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_C 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 -0.012 0.000 1.182 37 V CA 0.000 62.295 62.300 -0.009 0.000 1.235 37 V CB 0.000 31.819 31.823 -0.007 0.000 1.184 38 E N 1.255 121.448 120.200 -0.013 0.000 2.331 38 E HA 0.636 4.986 4.350 -0.000 0.000 0.272 38 E C -0.802 175.785 176.600 -0.021 0.000 1.036 38 E CA 0.290 56.680 56.400 -0.017 0.000 0.864 38 E CB 1.571 31.262 29.700 -0.016 0.000 1.035 38 E HN 0.942 nan 8.360 nan 0.000 0.408 39 T N 0.278 114.815 114.554 -0.028 0.000 2.916 39 T HA 0.495 4.845 4.350 -0.000 0.000 0.298 39 T C -0.329 174.342 174.700 -0.047 0.000 1.031 39 T CA -0.884 61.195 62.100 -0.036 0.000 0.993 39 T CB 0.973 69.818 68.868 -0.038 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 -0.052 0.000 2.377 40 I HA 0.381 4.551 4.170 -0.000 0.000 0.293 40 I C 0.911 176.975 176.117 -0.088 0.000 0.987 40 I CA -0.605 60.656 61.300 -0.066 0.000 1.185 40 I CB 1.671 39.637 38.000 -0.056 0.000 1.341 40 I HN 0.847 nan 8.210 nan 0.000 0.455 41 S N 3.304 118.933 115.700 -0.117 0.000 2.537 41 S HA 0.028 4.498 4.470 -0.000 0.000 0.286 41 S C 1.571 176.073 174.600 -0.163 0.000 1.299 41 S CA -0.006 58.097 58.200 -0.162 0.000 1.067 41 S CB 0.356 63.422 63.200 -0.223 0.000 0.864 41 S HN 0.804 nan 8.310 nan 0.000 0.494 42 T N 2.628 117.080 114.554 -0.170 0.000 2.962 42 T HA 0.191 4.541 4.350 -0.000 0.000 0.270 42 T C 1.577 176.164 174.700 -0.188 0.000 1.088 42 T CA 1.120 63.127 62.100 -0.155 0.000 1.127 42 T CB -0.516 68.259 68.868 -0.155 0.000 0.883 42 T HN 1.424 nan 8.240 nan 0.000 0.493 43 G N 0.527 109.172 108.800 -0.258 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 0.309 175.007 174.900 -0.337 0.000 1.023 43 G CA 0.264 45.198 45.100 -0.276 0.000 0.626 43 G HN 1.085 nan 8.290 nan 0.000 0.503 44 S N 0.590 116.058 115.700 -0.387 0.000 2.565 44 S HA 0.708 5.178 4.470 -0.000 0.000 0.290 44 S C 1.392 175.800 174.600 -0.320 0.000 1.150 44 S CA -0.326 57.607 58.200 -0.445 0.000 1.058 44 S CB 1.291 63.984 63.200 -0.846 0.000 1.032 44 S HN 0.393 nan 8.310 nan 0.000 0.510 45 L N 3.723 124.820 121.223 -0.209 0.000 2.068 45 L HA 0.021 4.361 4.340 -0.000 0.000 0.204 45 L C 2.569 179.385 176.870 -0.091 0.000 1.076 45 L CA 2.447 57.208 54.840 -0.133 0.000 0.753 45 L CB -1.528 40.524 42.059 -0.011 0.000 0.910 45 L HN 0.958 nan 8.230 nan 0.000 0.439 46 S N -1.093 114.571 115.700 -0.060 0.000 2.461 46 S HA -0.127 4.343 4.470 -0.000 0.000 0.228 46 S C 2.023 176.616 174.600 -0.012 0.000 1.005 46 S CA 0.427 58.625 58.200 -0.003 0.000 0.942 46 S CB -0.500 62.738 63.200 0.064 0.000 0.776 46 S HN 0.402 nan 8.310 nan 0.000 0.514 47 L N 1.579 122.756 121.223 -0.076 0.000 2.017 47 L HA -0.138 4.202 4.340 -0.000 0.000 0.208 47 L C 1.830 178.669 176.870 -0.052 0.000 1.073 47 L CA 1.942 56.749 54.840 -0.055 0.000 0.745 47 L CB -0.525 41.458 42.059 -0.127 0.000 0.894 47 L HN 0.194 nan 8.230 nan 0.000 0.432 48 D N 0.003 120.351 120.400 -0.087 0.000 2.149 48 D HA -0.213 4.427 4.640 -0.000 0.000 0.198 48 D C 2.130 178.406 176.300 -0.041 0.000 0.990 48 D CA 1.423 55.379 54.000 -0.074 0.000 0.839 48 D CB -0.148 40.590 40.800 -0.105 0.000 0.948 48 D HN 0.360 nan 8.370 nan 0.000 0.460 49 I N 0.663 121.216 120.570 -0.028 0.000 2.202 49 I HA -0.226 3.944 4.170 -0.000 0.000 0.242 49 I C 2.279 178.401 176.117 0.009 0.000 1.091 49 I CA 1.158 62.455 61.300 -0.004 0.000 1.368 49 I CB -0.128 37.877 38.000 0.009 0.000 1.058 49 I HN -0.041 nan 8.210 nan 0.000 0.410 50 A N 0.087 122.916 122.820 0.016 0.000 2.067 50 A HA -0.006 4.314 4.320 -0.000 0.000 0.217 50 A C 2.231 179.826 177.584 0.018 0.000 1.156 50 A CA 0.716 52.770 52.037 0.029 0.000 0.683 50 A CB -0.568 18.459 19.000 0.045 0.000 0.808 50 A HN 0.358 nan 8.150 nan 0.000 0.455 51 L N -1.301 119.923 121.223 0.003 0.000 2.131 51 L HA -0.045 4.294 4.340 -0.000 0.000 0.210 51 L C 2.125 178.994 176.870 -0.003 0.000 1.092 51 L CA 1.250 56.087 54.840 -0.006 0.000 0.759 51 L CB -0.235 41.812 42.059 -0.020 0.000 0.903 51 L HN 0.591 nan 8.230 nan 0.000 0.435 52 G N -1.616 107.183 108.800 -0.001 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 0.823 175.720 174.900 -0.005 0.000 0.982 52 G CA 0.505 45.607 45.100 0.002 0.000 0.632 52 G HN 0.515 nan 8.290 nan 0.000 0.529 53 A N -0.216 122.597 122.820 -0.013 0.000 2.324 53 A HA 0.644 4.964 4.320 -0.000 0.000 0.220 53 A C 2.253 179.820 177.584 -0.028 0.000 1.209 53 A CA 1.624 53.650 52.037 -0.018 0.000 0.918 53 A CB -0.037 18.951 19.000 -0.019 0.000 0.959 53 A HN 2.342 nan 8.150 nan 0.000 0.507 54 G N -1.112 107.668 108.800 -0.035 0.000 2.272 54 G HA2 0.327 4.287 3.960 -0.000 0.000 0.280 54 G HA3 0.327 4.287 3.960 -0.000 0.000 0.280 54 G C 0.947 175.808 174.900 -0.065 0.000 1.067 54 G CA 0.674 45.743 45.100 -0.051 0.000 0.902 54 G HN 2.284 nan 8.290 nan 0.000 0.500 55 G N -1.747 107.016 108.800 -0.061 0.000 2.357 55 G HA2 0.421 4.381 3.960 -0.000 0.000 0.289 55 G HA3 0.421 4.381 3.960 -0.000 0.000 0.289 55 G C -0.824 174.047 174.900 -0.048 0.000 1.302 55 G CA -0.559 44.501 45.100 -0.067 0.000 0.936 55 G HN 0.993 nan 8.290 nan 0.000 0.513 56 L N 1.488 122.684 121.223 -0.046 0.000 2.257 56 L HA 0.378 4.718 4.340 -0.000 0.000 0.290 56 L C -2.068 174.788 176.870 -0.024 0.000 1.044 56 L CA -1.704 53.117 54.840 -0.031 0.000 0.810 56 L CB 1.710 43.753 42.059 -0.027 0.000 1.193 56 L HN 0.201 nan 8.230 nan 0.000 0.425 57 P HA -0.082 nan 4.420 nan 0.000 0.251 57 P C -0.132 177.164 177.300 -0.007 0.000 1.154 57 P CA 0.532 63.624 63.100 -0.013 0.000 0.805 57 P CB 0.130 31.824 31.700 -0.010 0.000 0.759 58 M N 2.784 122.378 119.600 -0.009 0.000 2.248 58 M HA 0.117 4.597 4.480 -0.000 0.000 0.345 58 M C 1.644 177.945 176.300 0.001 0.000 1.243 58 M CA 1.146 56.443 55.300 -0.005 0.000 1.090 58 M CB -0.528 32.066 32.600 -0.009 0.000 1.683 58 M HN 0.782 nan 8.290 nan 0.000 0.450 59 G N 2.864 111.669 108.800 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 0.142 175.055 174.900 0.023 0.000 0.982 59 G CA -0.263 44.845 45.100 0.014 0.000 0.641 59 G HN 0.550 nan 8.290 nan 0.000 0.527 60 R N -0.643 119.872 120.500 0.025 0.000 2.919 60 R HA 0.754 5.094 4.340 -0.000 0.000 0.260 60 R C -0.074 176.262 176.300 0.060 0.000 1.067 60 R CA -1.154 54.967 56.100 0.035 0.000 1.003 60 R CB 0.873 31.184 30.300 0.018 0.000 1.192 60 R HN 0.199 nan 8.270 nan 0.000 0.488 61 I N 0.953 121.571 120.570 0.080 0.000 2.353 61 I HA 0.252 4.422 4.170 -0.000 0.000 0.293 61 I C -0.445 175.726 176.117 0.090 0.000 0.992 61 I CA -0.656 60.721 61.300 0.127 0.000 1.268 61 I CB 1.627 39.727 38.000 0.166 0.000 1.387 61 I HN -0.006 nan 8.210 nan 0.000 0.478 62 V N 6.505 126.487 119.914 0.114 0.000 2.483 62 V HA 0.300 4.420 4.120 -0.000 0.000 0.297 62 V C -0.305 175.848 176.094 0.098 0.000 1.027 62 V CA -0.643 61.695 62.300 0.064 0.000 0.855 62 V CB 1.805 33.650 31.823 0.035 0.000 0.995 62 V HN 0.676 nan 8.190 nan 0.000 0.424 63 E N 4.818 125.035 120.200 0.029 0.000 2.151 63 E HA 0.583 4.933 4.350 -0.000 0.000 0.275 63 E C -1.329 175.269 176.600 -0.003 0.000 0.936 63 E CA -0.574 55.840 56.400 0.023 0.000 0.777 63 E CB 1.448 31.090 29.700 -0.097 0.000 1.108 63 E HN 0.631 nan 8.360 nan 0.000 0.401 64 I N 6.735 127.351 120.570 0.075 0.000 2.382 64 I HA 0.288 4.458 4.170 -0.000 0.000 0.285 64 I C -0.632 175.612 176.117 0.210 0.000 1.007 64 I CA -0.711 60.660 61.300 0.119 0.000 1.142 64 I CB 0.688 38.753 38.000 0.109 0.000 1.289 64 I HN 0.509 nan 8.210 nan 0.000 0.453 65 Y N 4.511 124.825 120.300 0.024 0.000 2.562 65 Y HA 0.976 5.526 4.550 -0.000 0.000 0.343 65 Y C -0.060 175.847 175.900 0.012 0.000 1.025 65 Y CA -1.087 57.023 58.100 0.016 0.000 1.082 65 Y CB 2.491 40.952 38.460 0.002 0.000 1.264 65 Y HN 0.603 nan 8.280 nan 0.000 0.478 66 G N 1.408 110.171 108.800 -0.062 0.000 2.358 66 G HA2 0.269 4.229 3.960 -0.000 0.000 0.303 66 G HA3 0.269 4.229 3.960 -0.000 0.000 0.303 66 G C -3.514 171.326 174.900 -0.100 0.000 1.537 66 G CA -1.394 43.600 45.100 -0.177 0.000 0.928 66 G HN 0.464 nan 8.290 nan 0.000 0.656 67 P HA 0.095 nan 4.420 nan 0.000 0.265 67 P C 0.631 177.909 177.300 -0.037 0.000 1.167 67 P CA 0.552 63.611 63.100 -0.068 0.000 0.760 67 P CB 0.298 31.959 31.700 -0.065 0.000 0.783 68 E N 1.170 121.354 120.200 -0.027 0.000 2.425 68 E HA 0.108 4.458 4.350 -0.000 0.000 0.258 68 E C -0.307 176.282 176.600 -0.018 0.000 1.151 68 E CA -0.468 55.924 56.400 -0.015 0.000 0.958 68 E CB -0.193 29.499 29.700 -0.014 0.000 0.968 68 E HN 0.255 nan 8.360 nan 0.000 0.451 69 S N 0.257 115.947 115.700 -0.017 0.000 3.550 69 S HA -0.175 4.295 4.470 -0.000 0.000 0.372 69 S C 0.361 174.947 174.600 -0.023 0.000 0.966 69 S CA 0.897 59.080 58.200 -0.029 0.000 1.229 69 S CB -1.784 61.392 63.200 -0.040 0.000 0.917 69 S HN 0.756 nan 8.310 nan 0.000 0.496 70 S N -1.128 114.566 115.700 -0.010 0.000 2.666 70 S HA 0.535 5.005 4.470 -0.000 0.000 0.239 70 S C 1.176 175.781 174.600 0.008 0.000 1.031 70 S CA 0.548 58.742 58.200 -0.010 0.000 1.015 70 S CB 1.123 64.314 63.200 -0.016 0.000 0.981 70 S HN 2.007 nan 8.310 nan 0.000 0.547 71 G N 1.553 110.370 108.800 0.027 0.000 2.148 71 G HA2 -0.251 3.709 3.960 -0.000 0.000 0.203 71 G HA3 -0.251 3.709 3.960 -0.000 0.000 0.203 71 G C 0.612 175.569 174.900 0.096 0.000 0.993 71 G CA 0.273 45.414 45.100 0.069 0.000 0.661 71 G HN 0.432 nan 8.290 nan 0.000 0.518 72 K N -0.243 120.202 120.400 0.076 0.000 2.001 72 K HA -0.076 4.244 4.320 -0.000 0.000 0.214 72 K C 2.656 179.314 176.600 0.098 0.000 1.050 72 K CA 2.418 58.758 56.287 0.087 0.000 0.934 72 K CB -0.354 32.189 32.500 0.071 0.000 0.718 72 K HN 0.266 nan 8.250 nan 0.000 0.443 73 T N 0.035 114.649 114.554 0.099 0.000 2.867 73 T HA -0.091 4.259 4.350 -0.000 0.000 0.268 73 T C 1.559 176.328 174.700 0.115 0.000 1.057 73 T CA 1.664 63.834 62.100 0.116 0.000 1.136 73 T CB -0.247 68.696 68.868 0.126 0.000 0.874 73 T HN 0.386 nan 8.240 nan 0.000 0.466 74 T N 2.444 117.085 114.554 0.144 0.000 2.643 74 T HA -0.032 4.318 4.350 -0.000 0.000 0.264 74 T C 1.893 176.634 174.700 0.070 0.000 1.045 74 T CA 1.014 63.193 62.100 0.132 0.000 1.155 74 T CB -0.648 68.342 68.868 0.202 0.000 0.863 74 T HN 0.230 nan 8.240 nan 0.000 0.420 75 L N 0.487 121.771 121.223 0.103 0.000 2.013 75 L HA -0.227 4.113 4.340 -0.000 0.000 0.212 75 L C 2.658 179.549 176.870 0.035 0.000 1.073 75 L CA 1.633 56.520 54.840 0.077 0.000 0.753 75 L CB -0.784 41.349 42.059 0.124 0.000 0.890 75 L HN 0.310 nan 8.230 nan 0.000 0.432 76 T N 0.117 114.703 114.554 0.053 0.000 2.580 76 T HA -0.254 4.096 4.350 -0.000 0.000 0.265 76 T C 1.692 176.399 174.700 0.012 0.000 1.063 76 T CA 1.901 64.029 62.100 0.047 0.000 1.170 76 T CB -0.349 68.573 68.868 0.089 0.000 0.863 76 T HN 0.180 nan 8.240 nan 0.000 0.418 77 L N 1.300 122.519 121.223 -0.006 0.000 2.447 77 L HA -0.061 4.279 4.340 -0.000 0.000 0.225 77 L C 2.586 179.402 176.870 -0.091 0.000 1.148 77 L CA 1.316 56.111 54.840 -0.076 0.000 0.808 77 L CB -0.526 41.455 42.059 -0.129 0.000 0.928 77 L HN 0.227 nan 8.230 nan 0.000 0.448 78 Q N -1.069 118.691 119.800 -0.067 0.000 2.212 78 Q HA -0.030 4.310 4.340 -0.000 0.000 0.199 78 Q C 2.366 178.315 176.000 -0.085 0.000 0.950 78 Q CA 1.565 57.320 55.803 -0.081 0.000 0.863 78 Q CB -0.004 28.691 28.738 -0.071 0.000 0.944 78 Q HN 0.579 nan 8.270 nan 0.000 0.465 79 V N -2.147 117.727 119.914 -0.067 0.000 2.591 79 V HA -0.090 4.030 4.120 -0.000 0.000 0.249 79 V C 2.100 178.158 176.094 -0.061 0.000 1.053 79 V CA 0.978 63.237 62.300 -0.068 0.000 1.068 79 V CB -0.746 31.047 31.823 -0.050 0.000 0.689 79 V HN 0.140 nan 8.190 nan 0.000 0.462 80 I N 1.233 121.771 120.570 -0.054 0.000 2.493 80 I HA -0.105 4.065 4.170 -0.000 0.000 0.254 80 I C 2.854 178.929 176.117 -0.070 0.000 1.160 80 I CA 1.336 62.603 61.300 -0.055 0.000 1.445 80 I CB -0.649 37.316 38.000 -0.059 0.000 1.086 80 I HN 0.392 nan 8.210 nan 0.000 0.433 81 A N 1.178 123.948 122.820 -0.082 0.000 1.832 81 A HA -0.071 4.249 4.320 -0.000 0.000 0.214 81 A C 2.603 180.140 177.584 -0.077 0.000 1.204 81 A CA 1.600 53.587 52.037 -0.083 0.000 0.606 81 A CB -0.967 17.978 19.000 -0.091 0.000 0.849 81 A HN 0.368 nan 8.150 nan 0.000 0.445 82 A N -0.375 122.391 122.820 -0.090 0.000 1.978 82 A HA 0.115 4.435 4.320 -0.000 0.000 0.220 82 A C 2.380 179.916 177.584 -0.079 0.000 1.170 82 A CA 2.272 54.249 52.037 -0.100 0.000 0.636 82 A CB -0.812 18.107 19.000 -0.136 0.000 0.810 82 A HN 1.072 nan 8.150 nan 0.000 0.448 83 A N -1.670 121.110 122.820 -0.067 0.000 1.975 83 A HA 0.010 4.330 4.320 -0.000 0.000 0.215 83 A C 2.042 179.600 177.584 -0.044 0.000 1.170 83 A CA 1.554 53.560 52.037 -0.052 0.000 0.656 83 A CB -0.307 18.666 19.000 -0.045 0.000 0.821 83 A HN 0.454 nan 8.150 nan 0.000 0.449 84 Q N -0.242 119.530 119.800 -0.047 0.000 2.291 84 Q HA 0.001 4.341 4.340 -0.000 0.000 0.205 84 Q C 1.757 177.734 176.000 -0.037 0.000 0.970 84 Q CA 1.133 56.911 55.803 -0.042 0.000 0.876 84 Q CB -0.215 28.493 28.738 -0.050 0.000 0.935 84 Q HN 0.576 nan 8.270 nan 0.000 0.455 85 R N -0.029 120.446 120.500 -0.041 0.000 2.555 85 R HA 0.120 4.459 4.340 -0.000 0.000 0.272 85 R C -0.288 175.993 176.300 -0.032 0.000 1.089 85 R CA 0.245 56.324 56.100 -0.035 0.000 1.126 85 R CB 0.218 30.496 30.300 -0.037 0.000 1.250 85 R HN 0.108 nan 8.270 nan 0.000 0.551 86 E N -1.513 118.668 120.200 -0.031 0.000 3.293 86 E HA 0.150 4.500 4.350 -0.000 0.000 0.174 86 E C 0.312 176.899 176.600 -0.022 0.000 0.958 86 E CA 0.218 56.601 56.400 -0.027 0.000 1.352 86 E CB 1.275 30.956 29.700 -0.033 0.000 1.066 86 E HN 0.451 nan 8.360 nan 0.000 0.448 87 G N 2.217 111.005 108.800 -0.020 0.000 5.155 87 G HA2 -0.384 3.576 3.960 -0.000 0.000 0.239 87 G HA3 -0.384 3.576 3.960 -0.000 0.000 0.239 87 G C 0.145 175.036 174.900 -0.015 0.000 1.409 87 G CA 0.100 45.191 45.100 -0.015 0.000 0.927 87 G HN 0.209 nan 8.290 nan 0.000 0.710 88 K N 3.305 123.696 120.400 -0.016 0.000 4.321 88 K HA -0.124 4.196 4.320 -0.000 0.000 0.255 88 K C 1.030 177.622 176.600 -0.013 0.000 0.855 88 K CA 1.544 57.822 56.287 -0.015 0.000 0.904 88 K CB -1.889 30.599 32.500 -0.020 0.000 1.921 88 K HN 1.220 nan 8.250 nan 0.000 0.419 89 T N -0.771 113.779 114.554 -0.007 0.000 2.930 89 T HA 0.207 4.557 4.350 -0.000 0.000 0.306 89 T C 0.644 175.344 174.700 -0.001 0.000 1.045 89 T CA -0.800 61.297 62.100 -0.004 0.000 1.134 89 T CB 0.807 69.675 68.868 0.001 0.000 0.961 89 T HN 0.454 nan 8.240 nan 0.000 0.545 90 C N 2.362 121.663 119.300 0.001 0.000 2.614 90 C HA 0.888 5.348 4.460 -0.000 0.000 0.320 90 C C 0.496 175.504 174.990 0.031 0.000 1.200 90 C CA -0.631 58.392 59.018 0.009 0.000 1.700 90 C CB 1.166 28.907 27.740 0.001 0.000 2.275 90 C HN 1.220 nan 8.230 nan 0.000 0.492 91 A N 1.763 124.607 122.820 0.041 0.000 2.342 91 A HA 0.825 5.145 4.320 -0.000 0.000 0.323 91 A C -1.218 176.437 177.584 0.119 0.000 1.125 91 A CA -0.232 51.842 52.037 0.062 0.000 0.785 91 A CB 0.669 19.679 19.000 0.017 0.000 1.221 91 A HN 0.798 nan 8.150 nan 0.000 0.463 92 F N 4.715 124.638 119.950 -0.045 0.000 2.434 92 F HA 0.457 4.984 4.527 -0.000 0.000 0.367 92 F C -0.579 175.200 175.800 -0.034 0.000 1.093 92 F CA -1.287 56.681 58.000 -0.053 0.000 1.085 92 F CB 0.906 39.873 39.000 -0.055 0.000 1.322 92 F HN 0.404 nan 8.300 nan 0.000 0.452 93 I N 4.121 124.449 120.570 -0.404 0.000 2.347 93 I HA 0.138 4.308 4.170 -0.000 0.000 0.294 93 I C -0.267 175.530 176.117 -0.533 0.000 1.090 93 I CA -0.055 61.035 61.300 -0.350 0.000 1.314 93 I CB 0.134 37.957 38.000 -0.296 0.000 1.423 93 I HN 0.487 nan 8.210 nan 0.000 0.503 94 D N 5.230 125.424 120.400 -0.344 0.000 2.381 94 D HA 0.609 5.249 4.640 -0.000 0.000 0.235 94 D C 0.354 176.546 176.300 -0.179 0.000 1.068 94 D CA -0.395 53.432 54.000 -0.288 0.000 0.832 94 D CB 1.810 42.673 40.800 0.106 0.000 1.101 94 D HN 0.590 nan 8.370 nan 0.000 0.515 95 A N 3.801 126.485 122.820 -0.227 0.000 2.456 95 A HA 0.122 4.442 4.320 -0.000 0.000 0.237 95 A C 1.491 178.846 177.584 -0.383 0.000 1.217 95 A CA -0.214 51.670 52.037 -0.255 0.000 0.962 95 A CB 0.192 19.186 19.000 -0.009 0.000 1.079 95 A HN 0.529 nan 8.150 nan 0.000 0.536 96 E N 0.123 120.186 120.200 -0.229 0.000 2.158 96 E HA -0.059 4.291 4.350 -0.000 0.000 0.191 96 E C -0.412 176.188 176.600 0.000 0.000 0.982 96 E CA 0.765 57.115 56.400 -0.084 0.000 0.823 96 E CB -0.328 29.389 29.700 0.030 0.000 0.766 96 E HN 0.793 nan 8.360 nan 0.000 0.468 97 H N -1.206 117.988 119.070 0.205 0.000 2.770 97 H HA -0.204 4.352 4.556 -0.000 0.000 0.309 97 H C 0.677 176.214 175.328 0.349 0.000 1.206 97 H CA 0.031 56.230 56.048 0.250 0.000 1.147 97 H CB -1.464 28.330 29.762 0.054 0.000 1.422 97 H HN 0.274 nan 8.280 nan 0.000 0.420 98 A N 0.682 123.778 122.820 0.460 0.000 2.984 98 A HA 0.492 4.812 4.320 -0.000 0.000 0.212 98 A C 0.943 178.703 177.584 0.292 0.000 2.164 98 A CA 0.139 52.366 52.037 0.316 0.000 0.982 98 A CB -0.105 19.011 19.000 0.193 0.000 1.352 98 A HN 0.813 nan 8.150 nan 0.000 0.491 99 L N 0.531 121.831 121.223 0.127 0.000 3.319 99 L HA -0.169 4.171 4.340 -0.000 0.000 0.534 99 L C -1.261 175.563 176.870 -0.077 0.000 1.001 99 L CA 0.660 55.433 54.840 -0.113 0.000 1.233 99 L CB -1.277 40.447 42.059 -0.559 0.000 1.030 99 L HN 0.545 nan 8.230 nan 0.000 0.588 100 D N 8.145 128.542 120.400 -0.005 0.000 2.380 100 D HA 0.358 4.998 4.640 -0.000 0.000 0.230 100 D C -1.356 174.942 176.300 -0.004 0.000 1.154 100 D CA -1.704 52.323 54.000 0.045 0.000 0.859 100 D CB 1.147 42.002 40.800 0.090 0.000 1.045 100 D HN 0.446 nan 8.370 nan 0.000 0.495 101 P HA -0.203 nan 4.420 nan 0.000 0.217 101 P C 1.540 178.827 177.300 -0.022 0.000 1.151 101 P CA 0.918 63.984 63.100 -0.057 0.000 0.849 101 P CB 0.398 32.105 31.700 0.011 0.000 0.787 102 I N -1.479 119.111 120.570 0.033 0.000 2.233 102 I HA -0.207 3.963 4.170 -0.000 0.000 0.243 102 I C 2.741 178.900 176.117 0.070 0.000 1.093 102 I CA 1.226 62.555 61.300 0.047 0.000 1.380 102 I CB -1.944 36.095 38.000 0.066 0.000 1.067 102 I HN -0.066 nan 8.210 nan 0.000 0.413 103 Y N 2.213 122.492 120.300 -0.036 0.000 2.207 103 Y HA -0.265 4.285 4.550 -0.000 0.000 0.287 103 Y C 2.675 178.542 175.900 -0.056 0.000 1.156 103 Y CA 1.924 60.001 58.100 -0.040 0.000 1.182 103 Y CB 0.016 38.448 38.460 -0.047 0.000 0.979 103 Y HN 0.139 nan 8.280 nan 0.000 0.521 104 A N 0.507 123.253 122.820 -0.123 0.000 1.877 104 A HA -0.233 4.087 4.320 -0.000 0.000 0.216 104 A C 2.261 179.732 177.584 -0.188 0.000 1.186 104 A CA 1.825 53.728 52.037 -0.223 0.000 0.620 104 A CB -0.819 18.056 19.000 -0.208 0.000 0.822 104 A HN 0.545 nan 8.150 nan 0.000 0.443 105 R N -0.262 120.170 120.500 -0.114 0.000 2.091 105 R HA -0.140 4.200 4.340 -0.000 0.000 0.238 105 R C 1.962 178.211 176.300 -0.084 0.000 1.136 105 R CA 1.951 58.002 56.100 -0.081 0.000 0.959 105 R CB -0.181 30.095 30.300 -0.040 0.000 0.856 105 R HN 0.513 nan 8.270 nan 0.000 0.437 106 K N -0.158 120.187 120.400 -0.092 0.000 2.366 106 K HA -0.007 4.313 4.320 -0.000 0.000 0.198 106 K C 1.811 178.334 176.600 -0.128 0.000 1.044 106 K CA 0.521 56.762 56.287 -0.077 0.000 0.973 106 K CB 0.178 32.663 32.500 -0.026 0.000 0.767 106 K HN 0.198 nan 8.250 nan 0.000 0.475 107 L N -0.513 120.573 121.223 -0.229 0.000 2.240 107 L HA 0.006 4.346 4.340 -0.000 0.000 0.211 107 L C 0.967 177.756 176.870 -0.135 0.000 1.106 107 L CA 0.782 55.484 54.840 -0.230 0.000 0.793 107 L CB 0.132 41.973 42.059 -0.363 0.000 0.927 107 L HN 0.444 nan 8.230 nan 0.000 0.446 108 G N -0.072 108.657 108.800 -0.119 0.000 2.186 108 G HA2 -0.152 3.808 3.960 -0.000 0.000 0.130 108 G HA3 -0.152 3.808 3.960 -0.000 0.000 0.130 108 G C -0.318 174.532 174.900 -0.084 0.000 1.031 108 G CA -0.377 44.675 45.100 -0.080 0.000 0.697 108 G HN -0.003 nan 8.290 nan 0.000 0.494 109 V N 0.582 120.434 119.914 -0.104 0.000 2.439 109 V HA 0.453 4.573 4.120 -0.000 0.000 0.282 109 V C 0.367 176.411 176.094 -0.083 0.000 1.039 109 V CA -0.866 61.373 62.300 -0.102 0.000 0.913 109 V CB 1.849 33.588 31.823 -0.140 0.000 0.983 109 V HN 0.308 nan 8.190 nan 0.000 0.460 110 D N 4.042 124.403 120.400 -0.066 0.000 2.398 110 D HA 0.090 4.730 4.640 -0.000 0.000 0.250 110 D C 1.026 177.292 176.300 -0.058 0.000 1.287 110 D CA -0.075 53.894 54.000 -0.051 0.000 0.992 110 D CB 0.542 41.319 40.800 -0.037 0.000 1.071 110 D HN 0.296 nan 8.370 nan 0.000 0.514 111 I N 2.520 123.052 120.570 -0.064 0.000 2.252 111 I HA -0.224 3.946 4.170 -0.000 0.000 0.245 111 I C 1.403 177.496 176.117 -0.041 0.000 1.102 111 I CA 0.979 62.235 61.300 -0.073 0.000 1.385 111 I CB -0.739 37.216 38.000 -0.075 0.000 1.064 111 I HN 0.295 nan 8.210 nan 0.000 0.414 112 D N 0.361 120.746 120.400 -0.024 0.000 2.354 112 D HA -0.162 4.478 4.640 -0.000 0.000 0.216 112 D C 1.446 177.743 176.300 -0.005 0.000 0.970 112 D CA 0.812 54.807 54.000 -0.007 0.000 0.905 112 D CB -0.277 40.521 40.800 -0.004 0.000 0.903 112 D HN 0.291 nan 8.370 nan 0.000 0.508 113 N N 0.147 118.839 118.700 -0.013 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 -0.010 0.000 1.294 113 N CA -0.128 52.917 53.050 -0.008 0.000 0.891 113 N CB 0.631 39.112 38.487 -0.011 0.000 1.238 113 N HN 0.080 nan 8.380 nan 0.000 0.508 114 L N 1.877 123.092 121.223 -0.013 0.000 2.334 114 L HA 0.559 4.899 4.340 -0.000 0.000 0.276 114 L C -0.726 176.158 176.870 0.023 0.000 1.014 114 L CA -0.540 54.291 54.840 -0.014 0.000 0.815 114 L CB 2.028 44.047 42.059 -0.066 0.000 1.268 114 L HN 0.003 nan 8.230 nan 0.000 0.428 115 L N 4.494 125.746 121.223 0.048 0.000 2.282 115 L HA 0.468 4.808 4.340 -0.000 0.000 0.288 115 L C 0.000 176.955 176.870 0.141 0.000 1.033 115 L CA -0.658 54.229 54.840 0.078 0.000 0.807 115 L CB 1.397 43.492 42.059 0.060 0.000 1.209 115 L HN 0.658 nan 8.230 nan 0.000 0.423 116 C N 0.994 120.400 119.300 0.176 0.000 2.529 116 C HA 0.841 5.301 4.460 -0.000 0.000 0.329 116 C C 0.241 175.341 174.990 0.184 0.000 1.194 116 C CA -0.505 58.682 59.018 0.282 0.000 1.779 116 C CB 1.550 29.541 27.740 0.418 0.000 2.322 116 C HN 0.822 nan 8.230 nan 0.000 0.500 117 S N 3.662 119.445 115.700 0.139 0.000 2.594 117 S HA 0.397 4.867 4.470 -0.000 0.000 0.322 117 S C -0.534 174.113 174.600 0.077 0.000 1.085 117 S CA -0.331 57.903 58.200 0.056 0.000 1.116 117 S CB 1.011 64.193 63.200 -0.031 0.000 0.979 117 S HN 0.821 nan 8.310 nan 0.000 0.465 118 Q N 2.570 122.432 119.800 0.103 0.000 3.091 118 Q HA 0.258 4.598 4.340 -0.000 0.000 0.301 118 Q C -2.443 173.636 176.000 0.131 0.000 1.337 118 Q CA -1.722 54.166 55.803 0.142 0.000 1.083 118 Q CB -0.038 28.780 28.738 0.133 0.000 1.477 118 Q HN 0.443 nan 8.270 nan 0.000 0.537 119 P HA 0.029 nan 4.420 nan 0.000 0.272 119 P C 0.530 177.926 177.300 0.162 0.000 1.240 119 P CA -0.257 62.880 63.100 0.061 0.000 0.791 119 P CB 1.086 32.785 31.700 -0.001 0.000 0.978 120 D N -0.837 119.609 120.400 0.078 0.000 2.305 120 D HA -0.010 4.630 4.640 -0.000 0.000 0.206 120 D C 0.116 176.414 176.300 -0.003 0.000 0.974 120 D CA 1.033 55.101 54.000 0.113 0.000 0.871 120 D CB 0.606 41.431 40.800 0.042 0.000 0.947 120 D HN 0.531 nan 8.370 nan 0.000 0.516 121 T N -5.472 109.004 114.554 -0.131 0.000 2.769 121 T HA 0.419 4.769 4.350 -0.000 0.000 0.306 121 T C 1.113 175.668 174.700 -0.242 0.000 1.400 121 T CA -0.205 61.707 62.100 -0.314 0.000 1.007 121 T CB 1.013 69.780 68.868 -0.169 0.000 1.392 121 T HN -0.194 nan 8.240 nan 0.000 0.500 122 G N 0.129 108.772 108.800 -0.261 0.000 2.408 122 G HA2 -0.054 3.906 3.960 -0.000 0.000 0.217 122 G HA3 -0.054 3.906 3.960 -0.000 0.000 0.217 122 G C 1.020 175.865 174.900 -0.091 0.000 1.150 122 G CA 1.029 46.043 45.100 -0.143 0.000 0.776 122 G HN 0.797 nan 8.290 nan 0.000 0.542 123 E N 0.096 120.245 120.200 -0.084 0.000 2.000 123 E HA -0.157 4.193 4.350 -0.000 0.000 0.199 123 E C 2.473 179.032 176.600 -0.068 0.000 1.011 123 E CA 1.449 57.820 56.400 -0.048 0.000 0.836 123 E CB -0.476 29.212 29.700 -0.020 0.000 0.778 123 E HN 0.531 nan 8.360 nan 0.000 0.462 124 Q N 0.066 119.814 119.800 -0.087 0.000 2.182 124 Q HA -0.335 4.005 4.340 -0.000 0.000 0.213 124 Q C 1.990 177.816 176.000 -0.291 0.000 1.000 124 Q CA 2.202 57.882 55.803 -0.206 0.000 0.889 124 Q CB -0.312 28.322 28.738 -0.173 0.000 0.932 124 Q HN 0.306 nan 8.270 nan 0.000 0.415 125 A N 0.898 123.610 122.820 -0.181 0.000 1.851 125 A HA -0.180 4.140 4.320 -0.000 0.000 0.216 125 A C 1.938 179.446 177.584 -0.127 0.000 1.195 125 A CA 1.494 53.441 52.037 -0.151 0.000 0.622 125 A CB -0.936 18.008 19.000 -0.093 0.000 0.831 125 A HN 0.509 nan 8.150 nan 0.000 0.444 126 L N -0.739 120.442 121.223 -0.070 0.000 2.786 126 L HA -0.078 4.262 4.340 -0.000 0.000 0.250 126 L C 1.735 178.594 176.870 -0.020 0.000 1.151 126 L CA 0.672 55.503 54.840 -0.014 0.000 0.910 126 L CB -0.287 41.784 42.059 0.021 0.000 1.082 126 L HN 0.574 nan 8.230 nan 0.000 0.433 127 E N -1.194 118.957 120.200 -0.081 0.000 2.441 127 E HA 0.078 4.428 4.350 -0.000 0.000 0.212 127 E C 2.019 178.569 176.600 -0.084 0.000 0.840 127 E CA -0.029 56.348 56.400 -0.037 0.000 1.143 127 E CB 0.466 30.187 29.700 0.035 0.000 1.153 127 E HN 0.383 nan 8.360 nan 0.000 0.539 128 I N 1.560 121.979 120.570 -0.251 0.000 2.286 128 I HA -0.252 3.918 4.170 -0.000 0.000 0.245 128 I C 2.629 178.698 176.117 -0.080 0.000 1.104 128 I CA 0.839 62.011 61.300 -0.214 0.000 1.397 128 I CB -0.292 37.529 38.000 -0.298 0.000 1.072 128 I HN 0.351 nan 8.210 nan 0.000 0.417 129 C N -0.494 118.754 119.300 -0.087 0.000 2.422 129 C HA -0.163 4.297 4.460 -0.000 0.000 0.279 129 C C 2.485 177.468 174.990 -0.012 0.000 1.305 129 C CA 0.534 59.515 59.018 -0.062 0.000 1.757 129 C CB -1.013 26.668 27.740 -0.099 0.000 1.962 129 C HN 0.506 nan 8.230 nan 0.000 0.499 130 D N 1.652 122.058 120.400 0.010 0.000 2.097 130 D HA -0.060 4.580 4.640 -0.000 0.000 0.197 130 D C 2.433 178.764 176.300 0.052 0.000 0.984 130 D CA 1.994 56.020 54.000 0.043 0.000 0.826 130 D CB -0.287 40.548 40.800 0.058 0.000 0.973 130 D HN 0.539 nan 8.370 nan 0.000 0.460 131 A N 0.538 123.399 122.820 0.068 0.000 1.978 131 A HA -0.114 4.206 4.320 -0.000 0.000 0.220 131 A C 2.536 180.156 177.584 0.060 0.000 1.170 131 A CA 0.944 53.035 52.037 0.090 0.000 0.636 131 A CB -0.660 18.434 19.000 0.157 0.000 0.810 131 A HN 0.348 nan 8.150 nan 0.000 0.448 132 L N -1.160 120.086 121.223 0.039 0.000 2.179 132 L HA -0.071 4.269 4.340 -0.000 0.000 0.208 132 L C 3.010 179.895 176.870 0.024 0.000 1.096 132 L CA 0.699 55.556 54.840 0.028 0.000 0.779 132 L CB -0.515 41.552 42.059 0.013 0.000 0.922 132 L HN 0.404 nan 8.230 nan 0.000 0.443 133 A N 0.446 123.281 122.820 0.026 0.000 1.908 133 A HA -0.215 4.105 4.320 -0.000 0.000 0.218 133 A C 2.419 180.021 177.584 0.029 0.000 1.181 133 A CA 1.533 53.586 52.037 0.027 0.000 0.627 133 A CB -0.440 18.582 19.000 0.036 0.000 0.818 133 A HN 0.318 nan 8.150 nan 0.000 0.445 134 R N -0.311 120.210 120.500 0.035 0.000 2.092 134 R HA -0.005 4.335 4.340 -0.000 0.000 0.231 134 R C 1.201 177.518 176.300 0.027 0.000 1.119 134 R CA 1.196 57.315 56.100 0.032 0.000 0.970 134 R CB -0.273 30.049 30.300 0.038 0.000 0.864 134 R HN 0.370 nan 8.270 nan 0.000 0.440 135 S N 0.378 116.094 115.700 0.028 0.000 2.967 135 S HA 0.110 4.580 4.470 -0.000 0.000 0.254 135 S C 1.103 175.715 174.600 0.019 0.000 1.089 135 S CA 0.379 58.594 58.200 0.024 0.000 1.183 135 S CB -0.042 63.175 63.200 0.028 0.000 0.848 135 S HN 0.662 nan 8.310 nan 0.000 0.477 136 G N 2.090 110.900 108.800 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 0.581 175.487 174.900 0.010 0.000 1.491 136 G CA 0.238 45.346 45.100 0.013 0.000 1.324 136 G HN 1.047 nan 8.290 nan 0.000 0.829 137 A N 0.110 122.936 122.820 0.010 0.000 3.245 137 A HA 0.676 4.996 4.320 -0.000 0.000 0.282 137 A C -0.195 177.394 177.584 0.008 0.000 1.417 137 A CA 0.382 52.424 52.037 0.007 0.000 1.149 137 A CB 0.378 19.381 19.000 0.006 0.000 1.155 137 A HN 1.211 nan 8.150 nan 0.000 0.602 138 V N 1.239 121.158 119.914 0.009 0.000 2.447 138 V HA 0.205 4.325 4.120 -0.000 0.000 0.292 138 V C 0.027 176.124 176.094 0.004 0.000 1.021 138 V CA -0.472 61.833 62.300 0.008 0.000 0.850 138 V CB 1.560 33.391 31.823 0.012 0.000 1.005 138 V HN 0.733 nan 8.190 nan 0.000 0.426 139 D N 2.301 122.701 120.400 0.000 0.000 2.202 139 D HA 0.054 4.694 4.640 -0.000 0.000 0.214 139 D C 0.429 176.725 176.300 -0.006 0.000 0.967 139 D CA 1.473 55.471 54.000 -0.003 0.000 0.871 139 D CB 1.228 42.024 40.800 -0.007 0.000 1.020 139 D HN 0.383 nan 8.370 nan 0.000 0.474 140 V N 1.231 121.140 119.914 -0.008 0.000 2.577 140 V HA 0.411 4.531 4.120 -0.000 0.000 0.303 140 V C -1.236 174.850 176.094 -0.014 0.000 1.042 140 V CA -0.713 61.580 62.300 -0.012 0.000 0.872 140 V CB 1.937 33.751 31.823 -0.015 0.000 0.998 140 V HN -0.081 nan 8.190 nan 0.000 0.423 141 I N 6.358 126.907 120.570 -0.034 0.000 2.412 141 I HA 0.556 4.726 4.170 -0.000 0.000 0.296 141 I C -0.752 175.300 176.117 -0.108 0.000 0.987 141 I CA -0.863 60.399 61.300 -0.064 0.000 1.180 141 I CB 2.077 40.024 38.000 -0.087 0.000 1.340 141 I HN 0.390 nan 8.210 nan 0.000 0.455 142 V N 6.920 126.769 119.914 -0.108 0.000 2.531 142 V HA 0.342 4.462 4.120 -0.000 0.000 0.301 142 V C -0.336 175.554 176.094 -0.340 0.000 1.034 142 V CA -0.620 61.588 62.300 -0.154 0.000 0.865 142 V CB 2.323 34.166 31.823 0.034 0.000 0.995 142 V HN 0.463 nan 8.190 nan 0.000 0.424 143 V N 1.800 121.454 119.914 -0.434 0.000 2.398 143 V HA 0.752 4.872 4.120 -0.000 0.000 0.286 143 V C -0.707 175.177 176.094 -0.350 0.000 1.026 143 V CA -0.528 61.484 62.300 -0.480 0.000 0.868 143 V CB 1.683 33.108 31.823 -0.663 0.000 0.982 143 V HN 0.848 nan 8.190 nan 0.000 0.443 144 D N 2.658 122.826 120.400 -0.387 0.000 2.386 144 D HA 0.562 5.202 4.640 -0.000 0.000 0.247 144 D C -0.747 175.440 176.300 -0.187 0.000 1.336 144 D CA 0.244 54.081 54.000 -0.272 0.000 0.976 144 D CB 1.818 42.366 40.800 -0.419 0.000 1.257 144 D HN 0.841 nan 8.370 nan 0.000 0.570 145 S N 2.100 117.753 115.700 -0.079 0.000 2.627 145 S HA 0.389 4.859 4.470 -0.000 0.000 0.283 145 S C 1.160 175.783 174.600 0.037 0.000 1.127 145 S CA -0.632 57.555 58.200 -0.021 0.000 0.863 145 S CB 1.385 64.591 63.200 0.010 0.000 1.121 145 S HN 0.061 nan 8.310 nan 0.000 0.479 146 V N 2.733 122.706 119.914 0.098 0.000 2.277 146 V HA -0.261 3.859 4.120 -0.000 0.000 0.253 146 V C 2.891 179.027 176.094 0.070 0.000 1.067 146 V CA 2.839 65.215 62.300 0.126 0.000 1.047 146 V CB -1.540 30.360 31.823 0.128 0.000 0.649 146 V HN 0.935 nan 8.190 nan 0.000 0.447 147 A N -0.413 122.440 122.820 0.055 0.000 1.933 147 A HA -0.018 4.302 4.320 -0.000 0.000 0.218 147 A C 2.216 179.829 177.584 0.049 0.000 1.175 147 A CA 1.924 53.986 52.037 0.042 0.000 0.628 147 A CB -0.581 18.438 19.000 0.033 0.000 0.814 147 A HN 0.668 nan 8.150 nan 0.000 0.444 148 A N -1.342 121.511 122.820 0.055 0.000 2.251 148 A HA 0.405 4.725 4.320 -0.000 0.000 0.209 148 A C 0.595 178.257 177.584 0.130 0.000 1.187 148 A CA 0.009 52.101 52.037 0.092 0.000 0.823 148 A CB -0.207 18.825 19.000 0.053 0.000 0.846 148 A HN 0.274 nan 8.150 nan 0.000 0.486 149 L N 2.655 123.920 121.223 0.069 0.000 2.416 149 L HA 0.112 4.452 4.340 -0.000 0.000 0.243 149 L C 0.845 177.714 176.870 -0.001 0.000 1.373 149 L CA 0.456 55.315 54.840 0.032 0.000 1.227 149 L CB -1.285 40.797 42.059 0.038 0.000 1.428 149 L HN 0.358 nan 8.230 nan 0.000 0.425 150 T N -0.218 114.330 114.554 -0.011 0.000 2.761 150 T HA 0.404 4.754 4.350 -0.000 0.000 0.296 150 T C -2.314 172.309 174.700 -0.128 0.000 0.934 150 T CA -1.858 60.220 62.100 -0.037 0.000 1.091 150 T CB 0.527 69.415 68.868 0.032 0.000 0.896 150 T HN 0.101 nan 8.240 nan 0.000 0.515 151 P HA 0.042 nan 4.420 nan 0.000 0.266 151 P C 0.918 178.160 177.300 -0.096 0.000 1.186 151 P CA -0.308 62.748 63.100 -0.074 0.000 0.767 151 P CB 0.610 32.289 31.700 -0.034 0.000 0.820 152 K N 2.508 122.859 120.400 -0.082 0.000 2.152 152 K HA -0.213 4.107 4.320 -0.000 0.000 0.206 152 K C 1.761 178.338 176.600 -0.039 0.000 1.048 152 K CA 1.625 57.874 56.287 -0.064 0.000 0.933 152 K CB -0.473 32.011 32.500 -0.025 0.000 0.721 152 K HN 0.481 nan 8.250 nan 0.000 0.447 153 A N 1.469 124.272 122.820 -0.028 0.000 1.851 153 A HA -0.234 4.086 4.320 -0.000 0.000 0.216 153 A C 1.918 179.497 177.584 -0.008 0.000 1.195 153 A CA 1.830 53.858 52.037 -0.015 0.000 0.622 153 A CB -0.636 18.357 19.000 -0.012 0.000 0.831 153 A HN 0.438 nan 8.150 nan 0.000 0.444 154 E N -0.557 119.644 120.200 0.001 0.000 2.085 154 E HA -0.190 4.160 4.350 -0.000 0.000 0.194 154 E C 1.950 178.547 176.600 -0.005 0.000 0.994 154 E CA 1.285 57.705 56.400 0.032 0.000 0.801 154 E CB -0.304 29.419 29.700 0.038 0.000 0.743 154 E HN 0.713 nan 8.360 nan 0.000 0.453 155 I N 0.718 121.257 120.570 -0.051 0.000 2.142 155 I HA -0.252 3.918 4.170 -0.000 0.000 0.240 155 I C 1.687 177.732 176.117 -0.120 0.000 1.078 155 I CA 1.337 62.586 61.300 -0.084 0.000 1.343 155 I CB -0.125 37.800 38.000 -0.126 0.000 1.046 155 I HN 0.005 nan 8.210 nan 0.000 0.405 156 E N 0.488 120.633 120.200 -0.090 0.000 2.403 156 E HA 0.160 4.510 4.350 -0.000 0.000 0.187 156 E C 0.424 176.980 176.600 -0.072 0.000 1.073 156 E CA 0.240 56.574 56.400 -0.109 0.000 0.888 156 E CB 0.208 29.890 29.700 -0.031 0.000 1.035 156 E HN 0.543 nan 8.360 nan 0.000 0.471 157 G N 1.749 110.517 108.800 -0.054 0.000 2.526 157 G HA2 -0.227 3.733 3.960 -0.000 0.000 0.225 157 G HA3 -0.227 3.733 3.960 -0.000 0.000 0.225 157 G C -0.440 174.459 174.900 -0.002 0.000 1.120 157 G CA -0.384 44.700 45.100 -0.026 0.000 0.904 157 G HN 0.185 nan 8.290 nan 0.000 0.498 158 E N -0.345 119.864 120.200 0.015 0.000 2.204 158 E HA 0.724 5.074 4.350 -0.000 0.000 0.276 158 E C 1.572 178.156 176.600 -0.027 0.000 0.974 158 E CA -0.767 55.631 56.400 -0.004 0.000 0.815 158 E CB 0.852 30.545 29.700 -0.011 0.000 1.119 158 E HN 0.416 nan 8.360 nan 0.000 0.393 159 I N 1.290 121.815 120.570 -0.076 0.000 3.080 159 I HA 0.498 4.668 4.170 -0.000 0.000 0.183 159 I C 0.622 176.581 176.117 -0.264 0.000 1.432 159 I CA -0.433 60.778 61.300 -0.148 0.000 0.614 159 I CB -0.183 37.764 38.000 -0.087 0.000 1.876 159 I HN 0.627 nan 8.210 nan 0.000 0.995 160 G N 1.436 110.105 108.800 -0.218 0.000 3.383 160 G HA2 -0.150 3.810 3.960 -0.000 0.000 0.685 160 G HA3 -0.150 3.810 3.960 -0.000 0.000 0.685 160 G C 0.027 174.791 174.900 -0.226 0.000 1.104 160 G CA -0.165 44.820 45.100 -0.192 0.000 0.957 160 G HN 0.721 nan 8.290 nan 0.000 0.461 161 D N 0.574 120.894 120.400 -0.134 0.000 2.360 161 D HA -0.235 4.405 4.640 -0.000 0.000 0.192 161 D C 2.323 178.579 176.300 -0.074 0.000 1.025 161 D CA 1.988 55.935 54.000 -0.089 0.000 0.903 161 D CB 0.192 40.962 40.800 -0.050 0.000 0.900 161 D HN 0.490 nan 8.370 nan 0.000 0.452 162 S N -1.458 114.196 115.700 -0.077 0.000 2.349 162 S HA -0.201 4.269 4.470 -0.000 0.000 0.216 162 S C 1.058 175.684 174.600 0.043 0.000 1.033 162 S CA 1.633 59.818 58.200 -0.025 0.000 1.021 162 S CB -0.093 63.092 63.200 -0.026 0.000 0.968 162 S HN 0.336 nan 8.310 nan 0.000 0.426 163 H N -1.056 118.004 119.070 -0.018 0.000 4.724 163 H HA -0.177 4.379 4.556 -0.000 0.000 0.121 163 H C 1.221 176.540 175.328 -0.016 0.000 0.690 163 H CA 1.937 57.974 56.048 -0.017 0.000 1.226 163 H CB -1.281 28.471 29.762 -0.018 0.000 0.763 163 H HN 0.454 nan 8.280 nan 0.000 0.515 164 M N -0.748 118.909 119.600 0.096 0.000 3.127 164 M HA 0.184 4.664 4.480 -0.000 0.000 0.228 164 M C 2.281 178.596 176.300 0.025 0.000 1.558 164 M CA 1.455 56.782 55.300 0.045 0.000 1.349 164 M CB 0.024 32.640 32.600 0.026 0.000 1.098 164 M HN 0.191 nan 8.290 nan 0.000 0.582 165 G N 1.376 110.185 108.800 0.015 0.000 2.621 165 G HA2 -0.167 3.793 3.960 -0.000 0.000 0.215 165 G HA3 -0.167 3.793 3.960 -0.000 0.000 0.215 165 G C 1.202 176.098 174.900 -0.007 0.000 1.127 165 G CA 0.627 45.727 45.100 0.000 0.000 0.747 165 G HN 0.453 nan 8.290 nan 0.000 0.561 166 L N -0.387 120.835 121.223 -0.001 0.000 2.270 166 L HA 0.126 4.466 4.340 -0.000 0.000 0.210 166 L C 3.151 180.013 176.870 -0.014 0.000 1.104 166 L CA 0.698 55.533 54.840 -0.009 0.000 0.804 166 L CB -0.159 41.898 42.059 -0.003 0.000 0.937 166 L HN 0.270 nan 8.230 nan 0.000 0.450 167 A N 0.193 123.006 122.820 -0.010 0.000 1.898 167 A HA 0.009 4.329 4.320 -0.000 0.000 0.214 167 A C 2.460 180.025 177.584 -0.033 0.000 1.183 167 A CA 1.150 53.176 52.037 -0.018 0.000 0.622 167 A CB -0.563 18.432 19.000 -0.009 0.000 0.824 167 A HN 0.307 nan 8.150 nan 0.000 0.444 168 A N -0.747 122.055 122.820 -0.030 0.000 2.186 168 A HA -0.108 4.212 4.320 -0.000 0.000 0.219 168 A C 2.139 179.692 177.584 -0.053 0.000 1.159 168 A CA 1.424 53.436 52.037 -0.042 0.000 0.680 168 A CB -0.359 18.625 19.000 -0.027 0.000 0.787 168 A HN 0.525 nan 8.150 nan 0.000 0.467 169 R N -2.082 118.391 120.500 -0.044 0.000 2.250 169 R HA 0.253 4.593 4.340 -0.000 0.000 0.194 169 R C 2.071 178.342 176.300 -0.049 0.000 0.927 169 R CA 0.536 56.609 56.100 -0.046 0.000 1.052 169 R CB -0.180 30.100 30.300 -0.034 0.000 1.055 169 R HN 0.635 nan 8.270 nan 0.000 0.537 170 M N 0.375 119.948 119.600 -0.044 0.000 2.229 170 M HA -0.135 4.345 4.480 -0.000 0.000 0.264 170 M C 1.619 177.883 176.300 -0.059 0.000 1.063 170 M CA 1.402 56.677 55.300 -0.042 0.000 1.114 170 M CB 0.159 32.739 32.600 -0.034 0.000 1.387 170 M HN 0.069 nan 8.290 nan 0.000 0.420 171 M N -0.389 119.162 119.600 -0.080 0.000 2.091 171 M HA -0.181 4.299 4.480 -0.000 0.000 0.259 171 M C 2.374 178.575 176.300 -0.165 0.000 1.076 171 M CA 1.720 56.943 55.300 -0.130 0.000 1.111 171 M CB -1.650 30.859 32.600 -0.151 0.000 1.291 171 M HN 0.327 nan 8.290 nan 0.000 0.417 172 S N -0.177 115.430 115.700 -0.155 0.000 2.444 172 S HA -0.228 4.242 4.470 -0.000 0.000 0.244 172 S C 1.631 176.149 174.600 -0.138 0.000 1.025 172 S CA 1.580 59.679 58.200 -0.169 0.000 0.995 172 S CB -0.072 63.064 63.200 -0.107 0.000 0.781 172 S HN 0.393 nan 8.310 nan 0.000 0.496 173 Q N 0.862 120.604 119.800 -0.096 0.000 1.447 173 Q HA 0.376 4.716 4.340 -0.000 0.000 0.583 173 Q C 1.653 177.624 176.000 -0.048 0.000 0.915 173 Q CA 1.300 57.069 55.803 -0.056 0.000 0.902 173 Q CB -0.549 28.167 28.738 -0.036 0.000 0.981 173 Q HN 0.393 nan 8.270 nan 0.000 0.359 174 A N 0.076 122.879 122.820 -0.029 0.000 2.150 174 A HA -0.018 4.302 4.320 -0.000 0.000 0.220 174 A C 1.190 178.770 177.584 -0.007 0.000 1.356 174 A CA 0.377 52.412 52.037 -0.002 0.000 1.145 174 A CB -0.734 18.277 19.000 0.019 0.000 0.826 174 A HN 0.511 nan 8.150 nan 0.000 0.524 175 M N -0.790 118.771 119.600 -0.064 0.000 2.412 175 M HA 0.152 4.632 4.480 -0.000 0.000 0.263 175 M C 1.980 178.301 176.300 0.034 0.000 1.122 175 M CA 1.153 56.381 55.300 -0.120 0.000 1.179 175 M CB -0.258 32.101 32.600 -0.400 0.000 1.335 175 M HN 0.369 nan 8.290 nan 0.000 0.465 176 R N 0.580 121.145 120.500 0.107 0.000 2.094 176 R HA -0.204 4.136 4.340 -0.000 0.000 0.239 176 R C 2.248 178.646 176.300 0.162 0.000 1.137 176 R CA 1.809 58.084 56.100 0.292 0.000 0.943 176 R CB -0.932 29.497 30.300 0.214 0.000 0.850 176 R HN 0.470 nan 8.270 nan 0.000 0.433 177 K N 0.521 120.979 120.400 0.097 0.000 2.160 177 K HA -0.123 4.197 4.320 -0.000 0.000 0.206 177 K C 2.200 178.849 176.600 0.081 0.000 1.047 177 K CA 1.162 57.493 56.287 0.074 0.000 0.930 177 K CB -0.096 32.437 32.500 0.055 0.000 0.720 177 K HN 0.125 nan 8.250 nan 0.000 0.450 178 L N -0.194 121.087 121.223 0.095 0.000 2.102 178 L HA -0.039 4.301 4.340 -0.000 0.000 0.202 178 L C 2.439 179.381 176.870 0.120 0.000 1.076 178 L CA 0.912 55.814 54.840 0.104 0.000 0.761 178 L CB -0.430 41.700 42.059 0.119 0.000 0.921 178 L HN 0.273 nan 8.230 nan 0.000 0.444 179 A N 0.060 122.981 122.820 0.168 0.000 1.985 179 A HA -0.274 4.046 4.320 -0.000 0.000 0.223 179 A C 2.163 179.798 177.584 0.085 0.000 1.189 179 A CA 2.289 54.426 52.037 0.167 0.000 0.658 179 A CB -1.176 17.966 19.000 0.236 0.000 0.820 179 A HN 0.523 nan 8.150 nan 0.000 0.464 180 G N -1.669 107.174 108.800 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 1.117 176.042 174.900 0.041 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 -0.097 118.633 118.700 0.050 0.000 2.575 181 N HA 0.159 4.899 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 0.038 53.114 53.050 0.043 0.000 0.897 181 N CB 0.092 38.608 38.487 0.048 0.000 0.990 181 N HN 0.294 nan 8.380 nan 0.000 0.449 182 L N -0.586 120.662 121.223 0.041 0.000 2.515 182 L HA 0.150 4.490 4.340 -0.000 0.000 0.202 182 L C 1.604 178.489 176.870 0.025 0.000 1.056 182 L CA 0.229 55.091 54.840 0.036 0.000 0.847 182 L CB -0.090 41.999 42.059 0.050 0.000 1.131 182 L HN -0.116 nan 8.230 nan 0.000 0.484 183 K N 0.426 120.840 120.400 0.023 0.000 2.442 183 K HA -0.236 4.084 4.320 -0.000 0.000 0.199 183 K C 1.926 178.533 176.600 0.012 0.000 1.044 183 K CA 1.081 57.376 56.287 0.014 0.000 0.941 183 K CB -0.024 32.482 32.500 0.009 0.000 0.759 183 K HN 0.183 nan 8.250 nan 0.000 0.472 184 Q N 0.150 119.960 119.800 0.016 0.000 2.062 184 Q HA 0.000 4.340 4.340 -0.000 0.000 0.196 184 Q C 1.251 177.258 176.000 0.012 0.000 0.967 184 Q CA 1.723 57.535 55.803 0.014 0.000 0.832 184 Q CB 0.257 29.006 28.738 0.018 0.000 0.899 184 Q HN 0.057 nan 8.270 nan 0.000 0.442 185 S N 0.088 115.796 115.700 0.014 0.000 2.540 185 S HA 0.185 4.655 4.470 -0.000 0.000 0.218 185 S C 0.061 174.666 174.600 0.008 0.000 0.977 185 S CA 0.249 58.456 58.200 0.011 