140 1092 F CA -1.127 56.852 58.000 -0.036 0.000 1.037 1092 F CB 1.051 40.016 39.000 -0.059 0.000 1.287 1092 F HN 0.359 nan 8.300 nan 0.000 0.457 1093 I N 4.292 124.634 120.570 -0.380 0.000 2.301 1093 I HA 0.186 4.356 4.170 -0.000 0.000 0.292 1093 I C -0.444 175.344 176.117 -0.549 0.000 1.046 1093 I CA -0.260 60.854 61.300 -0.310 0.000 1.282 1093 I CB 0.838 38.721 38.000 -0.195 0.000 1.409 1093 I HN 0.516 nan 8.210 nan 0.000 0.484 1094 D N 5.157 125.320 120.400 -0.395 0.000 2.453 1094 D HA 0.578 5.218 4.640 -0.000 0.000 0.238 1094 D C 0.358 176.529 176.300 -0.216 0.000 1.088 1094 D CA -0.411 53.374 54.000 -0.357 0.000 0.854 1094 D CB 1.654 42.410 40.800 -0.074 0.000 1.076 1094 D HN 0.576 nan 8.370 nan 0.000 0.533 1095 A N 3.726 126.415 122.820 -0.218 0.000 2.390 1095 A HA 0.119 4.439 4.320 -0.000 0.000 0.232 1095 A C 1.553 178.935 177.584 -0.336 0.000 1.233 1095 A CA -0.086 51.834 52.037 -0.196 0.000 0.907 1095 A CB 0.137 19.152 19.000 0.024 0.000 0.967 1095 A HN 0.544 nan 8.150 nan 0.000 0.512 1096 E N -0.200 119.850 120.200 -0.251 0.000 2.190 1096 E HA -0.015 4.335 4.350 -0.000 0.000 0.191 1096 E C -0.494 176.102 176.600 -0.007 0.000 0.978 1096 E CA 0.593 56.936 56.400 -0.094 0.000 0.839 1096 E CB -0.246 29.469 29.700 0.024 0.000 0.787 1096 E HN 0.785 nan 8.360 nan 0.000 0.473 1097 H N -1.053 118.134 119.070 0.196 0.000 2.819 1097 H HA -0.185 4.371 4.556 -0.000 0.000 0.315 1097 H C 0.489 175.983 175.328 0.276 0.000 1.242 1097 H CA 0.066 56.233 56.048 0.198 0.000 1.157 1097 H CB -1.462 28.303 29.762 0.004 0.000 1.451 1097 H HN 0.275 nan 8.280 nan 0.000 0.430 1098 A N 0.617 123.728 122.820 0.485 0.000 2.579 1098 A HA 0.511 4.831 4.320 -0.000 0.000 0.220 1098 A C 0.880 178.725 177.584 0.433 0.000 2.352 1098 A CA 0.089 52.346 52.037 0.367 0.000 1.183 1098 A CB -0.034 19.102 19.000 0.227 0.000 1.311 1098 A HN 0.736 nan 8.150 nan 0.000 0.534 1099 L N 1.007 122.384 121.223 0.256 0.000 3.555 1099 L HA -0.175 4.165 4.340 -0.000 0.000 0.538 1099 L C -1.016 175.879 176.870 0.042 0.000 1.001 1099 L CA 0.717 55.553 54.840 -0.007 0.000 1.130 1099 L CB -1.076 40.681 42.059 -0.504 0.000 0.876 1099 L HN 0.564 nan 8.230 nan 0.000 0.674 1100 D N 8.077 128.508 120.400 0.051 0.000 2.365 1100 D HA 0.292 4.932 4.640 -0.000 0.000 0.237 1100 D C -1.349 174.982 176.300 0.051 0.000 1.190 1100 D CA -1.766 52.289 54.000 0.091 0.000 0.867 1100 D CB 1.115 41.970 40.800 0.092 0.000 1.050 1100 D HN 0.400 nan 8.370 nan 0.000 0.491 1101 P HA -0.197 nan 4.420 nan 0.000 0.214 1101 P C 1.828 179.138 177.300 0.018 0.000 1.163 1101 P CA 0.657 63.747 63.100 -0.017 0.000 0.889 1101 P CB 0.442 32.163 31.700 0.034 0.000 0.790 1102 I N -1.349 119.259 120.570 0.064 0.000 2.208 1102 I HA -0.254 3.916 4.170 -0.000 0.000 0.245 1102 I C 2.673 178.841 176.117 0.086 0.000 1.097 1102 I CA 1.674 63.015 61.300 0.068 0.000 1.363 1102 I CB -1.407 36.642 38.000 0.082 0.000 1.051 1102 I HN -0.045 nan 8.210 nan 0.000 0.413 1103 Y N 1.761 122.054 120.300 -0.011 0.000 2.242 1103 Y HA -0.186 4.364 4.550 -0.000 0.000 0.291 1103 Y C 2.599 178.477 175.900 -0.037 0.000 1.137 1103 Y CA 1.777 59.867 58.100 -0.017 0.000 1.181 1103 Y CB -0.065 38.384 38.460 -0.018 0.000 0.989 1103 Y HN 0.119 nan 8.280 nan 0.000 0.527 1104 A N 0.506 123.301 122.820 -0.042 0.000 1.933 1104 A HA -0.196 4.124 4.320 -0.000 0.000 0.218 1104 A C 2.308 179.797 177.584 -0.158 0.000 1.175 1104 A CA 1.725 53.673 52.037 -0.149 0.000 0.628 1104 A CB -0.700 18.217 19.000 -0.139 0.000 0.814 1104 A HN 0.524 nan 8.150 nan 0.000 0.444 1105 R N -0.390 120.049 120.500 -0.101 0.000 2.092 1105 R HA -0.069 4.271 4.340 -0.000 0.000 0.231 1105 R C 2.060 178.305 176.300 -0.092 0.000 1.119 1105 R CA 1.492 57.544 56.100 -0.080 0.000 0.970 1105 R CB -0.164 30.111 30.300 -0.041 0.000 0.864 1105 R HN 0.466 nan 8.270 nan 0.000 0.440 1106 K N 0.263 120.597 120.400 -0.111 0.000 2.148 1106 K HA -0.087 4.233 4.320 -0.000 0.000 0.204 1106 K C 2.029 178.521 176.600 -0.179 0.000 1.050 1106 K CA 0.777 56.993 56.287 -0.118 0.000 0.942 1106 K CB 0.009 32.451 32.500 -0.097 0.000 0.724 1106 K HN 0.230 nan 8.250 nan 0.000 0.446 1107 L N -0.681 120.371 121.223 -0.286 0.000 2.141 1107 L HA -0.118 4.222 4.340 -0.000 0.000 0.209 1107 L C 1.370 178.143 176.870 -0.163 0.000 1.094 1107 L CA 1.401 56.065 54.840 -0.294 0.000 0.763 1107 L CB 0.035 41.852 42.059 -0.404 0.000 0.908 1107 L HN 0.534 nan 8.230 nan 0.000 0.437 1108 G N -1.467 107.254 108.800 -0.131 0.000 2.370 1108 G HA2 -0.159 3.801 3.960 -0.000 0.000 0.174 1108 G HA3 -0.159 3.801 3.960 -0.000 0.000 0.174 1108 G C -0.047 174.803 174.900 -0.083 0.000 1.002 1108 G CA -0.200 44.848 45.100 -0.087 0.000 0.730 1108 G HN 0.008 nan 8.290 nan 0.000 0.497 1109 V N 1.707 121.560 119.914 -0.102 0.000 2.530 1109 V HA 0.436 4.556 4.120 -0.000 0.000 0.282 1109 V C 0.153 176.196 176.094 -0.084 0.000 1.048 1109 V CA -0.475 61.765 62.300 -0.099 0.000 0.997 1109 V CB 1.729 33.473 31.823 -0.131 0.000 0.987 1109 V HN 0.259 nan 8.190 nan 0.000 0.477 1110 D N 4.355 124.714 120.400 -0.069 0.000 2.435 1110 D HA 0.160 4.800 4.640 -0.000 0.000 0.230 1110 D C 1.026 177.288 176.300 -0.063 0.000 1.215 1110 D CA -0.272 53.695 54.000 -0.055 0.000 0.947 1110 D CB 0.641 41.417 40.800 -0.040 0.000 1.048 1110 D HN 0.288 nan 8.370 nan 0.000 0.512 1111 I N 2.730 123.258 120.570 -0.070 0.000 2.208 1111 I HA -0.257 3.912 4.170 -0.000 0.000 0.245 1111 I C 1.359 177.445 176.117 -0.052 0.000 1.097 1111 I CA 1.139 62.389 61.300 -0.083 0.000 1.363 1111 I CB -0.674 37.276 38.000 -0.083 0.000 1.051 1111 I HN 0.362 nan 8.210 nan 0.000 0.413 1112 D N 0.814 121.195 120.400 -0.030 0.000 2.190 1112 D HA -0.201 4.439 4.640 -0.000 0.000 0.200 1112 D C 1.538 177.832 176.300 -0.009 0.000 0.992 1112 D CA 1.100 55.093 54.000 -0.013 0.000 0.854 1112 D CB -0.202 40.594 40.800 -0.007 0.000 0.936 1112 D HN 0.303 nan 8.370 nan 0.000 0.462 1113 N N -0.216 118.474 118.700 -0.017 0.000 2.299 1113 N HA 0.050 4.790 4.740 -0.000 0.000 0.187 1113 N C 0.104 175.607 175.510 -0.012 0.000 1.099 1113 N CA -0.083 52.961 53.050 -0.011 0.000 0.867 1113 N CB 0.251 38.729 38.487 -0.014 0.000 0.974 1113 N HN 0.191 nan 8.380 nan 0.000 0.477 1114 L N 1.935 123.141 121.223 -0.027 0.000 2.410 1114 L HA 0.219 4.559 4.340 -0.000 0.000 0.273 1114 L C -0.428 176.445 176.870 0.006 0.000 1.152 1114 L CA -0.091 54.730 54.840 -0.031 0.000 0.855 1114 L CB 0.337 42.340 42.059 -0.094 0.000 1.129 1114 L HN -0.001 nan 8.230 nan 0.000 0.463 1115 L N 6.038 127.281 121.223 0.033 0.000 2.260 1115 L HA 0.275 4.614 4.340 -0.000 0.000 0.289 1115 L C 0.068 177.008 176.870 0.117 0.000 1.057 1115 L CA -0.263 54.615 54.840 0.065 0.000 0.811 1115 L CB 1.105 43.198 42.059 0.057 0.000 1.184 1115 L HN 0.631 nan 8.230 nan 0.000 0.429 1116 C N 3.059 122.441 119.300 0.137 0.000 2.417 1116 C HA 0.748 5.208 4.460 -0.000 0.000 0.324 1116 C C 0.217 175.327 174.990 0.200 0.000 1.240 1116 C CA -0.388 58.768 59.018 0.229 0.000 1.632 1116 C CB 1.339 29.226 27.740 0.244 0.000 2.241 1116 C HN 0.837 nan 8.230 nan 0.000 0.499 1117 S N 4.297 120.112 115.700 0.191 0.000 2.519 1117 S HA 0.540 5.009 4.470 -0.000 0.000 0.309 1117 S C -0.952 173.726 174.600 0.130 0.000 1.100 1117 S CA -0.279 57.993 58.200 0.119 0.000 1.059 1117 S CB 1.179 64.405 63.200 0.042 0.000 1.008 1117 S HN 0.902 nan 8.310 nan 0.000 0.478 1118 Q N 4.124 124.013 119.800 0.147 0.000 2.788 1118 Q HA 0.346 4.686 4.340 -0.000 0.000 0.261 1118 Q C -2.548 173.542 176.000 0.150 0.000 1.029 1118 Q CA -1.909 54.001 55.803 0.178 0.000 0.848 1118 Q CB 1.339 30.224 28.738 0.244 0.000 1.185 1118 Q HN 0.491 nan 8.270 nan 0.000 0.482 1119 P HA -0.038 nan 4.420 nan 0.000 0.271 1119 P C 0.191 177.556 177.300 0.108 0.000 1.218 1119 P CA -0.165 62.961 63.100 0.043 0.000 0.780 1119 P CB 0.902 32.577 31.700 -0.041 0.000 0.901 1120 D N -0.075 120.363 120.400 0.063 0.000 2.310 1120 D HA -0.063 4.577 4.640 -0.000 0.000 0.212 1120 D C 0.124 176.354 176.300 -0.117 0.000 0.965 1120 D CA 1.216 55.266 54.000 0.082 0.000 0.879 1120 D CB 0.563 41.429 40.800 0.111 0.000 0.921 1120 D HN 0.395 nan 8.370 nan 0.000 0.510 1121 T N -3.482 110.940 114.554 -0.220 0.000 2.774 1121 T HA 0.337 4.687 4.350 -0.000 0.000 0.325 1121 T C 1.024 175.528 174.700 -0.327 0.000 1.753 1121 T CA 0.054 61.889 62.100 -0.442 0.000 1.024 1121 T CB 0.711 69.353 68.868 -0.376 0.000 1.628 1121 T HN -0.062 nan 8.240 nan 0.000 0.497 1122 G N 1.380 109.954 108.800 -0.376 0.000 2.721 1122 G HA2 -0.247 3.713 3.960 -0.000 0.000 0.218 1122 G HA3 -0.247 3.713 3.960 -0.000 0.000 0.218 1122 G C 0.983 175.786 174.900 -0.161 0.000 1.265 1122 G CA 1.989 46.948 45.100 -0.235 0.000 0.796 1122 G HN 0.845 nan 8.290 nan 0.000 0.620 1123 E N -0.169 119.946 120.200 -0.142 0.000 2.038 1123 E HA -0.152 4.198 4.350 -0.000 0.000 0.195 1123 E C 2.532 179.054 176.600 -0.130 0.000 1.000 1123 E CA 1.488 57.828 56.400 -0.100 0.000 0.803 1123 E CB -0.316 29.345 29.700 -0.065 0.000 0.750 1123 E HN 0.660 nan 8.360 nan 0.000 0.448 1124 Q N 0.238 119.936 119.800 -0.169 0.000 2.133 1124 Q HA -0.299 4.041 4.340 -0.000 0.000 0.208 1124 Q C 2.055 177.863 176.000 -0.319 0.000 0.991 1124 Q CA 1.900 57.530 55.803 -0.288 0.000 0.867 1124 Q CB -0.241 28.341 28.738 -0.259 0.000 0.911 1124 Q HN 0.305 nan 8.270 nan 0.000 0.417 1125 A N 0.921 123.618 122.820 -0.206 0.000 1.859 1125 A HA -0.217 4.103 4.320 -0.000 0.000 0.217 1125 A C 2.092 179.608 177.584 -0.114 0.000 1.198 1125 A CA 1.697 53.644 52.037 -0.150 0.000 0.629 1125 A CB -1.057 17.883 19.000 -0.101 0.000 0.830 1125 A HN 0.501 nan 8.150 nan 0.000 0.446 1126 L N -0.793 120.388 121.223 -0.070 0.000 2.129 1126 L HA -0.252 4.088 4.340 -0.000 0.000 0.212 1126 L C 2.473 179.328 176.870 -0.025 0.000 1.087 1126 L CA 1.797 56.632 54.840 -0.008 0.000 0.757 1126 L CB -0.502 41.560 42.059 0.005 0.000 0.896 1126 L HN 0.526 nan 8.230 nan 0.000 0.434 1127 E N -0.360 119.789 120.200 -0.085 0.000 2.371 1127 E HA -0.073 4.277 4.350 -0.000 0.000 0.194 1127 E C 2.151 178.708 176.600 -0.071 0.000 1.012 1127 E CA 0.446 56.814 56.400 -0.053 0.000 0.860 1127 E CB 0.152 29.833 29.700 -0.032 0.000 0.811 1127 E HN 0.520 nan 8.360 nan 0.000 0.502 1128 I N 0.528 120.995 120.570 -0.170 0.000 2.761 1128 I HA -0.223 3.947 4.170 -0.000 0.000 0.261 1128 I C 1.952 178.053 176.117 -0.027 0.000 1.198 1128 I CA 0.289 61.520 61.300 -0.116 0.000 1.482 1128 I CB -0.070 37.828 38.000 -0.171 0.000 1.100 1128 I HN 0.261 nan 8.210 nan 0.000 0.445 1129 C N 0.030 119.312 119.300 -0.030 0.000 2.476 1129 C HA -0.126 4.334 4.460 -0.000 0.000 0.278 1129 C C 2.434 177.431 174.990 0.011 0.000 1.274 1129 C CA 0.040 59.048 59.018 -0.017 0.000 1.713 1129 C CB -0.980 26.744 27.740 -0.026 0.000 2.039 1129 C HN 0.479 nan 8.230 nan 0.000 0.484 1130 D N 1.238 121.656 120.400 0.031 0.000 2.191 1130 D HA -0.183 4.456 4.640 -0.000 0.000 0.190 1130 D C 2.195 178.528 176.300 0.054 0.000 1.007 1130 D CA 2.363 56.393 54.000 0.051 0.000 0.865 1130 D CB -0.316 40.527 40.800 0.070 0.000 0.929 1130 D HN 0.571 nan 8.370 nan 0.000 0.447 1131 A N -0.532 122.330 122.820 0.069 0.000 2.132 1131 A HA 0.103 4.423 4.320 -0.000 0.000 0.213 1131 A C 2.270 179.886 177.584 0.053 0.000 1.154 1131 A CA 0.073 52.156 52.037 0.076 0.000 0.753 1131 A CB -0.160 18.915 19.000 0.125 0.000 0.826 1131 A HN 0.208 nan 8.150 nan 0.000 0.469 1132 L N -0.998 120.248 121.223 0.038 0.000 2.492 1132 L HA 0.021 4.361 4.340 -0.000 0.000 0.223 1132 L C 2.739 179.617 176.870 0.013 0.000 1.132 1132 L CA 0.590 55.444 54.840 0.023 0.000 0.850 1132 L CB -0.172 41.895 42.059 0.013 0.000 0.966 1132 L HN 0.424 nan 8.230 nan 0.000 0.454 1133 A N 0.478 123.306 122.820 0.014 0.000 1.855 1133 A HA -0.063 4.257 4.320 -0.000 0.000 0.213 1133 A C 1.723 179.317 177.584 0.015 0.000 1.195 1133 A CA 0.569 52.611 52.037 0.010 0.000 0.610 1133 A CB -0.246 18.762 19.000 0.013 0.000 0.837 1133 A HN 0.302 nan 8.150 nan 0.000 0.444 1134 R N 0.390 120.905 120.500 0.024 0.000 4.739 1134 R HA 0.138 4.478 4.340 -0.000 0.000 0.203 1134 R C 0.840 177.154 176.300 0.023 0.000 2.125 1134 R CA 0.550 56.664 56.100 0.024 0.000 1.743 1134 R CB -0.283 30.035 30.300 0.030 0.000 1.271 1134 R HN 0.482 nan 8.270 nan 0.000 0.746 1135 S N -1.307 114.404 115.700 0.018 0.000 2.931 1135 S HA 0.208 4.678 4.470 -0.000 0.000 0.251 1135 S C 1.481 176.088 174.600 0.011 0.000 1.078 1135 S CA 0.714 58.924 58.200 0.017 0.000 0.835 1135 S CB 0.510 63.722 63.200 0.019 0.000 0.798 1135 S HN 0.549 nan 8.310 nan 0.000 0.495 1136 G N 1.156 109.960 108.800 0.007 0.000 2.336 1136 G HA2 -0.226 3.734 3.960 -0.000 0.000 0.233 1136 G HA3 -0.226 3.734 3.960 -0.000 0.000 0.233 1136 G C 0.811 175.712 174.900 0.001 0.000 1.053 1136 G CA 0.220 45.322 45.100 0.003 0.000 0.625 1136 G HN 1.437 nan 8.290 nan 0.000 0.511 1137 A N 0.093 122.916 122.820 0.004 0.000 2.507 1137 A HA 0.703 5.023 4.320 -0.000 0.000 0.270 1137 A C 0.488 178.073 177.584 0.003 0.000 1.318 1137 A CA 0.733 52.772 52.037 0.002 0.000 0.924 1137 A CB 0.351 19.354 19.000 0.004 0.000 1.061 1137 A HN 1.000 nan 8.150 nan 0.000 0.516 1138 V N 0.927 120.842 119.914 0.003 0.000 2.328 1138 V HA 0.173 4.293 4.120 -0.000 0.000 0.278 1138 V C -0.008 176.082 176.094 -0.007 0.000 1.021 1138 V CA -0.232 62.069 62.300 0.001 0.000 0.838 1138 V CB 1.016 32.841 31.823 0.004 0.000 0.999 1138 V HN 0.569 nan 8.190 nan 0.000 0.447 1139 D N 2.979 123.373 120.400 -0.010 0.000 2.197 1139 D HA 0.059 4.699 4.640 -0.000 0.000 0.212 1139 D C 0.514 176.800 176.300 -0.024 0.000 0.963 1139 D CA 0.819 54.810 54.000 -0.016 0.000 0.864 1139 D CB 0.380 41.171 40.800 -0.016 0.000 1.009 1139 D HN 0.522 nan 8.370 nan 0.000 0.479 1140 V N -0.843 119.057 119.914 -0.023 0.000 2.638 1140 V HA 0.489 4.609 4.120 -0.000 0.000 0.306 1140 V C -0.825 175.251 176.094 -0.031 0.000 1.052 1140 V CA -0.984 61.296 62.300 -0.033 0.000 0.885 1140 V CB 2.219 34.022 31.823 -0.033 0.000 0.999 1140 V HN -0.043 nan 8.190 nan 0.000 0.424 1141 I N 4.438 124.971 120.570 -0.061 0.000 2.359 1141 I HA 0.537 4.707 4.170 -0.000 0.000 0.294 1141 I C -0.741 175.314 176.117 -0.104 0.000 0.987 1141 I CA -0.819 60.434 61.300 -0.078 0.000 1.225 1141 I CB 2.098 40.027 38.000 -0.119 0.000 1.366 1141 I HN 0.487 nan 8.210 nan 0.000 0.466 1142 V N 7.590 127.469 119.914 -0.058 0.000 2.444 1142 V HA 0.330 4.450 4.120 -0.000 0.000 0.294 1142 V C -0.225 175.761 176.094 -0.178 0.000 1.022 1142 V CA -0.576 61.688 62.300 -0.059 0.000 0.850 1142 V CB 2.128 34.020 31.823 0.114 0.000 0.992 1142 V HN 0.379 nan 8.190 nan 0.000 0.426 1143 V N 3.737 123.541 119.914 -0.183 0.000 2.384 1143 V HA 0.523 4.643 4.120 -0.000 0.000 0.287 1143 V C -0.524 175.520 176.094 -0.082 0.000 1.020 1143 V CA -0.484 61.726 62.300 -0.149 0.000 0.850 1143 V CB 1.744 33.562 31.823 -0.008 0.000 0.987 1143 V HN 0.798 nan 8.190 nan 0.000 0.436 1144 D N 3.575 123.851 120.400 -0.208 0.000 2.408 1144 D HA 0.579 5.219 4.640 -0.000 0.000 0.261 1144 D C -0.530 175.711 176.300 -0.099 0.000 1.190 1144 D CA 0.217 54.130 54.000 -0.146 0.000 0.910 1144 D CB 1.489 42.138 40.800 -0.252 0.000 1.097 1144 D HN 0.787 nan 8.370 nan 0.000 0.522 1145 S N 0.089 115.774 115.700 -0.025 0.000 2.565 1145 S HA 0.260 4.730 4.470 -0.000 0.000 0.274 1145 S C 1.023 175.634 174.600 0.017 0.000 1.144 1145 S CA -0.563 57.652 58.200 0.025 0.000 0.849 1145 S CB 1.128 64.348 63.200 0.032 0.000 1.103 1145 S HN -0.047 nan 8.310 nan 0.000 0.455 1146 V N 1.722 121.643 119.914 0.010 0.000 2.308 1146 V HA -0.430 3.690 4.120 -0.000 0.000 0.251 1146 V C 3.060 179.121 176.094 -0.054 0.000 1.055 1146 V CA 3.369 65.623 62.300 -0.078 0.000 1.105 1146 V CB -1.872 29.885 31.823 -0.110 0.000 0.785 1146 V HN 1.329 nan 8.190 nan 0.000 0.479 1147 A N -0.528 122.273 122.820 -0.032 0.000 1.986 1147 A HA -0.072 4.248 4.320 -0.000 0.000 0.220 1147 A C 2.193 179.780 177.584 0.005 0.000 1.171 1147 A CA 2.554 54.579 52.037 -0.021 0.000 0.640 1147 A CB -0.733 18.258 19.000 -0.015 0.000 0.811 1147 A HN 0.978 nan 8.150 nan 0.000 0.451 1148 A N -1.242 121.589 122.820 0.019 0.000 2.208 1148 A HA 0.330 4.650 4.320 -0.000 0.000 0.209 1148 A C 0.852 178.504 177.584 0.112 0.000 1.161 1148 A CA 0.226 52.302 52.037 0.066 0.000 0.782 1148 A CB -0.138 18.882 19.000 0.033 0.000 0.816 1148 A HN 0.289 nan 8.150 nan 0.000 0.477 1149 L N 2.734 123.972 121.223 0.025 0.000 2.650 1149 L HA 0.092 4.431 4.340 -0.000 0.000 0.239 1149 L C 0.395 177.215 176.870 -0.083 0.000 1.412 1149 L CA 0.581 55.401 54.840 -0.033 0.000 1.219 1149 L CB -1.842 40.185 42.059 -0.054 0.000 1.534 1149 L HN 0.339 nan 8.230 nan 0.000 0.430 1150 T N -0.283 114.234 114.554 -0.060 0.000 2.769 1150 T HA 0.320 4.670 4.350 -0.000 0.000 0.293 1150 T C -2.164 172.385 174.700 -0.253 0.000 0.931 1150 T CA -1.507 60.541 62.100 -0.087 0.000 1.139 1150 T CB 0.534 69.453 68.868 0.085 0.000 0.881 1150 T HN 0.125 nan 8.240 nan 0.000 0.532 1151 P HA 0.198 nan 4.420 nan 0.000 0.272 1151 P C 0.936 178.128 177.300 -0.180 0.000 1.248 1151 P CA -0.617 62.382 63.100 -0.168 0.000 0.799 1151 P CB 0.698 32.337 31.700 -0.102 0.000 0.997 1152 K N 0.772 121.088 120.400 -0.139 0.000 1.991 1152 K HA -0.165 4.155 4.320 -0.000 0.000 0.212 1152 K C 2.116 178.674 176.600 -0.070 0.000 1.049 1152 K CA 2.221 58.443 56.287 -0.109 0.000 0.932 1152 K CB -1.160 31.307 32.500 -0.055 0.000 0.717 1152 K HN 0.420 nan 8.250 nan 0.000 0.441 1153 A N 1.215 124.008 122.820 -0.046 0.000 1.958 1153 A HA -0.304 4.016 4.320 -0.000 0.000 0.221 1153 A C 1.955 179.529 177.584 -0.015 0.000 1.178 1153 A CA 2.072 54.096 52.037 -0.023 0.000 0.642 1153 A CB -0.546 18.441 19.000 -0.022 0.000 0.816 1153 A HN 0.400 nan 8.150 nan 0.000 0.453 1154 E N -0.616 119.567 120.200 -0.028 0.000 2.046 1154 E HA -0.098 4.252 4.350 -0.000 0.000 0.190 1154 E C 1.978 178.572 176.600 -0.010 0.000 0.982 1154 E CA 1.026 57.422 56.400 -0.007 0.000 0.800 1154 E CB -0.243 29.454 29.700 -0.005 0.000 0.756 1154 E HN 0.720 nan 8.360 nan 0.000 0.449 1155 I N 1.109 121.641 120.570 -0.063 0.000 2.076 1155 I HA -0.305 3.865 4.170 -0.000 0.000 0.237 1155 I C 2.207 178.318 176.117 -0.010 0.000 1.059 1155 I CA 1.587 62.834 61.300 -0.089 0.000 1.317 1155 I CB -0.189 37.651 38.000 -0.266 0.000 1.037 1155 I HN 0.088 nan 8.210 nan 0.000 0.398 1156 E N 0.338 120.549 120.200 0.018 0.000 2.038 1156 E HA 0.078 4.428 4.350 -0.000 0.000 0.190 1156 E C 1.478 178.119 176.600 0.067 0.000 0.967 1156 E CA 0.596 57.055 56.400 0.098 0.000 0.816 1156 E CB -0.409 29.360 29.700 0.115 0.000 0.784 1156 E HN 0.456 nan 8.360 nan 0.000 0.456 1157 G N 0.663 109.486 108.800 0.039 0.000 2.447 1157 G HA2 -0.109 3.851 3.960 -0.000 0.000 0.269 1157 G HA3 -0.109 3.851 3.960 -0.000 0.000 0.269 1157 G C 0.544 175.462 174.900 0.029 0.000 1.455 1157 G CA -0.091 45.026 45.100 0.029 0.000 1.061 1157 G HN 0.109 nan 8.290 nan 0.000 0.545 1158 E N -1.596 118.617 120.200 0.021 0.000 2.474 1158 E HA 0.301 4.651 4.350 -0.000 0.000 0.195 1158 E C 0.423 177.050 176.600 0.045 0.000 1.039 1158 E CA -0.473 55.945 56.400 0.029 0.000 0.881 1158 E CB -0.354 29.354 29.700 0.012 0.000 0.970 1158 E HN 0.363 nan 8.360 nan 0.000 0.486 1159 I N -3.140 117.449 120.570 0.032 0.000 8.005 1159 I HA -0.188 3.982 4.170 -0.000 0.000 0.310 1159 I C 1.069 177.169 176.117 -0.028 0.000 2.207 1159 I CA 0.518 61.840 61.300 0.037 0.000 1.855 1159 I CB -0.865 37.233 38.000 0.164 0.000 3.693 1159 I HN 0.034 nan 8.210 nan 0.000 0.369 1160 G N 0.591 109.367 108.800 -0.040 0.000 2.559 1160 G HA2 -0.014 3.946 3.960 -0.000 0.000 0.216 1160 G HA3 -0.014 3.946 3.960 -0.000 0.000 0.216 1160 G C 0.637 175.466 174.900 -0.118 0.000 1.126 1160 G CA 1.205 46.264 45.100 -0.067 0.000 0.778 1160 G HN 0.950 nan 8.290 nan 0.000 0.543 1161 D N -1.487 118.783 120.400 -0.216 0.000 2.978 1161 D HA -0.137 4.503 4.640 -0.000 0.000 0.205 1161 D C 0.400 176.514 176.300 -0.310 0.000 1.093 1161 D CA 1.413 55.213 54.000 -0.334 0.000 1.006 1161 D CB -1.384 39.301 40.800 -0.192 0.000 1.116 1161 D HN 0.321 nan 8.370 nan 0.000 0.419 1162 S N -0.011 115.560 115.700 -0.215 0.000 2.498 1162 S HA 0.188 4.658 4.470 -0.000 0.000 0.324 1162 S C -0.484 174.059 174.600 -0.096 0.000 1.071 1162 S CA -0.593 57.519 58.200 -0.148 0.000 1.113 1162 S CB 1.106 64.254 63.200 -0.086 0.000 0.976 1162 S HN 0.127 nan 8.310 nan 0.000 0.462 1163 H N 4.806 123.860 119.070 -0.027 0.000 3.091 1163 H HA 0.042 4.598 4.556 -0.000 0.000 0.289 1163 H C 1.232 176.544 175.328 -0.027 0.000 0.995 1163 H CA 0.822 56.855 56.048 -0.025 0.000 1.461 1163 H CB 0.163 29.912 29.762 -0.022 0.000 1.510 1163 H HN 0.731 nan 8.280 nan 0.000 0.546 1164 M N 2.043 121.762 119.600 0.199 0.000 7.319 1164 M HA -0.226 4.254 4.480 -0.000 0.000 0.134 1164 M C 0.843 177.155 176.300 0.020 0.000 0.480 1164 M CA 2.199 57.548 55.300 0.083 0.000 1.311 1164 M CB -1.554 31.075 32.600 0.048 0.000 0.421 1164 M HN 0.750 nan 8.290 nan 0.000 0.252 1165 G N 1.630 110.433 108.800 0.004 0.000 3.213 1165 G HA2 0.457 4.417 3.960 -0.000 0.000 0.263 1165 G HA3 0.457 4.417 3.960 -0.000 0.000 0.263 1165 G C 0.648 175.526 174.900 -0.036 0.000 0.829 1165 G CA -0.013 45.075 45.100 -0.020 0.000 1.983 1165 G HN 0.462 nan 8.290 nan 0.000 0.616 1166 L N 0.889 122.088 121.223 -0.040 0.000 2.641 1166 L HA 0.255 4.595 4.340 -0.000 0.000 0.207 1166 L C 2.423 179.263 176.870 -0.049 0.000 1.049 1166 L CA 0.273 55.081 54.840 -0.053 0.000 0.866 1166 L CB 0.160 42.184 42.059 -0.058 0.000 1.264 1166 L HN 0.334 nan 8.230 nan 0.000 0.483 1167 A N 0.602 123.396 122.820 -0.044 0.000 2.081 1167 A HA 0.163 4.483 4.320 -0.000 0.000 0.213 1167 A C 1.809 179.359 177.584 -0.056 0.000 1.374 1167 A CA 0.843 52.852 52.037 -0.047 0.000 1.203 1167 A CB -0.796 18.176 19.000 -0.047 0.000 0.786 1167 A HN 0.372 nan 8.150 nan 0.000 0.535 1168 A N -0.221 122.565 122.820 -0.057 0.000 2.168 1168 A HA -0.029 4.291 4.320 -0.000 0.000 0.215 1168 A C 2.073 179.617 177.584 -0.065 0.000 1.152 1168 A CA 0.891 52.888 52.037 -0.066 0.000 0.716 1168 A CB -0.281 18.682 19.000 -0.061 0.000 0.794 1168 A HN 0.606 nan 8.150 nan 0.000 0.465 1169 R N -0.911 119.558 120.500 -0.053 0.000 2.148 1169 R HA -0.012 4.328 4.340 -0.000 0.000 0.223 1169 R C 2.181 178.450 176.300 -0.052 0.000 1.088 1169 R CA 1.196 57.269 56.100 -0.046 0.000 0.985 1169 R CB -0.341 29.941 30.300 -0.029 0.000 0.880 1169 R HN 0.676 nan 8.270 nan 0.000 0.451 1170 M N -0.021 119.545 119.600 -0.056 0.000 2.202 1170 M HA -0.230 4.250 4.480 -0.000 0.000 0.262 1170 M C 1.642 177.900 176.300 -0.070 0.000 1.063 1170 M CA 1.622 56.886 55.300 -0.059 0.000 1.097 1170 M CB 0.019 32.579 32.600 -0.067 0.000 1.382 1170 M HN 0.186 nan 8.290 nan 0.000 0.413 1171 M N 0.088 119.633 119.600 -0.091 0.000 2.062 1171 M HA -0.133 4.347 4.480 -0.000 0.000 0.259 1171 M C 2.230 178.467 176.300 -0.105 0.000 1.076 1171 M CA 1.786 57.016 55.300 -0.118 0.000 1.122 1171 M CB -1.136 31.369 32.600 -0.158 0.000 1.312 1171 M HN 0.316 nan 8.290 nan 0.000 0.412 1172 S N 0.434 116.072 115.700 -0.103 0.000 2.407 1172 S HA -0.243 4.227 4.470 -0.000 0.000 0.235 1172 S C 1.576 176.111 174.600 -0.108 0.000 1.036 1172 S CA 1.517 59.645 58.200 -0.121 0.000 1.013 1172 S CB -0.444 62.702 63.200 -0.090 0.000 0.820 1172 S HN 0.413 nan 8.310 nan 0.000 0.476 1173 Q N 1.595 121.353 119.800 -0.068 0.000 1.579 1173 Q HA 0.056 4.396 4.340 -0.000 0.000 0.490 1173 Q C 1.942 177.925 176.000 -0.027 0.000 0.970 1173 Q CA 1.546 57.324 55.803 -0.041 0.000 0.898 1173 Q CB -0.592 28.129 28.738 -0.028 0.000 0.936 1173 Q HN 0.441 nan 8.270 nan 0.000 0.385 1174 A N -0.228 122.588 122.820 -0.008 0.000 2.263 1174 A HA -0.053 4.267 4.320 -0.000 0.000 0.205 1174 A C 1.566 179.176 177.584 0.043 0.000 1.226 1174 A CA 0.829 52.879 52.037 0.022 0.000 0.810 1174 A CB -0.708 18.309 19.000 0.028 0.000 0.784 1174 A HN 0.608 nan 8.150 nan 0.000 0.486 1175 M N -0.308 119.297 119.600 0.008 0.000 2.073 1175 M HA -0.007 4.473 4.480 -0.000 0.000 0.259 1175 M C 2.052 178.417 176.300 0.108 0.000 1.079 1175 M CA 1.520 56.838 55.300 0.030 0.000 1.131 1175 M CB -0.475 32.054 32.600 -0.118 0.000 1.316 1175 M HN 0.362 nan 8.290 nan 0.000 0.415 1176 R N 0.617 121.131 120.500 0.023 0.000 2.189 1176 R HA -0.264 4.076 4.340 -0.000 0.000 0.252 1176 R C 2.099 178.545 176.300 0.244 0.000 1.134 1176 R CA 2.553 58.787 56.100 0.223 0.000 0.954 1176 R CB -0.741 29.618 30.300 0.098 0.000 0.890 1176 R HN 0.497 nan 8.270 nan 0.000 0.443 1177 K N 0.006 120.489 120.400 0.139 0.000 2.103 1177 K HA -0.019 4.301 4.320 -0.000 0.000 0.204 1177 K C 2.219 178.884 176.600 0.109 0.000 1.052 1177 K CA 0.777 57.128 56.287 0.108 0.000 0.945 1177 K CB -0.137 32.409 32.500 0.076 0.000 0.722 1177 K HN 0.152 nan 8.250 nan 0.000 0.443 1178 L N 0.671 121.970 121.223 0.125 0.000 2.127 1178 L HA -0.231 4.109 4.340 -0.000 0.000 0.211 1178 L C 2.435 179.368 176.870 0.105 0.000 1.089 1178 L CA 0.884 55.790 54.840 0.110 0.000 0.757 1178 L CB -0.521 41.616 42.059 0.131 0.000 0.899 1178 L HN 0.252 nan 8.230 nan 0.000 0.434 1179 A N 0.241 123.150 122.820 0.148 0.000 1.869 1179 A HA -0.252 4.068 4.320 -0.000 0.000 0.218 1179 A C 2.320 179.926 177.584 0.037 0.000 1.203 1179 A CA 2.245 54.333 52.037 0.086 0.000 0.638 1179 A CB -1.419 17.611 19.000 0.050 0.000 0.831 1179 A HN 0.470 nan 8.150 nan 0.000 0.450 1180 G N -0.596 108.230 108.800 0.044 0.000 2.464 1180 G HA2 -0.261 3.698 3.960 -0.000 0.000 0.214 1180 G HA3 -0.261 3.698 3.960 -0.000 0.000 0.214 1180 G C 1.327 176.242 174.900 0.025 0.000 1.218 1180 G CA 1.025 46.141 45.100 0.027 0.000 0.794 1180 G HN 0.671 nan 8.290 nan 0.000 0.542 1181 N N 0.190 118.910 118.700 0.034 0.000 2.242 1181 N HA -0.118 4.622 4.740 -0.000 0.000 0.191 1181 N C 2.039 177.559 175.510 0.017 0.000 1.005 1181 N CA 0.985 54.051 53.050 0.028 0.000 0.877 1181 N CB -0.158 38.351 38.487 0.036 0.000 0.983 1181 N HN 0.324 nan 8.380 nan 0.000 0.439 1182 L N -0.251 120.980 121.223 0.014 0.000 2.253 1182 L HA 0.048 4.388 4.340 -0.000 0.000 0.205 1182 L C 2.254 179.122 176.870 -0.004 0.000 1.078 1182 L CA 0.580 55.420 54.840 0.000 0.000 0.805 1182 L CB -0.120 41.936 42.059 -0.005 0.000 0.963 1182 L HN 0.020 nan 8.230 nan 0.000 0.459 1183 K N 0.555 120.953 120.400 -0.002 0.000 2.097 1183 K HA -0.150 4.170 4.320 -0.000 0.000 0.205 1183 K C 1.359 177.956 176.600 -0.004 0.000 1.050 1183 K CA 1.216 57.499 56.287 -0.006 0.000 0.938 1183 K CB 0.164 32.659 32.500 -0.008 0.000 0.718 1183 K HN 0.203 nan 8.250 nan 0.000 0.442 1184 Q N -0.477 119.323 119.800 0.000 0.000 2.244 1184 Q HA 0.152 4.492 4.340 -0.000 0.000 0.239 1184 Q C -0.023 175.978 176.000 0.002 0.000 0.890 1184 Q CA -0.107 55.696 55.803 0.001 0.000 0.964 1184 Q CB 0.968 29.709 28.738 0.004 0.000 1.076 1184 Q HN 0.136 nan 8.270 nan 0.000 0.447 1185 S N -0.861 114.838 115.700 -0.001 0.000 2.648 1185 S HA 0.063 4.533 4.470 -0.000 0.000 0.270 1185 S C 0.083 174.680 174.600 -0.006 0.000 1.082 1185 S CA -0.453 57.746 58.200 -0.002 0.000 1.116 1185 S CB 0.462 63.661 63.200 -0.001 0.000 1.040 1185 S HN 0.378 nan 8.310 nan 0.000 0.572 1186 N N 2.285 120.979 118.700 -0.009 0.000 2.725 1186 N HA -0.117 4.622 4.740 -0.000 0.000 0.251 1186 N C -1.223 174.277 175.510 -0.017 0.000 1.031 1186 N CA 0.843 53.885 53.050 -0.014 0.000 0.720 1186 N CB -1.381 37.098 38.487 -0.013 0.000 0.930 1186 N HN 0.339 nan 8.380 nan 0.000 0.543 1187 T N 0.962 115.505 114.554 -0.019 0.000 2.743 1187 T HA 0.414 4.764 4.350 -0.000 0.000 0.292 1187 T C 0.273 174.950 174.700 -0.037 0.000 0.972 1187 T CA -0.591 61.493 62.100 -0.025 0.000 0.967 1187 T CB 1.100 69.955 68.868 -0.021 0.000 0.926 1187 T HN 0.252 nan 8.240 nan 0.000 0.459 1188 L N 5.856 127.053 121.223 -0.044 0.000 2.281 1188 L HA 0.674 5.014 4.340 -0.000 0.000 0.285 1188 L C -0.816 176.002 176.870 -0.087 0.000 1.074 1188 L CA -0.358 54.447 54.840 -0.058 0.000 0.817 1188 L CB 0.389 42.417 42.059 -0.051 0.000 1.168 1188 L HN 0.631 nan 8.230 nan 0.000 0.434 1189 L N 6.032 127.184 121.223 -0.120 0.000 2.346 1189 L HA 0.685 5.025 4.340 -0.000 0.000 0.274 1189 L C -1.237 175.483 176.870 -0.250 0.000 1.007 1189 L CA -0.447 54.267 54.840 -0.210 0.000 0.818 1189 L CB 1.576 43.473 42.059 -0.270 0.000 1.284 1189 L HN 0.696 nan 8.230 nan 0.000 0.424 1190 I N 4.087 124.478 120.570 -0.299 0.000 2.466 1190 I HA 0.368 4.538 4.170 -0.000 0.000 0.289 1190 I C -1.186 174.773 176.117 -0.264 0.000 1.026 1190 I CA -0.297 60.878 61.300 -0.209 0.000 1.078 1190 I CB 1.767 39.712 38.000 -0.092 0.000 1.249 1190 I HN 0.432 nan 8.210 nan 0.000 0.429 1191 F N 6.497 126.438 119.950 -0.016 0.000 2.422 1191 F HA 0.582 5.109 4.527 -0.000 0.000 0.333 1191 F C 0.185 175.983 175.800 -0.005 0.000 1.095 1191 F CA -0.805 57.186 58.000 -0.015 0.000 1.038 1191 F CB 1.421 40.416 39.000 -0.007 0.000 1.156 1191 F HN 0.098 nan 8.300 nan 0.000 0.483 1192 I N 2.684 123.390 120.570 0.228 0.000 2.433 1192 I HA 0.429 4.599 4.170 -0.000 0.000 0.292 1192 I