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 3izk_1_O DATA FIRST_RESID 6875 DATA SEQUENCE VLPENMKRYM GRDAQRMNIL AGRIIAETVR STLGPKGMDK MLVDDLGDVV DATA SEQUENCE VTNDGVTILR EMSVEHPAAK MLIEVAKTQE KEVGDGTTTA VVVAGELLRK DATA SEQUENCE AEELLDQNVH PTIVVKGYQA AAQKAQELLK TIACEVGAQD KEILTKIAMT DATA SEQUENCE SITGKGAEKA KEKLAEIIVE AVSAVVDDEG KVDKDLIKIE KKSGASIDDT DATA SEQUENCE ELIKGVLVDK ERVSAQMPKK VTDAKIALLN CAIEETASEM LKDMVAEIKA DATA SEQUENCE SGANVLFCQK GIDDLAQHYL AKEGIVAARR VKKSDMEKLA KATGANVIAA DATA SEQUENCE IAALSAQDLG DAGLVEERKI SGDSMIFVEE CKHPKAVTML IRGTTEHVIE DATA SEQUENCE EVARAVDDAV GVVGCTIEDG RIVSGGGSTE VELSMKLREY AEGISGREQL DATA SEQUENCE AVRAFADALE VIPRTLAENA GLDAIEILVK VRAAHASNGN KCAGLNVFTG DATA SEQUENCE AVEDMCENGV VEPLRVKTQA IQSAAESTEM LLRIDDVIAA E 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 6875 V HA 0.000 nan 4.120 nan 0.000 0.244 6875 V C 0.000 176.088 176.094 -0.010 0.000 1.182 6875 V CA 0.000 62.293 62.300 -0.011 0.000 1.235 6875 V CB 0.000 31.816 31.823 -0.012 0.000 1.184 6876 L N 1.833 123.048 121.223 -0.012 0.000 2.352 6876 L HA 0.607 4.947 4.340 -0.001 0.000 0.269 6876 L C -2.290 174.575 176.870 -0.009 0.000 1.034 6876 L CA -1.672 53.162 54.840 -0.010 0.000 0.806 6876 L CB 0.684 42.736 42.059 -0.012 0.000 1.244 6876 L HN 0.139 nan 8.230 nan 0.000 0.447 6877 P HA 0.011 nan 4.420 nan 0.000 0.265 6877 P C -0.657 176.640 177.300 -0.004 0.000 1.193 6877 P CA -0.259 62.839 63.100 -0.003 0.000 0.765 6877 P CB 0.394 32.094 31.700 -0.001 0.000 0.823 6878 E N 2.894 123.092 120.200 -0.004 0.000 2.480 6878 E HA -0.051 4.298 4.350 -0.001 0.000 0.258 6878 E C 0.688 177.288 176.600 -0.001 0.000 0.984 6878 E CA 0.952 57.349 56.400 -0.005 0.000 0.930 6878 E CB -0.321 29.376 29.700 -0.005 0.000 0.936 6878 E HN 0.532 nan 8.360 nan 0.000 0.466 6879 N N 2.104 120.804 118.700 -0.000 0.000 2.879 6879 N HA -0.188 4.552 4.740 -0.001 0.000 0.156 6879 N C -0.658 174.860 175.510 0.014 0.000 1.554 6879 N CA 0.888 53.943 53.050 0.007 0.000 2.252 6879 N CB -1.205 37.288 38.487 0.010 0.000 1.232 6879 N HN 0.542 nan 8.380 nan 0.000 0.861 6880 M N 1.662 121.268 119.600 0.009 0.000 2.249 6880 M HA 0.319 4.798 4.480 -0.001 0.000 0.351 6880 M C -0.763 175.539 176.300 0.004 0.000 1.180 6880 M CA -0.095 55.215 55.300 0.017 0.000 1.127 6880 M CB 0.596 33.202 32.600 0.010 0.000 1.546 6880 M HN -0.046 nan 8.290 nan 0.000 0.461 6881 K N 4.160 124.575 120.400 0.024 0.000 2.267 6881 K HA 0.614 4.933 4.320 -0.001 0.000 0.246 6881 K C -1.005 175.571 176.600 -0.040 0.000 0.954 6881 K CA -0.758 55.505 56.287 -0.039 0.000 0.824 6881 K CB 1.851 34.340 32.500 -0.017 0.000 1.167 6881 K HN 0.674 nan 8.250 nan 0.000 0.431 6882 R N 1.573 121.949 