0.000 0.918 185 S CB 0.218 63.426 63.200 0.014 0.000 0.806 185 S HN 0.502 nan 8.310 nan 0.000 0.496 186 N N 1.608 120.312 118.700 0.008 0.000 2.753 186 N HA -0.130 4.610 4.740 -0.000 0.000 0.251 186 N C -0.803 174.710 175.510 0.005 0.000 1.097 186 N CA 0.921 53.974 53.050 0.005 0.000 0.786 186 N CB -1.871 36.617 38.487 0.000 0.000 1.137 186 N HN 0.322 nan 8.380 nan 0.000 0.566 187 T N 1.104 115.664 114.554 0.010 0.000 2.784 187 T HA 0.226 4.576 4.350 -0.000 0.000 0.291 187 T C 0.514 175.221 174.700 0.012 0.000 0.942 187 T CA -0.339 61.767 62.100 0.009 0.000 1.161 187 T CB 0.569 69.445 68.868 0.013 0.000 0.885 187 T HN 0.215 nan 8.240 nan 0.000 0.534 188 L N 5.940 127.166 121.223 0.004 0.000 2.265 188 L HA 0.583 4.923 4.340 -0.000 0.000 0.288 188 L C -0.852 176.017 176.870 -0.001 0.000 1.058 188 L CA -0.233 54.611 54.840 0.006 0.000 0.809 188 L CB 0.463 42.520 42.059 -0.003 0.000 1.179 188 L HN 0.592 nan 8.230 nan 0.000 0.429 189 L N 6.412 127.645 121.223 0.017 0.000 2.333 189 L HA 0.558 4.898 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 -0.348 54.484 54.840 -0.012 0.000 0.820 189 L CB 1.478 43.553 42.059 0.027 0.000 1.247 189 L HN 0.651 nan 8.230 nan 0.000 0.416 190 I N 4.312 124.836 120.570 -0.077 0.000 2.382 190 I HA 0.305 4.474 4.170 -0.000 0.000 0.286 190 I C -0.961 175.086 176.117 -0.116 0.000 1.002 190 I CA -0.286 60.999 61.300 -0.025 0.000 1.135 190 I CB 1.350 39.340 38.000 -0.015 0.000 1.288 190 I HN 0.388 nan 8.210 nan 0.000 0.448 191 F N 7.103 127.041 119.950 -0.019 0.000 2.420 191 F HA 0.503 5.030 4.527 -0.000 0.000 0.342 191 F C 0.385 176.182 175.800 -0.005 0.000 1.113 191 F CA -0.692 57.294 58.000 -0.023 0.000 1.059 191 F CB 1.317 40.300 39.000 -0.028 0.000 1.128 191 F HN 0.213 nan 8.300 nan 0.000 0.475 192 I N 1.385 122.045 120.570 0.149 0.000 2.378 192 I HA 0.613 4.783 4.170 -0.000 0.000 0.291 192 I C -0.903 175.293 176.117 0.132 0.000 0.992 192 I CA -0.594 60.779 61.300 0.122 0.000 1.154 192 I CB 1.664 39.708 38.000 0.074 0.000 1.315 192 I HN 0.446 nan 8.210 nan 0.000 0.448 193 N N 3.897 122.684 118.700 0.146 0.000 2.697 193 N HA 0.499 5.239 4.740 -0.000 0.000 0.272 193 N C -1.408 174.173 175.510 0.118 0.000 1.381 193 N CA -0.500 52.633 53.050 0.138 0.000 0.797 193 N CB 2.228 40.814 38.487 0.164 0.000 1.523 193 N HN 0.739 nan 8.380 nan 0.000 0.518 212 G N 0.422 109.211 108.800 -0.018 0.000 2.482 212 G HA2 0.005 3.965 3.960 -0.000 0.000 0.201 212 G HA3 0.005 3.965 3.960 -0.000 0.000 0.201 212 G C 0.185 175.053 174.900 -0.053 0.000 3.137 212 G CA -0.192 44.880 45.100 -0.045 0.000 0.798 212 G HN 0.252 nan 8.290 nan 0.000 0.493 213 N N 0.473 119.159 118.700 -0.023 0.000 2.573 213 N HA -0.052 4.688 4.740 -0.000 0.000 0.187 213 N C 2.220 177.745 175.510 0.026 0.000 1.107 213 N CA 1.097 54.156 53.050 0.014 0.000 0.918 213 N CB 0.211 38.725 38.487 0.046 0.000 0.966 213 N HN 0.653 nan 8.380 nan 0.000 0.448 214 A N 1.134 123.918 122.820 -0.059 0.000 1.841 214 A HA -0.112 4.208 4.320 -0.000 0.000 0.214 214 A C 2.095 179.585 177.584 -0.158 0.000 1.195 214 A CA 0.648 52.603 52.037 -0.136 0.000 0.611 214 A CB -0.858 17.994 19.000 -0.248 0.000 0.835 214 A HN 0.308 nan 8.150 nan 0.000 0.443 215 L N 0.366 121.455 121.223 -0.224 0.000 2.137 215 L HA -0.242 4.098 4.340 -0.000 0.000 0.213 215 L C 2.306 179.103 176.870 -0.123 0.000 1.085 215 L CA 2.659 57.341 54.840 -0.263 0.000 0.760 215 L CB -0.522 41.298 42.059 -0.397 0.000 0.893 215 L HN 0.528 nan 8.230 nan 0.000 0.434 216 K N -1.265 119.089 120.400 -0.078 0.000 2.059 216 K HA -0.261 4.059 4.320 -0.000 0.000 0.212 216 K C 1.949 178.478 176.600 -0.118 0.000 1.050 216 K CA 2.311 58.525 56.287 -0.121 0.000 0.927 216 K CB -0.349 32.086 32.500 -0.109 0.000 0.714 216 K HN 0.381 nan 8.250 nan 0.000 0.447 217 F N -1.011 118.981 119.950 0.069 0.000 2.569 217 F HA 0.049 4.576 4.527 -0.000 0.000 0.295 217 F C 1.284 177.183 175.800 0.164 0.000 1.115 217 F CA 0.412 58.484 58.000 0.120 0.000 1.450 217 F CB 0.243 39.333 39.000 0.151 0.000 1.107 217 F HN 0.042 nan 8.300 nan 0.000 0.563 218 Y N -0.446 119.894 120.300 0.067 0.000 2.482 218 Y HA 0.368 4.918 4.550 -0.000 0.000 0.270 218 Y C 1.280 177.169 175.900 -0.017 0.000 1.152 218 Y CA -0.513 57.601 58.100 0.023 0.000 1.292 218 Y CB -0.112 38.347 38.460 -0.001 0.000 1.070 218 Y HN -0.139 nan 8.280 nan 0.000 0.528 219 A N 0.008 122.879 122.820 0.086 0.000 2.409 219 A HA 0.236 4.556 4.320 -0.000 0.000 0.262 219 A C 0.999 178.572 177.584 -0.018 0.000 1.113 219 A CA -0.122 51.920 52.037 0.008 0.000 0.790 219 A CB 0.417 19.378 19.000 -0.064 0.000 1.046 219 A HN 0.296 nan 8.150 nan 0.000 0.496 220 S N 0.752 116.447 115.700 -0.009 0.000 2.478 220 S HA 0.174 4.644 4.470 -0.000 0.000 0.222 220 S C 0.380 174.954 174.600 -0.044 0.000 1.008 220 S CA 0.445 58.631 58.200 -0.024 0.000 0.928 220 S CB 0.070 63.265 63.200 -0.009 0.000 0.781 220 S HN 0.563 nan 8.310 nan 0.000 0.518 221 V N 1.745 121.630 119.914 -0.048 0.000 2.851 221 V HA 0.463 4.583 4.120 -0.000 0.000 0.307 221 V C -1.129 174.913 176.094 -0.087 0.000 1.129 221 V CA -0.783 61.479 62.300 -0.064 0.000 0.932 221 V CB 2.301 34.100 31.823 -0.039 0.000 1.024 221 V HN 0.121 nan 8.190 nan 0.000 0.426 222 R N 4.486 124.909 120.500 -0.128 0.000 2.628 222 R HA 0.685 5.025 4.340 -0.000 0.000 0.288 222 R C -1.930 174.289 176.300 -0.134 0.000 0.980 222 R CA -0.910 55.079 56.100 -0.185 0.000 0.891 222 R CB 2.303 32.407 30.300 -0.327 0.000 1.188 222 R HN 0.321 nan 8.270 nan 0.000 0.450 223 L N 1.949 123.125 121.223 -0.077 0.000 2.362 223 L HA 0.311 4.651 4.340 -0.000 0.000 0.275 223 L C -0.342 176.668 176.870 0.233 0.000 0.998 223 L CA -0.533 54.338 54.840 0.052 0.000 0.820 223 L CB 1.615 43.718 42.059 0.074 0.000 1.270 223 L HN 0.544 nan 8.230 nan 0.000 0.415 224 D N 3.453 124.010 120.400 0.261 0.000 2.505 224 D HA 0.255 4.895 4.640 -0.000 0.000 0.242 224 D C -0.081 176.290 176.300 0.120 0.000 1.136 224 D CA -0.148 54.028 54.000 0.293 0.000 0.954 224 D CB 0.265 41.219 40.800 0.256 0.000 1.002 224 D HN 0.412 nan 8.370 nan 0.000 0.512 225 I N 2.181 122.818 120.570 0.111 0.000 2.529 225 I HA 0.314 4.484 4.170 -0.000 0.000 0.284 225 I C -0.246 175.870 176.117 -0.002 0.000 1.082 225 I CA -0.288 61.050 61.300 0.063 0.000 1.406 225 I CB 0.314 38.369 38.000 0.092 0.000 1.405 225 I HN 0.178 nan 8.210 nan 0.000 0.548 226 R N 6.610 127.093 120.500 -0.028 0.000 2.566 226 R HA 0.358 4.698 4.340 -0.000 0.000 0.271 226 R C -1.193 175.071 176.300 -0.061 0.000 1.071 226 R CA -0.893 55.179 56.100 -0.048 0.000 0.915 226 R CB 1.413 31.682 30.300 -0.052 0.000 1.228 226 R HN 0.667 nan 8.270 nan 0.000 0.449 227 R N 4.356 124.826 120.500 -0.051 0.000 2.267 227 R HA 0.224 4.564 4.340 -0.000 0.000 0.319 227 R C 0.780 177.055 176.300 -0.042 0.000 1.067 227 R CA 0.139 56.209 56.100 -0.050 0.000 0.936 227 R CB 0.365 30.649 30.300 -0.026 0.000 1.006 227 R HN 0.674 nan 8.270 nan 0.000 0.452 228 I N 0.549 121.090 120.570 -0.048 0.000 4.338 228 I HA 0.492 4.662 4.170 -0.000 0.000 0.329 228 I C 0.334 176.435 176.117 -0.027 0.000 1.378 228 I CA -0.288 60.990 61.300 -0.036 0.000 1.170 228 I CB 1.297 39.274 38.000 -0.038 0.000 1.206 228 I HN 0.630 nan 8.210 nan 0.000 0.432 229 G N 1.258 110.042 108.800 -0.026 0.000 3.111 229 G HA2 0.839 4.799 3.960 -0.000 0.000 0.158 229 G HA3 0.839 4.799 3.960 -0.000 0.000 0.158 229 G C -1.404 173.491 174.900 -0.008 0.000 1.161 229 G CA -0.204 44.886 45.100 -0.017 0.000 1.025 229 G HN 0.721 nan 8.290 nan 0.000 0.619 230 A N -1.880 120.935 122.820 -0.008 0.000 2.592 230 A HA 0.568 4.888 4.320 -0.000 0.000 0.300 230 A C -1.744 175.831 177.584 -0.014 0.000 0.994 230 A CA -0.178 51.856 52.037 -0.006 0.000 0.707 230 A CB 0.703 19.695 19.000 -0.012 0.000 1.273 230 A HN 1.574 nan 8.150 nan 0.000 0.413 231 V N 1.912 121.815 119.914 -0.020 0.000 2.555 231 V HA 0.601 4.721 4.120 -0.000 0.000 0.302 231 V C -0.038 176.028 176.094 -0.046 0.000 1.038 231 V CA -0.611 61.676 62.300 -0.021 0.000 0.887 231 V CB 1.781 33.603 31.823 -0.001 0.000 0.991 231 V HN 0.872 nan 8.190 nan 0.000 0.434 232 K N 2.406 122.783 120.400 -0.038 0.000 2.208 232 K HA 0.608 4.928 4.320 -0.000 0.000 0.247 232 K C -0.540 176.036 176.600 -0.039 0.000 0.953 232 K CA -0.690 55.568 56.287 -0.048 0.000 0.837 232 K CB 2.244 34.721 32.500 -0.039 0.000 1.131 232 K HN 0.610 nan 8.250 nan 0.000 0.431 233 E N 1.221 121.395 120.200 -0.044 0.000 2.698 233 E HA 0.137 4.487 4.350 -0.000 0.000 0.242 233 E C 0.414 176.995 176.600 -0.030 0.000 1.243 233 E CA -0.162 56.217 56.400 -0.035 0.000 1.483 233 E CB 0.406 30.084 29.700 -0.036 0.000 1.495 233 E HN 0.952 nan 8.360 nan 0.000 0.440 234 G N 1.940 110.725 108.800 -0.026 0.000 4.148 234 G HA2 -0.344 3.616 3.960 -0.000 0.000 0.221 234 G HA3 -0.344 3.616 3.960 -0.000 0.000 0.221 234 G C 0.842 175.727 174.900 -0.025 0.000 1.373 234 G CA 0.240 45.327 45.100 -0.022 0.000 0.940 234 G HN 0.446 nan 8.290 nan 0.000 0.610 235 E N 1.868 122.050 120.200 -0.030 0.000 2.812 235 E HA 0.278 4.628 4.350 -0.000 0.000 0.211 235 E C -0.024 176.551 176.600 -0.042 0.000 0.986 235 E CA -0.024 56.358 56.400 -0.031 0.000 1.119 235 E CB 0.225 29.910 29.700 -0.025 0.000 1.046 235 E HN 0.668 nan 8.360 nan 0.000 0.474 236 N N -1.133 117.534 118.700 -0.056 0.000 2.525 236 N HA 0.121 4.861 4.740 -0.000 0.000 0.270 236 N C 1.008 176.448 175.510 -0.116 0.000 1.321 236 N CA -0.369 52.633 53.050 -0.081 0.000 0.797 236 N CB 2.402 40.840 38.487 -0.082 0.000 1.529 236 N HN -0.180 nan 8.380 nan 0.000 0.491 237 V N -1.046 118.767 119.914 -0.168 0.000 2.229 237 V HA -0.125 3.995 4.120 -0.000 0.000 0.243 237 V C 1.811 177.689 176.094 -0.360 0.000 1.042 237 V CA 1.400 63.550 62.300 -0.251 0.000 1.000 237 V CB -0.967 30.679 31.823 -0.294 0.000 0.637 237 V HN 0.581 nan 8.190 nan 0.000 0.446 238 V N 1.296 120.920 119.914 -0.483 0.000 2.045 238 V HA -0.354 3.766 4.120 -0.000 0.000 0.178 238 V C 1.341 177.243 176.094 -0.319 0.000 0.952 238 V CA 2.083 64.096 62.300 -0.478 0.000 1.254 238 V CB -1.436 30.275 31.823 -0.187 0.000 1.417 238 V HN 1.103 nan 8.190 nan 0.000 0.581 239 G N -2.336 106.345 108.800 -0.199 0.000 2.601 239 G HA2 0.611 4.571 3.960 -0.000 0.000 0.317 239 G HA3 0.611 4.571 3.960 -0.000 0.000 0.317 239 G C -0.659 174.288 174.900 0.078 0.000 1.246 239 G CA 0.352 45.447 45.100 -0.008 0.000 1.012 239 G HN 0.571 nan 8.290 nan 0.000 0.494 240 S N -0.314 115.448 115.700 0.103 0.000 2.417 240 S HA 0.145 4.615 4.470 -0.000 0.000 0.189 240 S C -0.725 173.878 174.600 0.004 0.000 1.005 240 S CA -0.665 57.587 58.200 0.087 0.000 1.116 240 S CB 1.222 64.511 63.200 0.149 0.000 1.343 240 S HN 0.740 nan 8.310 nan 0.000 0.406 241 E N 2.231 122.418 120.200 -0.022 0.000 2.406 241 E HA 0.255 4.605 4.350 -0.000 0.000 0.258 241 E C -0.336 176.180 176.600 -0.139 0.000 1.043 241 E CA 0.623 56.981 56.400 -0.070 0.000 0.929 241 E CB 0.356 30.033 29.700 -0.040 0.000 0.969 241 E HN 0.391 nan 8.360 nan 0.000 0.462 242 T N 5.552 119.929 114.554 -0.295 0.000 2.885 242 T HA 0.491 4.841 4.350 -0.000 0.000 0.285 242 T C -0.574 173.859 174.700 -0.445 0.000 1.019 242 T CA -0.843 61.010 62.100 -0.412 0.000 1.010 242 T CB 1.257 69.753 68.868 -0.620 0.000 1.022 242 T HN 0.275 nan 8.240 nan 0.000 0.466 243 R N 2.325 122.675 120.500 -0.250 0.000 2.473 243 R HA 0.543 4.883 4.340 -0.000 0.000 0.303 243 R C -1.986 174.300 176.300 -0.023 0.000 1.002 243 R CA -0.398 55.638 56.100 -0.107 0.000 0.884 243 R CB 1.322 31.591 30.300 -0.052 0.000 1.173 243 R HN 0.484 nan 8.270 nan 0.000 0.464 244 V N 4.883 124.838 119.914 0.069 0.000 2.417 244 V HA 0.401 4.521 4.120 -0.000 0.000 0.291 244 V C -0.045 176.115 176.094 0.110 0.000 1.024 244 V CA -0.706 61.672 62.300 0.130 0.000 0.861 244 V CB 1.918 33.893 31.823 0.253 0.000 0.985 244 V HN 0.559 nan 8.190 nan 0.000 0.436 245 K N 3.505 123.959 120.400 0.090 0.000 2.182 245 K HA 0.647 4.967 4.320 -0.000 0.000 0.262 245 K C -1.121 175.507 176.600 0.047 0.000 0.957 245 K CA -0.585 55.743 56.287 0.069 0.000 0.842 245 K CB 1.946 34.484 32.500 0.063 0.000 1.099 245 K HN 0.457 nan 8.250 nan 0.000 0.438 246 V N 5.809 125.732 119.914 0.016 0.000 2.353 246 V HA 0.040 4.160 4.120 -0.000 0.000 0.264 246 V C 0.866 176.892 176.094 -0.114 0.000 1.049 246 V CA -0.205 62.077 62.300 -0.030 0.000 0.896 246 V CB 1.008 32.822 31.823 -0.015 0.000 1.025 246 V HN 0.723 nan 8.190 nan 0.000 0.475 247 V N 3.830 123.653 119.914 -0.151 0.000 2.575 247 V HA 0.156 4.276 4.120 -0.000 0.000 0.242 247 V C 0.908 176.816 176.094 -0.309 0.000 1.045 247 V CA 0.678 62.818 62.300 -0.267 0.000 1.065 247 V CB -0.155 31.542 31.823 -0.211 0.000 0.717 247 V HN 0.698 nan 8.190 nan 0.000 0.467 248 K N 1.557 121.818 120.400 -0.232 0.000 2.358 248 K HA 0.460 4.780 4.320 -0.000 0.000 0.260 248 K C -1.054 175.468 176.600 -0.129 0.000 0.956 248 K CA -0.322 55.845 56.287 -0.200 0.000 0.834 248 K CB 0.911 33.278 32.500 -0.221 0.000 1.102 248 K HN 0.191 nan 8.250 nan 0.000 0.431 249 N N 3.300 121.941 118.700 -0.098 0.000 2.594 249 N HA 0.183 4.923 4.740 -0.000 0.000 0.280 249 N C -0.920 174.570 175.510 -0.032 0.000 1.156 249 N CA -0.365 52.653 53.050 -0.054 0.000 0.831 249 N CB 1.152 39.619 38.487 -0.034 0.000 1.379 249 N HN 0.532 nan 8.380 nan 0.000 0.536 250 K N 2.173 122.555 120.400 -0.030 0.000 2.358 250 K HA 0.256 4.576 4.320 -0.000 0.000 0.197 250 K C 0.824 177.418 176.600 -0.010 0.000 1.025 250 K CA 0.083 56.360 56.287 -0.016 0.000 1.104 250 K CB 0.686 33.175 32.500 -0.018 0.000 0.855 250 K HN 0.379 nan 8.250 nan 0.000 0.531 251 I N 0.277 120.840 120.570 -0.012 0.000 2.731 251 I HA -0.030 4.140 4.170 -0.000 0.000 0.260 251 I C 1.130 177.245 176.117 -0.003 0.000 1.138 251 I CA 0.575 61.870 61.300 -0.008 0.000 1.461 251 I CB 0.412 38.405 38.000 -0.012 0.000 1.128 251 I HN 0.055 nan 8.210 nan 0.000 0.438 252 A N -0.554 122.266 122.820 0.001 0.000 2.770 252 A HA 0.872 5.192 4.320 -0.000 0.000 0.183 252 A C -0.543 177.053 177.584 0.020 0.000 1.077 252 A CA 0.240 52.282 52.037 0.009 0.000 1.468 252 A CB -0.486 18.519 19.000 0.008 0.000 2.037 252 A HN 0.016 nan 8.150 nan 0.000 0.730 253 A N 0.888 123.726 122.820 0.030 0.000 2.303 253 A HA 0.746 5.066 4.320 -0.000 0.000 0.320 253 A C -2.740 174.882 177.584 0.064 0.000 1.192 253 A CA -1.538 50.532 52.037 0.054 0.000 0.821 253 A CB 0.260 19.295 19.000 0.058 0.000 1.188 253 A HN 0.320 nan 8.150 nan 0.000 0.492 254 P HA 0.545 nan 4.420 nan 0.000 0.293 254 P C 0.165 177.577 177.300 0.186 0.000 1.298 254 P CA -0.212 62.921 63.100 0.055 0.000 0.757 254 P CB 0.084 31.779 31.700 -0.008 0.000 1.262 255 F N -4.535 115.418 119.950 0.005 0.000 2.666 255 F HA -0.249 4.278 4.527 -0.000 0.000 0.458 255 F C 0.697 176.509 175.800 0.019 0.000 0.561 255 F CA 1.209 59.217 58.000 0.013 0.000 1.129 255 F CB -1.571 37.435 39.000 0.010 0.000 1.751 255 F HN 0.192 nan 8.300 nan 0.000 0.275 256 K N 1.840 122.335 120.400 0.158 0.000 2.249 256 K HA 0.373 4.693 4.320 -0.000 0.000 0.280 256 K C 0.336 176.987 176.600 0.084 0.000 1.033 256 K CA -0.278 56.075 56.287 0.110 0.000 0.946 256 K CB 0.956 33.506 32.500 0.083 0.000 1.005 256 K HN 0.369 nan 8.250 nan 0.000 0.469 257 Q N 0.799 120.650 119.800 0.085 0.000 2.351 257 Q HA 0.770 5.110 4.340 -0.000 0.000 0.273 257 Q C -1.461 174.592 176.000 0.088 0.000 1.077 257 Q CA -1.213 54.639 55.803 0.082 0.000 0.843 257 Q CB 2.123 30.909 28.738 0.080 0.000 1.367 257 Q HN 0.523 nan 8.270 nan 0.000 0.449 258 A N 1.575 124.461 122.820 0.110 0.000 2.520 258 A HA 0.569 4.889 4.320 -0.000 0.000 0.298 258 A C -1.423 176.283 177.584 0.203 0.000 1.051 258 A CA -0.787 51.334 52.037 0.139 0.000 0.690 258 A CB 1.792 20.870 19.000 0.130 0.000 1.281 258 A HN 0.794 nan 8.150 nan 0.000 0.402 259 E N 0.596 120.916 120.200 0.200 0.000 2.227 259 E HA 0.775 5.125 4.350 -0.000 0.000 0.268 259 E C -0.906 175.876 176.600 0.304 0.000 0.907 259 E CA -0.462 56.038 56.400 0.166 0.000 0.786 259 E CB 2.123 31.866 29.700 0.073 0.000 1.191 259 E HN 0.699 nan 8.360 nan 0.000 0.411 260 F N -1.402 118.575 119.950 0.045 0.000 3.461 260 F HA 0.452 4.979 4.527 -0.000 0.000 0.328 260 F C -1.591 174.241 175.800 0.053 0.000 1.160 260 F CA -1.062 56.969 58.000 0.051 0.000 0.879 260 F CB 1.183 40.216 39.000 0.055 0.000 1.559 260 F HN 0.201 nan 8.300 nan 0.000 0.510 261 Q N 0.778 120.744 119.800 0.276 0.000 2.423 261 Q HA 0.722 5.062 4.340 -0.000 0.000 0.278 261 Q C -1.693 174.450 176.000 0.239 0.000 1.097 261 Q CA -0.919 54.967 55.803 0.137 0.000 0.809 261 Q CB 3.503 32.319 28.738 0.129 0.000 1.391 261 Q HN 0.589 nan 8.270 nan 0.000 0.428 262 I N 2.135 122.797 120.570 0.153 0.000 2.466 262 I HA 0.325 4.495 4.170 -0.000 0.000 0.289 262 I C -1.312 174.931 176.117 0.211 0.000 1.026 262 I CA -0.839 60.581 61.300 0.200 0.000 1.078 262 I CB 1.598 39.702 38.000 0.174 0.000 1.249 262 I HN 0.274 nan 8.210 nan 0.000 0.429 263 L N 6.351 127.707 121.223 0.221 0.000 2.307 263 L HA 0.357 4.697 4.340 -0.000 0.000 0.284 263 L C -0.517 176.549 176.870 0.327 0.000 1.023 263 L CA -0.245 54.742 54.840 0.244 0.000 0.810 263 L CB 0.767 42.925 42.059 0.165 0.000 1.231 263 L HN 0.336 nan 8.230 nan 0.000 0.423 264 Y N 3.673 124.023 120.300 0.083 0.000 2.854 264 Y HA 0.190 4.740 4.550 -0.000 0.000 0.372 264 Y C 1.503 177.472 175.900 0.115 0.000 1.330 264 Y CA 0.718 58.858 58.100 0.068 0.000 1.765 264 Y CB -0.014 38.456 38.460 0.017 0.000 1.277 264 Y HN 0.873 nan 8.280 nan 0.000 0.498 265 G N 2.782 111.784 108.800 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 0.304 175.352 174.900 0.248 0.000 0.999 265 G CA 0.331 45.638 45.100 0.345 0.000 0.686 265 G HN 0.663 nan 8.290 nan 0.000 0.515 266 E N -1.654 118.684 120.200 0.230 0.000 2.640 266 E HA 0.428 4.778 4.350 -0.000 0.000 0.197 266 E C 1.247 177.887 176.600 0.066 0.000 0.925 266 E CA 0.840 57.306 56.400 0.110 0.000 1.604 266 E CB 0.826 30.589 29.700 0.105 0.000 1.769 266 E HN 1.771 nan 8.360 nan 0.000 0.965 267 G N 1.363 110.235 108.800 0.120 0.000 2.698 267 G HA2 -0.239 3.721 3.960 -0.000 0.000 0.225 267 G HA3 -0.239 3.721 3.960 -0.000 0.000 0.225 267 G C -0.208 174.770 174.900 0.130 0.000 1.345 267 G CA -0.381 44.770 45.100 0.085 0.000 0.871 267 G HN 0.152 nan 8.290 nan 0.000 0.540 268 I N 0.472 121.120 120.570 0.129 0.000 2.880 268 I HA 0.016 4.186 4.170 -0.000 0.000 0.296 268 I C 0.708 176.918 176.117 0.155 0.000 1.220 268 I CA 0.418 61.819 61.300 0.167 0.000 1.435 268 I CB 0.343 38.377 38.000 0.056 0.000 1.339 268 I HN 0.487 nan 8.210 nan 0.000 0.583 269 N N 5.440 124.246 118.700 0.175 0.000 2.800 269 N HA 0.206 4.945 4.740 -0.000 0.000 0.240 269 N C 0.448 176.011 175.510 0.089 0.000 1.096 269 N CA -0.581 52.541 53.050 0.120 0.000 0.877 269 N CB 0.315 38.872 38.487 0.117 0.000 1.138 269 N HN 0.468 nan 8.380 nan 0.000 0.509 270 F N 1.111 120.991 119.950 -0.117 0.000 2.407 270 F HA 0.084 4.611 4.527 -0.000 0.000 0.299 270 F C 0.730 176.439 175.800 -0.151 0.000 1.097 270 F CA 0.412 58.304 58.000 -0.180 0.000 1.422 270 F CB -0.303 38.534 39.000 -0.271 0.000 1.067 270 F HN 0.201 nan 8.300 nan 0.000 0.539 271 Y N 1.953 121.959 120.300 -0.490 0.000 2.200 271 Y HA 0.046 4.596 4.550 -0.000 0.000 0.290 271 Y C 2.798 178.606 175.900 -0.153 0.000 1.137 271 Y CA 0.973 58.849 58.100 -0.373 0.000 1.163 271 Y CB -1.252 36.964 38.460 -0.408 0.000 0.988 271 Y HN 0.190 nan 8.280 nan 0.000 0.518 272 G N 0.509 109.342 108.800 0.056 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 1.457 176.392 174.900 0.058 0.000 1.180 272 G CA 1.405 46.535 45.100 0.050 0.000 0.774 272 G HN 0.602 nan 8.290 nan 0.000 0.562 273 E N 0.008 120.260 120.200 0.087 0.000 2.274 273 E HA 0.033 4.383 4.350 -0.000 0.000 0.194 273 E C 2.335 178.988 176.600 0.088 0.000 0.996 273 E CA 0.385 56.846 56.400 0.102 0.000 0.840 273 E CB -0.230 29.549 29.700 0.132 0.000 0.772 273 E HN 0.345 nan 8.360 nan 0.000 0.491 274 L N 1.696 122.964 121.223 0.075 0.000 1.994 274 L HA -0.162 4.178 4.340 -0.000 0.000 0.208 274 L C 2.336 179.253 176.870 0.078 0.000 1.071 274 L CA 1.403 56.291 54.840 0.079 0.000 0.745 274 L CB -0.610 41.488 42.059 0.066 0.000 0.892 274 L HN 0.048 nan 8.230 nan 0.000 0.431 275 V N 0.215 120.162 119.914 0.056 0.000 2.231 275 V HA -0.402 3.718 4.120 -0.000 0.000 0.250 275 V C 2.342 178.497 176.094 0.101 0.000 1.058 275 V CA 2.234 64.562 62.300 0.047 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 -0.256 120.199 120.400 0.091 0.000 2.190 276 D HA -0.146 4.494 4.640 -0.000 0.000 0.200 276 D C 1.899 178.267 176.300 0.114 0.000 0.992 276 D CA 1.146 55.216 54.000 0.117 0.000 0.854 276 D CB -0.194 40.667 40.800 0.101 0.000 0.936 276 D HN 0.279 nan 8.370 nan 0.000 0.462 277 L N 0.236 121.520 121.223 0.102 0.000 2.179 277 L HA 0.090 4.430 4.340 -0.000 0.000 0.208 277 L C 2.552 179.483 176.870 0.102 0.000 1.096 277 L CA 1.191 56.087 54.840 0.094 0.000 0.779 277 L CB -1.224 40.885 42.059 0.084 0.000 0.922 277 L HN 0.029 nan 8.230 nan 0.000 0.443 278 G N -1.245 107.625 108.800 0.117 0.000 2.443 278 G HA2 -0.117 3.843 3.960 -0.000 0.000 0.219 278 G HA3 -0.117 3.843 3.960 -0.000 0.000 0.219 278 G C 1.654 176.641 174.900 0.145 0.000 1.131 278 G CA 0.867 46.048 45.100 0.135 0.000 0.775 278 G HN 0.235 nan 8.290 nan 0.000 0.547 279 V N 0.649 120.654 119.914 0.153 0.000 2.237 279 V HA -0.134 3.986 4.120 -0.000 0.000 0.245 279 V C 2.693 178.847 176.094 0.101 0.000 1.046 279 V CA 2.094 64.480 62.300 0.144 0.000 1.007 279 V CB -0.341 31.583 31.823 0.167 0.000 0.638 279 V HN 0.301 nan 8.190 nan 0.000 0.445 280 K N -0.244 120.210 120.400 0.091 0.000 2.283 280 K HA -0.104 4.216 4.320 -0.000 0.000 0.202 280 K C 1.022 177.661 176.600 0.066 0.000 1.048 280 K CA 0.850 57.179 56.287 0.071 0.000 0.948 280 K CB 0.087 32.627 32.500 0.066 0.000 0.742 280 K HN 0.399 nan 8.250 nan 0.000 0.458 281 E N 1.133 121.379 120.200 0.076 0.000 2.405 281 E HA 0.029 4.379 4.350 -0.000 0.000 0.214 281 E C 0.034 176.680 176.600 0.078 0.000 1.101 281 E CA -0.132 56.311 56.400 0.072 0.000 1.254 281 E CB 0.673 30.416 29.700 0.072 0.000 1.240 281 E HN 0.134 nan 8.360 nan 0.000 0.439 282 K N -0.992 119.453 120.400 0.074 0.000 6.581 282 K HA -0.292 4.028 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 1.582 57.911 56.287 0.070 0.000 1.893 282 K CB -1.913 30.619 32.500 0.053 0.000 0.843 282 K HN 0.264 nan 8.250 nan 0.000 0.751 283 L N 0.845 122.139 121.223 0.118 0.000 2.123 283 L HA -0.143 4.197 4.340 -0.000 0.000 0.217 283 L C 1.384 178.401 176.870 0.244 0.000 1.081 283 L CA 1.622 56.567 54.840 0.175 0.000 0.772 283 L CB -0.253 41.926 42.059 0.201 0.000 0.890 283 L HN 0.243 nan 8.230 nan 0.000 0.437 284 I N -0.899 119.803 120.570 0.219 0.000 2.412 284 I HA 0.176 4.346 4.170 -0.000 0.000 0.296 284 I C -0.139 176.080 176.117 0.170 0.000 0.987 284 I CA -0.397 61.052 61.300 0.249 0.000 1.180 284 I CB 1.657 39.817 38.000 0.266 0.000 1.340 284 I HN -0.036 nan 8.210 nan 0.000 0.455 285 E N 5.379 125.666 120.200 0.146 0.000 2.166 285 E HA 0.289 4.639 4.350 -0.000 0.000 0.275 285 E C -0.748 175.850 176.600 -0.003 0.000 0.941 285 E CA -0.837 55.601 56.400 0.063 0.000 0.784 285 E CB 1.935 31.661 29.700 0.043 0.000 1.115 285 E HN 0.292 nan 8.360 nan 0.000 0.399 286 K N 2.163 122.508 120.400 -0.092 0.000 2.268 286 K HA 0.357 4.677 4.320 -0.000 0.000 0.276 286 K C -0.764 175.740 176.600 -0.160 0.000 1.080 286 K CA -0.259 55.865 56.287 -0.271 0.000 0.910 286 K CB 0.821 33.135 32.500 -0.310 0.000 1.163 286 K HN 0.565 nan 8.250 nan 0.000 0.465 287 A N 3.815 126.559 122.820 -0.127 0.000 3.181 287 A HA 0.400 4.720 4.320 -0.000 0.000 0.293 287 A C 0.925 178.488 177.584 -0.035 0.000 1.346 287 A CA 0.299 52.306 52.037 -0.050 0.000 1.018 287 A CB -0.441 18.557 19.000 -0.004 0.000 1.093 287 A HN 1.081 nan 8.150 nan 0.000 0.629 288 G N 0.096 108.848 108.800 -0.080 0.000 5.347 288 G HA2 -0.162 3.798 3.960 -0.000 0.000 0.299 288 G HA3 -0.162 3.798 3.960 -0.000 0.000 0.299 288 G C 1.403 176.275 174.900 -0.046 0.000 1.492 288 G CA 0.859 45.932 45.100 -0.045 0.000 0.991 288 G HN 1.588 nan 8.290 nan 0.000 0.749 289 A N -1.078 121.767 122.820 0.042 0.000 1.969 289 A HA 0.523 4.843 4.320 -0.000 0.000 0.205 289 A C 0.746 178.406 177.584 0.127 0.000 1.364 289 A CA 0.863 52.951 52.037 0.085 0.000 0.756 289 A CB -0.104 18.975 19.000 0.131 0.000 0.988 289 A HN 0.692 nan 8.150 nan 0.000 0.490 290 W N 0.539 121.837 121.300 -0.004 0.000 2.446 290 W HA 0.446 5.106 4.660 -0.000 0.000 0.316 290 W C -0.554 175.971 176.519 0.010 0.000 1.376 290 W CA 0.306 57.671 57.345 0.033 0.000 1.300 290 W CB -0.285 29.173 29.460 -0.003 0.000 1.351 290 W HN 0.268 nan 8.180 nan 0.000 0.530 291 Y N 2.231 122.590 120.300 0.098 0.000 2.301 291 Y HA 0.342 4.892 4.550 -0.000 0.000 0.328 291 Y C 0.911 176.864 175.900 0.088 0.000 1.242 291 Y CA 0.324 58.467 58.100 0.072 0.000 1.323 291 Y CB 1.094 39.564 38.460 0.018 0.000 1.266 291 Y HN 0.170 nan 8.280 nan 0.000 0.527 292 S N 0.915 116.748 115.700 0.221 0.000 2.599 292 S HA 0.373 4.843 4.470 -0.000 0.000 0.294 292 S C -1.827 172.913 174.600 0.234 0.000 1.094 292 S CA -0.605 57.695 58.200 0.168 0.000 0.931 292 S CB 1.078 64.339 63.200 0.103 0.000 1.093 292 S HN 0.489 nan 8.310 nan 0.000 0.488 293 Y N 2.256 122.581 120.300 0.042 0.000 2.470 293 Y HA 0.406 4.956 4.550 -0.000 0.000 0.352 293 Y C -0.548 175.383 175.900 0.051 0.000 0.967 293 Y CA -0.804 57.335 58.100 0.065 0.000 1.121 293 Y CB -0.507 38.008 38.460 0.091 0.000 1.149 293 Y HN 0.794 nan 8.280 nan 0.000 0.641 294 K N 2.273 122.619 120.400 -0.090 0.000 4.868 294 K HA -0.199 4.121 4.320 -0.000 0.000 0.314 294 K C 1.075 177.620 176.600 -0.092 0.000 0.932 294 K CA 1.043 57.251 56.287 -0.131 0.000 0.998 294 K CB -1.210 31.152 32.500 -0.229 0.000 1.704 294 K HN 1.097 nan 8.250 nan 0.000 0.426 295 G N 0.809 109.586 108.800 -0.038 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 0.220 45.304 45.100 -0.027 0.000 0.792 295 G HN 0.484 nan 8.290 nan 0.000 0.527 296 E N 2.797 123.002 120.200 0.008 0.000 2.059 296 E HA 0.197 4.547 4.350 -0.000 0.000 0.262 296 E C 0.456 177.065 176.600 0.015 0.000 1.230 296 E CA 0.249 56.670 56.400 0.036 0.000 0.951 296 E CB 0.135 29.901 29.700 0.110 0.000 1.038 296 E HN 0.472 nan 8.360 nan 0.000 0.425 297 K N 2.951 123.352 120.400 0.001 0.000 2.401 297 K HA 0.053 4.373 4.320 -0.000 0.000 0.278 297 K C 1.496 178.001 176.600 -0.158 0.000 1.018 297 K CA 0.084 56.392 56.287 0.035 0.000 0.981 297 K CB 0.685 33.281 32.500 0.161 0.000 0.933 297 K HN 0.507 nan 8.250 nan 0.000 0.477 298 I N -1.631 118.800 120.570 -0.232 0.000 3.718 298 I HA 0.335 4.505 4.170 -0.000 0.000 0.297 298 I C 0.751 176.553 176.117 -0.526 0.000 1.220 298 I CA -0.175 60.702 61.300 -0.706 0.000 1.381 298 I CB 0.797 38.380 38.000 -0.696 0.000 1.238 298 I HN 0.608 nan 8.210 nan 0.000 0.448 299 G N 1.152 109.778 108.800 -0.290 0.000 2.328 299 G HA2 0.224 4.184 3.960 -0.000 0.000 0.295 299 G HA3 0.224 4.184 3.960 -0.000 0.000 0.295 299 G C -2.107 172.447 174.900 -0.577 0.000 1.413 299 G CA -0.616 44.236 45.100 -0.413 0.000 0.817 299 G HN 0.210 nan 8.290 nan 0.000 0.546 300 Q N 0.282 119.642 119.800 -0.733 0.000 2.347 300 Q HA 0.530 4.870 4.340 -0.000 0.000 0.262 300 Q C 0.538 176.362 176.000 -0.293 0.000 0.980 300 Q CA 0.583 55.941 55.803 -0.742 0.000 0.867 300 Q CB 0.908 29.082 28.738 -0.939 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 -0.108 174.768 174.900 -0.040 0.000 1.345 301 G CA -0.027 45.089 45.100 0.027 0.000 0.871 301 G HN 0.669 nan 8.290 nan 0.000 0.540 302 K N -0.087 120.275 120.400 -0.063 0.000 2.361 302 K HA 0.363 4.683 4.320 -0.000 0.000 0.196 302 K C 2.761 179.256 176.600 -0.175 0.000 1.039 302 K CA 1.437 57.587 56.287 -0.228 0.000 1.001 302 K CB -0.284 32.157 32.500 -0.098 0.000 0.795 302 K HN 0.785 nan 8.250 nan 0.000 0.495 303 A N 1.424 124.175 122.820 -0.114 0.000 1.898 303 A HA -0.119 4.201 4.320 -0.000 0.000 0.216 303 A C 1.708 179.228 177.584 -0.106 0.000 1.181 303 A CA 1.360 53.342 52.037 -0.092 0.000 0.620 303 A CB -0.293 18.666 19.000 -0.069 0.000 0.819 303 A HN 0.267 nan 8.150 nan 0.000 0.442 304 N N -0.385 118.234 118.700 -0.135 0.000 2.405 304 N HA 0.105 4.845 4.740 -0.000 0.000 0.175 304 N C 1.760 177.203 175.510 -0.113 0.000 1.051 304 N CA 1.012 53.985 53.050 -0.127 0.000 0.899 304 N CB -0.143 38.239 38.487 -0.175 0.000 1.000 304 N HN 0.429 nan 8.380 nan 0.000 0.451 305 A N 0.378 123.085 122.820 -0.189 0.000 1.930 305 A HA -0.065 4.255 4.320 -0.000 0.000 0.217 305 A C 2.286 179.813 177.584 -0.096 0.000 1.175 305 A CA 1.616 53.535 52.037 -0.197 0.000 0.627 305 A CB -0.792 17.885 19.000 -0.538 0.000 0.815 305 A HN 0.201 nan 8.150 nan 0.000 0.443 306 T N 0.344 114.818 114.554 -0.133 0.000 2.737 306 T HA 0.041 4.391 4.350 -0.000 0.000 0.265 306 T C 2.132 176.759 174.700 -0.121 0.000 1.038 306 T CA 1.351 63.391 62.100 -0.100 0.000 1.144 306 T CB -0.426 68.394 68.868 -0.080 0.000 0.866 306 T HN 0.554 nan 8.240 nan 0.000 0.434 307 A N -0.283 122.482 122.820 -0.092 0.000 2.225 307 A HA -0.049 4.271 4.320 -0.000 0.000 0.215 307 A C 1.868 179.417 177.584 -0.058 0.000 1.164 307 A CA 0.936 52.918 52.037 -0.092 0.000 0.710 307 A CB -0.803 18.159 19.000 -0.064 0.000 0.780 307 A HN 0.741 nan 8.150 nan 0.000 0.473 308 W N -0.319 120.852 121.300 -0.214 0.000 2.580 308 W HA 0.155 4.815 4.660 -0.000 0.000 0.287 308 W C 1.288 177.659 176.519 -0.247 0.000 1.175 308 W CA 0.811 58.040 57.345 -0.193 0.000 1.409 308 W CB -0.180 29.194 29.460 -0.144 0.000 1.101 308 W HN 0.145 nan 8.180 nan 0.000 0.558 309 L N 1.442 122.452 121.223 -0.355 0.000 2.549 309 L HA -0.138 4.202 4.340 -0.000 0.000 0.230 309 L C 2.277 178.602 176.870 -0.907 0.000 1.162 309 L CA 1.077 55.539 54.840 -0.631 0.000 0.834 309 L CB -0.651 41.226 42.059 -0.303 0.000 0.947 309 L HN 0.001 nan 8.230 nan 0.000 0.452 310 K N -0.156 119.737 120.400 -0.846 0.000 2.076 310 K HA -0.110 4.210 4.320 -0.000 0.000 0.204 310 K C 1.464 177.756 176.600 -0.514 0.000 1.051 310 K CA 1.016 56.815 56.287 -0.814 0.000 0.949 310 K CB 0.171 32.348 32.500 -0.539 0.000 0.726 310 K HN 0.188 nan 8.250 nan 0.000 0.443 311 D N 0.514 120.639 120.400 -0.458 0.000 2.224 311 D HA -0.057 4.583 4.640 -0.000 0.000 0.205 311 D C 0.143 176.199 176.300 -0.406 0.000 0.965 311 D CA 0.838 54.626 54.000 -0.354 0.000 0.852 311 D CB 0.041 40.684 40.800 -0.262 0.000 0.947 311 D HN 0.121 nan 8.370 nan 0.000 0.494 312 N N 0.989 119.315 118.700 -0.623 0.000 2.699 312 N HA 0.122 4.862 4.740 -0.000 0.000 0.232 312 N C -1.946 173.330 175.510 -0.390 0.000 1.027 312 N CA -1.061 51.651 53.050 -0.565 0.000 0.920 312 N CB 2.337 40.257 38.487 -0.945 0.000 1.148 312 N HN -0.024 nan 8.380 nan 0.000 0.509 313 P HA -0.057 nan 4.420 nan 0.000 0.213 313 P C 0.982 178.239 177.300 -0.073 0.000 1.169 313 P CA 1.061 64.095 63.100 -0.110 0.000 0.885 313 P CB 0.559 32.221 31.700 -0.063 0.000 0.779 314 E N -0.443 119.716 120.200 -0.068 0.000 2.097 314 E HA -0.169 4.181 4.350 -0.000 0.000 0.196 314 E C 1.940 178.520 176.600 -0.033 0.000 1.000 314 E CA 2.094 58.474 56.400 -0.033 0.000 0.804 314 E CB -0.734 28.954 29.700 -0.020 0.000 0.740 314 E HN 0.407 nan 8.360 nan 0.000 0.454 315 T N -0.792 113.715 114.554 -0.079 0.000 2.867 315 T HA 0.014 4.364 4.350 -0.000 0.000 0.268 315 T C 2.012 176.654 174.700 -0.096 0.000 1.057 315 T CA 0.857 62.913 62.100 -0.075 0.000 1.136 315 T CB -0.117 68.685 68.868 -0.110 0.000 0.874 315 T HN 0.170 nan 8.240 nan 0.000 0.466 316 A N 2.459 125.215 122.820 -0.107 0.000 1.832 316 A HA -0.008 4.312 4.320 -0.000 0.000 0.214 316 A C 2.379 179.981 177.584 0.029 0.000 1.200 316 A CA 1.641 53.657 52.037 -0.035 0.000 0.610 316 A CB -0.796 18.227 19.000 0.038 0.000 0.842 316 A HN 0.481 nan 8.150 nan 0.000 0.444 317 K N -0.467 119.961 120.400 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 0.043 0.000 1.046 317 K CA 1.952 58.272 56.287 0.055 0.000 0.929 317 K CB -0.143 32.381 32.500 0.041 0.000 0.720 317 K HN 0.727 nan 8.250 nan 0.000 0.463 318 E N 0.584 120.807 120.200 0.038 0.000 2.028 318 E HA -0.173 4.177 4.350 -0.000 0.000 0.191 318 E C 1.910 178.549 176.600 0.065 0.000 0.988 318 E CA 1.236 57.667 56.400 0.053 0.000 0.799 318 E CB 0.009 29.751 29.700 0.070 0.000 0.755 318 E HN 0.258 nan 8.360 nan 0.000 0.447 319 I N 0.985 121.592 120.570 0.061 0.000 2.315 319 I HA -0.223 3.947 4.170 -0.000 0.000 0.248 319 I C 2.567 178.727 176.117 0.072 0.000 1.117 319 I CA 1.040 62.387 61.300 0.079 0.000 1.404 319 I CB -0.436 37.599 38.000 0.059 0.000 1.071 319 I HN 0.233 nan 8.210 nan 0.000 0.419 320 E N 1.873 122.113 120.200 0.066 0.000 2.082 320 E HA -0.365 3.985 4.350 -0.000 0.000 0.215 320 E C 2.211 178.837 176.600 0.044 0.000 1.048 320 E CA 2.179 58.617 56.400 0.064 0.000 0.869 320 E CB -0.073 29.670 29.700 0.072 0.000 0.773 320 E HN 0.328 nan 8.360 nan 0.000 0.466 321 K N 0.194 120.616 120.400 0.037 0.000 2.009 321 K HA -0.190 4.130 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 1.860 58.163 56.287 0.027 0.000 0.929 321 K CB -0.025 32.490 32.500 0.025 0.000 0.714 321 K HN 0.030 nan 8.250 nan 0.000 0.440 322 K N 0.113 120.544 120.400 0.051 0.000 2.281 322 K HA -0.126 4.194 4.320 -0.000 0.000 0.203 322 K C 1.845 178.477 176.600 0.053 0.000 1.046 322 K CA 1.178 57.498 56.287 0.056 0.000 0.938 322 K CB 0.082 32.627 32.500 0.076 0.000 0.737 322 K HN 0.039 nan 8.250 nan 0.000 0.458 323 V N 0.616 120.562 119.914 0.054 0.000 2.346 323 V HA -0.163 3.957 4.120 -0.000 0.000 0.244 323 V C 2.158 178.273 176.094 0.035 0.000 1.037 323 V CA 1.274 63.604 62.300 0.050 0.000 1.029 323 V CB -0.451 31.406 31.823 0.056 0.000 0.663 323 V HN 0.245 nan 8.190 nan 0.000 0.454 324 R N 0.251 120.766 120.500 0.025 0.000 2.113 324 R HA -0.243 4.097 4.340 -0.000 0.000 0.244 324 R C 2.272 178.580 176.300 0.013 0.000 1.142 324 R CA 2.200 58.306 56.100 0.011 0.000 0.953 324 R CB -0.320 29.980 30.300 -0.001 0.000 0.860 324 R HN 0.618 nan 8.270 nan 0.000 0.438 325 E N 0.132 120.343 120.200 0.018 0.000 2.347 325 E HA -0.095 4.255 4.350 -0.000 0.000 0.196 325 E C 1.512 178.125 176.600 0.021 0.000 1.008 325 E CA 0.479 56.889 56.400 0.017 0.000 0.852 325 E CB 0.122 29.834 29.700 0.019 0.000 0.783 325 E HN 0.312 nan 8.360 nan 0.000 0.505 326 L N 0.275 121.514 121.223 0.026 0.000 2.591 326 L HA 0.045 4.385 4.340 -0.000 0.000 0.228 326 L C 1.335 178.221 176.870 0.027 0.000 1.133 326 L CA 0.239 55.096 54.840 0.028 0.000 0.880 326 L CB 0.267 42.347 42.059 0.036 0.000 1.033 326 L HN 0.152 nan 8.230 nan 0.000 0.450 327 L N -2.540 118.697 121.223 0.023 0.000 2.678 327 L HA 0.157 4.497 4.340 -0.000 0.000 0.187 327 L C 0.487 177.368 176.870 0.018 0.000 1.073 327 L CA -0.418 54.436 54.840 0.023 0.000 0.883 327 L CB -0.005 42.069 42.059 0.026 0.000 1.501 327 L HN -0.111 nan 8.230 nan 0.000 0.488 1007 Q N 0.443 120.246 119.800 0.005 0.000 2.403 1007 Q HA 0.178 4.518 4.340 -0.000 0.000 0.203 1007 Q C -0.041 175.964 176.000 0.008 0.000 0.932 1007 Q CA 0.561 56.368 55.803 0.006 0.000 0.945 1007 Q CB 0.330 29.071 28.738 0.005 0.000 1.045 1007 Q HN 0.152 nan 8.270 nan 0.000 0.511 1008 K N -0.783 119.621 120.400 0.008 0.000 2.438 1008 K HA 0.272 4.592 4.320 -0.000 0.000 0.205 1008 K C 0.964 177.570 176.600 0.010 0.000 1.033 1008 K CA 0.025 56.317 56.287 0.009 0.000 1.089 1008 K CB 0.932 33.437 32.500 0.008 0.000 0.857 1008 K HN 0.021 nan 8.250 nan 0.000 0.522 1009 A N 0.704 123.529 122.820 0.010 0.000 2.067 1009 A HA -0.025 4.295 4.320 -0.000 0.000 0.217 1009 A C 1.800 179.393 177.584 0.014 0.000 1.156 1009 A CA 0.767 52.811 52.037 0.011 0.000 0.683 1009 A CB -0.003 19.003 19.000 0.010 0.000 0.808 1009 A HN 0.223 nan 8.150 nan 0.000 0.455 1010 L N -0.726 120.505 121.223 0.014 0.000 2.121 1010 L HA 0.285 4.625 4.340 -0.000 0.000 0.200 1010 L C 2.689 179.570 176.870 0.019 0.000 1.132 1010 L CA 1.653 56.503 54.840 0.017 0.000 0.782 1010 L CB -0.809 41.259 42.059 0.015 0.000 0.940 1010 L HN 0.235 nan 8.230 nan 0.000 0.458 1011 A N -0.286 122.544 122.820 0.017 0.000 1.997 1011 A HA -0.260 4.060 4.320 -0.000 0.000 0.221 1011 A C 2.278 179.873 177.584 0.018 0.000 1.172 1011 A CA 2.342 54.389 52.037 0.017 0.000 0.645 1011 A CB -1.263 17.746 19.000 0.014 0.000 0.813 1011 A HN 0.656 nan 8.150 nan 0.000 0.454 1012 A N -0.635 122.194 122.820 0.016 0.000 1.874 1012 A HA 0.361 4.681 4.320 -0.000 0.000 0.214 1012 A C 2.411 180.006 177.584 0.019 0.000 1.189 1012 A CA 1.517 53.563 52.037 0.015 0.000 0.615 1012 A CB -0.944 18.063 19.000 0.012 0.000 0.830 1012 A HN 1.133 nan 8.150 nan 0.000 0.443 1013 A N -0.688 122.145 122.820 0.022 0.000 2.172 1013 A HA 0.186 4.506 4.320 -0.000 0.000 0.216 1013 A C 1.999 179.606 177.584 0.038 0.000 1.154 1013 A CA 0.840 52.894 52.037 0.028 0.000 0.701 1013 A CB -0.451 18.566 19.000 0.028 0.000 0.789 1013 A HN 0.475 nan 8.150 nan 0.000 0.465 1014 L N -1.145 120.099 121.223 0.035 0.000 2.013 1014 L HA -0.017 4.323 4.340 -0.000 0.000 0.204 1014 L C 2.838 179.736 176.870 0.047 0.000 1.081 1014 L CA 1.098 55.963 54.840 0.043 0.000 0.751 1014 L CB -1.013 41.068 42.059 0.036 0.000 0.901 1014 L HN 0.441 nan 8.230 nan 0.000 0.440 1015 G N -0.905 107.916 108.800 0.036 0.000 2.581 1015 G HA2 -0.293 3.666 3.960 -0.000 0.000 0.223 1015 G HA3 -0.293 3.666 3.960 -0.000 0.000 0.223 1015 G C 1.448 176.367 174.900 0.032 0.000 1.094 1015 G CA 0.497 45.615 45.100 0.032 0.000 0.736 1015 G HN 0.365 nan 8.290 nan 0.000 0.588 1016 Q N -0.186 119.634 119.800 0.033 0.000 2.020 1016 Q HA -0.084 4.256 4.340 -0.000 0.000 0.202 1016 Q C 2.724 178.753 176.000 0.049 0.000 0.982 1016 Q CA 1.053 56.873 55.803 0.028 0.000 0.838 1016 Q CB -0.247 28.509 28.738 0.029 0.000 0.899 1016 Q HN 0.495 nan 8.270 nan 0.000 0.423 1017 I N 0.872 121.500 120.570 0.098 0.000 2.614 1017 I HA -0.147 4.023 4.170 -0.000 0.000 0.258 1017 I C 2.031 178.276 176.117 0.213 0.000 1.189 1017 I CA 0.963 62.383 61.300 0.201 0.000 1.462 1017 I CB -1.151 36.966 38.000 0.195 0.000 1.092 1017 I HN 0.218 nan 8.210 nan 0.000 0.442 1018 E N 1.360 121.631 120.200 0.118 0.000 2.015 1018 E HA -0.217 4.133 4.350 -0.000 0.000 0.191 1018 E C 2.152 178.794 176.600 0.069 0.000 0.991 1018 E CA 0.952 57.410 56.400 0.097 0.000 0.802 1018 E CB -0.102 29.634 29.700 0.061 0.000 0.759 1018 E HN 0.377 nan 8.360 nan 0.000 0.447 1019 K N 1.008 121.425 120.400 0.028 0.000 2.152 1019 K HA -0.216 4.104 4.320 -0.000 0.000 0.206 1019 K C 2.138 178.705 176.600 -0.055 0.000 1.048 1019 K CA 1.246 57.529 56.287 -0.007 0.000 0.933 1019 K CB -0.008 32.482 32.500 -0.016 0.000 0.721 1019 K HN 0.072 nan 8.250 nan 0.000 0.447 1020 Q N -1.049 118.693 119.800 -0.096 0.000 2.167 1020 Q HA -0.096 4.244 4.340 -0.000 0.000 0.202 1020 Q C 0.277 175.954 176.000 -0.539 0.000 0.970 1020 Q CA 1.181 56.784 55.803 -0.333 0.000 0.855 1020 Q CB 0.234 28.726 28.738 -0.410 0.000 0.911 1020 Q HN 0.238 nan 8.270 nan 0.000 0.438 1021 F N -0.636 119.315 119.950 0.003 0.000 2.764 1021 F HA 0.383 4.910 4.527 -0.000 0.000 0.310 1021 F C 0.260 176.058 175.800 -0.002 0.000 1.124 1021 F CA 0.243 58.243 58.000 0.001 0.000 1.252 1021 F CB 1.376 40.380 39.000 0.006 0.000 1.010 1021 F HN 0.022 nan 8.300 nan 0.000 0.518 1022 G N 1.230 110.094 108.800 0.106 0.000 2.879 1022 G HA2 -0.203 3.757 3.960 -0.000 0.000 0.686 1022 G HA3 -0.203 3.757 3.960 -0.000 0.000 0.686 1022 G C -0.658 174.282 174.900 0.067 0.000 1.115 1022 G CA -1.281 43.859 45.100 0.067 0.000 0.770 1022 G HN 0.114 nan 8.290 nan 0.000 0.601 1023 K N 0.918 121.341 120.400 0.038 0.000 2.419 1023 K HA 0.519 4.839 4.320 -0.000 0.000 0.282 1023 K C 1.009 177.630 176.600 0.035 0.000 1.056 1023 K CA 1.494 57.801 56.287 0.034 0.000 1.035 1023 K CB 0.696 33.207 32.500 0.019 0.000 0.921 1023 K HN 2.276 nan 8.250 nan 0.000 0.472 1024 G N 2.454 111.280 108.800 0.044 0.000 2.905 1024 G HA2 -0.158 3.802 3.960 -0.000 0.000 0.245 1024 G HA3 -0.158 3.802 3.960 -0.000 0.000 0.245 1024 G C -0.006 174.923 174.900 0.048 0.000 1.004 1024 G CA -0.013 45.112 45.100 0.041 0.000 1.089 1024 G HN 0.671 nan 8.290 nan 0.000 0.456 1025 S N 0.561 116.296 115.700 0.059 0.000 3.004 1025 S HA 0.568 5.038 4.470 -0.000 0.000 0.244 1025 S C 0.040 174.670 174.600 0.049 0.000 0.870 1025 S CA 0.334 58.567 58.200 0.055 0.000 1.267 1025 S CB 0.146 63.382 63.200 0.060 0.000 1.208 1025 S HN 1.997 nan 8.310 nan 0.000 0.624 1026 I N 1.555 122.159 120.570 0.058 0.000 2.800 1026 I HA 0.616 4.786 4.170 -0.000 0.000 0.294 1026 I C -2.268 173.886 176.117 0.063 0.000 1.538 1026 I CA -0.952 60.385 61.300 0.061 0.000 1.010 1026 I CB 1.934 39.962 38.000 0.048 0.000 1.381 1026 I HN 0.376 nan 8.210 nan 0.000 0.462 1027 M N 4.424 124.067 119.600 0.071 0.000 2.790 1027 M HA 0.506 4.986 4.480 -0.000 0.000 0.272 1027 M C -1.662 174.677 176.300 0.065 0.000 1.168 1027 M CA -1.013 54.324 55.300 0.062 0.000 0.829 1027 M CB 1.915 34.548 32.600 0.054 0.000 1.675 1027 M HN 0.512 nan 8.290 nan 0.000 0.505 1028 R N 0.658 121.188 120.500 0.049 0.000 2.643 1028 R HA 0.348 4.688 4.340 -0.000 0.000 0.270 1028 R C 0.661 176.989 176.300 0.047 0.000 1.061 1028 R CA -0.148 55.976 56.100 0.041 0.000 1.107 1028 R CB 0.673 30.989 30.300 0.027 0.000 0.999 1028 R HN 0.622 nan 8.270 nan 0.000 0.460 1029 L N 1.134 122.383 121.223 0.044 