C -0.448 175.733 176.117 0.108 0.000 1.001 1192 I CA -0.722 60.659 61.300 0.135 0.000 1.119 1192 I CB 1.799 39.856 38.000 0.095 0.000 1.289 1192 I HN 0.479 nan 8.210 nan 0.000 0.438 1193 N N 3.879 122.645 118.700 0.110 0.000 3.091 1193 N HA 0.565 5.305 4.740 -0.000 0.000 0.329 1193 N C -1.305 174.239 175.510 0.057 0.000 1.430 1193 N CA -0.476 52.614 53.050 0.066 0.000 0.755 1193 N CB 1.807 40.332 38.487 0.063 0.000 1.626 1193 N HN 0.628 nan 8.380 nan 0.000 0.614 1212 G N -0.456 108.284 108.800 -0.100 0.000 2.420 1212 G HA2 0.440 4.400 3.960 -0.000 0.000 0.331 1212 G HA3 0.440 4.400 3.960 -0.000 0.000 0.331 1212 G C 0.429 175.298 174.900 -0.052 0.000 1.168 1212 G CA 0.083 45.135 45.100 -0.080 0.000 0.936 1212 G HN 0.426 nan 8.290 nan 0.000 0.479 1213 N N 1.027 119.719 118.700 -0.013 0.000 2.192 1213 N HA -0.180 4.560 4.740 -0.000 0.000 0.188 1213 N C 2.418 177.999 175.510 0.118 0.000 1.013 1213 N CA 1.645 54.727 53.050 0.055 0.000 0.863 1213 N CB -0.087 38.450 38.487 0.084 0.000 0.990 1213 N HN 0.568 nan 8.380 nan 0.000 0.430 1214 A N 0.976 123.827 122.820 0.053 0.000 1.835 1214 A HA -0.134 4.186 4.320 -0.000 0.000 0.215 1214 A C 2.175 179.826 177.584 0.112 0.000 1.199 1214 A CA 1.436 53.504 52.037 0.052 0.000 0.615 1214 A CB -1.195 17.738 19.000 -0.112 0.000 0.838 1214 A HN 0.324 nan 8.150 nan 0.000 0.444 1215 L N 0.407 121.636 121.223 0.011 0.000 2.123 1215 L HA -0.271 4.069 4.340 -0.000 0.000 0.217 1215 L C 2.229 179.134 176.870 0.059 0.000 1.081 1215 L CA 2.740 57.602 54.840 0.037 0.000 0.772 1215 L CB -0.766 41.236 42.059 -0.094 0.000 0.890 1215 L HN 0.550 nan 8.230 nan 0.000 0.437 1216 K N -2.046 118.334 120.400 -0.033 0.000 2.366 1216 K HA -0.232 4.088 4.320 -0.000 0.000 0.202 1216 K C 1.362 177.707 176.600 -0.425 0.000 1.045 1216 K CA 1.961 58.093 56.287 -0.258 0.000 0.934 1216 K CB -0.117 32.129 32.500 -0.423 0.000 0.746 1216 K HN 0.457 nan 8.250 nan 0.000 0.470 1217 F N -2.783 117.275 119.950 0.180 0.000 2.581 1217 F HA 0.120 4.647 4.527 -0.000 0.000 0.278 1217 F C 1.369 177.321 175.800 0.253 0.000 1.000 1217 F CA -0.347 57.785 58.000 0.221 0.000 1.230 1217 F CB -0.116 39.030 39.000 0.243 0.000 1.008 1217 F HN -0.119 nan 8.300 nan 0.000 0.695 1218 Y N 1.174 121.615 120.300 0.236 0.000 2.639 1218 Y HA 0.209 4.759 4.550 -0.000 0.000 0.297 1218 Y C 1.413 177.379 175.900 0.110 0.000 1.151 1218 Y CA -0.184 58.009 58.100 0.154 0.000 1.335 1218 Y CB -0.238 38.306 38.460 0.139 0.000 0.994 1218 Y HN -0.052 nan 8.280 nan 0.000 0.548 1219 A N -0.133 122.809 122.820 0.204 0.000 2.450 1219 A HA 0.143 4.463 4.320 -0.000 0.000 0.255 1219 A C 1.145 178.748 177.584 0.032 0.000 1.096 1219 A CA 0.128 52.224 52.037 0.099 0.000 0.778 1219 A CB 0.320 19.346 19.000 0.043 0.000 1.031 1219 A HN 0.342 nan 8.150 nan 0.000 0.494 1220 S N 1.044 116.748 115.700 0.006 0.000 2.425 1220 S HA 0.114 4.584 4.470 -0.000 0.000 0.225 1220 S C 0.609 175.177 174.600 -0.055 0.000 1.024 1220 S CA 0.797 58.984 58.200 -0.022 0.000 0.951 1220 S CB 0.011 63.197 63.200 -0.024 0.000 0.796 1220 S HN 0.669 nan 8.310 nan 0.000 0.498 1221 V N 1.357 121.230 119.914 -0.069 0.000 2.888 1221 V HA 0.539 4.659 4.120 -0.000 0.000 0.309 1221 V C -1.505 174.506 176.094 -0.138 0.000 1.114 1221 V CA -0.881 61.352 62.300 -0.113 0.000 0.940 1221 V CB 2.211 33.974 31.823 -0.099 0.000 1.021 1221 V HN 0.133 nan 8.190 nan 0.000 0.426 1222 R N 4.261 124.636 120.500 -0.209 0.000 2.574 1222 R HA 0.610 4.950 4.340 -0.000 0.000 0.288 1222 R C -2.019 174.084 176.300 -0.328 0.000 1.004 1222 R CA -0.817 55.124 56.100 -0.265 0.000 0.895 1222 R CB 2.095 32.203 30.300 -0.321 0.000 1.191 1222 R HN 0.414 nan 8.270 nan 0.000 0.444 1223 L N 2.218 123.214 121.223 -0.378 0.000 2.322 1223 L HA 0.308 4.648 4.340 -0.000 0.000 0.281 1223 L C -0.333 176.127 176.870 -0.682 0.000 1.014 1223 L CA -0.362 54.250 54.840 -0.380 0.000 0.815 1223 L CB 1.525 43.461 42.059 -0.205 0.000 1.247 1223 L HN 0.439 nan 8.230 nan 0.000 0.421 1224 D N 4.227 124.331 120.400 -0.492 0.000 2.477 1224 D HA 0.223 4.863 4.640 -0.000 0.000 0.239 1224 D C -0.521 175.755 176.300 -0.039 0.000 1.102 1224 D CA -0.259 53.566 54.000 -0.292 0.000 0.901 1224 D CB 0.552 41.334 40.800 -0.030 0.000 1.026 1224 D HN 0.429 nan 8.370 nan 0.000 0.515 1225 I N 3.081 123.652 120.570 0.001 0.000 2.428 1225 I HA 0.347 4.517 4.170 -0.000 0.000 0.289 1225 I C 0.092 176.238 176.117 0.047 0.000 1.019 1225 I CA -0.359 60.956 61.300 0.024 0.000 1.351 1225 I CB 0.430 38.447 38.000 0.028 0.000 1.412 1225 I HN 0.213 nan 8.210 nan 0.000 0.513 1226 R N 5.673 126.180 120.500 0.011 0.000 3.121 1226 R HA 0.626 4.966 4.340 -0.000 0.000 0.242 1226 R C -1.060 175.220 176.300 -0.033 0.000 1.402 1226 R CA -1.147 54.957 56.100 0.007 0.000 1.042 1226 R CB 1.563 31.874 30.300 0.017 0.000 1.410 1226 R HN 0.543 nan 8.270 nan 0.000 0.494 1227 R N 0.898 121.381 120.500 -0.028 0.000 2.548 1227 R HA 0.278 4.618 4.340 -0.000 0.000 0.280 1227 R C -0.074 176.210 176.300 -0.026 0.000 1.061 1227 R CA -0.159 55.916 56.100 -0.042 0.000 0.915 1227 R CB 1.211 31.494 30.300 -0.030 0.000 1.210 1227 R HN 0.721 nan 8.270 nan 0.000 0.442 1228 I N 0.075 120.626 120.570 -0.031 0.000 4.607 1228 I HA 0.502 4.672 4.170 -0.000 0.000 0.324 1228 I C 0.805 176.917 176.117 -0.008 0.000 1.279 1228 I CA 0.264 61.554 61.300 -0.016 0.000 1.286 1228 I CB 1.207 39.199 38.000 -0.014 0.000 1.265 1228 I HN 0.608 nan 8.210 nan 0.000 0.446 1229 G N 1.130 109.924 108.800 -0.010 0.000 2.621 1229 G HA2 0.613 4.573 3.960 -0.000 0.000 0.209 1229 G HA3 0.613 4.573 3.960 -0.000 0.000 0.209 1229 G C 0.451 175.358 174.900 0.011 0.000 1.379 1229 G CA 0.384 45.485 45.100 0.000 0.000 0.766 1229 G HN 0.931 nan 8.290 nan 0.000 0.599 1230 A N -1.651 121.181 122.820 0.021 0.000 2.435 1230 A HA 0.243 4.563 4.320 -0.000 0.000 0.686 1230 A C -0.301 177.294 177.584 0.018 0.000 0.138 1230 A CA 0.108 52.169 52.037 0.039 0.000 0.024 1230 A CB -1.487 17.538 19.000 0.041 0.000 3.974 1230 A HN 1.639 nan 8.150 nan 0.000 0.548 1231 V N 0.658 120.582 119.914 0.017 0.000 3.074 1231 V HA 0.907 5.027 4.120 -0.000 0.000 0.314 1231 V C 0.021 176.102 176.094 -0.022 0.000 1.117 1231 V CA -0.889 61.414 62.300 0.005 0.000 1.014 1231 V CB 2.101 33.938 31.823 0.024 0.000 1.057 1231 V HN 1.062 nan 8.190 nan 0.000 0.438 1232 K N 0.735 121.125 120.400 -0.017 0.000 2.316 1232 K HA 0.570 4.890 4.320 -0.000 0.000 0.251 1232 K C -0.877 175.712 176.600 -0.018 0.000 0.934 1232 K CA -0.619 55.650 56.287 -0.030 0.000 0.802 1232 K CB 2.135 34.619 32.500 -0.027 0.000 1.171 1232 K HN 0.521 nan 8.250 nan 0.000 0.426 1233 E N 2.422 122.606 120.200 -0.026 0.000 2.206 1233 E HA 0.179 4.529 4.350 -0.000 0.000 0.244 1233 E C 0.630 177.220 176.600 -0.017 0.000 1.055 1233 E CA 0.116 56.507 56.400 -0.015 0.000 0.970 1233 E CB 0.664 30.355 29.700 -0.015 0.000 1.256 1233 E HN 0.887 nan 8.360 nan 0.000 0.456 1234 G N 3.387 112.178 108.800 -0.014 0.000 2.950 1234 G HA2 -0.341 3.619 3.960 -0.000 0.000 0.299 1234 G HA3 -0.341 3.619 3.960 -0.000 0.000 0.299 1234 G C 0.846 175.734 174.900 -0.019 0.000 1.310 1234 G CA 0.185 45.276 45.100 -0.015 0.000 0.994 1234 G HN 0.445 nan 8.290 nan 0.000 0.575 1235 E N 1.714 121.900 120.200 -0.023 0.000 2.447 1235 E HA 0.136 4.486 4.350 -0.000 0.000 0.204 1235 E C 1.066 177.643 176.600 -0.038 0.000 0.977 1235 E CA -0.023 56.361 56.400 -0.026 0.000 0.950 1235 E CB -0.011 29.676 29.700 -0.021 0.000 0.975 1235 E HN 0.583 nan 8.360 nan 0.000 0.496 1236 N N 0.254 118.927 118.700 -0.044 0.000 2.416 1236 N HA 0.022 4.762 4.740 -0.000 0.000 0.246 1236 N C -0.632 174.822 175.510 -0.095 0.000 1.260 1236 N CA 0.155 53.164 53.050 -0.068 0.000 0.897 1236 N CB 1.120 39.568 38.487 -0.065 0.000 1.110 1236 N HN -0.229 nan 8.380 nan 0.000 0.439 1237 V N 2.696 122.523 119.914 -0.146 0.000 2.294 1237 V HA 0.132 4.252 4.120 -0.000 0.000 0.272 1237 V C 0.340 176.194 176.094 -0.400 0.000 1.027 1237 V CA -0.189 61.988 62.300 -0.206 0.000 0.823 1237 V CB 1.112 32.831 31.823 -0.173 0.000 1.030 1237 V HN 0.526 nan 8.190 nan 0.000 0.457 1238 V N 4.132 123.854 119.914 -0.320 0.000 3.477 1238 V HA 0.561 4.681 4.120 -0.000 0.000 0.297 1238 V C 0.905 176.884 176.094 -0.190 0.000 1.433 1238 V CA 0.930 63.006 62.300 -0.373 0.000 1.052 1238 V CB 0.512 32.251 31.823 -0.141 0.000 0.895 1238 V HN 0.782 nan 8.190 nan 0.000 0.438 1239 G N -0.827 107.923 108.800 -0.083 0.000 2.714 1239 G HA2 0.615 4.575 3.960 -0.000 0.000 0.292 1239 G HA3 0.615 4.575 3.960 -0.000 0.000 0.292 1239 G C -1.161 173.878 174.900 0.232 0.000 1.308 1239 G CA -0.453 44.732 45.100 0.142 0.000 0.964 1239 G HN 0.106 nan 8.290 nan 0.000 0.484 1240 S N -0.351 115.460 115.700 0.184 0.000 2.737 1240 S HA 0.267 4.737 4.470 -0.000 0.000 0.269 1240 S C -0.915 173.680 174.600 -0.008 0.000 1.150 1240 S CA -0.546 57.717 58.200 0.104 0.000 1.077 1240 S CB 1.590 64.852 63.200 0.102 0.000 1.075 1240 S HN 0.640 nan 8.310 nan 0.000 0.476 1241 E N 2.950 123.133 120.200 -0.028 0.000 2.166 1241 E HA 0.331 4.680 4.350 -0.000 0.000 0.279 1241 E C 0.312 176.822 176.600 -0.151 0.000 1.095 1241 E CA -0.037 56.312 56.400 -0.085 0.000 0.888 1241 E CB 0.400 30.076 29.700 -0.040 0.000 1.041 1241 E HN 0.593 nan 8.360 nan 0.000 0.414 1242 T N 2.020 116.386 114.554 -0.314 0.000 2.952 1242 T HA 0.554 4.904 4.350 -0.000 0.000 0.286 1242 T C -0.213 174.286 174.700 -0.336 0.000 1.024 1242 T CA -1.135 60.747 62.100 -0.362 0.000 1.029 1242 T CB 1.467 70.011 68.868 -0.540 0.000 1.094 1242 T HN 0.422 nan 8.240 nan 0.000 0.515 1243 R N 1.031 121.416 120.500 -0.191 0.000 2.518 1243 R HA 0.554 4.894 4.340 -0.000 0.000 0.296 1243 R C -2.124 174.169 176.300 -0.012 0.000 1.080 1243 R CA -0.599 55.457 56.100 -0.073 0.000 0.922 1243 R CB 1.601 31.885 30.300 -0.027 0.000 1.184 1243 R HN 0.573 nan 8.270 nan 0.000 0.445 1244 V N 5.270 125.219 119.914 0.059 0.000 2.370 1244 V HA 0.354 4.474 4.120 -0.000 0.000 0.279 1244 V C -0.107 176.011 176.094 0.041 0.000 1.029 1244 V CA -0.568 61.772 62.300 0.067 0.000 0.870 1244 V CB 1.610 33.520 31.823 0.145 0.000 0.984 1244 V HN 0.578 nan 8.190 nan 0.000 0.451 1245 K N 3.705 124.107 120.400 0.003 0.000 2.185 1245 K HA 0.512 4.832 4.320 -0.000 0.000 0.269 1245 K C -0.957 175.595 176.600 -0.080 0.000 0.987 1245 K CA -0.518 55.765 56.287 -0.006 0.000 0.865 1245 K CB 2.077 34.595 32.500 0.029 0.000 1.090 1245 K HN 0.407 nan 8.250 nan 0.000 0.450 1246 V N 5.061 124.927 119.914 -0.081 0.000 2.334 1246 V HA 0.047 4.167 4.120 -0.000 0.000 0.267 1246 V C 1.184 177.144 176.094 -0.223 0.000 1.040 1246 V CA -0.246 61.963 62.300 -0.153 0.000 0.866 1246 V CB 0.901 32.651 31.823 -0.121 0.000 1.019 1246 V HN 0.641 nan 8.190 nan 0.000 0.468 1247 V N 2.064 121.806 119.914 -0.286 0.000 3.085 1247 V HA 0.320 4.440 4.120 -0.000 0.000 0.245 1247 V C 0.870 176.638 176.094 -0.544 0.000 1.114 1247 V CA 0.298 62.379 62.300 -0.364 0.000 1.108 1247 V CB -0.181 31.565 31.823 -0.128 0.000 0.798 1247 V HN 0.607 nan 8.190 nan 0.000 0.471 1248 K N 2.187 122.287 120.400 -0.499 0.000 2.316 1248 K HA 0.433 4.753 4.320 -0.000 0.000 0.267 1248 K C -1.119 175.294 176.600 -0.313 0.000 1.025 1248 K CA -0.313 55.659 56.287 -0.525 0.000 0.896 1248 K CB 0.616 32.694 32.500 -0.704 0.000 1.124 1248 K HN 0.354 nan 8.250 nan 0.000 0.451 1249 N N 3.665 122.219 118.700 -0.243 0.000 2.549 1249 N HA 0.170 4.910 4.740 -0.000 0.000 0.281 1249 N C -1.009 174.457 175.510 -0.072 0.000 1.084 1249 N CA -0.429 52.532 53.050 -0.148 0.000 0.862 1249 N CB 1.135 39.534 38.487 -0.147 0.000 1.333 1249 N HN 0.473 nan 8.380 nan 0.000 0.523 1250 K N 2.989 123.359 120.400 -0.050 0.000 2.570 1250 K HA 0.250 4.570 4.320 -0.000 0.000 0.210 1250 K C 0.391 176.981 176.600 -0.016 0.000 1.048 1250 K CA -0.039 56.240 56.287 -0.014 0.000 1.167 1250 K CB 0.593 33.093 32.500 -0.001 0.000 0.892 1250 K HN 0.427 nan 8.250 nan 0.000 0.480 1251 I N -0.036 120.518 120.570 -0.027 0.000 3.194 1251 I HA 0.070 4.240 4.170 -0.000 0.000 0.271 1251 I C 0.891 177.001 176.117 -0.012 0.000 1.150 1251 I CA 0.444 61.730 61.300 -0.022 0.000 1.440 1251 I CB 0.502 38.482 38.000 -0.033 0.000 1.276 1251 I HN 0.096 nan 8.210 nan 0.000 0.457 1252 A N -0.424 122.387 122.820 -0.014 0.000 5.139 1252 A HA 0.812 5.132 4.320 -0.000 0.000 0.164 1252 A C -0.734 176.854 177.584 0.007 0.000 0.803 1252 A CA 0.054 52.090 52.037 -0.001 0.000 1.038 1252 A CB -0.661 18.337 19.000 -0.004 0.000 2.123 1252 A HN 0.014 nan 8.150 nan 0.000 0.998 1253 A N 1.577 124.406 122.820 0.015 0.000 2.505 1253 A HA 0.545 4.865 4.320 -0.000 0.000 0.271 1253 A C -2.476 175.119 177.584 0.019 0.000 1.112 1253 A CA -0.527 51.534 52.037 0.039 0.000 0.781 1253 A CB -1.014 18.011 19.000 0.043 0.000 1.059 1253 A HN 0.299 nan 8.150 nan 0.000 0.508 1254 P HA 0.528 nan 4.420 nan 0.000 0.278 1254 P C 0.004 177.318 177.300 0.024 0.000 1.258 1254 P CA -0.412 62.603 63.100 -0.142 0.000 0.811 1254 P CB 0.093 31.623 31.700 -0.282 0.000 1.063 1255 F N -3.134 116.831 119.950 0.024 0.000 2.794 1255 F HA -0.238 4.289 4.527 -0.000 0.000 0.335 1255 F C 0.675 176.482 175.800 0.012 0.000 0.653 1255 F CA 0.745 58.759 58.000 0.024 0.000 1.266 1255 F CB -1.988 37.029 39.000 0.029 0.000 1.666 1255 F HN 0.238 nan 8.300 nan 0.000 0.314 1256 K N 1.632 122.100 120.400 0.115 0.000 2.202 1256 K HA 0.428 4.748 4.320 -0.000 0.000 0.264 1256 K C 0.475 177.107 176.600 0.053 0.000 1.010 1256 K CA -0.126 56.206 56.287 0.076 0.000 0.940 1256 K CB 0.950 33.475 32.500 0.042 0.000 0.983 1256 K HN 0.476 nan 8.250 nan 0.000 0.475 1257 Q N -0.240 119.594 119.800 0.055 0.000 2.528 1257 Q HA 0.756 5.096 4.340 -0.000 0.000 0.289 1257 Q C -1.743 174.293 176.000 0.060 0.000 1.091 1257 Q CA -1.299 54.536 55.803 0.055 0.000 0.797 1257 Q CB 2.103 30.880 28.738 0.065 0.000 1.466 1257 Q HN 0.495 nan 8.270 nan 0.000 0.436 1258 A N 1.319 124.191 122.820 0.086 0.000 2.497 1258 A HA 0.431 4.751 4.320 -0.000 0.000 0.280 1258 A C -1.381 176.332 177.584 0.216 0.000 1.065 1258 A CA -0.669 51.446 52.037 0.129 0.000 0.781 1258 A CB 1.229 20.294 19.000 0.109 0.000 1.289 1258 A HN 0.692 nan 8.150 nan 0.000 0.415 1259 E N 1.248 121.554 120.200 0.178 0.000 2.266 1259 E HA 0.734 5.084 4.350 -0.000 0.000 0.277 1259 E C -0.624 176.144 176.600 0.281 0.000 1.018 1259 E CA -0.267 56.219 56.400 0.142 0.000 0.840 1259 E CB 1.540 31.279 29.700 0.065 0.000 1.082 1259 E HN 0.711 nan 8.360 nan 0.000 0.395 1260 F N -1.327 118.628 119.950 0.008 0.000 3.122 1260 F HA 0.356 4.883 4.527 -0.000 0.000 0.325 1260 F C -1.582 174.231 175.800 0.021 0.000 1.162 1260 F CA -1.223 56.782 58.000 0.008 0.000 0.876 1260 F CB 1.067 40.059 39.000 -0.013 0.000 1.429 1260 F HN 0.167 nan 8.300 nan 0.000 0.484 1261 Q N 1.313 121.223 119.800 0.184 0.000 2.309 1261 Q HA 0.707 5.047 4.340 -0.000 0.000 0.264 1261 Q C -1.343 174.748 176.000 0.153 0.000 1.008 1261 Q CA -0.931 54.913 55.803 0.068 0.000 0.853 1261 Q CB 3.106 31.913 28.738 0.115 0.000 1.314 1261 Q HN 0.568 nan 8.270 nan 0.000 0.448 1262 I N 2.796 123.403 120.570 0.062 0.000 2.389 1262 I HA 0.290 4.460 4.170 -0.000 0.000 0.288 1262 I C -1.034 175.186 176.117 0.171 0.000 0.999 1262 I CA -0.834 60.544 61.300 0.130 0.000 1.129 1262 I CB 1.214 39.256 38.000 0.071 0.000 1.288 1262 I HN 0.287 nan 8.210 nan 0.000 0.444 1263 L N 6.958 128.302 121.223 0.203 0.000 2.272 1263 L HA 0.372 4.712 4.340 -0.000 0.000 0.289 1263 L C -0.468 176.594 176.870 0.319 0.000 1.032 1263 L CA -0.208 54.787 54.840 0.259 0.000 0.810 1263 L CB 0.595 42.770 42.059 0.194 0.000 1.205 1263 L HN 0.315 nan 8.230 nan 0.000 0.422 1264 Y N 3.341 123.707 120.300 0.111 0.000 2.944 1264 Y HA 0.062 4.612 4.550 -0.000 0.000 0.340 1264 Y C 1.651 177.655 175.900 0.174 0.000 1.275 1264 Y CA 0.972 59.144 58.100 0.121 0.000 1.590 1264 Y CB 0.261 38.756 38.460 0.059 0.000 1.218 1264 Y HN 0.885 nan 8.280 nan 0.000 0.576 1265 G N 2.685 111.736 108.800 0.419 0.000 2.203 1265 G HA2 -0.353 3.607 3.960 -0.000 0.000 0.263 1265 G HA3 -0.353 3.607 3.960 -0.000 0.000 0.263 1265 G C 0.489 175.506 174.900 0.195 0.000 1.012 1265 G CA 0.833 46.140 45.100 0.346 0.000 0.749 1265 G HN 0.776 nan 8.290 nan 0.000 0.512 1266 E N -2.261 118.042 120.200 0.173 0.000 2.583 1266 E HA 0.436 4.786 4.350 -0.000 0.000 0.204 1266 E C 1.378 177.988 176.600 0.016 0.000 0.860 1266 E CA 0.940 57.386 56.400 0.077 0.000 1.473 1266 E CB 0.583 30.349 29.700 0.110 0.000 1.469 1266 E HN 1.540 nan 8.360 nan 0.000 0.788 1267 G N 0.988 109.827 108.800 0.066 0.000 2.341 1267 G HA2 -0.126 3.834 3.960 -0.000 0.000 0.196 1267 G HA3 -0.126 3.834 3.960 -0.000 0.000 0.196 1267 G C -0.848 174.115 174.900 0.105 0.000 1.231 1267 G CA -0.391 44.725 45.100 0.027 0.000 1.155 1267 G HN 0.093 nan 8.290 nan 0.000 0.529 1268 I N 1.635 122.251 120.570 0.078 0.000 2.441 1268 I HA 0.170 4.340 4.170 -0.000 0.000 0.287 1268 I C 0.360 176.534 176.117 0.096 0.000 1.049 1268 I CA -0.540 60.834 61.300 0.122 0.000 1.381 1268 I CB 1.196 39.208 38.000 0.021 0.000 1.409 1268 I HN 0.397 nan 8.210 nan 0.000 0.523 1269 N N 5.911 124.707 118.700 0.161 0.000 2.670 1269 N HA -0.068 4.672 4.740 -0.000 0.000 0.296 1269 N C 0.751 176.323 175.510 0.103 0.000 1.216 1269 N CA 0.246 53.385 53.050 0.149 0.000 1.123 1269 N CB -0.228 38.366 38.487 0.178 0.000 1.459 1269 N HN 0.449 nan 8.380 nan 0.000 0.509 1270 F N 2.455 122.306 119.950 -0.166 0.000 2.043 1270 F HA -0.304 4.223 4.527 -0.000 0.000 0.297 1270 F C 1.114 176.743 175.800 -0.284 0.000 1.118 1270 F CA 1.878 59.672 58.000 -0.343 0.000 1.202 1270 F CB -0.422 38.179 39.000 -0.666 0.000 0.965 1270 F HN 0.469 nan 8.300 nan 0.000 0.482 1271 Y N -0.085 120.393 120.300 0.296 0.000 2.314 1271 Y HA 0.052 4.602 4.550 -0.000 0.000 0.293 1271 Y C 2.632 178.593 175.900 0.103 0.000 1.129 1271 Y CA 0.654 58.845 58.100 0.151 0.000 1.201 1271 Y CB -1.441 37.047 38.460 0.046 0.000 0.999 1271 Y HN 0.102 nan 8.280 nan 0.000 0.541 1272 G N 1.034 109.973 108.800 0.231 0.000 2.739 1272 G HA2 -0.370 3.590 3.960 -0.000 0.000 0.216 1272 G HA3 -0.370 3.590 3.960 -0.000 0.000 0.216 1272 G C 1.472 176.440 174.900 0.113 0.000 1.298 1272 G CA 1.510 46.700 45.100 0.151 0.000 0.804 1272 G HN 0.578 nan 8.290 nan 0.000 0.623 1273 E N 0.192 120.454 120.200 0.102 0.000 2.219 1273 E HA -0.154 4.196 4.350 -0.000 0.000 0.198 1273 E C 2.372 179.004 176.600 0.054 0.000 0.998 1273 E CA 1.112 57.550 56.400 0.065 0.000 0.818 1273 E CB -0.347 29.357 29.700 0.007 0.000 0.741 1273 E HN 0.341 nan 8.360 nan 0.000 0.477 1274 L N 1.484 122.764 121.223 0.095 0.000 2.017 1274 L HA -0.147 4.193 4.340 -0.000 0.000 0.208 1274 L C 2.354 179.270 176.870 0.076 0.000 1.073 1274 L CA 1.357 56.267 54.840 0.117 0.000 0.745 1274 L CB -0.613 41.584 42.059 0.230 0.000 0.894 1274 L HN 0.085 nan 8.230 nan 0.000 0.432 1275 V N 0.124 120.069 119.914 0.052 0.000 2.220 1275 V HA -0.382 3.738 4.120 -0.000 0.000 0.250 1275 V C 2.314 178.388 176.094 -0.033 0.000 1.056 1275 V CA 2.217 64.490 62.300 -0.046 0.000 1.016 1275 V CB -0.911 30.817 31.823 -0.160 0.000 0.639 1275 V HN 0.448 nan 8.190 nan 0.000 0.446 1276 D N -0.440 119.957 120.400 -0.006 0.000 2.280 1276 D HA -0.155 4.485 4.640 -0.000 0.000 0.206 1276 D C 1.795 178.122 176.300 0.045 0.000 0.988 1276 D CA 1.172 55.190 54.000 0.030 0.000 0.886 1276 D CB -0.076 40.755 40.800 0.052 0.000 0.914 1276 D HN 0.271 nan 8.370 nan 0.000 0.473 1277 L N -0.255 120.992 121.223 0.041 0.000 2.168 1277 L HA 0.136 4.476 4.340 -0.000 0.000 0.203 1277 L C 2.496 179.400 176.870 0.057 0.000 1.078 1277 L CA 1.091 55.958 54.840 0.045 0.000 0.780 1277 L CB -1.151 40.929 42.059 0.035 0.000 0.939 1277 L HN -0.018 nan 8.230 nan 0.000 0.451 1278 G N -1.321 107.515 108.800 0.061 0.000 2.708 1278 G HA2 0.023 3.983 3.960 -0.000 0.000 0.210 1278 G HA3 0.023 3.983 3.960 -0.000 0.000 0.210 1278 G C 1.377 176.334 174.900 0.095 0.000 1.141 1278 G CA 0.667 45.816 45.100 0.082 0.000 0.788 1278 G HN 0.225 nan 8.290 nan 0.000 0.531 1279 V N 0.154 120.120 119.914 0.088 0.000 2.283 1279 V HA 0.014 4.134 4.120 -0.000 0.000 0.239 1279 V C 2.595 178.746 176.094 0.095 0.000 1.035 1279 V CA 1.700 64.070 62.300 0.117 0.000 1.018 1279 V CB -0.276 31.625 31.823 0.130 0.000 0.658 1279 V HN 0.288 nan 8.190 nan 0.000 0.459 1280 K N 0.017 120.463 120.400 0.076 0.000 2.155 1280 K HA -0.066 4.254 4.320 -0.000 0.000 0.203 1280 K C 0.422 177.056 176.600 0.057 0.000 1.052 1280 K CA 0.799 57.124 56.287 0.063 0.000 0.948 1280 K CB 0.165 32.697 32.500 0.053 0.000 0.728 1280 K HN 0.366 nan 8.250 nan 0.000 0.448 1281 E N 2.355 122.591 120.200 0.061 0.000 2.136 1281 E HA 0.021 4.371 4.350 -0.000 0.000 0.246 1281 E C -0.845 175.798 176.600 0.071 0.000 1.017 1281 E CA -0.160 56.275 56.400 0.058 0.000 0.883 1281 E CB 0.842 30.574 29.700 0.054 0.000 1.199 1281 E HN 0.107 nan 8.360 nan 0.000 0.447 1282 K N 2.710 123.150 120.400 0.067 0.000 2.210 1282 K HA -0.126 4.194 4.320 -0.000 0.000 0.202 1282 K C 0.652 177.305 176.600 0.087 0.000 0.990 1282 K CA 0.341 56.672 56.287 0.074 0.000 1.322 1282 K CB -0.547 31.986 32.500 0.055 0.000 0.955 1282 K HN 0.385 nan 8.250 nan 0.000 0.258 1283 L N 0.389 121.685 121.223 0.121 0.000 2.425 1283 L HA 0.213 4.553 4.340 -0.000 0.000 0.215 1283 L C 0.756 177.778 176.870 0.253 0.000 1.065 1283 L CA 0.329 55.275 54.840 0.175 0.000 0.842 1283 L CB 0.286 42.467 42.059 0.202 0.000 1.033 1283 L HN 0.327 nan 8.230 nan 0.000 0.474 1284 I N -0.718 119.983 120.570 0.217 0.000 2.406 1284 I HA 0.289 4.459 4.170 -0.000 0.000 0.290 1284 I C -0.522 175.718 176.117 0.205 0.000 0.999 1284 I CA -0.693 60.749 61.300 0.238 0.000 1.124 1284 I CB 1.793 39.904 38.000 0.186 0.000 1.289 1284 I HN -0.167 nan 8.210 nan 0.000 0.441 1285 E N 5.858 126.172 120.200 0.190 0.000 2.130 1285 E HA 0.166 4.516 4.350 -0.000 0.000 0.284 1285 E C -0.591 176.113 176.600 0.173 0.000 1.018 1285 E CA -0.389 56.097 56.400 0.144 0.000 0.817 1285 E CB 0.862 30.609 29.700 0.078 0.000 1.078 1285 E HN 0.318 nan 8.360 nan 0.000 0.396 1286 K N 3.326 123.817 120.400 0.151 0.000 2.262 1286 K HA 0.295 4.615 4.320 -0.000 0.000 0.288 1286 K C -0.689 175.919 176.600 0.013 0.000 1.090 1286 K CA -0.105 56.220 56.287 0.063 0.000 0.918 1286 K CB 0.342 32.894 32.500 0.087 0.000 1.139 1286 K HN 0.537 nan 8.250 nan 0.000 0.462 1287 A N 4.033 126.854 122.820 0.002 0.000 3.258 1287 A HA 0.379 4.699 4.320 -0.000 0.000 0.275 1287 A C 0.964 178.577 177.584 0.048 0.000 1.452 1287 A CA 0.272 52.325 52.037 0.027 0.000 1.120 1287 A CB -0.434 18.579 19.000 0.022 0.000 1.107 1287 A HN 1.065 nan 8.150 nan 0.000 0.651 1288 G N 0.317 109.111 108.800 -0.010 0.000 4.951 1288 G HA2 -0.130 3.830 3.960 -0.000 0.000 0.295 1288 G HA3 -0.130 3.830 3.960 -0.000 0.000 0.295 1288 G C 1.297 176.134 174.900 -0.106 0.000 1.540 1288 G CA 0.609 45.696 45.100 -0.020 0.000 1.044 1288 G HN 1.723 nan 8.290 nan 0.000 0.731 1289 A N -0.797 121.961 122.820 -0.103 0.000 2.382 1289 A HA 0.582 4.902 4.320 -0.000 0.000 0.228 1289 A C 0.446 177.762 177.584 -0.447 0.000 1.217 1289 A CA 0.436 52.311 52.037 -0.270 0.000 0.923 1289 A CB 0.142 18.997 19.000 -0.242 0.000 0.979 1289 A HN 0.554 nan 8.150 nan 0.000 0.515 1290 W N -1.029 120.072 121.300 -0.331 0.000 2.449 1290 W HA 0.584 5.244 4.660 -0.000 0.000 0.331 1290 W C -0.681 175.597 176.519 -0.401 0.000 1.119 1290 W CA -0.075 57.105 57.345 -0.275 0.000 1.240 1290 W CB 0.597 29.970 29.460 -0.145 0.000 1.251 1290 W HN 0.184 nan 8.180 nan 0.000 0.576 1291 Y N 2.256 122.681 120.300 0.208 0.000 2.345 1291 Y HA 0.398 4.948 4.550 -0.000 0.000 0.331 1291 Y C 0.161 176.097 175.900 0.060 0.000 0.959 1291 Y CA -0.717 57.441 58.100 0.098 0.000 1.204 1291 Y CB 1.254 39.730 38.460 0.027 0.000 1.135 1291 Y HN 0.149 nan 8.280 nan 0.000 0.477 1292 S N 2.931 118.756 115.700 0.208 0.000 2.501 1292 S HA 0.327 4.797 4.470 -0.000 0.000 0.301 1292 S C -1.594 173.090 174.600 0.139 0.000 1.096 1292 S CA -0.740 57.520 58.200 0.101 0.000 1.063 1292 S CB 1.232 64.458 63.200 0.043 0.000 1.042 1292 S HN 0.532 nan 8.310 nan 0.000 0.494 1293 Y N 2.968 123.226 120.300 -0.070 0.000 2.555 1293 Y HA 0.360 4.910 4.550 -0.000 0.000 0.326 1293 Y C -0.186 175.707 175.900 -0.011 0.000 0.984 1293 Y CA -0.906 57.174 58.100 -0.033 0.000 1.298 1293 Y CB -0.061 38.367 38.460 -0.053 0.000 1.094 1293 Y HN 0.805 nan 8.280 nan 0.000 0.500 1294 K N 4.754 124.970 120.400 -0.306 0.000 4.361 1294 K HA -0.229 4.091 4.320 -0.000 0.000 0.294 1294 K C 1.035 177.548 176.600 -0.144 0.000 0.970 1294 K CA 0.857 56.976 56.287 -0.279 0.000 0.913 1294 K CB -1.309 30.931 32.500 -0.433 0.000 1.583 1294 K HN 1.242 nan 8.250 nan 0.000 0.438 1295 G N 0.692 109.436 108.800 -0.092 0.000 2.855 1295 G HA2 -0.430 3.530 3.960 -0.000 0.000 0.231 1295 G HA3 -0.430 3.530 3.960 -0.000 0.000 0.231 1295 G C 0.012 174.870 174.900 -0.070 0.000 1.242 1295 G CA 0.733 45.788 45.100 -0.075 0.000 0.789 1295 G HN 0.661 nan 8.290 nan 0.000 0.517 1296 E N 2.083 122.251 120.200 -0.054 0.000 2.316 1296 E HA 0.368 4.718 4.350 -0.000 0.000 0.275 1296 E C -0.189 176.379 176.600 -0.053 0.000 1.029 1296 E CA -0.153 56.224 56.400 -0.038 0.000 0.871 1296 E CB 0.336 30.037 29.700 0.002 0.000 1.022 1296 E HN 0.449 nan 8.360 nan 0.000 0.418 1297 K N 4.426 124.788 120.400 -0.064 0.000 2.258 1297 K HA 0.184 4.504 4.320 -0.000 0.000 0.284 1297 K C 0.882 177.407 176.600 -0.125 0.000 1.051 1297 K CA -0.045 56.217 56.287 -0.041 0.000 0.923 1297 K CB 0.868 33.357 32.500 -0.019 0.000 1.046 1297 K HN 0.583 nan 8.250 nan 0.000 0.474 1298 I N -1.462 118.967 120.570 -0.234 0.000 4.032 1298 I HA 0.365 4.535 4.170 -0.000 0.000 0.313 1298 I C 0.554 176.405 176.117 -0.442 0.000 1.272 1298 I CA -0.138 60.720 61.300 -0.737 0.000 1.307 1298 I CB 1.084 38.345 38.000 -1.233 0.000 1.155 1298 I HN 0.504 nan 8.210 nan 0.000 0.431 1299 G N 1.140 109.906 108.800 -0.057 0.000 2.655 1299 G HA2 0.348 4.308 3.960 -0.000 0.000 0.296 1299 G HA3 0.348 4.308 3.960 -0.000 0.000 0.296 1299 G C -2.152 172.760 174.900 0.020 0.000 1.485 1299 G CA -0.565 44.552 45.100 0.029 0.000 0.869 1299 G HN 0.194 nan 8.290 nan 0.000 0.540 1300 Q N 0.517 120.204 119.800 -0.190 0.000 2.333 1300 Q HA 0.566 4.906 4.340 -0.000 0.000 0.265 1300 Q C 0.338 176.206 176.000 -0.221 0.000 0.989 1300 Q CA 0.317 55.832 55.803 -0.481 0.000 0.842 1300 Q CB 1.408 29.603 28.738 -0.906 0.000 1.262 1300 Q HN 2.215 nan 8.270 nan 0.000 0.451 1301 G N 3.160 111.860 108.800 -0.166 0.000 2.854 1301 G HA2 -0.271 3.689 3.960 -0.000 0.000 0.686 1301 G HA3 -0.271 3.689 3.960 -0.000 0.000 0.686 1301 G C 0.198 175.226 174.900 0.214 0.000 1.202 1301 G CA 0.097 45.196 45.100 -0.001 0.000 0.878 1301 G HN 0.842 nan 8.290 nan 0.000 0.583 1302 K N 1.558 122.155 120.400 0.329 0.000 2.189 1302 K HA -0.192 4.128 4.320 -0.000 0.000 0.207 1302 K C 2.884 179.545 176.600 0.101 0.000 1.046 1302 K CA 2.602 59.031 56.287 0.236 0.000 0.928 1302 K CB -0.347 32.249 32.500 0.161 0.000 0.720 1302 K HN 1.295 nan 8.250 nan 0.000 0.458 1303 A N 1.992 124.863 122.820 0.085 0.000 1.863 1303 A HA -0.285 4.035 4.320 -0.000 0.000 0.218 1303 A C 1.792 179.411 177.584 0.060 0.000 1.233 1303 A CA 2.301 54.372 52.037 0.056 0.000 0.655 1303 A CB -0.896 18.123 19.000 0.032 0.000 0.839 1303 A HN 0.532 nan 8.150 nan 0.000 0.454 1304 N N -0.134 118.603 118.700 0.061 0.000 2.354 1304 N HA 0.027 4.767 4.740 -0.000 0.000 0.179 1304 N C 1.910 177.488 175.510 0.114 0.000 1.021 1304 N CA 1.153 54.248 53.050 0.076 0.000 0.887 1304 N CB -0.471 38.045 38.487 0.049 0.000 0.974 1304 N HN 0.530 nan 8.380 nan 0.000 0.437 1305 A N 1.583 124.460 122.820 0.095 0.000 1.841 1305 A HA -0.169 4.151 4.320 -0.000 0.000 0.216 1305 A C 2.349 179.970 177.584 0.062 0.000 1.199 1305 A CA 2.217 54.279 52.037 0.041 0.000 0.621 1305 A CB -1.373 17.507 19.000 -0.201 0.000 0.835 1305 A HN 0.254 nan 8.150 nan 0.000 0.445 1306 T N 0.724 115.292 114.554 0.023 0.000 2.427 1306 T HA -0.289 4.061 4.350 -0.000 0.000 0.244 1306 T C 1.994 176.725 174.700 0.052 0.000 1.325 1306 T CA 2.695 64.833 62.100 0.065 0.000 1.173 1306 T CB -0.933 67.984 68.868 0.082 0.000 0.859 1306 T HN 0.811 nan 8.240 nan 0.000 0.415 1307 A N -0.642 122.208 122.820 0.051 0.000 2.248 1307 A HA -0.004 4.316 4.320 -0.000 0.000 0.210 1307 A C 1.832 179.413 177.584 -0.005 0.000 1.174 1307 A CA 1.055 53.092 52.037 -0.001 0.000 0.750 1307 A CB -1.013 17.999 19.000 0.021 0.000 0.780 1307 A HN 0.740 nan 8.150 nan 0.000 0.478 1308 W N 0.263 121.489 121.300 -0.124 0.000 2.444 1308 W HA -0.038 4.622 4.660 -0.000 0.000 0.308 1308 W C 1.617 178.004 176.519 -0.220 0.000 1.183 1308 W CA 1.533 58.801 57.345 -0.128 0.000 1.340 1308 W CB -0.269 29.148 29.460 -0.072 0.000 1.138 1308 W HN 0.221 nan 8.180 nan 0.000 0.510 1309 L N 1.051 122.209 121.223 -0.109 0.000 2.189 1309 L HA -0.264 4.076 4.340 -0.000 0.000 0.214 1309 L C 2.393 178.753 176.870 -0.850 0.000 1.097 1309 L CA 1.650 56.234 54.840 -0.426 0.000 0.764 1309 L CB -1.075 40.854 42.059 -0.215 0.000 