120.500 -0.206 0.000 2.686 6882 R HA 0.446 4.786 4.340 -0.001 0.000 0.286 6882 R C -0.906 175.166 176.300 -0.380 0.000 0.969 6882 R CA -0.753 55.266 56.100 -0.135 0.000 0.898 6882 R CB 1.274 31.533 30.300 -0.067 0.000 1.183 6882 R HN 0.558 nan 8.270 nan 0.000 0.456 6883 Y N 2.425 122.740 120.300 0.026 0.000 2.536 6883 Y HA 0.578 5.128 4.550 -0.000 0.000 0.347 6883 Y C 0.582 176.496 175.900 0.022 0.000 1.000 6883 Y CA -0.982 57.134 58.100 0.026 0.000 1.051 6883 Y CB 1.975 40.459 38.460 0.040 0.000 1.259 6883 Y HN 0.362 nan 8.280 nan 0.000 0.468 6884 M N 0.820 120.515 119.600 0.159 0.000 2.520 6884 M HA 0.784 5.264 4.480 -0.001 0.000 0.280 6884 M C 0.026 176.370 176.300 0.073 0.000 1.232 6884 M CA -0.240 55.114 55.300 0.089 0.000 0.892 6884 M CB 1.277 33.903 32.600 0.044 0.000 1.728 6884 M HN 0.891 nan 8.290 nan 0.000 0.475 6885 G N 2.729 111.559 108.800 0.050 0.000 2.561 6885 G HA2 -0.287 3.673 3.960 -0.001 0.000 0.289 6885 G HA3 -0.287 3.673 3.960 -0.001 0.000 0.289 6885 G C 0.672 175.590 174.900 0.031 0.000 1.169 6885 G CA 0.528 45.647 45.100 0.032 0.000 0.980 6885 G HN 0.842 nan 8.290 nan 0.000 0.550 6886 R N 1.082 121.596 120.500 0.023 0.000 2.152 6886 R HA -0.022 4.317 4.340 -0.001 0.000 0.232 6886 R C 2.102 178.421 176.300 0.032 0.000 1.117 6886 R CA 1.784 57.894 56.100 0.015 0.000 0.981 6886 R CB -0.795 29.509 30.300 0.007 0.000 0.870 6886 R HN 0.611 nan 8.270 nan 0.000 0.451 6887 D N 0.494 120.937 120.400 0.071 0.000 2.224 6887 D HA -0.032 4.608 4.640 -0.001 0.000 0.205 6887 D C 1.692 178.058 176.300 0.109 0.000 0.965 6887 D CA 1.158 55.233 54.000 0.125 0.000 0.852 6887 D CB -0.035 40.909 40.800 0.240 0.000 0.947 6887 D HN 0.169 nan 8.370 nan 0.000 0.494 6888 A N 0.656 123.541 122.820 0.108 0.000 1.929 6888 A HA -0.160 4.159 4.320 -0.001 0.000 0.216 6888 A C 2.092 179.694 177.584 0.030 0.000 1.176 6888 A CA 0.992 53.086 52.037 0.094 0.000 0.628 6888 A CB -0.205 18.850 19.000 0.092 0.000 0.816 6888 A HN 0.037 nan 8.150 nan 0.000 0.444 6889 Q N -0.445 119.362 119.800 0.012 0.000 2.016 6889 Q HA -0.173 4.167 4.340 -0.001 0.000 0.200 6889 Q C 2.252 178.227 176.000 -0.041 0.000 0.978 6889 Q CA 1.892 57.688 55.803 -0.012 0.000 0.833 6889 Q CB -0.469 28.260 28.738 -0.015 0.000 0.895 6889 Q HN 0.631 nan 8.270 nan 0.000 0.427 6890 R N 0.915 121.385 120.500 -0.051 0.000 2.075 6890 R HA -0.031 4.308 4.340 -0.001 0.000 0.232 6890 R C 2.183 178.387 176.300 -0.161 0.000 1.126 6890 R CA 1.522 57.571 56.100 -0.085 0.000 0.963 6890 R CB -0.617 29.644 30.300 -0.065 0.000 0.858 6890 R HN 0.306 nan 8.270 nan 0.000 0.435 6891 M N 0.296 119.760 119.600 -0.227 0.000 2.082 6891 M HA -0.231 4.248 4.480 -0.001 0.000 0.258 6891 M C 