0.000 2.068 1029 L HA 0.039 4.379 4.340 -0.000 0.000 0.204 1029 L C 1.597 178.490 176.870 0.040 0.000 1.076 1029 L CA 1.117 55.990 54.840 0.055 0.000 0.753 1029 L CB -0.216 41.875 42.059 0.053 0.000 0.910 1029 L HN 0.787 nan 8.230 nan 0.000 0.439 1030 G N 1.096 109.911 108.800 0.025 0.000 2.916 1030 G HA2 0.211 4.171 3.960 -0.000 0.000 0.280 1030 G HA3 0.211 4.171 3.960 -0.000 0.000 0.280 1030 G C -0.337 174.574 174.900 0.019 0.000 0.758 1030 G CA -0.014 45.098 45.100 0.019 0.000 1.993 1030 G HN 0.205 nan 8.290 nan 0.000 0.564 1031 E N 0.712 120.925 120.200 0.021 0.000 2.292 1031 E HA 0.170 4.520 4.350 -0.000 0.000 0.272 1031 E C -0.592 176.018 176.600 0.016 0.000 0.881 1031 E CA -0.619 55.792 56.400 0.019 0.000 0.754 1031 E CB 1.949 31.662 29.700 0.022 0.000 1.201 1031 E HN 0.245 nan 8.360 nan 0.000 0.425 1032 D N 0.877 121.285 120.400 0.013 0.000 2.340 1032 D HA 0.011 4.651 4.640 -0.000 0.000 0.220 1032 D C -0.015 176.290 176.300 0.009 0.000 1.039 1032 D CA 0.242 54.248 54.000 0.010 0.000 0.866 1032 D CB 0.271 41.076 40.800 0.009 0.000 0.913 1032 D HN -0.082 nan 8.370 nan 0.000 0.523 1033 R N 1.431 121.938 120.500 0.011 0.000 2.309 1033 R HA 0.169 4.509 4.340 -0.000 0.000 0.331 1033 R C -0.528 175.777 176.300 0.008 0.000 1.116 1033 R CA 0.047 56.153 56.100 0.010 0.000 0.970 1033 R CB 0.099 30.407 30.300 0.013 0.000 1.024 1033 R HN 0.078 nan 8.270 nan 0.000 0.472 1034 S N 4.032 119.734 115.700 0.004 0.000 2.530 1034 S HA 0.351 4.821 4.470 -0.000 0.000 0.322 1034 S C 0.402 175.001 174.600 -0.001 0.000 1.085 1034 S CA -1.095 57.105 58.200 -0.001 0.000 1.096 1034 S CB 1.261 64.457 63.200 -0.005 0.000 0.988 1034 S HN 0.427 nan 8.310 nan 0.000 0.466 1035 M N 1.676 121.276 119.600 -0.000 0.000 2.252 1035 M HA 0.186 4.666 4.480 -0.000 0.000 0.329 1035 M C -0.198 176.099 176.300 -0.005 0.000 1.101 1035 M CA 0.056 55.355 55.300 -0.001 0.000 1.117 1035 M CB -0.356 32.245 32.600 0.000 0.000 1.563 1035 M HN 0.513 nan 8.290 nan 0.000 0.445 1036 D N 2.390 122.788 120.400 -0.005 0.000 2.688 1036 D HA 0.294 4.934 4.640 -0.000 0.000 0.228 1036 D C -0.718 175.577 176.300 -0.009 0.000 1.116 1036 D CA -0.022 53.974 54.000 -0.007 0.000 1.023 1036 D CB 0.106 40.903 40.800 -0.005 0.000 1.100 1036 D HN 0.443 nan 8.370 nan 0.000 0.487 1037 V N -1.020 118.887 119.914 -0.012 0.000 2.630 1037 V HA 0.456 4.576 4.120 -0.000 0.000 0.305 1037 V C 0.460 176.542 176.094 -0.019 0.000 1.046 1037 V CA -1.077 61.214 62.300 -0.015 0.000 0.934 1037 V CB 1.919 33.732 31.823 -0.015 0.000 1.003 1037 V HN 0.073 nan 8.190 nan 0.000 0.451 1038 E N 2.253 122.441 120.200 -0.019 0.000 2.414 1038 E HA 0.271 4.621 4.350 -0.000 0.000 0.263 1038 E C 0.012 176.595 176.600 -0.028 0.000 1.000 1038 E CA 0.297 56.684 56.400 -0.022 0.000 0.914 1038 E CB 0.979 30.667 29.700 -0.021 0.000 0.948 1038 E HN 1.007 nan 8.360 nan 0.000 0.444 1039 T N 1.086 115.621 114.554 -0.031 0.000 2.797 1039 T HA 0.525 4.875 4.350 -0.000 0.000 0.279 1039 T C -0.195 174.479 174.700 -0.043 0.000 0.991 1039 T CA -0.903 61.174 62.100 -0.038 0.000 0.979 1039 T CB 0.859 69.704 68.868 -0.039 0.000 0.943 1039 T HN 0.149 nan 8.240 nan 0.000 0.444 1040 I N 2.719 123.259 120.570 -0.050 0.000 2.418 1040 I HA 0.333 4.503 4.170 -0.000 0.000 0.287 1040 I C 0.709 176.783 176.117 -0.070 0.000 1.008 1040 I CA -0.573 60.694 61.300 -0.055 0.000 1.104 1040 I CB 1.710 39.680 38.000 -0.051 0.000 1.264 1040 I HN 0.842 nan 8.210 nan 0.000 0.438 1041 S N 3.533 119.185 115.700 -0.080 0.000 2.537 1041 S HA 0.030 4.500 4.470 -0.000 0.000 0.286 1041 S C 1.575 176.102 174.600 -0.122 0.000 1.299 1041 S CA 0.067 58.202 58.200 -0.110 0.000 1.067 1041 S CB 0.386 63.511 63.200 -0.124 0.000 0.864 1041 S HN 0.780 nan 8.310 nan 0.000 0.494 1042 T N 2.391 116.859 114.554 -0.143 0.000 3.035 1042 T HA 0.243 4.593 4.350 -0.000 0.000 0.268 1042 T C 1.542 176.138 174.700 -0.174 0.000 1.109 1042 T CA 0.906 62.921 62.100 -0.142 0.000 1.119 1042 T CB -0.356 68.421 68.868 -0.152 0.000 0.900 1042 T HN 1.343 nan 8.240 nan 0.000 0.503 1043 G N 0.639 109.303 108.800 -0.227 0.000 2.284 1043 G HA2 -0.205 3.755 3.960 -0.000 0.000 0.216 1043 G HA3 -0.205 3.755 3.960 -0.000 0.000 0.216 1043 G C 0.304 174.951 174.900 -0.421 0.000 1.009 1043 G CA 0.159 45.092 45.100 -0.278 0.000 0.625 1043 G HN 1.107 nan 8.290 nan 0.000 0.501 1044 S N 1.339 116.764 115.700 -0.458 0.000 2.433 1044 S HA 0.665 5.135 4.470 -0.000 0.000 0.310 1044 S C 1.762 176.094 174.600 -0.446 0.000 1.097 1044 S CA -0.423 57.416 58.200 -0.602 0.000 1.103 1044 S CB 0.734 63.362 63.200 -0.954 0.000 0.992 1044 S HN 0.342 nan 8.310 nan 0.000 0.469 1045 L N 4.166 125.131 121.223 -0.431 0.000 1.990 1045 L HA -0.131 4.209 4.340 -0.000 0.000 0.213 1045 L C 2.854 179.599 176.870 -0.209 0.000 1.072 1045 L CA 2.370 57.037 54.840 -0.289 0.000 0.755 1045 L CB -1.557 40.354 42.059 -0.247 0.000 0.889 1045 L HN 0.925 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 -0.179 4.291 4.470 -0.000 0.000 0.236 1046 S C 1.927 176.464 174.600 -0.106 0.000 1.007 1046 S CA 0.854 58.985 58.200 -0.115 0.000 0.965 1046 S CB -0.520 62.656 63.200 -0.041 0.000 0.773 1046 S HN 0.393 nan 8.310 nan 0.000 0.504 1047 L N 1.411 122.522 121.223 -0.187 0.000 2.034 1047 L HA -0.067 4.273 4.340 -0.000 0.000 0.203 1047 L C 2.115 178.918 176.870 -0.112 0.000 1.074 1047 L CA 1.741 56.501 54.840 -0.133 0.000 0.748 1047 L CB -0.532 41.420 42.059 -0.178 0.000 0.905 1047 L HN 0.156 nan 8.230 nan 0.000 0.439 1048 D N 0.274 120.590 120.400 -0.141 0.000 2.170 1048 D HA -0.269 4.371 4.640 -0.000 0.000 0.193 1048 D C 2.108 178.361 176.300 -0.078 0.000 1.004 1048 D CA 1.695 55.629 54.000 -0.111 0.000 0.860 1048 D CB -0.271 40.454 40.800 -0.125 0.000 0.931 1048 D HN 0.369 nan 8.370 nan 0.000 0.448 1049 I N 0.848 121.373 120.570 -0.074 0.000 2.127 1049 I HA -0.273 3.897 4.170 -0.000 0.000 0.241 1049 I C 2.371 178.470 176.117 -0.030 0.000 1.075 1049 I CA 1.441 62.715 61.300 -0.045 0.000 1.334 1049 I CB -0.144 37.834 38.000 -0.037 0.000 1.040 1049 I HN -0.047 nan 8.210 nan 0.000 0.405 1050 A N -0.035 122.767 122.820 -0.030 0.000 2.119 1050 A HA 0.000 4.320 4.320 -0.000 0.000 0.216 1050 A C 2.250 179.816 177.584 -0.030 0.000 1.152 1050 A CA 0.643 52.671 52.037 -0.016 0.000 0.708 1050 A CB -0.577 18.422 19.000 -0.001 0.000 0.805 1050 A HN 0.363 nan 8.150 nan 0.000 0.460 1051 L N -1.442 119.753 121.223 -0.047 0.000 2.042 1051 L HA -0.107 4.233 4.340 -0.000 0.000 0.210 1051 L C 2.292 179.137 176.870 -0.042 0.000 1.076 1051 L CA 1.540 56.346 54.840 -0.055 0.000 0.749 1051 L CB -0.287 41.733 42.059 -0.064 0.000 0.893 1051 L HN 0.607 nan 8.230 nan 0.000 0.432 1052 G N -1.891 106.889 108.800 -0.033 0.000 2.399 1052 G HA2 -0.334 3.626 3.960 -0.000 0.000 0.216 1052 G HA3 -0.334 3.626 3.960 -0.000 0.000 0.216 1052 G C 1.043 175.929 174.900 -0.024 0.000 1.096 1052 G CA 0.424 45.511 45.100 -0.022 0.000 0.650 1052 G HN 0.449 nan 8.290 nan 0.000 0.512 1053 A N 0.460 123.261 122.820 -0.032 0.000 2.072 1053 A HA 0.544 4.864 4.320 -0.000 0.000 0.216 1053 A C 2.480 180.042 177.584 -0.036 0.000 1.156 1053 A CA 2.159 54.178 52.037 -0.030 0.000 0.701 1053 A CB -0.493 18.487 19.000 -0.033 0.000 0.816 1053 A HN 2.590 nan 8.150 nan 0.000 0.458 1054 G N -2.108 106.665 108.800 -0.046 0.000 2.203 1054 G HA2 0.401 4.361 3.960 -0.000 0.000 0.231 1054 G HA3 0.401 4.361 3.960 -0.000 0.000 0.231 1054 G C 0.760 175.621 174.900 -0.065 0.000 1.058 1054 G CA 0.305 45.371 45.100 -0.056 0.000 0.781 1054 G HN 2.281 nan 8.290 nan 0.000 0.496 1055 G N -1.578 107.180 108.800 -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 -0.525 174.337 174.900 -0.064 0.000 1.412 1055 G CA -0.562 44.495 45.100 -0.072 0.000 0.990 1055 G HN 0.983 nan 8.290 nan 0.000 0.637 1056 L N 1.819 123.003 121.223 -0.065 0.000 2.380 1056 L HA 0.337 4.677 4.340 -0.000 0.000 0.273 1056 L C -1.493 175.346 176.870 -0.051 0.000 1.138 1056 L CA -1.627 53.177 54.840 -0.060 0.000 0.832 1056 L CB 1.180 43.202 42.059 -0.061 0.000 1.124 1056 L HN 0.329 nan 8.230 nan 0.000 0.454 1057 P HA -0.058 nan 4.420 nan 0.000 0.257 1057 P C -0.184 177.093 177.300 -0.037 0.000 1.227 1057 P CA 0.036 63.113 63.100 -0.039 0.000 0.981 1057 P CB 0.239 31.916 31.700 -0.038 0.000 1.044 1058 M N 2.663 122.242 119.600 -0.035 0.000 2.336 1058 M HA 0.017 4.497 4.480 -0.000 0.000 0.371 1058 M C 1.466 177.749 176.300 -0.028 0.000 1.542 1058 M CA 1.480 56.761 55.300 -0.032 0.000 0.959 1058 M CB -0.974 31.610 32.600 -0.028 0.000 2.033 1058 M HN 0.776 nan 8.290 nan 0.000 0.472 1059 G N 3.579 112.361 108.800 -0.030 0.000 2.130 1059 G HA2 -0.168 3.792 3.960 -0.000 0.000 0.216 1059 G HA3 -0.168 3.792 3.960 -0.000 0.000 0.216 1059 G C 0.001 174.886 174.900 -0.025 0.000 0.999 1059 G CA -0.422 44.663 45.100 -0.025 0.000 0.686 1059 G HN 0.586 nan 8.290 nan 0.000 0.515 1060 R N -0.988 119.493 120.500 -0.031 0.000 2.922 1060 R HA 0.707 5.047 4.340 -0.000 0.000 0.256 1060 R C -0.267 176.015 176.300 -0.029 0.000 1.138 1060 R CA -1.005 55.079 56.100 -0.026 0.000 0.995 1060 R CB 0.947 31.231 30.300 -0.027 0.000 1.226 1060 R HN 0.183 nan 8.270 nan 0.000 0.481 1061 I N 1.481 122.049 120.570 -0.003 0.000 2.321 1061 I HA 0.286 4.456 4.170 -0.000 0.000 0.291 1061 I C -0.360 175.766 176.117 0.016 0.000 0.998 1061 I CA -0.850 60.457 61.300 0.012 0.000 1.227 1061 I CB 1.758 39.828 38.000 0.118 0.000 1.368 1061 I HN 0.007 nan 8.210 nan 0.000 0.466 1062 V N 6.147 126.052 119.914 -0.015 0.000 2.378 1062 V HA 0.277 4.397 4.120 -0.000 0.000 0.288 1062 V C -0.019 176.098 176.094 0.039 0.000 1.016 1062 V CA -0.656 61.636 62.300 -0.014 0.000 0.840 1062 V CB 1.622 33.416 31.823 -0.048 0.000 0.994 1062 V HN 0.709 nan 8.190 nan 0.000 0.431 1063 E N 5.240 125.468 120.200 0.048 0.000 2.109 1063 E HA 0.489 4.839 4.350 -0.000 0.000 0.278 1063 E C -1.110 175.474 176.600 -0.026 0.000 0.954 1063 E CA -0.578 55.874 56.400 0.086 0.000 0.779 1063 E CB 1.071 30.831 29.700 0.100 0.000 1.093 1063 E HN 0.681 nan 8.360 nan 0.000 0.401 1064 I N 6.578 127.151 120.570 0.005 0.000 2.307 1064 I HA 0.185 4.355 4.170 -0.000 0.000 0.287 1064 I C -0.515 175.629 176.117 0.044 0.000 1.054 1064 I CA -0.973 60.299 61.300 -0.048 0.000 1.218 1064 I CB -0.080 37.914 38.000 -0.011 0.000 1.398 1064 I HN 0.434 nan 8.210 nan 0.000 0.475 1065 Y N 4.309 124.611 120.300 0.002 0.000 2.453 1065 Y HA 0.968 5.518 4.550 -0.000 0.000 0.326 1065 Y C 0.029 175.927 175.900 -0.002 0.000 1.186 1065 Y CA -2.498 55.601 58.100 -0.002 0.000 1.200 1065 Y CB 1.441 39.891 38.460 -0.017 0.000 1.247 1065 Y HN 0.572 nan 8.280 nan 0.000 0.482 1066 G N 1.617 110.621 108.800 0.340 0.000 2.433 1066 G HA2 0.374 4.334 3.960 -0.000 0.000 0.306 1066 G HA3 0.374 4.334 3.960 -0.000 0.000 0.306 1066 G C -3.493 171.454 174.900 0.078 0.000 1.627 1066 G CA -1.344 43.882 45.100 0.211 0.000 0.893 1066 G HN 0.492 nan 8.290 nan 0.000 0.648 1067 P HA -0.048 nan 4.420 nan 0.000 0.263 1067 P C 0.816 178.121 177.300 0.009 0.000 1.145 1067 P CA 0.728 63.833 63.100 0.007 0.000 0.755 1067 P CB 0.253 31.957 31.700 0.006 0.000 0.746 1068 E N 1.927 122.126 120.200 -0.001 0.000 2.534 1068 E HA -0.037 4.313 4.350 -0.000 0.000 0.264 1068 E C -0.194 176.401 176.600 -0.009 0.000 0.981 1068 E CA 0.062 56.461 56.400 -0.003 0.000 0.948 1068 E CB -0.365 29.329 29.700 -0.009 0.000 0.934 1068 E HN 0.344 nan 8.360 nan 0.000 0.459 1069 S N 1.063 116.753 115.700 -0.016 0.000 3.587 1069 S HA -0.217 4.253 4.470 -0.000 0.000 0.337 1069 S C 0.834 175.414 174.600 -0.034 0.000 1.119 1069 S CA 0.952 59.131 58.200 -0.035 0.000 0.976 1069 S CB -2.054 61.124 63.200 -0.037 0.000 0.922 1069 S HN 0.760 nan 8.310 nan 0.000 0.503 1070 S N -0.215 115.474 115.700 -0.018 0.000 2.439 1070 S HA 0.460 4.930 4.470 -0.000 0.000 0.224 1070 S C 1.730 176.312 174.600 -0.029 0.000 1.029 1070 S CA 0.713 58.903 58.200 -0.015 0.000 0.946 1070 S CB 0.353 63.559 63.200 0.010 0.000 0.797 1070 S HN 1.830 nan 8.310 nan 0.000 0.504 1071 G N 2.014 110.802 108.800 -0.020 0.000 2.425 1071 G HA2 -0.192 3.768 3.960 -0.000 0.000 0.177 1071 G HA3 -0.192 3.768 3.960 -0.000 0.000 0.177 1071 G C 0.858 175.775 174.900 0.029 0.000 0.999 1071 G CA 0.155 45.247 45.100 -0.012 0.000 0.723 1071 G HN 0.488 nan 8.290 nan 0.000 0.491 1072 K N -0.093 120.327 120.400 0.033 0.000 2.034 1072 K HA -0.169 4.151 4.320 -0.000 0.000 0.214 1072 K C 1.966 178.604 176.600 0.062 0.000 1.051 1072 K CA 2.048 58.366 56.287 0.052 0.000 0.931 1072 K CB -0.889 31.645 32.500 0.057 0.000 0.715 1072 K HN 0.158 nan 8.250 nan 0.000 0.446 1073 T N 0.743 115.334 114.554 0.062 0.000 2.867 1073 T HA -0.073 4.277 4.350 -0.000 0.000 0.268 1073 T C 1.708 176.467 174.700 0.099 0.000 1.057 1073 T CA 1.794 63.944 62.100 0.084 0.000 1.136 1073 T CB -0.400 68.521 68.868 0.089 0.000 0.874 1073 T HN 0.452 nan 8.240 nan 0.000 0.466 1074 T N 2.300 116.921 114.554 0.112 0.000 2.622 1074 T HA -0.064 4.286 4.350 -0.000 0.000 0.266 1074 T C 1.858 176.615 174.700 0.097 0.000 1.047 1074 T CA 1.269 63.469 62.100 0.166 0.000 1.159 1074 T CB -0.592 68.392 68.868 0.192 0.000 0.863 1074 T HN 0.295 nan 8.240 nan 0.000 0.422 1075 L N 0.507 121.785 121.223 0.091 0.000 2.079 1075 L HA -0.181 4.159 4.340 -0.000 0.000 0.210 1075 L C 2.555 179.442 176.870 0.028 0.000 1.081 1075 L CA 1.500 56.379 54.840 0.064 0.000 0.752 1075 L CB -0.689 41.424 42.059 0.090 0.000 0.896 1075 L HN 0.264 nan 8.230 nan 0.000 0.433 1076 T N 0.005 114.586 114.554 0.045 0.000 2.674 1076 T HA -0.186 4.164 4.350 -0.000 0.000 0.265 1076 T C 1.712 176.427 174.700 0.025 0.000 1.039 1076 T CA 1.678 63.804 62.100 0.043 0.000 1.150 1076 T CB -0.221 68.695 68.868 0.080 0.000 0.864 1076 T HN 0.173 nan 8.240 nan 0.000 0.427 1077 L N 1.234 122.471 121.223 0.023 0.000 2.353 1077 L HA -0.007 4.333 4.340 -0.000 0.000 0.220 1077 L C 2.573 179.411 176.870 -0.053 0.000 1.133 1077 L CA 1.369 56.192 54.840 -0.028 0.000 0.798 1077 L CB -0.550 41.489 42.059 -0.032 0.000 0.922 1077 L HN 0.229 nan 8.230 nan 0.000 0.445 1078 Q N -1.018 118.758 119.800 -0.041 0.000 2.212 1078 Q HA -0.052 4.288 4.340 -0.000 0.000 0.199 1078 Q C 2.318 178.276 176.000 -0.070 0.000 0.950 1078 Q CA 1.562 57.325 55.803 -0.066 0.000 0.863 1078 Q CB 0.011 28.711 28.738 -0.064 0.000 0.944 1078 Q HN 0.568 nan 8.270 nan 0.000 0.465 1079 V N -1.365 118.516 119.914 -0.055 0.000 2.307 1079 V HA -0.194 3.926 4.120 -0.000 0.000 0.245 1079 V C 2.256 178.319 176.094 -0.051 0.000 1.045 1079 V CA 1.244 63.510 62.300 -0.057 0.000 1.024 1079 V CB -0.979 30.815 31.823 -0.048 0.000 0.651 1079 V HN 0.152 nan 8.190 nan 0.000 0.449 1080 I N 1.336 121.881 120.570 -0.042 0.000 2.315 1080 I HA -0.261 3.909 4.170 -0.000 0.000 0.251 1080 I C 2.899 178.981 176.117 -0.058 0.000 1.125 1080 I CA 1.649 62.922 61.300 -0.045 0.000 1.392 1080 I CB -0.730 37.240 38.000 -0.050 0.000 1.065 1080 I HN 0.404 nan 8.210 nan 0.000 0.424 1081 A N 1.044 123.824 122.820 -0.068 0.000 1.828 1081 A HA -0.185 4.135 4.320 -0.000 0.000 0.215 1081 A C 2.580 180.128 177.584 -0.060 0.000 1.203 1081 A CA 2.052 54.047 52.037 -0.071 0.000 0.614 1081 A CB -1.082 17.869 19.000 -0.082 0.000 0.844 1081 A HN 0.412 nan 8.150 nan 0.000 0.445 1082 A N -0.605 122.177 122.820 -0.064 0.000 1.972 1082 A HA 0.179 4.499 4.320 -0.000 0.000 0.219 1082 A C 2.400 179.955 177.584 -0.048 0.000 1.169 1082 A CA 2.108 54.110 52.037 -0.058 0.000 0.635 1082 A CB -0.844 18.111 19.000 -0.074 0.000 0.810 1082 A HN 1.103 nan 8.150 nan 0.000 0.446 1083 A N -1.255 121.537 122.820 -0.047 0.000 1.970 1083 A HA -0.085 4.235 4.320 -0.000 0.000 0.216 1083 A C 2.051 179.615 177.584 -0.034 0.000 1.170 1083 A CA 1.235 53.249 52.037 -0.039 0.000 0.645 1083 A CB -0.332 18.646 19.000 -0.037 0.000 0.816 1083 A HN 0.586 nan 8.150 nan 0.000 0.447 1084 Q N -1.139 118.639 119.800 -0.037 0.000 2.378 1084 Q HA 0.035 4.375 4.340 -0.000 0.000 0.205 1084 Q C 1.845 177.827 176.000 -0.031 0.000 0.954 1084 Q CA 0.522 56.304 55.803 -0.034 0.000 0.901 1084 Q CB 0.079 28.792 28.738 -0.041 0.000 0.981 1084 Q HN 0.584 nan 8.270 nan 0.000 0.483 1085 R N 0.352 120.832 120.500 -0.032 0.000 2.317 1085 R HA 0.034 4.374 4.340 -0.000 0.000 0.208 1085 R C 0.227 176.514 176.300 -0.022 0.000 0.914 1085 R CA 0.268 56.352 56.100 -0.027 0.000 1.060 1085 R CB 0.536 30.819 30.300 -0.027 0.000 1.015 1085 R HN 0.089 nan 8.270 nan 0.000 0.498 1086 E N -0.661 119.525 120.200 -0.023 0.000 2.830 1086 E HA 0.148 4.498 4.350 -0.000 0.000 0.225 1086 E C 0.286 176.875 176.600 -0.018 0.000 1.109 1086 E CA 0.062 56.450 56.400 -0.020 0.000 1.392 1086 E CB 0.998 30.685 29.700 -0.022 0.000 1.349 1086 E HN 0.456 nan 8.360 nan 0.000 0.433 1087 G N 1.644 110.434 108.800 -0.017 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 0.500 175.391 174.900 -0.014 0.000 1.033 1087 G CA 0.569 45.660 45.100 -0.014 0.000 0.633 1087 G HN 0.325 nan 8.290 nan 0.000 0.537 1088 K N 1.589 121.979 120.400 -0.016 0.000 2.380 1088 K HA 0.441 4.761 4.320 -0.000 0.000 0.267 1088 K C 0.420 177.011 176.600 -0.015 0.000 0.990 1088 K CA 0.927 57.204 56.287 -0.016 0.000 0.946 1088 K CB 0.422 32.910 32.500 -0.019 0.000 0.937 1088 K HN 0.441 nan 8.250 nan 0.000 0.491 1089 T N -1.214 113.333 114.554 -0.011 0.000 2.841 1089 T HA 0.540 4.890 4.350 -0.000 0.000 0.283 1089 T C -0.231 174.466 174.700 -0.004 0.000 1.000 1089 T CA -0.969 61.126 62.100 -0.008 0.000 0.977 1089 T CB 0.627 69.494 68.868 -0.003 0.000 0.979 1089 T HN 0.575 nan 8.240 nan 0.000 0.446 1090 C N 1.630 120.929 119.300 -0.002 0.000 2.667 1090 C HA 0.988 5.448 4.460 -0.000 0.000 0.323 1090 C C 0.552 175.559 174.990 0.030 0.000 1.214 1090 C CA -1.019 58.002 59.018 0.006 0.000 1.721 1090 C CB 1.044 28.784 27.740 -0.001 0.000 2.275 1090 C HN 1.226 nan 8.230 nan 0.000 0.491 1091 A N 0.796 123.641 122.820 0.041 0.000 2.340 1091 A HA 0.861 5.181 4.320 -0.000 0.000 0.331 1091 A C -1.296 176.376 177.584 0.147 0.000 1.140 1091 A CA -0.200 51.878 52.037 0.069 0.000 0.801 1091 A CB 0.728 19.741 19.000 0.023 0.000 1.234 1091 A HN 0.867 nan 8.150 nan 0.000 0.469 1092 F N 3.714 123.644 119.950 -0.034 0.000 2.610 1092 F HA 0.473 5.000 4.527 -0.000 0.000 0.355 1092 F C -0.989 174.803 175.800 -0.013 0.000 1.140 1092 F CA -1.111 56.867 58.000 -0.037 0.000 1.037 1092 F CB 1.053 40.020 39.000 -0.055 0.000 1.287 1092 F HN 0.359 nan 8.300 nan 0.000 0.457 1093 I N 4.294 124.636 120.570 -0.381 0.000 2.301 1093 I HA 0.183 4.353 4.170 -0.000 0.000 0.292 1093 I C -0.441 175.348 176.117 -0.547 0.000 1.046 1093 I CA -0.256 60.857 61.300 -0.312 0.000 1.282 1093 I CB 0.835 38.714 38.000 -0.201 0.000 1.409 1093 I HN 0.517 nan 8.210 nan 0.000 0.484 1094 D N 5.170 125.332 120.400 -0.396 0.000 2.453 1094 D HA 0.574 5.214 4.640 -0.000 0.000 0.238 1094 D C 0.383 176.550 176.300 -0.221 0.000 1.088 1094 D CA -0.404 53.380 54.000 -0.361 0.000 0.854 1094 D CB 1.628 42.376 40.800 -0.086 0.000 1.076 1094 D HN 0.578 nan 8.370 nan 0.000 0.533 1095 A N 3.727 126.413 122.820 -0.223 0.000 2.390 1095 A HA 0.117 4.437 4.320 -0.000 0.000 0.232 1095 A C 1.562 178.945 177.584 -0.336 0.000 1.233 1095 A CA -0.077 51.839 52.037 -0.203 0.000 0.907 1095 A CB 0.136 19.138 19.000 0.003 0.000 0.967 1095 A HN 0.542 nan 8.150 nan 0.000 0.512 1096 E N -0.214 119.835 120.200 -0.252 0.000 2.140 1096 E HA -0.012 4.338 4.350 -0.000 0.000 0.191 1096 E C -0.497 176.105 176.600 0.002 0.000 0.973 1096 E CA 0.586 56.932 56.400 -0.091 0.000 0.829 1096 E CB -0.243 29.470 29.700 0.022 0.000 0.781 1096 E HN 0.784 nan 8.360 nan 0.000 0.466 1097 H N -1.048 118.147 119.070 0.208 0.000 2.819 1097 H HA -0.184 4.372 4.556 -0.000 0.000 0.315 1097 H C 0.481 175.992 175.328 0.306 0.000 1.242 1097 H CA 0.066 56.251 56.048 0.228 0.000 1.157 1097 H CB -1.454 28.321 29.762 0.022 0.000 1.451 1097 H HN 0.275 nan 8.280 nan 0.000 0.430 1098 A N 0.622 123.743 122.820 0.502 0.000 2.392 1098 A HA 0.511 4.831 4.320 -0.000 0.000 0.217 1098 A C 0.876 178.710 177.584 0.416 0.000 2.391 1098 A CA 0.088 52.347 52.037 0.371 0.000 1.329 1098 A CB -0.029 19.104 19.000 0.222 0.000 1.199 1098 A HN 0.735 nan 8.150 nan 0.000 0.527 1099 L N 1.031 122.387 121.223 0.221 0.000 3.555 1099 L HA -0.175 4.165 4.340 -0.000 0.000 0.538 1099 L C -1.018 175.850 176.870 -0.003 0.000 1.001 1099 L CA 0.716 55.528 54.840 -0.046 0.000 1.130 1099 L CB -1.076 40.671 42.059 -0.519 0.000 0.876 1099 L HN 0.561 nan 8.230 nan 0.000 0.674 1100 D N 8.075 128.493 120.400 0.030 0.000 2.365 1100 D HA 0.290 4.930 4.640 -0.000 0.000 0.237 1100 D C -1.342 174.979 176.300 0.036 0.000 1.190 1100 D CA -1.767 52.278 54.000 0.075 0.000 0.867 1100 D CB 1.111 41.961 40.800 0.083 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 1.830 179.135 177.300 0.009 0.000 1.163 1101 P CA 0.651 63.732 63.100 -0.031 0.000 0.889 1101 P CB 0.446 32.157 31.700 0.017 0.000 0.790 1102 I N -1.339 119.265 120.570 0.057 0.000 2.208 1102 I HA -0.254 3.916 4.170 -0.000 0.000 0.245 1102 I C 2.670 178.836 176.117 0.082 0.000 1.097 1102 I CA 1.676 63.014 61.300 0.064 0.000 1.363 1102 I CB -1.408 36.640 38.000 0.079 0.000 1.051 1102 I HN -0.045 nan 8.210 nan 0.000 0.413 1103 Y N 1.762 122.053 120.300 -0.015 0.000 2.242 1103 Y HA -0.190 4.360 4.550 -0.000 0.000 0.291 1103 Y C 2.599 178.475 175.900 -0.041 0.000 1.137 1103 Y CA 1.792 59.880 58.100 -0.020 0.000 1.181 1103 Y CB -0.068 38.379 38.460 -0.022 0.000 0.989 1103 Y HN 0.120 nan 8.280 nan 0.000 0.527 1104 A N 0.489 123.283 122.820 -0.043 0.000 1.933 1104 A HA -0.194 4.126 4.320 -0.000 0.000 0.218 1104 A C 2.308 179.797 177.584 -0.159 0.000 1.175 1104 A CA 1.719 53.667 52.037 -0.149 0.000 0.628 1104 A CB -0.696 18.221 19.000 -0.139 0.000 0.814 1104 A HN 0.523 nan 8.150 nan 0.000 0.444 1105 R N -0.399 120.039 120.500 -0.103 0.000 2.092 1105 R HA -0.066 4.274 4.340 -0.000 0.000 0.231 1105 R C 2.055 178.298 176.300 -0.095 0.000 1.119 1105 R CA 1.477 57.527 56.100 -0.082 0.000 0.970 1105 R CB -0.163 30.111 30.300 -0.043 0.000 0.864 1105 R HN 0.462 nan 8.270 nan 0.000 0.440 1106 K N 0.266 120.598 120.400 -0.114 0.000 2.148 1106 K HA -0.084 4.236 4.320 -0.000 0.000 0.204 1106 K C 2.023 178.514 176.600 -0.183 0.000 1.050 1106 K CA 0.761 56.976 56.287 -0.120 0.000 0.942 1106 K CB 0.016 32.456 32.500 -0.100 0.000 0.724 1106 K HN 0.230 nan 8.250 nan 0.000 0.446 1107 L N -0.687 120.364 121.223 -0.288 0.000 2.141 1107 L HA -0.116 4.224 4.340 -0.000 0.000 0.209 1107 L C 1.361 178.130 176.870 -0.168 0.000 1.094 1107 L CA 1.392 56.054 54.840 -0.297 0.000 0.763 1107 L CB 0.047 41.863 42.059 -0.406 0.000 0.908 1107 L HN 0.530 nan 8.230 nan 0.000 0.437 1108 G N -1.464 107.255 108.800 -0.135 0.000 2.370 1108 G HA2 -0.157 3.803 3.960 -0.000 0.000 0.174 1108 G HA3 -0.157 3.803 3.960 -0.000 0.000 0.174 1108 G C -0.057 174.791 174.900 -0.087 0.000 1.002 1108 G CA -0.210 44.835 45.100 -0.093 0.000 0.730 1108 G HN 0.006 nan 8.290 nan 0.000 0.497 1109 V N 1.710 121.561 119.914 -0.105 0.000 2.498 1109 V HA 0.439 4.559 4.120 -0.000 0.000 0.279 1109 V C 0.129 176.171 176.094 -0.086 0.000 1.048 1109 V CA -0.484 61.756 62.300 -0.101 0.000 0.967 1109 V CB 1.737 33.481 31.823 -0.131 0.000 0.988 1109 V HN 0.257 nan 8.190 nan 0.000 0.473 1110 D N 4.356 124.714 120.400 -0.071 0.000 2.435 1110 D HA 0.161 4.801 4.640 -0.000 0.000 0.230 1110 D C 1.029 177.291 176.300 -0.064 0.000 1.215 1110 D CA -0.272 53.694 54.000 -0.057 0.000 0.947 1110 D CB 0.635 41.410 40.800 -0.042 0.000 1.048 1110 D HN 0.288 nan 8.370 nan 0.000 0.512 1111 I N 2.706 123.233 120.570 -0.072 0.000 2.208 1111 I HA -0.258 3.912 4.170 -0.000 0.000 0.245 1111 I C 1.354 177.439 176.117 -0.054 0.000 1.097 1111 I CA 1.139 62.388 61.300 -0.084 0.000 1.363 1111 I CB -0.669 37.279 38.000 -0.086 0.000 1.051 1111 I HN 0.360 nan 8.210 nan 0.000 0.413 1112 D N 0.808 121.189 120.400 -0.032 0.000 2.190 1112 D HA -0.199 4.441 4.640 -0.000 0.000 0.200 1112 D C 1.532 177.825 176.300 -0.011 0.000 0.992 1112 D CA 1.086 55.077 54.000 -0.015 0.000 0.854 1112 D CB -0.202 40.593 40.800 -0.009 0.000 0.936 1112 D HN 0.303 nan 8.370 nan 0.000 0.462 1113 N N -0.207 118.482 118.700 -0.019 0.000 2.299 1113 N HA 0.051 4.790 4.740 -0.000 0.000 0.187 1113 N C 0.097 175.599 175.510 -0.013 0.000 1.099 1113 N CA -0.082 52.960 53.050 -0.012 0.000 0.867 1113 N CB 0.257 38.735 38.487 -0.015 0.000 0.974 1113 N HN 0.192 nan 8.380 nan 0.000 0.477 1114 L N 1.920 123.126 121.223 -0.028 0.000 2.410 1114 L HA 0.224 4.564 4.340 -0.000 0.000 0.273 1114 L C -0.435 176.438 176.870 0.004 0.000 1.152 1114 L CA -0.099 54.722 54.840 -0.032 0.000 0.855 1114 L CB 0.346 42.350 42.059 -0.093 0.000 1.129 1114 L HN -0.003 nan 8.230 nan 0.000 0.463 1115 L N 6.045 127.288 121.223 0.032 0.000 2.260 1115 L HA 0.275 4.615 4.340 -0.000 0.000 0.289 1115 L C 0.059 176.998 176.870 0.115 0.000 1.057 1115 L CA -0.259 54.618 54.840 0.063 0.000 0.811 1115 L CB 1.109 43.201 42.059 0.055 0.000 1.184 1115 L HN 0.628 nan 8.230 nan 0.000 0.429 1116 C N 3.076 122.456 119.300 0.134 0.000 2.379 1116 C HA 0.748 5.208 4.460 -0.000 0.000 0.323 1116 C C 0.220 175.326 174.990 0.193 0.000 1.262 1116 C CA -0.381 58.770 59.018 0.222 0.000 1.581 1116 C CB 1.324 29.202 27.740 0.231 0.000 2.221 1116 C HN 0.837 nan 8.230 nan 0.000 0.497 1117 S N 4.310 120.121 115.700 0.186 0.000 2.502 1117 S HA 0.542 5.012 4.470 -0.000 0.000 0.304 1117 S C -0.963 173.713 174.600 0.126 0.000 1.097 1117 S CA -0.282 57.988 58.200 0.116 0.000 1.045 1117 S CB 1.199 64.424 63.200 0.041 0.000 1.019 1117 S HN 0.902 nan 8.310 nan 0.000 0.481 1118 Q N 4.079 123.966 119.800 0.146 0.000 2.700 1118 Q HA 0.347 4.687 4.340 -0.000 0.000 0.249 1118 Q C -2.546 173.545 176.000 0.152 0.000 1.033 1118 Q CA -1.893 54.018 55.803 0.179 0.000 0.804 1118 Q CB 1.334 30.223 28.738 0.251 0.000 1.164 1118 Q HN 0.493 nan 8.270 nan 0.000 0.500 1119 P HA -0.036 nan 4.420 nan 0.000 0.271 1119 P C 0.192 177.550 177.300 0.097 0.000 1.218 1119 P CA -0.169 62.951 63.100 0.032 0.000 0.780 1119 P CB 0.904 32.568 31.700 -0.061 0.000 0.901 1120 D N -0.063 120.363 120.400 0.043 0.000 2.310 1120 D HA -0.063 4.577 4.640 -0.000 0.000 0.212 1120 D C 0.117 176.296 176.300 -0.202 0.000 0.965 1120 D CA 1.212 55.243 54.000 0.053 0.000 0.879 1120 D CB 0.564 41.419 40.800 0.091 0.000 0.921 1120 D HN 0.397 nan 8.370 nan 0.000 0.510 1121 T N -3.470 110.906 114.554 -0.296 0.000 2.774 1121 T HA 0.338 4.688 4.350 -0.000 0.000 0.325 1121 T C 1.024 175.508 174.700 -0.360 0.000 1.753 1121 T CA 0.054 61.841 62.100 -0.521 0.000 1.024 1121 T CB 0.717 69.321 68.868 -0.439 0.000 1.628 1121 T HN -0.063 nan 8.240 nan 0.000 0.497 1122 G N 1.391 109.961 108.800 -0.383 0.000 2.721 1122 G HA2 -0.246 3.714 3.960 -0.000 0.000 0.218 1122 G HA3 -0.246 3.714 3.960 -0.000 0.000 0.218 1122 G C 0.984 175.784 174.900 -0.166 0.000 1.265 1122 G CA 1.982 46.943 45.100 -0.230 0.000 0.796 1122 G HN 0.843 nan 8.290 nan 0.000 0.620 1123 E N -0.172 119.940 120.200 -0.147 0.000 2.038 1123 E HA -0.149 4.201 4.350 -0.000 0.000 0.195 1123 E C 2.530 179.041 176.600 -0.148 0.000 1.000 1123 E CA 1.472 57.809 56.400 -0.105 0.000 0.803 1123 E CB -0.313 29.349 29.700 -0.063 0.000 0.750 1123 E HN 0.660 nan 8.360 nan 0.000 0.448 1124 Q N 0.245 119.922 119.800 -0.205 0.000 2.133 1124 Q HA -0.301 4.039 4.340 -0.000 0.000 0.208 1124 Q C 2.052 177.806 176.000 -0.409 0.000 0.991 1124 Q CA 1.905 57.475 55.803 -0.389 0.000 0.867 1124 Q CB -0.241 28.278 28.738 -0.365 0.000 0.911 1124 Q HN 0.305 nan 8.270 nan 0.000 0.417 1125 A N 0.920 123.588 122.820 -0.252 0.000 1.851 1125 A HA -0.216 4.104 4.320 -0.000 0.000 0.216 1125 A C 2.092 179.599 177.584 -0.129 0.000 1.195 1125 A CA 1.692 53.624 52.037 -0.176 0.000 0.622 1125 A CB -1.058 17.872 19.000 -0.116 0.000 0.831 1125 A HN 0.501 nan 8.150 nan 0.000 0.444 1126 L N -0.791 120.384 121.223 -0.079 0.000 2.129 1126 L HA -0.252 4.088 4.340 -0.000 0.000 0.212 1126 L C 2.468 179.325 176.870 -0.022 0.000 1.087 1126 L CA 1.789 56.623 54.840 -0.010 0.000 0.757 1126 L CB -0.494 41.568 42.059 0.006 0.000 0.896 1126 L HN 0.527 nan 8.230 nan 0.000 0.434 1127 E N -0.375 119.776 120.200 -0.082 0.000 2.371 1127 E HA -0.070 4.280 4.350 -0.000 0.000 0.194 1127 E C 2.150 178.734 176.600 -0.026 0.000 1.012 1127 E CA 0.428 56.813 56.400 -0.025 0.000 0.860 1127 E CB 0.158 29.875 29.700 0.029 0.000 0.811 1127 E HN 0.518 nan 8.360 nan 0.000 0.502 1128 I N 0.538 121.024 120.570 -0.140 0.000 2.761 1128 I HA -0.225 3.945 4.170 -0.000 0.000 0.261 1128 I C 1.952 178.062 176.117 -0.012 0.000 1.198 1128 I CA 0.294 61.547 61.300 -0.077 0.000 1.482 1128 I CB -0.072 37.841 38.000 -0.144 0.000 1.100 1128 I HN 0.262 nan 8.210 nan 0.000 0.445 1129 C N 0.027 119.315 119.300 -0.021 0.000 2.476 1129 C HA -0.127 4.333 4.460 -0.000 0.000 0.278 1129 C C 2.434 177.433 174.990 0.016 0.000 1.274 1129 C CA 0.041 59.051 59.018 -0.012 0.000 1.713 1129 C CB -0.984 26.742 27.740 -0.024 0.000 2.039 1129 C HN 0.479 nan 8.230 nan 0.000 0.484 1130 D N 1.231 121.653 120.400 0.037 0.000 2.191 1130 D HA -0.184 4.456 4.640 -0.000 0.000 0.190 1130 D C 2.189 178.522 176.300 0.054 0.000 1.007 1130 D CA 2.362 56.395 54.000 0.054 0.000 0.865 1130 D CB -0.311 40.534 40.800 0.075 0.000 0.929 1130 D HN 0.574 nan 8.370 nan 0.000 0.447 1131 A N -0.545 122.316 122.820 0.068 0.000 2.132 1131 A HA 0.107 4.427 4.320 -0.000 0.000 0.213 1131 A C 2.266 179.880 177.584 0.049 0.000 1.154 1131 A CA 0.056 52.135 52.037 0.070 0.000 0.753 1131 A CB -0.152 18.913 19.000 0.109 0.000 0.826 1131 A HN 0.206 nan 8.150 nan 0.000 0.469 1132 L N -0.983 120.262 121.223 0.036 0.000 2.492 1132 L HA 0.018 4.358 4.340 -0.000 0.000 0.223 1132 L C 2.740 179.617 176.870 0.012 0.000 1.132 1132 L CA 0.596 55.450 54.840 0.022 0.000 0.850 1132 L CB -0.173 41.894 42.059 0.012 0.000 0.966 1132 L HN 0.425 nan 8.230 nan 0.000 0.454 1133 A N 0.470 123.298 122.820 0.013 0.000 1.855 1133 A HA -0.063 4.257 4.320 -0.000 0.000 0.213 1133 A C 1.722 179.315 177.584 0.014 0.000 1.195 1133 A CA 0.560 52.602 52.037 0.009 0.000 0.610 1133 A CB -0.246 18.762 19.000 0.012 0.000 0.837 1133 A HN 0.301 nan 8.150 nan 0.000 0.444 1134 R N 0.400 120.914 120.500 0.023 0.000 4.739 1134 R HA 0.135 4.475 4.340 -0.000 0.000 0.203 1134 R C 0.844 177.157 176.300 0.021 0.000 2.125 1134 R CA 0.551 56.664 56.100 0.022 0.000 1.743 1134 R CB -0.287 30.029 30.300 0.028 0.000 1.271 1134 R HN 0.483 nan 8.270 nan 0.000 0.746 1135 S N -1.312 114.398 115.700 0.017 0.000 2.931 1135 S HA 0.209 4.679 4.470 -0.000 0.000 0.251 1135 S C 1.478 176.084 174.600 0.010 0.000 1.078 1135 S CA 0.713 58.922 58.200 0.015 0.000 0.835 1135 S CB 0.515 63.725 63.200 0.017 0.000 0.798 1135 S HN 0.548 nan 8.310 nan 0.000 0.495 1136 G N 1.147 109.951 108.800 0.006 0.000 2.336 1136 G HA2 -0.221 3.739 3.960 -0.000 0.000 0.233 1136 G HA3 -0.221 3.739 3.960 -0.000 0.000 0.233 1136 G C 0.803 175.703 174.900 0.000 0.000 1.053 1136 G CA 0.215 45.316 45.100 0.003 0.000 0.625 1136 G HN 1.440 nan 8.290 nan 0.000 0.511 1137 A N 0.095 122.917 122.820 0.003 0.000 2.507 1137 A HA 0.705 5.025 4.320 -0.000 0.000 0.270 1137 A C 0.479 178.065 177.584 0.002 0.000 1.318 1137 A CA 0.723 52.761 52.037 0.001 0.000 0.924 1137 A CB 0.362 19.364 19.000 0.003 0.000 1.061 1137 A HN 1.000 nan 8.150 nan 0.000 0.516 1138 V N 0.919 120.834 119.914 0.002 0.000 2.328 1138 V HA 0.176 4.296 4.120 -0.000 0.000 0.278 1138 V C -0.005 176.084 176.094 -0.008 0.000 1.021 1138 V CA -0.223 62.076 62.300 -0.000 0.000 0.838 1138 V CB 1.021 32.846 31.823 0.003 0.000 0.999 1138 V HN 0.568 nan 8.190 nan 0.000 0.447 1139 D N 2.958 123.352 120.400 -0.011 0.000 2.197 1139 D HA 0.065 4.705 4.640 -0.000 0.000 0.212 1139 D C 0.503 176.787 176.300 -0.025 0.000 0.963 1139 D CA 0.802 54.791 54.000 -0.017 0.000 0.864 1139 D CB 0.398 41.188 40.800 -0.017 0.000 1.009 1139 D HN 0.523 nan 8.370 nan 0.000 0.479 1140 V N -0.847 119.053 119.914 -0.025 0.000 2.638 1140 V HA 0.492 4.612 4.120 -0.000 0.000 0.306 1140 V C -0.834 175.241 176.094 -0.033 0.000 1.052 1140 V CA -0.982 61.297 62.300 -0.035 0.000 0.885 1140 V CB 2.234 34.037 31.823 -0.035 0.000 0.999 1140 V HN -0.045 nan 8.190 nan 0.000 0.424 1141 I N 4.391 124.923 120.570 -0.064 0.000 2.377 1141 I HA 0.546 4.716 4.170 -0.000 0.000 0.293 1141 I C -0.760 175.292 176.117 -0.108 0.000 0.987 1141 I CA -0.836 60.416 61.300 -0.080 0.000 1.185 1141 I CB 2.117 40.044 38.000 -0.121 0.000 1.341 1141 I HN 0.488 nan 8.210 nan 0.000 0.455 1142 V N 7.553 127.429 119.914 -0.064 0.000 2.444 1142 V HA 0.335 4.455 4.120 -0.000 0.000 0.294 1142 V C -0.241 175.740 176.094 -0.188 0.000 1.022 1142 V CA -0.575 61.684 62.300 -0.067 0.000 0.850 1142 V CB 2.143 34.030 31.823 0.108 0.000 0.992 1142 V HN 0.379 nan 8.190 nan 0.000 0.426 1143 V N 3.734 123.531 119.914 -0.195 0.000 2.384 1143 V HA 0.527 4.647 4.120 -0.000 0.000 0.287 1143 V C -0.542 175.498 176.094 -0.089 0.000 1.020 1143 V CA -0.485 61.719 62.300 -0.159 0.000 0.850 1143 V CB 1.760 33.568 31.823 -0.024 0.000 0.987 1143 V HN 0.800 nan 8.190 nan 0.000 0.436 1144 D N 3.555 123.827 120.400 -0.213 0.000 2.408 1144 D HA 0.580 5.220 4.640 -0.000 0.000 0.261 1144 D C -0.540 175.697 176.300 -0.104 0.000 1.190 1144 D CA 0.214 54.124 54.000 -0.151 0.000 0.910 1144 D CB 1.498 42.143 40.800 -0.259 0.000 1.097 1144 D HN 0.786 nan 8.370 nan 0.000 0.522 1145 S N 0.107 115.789 115.700 -0.030 0.000 2.565 1145 S HA 0.262 4.732 4.470 -0.000 0.000 0.274 1145 S C 1.023 175.632 174.600 0.016 0.000 1.144 1145 S CA -0.562 57.651 58.200 0.023 0.000 0.849 1145 S CB 1.134 64.353 63.200 0.030 0.000 1.103 1145 S HN -0.046 nan 8.310 nan 0.000 0.455 1146 V N 1.733 121.654 119.914 0.012 0.000 2.308 1146 V HA -0.430 3.690 4.120 -0.000 0.000 0.251 1146 V C 3.059 179.119 176.094 -0.056 0.000 1.055 1146 V CA 3.370 65.624 62.300 -0.077 0.000 1.105 1146 V CB -1.868 29.889 31.823 -0.110 0.000 0.785 1146 V HN 1.329 nan 8.190 nan 0.000 0.479 1147 A N -0.535 122.264 122.820 -0.035 0.000 1.978 1147 A HA -0.070 4.250 4.320 -0.000 0.000 0.220 1147 A C 2.191 179.773 177.584 -0.002 0.000 1.170 1147 A CA 2.546 54.568 52.037 -0.025 0.000 0.636 1147 A CB -0.730 18.258 19.000 -0.019 0.000 0.810 1147 A HN 0.978 nan 8.150 nan 0.000 0.448 1148 A N -1.231 121.595 122.820 0.011 0.000 2.208 1148 A HA 0.331 4.651 4.320 -0.000 0.000 0.209 1148 A C 0.851 178.489 177.584 0.090 0.000 1.161 1148 A CA 0.220 52.286 52.037 0.049 0.000 0.782 1148 A CB -0.138 18.874 19.000 0.021 0.000 0.816 1148 A HN 0.289 nan 8.150 nan 0.000 0.477 1149 L N 2.733 123.968 121.223 0.020 0.000 2.650 1149 L HA 0.089 4.429 4.340 -0.000 0.000 0.239 1149 L C 0.400 177.232 176.870 -0.063 0.000 1.412 1149 L CA 0.585 55.410 54.840 -0.025 0.000 1.219 1149 L CB -1.859 40.170 42.059 -0.050 0.000 1.534 1149 L HN 0.341 nan 8.230 nan 0.000 0.430 1150 T N -0.294 114.246 114.554 -0.023 0.000 2.751 1150 T HA 0.319 4.669 4.350 -0.000 0.000 0.290 1150 T C -2.159 172.424 174.700 -0.196 0.000 0.919 1150 T CA -1.502 60.570 62.100 -0.046 0.000 1.136 1150 T CB 0.517 69.448 68.868 0.104 0.000 0.875 1150 T HN 0.125 nan 8.240 nan 0.000 0.532 1151 P HA 0.199 nan 4.420 nan 0.000 0.272 1151 P C 0.940 178.140 177.300 -0.168 0.000 1.248 1151 P CA -0.618 62.390 63.100 -0.153 0.000 0.799 1151 P CB 0.699 32.345 31.700 -0.091 0.000 0.997 1152 K N 0.752 121.072 120.400 -0.134 0.000 1.991 1152 K HA -0.163 4.157 4.320 -0.000 0.000 0.212 1152 K C 2.115 178.673 176.600 -0.072 0.000 1.049 1152 K CA 2.217 58.438 56.287 -0.110 0.000 0.932 1152 K CB -1.159 31.306 32.500 -0.058 0.000 0.717 1152 K HN 0.419 nan 8.250 nan 0.000 0.441 1153 A N 1.215 124.008 122.820 -0.045 0.000 1.958 1153 A HA -0.303 4.017 4.320 -0.000 0.000 0.221 1153 A C 1.955 179.526 177.584 -0.021 0.000 1.178 1153 A CA 2.071 54.095 52.037 -0.022 0.000 0.642 1153 A CB -0.546 18.445 19.000 -0.015 0.000 0.816 1153 A HN 0.400 nan 8.150 nan 0.000 0.453 1154 E N -0.600 119.580 120.200 -0.034 0.000 2.046 1154 E HA -0.095 4.255 4.350 -0.000 0.000 0.190 1154 E C 1.941 178.529 176.600 -0.020 0.000 0.982 1154 E CA 0.978 57.365 56.400 -0.022 0.000 0.800 1154 E CB -0.236 29.453 29.700 -0.019 0.000 0.756 1154 E HN 0.720 nan 8.360 nan 0.000 0.449 1155 I N 1.446 121.981 120.570 -0.058 0.000 2.060 1155 I HA -0.232 3.938 4.170 -0.000 0.000 0.233 1155 I C 0.658 176.763 176.117 -0.020 0.000 1.054 1155 I CA 1.125 62.381 61.300 -0.073 0.000 1.318 1155 I CB -0.262 37.601 38.000 -0.227 0.000 1.054 1155 I HN -0.013 nan 8.210 nan 0.000 0.395 1156 E N 1.480 121.680 120.200 0.001 0.000 2.166 1156 E HA 0.284 4.634 4.350 -0.000 0.000 0.279 1156 E C 0.691 177.328 176.600 0.062 0.000 1.095 1156 E CA 0.348 56.801 56.400 0.090 0.000 0.888 1156 E CB 0.309 30.078 29.700 0.114 0.000 1.041 1156 E HN 0.479 nan 8.360 nan 0.000 0.414 1157 G N 4.612 113.454 108.800 0.070 0.000 2.627 1157 G HA2 -0.443 3.517 3.960 -0.000 0.000 0.312 1157 G HA3 -0.443 3.517 3.960 -0.000 0.000 0.312 1157 G C 0.714 175.628 174.900 0.024 0.000 1.299 1157 G CA 1.086 46.212 45.100 0.042 0.000 0.989 1157 G HN 0.773 nan 8.290 nan 0.000 0.547 1158 E N -1.554 118.655 120.200 0.015 0.000 2.555 1158 E HA 0.362 4.712 4.350 -0.000 0.000 0.209 1158 E C 1.014 177.617 176.600 0.006 0.000 0.847 1158 E CA 0.140 56.544 56.400 0.006 0.000 1.438 1158 E CB 0.040 29.740 29.700 -0.000 0.000 1.420 1158 E HN 1.573 nan 8.360 nan 0.000 0.755 1159 I N 2.126 122.703 120.570 0.010 0.000 6.364 1159 I HA -0.234 3.936 4.170 -0.000 0.000 0.126 1159 I C 0.745 176.868 176.117 0.010 0.000 1.442 1159 I CA 0.976 62.282 61.300 0.011 0.000 2.500 1159 I CB -1.638 36.369 38.000 0.012 0.000 2.730 1159 I HN 0.511 nan 8.210 nan 0.000 0.290 1160 G N 3.576 112.383 108.800 0.011 0.000 2.395 1160 G HA2 -0.261 3.699 3.960 -0.000 0.000 0.292 1160 G HA3 -0.261 3.699 3.960 -0.000 0.000 0.292 1160 G C 0.041 174.954 174.900 0.021 0.000 0.953 1160 G CA 0.567 45.677 45.100 0.016 0.000 1.207 1160 G HN 0.994 nan 8.290 nan 0.000 0.503 1161 D N -0.210 120.200 120.400 0.017 0.000 2.304 1161 D HA 0.525 5.165 4.640 -0.000 0.000 0.250 1161 D C 0.085 176.415 176.300 0.049 0.000 1.107 1161 D CA 0.027 54.041 54.000 0.022 0.000 0.885 1161 D CB 0.913 41.716 40.800 0.005 0.000 1.192 1161 D HN 0.034 nan 8.370 nan 0.000 0.436 1162 S N 3.399 119.152 115.700 0.089 0.000 2.669 1162 S HA 0.222 4.692 4.470 -0.000 0.000 0.315 1162 S C -0.933 173.814 174.600 0.244 0.000 1.106 1162 S CA -0.512 57.821 58.200 0.223 0.000 1.107 1162 S CB 0.300 63.625 63.200 0.208 0.000 0.990 1162 S HN 0.581 nan 8.310 nan 0.000 0.471 1163 H N 3.512 122.575 119.070 -0.012 0.000 2.740 1163 H HA -0.251 4.305 4.556 -0.000 0.000 0.327 1163 H C 0.642 175.958 175.328 -0.021 0.000 1.077 1163 H CA 0.832 56.871 56.048 -0.016 0.000 1.088 1163 H CB -1.295 28.458 29.762 -0.015 0.000 1.619 1163 H HN 0.973 nan 8.280 nan 0.000 0.386 1164 M N -1.757 117.873 119.600 0.051 0.000 3.086 1164 M HA -0.130 4.350 4.480 -0.000 0.000 0.231 1164 M C 0.299 176.598 176.300 -0.001 0.000 0.534 1164 M CA 2.013 57.322 55.300 0.016 0.000 0.883 1164 M CB -0.407 32.202 32.600 0.015 0.000 3.137 1164 M HN 1.020 nan 8.290 nan 0.000 0.306 1165 G N 1.377 110.176 108.800 -0.001 0.000 2.823 1165 G HA2 0.393 4.353 3.960 -0.000 0.000 0.235 1165 G HA3 0.393 4.353 3.960 -0.000 0.000 0.235 1165 G C -0.539 174.350 174.900 -0.018 0.000 3.696 1165 G CA -0.034 45.056 45.100 -0.016 0.000 0.652 1165 G HN 0.509 nan 8.290 nan 0.000 0.431 1166 L N 0.453 121.667 121.223 -0.015 0.000 2.641 1166 L HA 0.395 4.735 4.340 -0.000 0.000 0.207 1166 L C 2.418 179.276 176.870 -0.020 0.000 1.049 1166 L CA 0.789 55.620 54.840 -0.015 0.000 0.866 1166 L CB 0.167 42.231 42.059 0.008 0.000 1.264 1166 L HN 0.490 nan 8.230 nan 0.000 0.483 1167 A N 0.596 123.403 122.820 -0.020 0.000 2.081 1167 A HA 0.169 4.489 4.320 -0.000 0.000 0.213 1167 A C 1.808 179.365 177.584 -0.045 0.000 1.374 1167 A CA 0.837 52.857 52.037 -0.028 0.000 1.203 1167 A CB -0.790 18.191 19.000 -0.032 0.000 0.786 1167 A HN 0.370 nan 8.150 nan 0.000 0.535 1168 A N -0.214 122.576 122.820 -0.050 0.000 2.168 1168 A HA -0.031 4.289 4.320 -0.000 0.000 0.215 1168 A C 2.074 179.620 177.584 -0.062 0.000 1.152 1168 A CA 0.897 52.894 52.037 -0.067 0.000 0.716 1168 A CB -0.282 18.676 19.000 -0.071 0.000 0.794 1168 A HN 0.606 nan 8.150 nan 0.000 0.465 1169 R N -0.915 119.561 120.500 -0.040 0.000 2.148 1169 R HA -0.011 4.329 4.340 -0.000 0.000 0.223 1169 R C 2.182 178.460 176.300 -0.036 0.000 1.088 1169 R CA 1.190 57.275 56.100 -0.025 0.000 0.985 1169 R CB -0.340 29.966 30.300 0.010 0.000 0.880 1169 R HN 0.676 nan 8.270 nan 0.000 0.451 1170 M N -0.020 119.554 119.600 -0.043 0.000 2.202 1170 M HA -0.231 4.249 4.480 -0.000 0.000 0.262 1170 M C 1.638 177.900 176.300 -0.064 0.000 1.063 1170 M CA 1.624 56.895 55.300 -0.049 0.000 1.097 1170 M CB 0.018 32.583 32.600 -0.058 0.000 1.382 1170 M HN 0.186 nan 8.290 nan 0.000 0.413 1171 M N 0.083 119.631 119.600 -0.086 0.000 2.062 1171 M HA -0.132 4.348 4.480 -0.000 0.000 0.259 1171 M C 2.228 178.467 176.300 -0.102 0.000 1.076 1171 M CA 1.780 57.010 55.300 -0.116 0.000 1.122 1171 M CB -1.135 31.368 32.600 -0.160 0.000 1.312 1171 M HN 0.315 nan 8.290 nan 0.000 0.412 1172 S N 0.438 116.079 115.700 -0.098 0.000 2.407 1172 S HA -0.242 4.228 4.470 -0.000 0.000 