0.900 1309 L HN 0.051 nan 8.230 nan 0.000 0.436 1310 K N 0.116 120.003 120.400 -0.855 0.000 2.152 1310 K HA -0.188 4.132 4.320 -0.000 0.000 0.206 1310 K C 1.284 177.555 176.600 -0.550 0.000 1.048 1310 K CA 1.565 57.337 56.287 -0.858 0.000 0.933 1310 K CB 0.114 32.344 32.500 -0.450 0.000 0.721 1310 K HN 0.300 nan 8.250 nan 0.000 0.447 1311 D N -0.205 119.884 120.400 -0.518 0.000 2.367 1311 D HA 0.007 4.647 4.640 -0.000 0.000 0.207 1311 D C -0.233 175.784 176.300 -0.472 0.000 1.034 1311 D CA 0.443 54.190 54.000 -0.421 0.000 0.861 1311 D CB 0.254 40.841 40.800 -0.356 0.000 0.943 1311 D HN 0.212 nan 8.370 nan 0.000 0.515 1312 N N 1.481 119.801 118.700 -0.634 0.000 2.886 1312 N HA 0.154 4.894 4.740 -0.000 0.000 0.285 1312 N C -2.155 173.111 175.510 -0.406 0.000 1.706 1312 N CA -1.088 51.631 53.050 -0.551 0.000 0.904 1312 N CB 1.959 39.960 38.487 -0.810 0.000 1.224 1312 N HN -0.051 nan 8.380 nan 0.000 0.488 1313 P HA -0.200 nan 4.420 nan 0.000 0.214 1313 P C 1.721 178.933 177.300 -0.146 0.000 1.163 1313 P CA 1.387 64.360 63.100 -0.212 0.000 0.883 1313 P CB 0.288 31.896 31.700 -0.152 0.000 0.788 1314 E N -0.048 120.079 120.200 -0.122 0.000 2.085 1314 E HA -0.190 4.160 4.350 -0.000 0.000 0.194 1314 E C 1.564 178.127 176.600 -0.063 0.000 0.994 1314 E CA 2.134 58.489 56.400 -0.075 0.000 0.801 1314 E CB -2.137 27.531 29.700 -0.054 0.000 0.743 1314 E HN 0.175 nan 8.360 nan 0.000 0.453 1315 T N 1.369 115.865 114.554 -0.096 0.000 2.759 1315 T HA -0.040 4.310 4.350 -0.000 0.000 0.269 1315 T C 1.950 176.592 174.700 -0.095 0.000 1.042 1315 T CA 2.022 64.072 62.100 -0.084 0.000 1.140 1315 T CB -0.355 68.436 68.868 -0.127 0.000 0.864 1315 T HN 0.479 nan 8.240 nan 0.000 0.455 1316 A N 2.102 124.860 122.820 -0.103 0.000 1.826 1316 A HA -0.017 4.303 4.320 -0.000 0.000 0.214 1316 A C 2.163 179.752 177.584 0.008 0.000 1.212 1316 A CA 1.001 53.022 52.037 -0.027 0.000 0.605 1316 A CB -0.413 18.605 19.000 0.029 0.000 0.861 1316 A HN 0.344 nan 8.150 nan 0.000 0.447 1317 K N -0.116 120.271 120.400 -0.021 0.000 2.520 1317 K HA -0.172 4.148 4.320 -0.000 0.000 0.197 1317 K C 1.754 178.365 176.600 0.019 0.000 1.044 1317 K CA 1.237 57.516 56.287 -0.015 0.000 0.938 1317 K CB -0.017 32.449 32.500 -0.056 0.000 0.767 1317 K HN 0.708 nan 8.250 nan 0.000 0.481 1318 E N 1.029 121.241 120.200 0.020 0.000 2.127 1318 E HA -0.031 4.319 4.350 -0.000 0.000 0.191 1318 E C 1.978 178.614 176.600 0.060 0.000 0.964 1318 E CA 0.165 56.589 56.400 0.041 0.000 0.832 1318 E CB 0.146 29.874 29.700 0.047 0.000 0.790 1318 E HN 0.196 nan 8.360 nan 0.000 0.465 1319 I N 1.767 122.372 120.570 0.059 0.000 2.286 1319 I HA -0.257 3.913 4.170 -0.000 0.000 0.248 1319 I C 2.649 178.814 176.117 0.081 0.000 1.115 1319 I CA 1.100 62.446 61.300 0.076 0.000 1.392 1319 I CB -0.332 37.698 38.000 0.050 0.000 1.065 1319 I HN 0.272 nan 8.210 nan 0.000 0.418 1320 E N 1.737 121.991 120.200 0.090 0.000 2.037 1320 E HA -0.373 3.977 4.350 -0.000 0.000 0.214 1320 E C 2.212 178.857 176.600 0.075 0.000 1.041 1320 E CA 2.318 58.785 56.400 0.112 0.000 0.872 1320 E CB -0.181 29.614 29.700 0.158 0.000 0.785 1320 E HN 0.318 nan 8.360 nan 0.000 0.476 1321 K N 0.358 120.796 120.400 0.065 0.000 2.107 1321 K HA -0.238 4.082 4.320 -0.000 0.000 0.211 1321 K C 2.250 178.877 176.600 0.045 0.000 1.049 1321 K CA 1.947 58.262 56.287 0.047 0.000 0.927 1321 K CB -0.049 32.475 32.500 0.041 0.000 0.714 1321 K HN -0.025 nan 8.250 nan 0.000 0.452 1322 K N 0.308 120.741 120.400 0.056 0.000 2.152 1322 K HA -0.106 4.213 4.320 -0.000 0.000 0.206 1322 K C 1.976 178.606 176.600 0.050 0.000 1.048 1322 K CA 1.336 57.658 56.287 0.057 0.000 0.933 1322 K CB -0.058 32.488 32.500 0.077 0.000 0.721 1322 K HN 0.141 nan 8.250 nan 0.000 0.447 1323 V N 0.390 120.333 119.914 0.049 0.000 2.788 1323 V HA -0.054 4.066 4.120 -0.000 0.000 0.251 1323 V C 2.187 178.295 176.094 0.023 0.000 1.068 1323 V CA 0.940 63.263 62.300 0.038 0.000 1.090 1323 V CB -0.382 31.464 31.823 0.038 0.000 0.710 1323 V HN 0.213 nan 8.190 nan 0.000 0.467 1324 R N 0.142 120.656 120.500 0.022 0.000 2.189 1324 R HA -0.094 4.246 4.340 -0.000 0.000 0.223 1324 R C 2.134 178.441 176.300 0.012 0.000 1.092 1324 R CA 1.132 57.239 56.100 0.010 0.000 0.989 1324 R CB -0.051 30.256 30.300 0.010 0.000 0.876 1324 R HN 0.618 nan 8.270 nan 0.000 0.457 1325 E N 0.131 120.343 120.200 0.019 0.000 2.230 1325 E HA -0.050 4.300 4.350 -0.000 0.000 0.192 1325 E C 1.496 178.106 176.600 0.018 0.000 0.987 1325 E CA 0.573 56.984 56.400 0.018 0.000 0.841 1325 E CB 0.250 29.963 29.700 0.023 0.000 0.783 1325 E HN 0.228 nan 8.360 nan 0.000 0.481 1326 L N 0.148 121.384 121.223 0.021 0.000 2.567 1326 L HA 0.115 4.455 4.340 -0.000 0.000 0.225 1326 L C 1.251 178.131 176.870 0.016 0.000 1.119 1326 L CA 0.289 55.142 54.840 0.021 0.000 0.871 1326 L CB 0.566 42.643 42.059 0.029 0.000 1.036 1326 L HN 0.062 nan 8.230 nan 0.000 0.459 1327 L N -0.661 120.569 121.223 0.011 0.000 3.429 1327 L HA 0.298 4.638 4.340 -0.000 0.000 0.311 1327 L C -1.012 175.857 176.870 -0.001 0.000 1.274 1327 L CA -0.025 54.818 54.840 0.005 0.000 1.037 1327 L CB 0.922 42.984 42.059 0.004 0.000 1.433 1327 L HN 0.041 nan 8.230 nan 0.000 0.614 2007 Q N 0.545 120.348 119.800 0.005 0.000 2.444 2007 Q HA 0.069 4.409 4.340 -0.000 0.000 0.206 2007 Q C 0.814 176.819 176.000 0.008 0.000 0.948 2007 Q CA 0.510 56.317 55.803 0.007 0.000 0.946 2007 Q CB 0.273 29.014 28.738 0.006 0.000 1.027 2007 Q HN 0.306 nan 8.270 nan 0.000 0.513 2008 K N 0.769 121.173 120.400 0.007 0.000 1.984 2008 K HA -0.101 4.219 4.320 -0.000 0.000 0.209 2008 K C 1.916 178.521 176.600 0.009 0.000 1.046 2008 K CA 1.343 57.634 56.287 0.007 0.000 0.934 2008 K CB -0.037 32.466 32.500 0.006 0.000 0.717 2008 K HN 0.155 nan 8.250 nan 0.000 0.438 2009 A N 0.419 123.244 122.820 0.009 0.000 2.016 2009 A HA -0.041 4.279 4.320 -0.000 0.000 0.217 2009 A C 1.897 179.489 177.584 0.013 0.000 1.162 2009 A CA 0.718 52.761 52.037 0.010 0.000 0.662 2009 A CB -0.254 18.751 19.000 0.009 0.000 0.812 2009 A HN 0.287 nan 8.150 nan 0.000 0.450 2010 L N -0.424 120.807 121.223 0.013 0.000 2.022 2010 L HA 0.155 4.495 4.340 -0.000 0.000 0.204 2010 L C 2.667 179.548 176.870 0.019 0.000 1.076 2010 L CA 1.878 56.728 54.840 0.016 0.000 0.749 2010 L CB -0.687 41.380 42.059 0.014 0.000 0.903 2010 L HN 0.270 nan 8.230 nan 0.000 0.439 2011 A N -0.653 122.177 122.820 0.016 0.000 2.139 2011 A HA -0.150 4.170 4.320 -0.000 0.000 0.221 2011 A C 2.228 179.823 177.584 0.019 0.000 1.159 2011 A CA 1.912 53.960 52.037 0.018 0.000 0.662 2011 A CB -0.953 18.055 19.000 0.014 0.000 0.796 2011 A HN 0.604 nan 8.150 nan 0.000 0.463 2012 A N -0.847 121.984 122.820 0.017 0.000 1.901 2012 A HA 0.489 4.809 4.320 -0.000 0.000 0.210 2012 A C 2.284 179.881 177.584 0.021 0.000 1.208 2012 A CA 1.115 53.163 52.037 0.017 0.000 0.644 2012 A CB -0.752 18.257 19.000 0.014 0.000 0.863 2012 A HN 1.010 nan 8.150 nan 0.000 0.454 2013 A N -0.475 122.359 122.820 0.023 0.000 2.209 2013 A HA 0.251 4.571 4.320 -0.000 0.000 0.212 2013 A C 1.922 179.529 177.584 0.039 0.000 1.158 2013 A CA 0.587 52.642 52.037 0.030 0.000 0.742 2013 A CB -0.471 18.546 19.000 0.028 0.000 0.790 2013 A HN 0.462 nan 8.150 nan 0.000 0.472 2014 L N -1.004 120.241 121.223 0.037 0.000 1.971 2014 L HA -0.034 4.306 4.340 -0.000 0.000 0.208 2014 L C 2.734 179.634 176.870 0.049 0.000 1.083 2014 L CA 1.185 56.051 54.840 0.044 0.000 0.753 2014 L CB -0.959 41.124 42.059 0.038 0.000 0.893 2014 L HN 0.444 nan 8.230 nan 0.000 0.436 2015 G N -1.101 107.723 108.800 0.039 0.000 2.564 2015 G HA2 -0.234 3.726 3.960 -0.000 0.000 0.217 2015 G HA3 -0.234 3.726 3.960 -0.000 0.000 0.217 2015 G C 1.402 176.323 174.900 0.034 0.000 1.120 2015 G CA 0.196 45.318 45.100 0.036 0.000 0.752 2015 G HN 0.366 nan 8.290 nan 0.000 0.558 2016 Q N -0.453 119.370 119.800 0.037 0.000 2.297 2016 Q HA 0.004 4.344 4.340 -0.000 0.000 0.204 2016 Q C 2.276 178.302 176.000 0.044 0.000 0.962 2016 Q CA 0.579 56.401 55.803 0.031 0.000 0.879 2016 Q CB 0.065 28.822 28.738 0.032 0.000 0.947 2016 Q HN 0.530 nan 8.270 nan 0.000 0.462 2017 I N -0.873 119.749 120.570 0.087 0.000 3.081 2017 I HA -0.015 4.155 4.170 -0.000 0.000 0.274 2017 I C 1.794 178.004 176.117 0.154 0.000 1.178 2017 I CA 0.502 61.901 61.300 0.166 0.000 1.460 2017 I CB -0.884 37.239 38.000 0.205 0.000 1.137 2017 I HN 0.105 nan 8.210 nan 0.000 0.443 2018 E N 1.522 121.783 120.200 0.102 0.000 2.150 2018 E HA -0.213 4.137 4.350 -0.000 0.000 0.193 2018 E C 2.075 178.708 176.600 0.054 0.000 0.985 2018 E CA 0.914 57.365 56.400 0.085 0.000 0.814 2018 E CB 0.127 29.865 29.700 0.064 0.000 0.752 2018 E HN 0.365 nan 8.360 nan 0.000 0.466 2019 K N 0.667 121.083 120.400 0.026 0.000 2.062 2019 K HA -0.160 4.160 4.320 -0.000 0.000 0.205 2019 K C 2.145 178.718 176.600 -0.044 0.000 1.051 2019 K CA 1.134 57.418 56.287 -0.006 0.000 0.941 2019 K CB 0.128 32.619 32.500 -0.014 0.000 0.719 2019 K HN 0.027 nan 8.250 nan 0.000 0.440 2020 Q N -1.166 118.581 119.800 -0.088 0.000 2.259 2020 Q HA 0.006 4.346 4.340 -0.000 0.000 0.201 2020 Q C -0.115 175.664 176.000 -0.368 0.000 0.938 2020 Q CA 0.598 56.234 55.803 -0.278 0.000 0.872 2020 Q CB 0.504 28.992 28.738 -0.417 0.000 0.971 2020 Q HN 0.155 nan 8.270 nan 0.000 0.494 2021 F N 0.435 120.400 119.950 0.025 0.000 2.893 2021 F HA 0.398 4.925 4.527 -0.000 0.000 0.340 2021 F C 0.199 176.021 175.800 0.036 0.000 1.300 2021 F CA 0.050 58.068 58.000 0.030 0.000 1.227 2021 F CB 1.093 40.111 39.000 0.031 0.000 1.044 2021 F HN 0.066 nan 8.300 nan 0.000 0.512 2022 G N 1.384 110.287 108.800 0.171 0.000 2.977 2022 G HA2 -0.256 3.704 3.960 -0.000 0.000 0.686 2022 G HA3 -0.256 3.704 3.960 -0.000 0.000 0.686 2022 G C -0.450 174.516 174.900 0.110 0.000 1.088 2022 G CA -1.117 44.059 45.100 0.126 0.000 0.845 2022 G HN 0.260 nan 8.290 nan 0.000 0.565 2023 K N 1.178 121.624 120.400 0.077 0.000 2.419 2023 K HA 0.488 4.808 4.320 -0.000 0.000 0.282 2023 K C 1.211 177.852 176.600 0.070 0.000 1.056 2023 K CA 1.255 57.581 56.287 0.064 0.000 1.035 2023 K CB 0.660 33.187 32.500 0.045 0.000 0.921 2023 K HN 2.227 nan 8.250 nan 0.000 0.472 2024 G N 2.104 110.948 108.800 0.074 0.000 2.401 2024 G HA2 -0.246 3.714 3.960 -0.000 0.000 0.283 2024 G HA3 -0.246 3.714 3.960 -0.000 0.000 0.283 2024 G C 0.157 175.108 174.900 0.086 0.000 1.117 2024 G CA -0.069 45.075 45.100 0.073 0.000 1.051 2024 G HN 0.474 nan 8.290 nan 0.000 0.510 2025 S N -0.292 115.467 115.700 0.099 0.000 2.552 2025 S HA 0.631 5.101 4.470 -0.000 0.000 0.246 2025 S C 0.303 174.957 174.600 0.090 0.000 1.019 2025 S CA 0.424 58.683 58.200 0.098 0.000 1.045 2025 S CB -0.223 63.041 63.200 0.107 0.000 0.784 2025 S HN 1.140 nan 8.310 nan 0.000 0.453 2026 I N 1.207 121.832 120.570 0.091 0.000 2.614 2026 I HA 0.335 4.505 4.170 -0.000 0.000 0.300 2026 I C -2.165 174.003 176.117 0.086 0.000 1.825 2026 I CA -0.679 60.675 61.300 0.091 0.000 0.951 2026 I CB 1.478 39.525 38.000 0.079 0.000 1.487 2026 I HN 0.258 nan 8.210 nan 0.000 0.581 2027 M N 4.025 123.678 119.600 0.090 0.000 2.853 2027 M HA 0.479 4.959 4.480 -0.000 0.000 0.273 2027 M C -1.707 174.637 176.300 0.073 0.000 1.128 2027 M CA -1.024 54.321 55.300 0.075 0.000 0.814 2027 M CB 1.776 34.419 32.600 0.073 0.000 1.667 2027 M HN 0.543 nan 8.290 nan 0.000 0.519 2028 R N 0.783 121.315 120.500 0.054 0.000 2.537 2028 R HA 0.321 4.661 4.340 -0.000 0.000 0.280 2028 R C 0.749 177.078 176.300 0.049 0.000 1.058 2028 R CA -0.092 56.033 56.100 0.042 0.000 1.057 2028 R CB 0.699 31.016 30.300 0.029 0.000 0.973 2028 R HN 0.641 nan 8.270 nan 0.000 0.438 2029 L N 1.650 122.898 121.223 0.041 0.000 2.291 2029 L HA -0.026 4.314 4.340 -0.000 0.000 0.214 2029 L C 1.940 178.835 176.870 0.042 0.000 1.120 2029 L CA 1.115 55.987 54.840 0.052 0.000 0.799 2029 L CB -0.029 42.047 42.059 0.027 0.000 0.925 2029 L HN 0.852 nan 8.230 nan 0.000 0.446 2030 G N -0.885 107.931 108.800 0.026 0.000 3.181 2030 G HA2 0.004 3.964 3.960 -0.000 0.000 0.219 2030 G HA3 0.004 3.964 3.960 -0.000 0.000 0.219 2030 G C 0.353 175.267 174.900 0.024 0.000 1.182 2030 G CA -0.305 44.808 45.100 0.021 0.000 0.791 2030 G HN 0.231 nan 8.290 nan 0.000 0.537 2031 E N 0.108 120.327 120.200 0.030 0.000 2.313 2031 E HA 0.129 4.479 4.350 -0.000 0.000 0.276 2031 E C 0.007 176.623 176.600 0.026 0.000 1.031 2031 E CA -0.260 56.157 56.400 0.028 0.000 0.857 2031 E CB 1.106 30.826 29.700 0.033 0.000 1.040 2031 E HN 0.075 nan 8.360 nan 0.000 0.408 2032 D N 1.281 121.694 120.400 0.021 0.000 2.277 2032 D HA -0.054 4.586 4.640 -0.000 0.000 0.208 2032 D C 0.362 176.673 176.300 0.018 0.000 0.962 2032 D CA 0.495 54.506 54.000 0.018 0.000 0.865 2032 D CB 0.216 41.025 40.800 0.014 0.000 0.939 2032 D HN 0.088 nan 8.370 nan 0.000 0.510 2033 R N 1.436 121.948 120.500 0.021 0.000 2.446 2033 R HA 0.083 4.423 4.340 -0.000 0.000 0.314 2033 R C -0.574 175.740 176.300 0.022 0.000 1.003 2033 R CA 0.190 56.302 56.100 0.021 0.000 1.018 2033 R CB 0.075 30.389 30.300 0.024 0.000 0.945 2033 R HN 0.088 nan 8.270 nan 0.000 0.419 2034 S N 4.756 120.466 115.700 0.017 0.000 2.449 2034 S HA 0.342 4.812 4.470 -0.000 0.000 0.310 2034 S C 0.325 174.934 174.600 0.015 0.000 1.096 2034 S CA -1.035 57.174 58.200 0.015 0.000 1.095 2034 S CB 1.419 64.624 63.200 0.009 0.000 1.007 2034 S HN 0.518 nan 8.310 nan 0.000 0.474 2035 M N 2.627 122.238 119.600 0.018 0.000 2.327 2035 M HA 0.076 4.556 4.480 -0.000 0.000 0.353 2035 M C -0.245 176.062 176.300 0.011 0.000 1.539 2035 M CA 0.136 55.446 55.300 0.017 0.000 1.039 2035 M CB -0.402 32.210 32.600 0.021 0.000 1.967 2035 M HN 0.622 nan 8.290 nan 0.000 0.459 2036 D N 3.643 124.049 120.400 0.010 0.000 2.801 2036 D HA 0.233 4.873 4.640 -0.000 0.000 0.232 2036 D C -0.625 175.678 176.300 0.006 0.000 1.128 2036 D CA 0.096 54.100 54.000 0.007 0.000 1.003 2036 D CB 0.039 40.843 40.800 0.006 0.000 1.110 2036 D HN 0.240 nan 8.370 nan 0.000 0.477 2037 V N 0.982 120.899 119.914 0.005 0.000 2.785 2037 V HA 0.220 4.340 4.120 -0.000 0.000 0.300 2037 V C 0.925 177.018 176.094 -0.001 0.000 1.062 2037 V CA -0.845 61.456 62.300 0.003 0.000 1.029 2037 V CB 1.650 33.475 31.823 0.004 0.000 1.024 2037 V HN 0.204 nan 8.190 nan 0.000 0.477 2038 E N 1.277 121.475 120.200 -0.003 0.000 2.373 2038 E HA 0.444 4.794 4.350 -0.000 0.000 0.263 2038 E C -0.195 176.400 176.600 -0.009 0.000 1.073 2038 E CA -0.107 56.290 56.400 -0.005 0.000 0.894 2038 E CB 0.962 30.660 29.700 -0.004 0.000 1.008 2038 E HN 0.918 nan 8.360 nan 0.000 0.420 2039 T N -0.196 114.352 114.554 -0.011 0.000 2.886 2039 T HA 0.549 4.899 4.350 -0.000 0.000 0.292 2039 T C -0.475 174.214 174.700 -0.017 0.000 1.012 2039 T CA -0.915 61.175 62.100 -0.017 0.000 0.982 2039 T CB 0.774 69.630 68.868 -0.020 0.000 1.018 2039 T HN 0.135 nan 8.240 nan 0.000 0.451 2040 I N 2.401 122.959 120.570 -0.021 0.000 2.354 2040 I HA 0.351 4.521 4.170 -0.000 0.000 0.292 2040 I C 0.909 177.009 176.117 -0.029 0.000 0.989 2040 I CA -0.601 60.687 61.300 -0.020 0.000 1.188 2040 I CB 1.510 39.500 38.000 -0.017 0.000 1.342 2040 I HN 0.858 nan 8.210 nan 0.000 0.457 2041 S N 3.641 119.324 115.700 -0.029 0.000 2.546 2041 S HA 0.012 4.482 4.470 -0.000 0.000 0.290 2041 S C 1.617 176.185 174.600 -0.052 0.000 1.290 2041 S CA 0.150 58.322 58.200 -0.047 0.000 1.069 2041 S CB 0.383 63.561 63.200 -0.036 0.000 0.846 2041 S HN 0.810 nan 8.310 nan 0.000 0.495 2042 T N 2.680 117.184 114.554 -0.082 0.000 2.951 2042 T HA 0.221 4.571 4.350 -0.000 0.000 0.268 2042 T C 1.547 176.201 174.700 -0.077 0.000 1.073 2042 T CA 1.165 63.216 62.100 -0.082 0.000 1.134 2042 T CB -0.473 68.321 68.868 -0.124 0.000 0.884 2042 T HN 1.406 nan 8.240 nan 0.000 0.479 2043 G N 0.431 109.167 108.800 -0.106 0.000 2.436 2043 G HA2 -0.182 3.778 3.960 -0.000 0.000 0.204 2043 G HA3 -0.182 3.778 3.960 -0.000 0.000 0.204 2043 G C 0.373 175.142 174.900 -0.219 0.000 1.026 2043 G CA 0.175 45.225 45.100 -0.084 0.000 0.658 2043 G HN 0.985 nan 8.290 nan 0.000 0.499 2044 S N 2.068 117.573 115.700 -0.324 0.000 2.404 2044 S HA 0.588 5.058 4.470 -0.000 0.000 0.309 2044 S C 1.857 176.191 174.600 -0.443 0.000 1.076 2044 S CA -0.439 57.455 58.200 -0.510 0.000 1.095 2044 S CB 0.246 62.830 63.200 -1.026 0.000 0.972 2044 S HN 0.346 nan 8.310 nan 0.000 0.484 2045 L N 4.403 125.353 121.223 -0.454 0.000 2.034 2045 L HA -0.160 4.180 4.340 -0.000 0.000 0.217 2045 L C 2.783 179.502 176.870 -0.253 0.000 1.077 2045 L CA 2.576 57.203 54.840 -0.354 0.000 0.769 2045 L CB -1.682 40.145 42.059 -0.388 0.000 0.890 2045 L HN 0.891 nan 8.230 nan 0.000 0.435 2046 S N -0.903 114.646 115.700 -0.252 0.000 2.423 2046 S HA -0.186 4.284 4.470 -0.000 0.000 0.231 2046 S C 1.990 176.482 174.600 -0.181 0.000 1.014 2046 S CA 0.846 58.944 58.200 -0.169 0.000 0.965 2046 S CB -0.580 62.559 63.200 -0.101 0.000 0.785 2046 S HN 0.429 nan 8.310 nan 0.000 0.495 2047 L N 1.547 122.598 121.223 -0.287 0.000 2.005 2047 L HA -0.118 4.222 4.340 -0.000 0.000 0.207 2047 L C 2.102 178.878 176.870 -0.158 0.000 1.072 2047 L CA 1.955 56.657 54.840 -0.231 0.000 0.744 2047 L CB -0.620 41.249 42.059 -0.316 0.000 0.895 2047 L HN 0.182 nan 8.230 nan 0.000 0.433 2048 D N 0.364 120.661 120.400 -0.171 0.000 2.160 2048 D HA -0.289 4.351 4.640 -0.000 0.000 0.189 2048 D C 2.093 178.339 176.300 -0.089 0.000 1.003 2048 D CA 1.962 55.889 54.000 -0.121 0.000 0.846 2048 D CB -0.448 40.276 40.800 -0.128 0.000 0.949 2048 D HN 0.354 nan 8.370 nan 0.000 0.446 2049 I N 1.137 121.652 120.570 -0.092 0.000 2.087 2049 I HA -0.338 3.832 4.170 -0.000 0.000 0.240 2049 I C 2.413 178.505 176.117 -0.042 0.000 1.054 2049 I CA 1.814 63.078 61.300 -0.060 0.000 1.311 2049 I CB -0.269 37.696 38.000 -0.058 0.000 1.024 2049 I HN -0.025 nan 8.210 nan 0.000 0.402 2050 A N -0.152 122.642 122.820 -0.045 0.000 2.119 2050 A HA -0.066 4.254 4.320 -0.000 0.000 0.217 2050 A C 2.280 179.847 177.584 -0.028 0.000 1.153 2050 A CA 0.858 52.881 52.037 -0.023 0.000 0.692 2050 A CB -0.703 18.290 19.000 -0.012 0.000 0.799 2050 A HN 0.439 nan 8.150 nan 0.000 0.458 2051 L N -1.646 119.549 121.223 -0.047 0.000 2.191 2051 L HA -0.094 4.246 4.340 -0.000 0.000 0.212 2051 L C 2.178 179.029 176.870 -0.031 0.000 1.103 2051 L CA 1.227 56.038 54.840 -0.049 0.000 0.769 2051 L CB -0.213 41.810 42.059 -0.060 0.000 0.908 2051 L HN 0.622 nan 8.230 nan 0.000 0.438 2052 G N -1.504 107.282 108.800 -0.023 0.000 2.420 2052 G HA2 -0.368 3.592 3.960 -0.000 0.000 0.221 2052 G HA3 -0.368 3.592 3.960 -0.000 0.000 0.221 2052 G C 1.002 175.895 174.900 -0.011 0.000 1.117 2052 G CA 0.426 45.521 45.100 -0.009 0.000 0.657 2052 G HN 0.462 nan 8.290 nan 0.000 0.512 2053 A N 0.355 123.165 122.820 -0.017 0.000 2.147 2053 A HA 0.584 4.904 4.320 -0.000 0.000 0.211 2053 A C 2.368 179.938 177.584 -0.022 0.000 1.160 2053 A CA 1.925 53.953 52.037 -0.015 0.000 0.781 2053 A CB -0.307 18.685 19.000 -0.014 0.000 0.842 2053 A HN 2.558 nan 8.150 nan 0.000 0.475 2054 G N -1.872 106.908 108.800 -0.034 0.000 2.203 2054 G HA2 0.398 4.358 3.960 -0.000 0.000 0.231 2054 G HA3 0.398 4.358 3.960 -0.000 0.000 0.231 2054 G C 0.798 175.668 174.900 -0.050 0.000 1.058 2054 G CA 0.277 45.350 45.100 -0.044 0.000 0.781 2054 G HN 2.309 nan 8.290 nan 0.000 0.496 2055 G N -1.625 107.142 108.800 -0.054 0.000 2.339 2055 G HA2 0.414 4.374 3.960 -0.000 0.000 0.381 2055 G HA3 0.414 4.374 3.960 -0.000 0.000 0.381 2055 G C -0.458 174.416 174.900 -0.044 0.000 1.400 2055 G CA -0.520 44.549 45.100 -0.052 0.000 1.002 2055 G HN 1.016 nan 8.290 nan 0.000 0.633 2056 L N 1.983 123.181 121.223 -0.042 0.000 2.380 2056 L HA 0.355 4.695 4.340 -0.000 0.000 0.273 2056 L C -1.474 175.379 176.870 -0.029 0.000 1.138 2056 L CA -1.604 53.213 54.840 -0.038 0.000 0.832 2056 L CB 1.019 43.055 42.059 -0.038 0.000 1.124 2056 L HN 0.351 nan 8.230 nan 0.000 0.454 2057 P HA -0.007 nan 4.420 nan 0.000 0.264 2057 P C -0.611 176.678 177.300 -0.018 0.000 1.193 2057 P CA -0.045 63.044 63.100 -0.018 0.000 0.763 2057 P CB 0.500 32.192 31.700 -0.014 0.000 0.810 2058 M N 2.182 121.773 119.600 -0.014 0.000 2.200 2058 M HA 0.189 4.669 4.480 -0.000 0.000 0.355 2058 M C 1.550 177.842 176.300 -0.014 0.000 1.283 2058 M CA 0.646 55.938 55.300 -0.015 0.000 1.124 2058 M CB -0.391 32.202 32.600 -0.011 0.000 1.625 2058 M HN 0.809 nan 8.290 nan 0.000 0.463 2059 G N 3.125 111.914 108.800 -0.019 0.000 2.179 2059 G HA2 -0.220 3.740 3.960 -0.000 0.000 0.257 2059 G HA3 -0.220 3.740 3.960 -0.000 0.000 0.257 2059 G C 0.124 175.013 174.900 -0.018 0.000 1.010 2059 G CA 0.029 45.118 45.100 -0.019 0.000 0.736 2059 G HN 0.579 nan 8.290 nan 0.000 0.513 2060 R N -0.821 119.669 120.500 -0.017 0.000 2.892 2060 R HA 0.668 5.008 4.340 -0.000 0.000 0.265 2060 R C 0.279 176.574 176.300 -0.009 0.000 1.025 2060 R CA -1.185 54.911 56.100 -0.006 0.000 0.982 2060 R CB 1.101 31.402 30.300 0.002 0.000 1.185 2060 R HN 0.196 nan 8.270 nan 0.000 0.484 2061 I N 1.429 122.011 120.570 0.020 0.000 2.365 2061 I HA 0.224 4.394 4.170 -0.000 0.000 0.291 2061 I C -0.165 175.973 176.117 0.034 0.000 1.004 2061 I CA -0.715 60.608 61.300 0.038 0.000 1.311 2061 I CB 1.509 39.588 38.000 0.131 0.000 1.401 2061 I HN 0.003 nan 8.210 nan 0.000 0.491 2062 V N 6.386 126.307 119.914 0.012 0.000 2.487 2062 V HA 0.272 4.392 4.120 -0.000 0.000 0.298 2062 V C -0.109 176.008 176.094 0.038 0.000 1.028 2062 V CA -0.638 61.657 62.300 -0.007 0.000 0.860 2062 V CB 1.867 33.666 31.823 -0.039 0.000 0.991 2062 V HN 0.686 nan 8.190 nan 0.000 0.427 2063 E N 4.960 125.154 120.200 -0.009 0.000 2.113 2063 E HA 0.518 4.868 4.350 -0.000 0.000 0.273 2063 E C -1.291 175.230 176.600 -0.132 0.000 0.924 2063 E CA -0.492 55.899 56.400 -0.014 0.000 0.764 2063 E CB 1.234 30.890 29.700 -0.074 0.000 1.104 2063 E HN 0.612 nan 8.360 nan 0.000 0.406 2064 I N 6.263 126.804 120.570 -0.048 0.000 2.339 2064 I HA 0.248 4.418 4.170 -0.000 0.000 0.290 2064 I C -0.686 175.469 176.117 0.062 0.000 0.994 2064 I CA -0.891 60.377 61.300 -0.053 0.000 1.191 2064 I CB 0.468 38.475 38.000 0.011 0.000 1.343 2064 I HN 0.464 nan 8.210 nan 0.000 0.458 2065 Y N 4.632 124.934 120.300 0.003 0.000 2.662 2065 Y HA 1.006 5.556 4.550 -0.000 0.000 0.335 2065 Y C -0.132 175.767 175.900 -0.001 0.000 1.066 2065 Y CA -2.494 55.604 58.100 -0.003 0.000 1.116 2065 Y CB 1.074 39.521 38.460 -0.022 0.000 1.308 2065 Y HN 0.636 nan 8.280 nan 0.000 0.502 2066 G N -0.267 108.639 108.800 0.177 0.000 2.313 2066 G HA2 0.432 4.392 3.960 -0.000 0.000 0.296 2066 G HA3 0.432 4.392 3.960 -0.000 0.000 0.296 2066 G C -3.504 171.373 174.900 -0.038 0.000 1.356 2066 G CA -1.161 43.959 45.100 0.034 0.000 0.833 2066 G HN 0.565 nan 8.290 nan 0.000 0.552 2067 P HA 0.217 nan 4.420 nan 0.000 0.271 2067 P C 0.293 177.577 177.300 -0.028 0.000 1.233 2067 P CA -0.122 62.950 63.100 -0.047 0.000 0.789 2067 P CB 0.398 32.072 31.700 -0.043 0.000 0.951 2068 E N -0.146 120.035 120.200 -0.032 0.000 2.459 2068 E HA 0.027 4.377 4.350 -0.000 0.000 0.264 2068 E C -0.348 176.230 176.600 -0.035 0.000 1.055 2068 E CA -0.377 56.004 56.400 -0.031 0.000 0.957 2068 E CB -0.510 29.168 29.700 -0.035 0.000 0.952 2068 E HN 0.310 nan 8.360 nan 0.000 0.448 2069 S N 0.713 116.387 115.700 -0.044 0.000 3.550 2069 S HA -0.201 4.269 4.470 -0.000 0.000 0.372 2069 S C 0.679 175.249 174.600 -0.049 0.000 0.966 2069 S CA 0.825 58.988 58.200 -0.061 0.000 1.229 2069 S CB -1.917 61.244 63.200 -0.065 0.000 0.917 2069 S HN 0.749 nan 8.310 nan 0.000 0.496 2070 S N -0.310 115.369 115.700 -0.034 0.000 2.510 2070 S HA 0.542 5.012 4.470 -0.000 0.000 0.230 2070 S C 1.588 176.171 174.600 -0.028 0.000 1.066 2070 S CA 0.619 58.806 58.200 -0.022 0.000 0.941 2070 S CB 0.647 63.849 63.200 0.003 0.000 0.829 2070 S HN 1.746 nan 8.310 nan 0.000 0.530 2071 G N 1.905 110.696 108.800 -0.015 0.000 3.272 2071 G HA2 -0.114 3.846 3.960 -0.000 0.000 0.219 2071 G HA3 -0.114 3.846 3.960 -0.000 0.000 0.219 2071 G C 0.860 175.787 174.900 0.045 0.000 0.952 2071 G CA 0.183 45.282 45.100 -0.002 0.000 0.833 2071 G HN 0.491 nan 8.290 nan 0.000 0.608 2072 K N 0.056 120.484 120.400 0.048 0.000 2.113 2072 K HA -0.094 4.226 4.320 -0.000 0.000 0.208 2072 K C 1.931 178.576 176.600 0.075 0.000 1.047 2072 K CA 1.933 58.264 56.287 0.072 0.000 0.928 2072 K CB -0.532 32.014 32.500 0.076 0.000 0.716 2072 K HN 0.164 nan 8.250 nan 0.000 0.446 2073 T N 0.953 115.542 114.554 0.057 0.000 2.851 2073 T HA -0.056 4.294 4.350 -0.000 0.000 0.262 2073 T C 1.753 176.511 174.700 0.097 0.000 1.043 2073 T CA 1.700 63.844 62.100 0.074 0.000 1.140 2073 T CB -0.322 68.577 68.868 0.052 0.000 0.872 2073 T HN 0.400 nan 8.240 nan 0.000 0.446 2074 T N 2.613 117.227 114.554 0.100 0.000 2.624 2074 T HA -0.126 4.224 4.350 -0.000 0.000 0.268 2074 T C 1.862 176.658 174.700 0.159 0.000 1.041 2074 T CA 1.287 63.498 62.100 0.184 0.000 1.159 2074 T CB -0.586 68.399 68.868 0.195 0.000 0.863 2074 T HN 0.204 nan 8.240 nan 0.000 0.434 2075 L N 0.184 121.495 121.223 0.147 0.000 1.994 2075 L HA -0.163 4.177 4.340 -0.000 0.000 0.208 2075 L C 2.826 179.753 176.870 0.094 0.000 1.071 2075 L CA 1.577 56.498 54.840 0.135 0.000 0.745 2075 L CB -0.731 41.417 42.059 0.148 0.000 0.892 2075 L HN 0.262 nan 8.230 nan 0.000 0.431 2076 T N -0.135 114.475 114.554 0.094 0.000 2.653 2076 T HA -0.244 4.106 4.350 -0.000 0.000 0.268 2076 T C 1.700 176.453 174.700 0.090 0.000 1.035 2076 T CA 1.900 64.055 62.100 0.091 0.000 1.154 2076 T CB -0.206 68.730 68.868 0.113 0.000 0.862 2076 T HN 0.127 nan 8.240 nan 0.000 0.441 2077 L N 0.844 122.121 121.223 0.091 0.000 2.217 2077 L HA 0.052 4.392 4.340 -0.000 0.000 0.211 2077 L C 2.644 179.538 176.870 0.040 0.000 1.107 2077 L CA 1.289 56.163 54.840 0.056 0.000 0.783 2077 L CB -0.486 41.606 42.059 0.055 0.000 0.919 2077 L HN 0.193 nan 8.230 nan 0.000 0.442 2078 Q N -0.679 119.155 119.800 0.056 0.000 2.167 2078 Q HA -0.100 4.240 4.340 -0.000 0.000 0.202 2078 Q C 2.308 178.324 176.000 0.026 0.000 0.970 2078 Q CA 1.803 57.632 55.803 0.043 0.000 0.855 2078 Q CB -0.103 28.674 28.738 0.065 0.000 0.911 2078 Q HN 0.567 nan 8.270 nan 0.000 0.438 2079 V N -1.799 118.131 119.914 0.026 0.000 2.379 2079 V HA -0.159 3.961 4.120 -0.000 0.000 0.245 2079 V C 2.225 178.327 176.094 0.014 0.000 1.044 2079 V CA 1.129 63.437 62.300 0.013 0.000 1.036 2079 V CB -0.875 30.953 31.823 0.008 0.000 0.664 2079 V HN 0.143 nan 8.190 nan 0.000 0.453 2080 I N 1.201 121.785 120.570 0.023 0.000 2.423 2080 I HA -0.212 3.958 4.170 -0.000 0.000 0.254 2080 I C 2.775 178.895 176.117 0.005 0.000 1.151 2080 I CA 1.502 62.814 61.300 0.020 0.000 1.421 2080 I CB -0.543 37.474 38.000 0.028 0.000 1.079 2080 I HN 0.398 nan 8.210 nan 0.000 0.431 2081 A N 0.790 123.611 122.820 0.002 0.000 1.832 2081 A HA -0.041 4.279 4.320 -0.000 0.000 0.214 2081 A C 2.572 180.157 177.584 0.002 0.000 1.204 2081 A CA 1.379 53.413 52.037 -0.004 0.000 0.606 2081 A CB -1.051 17.946 19.000 -0.006 0.000 0.849 2081 A HN 0.358 nan 8.150 nan 0.000 0.445 2082 A N -0.266 122.559 122.820 0.009 0.000 2.032 2082 A HA 0.066 4.386 4.320 -0.000 0.000 0.221 2082 A C 2.367 179.954 177.584 0.006 0.000 1.165 2082 A CA 2.332 54.375 52.037 0.011 0.000 0.645 2082 A CB -0.862 18.145 19.000 0.012 0.000 0.807 2082 A HN 1.065 nan 8.150 nan 0.000 0.453 2083 A N -1.262 121.560 122.820 0.004 0.000 1.874 2083 A HA -0.115 4.205 4.320 -0.000 0.000 0.214 2083 A C 2.071 179.657 177.584 0.002 0.000 1.189 2083 A CA 1.344 53.382 52.037 0.002 0.000 0.615 2083 A CB -0.446 18.556 19.000 0.003 0.000 0.830 2083 A HN 0.582 nan 8.150 nan 0.000 0.443 2084 Q N -0.950 118.851 119.800 0.002 0.000 2.364 2084 Q HA -0.011 4.329 4.340 -0.000 0.000 0.207 2084 Q C 1.417 177.417 176.000 -0.001 0.000 0.970 2084 Q CA 0.668 56.471 55.803 0.000 0.000 0.888 2084 Q CB 0.003 28.739 28.738 -0.003 0.000 0.951 2084 Q HN 0.509 nan 8.270 nan 0.000 0.469 2085 R N -0.113 120.387 120.500 -0.001 0.000 2.426 2085 R HA 0.069 4.409 4.340 -0.000 0.000 0.263 2085 R C 0.453 176.753 176.300 -0.000 0.000 0.961 2085 R CA 0.125 56.224 56.100 -0.002 0.000 1.086 2085 R CB 0.481 30.780 30.300 -0.003 0.000 1.186 2085 R HN 0.170 nan 8.270 nan 0.000 0.537 2086 E N -1.510 118.690 120.200 0.001 0.000 2.601 2086 E HA 0.156 4.506 4.350 -0.000 0.000 0.219 2086 E C 0.694 177.295 176.600 0.001 0.000 0.964 2086 E CA 0.327 56.728 56.400 0.001 0.000 1.050 2086 E CB 1.448 31.149 29.700 0.001 0.000 1.068 2086 E HN 0.423 nan 8.360 nan 0.000 0.496 2087 G N 2.116 110.917 108.800 0.001 0.000 2.611 2087 G HA2 -0.276 3.684 3.960 -0.000 0.000 0.208 2087 G HA3 -0.276 3.684 3.960 -0.000 0.000 0.208 2087 G C 0.105 175.007 174.900 0.004 0.000 1.201 2087 G CA -0.305 44.797 45.100 0.003 0.000 0.739 2087 G HN 0.128 nan 8.290 nan 0.000 0.528 2088 K N 2.954 123.356 120.400 0.003 0.000 2.477 2088 K HA 0.284 4.603 4.320 -0.000 0.000 0.275 2088 K C 0.518 177.122 176.600 0.006 0.000 1.054 2088 K CA 1.188 57.477 56.287 0.004 0.000 1.135 2088 K CB 0.077 32.578 32.500 0.002 0.000 0.854 2088 K HN 0.603 nan 8.250 nan 0.000 0.484 