1.020 177.152 176.300 -0.280 0.000 1.069 6891 M CA 2.104 57.189 55.300 -0.359 0.000 1.102 6891 M CB -0.265 32.098 32.600 -0.395 0.000 1.336 6891 M HN 0.178 nan 8.290 nan 0.000 0.404 6892 N N 0.756 119.357 118.700 -0.165 0.000 2.188 6892 N HA -0.102 4.638 4.740 -0.001 0.000 0.184 6892 N C 1.655 177.072 175.510 -0.155 0.000 1.018 6892 N CA 1.365 54.320 53.050 -0.159 0.000 0.858 6892 N CB -0.429 38.038 38.487 -0.032 0.000 0.989 6892 N HN 0.395 nan 8.380 nan 0.000 0.426 6893 I N 0.547 121.048 120.570 -0.115 0.000 2.315 6893 I HA -0.142 4.028 4.170 -0.001 0.000 0.248 6893 I C 1.849 177.898 176.117 -0.114 0.000 1.117 6893 I CA 0.683 61.930 61.300 -0.089 0.000 1.404 6893 I CB -0.830 37.134 38.000 -0.061 0.000 1.071 6893 I HN 0.053 nan 8.210 nan 0.000 0.419 6894 L N 0.998 122.130 121.223 -0.151 0.000 2.093 6894 L HA -0.054 4.286 4.340 -0.001 0.000 0.208 6894 L C 2.722 179.488 176.870 -0.173 0.000 1.085 6894 L CA 1.810 56.559 54.840 -0.153 0.000 0.755 6894 L CB -1.338 40.614 42.059 -0.178 0.000 0.904 6894 L HN 0.167 nan 8.230 nan 0.000 0.435 6895 A N -0.550 122.114 122.820 -0.261 0.000 1.902 6895 A HA -0.112 4.208 4.320 -0.001 0.000 0.217 6895 A C 2.405 179.887 177.584 -0.170 0.000 1.181 6895 A CA 1.699 53.560 52.037 -0.294 0.000 0.623 6895 A CB -1.279 17.355 19.000 -0.610 0.000 0.818 6895 A HN 0.432 nan 8.150 nan 0.000 0.443 6896 G N -0.716 107.999 108.800 -0.141 0.000 2.422 6896 G HA2 -0.202 3.758 3.960 -0.001 0.000 0.218 6896 G HA3 -0.202 3.758 3.960 -0.001 0.000 0.218 6896 G C 1.672 176.530 174.900 -0.069 0.000 1.140 6896 G CA 1.139 46.189 45.100 -0.083 0.000 0.775 6896 G HN 0.520 nan 8.290 nan 0.000 0.545 6897 R N 0.636 121.089 120.500 -0.078 0.000 2.092 6897 R HA 0.109 4.448 4.340 -0.001 0.000 0.231 6897 R C 2.400 178.665 176.300 -0.058 0.000 1.119 6897 R CA 0.986 57.048 56.100 -0.064 0.000 0.970 6897 R CB -0.648 29.613 30.300 -0.065 0.000 0.864 6897 R HN 0.427 nan 8.270 nan 0.000 0.440 6898 I N 0.099 120.629 120.570 -0.066 0.000 2.163 6898 I HA -0.292 3.877 4.170 -0.001 0.000 0.243 6898 I C 1.773 177.866 176.117 -0.041 0.000 1.085 6898 I CA 1.060 62.329 61.300 -0.052 0.000 1.347 6898 I CB -0.282 37.685 38.000 -0.056 0.000 1.044 6898 I HN 0.140 nan 8.210 nan 0.000 0.408 6899 I N 0.899 121.444 120.570 -0.042 0.000 2.233 6899 I HA -0.202 3.968 4.170 -0.001 0.000 0.243 6899 I C 2.873 178.971 176.117 -0.032 0.000 1.093 6899 I CA 1.597 62.878 61.300 -0.031 0.000 1.380 6899 I CB -1.614 36.370 38.000 -0.027 0.000 1.067 6899 I HN 0.167 nan 8.210 nan 0.000 0.413 6900 A N 0.442 123.240 122.820 -0.038 0.000 1.940 6900 A HA -0.257 4.062 4.320 -0.001 0.000 0.219 6900 A C 2.282 179.843 177.584 -0.038 0.000 1.176 6900 A CA 2.096 54.111 