0.235 1172 S C 1.579 176.119 174.600 -0.100 0.000 1.036 1172 S CA 1.516 59.648 58.200 -0.114 0.000 1.013 1172 S CB -0.443 62.711 63.200 -0.078 0.000 0.820 1172 S HN 0.413 nan 8.310 nan 0.000 0.476 1173 Q N 1.601 121.365 119.800 -0.060 0.000 1.579 1173 Q HA 0.058 4.398 4.340 -0.000 0.000 0.490 1173 Q C 1.943 177.930 176.000 -0.021 0.000 0.970 1173 Q CA 1.548 57.331 55.803 -0.033 0.000 0.898 1173 Q CB -0.592 28.134 28.738 -0.020 0.000 0.936 1173 Q HN 0.443 nan 8.270 nan 0.000 0.385 1174 A N -0.231 122.588 122.820 -0.002 0.000 2.263 1174 A HA -0.050 4.270 4.320 -0.000 0.000 0.205 1174 A C 1.567 179.179 177.584 0.048 0.000 1.226 1174 A CA 0.818 52.871 52.037 0.027 0.000 0.810 1174 A CB -0.705 18.315 19.000 0.034 0.000 0.784 1174 A HN 0.607 nan 8.150 nan 0.000 0.486 1175 M N -0.310 119.298 119.600 0.013 0.000 2.073 1175 M HA -0.008 4.472 4.480 -0.000 0.000 0.259 1175 M C 2.054 178.422 176.300 0.115 0.000 1.079 1175 M CA 1.522 56.844 55.300 0.035 0.000 1.131 1175 M CB -0.471 32.060 32.600 -0.114 0.000 1.316 1175 M HN 0.362 nan 8.290 nan 0.000 0.415 1176 R N 0.617 121.135 120.500 0.030 0.000 2.189 1176 R HA -0.266 4.074 4.340 -0.000 0.000 0.252 1176 R C 2.099 178.547 176.300 0.248 0.000 1.134 1176 R CA 2.567 58.805 56.100 0.229 0.000 0.954 1176 R CB -0.752 29.610 30.300 0.102 0.000 0.890 1176 R HN 0.497 nan 8.270 nan 0.000 0.443 1177 K N 0.004 120.490 120.400 0.142 0.000 2.103 1177 K HA -0.017 4.303 4.320 -0.000 0.000 0.204 1177 K C 2.217 178.884 176.600 0.111 0.000 1.052 1177 K CA 0.769 57.122 56.287 0.110 0.000 0.945 1177 K CB -0.134 32.413 32.500 0.079 0.000 0.722 1177 K HN 0.153 nan 8.250 nan 0.000 0.443 1178 L N 0.662 121.962 121.223 0.129 0.000 2.127 1178 L HA -0.229 4.111 4.340 -0.000 0.000 0.211 1178 L C 2.431 179.366 176.870 0.107 0.000 1.089 1178 L CA 0.879 55.786 54.840 0.113 0.000 0.757 1178 L CB -0.518 41.622 42.059 0.135 0.000 0.899 1178 L HN 0.251 nan 8.230 nan 0.000 0.434 1179 A N 0.240 123.150 122.820 0.149 0.000 1.869 1179 A HA -0.250 4.070 4.320 -0.000 0.000 0.218 1179 A C 2.320 179.926 177.584 0.038 0.000 1.203 1179 A CA 2.240 54.329 52.037 0.086 0.000 0.638 1179 A CB -1.416 17.614 19.000 0.049 0.000 0.831 1179 A HN 0.470 nan 8.150 nan 0.000 0.450 1180 G N -0.598 108.229 108.800 0.045 0.000 2.464 1180 G HA2 -0.261 3.699 3.960 -0.000 0.000 0.214 1180 G HA3 -0.261 3.699 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 1.023 46.139 45.100 0.028 0.000 0.794 1180 G HN 0.670 nan 8.290 nan 0.000 0.542 1181 N N 0.185 118.906 118.700 0.034 0.000 2.242 1181 N HA -0.118 4.622 4.740 -0.000 0.000 0.191 1181 N C 2.038 177.558 175.510 0.017 0.000 1.005 1181 N CA 0.977 54.044 53.050 0.028 0.000 0.877 1181 N CB -0.157 38.352 38.487 0.036 0.000 0.983 1181 N HN 0.324 nan 8.380 nan 0.000 0.439 1182 L N -0.258 120.974 121.223 0.014 0.000 2.253 1182 L HA 0.047 4.387 4.340 -0.000 0.000 0.205 1182 L C 2.253 179.121 176.870 -0.004 0.000 1.078 1182 L CA 0.581 55.422 54.840 0.001 0.000 0.805 1182 L CB -0.117 41.939 42.059 -0.004 0.000 0.963 1182 L HN 0.021 nan 8.230 nan 0.000 0.459 1183 K N 0.544 120.943 120.400 -0.002 0.000 2.097 1183 K HA -0.149 4.171 4.320 -0.000 0.000 0.205 1183 K C 1.365 177.963 176.600 -0.004 0.000 1.050 1183 K CA 1.211 57.494 56.287 -0.006 0.000 0.938 1183 K CB 0.167 32.662 32.500 -0.008 0.000 0.718 1183 K HN 0.201 nan 8.250 nan 0.000 0.442 1184 Q N -0.481 119.319 119.800 0.000 0.000 2.244 1184 Q HA 0.153 4.493 4.340 -0.000 0.000 0.239 1184 Q C -0.012 175.989 176.000 0.001 0.000 0.890 1184 Q CA -0.105 55.699 55.803 0.001 0.000 0.964 1184 Q CB 0.973 29.714 28.738 0.004 0.000 1.076 1184 Q HN 0.137 nan 8.270 nan 0.000 0.447 1185 S N -0.850 114.849 115.700 -0.001 0.000 2.692 1185 S HA 0.064 4.534 4.470 -0.000 0.000 0.269 1185 S C 0.092 174.688 174.600 -0.007 0.000 1.080 1185 S CA -0.449 57.749 58.200 -0.002 0.000 1.058 1185 S CB 0.462 63.661 63.200 -0.001 0.000 0.982 1185 S HN 0.377 nan 8.310 nan 0.000 0.534 1186 N N 2.279 120.973 118.700 -0.009 0.000 2.725 1186 N HA -0.117 4.623 4.740 -0.000 0.000 0.251 1186 N C -1.220 174.279 175.510 -0.018 0.000 1.031 1186 N CA 0.837 53.878 53.050 -0.014 0.000 0.720 1186 N CB -1.398 37.081 38.487 -0.014 0.000 0.930 1186 N HN 0.338 nan 8.380 nan 0.000 0.543 1187 T N 0.966 115.509 114.554 -0.019 0.000 2.733 1187 T HA 0.410 4.760 4.350 -0.000 0.000 0.294 1187 T C 0.292 174.969 174.700 -0.038 0.000 0.956 1187 T CA -0.590 61.494 62.100 -0.026 0.000 0.987 1187 T CB 1.073 69.928 68.868 -0.022 0.000 0.920 1187 T HN 0.254 nan 8.240 nan 0.000 0.470 1188 L N 5.852 127.048 121.223 -0.045 0.000 2.281 1188 L HA 0.675 5.015 4.340 -0.000 0.000 0.285 1188 L C -0.812 176.005 176.870 -0.088 0.000 1.074 1188 L CA -0.353 54.452 54.840 -0.059 0.000 0.817 1188 L CB 0.393 42.421 42.059 -0.052 0.000 1.168 1188 L HN 0.631 nan 8.230 nan 0.000 0.434 1189 L N 6.032 127.182 121.223 -0.122 0.000 2.346 1189 L HA 0.686 5.026 4.340 -0.000 0.000 0.274 1189 L C -1.249 175.469 176.870 -0.253 0.000 1.007 1189 L CA -0.450 54.262 54.840 -0.213 0.000 0.818 1189 L CB 1.587 43.483 42.059 -0.273 0.000 1.284 1189 L HN 0.698 nan 8.230 nan 0.000 0.424 1190 I N 4.105 124.490 120.570 -0.307 0.000 2.447 1190 I HA 0.367 4.537 4.170 -0.000 0.000 0.287 1190 I C -1.196 174.753 176.117 -0.279 0.000 1.023 1190 I CA -0.288 60.882 61.300 -0.217 0.000 1.083 1190 I CB 1.760 39.702 38.000 -0.097 0.000 1.245 1190 I HN 0.432 nan 8.210 nan 0.000 0.434 1191 F N 6.519 126.458 119.950 -0.018 0.000 2.422 1191 F HA 0.583 5.110 4.527 -0.000 0.000 0.333 1191 F C 0.185 175.980 175.800 -0.008 0.000 1.095 1191 F CA -0.797 57.191 58.000 -0.018 0.000 1.038 1191 F CB 1.428 40.422 39.000 -0.010 0.000 1.156 1191 F HN 0.098 nan 8.300 nan 0.000 0.483 1192 I N 2.691 123.399 120.570 0.230 0.000 2.433 1192 I HA 0.434 4.604 4.170 -0.000 0.000 0.292 1192 I C -0.452 175.730 176.117 0.108 0.000 1.001 1192 I CA -0.722 60.659 61.300 0.136 0.000 1.119 1192 I CB 1.822 39.878 38.000 0.094 0.000 1.289 1192 I HN 0.482 nan 8.210 nan 0.000 0.438 1193 N N 3.829 122.595 118.700 0.110 0.000 3.091 1193 N HA 0.565 5.305 4.740 -0.000 0.000 0.329 1193 N C -1.337 174.206 175.510 0.056 0.000 1.430 1193 N CA -0.478 52.611 53.050 0.065 0.000 0.755 1193 N CB 1.833 40.357 38.487 0.061 0.000 1.626 1193 N HN 0.632 nan 8.380 nan 0.000 0.614 1212 G N -0.456 108.278 108.800 -0.109 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 0.428 175.289 174.900 -0.066 0.000 1.168 1212 G CA 0.079 45.123 45.100 -0.092 0.000 0.936 1212 G HN 0.426 nan 8.290 nan 0.000 0.479 1213 N N 1.027 119.707 118.700 -0.033 0.000 2.192 1213 N HA -0.178 4.562 4.740 -0.000 0.000 0.188 1213 N C 2.413 177.985 175.510 0.103 0.000 1.013 1213 N CA 1.634 54.704 53.050 0.034 0.000 0.863 1213 N CB -0.080 38.438 38.487 0.053 0.000 0.990 1213 N HN 0.567 nan 8.380 nan 0.000 0.430 1214 A N 0.962 123.807 122.820 0.041 0.000 1.835 1214 A HA -0.131 4.189 4.320 -0.000 0.000 0.215 1214 A C 2.172 179.820 177.584 0.105 0.000 1.199 1214 A CA 1.416 53.481 52.037 0.046 0.000 0.615 1214 A CB -1.187 17.746 19.000 -0.113 0.000 0.838 1214 A HN 0.322 nan 8.150 nan 0.000 0.444 1215 L N 0.415 121.640 121.223 0.003 0.000 2.123 1215 L HA -0.271 4.068 4.340 -0.000 0.000 0.217 1215 L C 2.228 179.130 176.870 0.053 0.000 1.081 1215 L CA 2.739 57.597 54.840 0.029 0.000 0.772 1215 L CB -0.770 41.226 42.059 -0.105 0.000 0.890 1215 L HN 0.549 nan 8.230 nan 0.000 0.437 1216 K N -2.050 118.327 120.400 -0.038 0.000 2.366 1216 K HA -0.233 4.087 4.320 -0.000 0.000 0.202 1216 K C 1.360 177.710 176.600 -0.417 0.000 1.045 1216 K CA 1.961 58.094 56.287 -0.257 0.000 0.934 1216 K CB -0.119 32.129 32.500 -0.421 0.000 0.746 1216 K HN 0.457 nan 8.250 nan 0.000 0.470 1217 F N -2.790 117.267 119.950 0.179 0.000 2.581 1217 F HA 0.120 4.647 4.527 -0.000 0.000 0.278 1217 F C 1.360 177.312 175.800 0.252 0.000 1.000 1217 F CA -0.355 57.778 58.000 0.221 0.000 1.230 1217 F CB -0.100 39.044 39.000 0.241 0.000 1.008 1217 F HN -0.118 nan 8.300 nan 0.000 0.695 1218 Y N 1.164 121.605 120.300 0.235 0.000 2.639 1218 Y HA 0.211 4.761 4.550 -0.000 0.000 0.297 1218 Y C 1.409 177.375 175.900 0.109 0.000 1.151 1218 Y CA -0.186 58.005 58.100 0.153 0.000 1.335 1218 Y CB -0.231 38.313 38.460 0.139 0.000 0.994 1218 Y HN -0.052 nan 8.280 nan 0.000 0.548 1219 A N -0.150 122.790 122.820 0.201 0.000 2.450 1219 A HA 0.150 4.470 4.320 -0.000 0.000 0.255 1219 A C 1.138 178.740 177.584 0.031 0.000 1.096 1219 A CA 0.109 52.204 52.037 0.097 0.000 0.778 1219 A CB 0.333 19.357 19.000 0.038 0.000 1.031 1219 A HN 0.338 nan 8.150 nan 0.000 0.494 1220 S N 1.011 116.715 115.700 0.006 0.000 2.425 1220 S HA 0.118 4.588 4.470 -0.000 0.000 0.225 1220 S C 0.605 175.172 174.600 -0.055 0.000 1.024 1220 S CA 0.785 58.972 58.200 -0.022 0.000 0.951 1220 S CB 0.015 63.201 63.200 -0.024 0.000 0.796 1220 S HN 0.668 nan 8.310 nan 0.000 0.498 1221 V N 1.367 121.239 119.914 -0.070 0.000 2.971 1221 V HA 0.540 4.660 4.120 -0.000 0.000 0.309 1221 V C -1.521 174.488 176.094 -0.141 0.000 1.130 1221 V CA -0.882 61.349 62.300 -0.114 0.000 0.964 1221 V CB 2.212 33.975 31.823 -0.099 0.000 1.029 1221 V HN 0.134 nan 8.190 nan 0.000 0.427 1222 R N 4.281 124.653 120.500 -0.213 0.000 2.574 1222 R HA 0.606 4.946 4.340 -0.000 0.000 0.288 1222 R C -2.020 174.079 176.300 -0.335 0.000 1.004 1222 R CA -0.811 55.124 56.100 -0.274 0.000 0.895 1222 R CB 2.091 32.188 30.300 -0.338 0.000 1.191 1222 R HN 0.413 nan 8.270 nan 0.000 0.444 1223 L N 2.215 123.208 121.223 -0.383 0.000 2.322 1223 L HA 0.312 4.652 4.340 -0.000 0.000 0.281 1223 L C -0.340 176.123 176.870 -0.678 0.000 1.014 1223 L CA -0.362 54.249 54.840 -0.381 0.000 0.815 1223 L CB 1.536 43.471 42.059 -0.208 0.000 1.247 1223 L HN 0.438 nan 8.230 nan 0.000 0.421 1224 D N 4.222 124.329 120.400 -0.489 0.000 2.477 1224 D HA 0.225 4.865 4.640 -0.000 0.000 0.239 1224 D C -0.542 175.735 176.300 -0.038 0.000 1.102 1224 D CA -0.259 53.564 54.000 -0.295 0.000 0.901 1224 D CB 0.578 41.357 40.800 -0.034 0.000 1.026 1224 D HN 0.430 nan 8.370 nan 0.000 0.515 1225 I N 3.133 123.706 120.570 0.004 0.000 2.428 1225 I HA 0.351 4.521 4.170 -0.000 0.000 0.289 1225 I C 0.081 176.227 176.117 0.050 0.000 1.019 1225 I CA -0.366 60.950 61.300 0.027 0.000 1.351 1225 I CB 0.435 38.453 38.000 0.031 0.000 1.412 1225 I HN 0.215 nan 8.210 nan 0.000 0.513 1226 R N 5.688 126.196 120.500 0.014 0.000 3.150 1226 R HA 0.626 4.966 4.340 -0.000 0.000 0.236 1226 R C -1.054 175.227 176.300 -0.031 0.000 1.469 1226 R CA -1.148 54.957 56.100 0.009 0.000 1.045 1226 R CB 1.563 31.875 30.300 0.019 0.000 1.481 1226 R HN 0.544 nan 8.270 nan 0.000 0.506 1227 R N 0.897 121.381 120.500 -0.026 0.000 2.548 1227 R HA 0.279 4.619 4.340 -0.000 0.000 0.280 1227 R C -0.070 176.215 176.300 -0.025 0.000 1.061 1227 R CA -0.160 55.916 56.100 -0.040 0.000 0.915 1227 R CB 1.206 31.489 30.300 -0.028 0.000 1.210 1227 R HN 0.721 nan 8.270 nan 0.000 0.442 1228 I N 0.073 120.625 120.570 -0.030 0.000 4.607 1228 I HA 0.501 4.671 4.170 -0.000 0.000 0.324 1228 I C 0.804 176.917 176.117 -0.006 0.000 1.279 1228 I CA 0.254 61.546 61.300 -0.014 0.000 1.286 1228 I CB 1.218 39.211 38.000 -0.012 0.000 1.265 1228 I HN 0.610 nan 8.210 nan 0.000 0.446 1229 G N 1.130 109.926 108.800 -0.008 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 0.455 175.363 174.900 0.013 0.000 1.379 1229 G CA 0.385 45.486 45.100 0.002 0.000 0.766 1229 G HN 0.924 nan 8.290 nan 0.000 0.599 1230 A N -1.642 121.191 122.820 0.023 0.000 2.435 1230 A HA 0.241 4.561 4.320 -0.000 0.000 0.686 1230 A C -0.293 177.303 177.584 0.019 0.000 0.138 1230 A CA 0.114 52.175 52.037 0.041 0.000 0.024 1230 A CB -1.488 17.538 19.000 0.042 0.000 3.974 1230 A HN 1.638 nan 8.150 nan 0.000 0.548 1231 V N 0.641 120.565 119.914 0.018 0.000 3.074 1231 V HA 0.907 5.027 4.120 -0.000 0.000 0.314 1231 V C 0.028 176.108 176.094 -0.022 0.000 1.117 1231 V CA -0.881 61.422 62.300 0.005 0.000 1.014 1231 V CB 2.091 33.929 31.823 0.025 0.000 1.057 1231 V HN 1.063 nan 8.190 nan 0.000 0.438 1232 K N 0.724 121.114 120.400 -0.017 0.000 2.316 1232 K HA 0.572 4.892 4.320 -0.000 0.000 0.251 1232 K C -0.881 175.708 176.600 -0.019 0.000 0.934 1232 K CA -0.622 55.647 56.287 -0.031 0.000 0.802 1232 K CB 2.139 34.623 32.500 -0.027 0.000 1.171 1232 K HN 0.521 nan 8.250 nan 0.000 0.426 1233 E N 2.401 122.585 120.200 -0.026 0.000 2.206 1233 E HA 0.182 4.532 4.350 -0.000 0.000 0.244 1233 E C 0.616 177.205 176.600 -0.017 0.000 1.055 1233 E CA 0.108 56.499 56.400 -0.015 0.000 0.970 1233 E CB 0.679 30.371 29.700 -0.015 0.000 1.256 1233 E HN 0.888 nan 8.360 nan 0.000 0.456 1234 G N 3.377 112.169 108.800 -0.014 0.000 2.950 1234 G HA2 -0.339 3.621 3.960 -0.000 0.000 0.299 1234 G HA3 -0.339 3.621 3.960 -0.000 0.000 0.299 1234 G C 0.842 175.730 174.900 -0.019 0.000 1.310 1234 G CA 0.178 45.269 45.100 -0.014 0.000 0.994 1234 G HN 0.443 nan 8.290 nan 0.000 0.575 1235 E N 1.709 121.896 120.200 -0.022 0.000 2.447 1235 E HA 0.137 4.487 4.350 -0.000 0.000 0.204 1235 E C 1.067 177.645 176.600 -0.038 0.000 0.977 1235 E CA -0.024 56.361 56.400 -0.026 0.000 0.950 1235 E CB -0.008 29.680 29.700 -0.021 0.000 0.975 1235 E HN 0.580 nan 8.360 nan 0.000 0.496 1236 N N 0.246 118.919 118.700 -0.044 0.000 2.416 1236 N HA 0.025 4.765 4.740 -0.000 0.000 0.246 1236 N C -0.633 174.821 175.510 -0.094 0.000 1.260 1236 N CA 0.146 53.156 53.050 -0.067 0.000 0.897 1236 N CB 1.129 39.578 38.487 -0.065 0.000 1.110 1236 N HN -0.229 nan 8.380 nan 0.000 0.439 1237 V N 2.677 122.503 119.914 -0.146 0.000 2.294 1237 V HA 0.131 4.251 4.120 -0.000 0.000 0.272 1237 V C 0.344 176.198 176.094 -0.401 0.000 1.027 1237 V CA -0.187 61.990 62.300 -0.206 0.000 0.823 1237 V CB 1.111 32.831 31.823 -0.173 0.000 1.030 1237 V HN 0.525 nan 8.190 nan 0.000 0.457 1238 V N 4.157 123.879 119.914 -0.320 0.000 3.477 1238 V HA 0.563 4.683 4.120 -0.000 0.000 0.297 1238 V C 0.901 176.876 176.094 -0.198 0.000 1.433 1238 V CA 0.933 63.006 62.300 -0.378 0.000 1.052 1238 V CB 0.499 32.236 31.823 -0.142 0.000 0.895 1238 V HN 0.784 nan 8.190 nan 0.000 0.438 1239 G N -0.832 107.915 108.800 -0.089 0.000 2.714 1239 G HA2 0.617 4.577 3.960 -0.000 0.000 0.292 1239 G HA3 0.617 4.577 3.960 -0.000 0.000 0.292 1239 G C -1.165 173.875 174.900 0.234 0.000 1.308 1239 G CA -0.457 44.728 45.100 0.142 0.000 0.964 1239 G HN 0.107 nan 8.290 nan 0.000 0.484 1240 S N -0.355 115.456 115.700 0.185 0.000 2.737 1240 S HA 0.261 4.731 4.470 -0.000 0.000 0.269 1240 S C -0.924 173.672 174.600 -0.007 0.000 1.150 1240 S CA -0.551 57.712 58.200 0.106 0.000 1.077 1240 S CB 1.583 64.845 63.200 0.104 0.000 1.075 1240 S HN 0.641 nan 8.310 nan 0.000 0.476 1241 E N 2.963 123.147 120.200 -0.026 0.000 2.166 1241 E HA 0.327 4.677 4.350 -0.000 0.000 0.279 1241 E C 0.336 176.846 176.600 -0.150 0.000 1.095 1241 E CA -0.025 56.325 56.400 -0.084 0.000 0.888 1241 E CB 0.393 30.070 29.700 -0.038 0.000 1.041 1241 E HN 0.593 nan 8.360 nan 0.000 0.414 1242 T N 2.003 116.369 114.554 -0.314 0.000 2.952 1242 T HA 0.553 4.902 4.350 -0.000 0.000 0.286 1242 T C -0.211 174.288 174.700 -0.335 0.000 1.024 1242 T CA -1.135 60.748 62.100 -0.361 0.000 1.029 1242 T CB 1.468 70.013 68.868 -0.539 0.000 1.094 1242 T HN 0.420 nan 8.240 nan 0.000 0.515 1243 R N 1.025 121.413 120.500 -0.187 0.000 2.518 1243 R HA 0.554 4.894 4.340 -0.000 0.000 0.296 1243 R C -2.123 174.172 176.300 -0.008 0.000 1.080 1243 R CA -0.600 55.459 56.100 -0.068 0.000 0.922 1243 R CB 1.615 31.901 30.300 -0.023 0.000 1.184 1243 R HN 0.574 nan 8.270 nan 0.000 0.445 1244 V N 5.267 125.219 119.914 0.064 0.000 2.370 1244 V HA 0.357 4.477 4.120 -0.000 0.000 0.279 1244 V C -0.111 176.009 176.094 0.042 0.000 1.029 1244 V CA -0.570 61.772 62.300 0.070 0.000 0.870 1244 V CB 1.612 33.522 31.823 0.145 0.000 0.984 1244 V HN 0.577 nan 8.190 nan 0.000 0.451 1245 K N 3.692 124.094 120.400 0.003 0.000 2.185 1245 K HA 0.517 4.837 4.320 -0.000 0.000 0.269 1245 K C -0.969 175.584 176.600 -0.079 0.000 0.987 1245 K CA -0.524 55.760 56.287 -0.005 0.000 0.865 1245 K CB 2.088 34.606 32.500 0.029 0.000 1.090 1245 K HN 0.407 nan 8.250 nan 0.000 0.450 1246 V N 5.035 124.901 119.914 -0.080 0.000 2.334 1246 V HA 0.050 4.170 4.120 -0.000 0.000 0.267 1246 V C 1.180 177.142 176.094 -0.220 0.000 1.040 1246 V CA -0.249 61.960 62.300 -0.152 0.000 0.866 1246 V CB 0.918 32.669 31.823 -0.120 0.000 1.019 1246 V HN 0.641 nan 8.190 nan 0.000 0.468 1247 V N 2.067 121.811 119.914 -0.283 0.000 3.085 1247 V HA 0.322 4.442 4.120 -0.000 0.000 0.245 1247 V C 0.865 176.645 176.094 -0.522 0.000 1.114 1247 V CA 0.294 62.381 62.300 -0.355 0.000 1.108 1247 V CB -0.179 31.570 31.823 -0.123 0.000 0.798 1247 V HN 0.608 nan 8.190 nan 0.000 0.471 1248 K N 2.190 122.296 120.400 -0.489 0.000 2.316 1248 K HA 0.434 4.754 4.320 -0.000 0.000 0.267 1248 K C -1.125 175.292 176.600 -0.305 0.000 1.025 1248 K CA -0.318 55.663 56.287 -0.510 0.000 0.896 1248 K CB 0.633 32.693 32.500 -0.733 0.000 1.124 1248 K HN 0.355 nan 8.250 nan 0.000 0.451 1249 N N 3.682 122.243 118.700 -0.233 0.000 2.549 1249 N HA 0.170 4.910 4.740 -0.000 0.000 0.281 1249 N C -1.015 174.454 175.510 -0.069 0.000 1.084 1249 N CA -0.430 52.534 53.050 -0.144 0.000 0.862 1249 N CB 1.142 39.543 38.487 -0.143 0.000 1.333 1249 N HN 0.476 nan 8.380 nan 0.000 0.523 1250 K N 3.018 123.390 120.400 -0.048 0.000 2.570 1250 K HA 0.251 4.571 4.320 -0.000 0.000 0.210 1250 K C 0.392 176.983 176.600 -0.015 0.000 1.048 1250 K CA -0.041 56.238 56.287 -0.013 0.000 1.167 1250 K CB 0.589 33.089 32.500 0.000 0.000 0.892 1250 K HN 0.429 nan 8.250 nan 0.000 0.480 1251 I N -0.034 120.521 120.570 -0.026 0.000 3.194 1251 I HA 0.069 4.239 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 0.442 61.729 61.300 -0.021 0.000 1.440 1251 I CB 0.509 38.489 38.000 -0.033 0.000 1.276 1251 I HN 0.098 nan 8.210 nan 0.000 0.457 1252 A N -0.425 122.387 122.820 -0.014 0.000 5.139 1252 A HA 0.811 5.131 4.320 -0.000 0.000 0.164 1252 A C -0.731 176.858 177.584 0.008 0.000 0.803 1252 A CA 0.055 52.092 52.037 -0.000 0.000 1.038 1252 A CB -0.663 18.335 19.000 -0.004 0.000 2.123 1252 A HN 0.011 nan 8.150 nan 0.000 0.998 1253 A N 1.580 124.409 122.820 0.016 0.000 2.505 1253 A HA 0.546 4.866 4.320 -0.000 0.000 0.271 1253 A C -2.480 175.116 177.584 0.020 0.000 1.112 1253 A CA -0.531 51.530 52.037 0.040 0.000 0.781 1253 A CB -1.008 18.018 19.000 0.043 0.000 1.059 1253 A HN 0.298 nan 8.150 nan 0.000 0.508 1254 P HA 0.528 nan 4.420 nan 0.000 0.278 1254 P C 0.003 177.318 177.300 0.026 0.000 1.258 1254 P CA -0.415 62.603 63.100 -0.136 0.000 0.811 1254 P CB 0.093 31.630 31.700 -0.272 0.000 1.063 1255 F N -3.145 116.820 119.950 0.025 0.000 2.794 1255 F HA -0.239 4.288 4.527 -0.000 0.000 0.335 1255 F C 0.674 176.481 175.800 0.012 0.000 0.653 1255 F CA 0.747 58.761 58.000 0.024 0.000 1.266 1255 F CB -1.988 37.028 39.000 0.026 0.000 1.666 1255 F HN 0.238 nan 8.300 nan 0.000 0.314 1256 K N 1.628 122.096 120.400 0.114 0.000 2.202 1256 K HA 0.426 4.746 4.320 -0.000 0.000 0.264 1256 K C 0.474 177.106 176.600 0.054 0.000 1.010 1256 K CA -0.127 56.206 56.287 0.076 0.000 0.940 1256 K CB 0.951 33.477 32.500 0.042 0.000 0.983 1256 K HN 0.476 nan 8.250 nan 0.000 0.475 1257 Q N -0.225 119.608 119.800 0.056 0.000 2.528 1257 Q HA 0.756 5.096 4.340 -0.000 0.000 0.289 1257 Q C -1.744 174.293 176.000 0.062 0.000 1.091 1257 Q CA -1.297 54.539 55.803 0.056 0.000 0.797 1257 Q CB 2.103 30.880 28.738 0.066 0.000 1.466 1257 Q HN 0.495 nan 8.270 nan 0.000 0.436 1258 A N 1.323 124.196 122.820 0.087 0.000 2.497 1258 A HA 0.429 4.749 4.320 -0.000 0.000 0.280 1258 A C -1.380 176.334 177.584 0.217 0.000 1.065 1258 A CA -0.669 51.445 52.037 0.130 0.000 0.781 1258 A CB 1.228 20.292 19.000 0.107 0.000 1.289 1258 A HN 0.693 nan 8.150 nan 0.000 0.415 1259 E N 1.265 121.573 120.200 0.180 0.000 2.266 1259 E HA 0.730 5.080 4.350 -0.000 0.000 0.277 1259 E C -0.627 176.146 176.600 0.288 0.000 1.018 1259 E CA -0.261 56.227 56.400 0.148 0.000 0.840 1259 E CB 1.527 31.269 29.700 0.070 0.000 1.082 1259 E HN 0.705 nan 8.360 nan 0.000 0.395 1260 F N -1.314 118.643 119.950 0.012 0.000 3.122 1260 F HA 0.362 4.889 4.527 -0.000 0.000 0.325 1260 F C -1.541 174.274 175.800 0.025 0.000 1.162 1260 F CA -1.229 56.779 58.000 0.012 0.000 0.876 1260 F CB 1.072 40.067 39.000 -0.008 0.000 1.429 1260 F HN 0.164 nan 8.300 nan 0.000 0.484 1261 Q N 1.304 121.217 119.800 0.188 0.000 2.309 1261 Q HA 0.705 5.045 4.340 -0.000 0.000 0.264 1261 Q C -1.341 174.753 176.000 0.157 0.000 1.008 1261 Q CA -0.924 54.922 55.803 0.072 0.000 0.853 1261 Q CB 3.096 31.904 28.738 0.116 0.000 1.314 1261 Q HN 0.567 nan 8.270 nan 0.000 0.448 1262 I N 2.805 123.414 120.570 0.066 0.000 2.389 1262 I HA 0.291 4.461 4.170 -0.000 0.000 0.288 1262 I C -1.048 175.171 176.117 0.171 0.000 0.999 1262 I CA -0.829 60.550 61.300 0.131 0.000 1.129 1262 I CB 1.229 39.273 38.000 0.073 0.000 1.288 1262 I HN 0.287 nan 8.210 nan 0.000 0.444 1263 L N 6.945 128.288 121.223 0.200 0.000 2.287 1263 L HA 0.375 4.715 4.340 -0.000 0.000 0.287 1263 L C -0.475 176.585 176.870 0.317 0.000 1.022 1263 L CA -0.214 54.780 54.840 0.257 0.000 0.814 1263 L CB 0.626 42.799 42.059 0.190 0.000 1.217 1263 L HN 0.315 nan 8.230 nan 0.000 0.420 1264 Y N 3.346 123.711 120.300 0.109 0.000 2.944 1264 Y HA 0.066 4.616 4.550 -0.000 0.000 0.340 1264 Y C 1.649 177.652 175.900 0.171 0.000 1.275 1264 Y CA 0.971 59.143 58.100 0.121 0.000 1.590 1264 Y CB 0.262 38.758 38.460 0.059 0.000 1.218 1264 Y HN 0.885 nan 8.280 nan 0.000 0.576 1265 G N 2.684 111.733 108.800 0.416 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 0.487 175.500 174.900 0.187 0.000 1.012 1265 G CA 0.826 46.129 45.100 0.339 0.000 0.749 1265 G HN 0.776 nan 8.290 nan 0.000 0.512 1266 E N -2.251 118.047 120.200 0.163 0.000 2.583 1266 E HA 0.435 4.785 4.350 -0.000 0.000 0.204 1266 E C 1.369 177.973 176.600 0.006 0.000 0.860 1266 E CA 0.939 57.380 56.400 0.068 0.000 1.473 1266 E CB 0.585 30.345 29.700 0.100 0.000 1.469 1266 E HN 1.549 nan 8.360 nan 0.000 0.788 1267 G N 0.979 109.813 108.800 0.057 0.000 2.341 1267 G HA2 -0.124 3.836 3.960 -0.000 0.000 0.196 1267 G HA3 -0.124 3.836 3.960 -0.000 0.000 0.196 1267 G C -0.808 174.150 174.900 0.097 0.000 1.231 1267 G CA -0.385 44.726 45.100 0.018 0.000 1.155 1267 G HN 0.094 nan 8.290 nan 0.000 0.529 1268 I N 1.457 122.070 120.570 0.071 0.000 2.519 1268 I HA 0.195 4.365 4.170 -0.000 0.000 0.287 1268 I C 0.267 176.438 176.117 0.089 0.000 1.047 1268 I CA -0.574 60.798 61.300 0.120 0.000 1.381 1268 I CB 1.240 39.255 38.000 0.026 0.000 1.417 1268 I HN 0.394 nan 8.210 nan 0.000 0.540 1269 N N 5.431 124.217 118.700 0.142 0.000 2.671 1269 N HA -0.016 4.724 4.740 -0.000 0.000 0.274 1269 N C 0.677 176.244 175.510 0.095 0.000 1.188 1269 N CA 0.154 53.285 53.050 0.135 0.000 1.065 1269 N CB -0.149 38.441 38.487 0.172 0.000 1.415 1269 N HN 0.448 nan 8.380 nan 0.000 0.511 1270 F N 2.748 122.596 119.950 -0.171 0.000 2.043 1270 F HA -0.292 4.235 4.527 -0.000 0.000 0.297 1270 F C 1.069 176.703 175.800 -0.278 0.000 1.118 1270 F CA 1.875 59.672 58.000 -0.338 0.000 1.202 1270 F CB -0.359 38.248 39.000 -0.655 0.000 0.965 1270 F HN 0.487 nan 8.300 nan 0.000 0.482 1271 Y N -0.080 120.397 120.300 0.295 0.000 2.314 1271 Y HA 0.060 4.610 4.550 -0.000 0.000 0.293 1271 Y C 2.627 178.590 175.900 0.104 0.000 1.129 1271 Y CA 0.635 58.826 58.100 0.152 0.000 1.201 1271 Y CB -1.435 37.052 38.460 0.045 0.000 0.999 1271 Y HN 0.098 nan 8.280 nan 0.000 0.541 1272 G N 1.038 109.976 108.800 0.231 0.000 2.739 1272 G HA2 -0.366 3.594 3.960 -0.000 0.000 0.216 1272 G HA3 -0.366 3.594 3.960 -0.000 0.000 0.216 1272 G C 1.462 176.432 174.900 0.118 0.000 1.298 1272 G CA 1.492 46.685 45.100 0.155 0.000 0.804 1272 G HN 0.577 nan 8.290 nan 0.000 0.623 1273 E N 0.204 120.467 120.200 0.106 0.000 2.219 1273 E HA -0.143 4.207 4.350 -0.000 0.000 0.198 1273 E C 2.360 178.994 176.600 0.056 0.000 0.998 1273 E CA 1.043 57.484 56.400 0.069 0.000 0.818 1273 E CB -0.318 29.385 29.700 0.006 0.000 0.741 1273 E HN 0.340 nan 8.360 nan 0.000 0.477 1274 L N 1.466 122.748 121.223 0.098 0.000 1.994 1274 L HA -0.146 4.194 4.340 -0.000 0.000 0.208 1274 L C 2.346 179.262 176.870 0.078 0.000 1.071 1274 L CA 1.341 56.253 54.840 0.120 0.000 0.745 1274 L CB -0.627 41.573 42.059 0.235 0.000 0.892 1274 L HN 0.080 nan 8.230 nan 0.000 0.431 1275 V N 0.166 120.112 119.914 0.053 0.000 2.220 1275 V HA -0.393 3.727 4.120 -0.000 0.000 0.250 1275 V C 2.321 178.395 176.094 -0.033 0.000 1.056 1275 V CA 2.234 64.506 62.300 -0.046 0.000 1.016 1275 V CB -0.925 30.803 31.823 -0.158 0.000 0.639 1275 V HN 0.452 nan 8.190 nan 0.000 0.446 1276 D N -0.453 119.945 120.400 -0.003 0.000 2.239 1276 D HA -0.160 4.480 4.640 -0.000 0.000 0.202 1276 D C 1.804 178.132 176.300 0.048 0.000 0.993 1276 D CA 1.205 55.226 54.000 0.034 0.000 0.874 1276 D CB -0.094 40.741 40.800 0.058 0.000 0.922 1276 D HN 0.274 nan 8.370 nan 0.000 0.464 1277 L N -0.238 121.011 121.223 0.043 0.000 2.168 1277 L HA 0.132 4.472 4.340 -0.000 0.000 0.203 1277 L C 2.494 179.399 176.870 0.057 0.000 1.078 1277 L CA 1.126 55.993 54.840 0.046 0.000 0.780 1277 L CB -1.147 40.933 42.059 0.035 0.000 0.939 1277 L HN -0.015 nan 8.230 nan 0.000 0.451 1278 G N -1.370 107.466 108.800 0.061 0.000 2.882 1278 G HA2 0.039 3.999 3.960 -0.000 0.000 0.206 1278 G HA3 0.039 3.999 3.960 -0.000 0.000 0.206 1278 G C 1.376 176.332 174.900 0.094 0.000 1.155 1278 G CA 0.623 45.771 45.100 0.081 0.000 0.800 1278 G HN 0.221 nan 8.290 nan 0.000 0.524 1279 V N 0.174 120.140 119.914 0.086 0.000 2.283 1279 V HA 0.010 4.130 4.120 -0.000 0.000 0.239 1279 V C 2.598 178.749 176.094 0.094 0.000 1.035 1279 V CA 1.706 64.075 62.300 0.116 0.000 1.018 1279 V CB -0.267 31.634 31.823 0.129 0.000 0.658 1279 V HN 0.292 nan 8.190 nan 0.000 0.459 1280 K N -0.006 120.440 120.400 0.077 0.000 2.155 1280 K HA -0.061 4.259 4.320 -0.000 0.000 0.203 1280 K C 0.405 177.039 176.600 0.058 0.000 1.052 1280 K CA 0.777 57.102 56.287 0.063 0.000 0.948 1280 K CB 0.177 32.709 32.500 0.054 0.000 0.728 1280 K HN 0.367 nan 8.250 nan 0.000 0.448 1281 E N 2.355 122.592 120.200 0.061 0.000 2.136 1281 E HA 0.023 4.373 4.350 -0.000 0.000 0.246 1281 E C -0.851 175.792 176.600 0.071 0.000 1.017 1281 E CA -0.169 56.266 56.400 0.059 0.000 0.883 1281 E CB 0.882 30.614 29.700 0.054 0.000 1.199 1281 E HN 0.104 nan 8.360 nan 0.000 0.447 1282 K N 2.784 123.224 120.400 0.067 0.000 2.210 1282 K HA -0.121 4.199 4.320 -0.000 0.000 0.202 1282 K C 0.659 177.311 176.600 0.086 0.000 0.990 1282 K CA 0.334 56.665 56.287 0.074 0.000 1.322 1282 K CB -0.525 32.008 32.500 0.055 0.000 0.955 1282 K HN 0.388 nan 8.250 nan 0.000 0.258 1283 L N 0.412 121.707 121.223 0.120 0.000 2.425 1283 L HA 0.209 4.549 4.340 -0.000 0.000 0.215 1283 L C 0.763 177.784 176.870 0.251 0.000 1.065 1283 L CA 0.339 55.283 54.840 0.174 0.000 0.842 1283 L CB 0.284 42.463 42.059 0.200 0.000 1.033 1283 L HN 0.329 nan 8.230 nan 0.000 0.474 1284 I N -0.690 120.009 120.570 0.216 0.000 2.406 1284 I HA 0.285 4.455 4.170 -0.000 0.000 0.290 1284 I C -0.503 175.736 176.117 0.204 0.000 0.999 1284 I CA -0.692 60.749 61.300 0.235 0.000 1.124 1284 I CB 1.762 39.871 38.000 0.181 0.000 1.289 1284 I HN -0.163 nan 8.210 nan 0.000 0.441 1285 E N 5.883 126.197 120.200 0.190 0.000 2.130 1285 E HA 0.168 4.518 4.350 -0.000 0.000 0.284 1285 E C -0.604 176.105 176.600 0.180 0.000 1.018 1285 E CA -0.390 56.098 56.400 0.146 0.000 0.817 1285 E CB 0.870 30.617 29.700 0.079 0.000 1.078 1285 E HN 0.320 nan 8.360 nan 0.000 0.396 1286 K N 3.314 123.809 120.400 0.159 0.000 2.292 1286 K HA 0.306 4.626 4.320 -0.000 0.000 0.290 1286 K C -0.692 175.920 176.600 0.020 0.000 1.083 1286 K CA -0.115 56.217 56.287 0.074 0.000 0.918 1286 K CB 0.370 32.926 32.500 0.094 0.000 1.089 1286 K HN 0.538 nan 8.250 nan 0.000 0.473 1287 A N 4.032 126.858 122.820 0.009 0.000 3.258 1287 A HA 0.379 4.699 4.320 -0.000 0.000 0.275 1287 A C 0.959 178.573 177.584 0.050 0.000 1.452 1287 A CA 0.272 52.327 52.037 0.030 0.000 1.120 1287 A CB -0.432 18.581 19.000 0.023 0.000 1.107 1287 A HN 1.066 nan 8.150 nan 0.000 0.651 1288 G N 0.316 109.112 108.800 -0.007 0.000 4.951 1288 G HA2 -0.131 3.829 3.960 -0.000 0.000 0.295 1288 G HA3 -0.131 3.829 3.960 -0.000 0.000 0.295 1288 G C 1.303 176.142 174.900 -0.102 0.000 1.540 1288 G CA 0.606 45.696 45.100 -0.018 0.000 1.044 1288 G HN 1.717 nan 8.290 nan 0.000 0.731 1289 A N -0.778 121.985 122.820 -0.096 0.000 2.382 1289 A HA 0.582 4.902 4.320 -0.000 0.000 0.228 1289 A C 0.448 177.767 177.584 -0.440 0.000 1.217 1289 A CA 0.443 52.321 52.037 -0.265 0.000 0.923 1289 A CB 0.134 18.991 19.000 -0.239 0.000 0.979 1289 A HN 0.555 nan 8.150 nan 0.000 0.515 1290 W N -1.061 120.044 121.300 -0.324 0.000 2.449 1290 W HA 0.585 5.245 4.660 -0.000 0.000 0.331 1290 W C -0.674 175.614 176.519 -0.385 0.000 1.119 1290 W CA -0.101 57.082 57.345 -0.270 0.000 1.240 1290 W CB 0.600 29.975 29.460 -0.142 0.000 1.251 1290 W HN 0.180 nan 8.180 nan 0.000 0.576 1291 Y N 2.257 122.683 120.300 0.211 0.000 2.345 1291 Y HA 0.397 4.947 4.550 -0.000 0.000 0.331 1291 Y C 0.168 176.106 175.900 0.063 0.000 0.959 1291 Y CA -0.716 57.444 58.100 0.100 0.000 1.204 1291 Y CB 1.252 39.729 38.460 0.029 0.000 1.135 1291 Y HN 0.152 nan 8.280 nan 0.000 0.477 1292 S N 2.945 118.773 115.700 0.214 0.000 2.501 1292 S HA 0.326 4.796 4.470 -0.000 0.000 0.301 1292 S C -1.587 173.097 174.600 0.140 0.000 1.096 1292 S CA -0.735 57.527 58.200 0.103 0.000 1.063 1292 S CB 1.233 64.461 63.200 0.045 0.000 1.042 1292 S HN 0.533 nan 8.310 nan 0.000 0.494 1293 Y N 2.944 123.203 120.300 -0.069 0.000 2.555 1293 Y HA 0.359 4.909 4.550 -0.000 0.000 0.326 1293 Y C -0.194 175.699 175.900 -0.012 0.000 0.984 1293 Y CA -0.883 57.197 58.100 -0.033 0.000 1.298 1293 Y CB -0.043 38.384 38.460 -0.054 0.000 1.094 1293 Y HN 0.802 nan 8.280 nan 0.000 0.500 1294 K N 4.761 124.976 120.400 -0.309 0.000 4.361 1294 K HA -0.230 4.090 4.320 -0.000 0.000 0.294 1294 K C 1.041 177.554 176.600 -0.144 0.000 0.970 1294 K CA 0.862 56.981 56.287 -0.280 0.000 0.913 1294 K CB -1.297 30.943 32.500 -0.434 0.000 1.583 1294 K HN 1.244 nan 8.250 nan 0.000 0.438 1295 G N 0.725 109.469 108.800 -0.092 0.000 2.855 1295 G HA2 -0.431 3.529 3.960 -0.000 0.000 0.231 1295 G HA3 -0.431 3.529 3.960 -0.000 0.000 0.231 1295 G C 0.019 174.878 174.900 -0.068 0.000 1.242 1295 G CA 0.769 45.825 45.100 -0.074 0.000 0.789 1295 G HN 0.667 nan 8.290 nan 0.000 0.517 1296 E N 2.039 122.208 120.200 -0.052 0.000 2.316 1296 E HA 0.379 4.729 4.350 -0.000 0.000 0.275 1296 E C -0.197 176.373 176.600 -0.050 0.000 1.029 1296 E CA -0.176 56.203 56.400 -0.036 0.000 0.871 1296 E CB 0.357 30.059 29.700 0.004 0.000 1.022 1296 E HN 0.446 nan 8.360 nan 0.000 0.418 1297 K N 4.373 124.737 120.400 -0.061 0.000 2.234 1297 K HA 0.193 4.513 4.320 -0.000 0.000 0.282 1297 K C 0.869 177.398 176.600 -0.118 0.000 1.039 1297 K CA -0.053 56.212 56.287 -0.037 0.000 0.928 1297 K CB 0.900 33.392 32.500 -0.014 0.000 1.039 1297 K HN 0.584 nan 8.250 nan 0.000 0.470 1298 I N -1.528 118.907 120.570 -0.225 0.000 4.032 1298 I HA 0.371 4.541 4.170 -0.000 0.000 0.313 1298 I C 0.549 176.401 176.117 -0.441 0.000 1.272 1298 I CA -0.156 60.708 61.300 -0.728 0.000 1.307 1298 I CB 1.111 38.375 38.000 -1.227 0.000 1.155 1298 I HN 0.506 nan 8.210 nan 0.000 0.431 1299 G N 1.149 109.913 108.800 -0.059 0.000 2.655 1299 G HA2 0.352 4.312 3.960 -0.000 0.000 0.296 1299 G HA3 0.352 4.312 3.960 -0.000 0.000 0.296 1299 G C -2.160 172.753 174.900 0.021 0.000 1.485 1299 G CA -0.558 44.561 45.100 0.031 0.000 0.869 1299 G HN 0.192 nan 8.290 nan 0.000 0.540 1300 Q N 0.489 120.175 119.800 -0.190 0.000 2.333 1300 Q HA 0.567 4.907 4.340 -0.000 0.000 0.265 1300 Q C 0.325 176.190 176.000 -0.224 0.000 0.989 1300 Q CA 0.302 55.817 55.803 -0.480 0.000 0.842 1300 Q CB 1.429 29.620 28.738 -0.913 0.000 1.262 1300 Q HN 2.212 nan 8.270 nan 0.000 0.451 1301 G N 3.190 111.886 108.800 -0.174 0.000 2.977 1301 G HA2 -0.268 3.692 3.960 -0.000 0.000 0.686 1301 G HA3 -0.268 3.692 3.960 -0.000 0.000 0.686 1301 G C 0.202 175.224 174.900 0.203 0.000 1.088 1301 G CA 0.101 45.194 45.100 -0.012 0.000 0.845 1301 G HN 0.845 nan 8.290 nan 0.000 0.565 1302 K N 1.580 122.176 120.400 0.327 0.000 2.189 1302 K HA -0.200 4.120 4.320 -0.000 0.000 0.207 1302 K C 2.869 179.535 176.600 0.110 0.000 1.046 1302 K CA 2.613 59.053 56.287 0.255 0.000 0.928 1302 K CB -0.340 32.264 32.500 0.174 0.000 0.720 1302 K HN 1.299 nan 8.250 nan 0.000 0.458 1303 A N 1.985 124.859 122.820 0.089 0.000 1.863 1303 A HA -0.283 4.037 4.320 -0.000 0.000 0.218 1303 A C 1.796 179.417 177.584 0.062 0.000 1.233 1303 A CA 2.285 54.357 52.037 0.059 0.000 0.655 1303 A CB -0.889 18.130 19.000 0.033 0.000 0.839 1303 A HN 0.531 nan 8.150 nan 0.000 0.454 1304 N N -0.103 118.635 118.700 0.064 0.000 2.354 1304 N HA 0.016 4.756 4.740 -0.000 0.000 0.179 1304 N C 1.917 177.496 175.510 0.115 0.000 1.021 1304 N CA 1.175 54.271 53.050 0.077 0.000 0.887 1304 N CB -0.483 38.034 38.487 0.050 0.000 0.974 1304 N HN 0.529 nan 8.380 nan 0.000 0.437 1305 A N 1.552 124.431 122.820 0.099 0.000 1.841 1305 A HA -0.168 4.152 4.320 -0.000 0.000 0.216 1305 A C 2.362 179.984 177.584 0.064 0.000 1.199 1305 A CA 2.206 54.270 52.037 0.045 0.000 0.621 1305 A CB -1.366 17.518 19.000 -0.193 0.000 0.835 1305 A HN 0.253 nan 8.150 nan 0.000 0.445 1306 T N 0.711 115.282 114.554 0.028 0.000 2.427 1306 T HA -0.277 4.073 4.350 -0.000 0.000 0.244 1306 T C 2.001 176.734 174.700 0.054 0.000 1.325 1306 T CA 2.655 64.795 62.100 0.068 0.000 1.173 1306 T CB -0.902 68.017 68.868 0.085 0.000 0.859 1306 T HN 0.792 nan 8.240 nan 0.000 0.415 1307 A N -0.633 122.219 122.820 0.053 0.000 2.248 1307 A HA -0.007 4.313 4.320 -0.000 0.000 0.210 1307 A C 1.832 179.412 177.584 -0.006 0.000 1.174 1307 A CA 1.035 53.072 52.037 0.001 0.000 0.750 1307 A CB -1.013 18.000 19.000 0.021 0.000 0.780 1307 A HN 0.742 nan 8.150 nan 0.000 0.478 1308 W N 0.263 121.488 121.300 -0.124 0.000 2.444 1308 W HA -0.041 4.619 4.660 -0.000 0.000 0.308 1308 W C 1.610 177.996 176.519 -0.221 0.000 1.183 1308 W CA 1.528 58.796 57.345 -0.128 0.000 1.340 1308 W CB -0.261 29.155 29.460 -0.073 0.000 1.138 1308 W HN 0.222 nan 8.180 nan 0.000 0.510 1309 L N 1.044 122.199 121.223 -0.113 0.000 2.189 1309 L HA -0.264 4.076 4.340 -0.000 0.000 0.214 1309 L C 2.395 178.759 176.870 -0.843 0.000 1.097 1309 L CA 1.662 56.247 54.840 -0.425 0.000 0.764 1309 L CB -1.070 40.856 42.059 -0.221 0.000 0.900 1309 L HN 0.047 nan 8.230 nan 0.000 0.436 1310 K N 0.084 119.980 120.400 -0.841 0.000 2.152 1310 K HA -0.184 4.136 4.320 -0.000 0.000 0.206 1310 K C 1.261 177.527 176.600 -0.556 0.000 1.048 1310 K CA 1.508 57.278 56.287 -0.862 0.000 0.933 1310 K CB 0.119 32.349 32.500 -0.452 0.000 0.721 1310 K HN 0.297 nan 8.250 nan 0.000 0.447 1311 D N -0.191 119.896 120.400 -0.523 0.000 2.360 1311 D HA 0.010 4.650 4.640 -0.000 0.000 0.210 1311 D C -0.247 175.767 176.300 -0.477 0.000 1.047 1311 D CA 0.434 54.179 54.000 -0.426 0.000 0.854 1311 D CB 0.262 40.848 40.800 -0.357 0.000 0.936 1311 D HN 0.212 nan 8.370 nan 0.000 0.514 1312 N N 1.443 119.763 118.700 -0.634 0.000 2.886 1312 N HA 0.153 4.893 4.740 -0.000 0.000 0.285 1312 N C -2.165 173.104 175.510 -0.401 0.000 1.706 1312 N CA -1.088 51.632 53.050 -0.551 0.000 0.904 1312 N CB 1.960 39.959 38.487 -0.813 0.000 1.224 1312 N HN -0.052 nan 8.380 nan 0.000 0.488 1313 P HA -0.197 nan 4.420 nan 0.000 0.214 1313 P C 1.715 178.926 177.300 -0.148 0.000 1.163 1313 P CA 1.379 64.350 63.100 -0.215 0.000 0.883 1313 P CB 0.288 31.896 31.700 -0.153 0.000 0.788 1314 E N -0.077 120.050 120.200 -0.122 0.000 2.085 1314 E HA -0.182 4.168 4.350 -0.000 0.000 0.194 1314 E C 1.552 178.114 176.600 -0.063 0.000 0.994 1314 E CA 2.078 58.433 56.400 -0.075 0.000 0.801 1314 E CB -2.133 27.535 29.700 -0.053 0.000 0.743 1314 E HN 0.174 nan 8.360 nan 0.000 0.453 1315 T N 1.334 115.829 114.554 -0.098 0.000 2.759 1315 T HA -0.027 4.323 4.350 -0.000 0.000 0.269 1315 T C 1.943 176.585 174.700 -0.097 0.000 1.042 1315 T CA 1.964 64.013 62.100 -0.086 0.000 1.140 1315 T CB -0.337 68.455 68.868 -0.128 0.000 0.864 1315 T HN 0.473 nan 8.240 nan 0.000 0.455 1316 A N 2.119 124.877 122.820 -0.104 0.000 1.826 1316 A HA -0.018 4.302 4.320 -0.000 0.000 0.214 1316 A C 2.161 179.751 177.584 0.009 0.000 1.212 1316 A CA 0.998 53.018 52.037 -0.028 0.000 0.605 1316 A CB -0.412 18.601 19.000 0.022 0.000 0.861 1316 A HN 0.342 nan 8.150 nan 0.000 0.447 1317 K N -0.121 120.268 120.400 -0.019 0.000 2.520 1317 K HA -0.177 4.143 4.320 -0.000 0.000 0.197 1317 K C 1.751 178.364 176.600 0.021 0.000 1.044 1317 K CA 1.252 57.532 56.287 -0.011 0.000 0.938 1317 K CB -0.021 32.448 32.500 -0.052 0.000 0.767 1317 K HN 0.708 nan 8.250 nan 0.000 0.481 1318 E N 1.010 121.223 120.200 0.021 0.000 2.127 1318 E HA -0.029 4.321 4.350 -0.000 0.000 0.191 1318 E C 1.982 178.619 176.600 0.061 0.000 0.964 1318 E CA 0.157 56.582 56.400 0.042 0.000 0.832 1318 E CB 0.150 29.879 29.700 0.047 0.000 0.790 1318 E HN 0.198 nan 8.360 nan 0.000 0.465 1319 I N 1.754 122.360 120.570 0.059 0.000 2.286 1319 I HA -0.256 3.914 4.170 -0.000 0.000 0.248 1319 I C 2.653 178.820 176.117 0.083 0.000 1.115 1319 I CA 1.100 62.446 61.300 0.077 0.000 1.392 1319 I CB -0.332 37.697 38.000 0.050 0.000 1.065 1319 I HN 0.270 nan 8.210 nan 0.000 0.418 1320 E N 1.733 121.989 120.200 0.093 0.000 2.037 1320 E HA -0.376 3.974 4.350 -0.000 0.000 0.214 1320 E C 2.210 178.857 176.600 0.077 0.000 1.041 1320 E CA 2.349 58.819 56.400 0.116 0.000 0.872 1320 E CB -0.188 29.612 29.700 0.165 0.000 0.785 1320 E HN 0.319 nan 8.360 nan 0.000 0.476 1321 K N 0.351 120.791 120.400 0.067 0.000 2.107 1321 K HA -0.235 4.085 4.320 -0.000 0.000 0.211 1321 K C 2.248 178.876 176.600 0.046 0.000 1.049 1321 K CA 1.930 58.246 56.287 0.049 0.000 0.927 1321 K CB -0.048 32.477 32.500 0.043 0.000 0.714 1321 K HN -0.026 nan 8.250 nan 0.000 0.452 1322 K N 0.321 120.756 120.400 0.057 0.000 2.152 1322 K HA -0.100 4.220 4.320 -0.000 0.000 0.206 1322 K C 1.970 178.600 176.600 0.050 0.000 1.048 1322 K CA 1.282 57.603 56.287 0.058 0.000 0.933 1322 K CB -0.035 32.512 32.500 0.078 0.000 0.721 1322 K HN 0.137 nan 8.250 nan 0.000 0.447 1323 V N 0.400 120.344 119.914 0.050 0.000 2.788 1323 V HA -0.057 4.063 4.120 -0.000 0.000 0.251 1323 V C 2.182 178.291 176.094 0.024 0.000 1.068 1323 V CA 0.949 63.272 62.300 0.039 0.000 1.090 1323 V CB -0.380 31.466 31.823 0.039 0.000 0.710 1323 V HN 0.214 nan 8.190 nan 0.000 0.467 1324 R N 0.130 120.644 120.500 0.023 0.000 2.189 1324 R HA -0.096 4.244 4.340 -0.000 0.000 0.223 1324 R C 2.128 178.435 176.300 0.012 0.000 1.092 1324 R CA 1.127 57.234 56.100 0.011 0.000 0.989 1324 R CB -0.052 30.255 30.300 0.011 0.000 0.876 1324 R HN 0.618 nan 8.270 nan 0.000 0.457 1325 E N 0.117 120.329 120.200 0.020 0.000 2.230 1325 E HA -0.048 4.302 4.350 -0.000 0.000 0.192 1325 E C 1.489 178.099 176.600 0.018 0.000 0.987 1325 E CA 0.566 56.978 56.400 0.019 0.000 0.841 1325 E CB 0.256 29.970 29.700 0.024 0.000 0.783 1325 E HN 0.228 nan 8.360 nan 0.000 0.481 1326 L N 0.143 121.379 121.223 0.022 0.000 2.567 1326 L HA 0.119 4.459 4.340 -0.000 0.000 0.225 1326 L C 1.253 178.133 176.870 0.017 0.000 1.119 1326 L CA 0.279 55.133 54.840 0.022 0.000 0.871 1326 L CB 0.574 42.651 42.059 0.029 0.000 1.036 1326 L HN 0.060 nan 8.230 nan 0.000 0.459 1327 L N -0.645 120.585 121.223 0.011 0.000 3.429 1327 L HA 0.299 4.639 4.340 -0.000 0.000 0.311 1327 L C -1.012 175.858 176.870 -0.001 0.000 1.274 1327 L CA -0.024 54.819 54.840 0.006 0.000 1.037 1327 L CB 0.920 42.981 42.059 0.004 0.000 1.433 1327 L HN 0.042 nan 8.230 nan 0.000 0.614 2007 Q N 0.556 120.359 119.800 0.005 0.000 2.444 2007 Q HA 0.065 4.405 4.340 -0.000 0.000 0.206 2007 Q C 0.812 176.816 176.000 0.008 0.000 0.948 2007 Q CA 0.524 56.331 55.803 0.007 0.000 0.946 2007 Q CB 0.267 29.009 28.738 0.006 0.000 1.027 2007 Q HN 0.304 nan 8.270 nan 0.000 0.513 2008 K N 0.735 121.139 120.400 0.007 0.000 1.984 2008 K HA -0.091 4.229 4.320 -0.000 0.000 0.209 2008 K C 1.904 178.509 176.600 0.009 0.000 1.046 2008 K CA 1.312 57.603 56.287 0.007 0.000 0.934 2008 K CB -0.026 32.477 32.500 0.006 0.000 0.717 2008 K HN 0.152 nan 8.250 nan 0.000 0.438 2009 A N 0.408 123.233 122.820 0.009 0.000 2.016 2009 A HA -0.034 4.286 4.320 -0.000 0.000 0.217 2009 A C 1.884 179.476 177.584 0.013 0.000 1.162 2009 A CA 0.684 52.727 52.037 0.010 0.000 0.662 2009 A CB -0.238 18.767 19.000 0.009 0.000 0.812 2009 A HN 0.284 nan 8.150 nan 0.000 0.450 2010 L N -0.428 120.802 121.223 0.013 0.000 2.022 2010 L HA 0.160 4.500 4.340 -0.000 0.000 0.204 2010 L C 2.657 179.538 176.870 0.018 0.000 1.076 2010 L CA 1.871 56.720 54.840 0.016 0.000 0.749 2010 L CB -0.680 41.388 42.059 0.013 0.000 0.903 2010 L HN 0.268 nan 8.230 nan 0.000 0.439 2011 A N -0.655 122.175 122.820 0.016 0.000 2.139 2011 A HA -0.142 4.178 4.320 -0.000 0.000 0.221 2011 A C 2.223 179.818 177.584 0.019 0.000 1.159 2011 A CA 1.890 53.937 52.037 0.018 0.000 0.662 2011 A CB -0.946 18.062 19.000 0.014 0.000 0.796 2011 A HN 0.603 nan 8.150 nan 0.000 0.463 2012 A N -0.852 121.978 