2089 T N 0.168 114.728 114.554 0.009 0.000 2.907 2089 T HA 0.516 4.866 4.350 -0.000 0.000 0.284 2089 T C 0.296 175.006 174.700 0.017 0.000 1.004 2089 T CA -1.091 61.018 62.100 0.014 0.000 1.063 2089 T CB 0.719 69.597 68.868 0.017 0.000 0.992 2089 T HN 0.633 nan 8.240 nan 0.000 0.483 2090 C N 0.765 120.081 119.300 0.025 0.000 2.719 2090 C HA 1.012 5.472 4.460 -0.000 0.000 0.327 2090 C C 0.244 175.268 174.990 0.057 0.000 1.238 2090 C CA -1.175 57.863 59.018 0.035 0.000 1.727 2090 C CB 0.690 28.452 27.740 0.038 0.000 2.256 2090 C HN 1.250 nan 8.230 nan 0.000 0.489 2091 A N 0.624 123.485 122.820 0.067 0.000 2.414 2091 A HA 0.853 5.173 4.320 -0.000 0.000 0.306 2091 A C -1.453 176.222 177.584 0.151 0.000 1.054 2091 A CA -0.243 51.852 52.037 0.097 0.000 0.724 2091 A CB 1.157 20.189 19.000 0.054 0.000 1.267 2091 A HN 1.019 nan 8.150 nan 0.000 0.418 2092 F N 4.045 124.002 119.950 0.011 0.000 2.496 2092 F HA 0.566 5.093 4.527 -0.000 0.000 0.341 2092 F C -0.970 174.857 175.800 0.046 0.000 1.134 2092 F CA -0.986 57.023 58.000 0.015 0.000 0.968 2092 F CB 1.024 40.030 39.000 0.011 0.000 1.205 2092 F HN 0.389 nan 8.300 nan 0.000 0.436 2093 I N 4.517 124.888 120.570 -0.331 0.000 2.325 2093 I HA 0.253 4.423 4.170 -0.000 0.000 0.291 2093 I C -0.504 175.376 176.117 -0.396 0.000 1.019 2093 I CA -0.406 60.761 61.300 -0.222 0.000 1.302 2093 I CB 0.848 38.753 38.000 -0.158 0.000 1.401 2093 I HN 0.484 nan 8.210 nan 0.000 0.485 2094 D N 5.081 125.416 120.400 -0.108 0.000 2.440 2094 D HA 0.590 5.230 4.640 -0.000 0.000 0.239 2094 D C 0.443 176.766 176.300 0.038 0.000 1.084 2094 D CA -0.321 53.671 54.000 -0.015 0.000 0.843 2094 D CB 1.870 42.934 40.800 0.440 0.000 1.097 2094 D HN 0.630 nan 8.370 nan 0.000 0.531 2095 A N 3.732 126.505 122.820 -0.079 0.000 2.303 2095 A HA 0.104 4.424 4.320 -0.000 0.000 0.217 2095 A C 1.533 178.839 177.584 -0.465 0.000 1.205 2095 A CA 0.101 52.066 52.037 -0.120 0.000 0.875 2095 A CB 0.228 19.281 19.000 0.089 0.000 0.910 2095 A HN 0.473 nan 8.150 nan 0.000 0.501 2096 E N -0.232 119.766 120.200 -0.337 0.000 2.166 2096 E HA 0.026 4.376 4.350 -0.000 0.000 0.192 2096 E C -0.622 175.882 176.600 -0.160 0.000 0.967 2096 E CA 0.478 56.744 56.400 -0.224 0.000 0.840 2096 E CB -0.236 29.447 29.700 -0.029 0.000 0.795 2096 E HN 0.803 nan 8.360 nan 0.000 0.470 2097 H N -0.627 118.581 119.070 0.228 0.000 2.765 2097 H HA -0.178 4.378 4.556 -0.000 0.000 0.332 2097 H C 0.432 175.960 175.328 0.334 0.000 1.180 2097 H CA -0.065 56.184 56.048 0.334 0.000 1.142 2097 H CB -1.350 28.497 29.762 0.141 0.000 1.576 2097 H HN 0.278 nan 8.280 nan 0.000 0.420 2098 A N 1.389 124.449 122.820 0.400 0.000 2.084 2098 A HA 0.436 4.756 4.320 -0.000 0.000 0.211 2098 A C 0.851 178.507 177.584 0.119 0.000 2.280 2098 A CA 0.094 52.260 52.037 0.215 0.000 1.128 2098 A CB 0.029 19.105 19.000 0.127 0.000 1.248 2098 A HN 0.707 nan 8.150 nan 0.000 0.624 2099 L N 1.447 122.647 121.223 -0.038 0.000 4.639 2099 L HA -0.166 4.173 4.340 -0.000 0.000 0.580 2099 L C -0.945 175.788 176.870 -0.229 0.000 0.983 2099 L CA 0.696 55.357 54.840 -0.298 0.000 0.510 2099 L CB -0.983 40.589 42.059 -0.811 0.000 0.381 2099 L HN 0.520 nan 8.230 nan 0.000 1.152 2100 D N 8.261 128.588 120.400 -0.121 0.000 2.380 2100 D HA 0.292 4.932 4.640 -0.000 0.000 0.230 2100 D C -1.467 174.811 176.300 -0.036 0.000 1.154 2100 D CA -1.850 52.129 54.000 -0.035 0.000 0.859 2100 D CB 1.194 41.998 40.800 0.007 0.000 1.045 2100 D HN 0.433 nan 8.370 nan 0.000 0.495 2101 P HA -0.207 nan 4.420 nan 0.000 0.214 2101 P C 1.823 179.121 177.300 -0.003 0.000 1.163 2101 P CA 0.749 63.818 63.100 -0.051 0.000 0.889 2101 P CB 0.435 32.141 31.700 0.010 0.000 0.790 2102 I N -1.459 119.133 120.570 0.036 0.000 2.163 2102 I HA -0.253 3.917 4.170 -0.000 0.000 0.243 2102 I C 2.685 178.838 176.117 0.060 0.000 1.085 2102 I CA 1.582 62.910 61.300 0.046 0.000 1.347 2102 I CB -1.781 36.256 38.000 0.061 0.000 1.044 2102 I HN -0.063 nan 8.210 nan 0.000 0.408 2103 Y N 1.868 122.147 120.300 -0.034 0.000 2.181 2103 Y HA -0.210 4.340 4.550 -0.000 0.000 0.288 2103 Y C 2.635 178.509 175.900 -0.044 0.000 1.146 2103 Y CA 1.896 59.975 58.100 -0.035 0.000 1.164 2103 Y CB -0.219 38.213 38.460 -0.046 0.000 0.982 2103 Y HN 0.127 nan 8.280 nan 0.000 0.515 2104 A N 0.282 123.118 122.820 0.025 0.000 1.902 2104 A HA -0.203 4.117 4.320 -0.000 0.000 0.217 2104 A C 2.332 179.855 177.584 -0.100 0.000 1.181 2104 A CA 1.761 53.760 52.037 -0.063 0.000 0.623 2104 A CB -0.768 18.180 19.000 -0.088 0.000 0.818 2104 A HN 0.507 nan 8.150 nan 0.000 0.443 2105 R N -0.267 120.190 120.500 -0.072 0.000 2.091 2105 R HA -0.140 4.200 4.340 -0.000 0.000 0.238 2105 R C 1.958 178.209 176.300 -0.082 0.000 1.136 2105 R CA 1.945 58.009 56.100 -0.060 0.000 0.959 2105 R CB -0.185 30.096 30.300 -0.032 0.000 0.856 2105 R HN 0.508 nan 8.270 nan 0.000 0.437 2106 K N -0.063 120.267 120.400 -0.117 0.000 2.366 2106 K HA -0.009 4.311 4.320 -0.000 0.000 0.198 2106 K C 1.850 178.337 176.600 -0.188 0.000 1.044 2106 K CA 0.453 56.659 56.287 -0.135 0.000 0.973 2106 K CB 0.171 32.593 32.500 -0.130 0.000 0.767 2106 K HN 0.212 nan 8.250 nan 0.000 0.475 2107 L N -0.511 120.560 121.223 -0.253 0.000 2.240 2107 L HA -0.014 4.326 4.340 -0.000 0.000 0.211 2107 L C 0.976 177.785 176.870 -0.102 0.000 1.106 2107 L CA 0.900 55.608 54.840 -0.220 0.000 0.793 2107 L CB 0.190 42.097 42.059 -0.253 0.000 0.927 2107 L HN 0.485 nan 8.230 nan 0.000 0.446 2108 G N -0.379 108.369 108.800 -0.086 0.000 2.157 2108 G HA2 -0.154 3.806 3.960 -0.000 0.000 0.118 2108 G HA3 -0.154 3.806 3.960 -0.000 0.000 0.118 2108 G C -0.271 174.604 174.900 -0.042 0.000 1.032 2108 G CA -0.353 44.716 45.100 -0.051 0.000 0.697 2108 G HN -0.001 nan 8.290 nan 0.000 0.495 2109 V N 0.998 120.880 119.914 -0.053 0.000 2.407 2109 V HA 0.440 4.560 4.120 -0.000 0.000 0.278 2109 V C 0.241 176.309 176.094 -0.042 0.000 1.037 2109 V CA -0.740 61.531 62.300 -0.048 0.000 0.900 2109 V CB 1.804 33.586 31.823 -0.069 0.000 0.983 2109 V HN 0.283 nan 8.190 nan 0.000 0.459 2110 D N 4.416 124.798 120.400 -0.030 0.000 2.455 2110 D HA 0.116 4.756 4.640 -0.000 0.000 0.234 2110 D C 1.097 177.382 176.300 -0.024 0.000 1.224 2110 D CA -0.155 53.833 54.000 -0.021 0.000 0.999 2110 D CB 0.520 41.313 40.800 -0.011 0.000 1.072 2110 D HN 0.300 nan 8.370 nan 0.000 0.514 2111 I N 2.526 123.077 120.570 -0.032 0.000 2.208 2111 I HA -0.263 3.907 4.170 -0.000 0.000 0.245 2111 I C 1.373 177.484 176.117 -0.009 0.000 1.097 2111 I CA 1.124 62.401 61.300 -0.038 0.000 1.363 2111 I CB -0.621 37.354 38.000 -0.042 0.000 1.051 2111 I HN 0.323 nan 8.210 nan 0.000 0.413 2112 D N 0.925 121.326 120.400 0.002 0.000 2.133 2112 D HA -0.186 4.454 4.640 -0.000 0.000 0.195 2112 D C 1.306 177.617 176.300 0.019 0.000 0.997 2112 D CA 1.144 55.153 54.000 0.015 0.000 0.840 2112 D CB -0.255 40.554 40.800 0.014 0.000 0.947 2112 D HN 0.304 nan 8.370 nan 0.000 0.452 2113 N N 0.118 118.825 118.700 0.012 0.000 2.251 2113 N HA 0.077 4.817 4.740 -0.000 0.000 0.217 2113 N C -0.143 175.378 175.510 0.020 0.000 1.124 2113 N CA -0.103 52.957 53.050 0.017 0.000 0.843 2113 N CB 0.609 39.103 38.487 0.012 0.000 1.024 2113 N HN 0.210 nan 8.380 nan 0.000 0.501 2114 L N 1.162 122.395 121.223 0.017 0.000 2.379 2114 L HA 0.430 4.770 4.340 -0.000 0.000 0.269 2114 L C -0.521 176.382 176.870 0.055 0.000 1.084 2114 L CA -0.342 54.512 54.840 0.023 0.000 0.802 2114 L CB 1.097 43.147 42.059 -0.015 0.000 1.175 2114 L HN -0.077 nan 8.230 nan 0.000 0.448 2115 L N 4.528 125.800 121.223 0.081 0.000 2.282 2115 L HA 0.362 4.702 4.340 -0.000 0.000 0.288 2115 L C -0.266 176.708 176.870 0.174 0.000 1.033 2115 L CA -0.407 54.498 54.840 0.108 0.000 0.807 2115 L CB 1.603 43.715 42.059 0.090 0.000 1.209 2115 L HN 0.634 nan 8.230 nan 0.000 0.423 2116 C N 2.340 121.757 119.300 0.194 0.000 2.456 2116 C HA 0.768 5.228 4.460 -0.000 0.000 0.325 2116 C C -0.020 175.106 174.990 0.227 0.000 1.217 2116 C CA -0.185 59.011 59.018 0.297 0.000 1.687 2116 C CB 1.507 29.469 27.740 0.371 0.000 2.270 2116 C HN 0.823 nan 8.230 nan 0.000 0.499 2117 S N 4.191 120.028 115.700 0.229 0.000 2.789 2117 S HA 0.372 4.842 4.470 -0.000 0.000 0.286 2117 S C -1.003 173.693 174.600 0.161 0.000 1.153 2117 S CA -0.313 57.974 58.200 0.145 0.000 1.084 2117 S CB 1.216 64.460 63.200 0.074 0.000 1.036 2117 S HN 0.842 nan 8.310 nan 0.000 0.484 2118 Q N 3.114 123.015 119.800 0.169 0.000 2.569 2118 Q HA 0.283 4.623 4.340 -0.000 0.000 0.226 2118 Q C -2.488 173.628 176.000 0.192 0.000 1.136 2118 Q CA -1.790 54.145 55.803 0.220 0.000 0.947 2118 Q CB 0.559 29.399 28.738 0.170 0.000 1.218 2118 Q HN 0.331 nan 8.270 nan 0.000 0.547 2119 P HA 0.030 nan 4.420 nan 0.000 0.276 2119 P C 0.118 177.537 177.300 0.198 0.000 1.252 2119 P CA -0.382 62.781 63.100 0.104 0.000 0.802 2119 P CB 1.160 32.866 31.700 0.010 0.000 1.035 2120 D N -1.060 119.395 120.400 0.093 0.000 2.201 2120 D HA -0.032 4.608 4.640 -0.000 0.000 0.209 2120 D C 0.035 176.207 176.300 -0.214 0.000 0.961 2120 D CA 1.310 55.370 54.000 0.101 0.000 0.861 2120 D CB 0.587 41.462 40.800 0.125 0.000 0.997 2120 D HN 0.312 nan 8.370 nan 0.000 0.486 2121 T N -1.825 112.585 114.554 -0.240 0.000 2.900 2121 T HA 0.469 4.819 4.350 -0.000 0.000 0.295 2121 T C 1.124 175.650 174.700 -0.291 0.000 1.044 2121 T CA -0.093 61.782 62.100 -0.374 0.000 0.995 2121 T CB 1.600 70.334 68.868 -0.224 0.000 1.072 2121 T HN -0.009 nan 8.240 nan 0.000 0.473 2122 G N 2.513 111.121 108.800 -0.319 0.000 2.553 2122 G HA2 -0.241 3.719 3.960 -0.000 0.000 0.218 2122 G HA3 -0.241 3.719 3.960 -0.000 0.000 0.218 2122 G C 1.048 175.881 174.900 -0.112 0.000 1.195 2122 G CA 1.702 46.700 45.100 -0.170 0.000 0.779 2122 G HN 0.844 nan 8.290 nan 0.000 0.577 2123 E N -0.142 119.994 120.200 -0.107 0.000 2.045 2123 E HA -0.278 4.072 4.350 -0.000 0.000 0.212 2123 E C 2.476 179.025 176.600 -0.085 0.000 1.039 2123 E CA 1.880 58.242 56.400 -0.064 0.000 0.860 2123 E CB -0.421 29.253 29.700 -0.043 0.000 0.776 2123 E HN 0.651 nan 8.360 nan 0.000 0.467 2124 Q N 0.256 119.980 119.800 -0.126 0.000 2.118 2124 Q HA -0.332 4.008 4.340 -0.000 0.000 0.211 2124 Q C 2.125 177.950 176.000 -0.292 0.000 0.998 2124 Q CA 2.107 57.759 55.803 -0.252 0.000 0.872 2124 Q CB -0.318 28.271 28.738 -0.248 0.000 0.925 2124 Q HN 0.319 nan 8.270 nan 0.000 0.414 2125 A N 0.824 123.537 122.820 -0.179 0.000 1.869 2125 A HA -0.242 4.078 4.320 -0.000 0.000 0.218 2125 A C 2.124 179.652 177.584 -0.093 0.000 1.203 2125 A CA 1.953 53.916 52.037 -0.122 0.000 0.638 2125 A CB -1.090 17.876 19.000 -0.056 0.000 0.831 2125 A HN 0.494 nan 8.150 nan 0.000 0.450 2126 L N -0.781 120.418 121.223 -0.041 0.000 1.990 2126 L HA -0.258 4.081 4.340 -0.000 0.000 0.213 2126 L C 2.608 179.472 176.870 -0.010 0.000 1.072 2126 L CA 1.989 56.837 54.840 0.014 0.000 0.755 2126 L CB -0.779 41.309 42.059 0.048 0.000 0.889 2126 L HN 0.485 nan 8.230 nan 0.000 0.432 2127 E N 0.035 120.213 120.200 -0.036 0.000 2.267 2127 E HA -0.224 4.126 4.350 -0.000 0.000 0.197 2127 E C 2.193 178.798 176.600 0.009 0.000 0.998 2127 E CA 1.108 57.520 56.400 0.020 0.000 0.830 2127 E CB -0.175 29.573 29.700 0.079 0.000 0.751 2127 E HN 0.553 nan 8.360 nan 0.000 0.491 2128 I N 0.478 120.961 120.570 -0.144 0.000 2.233 2128 I HA -0.282 3.888 4.170 -0.000 0.000 0.243 2128 I C 2.430 178.544 176.117 -0.005 0.000 1.093 2128 I CA 0.608 61.847 61.300 -0.102 0.000 1.380 2128 I CB -0.324 37.563 38.000 -0.189 0.000 1.067 2128 I HN 0.215 nan 8.210 nan 0.000 0.413 2129 C N 0.342 119.627 119.300 -0.025 0.000 2.401 2129 C HA -0.222 4.238 4.460 -0.000 0.000 0.276 2129 C C 2.495 177.491 174.990 0.010 0.000 1.233 2129 C CA 0.475 59.482 59.018 -0.019 0.000 1.753 2129 C CB -1.106 26.610 27.740 -0.040 0.000 2.029 2129 C HN 0.539 nan 8.230 nan 0.000 0.478 2130 D N 0.840 121.259 120.400 0.032 0.000 2.177 2130 D HA -0.199 4.441 4.640 -0.000 0.000 0.189 2130 D C 2.249 178.580 176.300 0.051 0.000 1.002 2130 D CA 2.430 56.458 54.000 0.048 0.000 0.845 2130 D CB -0.348 40.497 40.800 0.076 0.000 0.960 2130 D HN 0.517 nan 8.370 nan 0.000 0.447 2131 A N -0.121 122.747 122.820 0.080 0.000 2.119 2131 A HA 0.016 4.336 4.320 -0.000 0.000 0.216 2131 A C 2.418 180.035 177.584 0.055 0.000 1.152 2131 A CA 0.288 52.370 52.037 0.075 0.000 0.708 2131 A CB -0.352 18.714 19.000 0.110 0.000 0.805 2131 A HN 0.253 nan 8.150 nan 0.000 0.460 2132 L N -1.117 120.133 121.223 0.046 0.000 2.217 2132 L HA -0.090 4.250 4.340 -0.000 0.000 0.211 2132 L C 2.925 179.803 176.870 0.013 0.000 1.107 2132 L CA 0.754 55.611 54.840 0.028 0.000 0.783 2132 L CB -0.299 41.770 42.059 0.017 0.000 0.919 2132 L HN 0.434 nan 8.230 nan 0.000 0.442 2133 A N 0.173 122.998 122.820 0.009 0.000 1.854 2133 A HA -0.091 4.229 4.320 -0.000 0.000 0.214 2133 A C 1.557 179.145 177.584 0.007 0.000 1.192 2133 A CA 0.710 52.748 52.037 0.001 0.000 0.611 2133 A CB -0.303 18.695 19.000 -0.004 0.000 0.832 2133 A HN 0.273 nan 8.150 nan 0.000 0.442 2134 R N 0.828 121.336 120.500 0.014 0.000 3.641 2134 R HA 0.143 4.483 4.340 -0.000 0.000 0.189 2134 R C 0.521 176.831 176.300 0.017 0.000 1.706 2134 R CA 0.519 56.627 56.100 0.014 0.000 1.311 2134 R CB -0.204 30.106 30.300 0.018 0.000 1.330 2134 R HN 0.698 nan 8.270 nan 0.000 0.727 2135 S N -1.890 113.818 115.700 0.013 0.000 3.050 2135 S HA 0.126 4.596 4.470 -0.000 0.000 0.261 2135 S C 1.393 175.999 174.600 0.010 0.000 1.057 2135 S CA 0.238 58.447 58.200 0.014 0.000 1.012 2135 S CB 0.536 63.747 63.200 0.019 0.000 0.919 2135 S HN 0.494 nan 8.310 nan 0.000 0.429 2136 G N 1.697 110.501 108.800 0.007 0.000 2.184 2136 G HA2 -0.166 3.794 3.960 -0.000 0.000 0.264 2136 G HA3 -0.166 3.794 3.960 -0.000 0.000 0.264 2136 G C 0.846 175.749 174.900 0.005 0.000 0.975 2136 G CA 0.535 45.637 45.100 0.004 0.000 0.642 2136 G HN 1.623 nan 8.290 nan 0.000 0.536 2137 A N -0.889 121.936 122.820 0.008 0.000 2.288 2137 A HA 0.676 4.996 4.320 -0.000 0.000 0.216 2137 A C 0.884 178.474 177.584 0.011 0.000 1.199 2137 A CA 1.059 53.102 52.037 0.010 0.000 0.891 2137 A CB 0.647 19.655 19.000 0.013 0.000 0.923 2137 A HN 0.990 nan 8.150 nan 0.000 0.500 2138 V N 1.664 121.584 119.914 0.010 0.000 2.364 2138 V HA 0.208 4.328 4.120 -0.000 0.000 0.272 2138 V C -0.073 176.021 176.094 -0.000 0.000 1.036 2138 V CA -0.331 61.974 62.300 0.008 0.000 0.880 2138 V CB 1.159 32.987 31.823 0.009 0.000 0.991 2138 V HN 0.375 nan 8.190 nan 0.000 0.460 2139 D N 2.687 123.087 120.400 -0.000 0.000 2.389 2139 D HA 0.127 4.767 4.640 -0.000 0.000 0.206 2139 D C 0.198 176.490 176.300 -0.012 0.000 1.055 2139 D CA 0.837 54.834 54.000 -0.006 0.000 0.856 2139 D CB 1.910 42.709 40.800 -0.002 0.000 0.957 2139 D HN 0.416 nan 8.370 nan 0.000 0.509 2140 V N 1.257 121.165 119.914 -0.011 0.000 2.653 2140 V HA 0.341 4.461 4.120 -0.000 0.000 0.298 2140 V C -1.722 174.361 176.094 -0.019 0.000 1.097 2140 V CA -0.704 61.585 62.300 -0.019 0.000 0.908 2140 V CB 1.655 33.474 31.823 -0.008 0.000 1.024 2140 V HN -0.136 nan 8.190 nan 0.000 0.435 2141 I N 6.530 127.066 120.570 -0.056 0.000 2.412 2141 I HA 0.629 4.799 4.170 -0.000 0.000 0.296 2141 I C -0.558 175.489 176.117 -0.117 0.000 0.987 2141 I CA -1.002 60.251 61.300 -0.078 0.000 1.180 2141 I CB 2.049 39.977 38.000 -0.120 0.000 1.340 2141 I HN 0.380 nan 8.210 nan 0.000 0.455 2142 V N 6.705 126.564 119.914 -0.091 0.000 2.540 2142 V HA 0.411 4.531 4.120 -0.000 0.000 0.302 2142 V C -0.375 175.558 176.094 -0.268 0.000 1.035 2142 V CA -0.612 61.613 62.300 -0.125 0.000 0.873 2142 V CB 2.435 34.282 31.823 0.038 0.000 0.992 2142 V HN 0.417 nan 8.190 nan 0.000 0.428 2143 V N 3.057 122.818 119.914 -0.254 0.000 2.350 2143 V HA 0.514 4.633 4.120 -0.000 0.000 0.285 2143 V C -0.746 175.274 176.094 -0.124 0.000 1.014 2143 V CA -0.547 61.626 62.300 -0.211 0.000 0.831 2143 V CB 1.624 33.397 31.823 -0.084 0.000 1.000 2143 V HN 0.805 nan 8.190 nan 0.000 0.433 2144 D N 3.633 123.882 120.400 -0.251 0.000 2.461 2144 D HA 0.612 5.252 4.640 -0.000 0.000 0.240 2144 D C -0.313 175.932 176.300 -0.092 0.000 1.094 2144 D CA 0.272 54.188 54.000 -0.140 0.000 0.868 2144 D CB 1.777 42.472 40.800 -0.176 0.000 1.062 2144 D HN 0.766 nan 8.370 nan 0.000 0.530 2145 S N 1.028 116.716 115.700 -0.020 0.000 2.579 2145 S HA 0.313 4.783 4.470 -0.000 0.000 0.272 2145 S C 1.052 175.674 174.600 0.036 0.000 1.141 2145 S CA -0.666 57.549 58.200 0.025 0.000 0.843 2145 S CB 1.278 64.489 63.200 0.019 0.000 1.122 2145 S HN -0.013 nan 8.310 nan 0.000 0.468 2146 V N 1.848 121.788 119.914 0.044 0.000 2.233 2146 V HA -0.282 3.838 4.120 -0.000 0.000 0.252 2146 V C 3.117 179.189 176.094 -0.038 0.000 1.063 2146 V CA 3.000 65.278 62.300 -0.036 0.000 1.032 2146 V CB -1.700 30.057 31.823 -0.110 0.000 0.645 2146 V HN 1.076 nan 8.190 nan 0.000 0.446 2147 A N -0.432 122.373 122.820 -0.024 0.000 1.940 2147 A HA -0.106 4.214 4.320 -0.000 0.000 0.219 2147 A C 2.272 179.855 177.584 -0.003 0.000 1.176 2147 A CA 2.181 54.204 52.037 -0.024 0.000 0.631 2147 A CB -0.677 18.309 19.000 -0.023 0.000 0.814 2147 A HN 0.691 nan 8.150 nan 0.000 0.446 2148 A N -1.161 121.668 122.820 0.015 0.000 2.169 2148 A HA 0.291 4.611 4.320 -0.000 0.000 0.212 2148 A C 1.011 178.675 177.584 0.133 0.000 1.153 2148 A CA 0.270 52.342 52.037 0.058 0.000 0.756 2148 A CB -0.199 18.811 19.000 0.016 0.000 0.813 2148 A HN 0.300 nan 8.150 nan 0.000 0.471 2149 L N 2.780 124.038 121.223 0.058 0.000 3.168 2149 L HA 0.032 4.372 4.340 -0.000 0.000 0.253 2149 L C 0.647 177.491 176.870 -0.043 0.000 1.384 2149 L CA 0.718 55.569 54.840 0.017 0.000 1.131 2149 L CB -2.271 39.784 42.059 -0.007 0.000 1.552 2149 L HN 0.413 nan 8.230 nan 0.000 0.431 2150 T N -0.030 114.514 114.554 -0.015 0.000 2.853 2150 T HA 0.268 4.618 4.350 -0.000 0.000 0.298 2150 T C -2.052 172.530 174.700 -0.196 0.000 0.978 2150 T CA -1.362 60.700 62.100 -0.063 0.000 1.152 2150 T CB 0.621 69.509 68.868 0.033 0.000 0.914 2150 T HN 0.184 nan 8.240 nan 0.000 0.539 2151 P HA 0.130 nan 4.420 nan 0.000 0.274 2151 P C 0.837 178.033 177.300 -0.173 0.000 1.260 2151 P CA -0.637 62.373 63.100 -0.150 0.000 0.793 2151 P CB 1.035 32.680 31.700 -0.091 0.000 1.048 2152 K N 0.632 120.948 120.400 -0.141 0.000 2.057 2152 K HA -0.132 4.188 4.320 -0.000 0.000 0.206 2152 K C 1.991 178.536 176.600 -0.091 0.000 1.050 2152 K CA 1.600 57.813 56.287 -0.123 0.000 0.935 2152 K CB -0.752 31.707 32.500 -0.068 0.000 0.715 2152 K HN 0.454 nan 8.250 nan 0.000 0.439 2153 A N 1.330 124.111 122.820 -0.066 0.000 1.927 2153 A HA -0.250 4.070 4.320 -0.000 0.000 0.220 2153 A C 1.969 179.519 177.584 -0.056 0.000 1.185 2153 A CA 2.076 54.085 52.037 -0.047 0.000 0.639 2153 A CB -0.502 18.478 19.000 -0.034 0.000 0.820 2153 A HN 0.534 nan 8.150 nan 0.000 0.451 2154 E N -0.790 119.366 120.200 -0.073 0.000 2.230 2154 E HA 0.021 4.371 4.350 -0.000 0.000 0.192 2154 E C 1.633 178.178 176.600 -0.091 0.000 0.987 2154 E CA 0.335 56.694 56.400 -0.069 0.000 0.841 2154 E CB -0.111 29.552 29.700 -0.061 0.000 0.783 2154 E HN 0.674 nan 8.360 nan 0.000 0.481 2155 I N 0.982 121.467 120.570 -0.142 0.000 2.850 2155 I HA -0.154 4.016 4.170 -0.000 0.000 0.266 2155 I C 0.425 176.438 176.117 -0.174 0.000 1.257 2155 I CA 0.857 62.029 61.300 -0.214 0.000 1.465 2155 I CB 0.006 37.803 38.000 -0.338 0.000 1.091 2155 I HN 0.075 nan 8.210 nan 0.000 0.467 2166 L N -0.281 120.900 121.223 -0.071 0.000 2.253 2166 L HA 0.655 4.995 4.340 -0.000 0.000 0.205 2166 L C 2.161 178.977 176.870 -0.090 0.000 1.078 2166 L CA 1.102 55.882 54.840 -0.101 0.000 0.805 2166 L CB -0.299 41.708 42.059 -0.086 0.000 0.963 2166 L HN 0.319 nan 8.230 nan 0.000 0.459 2167 A N 0.989 123.774 122.820 -0.058 0.000 2.900 2167 A HA 0.530 4.850 4.320 -0.000 0.000 0.246 2167 A C 1.738 179.290 177.584 -0.054 0.000 1.725 2167 A CA 0.502 52.512 52.037 -0.046 0.000 1.400 2167 A CB -0.843 18.134 19.000 -0.038 0.000 0.973 2167 A HN 0.474 nan 8.150 nan 0.000 0.635 2168 A N 0.082 122.863 122.820 -0.065 0.000 2.235 2168 A HA 0.007 4.327 4.320 -0.000 0.000 0.208 2168 A C 2.031 179.587 177.584 -0.046 0.000 1.172 2168 A CA 0.633 52.632 52.037 -0.065 0.000 0.786 2168 A CB -0.274 18.681 19.000 -0.074 0.000 0.804 2168 A HN 0.690 nan 8.150 nan 0.000 0.479 2169 R N -0.871 119.611 120.500 -0.029 0.000 2.092 2169 R HA -0.063 4.276 4.340 -0.000 0.000 0.231 2169 R C 2.208 178.509 176.300 0.001 0.000 1.119 2169 R CA 1.495 57.595 56.100 0.001 0.000 0.970 2169 R CB -0.447 29.866 30.300 0.023 0.000 0.864 2169 R HN 0.654 nan 8.270 nan 0.000 0.440 2170 M N 0.143 119.734 119.600 -0.014 0.000 2.080 2170 M HA -0.232 4.248 4.480 -0.000 0.000 0.260 2170 M C 1.916 178.207 176.300 -0.015 0.000 1.068 2170 M CA 1.685 56.976 55.300 -0.016 0.000 1.109 2170 M CB -0.014 32.566 32.600 -0.034 0.000 1.342 2170 M HN 0.176 nan 8.290 nan 0.000 0.405 2171 M N 0.188 119.765 119.600 -0.039 0.000 2.149 2171 M HA -0.163 4.317 4.480 -0.000 0.000 0.261 2171 M C 2.130 178.425 176.300 -0.010 0.000 1.064 2171 M CA 1.711 56.975 55.300 -0.059 0.000 1.102 2171 M CB -1.095 31.435 32.600 -0.117 0.000 1.369 2171 M HN 0.342 nan 8.290 nan 0.000 0.408 2172 S N -0.247 115.458 115.700 0.009 0.000 2.423 2172 S HA -0.134 4.336 4.470 -0.000 0.000 0.231 2172 S C 1.557 176.201 174.600 0.073 0.000 1.014 2172 S CA 0.750 58.977 58.200 0.046 0.000 0.965 2172 S CB -0.098 63.125 63.200 0.038 0.000 0.785 2172 S HN 0.412 nan 8.310 nan 0.000 0.495 2173 Q N 2.111 121.943 119.800 0.052 0.000 1.596 2173 Q HA 0.160 4.500 4.340 -0.000 0.000 0.476 2173 Q C 1.995 178.037 176.000 0.070 0.000 0.959 2173 Q CA 1.605 57.442 55.803 0.056 0.000 0.901 2173 Q CB -0.771 27.990 28.738 0.038 0.000 0.932 2173 Q HN 0.406 nan 8.270 nan 0.000 0.389 2174 A N -0.027 122.830 122.820 0.062 0.000 2.277 2174 A HA -0.109 4.211 4.320 -0.000 0.000 0.208 2174 A C 1.694 179.326 177.584 0.080 0.000 1.202 2174 A CA 1.139 53.215 52.037 0.064 0.000 0.762 2174 A CB -0.806 18.230 19.000 0.060 0.000 0.770 2174 A HN 0.605 nan 8.150 nan 0.000 0.487 2175 M N 0.301 119.965 119.600 0.107 0.000 2.066 2175 M HA -0.144 4.336 4.480 -0.000 0.000 0.259 2175 M C 2.109 178.463 176.300 0.091 0.000 1.074 2175 M CA 2.183 57.573 55.300 0.151 0.000 1.114 2175 M CB -0.473 32.257 32.600 0.217 0.000 1.306 2175 M HN 0.441 nan 8.290 nan 0.000 0.411 2176 R N 0.119 120.676 120.500 0.096 0.000 2.096 2176 R HA -0.172 4.167 4.340 -0.000 0.000 0.235 2176 R C 2.277 178.513 176.300 -0.106 0.000 1.127 2176 R CA 1.672 57.726 56.100 -0.077 0.000 0.968 2176 R CB -0.498 29.861 30.300 0.098 0.000 0.861 2176 R HN 0.501 nan 8.270 nan 0.000 0.440 2177 K N 0.581 120.969 120.400 -0.021 0.000 2.097 2177 K HA -0.119 4.201 4.320 -0.000 0.000 0.205 2177 K C 2.203 178.788 176.600 -0.024 0.000 1.050 2177 K CA 0.911 57.189 56.287 -0.016 0.000 0.938 2177 K CB -0.121 32.387 32.500 0.014 0.000 0.718 2177 K HN 0.213 nan 8.250 nan 0.000 0.442 2178 L N 0.599 121.816 121.223 -0.009 0.000 2.156 2178 L HA -0.102 4.237 4.340 -0.000 0.000 0.208 2178 L C 2.268 179.116 176.870 -0.037 0.000 1.095 2178 L CA 1.171 56.010 54.840 -0.003 0.000 0.770 2178 L CB -0.270 41.812 42.059 0.038 0.000 0.914 2178 L HN 0.167 nan 8.230 nan 0.000 0.439 2179 A N -0.068 122.697 122.820 -0.092 0.000 1.884 2179 A HA -0.239 4.081 4.320 -0.000 0.000 0.219 2179 A C 2.286 179.807 177.584 -0.105 0.000 1.197 2179 A CA 2.071 54.017 52.037 -0.150 0.000 0.637 2179 A CB -1.574 17.191 19.000 -0.392 0.000 0.827 2179 A HN 0.511 nan 8.150 nan 0.000 0.450 2180 G N -0.552 108.189 108.800 -0.098 0.000 2.414 2180 G HA2 -0.249 3.711 3.960 -0.000 0.000 0.215 2180 G HA3 -0.249 3.711 3.960 -0.000 0.000 0.215 2180 G C 1.328 176.206 174.900 -0.036 0.000 1.188 2180 G CA 0.914 45.977 45.100 -0.061 0.000 0.783 2180 G HN 0.721 nan 8.290 nan 0.000 0.537 2181 N N 0.202 118.885 118.700 -0.029 0.000 2.417 2181 N HA -0.065 4.675 4.740 -0.000 0.000 0.187 2181 N C 1.939 177.439 175.510 -0.016 0.000 1.027 2181 N CA 0.393 53.433 53.050 -0.016 0.000 0.891 2181 N CB -0.126 38.356 38.487 -0.007 0.000 0.956 2181 N HN 0.320 nan 8.380 nan 0.000 0.442 2182 L N 0.147 121.356 121.223 -0.024 0.000 2.249 2182 L HA 0.031 4.371 4.340 -0.000 0.000 0.207 2182 L C 2.009 178.868 176.870 -0.018 0.000 1.090 2182 L CA 0.671 55.497 54.840 -0.023 0.000 0.802 2182 L CB -0.123 41.918 42.059 -0.030 0.000 0.947 2182 L HN -0.040 nan 8.230 nan 0.000 0.453 2183 K N 0.398 120.787 120.400 -0.018 0.000 2.209 2183 K HA -0.147 4.173 4.320 -0.000 0.000 0.204 2183 K C 1.509 178.104 176.600 -0.009 0.000 1.048 2183 K CA 1.095 57.374 56.287 -0.012 0.000 0.940 2183 K CB 0.022 32.515 32.500 -0.012 0.000 0.729 2183 K HN 0.312 nan 8.250 nan 0.000 0.451 2184 Q N -0.745 119.050 119.800 -0.009 0.000 2.228 2184 Q HA 0.146 4.486 4.340 -0.000 0.000 0.211 2184 Q C 0.184 176.181 176.000 -0.004 0.000 0.890 2184 Q CA 0.055 55.854 55.803 -0.005 0.000 0.953 2184 Q CB 0.864 29.599 28.738 -0.005 0.000 1.053 2184 Q HN 0.088 nan 8.270 nan 0.000 0.471 2185 S N -0.852 114.844 115.700 -0.006 0.000 2.560 2185 S HA 0.060 4.530 4.470 -0.000 0.000 0.281 2185 S C 0.333 174.929 174.600 -0.006 0.000 1.075 2185 S CA -0.354 57.843 58.200 -0.005 0.000 1.295 2185 S CB 0.527 63.723 63.200 -0.006 0.000 1.156 2185 S HN 0.302 nan 8.310 nan 0.000 0.627 2186 N N 1.548 120.243 118.700 -0.008 0.000 2.857 2186 N HA -0.130 4.610 4.740 -0.000 0.000 0.242 2186 N C -0.593 174.908 175.510 -0.015 0.000 0.983 2186 N CA 1.410 54.454 53.050 -0.010 0.000 0.934 2186 N CB -1.830 36.653 38.487 -0.007 0.000 1.115 2186 N HN 0.426 nan 8.380 nan 0.000 0.593 2187 T N 1.369 115.913 114.554 -0.017 0.000 2.734 2187 T HA 0.096 4.446 4.350 -0.000 0.000 0.269 2187 T C 0.578 175.256 174.700 -0.037 0.000 0.964 2187 T CA -0.223 61.862 62.100 -0.024 0.000 1.226 2187 T CB -0.055 68.799 68.868 -0.024 0.000 0.910 2187 T HN 0.221 nan 8.240 nan 0.000 0.534 2188 L N 6.073 127.273 121.223 -0.038 0.000 2.315 2188 L HA 0.530 4.870 4.340 -0.000 0.000 0.283 2188 L C -0.542 176.279 176.870 -0.081 0.000 1.089 2188 L CA -0.195 54.615 54.840 -0.050 0.000 0.833 2188 L CB 0.262 42.298 42.059 -0.038 0.000 1.170 2188 L HN 0.574 nan 8.230 nan 0.000 0.442 2189 L N 6.330 127.484 121.223 -0.115 0.000 2.322 2189 L HA 0.603 4.943 4.340 -0.000 0.000 0.281 2189 L C -0.866 175.862 176.870 -0.236 0.000 1.014 2189 L CA -0.313 54.400 54.840 -0.211 0.000 0.815 2189 L CB 1.195 43.083 42.059 -0.285 0.000 1.247 2189 L HN 0.653 nan 8.230 nan 0.000 0.421 2190 I N 4.611 125.024 120.570 -0.262 0.000 2.378 2190 I HA 0.340 4.510 4.170 -0.000 0.000 0.291 2190 I C -0.836 175.121 176.117 -0.266 0.000 0.992 2190 I CA -0.361 60.827 61.300 -0.186 0.000 1.154 2190 I CB 1.435 39.387 38.000 -0.081 0.000 1.315 2190 I HN 0.415 nan 8.210 nan 0.000 0.448 2191 F N 6.222 126.151 119.950 -0.034 0.000 2.440 2191 F HA 0.606 5.133 4.527 -0.000 0.000 0.328 2191 F C 0.203 175.988 175.800 -0.025 0.000 1.070 2191 F CA -0.690 57.289 58.000 -0.035 0.000 1.011 2191 F CB 1.355 40.337 39.000 -0.029 0.000 1.226 2191 F HN 0.118 nan 8.300 nan 0.000 0.491 2192 I N 2.091 122.798 120.570 0.229 0.000 2.499 2192 I HA 0.355 4.525 4.170 -0.000 0.000 0.288 2192 I C -0.656 175.524 176.117 0.106 0.000 1.048 2192 I CA -0.676 60.703 61.300 0.132 0.000 1.062 2192 I CB 1.864 39.917 38.000 0.088 0.000 1.238 2192 I HN 0.469 nan 8.210 nan 0.000 0.426 2193 N N 3.907 122.676 118.700 0.115 0.000 2.890 2193 N HA 0.589 5.329 4.740 -0.000 0.000 0.317 2193 N C -1.276 174.273 175.510 0.065 0.000 1.355 2193 N CA -0.485 52.614 53.050 0.082 0.000 0.803 2193 N CB 1.736 40.286 38.487 0.105 0.000 1.465 2193 N HN 0.584 nan 8.380 nan 0.000 0.591 2212 G N -0.827 107.910 108.800 -0.105 0.000 2.417 2212 G HA2 0.436 4.396 3.960 -0.000 0.000 0.334 2212 G HA3 0.436 4.396 3.960 -0.000 0.000 0.334 2212 G C 0.581 175.437 174.900 -0.074 0.000 1.150 2212 G CA -0.275 44.774 45.100 -0.085 0.000 0.923 2212 G HN 0.521 nan 8.290 nan 0.000 0.485 2213 N N 0.818 119.494 118.700 -0.041 0.000 2.272 2213 N HA -0.145 4.595 4.740 -0.000 0.000 0.185 2213 N C 2.422 177.941 175.510 0.015 0.000 1.014 2213 N CA 1.514 54.557 53.050 -0.012 0.000 0.870 2213 N CB -0.060 38.454 38.487 0.045 0.000 0.975 2213 N HN 0.539 nan 8.380 nan 0.000 0.433 2214 A N 0.506 123.337 122.820 0.018 0.000 1.877 2214 A HA -0.121 4.199 4.320 -0.000 0.000 0.216 2214 A C 2.154 179.747 177.584 0.015 0.000 1.186 2214 A CA 1.203 53.264 52.037 0.040 0.000 0.620 2214 A CB -0.882 18.141 19.000 0.039 0.000 0.822 2214 A HN 0.339 nan 8.150 nan 0.000 0.443 2215 L N 0.259 121.455 121.223 -0.045 0.000 2.043 2215 L HA -0.209 4.131 4.340 -0.000 0.000 0.212 2215 L C 2.233 179.053 176.870 -0.083 0.000 1.075 2215 L CA 2.695 57.502 54.840 -0.055 0.000 0.752 2215 L CB -0.773 41.183 42.059 -0.171 0.000 0.891 2215 L HN 0.494 nan 8.230 nan 0.000 0.432 2216 K N -1.776 118.500 120.400 -0.208 0.000 2.189 2216 K HA -0.255 4.065 4.320 -0.000 0.000 0.207 2216 K C 1.721 178.052 176.600 -0.450 0.000 1.046 2216 K CA 2.182 58.227 56.287 -0.403 0.000 0.928 2216 K CB -0.184 31.931 32.500 -0.641 0.000 0.720 2216 K HN 