52.037 -0.038 0.000 0.631 6900 A CB -0.574 18.401 19.000 -0.043 0.000 0.814 6900 A HN 0.407 nan 8.150 nan 0.000 0.446 6901 E N -0.492 119.685 120.200 -0.038 0.000 2.107 6901 E HA -0.081 4.269 4.350 -0.001 0.000 0.191 6901 E C 2.014 178.595 176.600 -0.031 0.000 0.982 6901 E CA 1.779 58.158 56.400 -0.035 0.000 0.809 6901 E CB -0.514 29.166 29.700 -0.035 0.000 0.756 6901 E HN 0.505 nan 8.360 nan 0.000 0.459 6902 T N 0.115 114.651 114.554 -0.029 0.000 2.746 6902 T HA -0.140 4.210 4.350 -0.001 0.000 0.267 6902 T C 1.881 176.566 174.700 -0.025 0.000 1.039 6902 T CA 1.793 63.878 62.100 -0.025 0.000 1.142 6902 T CB -0.322 68.532 68.868 -0.022 0.000 0.866 6902 T HN 0.267 nan 8.240 nan 0.000 0.444 6903 V N 1.866 121.765 119.914 -0.026 0.000 2.649 6903 V HA 0.013 4.133 4.120 -0.001 0.000 0.248 6903 V C 2.347 178.424 176.094 -0.030 0.000 1.054 6903 V CA 1.311 63.595 62.300 -0.026 0.000 1.073 6903 V CB -0.891 30.917 31.823 -0.025 0.000 0.699 6903 V HN 0.480 nan 8.190 nan 0.000 0.463 6904 R N 2.696 123.176 120.500 -0.033 0.000 2.241 6904 R HA -0.062 4.277 4.340 -0.001 0.000 0.224 6904 R C 2.015 178.293 176.300 -0.037 0.000 1.101 6904 R CA 1.594 57.671 56.100 -0.038 0.000 0.995 6904 R CB -0.985 29.291 30.300 -0.041 0.000 0.870 6904 R HN 0.690 nan 8.270 nan 0.000 0.463 6905 S N 0.029 115.709 115.700 -0.033 0.000 2.522 6905 S HA -0.073 4.396 4.470 -0.001 0.000 0.227 6905 S C 1.690 176.271 174.600 -0.033 0.000 0.986 6905 S CA 0.683 58.864 58.200 -0.033 0.000 0.929 6905 S CB 0.079 63.262 63.200 -0.029 0.000 0.769 6905 S HN 0.551 nan 8.310 nan 0.000 0.529 6906 T N -0.946 113.590 114.554 -0.031 0.000 3.069 6906 T HA 0.353 4.703 4.350 -0.001 0.000 0.252 6906 T C 0.323 175.003 174.700 -0.033 0.000 1.053 6906 T CA -0.522 61.561 62.100 -0.029 0.000 0.964 6906 T CB -0.435 68.419 68.868 -0.023 0.000 1.005 6906 T HN 0.258 nan 8.240 nan 0.000 0.532 6907 L N 2.927 124.128 121.223 -0.038 0.000 2.462 6907 L HA 0.519 4.858 4.340 -0.001 0.000 0.272 6907 L C 0.702 177.541 176.870 -0.052 0.000 1.166 6907 L CA 1.608 56.423 54.840 -0.041 0.000 0.880 6907 L CB -0.750 41.282 42.059 -0.044 0.000 1.142 6907 L HN 0.697 nan 8.230 nan 0.000 0.473 6908 G N 4.399 113.170 108.800 -0.048 0.000 2.663 6908 G HA2 -0.132 3.828 3.960 -0.001 0.000 0.686 6908 G HA3 -0.132 3.828 3.960 -0.001 0.000 0.686 6908 G C -2.067 172.788 174.900 -0.075 0.000 1.288 6908 G CA -0.340 44.719 45.100 -0.068 0.000 0.836 6908 G HN 0.552 nan 8.290 nan 0.000 0.584 6909 P HA 0.004 nan 4.420 nan 0.000 0.222 6909 P C 1.121 178.328 177.300 -0.155 0.000 1.147 6909 P CA 1.229 64.268 63.100 -0.103 0.000 0.790 6909 P CB 0.112 31.726 31.700 -0.145 0.000 0.780 6910 K N -0.211 120.061 120.400 -0.214 