122.820 0.018 0.000 1.901 2012 A HA 0.492 4.812 4.320 -0.000 0.000 0.210 2012 A C 2.275 179.872 177.584 0.021 0.000 1.208 2012 A CA 1.106 53.154 52.037 0.017 0.000 0.644 2012 A CB -0.736 18.272 19.000 0.014 0.000 0.863 2012 A HN 1.005 nan 8.150 nan 0.000 0.454 2013 A N -0.485 122.349 122.820 0.024 0.000 2.209 2013 A HA 0.262 4.582 4.320 -0.000 0.000 0.212 2013 A C 1.917 179.524 177.584 0.039 0.000 1.158 2013 A CA 0.559 52.613 52.037 0.030 0.000 0.742 2013 A CB -0.469 18.549 19.000 0.028 0.000 0.790 2013 A HN 0.461 nan 8.150 nan 0.000 0.472 2014 L N -0.995 120.250 121.223 0.037 0.000 1.971 2014 L HA -0.036 4.304 4.340 -0.000 0.000 0.208 2014 L C 2.731 179.630 176.870 0.049 0.000 1.083 2014 L CA 1.192 56.058 54.840 0.044 0.000 0.753 2014 L CB -0.939 41.143 42.059 0.038 0.000 0.893 2014 L HN 0.447 nan 8.230 nan 0.000 0.436 2015 G N -1.116 107.708 108.800 0.039 0.000 2.564 2015 G HA2 -0.233 3.727 3.960 -0.000 0.000 0.217 2015 G HA3 -0.233 3.727 3.960 -0.000 0.000 0.217 2015 G C 1.402 176.323 174.900 0.035 0.000 1.120 2015 G CA 0.189 45.311 45.100 0.037 0.000 0.752 2015 G HN 0.364 nan 8.290 nan 0.000 0.558 2016 Q N -0.452 119.370 119.800 0.038 0.000 2.297 2016 Q HA 0.007 4.347 4.340 -0.000 0.000 0.204 2016 Q C 2.271 178.298 176.000 0.046 0.000 0.962 2016 Q CA 0.570 56.392 55.803 0.031 0.000 0.879 2016 Q CB 0.068 28.826 28.738 0.033 0.000 0.947 2016 Q HN 0.528 nan 8.270 nan 0.000 0.462 2017 I N -0.867 119.755 120.570 0.088 0.000 3.081 2017 I HA -0.015 4.155 4.170 -0.000 0.000 0.274 2017 I C 1.790 178.001 176.117 0.156 0.000 1.178 2017 I CA 0.507 61.907 61.300 0.167 0.000 1.460 2017 I CB -0.871 37.252 38.000 0.205 0.000 1.137 2017 I HN 0.106 nan 8.210 nan 0.000 0.443 2018 E N 1.512 121.773 120.200 0.103 0.000 2.150 2018 E HA -0.211 4.139 4.350 -0.000 0.000 0.193 2018 E C 2.076 178.709 176.600 0.056 0.000 0.985 2018 E CA 0.896 57.348 56.400 0.086 0.000 0.814 2018 E CB 0.130 29.869 29.700 0.065 0.000 0.752 2018 E HN 0.363 nan 8.360 nan 0.000 0.466 2019 K N 0.665 121.082 120.400 0.028 0.000 2.062 2019 K HA -0.159 4.161 4.320 -0.000 0.000 0.205 2019 K C 2.138 178.712 176.600 -0.043 0.000 1.051 2019 K CA 1.129 57.414 56.287 -0.004 0.000 0.941 2019 K CB 0.130 32.622 32.500 -0.013 0.000 0.719 2019 K HN 0.028 nan 8.250 nan 0.000 0.440 2020 Q N -1.178 118.570 119.800 -0.086 0.000 2.297 2020 Q HA 0.009 4.349 4.340 -0.000 0.000 0.203 2020 Q C -0.119 175.662 176.000 -0.364 0.000 0.931 2020 Q CA 0.578 56.214 55.803 -0.277 0.000 0.885 2020 Q CB 0.511 28.998 28.738 -0.418 0.000 0.991 2020 Q HN 0.154 nan 8.270 nan 0.000 0.498 2021 F N 0.419 120.385 119.950 0.026 0.000 2.893 2021 F HA 0.399 4.926 4.527 -0.000 0.000 0.340 2021 F C 0.185 176.008 175.800 0.038 0.000 1.300 2021 F CA 0.056 58.074 58.000 0.030 0.000 1.227 2021 F CB 1.118 40.136 39.000 0.030 0.000 1.044 2021 F HN 0.064 nan 8.300 nan 0.000 0.512 2022 G N 1.384 110.289 108.800 0.175 0.000 2.977 2022 G HA2 -0.252 3.708 3.960 -0.000 0.000 0.686 2022 G HA3 -0.252 3.708 3.960 -0.000 0.000 0.686 2022 G C -0.467 174.501 174.900 0.113 0.000 1.088 2022 G CA -1.125 44.054 45.100 0.131 0.000 0.845 2022 G HN 0.254 nan 8.290 nan 0.000 0.565 2023 K N 1.175 121.623 120.400 0.080 0.000 2.419 2023 K HA 0.492 4.812 4.320 -0.000 0.000 0.282 2023 K C 1.207 177.850 176.600 0.072 0.000 1.056 2023 K CA 1.232 57.559 56.287 0.067 0.000 1.035 2023 K CB 0.705 33.233 32.500 0.047 0.000 0.921 2023 K HN 2.225 nan 8.250 nan 0.000 0.472 2024 G N 2.101 110.946 108.800 0.076 0.000 2.401 2024 G HA2 -0.245 3.715 3.960 -0.000 0.000 0.283 2024 G HA3 -0.245 3.715 3.960 -0.000 0.000 0.283 2024 G C 0.141 175.094 174.900 0.088 0.000 1.117 2024 G CA -0.066 45.079 45.100 0.075 0.000 1.051 2024 G HN 0.473 nan 8.290 nan 0.000 0.510 2025 S N -0.272 115.488 115.700 0.101 0.000 2.552 2025 S HA 0.632 5.102 4.470 -0.000 0.000 0.246 2025 S C 0.285 174.940 174.600 0.091 0.000 1.019 2025 S CA 0.400 58.660 58.200 0.100 0.000 1.045 2025 S CB -0.208 63.056 63.200 0.107 0.000 0.784 2025 S HN 1.143 nan 8.310 nan 0.000 0.453 2026 I N 1.241 121.867 120.570 0.092 0.000 2.624 2026 I HA 0.339 4.509 4.170 -0.000 0.000 0.296 2026 I C -2.161 174.007 176.117 0.085 0.000 1.792 2026 I CA -0.674 60.681 61.300 0.091 0.000 0.970 2026 I CB 1.481 39.527 38.000 0.078 0.000 1.502 2026 I HN 0.260 nan 8.210 nan 0.000 0.549 2027 M N 4.103 123.756 119.600 0.089 0.000 2.853 2027 M HA 0.486 4.966 4.480 -0.000 0.000 0.273 2027 M C -1.684 174.659 176.300 0.071 0.000 1.128 2027 M CA -1.028 54.317 55.300 0.074 0.000 0.814 2027 M CB 1.800 34.443 32.600 0.072 0.000 1.667 2027 M HN 0.539 nan 8.290 nan 0.000 0.519 2028 R N 0.769 121.301 120.500 0.053 0.000 2.590 2028 R HA 0.316 4.656 4.340 -0.000 0.000 0.274 2028 R C 0.746 177.074 176.300 0.046 0.000 1.061 2028 R CA -0.084 56.040 56.100 0.041 0.000 1.081 2028 R CB 0.697 31.014 30.300 0.028 0.000 0.984 2028 R HN 0.643 nan 8.270 nan 0.000 0.448 2029 L N 1.639 122.885 121.223 0.038 0.000 2.291 2029 L HA -0.025 4.315 4.340 -0.000 0.000 0.214 2029 L C 1.938 178.830 176.870 0.037 0.000 1.120 2029 L CA 1.110 55.978 54.840 0.046 0.000 0.799 2029 L CB -0.031 42.040 42.059 0.019 0.000 0.925 2029 L HN 0.851 nan 8.230 nan 0.000 0.446 2030 G N -0.854 107.960 108.800 0.023 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 0.350 175.263 174.900 0.022 0.000 1.182 2030 G CA -0.301 44.810 45.100 0.019 0.000 0.791 2030 G HN 0.231 nan 8.290 nan 0.000 0.537 2031 E N 0.086 120.303 120.200 0.029 0.000 2.313 2031 E HA 0.132 4.482 4.350 -0.000 0.000 0.276 2031 E C 0.003 176.619 176.600 0.026 0.000 1.031 2031 E CA -0.271 56.146 56.400 0.028 0.000 0.857 2031 E CB 1.118 30.837 29.700 0.033 0.000 1.040 2031 E HN 0.072 nan 8.360 nan 0.000 0.408 2032 D N 1.263 121.676 120.400 0.021 0.000 2.277 2032 D HA -0.054 4.586 4.640 -0.000 0.000 0.208 2032 D C 0.360 176.671 176.300 0.019 0.000 0.962 2032 D CA 0.501 54.512 54.000 0.018 0.000 0.865 2032 D CB 0.216 41.025 40.800 0.015 0.000 0.939 2032 D HN 0.086 nan 8.370 nan 0.000 0.510 2033 R N 1.428 121.940 120.500 0.021 0.000 2.446 2033 R HA 0.085 4.425 4.340 -0.000 0.000 0.314 2033 R C -0.573 175.741 176.300 0.023 0.000 1.003 2033 R CA 0.188 56.300 56.100 0.022 0.000 1.018 2033 R CB 0.082 30.397 30.300 0.024 0.000 0.945 2033 R HN 0.088 nan 8.270 nan 0.000 0.419 2034 S N 4.738 120.449 115.700 0.019 0.000 2.449 2034 S HA 0.344 4.814 4.470 -0.000 0.000 0.310 2034 S C 0.318 174.928 174.600 0.017 0.000 1.096 2034 S CA -1.036 57.174 58.200 0.017 0.000 1.095 2034 S CB 1.428 64.635 63.200 0.011 0.000 1.007 2034 S HN 0.519 nan 8.310 nan 0.000 0.474 2035 M N 2.635 122.246 119.600 0.019 0.000 2.327 2035 M HA 0.087 4.567 4.480 -0.000 0.000 0.353 2035 M C -0.358 175.949 176.300 0.013 0.000 1.539 2035 M CA 0.142 55.453 55.300 0.018 0.000 1.039 2035 M CB -0.442 32.171 32.600 0.022 0.000 1.967 2035 M HN 0.614 nan 8.290 nan 0.000 0.459 2036 D N 4.019 124.426 120.400 0.011 0.000 2.498 2036 D HA 0.311 4.951 4.640 -0.000 0.000 0.229 2036 D C -0.954 175.350 176.300 0.006 0.000 1.188 2036 D CA 0.180 54.185 54.000 0.007 0.000 1.028 2036 D CB 0.238 41.042 40.800 0.007 0.000 1.087 2036 D HN 0.236 nan 8.370 nan 0.000 0.510 2037 V N 1.874 121.791 119.914 0.004 0.000 2.815 2037 V HA 0.360 4.480 4.120 -0.000 0.000 0.314 2037 V C 0.558 176.651 176.094 -0.002 0.000 1.064 2037 V CA -1.089 61.212 62.300 0.002 0.000 0.952 2037 V CB 2.158 33.983 31.823 0.004 0.000 1.020 2037 V HN 0.239 nan 8.190 nan 0.000 0.439 2038 E N 1.260 121.458 120.200 -0.003 0.000 2.373 2038 E HA 0.492 4.842 4.350 -0.000 0.000 0.263 2038 E C -0.296 176.298 176.600 -0.009 0.000 1.073 2038 E CA -0.100 56.297 56.400 -0.005 0.000 0.894 2038 E CB 1.048 30.745 29.700 -0.004 0.000 1.008 2038 E HN 0.906 nan 8.360 nan 0.000 0.420 2039 T N -0.185 114.363 114.554 -0.011 0.000 2.886 2039 T HA 0.549 4.899 4.350 -0.000 0.000 0.292 2039 T C -0.471 174.219 174.700 -0.018 0.000 1.012 2039 T CA -0.914 61.176 62.100 -0.017 0.000 0.982 2039 T CB 0.773 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 2.400 122.957 120.570 -0.021 0.000 2.354 2040 I HA 0.352 4.522 4.170 -0.000 0.000 0.292 2040 I C 0.908 177.008 176.117 -0.029 0.000 0.989 2040 I CA -0.602 60.686 61.300 -0.020 0.000 1.188 2040 I CB 1.521 39.512 38.000 -0.017 0.000 1.342 2040 I HN 0.858 nan 8.210 nan 0.000 0.457 2041 S N 3.616 119.299 115.700 -0.029 0.000 2.546 2041 S HA 0.014 4.484 4.470 -0.000 0.000 0.290 2041 S C 1.606 176.175 174.600 -0.052 0.000 1.290 2041 S CA 0.143 58.315 58.200 -0.047 0.000 1.069 2041 S CB 0.388 63.566 63.200 -0.037 0.000 0.846 2041 S HN 0.809 nan 8.310 nan 0.000 0.495 2042 T N 2.627 117.132 114.554 -0.082 0.000 2.951 2042 T HA 0.231 4.581 4.350 -0.000 0.000 0.268 2042 T C 1.544 176.198 174.700 -0.076 0.000 1.073 2042 T CA 1.136 63.187 62.100 -0.081 0.000 1.134 2042 T CB -0.458 68.337 68.868 -0.123 0.000 0.884 2042 T HN 1.405 nan 8.240 nan 0.000 0.479 2043 G N 0.461 109.198 108.800 -0.105 0.000 2.436 2043 G HA2 -0.186 3.774 3.960 -0.000 0.000 0.204 2043 G HA3 -0.186 3.774 3.960 -0.000 0.000 0.204 2043 G C 0.376 175.147 174.900 -0.216 0.000 1.026 2043 G CA 0.169 45.220 45.100 -0.083 0.000 0.658 2043 G HN 0.981 nan 8.290 nan 0.000 0.499 2044 S N 2.096 117.603 115.700 -0.321 0.000 2.399 2044 S HA 0.584 5.054 4.470 -0.000 0.000 0.301 2044 S C 1.864 176.199 174.600 -0.442 0.000 1.093 2044 S CA -0.423 57.472 58.200 -0.507 0.000 1.077 2044 S CB 0.229 62.815 63.200 -1.024 0.000 0.980 2044 S HN 0.350 nan 8.310 nan 0.000 0.494 2045 L N 4.418 125.369 121.223 -0.454 0.000 2.034 2045 L HA -0.161 4.179 4.340 -0.000 0.000 0.217 2045 L C 2.784 179.503 176.870 -0.253 0.000 1.077 2045 L CA 2.580 57.208 54.840 -0.354 0.000 0.769 2045 L CB -1.685 40.141 42.059 -0.389 0.000 0.890 2045 L HN 0.892 nan 8.230 nan 0.000 0.435 2046 S N -0.905 114.643 115.700 -0.252 0.000 2.423 2046 S HA -0.187 4.283 4.470 -0.000 0.000 0.231 2046 S C 1.992 176.484 174.600 -0.180 0.000 1.014 2046 S CA 0.851 58.949 58.200 -0.169 0.000 0.965 2046 S CB -0.585 62.554 63.200 -0.102 0.000 0.785 2046 S HN 0.430 nan 8.310 nan 0.000 0.495 2047 L N 1.549 122.600 121.223 -0.287 0.000 2.005 2047 L HA -0.121 4.219 4.340 -0.000 0.000 0.207 2047 L C 2.112 178.888 176.870 -0.157 0.000 1.072 2047 L CA 1.970 56.672 54.840 -0.230 0.000 0.744 2047 L CB -0.624 41.245 42.059 -0.316 0.000 0.895 2047 L HN 0.183 nan 8.230 nan 0.000 0.433 2048 D N 0.359 120.657 120.400 -0.170 0.000 2.160 2048 D HA -0.289 4.351 4.640 -0.000 0.000 0.189 2048 D C 2.092 178.338 176.300 -0.090 0.000 1.003 2048 D CA 1.976 55.903 54.000 -0.121 0.000 0.846 2048 D CB -0.454 40.269 40.800 -0.128 0.000 0.949 2048 D HN 0.353 nan 8.370 nan 0.000 0.446 2049 I N 1.133 121.647 120.570 -0.092 0.000 2.087 2049 I HA -0.339 3.831 4.170 -0.000 0.000 0.240 2049 I C 2.412 178.503 176.117 -0.042 0.000 1.054 2049 I CA 1.821 63.084 61.300 -0.060 0.000 1.311 2049 I CB -0.268 37.697 38.000 -0.058 0.000 1.024 2049 I HN -0.024 nan 8.210 nan 0.000 0.402 2050 A N -0.159 122.634 122.820 -0.045 0.000 2.119 2050 A HA -0.064 4.256 4.320 -0.000 0.000 0.217 2050 A C 2.279 179.845 177.584 -0.029 0.000 1.153 2050 A CA 0.850 52.873 52.037 -0.023 0.000 0.692 2050 A CB -0.699 18.294 19.000 -0.012 0.000 0.799 2050 A HN 0.439 nan 8.150 nan 0.000 0.458 2051 L N -1.641 119.553 121.223 -0.048 0.000 2.191 2051 L HA -0.092 4.248 4.340 -0.000 0.000 0.212 2051 L C 2.172 179.023 176.870 -0.032 0.000 1.103 2051 L CA 1.203 56.014 54.840 -0.049 0.000 0.769 2051 L CB -0.212 41.811 42.059 -0.060 0.000 0.908 2051 L HN 0.623 nan 8.230 nan 0.000 0.438 2052 G N -1.464 107.322 108.800 -0.024 0.000 2.420 2052 G HA2 -0.371 3.589 3.960 -0.000 0.000 0.221 2052 G HA3 -0.371 3.589 3.960 -0.000 0.000 0.221 2052 G C 1.004 175.897 174.900 -0.011 0.000 1.117 2052 G CA 0.430 45.525 45.100 -0.010 0.000 0.657 2052 G HN 0.461 nan 8.290 nan 0.000 0.512 2053 A N 0.348 123.157 122.820 -0.018 0.000 2.147 2053 A HA 0.584 4.904 4.320 -0.000 0.000 0.211 2053 A C 2.369 179.939 177.584 -0.023 0.000 1.160 2053 A CA 1.926 53.953 52.037 -0.016 0.000 0.781 2053 A CB -0.306 18.685 19.000 -0.014 0.000 0.842 2053 A HN 2.559 nan 8.150 nan 0.000 0.475 2054 G N -1.874 106.905 108.800 -0.034 0.000 2.203 2054 G HA2 0.400 4.359 3.960 -0.000 0.000 0.231 2054 G HA3 0.400 4.359 3.960 -0.000 0.000 0.231 2054 G C 0.795 175.665 174.900 -0.050 0.000 1.058 2054 G CA 0.274 45.347 45.100 -0.045 0.000 0.781 2054 G HN 2.308 nan 8.290 nan 0.000 0.496 2055 G N -1.623 107.145 108.800 -0.054 0.000 2.339 2055 G HA2 0.415 4.375 3.960 -0.000 0.000 0.381 2055 G HA3 0.415 4.375 3.960 -0.000 0.000 0.381 2055 G C -0.456 174.417 174.900 -0.044 0.000 1.400 2055 G CA -0.518 44.551 45.100 -0.052 0.000 1.002 2055 G HN 1.017 nan 8.290 nan 0.000 0.633 2056 L N 1.970 123.168 121.223 -0.042 0.000 2.397 2056 L HA 0.357 4.697 4.340 -0.000 0.000 0.271 2056 L C -1.477 175.376 176.870 -0.029 0.000 1.148 2056 L CA -1.608 53.209 54.840 -0.038 0.000 0.825 2056 L CB 1.021 43.057 42.059 -0.038 0.000 1.117 2056 L HN 0.351 nan 8.230 nan 0.000 0.456 2057 P HA -0.002 nan 4.420 nan 0.000 0.264 2057 P C -0.616 176.673 177.300 -0.018 0.000 1.193 2057 P CA -0.061 63.028 63.100 -0.018 0.000 0.763 2057 P CB 0.515 32.207 31.700 -0.014 0.000 0.810 2058 M N 2.183 121.774 119.600 -0.014 0.000 2.200 2058 M HA 0.192 4.672 4.480 -0.000 0.000 0.355 2058 M C 1.546 177.837 176.300 -0.014 0.000 1.283 2058 M CA 0.646 55.937 55.300 -0.015 0.000 1.124 2058 M CB -0.371 32.222 32.600 -0.011 0.000 1.625 2058 M HN 0.810 nan 8.290 nan 0.000 0.463 2059 G N 3.127 111.915 108.800 -0.019 0.000 2.179 2059 G HA2 -0.219 3.741 3.960 -0.000 0.000 0.257 2059 G HA3 -0.219 3.741 3.960 -0.000 0.000 0.257 2059 G C 0.128 175.017 174.900 -0.018 0.000 1.010 2059 G CA 0.026 45.114 45.100 -0.020 0.000 0.736 2059 G HN 0.577 nan 8.290 nan 0.000 0.513 2060 R N -0.822 119.667 120.500 -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 54.912 56.100 -0.006 0.000 0.982 2060 R CB 1.091 31.392 30.300 0.002 0.000 1.185 2060 R HN 0.196 nan 8.270 nan 0.000 0.484 2061 I N 1.434 122.016 120.570 0.021 0.000 2.365 2061 I HA 0.222 4.392 4.170 -0.000 0.000 0.291 2061 I C -0.168 175.970 176.117 0.036 0.000 1.004 2061 I CA -0.707 60.617 61.300 0.039 0.000 1.311 2061 I CB 1.501 39.580 38.000 0.132 0.000 1.401 2061 I HN 0.000 nan 8.210 nan 0.000 0.491 2062 V N 6.428 126.350 119.914 0.013 0.000 2.487 2062 V HA 0.269 4.389 4.120 -0.000 0.000 0.298 2062 V C -0.102 176.015 176.094 0.038 0.000 1.028 2062 V CA -0.636 61.661 62.300 -0.006 0.000 0.860 2062 V CB 1.862 33.662 31.823 -0.038 0.000 0.991 2062 V HN 0.686 nan 8.190 nan 0.000 0.427 2063 E N 5.002 125.197 120.200 -0.008 0.000 2.113 2063 E HA 0.516 4.866 4.350 -0.000 0.000 0.273 2063 E C -1.280 175.241 176.600 -0.132 0.000 0.924 2063 E CA -0.489 55.904 56.400 -0.013 0.000 0.764 2063 E CB 1.223 30.880 29.700 -0.072 0.000 1.104 2063 E HN 0.611 nan 8.360 nan 0.000 0.406 2064 I N 6.269 126.810 120.570 -0.048 0.000 2.339 2064 I HA 0.247 4.417 4.170 -0.000 0.000 0.290 2064 I C -0.692 175.461 176.117 0.059 0.000 0.994 2064 I CA -0.889 60.378 61.300 -0.055 0.000 1.191 2064 I CB 0.471 38.477 38.000 0.010 0.000 1.343 2064 I HN 0.464 nan 8.210 nan 0.000 0.458 2065 Y N 4.629 124.931 120.300 0.003 0.000 2.662 2065 Y HA 1.005 5.555 4.550 -0.000 0.000 0.335 2065 Y C -0.142 175.757 175.900 -0.001 0.000 1.066 2065 Y CA -2.503 55.596 58.100 -0.003 0.000 1.116 2065 Y CB 1.085 39.533 38.460 -0.020 0.000 1.308 2065 Y HN 0.636 nan 8.280 nan 0.000 0.502 2066 G N -0.244 108.668 108.800 0.187 0.000 2.313 2066 G HA2 0.433 4.393 3.960 -0.000 0.000 0.296 2066 G HA3 0.433 4.393 3.960 -0.000 0.000 0.296 2066 G C -3.510 171.370 174.900 -0.034 0.000 1.356 2066 G CA -1.167 43.956 45.100 0.039 0.000 0.833 2066 G HN 0.562 nan 8.290 nan 0.000 0.552 2067 P HA 0.216 nan 4.420 nan 0.000 0.271 2067 P C 0.304 177.588 177.300 -0.026 0.000 1.233 2067 P CA -0.120 62.953 63.100 -0.045 0.000 0.789 2067 P CB 0.395 32.070 31.700 -0.042 0.000 0.951 2068 E N -0.146 120.036 120.200 -0.030 0.000 2.459 2068 E HA 0.026 4.376 4.350 -0.000 0.000 0.264 2068 E C -0.349 176.230 176.600 -0.034 0.000 1.055 2068 E CA -0.374 56.009 56.400 -0.029 0.000 0.957 2068 E CB -0.514 29.166 29.700 -0.034 0.000 0.952 2068 E HN 0.310 nan 8.360 nan 0.000 0.448 2069 S N 0.712 116.386 115.700 -0.043 0.000 3.550 2069 S HA -0.200 4.270 4.470 -0.000 0.000 0.372 2069 S C 0.674 175.245 174.600 -0.048 0.000 0.966 2069 S CA 0.823 58.987 58.200 -0.060 0.000 1.229 2069 S CB -1.923 61.239 63.200 -0.063 0.000 0.917 2069 S HN 0.748 nan 8.310 nan 0.000 0.496 2070 S N -0.322 115.359 115.700 -0.033 0.000 2.510 2070 S HA 0.542 5.012 4.470 -0.000 0.000 0.230 2070 S C 1.586 176.169 174.600 -0.028 0.000 1.066 2070 S CA 0.614 58.802 58.200 -0.021 0.000 0.941 2070 S CB 0.661 63.864 63.200 0.004 0.000 0.829 2070 S HN 1.750 nan 8.310 nan 0.000 0.530 2071 G N 1.909 110.700 108.800 -0.015 0.000 3.272 2071 G HA2 -0.113 3.847 3.960 -0.000 0.000 0.219 2071 G HA3 -0.113 3.847 3.960 -0.000 0.000 0.219 2071 G C 0.858 175.785 174.900 0.046 0.000 0.952 2071 G CA 0.178 45.277 45.100 -0.001 0.000 0.833 2071 G HN 0.489 nan 8.290 nan 0.000 0.608 2072 K N 0.052 120.481 120.400 0.048 0.000 2.113 2072 K HA -0.089 4.231 4.320 -0.000 0.000 0.208 2072 K C 1.932 178.577 176.600 0.075 0.000 1.047 2072 K CA 1.917 58.248 56.287 0.073 0.000 0.928 2072 K CB -0.523 32.023 32.500 0.077 0.000 0.716 2072 K HN 0.162 nan 8.250 nan 0.000 0.446 2073 T N 0.978 115.566 114.554 0.058 0.000 2.851 2073 T HA -0.057 4.293 4.350 -0.000 0.000 0.262 2073 T C 1.751 176.510 174.700 0.097 0.000 1.043 2073 T CA 1.706 63.850 62.100 0.075 0.000 1.140 2073 T CB -0.324 68.576 68.868 0.053 0.000 0.872 2073 T HN 0.398 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 1.862 176.657 174.700 0.159 0.000 1.041 2074 T CA 1.284 63.495 62.100 0.184 0.000 1.159 2074 T CB -0.585 68.400 68.868 0.195 0.000 0.863 2074 T HN 0.205 nan 8.240 nan 0.000 0.434 2075 L N 0.186 121.497 121.223 0.147 0.000 1.994 2075 L HA -0.165 4.175 4.340 -0.000 0.000 0.208 2075 L C 2.828 179.754 176.870 0.094 0.000 1.071 2075 L CA 1.590 56.511 54.840 0.135 0.000 0.745 2075 L CB -0.733 41.415 42.059 0.148 0.000 0.892 2075 L HN 0.261 nan 8.230 nan 0.000 0.431 2076 T N -0.146 114.464 114.554 0.094 0.000 2.653 2076 T HA -0.243 4.107 4.350 -0.000 0.000 0.268 2076 T C 1.703 176.457 174.700 0.090 0.000 1.035 2076 T CA 1.894 64.048 62.100 0.091 0.000 1.154 2076 T CB -0.204 68.732 68.868 0.113 0.000 0.862 2076 T HN 0.127 nan 8.240 nan 0.000 0.441 2077 L N 0.841 122.119 121.223 0.091 0.000 2.217 2077 L HA 0.050 4.390 4.340 -0.000 0.000 0.211 2077 L C 2.652 179.546 176.870 0.040 0.000 1.107 2077 L CA 1.297 56.171 54.840 0.056 0.000 0.783 2077 L CB -0.487 41.606 42.059 0.056 0.000 0.919 2077 L HN 0.193 nan 8.230 nan 0.000 0.442 2078 Q N -0.668 119.165 119.800 0.056 0.000 2.167 2078 Q HA -0.104 4.236 4.340 -0.000 0.000 0.202 2078 Q C 2.307 178.323 176.000 0.027 0.000 0.970 2078 Q CA 1.820 57.649 55.803 0.043 0.000 0.855 2078 Q CB -0.117 28.660 28.738 0.065 0.000 0.911 2078 Q HN 0.568 nan 8.270 nan 0.000 0.438 2079 V N -1.797 118.133 119.914 0.026 0.000 2.379 2079 V HA -0.160 3.960 4.120 -0.000 0.000 0.245 2079 V C 2.223 178.326 176.094 0.014 0.000 1.044 2079 V CA 1.136 63.444 62.300 0.013 0.000 1.036 2079 V CB -0.873 30.955 31.823 0.008 0.000 0.664 2079 V HN 0.144 nan 8.190 nan 0.000 0.453 2080 I N 1.195 121.779 120.570 0.023 0.000 2.423 2080 I HA -0.207 3.963 4.170 -0.000 0.000 0.254 2080 I C 2.773 178.893 176.117 0.005 0.000 1.151 2080 I CA 1.487 62.799 61.300 0.019 0.000 1.421 2080 I CB -0.541 37.476 38.000 0.028 0.000 1.079 2080 I HN 0.396 nan 8.210 nan 0.000 0.431 2081 A N 0.794 123.615 122.820 0.002 0.000 1.832 2081 A HA -0.040 4.280 4.320 -0.000 0.000 0.214 2081 A C 2.571 180.157 177.584 0.002 0.000 1.204 2081 A CA 1.378 53.413 52.037 -0.004 0.000 0.606 2081 A CB -1.044 17.953 19.000 -0.005 0.000 0.849 2081 A HN 0.357 nan 8.150 nan 0.000 0.445 2082 A N -0.260 122.566 122.820 0.009 0.000 2.032 2082 A HA 0.070 4.390 4.320 -0.000 0.000 0.221 2082 A C 2.370 179.957 177.584 0.006 0.000 1.165 2082 A CA 2.320 54.363 52.037 0.011 0.000 0.645 2082 A CB -0.863 18.144 19.000 0.012 0.000 0.807 2082 A HN 1.061 nan 8.150 nan 0.000 0.453 2083 A N -1.240 121.582 122.820 0.004 0.000 1.874 2083 A HA -0.120 4.200 4.320 -0.000 0.000 0.214 2083 A C 2.073 179.658 177.584 0.002 0.000 1.189 2083 A CA 1.356 53.394 52.037 0.002 0.000 0.615 2083 A CB -0.452 18.550 19.000 0.003 0.000 0.830 2083 A HN 0.583 nan 8.150 nan 0.000 0.443 2084 Q N -0.960 118.841 119.800 0.002 0.000 2.364 2084 Q HA -0.011 4.329 4.340 -0.000 0.000 0.207 2084 Q C 1.418 177.418 176.000 -0.001 0.000 0.970 2084 Q CA 0.663 56.466 55.803 0.000 0.000 0.888 2084 Q CB 0.002 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 -0.108 120.391 120.500 -0.001 0.000 2.426 2085 R HA 0.068 4.408 4.340 -0.000 0.000 0.263 2085 R C 0.448 176.748 176.300 -0.000 0.000 0.961 2085 R CA 0.129 56.227 56.100 -0.002 0.000 1.086 2085 R CB 0.479 30.777 30.300 -0.003 0.000 1.186 2085 R HN 0.170 nan 8.270 nan 0.000 0.537 2086 E N -1.530 118.671 120.200 0.001 0.000 2.641 2086 E HA 0.156 4.506 4.350 -0.000 0.000 0.224 2086 E C 0.692 177.292 176.600 0.001 0.000 0.951 2086 E CA 0.328 56.729 56.400 0.001 0.000 1.102 2086 E CB 1.457 31.158 29.700 0.001 0.000 1.091 2086 E HN 0.421 nan 8.360 nan 0.000 0.507 2087 G N 2.110 110.911 108.800 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 0.107 175.010 174.900 0.004 0.000 1.201 2087 G CA -0.306 44.795 45.100 0.002 0.000 0.739 2087 G HN 0.126 nan 8.290 nan 0.000 0.528 2088 K N 2.944 123.346 120.400 0.003 0.000 2.477 2088 K HA 0.288 4.608 4.320 -0.000 0.000 0.275 2088 K C 0.516 177.120 176.600 0.006 0.000 1.054 2088 K CA 1.185 57.474 56.287 0.004 0.000 1.135 2088 K CB 0.091 32.592 32.500 0.001 0.000 0.854 2088 K HN 0.600 nan 8.250 nan 0.000 0.484 2089 T N 0.146 114.705 114.554 0.009 0.000 2.902 2089 T HA 0.521 4.871 4.350 -0.000 0.000 0.283 2089 T C 0.291 175.001 174.700 0.017 0.000 1.009 2089 T CA -1.089 61.020 62.100 0.014 0.000 1.051 2089 T CB 0.725 69.603 68.868 0.016 0.000 0.999 2089 T HN 0.639 nan 8.240 nan 0.000 0.474 2090 C N 0.721 120.036 119.300 0.025 0.000 2.719 2090 C HA 1.012 5.472 4.460 -0.000 0.000 0.327 2090 C C 0.227 175.251 174.990 0.057 0.000 1.238 2090 C CA -1.180 57.859 59.018 0.034 0.000 1.727 2090 C CB 0.690 28.453 27.740 0.038 0.000 2.256 2090 C HN 1.252 nan 8.230 nan 0.000 0.489 2091 A N 0.623 123.483 122.820 0.068 0.000 2.414 2091 A HA 0.855 5.175 4.320 -0.000 0.000 0.306 2091 A C -1.459 176.218 177.584 0.155 0.000 1.054 2091 A CA -0.244 51.853 52.037 0.099 0.000 0.724 2091 A CB 1.166 20.199 19.000 0.055 0.000 1.267 2091 A HN 1.024 nan 8.150 nan 0.000 0.418 2092 F N 4.012 123.969 119.950 0.011 0.000 2.496 2092 F HA 0.570 5.097 4.527 -0.000 0.000 0.341 2092 F C -0.984 174.844 175.800 0.046 0.000 1.134 2092 F CA -0.978 57.031 58.000 0.015 0.000 0.968 2092 F CB 1.031 40.038 39.000 0.012 0.000 1.205 2092 F HN 0.388 nan 8.300 nan 0.000 0.436 2093 I N 4.536 124.907 120.570 -0.332 0.000 2.325 2093 I HA 0.255 4.425 4.170 -0.000 0.000 0.291 2093 I C -0.516 175.362 176.117 -0.398 0.000 1.019 2093 I CA -0.422 60.745 61.300 -0.222 0.000 1.302 2093 I CB 0.876 38.781 38.000 -0.159 0.000 1.401 2093 I HN 0.484 nan 8.210 nan 0.000 0.485 2094 D N 5.054 125.389 120.400 -0.108 0.000 2.414 2094 D HA 0.590 5.230 4.640 -0.000 0.000 0.232 2094 D C 0.450 176.774 176.300 0.039 0.000 1.070 2094 D CA -0.316 53.674 54.000 -0.016 0.000 0.839 2094 D CB 1.874 42.939 40.800 0.442 0.000 1.079 2094 D HN 0.630 nan 8.370 nan 0.000 0.521 2095 A N 3.739 126.511 122.820 -0.079 0.000 2.303 2095 A HA 0.100 4.420 4.320 -0.000 0.000 0.217 2095 A C 1.545 178.849 177.584 -0.467 0.000 1.205 2095 A CA 0.113 52.079 52.037 -0.119 0.000 0.875 2095 A CB 0.222 19.275 19.000 0.089 0.000 0.910 2095 A HN 0.474 nan 8.150 nan 0.000 0.501 2096 E N -0.223 119.775 120.200 -0.338 0.000 2.166 2096 E HA 0.023 4.373 4.350 -0.000 0.000 0.192 2096 E C -0.620 175.887 176.600 -0.156 0.000 0.967 2096 E CA 0.487 56.754 56.400 -0.222 0.000 0.840 2096 E CB -0.245 29.438 29.700 -0.028 0.000 0.795 2096 E HN 0.803 nan 8.360 nan 0.000 0.470 2097 H N -0.624 118.583 119.070 0.229 0.000 2.765 2097 H HA -0.178 4.378 4.556 -0.000 0.000 0.332 2097 H C 0.432 175.961 175.328 0.335 0.000 1.180 2097 H CA -0.068 56.180 56.048 0.334 0.000 1.142 2097 H CB -1.336 28.510 29.762 0.140 0.000 1.576 2097 H HN 0.279 nan 8.280 nan 0.000 0.420 2098 A N 1.426 124.488 122.820 0.403 0.000 2.084 2098 A HA 0.432 4.752 4.320 -0.000 0.000 0.211 2098 A C 0.851 178.508 177.584 0.121 0.000 2.280 2098 A CA 0.096 52.264 52.037 0.218 0.000 1.128 2098 A CB 0.033 19.110 19.000 0.129 0.000 1.248 2098 A HN 0.706 nan 8.150 nan 0.000 0.624 2099 L N 1.460 122.661 121.223 -0.037 0.000 4.639 2099 L HA -0.166 4.174 4.340 -0.000 0.000 0.580 2099 L C -0.943 175.789 176.870 -0.230 0.000 0.983 2099 L CA 0.695 55.356 54.840 -0.299 0.000 0.510 2099 L CB -0.976 40.595 42.059 -0.812 0.000 0.381 2099 L HN 0.518 nan 8.230 nan 0.000 1.152 2100 D N 8.251 128.578 120.400 -0.121 0.000 2.380 2100 D HA 0.294 4.934 4.640 -0.000 0.000 0.230 2100 D C -1.476 174.802 176.300 -0.037 0.000 1.154 2100 D CA -1.858 52.121 54.000 -0.035 0.000 0.859 2100 D CB 1.201 42.006 40.800 0.008 0.000 1.045 2100 D HN 0.432 nan 8.370 nan 0.000 0.495 2101 P HA -0.205 nan 4.420 nan 0.000 0.214 2101 P C 1.827 179.124 177.300 -0.004 0.000 1.163 2101 P CA 0.740 63.809 63.100 -0.052 0.000 0.889 2101 P CB 0.434 32.139 31.700 0.009 0.000 0.790 2102 I N -1.434 119.157 120.570 0.035 0.000 2.163 2102 I HA -0.255 3.915 4.170 -0.000 0.000 0.243 2102 I C 2.682 178.834 176.117 0.058 0.000 1.085 2102 I CA 1.592 62.919 61.300 0.045 0.000 1.347 2102 I CB -1.785 36.252 38.000 0.060 0.000 1.044 2102 I HN -0.062 nan 8.210 nan 0.000 0.408 2103 Y N 1.862 122.142 120.300 -0.034 0.000 2.181 2103 Y HA -0.214 4.336 4.550 -0.000 0.000 0.288 2103 Y C 2.634 178.508 175.900 -0.044 0.000 1.146 2103 Y CA 1.911 59.990 58.100 -0.035 0.000 1.164 2103 Y CB -0.222 38.210 38.460 -0.046 0.000 0.982 2103 Y HN 0.128 nan 8.280 nan 0.000 0.515 2104 A N 0.277 123.110 122.820 0.022 0.000 1.902 2104 A HA -0.202 4.118 4.320 -0.000 0.000 0.217 2104 A C 2.333 179.856 177.584 -0.101 0.000 1.181 2104 A CA 1.757 53.755 52.037 -0.064 0.000 0.623 2104 A CB -0.767 18.179 19.000 -0.089 0.000 0.818 2104 A HN 0.508 nan 8.150 nan 0.000 0.443 2105 R N -0.262 120.194 120.500 -0.073 0.000 2.091 2105 R HA -0.139 4.201 4.340 -0.000 0.000 0.238 2105 R C 1.957 178.208 176.300 -0.082 0.000 1.136 2105 R CA 1.944 58.007 56.100 -0.061 0.000 0.959 2105 R CB -0.186 30.095 30.300 -0.033 0.000 0.856 2105 R HN 0.506 nan 8.270 nan 0.000 0.437 2106 K N -0.058 120.271 120.400 -0.118 0.000 2.366 2106 K HA -0.010 4.310 4.320 -0.000 0.000 0.198 2106 K C 1.845 178.332 176.600 -0.188 0.000 1.044 2106 K CA 0.457 56.663 56.287 -0.135 0.000 0.973 2106 K CB 0.172 32.593 32.500 -0.130 0.000 0.767 2106 K HN 0.213 nan 8.250 nan 0.000 0.475 2107 L N -0.526 120.545 121.223 -0.252 0.000 2.240 2107 L HA -0.010 4.330 4.340 -0.000 0.000 0.211 2107 L C 0.971 177.780 176.870 -0.102 0.000 1.106 2107 L CA 0.876 55.585 54.840 -0.218 0.000 0.793 2107 L CB 0.198 42.106 42.059 -0.252 0.000 0.927 2107 L HN 0.483 nan 8.230 nan 0.000 0.446 2108 G N -0.356 108.392 108.800 -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 -0.269 174.606 174.900 -0.042 0.000 1.032 2108 G CA -0.357 44.712 45.100 -0.051 0.000 0.697 2108 G HN -0.002 nan 8.290 nan 0.000 0.495 2109 V N 1.005 120.887 119.914 -0.053 0.000 2.407 2109 V HA 0.440 4.560 4.120 -0.000 0.000 0.278 2109 V C 0.234 176.303 176.094 -0.042 0.000 1.037 2109 V CA -0.737 61.533 62.300 -0.049 0.000 0.900 2109 V CB 1.803 33.584 31.823 -0.070 0.000 0.983 2109 V HN 0.285 nan 8.190 nan 0.000 0.459 2110 D N 4.424 124.806 120.400 -0.030 0.000 2.455 2110 D HA 0.118 4.758 4.640 -0.000 0.000 0.234 2110 D C 1.089 177.374 176.300 -0.025 0.000 1.224 2110 D CA -0.158 53.829 54.000 -0.022 0.000 0.999 2110 D CB 0.532 41.325 40.800 -0.012 0.000 1.072 2110 D HN 0.299 nan 8.370 nan 0.000 0.514 2111 I N 2.543 123.093 120.570 -0.033 0.000 2.208 2111 I HA -0.261 3.909 4.170 -0.000 0.000 0.245 2111 I C 1.366 177.477 176.117 -0.011 0.000 1.097 2111 I CA 1.115 62.391 61.300 -0.039 0.000 1.363 2111 I CB -0.616 37.358 38.000 -0.043 0.000 1.051 2111 I HN 0.325 nan 8.210 nan 0.000 0.413 2112 D N 0.936 121.337 120.400 0.001 0.000 2.133 2112 D HA -0.187 4.453 4.640 -0.000 0.000 0.195 2112 D C 1.300 177.611 176.300 0.018 0.000 0.997 2112 D CA 1.145 55.154 54.000 0.014 0.000 0.840 2112 D CB -0.259 40.549 40.800 0.013 0.000 0.947 2112 D HN 0.304 nan 8.370 nan 0.000 0.452 2113 N N 0.120 118.827 118.700 0.011 0.000 2.251 2113 N HA 0.077 4.817 4.740 -0.000 0.000 0.217 2113 N C -0.142 175.380 175.510 0.019 0.000 1.124 2113 N CA -0.102 52.958 53.050 0.016 0.000 0.843 2113 N CB 0.600 39.094 38.487 0.012 0.000 1.024 2113 N HN 0.211 nan 8.380 nan 0.000 0.501 2114 L N 1.150 122.382 121.223 0.016 0.000 2.379 2114 L HA 0.431 4.771 4.340 -0.000 0.000 0.269 2114 L C -0.519 176.383 176.870 0.053 0.000 1.084 2114 L CA -0.348 54.505 54.840 0.022 0.000 0.802 2114 L CB 1.104 43.153 42.059 -0.017 0.000 1.175 2114 L HN -0.077 nan 8.230 nan 0.000 0.448 2115 L N 4.498 125.769 121.223 0.080 0.000 2.282 2115 L HA 0.363 4.703 4.340 -0.000 0.000 0.288 2115 L C -0.267 176.707 176.870 0.174 0.000 1.033 2115 L CA -0.402 54.502 54.840 0.107 0.000 0.807 2115 L CB 1.600 43.713 42.059 0.089 0.000 1.209 2115 L HN 0.632 nan 8.230 nan 0.000 0.423 2116 C N 2.331 121.748 119.300 0.194 0.000 2.507 2116 C HA 0.769 5.229 4.460 -0.000 0.000 0.319 2116 C C -0.032 175.094 174.990 0.227 0.000 1.208 2116 C CA -0.184 59.012 59.018 0.297 0.000 1.619 2116 C CB 1.523 29.485 27.740 0.369 0.000 2.230 2116 C HN 0.824 nan 8.230 nan 0.000 0.492 2117 S N 4.165 120.003 115.700 0.230 0.000 2.779 2117 S HA 0.372 4.842 4.470 -0.000 0.000 0.293 2117 S C -1.015 173.681 174.600 0.161 0.000 1.150 2117 S CA -0.315 57.972 58.200 0.146 0.000 1.057 2117 S CB 1.225 64.469 63.200 0.074 0.000 1.021 2117 S HN 0.840 nan 8.310 nan 0.000 0.485 2118 Q N 3.109 123.010 119.800 0.168 0.000 2.569 2118 Q HA 0.284 4.624 4.340 -0.000 0.000 0.226 2118 Q C -2.489 173.626 176.000 0.191 0.000 1.136 2118 Q CA -1.798 54.136 55.803 0.218 0.000 0.947 2118 Q CB 0.567 29.406 28.738 0.168 0.000 1.218 2118 Q HN 0.330 nan 8.270 nan 0.000 0.547 2119 P HA 0.027 nan 4.420 nan 0.000 0.276 2119 P C 0.122 177.541 177.300 0.199 0.000 1.252 2119 P CA -0.374 62.788 63.100 0.104 0.000 0.802 2119 P CB 1.153 32.858 31.700 0.009 0.000 1.035 2120 D N -1.053 119.405 120.400 0.095 0.000 2.201 2120 D HA -0.032 4.608 4.640 -0.000 0.000 0.209 2120 D C 0.032 176.206 176.300 -0.211 0.000 0.961 2120 D CA 1.311 55.374 54.000 0.105 0.000 0.861 2120 D CB 0.582 41.458 40.800 0.125 0.000 0.997 2120 D HN 0.312 nan 8.370 nan 0.000 0.486 2121 T N -1.805 112.606 114.554 -0.239 0.000 2.900 2121 T HA 0.468 4.818 4.350 -0.000 0.000 0.295 2121 T C 1.126 175.652 174.700 -0.290 0.000 1.044 2121 T CA -0.094 61.783 62.100 -0.371 0.000 0.995 2121 T CB 1.598 70.332 68.868 -0.224 0.000 1.072 2121 T HN -0.008 nan 8.240 nan 0.000 0.473 2122 G N 2.566 111.174 108.800 -0.320 0.000 2.553 2122 G HA2 -0.245 3.715 3.960 -0.000 0.000 0.218 2122 G HA3 -0.245 3.715 3.960 -0.000 0.000 0.218 2122 G C 1.049 175.880 174.900 -0.115 0.000 1.195 2122 G CA 1.710 46.708 45.100 -0.171 0.000 0.779 2122 G HN 0.844 nan 8.290 nan 0.000 0.577 2123 E N -0.148 119.986 120.200 -0.110 0.000 2.045 2123 E HA -0.279 4.071 4.350 -0.000 0.000 0.212 2123 E C 2.477 179.024 176.600 -0.089 0.000 1.039 2123 E CA 1.886 58.245 56.400 -0.068 0.000 0.860 2123 E CB -0.418 29.253 29.700 -0.048 0.000 0.776 2123 E HN 0.652 nan 8.360 nan 0.000 0.467 2124 Q N 0.247 119.969 119.800 -0.130 0.000 2.118 2124 Q HA -0.330 4.010 4.340 -0.000 0.000 0.211 2124 Q C 2.126 177.950 176.000 -0.294 0.000 0.998 2124 Q CA 2.096 57.746 55.803 -0.256 0.000 0.872 2124 Q CB -0.315 28.273 28.738 -0.249 0.000 0.925 2124 Q HN 0.319 nan 8.270 nan 0.000 0.414 2125 A N 0.828 123.539 122.820 -0.181 0.000 1.869 2125 A HA -0.242 4.078 4.320 -0.000 0.000 0.218 2125 A C 2.123 179.649 177.584 -0.096 0.000 1.203 2125 A CA 1.952 53.914 52.037 -0.124 0.000 0.638 2125 A CB -1.091 17.874 19.000 -0.058 0.000 0.831 2125 A HN 0.493 nan 8.150 nan 0.000 0.450 2126 L N -0.779 120.418 121.223 -0.044 0.000 1.990 2126 L HA -0.258 4.082 4.340 -0.000 0.000 0.213 2126 L C 2.603 179.465 176.870 -0.013 0.000 1.072 2126 L CA 1.989 56.836 54.840 0.011 0.000 0.755 2126 L CB -0.775 41.311 42.059 0.046 0.000 0.889 2126 L HN 0.484 nan 8.230 nan 0.000 0.432 2127 E N 0.027 120.203 120.200 -0.040 0.000 2.267 2127 E HA -0.221 4.129 4.350 -0.000 0.000 0.197 2127 E C 2.194 178.797 176.600 0.004 0.000 0.998 2127 E CA 1.087 57.496 56.400 0.015 0.000 0.830 2127 E CB -0.168 29.576 29.700 0.074 0.000 0.751 2127 E HN 0.553 nan 8.360 nan 0.000 0.491 2128 I N 0.466 120.947 120.570 -0.148 0.000 2.233 2128 I HA -0.281 3.889 4.170 -0.000 0.000 0.243 2128 I C 2.423 178.536 176.117 -0.007 0.000 1.093 2128 I CA 0.601 61.838 61.300 -0.104 0.000 1.380 2128 I CB -0.318 37.567 38.000 -0.191 0.000 1.067 2128 I HN 0.215 nan 8.210 nan 0.000 0.413 2129 C N 0.343 119.628 119.300 -0.026 0.000 2.401 2129 C HA -0.223 4.237 4.460 -0.000 0.000 0.276 2129 C C 2.496 177.491 174.990 0.008 0.000 1.233 2129 C CA 0.479 59.485 59.018 -0.020 0.000 1.753 2129 C CB -1.106 26.609 27.740 -0.042 0.000 2.029 2129 C HN 0.539 nan 8.230 nan 0.000 0.478 2130 D N 0.836 121.254 120.400 0.030 0.000 2.177 2130 D HA -0.199 4.441 4.640 -0.000 0.000 0.189 2130 D C 2.249 178.579 176.300 0.050 0.000 1.002 2130 D CA 2.427 56.455 54.000 0.046 0.000 0.845 2130 D CB -0.344 40.501 40.800 0.074 0.000 0.960 2130 D HN 0.517 nan 8.370 nan 0.000 0.447 2131 A N -0.125 122.743 122.820 0.079 0.000 2.119 2131 A HA 0.018 4.338 4.320 -0.000 0.000 0.216 2131 A C 2.416 180.033 177.584 0.055 0.000 1.152 2131 A CA 0.282 52.363 52.037 0.074 0.000 0.708 2131 A CB -0.346 18.720 19.000 0.109 0.000 0.805 2131 A HN 0.252 nan 8.150 nan 0.000 0.460 2132 L N -1.116 120.134 121.223 0.045 0.000 2.217 2132 L HA -0.088 4.252 4.340 -0.000 0.000 0.211 2132 L C 2.929 179.807 176.870 0.013 0.000 1.107 2132 L CA 0.751 55.608 54.840 0.028 0.000 0.783 2132 L CB -0.302 41.767 42.059 0.017 0.000 0.919 2132 L HN 0.434 nan 8.230 nan 0.000 0.442 2133 A N 0.194 123.020 122.820 0.008 0.000 1.854 2133 A HA -0.097 4.223 4.320 -0.000 0.000 0.214 2133 A C 1.564 179.152 177.584 0.006 0.000 1.192 2133 A CA 0.733 52.770 52.037 -0.000 0.000 0.611 2133 A CB -0.314 18.683 19.000 -0.005 0.000 0.832 2133 A HN 0.277 nan 8.150 nan 0.000 0.442 2134 R N 0.820 121.328 120.500 0.014 0.000 3.641 2134 R HA 0.139 4.479 4.340 -0.000 0.000 0.189 2134 R C 0.530 176.840 176.300 0.016 0.000 1.706 2134 R CA 0.519 56.627 56.100 0.014 0.000 1.311 2134 R CB -0.217 30.093 30.300 0.017 0.000 1.330 2134 R HN 0.699 nan 8.270 nan 0.000 0.727 2135 S N -1.937 113.771 115.700 0.013 0.000 3.050 2135 S HA 0.127 4.597 4.470 -0.000 0.000 0.261 2135 S C 1.396 176.002 174.600 0.009 0.000 1.057 2135 S CA 0.239 58.447 58.200 0.014 0.000 1.012 2135 S CB 0.541 63.752 63.200 0.019 0.000 0.919 2135 S HN 0.491 nan 8.310 nan 0.000 0.429 2136 G N 1.694 110.498 108.800 0.006 0.000 2.184 2136 G HA2 -0.167 3.793 3.960 -0.000 0.000 0.264 2136 G HA3 -0.167 3.793 3.960 -0.000 0.000 0.264 2136 G C 0.845 175.747 174.900 0.004 0.000 0.975 2136 G CA 0.533 45.635 45.100 0.003 0.000 0.642 2136 G HN 1.622 nan 8.290 nan 0.000 0.536 2137 A N -0.891 121.933 122.820 0.008 0.000 2.288 2137 A HA 0.676 4.996 4.320 -0.000 0.000 0.216 2137 A C 0.884 178.475 177.584 0.011 0.000 1.199 2137 A CA 1.057 53.099 52.037 0.010 0.000 0.891 2137 A CB 0.649 19.656 19.000 0.013 0.000 0.923 2137 A HN 0.991 nan 8.150 nan 0.000 0.500 2138 V N 1.654 121.574 119.914 0.010 0.000 2.364 2138 V HA 0.209 4.329 4.120 -0.000 0.000 0.272 2138 V C -0.062 176.032 176.094 -0.000 0.000 1.036 2138 V CA -0.323 61.982 62.300 0.008 0.000 0.880 2138 V CB 1.158 32.986 31.823 0.009 0.000 0.991 2138 V HN 0.373 nan 8.190 nan 0.000 0.460 2139 D N 2.666 123.066 120.400 -0.000 0.000 2.389 2139 D HA 0.129 4.769 4.640 -0.000 0.000 0.206 2139 D C 0.191 176.483 176.300 -0.012 0.000 1.055 2139 D CA 0.835 54.831 54.000 -0.006 0.000 0.856 2139 D CB 1.910 42.709 40.800 -0.003 0.000 0.957 2139 D HN 0.417 nan 8.370 nan 0.000 0.509 2140 V N 1.253 121.160 119.914 -0.011 0.000 2.653 2140 V HA 0.345 4.465 4.120 -0.000 0.000 0.298 2140 V C -1.729 174.354 176.094 -0.019 0.000 1.097 2140 V CA -0.702 61.587 62.300 -0.019 0.000 0.908 2140 V CB 1.669 33.487 31.823 -0.008 0.000 1.024 2140 V HN -0.136 nan 8.190 nan 0.000 0.435 2141 I N 6.526 127.063 120.570 -0.055 0.000 2.412 2141 I HA 0.630 4.800 4.170 -0.000 0.000 0.296 2141 I C -0.567 175.482 176.117 -0.114 0.000 0.987 2141 I CA -1.011 60.243 61.300 -0.076 0.000 1.180 2141 I CB 2.060 39.989 38.000 -0.119 0.000 1.340 2141 I HN 0.380 nan 8.210 nan 0.000 0.455 2142 V N 6.700 126.562 119.914 -0.088 0.000 2.540 2142 V HA 0.411 4.531 4.120 -0.000 0.000 0.302 2142 V C -0.370 175.564 176.094 -0.268 0.000 1.035 2142 V CA -0.613 61.614 62.300 -0.122 0.000 0.873 2142 V CB 2.420 34.270 31.823 0.044 0.000 0.992 2142 V HN 0.418 nan 8.190 nan 0.000 0.428 2143 V N 3.064 122.825 119.914 -0.255 0.000 2.350 2143 V HA 0.514 4.634 4.120 -0.000 0.000 0.285 2143 V C -0.740 175.280 176.094 -0.124 0.000 1.014 2143 V CA -0.546 61.628 62.300 -0.211 0.000 0.831 2143 V CB 1.622 33.394 31.823 -0.086 0.000 1.000 2143 V HN 0.805 nan 8.190 nan 0.000 0.433 2144 D N 3.636 123.885 120.400 -0.252 0.000 2.461 2144 D HA 0.614 5.253 4.640 -0.000 0.000 0.240 2144 D C -0.316 175.929 176.300 -0.093 0.000 1.094 2144 D CA 0.271 54.186 54.000 -0.142 0.000 0.868 2144 D CB 1.778 42.470 40.800 -0.179 0.000 1.062 2144 D HN 0.767 nan 8.370 nan 0.000 0.530 2145 S N 1.008 116.696 115.700 -0.020 0.000 2.607 2145 S HA 0.312 4.782 4.470 -0.000 0.000 0.273 2145 S C 1.046 175.668 174.600 0.037 0.000 1.148 2145 S CA -0.665 57.550 58.200 0.025 0.000 0.833 2145 S CB 1.268 64.480 63.200 0.019 0.000 1.130 2145 S HN -0.015 nan 8.310 nan 0.000 0.470 2146 V N 1.829 121.769 119.914 0.044 0.000 2.233 2146 V HA -0.280 3.840 4.120 -0.000 0.000 0.252 2146 V C 3.116 179.189 176.094 -0.036 0.000 1.063 2146 V CA 3.001 65.280 62.300 -0.036 0.000 1.032 2146 V CB -1.697 30.060 31.823 -0.109 0.000 0.645 2146 V HN 1.076 nan 8.190 nan 0.000 0.446 2147 A N -0.435 122.371 122.820 -0.022 0.000 1.940 2147 A HA -0.103 4.217 4.320 -0.000 0.000 0.219 2147 A C 2.273 179.857 177.584 0.000 0.000 1.176 2147 A CA 2.174 54.198 52.037 -0.020 0.000 0.631 2147 A CB -0.677 18.311 19.000 -0.019 0.000 0.814 2147 A HN 0.688 nan 8.150 nan 0.000 0.446 2148 A N -1.150 121.680 122.820 0.017 0.000 2.169 2148 A HA 0.289 4.609 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 52.343 52.037 0.060 0.000 0.756 2148 A CB -0.202 18.809 19.000 0.019 0.000 0.813 2148 A HN 0.301 nan 8.150 nan 0.000 0.471 2149 L N 2.786 124.044 121.223 0.059 0.000 3.168 2149 L HA 0.030 4.370 4.340 -0.000 0.000 0.253 2149 L C 0.634 177.477 176.870 -0.045 0.000 1.384 2149 L CA 0.723 55.573 54.840 0.016 0.000 1.131 2149 L CB -2.282 39.772 42.059 -0.008 0.000 1.552 2149 L HN 0.410 nan 8.230 nan 0.000 0.431 2150 T N -0.031 114.511 114.554 -0.019 0.000 2.834 2150 T HA 0.275 4.625 4.350 -0.000 0.000 0.298 2150 T C -2.054 172.526 174.700 -0.200 0.000 0.966 2150 T CA -1.373 60.687 62.100 -0.066 0.000 1.141 2150 T CB 0.652 69.537 68.868 0.030 0.000 0.905 2150 T HN 0.184 nan 8.240 nan 0.000 0.535 2151 P HA 0.133 nan 4.420 nan 0.000 0.274 2151 P C 0.833 178.026 177.300 -0.177 0.000 1.260 2151 P CA -0.641 62.367 63.100 -0.154 0.000 0.793 2151 P CB 1.042 32.685 31.700 -0.096 0.000 1.048 2152 K N 0.636 120.948 120.400 -0.145 0.000 2.057 2152 K HA -0.132 4.188 4.320 -0.000 0.000 0.206 2152 K C 1.990 178.532 176.600 -0.097 0.000 1.050 2152 K CA 1.597 57.807 56.287 -0.127 0.000 0.935 2152 K CB -0.753 31.704 32.500 -0.072 0.000 0.715 2152 K HN 0.454 nan 8.250 nan 0.000 0.439 2153 A N 1.334 124.111 122.820 -0.073 0.000 1.927 2153 A HA -0.251 4.069 4.320 -0.000 0.000 0.220 2153 A C 1.969 179.515 177.584 -0.063 0.000 1.185 2153 A CA 2.078 54.082 52.037 -0.055 0.000 0.639 2153 A CB -0.503 18.470 19.000 -0.046 0.000 0.820 2153 A HN 0.535 nan 8.150 nan 0.000 0.451 2154 E N -0.796 119.356 120.200 -0.079 0.000 2.230 2154 E HA 0.020 4.370 4.350 -0.000 0.000 0.192 2154 E C 1.642 178.185 176.600 -0.095 0.000 0.987 2154 E CA 0.342 56.698 56.400 -0.074 0.000 0.841 2154 E CB -0.110 29.551 29.700 -0.065 0.000 0.783 2154 E HN 0.675 nan 8.360 nan 0.000 0.481 2155 I N 0.956 121.439 120.570 -0.145 0.000 2.916 2155 I HA -0.160 4.010 4.170 -0.000 0.000 0.267 2155 I C 0.147 176.157 176.117 -0.177 0.000 1.263 2155 I CA 0.888 62.058 61.300 -0.216 0.000 1.471 2155 I CB -0.011 37.785 38.000 -0.339 0.000 1.089 2155 I HN 0.080 nan 8.210 nan 0.000 0.468 2166 L N -0.290 120.907 121.223 -0.043 0.000 2.253 2166 L HA 0.657 4.997 4.340 -0.000 0.000 0.205 2166 L C 2.156 178.999 