0.385 nan 8.250 nan 0.000 0.458 2217 F N -1.765 118.165 119.950 -0.035 0.000 2.399 2217 F HA 0.085 4.612 4.527 -0.000 0.000 0.282 2217 F C 1.781 177.587 175.800 0.011 0.000 1.027 2217 F CA 0.232 58.199 58.000 -0.054 0.000 1.333 2217 F CB -0.629 38.252 39.000 -0.199 0.000 1.132 2217 F HN -0.072 nan 8.300 nan 0.000 0.590 2218 Y N 0.832 121.259 120.300 0.211 0.000 2.483 2218 Y HA 0.095 4.645 4.550 -0.000 0.000 0.291 2218 Y C 1.507 177.459 175.900 0.088 0.000 1.143 2218 Y CA -0.289 57.892 58.100 0.134 0.000 1.289 2218 Y CB -0.403 38.128 38.460 0.118 0.000 0.983 2218 Y HN -0.045 nan 8.280 nan 0.000 0.556 2219 A N -0.070 122.867 122.820 0.195 0.000 2.498 2219 A HA 0.102 4.422 4.320 -0.000 0.000 0.239 2219 A C 1.100 178.721 177.584 0.061 0.000 1.068 2219 A CA 0.309 52.399 52.037 0.089 0.000 0.766 2219 A CB 0.304 19.295 19.000 -0.014 0.000 1.003 2219 A HN 0.312 nan 8.150 nan 0.000 0.497 2220 S N 0.312 116.032 115.700 0.035 0.000 2.483 2220 S HA 0.207 4.677 4.470 -0.000 0.000 0.221 2220 S C 0.273 174.854 174.600 -0.032 0.000 1.030 2220 S CA 0.348 58.561 58.200 0.022 0.000 0.925 2220 S CB 0.273 63.489 63.200 0.026 0.000 0.795 2220 S HN 0.541 nan 8.310 nan 0.000 0.511 2221 V N 2.489 122.364 119.914 -0.064 0.000 2.623 2221 V HA 0.444 4.564 4.120 -0.000 0.000 0.304 2221 V C -1.041 174.952 176.094 -0.169 0.000 1.054 2221 V CA -0.728 61.504 62.300 -0.114 0.000 0.882 2221 V CB 2.056 33.828 31.823 -0.086 0.000 1.002 2221 V HN 0.156 nan 8.190 nan 0.000 0.424 2222 R N 4.471 124.814 120.500 -0.262 0.000 2.439 2222 R HA 0.627 4.967 4.340 -0.000 0.000 0.310 2222 R C -1.631 174.443 176.300 -0.377 0.000 0.955 2222 R CA -0.885 54.996 56.100 -0.364 0.000 0.853 2222 R CB 2.099 32.099 30.300 -0.499 0.000 1.171 2222 R HN 0.350 nan 8.270 nan 0.000 0.449 2223 L N 2.108 123.110 121.223 -0.367 0.000 2.309 2223 L HA 0.308 4.648 4.340 -0.000 0.000 0.282 2223 L C -0.242 176.455 176.870 -0.289 0.000 1.036 2223 L CA -0.272 54.416 54.840 -0.253 0.000 0.806 2223 L CB 1.417 43.401 42.059 -0.126 0.000 1.220 2223 L HN 0.458 nan 8.230 nan 0.000 0.429 2224 D N 3.760 124.131 120.400 -0.048 0.000 2.464 2224 D HA 0.285 4.925 4.640 -0.000 0.000 0.243 2224 D C -0.773 175.642 176.300 0.192 0.000 1.104 2224 D CA -0.184 53.965 54.000 0.248 0.000 0.883 2224 D CB 0.732 41.739 40.800 0.344 0.000 1.050 2224 D HN 0.400 nan 8.370 nan 0.000 0.524 2225 I N 3.362 124.050 120.570 0.198 0.000 2.392 2225 I HA 0.471 4.641 4.170 -0.000 0.000 0.295 2225 I C -0.580 175.597 176.117 0.101 0.000 0.985 2225 I CA -0.544 60.839 61.300 0.138 0.000 1.221 2225 I CB 0.411 38.487 38.000 0.127 0.000 1.366 2225 I HN 0.219 nan 8.210 nan 0.000 0.467 2226 R N 6.381 126.918 120.500 0.062 0.000 2.725 2226 R HA 0.479 4.819 4.340 -0.000 0.000 0.277 2226 R C -1.111 175.188 176.300 -0.001 0.000 0.987 2226 R CA -1.037 55.078 56.100 0.026 0.000 0.901 2226 R CB 1.963 32.278 30.300 0.025 0.000 1.207 2226 R HN 0.563 nan 8.270 nan 0.000 0.463 2227 R N 2.509 123.001 120.500 -0.013 0.000 2.312 2227 R HA 0.253 4.593 4.340 -0.000 0.000 0.311 2227 R C 0.557 176.848 176.300 -0.014 0.000 1.004 2227 R CA -0.173 55.911 56.100 -0.026 0.000 0.902 2227 R CB 0.784 31.069 30.300 -0.025 0.000 1.073 2227 R HN 0.852 nan 8.270 nan 0.000 0.457 2228 I N 0.986 121.546 120.570 -0.016 0.000 3.565 2228 I HA 0.456 4.626 4.170 -0.000 0.000 0.287 2228 I C 0.759 176.876 176.117 -0.001 0.000 1.193 2228 I CA 0.283 61.581 61.300 -0.003 0.000 1.402 2228 I CB 0.601 38.604 38.000 0.005 0.000 1.284 2228 I HN 0.622 nan 8.210 nan 0.000 0.454 2229 G N 0.927 109.725 108.800 -0.004 0.000 2.851 2229 G HA2 0.793 4.753 3.960 -0.000 0.000 0.208 2229 G HA3 0.793 4.753 3.960 -0.000 0.000 0.208 2229 G C -0.553 174.349 174.900 0.003 0.000 1.894 2229 G CA -0.010 45.090 45.100 -0.000 0.000 0.732 2229 G HN 0.863 nan 8.290 nan 0.000 0.802 2230 A N -2.250 120.570 122.820 0.000 0.000 2.613 2230 A HA 0.468 4.788 4.320 -0.000 0.000 0.303 2230 A C -1.799 175.775 177.584 -0.016 0.000 0.915 2230 A CA -0.269 51.767 52.037 -0.001 0.000 0.654 2230 A CB 0.190 19.188 19.000 -0.004 0.000 1.280 2230 A HN 1.386 nan 8.150 nan 0.000 0.407 2231 V N 1.995 121.889 119.914 -0.032 0.000 2.444 2231 V HA 0.542 4.662 4.120 -0.000 0.000 0.294 2231 V C -0.059 175.992 176.094 -0.071 0.000 1.022 2231 V CA -0.534 61.741 62.300 -0.041 0.000 0.850 2231 V CB 1.728 33.535 31.823 -0.027 0.000 0.992 2231 V HN 0.772 nan 8.190 nan 0.000 0.426 2232 K N 3.334 123.700 120.400 -0.057 0.000 2.235 2232 K HA 0.475 4.795 4.320 -0.000 0.000 0.266 2232 K C -0.489 176.077 176.600 -0.057 0.000 0.980 2232 K CA -0.571 55.678 56.287 -0.064 0.000 0.849 2232 K CB 1.745 34.215 32.500 -0.050 0.000 1.098 2232 K HN 0.589 nan 8.250 nan 0.000 0.445 2233 E N 2.413 122.574 120.200 -0.064 0.000 1.993 2233 E HA 0.117 4.467 4.350 -0.000 0.000 0.271 2233 E C 0.705 177.277 176.600 -0.046 0.000 1.008 2233 E CA -0.042 56.327 56.400 -0.053 0.000 0.814 2233 E CB 1.231 30.898 29.700 -0.055 0.000 1.098 2233 E HN 0.956 nan 8.360 nan 0.000 0.407 2234 G N 4.240 113.016 108.800 -0.040 0.000 5.206 2234 G HA2 -0.320 3.640 3.960 -0.000 0.000 0.328 2234 G HA3 -0.320 3.640 3.960 -0.000 0.000 0.328 2234 G C 0.440 175.319 174.900 -0.035 0.000 1.382 2234 G CA 0.468 45.547 45.100 -0.035 0.000 0.994 2234 G HN 0.501 nan 8.290 nan 0.000 0.800 2235 E N 1.618 121.795 120.200 -0.038 0.000 2.934 2235 E HA 0.343 4.693 4.350 -0.000 0.000 0.343 2235 E C -1.299 175.274 176.600 -0.045 0.000 1.148 2235 E CA -0.191 56.187 56.400 -0.037 0.000 0.803 2235 E CB -0.361 29.322 29.700 -0.029 0.000 1.541 2235 E HN 0.571 nan 8.360 nan 0.000 0.380 2236 N N 1.513 120.177 118.700 -0.060 0.000 2.777 2236 N HA 0.062 4.802 4.740 -0.000 0.000 0.260 2236 N C -0.815 174.623 175.510 -0.120 0.000 1.113 2236 N CA -0.271 52.733 53.050 -0.078 0.000 0.996 2236 N CB 1.870 40.314 38.487 -0.073 0.000 1.584 2236 N HN -0.082 nan 8.380 nan 0.000 0.573 2237 V N 3.363 123.195 119.914 -0.136 0.000 2.415 2237 V HA 0.002 4.122 4.120 -0.000 0.000 0.252 2237 V C 1.042 176.882 176.094 -0.425 0.000 1.043 2237 V CA 0.382 62.560 62.300 -0.203 0.000 1.149 2237 V CB 0.459 32.201 31.823 -0.136 0.000 1.143 2237 V HN 0.531 nan 8.190 nan 0.000 0.478 2238 V N 4.007 123.669 119.914 -0.420 0.000 3.380 2238 V HA 0.632 4.752 4.120 -0.000 0.000 0.307 2238 V C 0.845 176.607 176.094 -0.554 0.000 1.434 2238 V CA 0.912 62.857 62.300 -0.592 0.000 1.075 2238 V CB 0.389 32.052 31.823 -0.268 0.000 0.954 2238 V HN 0.866 nan 8.190 nan 0.000 0.444 2239 G N -0.859 107.735 108.800 -0.344 0.000 2.703 2239 G HA2 0.516 4.476 3.960 -0.000 0.000 0.294 2239 G HA3 0.516 4.476 3.960 -0.000 0.000 0.294 2239 G C -1.341 173.634 174.900 0.124 0.000 1.451 2239 G CA -0.315 44.804 45.100 0.032 0.000 0.869 2239 G HN 0.029 nan 8.290 nan 0.000 0.516 2240 S N 0.076 115.886 115.700 0.182 0.000 2.456 2240 S HA 0.426 4.896 4.470 -0.000 0.000 0.316 2240 S C -0.359 174.231 174.600 -0.017 0.000 1.089 2240 S CA -0.506 57.744 58.200 0.083 0.000 1.101 2240 S CB 1.753 64.998 63.200 0.075 0.000 0.995 2240 S HN 0.650 nan 8.310 nan 0.000 0.468 2241 E N 2.952 123.132 120.200 -0.032 0.000 2.129 2241 E HA 0.286 4.636 4.350 -0.000 0.000 0.283 2241 E C 0.106 176.638 176.600 -0.113 0.000 1.080 2241 E CA -0.205 56.152 56.400 -0.072 0.000 0.867 2241 E CB 0.335 30.017 29.700 -0.030 0.000 1.056 2241 E HN 0.627 nan 8.360 nan 0.000 0.404 2242 T N 2.152 116.559 114.554 -0.245 0.000 2.948 2242 T HA 0.579 4.929 4.350 -0.000 0.000 0.285 2242 T C -0.246 174.358 174.700 -0.160 0.000 1.019 2242 T CA -1.134 60.810 62.100 -0.260 0.000 1.013 2242 T CB 1.451 70.050 68.868 -0.449 0.000 1.117 2242 T HN 0.444 nan 8.240 nan 0.000 0.533 2243 R N 0.613 121.098 120.500 -0.024 0.000 2.515 2243 R HA 0.586 4.926 4.340 -0.000 0.000 0.291 2243 R C -2.238 174.153 176.300 0.152 0.000 1.046 2243 R CA -0.636 55.523 56.100 0.098 0.000 0.914 2243 R CB 1.728 32.071 30.300 0.072 0.000 1.191 2243 R HN 0.565 nan 8.270 nan 0.000 0.435 2244 V N 4.758 124.811 119.914 0.232 0.000 2.417 2244 V HA 0.399 4.519 4.120 -0.000 0.000 0.291 2244 V C -0.332 175.828 176.094 0.109 0.000 1.024 2244 V CA -0.631 61.779 62.300 0.183 0.000 0.861 2244 V CB 1.734 33.691 31.823 0.224 0.000 0.985 2244 V HN 0.656 nan 8.190 nan 0.000 0.436 2245 K N 3.762 124.211 120.400 0.082 0.000 2.358 2245 K HA 0.569 4.889 4.320 -0.000 0.000 0.260 2245 K C -1.054 175.537 176.600 -0.014 0.000 0.956 2245 K CA -0.590 55.729 56.287 0.054 0.000 0.834 2245 K CB 1.871 34.422 32.500 0.086 0.000 1.102 2245 K HN 0.487 nan 8.250 nan 0.000 0.431 2246 V N 6.199 126.082 119.914 -0.052 0.000 2.338 2246 V HA 0.005 4.125 4.120 -0.000 0.000 0.255 2246 V C 1.183 177.129 176.094 -0.246 0.000 1.082 2246 V CA -0.229 61.991 62.300 -0.134 0.000 0.951 2246 V CB 0.355 32.112 31.823 -0.109 0.000 1.102 2246 V HN 0.703 nan 8.190 nan 0.000 0.489 2247 V N 1.520 121.261 119.914 -0.289 0.000 3.052 2247 V HA 0.241 4.361 4.120 -0.000 0.000 0.254 2247 V C 0.835 176.588 176.094 -0.569 0.000 1.100 2247 V CA 0.616 62.666 62.300 -0.415 0.000 1.112 2247 V CB -0.367 31.362 31.823 -0.156 0.000 0.738 2247 V HN 0.661 nan 8.190 nan 0.000 0.469 2248 K N 1.591 121.707 120.400 -0.473 0.000 2.426 2248 K HA 0.483 4.803 4.320 -0.000 0.000 0.254 2248 K C -1.456 174.984 176.600 -0.267 0.000 0.936 2248 K CA -0.482 55.542 56.287 -0.438 0.000 0.801 2248 K CB 1.359 33.410 32.500 -0.747 0.000 1.139 2248 K HN 0.253 nan 8.250 nan 0.000 0.424 2249 N N 3.813 122.421 118.700 -0.154 0.000 2.653 2249 N HA 0.156 4.896 4.740 -0.000 0.000 0.261 2249 N C -1.398 174.112 175.510 -0.000 0.000 1.216 2249 N CA -0.372 52.632 53.050 -0.077 0.000 0.784 2249 N CB 0.995 39.438 38.487 -0.074 0.000 1.327 2249 N HN 0.520 nan 8.380 nan 0.000 0.539 2250 K N 2.940 123.347 120.400 0.011 0.000 2.994 2250 K HA 0.277 4.597 4.320 -0.000 0.000 0.231 2250 K C 0.272 176.892 176.600 0.034 0.000 1.174 2250 K CA -0.034 56.281 56.287 0.046 0.000 1.221 2250 K CB 0.394 32.935 32.500 0.068 0.000 1.166 2250 K HN 0.426 nan 8.250 nan 0.000 0.453 2251 I N -0.890 119.692 120.570 0.020 0.000 4.607 2251 I HA 0.172 4.342 4.170 -0.000 0.000 0.324 2251 I C 0.192 176.321 176.117 0.020 0.000 1.279 2251 I CA 0.110 61.420 61.300 0.016 0.000 1.286 2251 I CB 1.039 39.039 38.000 0.000 0.000 1.265 2251 I HN 0.148 nan 8.210 nan 0.000 0.446 2252 A N -0.084 122.749 122.820 0.023 0.000 5.450 2252 A HA 0.829 5.149 4.320 -0.000 0.000 0.198 2252 A C -0.941 176.670 177.584 0.045 0.000 0.883 2252 A CA 0.007 52.062 52.037 0.030 0.000 0.784 2252 A CB -0.570 18.441 19.000 0.018 0.000 2.043 2252 A HN 0.097 nan 8.150 nan 0.000 0.994 2253 A N 1.457 124.305 122.820 0.047 0.000 2.451 2253 A HA 0.615 4.935 4.320 -0.000 0.000 0.266 2253 A C -2.519 175.111 177.584 0.077 0.000 1.119 2253 A CA -0.905 51.176 52.037 0.073 0.000 0.786 2253 A CB -0.720 18.320 19.000 0.066 0.000 1.061 2253 A HN 0.353 nan 8.150 nan 0.000 0.503 2254 P HA 0.648 nan 4.420 nan 0.000 0.285 2254 P C -0.050 177.401 177.300 0.252 0.000 1.269 2254 P CA -0.436 62.707 63.100 0.072 0.000 0.844 2254 P CB 0.351 32.089 31.700 0.063 0.000 1.094 2255 F N -3.184 116.795 119.950 0.048 0.000 2.397 2255 F HA -0.206 4.321 4.527 -0.000 0.000 0.438 2255 F C 0.670 176.490 175.800 0.033 0.000 0.555 2255 F CA 0.723 58.751 58.000 0.047 0.000 1.561 2255 F CB -1.625 37.403 39.000 0.046 0.000 2.188 2255 F HN 0.227 nan 8.300 nan 0.000 0.267 2256 K N 2.103 122.588 120.400 0.141 0.000 2.258 2256 K HA 0.413 4.733 4.320 -0.000 0.000 0.264 2256 K C 0.382 177.019 176.600 0.060 0.000 1.007 2256 K CA -0.048 56.293 56.287 0.090 0.000 0.941 2256 K CB 0.852 33.388 32.500 0.060 0.000 0.966 2256 K HN 0.430 nan 8.250 nan 0.000 0.480 2257 Q N -0.200 119.637 119.800 0.061 0.000 2.484 2257 Q HA 0.768 5.108 4.340 -0.000 0.000 0.285 2257 Q C -1.723 174.309 176.000 0.054 0.000 1.097 2257 Q CA -1.298 54.542 55.803 0.060 0.000 0.802 2257 Q CB 2.206 30.993 28.738 0.082 0.000 1.444 2257 Q HN 0.538 nan 8.270 nan 0.000 0.429 2258 A N 1.301 124.164 122.820 0.072 0.000 2.465 2258 A HA 0.526 4.846 4.320 -0.000 0.000 0.292 2258 A C -1.513 176.188 177.584 0.194 0.000 1.041 2258 A CA -0.697 51.387 52.037 0.078 0.000 0.718 2258 A CB 1.689 20.684 19.000 -0.009 0.000 1.266 2258 A HN 0.735 nan 8.150 nan 0.000 0.403 2259 E N 1.051 121.377 120.200 0.210 0.000 2.183 2259 E HA 0.765 5.115 4.350 -0.000 0.000 0.271 2259 E C -0.948 175.886 176.600 0.390 0.000 0.919 2259 E CA -0.471 56.093 56.400 0.274 0.000 0.781 2259 E CB 2.047 31.832 29.700 0.141 0.000 1.140 2259 E HN 0.679 nan 8.360 nan 0.000 0.402 2260 F N -1.361 118.606 119.950 0.029 0.000 2.817 2260 F HA 0.404 4.931 4.527 -0.000 0.000 0.317 2260 F C -1.234 174.594 175.800 0.046 0.000 1.168 2260 F CA -1.305 56.714 58.000 0.031 0.000 0.911 2260 F CB 1.185 40.193 39.000 0.014 0.000 1.337 2260 F HN 0.160 nan 8.300 nan 0.000 0.464 2261 Q N 1.630 121.453 119.800 0.039 0.000 2.230 2261 Q HA 0.651 4.991 4.340 -0.000 0.000 0.253 2261 Q C -1.199 174.780 176.000 -0.036 0.000 0.919 2261 Q CA -0.861 54.917 55.803 -0.041 0.000 0.908 2261 Q CB 2.813 31.586 28.738 0.059 0.000 1.245 2261 Q HN 0.569 nan 8.270 nan 0.000 0.437 2262 I N 2.962 123.499 120.570 -0.056 0.000 2.406 2262 I HA 0.278 4.448 4.170 -0.000 0.000 0.290 2262 I C -1.075 175.135 176.117 0.155 0.000 0.999 2262 I CA -0.772 60.560 61.300 0.053 0.000 1.124 2262 I CB 1.272 39.275 38.000 0.005 0.000 1.289 2262 I HN 0.288 nan 8.210 nan 0.000 0.441 2263 L N 6.872 128.215 121.223 0.199 0.000 2.313 2263 L HA 0.387 4.727 4.340 -0.000 0.000 0.283 2263 L C -0.565 176.528 176.870 0.372 0.000 1.013 2263 L CA -0.241 54.755 54.840 0.260 0.000 0.816 2263 L CB 0.905 43.059 42.059 0.159 0.000 1.236 2263 L HN 0.317 nan 8.230 nan 0.000 0.419 2264 Y N 3.619 123.989 120.300 0.116 0.000 2.852 2264 Y HA 0.139 4.689 4.550 -0.000 0.000 0.343 2264 Y C 1.594 177.604 175.900 0.182 0.000 1.280 2264 Y CA 0.584 58.784 58.100 0.167 0.000 1.604 2264 Y CB 0.178 38.689 38.460 0.085 0.000 1.216 2264 Y HN 0.887 nan 8.280 nan 0.000 0.541 2265 G N 2.699 111.755 108.800 0.427 0.000 2.143 2265 G HA2 -0.320 3.640 3.960 -0.000 0.000 0.248 2265 G HA3 -0.320 3.640 3.960 -0.000 0.000 0.248 2265 G C 0.402 175.312 174.900 0.017 0.000 0.991 2265 G CA 0.560 45.772 45.100 0.187 0.000 0.689 2265 G HN 0.734 nan 8.290 nan 0.000 0.522 2266 E N -1.769 118.435 120.200 0.006 0.000 2.614 2266 E HA 0.411 4.761 4.350 -0.000 0.000 0.201 2266 E C 1.351 177.931 176.600 -0.034 0.000 0.889 2266 E CA 0.952 57.339 56.400 -0.022 0.000 1.564 2266 E CB 0.473 30.200 29.700 0.045 0.000 1.623 2266 E HN 1.759 nan 8.360 nan 0.000 0.898 2267 G N 1.482 110.301 108.800 0.031 0.000 2.545 2267 G HA2 -0.238 3.722 3.960 -0.000 0.000 0.216 2267 G HA3 -0.238 3.722 3.960 -0.000 0.000 0.216 2267 G C -0.222 174.773 174.900 0.157 0.000 1.314 2267 G CA -0.324 44.825 45.100 0.081 0.000 0.906 2267 G HN 0.174 nan 8.290 nan 0.000 0.563 2268 I N 1.157 121.842 120.570 0.192 0.000 2.845 2268 I HA -0.059 4.111 4.170 -0.000 0.000 0.296 2268 I C 0.729 176.999 176.117 0.256 0.000 1.216 2268 I CA 0.256 61.723 61.300 0.278 0.000 1.438 2268 I CB 0.293 38.470 38.000 0.295 0.000 1.342 2268 I HN 0.469 nan 8.210 nan 0.000 0.577 2269 N N 6.464 125.333 118.700 0.282 0.000 2.868 2269 N HA 0.076 4.816 4.740 -0.000 0.000 0.252 2269 N C 0.620 176.303 175.510 0.288 0.000 1.130 2269 N CA -0.042 53.169 53.050 0.268 0.000 1.026 2269 N CB -0.081 38.538 38.487 0.219 0.000 1.335 2269 N HN 0.497 nan 8.380 nan 0.000 0.516 2270 F N 2.111 122.127 119.950 0.108 0.000 2.063 2270 F HA -0.362 4.165 4.527 -0.000 0.000 0.298 2270 F C 0.970 176.738 175.800 -0.053 0.000 1.105 2270 F CA 1.839 59.813 58.000 -0.044 0.000 1.215 2270 F CB -0.022 38.850 39.000 -0.215 0.000 0.972 2270 F HN 0.501 nan 8.300 nan 0.000 0.483 2271 Y N -0.329 120.199 120.300 0.381 0.000 2.314 2271 Y HA -0.025 4.525 4.550 -0.000 0.000 0.293 2271 Y C 2.607 178.607 175.900 0.167 0.000 1.129 2271 Y CA 0.894 59.150 58.100 0.260 0.000 1.201 2271 Y CB -1.224 37.329 38.460 0.155 0.000 0.999 2271 Y HN 0.118 nan 8.280 nan 0.000 0.541 2272 G N 0.699 109.680 108.800 0.302 0.000 2.446 2272 G HA2 -0.296 3.664 3.960 -0.000 0.000 0.217 2272 G HA3 -0.296 3.664 3.960 -0.000 0.000 0.217 2272 G C 1.379 176.371 174.900 0.154 0.000 1.168 2272 G CA 1.324 46.540 45.100 0.193 0.000 0.771 2272 G HN 0.602 nan 8.290 nan 0.000 0.551 2273 E N -0.114 120.167 120.200 0.135 0.000 2.216 2273 E HA 0.088 4.438 4.350 -0.000 0.000 0.192 2273 E C 2.293 178.930 176.600 0.062 0.000 0.988 2273 E CA 0.246 56.697 56.400 0.086 0.000 0.834 2273 E CB -0.257 29.464 29.700 0.036 0.000 0.772 2273 E HN 0.337 nan 8.360 nan 0.000 0.479 2274 L N 1.208 122.478 121.223 0.078 0.000 2.046 2274 L HA -0.138 4.201 4.340 -0.000 0.000 0.208 2274 L C 2.266 179.217 176.870 0.135 0.000 1.077 2274 L CA 1.139 56.031 54.840 0.086 0.000 0.747 2274 L CB -0.156 41.990 42.059 0.144 0.000 0.896 2274 L HN 0.050 nan 8.230 nan 0.000 0.432 2275 V N -0.400 119.619 119.914 0.174 0.000 2.233 2275 V HA -0.334 3.786 4.120 -0.000 0.000 0.247 2275 V C 2.283 178.496 176.094 0.198 0.000 1.050 2275 V CA 2.092 64.512 62.300 0.200 0.000 1.010 2275 V CB -0.759 31.171 31.823 0.178 0.000 0.637 2275 V HN 0.447 nan 8.190 nan 0.000 0.444 2276 D N -0.201 120.298 120.400 0.166 0.000 2.149 2276 D HA -0.172 4.468 4.640 -0.000 0.000 0.194 2276 D C 1.983 178.351 176.300 0.113 0.000 1.001 2276 D CA 1.280 55.369 54.000 0.148 0.000 0.849 2276 D CB -0.189 40.682 40.800 0.119 0.000 0.939 2276 D HN 0.221 nan 8.370 nan 0.000 0.449 2277 L N 0.445 121.722 121.223 0.090 0.000 2.046 2277 L HA -0.032 4.307 4.340 -0.000 0.000 0.208 2277 L C 2.540 179.457 176.870 0.078 0.000 1.077 2277 L CA 1.660 56.538 54.840 0.063 0.000 0.747 2277 L CB -1.208 40.871 42.059 0.033 0.000 0.896 2277 L HN 0.054 nan 8.230 nan 0.000 0.432 2278 G N -1.891 106.973 108.800 0.107 0.000 2.598 2278 G HA2 -0.049 3.911 3.960 -0.000 0.000 0.215 2278 G HA3 -0.049 3.911 3.960 -0.000 0.000 0.215 2278 G C 1.502 176.470 174.900 0.113 0.000 1.131 2278 G CA 0.790 45.964 45.100 0.122 0.000 0.785 2278 G HN 0.286 nan 8.290 nan 0.000 0.539 2279 V N 0.044 120.021 119.914 0.105 0.000 2.446 2279 V HA 0.057 4.177 4.120 -0.000 0.000 0.244 2279 V C 2.482 178.601 176.094 0.041 0.000 1.039 2279 V CA 1.420 63.757 62.300 0.062 0.000 1.045 2279 V CB -0.079 31.784 31.823 0.067 0.000 0.681 2279 V HN 0.259 nan 8.190 nan 0.000 0.459 2280 K N -0.300 120.131 120.400 0.051 0.000 2.418 2280 K HA -0.021 4.299 4.320 -0.000 0.000 0.195 2280 K C 1.129 177.750 176.600 0.035 0.000 1.035 2280 K CA 0.563 56.873 56.287 0.038 0.000 1.003 2280 K CB 0.267 32.791 32.500 0.040 0.000 0.793 2280 K HN 0.295 nan 8.250 nan 0.000 0.494 2281 E N 0.499 120.725 120.200 0.044 0.000 2.558 2281 E HA 0.050 4.400 4.350 -0.000 0.000 0.205 2281 E C -0.357 176.270 176.600 0.045 0.000 1.006 2281 E CA -0.014 56.411 56.400 0.042 0.000 0.961 2281 E CB 0.751 30.478 29.700 0.045 0.000 1.044 2281 E HN 0.086 nan 8.360 nan 0.000 0.465 2282 K N -0.344 120.082 120.400 0.042 0.000 3.349 2282 K HA -0.209 4.111 4.320 -0.000 0.000 0.310 2282 K C 1.071 177.698 176.600 0.046 0.000 1.267 2282 K CA 0.523 56.829 56.287 0.031 0.000 0.920 2282 K CB -2.143 30.367 32.500 0.016 0.000 1.240 2282 K HN 0.221 nan 8.250 nan 0.000 0.453 2283 L N -0.045 121.230 121.223 0.087 0.000 2.179 2283 L HA 0.125 4.465 4.340 -0.000 0.000 0.208 2283 L C 1.146 178.131 176.870 0.192 0.000 1.096 2283 L CA 0.946 55.871 54.840 0.142 0.000 0.779 2283 L CB 0.087 42.266 42.059 0.200 0.000 0.922 2283 L HN 0.140 nan 8.230 nan 0.000 0.443 2284 I N -1.038 119.630 120.570 0.164 0.000 2.509 2284 I HA 0.245 4.415 4.170 -0.000 0.000 0.293 2284 I C -0.589 175.551 176.117 0.038 0.000 1.020 2284 I CA -0.497 60.901 61.300 0.164 0.000 1.088 2284 I CB 2.004 40.137 38.000 0.222 0.000 1.267 2284 I HN -0.100 nan 8.210 nan 0.000 0.430 2285 E N 4.959 125.154 120.200 -0.008 0.000 2.133 2285 E HA 0.290 4.640 4.350 -0.000 0.000 0.274 2285 E C -0.794 175.709 176.600 -0.162 0.000 0.930 2285 E CA -0.832 55.526 56.400 -0.069 0.000 0.770 2285 E CB 1.816 31.488 29.700 -0.047 0.000 1.104 2285 E HN 0.307 nan 8.360 nan 0.000 0.403 2286 K N 2.209 122.483 120.400 -0.210 0.000 2.273 2286 K HA 0.311 4.631 4.320 -0.000 0.000 0.287 2286 K C -0.523 176.006 176.600 -0.119 0.000 1.089 2286 K CA -0.217 55.893 56.287 -0.296 0.000 0.909 2286 K CB 0.523 32.847 32.500 -0.294 0.000 1.123 2286 K HN 0.573 nan 8.250 nan 0.000 0.473 2287 A N 4.168 126.964 122.820 -0.041 0.000 3.258 2287 A HA 0.367 4.687 4.320 -0.000 0.000 0.275 2287 A C 1.031 178.678 177.584 0.106 0.000 1.452 2287 A CA 0.254 52.317 52.037 0.044 0.000 1.120 2287 A CB -0.614 18.427 19.000 0.068 0.000 1.107 2287 A HN 1.100 nan 8.150 nan 0.000 0.651 2288 G N 0.301 109.130 108.800 0.047 0.000 5.155 2288 G HA2 -0.211 3.749 3.960 -0.000 0.000 0.239 2288 G HA3 -0.211 3.749 3.960 -0.000 0.000 0.239 2288 G C 1.336 176.281 174.900 0.075 0.000 1.409 2288 G CA 0.811 45.949 45.100 0.064 0.000 0.927 2288 G HN 1.759 nan 8.290 nan 0.000 0.710 2289 A N -1.063 121.831 122.820 0.123 0.000 2.358 2289 A HA 0.575 4.895 4.320 -0.000 0.000 0.223 2289 A C 0.521 178.144 177.584 0.066 0.000 1.218 2289 A CA 0.499 52.574 52.037 0.065 0.000 0.942 2289 A CB 0.200 19.176 19.000 -0.040 0.000 1.005 2289 A HN 0.558 nan 8.150 nan 0.000 0.514 2290 W N -1.057 120.294 121.300 0.085 0.000 2.376 2290 W HA 0.579 5.239 4.660 -0.000 0.000 0.322 2290 W C -0.784 175.778 176.519 0.070 0.000 1.160 2290 W CA -0.006 57.402 57.345 0.106 0.000 1.218 2290 W CB 0.554 30.028 29.460 0.025 0.000 1.205 2290 W HN 0.174 nan 8.180 nan 0.000 0.559 2291 Y N 2.261 122.684 120.300 0.206 0.000 2.388 2291 Y HA 0.387 4.937 4.550 -0.000 0.000 0.328 2291 Y C 0.072 176.017 175.900 0.075 0.000 0.963 2291 Y CA -0.723 57.439 58.100 0.102 0.000 1.240 2291 Y CB 1.115 39.595 38.460 0.033 0.000 1.118 2291 Y HN 0.133 nan 8.280 nan 0.000 0.484 2292 S N 2.939 118.708 115.700 0.116 0.000 2.472 2292 S HA 0.287 4.757 4.470 -0.000 0.000 0.303 2292 S C -1.407 173.258 174.600 0.109 0.000 1.099 2292 S CA -0.692 57.550 58.200 0.070 0.000 1.077 2292 S CB 0.954 64.162 63.200 0.014 0.000 1.031 2292 S HN 0.500 nan 8.310 nan 0.000 0.487 2293 Y N 3.237 123.515 120.300 -0.037 0.000 2.944 2293 Y HA 0.377 4.927 4.550 -0.000 0.000 0.335 2293 Y C -0.253 175.654 175.900 0.012 0.000 1.075 2293 Y CA -0.818 57.285 58.100 0.005 0.000 1.240 2293 Y CB -0.415 38.064 38.460 0.031 0.000 1.167 2293 Y HN 0.781 nan 8.280 nan 0.000 0.555 2294 K N 4.005 124.213 120.400 -0.319 0.000 5.617 2294 K HA -0.225 4.095 4.320 -0.000 0.000 0.401 2294 K C 1.066 177.566 176.600 -0.167 0.000 0.978 2294 K CA 1.067 57.175 56.287 -0.298 0.000 1.200 2294 K CB -1.132 31.098 32.500 -0.451 0.000 1.863 2294 K HN 1.163 nan 8.250 nan 0.000 0.382 2295 G N 1.454 110.194 108.800 -0.101 0.000 3.444 2295 G HA2 -0.368 3.592 3.960 -0.000 0.000 0.222 2295 G HA3 -0.368 3.592 3.960 -0.000 0.000 0.222 2295 G C -0.043 174.830 174.900 -0.046 0.000 1.358 2295 G CA 0.319 45.380 45.100 -0.066 0.000 0.880 2295 G HN 0.549 nan 8.290 nan 0.000 0.555 2296 E N 2.245 122.434 120.200 -0.019 0.000 2.417 2296 E HA 0.245 4.595 4.350 -0.000 0.000 0.261 2296 E C 0.059 176.644 176.600 -0.026 0.000 1.000 2296 E CA 0.395 56.799 56.400 0.006 0.000 0.919 2296 E CB 0.389 30.141 29.700 0.086 0.000 0.955 2296 E HN 0.450 nan 8.360 nan 0.000 0.455 2297 K N 3.820 124.194 120.400 -0.044 0.000 2.253 2297 K HA 0.200 4.520 4.320 -0.000 0.000 0.277 2297 K C 1.057 177.585 176.600 -0.119 0.000 1.053 2297 K CA -0.111 56.163 56.287 -0.021 0.000 0.892 2297 K CB 0.632 33.134 32.500 0.003 0.000 1.102 2297 K HN 0.506 nan 8.250 nan 0.000 0.469 2298 I N -1.554 118.871 120.570 -0.241 0.000 4.057 2298 I HA 0.333 4.503 4.170 -0.000 0.000 0.334 2298 I C 0.503 176.325 176.117 -0.491 0.000 1.308 2298 I CA -0.290 60.557 61.300 -0.755 0.000 1.125 2298 I CB 0.925 38.128 38.000 -1.329 0.000 1.034 2298 I HN 0.526 nan 8.210 nan 0.000 0.401 2299 G N 0.987 109.725 108.800 -0.103 0.000 2.489 2299 G HA2 0.381 4.341 3.960 -0.000 0.000 0.291 2299 G HA3 0.381 4.341 3.960 -0.000 0.000 0.291 2299 G C -2.198 172.659 174.900 -0.072 0.000 1.487 2299 G CA -0.612 44.441 45.100 -0.078 0.000 0.795 2299 G HN 0.219 nan 8.290 nan 0.000 0.513 2300 Q N -0.023 119.615 119.800 -0.269 0.000 2.292 2300 Q HA 0.554 4.894 4.340 -0.000 0.000 0.270 2300 Q C -0.036 175.771 176.000 -0.323 0.000 1.024 2300 Q CA 0.141 55.653 55.803 -0.484 0.000 0.768 2300 Q CB 1.597 29.777 28.738 -0.929 0.000 1.250 2300 Q HN 2.460 nan 8.270 nan 0.000 0.447 2301 G N 3.541 112.201 108.800 -0.233 0.000 3.285 2301 G HA2 -0.254 3.706 3.960 -0.000 0.000 0.685 2301 G HA3 -0.254 3.706 3.960 -0.000 0.000 0.685 2301 G C 0.219 174.932 174.900 -0.313 0.000 0.938 2301 G CA 0.130 45.115 45.100 -0.191 0.000 0.778 2301 G HN 0.846 nan 8.290 nan 0.000 0.515 2302 K N 1.699 121.899 120.400 -0.332 0.000 2.117 2302 K HA -0.266 4.054 4.320 -0.000 0.000 0.215 2302 K C 2.902 179.318 176.600 -0.306 0.000 1.053 2302 K CA 3.056 59.073 56.287 -0.450 0.000 0.935 2302 K CB -0.331 32.068 32.500 -0.169 0.000 0.719 2302 K HN 1.350 nan 8.250 nan 0.000 0.460 2303 A N 1.658 124.371 122.820 -0.178 0.000 1.842 2303 A HA -0.252 4.068 4.320 -0.000 0.000 0.217 2303 A C 1.852 179.373 177.584 -0.106 0.000 1.206 2303 A CA 2.157 54.128 52.037 -0.110 0.000 0.630 2303 A CB -0.986 17.965 19.000 -0.081 0.000 0.839 2303 A HN 0.497 nan 8.150 nan 0.000 0.447 2304 N N 0.108 118.736 118.700 -0.121 0.000 2.348 2304 N HA -0.103 4.637 4.740 -0.000 0.000 0.185 2304 N C 1.686 177.166 175.510 -0.050 0.000 1.019 2304 N CA 1.388 54.391 53.050 -0.079 0.000 0.880 2304 N CB -0.459 37.969 38.487 -0.098 0.000 0.965 2304 N HN 0.548 nan 8.380 nan 0.000 0.437 2305 A N 0.217 122.951 122.820 -0.143 0.000 1.878 2305 A HA -0.019 4.301 4.320 -0.000 0.000 0.213 2305 A C 2.333 179.937 177.584 0.033 0.000 1.192 2305 A CA 1.428 53.405 52.037 -0.100 0.000 0.619 2305 A CB -0.928 17.855 19.000 -0.360 0.000 0.837 2305 A HN 0.219 nan 8.150 nan 0.000 0.446 2306 T N 1.043 115.577 114.554 -0.033 0.000 2.536 2306 T HA -0.205 4.145 4.350 -0.000 0.000 0.263 2306 T C 1.827 176.563 174.700 0.060 0.000 1.115 2306 T CA 2.075 64.203 62.100 0.047 0.000 1.180 2306 T CB -0.624 68.258 68.868 0.023 0.000 0.864 2306 T HN 0.620 nan 8.240 nan 0.000 0.419 2307 A N -0.826 122.003 122.820 0.014 0.000 2.236 2307 A HA 0.128 4.448 4.320 -0.000 0.000 0.214 2307 A C 1.508 179.102 177.584 0.018 0.000 1.287 2307 A CA 0.222 52.235 52.037 -0.041 0.000 0.909 2307 A CB -1.055 17.917 19.000 -0.047 0.000 0.839 2307 A HN 0.774 nan 8.150 nan 0.000 0.486 2308 W N -0.772 120.470 121.300 -0.096 0.000 2.735 2308 W HA 0.179 4.839 4.660 -0.000 0.000 0.264 2308 W C 1.259 177.734 176.519 -0.072 0.000 1.233 2308 W CA 0.484 57.788 57.345 -0.068 0.000 1.408 2308 W CB 0.155 29.602 29.460 -0.022 0.000 1.038 2308 W HN 0.222 nan 8.180 nan 0.000 0.603 2309 L N 1.018 122.311 121.223 0.116 0.000 2.201 2309 L HA -0.124 4.216 4.340 -0.000 0.000 0.212 2309 L C 2.321 179.021 176.870 -0.284 0.000 1.105 2309 L CA 1.226 56.074 54.840 0.013 0.000 0.775 2309 L CB -0.840 41.429 42.059 0.350 0.000 0.913 2309 L HN -0.074 nan 8.230 nan 0.000 0.440 2310 K N 0.212 120.269 120.400 -0.572 0.000 2.362 2310 K HA -0.185 4.134 4.320 -0.000 0.000 0.200 2310 K C 1.291 177.627 176.600 -0.441 0.000 1.046 2310 K CA 1.164 56.976 56.287 -0.793 0.000 0.952 2310 K CB 0.155 32.245 32.500 -0.682 0.000 0.753 2310 K HN 0.196 nan 8.250 nan 0.000 0.466 2311 D N 0.215 120.360 120.400 -0.425 0.000 2.277 2311 D HA -0.017 4.623 4.640 -0.000 0.000 0.209 2311 D C -0.310 175.741 176.300 -0.414 0.000 0.970 2311 D CA 0.538 54.301 54.000 -0.395 0.000 0.874 2311 D CB 0.356 40.900 40.800 -0.428 0.000 0.982 2311 D HN 0.266 nan 8.370 nan 0.000 0.504 2312 N N -0.139 118.243 118.700 -0.530 0.000 2.664 2312 N HA 0.201 4.941 4.740 -0.000 0.000 0.257 2312 N C -2.535 172.816 175.510 -0.266 0.000 1.108 2312 N CA -1.299 51.516 53.050 -0.393 0.000 0.822 2312 N CB 2.070 40.292 38.487 -0.441 0.000 1.199 2312 N HN -0.161 nan 8.380 nan 0.000 0.529 2313 P HA -0.071 nan 4.420 nan 0.000 0.236 2313 P C 1.017 178.280 177.300 -0.061 0.000 1.172 2313 P CA 0.684 63.752 63.100 -0.053 0.000 0.759 2313 P CB 0.362 32.041 31.700 -0.035 0.000 0.843 2314 E N -0.260 119.888 120.200 -0.086 0.000 2.007 2314 E HA -0.108 4.242 4.350 -0.000 0.000 0.194 2314 E C 1.648 178.224 176.600 -0.040 0.000 0.999 2314 E CA 1.730 58.097 56.400 -0.055 0.000 0.811 2314 E CB -1.143 28.526 29.700 -0.052 0.000 0.762 2314 E HN 0.281 nan 8.360 nan 0.000 0.450 2315 T N 1.321 115.836 114.554 -0.064 0.000 2.995 2315 T HA 0.057 4.407 4.350 -0.000 0.000 0.269 2315 T C 1.912 176.576 174.700 -0.061 0.000 1.091 2315 T CA 0.864 62.922 62.100 -0.069 0.000 1.128 2315 T CB -0.057 68.740 68.868 -0.118 0.000 0.891 2315 T HN 0.214 nan 8.240 nan 0.000 0.492 2316 A N 2.722 125.525 122.820 -0.028 0.000 1.835 2316 A HA -0.105 4.215 4.320 -0.000 0.000 0.215 2316 A C 2.225 179.817 177.584 0.014 0.000 1.199 2316 A CA 1.356 53.410 52.037 0.028 