176.870 -0.044 0.000 1.078 2166 L CA 1.100 55.912 54.840 -0.047 0.000 0.805 2166 L CB -0.290 41.737 42.059 -0.054 0.000 0.963 2166 L HN 0.318 nan 8.230 nan 0.000 0.459 2167 A N 0.987 123.780 122.820 -0.044 0.000 2.900 2167 A HA 0.535 4.855 4.320 -0.000 0.000 0.246 2167 A C 1.736 179.293 177.584 -0.046 0.000 1.725 2167 A CA 0.496 52.507 52.037 -0.043 0.000 1.400 2167 A CB -0.837 18.136 19.000 -0.046 0.000 0.973 2167 A HN 0.473 nan 8.150 nan 0.000 0.635 2168 A N 0.089 122.882 122.820 -0.045 0.000 2.235 2168 A HA 0.005 4.325 4.320 -0.000 0.000 0.208 2168 A C 2.031 179.591 177.584 -0.041 0.000 1.172 2168 A CA 0.638 52.646 52.037 -0.049 0.000 0.786 2168 A CB -0.276 18.696 19.000 -0.047 0.000 0.804 2168 A HN 0.690 nan 8.150 nan 0.000 0.479 2169 R N -0.875 119.605 120.500 -0.033 0.000 2.092 2169 R HA -0.065 4.275 4.340 -0.000 0.000 0.231 2169 R C 2.209 178.499 176.300 -0.017 0.000 1.119 2169 R CA 1.498 57.585 56.100 -0.021 0.000 0.970 2169 R CB -0.447 29.841 30.300 -0.021 0.000 0.864 2169 R HN 0.654 nan 8.270 nan 0.000 0.440 2170 M N 0.143 119.727 119.600 -0.027 0.000 2.080 2170 M HA -0.232 4.248 4.480 -0.000 0.000 0.260 2170 M C 1.921 178.207 176.300 -0.022 0.000 1.068 2170 M CA 1.687 56.972 55.300 -0.026 0.000 1.109 2170 M CB -0.015 32.559 32.600 -0.042 0.000 1.342 2170 M HN 0.175 nan 8.290 nan 0.000 0.405 2171 M N 0.191 119.764 119.600 -0.044 0.000 2.149 2171 M HA -0.164 4.316 4.480 -0.000 0.000 0.261 2171 M C 2.130 178.421 176.300 -0.015 0.000 1.064 2171 M CA 1.716 56.979 55.300 -0.062 0.000 1.102 2171 M CB -1.100 31.429 32.600 -0.118 0.000 1.369 2171 M HN 0.342 nan 8.290 nan 0.000 0.408 2172 S N -0.262 115.438 115.700 0.000 0.000 2.428 2172 S HA -0.133 4.337 4.470 -0.000 0.000 0.230 2172 S C 1.558 176.196 174.600 0.063 0.000 1.014 2172 S CA 0.744 58.965 58.200 0.035 0.000 0.957 2172 S CB -0.093 63.120 63.200 0.021 0.000 0.784 2172 S HN 0.413 nan 8.310 nan 0.000 0.499 2173 Q N 2.121 121.946 119.800 0.042 0.000 1.596 2173 Q HA 0.161 4.501 4.340 -0.000 0.000 0.476 2173 Q C 1.997 178.035 176.000 0.063 0.000 0.959 2173 Q CA 1.608 57.439 55.803 0.047 0.000 0.901 2173 Q CB -0.772 27.983 28.738 0.028 0.000 0.932 2173 Q HN 0.406 nan 8.270 nan 0.000 0.389 2174 A N -0.025 122.828 122.820 0.056 0.000 2.277 2174 A HA -0.108 4.212 4.320 -0.000 0.000 0.208 2174 A C 1.698 179.328 177.584 0.077 0.000 1.202 2174 A CA 1.141 53.214 52.037 0.060 0.000 0.762 2174 A CB -0.805 18.228 19.000 0.055 0.000 0.770 2174 A HN 0.605 nan 8.150 nan 0.000 0.487 2175 M N 0.299 119.960 119.600 0.103 0.000 2.066 2175 M HA -0.144 4.336 4.480 -0.000 0.000 0.259 2175 M C 2.108 178.460 176.300 0.087 0.000 1.074 2175 M CA 2.182 57.571 55.300 0.147 0.000 1.114 2175 M CB -0.471 32.257 32.600 0.213 0.000 1.306 2175 M HN 0.440 nan 8.290 nan 0.000 0.411 2176 R N 0.117 120.672 120.500 0.092 0.000 2.096 2176 R HA -0.172 4.168 4.340 -0.000 0.000 0.235 2176 R C 2.275 178.509 176.300 -0.110 0.000 1.127 2176 R CA 1.667 57.718 56.100 -0.082 0.000 0.968 2176 R CB -0.494 29.862 30.300 0.093 0.000 0.861 2176 R HN 0.501 nan 8.270 nan 0.000 0.440 2177 K N 0.579 120.965 120.400 -0.024 0.000 2.097 2177 K HA -0.118 4.202 4.320 -0.000 0.000 0.205 2177 K C 2.204 178.788 176.600 -0.026 0.000 1.050 2177 K CA 0.901 57.177 56.287 -0.019 0.000 0.938 2177 K CB -0.122 32.385 32.500 0.011 0.000 0.718 2177 K HN 0.212 nan 8.250 nan 0.000 0.442 2178 L N 0.613 121.829 121.223 -0.012 0.000 2.141 2178 L HA -0.105 4.235 4.340 -0.000 0.000 0.209 2178 L C 2.267 179.114 176.870 -0.038 0.000 1.094 2178 L CA 1.175 56.013 54.840 -0.005 0.000 0.763 2178 L CB -0.269 41.811 42.059 0.036 0.000 0.908 2178 L HN 0.167 nan 8.230 nan 0.000 0.437 2179 A N -0.070 122.694 122.820 -0.093 0.000 1.884 2179 A HA -0.237 4.083 4.320 -0.000 0.000 0.219 2179 A C 2.288 179.808 177.584 -0.106 0.000 1.197 2179 A CA 2.062 54.008 52.037 -0.152 0.000 0.637 2179 A CB -1.575 17.189 19.000 -0.394 0.000 0.827 2179 A HN 0.510 nan 8.150 nan 0.000 0.450 2180 G N -0.540 108.201 108.800 -0.100 0.000 2.404 2180 G HA2 -0.252 3.708 3.960 -0.000 0.000 0.215 2180 G HA3 -0.252 3.708 3.960 -0.000 0.000 0.215 2180 G C 1.329 176.207 174.900 -0.038 0.000 1.174 2180 G CA 0.921 45.983 45.100 -0.062 0.000 0.780 2180 G HN 0.721 nan 8.290 nan 0.000 0.537 2181 N N 0.198 118.880 118.700 -0.030 0.000 2.417 2181 N HA -0.064 4.676 4.740 -0.000 0.000 0.187 2181 N C 1.940 177.440 175.510 -0.017 0.000 1.027 2181 N CA 0.391 53.431 53.050 -0.017 0.000 0.891 2181 N CB -0.126 38.356 38.487 -0.008 0.000 0.956 2181 N HN 0.320 nan 8.380 nan 0.000 0.442 2182 L N 0.153 121.362 121.223 -0.024 0.000 2.249 2182 L HA 0.030 4.370 4.340 -0.000 0.000 0.207 2182 L C 2.009 178.867 176.870 -0.019 0.000 1.090 2182 L CA 0.672 55.497 54.840 -0.024 0.000 0.802 2182 L CB -0.125 41.916 42.059 -0.031 0.000 0.947 2182 L HN -0.040 nan 8.230 nan 0.000 0.453 2183 K N 0.400 120.789 120.400 -0.019 0.000 2.209 2183 K HA -0.148 4.172 4.320 -0.000 0.000 0.204 2183 K C 1.509 178.103 176.600 -0.009 0.000 1.048 2183 K CA 1.100 57.379 56.287 -0.013 0.000 0.940 2183 K CB 0.020 32.513 32.500 -0.012 0.000 0.729 2183 K HN 0.313 nan 8.250 nan 0.000 0.451 2184 Q N -0.748 119.046 119.800 -0.010 0.000 2.228 2184 Q HA 0.147 4.487 4.340 -0.000 0.000 0.211 2184 Q C 0.182 176.179 176.000 -0.005 0.000 0.890 2184 Q CA 0.053 55.852 55.803 -0.006 0.000 0.953 2184 Q CB 0.866 29.601 28.738 -0.006 0.000 1.053 2184 Q HN 0.088 nan 8.270 nan 0.000 0.471 2185 S N -0.848 114.848 115.700 -0.007 0.000 2.560 2185 S HA 0.060 4.530 4.470 -0.000 0.000 0.281 2185 S C 0.332 174.928 174.600 -0.007 0.000 1.075 2185 S CA -0.356 57.841 58.200 -0.006 0.000 1.295 2185 S CB 0.526 63.722 63.200 -0.007 0.000 1.156 2185 S HN 0.303 nan 8.310 nan 0.000 0.627 2186 N N 1.554 120.248 118.700 -0.009 0.000 2.857 2186 N HA -0.130 4.610 4.740 -0.000 0.000 0.242 2186 N C -0.594 174.907 175.510 -0.015 0.000 0.983 2186 N CA 1.411 54.455 53.050 -0.010 0.000 0.934 2186 N CB -1.832 36.651 38.487 -0.007 0.000 1.115 2186 N HN 0.427 nan 8.380 nan 0.000 0.593 2187 T N 1.365 115.909 114.554 -0.017 0.000 2.734 2187 T HA 0.095 4.445 4.350 -0.000 0.000 0.269 2187 T C 0.583 175.261 174.700 -0.037 0.000 0.964 2187 T CA -0.225 61.861 62.100 -0.025 0.000 1.226 2187 T CB -0.063 68.791 68.868 -0.024 0.000 0.910 2187 T HN 0.222 nan 8.240 nan 0.000 0.534 2188 L N 6.051 127.251 121.223 -0.038 0.000 2.315 2188 L HA 0.528 4.868 4.340 -0.000 0.000 0.283 2188 L C -0.538 176.284 176.870 -0.081 0.000 1.089 2188 L CA -0.193 54.617 54.840 -0.050 0.000 0.833 2188 L CB 0.260 42.296 42.059 -0.038 0.000 1.170 2188 L HN 0.573 nan 8.230 nan 0.000 0.442 2189 L N 6.337 127.491 121.223 -0.114 0.000 2.307 2189 L HA 0.602 4.942 4.340 -0.000 0.000 0.284 2189 L C -0.861 175.869 176.870 -0.234 0.000 1.023 2189 L CA -0.310 54.404 54.840 -0.210 0.000 0.810 2189 L CB 1.185 43.073 42.059 -0.285 0.000 1.231 2189 L HN 0.654 nan 8.230 nan 0.000 0.423 2190 I N 4.604 125.017 120.570 -0.261 0.000 2.378 2190 I HA 0.343 4.513 4.170 -0.000 0.000 0.291 2190 I C -0.841 175.118 176.117 -0.264 0.000 0.992 2190 I CA -0.360 60.830 61.300 -0.184 0.000 1.154 2190 I CB 1.446 39.398 38.000 -0.080 0.000 1.315 2190 I HN 0.415 nan 8.210 nan 0.000 0.448 2191 F N 6.192 126.121 119.950 -0.034 0.000 2.440 2191 F HA 0.610 5.137 4.527 -0.000 0.000 0.328 2191 F C 0.189 175.974 175.800 -0.025 0.000 1.070 2191 F CA -0.701 57.278 58.000 -0.035 0.000 1.011 2191 F CB 1.383 40.365 39.000 -0.029 0.000 1.226 2191 F HN 0.117 nan 8.300 nan 0.000 0.491 2192 I N 2.083 122.791 120.570 0.230 0.000 2.499 2192 I HA 0.358 4.528 4.170 -0.000 0.000 0.288 2192 I C -0.660 175.521 176.117 0.106 0.000 1.048 2192 I CA -0.674 60.705 61.300 0.132 0.000 1.062 2192 I CB 1.863 39.916 38.000 0.089 0.000 1.238 2192 I HN 0.470 nan 8.210 nan 0.000 0.426 2193 N N 3.904 122.675 118.700 0.117 0.000 2.890 2193 N HA 0.589 5.329 4.740 -0.000 0.000 0.317 2193 N C -1.281 174.270 175.510 0.069 0.000 1.355 2193 N CA -0.487 52.613 53.050 0.084 0.000 0.803 2193 N CB 1.742 40.294 38.487 0.107 0.000 1.465 2193 N HN 0.585 nan 8.380 nan 0.000 0.591 2212 G N -0.832 107.909 108.800 -0.098 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 0.582 175.440 174.900 -0.069 0.000 1.150 2212 G CA -0.274 44.780 45.100 -0.076 0.000 0.923 2212 G HN 0.521 nan 8.290 nan 0.000 0.485 2213 N N 0.807 119.486 118.700 -0.035 0.000 2.272 2213 N HA -0.144 4.596 4.740 -0.000 0.000 0.185 2213 N C 2.421 177.938 175.510 0.012 0.000 1.014 2213 N CA 1.508 54.551 53.050 -0.011 0.000 0.870 2213 N CB -0.061 38.453 38.487 0.044 0.000 0.975 2213 N HN 0.537 nan 8.380 nan 0.000 0.433 2214 A N 0.503 123.331 122.820 0.014 0.000 1.877 2214 A HA -0.120 4.200 4.320 -0.000 0.000 0.216 2214 A C 2.152 179.743 177.584 0.011 0.000 1.186 2214 A CA 1.193 53.251 52.037 0.035 0.000 0.620 2214 A CB -0.876 18.145 19.000 0.034 0.000 0.822 2214 A HN 0.338 nan 8.150 nan 0.000 0.443 2215 L N 0.259 121.453 121.223 -0.047 0.000 2.043 2215 L HA -0.210 4.130 4.340 -0.000 0.000 0.212 2215 L C 2.233 179.051 176.870 -0.087 0.000 1.075 2215 L CA 2.694 57.500 54.840 -0.057 0.000 0.752 2215 L CB -0.775 41.180 42.059 -0.172 0.000 0.891 2215 L HN 0.493 nan 8.230 nan 0.000 0.432 2216 K N -1.775 118.498 120.400 -0.212 0.000 2.189 2216 K HA -0.255 4.065 4.320 -0.000 0.000 0.207 2216 K C 1.731 178.055 176.600 -0.461 0.000 1.046 2216 K CA 2.188 58.229 56.287 -0.410 0.000 0.928 2216 K CB -0.186 31.924 32.500 -0.650 0.000 0.720 2216 K HN 0.384 nan 8.250 nan 0.000 0.458 2217 F N -1.760 118.163 119.950 -0.044 0.000 2.399 2217 F HA 0.085 4.612 4.527 -0.000 0.000 0.282 2217 F C 1.782 177.584 175.800 0.003 0.000 1.027 2217 F CA 0.237 58.199 58.000 -0.064 0.000 1.333 2217 F CB -0.621 38.257 39.000 -0.204 0.000 1.132 2217 F HN -0.070 nan 8.300 nan 0.000 0.590 2218 Y N 0.816 121.241 120.300 0.207 0.000 2.483 2218 Y HA 0.097 4.647 4.550 -0.000 0.000 0.291 2218 Y C 1.512 177.464 175.900 0.087 0.000 1.143 2218 Y CA -0.288 57.891 58.100 0.132 0.000 1.289 2218 Y CB -0.398 38.132 38.460 0.117 0.000 0.983 2218 Y HN -0.047 nan 8.280 nan 0.000 0.556 2219 A N -0.073 122.863 122.820 0.194 0.000 2.498 2219 A HA 0.103 4.423 4.320 -0.000 0.000 0.239 2219 A C 1.100 178.721 177.584 0.062 0.000 1.068 2219 A CA 0.311 52.402 52.037 0.091 0.000 0.766 2219 A CB 0.304 19.298 19.000 -0.010 0.000 1.003 2219 A HN 0.312 nan 8.150 nan 0.000 0.497 2220 S N 0.293 116.015 115.700 0.036 0.000 2.483 2220 S HA 0.208 4.678 4.470 -0.000 0.000 0.221 2220 S C 0.269 174.851 174.600 -0.030 0.000 1.030 2220 S CA 0.342 58.556 58.200 0.022 0.000 0.925 2220 S CB 0.277 63.493 63.200 0.026 0.000 0.795 2220 S HN 0.540 nan 8.310 nan 0.000 0.511 2221 V N 2.506 122.383 119.914 -0.061 0.000 2.623 2221 V HA 0.444 4.564 4.120 -0.000 0.000 0.304 2221 V C -1.040 174.955 176.094 -0.164 0.000 1.054 2221 V CA -0.727 61.506 62.300 -0.111 0.000 0.882 2221 V CB 2.051 33.823 31.823 -0.085 0.000 1.002 2221 V HN 0.157 nan 8.190 nan 0.000 0.424 2222 R N 4.491 124.838 120.500 -0.255 0.000 2.439 2222 R HA 0.626 4.966 4.340 -0.000 0.000 0.310 2222 R C -1.629 174.447 176.300 -0.373 0.000 0.955 2222 R CA -0.884 55.002 56.100 -0.357 0.000 0.853 2222 R CB 2.091 32.100 30.300 -0.485 0.000 1.171 2222 R HN 0.350 nan 8.270 nan 0.000 0.449 2223 L N 2.112 123.115 121.223 -0.365 0.000 2.309 2223 L HA 0.310 4.650 4.340 -0.000 0.000 0.282 2223 L C -0.244 176.453 176.870 -0.289 0.000 1.036 2223 L CA -0.271 54.417 54.840 -0.254 0.000 0.806 2223 L CB 1.417 43.400 42.059 -0.127 0.000 1.220 2223 L HN 0.458 nan 8.230 nan 0.000 0.429 2224 D N 3.746 124.118 120.400 -0.046 0.000 2.461 2224 D HA 0.287 4.927 4.640 -0.000 0.000 0.240 2224 D C -0.786 175.630 176.300 0.192 0.000 1.094 2224 D CA -0.186 53.963 54.000 0.249 0.000 0.868 2224 D CB 0.754 41.761 40.800 0.345 0.000 1.062 2224 D HN 0.400 nan 8.370 nan 0.000 0.530 2225 I N 3.386 124.075 120.570 0.199 0.000 2.392 2225 I HA 0.471 4.641 4.170 -0.000 0.000 0.295 2225 I C -0.583 175.595 176.117 0.101 0.000 0.985 2225 I CA -0.542 60.842 61.300 0.139 0.000 1.221 2225 I CB 0.404 38.481 38.000 0.127 0.000 1.366 2225 I HN 0.221 nan 8.210 nan 0.000 0.467 2226 R N 6.402 126.939 120.500 0.062 0.000 2.725 2226 R HA 0.480 4.820 4.340 -0.000 0.000 0.277 2226 R C -1.107 175.193 176.300 -0.000 0.000 0.987 2226 R CA -1.036 55.080 56.100 0.026 0.000 0.901 2226 R CB 1.970 32.286 30.300 0.026 0.000 1.207 2226 R HN 0.563 nan 8.270 nan 0.000 0.463 2227 R N 2.530 123.022 120.500 -0.012 0.000 2.312 2227 R HA 0.254 4.594 4.340 -0.000 0.000 0.311 2227 R C 0.553 176.844 176.300 -0.014 0.000 1.004 2227 R CA -0.173 55.911 56.100 -0.026 0.000 0.902 2227 R CB 0.786 31.071 30.300 -0.025 0.000 1.073 2227 R HN 0.854 nan 8.270 nan 0.000 0.457 2228 I N 0.980 121.540 120.570 -0.015 0.000 3.565 2228 I HA 0.456 4.626 4.170 -0.000 0.000 0.287 2228 I C 0.761 176.878 176.117 -0.000 0.000 1.193 2228 I CA 0.278 61.576 61.300 -0.003 0.000 1.402 2228 I CB 0.599 38.602 38.000 0.005 0.000 1.284 2228 I HN 0.622 nan 8.210 nan 0.000 0.454 2229 G N 0.933 109.731 108.800 -0.004 0.000 2.851 2229 G HA2 0.792 4.752 3.960 -0.000 0.000 0.208 2229 G HA3 0.792 4.752 3.960 -0.000 0.000 0.208 2229 G C -0.545 174.357 174.900 0.003 0.000 1.894 2229 G CA -0.008 45.093 45.100 0.000 0.000 0.732 2229 G HN 0.865 nan 8.290 nan 0.000 0.802 2230 A N -2.256 120.564 122.820 0.000 0.000 2.613 2230 A HA 0.467 4.787 4.320 -0.000 0.000 0.303 2230 A C -1.794 175.781 177.584 -0.015 0.000 0.915 2230 A CA -0.271 51.766 52.037 -0.000 0.000 0.654 2230 A CB 0.182 19.180 19.000 -0.004 0.000 1.280 2230 A HN 1.385 nan 8.150 nan 0.000 0.407 2231 V N 2.002 121.897 119.914 -0.032 0.000 2.444 2231 V HA 0.542 4.662 4.120 -0.000 0.000 0.294 2231 V C -0.055 175.996 176.094 -0.071 0.000 1.022 2231 V CA -0.533 61.742 62.300 -0.041 0.000 0.850 2231 V CB 1.723 33.531 31.823 -0.026 0.000 0.992 2231 V HN 0.771 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 0.476 4.796 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 -0.572 55.677 56.287 -0.064 0.000 0.849 2232 K CB 1.751 34.221 32.500 -0.050 0.000 1.098 2232 K HN 0.589 nan 8.250 nan 0.000 0.445 2233 E N 2.412 122.574 120.200 -0.064 0.000 1.993 2233 E HA 0.117 4.467 4.350 -0.000 0.000 0.271 2233 E C 0.703 177.275 176.600 -0.046 0.000 1.008 2233 E CA -0.043 56.326 56.400 -0.053 0.000 0.814 2233 E CB 1.228 30.895 29.700 -0.055 0.000 1.098 2233 E HN 0.957 nan 8.360 nan 0.000 0.407 2234 G N 4.231 113.007 108.800 -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 0.437 175.316 174.900 -0.035 0.000 1.382 2234 G CA 0.462 45.541 45.100 -0.035 0.000 0.994 2234 G HN 0.500 nan 8.290 nan 0.000 0.800 2235 E N 1.622 121.800 120.200 -0.037 0.000 2.934 2235 E HA 0.344 4.694 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 56.186 56.400 -0.037 0.000 0.803 2235 E CB -0.358 29.324 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 -0.823 174.616 175.510 -0.120 0.000 1.113 2236 N CA -0.271 52.733 53.050 -0.078 0.000 0.996 2236 N CB 1.874 40.318 38.487 -0.072 0.000 1.584 2236 N HN -0.082 nan 8.380 nan 0.000 0.573 2237 V N 3.367 123.199 119.914 -0.137 0.000 2.415 2237 V HA 0.004 4.124 4.120 -0.000 0.000 0.252 2237 V C 1.044 176.884 176.094 -0.423 0.000 1.043 2237 V CA 0.375 62.553 62.300 -0.203 0.000 1.149 2237 V CB 0.472 32.213 31.823 -0.137 0.000 1.143 2237 V HN 0.531 nan 8.190 nan 0.000 0.478 2238 V N 4.028 123.691 119.914 -0.417 0.000 3.380 2238 V HA 0.632 4.752 4.120 -0.000 0.000 0.307 2238 V C 0.846 176.608 176.094 -0.554 0.000 1.434 2238 V CA 0.917 62.863 62.300 -0.590 0.000 1.075 2238 V CB 0.381 32.044 31.823 -0.266 0.000 0.954 2238 V HN 0.868 nan 8.190 nan 0.000 0.444 2239 G N -0.864 107.729 108.800 -0.344 0.000 2.703 2239 G HA2 0.514 4.474 3.960 -0.000 0.000 0.294 2239 G HA3 0.514 4.474 3.960 -0.000 0.000 0.294 2239 G C -1.340 173.635 174.900 0.126 0.000 1.451 2239 G CA -0.315 44.806 45.100 0.035 0.000 0.869 2239 G HN 0.028 nan 8.290 nan 0.000 0.516 2240 S N 0.084 115.893 115.700 0.183 0.000 2.456 2240 S HA 0.426 4.896 4.470 -0.000 0.000 0.316 2240 S C -0.356 174.234 174.600 -0.018 0.000 1.089 2240 S CA -0.507 57.742 58.200 0.082 0.000 1.101 2240 S CB 1.753 64.998 63.200 0.074 0.000 0.995 2240 S HN 0.651 nan 8.310 nan 0.000 0.468 2241 E N 2.962 123.143 120.200 -0.032 0.000 2.129 2241 E HA 0.284 4.634 4.350 -0.000 0.000 0.283 2241 E C 0.113 176.645 176.600 -0.113 0.000 1.080 2241 E CA -0.204 56.154 56.400 -0.071 0.000 0.867 2241 E CB 0.332 30.015 29.700 -0.030 0.000 1.056 2241 E HN 0.627 nan 8.360 nan 0.000 0.404 2242 T N 2.148 116.556 114.554 -0.244 0.000 2.948 2242 T HA 0.576 4.926 4.350 -0.000 0.000 0.285 2242 T C -0.241 174.363 174.700 -0.159 0.000 1.019 2242 T CA -1.133 60.811 62.100 -0.259 0.000 1.013 2242 T CB 1.448 70.048 68.868 -0.448 0.000 1.117 2242 T HN 0.444 nan 8.240 nan 0.000 0.533 2243 R N 0.638 121.125 120.500 -0.022 0.000 2.515 2243 R HA 0.586 4.926 4.340 -0.000 0.000 0.291 2243 R C -2.228 174.164 176.300 0.153 0.000 1.046 2243 R CA -0.636 55.524 56.100 0.099 0.000 0.914 2243 R CB 1.720 32.063 30.300 0.072 0.000 1.191 2243 R HN 0.566 nan 8.270 nan 0.000 0.435 2244 V N 4.768 124.821 119.914 0.232 0.000 2.417 2244 V HA 0.397 4.517 4.120 -0.000 0.000 0.291 2244 V C -0.325 175.834 176.094 0.108 0.000 1.024 2244 V CA -0.627 61.783 62.300 0.183 0.000 0.861 2244 V CB 1.730 33.687 31.823 0.223 0.000 0.985 2244 V HN 0.656 nan 8.190 nan 0.000 0.436 2245 K N 3.767 124.215 120.400 0.080 0.000 2.358 2245 K HA 0.569 4.889 4.320 -0.000 0.000 0.260 2245 K C -1.062 175.529 176.600 -0.015 0.000 0.956 2245 K CA -0.589 55.730 56.287 0.053 0.000 0.834 2245 K CB 1.872 34.423 32.500 0.085 0.000 1.102 2245 K HN 0.486 nan 8.250 nan 0.000 0.431 2246 V N 6.202 126.084 119.914 -0.053 0.000 2.338 2246 V HA 0.005 4.125 4.120 -0.000 0.000 0.255 2246 V C 1.185 177.130 176.094 -0.249 0.000 1.082 2246 V CA -0.228 61.991 62.300 -0.135 0.000 0.951 2246 V CB 0.374 32.130 31.823 -0.111 0.000 1.102 2246 V HN 0.704 nan 8.190 nan 0.000 0.489 2247 V N 1.548 121.287 119.914 -0.293 0.000 3.052 2247 V HA 0.238 4.358 4.120 -0.000 0.000 0.254 2247 V C 0.836 176.577 176.094 -0.588 0.000 1.100 2247 V CA 0.625 62.670 62.300 -0.423 0.000 1.112 2247 V CB -0.369 31.354 31.823 -0.167 0.000 0.738 2247 V HN 0.662 nan 8.190 nan 0.000 0.469 2248 K N 1.588 121.699 120.400 -0.482 0.000 2.426 2248 K HA 0.482 4.802 4.320 -0.000 0.000 0.254 2248 K C -1.456 174.982 176.600 -0.269 0.000 0.936 2248 K CA -0.483 55.537 56.287 -0.445 0.000 0.801 2248 K CB 1.362 33.445 32.500 -0.695 0.000 1.139 2248 K HN 0.254 nan 8.250 nan 0.000 0.424 2249 N N 3.821 122.425 118.700 -0.160 0.000 2.653 2249 N HA 0.157 4.897 4.740 -0.000 0.000 0.261 2249 N C -1.398 174.109 175.510 -0.004 0.000 1.216 2249 N CA -0.374 52.628 53.050 -0.080 0.000 0.784 2249 N CB 1.000 39.441 38.487 -0.076 0.000 1.327 2249 N HN 0.521 nan 8.380 nan 0.000 0.539 2250 K N 2.963 123.368 120.400 0.008 0.000 2.994 2250 K HA 0.277 4.597 4.320 -0.000 0.000 0.231 2250 K C 0.268 176.887 176.600 0.033 0.000 1.174 2250 K CA -0.033 56.280 56.287 0.044 0.000 1.221 2250 K CB 0.390 32.930 32.500 0.066 0.000 1.166 2250 K HN 0.428 nan 8.250 nan 0.000 0.453 2251 I N -0.894 119.687 120.570 0.019 0.000 4.607 2251 I HA 0.171 4.341 4.170 -0.000 0.000 0.324 2251 I C 0.191 176.319 176.117 0.019 0.000 1.279 2251 I CA 0.111 61.420 61.300 0.015 0.000 1.286 2251 I CB 1.041 39.041 38.000 -0.000 0.000 1.265 2251 I HN 0.149 nan 8.210 nan 0.000 0.446 2252 A N -0.081 122.751 122.820 0.021 0.000 5.450 2252 A HA 0.830 5.150 4.320 -0.000 0.000 0.198 2252 A C -0.940 176.670 177.584 0.043 0.000 0.883 2252 A CA 0.009 52.063 52.037 0.028 0.000 0.784 2252 A CB -0.571 18.439 19.000 0.016 0.000 2.043 2252 A HN 0.096 nan 8.150 nan 0.000 0.994 2253 A N 1.462 124.309 122.820 0.045 0.000 2.451 2253 A HA 0.615 4.935 4.320 -0.000 0.000 0.266 2253 A C -2.517 175.112 177.584 0.075 0.000 1.119 2253 A CA -0.910 51.170 52.037 0.072 0.000 0.786 2253 A CB -0.719 18.319 19.000 0.064 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 -0.054 177.396 177.300 0.251 0.000 1.269 2254 P CA -0.431 62.711 63.100 0.069 0.000 0.844 2254 P CB 0.352 32.088 31.700 0.059 0.000 1.094 2255 F N -3.163 116.814 119.950 0.045 0.000 2.397 2255 F HA -0.205 4.322 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 0.712 58.739 58.000 0.046 0.000 1.561 2255 F CB -1.613 37.415 39.000 0.047 0.000 2.188 2255 F HN 0.227 nan 8.300 nan 0.000 0.267 2256 K N 2.091 122.576 120.400 0.141 0.000 2.258 2256 K HA 0.419 4.739 4.320 -0.000 0.000 0.264 2256 K C 0.376 177.012 176.600 0.060 0.000 1.007 2256 K CA -0.060 56.281 56.287 0.090 0.000 0.941 2256 K CB 0.860 33.396 32.500 0.060 0.000 0.966 2256 K HN 0.427 nan 8.250 nan 0.000 0.480 2257 Q N -0.214 119.622 119.800 0.060 0.000 2.484 2257 Q HA 0.767 5.107 4.340 -0.000 0.000 0.285 2257 Q C -1.729 174.303 176.000 0.053 0.000 1.097 2257 Q CA -1.295 54.544 55.803 0.060 0.000 0.802 2257 Q CB 2.207 30.994 28.738 0.081 0.000 1.444 2257 Q HN 0.539 nan 8.270 nan 0.000 0.429 2258 A N 1.318 124.181 122.820 0.071 0.000 2.465 2258 A HA 0.528 4.848 4.320 -0.000 0.000 0.292 2258 A C -1.508 176.191 177.584 0.192 0.000 1.041 2258 A CA -0.697 51.386 52.037 0.076 0.000 0.718 2258 A CB 1.691 20.684 19.000 -0.010 0.000 1.266 2258 A HN 0.736 nan 8.150 nan 0.000 0.403 2259 E N 1.061 121.387 120.200 0.209 0.000 2.183 2259 E HA 0.762 5.112 4.350 -0.000 0.000 0.271 2259 E C -0.956 175.877 176.600 0.388 0.000 0.919 2259 E CA -0.469 56.095 56.400 0.273 0.000 0.781 2259 E CB 2.042 31.827 29.700 0.142 0.000 1.140 2259 E HN 0.677 nan 8.360 nan 0.000 0.402 2260 F N -1.345 118.623 119.950 0.029 0.000 2.773 2260 F HA 0.404 4.931 4.527 -0.000 0.000 0.314 2260 F C -1.234 174.593 175.800 0.046 0.000 1.160 2260 F CA -1.307 56.712 58.000 0.031 0.000 0.920 2260 F CB 1.190 40.199 39.000 0.014 0.000 1.323 2260 F HN 0.160 nan 8.300 nan 0.000 0.457 2261 Q N 1.658 121.480 119.800 0.037 0.000 2.230 2261 Q HA 0.649 4.989 4.340 -0.000 0.000 0.253 2261 Q C -1.195 174.783 176.000 -0.037 0.000 0.919 2261 Q CA -0.857 54.922 55.803 -0.041 0.000 0.908 2261 Q CB 2.810 31.583 28.738 0.059 0.000 1.245 2261 Q HN 0.570 nan 8.270 nan 0.000 0.437 2262 I N 2.986 123.522 120.570 -0.057 0.000 2.389 2262 I HA 0.278 4.448 4.170 -0.000 0.000 0.288 2262 I C -1.071 175.139 176.117 0.155 0.000 0.999 2262 I CA -0.768 60.563 61.300 0.053 0.000 1.129 2262 I CB 1.264 39.267 38.000 0.006 0.000 1.288 2262 I HN 0.289 nan 8.210 nan 0.000 0.444 2263 L N 6.882 128.225 121.223 0.199 0.000 2.313 2263 L HA 0.388 4.728 4.340 -0.000 0.000 0.283 2263 L C -0.569 176.523 176.870 0.370 0.000 1.013 2263 L CA -0.242 54.754 54.840 0.259 0.000 0.816 2263 L CB 0.909 43.064 42.059 0.160 0.000 1.236 2263 L HN 0.316 nan 8.230 nan 0.000 0.419 2264 Y N 3.641 124.011 120.300 0.116 0.000 2.852 2264 Y HA 0.138 4.688 4.550 -0.000 0.000 0.343 2264 Y C 1.595 177.604 175.900 0.182 0.000 1.280 2264 Y CA 0.590 58.790 58.100 0.167 0.000 1.604 2264 Y CB 0.167 38.678 38.460 0.085 0.000 1.216 2264 Y HN 0.887 nan 8.280 nan 0.000 0.541 2265 G N 2.688 111.742 108.800 0.424 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 0.558 45.770 45.100 0.187 0.000 0.689 2265 G HN 0.733 nan 8.290 nan 0.000 0.522 2266 E N -1.780 118.423 120.200 0.006 0.000 2.652 2266 E HA 0.411 4.761 4.350 -0.000 0.000 0.197 2266 E C 1.346 177.926 176.600 -0.033 0.000 0.936 2266 E CA 0.951 57.338 56.400 -0.021 0.000 1.638 2266 E CB 0.468 30.196 29.700 0.046 0.000 1.884 2266 E HN 1.762 nan 8.360 nan 0.000 1.005 2267 G N 1.484 110.303 108.800 0.031 0.000 2.545 2267 G HA2 -0.237 3.723 3.960 -0.000 0.000 0.216 2267 G HA3 -0.237 3.723 3.960 -0.000 0.000 0.216 2267 G C -0.223 174.771 174.900 0.157 0.000 1.314 2267 G CA -0.326 44.823 45.100 0.081 0.000 0.906 2267 G HN 0.174 nan 8.290 nan 0.000 0.563 2268 I N 1.155 121.840 120.570 0.192 0.000 2.919 2268 I HA -0.062 4.108 4.170 -0.000 0.000 0.303 2268 I C 0.734 177.004 176.117 0.255 0.000 1.221 2268 I CA 0.262 61.729 61.300 0.277 0.000 1.444 2268 I CB 0.286 38.463 38.000 0.295 0.000 1.331 2268 I HN 0.471 nan 8.210 nan 0.000 0.572 2269 N N 6.479 125.347 118.700 0.281 0.000 2.868 2269 N HA 0.074 4.814 4.740 -0.000 0.000 0.252 2269 N C 0.616 176.299 175.510 0.289 0.000 1.130 2269 N CA -0.036 53.175 53.050 0.268 0.000 1.026 2269 N CB -0.077 38.541 38.487 0.219 0.000 1.335 2269 N HN 0.496 nan 8.380 nan 0.000 0.516 2270 F N 2.150 122.164 119.950 0.107 0.000 2.063 2270 F HA -0.357 4.170 4.527 -0.000 0.000 0.298 2270 F C 0.972 176.739 175.800 -0.056 0.000 1.105 2270 F CA 1.829 59.801 58.000 -0.046 0.000 1.215 2270 F CB -0.023 38.846 39.000 -0.219 0.000 0.972 2270 F HN 0.502 nan 8.300 nan 0.000 0.483 2271 Y N -0.309 120.220 120.300 0.383 0.000 2.314 2271 Y HA -0.031 4.519 4.550 -0.000 0.000 0.293 2271 Y C 2.610 178.611 175.900 0.167 0.000 1.129 2271 Y CA 0.908 59.164 58.100 0.261 0.000 1.201 2271 Y CB -1.230 37.323 38.460 0.155 0.000 0.999 2271 Y HN 0.118 nan 8.280 nan 0.000 0.541 2272 G N 0.694 109.675 108.800 0.302 0.000 2.446 2272 G HA2 -0.297 3.663 3.960 -0.000 0.000 0.217 2272 G HA3 -0.297 3.663 3.960 -0.000 0.000 0.217 2272 G C 1.381 176.373 174.900 0.154 0.000 1.168 2272 G CA 1.322 46.538 45.100 0.193 0.000 0.771 2272 G HN 0.603 nan 8.290 nan 0.000 0.551 2273 E N -0.110 120.171 120.200 0.135 0.000 2.216 2273 E HA 0.083 4.433 4.350 -0.000 0.000 0.192 2273 E C 2.294 178.931 176.600 0.061 0.000 0.988 2273 E CA 0.269 56.720 56.400 0.085 0.000 0.834 2273 E CB -0.260 29.461 29.700 0.035 0.000 0.772 2273 E HN 0.338 nan 8.360 nan 0.000 0.479 2274 L N 1.197 122.466 121.223 0.077 0.000 2.046 2274 L HA -0.137 4.203 4.340 -0.000 0.000 0.208 2274 L C 2.271 179.223 176.870 0.135 0.000 1.077 2274 L CA 1.140 56.031 54.840 0.086 0.000 0.747 2274 L CB -0.164 41.981 42.059 0.143 0.000 0.896 2274 L HN 0.051 nan 8.230 nan 0.000 0.432 2275 V N -0.377 119.641 119.914 0.174 0.000 2.233 2275 V HA -0.338 3.782 4.120 -0.000 0.000 0.247 2275 V C 2.286 178.499 176.094 0.199 0.000 1.050 2275 V CA 2.100 64.520 62.300 0.200 0.000 1.010 2275 V CB -0.763 31.168 31.823 0.179 0.000 0.637 2275 V HN 0.450 nan 8.190 nan 0.000 0.444 2276 D N -0.210 120.290 120.400 0.167 0.000 2.149 2276 D HA -0.174 4.466 4.640 -0.000 0.000 0.194 2276 D C 1.984 178.351 176.300 0.113 0.000 1.001 2276 D CA 1.285 55.374 54.000 0.149 0.000 0.849 2276 D CB -0.195 40.676 40.800 0.119 0.000 0.939 2276 D HN 0.222 nan 8.370 nan 0.000 0.449 2277 L N 0.450 121.727 121.223 0.090 0.000 2.046 2277 L HA -0.037 4.303 4.340 -0.000 0.000 0.208 2277 L C 2.542 179.459 176.870 0.079 0.000 1.077 2277 L CA 1.678 56.556 54.840 0.064 0.000 0.747 2277 L CB -1.209 40.870 42.059 0.033 0.000 0.896 2277 L HN 0.056 nan 8.230 nan 0.000 0.432 2278 G N -1.905 106.960 108.800 0.108 0.000 2.598 2278 G HA2 -0.047 3.913 3.960 -0.000 0.000 0.215 2278 G HA3 -0.047 3.913 3.960 -0.000 0.000 0.215 2278 G C 1.503 176.471 174.900 0.113 0.000 1.131 2278 G CA 0.785 45.959 45.100 0.122 0.000 0.785 2278 G HN 0.286 nan 8.290 nan 0.000 0.539 2279 V N 0.051 120.029 119.914 0.106 0.000 2.446 2279 V HA 0.056 4.176 4.120 -0.000 0.000 0.244 2279 V C 2.481 178.600 176.094 0.042 0.000 1.039 2279 V CA 1.426 63.763 62.300 0.062 0.000 1.045 2279 V CB -0.082 31.782 31.823 0.068 0.000 0.681 2279 V HN 0.259 nan 8.190 nan 0.000 0.459 2280 K N -0.305 120.126 120.400 0.052 0.000 2.418 2280 K HA -0.019 4.301 4.320 -0.000 0.000 0.195 2280 K C 1.124 177.746 176.600 0.035 0.000 1.035 2280 K CA 0.557 56.867 56.287 0.039 0.000 1.003 2280 K CB 0.269 32.793 32.500 0.041 0.000 0.793 2280 K HN 0.296 nan 8.250 nan 0.000 0.494 2281 E N 0.498 120.724 120.200 0.044 0.000 2.558 2281 E HA 0.051 4.401 4.350 -0.000 0.000 0.205 2281 E C -0.361 176.267 176.600 0.046 0.000 1.006 2281 E CA -0.015 56.410 56.400 0.042 0.000 0.961 2281 E CB 0.755 30.482 29.700 0.045 0.000 1.044 2281 E HN 0.086 nan 8.360 nan 0.000 0.465 2282 K N -0.324 120.101 120.400 0.042 0.000 3.274 2282 K HA -0.209 4.111 4.320 -0.000 0.000 0.300 2282 K C 1.070 177.697 176.600 0.046 0.000 1.230 2282 K CA 0.518 56.824 56.287 0.032 0.000 0.884 2282 K CB -2.137 30.373 32.500 0.016 0.000 1.242 2282 K HN 0.221 nan 8.250 nan 0.000 0.467 2283 L N -0.043 121.232 121.223 0.087 0.000 2.179 2283 L HA 0.122 4.462 4.340 -0.000 0.000 0.208 2283 L C 1.147 178.133 176.870 0.193 0.000 1.096 2283 L CA 0.953 55.879 54.840 0.142 0.000 0.779 2283 L CB 0.086 42.266 42.059 0.200 0.000 0.922 2283 L HN 0.141 nan 8.230 nan 0.000 0.443 2284 I N -1.051 119.618 120.570 0.165 0.000 2.509 2284 I HA 0.246 4.416 4.170 -0.000 0.000 0.293 2284 I C -0.587 175.553 176.117 0.037 0.000 1.020 2284 I CA -0.496 60.903 61.300 0.165 0.000 1.088 2284 I CB 1.996 40.129 38.000 0.222 0.000 1.267 2284 I HN -0.102 nan 8.210 nan 0.000 0.430 2285 E N 4.943 125.138 120.200 -0.008 0.000 2.133 2285 E HA 0.288 4.638 4.350 -0.000 0.000 0.274 2285 E C -0.794 175.708 176.600 -0.163 0.000 0.930 2285 E CA -0.829 55.529 56.400 -0.070 0.000 0.770 2285 E CB 1.800 31.472 29.700 -0.047 0.000 1.104 2285 E HN 0.307 nan 8.360 nan 0.000 0.403 2286 K N 2.222 122.495 120.400 -0.212 0.000 2.273 2286 K HA 0.306 4.626 4.320 -0.000 0.000 0.287 2286 K C -0.511 176.018 176.600 -0.118 0.000 1.089 2286 K CA -0.211 55.898 56.287 -0.296 0.000 0.909 2286 K CB 0.510 32.835 32.500 -0.292 0.000 1.123 2286 K HN 0.572 nan 8.250 nan 0.000 0.473 2287 A N 4.173 126.969 122.820 -0.040 0.000 3.258 2287 A HA 0.365 4.685 4.320 -0.000 0.000 0.275 2287 A C 1.035 178.683 177.584 0.107 0.000 1.452 2287 A CA 0.256 52.320 52.037 0.045 0.000 1.120 2287 A CB -0.619 18.421 19.000 0.067 0.000 1.107 2287 A HN 1.099 nan 8.150 nan 0.000 0.651 2288 G N 0.296 109.125 108.800 0.049 0.000 5.155 2288 G HA2 -0.210 3.750 3.960 -0.000 0.000 0.239 2288 G HA3 -0.210 3.750 3.960 -0.000 0.000 0.239 2288 G C 1.336 176.282 174.900 0.077 0.000 1.409 2288 G CA 0.807 45.946 45.100 0.065 0.000 0.927 2288 G HN 1.757 nan 8.290 nan 0.000 0.710 2289 A N -1.058 121.837 122.820 0.125 0.000 2.358 2289 A HA 0.575 4.895 4.320 -0.000 0.000 0.223 2289 A C 0.519 178.143 177.584 0.067 0.000 1.218 2289 A CA 0.500 52.577 52.037 0.066 0.000 0.942 2289 A CB 0.199 19.176 19.000 -0.039 0.000 1.005 2289 A HN 0.559 nan 8.150 nan 0.000 0.514 2290 W N -1.068 120.283 121.300 0.085 0.000 2.438 2290 W HA 0.580 5.240 4.660 -0.000 0.000 0.324 2290 W C -0.786 175.773 176.519 0.066 0.000 1.119 2290 W CA -0.016 57.393 57.345 0.106 0.000 1.221 2290 W CB 0.556 30.031 29.460 0.025 0.000 1.253 2290 W HN 0.173 nan 8.180 nan 0.000 0.555 2291 Y N 2.258 122.684 120.300 0.209 0.000 2.388 2291 Y HA 0.388 4.938 4.550 -0.000 0.000 0.328 2291 Y C 0.071 176.017 175.900 0.077 0.000 0.963 2291 Y CA -0.727 57.435 58.100 0.104 0.000 1.240 2291 Y CB 1.110 39.591 38.460 0.035 0.000 1.118 2291 Y HN 0.133 nan 8.280 nan 0.000 0.484 2292 S N 2.938 118.706 115.700 0.114 0.000 2.472 2292 S HA 0.290 4.760 4.470 -0.000 0.000 0.303 2292 S C -1.413 173.252 174.600 0.109 0.000 1.099 2292 S CA -0.693 57.549 58.200 0.070 0.000 1.077 2292 S CB 0.966 64.174 63.200 0.013 0.000 1.031 2292 S HN 0.499 nan 8.310 nan 0.000 0.487 2293 Y N 3.220 123.497 120.300 -0.037 0.000 2.944 2293 Y HA 0.378 4.928 4.550 -0.000 0.000 0.335 2293 Y C -0.258 175.649 175.900 0.011 0.000 1.075 2293 Y CA -0.826 57.276 58.100 0.004 0.000 1.240 2293 Y CB -0.408 38.070 38.460 0.030 0.000 1.167 2293 Y HN 0.782 nan 8.280 nan 0.000 0.555 2294 K N 4.032 124.238 120.400 -0.323 0.000 5.617 2294 K HA -0.225 4.095 4.320 -0.000 0.000 0.401 2294 K C 1.066 177.565 176.600 -0.168 0.000 0.978 2294 K CA 1.070 57.177 56.287 -0.301 0.000 1.200 2294 K CB -1.133 31.095 32.500 -0.453 0.000 1.863 2294 K HN 1.166 nan 8.250 nan 0.000 0.382 2295 G N 1.436 110.175 108.800 -0.102 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 -0.042 174.830 174.900 -0.046 0.000 1.358 2295 G CA 0.319 45.379 45.100 -0.067 0.000 0.880 2295 G HN 0.548 nan 8.290 nan 0.000 0.555 2296 E N 2.237 122.425 120.200 -0.020 0.000 2.417 2296 E HA 0.248 4.598 4.350 -0.000 0.000 0.261 2296 E C 0.053 176.637 176.600 -0.026 0.000 1.000 2296 E CA 0.391 56.794 56.400 0.006 0.000 0.919 2296 E CB 0.392 30.143 29.700 0.085 0.000 0.955 2296 E HN 0.450 nan 8.360 nan 0.000 0.455 2297 K N 3.823 124.196 120.400 -0.044 0.000 2.253 2297 K HA 0.202 4.522 4.320 -0.000 0.000 0.277 2297 K C 1.052 177.581 176.600 -0.117 0.000 1.053 2297 K CA -0.112 56.163 56.287 -0.020 0.000 0.892 2297 K CB 0.633 33.136 32.500 0.005 0.000 1.102 2297 K HN 0.506 nan 8.250 nan 0.000 0.469 2298 I N -1.557 118.870 120.570 -0.237 0.000 4.057 2298 I HA 0.333 4.503 4.170 -0.000 0.000 0.334 2298 I C 0.502 176.329 176.117 -0.483 0.000 1.308 2298 I CA -0.288 60.563 61.300 -0.747 0.000 1.125 2298 I CB 0.922 38.132 38.000 -1.317 0.000 1.034 2298 I HN 0.527 nan 8.210 nan 0.000 0.401 2299 G N 0.986 109.727 108.800 -0.098 0.000 2.387 2299 G HA2 0.381 4.341 3.960 -0.000 0.000 0.294 2299 G HA3 0.381 4.341 3.960 -0.000 0.000 0.294 2299 G C -2.196 172.664 174.900 -0.066 0.000 1.509 2299 G CA -0.613 44.443 45.100 -0.074 0.000 0.806 2299 G HN 0.220 nan 8.290 nan 0.000 0.546 2300 Q N -0.024 119.617 119.800 -0.265 0.000 2.274 2300 Q HA 0.553 4.893 4.340 -0.000 0.000 0.268 2300 Q C -0.037 175.771 176.000 -0.321 0.000 1.015 2300 Q CA 0.142 55.657 55.803 -0.480 0.000 0.775 2300 Q CB 1.594 29.777 28.738 -0.924 0.000 1.256 2300 Q HN 2.466 nan 8.270 nan 0.000 0.442 2301 G N 3.552 112.213 108.800 -0.232 0.000 3.285 2301 G HA2 -0.255 3.705 3.960 -0.000 0.000 0.685 2301 G HA3 -0.255 3.705 3.960 -0.000 0.000 0.685 2301 G C 0.223 174.936 174.900 -0.313 0.000 0.938 2301 G CA 0.137 45.122 45.100 -0.191 0.000 0.778 2301 G HN 0.846 nan 8.290 nan 0.000 0.515 2302 K N 1.700 121.900 120.400 -0.334 0.000 2.117 2302 K HA -0.266 4.054 4.320 -0.000 0.000 0.215 2302 K C 2.899 179.315 176.600 -0.307 0.000 1.053 2302 K CA 3.046 59.062 56.287 -0.452 0.000 0.935 2302 K CB -0.326 32.071 32.500 -0.171 0.000 0.719 2302 K HN 1.339 nan 8.250 nan 0.000 0.460 2303 A N 1.650 124.363 122.820 -0.178 0.000 1.842 2303 A HA -0.249 4.071 4.320 -0.000 0.000 0.217 2303 A C 1.854 179.374 177.584 -0.105 0.000 1.206 2303 A CA 2.139 54.110 52.037 -0.110 0.000 0.630 2303 A CB -0.973 17.977 19.000 -0.082 0.000 0.839 2303 A HN 0.492 nan 8.150 nan 0.000 0.447 2304 N N 0.114 118.742 118.700 -0.120 0.000 2.348 2304 N HA -0.105 4.635 4.740 -0.000 0.000 0.185 2304 N C 1.687 177.168 175.510 -0.048 0.000 1.019 2304 N CA 1.391 54.394 53.050 -0.078 0.000 0.880 2304 N CB -0.458 37.971 38.487 -0.097 0.000 0.965 2304 N HN 0.546 nan 8.380 nan 0.000 0.437 2305 A N 0.195 122.930 122.820 -0.141 0.000 1.878 2305 A HA -0.020 4.300 4.320 -0.000 0.000 0.213 2305 A C 2.337 179.942 177.584 0.036 0.000 1.192 2305 A CA 1.429 53.409 52.037 -0.096 0.000 0.619 2305 A CB -0.921 17.863 19.000 -0.359 0.000 0.837 2305 A HN 0.220 nan 8.150 nan 0.000 0.446 2306 T N 1.027 115.562 114.554 -0.031 0.000 2.565 2306 T HA -0.198 4.152 4.350 -0.000 0.000 0.265 2306 T C 1.829 176.566 174.700 0.061 0.000 1.082 2306 T CA 2.049 64.178 62.100 0.049 0.000 1.173 2306 T CB -0.610 68.272 68.868 0.024 0.000 0.864 2306 T HN 0.614 nan 8.240 nan 0.000 0.425 2307 A N -0.826 122.003 122.820 0.015 0.000 2.236 2307 A HA 0.127 4.447 4.320 -0.000 0.000 0.214 2307 A C 1.508 179.101 177.584 0.015 0.000 1.287 2307 A CA 0.217 52.229 52.037 -0.040 0.000 0.909 2307 A CB -1.048 17.924 19.000 -0.047 0.000 0.839 2307 A HN 0.772 nan 8.150 nan 0.000 0.486 2308 W N -0.771 120.472 121.300 -0.095 0.000 2.735 2308 W HA 0.179 4.839 4.660 -0.000 0.000 0.264 2308 W C 1.263 177.740 176.519 -0.071 0.000 1.233 2308 W CA 0.495 57.800 57.345 -0.067 0.000 1.408 2308 W CB 0.154 29.602 29.460 -0.020 0.000 1.038 2308 W HN 0.222 nan 8.180 nan 0.000 0.603 2309 L N 1.004 122.294 121.223 0.112 0.000 2.201 2309 L HA -0.119 4.221 4.340 -0.000 0.000 0.212 2309 L C 2.319 179.016 176.870 -0.287 0.000 1.105 2309 L CA 1.215 56.061 54.840 0.011 0.000 0.775 2309 L CB -0.835 41.433 42.059 0.348 0.000 0.913 2309 L HN -0.077 nan 8.230 nan 0.000 0.440 2310 K N 0.213 120.272 120.400 -0.568 0.000 2.362 2310 K HA -0.184 4.136 4.320 -0.000 0.000 0.200 2310 K C 1.287 177.622 176.600 -0.442 0.000 1.046 2310 K CA 1.148 56.964 56.287 -0.786 0.000 0.952 2310 K CB 0.157 32.250 32.500 -0.678 0.000 0.753 2310 K HN 0.194 nan 8.250 nan 0.000 0.466 2311 D N 0.225 120.369 120.400 -0.426 0.000 2.277 2311 D HA -0.017 4.623 4.640 -0.000 0.000 0.209 2311 D C -0.313 175.738 176.300 -0.414 0.000 0.970 2311 D CA 0.539 54.302 54.000 -0.395 0.000 0.874 2311 D CB 0.356 40.900 40.800 -0.427 0.000 0.982 2311 D HN 0.266 nan 8.370 nan 0.000 0.504 2312 N N -0.151 118.232 118.700 -0.529 0.000 2.664 2312 N HA 0.200 4.940 4.740 -0.000 0.000 0.257 2312 N C -2.536 172.814 175.510 -0.266 0.000 1.108 2312 N CA -1.297 51.517 53.050 -0.392 0.000 0.822 2312 N CB 2.070 40.293 38.487 -0.439 0.000 1.199 2312 N HN -0.162 nan 8.380 nan 0.000 0.529 2313 P HA -0.071 nan 4.420 nan 0.000 0.236 2313 P C 1.018 178.281 177.300 -0.061 0.000 1.172 2313 P CA 0.684 63.751 63.100 -0.055 0.000 0.759 2313 P CB 0.361 32.039 31.700 -0.037 0.000 0.843 2314 E N -0.267 119.882 120.200 -0.086 0.000 2.017 2314 E HA -0.108 4.242 4.350 -0.000 0.000 0.193 2314 E C 1.648 178.225 176.600 -0.039 0.000 0.997 2314 E CA 1.730 58.097 56.400 -0.055 0.000 0.804 2314 E CB -1.139 28.529 29.700 -0.052 0.000 0.757 2314 E HN 0.281 nan 8.360 nan 0.000 0.448 2315 T N 1.321 115.837 114.554 -0.064 0.000 2.995 2315 T HA 0.057 4.407 4.350 -0.000 0.000 0.269 2315 T C 1.916 176.579 174.700 -0.061 0.000 1.091 2315 T CA 0.866 62.925 62.100 -0.069 0.000 1.128 2315 T CB -0.059 68.738 68.868 -0.119 0.000 0.891 2315 T HN 0.214 nan 8.240 nan 0.000 0.492 2316 A N 2.720 125.523 122.820 -0.028 0.000 1.835 2316 A HA -0.108 4.212 4.320 -0.000 0.000 0.215 2316 A C 2.226 179.819 177.584 0.015 0.000 1.199 2316 A CA 1.366 53.420 52.037 0.029 0.000 0.615 2316 A CB -0.535 18.518 19.000 0.088 0.000 0.838 2316 A HN 0.410 nan 8.150 nan 0.000 0.444 2317 K N -0.418 119.975 120.400 -0.011 0.000 2.362 2317 K HA -0.188 4.132 4.320 -0.000 0.000 0.202 2317 K C 1.961 178.572 176.600 0.019 0.000 1.045 2317 K CA 1.425 57.707 56.287 -0.009 0.000 0.936 2317 K CB -0.071 32.411 32.500 -0.030 0.000 0.747 2317 K HN 0.721 nan 8.250 nan 0.000 0.467 2318 E N 0.917 121.131 120.200 0.024 0.000 2.033 2318 E HA -0.089 4.261 4.350 -0.000 0.000 0.189 2318 E C 1.907 178.546 176.600 0.064 0.000 0.979 2318 E CA 0.603 57.031 56.400 0.046 0.000 0.802 2318 E CB 0.124 29.859 29.700 0.060 0.000 0.763 2318 E HN 0.209 nan 8.360 nan 0.000 0.449 2319 I N 1.197 121.803 120.570 0.060 0.000 2.315 2319 I HA -0.204 3.966 4.170 -0.000 0.000 0.248 2319 I C 2.571 178.736 176.117 0.079 0.000 1.117 2319 I CA 0.831 62.181 61.300 0.084 0.000 1.404 2319 I CB -0.330 37.717 38.000 0.078 0.000 1.071 2319 I HN 0.244 nan 8.210 nan 0.000 0.419 2320 E N 1.768 122.016 120.200 0.079 0.000 2.068 2320 E HA -0.359 3.991 4.350 -0.000 0.000 0.207 2320 E C 2.178 178.816 176.600 0.063 0.000 1.032 2320 E CA 2.089 58.545 56.400 0.093 0.000 0.839 2320 E CB -0.025 29.752 29.700 0.128 0.000 0.758 2320 E HN 0.345 nan 8.360 nan 0.000 0.457 2321 K N 0.266 120.700 120.400 0.056 0.000 2.057 2321 K HA -0.113 4.207 4.320 -0.000 0.000 0.206 2321 K C 2.165 178.790 176.600 0.042 0.000 1.050 2321 K CA 1.400 57.713 56.287 0.043 0.000 0.935 2321 K CB 0.071 32.594 32.500 0.039 0.000 0.715 2321 K HN -0.008 nan 8.250 nan 0.000 0.439 2322 K N 0.062 120.495 120.400 0.054 0.000 2.360 2322 K HA -0.097 4.223 4.320 -0.000 0.000 0.201 2322 K C 1.702 178.332 176.600 0.049 0.000 1.046 2322 K CA 0.916 57.236 56.287 0.057 0.000 0.945 2322 K CB 0.189 32.736 32.500 0.079 0.000 0.750 2322 K HN 0.038 nan 8.250 nan 0.000 0.464 2323 V N 0.556 120.497 119.914 0.044 0.000 2.599 2323 V HA -0.092 4.028 4.120 -0.000 0.000 0.245 2323 V C 2.051 178.154 176.094 0.014 0.000 1.046 2323 V CA 0.974 63.293 62.300 0.031 0.000 1.065 2323 V CB -0.295 31.545 31.823 0.028 0.000 0.703 2323 V HN 0.224 nan 8.190 nan 0.000 0.464 2324 R N 0.340 120.847 120.500 0.011 0.000 2.103 2324 R HA -0.220 4.120 4.340 -0.000 0.000 0.242 2324 R C 2.244 178.548 176.300 0.007 0.000 1.142 2324 R CA 1.926 58.027 56.100 0.002 0.000 0.960 2324 R CB -0.293 30.010 30.300 0.005 0.000 0.858 2324 R HN 0.594 nan 8.270 nan 0.000 0.439 2325 E N 0.339 120.548 120.200 0.016 0.000 2.204 2325 E HA -0.142 4.208 4.350 -0.000 0.000 0.194 2325 E C 1.740 178.349 176.600 0.016 0.000 0.989 2325 E CA 0.794 57.204 56.400 0.017 0.000 0.824 2325 E CB 0.064 29.778 29.700 0.023 0.000 0.756 2325 E HN 0.276 nan 8.360 nan 0.000 0.477 2326 L N -0.153 121.081 121.223 0.018 0.000 2.529 2326 L HA 0.041 4.381 4.340 -0.000 0.000 0.223 2326 L C 1.577 178.454 176.870 0.012 0.000 1.113 2326 L CA 0.330 55.180 54.840 0.017 0.000 0.861 2326 L CB 0.440 42.513 42.059 0.023 0.000 1.012 2326 L HN 0.099 nan 8.230 nan 0.000 0.461 2327 L N -1.917 119.310 121.223 0.006 0.000 3.128 2327 L HA 0.213 4.553 4.340 -0.000 0.000 0.277 2327 L C -0.201 176.668 176.870 -0.003 0.000 1.171 2327 L CA -0.170 54.670 54.840 0.001 0.000 1.008 2327 L CB 0.935 42.992 42.059 -0.003 0.000 1.442 2327 L HN 0.020 nan 8.230 nan 0.000 0.584 3007 Q N 0.845 120.650 119.800 0.008 0.000 2.329 3007 Q HA 0.066 4.406 4.340 -0.000 0.000 0.208 3007 Q C 0.692 176.698 176.000 0.010 0.000 0.934 3007 Q CA 0.522 56.331 55.803 0.009 0.000 0.951 3007 Q CB 0.156 28.900 28.738 0.009 0.000 1.017 3007 Q HN 0.392 nan 8.270 nan 0.000 0.490 3008 K N -0.541 119.864 120.400 0.009 0.000 2.021 3008 K HA -0.044 4.276 4.320 -0.000 0.000 0.205 3008 K C 1.732 178.337 176.600 0.010 0.000 1.047 3008 K CA 1.097 57.389 56.287 0.008 0.000 0.943 3008 K CB -0.036 32.468 32.500 0.007 0.000 0.725 3008 K HN 0.238 nan 8.250 nan 0.000 0.439 3009 A N 0.975 123.801 122.820 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 0.860 52.904 52.037 0.011 0.000 0.652 3009 A CB -0.316 18.689 19.000 0.010 0.000 0.808 3009 A HN 0.360 nan 8.150 nan 0.000 0.449 3010 L N -0.522 120.710 121.223 0.015 0.000 2.051 3010 L HA 0.262 4.602 4.340 -0.000 0.000 0.202 3010 L C 2.437 179.320 176.870 0.020 0.000 1.097 3010 L CA 1.914 56.765 54.840 0.018 0.000 0.762 3010 L CB -0.813 41.256 42.059 0.017 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 0.146 4.466 4.320 -0.000 0.000 0.213 3011 A C 1.860 179.455 177.584 0.017 0.000 1.183 3011 A CA 1.539 53.587 52.037 0.018 0.000 0.719 3011 A CB -0.961 18.049 19.000 0.015 0.000 0.771 3011 A HN 0.637 nan 8.150 nan 0.000 0.484 3012 A N -1.141 121.689 122.820 0.017 0.000 2.016 3012 A HA 0.564 4.884 4.320 -0.000 0.000 0.202 3012 A C 2.218 179.814 177.584 0.020 0.000 1.632 3012 A CA 0.931 52.978 52.037 0.016 0.000 0.891 3012 A CB -0.946 18.061 19.000 0.012 0.000 1.103 3012 A HN 0.988 nan 8.150 nan 0.000 0.547 3013 A N 0.297 123.130 122.820 0.022 0.000 2.131 3013 A HA 0.015 4.335 4.320 -0.000 0.000 0.220 3013 A C 1.992 179.599 177.584 0.038 0.000 1.158 3013 A CA 1.274 53.327 52.037 0.027 0.000 0.665 3013 A CB -0.770 18.247 19.000 0.027 0.000 0.795 3013 A HN 0.487 nan 8.150 nan 0.000 0.460 3014 L N -0.805 120.441 121.223 0.038 0.000 1.924 3014 L HA -0.192 4.148 4.340 -0.000 0.000 0.222 3014 L C 2.869 179.770 176.870 0.052 0.000 1.081 3014 L CA 1.534 56.401 54.840 0.047 0.000 0.780 3014 L CB -1.273 40.810 42.059 0.040 0.000 0.891 3014 L HN 0.442 nan 8.230 nan 0.000 0.434 3015 G N -1.258 107.567 108.800 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 1.475 176.397 174.900 0.037 0.000 1.109 3015 G CA 0.302 45.425 45.100 0.039 0.000 0.749 3015 G HN 0.366 nan 8.290 nan 0.000 0.568 3016 Q N -0.078 119.740 119.800 0.031 0.000 2.152 3016 Q HA -0.126 4.214 4.340 -0.000 0.000 0.206 3016 Q C 2.636 178.650 176.000 0.023 0.000 0.985 3016 Q CA 0.967 56.780 55.803 0.016 0.000 0.863 3016 Q CB -0.224 28.523 28.738 0.016 0.000 0.904 3016 Q HN 0.508 nan 8.270 nan 0.000 0.422 3017 I N 0.153 120.773 120.570 0.084 0.000 2.406 3017 I HA -0.120 4.050 4.170 -0.000 0.000 0.249 3017 I C 2.040 178.284 176.117 0.212 0.000 1.122 3017 I CA 0.801 62.214 61.300 0.189 0.000 1.431 3017 I CB -1.176 36.963 38.000 0.231 0.000 1.087 3017 I HN 0.201 nan 8.210 nan 0.000 0.424 3018 E N 1.163 121.441 120.200 0.131 0.000 2.077 3018 E HA -0.246 4.104 4.350 -0.000 0.000 0.193 3018 E C 2.195 178.837 176.600 0.070 0.000 0.989 3018 E CA 1.208 57.675 56.400 0.112 0.000 0.800 3018 E CB 0.014 29.758 29.700 0.073 0.000 0.746 3018 E HN 0.374 nan 8.360 nan 0.000 0.452 3019 K N 0.643 121.056 120.400 0.021 0.000 2.057 3019 K HA -0.169 4.151 4.320 -0.000 0.000 0.206 3019 K C 2.158 178.704 176.600 -0.090 0.000 1.050 3019 K CA 1.138 57.411 56.287 -0.023 0.000 0.935 3019 K CB 0.090 32.571 32.500 -0.031 0.000 0.715 3019 K HN 0.074 nan 8.250 nan 0.000 0.439 3020 Q N -1.097 118.588 119.800 -0.192 0.000 2.167 3020 Q HA -0.125 4.215 4.340 -0.000 0.000 0.202 3020 Q C 1.052 176.682 176.000 -0.617 0.000 0.970 3020 Q CA 1.457 56.964 55.803 -0.495 0.000 0.855 3020 Q CB 0.158 28.420 28.738 -0.793 0.000 0.911 3020 Q HN 0.230 nan 8.270 nan 0.000 0.438 3021 F N -1.647 118.312 119.950 0.016 0.000 2.294 3021 F HA 0.384 4.911 4.527 -0.000 0.000 0.241 3021 F C 0.973 176.785 175.800 0.019 0.000 1.009 3021 F CA 0.044 58.056 58.000 0.019 0.000 1.165 3021 F CB -0.146 38.868 39.000 0.024 0.000 1.445 3021 F HN -0.151 nan 8.300 nan 0.000 0.632 3022 G N 0.166 109.122 108.800 0.259 0.000 2.638 3022 G HA2 0.431 4.391 3.960 -0.000 0.000 0.302 3022 G HA3 0.431 4.391 3.960 -0.000 0.000 0.302 3022 G C -1.587 173.378 174.900 0.109 0.000 1.365 3022 G CA -0.749 44.435 45.100 0.139 0.000 0.987 3022 G HN 0.012 nan 8.290 nan 0.000 0.495 3023 K N 0.856 121.297 120.400 0.069 0.000 2.336 3023 K HA 0.443 4.763 4.320 -0.000 0.000 0.290 3023 K C 0.941 177.571 176.600 0.050 0.000 1.067 3023 K CA 1.046 57.365 56.287 0.053 0.000 0.962 3023 K CB 0.078 32.598 32.500 0.033 0.000 1.008 3023 K HN 1.308 nan 8.250 nan 0.000 0.467 3024 G N 2.653 111.488 108.800 0.058 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 0.046 174.980 174.900 0.056 0.000 1.071 3024 G CA 0.134 45.264 45.100 0.050 0.000 0.788 3024 G HN 0.623 nan 8.290 nan 0.000 0.491 3025 S N -0.922 114.823 115.700 0.074 0.000 2.651 3025 S HA 0.694 5.164 4.470 -0.000 0.000 0.246 3025 S C 0.221 174.865 174.600 0.074 0.000 1.039 3025 S CA 0.157 58.400 58.200 0.072 0.000 1.013 3025 S CB 0.581 63.824 63.200 0.071 0.000 0.861 3025 S HN 1.576 nan 8.310 nan 0.000 0.485 3026 I N 0.953 121.570 120.570 0.078 0.000 2.787 3026 I HA 0.640 4.810 4.170 -0.000 0.000 0.294 3026 I C -1.861 174.303 176.117 0.078 0.000 1.365 3026 I CA -1.071 60.279 61.300 0.084 0.000 1.029 3026 I CB 1.987 40.035 38.000 0.081 0.000 1.313 3026 I HN 0.418 nan 8.210 nan 0.000 0.431 3027 M N 4.578 124.229 119.600 0.085 0.000 2.895 3027 M HA 0.506 4.986 4.480 -0.000 0.000 0.271 3027 M C -1.714 174.633 176.300 0.078 0.000 1.174 3027 M CA -1.051 54.292 55.300 0.073 0.000 0.816 3027 M CB 1.769 34.405 32.600 0.061 0.000 1.647 3027 M HN 0.449 nan 8.290 nan 0.000 0.506 3028 R N 0.771 121.308 120.500 0.062 0.000 2.543 3028 R HA 0.375 4.715 4.340 -0.000 0.000 0.277 3028 R C 0.528 176.865 176.300 0.062 0.000 1.074 3028 R CA -0.213 55.921 56.100 0.057 0.000 1.076 3028 R CB 0.842 31.167 30.300 0.042 0.000 0.993 3028 R HN 0.662 nan 8.270 nan 0.000 0.459 3029 L N 1.190 122.453 121.223 0.066 0.000 2.418 3029 L HA 0.047 4.387 4.340 -0.000 0.000 0.218 3029 L C 1.578 178.483 176.870 0.058 0.000 1.125 3029 L CA 0.781 55.668 54.840 0.078 0.000 0.835 3029 L CB 0.128 42.241 42.059 0.089 0.000 0.953 3029 L HN 0.790 nan 8.230 nan 0.000 0.454 3030 G N -0.047 108.779 108.800 0.042 0.000 3.943 3030 G HA2 0.148 4.108 3.960 -0.000 0.000 0.275 3030 G HA3 0.148 4.108 3.960 -0.000 0.000 0.275 3030 G C -0.058 174.861 174.900 0.030 0.000 1.234 3030 G CA -0.210 44.910 45.100 0.033 0.000 1.522 3030 G HN -0.049 nan 8.290 nan 0.000 0.636 3031 E N 0.222 120.441 120.200 0.033 0.000 2.171 3031 E HA 0.192 4.542 4.350 -0.000 0.000 0.271 3031 E C -0.117 176.497 176.600 0.023 0.000 0.916 3031 E CA -0.491 55.926 56.400 0.028 0.000 0.774 3031 E CB 2.062 31.780 29.700 0.031 0.000 1.128 3031 E HN 0.113 nan 8.360 nan 0.000 0.403 3032 D N 1.444 121.855 120.400 0.019 0.000 2.117 3032 D HA -0.081 4.559 4.640 -0.000 0.000 0.198 3032 D C 0.327 176.635 176.300 0.014 0.000 0.982 3032 D CA 0.824 54.833 54.000 0.016 0.000 0.828 3032 D CB 0.069 40.878 40.800 0.015 0.000 0.967 3032 D HN 0.092 nan 8.370 nan 0.000 0.464 3033 R N 1.525 122.034 120.500 0.015 0.000 3.253 3033 R HA 0.019 4.359 4.340 -0.000 0.000 0.319 3033 R C 0.055 176.362 176.300 0.012 0.000 1.047 3033 R CA 0.001 56.109 56.100 0.014 0.000 0.970 3033 R CB -0.551 29.760 30.300 0.018 0.000 1.000 3033 R HN 0.221 nan 8.270 nan 0.000 0.423 3034 S N 2.348 118.053 115.700 0.007 0.000 2.713 3034 S HA 0.571 5.041 4.470 -0.000 0.000 0.283 3034 S C 0.382 174.984 174.600 0.003 0.000 1.161 3034 S CA -0.977 57.225 58.200 0.003 0.000 0.999 3034 S CB 1.700 64.899 63.200 -0.002 0.000 1.039 3034 S HN 0.320 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 0.482 4.962 4.480 -0.000 0.000 0.274 3035 M C -1.147 175.151 176.300 -0.004 0.000 1.137 3035 M CA -0.820 54.480 55.300 0.000 0.000 0.897 3035 M CB 0.417 33.018 32.600 0.002 0.000 1.567 3035 M HN 0.472 nan 8.290 nan 0.000 0.536 3036 D N 1.146 121.543 120.400 -0.003 0.000 2.396 3036 D HA 0.524 5.164 4.640 -0.000 0.000 0.225 3036 D C -1.301 174.994 176.300 -0.009 0.000 1.121 3036 D CA 0.178 54.175 54.000 -0.006 0.000 0.853 3036 D CB 0.860 41.657 40.800 -0.004 0.000 1.043 3036 D HN 0.235 nan 8.370 nan 0.000 0.500 3037 V N 1.368 121.275 119.914 -0.012 0.000 3.087 3037 V HA 0.271 4.391 4.120 -0.000 0.000 0.306 3037 V C 0.151 176.234 176.094 -0.018 0.000 1.187 3037 V CA -1.179 61.112 62.300 -0.015 0.000 0.999 3037 V CB 2.241 34.054 31.823 -0.017 0.000 1.049 3037 V HN 0.319 nan 8.190 nan 0.000 0.431 3038 E N 2.271 122.460 120.200 -0.019 0.000 2.493 3038 E HA 0.227 4.577 4.350 -0.000 0.000 0.255 3038 E C -0.320 176.264 176.600 -0.028 0.000 0.999 3038 E CA 0.287 56.673 56.400 -0.023 0.000 0.934 3038 E CB 0.706 30.392 29.700 -0.022 0.000 0.940 3038 E HN 0.841 nan 8.360 nan 0.000 0.473 3039 T N 1.534 116.069 114.554 -0.032 0.000 2.815 3039 T HA 0.396 4.746 4.350 -0.000 0.000 0.289 3039 T C 0.105 174.777 174.700 -0.047 0.000 1.000 3039 T CA -0.976 61.102 62.100 -0.038 0.000 0.958 3039 T CB 0.669 69.514 68.868 -0.038 0.000 0.944 3039 T HN 0.126 nan 8.240 nan 0.000 0.442 3040 I N 2.420 122.959 120.570 -0.052 0.000 2.575 3040 I HA 0.270 4.440 4.170 -0.000 0.000 0.285 3040 I C 1.146 177.216 176.117 -0.078 0.000 1.085 3040 I CA -0.436 60.827 61.300 -0.063 0.000 1.403 3040 I CB 1.083 39.046 38.000 -0.061 0.000 1.409 3040 I HN 0.719 nan 8.210 nan 0.000 0.557 3041 S N 2.829 118.471 115.700 -0.096 0.000 2.562 3041 S HA 0.083 4.553 4.470 -0.000 0.000 0.281 3041 S C 1.412 175.930 174.600 -0.137 0.000 1.333 3041 S CA -0.120 58.005 58.200 -0.125 0.000 1.052 3041 S CB 0.411 63.517 63.200 -0.158 0.000 0.884 3041 S HN 0.809 nan 8.310 nan 0.000 0.506 3042 T N 1.623 116.089 114.554 -0.147 0.000 3.088 3042 T HA 0.312 4.662 4.350 -0.000 0.000 0.259 3042 T C 1.447 176.035 174.700 -0.187 0.000 1.122 3042 T CA 0.850 62.865 62.100 -0.141 0.000 1.095 3042 T CB -0.228 68.567 68.868 -0.121 0.000 0.930 3042 T HN 1.248 nan 8.240 nan 0.000 0.508 3043 G N 0.880 109.534 108.800 -0.244 0.000 2.397 3043 G HA2 -0.275 3.685 3.960 -0.000 0.000 0.211 3043 G HA3 -0.275 3.685 3.960 -0.000 0.000 0.211 3043 G C 0.556 175.207 174.900 -0.415 0.000 1.077 3043 G CA 0.425 45.342 45.100 -0.305 0.000 0.649 3043 G HN 0.992 nan 8.290 nan 0.000 0.511 3044 S N -0.362 115.065 115.700 -0.455 0.000 2.625 3044 S HA 0.668 5.138 4.470 -0.000 0.000 0.258 3044 S C 1.227 175.604 174.600 -0.371 0.000 1.256 3044 S CA 0.595 58.449 58.200 -0.577 0.000 0.983 3044 S CB 1.045 63.808 63.200 -0.727 0.000 1.032 3044 S HN 0.772 nan 8.310 nan 0.000 0.572 3045 L N 0.379 121.433 121.223 -0.280 0.000 2.688 3045 L HA 0.229 4.569 4.340 -0.000 0.000 0.216 3045 L C 2.389 179.207 176.870 -0.088 0.000 1.036 3045 L CA 1.504 56.249 54.840 -0.158 0.000 0.906 3045 L CB -1.019 40.982 42.059 -0.097 0.000 1.501 3045 L HN 0.889 nan 8.230 nan 0.000 0.489 3046 S N -0.340 115.327 115.700 -0.055 0.000 2.453 3046 S HA -0.108 4.362 4.470 -0.000 0.000 0.231 3046 S C 1.926 176.539 174.600 0.022 0.000 1.005 3046 S CA 0.714 58.923 58.200 0.015 0.000 0.949 3046 S CB -0.479 62.768 63.200 0.078 0.000 0.774 3046 S HN 0.388 nan 8.310 nan 0.000 0.510 3047 L N 1.765 122.982 121.223 -0.009 0.000 2.017 3047 L HA -0.139 4.201 4.340 -0.000 0.000 0.208 3047 L C 1.285 178.138 176.870 -0.029 0.000 1.073 3047 L CA 1.991 56.833 54.840 0.005 0.000 0.745 3047 L CB -0.506 41.537 42.059 -0.026 0.000 0.894 3047 L HN 0.221 nan 8.230 nan 0.000 0.432 3048 D N -0.518 119.844 120.400 -0.063 0.000 2.371 3048 D HA -0.072 4.568 4.640 -0.000 0.000 0.221 3048 D C 1.857 178.135 176.300 -0.037 0.000 0.986 3048 D CA 0.831 54.795 54.000 -0.060 0.000 0.899 3048 D CB 0.132 40.881 40.800 -0.086 0.000 0.902 3048 D HN 0.394 nan 8.370 nan 0.000 0.530 3049 I N 0.076 120.632 120.570 -0.023 0.000 3.081 3049 I HA 0.036 4.206 4.170 -0.000 0.000 0.274 3049 I C 2.132 178.250 176.117 0.002 0.000 1.178 3049 I CA 0.267 61.563 61.300 -0.006 0.000 1.460 3049 I CB 0.219 38.222 38.000 0.005 0.000 1.137 3049 I HN -0.054 nan 8.210 nan 0.000 0.443 3050 A N 0.474 123.298 122.820 0.007 0.000 2.072 3050 A HA 0.024 4.344 4.320 -0.000 0.000 0.216 3050 A C 2.186 179.765 177.584 -0.008 0.000 1.156 3050 A CA 0.672 52.717 52.037 0.012 0.000 0.701 3050 A CB -0.457 18.561 19.000 0.030 0.000 0.816 3050 A HN 0.304 nan 8.150 nan 0.000 0.458 3051 L N -1.301 119.910 121.223 -0.020 0.000 2.017 3051 L HA -0.073 4.267 4.340 -0.000 0.000 0.208 3051 L C 2.251 179.104 176.870 -0.029 0.000 1.073 3051 L CA 1.454 56.273 54.840 -0.035 0.000 0.745 3051 L CB -0.408 41.626 42.059 -0.042 0.000 0.894 3051 L HN 0.593 nan 8.230 nan 0.000 0.432 3052 G N -1.769 107.020 108.800 -0.019 0.000 2.234 3052 G HA2 -0.328 3.632 3.960 -0.000 0.000 0.235 3052 G HA3 -0.328 3.632 3.960 -0.000 0.000 0.235 3052 G C 0.962 175.854 174.900 -0.014 0.000 0.997 3052 G CA 0.563 45.656 45.100 -0.011 0.000 0.623 3052 G HN 0.491 nan 8.290 nan 0.000 0.514 3053 A N -0.559 122.248 122.820 -0.022 0.000 2.063 3053 A HA 0.612 4.932 4.320 -0.000 0.000 0.211 3053 A C 2.530 180.098 177.584 -0.026 0.000 1.177 3053 A CA 2.190 54.213 52.037 -0.023 0.000 0.759 3053 A CB -0.119 18.864 19.000 -0.028 0.000 0.857 3053 A HN 2.416 nan 8.150 nan 0.000 0.468 3054 G N -3.096 105.686 108.800 -0.032 0.000 2.229 3054 G HA2 0.393 4.353 3.960 -0.000 0.000 0.189 3054 G HA3 0.393 4.353 3.960 -0.000 0.000 0.189 3054 G C 0.949 175.817 174.900 -0.052 0.000 1.000 3054 G CA 0.370 45.447 45.100 -0.038 0.000 0.663 3054 G HN 2.158 nan 8.290 nan 0.000 0.493 3055 G N -1.091 107.678 108.800 -0.052 0.000 2.352 3055 G HA2 0.455 4.415 3.960 -0.000 0.000 0.283 3055 G HA3 0.455 4.415 3.960 -0.000 0.000 0.283 3055 G C -0.828 174.040 174.900 -0.053 0.000 1.308 3055 G CA -0.447 44.617 45.100 -0.061 0.000 0.892 3055 G HN 0.933 nan 8.290 nan 0.000 0.504 3056 L N 1.391 122.582 121.223 -0.054 0.000 2.367 3056 L HA 0.346 4.686 4.340 -0.000 0.000 0.275 3056 L C -2.088 174.758 176.870 -0.040 0.000 1.129 3056 L CA -1.494 53.318 54.840 -0.047 0.000 0.839 3056 L CB 0.979 43.011 42.059 -0.046 0.000 1.133 3056 L HN 0.186 nan 8.230 nan 0.000 0.453 3057 P HA 0.038 nan 4.420 nan 0.000 0.265 3057 P C -0.211 177.073 177.300 -0.026 0.000 1.222 3057 P CA 0.018 63.101 63.100 -0.030 0.000 0.767 3057 P CB 0.370 32.053 31.700 -0.028 0.000 0.801 3058 M N 3.159 122.744 119.600 -0.026 0.000 2.268 3058 M HA 0.145 4.625 4.480 -0.000 0.000 0.349 3058 M C 1.341 177.628 176.300 -0.021 0.000 1.485 3058 M CA 0.917 56.203 55.300 -0.024 0.000 1.094 3058 M CB -0.821 31.764 32.600 -0.025 0.000 1.843 3058 M HN 0.782 nan 8.290 nan 0.000 0.460 3059 G N 3.829 112.617 108.800 -0.020 0.000 2.212 3059 G HA2 -0.194 3.766 3.960 -0.000 0.000 0.255 3059 G HA3 -0.194 3.766 3.960 -0.000 0.000 0.255 3059 G C 0.147 175.036 174.900 -0.019 0.000 1.062 3059 G CA -0.213 44.876 45.100 -0.019 0.000 0.815 3059 G HN 0.611 nan 8.290 nan 0.000 0.497 3060 R N -1.202 119.289 120.500 -0.014 0.000 3.150 3060 R HA 0.752 5.092 4.340 -0.000 0.000 0.236 3060 R C 0.143 176.450 176.300 0.012 0.000 1.469 3060 R CA -0.927 55.166 56.100 -0.013 0.000 1.045 3060 R CB 0.715 31.006 30.300 -0.015 0.000 1.481 3060 R HN 0.209 nan 8.270 nan 0.000 0.506 3061 I N 0.911 121.498 120.570 0.029 0.000 2.530 3061 I HA 0.394 4.564 4.170 -0.000 0.000 0.297 3061 I C -0.670 175.488 176.117 0.068 0.000 1.011 3061 I CA -1.014 60.339 61.300 0.088 0.000 1.107 3061 I CB 2.256 40.344 38.000 0.147 0.000 1.285 3061 I HN 0.002 nan 8.210 nan 0.000 0.436 3062 V N 5.375 125.347 119.914 0.097 0.000 2.577 3062 V HA 0.288 4.408 4.120 -0.000 0.000 0.303 3062 V C -0.455 175.694 176.094 0.091 0.000 1.042 3062 V CA -0.554 61.774 62.300 0.047 0.000 0.872 3062 V CB 2.089 33.917 31.823 0.009 0.000 0.998 3062 V HN 0.722 nan 8.190 nan 0.000 0.423 3063 E N 5.285 125.501 120.200 0.026 0.000 2.158 3063 E HA 0.592 4.942 4.350 -0.000 0.000 0.271 3063 E C -1.431 175.130 176.600 -0.066 0.000 0.911 3063 E CA -0.555 55.866 56.400 0.035 0.000 0.767 3063 E CB 1.608 31.307 29.700 -0.001 0.000 1.120 3063 E HN 0.623 nan 8.360 nan 0.000 0.405 3064 I N 6.247 126.815 120.570 -0.003 0.000 2.404 3064 I HA 0.378 4.548 4.170 -0.000 0.000 0.293 3064 I C -0.641 175.522 176.117 0.077 0.000 0.992 3064 I CA -0.746 60.532 61.300 -0.037 0.000 1.149 3064 I CB 1.029 39.036 38.000 0.012 0.000 1.315 3064 I HN 0.574 nan 8.210 nan 0.000 0.446 3065 Y N 3.877 124.198 120.300 0.034 0.000 2.638 3065 Y HA 0.947 5.497 4.550 -0.000 0.000 0.339 3065 Y C -0.196 175.720 175.900 0.025 0.000 1.084 3065 Y CA -1.126 56.992 58.100 0.030 0.000 1.068 3065 Y CB 2.321 40.794 38.460 0.023 0.000 1.294 3065 Y HN 0.668 nan 8.280 nan 0.000 0.480 3066 G N 0.758 109.730 108.800 0.287 0.000 2.321 3066 G HA2 0.251 4.211 3.960 -0.000 0.000 0.339 3066 G HA3 0.251 4.211 3.960 -0.000 0.000 0.339 3066 G C -3.488 171.445 174.900 0.055 0.000 1.518 3066 G CA -1.214 43.966 45.100 0.134 0.000 0.994 3066 G HN 0.498 nan 8.290 nan 0.000 0.668 3067 P HA 0.145 nan 4.420 nan 0.000 0.270 3067 P C 0.307 177.624 177.300 0.029 0.000 1.216 3067 P CA 0.247 63.355 63.100 0.012 0.000 0.788 3067 P CB 0.354 32.059 31.700 0.008 0.000 0.883 3068 E N -0.178 120.037 120.200 0.025 0.000 2.373 3068 E HA 0.174 4.524 4.350 -0.000 0.000 0.267 3068 E C -0.409 176.213 176.600 0.037 0.000 1.032 3068 E CA -0.585 55.835 56.400 0.033 0.000 0.889 3068 E CB -0.134 29.583 29.700 0.030 0.000 0.984 3068 E HN 0.293 nan 8.360 nan 0.000 0.425 3069 S N 1.455 117.181 115.700 0.042 0.000 3.706 3069 S HA -0.186 4.284 4.470 -0.000 0.000 0.363 3069 S C 0.635 175.259 174.600 0.039 0.000 0.999 3069 S CA 0.828 59.053 58.200 0.042 0.000 1.143 3069 S CB -1.884 61.346 63.200 0.050 0.000 0.902 3069 S HN 0.767 nan 8.310 nan 0.000 0.476 3070 S N -0.517 115.206 115.700 0.038 0.000 2.497 3070 S HA 0.504 4.974 4.470 -0.000 0.000 0.221 3070 S C 1.543 176.158 174.600 0.026 0.000 1.037 3070 S CA 0.691 58.912 58.200 0.034 0.000 0.920 3070 S CB 0.833 64.059 63.200 0.043 0.000 0.800 3070 S HN 1.951 nan 8.310 nan 0.000 0.505 3071 G N 1.217 110.035 108.800 0.029 0.000 2.198 3071 G HA2 -0.178 3.782 3.960 -0.000 0.000 0.156 3071 G HA3 -0.178 3.782 3.960 -0.000 0.000 0.156 3071 G C 0.552 175.477 174.900 0.041 0.000 1.012 3071 G CA 0.215 45.328 45.100 0.023 0.000 0.692 3071 G HN 0.374 nan 8.290 nan 0.000 0.492 3072 K N 0.054 120.487 120.400 0.054 0.000 1.986 3072 K HA -0.192 4.128 4.320 -0.000 0.000 0.230 3072 K C 2.616 179.253 176.600 0.061 0.000 1.048 3072 K CA 2.761 59.088 56.287 0.067 0.000 1.008 3072 K CB -0.529 32.017 32.500 0.077 0.000 0.737 3072 K HN 0.257 nan 8.250 nan 0.000 0.447 3073 T N 0.137 114.733 114.554 0.070 0.000 2.565 3073 T HA -0.243 4.107 4.350 -0.000 0.000 0.265 3073 T C 1.841 176.539 174.700 -0.003 0.000 1.082 3073 T CA 2.368 64.516 62.100 0.081 0.000 1.173 3073 T CB -0.684 68.250 68.868 0.110 0.000 0.864 3073 T HN 0.426 nan 8.240 nan 0.000 0.425 3074 T N 2.065 116.593 114.554 -0.043 0.000 2.620 3074 T HA -0.168 4.182 4.350 -0.000 0.000 0.267 3074 T C 1.856 176.507 174.700 -0.081 0.000 1.044 3074 T CA 1.580 63.612 62.100 -0.114 0.000 1.161 3074 T CB -0.628 68.196 68.868 -0.075 0.000 0.862 3074 T HN 0.247 nan 8.240 nan 0.000 0.438 3075 L N 0.641 121.856 121.223 -0.013 0.000 1.989 3075 L HA -0.202 4.138 4.340 -0.000 0.000 0.211 3075 L C 2.893 179.739 176.870 -0.039 0.000 1.071 3075 L CA 2.172 57.013 54.840 0.002 0.000 0.749 3075 L CB -0.897 41.194 42.059 0.054 0.000 0.890 3075 L HN 0.499 nan 8.230 nan 0.000 0.431 3076 T N -1.513 113.030 114.554 -0.017 0.000 2.635 3076 T HA -0.295 4.055 4.350 -0.000 0.000 0.267 3076 T C 1.794 176.443 174.700 -0.086 0.000 1.040 3076 T CA 1.794 63.885 62.100 -0.016 0.000 1.156 3076 T CB -0.923 67.987 68.868 0.070 0.000 0.863 3076 T HN 0.263 nan 8.240 nan 0.000 0.430 3077 L N 0.930 122.062 121.223 -0.152 0.000 2.127 3077 L HA -0.079 4.261 4.340 -0.000 0.000 0.211 3077 L C 3.122 179.868 176.870 -0.206 0.000 1.089 3077 L CA 1.398 56.086 54.840 -0.253 0.000 0.757 3077 L CB -0.650 41.204 42.059 -0.340 0.000 0.899 3077 L HN 0.242 nan 8.230 nan 0.000 0.434 3078 Q N -0.818 118.881 119.800 -0.169 0.000 2.291 3078 Q HA -0.094 4.246 4.340 -0.000 0.000 0.205 3078 Q C 2.276 178.183 176.000 -0.155 0.000 0.970 3078 Q CA 1.228 56.935 55.803 -0.161 0.000 0.876 3078 Q CB 0.022 28.669 28.738 -0.152 0.000 0.935 3078 Q HN 0.458 nan 8.270 nan 0.000 0.455 3079 V N 0.302 120.137 119.914 -0.131 0.000 2.446 3079 V HA -0.174 3.946 4.120 -0.000 0.000 0.244 3079 V C 2.239 178.266 176.094 -0.111 0.000 1.039 3079 V CA 1.004 63.235 62.300 -0.116 0.000 1.045 3079 V CB -0.522 31.250 31.823 -0.086 0.000 0.681 3079 V HN 0.212 nan 8.190 nan 0.000 0.459 3080 I N 1.275 121.775 120.570 -0.117 0.000 2.264 3080 I HA -0.256 3.914 4.170 -0.000 0.000 0.248 3080 I C 2.729 178.773 176.117 -0.122 0.000 1.111 3080 I CA 1.515 62.744 61.300 -0.118 0.000 1.382 3080 I CB -0.699 37.205 38.000 -0.161 0.000 1.060 3080 I HN 0.281 nan 8.210 nan 0.000 0.418 3081 A N 1.000 123.737 122.820 -0.138 0.000 1.851 3081 A HA -0.119 4.201 4.320 -0.000 0.000 0.216 3081 A C 2.287 179.803 177.584 -0.112 0.000 1.195 3081 A CA 1.957 53.917 52.037 -0.127 0.000 0.622 3081 A CB -0.859 18.058 19.000 -0.139 0.000 0.831 3081 A HN 0.433 nan 8.150 nan 0.000 0.444 3082 A N -1.302 121.443 122.820 -0.125 0.000 2.327 3082 A HA 0.596 4.916 4.320 -0.000 0.000 0.228 3082 A C 1.699 179.224 177.584 -0.098 0.000 1.275 3082 A CA 1.017 52.981 52.037 -0.122 0.000 0.875 3082 A CB -0.639 18.264 19.000 -0.162 0.000 0.925 3082 A HN 0.845 nan 8.150 nan 0.000 0.493 3083 A N -1.159 121.609 122.820 -0.086 0.000 1.920 3083 A HA 0.124 4.444 4.320 -0.000 0.000 0.209 3083 A C 1.904 179.452 177.584 -0.061 0.000 1.229 3083 A CA 0.993 52.989 52.037 -0.069 0.000 0.671 3083 A CB -0.320 18.641 19.000 -0.064 0.000 0.886 3083 A HN 0.366 nan 8.150 nan 0.000 0.461 3084 Q N -0.092 119.668 119.800 -0.066 0.000 2.268 3084 Q HA -0.163 4.177 4.340 -0.000 0.000 0.210 3084 Q C 1.963 177.933 176.000 -0.050 0.000 0.988 3084 Q CA 1.688 57.456 55.803 -0.057 0.000 0.883 3084 Q CB -0.316 28.382 28.738 -0.067 0.000 0.911 3084 Q HN 0.506 nan 8.270 nan 0.000 0.430 3085 R N -0.141 120.325 120.500 -0.056 0.000 2.280 3085 R HA 0.039 4.379 4.340 -0.000 0.000 0.207 3085 R C -0.002 176.274 176.300 -0.040 0.000 1.043 3085 R CA 0.791 56.862 56.100 -0.049 0.000 1.006 3085 R CB 0.341 30.604 30.300 -0.062 0.000 0.885 3085 R HN 0.116 nan 8.270 nan 0.000 0.467 3086 E N -1.627 118.549 120.200 -0.041 0.000 3.832 3086 E HA 0.214 4.564 4.350 -0.000 0.000 0.250 3086 E C 0.033 176.615 176.600 -0.031 0.000 1.215 3086 E CA 0.207 56.587 56.400 -0.033 0.000 1.179 3086 E CB 0.769 30.449 29.700 -0.033 0.000 1.270 3086 E HN 0.293 nan 8.360 nan 0.000 0.405 3087 G N 1.846 110.628 108.800 -0.029 0.000 4.236 3087 G HA2 -0.393 3.567 3.960 -0.000 0.000 0.222 3087 G HA3 -0.393 3.567 3.960 -0.000 0.000 0.222 3087 G C 0.205 175.088 174.900 -0.028 0.000 1.354 3087 G CA 0.229 45.313 45.100 -0.026 0.000 0.966 3087 G HN 0.331 nan 8.290 nan 0.000 0.624 3088 K N 3.278 123.660 120.400 -0.030 0.000 2.392 3088 K HA 0.019 4.339 4.320 -0.000 0.000 0.259 3088 K C 0.895 177.476 176.600 -0.032 0.000 1.141 3088 K CA 1.562 57.830 56.287 -0.031 0.000 1.208 3088 K CB -0.782 31.697 32.500 -0.035 0.000 0.786 3088 K HN 0.874 nan 8.250 nan 0.000 0.498 3089 T N -0.081 114.457 114.554 -0.027 0.000 2.899 3089 T HA 0.420 4.770 4.350 -0.000 0.000 0.284 3089 T C 0.309 174.994 174.700 -0.024 0.000 1.004 3089 T CA -0.920 61.165 62.100 -0.025 0.000 1.043 3089 T CB 1.221 70.077 68.868 -0.020 0.000 1.013 3089 T HN 0.564 nan 8.240 nan 0.000 0.518 3090 C N 1.588 120.874 119.300 -0.022 0.000 2.547 3090 C HA 0.894 5.354 4.460 -0.000 0.000 0.313 3090 C C 0.247 175.240 174.990 0.006 0.000 1.191 3090 C CA -0.560 58.449 59.018 -0.014 0.000 1.474 3090 C CB 0.753 28.477 27.740 -0.027 0.000 2.081 3090 C HN 1.227 nan 8.230 nan 0.000 0.476 3091 A N 2.232 125.064 122.820 0.020 0.000 2.401 3091 A HA 0.901 5.221 4.320 -0.000 0.000 0.310 3091 A C -1.354 176.293 177.584 0.105 0.000 1.075 3091 A CA -0.296 51.768 52.037 0.046 0.000 0.746 3091 A CB 1.075 20.078 19.000 0.006 0.000 1.277 3091 A HN 0.882 nan 8.150 nan 0.000 0.425 3092 F N 3.953 123.857 119.950 -0.077 0.000 2.771 3092 F HA 0.460 4.987 4.527 -0.000 0.000 0.365 3092 F C -0.810 174.937 175.800 -0.088 0.000 1.169 3092 F CA -1.161 56.787 58.000 -0.086 0.000 1.093 3092 F CB 0.901 39.856 39.000 -0.075 0.000 1.363 3092 F HN 0.402 nan 8.300 nan 0.000 0.496 3093 I N 4.294 124.623 120.570 -0.401 0.000 2.406 3093 I HA 0.058 4.228 4.170 -0.000 0.000 0.293 3093 I C 0.240 176.020 176.117 -0.560 0.000 1.101 3093 I CA 0.246 61.327 61.300 -0.365 0.000 1.334 3093 I CB 0.151 37.985 38.000 -0.277 0.000 1.421 3093 I HN 0.543 nan 8.210 nan 0.000 0.513 3094 D N 5.372 125.492 120.400 -0.466 0.000 3.110 3094 D HA 0.375 5.015 4.640 -0.000 0.000 0.254 3094 D C 1.417 177.495 176.300 -0.371 0.000 1.283 3094 D CA -0.099 53.618 54.000 -0.472 0.000 0.944 3094 D CB 0.701 41.343 40.800 -0.264 0.000 1.066 3094 D HN 0.598 nan 8.370 nan 0.000 0.496 3095 A N 1.185 123.818 122.820 -0.310 0.000 1.958 3095 A HA -0.231 4.089 4.320 -0.000 0.000 0.221 3095 A C 1.980 179.443 177.584 -0.202 0.000 1.178 3095 A CA 1.239 53.132 52.037 -0.241 0.000 0.642 3095 A CB -0.292 18.632 19.000 -0.126 0.000 0.816 3095 A HN 0.469 nan 8.150 nan 0.000 0.453 3096 E N -1.629 118.493 120.200 -0.129 0.000 2.338 3096 E HA -0.137 4.213 4.350 -0.000 0.000 0.197 3096 E C -0.217 176.445 176.600 0.104 0.000 1.007 3096 E CA 0.861 57.263 56.400 0.003 0.000 0.849 3096 E CB -0.242 29.463 29.700 0.007 0.000 0.774 3096 E HN 0.831 nan 8.360 nan 0.000 0.506 3097 H N -1.938 117.131 119.070 -0.002 0.000 2.862 3097 H HA -0.199 4.357 4.556 -0.000 0.000 0.290 3097 H C 0.484 175.838 175.328 0.043 0.000 1.211 3097 H CA 0.261 56.321 56.048 0.019 0.000 1.140 3097 H CB -1.634 28.137 29.762 0.015 0.000 1.341 3097 H HN 0.294 nan 8.280 nan 0.000 0.392 3098 A N 0.638 123.529 122.820 0.119 0.000 3.293 3098 A HA 0.648 4.968 4.320 -0.000 0.000 0.163 3098 A C 0.796 178.471 177.584 0.152 0.000 2.052 3098 A CA -0.107 52.007 52.037 0.129 0.000 1.062 3098 A CB -0.153 18.921 19.000 0.123 0.000 1.908 3098 A HN 1.188 nan 8.150 nan 0.000 0.790 3099 L N -1.621 119.709 121.223 0.179 0.000 3.089 3099 L HA -0.148 4.192 4.340 -0.000 0.000 0.511 3099 L C -1.153 175.794 176.870 0.128 0.000 1.002 3099 L CA 0.817 55.755 54.840 0.163 0.000 1.246 3099 L CB -1.344 40.850 42.059 0.226 0.000 1.087 3099 L HN 0.636 nan 8.230 nan 0.000 0.591 3100 D N 7.489 127.974 120.400 0.142 0.000 2.456 3100 D HA 0.411 5.051 4.640 -0.000 0.000 0.219 3100 D C -1.276 175.085 176.300 0.101 0.000 1.126 3100 D CA -1.822 52.259 54.000 0.134 0.000 0.890 3100 D CB 1.061 41.967 40.800 0.176 0.000 1.025 3100 D HN 0.499 nan 8.370 nan 0.000 0.511 3101 P HA -0.247 nan 4.420 nan 0.000 0.217 3101 P C 1.797 179.114 177.300 0.029 0.000 1.158 3101 P CA 0.891 64.002 63.100 0.019 0.000 0.887 3101 P CB 0.307 32.020 31.700 0.023 0.000 0.792 3102 I N -0.638 119.967 120.570 0.058 0.000 2.065 3102 I HA -0.314 3.856 4.170 -0.000 0.000 0.236 3102 I C 2.681 178.870 176.117 0.120 0.000 1.028 3102 I CA 1.782 63.125 61.300 0.072 0.000 1.299 3102 I CB -2.090 35.953 38.000 0.070 0.000 1.015 3102 I HN 0.009 nan 8.210 nan 0.000 0.396 3103 Y N 1.591 121.884 120.300 -0.011 0.000 2.096 3103 Y HA -0.369 4.181 4.550 -0.000 0.000 0.278 3103 Y C 2.703 178.579 175.900 -0.039 0.000 1.192 3103 Y CA 1.920 60.010 58.100 -0.017 0.000 1.143 3103 Y CB -0.052 38.399 38.460 -0.015 0.000 0.963 3103 Y HN 0.232 nan 8.280 nan 0.000 0.505 3104 A N 0.545 123.321 122.820 -0.073 0.000 1.892 3104 A HA -0.291 4.029 4.320 -0.000 0.000 0.218 3104 A C 2.253 179.752 177.584 -0.142 0.000 1.188 3104 A CA 2.021 53.930 52.037 -0.213 0.000 0.631 3104 A CB -0.943 17.941 19.000 -0.193 0.000 0.822 3104 A HN 0.586 nan 8.150 nan 0.000 0.447 3105 R N -0.190 120.275 120.500 -0.060 0.000 2.083 3105 R HA -0.157 4.183 4.340 -0.000 0.000 0.237 3105 R C 2.110 178.393 176.300 -0.027 0.000 1.137 3105 R CA 1.914 57.990 56.100 -0.040 0.000 0.951 3105 R CB -0.267 30.028 30.300 -0.008 0.000 0.851 3105 R HN 0.540 nan 8.270 nan 0.000 0.434 3106 K N 0.127 120.537 120.400 0.016 0.000 2.281 3106 K HA -0.153 4.167 4.320 -0.000 0.000 0.203 3106 K C 1.952 178.558 176.600 0.010 0.000 1.046 3106 K CA 1.010 57.327 56.287 0.050 0.000 0.938 3106 K CB -0.043 32.543 32.500 0.144 0.000 0.737 3106 K HN 0.234 nan 8.250 nan 0.000 0.458 3107 L N -0.961 120.216 121.223 -0.077 0.000 2.270 3107 L HA 0.018 4.358 4.340 -0.000 0.000 0.210 3107 L C 1.113 177.921 176.870 -0.103 0.000 1.104 3107 L CA 0.753 55.517 54.840 -0.126 0.000 0.804 3107 L CB 0.381 42.279 42.059 -0.268 0.000 0.937 3107 L HN 0.435 nan 8.230 nan 0.000 0.450 3108 G N -0.675 108.069 108.800 -0.093 0.000 2.157 3108 G HA2 -0.135 3.825 3.960 -0.000 0.000 0.114 3108 G HA3 -0.135 3.825 3.960 -0.000 0.000 0.114 3108 G C -0.196 174.651 174.900 -0.089 0.000 1.041 3108 G CA -0.286 44.770 45.100 -0.074 0.000 0.714 3108 G HN -0.015 nan 8.290 nan 0.000 0.492 3109 V N 0.361 120.210 119.914 -0.109 0.000 2.863 3109 V HA 0.518 4.638 4.120 -0.000 0.000 0.307 3109 V C 0.361 176.405 176.094 -0.083 0.000 1.061 3109 V CA -0.820 61.411 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 0.260 nan 8.190 nan 0.000 0.471 3110 D N 2.133 122.489 120.400 -0.074 0.000 2.374 3110 D HA 0.153 4.793 4.640 -0.000 0.000 0.240 3110 D C 0.942 177.209 176.300 -0.055 0.000 1.229 3110 D CA -0.277 53.691 54.000 -0.054 0.000 0.895 3110 D CB 0.950 41.724 40.800 -0.044 0.000 1.046 3110 D HN 0.285 nan 8.370 nan 0.000 0.498 3111 I N 3.026 123.567 120.570 -0.049 0.000 2.361 3111 I HA -0.233 3.937 4.170 -0.000 0.000 0.251 3111 I C 1.318 177.416 176.117 -0.030 0.000 1.133 3111 I CA 1.204 62.476 61.300 -0.046 0.000 1.413 3111 I CB -0.702 37.279 38.000 -0.032 0.000 1.073 3111 I HN 0.345 nan 8.210 nan 0.000 0.424 3112 D N -0.335 120.051 120.400 -0.024 0.000 2.333 3112 D HA -0.023 4.617 4.640 -0.000 0.000 0.208 3112 D C 1.298 177.588 176.300 -0.015 0.000 0.984 3112 D CA 0.458 54.449 54.000 -0.015 0.000 0.873 3112 D CB -0.153 40.640 40.800 -0.011 0.000 0.935 3112 D HN 0.310 nan 8.370 nan 0.000 0.521 3113 N N 0.639 119.325 118.700 -0.022 0.000 2.321 3113 N HA 0.087 4.827 4.740 -0.000 0.000 0.242 3113 N C -0.437 175.058 175.510 -0.025 0.000 1.141 3113 N CA 0.028 53.065 53.050 -0.022 0.000 0.864 3113 N CB 1.058 39.531 38.487 -0.024 0.000 1.100 3113 N HN 0.124 nan 8.380 nan 0.000 0.510 3114 L N 2.086 123.294 121.223 -0.025 0.000 2.581 3114 L HA 0.424 4.764 4.340 -0.000 0.000 0.241 3114 L C -0.972 175.900 176.870 0.003 0.000 1.265 3114 L CA -0.283 54.543 54.840 -0.023 0.000 0.954 3114 L CB -0.004 42.020 42.059 -0.058 0.000 1.269 3114 L HN -0.006 nan 8.230 nan 0.000 0.475 3115 L N 3.393 124.620 121.223 0.006 0.000 2.418 3115 L HA 0.284 4.624 4.340 -0.000 0.000 0.274 3115 L C 0.299 177.184 176.870 0.026 0.000 1.135 3115 L CA -0.111 54.736 54.840 0.012 0.000 0.870 3115 L CB 0.546 42.607 42.059 0.003 0.000 1.154 3115 L HN 0.612 nan 8.230 nan 0.000 0.462 3116 C N 0.564 119.886 119.300 0.036 0.000 3.080 3116 C HA 0.919 5.379 4.460 -0.000 0.000 0.307 3116 C C 0.022 175.022 174.990 0.018 0.000 1.311 3116 C CA -0.947 58.101 59.018 0.051 0.000 1.533 3116 C CB 1.419 29.242 27.740 0.138 0.000 1.970 3116 C HN 0.774 nan 8.230 nan 0.000 0.467 3117 S N 0.424 116.114 115.700 -0.017 0.000 2.566 3117 S HA 0.679 5.149 4.470 -0.000 0.000 0.298 3117 S C -1.032 173.516 174.600 -0.088 0.000 1.083 3117 S CA -0.475 57.698 58.200 -0.046 0.000 0.978 3117 S CB 1.417 64.579 63.200 -0.062 0.000 1.073 3117 S HN 0.849 nan 8.310 nan 0.000 0.491 3118 Q N 1.114 120.865 119.800 -0.081 0.000 2.851 3118 Q HA 0.312 4.652 4.340 -0.000 0.000 0.331 3118 Q C -2.567 173.361 176.000 -0.121 0.000 0.979 3118 Q CA -1.554 54.154 55.803 -0.159 0.000 0.955 3118 Q CB 0.617 29.314 28.738 -0.069 0.000 1.298 3118 Q HN 0.510 nan 8.270 nan 0.000 0.432 3119 P HA -0.022 nan 4.420 nan 0.000 0.269 3119 P C 0.248 177.553 177.300 0.010 0.000 1.217 3119 P CA 0.010 63.080 63.100 -0.051 0.000 0.783 3119 P CB 1.028 32.688 31.700 -0.066 0.000 0.898 3120 D N -0.969 119.454 120.400 0.039 0.000 2.290 3120 D HA -0.013 4.627 4.640 -0.000 0.000 0.224 3120 D C 0.707 177.039 176.300 0.053 0.000 0.967 3120 D CA 1.374 55.416 54.000 0.069 0.000 0.893 3120 D CB -0.144 40.686 40.800 0.049 0.000 1.037 3120 D HN 0.492 nan 8.370 nan 0.000 0.477 3121 T N -2.683 111.889 114.554 0.029 0.000 2.918 3121 T HA 0.523 4.873 4.350 -0.000 0.000 0.286 3121 T C 1.427 176.137 174.700 0.017 0.000 1.026 3121 T CA -0.357 61.758 62.100 0.024 0.000 1.031 3121 T CB 1.979 70.858 68.868 0.020 0.000 1.046 3121 T HN -0.015 nan 8.240 nan 0.000 0.479 3122 G N 0.568 109.380 108.800 0.020 0.000 2.513 3122 G HA2 -0.211 3.749 3.960 -0.000 0.000 0.219 3122 G HA3 -0.211 3.749 3.960 -0.000 0.000 0.219 3122 G C 1.228 176.142 174.900 0.023 0.000 1.160 3122 G CA 0.804 45.918 45.100 0.022 0.000 0.767 3122 G HN 0.859 nan 8.290 nan 0.000 0.571 3123 E N -0.205 120.008 120.200 0.022 0.000 2.031 3123 E HA -0.194 4.156 4.350 -0.000 0.000 0.193 3123 E C 2.480 179.090 176.600 0.016 0.000 0.994 3123 E CA 1.117 57.531 56.400 0.022 0.000 0.800 3123 E CB -0.269 29.443 29.700 0.019 0.000 0.752 3123 E HN 0.596 nan 8.360 nan 0.000 0.447 3124 Q N 0.414 120.220 119.800 0.010 0.000 2.047 3124 Q HA -0.290 4.050 4.340 -0.000 0.000 0.211 3124 Q C 2.147 178.145 176.000 -0.005 0.000 1.005 3124 Q CA 2.158 57.963 55.803 0.003 0.000 0.866 3124 Q CB -0.238 28.501 28.738 0.002 0.000 0.938 3124 Q HN 0.255 nan 8.270 nan 0.000 0.414 3125 A N 0.632 123.445 122.820 -0.012 0.000 1.873 3125 A HA -0.239 4.081 4.320 -0.000 0.000 0.218 3125 A C 2.103 179.679 177.584 -0.012 0.000 1.193 3125 A CA 1.745 53.764 52.037 -0.029 0.000 0.629 3125 A CB -1.016 17.960 19.000 -0.039 0.000 0.826 3125 A HN 0.493 nan 8.150 nan 0.000 0.447 3126 L N -1.270 119.965 121.223 0.019 0.000 1.956 3126 L HA -0.235 4.105 4.340 -0.000 0.000 0.216 3126 L C 2.638 179.526 176.870 0.029 0.000 1.073 3126 L CA 2.039 56.906 54.840 0.046 0.000 0.762 3126 L CB -0.495 41.602 42.059 0.065 0.000 0.889 3126 L HN 0.364 nan 8.230 nan 0.000 0.433 3127 E N -0.324 119.889 120.200 0.022 0.000 2.401 3127 E HA -0.142 4.208 4.350 -0.000 0.000 0.199 3127 E C 1.932 178.535 176.600 0.005 0.000 1.023 3127 E CA 0.586 56.995 56.400 0.016 0.000 0.859 3127 E CB -0.030 29.679 29.700 0.015 0.000 0.780 3127 E HN 0.431 nan 8.360 nan 0.000 0.523 3128 I N -0.184 120.383 120.570 -0.005 0.000 2.193 3128 I HA -0.280 3.890 4.170 -0.000 0.000 0.240 3128 I C 2.274 178.379 176.117 -0.020 0.000 1.084 3128 I CA 1.013 62.304 61.300 -0.015 0.000 1.365 3128 I CB -0.249 37.735 38.000 -0.027 0.000 1.064 3128 I HN 0.346 nan 8.210 nan 0.000 0.410 3129 C N -0.593 118.690 119.300 -0.029 0.000 2.432 3129 C HA -0.098 4.362 4.460 -0.000 0.000 0.280 3129 C C 2.449 177.431 174.990 -0.013 0.000 1.353 3129 C CA 0.173 59.168 59.018 -0.038 0.000 1.766 3129 C CB -0.953 26.741 27.740 -0.078 0.000 1.924 3129 C HN 0.498 nan 8.230 nan 0.000 0.509 3130 D N 2.159 122.563 120.400 0.006 0.000 2.092 3130 D HA -0.118 4.522 4.640 -0.000 0.000 0.193 3130 D C 2.302 178.605 176.300 0.005 0.000 0.994 3130 D CA 2.393 56.402 54.000 0.015 0.000 0.828 3130 D CB -0.393 40.421 40.800 0.024 0.000 0.963 3130 D HN 0.540 nan 8.370 nan 0.000 0.450 3131 A N -0.229 122.591 122.820 0.001 0.000 2.216 3131 A HA 0.014 4.334 4.320 -0.000 0.000 0.214 3131 A C 2.254 179.834 177.584 -0.007 0.000 1.160 3131 A CA 0.542 52.578 52.037 -0.002 0.000 0.725 3131 A CB -0.390 18.609 19.000 -0.002 0.000 0.784 3131 A HN 0.390 nan 8.150 nan 0.000 0.472 3132 L N -1.998 119.217 121.223 -0.012 0.000 2.513 3132 L HA 0.119 4.459 4.340 -0.000 0.000 0.222 3132 L C 2.690 179.551 176.870 -0.016 0.000 1.096 3132 L CA 0.703 55.533 54.840 -0.016 0.000 0.857 3132 L CB -0.362 41.683 42.059 -0.024 0.000 1.026 3132 L HN 0.371 nan 8.230 nan 0.000 0.469 3133 A N 0.802 123.615 122.820 -0.012 0.000 1.929 3133 A HA -0.109 4.211 4.320 -0.000 0.000 0.216 3133 A C 2.352 179.931 177.584 -0.008 0.000 1.176 3133 A CA 0.984 53.015 52.037 -0.010 0.000 0.628 3133 A CB -0.226 18.772 19.000 -0.002 0.000 0.816 3133 A HN 0.303 nan 8.150 nan 0.000 0.444 3134 R N -0.285 120.212 120.500 -0.005 0.000 2.153 3134 R HA 0.080 4.420 4.340 -0.000 0.000 0.218 3134 R C 0.828 177.124 176.300 -0.006 0.000 1.072 3134 R CA 0.747 56.844 56.100 -0.005 0.000 0.990 3134 R CB -0.237 30.062 30.300 -0.002 0.000 0.889 3134 R HN 0.280 nan 8.270 nan 0.000 0.452 3135 S N 1.329 117.024 115.700 -0.008 0.000 3.613 3135 S HA 0.123 4.593 4.470 -0.000 0.000 0.220 3135 S C 0.878 175.472 174.600 -0.010 0.000 1.261 3135 S CA 0.341 58.536 58.200 -0.008 0.000 1.143 3135 S CB -0.667 62.528 63.200 -0.009 0.000 1.315 3135 S HN 0.637 nan 8.310 nan 0.000 0.450 3136 G N 2.092 110.886 108.800 -0.009 0.000 2.651 3136 G HA2 -0.327 3.633 3.960 -0.000 0.000 0.315 3136 G HA3 -0.327 3.633 3.960 -0.000 0.000 0.315 3136 G C 0.359 175.251 174.900 -0.012 0.000 1.258 3136 G CA -0.021 45.073 45.100 -0.010 0.000 1.002 3136 G HN 1.148 nan 8.290 nan 0.000 0.551 3137 A N -0.311 122.502 122.820 -0.012 0.000 3.078 3137 A HA 0.603 4.923 4.320 -0.000 0.000 0.279 3137 A C 0.092 177.667 177.584 -0.015 0.000 1.594 3137 A CA 0.299 52.327 52.037 -0.014 0.000 1.301 3137 A CB 0.041 19.033 19.000 -0.014 0.000 1.162 3137 A HN 1.415 nan 8.150 nan 0.000 0.585 3138 V N 1.986 121.890 119.914 -0.016 0.000 2.318 3138 V HA 0.146 4.266 4.120 -0.000 0.000 0.271 3138 V C 0.310 176.391 176.094 -0.021 0.000 1.030 3138 V CA -0.283 62.007 62.300 -0.018 0.000 0.844 3138 V CB 1.046 32.859 31.823 -0.017 0.000 1.015 3138 V HN 0.723 nan 8.190 nan 0.000 0.460 3139 D N 2.571 122.957 120.400 -0.023 0.000 2.323 3139 D HA 0.109 4.749 4.640 -0.000 0.000 0.209 3139 D C 0.192 176.475 176.300 -0.029 0.000 0.973 3139 D CA 0.986 54.971 54.000 -0.025 0.000 0.874 3139 D CB 1.418 42.203 40.800 -0.026 0.000 0.930 3139 D HN 0.363 nan 8.370 nan 0.000 0.521 3140 V N 0.672 120.568 119.914 -0.030 0.000 3.023 3140 V HA 0.330 4.450 4.120 -0.000 0.000 0.294 3140 V C -1.791 174.283 176.094 -0.033 0.000 1.324 3140 V CA -0.725 61.555 62.300 -0.034 0.000 0.979 3140 V CB 2.353 34.154 31.823 -0.036 0.000 1.093 3140 V HN -0.179 nan 8.190 nan 0.000 0.434 3141 I N 5.830 126.369 120.570 -0.051 0.000 2.498 3141 I HA 0.609 4.779 4.170 -0.000 0.000 0.290 3141 I C -0.765 175.293 176.117 -0.100 0.000 1.032 3141 I CA -0.971 60.287 61.300 -0.069 0.000 1.073 3141 I CB 2.158 40.094 38.000 -0.106 0.000 1.251 3141 I HN 0.317 nan 8.210 nan 0.000 0.426 3142 V N 6.505 126.389 119.914 -0.051 0.000 2.417 3142 V HA 0.367 4.487 4.120 -0.000 0.000 0.291 3142 V C -0.213 175.732 176.094 -0.248 0.000 1.024 3142 V CA -0.729 61.531 62.300 -0.066 0.000 0.861 3142 V CB 2.058 33.995 31.823 0.191 0.000 0.985 3142 V HN 0.478 nan 8.190 nan 0.000 0.436 3143 V N 1.217 120.924 119.914 -0.344 0.000 2.311 3143 V HA 0.610 4.730 4.120 -0.000 0.000 0.275 3143 V C -0.641 175.295 176.094 -0.263 0.000 1.022 3143 V CA -0.473 61.597 62.300 -0.384 0.000 0.830 3143 V CB 1.272 32.780 31.823 -0.526 0.000 1.012 3143 V HN 0.807 nan 8.190 nan 0.000 0.452 3144 D N 3.400 123.587 120.400 -0.355 0.000 2.461 3144 D HA 0.624 5.264 4.640 -0.000 0.000 0.240 3144 D C -0.577 175.608 176.300 -0.192 0.000 1.094 3144 D CA 0.339 54.194 54.000 -0.243 0.000 0.868 3144 D CB 1.732 42.329 40.800 -0.338 0.000 1.062 3144 D HN 0.742 nan 8.370 nan 0.000 0.530 3145 S N 2.221 117.874 115.700 -0.079 0.000 2.579 3145 S HA 0.250 4.720 4.470 -0.000 0.000 0.272 3145 S C 1.075 175.701 174.600 0.042 0.000 1.141 3145 S CA -0.708 57.488 58.200 -0.008 0.000 0.843 3145 S CB 1.347 64.560 63.200 0.022 0.000 1.122 3145 S HN 0.088 nan 8.310 nan 0.000 0.468 3146 V N 3.142 123.122 119.914 0.110 0.000 2.495 3146 V HA -0.307 3.813 4.120 -0.000 0.000 0.260 3146 V C 2.723 178.855 176.094 0.063 0.000 1.097 3146 V CA 2.705 65.076 62.300 0.118 0.000 1.105 3146 V CB -1.773 30.123 31.823 0.122 0.000 0.678 3146 V HN 0.910 nan 8.190 nan 0.000 0.469 3147 A N 0.458 123.308 122.820 0.050 0.000 1.859 3147 A HA -0.268 4.052 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 2.580 54.638 52.037 0.035 0.000 0.661 3147 A CB -1.140 17.880 19.000 0.034 0.000 0.842 3147 A HN 0.853 nan 8.150 nan 0.000 0.455 3148 A N -1.792 121.046 122.820 0.030 0.000 2.247 3148 A HA 0.347 4.667 4.320 -0.000 0.000 0.205 3148 A C 0.790 178.392 177.584 0.030 0.000 1.261 3148 A CA 0.561 52.618 52.037 0.033 0.000 0.853 3148 A CB -0.488 18.539 19.000 0.044 0.000 0.793 3148 A HN 0.347 nan 8.150 nan 0.000 0.487 3149 L N 0.829 122.070 121.223 0.031 0.000 2.984 3149 L HA 0.151 4.491 4.340 -0.000 0.000 0.246 3149 L C 0.984 177.869 176.870 0.024 0.000 1.268 3149 L CA 0.390 55.249 54.840 0.032 0.000 1.054 3149 L CB -0.153 41.934 42.059 0.047 0.000 1.393 3149 L HN 0.343 nan 8.230 nan 0.000 0.532 3150 T N -2.123 112.443 114.554 0.020 0.000 2.729 3150 T HA 0.550 4.900 4.350 -0.000 0.000 0.296 3150 T C -1.583 173.127 174.700 0.015 0.000 0.928 3150 T CA -1.427 60.681 62.100 0.014 0.000 1.045 3150 T CB 0.323 69.197 68.868 0.009 0.000 0.902 3150 