0.000 0.615 2316 A CB -0.535 18.518 19.000 0.088 0.000 0.838 2316 A HN 0.409 nan 8.150 nan 0.000 0.444 2317 K N -0.414 119.979 120.400 -0.012 0.000 2.362 2317 K HA -0.188 4.132 4.320 -0.000 0.000 0.202 2317 K C 1.958 178.569 176.600 0.018 0.000 1.045 2317 K CA 1.427 57.708 56.287 -0.011 0.000 0.936 2317 K CB -0.070 32.411 32.500 -0.031 0.000 0.747 2317 K HN 0.721 nan 8.250 nan 0.000 0.467 2318 E N 0.910 121.124 120.200 0.023 0.000 2.033 2318 E HA -0.087 4.263 4.350 -0.000 0.000 0.189 2318 E C 1.906 178.543 176.600 0.063 0.000 0.979 2318 E CA 0.592 57.020 56.400 0.046 0.000 0.802 2318 E CB 0.126 29.861 29.700 0.059 0.000 0.763 2318 E HN 0.208 nan 8.360 nan 0.000 0.449 2319 I N 1.200 121.805 120.570 0.059 0.000 2.353 2319 I HA -0.203 3.967 4.170 -0.000 0.000 0.248 2319 I C 2.570 178.734 176.117 0.078 0.000 1.119 2319 I CA 0.827 62.177 61.300 0.084 0.000 1.417 2319 I CB -0.328 37.719 38.000 0.078 0.000 1.078 2319 I HN 0.243 nan 8.210 nan 0.000 0.421 2320 E N 1.768 122.015 120.200 0.078 0.000 2.068 2320 E HA -0.358 3.992 4.350 -0.000 0.000 0.207 2320 E C 2.177 178.815 176.600 0.063 0.000 1.032 2320 E CA 2.083 58.538 56.400 0.092 0.000 0.839 2320 E CB -0.023 29.753 29.700 0.126 0.000 0.758 2320 E HN 0.344 nan 8.360 nan 0.000 0.457 2321 K N 0.265 120.698 120.400 0.056 0.000 2.057 2321 K HA -0.112 4.208 4.320 -0.000 0.000 0.206 2321 K C 2.166 178.791 176.600 0.042 0.000 1.050 2321 K CA 1.400 57.713 56.287 0.043 0.000 0.935 2321 K CB 0.072 32.595 32.500 0.038 0.000 0.715 2321 K HN -0.008 nan 8.250 nan 0.000 0.439 2322 K N 0.063 120.495 120.400 0.054 0.000 2.360 2322 K HA -0.098 4.222 4.320 -0.000 0.000 0.201 2322 K C 1.708 178.338 176.600 0.049 0.000 1.046 2322 K CA 0.930 57.251 56.287 0.056 0.000 0.945 2322 K CB 0.184 32.731 32.500 0.078 0.000 0.750 2322 K HN 0.038 nan 8.250 nan 0.000 0.464 2323 V N 0.569 120.510 119.914 0.045 0.000 2.599 2323 V HA -0.093 4.027 4.120 -0.000 0.000 0.245 2323 V C 2.054 178.156 176.094 0.014 0.000 1.046 2323 V CA 0.979 63.298 62.300 0.031 0.000 1.065 2323 V CB -0.301 31.540 31.823 0.029 0.000 0.703 2323 V HN 0.224 nan 8.190 nan 0.000 0.464 2324 R N 0.338 120.845 120.500 0.011 0.000 2.103 2324 R HA -0.222 4.118 4.340 -0.000 0.000 0.242 2324 R C 2.248 178.552 176.300 0.007 0.000 1.142 2324 R CA 1.937 58.038 56.100 0.002 0.000 0.960 2324 R CB -0.296 30.007 30.300 0.005 0.000 0.858 2324 R HN 0.595 nan 8.270 nan 0.000 0.439 2325 E N 0.339 120.549 120.200 0.016 0.000 2.150 2325 E HA -0.143 4.207 4.350 -0.000 0.000 0.193 2325 E C 1.745 178.355 176.600 0.016 0.000 0.985 2325 E CA 0.801 57.212 56.400 0.017 0.000 0.814 2325 E CB 0.061 29.775 29.700 0.023 0.000 0.752 2325 E HN 0.276 nan 8.360 nan 0.000 0.466 2326 L N -0.146 121.087 121.223 0.018 0.000 2.509 2326 L HA 0.040 4.380 4.340 -0.000 0.000 0.222 2326 L C 1.579 178.456 176.870 0.012 0.000 1.123 2326 L CA 0.331 55.182 54.840 0.017 0.000 0.856 2326 L CB 0.439 42.512 42.059 0.023 0.000 0.985 2326 L HN 0.100 nan 8.230 nan 0.000 0.456 2327 L N -1.931 119.296 121.223 0.006 0.000 3.128 2327 L HA 0.213 4.553 4.340 -0.000 0.000 0.277 2327 L C -0.205 176.664 176.870 -0.003 0.000 1.171 2327 L CA -0.170 54.671 54.840 0.001 0.000 1.008 2327 L CB 0.939 42.996 42.059 -0.003 0.000 1.442 2327 L HN 0.019 nan 8.230 nan 0.000 0.584 3007 Q N 0.843 120.648 119.800 0.008 0.000 2.329 3007 Q HA 0.067 4.407 4.340 -0.000 0.000 0.208 3007 Q C 0.690 176.696 176.000 0.010 0.000 0.934 3007 Q CA 0.517 56.326 55.803 0.010 0.000 0.951 3007 Q CB 0.158 28.901 28.738 0.010 0.000 1.017 3007 Q HN 0.391 nan 8.270 nan 0.000 0.490 3008 K N -0.546 119.859 120.400 0.009 0.000 2.021 3008 K HA -0.042 4.278 4.320 -0.000 0.000 0.205 3008 K C 1.731 178.337 176.600 0.010 0.000 1.047 3008 K CA 1.094 57.386 56.287 0.009 0.000 0.943 3008 K CB -0.033 32.471 32.500 0.007 0.000 0.725 3008 K HN 0.238 nan 8.250 nan 0.000 0.439 3009 A N 0.978 123.804 122.820 0.010 0.000 2.014 3009 A HA -0.068 4.252 4.320 -0.000 0.000 0.218 3009 A C 1.889 179.482 177.584 0.015 0.000 1.163 3009 A CA 0.857 52.901 52.037 0.012 0.000 0.652 3009 A CB -0.316 18.690 19.000 0.010 0.000 0.808 3009 A HN 0.360 nan 8.150 nan 0.000 0.449 3010 L N -0.516 120.716 121.223 0.015 0.000 2.051 3010 L HA 0.261 4.601 4.340 -0.000 0.000 0.202 3010 L C 2.439 179.321 176.870 0.021 0.000 1.097 3010 L CA 1.916 56.768 54.840 0.019 0.000 0.762 3010 L CB -0.814 41.255 42.059 0.018 0.000 0.913 3010 L HN 0.216 nan 8.230 nan 0.000 0.447 3011 A N -0.933 121.898 122.820 0.018 0.000 2.272 3011 A HA 0.144 4.464 4.320 -0.000 0.000 0.213 3011 A C 1.863 179.457 177.584 0.018 0.000 1.183 3011 A CA 1.541 53.589 52.037 0.018 0.000 0.719 3011 A CB -0.961 18.048 19.000 0.015 0.000 0.771 3011 A HN 0.638 nan 8.150 nan 0.000 0.484 3012 A N -1.137 121.693 122.820 0.018 0.000 2.016 3012 A HA 0.563 4.883 4.320 -0.000 0.000 0.202 3012 A C 2.221 179.817 177.584 0.020 0.000 1.632 3012 A CA 0.933 52.980 52.037 0.017 0.000 0.891 3012 A CB -0.946 18.061 19.000 0.013 0.000 1.103 3012 A HN 0.987 nan 8.150 nan 0.000 0.547 3013 A N 0.299 123.132 122.820 0.022 0.000 2.131 3013 A HA 0.014 4.334 4.320 -0.000 0.000 0.220 3013 A C 1.993 179.600 177.584 0.039 0.000 1.158 3013 A CA 1.276 53.330 52.037 0.028 0.000 0.665 3013 A CB -0.770 18.247 19.000 0.028 0.000 0.795 3013 A HN 0.487 nan 8.150 nan 0.000 0.460 3014 L N -0.804 120.442 121.223 0.038 0.000 1.924 3014 L HA -0.193 4.147 4.340 -0.000 0.000 0.222 3014 L C 2.868 179.770 176.870 0.053 0.000 1.081 3014 L CA 1.534 56.402 54.840 0.047 0.000 0.780 3014 L CB -1.277 40.806 42.059 0.041 0.000 0.891 3014 L HN 0.441 nan 8.230 nan 0.000 0.434 3015 G N -1.257 107.568 108.800 0.041 0.000 2.499 3015 G HA2 -0.256 3.704 3.960 -0.000 0.000 0.221 3015 G HA3 -0.256 3.704 3.960 -0.000 0.000 0.221 3015 G C 1.476 176.398 174.900 0.037 0.000 1.109 3015 G CA 0.305 45.429 45.100 0.039 0.000 0.749 3015 G HN 0.367 nan 8.290 nan 0.000 0.568 3016 Q N -0.076 119.743 119.800 0.032 0.000 2.152 3016 Q HA -0.126 4.214 4.340 -0.000 0.000 0.206 3016 Q C 2.640 178.655 176.000 0.025 0.000 0.985 3016 Q CA 0.969 56.782 55.803 0.017 0.000 0.863 3016 Q CB -0.226 28.522 28.738 0.016 0.000 0.904 3016 Q HN 0.508 nan 8.270 nan 0.000 0.422 3017 I N 0.173 120.794 120.570 0.085 0.000 2.406 3017 I HA -0.122 4.048 4.170 -0.000 0.000 0.249 3017 I C 2.042 178.287 176.117 0.214 0.000 1.122 3017 I CA 0.810 62.224 61.300 0.190 0.000 1.431 3017 I CB -1.181 36.958 38.000 0.232 0.000 1.087 3017 I HN 0.202 nan 8.210 nan 0.000 0.424 3018 E N 1.157 121.436 120.200 0.132 0.000 2.077 3018 E HA -0.246 4.104 4.350 -0.000 0.000 0.193 3018 E C 2.198 178.840 176.600 0.071 0.000 0.989 3018 E CA 1.211 57.679 56.400 0.113 0.000 0.800 3018 E CB 0.012 29.756 29.700 0.074 0.000 0.746 3018 E HN 0.374 nan 8.360 nan 0.000 0.452 3019 K N 0.640 121.053 120.400 0.022 0.000 2.057 3019 K HA -0.169 4.151 4.320 -0.000 0.000 0.206 3019 K C 2.157 178.704 176.600 -0.088 0.000 1.050 3019 K CA 1.137 57.410 56.287 -0.022 0.000 0.935 3019 K CB 0.091 32.573 32.500 -0.030 0.000 0.715 3019 K HN 0.075 nan 8.250 nan 0.000 0.439 3020 Q N -1.093 118.593 119.800 -0.190 0.000 2.167 3020 Q HA -0.124 4.215 4.340 -0.000 0.000 0.202 3020 Q C 1.057 176.690 176.000 -0.613 0.000 0.970 3020 Q CA 1.455 56.964 55.803 -0.491 0.000 0.855 3020 Q CB 0.158 28.423 28.738 -0.788 0.000 0.911 3020 Q HN 0.230 nan 8.270 nan 0.000 0.438 3021 F N -1.634 118.326 119.950 0.017 0.000 2.294 3021 F HA 0.384 4.911 4.527 -0.000 0.000 0.241 3021 F C 0.976 176.788 175.800 0.020 0.000 1.009 3021 F CA 0.044 58.056 58.000 0.020 0.000 1.165 3021 F CB -0.146 38.869 39.000 0.025 0.000 1.445 3021 F HN -0.151 nan 8.300 nan 0.000 0.632 3022 G N 0.168 109.124 108.800 0.260 0.000 2.638 3022 G HA2 0.430 4.390 3.960 -0.000 0.000 0.302 3022 G HA3 0.430 4.390 3.960 -0.000 0.000 0.302 3022 G C -1.591 173.375 174.900 0.110 0.000 1.365 3022 G CA -0.748 44.435 45.100 0.140 0.000 0.987 3022 G HN 0.013 nan 8.290 nan 0.000 0.495 3023 K N 0.865 121.307 120.400 0.070 0.000 2.336 3023 K HA 0.443 4.763 4.320 -0.000 0.000 0.290 3023 K C 0.945 177.575 176.600 0.051 0.000 1.067 3023 K CA 1.045 57.364 56.287 0.054 0.000 0.962 3023 K CB 0.078 32.599 32.500 0.034 0.000 1.008 3023 K HN 1.310 nan 8.250 nan 0.000 0.467 3024 G N 2.658 111.494 108.800 0.059 0.000 2.288 3024 G HA2 -0.201 3.759 3.960 -0.000 0.000 0.205 3024 G HA3 -0.201 3.759 3.960 -0.000 0.000 0.205 3024 G C 0.045 174.980 174.900 0.057 0.000 1.071 3024 G CA 0.135 45.265 45.100 0.051 0.000 0.788 3024 G HN 0.623 nan 8.290 nan 0.000 0.491 3025 S N -0.918 114.827 115.700 0.075 0.000 2.651 3025 S HA 0.694 5.164 4.470 -0.000 0.000 0.246 3025 S C 0.224 174.868 174.600 0.074 0.000 1.039 3025 S CA 0.155 58.398 58.200 0.072 0.000 1.013 3025 S CB 0.584 63.827 63.200 0.071 0.000 0.861 3025 S HN 1.569 nan 8.310 nan 0.000 0.485 3026 I N 0.946 121.563 120.570 0.079 0.000 2.787 3026 I HA 0.644 4.814 4.170 -0.000 0.000 0.294 3026 I C -1.856 174.308 176.117 0.079 0.000 1.365 3026 I CA -1.081 60.269 61.300 0.084 0.000 1.029 3026 I CB 1.992 40.041 38.000 0.082 0.000 1.313 3026 I HN 0.417 nan 8.210 nan 0.000 0.431 3027 M N 4.554 124.206 119.600 0.086 0.000 2.895 3027 M HA 0.505 4.985 4.480 -0.000 0.000 0.271 3027 M C -1.719 174.628 176.300 0.079 0.000 1.174 3027 M CA -1.051 54.293 55.300 0.073 0.000 0.816 3027 M CB 1.764 34.401 32.600 0.061 0.000 1.647 3027 M HN 0.449 nan 8.290 nan 0.000 0.506 3028 R N 0.767 121.304 120.500 0.063 0.000 2.543 3028 R HA 0.379 4.719 4.340 -0.000 0.000 0.277 3028 R C 0.532 176.870 176.300 0.063 0.000 1.074 3028 R CA -0.220 55.915 56.100 0.058 0.000 1.076 3028 R CB 0.856 31.181 30.300 0.043 0.000 0.993 3028 R HN 0.662 nan 8.270 nan 0.000 0.459 3029 L N 1.187 122.450 121.223 0.067 0.000 2.418 3029 L HA 0.046 4.386 4.340 -0.000 0.000 0.218 3029 L C 1.578 178.483 176.870 0.059 0.000 1.125 3029 L CA 0.788 55.676 54.840 0.079 0.000 0.835 3029 L CB 0.124 42.237 42.059 0.090 0.000 0.953 3029 L HN 0.790 nan 8.230 nan 0.000 0.454 3030 G N -0.042 108.784 108.800 0.043 0.000 3.943 3030 G HA2 0.147 4.107 3.960 -0.000 0.000 0.275 3030 G HA3 0.147 4.107 3.960 -0.000 0.000 0.275 3030 G C -0.059 174.859 174.900 0.031 0.000 1.234 3030 G CA -0.210 44.911 45.100 0.034 0.000 1.522 3030 G HN -0.049 nan 8.290 nan 0.000 0.636 3031 E N 0.226 120.446 120.200 0.033 0.000 2.171 3031 E HA 0.192 4.542 4.350 -0.000 0.000 0.271 3031 E C -0.112 176.502 176.600 0.024 0.000 0.916 3031 E CA -0.493 55.924 56.400 0.028 0.000 0.774 3031 E CB 2.056 31.775 29.700 0.031 0.000 1.128 3031 E HN 0.114 nan 8.360 nan 0.000 0.403 3032 D N 1.452 121.865 120.400 0.020 0.000 2.117 3032 D HA -0.083 4.557 4.640 -0.000 0.000 0.198 3032 D C 0.327 176.636 176.300 0.014 0.000 0.982 3032 D CA 0.831 54.840 54.000 0.016 0.000 0.828 3032 D CB 0.066 40.875 40.800 0.015 0.000 0.967 3032 D HN 0.094 nan 8.370 nan 0.000 0.464 3033 R N 1.525 122.035 120.500 0.016 0.000 3.253 3033 R HA 0.018 4.358 4.340 -0.000 0.000 0.319 3033 R C 0.057 176.364 176.300 0.012 0.000 1.047 3033 R CA -0.000 56.108 56.100 0.015 0.000 0.970 3033 R CB -0.557 29.753 30.300 0.018 0.000 1.000 3033 R HN 0.222 nan 8.270 nan 0.000 0.423 3034 S N 2.333 118.038 115.700 0.008 0.000 2.713 3034 S HA 0.569 5.039 4.470 -0.000 0.000 0.283 3034 S C 0.385 174.987 174.600 0.003 0.000 1.161 3034 S CA -0.976 57.226 58.200 0.003 0.000 0.999 3034 S CB 1.694 64.893 63.200 -0.001 0.000 1.039 3034 S HN 0.319 nan 8.310 nan 0.000 0.548 3035 M N 0.495 120.095 119.600 0.000 0.000 2.799 3035 M HA 0.483 4.963 4.480 -0.000 0.000 0.274 3035 M C -1.146 175.152 176.300 -0.003 0.000 1.137 3035 M CA -0.819 54.481 55.300 0.001 0.000 0.897 3035 M CB 0.415 33.016 32.600 0.002 0.000 1.567 3035 M HN 0.471 nan 8.290 nan 0.000 0.536 3036 D N 1.137 121.535 120.400 -0.003 0.000 2.396 3036 D HA 0.525 5.165 4.640 -0.000 0.000 0.225 3036 D C -1.298 174.997 176.300 -0.008 0.000 1.121 3036 D CA 0.175 54.171 54.000 -0.006 0.000 0.853 3036 D CB 0.869 41.666 40.800 -0.004 0.000 1.043 3036 D HN 0.237 nan 8.370 nan 0.000 0.500 3037 V N 1.350 121.257 119.914 -0.012 0.000 3.087 3037 V HA 0.275 4.395 4.120 -0.000 0.000 0.306 3037 V C 0.146 176.229 176.094 -0.018 0.000 1.187 3037 V CA -1.179 61.112 62.300 -0.015 0.000 0.999 3037 V CB 2.243 34.056 31.823 -0.017 0.000 1.049 3037 V HN 0.317 nan 8.190 nan 0.000 0.431 3038 E N 2.244 122.432 120.200 -0.019 0.000 2.493 3038 E HA 0.240 4.590 4.350 -0.000 0.000 0.255 3038 E C -0.335 176.248 176.600 -0.028 0.000 0.999 3038 E CA 0.269 56.655 56.400 -0.023 0.000 0.934 3038 E CB 0.729 30.416 29.700 -0.023 0.000 0.940 3038 E HN 0.842 nan 8.360 nan 0.000 0.473 3039 T N 1.524 116.059 114.554 -0.032 0.000 2.815 3039 T HA 0.396 4.746 4.350 -0.000 0.000 0.289 3039 T C 0.094 174.766 174.700 -0.048 0.000 1.000 3039 T CA -0.972 61.104 62.100 -0.039 0.000 0.958 3039 T CB 0.658 69.503 68.868 -0.038 0.000 0.944 3039 T HN 0.126 nan 8.240 nan 0.000 0.442 3040 I N 2.421 122.959 120.570 -0.053 0.000 2.519 3040 I HA 0.272 4.442 4.170 -0.000 0.000 0.287 3040 I C 1.149 177.218 176.117 -0.081 0.000 1.047 3040 I CA -0.442 60.819 61.300 -0.065 0.000 1.381 3040 I CB 1.099 39.061 38.000 -0.063 0.000 1.417 3040 I HN 0.721 nan 8.210 nan 0.000 0.540 3041 S N 2.836 118.475 115.700 -0.100 0.000 2.562 3041 S HA 0.079 4.548 4.470 -0.000 0.000 0.281 3041 S C 1.417 175.932 174.600 -0.141 0.000 1.333 3041 S CA -0.104 58.018 58.200 -0.130 0.000 1.052 3041 S CB 0.405 63.505 63.200 -0.168 0.000 0.884 3041 S HN 0.810 nan 8.310 nan 0.000 0.506 3042 T N 1.632 116.096 114.554 -0.149 0.000 3.088 3042 T HA 0.313 4.663 4.350 -0.000 0.000 0.259 3042 T C 1.446 176.034 174.700 -0.188 0.000 1.122 3042 T CA 0.852 62.867 62.100 -0.142 0.000 1.095 3042 T CB -0.222 68.573 68.868 -0.122 0.000 0.930 3042 T HN 1.250 nan 8.240 nan 0.000 0.508 3043 G N 0.875 109.526 108.800 -0.248 0.000 2.397 3043 G HA2 -0.273 3.687 3.960 -0.000 0.000 0.211 3043 G HA3 -0.273 3.687 3.960 -0.000 0.000 0.211 3043 G C 0.560 175.212 174.900 -0.414 0.000 1.077 3043 G CA 0.429 45.343 45.100 -0.310 0.000 0.649 3043 G HN 0.987 nan 8.290 nan 0.000 0.511 3044 S N -0.371 115.056 115.700 -0.454 0.000 2.625 3044 S HA 0.660 5.130 4.470 -0.000 0.000 0.258 3044 S C 1.230 175.612 174.600 -0.365 0.000 1.256 3044 S CA 0.625 58.481 58.200 -0.572 0.000 0.983 3044 S CB 1.019 63.789 63.200 -0.717 0.000 1.032 3044 S HN 0.774 nan 8.310 nan 0.000 0.572 3045 L N 0.334 121.393 121.223 -0.273 0.000 2.688 3045 L HA 0.231 4.571 4.340 -0.000 0.000 0.216 3045 L C 2.366 179.186 176.870 -0.083 0.000 1.036 3045 L CA 1.483 56.232 54.840 -0.150 0.000 0.906 3045 L CB -1.000 41.006 42.059 -0.087 0.000 1.501 3045 L HN 0.886 nan 8.230 nan 0.000 0.489 3046 S N -0.398 115.271 115.700 -0.052 0.000 2.461 3046 S HA -0.096 4.374 4.470 -0.000 0.000 0.228 3046 S C 1.911 176.525 174.600 0.023 0.000 1.005 3046 S CA 0.658 58.868 58.200 0.017 0.000 0.942 3046 S CB -0.427 62.821 63.200 0.081 0.000 0.776 3046 S HN 0.381 nan 8.310 nan 0.000 0.514 3047 L N 1.785 123.002 121.223 -0.009 0.000 2.017 3047 L HA -0.130 4.210 4.340 -0.000 0.000 0.208 3047 L C 1.295 178.148 176.870 -0.028 0.000 1.073 3047 L CA 1.951 56.794 54.840 0.005 0.000 0.745 3047 L CB -0.492 41.550 42.059 -0.028 0.000 0.894 3047 L HN 0.215 nan 8.230 nan 0.000 0.432 3048 D N -0.485 119.877 120.400 -0.063 0.000 2.371 3048 D HA -0.082 4.558 4.640 -0.000 0.000 0.221 3048 D C 1.866 178.144 176.300 -0.036 0.000 0.986 3048 D CA 0.863 54.827 54.000 -0.060 0.000 0.899 3048 D CB 0.109 40.858 40.800 -0.086 0.000 0.902 3048 D HN 0.396 nan 8.370 nan 0.000 0.530 3049 I N 0.088 120.645 120.570 -0.022 0.000 3.081 3049 I HA 0.035 4.205 4.170 -0.000 0.000 0.274 3049 I C 2.132 178.251 176.117 0.003 0.000 1.178 3049 I CA 0.267 61.564 61.300 -0.005 0.000 1.460 3049 I CB 0.215 38.219 38.000 0.006 0.000 1.137 3049 I HN -0.055 nan 8.210 nan 0.000 0.443 3050 A N 0.459 123.284 122.820 0.008 0.000 2.072 3050 A HA 0.029 4.349 4.320 -0.000 0.000 0.216 3050 A C 2.184 179.764 177.584 -0.007 0.000 1.156 3050 A CA 0.667 52.712 52.037 0.013 0.000 0.701 3050 A CB -0.440 18.578 19.000 0.030 0.000 0.816 3050 A HN 0.303 nan 8.150 nan 0.000 0.458 3051 L N -1.322 119.890 121.223 -0.020 0.000 2.017 3051 L HA -0.058 4.282 4.340 -0.000 0.000 0.208 3051 L C 2.245 179.098 176.870 -0.028 0.000 1.073 3051 L CA 1.454 56.273 54.840 -0.035 0.000 0.745 3051 L CB -0.389 41.645 42.059 -0.042 0.000 0.894 3051 L HN 0.589 nan 8.230 nan 0.000 0.432 3052 G N -1.781 107.008 108.800 -0.018 0.000 2.234 3052 G HA2 -0.323 3.637 3.960 -0.000 0.000 0.235 3052 G HA3 -0.323 3.637 3.960 -0.000 0.000 0.235 3052 G C 0.959 175.851 174.900 -0.014 0.000 0.997 3052 G CA 0.550 45.643 45.100 -0.011 0.000 0.623 3052 G HN 0.488 nan 8.290 nan 0.000 0.514 3053 A N -0.540 122.267 122.820 -0.022 0.000 2.063 3053 A HA 0.613 4.933 4.320 -0.000 0.000 0.211 3053 A C 2.517 180.086 177.584 -0.026 0.000 1.177 3053 A CA 2.191 54.214 52.037 -0.022 0.000 0.759 3053 A CB -0.116 18.868 19.000 -0.027 0.000 0.857 3053 A HN 2.413 nan 8.150 nan 0.000 0.468 3054 G N -3.108 105.673 108.800 -0.031 0.000 2.229 3054 G HA2 0.395 4.355 3.960 -0.000 0.000 0.189 3054 G HA3 0.395 4.355 3.960 -0.000 0.000 0.189 3054 G C 0.939 175.808 174.900 -0.053 0.000 1.000 3054 G CA 0.367 45.444 45.100 -0.038 0.000 0.663 3054 G HN 2.151 nan 8.290 nan 0.000 0.493 3055 G N -1.083 107.686 108.800 -0.052 0.000 2.352 3055 G HA2 0.456 4.416 3.960 -0.000 0.000 0.283 3055 G HA3 0.456 4.416 3.960 -0.000 0.000 0.283 3055 G C -0.830 174.038 174.900 -0.053 0.000 1.308 3055 G CA -0.447 44.616 45.100 -0.061 0.000 0.892 3055 G HN 0.928 nan 8.290 nan 0.000 0.504 3056 L N 1.379 122.569 121.223 -0.055 0.000 2.367 3056 L HA 0.348 4.688 4.340 -0.000 0.000 0.275 3056 L C -2.091 174.755 176.870 -0.041 0.000 1.129 3056 L CA -1.495 53.316 54.840 -0.048 0.000 0.839 3056 L CB 0.988 43.020 42.059 -0.046 0.000 1.133 3056 L HN 0.187 nan 8.230 nan 0.000 0.453 3057 P HA 0.044 nan 4.420 nan 0.000 0.265 3057 P C -0.225 177.059 177.300 -0.026 0.000 1.222 3057 P CA 0.012 63.094 63.100 -0.030 0.000 0.767 3057 P CB 0.384 32.068 31.700 -0.028 0.000 0.801 3058 M N 3.137 122.722 119.600 -0.026 0.000 2.268 3058 M HA 0.156 4.636 4.480 -0.000 0.000 0.349 3058 M C 1.336 177.624 176.300 -0.021 0.000 1.485 3058 M CA 0.889 56.175 55.300 -0.024 0.000 1.094 3058 M CB -0.754 31.831 32.600 -0.025 0.000 1.843 3058 M HN 0.780 nan 8.290 nan 0.000 0.460 3059 G N 3.822 112.610 108.800 -0.020 0.000 2.212 3059 G HA2 -0.195 3.765 3.960 -0.000 0.000 0.255 3059 G HA3 -0.195 3.765 3.960 -0.000 0.000 0.255 3059 G C 0.152 175.041 174.900 -0.019 0.000 1.062 3059 G CA -0.198 44.891 45.100 -0.019 0.000 0.815 3059 G HN 0.611 nan 8.290 nan 0.000 0.497 3060 R N -1.215 119.277 120.500 -0.014 0.000 3.236 3060 R HA 0.757 5.097 4.340 -0.000 0.000 0.234 3060 R C 0.141 176.448 176.300 0.012 0.000 1.541 3060 R CA -0.914 55.178 56.100 -0.012 0.000 1.038 3060 R CB 0.704 30.995 30.300 -0.014 0.000 1.587 3060 R HN 0.211 nan 8.270 nan 0.000 0.515 3061 I N 0.859 121.447 120.570 0.029 0.000 2.603 3061 I HA 0.402 4.572 4.170 -0.000 0.000 0.300 3061 I C -0.690 175.469 176.117 0.069 0.000 1.017 3061 I CA -1.031 60.321 61.300 0.088 0.000 1.098 3061 I CB 2.299 40.388 38.000 0.148 0.000 1.279 3061 I HN 0.002 nan 8.210 nan 0.000 0.437 3062 V N 5.229 125.202 119.914 0.098 0.000 2.577 3062 V HA 0.287 4.407 4.120 -0.000 0.000 0.303 3062 V C -0.462 175.688 176.094 0.094 0.000 1.042 3062 V CA -0.553 61.776 62.300 0.048 0.000 0.872 3062 V CB 2.085 33.913 31.823 0.008 0.000 0.998 3062 V HN 0.721 nan 8.190 nan 0.000 0.423 3063 E N 5.274 125.490 120.200 0.027 0.000 2.158 3063 E HA 0.591 4.941 4.350 -0.000 0.000 0.271 3063 E C -1.429 175.129 176.600 -0.070 0.000 0.911 3063 E CA -0.557 55.863 56.400 0.033 0.000 0.767 3063 E CB 1.614 31.312 29.700 -0.003 0.000 1.120 3063 E HN 0.622 nan 8.360 nan 0.000 0.405 3064 I N 6.256 126.822 120.570 -0.007 0.000 2.404 3064 I HA 0.372 4.542 4.170 -0.000 0.000 0.293 3064 I C -0.653 175.505 176.117 0.069 0.000 0.992 3064 I CA -0.747 60.528 61.300 -0.042 0.000 1.149 3064 I CB 1.024 39.030 38.000 0.011 0.000 1.315 3064 I HN 0.573 nan 8.210 nan 0.000 0.446 3065 Y N 3.951 124.271 120.300 0.034 0.000 2.638 3065 Y HA 0.951 5.500 4.550 -0.000 0.000 0.339 3065 Y C -0.189 175.726 175.900 0.025 0.000 1.084 3065 Y CA -1.127 56.992 58.100 0.030 0.000 1.068 3065 Y CB 2.337 40.811 38.460 0.022 0.000 1.294 3065 Y HN 0.661 nan 8.280 nan 0.000 0.480 3066 G N 0.793 109.766 108.800 0.288 0.000 2.337 3066 G HA2 0.253 4.213 3.960 -0.000 0.000 0.310 3066 G HA3 0.253 4.213 3.960 -0.000 0.000 0.310 3066 G C -3.485 171.449 174.900 0.057 0.000 1.534 3066 G CA -1.219 43.963 45.100 0.135 0.000 0.982 3066 G HN 0.499 nan 8.290 nan 0.000 0.672 3067 P HA 0.139 nan 4.420 nan 0.000 0.271 3067 P C 0.315 177.632 177.300 0.030 0.000 1.212 3067 P CA 0.253 63.361 63.100 0.013 0.000 0.788 3067 P CB 0.358 32.063 31.700 0.008 0.000 0.865 3068 E N -0.138 120.078 120.200 0.026 0.000 2.373 3068 E HA 0.168 4.518 4.350 -0.000 0.000 0.267 3068 E C -0.413 176.209 176.600 0.037 0.000 1.032 3068 E CA -0.577 55.844 56.400 0.034 0.000 0.889 3068 E CB -0.143 29.575 29.700 0.030 0.000 0.984 3068 E HN 0.294 nan 8.360 nan 0.000 0.425 3069 S N 1.473 117.199 115.700 0.042 0.000 3.711 3069 S HA -0.185 4.285 4.470 -0.000 0.000 0.374 3069 S C 0.633 175.257 174.600 0.040 0.000 0.969 3069 S CA 0.821 59.047 58.200 0.043 0.000 1.198 3069 S CB -1.871 61.359 63.200 0.050 0.000 0.903 3069 S HN 0.770 nan 8.310 nan 0.000 0.493 3070 S N -0.487 115.236 115.700 0.038 0.000 2.497 3070 S HA 0.503 4.973 4.470 -0.000 0.000 0.221 3070 S C 1.542 176.158 174.600 0.026 0.000 1.037 3070 S CA 0.705 58.926 58.200 0.035 0.000 0.920 3070 S CB 0.843 64.069 63.200 0.043 0.000 0.800 3070 S HN 1.960 nan 8.310 nan 0.000 0.505 3071 G N 1.208 110.026 108.800 0.029 0.000 2.198 3071 G HA2 -0.179 3.781 3.960 -0.000 0.000 0.156 3071 G HA3 -0.179 3.781 3.960 -0.000 0.000 0.156 3071 G C 0.559 175.483 174.900 0.041 0.000 1.012 3071 G CA 0.217 45.330 45.100 0.023 0.000 0.692 3071 G HN 0.376 nan 8.290 nan 0.000 0.492 3072 K N 0.061 120.493 120.400 0.054 0.000 1.986 3072 K HA -0.198 4.122 4.320 -0.000 0.000 0.230 3072 K C 2.614 179.250 176.600 0.060 0.000 1.048 3072 K CA 2.771 59.098 56.287 0.066 0.000 1.008 3072 K CB -0.529 32.017 32.500 0.077 0.000 0.737 3072 K HN 0.264 nan 8.250 nan 0.000 0.447 3073 T N 0.110 114.706 114.554 0.069 0.000 2.565 3073 T HA -0.243 4.107 4.350 -0.000 0.000 0.265 3073 T C 1.845 176.541 174.700 -0.007 0.000 1.082 3073 T CA 2.371 64.518 62.100 0.078 0.000 1.173 3073 T CB -0.685 68.248 68.868 0.108 0.000 0.864 3073 T HN 0.424 nan 8.240 nan 0.000 0.425 3074 T N 2.050 116.576 114.554 -0.046 0.000 2.649 3074 T HA -0.163 4.187 4.350 -0.000 0.000 0.268 3074 T C 1.857 176.507 174.700 -0.084 0.000 1.036 3074 T CA 1.553 63.583 62.100 -0.117 0.000 1.157 3074 T CB -0.611 68.211 68.868 -0.077 0.000 0.861 3074 T HN 0.246 nan 8.240 nan 0.000 0.445 3075 L N 0.644 121.859 121.223 -0.015 0.000 1.989 3075 L HA -0.199 4.141 4.340 -0.000 0.000 0.211 3075 L C 2.893 179.739 176.870 -0.041 0.000 1.071 3075 L CA 2.162 57.003 54.840 0.000 0.000 0.749 3075 L CB -0.898 41.192 42.059 0.053 0.000 0.890 3075 L HN 0.494 nan 8.230 nan 0.000 0.431 3076 T N -1.482 113.061 114.554 -0.020 0.000 2.635 3076 T HA -0.300 4.050 4.350 -0.000 0.000 0.267 3076 T C 1.797 176.442 174.700 -0.091 0.000 1.040 3076 T CA 1.818 63.906 62.100 -0.020 0.000 1.156 3076 T CB -0.945 67.963 68.868 0.067 0.000 0.863 3076 T HN 0.264 nan 8.240 nan 0.000 0.430 3077 L N 0.955 122.083 121.223 -0.158 0.000 2.127 3077 L HA -0.086 4.254 4.340 -0.000 0.000 0.211 3077 L C 3.127 179.872 176.870 -0.209 0.000 1.089 3077 L CA 1.417 56.102 54.840 -0.259 0.000 0.757 3077 L CB -0.655 41.196 42.059 -0.348 0.000 0.899 3077 L HN 0.249 nan 8.230 nan 0.000 0.434 3078 Q N -0.829 118.869 119.800 -0.171 0.000 2.291 3078 Q HA -0.096 4.244 4.340 -0.000 0.000 0.205 3078 Q C 2.272 178.178 176.000 -0.157 0.000 0.970 3078 Q CA 1.233 56.939 55.803 -0.163 0.000 0.876 3078 Q CB 0.022 28.669 28.738 -0.152 0.000 0.935 3078 Q HN 0.460 nan 8.270 nan 0.000 0.455 3079 V N 0.303 120.137 119.914 -0.133 0.000 2.379 3079 V HA -0.174 3.946 4.120 -0.000 0.000 0.243 3079 V C 2.241 178.266 176.094 -0.115 0.000 1.035 3079 V CA 1.001 63.230 62.300 -0.119 0.000 1.035 3079 V CB -0.527 31.243 31.823 -0.089 0.000 0.673 3079 V HN 0.212 nan 8.190 nan 0.000 0.457 3080 I N 1.307 121.805 120.570 -0.120 0.000 2.264 3080 I HA -0.264 3.906 4.170 -0.000 0.000 0.248 3080 I C 2.726 178.769 176.117 -0.124 0.000 1.111 3080 I CA 1.544 62.771 61.300 -0.120 0.000 1.382 3080 I CB -0.704 37.198 38.000 -0.163 0.000 1.060 3080 I HN 0.283 nan 8.210 nan 0.000 0.418 3081 A N 0.972 123.708 122.820 -0.141 0.000 1.865 3081 A HA -0.106 4.214 4.320 -0.000 0.000 0.217 3081 A C 2.279 179.793 177.584 -0.116 0.000 1.191 3081 A CA 1.934 53.893 52.037 -0.130 0.000 0.623 3081 A CB -0.832 18.083 19.000 -0.141 0.000 0.826 3081 A HN 0.434 nan 8.150 nan 0.000 0.444 3082 A N -1.315 121.427 122.820 -0.130 0.000 2.359 3082 A HA 0.606 4.926 4.320 -0.000 0.000 0.240 3082 A C 1.675 179.198 177.584 -0.103 0.000 1.306 3082 A CA 0.990 52.950 52.037 -0.128 0.000 0.898 3082 A CB -0.630 18.267 19.000 -0.172 0.000 0.956 3082 A HN 0.837 nan 8.150 nan 0.000 0.497 3083 A N -1.152 121.614 122.820 -0.090 0.000 1.944 3083 A HA 0.127 4.447 4.320 -0.000 0.000 0.207 3083 A C 1.901 179.447 177.584 -0.063 0.000 1.265 3083 A CA 0.984 52.978 52.037 -0.071 0.000 0.712 3083 A CB -0.315 18.645 19.000 -0.066 0.000 0.915 3083 A HN 0.366 nan 8.150 nan 0.000 0.470 3084 Q N -0.083 119.677 119.800 -0.068 0.000 2.268 3084 Q HA -0.162 4.178 4.340 -0.000 0.000 0.210 3084 Q C 1.961 177.930 176.000 -0.051 0.000 0.988 3084 Q CA 1.689 57.457 55.803 -0.059 0.000 0.883 3084 Q CB -0.315 28.383 28.738 -0.068 0.000 0.911 3084 Q HN 0.506 nan 8.270 nan 0.000 0.430 3085 R N -0.145 120.320 120.500 -0.058 0.000 2.280 3085 R HA 0.040 4.380 4.340 -0.000 0.000 0.207 3085 R C -0.003 176.273 176.300 -0.041 0.000 1.043 3085 R CA 0.782 56.852 56.100 -0.050 0.000 1.006 3085 R CB 0.341 30.602 30.300 -0.064 0.000 0.885 3085 R HN 0.117 nan 8.270 nan 0.000 0.467 3086 E N -1.620 118.555 120.200 -0.042 0.000 3.832 3086 E HA 0.215 4.565 4.350 -0.000 0.000 0.250 3086 E C 0.032 176.613 176.600 -0.031 0.000 1.215 3086 E CA 0.207 56.587 56.400 -0.034 0.000 1.179 3086 E CB 0.777 30.456 29.700 -0.034 0.000 1.270 3086 E HN 0.294 nan 8.360 nan 0.000 0.405 3087 G N 1.815 110.598 108.800 -0.030 0.000 4.236 3087 G HA2 -0.388 3.572 3.960 -0.000 0.000 0.222 3087 G HA3 -0.388 3.572 3.960 -0.000 0.000 0.222 3087 G C 0.199 175.082 174.900 -0.029 0.000 1.354 3087 G CA 0.190 45.274 45.100 -0.026 0.000 0.966 3087 G HN 0.325 nan 8.290 nan 0.000 0.624 3088 K N 3.295 123.677 120.400 -0.031 0.000 2.392 3088 K HA 0.026 4.346 4.320 -0.000 0.000 0.259 3088 K C 0.880 177.461 176.600 -0.032 0.000 1.141 3088 K CA 1.563 57.831 56.287 -0.031 0.000 1.208 3088 K CB -0.772 31.707 32.500 -0.036 0.000 0.786 3088 K HN 0.870 nan 8.250 nan 0.000 0.498 3089 T N -0.088 114.449 114.554 -0.027 0.000 2.922 3089 T HA 0.422 4.771 4.350 -0.000 0.000 0.285 3089 T C 0.299 174.984 174.700 -0.025 0.000 1.005 3089 T CA -0.921 61.163 62.100 -0.026 0.000 1.061 3089 T CB 1.231 70.087 68.868 -0.021 0.000 1.007 3089 T HN 0.561 nan 8.240 nan 0.000 0.502 3090 C N 1.611 120.897 119.300 -0.023 0.000 2.547 3090 C HA 0.898 5.358 4.460 -0.000 0.000 0.313 3090 C C 0.261 175.255 174.990 0.005 0.000 1.191 3090 C CA -0.544 58.465 59.018 -0.015 0.000 1.474 3090 C CB 0.728 28.451 27.740 -0.028 0.000 2.081 3090 C HN 1.227 nan 8.230 nan 0.000 0.476 3091 A N 2.233 125.065 122.820 0.020 0.000 2.401 3091 A HA 0.903 5.223 4.320 -0.000 0.000 0.310 3091 A C -1.361 176.285 177.584 0.105 0.000 1.075 3091 A CA -0.300 51.765 52.037 0.046 0.000 0.746 3091 A CB 1.092 20.096 19.000 0.007 0.000 1.277 3091 A HN 0.880 nan 8.150 nan 0.000 0.425 3092 F N 3.864 123.768 119.950 -0.077 0.000 2.771 3092 F HA 0.462 4.989 4.527 -0.000 0.000 0.365 3092 F C -0.831 174.916 175.800 -0.088 0.000 1.169 3092 F CA -1.157 56.791 58.000 -0.086 0.000 1.093 3092 F CB 0.907 39.862 39.000 -0.076 0.000 1.363 3092 F HN 0.398 nan 8.300 nan 0.000 0.496 3093 I N 4.317 124.642 120.570 -0.409 0.000 2.389 3093 I HA 0.061 4.231 4.170 -0.000 0.000 0.295 3093 I C 0.235 176.015 176.117 -0.563 0.000 1.117 3093 I CA 0.236 61.314 61.300 -0.370 0.000 1.317 3093 I CB 0.151 37.983 38.000 -0.280 0.000 1.431 3093 I HN 0.543 nan 8.210 nan 0.000 0.521 3094 D N 5.354 125.471 120.400 -0.472 0.000 3.110 3094 D HA 0.377 5.017 4.640 -0.000 0.000 0.254 3094 D C 1.419 177.494 176.300 -0.376 0.000 1.283 3094 D CA -0.104 53.605 54.000 -0.485 0.000 0.944 3094 D CB 0.707 41.342 40.800 -0.276 0.000 1.066 3094 D HN 0.595 nan 8.370 nan 0.000 0.496 3095 A N 1.209 123.841 122.820 -0.314 0.000 1.958 3095 A HA -0.233 4.087 4.320 -0.000 0.000 0.221 3095 A C 1.979 179.442 177.584 -0.201 0.000 1.178 3095 A CA 1.249 53.141 52.037 -0.242 0.000 0.642 3095 A CB -0.295 18.628 19.000 -0.128 0.000 0.816 3095 A HN 0.473 nan 8.150 nan 0.000 0.453 3096 E N -1.633 118.489 120.200 -0.130 0.000 2.338 3096 E HA -0.135 4.215 4.350 -0.000 0.000 0.197 3096 E C -0.219 176.441 176.600 0.100 0.000 1.007 3096 E CA 0.856 57.257 56.400 0.001 0.000 0.849 3096 E CB -0.242 29.462 29.700 0.006 0.000 0.774 3096 E HN 0.831 nan 8.360 nan 0.000 0.506 3097 H N -1.919 117.149 119.070 -0.004 0.000 2.862 3097 H HA -0.199 4.357 4.556 -0.000 0.000 0.290 3097 H C 0.489 175.842 175.328 0.043 0.000 1.211 3097 H CA 0.265 56.324 56.048 0.019 0.000 1.140 3097 H CB -1.640 28.131 29.762 0.015 0.000 1.341 3097 H HN 0.294 nan 8.280 nan 0.000 0.392 3098 A N 0.639 123.530 122.820 0.118 0.000 3.293 3098 A HA 0.644 4.964 4.320 -0.000 0.000 0.163 3098 A C 0.801 178.476 177.584 0.153 0.000 2.052 3098 A CA -0.106 52.008 52.037 0.129 0.000 1.062 3098 A CB -0.161 18.913 19.000 0.123 0.000 1.908 3098 A HN 1.186 nan 8.150 nan 0.000 0.790 3099 L N -1.619 119.712 121.223 0.181 0.000 3.089 3099 L HA -0.149 4.191 4.340 -0.000 0.000 0.511 3099 L C -1.153 175.795 176.870 0.129 0.000 1.002 3099 L CA 0.817 55.757 54.840 0.166 0.000 1.246 3099 L CB -1.330 40.868 42.059 0.233 0.000 1.087 3099 L HN 0.631 nan 8.230 nan 0.000 0.591 3100 D N 7.484 127.970 120.400 0.144 0.000 2.456 3100 D HA 0.407 5.047 4.640 -0.000 0.000 0.219 3100 D C -1.281 175.081 176.300 0.103 0.000 1.126 3100 D CA -1.826 52.257 54.000 0.137 0.000 0.890 3100 D CB 1.053 41.960 40.800 0.179 0.000 1.025 3100 D HN 0.498 nan 8.370 nan 0.000 0.511 3101 P HA -0.248 nan 4.420 nan 0.000 0.217 3101 P C 1.799 179.117 177.300 0.031 0.000 1.158 3101 P CA 0.893 64.006 63.100 0.021 0.000 0.887 3101 P CB 0.309 32.023 31.700 0.024 0.000 0.792 3102 I N -0.689 119.917 120.570 0.060 0.000 2.065 3102 I HA -0.312 3.858 4.170 -0.000 0.000 0.236 3102 I C 2.680 178.870 176.117 0.122 0.000 1.028 3102 I CA 1.774 63.118 61.300 0.073 0.000 1.299 3102 I CB -2.074 35.969 38.000 0.071 0.000 1.015 3102 I HN 0.010 nan 8.210 nan 0.000 0.396 3103 Y N 1.587 121.881 120.300 -0.010 0.000 2.096 3103 Y HA -0.368 4.182 4.550 -0.000 0.000 0.278 3103 Y C 2.707 178.584 175.900 -0.039 0.000 1.192 3103 Y CA 1.898 59.988 58.100 -0.017 0.000 1.143 3103 Y CB -0.049 38.402 38.460 -0.015 0.000 0.963 3103 Y HN 0.228 nan 8.280 nan 0.000 0.505 3104 A N 0.558 123.334 122.820 -0.073 0.000 1.892 3104 A HA -0.296 4.024 4.320 -0.000 0.000 0.218 3104 A C 2.251 179.751 177.584 -0.140 0.000 1.188 3104 A CA 2.044 53.953 52.037 -0.212 0.000 0.631 3104 A CB -0.955 17.930 19.000 -0.192 0.000 0.822 3104 A HN 0.587 nan 8.150 nan 0.000 0.447 3105 R N -0.193 120.272 120.500 -0.058 0.000 2.083 3105 R HA -0.160 4.180 4.340 -0.000 0.000 0.237 3105 R C 2.112 178.397 176.300 -0.026 0.000 1.137 3105 R CA 1.927 58.005 56.100 -0.038 0.000 0.951 3105 R CB -0.269 30.027 30.300 -0.007 0.000 0.851 3105 R HN 0.543 nan 8.270 nan 0.000 0.434 3106 K N 0.114 120.525 120.400 0.018 0.000 2.281 3106 K HA -0.152 4.168 4.320 -0.000 0.000 0.203 3106 K C 1.948 178.556 176.600 0.014 0.000 1.046 3106 K CA 1.010 57.329 56.287 0.054 0.000 0.938 3106 K CB -0.039 32.550 32.500 0.149 0.000 0.737 3106 K HN 0.235 nan 8.250 nan 0.000 0.458 3107 L N -0.990 120.189 121.223 -0.074 0.000 2.270 3107 L HA 0.025 4.365 4.340 -0.000 0.000 0.210 3107 L C 1.102 177.911 176.870 -0.101 0.000 1.104 3107 L CA 0.728 55.494 54.840 -0.123 0.000 0.804 3107 L CB 0.408 42.308 42.059 -0.264 0.000 0.937 3107 L HN 0.429 nan 8.230 nan 0.000 0.450 3108 G N -0.647 108.097 108.800 -0.092 0.000 2.157 3108 G HA2 -0.132 3.828 3.960 -0.000 0.000 0.114 3108 G HA3 -0.132 3.828 3.960 -0.000 0.000 0.114 3108 G C -0.204 174.642 174.900 -0.089 0.000 1.041 3108 G CA -0.291 44.765 45.100 -0.073 0.000 0.714 3108 G HN -0.017 nan 8.290 nan 0.000 0.492 3109 V N 0.330 120.179 119.914 -0.109 0.000 2.863 3109 V HA 0.524 4.644 4.120 -0.000 0.000 0.307 3109 V C 0.350 176.394 176.094 -0.083 0.000 1.061 3109 V CA -0.817 61.414 62.300 -0.115 0.000 1.024 3109 V CB 1.834 33.560 31.823 -0.162 0.000 1.049 3109 V HN 0.259 nan 8.190 nan 0.000 0.471 3110 D N 2.063 122.419 120.400 -0.074 0.000 2.374 3110 D HA 0.159 4.799 4.640 -0.000 0.000 0.240 3110 D C 0.927 177.194 176.300 -0.055 0.000 1.229 3110 D CA -0.280 53.688 54.000 -0.053 0.000 0.895 3110 D CB 0.961 41.735 40.800 -0.043 0.000 1.046 3110 D HN 0.283 nan 8.370 nan 0.000 0.498 3111 I N 3.020 123.561 120.570 -0.049 0.000 2.361 3111 I HA -0.230 3.940 4.170 -0.000 0.000 0.251 3111 I C 1.315 177.414 176.117 -0.030 0.000 1.133 3111 I CA 1.191 62.464 61.300 -0.045 0.000 1.413 3111 I CB -0.690 37.291 38.000 -0.032 0.000 1.073 3111 I HN 0.345 nan 8.210 nan 0.000 0.424 3112 D N -0.339 120.047 120.400 -0.023 0.000 2.333 3112 D HA -0.023 4.617 4.640 -0.000 0.000 0.208 3112 D C 1.298 177.589 176.300 -0.015 0.000 0.984 3112 D CA 0.467 54.459 54.000 -0.015 0.000 0.873 3112 D CB -0.145 40.649 40.800 -0.011 0.000 0.935 3112 D HN 0.305 nan 8.370 nan 0.000 0.521 3113 N N 0.634 119.321 118.700 -0.022 0.000 2.328 3113 N HA 0.088 4.828 4.740 -0.000 0.000 0.247 3113 N C -0.461 175.034 175.510 -0.025 0.000 1.165 3113 N CA 0.028 53.065 53.050 -0.022 0.000 0.873 3113 N CB 1.059 39.532 38.487 -0.024 0.000 1.125 3113 N HN 0.122 nan 8.380 nan 0.000 0.513 3114 L N 2.087 123.295 121.223 -0.025 0.000 2.581 3114 L HA 0.426 4.766 4.340 -0.000 0.000 0.241 3114 L C -0.984 175.888 176.870 0.004 0.000 1.265 3114 L CA -0.288 54.538 54.840 -0.023 0.000 0.954 3114 L CB 0.014 42.039 42.059 -0.057 0.000 1.269 3114 L HN -0.006 nan 8.230 nan 0.000 0.475 3115 L N 3.501 124.728 121.223 0.006 0.000 2.361 3115 L HA 0.289 4.629 4.340 -0.000 0.000 0.278 3115 L C 0.304 177.189 176.870 0.026 0.000 1.113 3115 L CA -0.116 54.732 54.840 0.012 0.000 0.849 3115 L CB 0.544 42.605 42.059 0.003 0.000 1.155 3115 L HN 0.616 nan 8.230 nan 0.000 0.452 3116 C N 0.585 119.907 119.300 0.036 0.000 3.080 3116 C HA 0.921 5.381 4.460 -0.000 0.000 0.307 3116 C C 0.016 175.016 174.990 0.018 0.000 1.311 3116 C CA -0.938 58.110 59.018 0.051 0.000 1.533 3116 C CB 1.431 29.254 27.740 0.138 0.000 1.970 3116 C HN 0.775 nan 8.230 nan 0.000 0.467 3117 S N 0.446 116.136 115.700 -0.017 0.000 2.566 3117 S HA 0.681 5.151 4.470 -0.000 0.000 0.298 3117 S C -1.043 173.503 174.600 -0.090 0.000 1.083 3117 S CA -0.470 57.702 58.200 -0.047 0.000 0.978 3117 S CB 1.433 64.595 63.200 -0.063 0.000 1.073 3117 S HN 0.851 nan 8.310 nan 0.000 0.491 3118 Q N 1.134 120.885 119.800 -0.082 0.000 2.851 3118 Q HA 0.312 4.652 4.340 -0.000 0.000 0.331 3118 Q C -2.570 173.357 176.000 -0.121 0.000 0.979 3118 Q CA -1.553 54.154 55.803 -0.160 0.000 0.955 3118 Q CB 0.641 29.337 28.738 -0.069 0.000 1.298 3118 Q HN 0.512 nan 8.270 nan 0.000 0.432 3119 P HA -0.022 nan 4.420 nan 0.000 0.269 3119 P C 0.246 177.552 177.300 0.010 0.000 1.217 3119 P CA 0.010 63.079 63.100 -0.052 0.000 0.783 3119 P CB 1.029 32.689 31.700 -0.067 0.000 0.898 3120 D N -0.985 119.438 120.400 0.039 0.000 2.290 3120 D HA -0.012 4.628 4.640 -0.000 0.000 0.224 3120 D C 0.711 177.042 176.300 0.052 0.000 0.967 3120 D CA 1.370 55.412 54.000 0.069 0.000 0.893 3120 D CB -0.132 40.697 40.800 0.049 0.000 1.037 3120 D HN 0.493 nan 8.370 nan 0.000 0.477 3121 T N -2.723 111.848 114.554 0.029 0.000 2.918 3121 T HA 0.525 4.874 4.350 -0.000 0.000 0.286 3121 T C 1.425 176.135 174.700 0.016 0.000 1.026 3121 T CA -0.358 61.756 62.100 0.024 0.000 1.031 3121 T CB 1.980 70.860 68.868 0.019 0.000 1.046 3121 T HN -0.018 nan 8.240 nan 0.000 0.479 3122 G N 0.537 109.349 108.800 0.020 0.000 2.513 3122 G HA2 -0.210 3.750 3.960 -0.000 0.000 0.219 3122 G HA3 -0.210 3.750 3.960 -0.000 0.000 0.219 3122 G C 1.227 176.141 174.900 0.023 0.000 1.160 3122 G CA 0.801 45.914 45.100 0.022 0.000 0.767 3122 G HN 0.858 nan 8.290 nan 0.000 0.571 3123 E N -0.203 120.010 120.200 0.022 0.000 2.031 3123 E HA -0.194 4.156 4.350 -0.000 0.000 0.193 3123 E C 2.481 179.090 176.600 0.016 0.000 0.994 3123 E CA 1.122 57.535 56.400 0.022 0.000 0.800 3123 E CB -0.267 29.445 29.700 0.019 0.000 0.752 3123 E HN 0.596 nan 8.360 nan 0.000 0.447 3124 Q N 0.412 120.218 119.800 0.010 0.000 2.047 3124 Q HA -0.289 4.051 4.340 -0.000 0.000 0.211 3124 Q C 2.145 178.142 176.000 -0.005 0.000 1.005 3124 Q CA 2.148 57.952 55.803 0.003 0.000 0.866 3124 Q CB -0.236 28.503 28.738 0.002 0.000 0.938 3124 Q HN 0.255 nan 8.270 nan 0.000 0.414 3125 A N 0.646 123.458 122.820 -0.012 0.000 1.873 3125 A HA -0.241 4.079 4.320 -0.000 0.000 0.218 3125 A C 2.103 179.680 177.584 -0.012 0.000 1.193 3125 A CA 1.756 53.776 52.037 -0.029 0.000 0.629 3125 A CB -1.031 17.945 19.000 -0.039 0.000 0.826 3125 A HN 0.494 nan 8.150 nan 0.000 0.447 3126 L N -1.279 119.955 121.223 0.019 0.000 1.956 3126 L HA -0.235 4.105 4.340 -0.000 0.000 0.216 3126 L C 2.640 179.527 176.870 0.029 0.000 1.073 3126 L CA 2.041 56.908 54.840 0.045 0.000 0.762 3126 L CB -0.487 41.611 42.059 0.065 0.000 0.889 3126 L HN 0.369 nan 8.230 nan 0.000 0.433 3127 E N -0.333 119.880 120.200 0.022 0.000 2.401 3127 E HA -0.139 4.211 4.350 -0.000 0.000 0.199 3127 E C 1.934 178.537 176.600 0.005 0.000 1.023 3127 E CA 0.574 56.984 56.400 0.016 0.000 0.859 3127 E CB -0.021 29.688 29.700 0.015 0.000 0.780 3127 E HN 0.432 nan 8.360 nan 0.000 0.523 3128 I N -0.200 120.367 120.570 -0.005 0.000 2.193 3128 I HA -0.275 3.895 4.170 -0.000 0.000 0.240 3128 I C 2.260 178.365 176.117 -0.021 0.000 1.084 3128 I CA 0.997 62.287 61.300 -0.016 0.000 1.365 3128 I CB -0.235 37.749 38.000 -0.028 0.000 1.064 3128 I HN 0.346 nan 8.210 nan 0.000 0.410 3129 C N -0.631 118.651 119.300 -0.029 0.000 2.448 3129 C HA -0.089 4.370 4.460 -0.000 0.000 0.280 3129 C C 2.438 177.420 174.990 -0.014 0.000 1.398 3129 C CA 0.116 59.111 59.018 -0.039 0.000 1.774 3129 C CB -0.933 26.760 27.740 -0.079 0.000 1.888 3129 C HN 0.495 nan 8.230 nan 0.000 0.519 3130 D N 2.183 122.587 120.400 0.005 0.000 2.106 3130 D HA -0.120 4.520 4.640 -0.000 0.000 0.191 3130 D C 2.302 178.605 176.300 0.005 0.000 0.997 3130 D CA 2.409 56.418 54.000 0.015 0.000 0.834 3130 D CB -0.394 40.420 40.800 0.024 0.000 0.956 3130 D HN 0.538 nan 8.370 nan 0.000 0.448 3131 A N -0.238 122.583 122.820 0.000 0.000 2.216 3131 A HA 0.012 4.332 4.320 -0.000 0.000 0.214 3131 A C 2.249 179.828 177.584 -0.007 0.000 1.160 3131 A CA 0.548 52.584 52.037 -0.002 0.000 0.725 3131 A CB -0.392 18.606 19.000 -0.002 0.000 0.784 3131 A HN 0.392 nan 8.150 nan 0.000 0.472 3132 L N -2.027 119.189 121.223 -0.012 0.000 2.513 3132 L HA 0.124 4.464 4.340 -0.000 0.000 0.222 3132 L C 2.679 179.540 176.870 -0.016 0.000 1.096 3132 L CA 0.699 55.529 54.840 -0.017 0.000 0.857 3132 L CB -0.344 41.700 42.059 -0.024 0.000 1.026 3132 L HN 0.369 nan 8.230 nan 0.000 0.469 3133 A N 0.787 123.599 122.820 -0.013 0.000 1.929 3133 A HA -0.105 4.215 4.320 -0.000 0.000 0.216 3133 A C 2.348 179.927 177.584 -0.008 0.000 1.176 3133 A CA 0.964 52.995 52.037 -0.010 0.000 0.628 3133 A CB -0.221 18.778 19.000 -0.002 0.000 0.816 3133 A HN 0.301 nan 8.150 nan 0.000 0.444 3134 R N -0.262 120.235 120.500 -0.005 0.000 2.153 3134 R HA 0.080 4.420 4.340 -0.000 0.000 0.218 3134 R C 0.812 177.108 176.300 -0.006 0.000 1.072 3134 R CA 0.738 56.836 56.100 -0.005 0.000 0.990 3134 R CB -0.233 30.066 30.300 -0.002 0.000 0.889 3134 R HN 0.279 nan 8.270 nan 0.000 0.452 3135 S N 1.358 117.054 115.700 -0.008 0.000 3.613 3135 S HA 0.118 4.588 4.470 -0.000 0.000 0.220 3135 S C 0.891 175.485 174.600 -0.010 0.000 1.261 3135 S CA 0.341 58.536 58.200 -0.008 0.000 1.143 3135 S CB -0.672 62.523 63.200 -0.009 0.000 1.315 3135 S HN 0.635 nan 8.310 nan 0.000 0.450 3136 G N 2.121 110.916 108.800 -0.009 0.000 2.672 3136 G HA2 -0.331 3.629 3.960 -0.000 0.000 0.324 3136 G HA3 -0.331 3.629 3.960 -0.000 0.000 0.324 3136 G C 0.371 175.264 174.900 -0.012 0.000 1.286 3136 G CA -0.009 45.086 45.100 -0.010 0.000 1.004 3136 G HN 1.144 nan 8.290 nan 0.000 0.548 3137 A N -0.309 122.503 122.820 -0.012 0.000 3.078 3137 A HA 0.599 4.919 4.320 -0.000 0.000 0.279 3137 A C 0.105 177.680 177.584 -0.015 0.000 1.594 3137 A CA 0.301 52.329 52.037 -0.014 0.000 1.301 3137 A CB 0.012 19.003 19.000 -0.014 0.000 1.162 3137 A HN 1.406 nan 8.150 nan 0.000 0.585 3138 V N 1.963 121.867 119.914 -0.016 0.000 2.318 3138 V HA 0.146 4.265 4.120 -0.000 0.000 0.271 3138 V C 0.314 176.395 176.094 -0.022 0.000 1.030 3138 V CA -0.280 62.010 62.300 -0.018 0.000 0.844 3138 V CB 1.039 32.852 31.823 -0.017 0.000 1.015 3138 V HN 0.720 nan 8.190 nan 0.000 0.460 3139 D N 2.571 122.957 120.400 -0.023 0.000 2.333 3139 D HA 0.111 4.751 4.640 -0.000 0.000 0.208 3139 D C 0.196 176.478 176.300 -0.030 0.000 0.984 3139 D CA 0.991 54.975 54.000 -0.026 0.000 0.873 3139 D CB 1.429 42.213 40.800 -0.027 0.000 0.935 3139 D HN 0.364 nan 8.370 nan 0.000 0.521 3140 V N 0.675 120.570 119.914 -0.031 0.000 3.023 3140 V HA 0.332 4.452 4.120 -0.000 0.000 0.294 3140 V C -1.793 174.281 176.094 -0.034 0.000 1.324 3140 V CA -0.721 61.558 62.300 -0.035 0.000 0.979 3140 V CB 2.356 34.157 31.823 -0.037 0.000 1.093 3140 V HN -0.178 nan 8.190 nan 0.000 0.434 3141 I N 5.860 126.399 120.570 -0.051 0.000 2.466 3141 I HA 0.601 4.771 4.170 -0.000 0.000 0.289 3141 I C -0.768 175.289 176.117 -0.099 0.000 1.026 3141 I CA -0.963 60.296 61.300 -0.069 0.000 1.078 3141 I CB 2.151 40.087 38.000 -0.107 0.000 1.249 3141 I HN 0.315 nan 8.210 nan 0.000 0.429 3142 V N 6.572 126.457 119.914 -0.048 0.000 2.417 3142 V HA 0.364 4.484 4.120 -0.000 0.000 0.291 3142 V C -0.197 175.753 176.094 -0.241 0.000 1.024 3142 V CA -0.728 61.536 62.300 -0.060 0.000 0.861 3142 V CB 2.028 33.971 31.823 0.199 0.000 0.985 3142 V HN 0.479 nan 8.190 nan 0.000 0.436 3143 V N 1.223 120.933 119.914 -0.340 0.000 2.311 3143 V HA 0.610 4.730 4.120 -0.000 0.000 0.275 3143 V C -0.641 175.297 176.094 -0.260 0.000 1.022 3143 V CA -0.474 61.596 62.300 -0.383 0.000 0.830 3143 V CB 1.282 32.790 31.823 -0.524 0.000 1.012 3143 V HN 0.805 nan 8.190 nan 0.000 0.452 3144 D N 3.400 123.588 120.400 -0.354 0.000 2.461 3144 D HA 0.622 5.262 4.640 -0.000 0.000 0.240 3144 D C -0.566 175.618 176.300 -0.193 0.000 1.094 3144 D CA 0.347 54.201 54.000 -0.243 0.000 0.868 3144 D CB 1.717 42.317 40.800 -0.333 0.000 1.062 3144 D HN 0.745 nan 8.370 nan 0.000 0.530 3145 S N 2.205 117.858 115.700 -0.079 0.000 2.579 3145 S HA 0.252 4.722 4.470 -0.000 0.000 0.272 3145 S C 1.081 175.707 174.600 0.043 0.000 1.141 3145 S CA -0.710 57.486 58.200 -0.007 0.000 0.843 3145 S CB 1.347 64.560 63.200 0.022 0.000 1.122 3145 S HN 0.086 nan 8.310 nan 0.000 0.468 3146 V N 3.136 123.117 119.914 0.111 0.000 2.495 3146 V HA -0.306 3.814 4.120 -0.000 0.000 0.260 3146 V C 2.724 178.856 176.094 0.063 0.000 1.097 3146 V CA 2.693 65.064 62.300 0.118 0.000 1.105 3146 V CB -1.797 30.098 31.823 0.120 0.000 0.678 3146 V HN 0.911 nan 8.190 nan 0.000 0.469 3147 A N 0.491 123.341 122.820 0.050 0.000 1.859 3147 A HA -0.276 4.044 4.320 -0.000 0.000 0.218 3147 A C 2.232 179.835 177.584 0.031 0.000 1.242 3147 A CA 2.618 54.676 52.037 0.035 0.000 0.661 3147 A CB -1.164 17.856 19.000 0.034 0.000 0.842 3147 A HN 0.863 nan 8.150 nan 0.000 0.455 3148 A N -1.824 121.013 122.820 0.030 0.000 2.247 3148 A HA 0.345 4.665 4.320 -0.000 0.000 0.205 3148 A C 0.797 178.399 177.584 0.030 0.000 1.261 3148 A CA 0.588 52.644 52.037 0.033 0.000 0.853 3148 A CB -0.490 18.536 19.000 0.044 0.000 0.793 3148 A HN 0.352 nan 8.150 nan 0.000 0.487 3149 L N 0.805 122.047 121.223 0.031 0.000 2.984 3149 L HA 0.152 4.492 4.340 -0.000 0.000 0.246 3149 L C 0.978 177.863 176.870 0.024 0.000 1.268 3149 L CA 0.389 55.248 54.840 0.032 0.000 1.054 3149 L CB -0.116 41.971 42.059 0.047 0.000 1.393 3149 L HN 0.342 nan 8.230 nan 0.000 0.532 3150 T N -2.123 112.442 114.554 0.020 0.000 2.729 3150 T HA 0.550 4.900 4.350 -0.000 0.000 0.296 3150 T C -1.591 173.118 174.700 0.015 0.000 0.928 3150 T CA -1.424 60.684 62.100 0.014 0.000 1.045 3150 T CB 0.330 69.203 68.868 0.009 0.000 0.902 3150 T HN -0.000 nan 8.240 nan 0.000 0.500 3167 A N 0.176 122.993 122.820 -0.004 0.000 2.247 3167 A HA 0.627 4.947 4.320 -0.000 0.000 0.205 3167 A C 1.654 179.233 177.584 -0.008 0.000 1.261 3167 A CA 1.413 53.449 52.037 -0.002 0.000 0.853 3167 A CB -0.225 18.775 19.000 -0.001 0.000 0.793 3167 A HN 1.083 nan 8.150 nan 0.000 0.487 3168 A N -1.468 121.344 122.820 -0.013 0.000 2.533 3168 A HA 0.247 4.567 4.320 -0.000 0.000 0.180 3168 A C 1.747 179.319 177.584 -0.020 0.000 1.566 3168 A CA 0.140 52.164 52.037 -0.022 0.000 1.153 3168 A CB 0.158 19.142 19.000 -0.026 0.000 1.462 3168 A HN 0.354 nan 8.150 nan 0.000 0.523 3169 R N -0.442 120.050 120.500 -0.013 0.000 2.119 3169 R HA 0.088 4.428 4.340 -0.000 0.000 0.222 3169 R C 2.140 178.439 176.300 -0.002 0.000 1.088 3169 R CA 1.385 57.479 56.100 -0.010 0.000 0.984 3169 R CB -0.278 30.017 30.300 -0.008 0.000 0.884 3169 R HN 0.625 nan 8.270 nan 0.000 0.447 3170 M N 0.178 119.780 119.600 0.002 0.000 2.117 3170 M HA -0.167 4.313 4.480 -0.000 0.000 0.262 3170 M C 1.837 178.147 176.300 0.016 0.000 1.065 3170 M CA 1.523 56.829 55.300 0.011 0.000 1.114 3170 M CB 0.143 32.751 32.600 0.013 0.000 1.361 3170 M HN 0.099 nan 8.290 nan 0.000 0.408 3171 M N -0.675 118.927 119.600 0.004 0.000 2.062 3171 M HA -0.143 4.337 4.480 -0.000 0.000 0.259 3171 M C 2.435 178.739 176.300 0.007 0.000 1.076 3171 M CA 1.773 57.072 55.300 -0.002 0.000 1.122 3171 M CB -1.551 31.023 32.600 -0.043 0.000 1.312 3171 M HN 0.393 nan 8.290 nan 0.000 0.412 3172 S N -0.031 115.661 115.700 -0.013 0.000 2.461 3172 S HA -0.241 4.229 4.470 -0.000 0.000 0.246 3172 S C 1.723 176.339 174.600 0.026 0.000 1.007 3172 S CA 1.657 59.847 58.200 -0.016 0.000 0.976 3172 S CB -0.102 63.072 63.200 -0.044 0.000 0.763 3172 S HN 0.418 nan 8.310 nan 0.000 0.508 3173 Q N 1.012 120.830 119.800 0.030 0.000 1.858 3173 Q HA 0.213 4.553 4.340 -0.000 0.000 0.224 3173 Q C 2.325 178.365 176.000 0.067 0.000 0.980 3173 Q CA 1.844 57.672 55.803 0.042 0.000 0.868 3173 Q CB -0.734 28.023 28.738 0.032 0.000 0.920 3173 Q HN 0.552 nan 8.270 nan 0.000 0.427 3174 A N -0.438 122.423 122.820 0.069 0.000 2.209 3174 A HA -0.089 4.231 4.320 -0.000 0.000 0.212 3174 A C 1.853 179.507 177.584 0.117 0.000 1.158 3174 A CA 1.077 53.164 52.037 0.084 0.000 0.742 3174 A CB -0.511 18.538 19.000 0.082 0.000 0.790 3174 A HN 0.518 nan 8.150 nan 0.000 0.472 3175 M N -0.581 119.100 119.600 0.134 0.000 2.229 3175 M HA -0.029 4.451 4.480 -0.000 0.000 0.264 3175 M C 2.024 178.511 176.300 0.311 0.000 1.063 3175 M CA 1.316 56.745 55.300 0.215 0.000 1.114 3175 M CB -0.351 32.363 32.600 0.189 0.000 1.387 3175 M HN 0.356 nan 8.290 nan 0.000 0.420 3176 R N -0.284 120.386 120.500 0.284 0.000 2.115 3176 R HA -0.101 4.239 4.340 -0.000 0.000 0.230 3176 R C 2.073 178.425 176.300 0.087 0.000 1.111 3176 R CA 1.324 57.580 56.100 0.260 0.000 0.976 3176 R CB -0.173 30.245 30.300 0.197 0.000 0.870 3176 R HN 0.396 nan 8.270 nan 0.000 0.445 3177 K N -0.116 120.331 120.400 0.079 0.000 2.098 3177 K HA 0.035 4.355 4.320 -0.000 0.000 0.203 3177 K C 2.059 178.676 176.600 0.028 0.000 1.051 3177 K CA 0.577 56.891 56.287 0.045 0.000 0.957 3177 K CB 0.081 32.611 32.500 0.049 0.000 0.738 3177 K HN 0.060 nan 8.250 nan 0.000 0.447 3178 L N 0.345 121.597 121.223 0.047 0.000 2.376 3178 L HA -0.035 4.305 4.340 -0.000 0.000 0.219 3178 L C 2.167 179.034 176.870 -0.004 0.000 1.133 3178 L CA 0.602 55.467 54.840 0.042 0.000 0.816 3178 L CB -0.191 41.929 42.059 0.102 0.000 0.933 3178 L HN 0.184 nan 8.230 nan 0.000 0.449 3179 A N -0.065 122.717 122.820 -0.063 0.000 1.930 3179 A HA -0.067 4.253 4.320 -0.000 0.000 0.217 3179 A C 2.214 179.725 177.584 -0.121 0.000 1.175 3179 A CA 1.719 53.647 52.037 -0.182 0.000 0.627 3179 A CB -0.730 18.013 19.000 -0.428 0.000 0.815 3179 A HN 0.412 nan 8.150 nan 0.000 0.443 3180 G N -1.621 107.136 108.800 -0.072 0.000 3.159 3180 G HA2 0.090 4.050 3.960 -0.000 0.000 0.232 3180 G HA3 0.090 4.050 3.960 -0.000 0.000 0.232 3180 G C 0.916 175.801 174.900 -0.026 0.000 1.116 3180 G CA 0.398 45.470 45.100 -0.047 0.000 0.767 3180 G HN 0.599 nan 8.290 nan 0.000 0.547 3181 N N -0.295 118.394 118.700 -0.019 0.000 2.373 3181 N HA 0.230 4.970 4.740 -0.000 0.000 0.181 3181 N C 1.741 177.243 175.510 -0.013 0.000 1.082 3181 N CA -0.055 52.989 53.050 -0.010 0.000 0.885 3181 N CB 0.271 38.758 38.487 -0.001 0.000 0.977 3181 N HN 0.193 nan 8.380 nan 0.000 0.462 3182 L N 0.263 121.475 121.223 -0.018 0.000 2.269 3182 L HA 0.101 4.441 4.340 -0.000 0.000 0.200 3182 L C 1.821 178.678 176.870 -0.021 0.000 1.069 3182 L CA 0.623 55.452 54.840 -0.018 0.000 0.804 3182 L CB -0.139 41.911 42.059 -0.015 0.000 0.987 3182 L HN -0.057 nan 8.230 nan 0.000 0.468 3183 K N 0.057 120.440 120.400 -0.028 0.000 2.442 3183 K HA -0.250 4.070 4.320 -0.000 0.000 0.199 3183 K C 1.965 178.554 176.600 -0.019 0.000 1.044 3183 K CA 1.072 57.344 56.287 -0.025 0.000 0.941 3183 K CB 0.080 32.562 32.500 -0.031 0.000 0.759 3183 K HN 0.181 nan 8.250 nan 0.000 0.472 3184 Q N -0.700 119.089 119.800 -0.017 0.000 2.107 3184 Q HA 0.058 4.398 4.340 -0.000 0.000 0.195 3184 Q C 1.246 177.238 176.000 -0.013 0.000 0.964 3184 Q CA 1.469 57.264 55.803 -0.014 0.000 0.833 3184 Q CB 0.342 29.073 28.738 -0.012 0.000 0.910 3184 Q HN 0.028 nan 8.270 nan 0.000 0.465 3185 S N 0.397 116.089 115.700 -0.014 0.000 2.556 3185 S HA 0.153 4.623 4.470 -0.000 0.000 0.216 3185 S C 0.262 174.852 174.600 -0.015 0.000 0.970 3185 S CA 0.396 58.588 58.200 -0.014 0.000 0.912 3185 S CB 0.030 63.222 63.200 -0.013 0.000 0.790 3185 S HN 0.515 nan 8.310 nan 0.000 0.504 3186 N N 0.830 119.520 118.700 -0.016 0.000 2.909 3186 N HA -0.157 4.583 4.740 -0.000 0.000 0.230 3186 N C -0.377 175.121 175.510 -0.020 0.000 0.869 3186 N CA 1.584 54.623 53.050 -0.018 0.000 1.071 3186 N CB -1.920 36.556 38.487 -0.018 0.000 1.040 3186 N HN 0.365 nan 8.380 nan 0.000 0.620 3187 T N 1.112 115.654 114.554 -0.020 0.000 2.777 3187 T HA 0.082 4.432 4.350 -0.000 0.000 0.273 3187 T C 0.388 175.075 174.700 -0.022 0.000 1.016 3187 T CA 0.184 62.271 62.100 -0.022 0.000 1.156 3187 T CB 0.241 69.096 68.868 -0.021 0.000 1.019 3187 T HN 0.262 nan 8.240 nan 0.000 0.503 3188 L N 4.987 126.194 121.223 -0.027 0.000 2.322 3188 L HA 0.719 5.059 4.340 -0.000 0.000 0.279 3188 L C -0.872 175.976 176.870 -0.036 0.000 1.036 3188 L CA -0.556 54.268 54.840 -0.026 0.000 0.807 3188 L CB 1.223 43.265 42.059 -0.028 0.000 1.226 3188 L HN 0.638 nan 8.230 nan 0.000 0.433 3189 L N 5.861 127.069 121.223 -0.026 0.000 2.381 3189 L HA 0.560 4.900 4.340 -0.000 0.000 0.274 3189 L C -1.176 175.667 176.870 -0.045 0.000 0.988 3189 L CA -0.407 54.391 54.840 -0.070 0.000 0.824 3189 L CB 1.781 43.806 42.059 -0.057 0.000 1.263 3189 L HN 0.617 nan 8.230 nan 0.000 0.410 3190 I N 4.088 124.583 120.570 -0.124 0.000 2.382 3190 I HA 0.315 4.485 4.170 -0.000 0.000 0.285 3190 I C -0.859 175.177 176.117 -0.134 0.000 1.007 3190 I CA -0.286 60.983 61.300 -0.053 0.000 1.142 3190 I CB 1.357 39.340 38.000 -0.027 0.000 1.289 3190 I HN 0.349 nan 8.210 nan 0.000 0.453 3191 F N 6.803 126.751 119.950 -0.005 0.000 2.399 3191 F HA 0.559 5.086 4.527 -0.000 0.000 0.334 3191 F C 0.495 176.300 175.800 0.008 0.000 1.097 3191 F CA -0.630 57.370 58.000 -0.001 0.000 1.076 3191 F CB 1.326 40.331 39.000 0.009 0.000 1.162 3191 F HN 0.229 nan 8.300 nan 0.000 0.495 3192 I N 0.427 121.113 120.570 0.194 0.000 2.603 3192 I HA 0.659 4.829 4.170 -0.000 0.000 0.300 3192 I C -0.942 175.267 176.117 0.154 0.000 1.017 3192 I CA -0.761 60.627 61.300 0.146 0.000 1.098 3192 I CB 2.094 40.151 38.000 0.096 0.000 1.279 3192 I HN 0.449 nan 8.210 nan 0.000 0.437 3193 N N 2.148 120.943 118.700 0.159 0.000 2.902 3193 N HA 0.447 5.187 4.740 -0.000 0.000 0.268 3193 N C -1.465 174.112 175.510 0.113 0.000 1.450 3193 N CA -0.480 52.653 53.050 0.137 0.000 0.819 3193 N CB 2.280 40.865 38.487 0.164 0.000 1.540 3193 N HN 0.722 nan 8.380 nan 0.000 0.545 3212 G N 0.753 109.540 108.800 -0.023 0.000 2.880 3212 G HA2 0.358 4.318 3.960 -0.000 0.000 0.303 3212 G HA3 0.358 4.318 3.960 -0.000 0.000 0.303 3212 G C 0.070 174.943 174.900 -0.045 0.000 2.853 3212 G CA 0.611 45.692 45.100 -0.032 0.000 0.748 3212 G HN 0.367 nan 8.290 nan 0.000 0.349 3213 N N 1.901 120.581 118.700 -0.033 0.000 2.016 3213 N HA -0.291 4.449 4.740 -0.000 0.000 0.194 3213 N C 2.695 178.187 175.510 -0.031 0.000 1.078 3213 N CA 2.636 55.671 53.050 -0.025 0.000 0.894 3213 N CB -0.184 38.309 38.487 0.009 0.000 1.073 3213 N HN 1.019 nan 8.380 nan 0.000 0.480 3214 A N 1.294 124.110 122.820 -0.008 0.000 1.698 3214 A HA -0.336 3.984 4.320 -0.000 0.000 0.315 3214 A C 2.246 179.812 177.584 -0.031 0.000 3.574 3214 A CA 3.218 55.234 52.037 -0.036 0.000 0.952 3214 A CB -1.874 17.050 19.000 -0.126 0.000 0.759 3214 A HN 0.704 nan 8.150 nan 0.000 0.516 3215 L N -0.108 121.065 121.223 -0.083 0.000 2.119 3215 L HA -0.338 4.002 4.340 -0.000 0.000 0.226 3215 L C 2.302 179.156 176.870 -0.026 0.000 1.093 3215 L CA 3.487 58.272 54.840 -0.091 0.000 0.806 3215 L CB -0.733 41.174 42.059 -0.254 0.000 0.902 3215 L HN 0.647 nan 8.230 nan 0.000 0.444 3216 K N -1.635 118.718 120.400 -0.077 0.000 2.127 3216 K HA -0.280 4.040 4.320 -0.000 0.000 0.212 3216 K C 1.833 178.322 176.600 -0.185 0.000 1.050 3216 K CA 2.590 58.781 56.287 -0.161 0.000 0.929 3216 K CB -0.346 31.957 32.500 -0.327 0.000 0.715 3216 K HN 0.493 nan 8.250 nan 0.000 0.457 3217 F N -1.544 118.448 119.950 0.071 0.000 2.505 3217 F HA 0.070 4.597 4.527 -0.000 0.000 0.289 3217 F C 1.698 177.623 175.800 0.208 0.000 1.101 3217 F CA 0.231 58.294 58.000 0.106 0.000 1.446 3217 F CB -0.183 38.824 39.000 0.011 0.000 1.123 3217 F HN -0.003 nan 8.300 nan 0.000 0.564 3218 Y N 0.435 120.833 120.300 0.165 0.000 2.632 3218 Y HA 0.251 4.801 4.550 -0.000 0.000 0.301 3218 Y C 1.303 177.228 175.900 0.041 0.000 1.172 3218 Y CA -0.531 57.619 58.100 0.083 0.000 1.328 3218 Y CB -0.214 38.272 38.460 0.044 0.000 1.016 3218 Y HN -0.056 nan 8.280 nan 0.000 0.529 3219 A N -0.408 122.509 122.820 0.162 0.000 2.304 3219 A HA 0.284 4.604 4.320 -0.000 0.000 0.271 3219 A C 0.952 178.555 177.584 0.031 0.000 1.091 3219 A CA -0.202 51.871 52.037 0.061 0.000 0.812 3219 A CB 0.635 19.633 19.000 -0.004 0.000 1.056 3219 A HN 0.219 nan 8.150 nan 0.000 0.489 3220 S N -0.770 114.928 115.700 -0.003 0.000 2.512 3220 S HA 0.300 4.770 4.470 -0.000 0.000 0.216 3220 S C -0.011 174.547 174.600 -0.069 0.000 1.006 3220 S CA 0.129 58.314 58.200 -0.025 0.000 0.915 3220 S CB 0.301 63.492 63.200 -0.016 0.000 0.824 3220 S HN 0.518 nan 8.310 nan 0.000 0.497 3221 V N 2.186 122.052 119.914 -0.080 0.000 2.851 3221 V HA 0.466 4.586 4.120 -0.000 0.000 0.307 3221 V C -1.185 174.820 176.094 -0.147 0.000 1.129 3221 V CA -0.758 61.468 62.300 -0.123 0.000 0.932 3221 V CB 2.276 34.041 31.823 -0.097 0.000 1.024 3221 V HN 0.128 nan 8.190 nan 0.000 0.426 3222 R N 4.359 124.726 120.500 -0.221 0.000 2.670 3222 R HA 0.709 5.049 4.340 -0.000 0.000 0.289 3222 R C -1.836 174.284 176.300 -0.300 0.000 0.965 3222 R CA -0.944 54.990 56.100 -0.278 0.000 0.899 3222 R CB 2.288 32.378 30.300 -0.350 0.000 1.173 3222 R HN 0.312 nan 8.270 nan 0.000 0.456 3223 L N 1.806 122.819 121.223 -0.351 0.000 2.362 3223 L HA 0.321 4.660 4.340 -0.000 0.000 0.275 3223 L C -0.425 176.191 176.870 -0.423 0.000 0.998 3223 L CA -0.515 54.155 54.840 -0.282 0.000 0.820 3223 L CB 1.636 43.615 42.059 -0.133 0.000 1.270 3223 L HN 0.534 nan 8.230 nan 0.000 0.415 3224 D N 3.899 124.185 120.400 -0.191 0.000 2.473 3224 D HA 0.292 4.932 4.640 -0.000 0.000 0.226 3224 D C -0.342 176.026 176.300 0.113 0.000 1.089 3224 D CA -0.145 53.914 54.000 0.098 0.000 0.883 3224 D CB 0.833 41.795 40.800 0.271 0.000 1.029 3224 D HN 0.416 nan 8.370 nan 0.000 0.517 3225 I N 2.982 123.631 120.570 0.133 0.000 2.499 3225 I HA 0.453 4.622 4.170 -0.000 0.000 0.296 3225 I C -0.335 175.828 176.117 0.076 0.000 0.992 3225 I CA -0.585 60.762 61.300 0.079 0.000 1.297 3225 I CB 0.721 38.765 38.000 0.072 0.000 1.410 3225 I HN 0.270 nan 8.210 nan 0.000 0.507 3226 R N 5.743 126.256 120.500 0.021 0.000 2.579 3226 R HA 0.302 4.642 4.340 -0.000 0.000 0.260 3226 R C -1.396 174.893 176.300 -0.019 0.000 1.103 3226 R CA -0.822 55.287 56.100 0.014 0.000 0.942 3226 R CB 1.289 31.603 30.300 0.023 0.000 1.251 3226 R HN 0.664 nan 8.270 nan 0.000 0.450 3227 R N 4.852 125.350 120.500 -0.002 0.000 2.254 3227 R HA 0.290 4.630 4.340 -0.000 0.000 0.318 3227 R C 0.475 176.776 176.300 0.002 0.000 1.031 3227 R CA -0.050 56.048 56.100 -0.003 0.000 0.905 3227 R CB 0.522 30.839 30.300 0.028 0.000 1.050 3227 R HN 0.716 nan 8.270 nan 0.000 0.456 3228 I N 0.762 121.327 120.570 -0.009 0.000 4.338 3228 I HA 0.470 4.640 4.170 -0.000 0.000 0.329 3228 I C 0.396 176.517 176.117 0.006 0.000 1.378 3228 I CA -0.182 61.117 61.300 -0.001 0.000 1.170 3228 I CB 1.429 39.424 38.000 -0.008 0.000 1.206 3228 I HN 0.670 nan 8.210 nan 0.000 0.432 