T HN 0.002 nan 8.240 nan 0.000 0.500 3167 A N 0.181 122.998 122.820 -0.004 0.000 2.247 3167 A HA 0.623 4.943 4.320 -0.000 0.000 0.205 3167 A C 1.656 179.234 177.584 -0.009 0.000 1.261 3167 A CA 1.427 53.463 52.037 -0.003 0.000 0.853 3167 A CB -0.228 18.771 19.000 -0.001 0.000 0.793 3167 A HN 1.087 nan 8.150 nan 0.000 0.487 3168 A N -1.481 121.331 122.820 -0.013 0.000 2.533 3168 A HA 0.246 4.566 4.320 -0.000 0.000 0.180 3168 A C 1.744 179.316 177.584 -0.021 0.000 1.566 3168 A CA 0.143 52.167 52.037 -0.023 0.000 1.153 3168 A CB 0.158 19.142 19.000 -0.027 0.000 1.462 3168 A HN 0.354 nan 8.150 nan 0.000 0.523 3169 R N -0.440 120.051 120.500 -0.015 0.000 2.119 3169 R HA 0.090 4.430 4.340 -0.000 0.000 0.222 3169 R C 2.139 178.437 176.300 -0.004 0.000 1.088 3169 R CA 1.386 57.479 56.100 -0.012 0.000 0.984 3169 R CB -0.276 30.017 30.300 -0.010 0.000 0.884 3169 R HN 0.625 nan 8.270 nan 0.000 0.447 3170 M N 0.175 119.775 119.600 0.000 0.000 2.117 3170 M HA -0.165 4.315 4.480 -0.000 0.000 0.262 3170 M C 1.836 178.144 176.300 0.014 0.000 1.065 3170 M CA 1.516 56.822 55.300 0.010 0.000 1.114 3170 M CB 0.145 32.752 32.600 0.012 0.000 1.361 3170 M HN 0.100 nan 8.290 nan 0.000 0.408 3171 M N -0.672 118.930 119.600 0.002 0.000 2.062 3171 M HA -0.144 4.336 4.480 -0.000 0.000 0.259 3171 M C 2.433 178.736 176.300 0.004 0.000 1.076 3171 M CA 1.773 57.071 55.300 -0.004 0.000 1.122 3171 M CB -1.550 31.024 32.600 -0.044 0.000 1.312 3171 M HN 0.392 nan 8.290 nan 0.000 0.412 3172 S N -0.029 115.662 115.700 -0.016 0.000 2.461 3172 S HA -0.244 4.226 4.470 -0.000 0.000 0.246 3172 S C 1.724 176.338 174.600 0.023 0.000 1.007 3172 S CA 1.677 59.865 58.200 -0.020 0.000 0.976 3172 S CB -0.105 63.067 63.200 -0.047 0.000 0.763 3172 S HN 0.420 nan 8.310 nan 0.000 0.508 3173 Q N 0.994 120.811 119.800 0.028 0.000 1.858 3173 Q HA 0.217 4.557 4.340 -0.000 0.000 0.224 3173 Q C 2.327 178.366 176.000 0.065 0.000 0.980 3173 Q CA 1.840 57.667 55.803 0.040 0.000 0.868 3173 Q CB -0.733 28.023 28.738 0.031 0.000 0.920 3173 Q HN 0.552 nan 8.270 nan 0.000 0.427 3174 A N -0.442 122.418 122.820 0.067 0.000 2.209 3174 A HA -0.087 4.233 4.320 -0.000 0.000 0.212 3174 A C 1.854 179.507 177.584 0.116 0.000 1.158 3174 A CA 1.069 53.156 52.037 0.083 0.000 0.742 3174 A CB -0.507 18.541 19.000 0.081 0.000 0.790 3174 A HN 0.517 nan 8.150 nan 0.000 0.472 3175 M N -0.579 119.100 119.600 0.132 0.000 2.229 3175 M HA -0.029 4.451 4.480 -0.000 0.000 0.264 3175 M C 2.023 178.511 176.300 0.314 0.000 1.063 3175 M CA 1.311 56.739 55.300 0.212 0.000 1.114 3175 M CB -0.349 32.361 32.600 0.184 0.000 1.387 3175 M HN 0.356 nan 8.290 nan 0.000 0.420 3176 R N -0.292 120.379 120.500 0.284 0.000 2.115 3176 R HA -0.100 4.240 4.340 -0.000 0.000 0.230 3176 R C 2.073 178.426 176.300 0.088 0.000 1.111 3176 R CA 1.319 57.576 56.100 0.262 0.000 0.976 3176 R CB -0.171 30.247 30.300 0.196 0.000 0.870 3176 R HN 0.395 nan 8.270 nan 0.000 0.445 3177 K N -0.104 120.344 120.400 0.079 0.000 2.098 3177 K HA 0.032 4.352 4.320 -0.000 0.000 0.203 3177 K C 2.062 178.679 176.600 0.028 0.000 1.051 3177 K CA 0.588 56.901 56.287 0.044 0.000 0.957 3177 K CB 0.077 32.606 32.500 0.048 0.000 0.738 3177 K HN 0.059 nan 8.250 nan 0.000 0.447 3178 L N 0.352 121.603 121.223 0.047 0.000 2.376 3178 L HA -0.040 4.300 4.340 -0.000 0.000 0.219 3178 L C 2.172 179.039 176.870 -0.005 0.000 1.133 3178 L CA 0.622 55.487 54.840 0.042 0.000 0.816 3178 L CB -0.200 41.920 42.059 0.102 0.000 0.933 3178 L HN 0.185 nan 8.230 nan 0.000 0.449 3179 A N -0.068 122.714 122.820 -0.063 0.000 1.930 3179 A HA -0.066 4.254 4.320 -0.000 0.000 0.217 3179 A C 2.216 179.727 177.584 -0.123 0.000 1.175 3179 A CA 1.718 53.645 52.037 -0.184 0.000 0.627 3179 A CB -0.732 18.009 19.000 -0.432 0.000 0.815 3179 A HN 0.412 nan 8.150 nan 0.000 0.443 3180 G N -1.623 107.134 108.800 -0.073 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 0.915 175.800 174.900 -0.026 0.000 1.116 3180 G CA 0.398 45.469 45.100 -0.047 0.000 0.767 3180 G HN 0.599 nan 8.290 nan 0.000 0.547 3181 N N -0.298 118.391 118.700 -0.019 0.000 2.373 3181 N HA 0.231 4.971 4.740 -0.000 0.000 0.181 3181 N C 1.740 177.242 175.510 -0.013 0.000 1.082 3181 N CA -0.060 52.984 53.050 -0.010 0.000 0.885 3181 N CB 0.275 38.761 38.487 -0.001 0.000 0.977 3181 N HN 0.192 nan 8.380 nan 0.000 0.462 3182 L N 0.274 121.486 121.223 -0.018 0.000 2.200 3182 L HA 0.101 4.441 4.340 -0.000 0.000 0.200 3182 L C 1.820 178.677 176.870 -0.021 0.000 1.072 3182 L CA 0.628 55.458 54.840 -0.018 0.000 0.787 3182 L CB -0.144 41.907 42.059 -0.015 0.000 0.957 3182 L HN -0.057 nan 8.230 nan 0.000 0.459 3183 K N 0.057 120.440 120.400 -0.028 0.000 2.442 3183 K HA -0.251 4.069 4.320 -0.000 0.000 0.199 3183 K C 1.965 178.553 176.600 -0.019 0.000 1.044 3183 K CA 1.075 57.346 56.287 -0.026 0.000 0.941 3183 K CB 0.078 32.559 32.500 -0.031 0.000 0.759 3183 K HN 0.182 nan 8.250 nan 0.000 0.472 3184 Q N -0.714 119.075 119.800 -0.018 0.000 2.107 3184 Q HA 0.060 4.400 4.340 -0.000 0.000 0.195 3184 Q C 1.244 177.237 176.000 -0.013 0.000 0.964 3184 Q CA 1.460 57.255 55.803 -0.014 0.000 0.833 3184 Q CB 0.345 29.076 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 0.154 4.624 4.470 -0.000 0.000 0.216 3185 S C 0.261 174.852 174.600 -0.015 0.000 0.970 3185 S CA 0.394 58.586 58.200 -0.014 0.000 0.912 3185 S CB 0.032 63.224 63.200 -0.013 0.000 0.790 3185 S HN 0.515 nan 8.310 nan 0.000 0.504 3186 N N 0.833 119.523 118.700 -0.016 0.000 2.909 3186 N HA -0.157 4.583 4.740 -0.000 0.000 0.230 3186 N C -0.380 175.118 175.510 -0.020 0.000 0.869 3186 N CA 1.585 54.624 53.050 -0.018 0.000 1.071 3186 N CB -1.922 36.554 38.487 -0.018 0.000 1.040 3186 N HN 0.366 nan 8.380 nan 0.000 0.620 3187 T N 1.114 115.656 114.554 -0.020 0.000 2.777 3187 T HA 0.080 4.430 4.350 -0.000 0.000 0.273 3187 T C 0.391 175.077 174.700 -0.022 0.000 1.016 3187 T CA 0.190 62.277 62.100 -0.022 0.000 1.156 3187 T CB 0.237 69.092 68.868 -0.021 0.000 1.019 3187 T HN 0.263 nan 8.240 nan 0.000 0.503 3188 L N 4.957 126.164 121.223 -0.027 0.000 2.322 3188 L HA 0.722 5.062 4.340 -0.000 0.000 0.279 3188 L C -0.869 175.980 176.870 -0.036 0.000 1.036 3188 L CA -0.570 54.255 54.840 -0.025 0.000 0.807 3188 L CB 1.241 43.284 42.059 -0.028 0.000 1.226 3188 L HN 0.640 nan 8.230 nan 0.000 0.433 3189 L N 5.827 127.034 121.223 -0.026 0.000 2.381 3189 L HA 0.560 4.900 4.340 -0.000 0.000 0.274 3189 L C -1.179 175.664 176.870 -0.046 0.000 0.988 3189 L CA -0.406 54.393 54.840 -0.069 0.000 0.824 3189 L CB 1.778 43.804 42.059 -0.055 0.000 1.263 3189 L HN 0.616 nan 8.230 nan 0.000 0.410 3190 I N 4.088 124.583 120.570 -0.125 0.000 2.382 3190 I HA 0.316 4.486 4.170 -0.000 0.000 0.285 3190 I C -0.857 175.178 176.117 -0.136 0.000 1.007 3190 I CA -0.288 60.980 61.300 -0.054 0.000 1.142 3190 I CB 1.360 39.343 38.000 -0.028 0.000 1.289 3190 I HN 0.349 nan 8.210 nan 0.000 0.453 3191 F N 6.800 126.747 119.950 -0.005 0.000 2.399 3191 F HA 0.558 5.085 4.527 -0.000 0.000 0.334 3191 F C 0.497 176.302 175.800 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 40.332 39.000 0.009 0.000 1.162 3191 F HN 0.230 nan 8.300 nan 0.000 0.495 3192 I N 0.419 121.103 120.570 0.190 0.000 2.603 3192 I HA 0.660 4.830 4.170 -0.000 0.000 0.300 3192 I C -0.942 175.267 176.117 0.153 0.000 1.017 3192 I CA -0.756 60.631 61.300 0.145 0.000 1.098 3192 I CB 2.092 40.149 38.000 0.095 0.000 1.279 3192 I HN 0.450 nan 8.210 nan 0.000 0.437 3193 N N 2.139 120.934 118.700 0.158 0.000 2.902 3193 N HA 0.449 5.189 4.740 -0.000 0.000 0.268 3193 N C -1.473 174.104 175.510 0.110 0.000 1.450 3193 N CA -0.479 52.653 53.050 0.136 0.000 0.819 3193 N CB 2.268 40.853 38.487 0.162 0.000 1.540 3193 N HN 0.726 nan 8.380 nan 0.000 0.545 3212 G N 0.751 109.538 108.800 -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 0.072 174.944 174.900 -0.045 0.000 2.853 3212 G CA 0.613 45.694 45.100 -0.032 0.000 0.748 3212 G HN 0.368 nan 8.290 nan 0.000 0.349 3213 N N 1.911 120.591 118.700 -0.033 0.000 2.016 3213 N HA -0.291 4.449 4.740 -0.000 0.000 0.194 3213 N C 2.698 178.190 175.510 -0.030 0.000 1.078 3213 N CA 2.633 55.668 53.050 -0.024 0.000 0.894 3213 N CB -0.187 38.306 38.487 0.010 0.000 1.073 3213 N HN 1.013 nan 8.380 nan 0.000 0.480 3214 A N 1.309 124.124 122.820 -0.008 0.000 1.698 3214 A HA -0.336 3.984 4.320 -0.000 0.000 0.315 3214 A C 2.249 179.814 177.584 -0.031 0.000 3.574 3214 A CA 3.211 55.226 52.037 -0.037 0.000 0.952 3214 A CB -1.870 17.054 19.000 -0.128 0.000 0.759 3214 A HN 0.702 nan 8.150 nan 0.000 0.516 3215 L N -0.117 121.056 121.223 -0.083 0.000 2.119 3215 L HA -0.340 4.000 4.340 -0.000 0.000 0.226 3215 L C 2.302 179.156 176.870 -0.027 0.000 1.093 3215 L CA 3.494 58.279 54.840 -0.091 0.000 0.806 3215 L CB -0.743 41.165 42.059 -0.251 0.000 0.902 3215 L HN 0.646 nan 8.230 nan 0.000 0.444 3216 K N -1.646 118.707 120.400 -0.078 0.000 2.148 3216 K HA -0.281 4.039 4.320 -0.000 0.000 0.213 3216 K C 1.836 178.323 176.600 -0.189 0.000 1.050 3216 K CA 2.597 58.786 56.287 -0.162 0.000 0.932 3216 K CB -0.349 31.955 32.500 -0.327 0.000 0.717 3216 K HN 0.493 nan 8.250 nan 0.000 0.462 3217 F N -1.551 118.441 119.950 0.069 0.000 2.505 3217 F HA 0.070 4.597 4.527 -0.000 0.000 0.289 3217 F C 1.700 177.623 175.800 0.206 0.000 1.101 3217 F CA 0.229 58.292 58.000 0.105 0.000 1.446 3217 F CB -0.177 38.830 39.000 0.011 0.000 1.123 3217 F HN -0.002 nan 8.300 nan 0.000 0.564 3218 Y N 0.428 120.826 120.300 0.163 0.000 2.632 3218 Y HA 0.254 4.804 4.550 -0.000 0.000 0.301 3218 Y C 1.306 177.230 175.900 0.040 0.000 1.172 3218 Y CA -0.532 57.617 58.100 0.081 0.000 1.328 3218 Y CB -0.210 38.276 38.460 0.042 0.000 1.016 3218 Y HN -0.056 nan 8.280 nan 0.000 0.529 3219 A N -0.409 122.508 122.820 0.161 0.000 2.304 3219 A HA 0.284 4.604 4.320 -0.000 0.000 0.271 3219 A C 0.952 178.554 177.584 0.030 0.000 1.091 3219 A CA -0.201 51.872 52.037 0.060 0.000 0.812 3219 A CB 0.631 19.628 19.000 -0.004 0.000 1.056 3219 A HN 0.218 nan 8.150 nan 0.000 0.489 3220 S N -0.801 114.897 115.700 -0.004 0.000 2.512 3220 S HA 0.306 4.776 4.470 -0.000 0.000 0.216 3220 S C -0.026 174.533 174.600 -0.069 0.000 1.006 3220 S CA 0.122 58.306 58.200 -0.025 0.000 0.915 3220 S CB 0.300 63.490 63.200 -0.017 0.000 0.824 3220 S HN 0.518 nan 8.310 nan 0.000 0.497 3221 V N 2.163 122.029 119.914 -0.081 0.000 2.851 3221 V HA 0.466 4.586 4.120 -0.000 0.000 0.307 3221 V C -1.201 174.805 176.094 -0.147 0.000 1.129 3221 V CA -0.758 61.468 62.300 -0.124 0.000 0.932 3221 V CB 2.288 34.052 31.823 -0.097 0.000 1.024 3221 V HN 0.128 nan 8.190 nan 0.000 0.426 3222 R N 4.356 124.724 120.500 -0.221 0.000 2.670 3222 R HA 0.712 5.052 4.340 -0.000 0.000 0.289 3222 R C -1.844 174.276 176.300 -0.300 0.000 0.965 3222 R CA -0.942 54.991 56.100 -0.277 0.000 0.899 3222 R CB 2.290 32.381 30.300 -0.349 0.000 1.173 3222 R HN 0.312 nan 8.270 nan 0.000 0.456 3223 L N 1.808 122.820 121.223 -0.351 0.000 2.362 3223 L HA 0.322 4.662 4.340 -0.000 0.000 0.275 3223 L C -0.432 176.182 176.870 -0.426 0.000 0.998 3223 L CA -0.519 54.151 54.840 -0.283 0.000 0.820 3223 L CB 1.642 43.621 42.059 -0.133 0.000 1.270 3223 L HN 0.536 nan 8.230 nan 0.000 0.415 3224 D N 3.885 124.167 120.400 -0.197 0.000 2.473 3224 D HA 0.292 4.932 4.640 -0.000 0.000 0.226 3224 D C -0.337 176.030 176.300 0.112 0.000 1.089 3224 D CA -0.148 53.907 54.000 0.092 0.000 0.883 3224 D CB 0.834 41.794 40.800 0.267 0.000 1.029 3224 D HN 0.417 nan 8.370 nan 0.000 0.517 3225 I N 2.982 123.632 120.570 0.132 0.000 2.499 3225 I HA 0.448 4.618 4.170 -0.000 0.000 0.296 3225 I C -0.325 175.837 176.117 0.076 0.000 0.992 3225 I CA -0.573 60.775 61.300 0.079 0.000 1.297 3225 I CB 0.706 38.749 38.000 0.073 0.000 1.410 3225 I HN 0.270 nan 8.210 nan 0.000 0.507 3226 R N 5.755 126.268 120.500 0.021 0.000 2.579 3226 R HA 0.302 4.642 4.340 -0.000 0.000 0.260 3226 R C -1.397 174.892 176.300 -0.018 0.000 1.103 3226 R CA -0.822 55.286 56.100 0.014 0.000 0.942 3226 R CB 1.283 31.597 30.300 0.023 0.000 1.251 3226 R HN 0.664 nan 8.270 nan 0.000 0.450 3227 R N 4.857 125.356 120.500 -0.002 0.000 2.254 3227 R HA 0.292 4.631 4.340 -0.000 0.000 0.318 3227 R C 0.474 176.775 176.300 0.002 0.000 1.031 3227 R CA -0.051 56.048 56.100 -0.003 0.000 0.905 3227 R CB 0.519 30.836 30.300 0.028 0.000 1.050 3227 R HN 0.715 nan 8.270 nan 0.000 0.456 3228 I N 0.753 121.318 120.570 -0.008 0.000 4.338 3228 I HA 0.471 4.641 4.170 -0.000 0.000 0.329 3228 I C 0.397 176.518 176.117 0.007 0.000 1.378 3228 I CA -0.187 61.113 61.300 -0.001 0.000 1.170 3228 I CB 1.432 39.427 38.000 -0.008 0.000 1.206 3228 I HN 0.669 nan 8.210 nan 0.000 0.432 3229 G N 1.331 110.138 108.800 0.012 0.000 2.691 3229 G HA2 0.719 4.679 3.960 -0.000 0.000 0.169 3229 G HA3 0.719 4.679 3.960 -0.000 0.000 0.169 3229 G C -0.194 174.721 174.900 0.025 0.000 1.638 3229 G CA 0.126 45.236 45.100 0.017 0.000 0.822 3229 G HN 1.060 nan 8.290 nan 0.000 0.768 3230 A N -1.626 121.215 122.820 0.034 0.000 2.425 3230 A HA 0.357 4.677 4.320 -0.000 0.000 0.683 3230 A C -0.938 176.658 177.584 0.020 0.000 0.139 3230 A CA -0.210 51.846 52.037 0.032 0.000 0.044 3230 A CB -0.935 18.071 19.000 0.009 0.000 3.957 3230 A HN 1.554 nan 8.150 nan 0.000 0.546 3231 V N 3.445 123.372 119.914 0.021 0.000 2.370 3231 V HA 0.554 4.674 4.120 -0.000 0.000 0.279 3231 V C 0.487 176.572 176.094 -0.016 0.000 1.029 3231 V CA -0.353 61.959 62.300 0.019 0.000 0.870 3231 V CB 1.427 33.281 31.823 0.051 0.000 0.984 3231 V HN 0.820 nan 8.190 nan 0.000 0.451 3232 K N 2.854 123.247 120.400 -0.012 0.000 2.118 3232 K HA 0.582 4.902 4.320 -0.000 0.000 0.254 3232 K C -0.281 176.312 176.600 -0.012 0.000 0.961 3232 K CA -0.612 55.661 56.287 -0.024 0.000 0.876 3232 K CB 1.878 34.366 32.500 -0.021 0.000 1.077 3232 K HN 0.641 nan 8.250 nan 0.000 0.440 3233 E N 1.016 121.206 120.200 -0.017 0.000 3.588 3233 E HA 0.168 4.518 4.350 -0.000 0.000 0.213 3233 E C 0.182 176.776 176.600 -0.011 0.000 1.168 3233 E CA -0.189 56.207 56.400 -0.008 0.000 1.254 3233 E CB 0.715 30.413 29.700 -0.004 0.000 1.302 3233 E HN 0.948 nan 8.360 nan 0.000 0.429 3234 G N 1.780 110.573 108.800 -0.011 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 0.849 175.738 174.900 -0.017 0.000 1.450 3234 G CA 0.292 45.384 45.100 -0.013 0.000 0.937 3234 G HN 0.446 nan 8.290 nan 0.000 0.625 3235 E N 0.944 121.132 120.200 -0.021 0.000 2.665 3235 E HA 0.109 4.459 4.350 -0.000 0.000 0.225 3235 E C -0.094 176.485 176.600 -0.035 0.000 0.922 3235 E CA 0.012 56.398 56.400 -0.024 0.000 1.242 3235 E CB 0.530 30.218 29.700 -0.020 0.000 1.197 3235 E HN 0.690 nan 8.360 nan 0.000 0.581 3236 N N 1.293 119.969 118.700 -0.041 0.000 2.419 3236 N HA 0.161 4.901 4.740 -0.000 0.000 0.277 3236 N C -0.060 175.395 175.510 -0.091 0.000 1.006 3236 N CA -0.405 52.608 53.050 -0.061 0.000 0.923 3236 N CB 2.183 40.637 38.487 -0.054 0.000 1.140 3236 N HN -0.200 nan 8.380 nan 0.000 0.488 3237 V N 0.617 120.455 119.914 -0.127 0.000 2.266 3237 V HA 0.070 4.190 4.120 -0.000 0.000 0.240 3237 V C 0.689 176.571 176.094 -0.353 0.000 1.225 3237 V CA -0.140 62.038 62.300 -0.205 0.000 1.237 3237 V CB -0.042 31.662 31.823 -0.199 0.000 1.343 3237 V HN 0.592 nan 8.190 nan 0.000 0.496 3238 V N 3.699 123.450 119.914 -0.273 0.000 3.483 3238 V HA 0.676 4.796 4.120 -0.000 0.000 0.301 3238 V C 1.028 176.995 176.094 -0.212 0.000 1.389 3238 V CA 0.975 63.110 62.300 -0.275 0.000 1.101 3238 V CB 0.063 31.834 31.823 -0.087 0.000 0.971 3238 V HN 0.959 nan 8.190 nan 0.000 0.434 3239 G N -1.002 107.670 108.800 -0.214 0.000 2.727 3239 G HA2 0.602 4.562 3.960 -0.000 0.000 0.289 3239 G HA3 0.602 4.562 3.960 -0.000 0.000 0.289 3239 G C -1.370 173.688 174.900 0.264 0.000 1.418 3239 G CA -0.393 44.788 45.100 0.134 0.000 0.818 3239 G HN 0.078 nan 8.290 nan 0.000 0.486 3240 S N -0.245 115.639 115.700 0.306 0.000 2.750 3240 S HA 0.357 4.827 4.470 -0.000 0.000 0.276 3240 S C -0.920 173.735 174.600 0.092 0.000 1.165 3240 S CA -0.544 57.781 58.200 0.209 0.000 1.047 3240 S CB 1.736 65.079 63.200 0.238 0.000 1.056 3240 S HN 0.639 nan 8.310 nan 0.000 0.481 3241 E N 2.155 122.381 120.200 0.043 0.000 2.324 3241 E HA 0.399 4.749 4.350 -0.000 0.000 0.271 3241 E C -0.610 175.935 176.600 -0.091 0.000 1.028 3241 E CA 0.333 56.724 56.400 -0.015 0.000 0.890 3241 E CB 0.543 30.244 29.700 0.001 0.000 1.004 3241 E HN 0.456 nan 8.360 nan 0.000 0.431 3242 T N 5.276 119.687 114.554 -0.239 0.000 2.861 3242 T HA 0.516 4.866 4.350 -0.000 0.000 0.287 3242 T C -0.465 173.965 174.700 -0.449 0.000 1.003 3242 T CA -0.837 61.041 62.100 -0.371 0.000 0.977 3242 T CB 1.183 69.713 68.868 -0.563 0.000 0.996 3242 T HN 0.295 nan 8.240 nan 0.000 0.448 3243 R N 1.781 122.127 120.500 -0.257 0.000 2.439 3243 R HA 0.652 4.992 4.340 -0.000 0.000 0.310 3243 R C -1.470 174.776 176.300 -0.089 0.000 0.955 3243 R CA -0.652 55.356 56.100 -0.154 0.000 0.853 3243 R CB 2.077 32.343 30.300 -0.057 0.000 1.171 3243 R HN 0.378 nan 8.270 nan 0.000 0.449 3244 V N 4.406 124.297 119.914 -0.038 0.000 2.409 3244 V HA 0.303 4.423 4.120 -0.000 0.000 0.291 3244 V C -0.154 175.969 176.094 0.047 0.000 1.020 3244 V CA -0.725 61.594 62.300 0.032 0.000 0.848 3244 V CB 1.859 33.746 31.823 0.107 0.000 0.990 3244 V HN 0.546 nan 8.190 nan 0.000 0.430 3245 K N 3.322 123.748 120.400 0.044 0.000 2.183 3245 K HA 0.512 4.832 4.320 -0.000 0.000 0.274 3245 K C -0.735 175.864 176.600 -0.003 0.000 1.009 3245 K CA -0.602 55.714 56.287 0.048 0.000 0.888 3245 K CB 2.142 34.694 32.500 0.088 0.000 1.078 3245 K HN 0.409 nan 8.250 nan 0.000 0.459 3246 V N 5.338 125.240 119.914 -0.019 0.000 2.370 3246 V HA -0.032 4.088 4.120 -0.000 0.000 0.257 3246 V C 1.156 177.152 176.094 -0.163 0.000 1.064 3246 V CA 0.119 62.360 62.300 -0.098 0.000 0.975 3246 V CB 0.719 32.486 31.823 -0.092 0.000 1.067 3246 V HN 0.618 nan 8.190 nan 0.000 0.485 3247 V N 3.733 123.528 119.914 -0.200 0.000 2.374 3247 V HA 0.140 4.260 4.120 -0.000 0.000 0.241 3247 V C 0.999 176.815 176.094 -0.462 0.000 1.034 3247 V CA 0.683 62.866 62.300 -0.196 0.000 1.037 3247 V CB -0.282 31.503 31.823 -0.063 0.000 0.682 3247 V HN 0.660 nan 8.190 nan 0.000 0.463 3248 K N 1.738 121.858 120.400 -0.468 0.000 2.307 3248 K HA 0.374 4.694 4.320 -0.000 0.000 0.263 3248 K C -1.067 175.309 176.600 -0.373 0.000 0.973 3248 K CA -0.379 55.565 56.287 -0.571 0.000 0.846 3248 K CB 0.795 32.865 32.500 -0.718 0.000 1.100 3248 K HN 0.219 nan 8.250 nan 0.000 0.438 3249 N N 4.002 122.503 118.700 -0.332 0.000 2.690 3249 N HA 0.130 4.870 4.740 -0.000 0.000 0.255 3249 N C -1.077 174.357 175.510 -0.127 0.000 1.195 3249 N CA -0.297 52.629 53.050 -0.206 0.000 0.790 3249 N CB 0.912 39.278 38.487 -0.202 0.000 1.216 3249 N HN 0.511 nan 8.380 nan 0.000 0.528 3250 K N 2.386 122.733 120.400 -0.089 0.000 2.862 3250 K HA 0.216 4.536 4.320 -0.000 0.000 0.229 3250 K C 0.429 177.014 176.600 -0.025 0.000 1.107 3250 K CA -0.011 56.255 56.287 -0.035 0.000 1.222 3250 K CB 0.448 32.944 32.500 -0.007 0.000 1.067 3250 K HN 0.412 nan 8.250 nan 0.000 0.464 3251 I N -0.912 119.635 120.570 -0.038 0.000 4.338 3251 I HA 0.142 4.312 4.170 -0.000 0.000 0.315 3251 I C 0.305 176.410 176.117 -0.019 0.000 1.262 3251 I CA 0.158 61.442 61.300 -0.027 0.000 1.298 3251 I CB 0.916 38.895 38.000 -0.034 0.000 1.257 3251 I HN 0.088 nan 8.210 nan 0.000 0.444 3252 A N -0.186 122.618 122.820 -0.026 0.000 4.642 3252 A HA 0.838 5.158 4.320 -0.000 0.000 0.248 3252 A C -0.921 176.654 177.584 -0.016 0.000 0.987 3252 A CA -0.033 51.995 52.037 -0.014 0.000 0.622 3252 A CB -0.508 18.484 19.000 -0.013 0.000 1.769 3252 A HN 0.094 nan 8.150 nan 0.000 0.864 3253 A N 1.256 124.073 122.820 -0.005 0.000 2.492 3253 A HA 0.596 4.916 4.320 -0.000 0.000 0.254 3253 A C -2.410 175.157 177.584 -0.029 0.000 1.091 3253 A CA -0.746 51.296 52.037 0.009 0.000 0.768 3253 A CB -0.793 18.225 19.000 0.030 0.000 1.028 3253 A HN 0.376 nan 8.150 nan 0.000 0.498 3254 P HA 0.564 nan 4.420 nan 0.000 0.284 3254 P C -0.120 177.118 177.300 -0.103 0.000 1.292 3254 P CA -0.568 62.376 63.100 -0.261 0.000 0.800 3254 P CB 0.053 31.410 31.700 -0.570 0.000 1.188 3255 F N -4.156 115.800 119.950 0.009 0.000 3.006 3255 F HA -0.242 4.285 4.527 -0.000 0.000 0.289 3255 F C 0.517 176.323 175.800 0.010 0.000 0.772 3255 F CA 0.899 58.906 58.000 0.012 0.000 1.162 3255 F CB -2.258 36.747 39.000 0.008 0.000 1.382 3255 F HN 0.184 nan 8.300 nan 0.000 0.406 3256 K N 1.143 121.609 120.400 0.108 0.000 2.098 3256 K HA 0.574 4.894 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 -0.628 55.708 56.287 0.082 0.000 0.916 3256 K CB 1.591 34.123 32.500 0.053 0.000 1.039 3256 K HN 0.427 nan 8.250 nan 0.000 0.455 3257 Q N -0.095 119.746 119.800 0.068 0.000 2.484 3257 Q HA 0.777 5.117 4.340 -0.000 0.000 0.285 3257 Q C -1.756 174.288 176.000 0.073 0.000 1.097 3257 Q CA -1.234 54.609 55.803 0.067 0.000 0.802 3257 Q CB 2.234 31.013 28.738 0.068 0.000 1.444 3257 Q HN 0.558 nan 8.270 nan 0.000 0.429 3258 A N 1.391 124.264 122.820 0.089 0.000 2.486 3258 A HA 0.600 4.920 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 0.131 0.000 0.696 3258 A CB 1.778 20.881 19.000 0.172 0.000 1.278 3258 A HN 0.761 nan 8.150 nan 0.000 0.405 3259 E N 0.760 121.041 120.200 0.135 0.000 2.227 3259 E HA 0.784 5.134 4.350 -0.000 0.000 0.268 3259 E C -1.239 175.471 176.600 0.184 0.000 0.907 3259 E CA -0.545 55.877 56.400 0.036 0.000 0.786 3259 E CB 2.276 31.986 29.700 0.018 0.000 1.191 3259 E HN 0.724 nan 8.360 nan 0.000 0.411 3260 F N -2.128 117.845 119.950 0.037 0.000 2.807 3260 F HA 0.305 4.832 4.527 -0.000 0.000 0.316 3260 F C -1.381 174.450 175.800 0.053 0.000 1.162 3260 F CA -1.275 56.750 58.000 0.042 0.000 0.910 3260 F CB 0.908 39.925 39.000 0.028 0.000 1.314 3260 F HN 0.173 nan 8.300 nan 0.000 0.454 3261 Q N 1.851 121.846 119.800 0.325 0.000 2.261 3261 Q HA 0.616 4.956 4.340 -0.000 0.000 0.252 3261 Q C -0.972 175.221 176.000 0.323 0.000 0.915 3261 Q CA -0.517 55.426 55.803 0.234 0.000 0.915 3261 Q CB 2.305 31.157 28.738 0.190 0.000 1.204 3261 Q HN 0.587 nan 8.270 nan 0.000 0.421 3262 I N 3.786 124.503 120.570 0.245 0.000 2.354 3262 I HA 0.182 4.352 4.170 -0.000 0.000 0.286 3262 I C -0.911 175.353 176.117 0.246 0.000 1.007 3262 I CA -0.741 60.701 61.300 0.238 0.000 1.167 3262 I CB 0.893 39.000 38.000 0.179 0.000 1.320 3262 I HN 0.327 nan 8.210 nan 0.000 0.458 3263 L N 7.236 128.597 121.223 0.231 0.000 2.265 3263 L HA 0.271 4.611 4.340 -0.000 0.000 0.288 3263 L C -0.368 176.692 176.870 0.317 0.000 1.058 3263 L CA -0.080 54.925 54.840 0.275 0.000 0.809 3263 L CB 0.231 42.410 42.059 0.200 0.000 1.179 3263 L HN 0.330 nan 8.230 nan 0.000 0.429 3264 Y N 3.814 124.183 120.300 0.116 0.000 2.834 3264 Y HA 0.182 4.732 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 0.714 58.889 58.100 0.126 0.000 1.647 3264 Y CB 0.077 38.562 38.460 0.040 0.000 1.221 3264 Y HN 0.871 nan 8.280 nan 0.000 0.519 3265 G N 2.582 111.614 108.800 0.387 0.000 2.132 3265 G HA2 -0.286 3.674 3.960 -0.000 0.000 0.234 3265 G HA3 -0.286 3.674 3.960 -0.000 0.000 0.234 3265 G C 0.424 175.454 174.900 0.216 0.000 0.989 3265 G CA 0.440 45.744 45.100 0.340 0.000 0.676 3265 G HN 0.659 nan 8.290 nan 0.000 0.522 3266 E N -1.527 118.786 120.200 0.189 0.000 2.879 3266 E HA 0.454 4.804 4.350 -0.000 0.000 0.206 3266 E C 1.249 177.901 176.600 0.087 0.000 0.969 3266 E CA 1.153 57.628 56.400 0.126 0.000 1.496 3266 E CB 0.646 30.424 29.700 0.129 0.000 1.454 3266 E HN 1.698 nan 8.360 nan 0.000 0.750 3267 G N 1.054 109.914 108.800 0.099 0.000 2.342 3267 G HA2 -0.093 3.867 3.960 -0.000 0.000 0.220 3267 G HA3 -0.093 3.867 3.960 -0.000 0.000 0.220 3267 G C -0.538 174.404 174.900 0.070 0.000 1.243 3267 G CA -0.386 44.740 45.100 0.044 0.000 1.083 3267 G HN 0.154 nan 8.290 nan 0.000 0.500 3268 I N 0.882 121.459 120.570 0.012 0.000 2.948 3268 I HA 0.033 4.203 4.170 -0.000 0.000 0.290 3268 I C 0.574 176.714 176.117 0.039 0.000 1.226 3268 I CA -0.045 61.257 61.300 0.002 0.000 1.413 3268 I CB 0.399 38.282 38.000 -0.195 0.000 1.352 3268 I HN 0.415 nan 8.210 nan 0.000 0.597 3269 N N 4.629 123.384 118.700 0.092 0.000 3.229 3269 N HA 0.066 4.806 4.740 -0.000 0.000 0.275 3269 N C 0.724 176.321 175.510 0.145 0.000 1.225 3269 N CA -0.208 52.934 53.050 0.153 0.000 1.119 3269 N CB -0.163 38.443 38.487 0.198 0.000 1.392 3269 N HN 0.462 nan 8.380 nan 0.000 0.520 3270 F N 1.665 121.542 119.950 -0.121 0.000 2.060 3270 F HA -0.378 4.149 4.527 -0.000 0.000 0.293 3270 F C 0.961 176.600 175.800 -0.268 0.000 1.096 3270 F CA 2.083 59.899 58.000 -0.307 0.000 1.241 3270 F CB -0.503 38.139 39.000 -0.596 0.000 0.959 3270 F HN 0.484 nan 8.300 nan 0.000 0.499 3271 Y N -0.948 119.477 120.300 0.207 0.000 2.365 3271 Y HA 0.147 4.697 4.550 -0.000 0.000 0.293 3271 Y C 2.581 178.524 175.900 0.071 0.000 1.119 3271 Y CA 0.623 58.764 58.100 0.068 0.000 1.203 3271 Y CB -1.265 37.200 38.460 0.008 0.000 1.026 3271 Y HN 0.072 nan 8.280 nan 0.000 0.549 3272 G N 1.178 110.128 108.800 0.249 0.000 2.587 3272 G HA2 -0.340 3.620 3.960 -0.000 0.000 0.217 3272 G HA3 -0.340 3.620 3.960 -0.000 0.000 0.217 3272 G C 1.453 176.435 174.900 0.136 0.000 1.240 3272 G CA 1.440 46.646 45.100 0.177 0.000 0.794 3272 G HN 0.577 nan 8.290 nan 0.000 0.580 3273 E N 0.196 120.479 120.200 0.138 0.000 2.265 3273 E HA -0.082 4.268 4.350 -0.000 0.000 0.196 3273 E C 2.348 178.995 176.600 0.078 0.000 0.996 3273 E CA 0.759 57.227 56.400 0.113 0.000 0.832 3273 E CB -0.252 29.512 29.700 0.107 0.000 0.756 3273 E HN 0.348 nan 8.360 nan 0.000 0.491 3274 L N 1.718 122.993 121.223 0.086 0.000 2.005 3274 L HA -0.128 4.212 4.340 -0.000 0.000 0.207 3274 L C 2.337 179.224 176.870 0.029 0.000 1.072 3274 L CA 1.293 56.172 54.840 0.064 0.000 0.744 3274 L CB -0.773 41.330 42.059 0.073 0.000 0.895 3274 L HN 0.054 nan 8.230 nan 0.000 0.433 3275 V N 0.480 120.405 119.914 0.017 0.000 2.222 3275 V HA -0.412 3.708 4.120 -0.000 0.000 0.252 3275 V C 2.421 178.460 176.094 -0.092 0.000 1.060 3275 V CA 2.263 64.514 62.300 -0.081 0.000 1.027 3275 V CB -0.977 30.759 31.823 -0.146 0.000 0.644 3275 V HN 0.444 nan 8.190 nan 0.000 0.448 3276 D N -0.358 120.016 120.400 -0.043 0.000 2.149 3276 D HA -0.170 4.470 4.640 -0.000 0.000 0.194 3276 D C 1.978 178.288 176.300 0.016 0.000 1.001 3276 D CA 1.334 55.331 54.000 -0.005 0.000 0.849 3276 D CB -0.296 40.529 40.800 0.042 0.000 0.939 3276 D HN 0.260 nan 8.370 nan 0.000 0.449 3277 L N 0.615 121.853 121.223 0.025 0.000 2.027 3277 L HA -0.016 4.324 4.340 -0.000 0.000 0.206 3277 L C 2.626 179.513 176.870 0.028 0.000 1.074 3277 L CA 1.741 56.600 54.840 0.032 0.000 0.745 3277 L CB -1.373 40.707 42.059 0.036 0.000 0.898 3277 L HN 0.071 nan 8.230 nan 0.000 0.433 3278 G N -1.375 107.435 108.800 0.016 0.000 2.501 3278 G HA2 -0.156 3.804 3.960 -0.000 0.000 0.220 3278 G HA3 -0.156 3.804 3.960 -0.000 0.000 0.220 3278 G C 1.591 176.510 174.900 0.032 0.000 1.114 3278 G CA 1.030 46.144 45.100 0.023 0.000 0.757 3278 G HN 0.291 nan 8.290 nan 0.000 0.559 3279 V N 0.192 120.117 119.914 0.019 0.000 2.302 3279 V HA -0.007 4.113 4.120 -0.000 0.000 0.243 3279 V C 2.503 178.634 176.094 0.063 0.000 1.036 3279 V CA 1.922 64.252 62.300 0.050 0.000 1.020 3279 V CB -0.242 31.614 31.823 0.057 0.000 0.657 3279 V HN 0.353 nan 8.190 nan 0.000 0.453 3280 K N -0.128 120.305 120.400 0.053 0.000 2.486 3280 K HA -0.050 4.270 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 0.603 56.921 56.287 0.052 0.000 1.004 3280 K CB 0.215 32.744 32.500 0.049 0.000 0.798 3280 K HN 0.327 nan 8.250 nan 0.000 0.495 3281 E N 1.175 121.404 120.200 0.049 0.000 2.723 3281 E HA 0.039 4.389 4.350 -0.000 0.000 0.219 3281 E C -0.436 176.198 176.600 0.057 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 0.115 nan 8.360 nan 0.000 0.438 3282 K N -0.459 119.976 120.400 0.059 0.000 3.184 3282 K HA -0.233 4.087 4.320 -0.000 0.000 0.301 3282 K C 1.134 177.780 176.600 0.077 0.000 1.170 3282 K CA 0.679 57.002 56.287 0.061 0.000 0.897 3282 K CB -1.967 30.560 32.500 0.046 0.000 1.218 3282 K HN 0.302 nan 8.250 nan 0.000 0.441 3283 L N -0.238 121.044 121.223 0.098 0.000 2.162 3283 L HA 0.135 4.475 4.340 -0.000 0.000 0.205 3283 L C 1.135 178.142 176.870 0.228 0.000 1.086 3283 L CA 0.787 55.722 54.840 0.157 0.000 0.778 3283 L CB 0.111 42.269 42.059 0.164 0.000 0.928 3283 L HN 0.102 nan 8.230 nan 0.000 0.446 3284 I N -0.885 119.778 120.570 0.156 0.000 2.474 3284 I HA 0.246 4.416 4.170 -0.000 0.000 0.294 3284 I C -0.671 175.534 176.117 0.147 0.000 1.005 3284 I CA -0.520 60.874 61.300 0.156 0.000 1.113 3284 I CB 1.954 39.982 38.000 0.046 0.000 1.289 3284 I HN -0.077 nan 8.210 nan 0.000 0.436 3285 E N 4.895 125.196 120.200 0.168 0.000 2.151 3285 E HA 0.319 4.669 4.350 -0.000 0.000 0.275 3285 E C -0.831 175.893 176.600 0.206 0.000 0.936 3285 E CA -0.922 55.569 56.400 0.152 0.000 0.777 3285 E CB 1.957 31.714 29.700 0.094 0.000 1.108 3285 E HN 0.318 nan 8.360 nan 0.000 0.401 3286 K N 2.063 122.577 120.400 0.190 0.000 2.310 3286 K HA 0.303 4.623 4.320 -0.000 0.000 0.290 3286 K C -0.654 175.982 176.600 0.060 0.000 1.077 3286 K CA -0.179 56.194 56.287 0.143 0.000 0.922 3286 K CB 0.515 33.108 32.500 0.155 0.000 1.057 3286 K HN 0.594 nan 8.250 nan 0.000 0.479 3287 A N 4.196 127.041 122.820 0.043 0.000 3.293 3287 A HA 0.402 4.722 4.320 -0.000 0.000 0.282 3287 A C 0.912 178.529 177.584 0.056 0.000 1.394 3287 A CA 0.191 52.271 52.037 0.071 0.000 1.118 3287 A CB -0.390 18.679 19.000 0.116 0.000 1.133 3287 A HN 1.071 nan 8.150 nan 0.000 0.627 3288 G N 0.715 109.507 108.800 -0.013 0.000 4.026 3288 G HA2 -0.207 3.753 3.960 -0.000 0.000 0.309 3288 G HA3 -0.207 3.753 3.960 -0.000 0.000 0.309 3288 G C 1.442 176.239 174.900 -0.172 0.000 1.411 3288 G CA 0.894 45.959 45.100 -0.059 0.000 1.037 3288 G HN 1.731 nan 8.290 nan 0.000 0.687 3289 A N -0.705 121.974 122.820 -0.235 0.000 2.197 3289 A HA 0.526 4.846 4.320 -0.000 0.000 0.210 3289 A C 0.793 178.052 177.584 -0.543 0.000 1.180 3289 A CA 0.558 52.349 52.037 -0.409 0.000 0.846 3289 A CB 0.033 18.770 19.000 -0.438 0.000 0.884 3289 A HN 0.582 nan 8.150 nan 0.000 0.487 3290 W N -0.700 120.408 121.300 -0.319 0.000 2.315 3290 W HA 0.508 5.168 4.660 -0.000 0.000 0.316 3290 W C -0.577 175.730 176.519 -0.353 0.000 1.211 3290 W CA -0.123 57.061 57.345 -0.268 0.000 1.201 3290 W CB 0.397 29.775 29.460 -0.137 0.000 1.184 3290 W HN 0.210 nan 8.180 nan 0.000 0.544 3291 Y N 2.266 122.697 120.300 0.218 0.000 2.335 3291 Y HA 0.412 4.962 4.550 -0.000 0.000 0.338 3291 Y C 0.407 176.319 175.900 0.021 0.000 0.977 3291 Y CA -0.718 57.427 58.100 0.075 0.000 1.114 3291 Y CB 1.549 40.006 38.460 -0.005 0.000 1.182 3291 Y HN 0.179 nan 8.280 nan 0.000 0.463 3292 S N 2.628 118.445 115.700 0.194 0.000 2.532 3292 S HA 0.454 4.924 4.470 -0.000 0.000 0.301 3292 S C -1.895 172.785 174.600 0.133 0.000 1.083 3292 S CA -0.738 57.512 58.200 0.084 0.000 1.025 3292 S CB 1.496 64.722 63.200 0.043 0.000 1.056 3292 S HN 0.517 nan 8.310 nan 0.000 0.494 3293 Y N 2.030 122.282 120.300 -0.078 0.000 2.344 3293 Y HA 0.357 4.907 4.550 -0.000 0.000 0.328 3293 Y C -0.111 175.780 175.900 -0.016 0.000 1.067 3293 Y CA -0.888 57.183 58.100 -0.047 0.000 1.247 3293 Y CB 0.346 38.762 38.460 -0.073 0.000 1.113 3293 Y HN 0.841 nan 8.280 nan 0.000 0.465 3294 K N 4.431 124.601 120.400 -0.384 0.000 3.125 3294 K HA -0.205 4.115 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 0.985 57.080 56.287 -0.320 0.000 0.775 3294 K CB -1.398 30.840 32.500 -0.436 0.000 1.253 3294 K HN 1.396 nan 8.250 nan 0.000 0.486 3295 G N -0.320 108.420 108.800 -0.099 0.000 2.220 3295 G HA2 -0.339 3.621 3.960 -0.000 0.000 0.269 3295 G HA3 -0.339 3.621 3.960 -0.000 0.000 0.269 3295 G C -0.075 174.782 174.900 -0.073 0.000 0.977 3295 G CA 0.803 45.858 45.100 -0.075 0.000 0.634 3295 G HN 0.475 nan 8.290 nan 0.000 0.539 3296 E N 0.994 121.161 120.200 -0.056 0.000 2.249 3296 E HA 0.303 4.653 4.350 -0.000 0.000 0.280 3296 E C 0.101 176.668 176.600 -0.055 0.000 1.016 3296 E CA -0.641 55.738 56.400 -0.035 0.000 0.830 3296 E CB 0.575 30.289 29.700 0.024 0.000 1.081 3296 E HN 0.114 nan 8.360 nan 0.000 0.395 3297 K N 3.710 124.056 120.400 -0.090 0.000 2.339 3297 K HA 0.139 4.459 4.320 -0.000 0.000 0.286 3297 K C 0.954 177.471 176.600 -0.138 0.000 1.050 3297 K CA 0.157 56.376 56.287 -0.114 0.000 0.956 3297 K CB 0.616 33.008 32.500 -0.180 0.000 0.990 3297 K HN 0.548 nan 8.250 nan 0.000 0.475 3298 I N -1.968 118.455 120.570 -0.244 0.000 4.338 3298 I HA 0.338 4.508 4.170 -0.000 0.000 0.315 3298 I C 0.643 176.448 176.117 -0.521 0.000 1.262 3298 I CA -0.265 60.589 61.300 -0.744 0.000 1.298 3298 I CB 1.210 38.389 38.000 -1.368 0.000 1.257 3298 I HN 0.449 nan 8.210 nan 0.000 0.444 3299 G N 1.186 109.935 108.800 -0.086 0.000 2.702 3299 G HA2 0.452 4.412 3.960 -0.000 0.000 0.296 3299 G HA3 0.452 4.412 3.960 -0.000 0.000 0.296 3299 G C -2.194 172.810 174.900 0.174 0.000 1.463 3299 G CA -0.457 44.693 45.100 0.083 0.000 0.890 3299 G HN 0.160 nan 8.290 nan 0.000 0.534 3300 Q N 0.409 120.217 119.800 0.013 0.000 2.333 3300 Q HA 0.562 4.902 4.340 -0.000 0.000 0.268 3300 Q C 0.214 176.105 176.000 -0.182 0.000 1.007 3300 Q CA 0.170 55.796 55.803 -0.295 0.000 0.810 3300 Q CB 1.494 29.818 28.738 -0.691 0.000 1.264 3300 Q HN 2.117 nan 8.270 nan 0.000 0.452 3301 G N 3.466 112.142 108.800 -0.206 0.000 3.285 3301 G HA2 -0.258 3.701 3.960 -0.000 0.000 0.685 3301 G HA3 -0.258 3.701 3.960 -0.000 0.000 0.685 3301 G C 0.252 175.242 174.900 0.150 0.000 0.938 3301 G CA 0.154 45.215 45.100 -0.065 0.000 0.778 3301 G HN 0.846 nan 8.290 nan 0.000 0.515 3302 K N 2.002 122.575 120.400 0.288 0.000 2.127 3302 K HA -0.230 4.090 4.320 -0.000 0.000 0.212 3302 K C 2.903 179.604 176.600 0.169 0.000 1.050 3302 K CA 2.808 59.301 56.287 0.343 0.000 0.929 3302 K CB -0.361 32.276 32.500 0.227 0.000 0.715 3302 K HN 1.487 nan 8.250 nan 0.000 0.457 3303 A N 1.917 124.806 122.820 0.116 0.000 1.877 3303 A HA -0.314 4.006 4.320 -0.000 0.000 0.218 3303 A C 1.808 179.446 177.584 0.090 0.000 1.301 3303 A CA 2.421 54.508 52.037 0.082 0.000 0.699 3303 A CB -1.289 17.741 19.000 0.051 0.000 0.844 3303 A HN 0.634 nan 8.150 nan 0.000 0.464 3304 N N 0.070 118.823 118.700 0.088 0.000 2.289 3304 N HA -0.080 4.660 4.740 -0.000 0.000 0.184 3304 N C 1.898 177.496 175.510 0.146 0.000 1.016 3304 N CA 1.124 54.235 53.050 0.102 0.000 0.872 3304 N CB -0.305 38.230 38.487 0.081 0.000 0.973 3304 N HN 0.582 nan 8.380 nan 0.000 0.433 3305 A N 1.316 124.226 122.820 0.149 0.000 1.902 3305 A HA -0.128 4.192 4.320 -0.000 0.000 0.217 3305 A C 2.391 180.051 177.584 0.127 0.000 1.181 3305 A CA 1.728 53.835 52.037 0.117 0.000 0.623 3305 A CB -0.969 18.069 19.000 0.064 0.000 0.818 3305 A HN 0.239 nan 8.150 nan 0.000 0.443 3306 T N 0.837 115.448 114.554 0.094 0.000 2.496 3306 T HA -0.089 4.261 4.350 -0.000 0.000 0.254 3306 T C 2.098 176.834 174.700 0.060 0.000 1.161 3306 T CA 1.855 64.008 62.100 0.088 0.000 1.231 3306 T CB -0.910 68.014 68.868 0.093 0.000 0.866 3306 T HN 0.692 nan 8.240 nan 0.000 0.396 3307 A N -0.212 122.632 122.820 0.041 0.000 2.285 3307 A HA -0.111 4.209 4.320 -0.000 0.000 0.214 3307 A C 1.821 179.401 177.584 -0.007 0.000 1.188 3307 A CA 1.273 53.295 52.037 -0.026 0.000 0.707 3307 A CB -1.225 17.776 19.000 0.002 0.000 0.771 3307 A HN 0.739 nan 8.150 nan 0.000 0.488 3308 W N -0.186 121.049 121.300 -0.110 0.000 2.463 3308 W HA -0.018 4.642 4.660 -0.000 0.000 0.316 3308 W C 1.670 178.086 176.519 -0.173 0.000 1.170 3308 W CA 1.566 58.850 57.345 -0.101 0.000 1.355 3308 W CB -0.396 29.038 29.460 -0.043 0.000 1.159 3308 W HN 0.208 nan 8.180 nan 0.000 0.487 3309 L N 1.229 122.518 121.223 0.109 0.000 2.263 3309 L HA -0.271 4.069 4.340 -0.000 0.000 0.216 3309 L C 2.435 178.962 176.870 -0.572 0.000 1.111 3309 L CA 1.602 56.351 54.840 -0.153 0.000 0.773 3309 L CB -0.790 41.321 42.059 0.086 0.000 0.906 3309 L HN 0.057 nan 8.230 nan 0.000 0.439 3310 K N 0.042 119.988 120.400 -0.756 0.000 2.147 3310 K HA -0.185 4.135 4.320 -0.000 0.000 0.205 3310 K C 0.896 177.172 176.600 -0.539 0.000 1.049 3310 K CA 1.516 57.226 56.287 -0.962 0.000 0.936 3310 K CB 0.111 32.233 32.500 -0.630 0.000 0.722 3310 K HN 0.225 nan 8.250 nan 0.000 0.446 3311 D N -0.404 119.710 120.400 -0.477 0.000 2.363 3311 D HA 0.066 4.706 4.640 -0.000 0.000 0.214 3311 D C -0.550 175.474 176.300 -0.460 0.000 1.093 3311 D CA 0.192 53.952 54.000 -0.400 0.000 0.837 3311 D CB 0.413 41.003 40.800 -0.350 0.000 0.948 3311 D HN 0.113 nan 8.370 nan 0.000 0.507 3312 N N 0.378 118.754 118.700 -0.539 0.000 2.642 3312 N HA 0.109 4.849 4.740 -0.000 0.000 0.308 3312 N C -2.119 173.214 175.510 -0.296 0.000 1.914 3312 N CA -0.903 51.857 53.050 -0.484 0.000 0.893 3312 N CB 1.560 39.561 38.487 -0.809 0.000 1.322 3312 N HN -0.006 nan 8.380 nan 0.000 0.490 3313 P HA -0.191 nan 4.420 nan 0.000 0.216 3313 P C 1.464 178.706 177.300 -0.098 0.000 1.154 3313 P CA 1.365 64.392 63.100 -0.121 0.000 0.865 3313 P CB 0.481 32.127 31.700 -0.090 0.000 0.789 3314 E N -0.548 119.597 120.200 -0.092 0.000 2.026 3314 E HA -0.200 4.150 4.350 -0.000 0.000 0.206 3314 E C 1.859 178.437 176.600 -0.036 0.000 1.028 3314 E CA 2.370 58.737 56.400 -0.054 0.000 0.845 3314 E CB -1.548 28.126 29.700 -0.044 0.000 0.772 3314 E HN 0.380 nan 8.360 nan 0.000 0.462 3315 T N -1.196 113.333 114.554 -0.042 0.000 3.163 3315 T HA 0.251 4.601 4.350 -0.000 0.000 0.260 3315 T C 1.613 176.285 174.700 -0.046 0.000 1.156 3315 T CA 0.782 62.887 62.100 0.009 0.000 1.072 3315 T CB 0.159 69.083 68.868 0.094 0.000 0.937 3315 T HN 0.216 nan 8.240 nan 0.000 0.528 3316 A N 2.423 125.202 122.820 -0.069 0.000 1.884 3316 A HA 0.250 4.570 4.320 -0.000 0.000 0.212 3316 A C 2.279 179.828 177.584 -0.058 0.000 1.265 3316 A CA 0.603 52.608 52.037 -0.054 0.000 0.626 3316 A CB -0.446 18.541 19.000 -0.022 0.000 0.943 3316 A HN 0.385 nan 8.150 nan 0.000 0.466 3317 K N 0.016 120.370 120.400 -0.076 0.000 2.189 3317 K HA -0.240 4.080 4.320 -0.000 0.000 0.207 3317 K C 1.939 178.526 176.600 -0.022 0.000 1.046 3317 K CA 1.827 58.073 56.287 -0.070 0.000 0.928 3317 K CB -0.110 32.355 32.500 -0.059 0.000 0.720 3317 K HN 0.661 nan 8.250 nan 0.000 0.458 3318 E N 0.438 120.636 120.200 -0.003 0.000 2.208 3318 E HA -0.123 4.227 4.350 -0.000 0.000 0.193 3318 E C 1.783 178.410 176.600 0.044 0.000 0.988 3318 E CA 0.674 57.093 56.400 0.031 0.000 0.828 3318 E CB 0.131 29.867 29.700 0.060 0.000 0.763 3318 E HN 0.313 nan 8.360 nan 0.000 0.478 3319 I N 0.587 121.171 120.570 0.024 0.000 2.480 3319 I HA -0.172 3.998 4.170 -0.000 0.000 0.251 3319 I C 2.478 178.609 176.117 0.024 0.000 1.124 3319 I CA 0.628 61.946 61.300 0.031 0.000 1.444 3319 I CB -0.223 37.771 38.000 -0.010 0.000 1.098 3319 I HN 0.161 nan 8.210 nan 0.000 0.428 3320 E N 1.909 122.113 120.200 0.006 0.000 2.045 3320 E HA -0.387 3.963 4.350 -0.000 0.000 0.212 3320 E C 2.133 178.752 176.600 0.032 0.000 1.039 3320 E CA 2.370 58.783 56.400 0.021 0.000 0.860 3320 E CB -0.085 29.621 29.700 0.010 0.000 0.776 3320 E HN 0.222 nan 8.360 nan 0.000 0.467 3321 K N 0.455 120.871 120.400 0.028 0.000 2.020 3321 K HA -0.184 4.136 4.320 -0.000 0.000 0.212 3321 K C 1.977 178.595 176.600 0.031 0.000 1.050 3321 K CA 2.170 58.474 56.287 0.028 0.000 0.929 3321 K CB -0.002 32.514 32.500 0.025 0.000 0.714 3321 K HN 0.047 nan 8.250 nan 0.000 0.443 3322 K N -0.002 120.421 120.400 0.038 0.000 2.555 3322 K HA -0.037 4.283 4.320 -0.000 0.000 0.193 3322 K C 1.540 178.164 176.600 0.040 0.000 1.032 3322 K CA 0.667 56.980 56.287 0.042 0.000 1.004 3322 K CB 0.341 32.875 32.500 0.057 0.000 0.804 3322 K HN 0.076 nan 8.250 nan 0.000 0.496 3323 V N 0.272 120.208 119.914 0.037 0.000 2.672 3323 V HA -0.043 4.077 4.120 -0.000 0.000 0.242 3323 V C 2.030 178.140 176.094 0.026 0.000 1.059 3323 V CA 0.665 62.985 62.300 0.033 0.000 1.081 3323 V CB -0.256 31.587 31.823 0.034 0.000 0.752 3323 V HN 0.194 nan 8.190 nan 0.000 0.472 3324 R N 0.364 120.878 120.500 0.024 0.000 2.139 3324 R HA -0.205 4.135 4.340 -0.000 0.000 0.243 3324 R C 2.193 178.502 176.300 0.015 0.000 1.145 3324 R CA 1.742 57.852 56.100 0.017 0.000 0.976 3324 R CB -0.201 30.109 30.300 0.017 0.000 0.866 3324 R HN 0.594 nan 8.270 nan 0.000 0.449 3325 E N 0.201 120.412 120.200 0.019 0.000 2.208 3325 E HA -0.095 4.255 4.350 -0.000 0.000 0.193 3325 E C 1.450 178.061 176.600 0.018 0.000 0.988 3325 E CA 0.657 57.068 56.400 0.018 0.000 0.828 3325 E CB 0.178 29.890 29.700 0.020 0.000 0.763 3325 E HN 0.256 nan 8.360 nan 0.000 0.478 3326 L N 0.030 121.265 121.223 0.021 0.000 2.607 3326 L HA 0.118 4.458 4.340 -0.000 0.000 0.228 3326 L C 0.911 177.792 176.870 0.019 0.000 1.123 3326 L CA 0.191 55.044 54.840 0.021 0.000 0.890 3326 L CB 0.600 42.674 42.059 0.026 0.000 1.103 3326 L HN 0.058 nan 8.230 nan 0.000 0.468 3327 L N -1.098 120.135 121.223 0.016 0.000 3.521 3327 L HA 0.296 4.636 4.340 -0.000 0.000 0.323 3327 L C -0.867 176.008 176.870 0.007 0.000 1.268 3327 L CA 0.016 54.864 54.840 0.013 0.000 1.064 3327 L CB 0.899 42.967 42.059 0.015 0.000 1.455 3327 L HN -0.001 nan 8.230 nan 0.000 0.622 3328 L N 0.000 121.227 121.223 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 54.841 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