3229 G N 1.326 110.133 108.800 0.012 0.000 2.691 3229 G HA2 0.718 4.678 3.960 -0.000 0.000 0.169 3229 G HA3 0.718 4.678 3.960 -0.000 0.000 0.169 3229 G C -0.191 174.724 174.900 0.024 0.000 1.638 3229 G CA 0.127 45.237 45.100 0.016 0.000 0.822 3229 G HN 1.059 nan 8.290 nan 0.000 0.768 3230 A N -1.623 121.217 122.820 0.034 0.000 2.425 3230 A HA 0.357 4.677 4.320 -0.000 0.000 0.683 3230 A C -0.939 176.656 177.584 0.019 0.000 0.139 3230 A CA -0.210 51.845 52.037 0.031 0.000 0.044 3230 A CB -0.935 18.070 19.000 0.008 0.000 3.957 3230 A HN 1.554 nan 8.150 nan 0.000 0.546 3231 V N 3.444 123.369 119.914 0.019 0.000 2.370 3231 V HA 0.556 4.676 4.120 -0.000 0.000 0.283 3231 V C 0.485 176.568 176.094 -0.017 0.000 1.023 3231 V CA -0.352 61.958 62.300 0.017 0.000 0.857 3231 V CB 1.425 33.277 31.823 0.049 0.000 0.985 3231 V HN 0.821 nan 8.190 nan 0.000 0.443 3232 K N 2.849 123.241 120.400 -0.013 0.000 2.118 3232 K HA 0.583 4.903 4.320 -0.000 0.000 0.254 3232 K C -0.279 176.313 176.600 -0.013 0.000 0.961 3232 K CA -0.614 55.658 56.287 -0.025 0.000 0.876 3232 K CB 1.882 34.369 32.500 -0.022 0.000 1.077 3232 K HN 0.640 nan 8.250 nan 0.000 0.440 3233 E N 1.010 121.199 120.200 -0.018 0.000 3.588 3233 E HA 0.168 4.518 4.350 -0.000 0.000 0.213 3233 E C 0.179 176.772 176.600 -0.011 0.000 1.168 3233 E CA -0.187 56.208 56.400 -0.009 0.000 1.254 3233 E CB 0.711 30.408 29.700 -0.005 0.000 1.302 3233 E HN 0.947 nan 8.360 nan 0.000 0.429 3234 G N 1.774 110.567 108.800 -0.012 0.000 4.365 3234 G HA2 -0.322 3.638 3.960 -0.000 0.000 0.214 3234 G HA3 -0.322 3.638 3.960 -0.000 0.000 0.214 3234 G C 0.850 175.740 174.900 -0.017 0.000 1.450 3234 G CA 0.293 45.385 45.100 -0.013 0.000 0.937 3234 G HN 0.445 nan 8.290 nan 0.000 0.625 3235 E N 0.939 121.126 120.200 -0.021 0.000 2.665 3235 E HA 0.109 4.459 4.350 -0.000 0.000 0.225 3235 E C -0.090 176.488 176.600 -0.035 0.000 0.922 3235 E CA 0.015 56.401 56.400 -0.025 0.000 1.242 3235 E CB 0.531 30.219 29.700 -0.020 0.000 1.197 3235 E HN 0.689 nan 8.360 nan 0.000 0.581 3236 N N 1.276 119.951 118.700 -0.041 0.000 2.419 3236 N HA 0.163 4.902 4.740 -0.000 0.000 0.277 3236 N C -0.066 175.389 175.510 -0.092 0.000 1.006 3236 N CA -0.409 52.604 53.050 -0.061 0.000 0.923 3236 N CB 2.198 40.652 38.487 -0.055 0.000 1.140 3236 N HN -0.201 nan 8.380 nan 0.000 0.488 3237 V N 0.607 120.445 119.914 -0.127 0.000 2.266 3237 V HA 0.072 4.192 4.120 -0.000 0.000 0.240 3237 V C 0.679 176.561 176.094 -0.354 0.000 1.225 3237 V CA -0.139 62.038 62.300 -0.205 0.000 1.237 3237 V CB -0.041 31.663 31.823 -0.198 0.000 1.343 3237 V HN 0.592 nan 8.190 nan 0.000 0.496 3238 V N 3.704 123.453 119.914 -0.275 0.000 3.483 3238 V HA 0.676 4.796 4.120 -0.000 0.000 0.301 3238 V C 1.028 176.990 176.094 -0.220 0.000 1.389 3238 V CA 0.969 63.102 62.300 -0.279 0.000 1.101 3238 V CB 0.070 31.840 31.823 -0.089 0.000 0.971 3238 V HN 0.958 nan 8.190 nan 0.000 0.434 3239 G N -0.987 107.680 108.800 -0.222 0.000 2.727 3239 G HA2 0.604 4.564 3.960 -0.000 0.000 0.289 3239 G HA3 0.604 4.564 3.960 -0.000 0.000 0.289 3239 G C -1.366 173.691 174.900 0.262 0.000 1.418 3239 G CA -0.396 44.779 45.100 0.126 0.000 0.818 3239 G HN 0.082 nan 8.290 nan 0.000 0.486 3240 S N -0.236 115.650 115.700 0.310 0.000 2.750 3240 S HA 0.356 4.826 4.470 -0.000 0.000 0.276 3240 S C -0.924 173.732 174.600 0.092 0.000 1.165 3240 S CA -0.546 57.780 58.200 0.211 0.000 1.047 3240 S CB 1.736 65.081 63.200 0.242 0.000 1.056 3240 S HN 0.640 nan 8.310 nan 0.000 0.481 3241 E N 2.166 122.392 120.200 0.044 0.000 2.324 3241 E HA 0.400 4.750 4.350 -0.000 0.000 0.271 3241 E C -0.607 175.939 176.600 -0.090 0.000 1.028 3241 E CA 0.321 56.713 56.400 -0.014 0.000 0.890 3241 E CB 0.543 30.244 29.700 0.001 0.000 1.004 3241 E HN 0.458 nan 8.360 nan 0.000 0.431 3242 T N 5.274 119.686 114.554 -0.237 0.000 2.861 3242 T HA 0.520 4.870 4.350 -0.000 0.000 0.287 3242 T C -0.454 173.978 174.700 -0.448 0.000 1.003 3242 T CA -0.839 61.039 62.100 -0.370 0.000 0.977 3242 T CB 1.185 69.716 68.868 -0.560 0.000 0.996 3242 T HN 0.295 nan 8.240 nan 0.000 0.448 3243 R N 1.768 122.115 120.500 -0.256 0.000 2.439 3243 R HA 0.651 4.991 4.340 -0.000 0.000 0.310 3243 R C -1.479 174.768 176.300 -0.088 0.000 0.955 3243 R CA -0.653 55.354 56.100 -0.154 0.000 0.853 3243 R CB 2.090 32.356 30.300 -0.057 0.000 1.171 3243 R HN 0.380 nan 8.270 nan 0.000 0.449 3244 V N 4.396 124.286 119.914 -0.038 0.000 2.409 3244 V HA 0.304 4.424 4.120 -0.000 0.000 0.291 3244 V C -0.156 175.967 176.094 0.048 0.000 1.020 3244 V CA -0.720 61.599 62.300 0.032 0.000 0.848 3244 V CB 1.854 33.741 31.823 0.107 0.000 0.990 3244 V HN 0.546 nan 8.190 nan 0.000 0.430 3245 K N 3.320 123.746 120.400 0.044 0.000 2.183 3245 K HA 0.513 4.833 4.320 -0.000 0.000 0.274 3245 K C -0.738 175.861 176.600 -0.001 0.000 1.009 3245 K CA -0.604 55.712 56.287 0.049 0.000 0.888 3245 K CB 2.143 34.696 32.500 0.089 0.000 1.078 3245 K HN 0.409 nan 8.250 nan 0.000 0.459 3246 V N 5.358 125.261 119.914 -0.018 0.000 2.370 3246 V HA -0.031 4.089 4.120 -0.000 0.000 0.257 3246 V C 1.146 177.142 176.094 -0.164 0.000 1.064 3246 V CA 0.120 62.361 62.300 -0.098 0.000 0.975 3246 V CB 0.711 32.478 31.823 -0.092 0.000 1.067 3246 V HN 0.618 nan 8.190 nan 0.000 0.485 3247 V N 3.741 123.535 119.914 -0.200 0.000 2.374 3247 V HA 0.140 4.260 4.120 -0.000 0.000 0.241 3247 V C 1.000 176.817 176.094 -0.462 0.000 1.034 3247 V CA 0.681 62.863 62.300 -0.196 0.000 1.037 3247 V CB -0.281 31.507 31.823 -0.059 0.000 0.682 3247 V HN 0.657 nan 8.190 nan 0.000 0.463 3248 K N 1.735 121.855 120.400 -0.467 0.000 2.307 3248 K HA 0.373 4.693 4.320 -0.000 0.000 0.263 3248 K C -1.060 175.316 176.600 -0.374 0.000 0.973 3248 K CA -0.377 55.567 56.287 -0.571 0.000 0.846 3248 K CB 0.788 32.859 32.500 -0.715 0.000 1.100 3248 K HN 0.218 nan 8.250 nan 0.000 0.438 3249 N N 4.005 122.506 118.700 -0.330 0.000 2.690 3249 N HA 0.130 4.869 4.740 -0.000 0.000 0.255 3249 N C -1.070 174.364 175.510 -0.126 0.000 1.195 3249 N CA -0.295 52.632 53.050 -0.205 0.000 0.790 3249 N CB 0.910 39.277 38.487 -0.201 0.000 1.216 3249 N HN 0.512 nan 8.380 nan 0.000 0.528 3250 K N 2.357 122.705 120.400 -0.088 0.000 2.862 3250 K HA 0.214 4.534 4.320 -0.000 0.000 0.229 3250 K C 0.438 177.023 176.600 -0.025 0.000 1.107 3250 K CA -0.008 56.258 56.287 -0.034 0.000 1.222 3250 K CB 0.446 32.942 32.500 -0.006 0.000 1.067 3250 K HN 0.412 nan 8.250 nan 0.000 0.464 3251 I N -0.914 119.634 120.570 -0.037 0.000 4.338 3251 I HA 0.140 4.310 4.170 -0.000 0.000 0.315 3251 I C 0.308 176.414 176.117 -0.019 0.000 1.262 3251 I CA 0.158 61.443 61.300 -0.026 0.000 1.298 3251 I CB 0.911 38.891 38.000 -0.034 0.000 1.257 3251 I HN 0.089 nan 8.210 nan 0.000 0.444 3252 A N -0.189 122.616 122.820 -0.026 0.000 4.642 3252 A HA 0.837 5.157 4.320 -0.000 0.000 0.248 3252 A C -0.923 176.652 177.584 -0.015 0.000 0.987 3252 A CA -0.034 51.995 52.037 -0.013 0.000 0.622 3252 A CB -0.509 18.483 19.000 -0.013 0.000 1.769 3252 A HN 0.093 nan 8.150 nan 0.000 0.864 3253 A N 1.268 124.086 122.820 -0.004 0.000 2.491 3253 A HA 0.596 4.916 4.320 -0.000 0.000 0.261 3253 A C -2.406 175.161 177.584 -0.028 0.000 1.101 3253 A CA -0.751 51.292 52.037 0.009 0.000 0.772 3253 A CB -0.796 18.223 19.000 0.031 0.000 1.043 3253 A HN 0.376 nan 8.150 nan 0.000 0.501 3254 P HA 0.560 nan 4.420 nan 0.000 0.284 3254 P C -0.119 177.118 177.300 -0.104 0.000 1.292 3254 P CA -0.553 62.391 63.100 -0.261 0.000 0.800 3254 P CB 0.050 31.412 31.700 -0.564 0.000 1.188 3255 F N -4.170 115.786 119.950 0.010 0.000 3.006 3255 F HA -0.241 4.286 4.527 -0.000 0.000 0.289 3255 F C 0.520 176.326 175.800 0.011 0.000 0.772 3255 F CA 0.892 58.899 58.000 0.013 0.000 1.162 3255 F CB -2.256 36.749 39.000 0.009 0.000 1.382 3255 F HN 0.186 nan 8.300 nan 0.000 0.406 3256 K N 1.148 121.612 120.400 0.106 0.000 2.098 3256 K HA 0.575 4.895 4.320 -0.000 0.000 0.261 3256 K C 0.351 176.990 176.600 0.066 0.000 0.987 3256 K CA -0.625 55.711 56.287 0.081 0.000 0.916 3256 K CB 1.590 34.122 32.500 0.053 0.000 1.039 3256 K HN 0.427 nan 8.250 nan 0.000 0.455 3257 Q N -0.100 119.741 119.800 0.068 0.000 2.484 3257 Q HA 0.777 5.117 4.340 -0.000 0.000 0.285 3257 Q C -1.752 174.292 176.000 0.073 0.000 1.097 3257 Q CA -1.232 54.611 55.803 0.067 0.000 0.802 3257 Q CB 2.231 31.011 28.738 0.068 0.000 1.444 3257 Q HN 0.558 nan 8.270 nan 0.000 0.429 3258 A N 1.379 124.254 122.820 0.090 0.000 2.486 3258 A HA 0.601 4.921 4.320 -0.000 0.000 0.300 3258 A C -1.427 176.237 177.584 0.134 0.000 1.048 3258 A CA -0.767 51.349 52.037 0.132 0.000 0.696 3258 A CB 1.779 20.883 19.000 0.173 0.000 1.278 3258 A HN 0.762 nan 8.150 nan 0.000 0.405 3259 E N 0.739 121.020 120.200 0.135 0.000 2.227 3259 E HA 0.787 5.137 4.350 -0.000 0.000 0.268 3259 E C -1.238 175.473 176.600 0.185 0.000 0.907 3259 E CA -0.549 55.873 56.400 0.036 0.000 0.786 3259 E CB 2.279 31.990 29.700 0.018 0.000 1.191 3259 E HN 0.727 nan 8.360 nan 0.000 0.411 3260 F N -2.141 117.832 119.950 0.039 0.000 2.807 3260 F HA 0.303 4.830 4.527 -0.000 0.000 0.316 3260 F C -1.389 174.443 175.800 0.054 0.000 1.162 3260 F CA -1.274 56.752 58.000 0.043 0.000 0.910 3260 F CB 0.905 39.924 39.000 0.031 0.000 1.314 3260 F HN 0.174 nan 8.300 nan 0.000 0.454 3261 Q N 1.856 121.853 119.800 0.328 0.000 2.261 3261 Q HA 0.616 4.956 4.340 -0.000 0.000 0.252 3261 Q C -0.967 175.229 176.000 0.326 0.000 0.915 3261 Q CA -0.520 55.423 55.803 0.234 0.000 0.915 3261 Q CB 2.300 31.151 28.738 0.189 0.000 1.204 3261 Q HN 0.585 nan 8.270 nan 0.000 0.421 3262 I N 3.791 124.510 120.570 0.247 0.000 2.354 3262 I HA 0.180 4.350 4.170 -0.000 0.000 0.286 3262 I C -0.901 175.365 176.117 0.249 0.000 1.007 3262 I CA -0.742 60.702 61.300 0.240 0.000 1.167 3262 I CB 0.883 38.992 38.000 0.182 0.000 1.320 3262 I HN 0.329 nan 8.210 nan 0.000 0.458 3263 L N 7.259 128.622 121.223 0.233 0.000 2.265 3263 L HA 0.265 4.605 4.340 -0.000 0.000 0.288 3263 L C -0.363 176.700 176.870 0.321 0.000 1.058 3263 L CA -0.072 54.934 54.840 0.277 0.000 0.809 3263 L CB 0.206 42.385 42.059 0.200 0.000 1.179 3263 L HN 0.331 nan 8.230 nan 0.000 0.429 3264 Y N 3.842 124.212 120.300 0.116 0.000 2.834 3264 Y HA 0.180 4.730 4.550 -0.000 0.000 0.355 3264 Y C 1.542 177.526 175.900 0.140 0.000 1.287 3264 Y CA 0.716 58.892 58.100 0.127 0.000 1.647 3264 Y CB 0.068 38.553 38.460 0.040 0.000 1.221 3264 Y HN 0.871 nan 8.280 nan 0.000 0.519 3265 G N 2.569 111.601 108.800 0.386 0.000 2.132 3265 G HA2 -0.284 3.676 3.960 -0.000 0.000 0.234 3265 G HA3 -0.284 3.676 3.960 -0.000 0.000 0.234 3265 G C 0.420 175.450 174.900 0.217 0.000 0.989 3265 G CA 0.431 45.734 45.100 0.338 0.000 0.676 3265 G HN 0.657 nan 8.290 nan 0.000 0.522 3266 E N -1.528 118.786 120.200 0.190 0.000 2.879 3266 E HA 0.454 4.804 4.350 -0.000 0.000 0.206 3266 E C 1.243 177.897 176.600 0.090 0.000 0.969 3266 E CA 1.153 57.629 56.400 0.127 0.000 1.496 3266 E CB 0.647 30.424 29.700 0.130 0.000 1.454 3266 E HN 1.699 nan 8.360 nan 0.000 0.750 3267 G N 1.059 109.920 108.800 0.102 0.000 2.342 3267 G HA2 -0.090 3.870 3.960 -0.000 0.000 0.220 3267 G HA3 -0.090 3.870 3.960 -0.000 0.000 0.220 3267 G C -0.426 174.519 174.900 0.074 0.000 1.243 3267 G CA -0.374 44.754 45.100 0.048 0.000 1.083 3267 G HN 0.152 nan 8.290 nan 0.000 0.500 3268 I N 0.659 121.240 120.570 0.017 0.000 3.161 3268 I HA 0.069 4.239 4.170 -0.000 0.000 0.284 3268 I C 0.589 176.734 176.117 0.046 0.000 1.252 3268 I CA -0.031 61.275 61.300 0.011 0.000 1.374 3268 I CB 0.331 38.220 38.000 -0.185 0.000 1.359 3268 I HN 0.419 nan 8.210 nan 0.000 0.606 3269 N N 3.007 121.752 118.700 0.075 0.000 3.091 3269 N HA 0.109 4.849 4.740 -0.000 0.000 0.255 3269 N C 0.620 176.210 175.510 0.134 0.000 1.204 3269 N CA -0.306 52.829 53.050 0.143 0.000 0.990 3269 N CB -0.053 38.549 38.487 0.192 0.000 1.260 3269 N HN 0.460 nan 8.380 nan 0.000 0.502 3270 F N 1.694 121.567 119.950 -0.128 0.000 2.060 3270 F HA -0.373 4.154 4.527 -0.000 0.000 0.293 3270 F C 0.942 176.577 175.800 -0.276 0.000 1.096 3270 F CA 2.099 59.911 58.000 -0.313 0.000 1.241 3270 F CB -0.452 38.188 39.000 -0.601 0.000 0.959 3270 F HN 0.493 nan 8.300 nan 0.000 0.499 3271 Y N -0.951 119.470 120.300 0.203 0.000 2.420 3271 Y HA 0.148 4.698 4.550 -0.000 0.000 0.292 3271 Y C 2.575 178.516 175.900 0.068 0.000 1.119 3271 Y CA 0.618 58.756 58.100 0.064 0.000 1.229 3271 Y CB -1.250 37.212 38.460 0.005 0.000 1.026 3271 Y HN 0.071 nan 8.280 nan 0.000 0.554 3272 G N 1.164 110.111 108.800 0.245 0.000 2.587 3272 G HA2 -0.332 3.628 3.960 -0.000 0.000 0.217 3272 G HA3 -0.332 3.628 3.960 -0.000 0.000 0.217 3272 G C 1.450 176.430 174.900 0.133 0.000 1.240 3272 G CA 1.405 46.610 45.100 0.175 0.000 0.794 3272 G HN 0.576 nan 8.290 nan 0.000 0.580 3273 E N 0.189 120.467 120.200 0.130 0.000 2.265 3273 E HA -0.075 4.275 4.350 -0.000 0.000 0.196 3273 E C 2.342 178.986 176.600 0.073 0.000 0.996 3273 E CA 0.717 57.180 56.400 0.104 0.000 0.832 3273 E CB -0.245 29.506 29.700 0.085 0.000 0.756 3273 E HN 0.348 nan 8.360 nan 0.000 0.491 3274 L N 1.711 122.983 121.223 0.082 0.000 2.005 3274 L HA -0.125 4.215 4.340 -0.000 0.000 0.207 3274 L C 2.334 179.221 176.870 0.028 0.000 1.072 3274 L CA 1.284 56.161 54.840 0.061 0.000 0.744 3274 L CB -0.767 41.333 42.059 0.069 0.000 0.895 3274 L HN 0.052 nan 8.230 nan 0.000 0.433 3275 V N 0.483 120.408 119.914 0.017 0.000 2.222 3275 V HA -0.411 3.709 4.120 -0.000 0.000 0.252 3275 V C 2.422 178.461 176.094 -0.092 0.000 1.060 3275 V CA 2.266 64.518 62.300 -0.081 0.000 1.027 3275 V CB -0.973 30.763 31.823 -0.145 0.000 0.644 3275 V HN 0.444 nan 8.190 nan 0.000 0.448 3276 D N -0.365 120.009 120.400 -0.042 0.000 2.133 3276 D HA -0.166 4.474 4.640 -0.000 0.000 0.195 3276 D C 1.989 178.299 176.300 0.017 0.000 0.997 3276 D CA 1.310 55.307 54.000 -0.003 0.000 0.840 3276 D CB -0.294 40.532 40.800 0.043 0.000 0.947 3276 D HN 0.258 nan 8.370 nan 0.000 0.452 3277 L N 0.654 121.892 121.223 0.024 0.000 1.994 3277 L HA -0.026 4.314 4.340 -0.000 0.000 0.208 3277 L C 2.622 179.509 176.870 0.028 0.000 1.071 3277 L CA 1.760 56.619 54.840 0.031 0.000 0.745 3277 L CB -1.378 40.701 42.059 0.034 0.000 0.892 3277 L HN 0.071 nan 8.230 nan 0.000 0.431 3278 G N -1.418 107.391 108.800 0.016 0.000 2.501 3278 G HA2 -0.151 3.809 3.960 -0.000 0.000 0.220 3278 G HA3 -0.151 3.809 3.960 -0.000 0.000 0.220 3278 G C 1.588 176.507 174.900 0.032 0.000 1.114 3278 G CA 1.017 46.130 45.100 0.022 0.000 0.757 3278 G HN 0.291 nan 8.290 nan 0.000 0.559 3279 V N 0.198 120.124 119.914 0.019 0.000 2.302 3279 V HA -0.007 4.113 4.120 -0.000 0.000 0.243 3279 V C 2.503 178.635 176.094 0.063 0.000 1.036 3279 V CA 1.917 64.247 62.300 0.050 0.000 1.020 3279 V CB -0.244 31.613 31.823 0.056 0.000 0.657 3279 V HN 0.352 nan 8.190 nan 0.000 0.453 3280 K N -0.123 120.309 120.400 0.053 0.000 2.486 3280 K HA -0.051 4.269 4.320 -0.000 0.000 0.194 3280 K C 0.728 177.356 176.600 0.047 0.000 1.033 3280 K CA 0.610 56.928 56.287 0.052 0.000 1.004 3280 K CB 0.214 32.743 32.500 0.049 0.000 0.798 3280 K HN 0.329 nan 8.250 nan 0.000 0.495 3281 E N 1.184 121.413 120.200 0.048 0.000 2.723 3281 E HA 0.039 4.389 4.350 -0.000 0.000 0.219 3281 E C -0.438 176.196 176.600 0.056 0.000 1.060 3281 E CA -0.124 56.305 56.400 0.048 0.000 1.291 3281 E CB 0.794 30.521 29.700 0.045 0.000 1.265 3281 E HN 0.116 nan 8.360 nan 0.000 0.438 3282 K N -0.451 119.984 120.400 0.058 0.000 3.184 3282 K HA -0.233 4.087 4.320 -0.000 0.000 0.301 3282 K C 1.129 177.775 176.600 0.077 0.000 1.170 3282 K CA 0.677 57.001 56.287 0.061 0.000 0.897 3282 K CB -1.971 30.557 32.500 0.046 0.000 1.218 3282 K HN 0.303 nan 8.250 nan 0.000 0.441 3283 L N -0.245 121.036 121.223 0.098 0.000 2.162 3283 L HA 0.138 4.478 4.340 -0.000 0.000 0.205 3283 L C 1.131 178.136 176.870 0.226 0.000 1.086 3283 L CA 0.772 55.706 54.840 0.156 0.000 0.778 3283 L CB 0.115 42.272 42.059 0.163 0.000 0.928 3283 L HN 0.102 nan 8.230 nan 0.000 0.446 3284 I N -0.874 119.788 120.570 0.155 0.000 2.474 3284 I HA 0.246 4.416 4.170 -0.000 0.000 0.294 3284 I C -0.674 175.530 176.117 0.146 0.000 1.005 3284 I CA -0.520 60.873 61.300 0.155 0.000 1.113 3284 I CB 1.955 39.982 38.000 0.045 0.000 1.289 3284 I HN -0.077 nan 8.210 nan 0.000 0.436 3285 E N 4.907 125.207 120.200 0.168 0.000 2.151 3285 E HA 0.322 4.671 4.350 -0.000 0.000 0.275 3285 E C -0.836 175.888 176.600 0.206 0.000 0.936 3285 E CA -0.922 55.569 56.400 0.151 0.000 0.777 3285 E CB 1.975 31.731 29.700 0.094 0.000 1.108 3285 E HN 0.319 nan 8.360 nan 0.000 0.401 3286 K N 2.054 122.567 120.400 0.189 0.000 2.284 3286 K HA 0.313 4.633 4.320 -0.000 0.000 0.287 3286 K C -0.653 175.984 176.600 0.061 0.000 1.081 3286 K CA -0.186 56.187 56.287 0.143 0.000 0.910 3286 K CB 0.532 33.125 32.500 0.154 0.000 1.088 3286 K HN 0.596 nan 8.250 nan 0.000 0.478 3287 A N 4.177 127.023 122.820 0.043 0.000 3.293 3287 A HA 0.404 4.724 4.320 -0.000 0.000 0.282 3287 A C 0.903 178.521 177.584 0.057 0.000 1.394 3287 A CA 0.193 52.273 52.037 0.071 0.000 1.118 3287 A CB -0.387 18.682 19.000 0.115 0.000 1.133 3287 A HN 1.071 nan 8.150 nan 0.000 0.627 3288 G N 0.677 109.469 108.800 -0.013 0.000 4.026 3288 G HA2 -0.199 3.761 3.960 -0.000 0.000 0.309 3288 G HA3 -0.199 3.761 3.960 -0.000 0.000 0.309 3288 G C 1.435 176.233 174.900 -0.171 0.000 1.411 3288 G CA 0.872 45.937 45.100 -0.058 0.000 1.037 3288 G HN 1.724 nan 8.290 nan 0.000 0.687 3289 A N -0.705 121.975 122.820 -0.233 0.000 2.197 3289 A HA 0.529 4.849 4.320 -0.000 0.000 0.210 3289 A C 0.787 178.050 177.584 -0.536 0.000 1.180 3289 A CA 0.557 52.350 52.037 -0.407 0.000 0.846 3289 A CB 0.037 18.775 19.000 -0.438 0.000 0.884 3289 A HN 0.583 nan 8.150 nan 0.000 0.487 3290 W N -0.714 120.395 121.300 -0.319 0.000 2.315 3290 W HA 0.511 5.171 4.660 -0.000 0.000 0.316 3290 W C -0.578 175.728 176.519 -0.355 0.000 1.211 3290 W CA -0.142 57.043 57.345 -0.266 0.000 1.201 3290 W CB 0.410 29.788 29.460 -0.137 0.000 1.184 3290 W HN 0.210 nan 8.180 nan 0.000 0.544 3291 Y N 2.266 122.698 120.300 0.220 0.000 2.335 3291 Y HA 0.410 4.960 4.550 -0.000 0.000 0.338 3291 Y C 0.411 176.322 175.900 0.019 0.000 0.977 3291 Y CA -0.714 57.432 58.100 0.076 0.000 1.114 3291 Y CB 1.534 39.993 38.460 -0.002 0.000 1.182 3291 Y HN 0.180 nan 8.280 nan 0.000 0.463 3292 S N 2.634 118.449 115.700 0.192 0.000 2.568 3292 S HA 0.456 4.926 4.470 -0.000 0.000 0.302 3292 S C -1.892 172.787 174.600 0.131 0.000 1.082 3292 S CA -0.737 57.512 58.200 0.082 0.000 1.009 3292 S CB 1.495 64.720 63.200 0.041 0.000 1.069 3292 S HN 0.518 nan 8.310 nan 0.000 0.500 3293 Y N 2.017 122.270 120.300 -0.078 0.000 2.344 3293 Y HA 0.355 4.905 4.550 -0.000 0.000 0.328 3293 Y C -0.114 175.776 175.900 -0.016 0.000 1.067 3293 Y CA -0.875 57.197 58.100 -0.047 0.000 1.247 3293 Y CB 0.351 38.769 38.460 -0.070 0.000 1.113 3293 Y HN 0.839 nan 8.280 nan 0.000 0.465 3294 K N 4.433 124.603 120.400 -0.382 0.000 3.125 3294 K HA -0.207 4.113 4.320 -0.000 0.000 0.268 3294 K C 0.917 177.427 176.600 -0.150 0.000 1.078 3294 K CA 0.996 57.092 56.287 -0.318 0.000 0.775 3294 K CB -1.398 30.843 32.500 -0.433 0.000 1.253 3294 K HN 1.399 nan 8.250 nan 0.000 0.486 3295 G N -0.329 108.411 108.800 -0.099 0.000 2.220 3295 G HA2 -0.337 3.623 3.960 -0.000 0.000 0.269 3295 G HA3 -0.337 3.623 3.960 -0.000 0.000 0.269 3295 G C -0.078 174.778 174.900 -0.074 0.000 0.977 3295 G CA 0.793 45.848 45.100 -0.076 0.000 0.634 3295 G HN 0.475 nan 8.290 nan 0.000 0.539 3296 E N 0.997 121.162 120.200 -0.057 0.000 2.249 3296 E HA 0.303 4.653 4.350 -0.000 0.000 0.280 3296 E C 0.097 176.661 176.600 -0.059 0.000 1.016 3296 E CA -0.647 55.730 56.400 -0.037 0.000 0.830 3296 E CB 0.576 30.289 29.700 0.022 0.000 1.081 3296 E HN 0.111 nan 8.360 nan 0.000 0.395 3297 K N 3.718 124.061 120.400 -0.095 0.000 2.339 3297 K HA 0.136 4.456 4.320 -0.000 0.000 0.286 3297 K C 0.958 177.470 176.600 -0.146 0.000 1.050 3297 K CA 0.164 56.379 56.287 -0.121 0.000 0.956 3297 K CB 0.588 32.976 32.500 -0.187 0.000 0.990 3297 K HN 0.548 nan 8.250 nan 0.000 0.475 3298 I N -1.944 118.477 120.570 -0.249 0.000 4.338 3298 I HA 0.338 4.508 4.170 -0.000 0.000 0.315 3298 I C 0.649 176.454 176.117 -0.521 0.000 1.262 3298 I CA -0.268 60.584 61.300 -0.747 0.000 1.298 3298 I CB 1.198 38.380 38.000 -1.364 0.000 1.257 3298 I HN 0.447 nan 8.210 nan 0.000 0.444 3299 G N 1.178 109.927 108.800 -0.085 0.000 2.702 3299 G HA2 0.450 4.410 3.960 -0.000 0.000 0.296 3299 G HA3 0.450 4.410 3.960 -0.000 0.000 0.296 3299 G C -2.197 172.810 174.900 0.179 0.000 1.463 3299 G CA -0.458 44.693 45.100 0.085 0.000 0.890 3299 G HN 0.159 nan 8.290 nan 0.000 0.534 3300 Q N 0.400 120.211 119.800 0.019 0.000 2.333 3300 Q HA 0.562 4.902 4.340 -0.000 0.000 0.268 3300 Q C 0.207 176.100 176.000 -0.179 0.000 1.007 3300 Q CA 0.161 55.789 55.803 -0.290 0.000 0.810 3300 Q CB 1.502 29.822 28.738 -0.696 0.000 1.264 3300 Q HN 2.122 nan 8.270 nan 0.000 0.452 3301 G N 3.465 112.144 108.800 -0.201 0.000 3.285 3301 G HA2 -0.257 3.703 3.960 -0.000 0.000 0.685 3301 G HA3 -0.257 3.703 3.960 -0.000 0.000 0.685 3301 G C 0.247 175.235 174.900 0.147 0.000 0.938 3301 G CA 0.152 45.214 45.100 -0.063 0.000 0.778 3301 G HN 0.845 nan 8.290 nan 0.000 0.515 3302 K N 1.991 122.559 120.400 0.279 0.000 2.127 3302 K HA -0.224 4.096 4.320 -0.000 0.000 0.212 3302 K C 2.896 179.598 176.600 0.169 0.000 1.050 3302 K CA 2.784 59.275 56.287 0.340 0.000 0.929 3302 K CB -0.355 32.281 32.500 0.228 0.000 0.715 3302 K HN 1.474 nan 8.250 nan 0.000 0.457 3303 A N 1.939 124.829 122.820 0.117 0.000 1.877 3303 A HA -0.311 4.009 4.320 -0.000 0.000 0.218 3303 A C 1.806 179.445 177.584 0.092 0.000 1.301 3303 A CA 2.405 54.493 52.037 0.084 0.000 0.699 3303 A CB -1.277 17.754 19.000 0.052 0.000 0.844 3303 A HN 0.630 nan 8.150 nan 0.000 0.464 3304 N N 0.071 118.824 118.700 0.089 0.000 2.364 3304 N HA -0.076 4.664 4.740 -0.000 0.000 0.183 3304 N C 1.887 177.485 175.510 0.147 0.000 1.022 3304 N CA 1.111 54.223 53.050 0.103 0.000 0.883 3304 N CB -0.298 38.237 38.487 0.081 0.000 0.965 3304 N HN 0.581 nan 8.380 nan 0.000 0.438 3305 A N 1.302 124.212 122.820 0.150 0.000 1.902 3305 A HA -0.123 4.197 4.320 -0.000 0.000 0.217 3305 A C 2.386 180.048 177.584 0.129 0.000 1.181 3305 A CA 1.691 53.800 52.037 0.120 0.000 0.623 3305 A CB -0.951 18.087 19.000 0.064 0.000 0.818 3305 A HN 0.235 nan 8.150 nan 0.000 0.443 3306 T N 0.852 115.463 114.554 0.096 0.000 2.474 3306 T HA -0.093 4.257 4.350 -0.000 0.000 0.254 3306 T C 2.102 176.838 174.700 0.060 0.000 1.191 3306 T CA 1.862 64.015 62.100 0.089 0.000 1.231 3306 T CB -0.913 68.011 68.868 0.094 0.000 0.865 3306 T HN 0.690 nan 8.240 nan 0.000 0.398 3307 A N -0.202 122.643 122.820 0.040 0.000 2.298 3307 A HA -0.113 4.207 4.320 -0.000 0.000 0.215 3307 A C 1.827 179.406 177.584 -0.009 0.000 1.193 3307 A CA 1.297 53.318 52.037 -0.027 0.000 0.697 3307 A CB -1.231 17.771 19.000 0.002 0.000 0.774 3307 A HN 0.738 nan 8.150 nan 0.000 0.492 3308 W N -0.146 121.089 121.300 -0.109 0.000 2.463 3308 W HA -0.030 4.630 4.660 -0.000 0.000 0.316 3308 W C 1.685 178.100 176.519 -0.173 0.000 1.170 3308 W CA 1.605 58.890 57.345 -0.100 0.000 1.355 3308 W CB -0.411 29.024 29.460 -0.043 0.000 1.159 3308 W HN 0.211 nan 8.180 nan 0.000 0.487 3309 L N 1.208 122.490 121.223 0.097 0.000 2.189 3309 L HA -0.278 4.062 4.340 -0.000 0.000 0.214 3309 L C 2.444 178.971 176.870 -0.572 0.000 1.097 3309 L CA 1.642 56.386 54.840 -0.160 0.000 0.764 3309 L CB -0.808 41.299 42.059 0.080 0.000 0.900 3309 L HN 0.061 nan 8.230 nan 0.000 0.436 3310 K N 0.038 119.984 120.400 -0.756 0.000 2.147 3310 K HA -0.188 4.132 4.320 -0.000 0.000 0.205 3310 K C 0.904 177.179 176.600 -0.542 0.000 1.049 3310 K CA 1.545 57.256 56.287 -0.961 0.000 0.936 3310 K CB 0.105 32.228 32.500 -0.628 0.000 0.722 3310 K HN 0.226 nan 8.250 nan 0.000 0.446 3311 D N -0.433 119.680 120.400 -0.480 0.000 2.363 3311 D HA 0.068 4.708 4.640 -0.000 0.000 0.214 3311 D C -0.555 175.468 176.300 -0.462 0.000 1.093 3311 D CA 0.185 53.944 54.000 -0.401 0.000 0.837 3311 D CB 0.416 41.007 40.800 -0.350 0.000 0.948 3311 D HN 0.114 nan 8.370 nan 0.000 0.507 3312 N N 0.390 118.764 118.700 -0.543 0.000 2.642 3312 N HA 0.109 4.849 4.740 -0.000 0.000 0.308 3312 N C -2.122 173.209 175.510 -0.298 0.000 1.914 3312 N CA -0.908 51.851 53.050 -0.486 0.000 0.893 3312 N CB 1.562 39.564 38.487 -0.809 0.000 1.322 3312 N HN -0.006 nan 8.380 nan 0.000 0.490 3313 P HA -0.189 nan 4.420 nan 0.000 0.216 3313 P C 1.467 178.707 177.300 -0.100 0.000 1.154 3313 P CA 1.361 64.387 63.100 -0.123 0.000 0.865 3313 P CB 0.481 32.127 31.700 -0.091 0.000 0.789 3314 E N -0.562 119.581 120.200 -0.094 0.000 2.026 3314 E HA -0.195 4.155 4.350 -0.000 0.000 0.206 3314 E C 1.853 178.430 176.600 -0.038 0.000 1.028 3314 E CA 2.353 58.719 56.400 -0.056 0.000 0.845 3314 E CB -1.515 28.157 29.700 -0.046 0.000 0.772 3314 E HN 0.380 nan 8.360 nan 0.000 0.462 3315 T N -1.218 113.310 114.554 -0.044 0.000 3.163 3315 T HA 0.262 4.612 4.350 -0.000 0.000 0.260 3315 T C 1.608 176.279 174.700 -0.048 0.000 1.156 3315 T CA 0.755 62.858 62.100 0.007 0.000 1.072 3315 T CB 0.176 69.097 68.868 0.089 0.000 0.937 3315 T HN 0.208 nan 8.240 nan 0.000 0.528 3316 A N 2.464 125.241 122.820 -0.072 0.000 1.896 3316 A HA 0.245 4.565 4.320 -0.000 0.000 0.213 3316 A C 2.274 179.822 177.584 -0.060 0.000 1.306 3316 A CA 0.616 52.619 52.037 -0.057 0.000 0.626 3316 A CB -0.459 18.526 19.000 -0.025 0.000 0.994 3316 A HN 0.385 nan 8.150 nan 0.000 0.475 3317 K N 0.007 120.360 120.400 -0.079 0.000 2.189 3317 K HA -0.244 4.076 4.320 -0.000 0.000 0.207 3317 K C 1.937 178.523 176.600 -0.023 0.000 1.046 3317 K CA 1.849 58.093 56.287 -0.072 0.000 0.928 3317 K CB -0.112 32.351 32.500 -0.060 0.000 0.720 3317 K HN 0.663 nan 8.250 nan 0.000 0.458 3318 E N 0.423 120.620 120.200 -0.004 0.000 2.208 3318 E HA -0.118 4.232 4.350 -0.000 0.000 0.193 3318 E C 1.781 178.406 176.600 0.043 0.000 0.988 3318 E CA 0.650 57.068 56.400 0.030 0.000 0.828 3318 E CB 0.137 29.873 29.700 0.059 0.000 0.763 3318 E HN 0.314 nan 8.360 nan 0.000 0.478 3319 I N 0.589 121.172 120.570 0.023 0.000 2.480 3319 I HA -0.169 4.001 4.170 -0.000 0.000 0.251 3319 I C 2.474 178.605 176.117 0.023 0.000 1.124 3319 I CA 0.612 61.930 61.300 0.030 0.000 1.444 3319 I CB -0.215 37.779 38.000 -0.011 0.000 1.098 3319 I HN 0.159 nan 8.210 nan 0.000 0.428 3320 E N 1.910 122.113 120.200 0.004 0.000 2.045 3320 E HA -0.386 3.964 4.350 -0.000 0.000 0.212 3320 E C 2.133 178.751 176.600 0.031 0.000 1.039 3320 E CA 2.360 58.772 56.400 0.019 0.000 0.860 3320 E CB -0.082 29.623 29.700 0.008 0.000 0.776 3320 E HN 0.221 nan 8.360 nan 0.000 0.467 3321 K N 0.461 120.878 120.400 0.027 0.000 2.034 3321 K HA -0.185 4.135 4.320 -0.000 0.000 0.214 3321 K C 1.982 178.600 176.600 0.030 0.000 1.051 3321 K CA 2.188 58.492 56.287 0.028 0.000 0.931 3321 K CB -0.005 32.510 32.500 0.025 0.000 0.715 3321 K HN 0.047 nan 8.250 nan 0.000 0.446 3322 K N 0.006 120.428 120.400 0.037 0.000 2.574 3322 K HA -0.042 4.278 4.320 -0.000 0.000 0.193 3322 K C 1.560 178.183 176.600 0.039 0.000 1.035 3322 K CA 0.699 57.011 56.287 0.042 0.000 0.982 3322 K CB 0.323 32.857 32.500 0.056 0.000 0.795 3322 K HN 0.079 nan 8.250 nan 0.000 0.491 3323 V N 0.279 120.214 119.914 0.036 0.000 2.672 3323 V HA -0.044 4.076 4.120 -0.000 0.000 0.242 3323 V C 2.035 178.144 176.094 0.025 0.000 1.059 3323 V CA 0.664 62.983 62.300 0.032 0.000 1.081 3323 V CB -0.263 31.580 31.823 0.033 0.000 0.752 3323 V HN 0.192 nan 8.190 nan 0.000 0.472 3324 R N 0.361 120.876 120.500 0.024 0.000 2.139 3324 R HA -0.205 4.135 4.340 -0.000 0.000 0.243 3324 R C 2.194 178.503 176.300 0.015 0.000 1.145 3324 R CA 1.739 57.849 56.100 0.017 0.000 0.976 3324 R CB -0.202 30.109 30.300 0.017 0.000 0.866 3324 R HN 0.595 nan 8.270 nan 0.000 0.449 3325 E N 0.201 120.413 120.200 0.019 0.000 2.208 3325 E HA -0.096 4.254 4.350 -0.000 0.000 0.193 3325 E C 1.450 178.060 176.600 0.017 0.000 0.988 3325 E CA 0.658 57.068 56.400 0.017 0.000 0.828 3325 E CB 0.177 29.889 29.700 0.020 0.000 0.763 3325 E HN 0.257 nan 8.360 nan 0.000 0.478 3326 L N 0.023 121.258 121.223 0.021 0.000 2.607 3326 L HA 0.116 4.456 4.340 -0.000 0.000 0.228 3326 L C 0.923 177.804 176.870 0.019 0.000 1.123 3326 L CA 0.196 55.049 54.840 0.021 0.000 0.890 3326 L CB 0.596 42.671 42.059 0.026 0.000 1.103 3326 L HN 0.058 nan 8.230 nan 0.000 0.468 3327 L N -1.090 120.143 121.223 0.016 0.000 3.521 3327 L HA 0.296 4.636 4.340 -0.000 0.000 0.323 3327 L C -0.878 175.996 176.870 0.007 0.000 1.268 3327 L CA 0.013 54.861 54.840 0.013 0.000 1.064 3327 L CB 0.894 42.961 42.059 0.014 0.000 1.455 3327 L HN -0.001 nan 8.230 nan 0.000 0.622 3328 L N 0.000 121.226 121.223 0.006 0.000 2.949 3328 L HA 0.000 4.340 4.340 -0.000 0.000 0.249 3328 L CA 0.000 54.840 54.840 0.001 0.000 0.813 3328 L CB 0.000 42.057 42.059 -0.004 0.000 0.961 3328 L HN 0.000 nan 8.230 nan 0.000 0.502