0.000 2.372 6910 K HA 0.272 4.592 4.320 -0.001 0.000 0.200 6910 K C 1.172 177.712 176.600 -0.100 0.000 1.022 6910 K CA -0.140 56.047 56.287 -0.167 0.000 1.125 6910 K CB -0.109 32.263 32.500 -0.212 0.000 0.855 6910 K HN 0.067 nan 8.250 nan 0.000 0.524 6911 G N 0.226 108.977 108.800 -0.082 0.000 2.616 6911 G HA2 0.245 4.205 3.960 -0.001 0.000 0.268 6911 G HA3 0.245 4.205 3.960 -0.001 0.000 0.268 6911 G C 0.017 174.893 174.900 -0.041 0.000 1.213 6911 G CA -0.513 44.553 45.100 -0.057 0.000 0.926 6911 G HN -0.069 nan 8.290 nan 0.000 0.523 6912 M N -0.045 119.535 119.600 -0.034 0.000 2.531 6912 M HA 0.401 4.881 4.480 -0.001 0.000 0.262 6912 M C -0.233 176.055 176.300 -0.021 0.000 1.168 6912 M CA -0.678 54.607 55.300 -0.026 0.000 0.926 6912 M CB 1.117 33.702 32.600 -0.025 0.000 1.445 6912 M HN 0.726 nan 8.290 nan 0.000 0.531 6913 D N -0.590 119.800 120.400 -0.018 0.000 2.493 6913 D HA 0.562 5.201 4.640 -0.001 0.000 0.239 6913 D C -1.301 174.989 176.300 -0.017 0.000 1.049 6913 D CA -0.763 53.228 54.000 -0.016 0.000 1.008 6913 D CB 1.271 42.063 40.800 -0.013 0.000 1.398 6913 D HN 0.116 nan 8.370 nan 0.000 0.513 6914 K N 0.346 120.737 120.400 -0.016 0.000 2.259 6914 K HA 0.397 4.716 4.320 -0.001 0.000 0.252 6914 K C -0.949 175.641 176.600 -0.017 0.000 0.936 6914 K CA -0.719 55.558 56.287 -0.016 0.000 0.810 6914 K CB 1.969 34.461 32.500 -0.014 0.000 1.143 6914 K HN 0.677 nan 8.250 nan 0.000 0.427 6915 M N 4.060 123.649 119.600 -0.019 0.000 2.047 6915 M HA 0.253 4.732 4.480 -0.001 0.000 0.342 6915 M C -1.493 174.796 176.300 -0.017 0.000 1.058 6915 M CA -0.972 54.315 55.300 -0.022 0.000 0.991 6915 M CB 0.367 32.951 32.600 -0.026 0.000 1.474 6915 M HN 0.347 nan 8.290 nan 0.000 0.419 6916 L N 6.055 127.269 121.223 -0.015 0.000 2.272 6916 L HA 0.522 4.861 4.340 -0.001 0.000 0.289 6916 L C -0.797 176.066 176.870 -0.011 0.000 1.032 6916 L CA -0.252 54.581 54.840 -0.011 0.000 0.810 6916 L CB 1.668 43.722 42.059 -0.008 0.000 1.205 6916 L HN 0.414 nan 8.230 nan 0.000 0.422 6917 V N 2.815 122.724 119.914 -0.009 0.000 2.407 6917 V HA 0.370 4.489 4.120 -0.001 0.000 0.291 6917 V C -0.352 175.740 176.094 -0.004 0.000 1.018 6917 V CA -0.940 61.355 62.300 -0.009 0.000 0.842 6917 V CB 1.528 33.345 31.823 -0.010 0.000 0.996 6917 V HN 0.806 nan 8.190 nan 0.000 0.426 6918 D N 2.245 122.644 120.400 -0.002 0.000 2.478 6918 D HA 0.094 4.733 4.640 -0.001 0.000 0.269 6918 D C 0.888 177.188 176.300 0.000 0.000 1.232 6918 D CA -0.494 53.506 54.000 -0.000 0.000 1.059 6918 D CB 0.705 41.506 40.800 0.001 0.000 1.104 6918 D HN 0.399 nan 8.370 nan 0.000 0.566 6919 D N -1.739 118.662 120.400 0.001 0.000 2.264 6919 D HA -0.088 4.551 4.640 -0.001 0.000 0.208 6919 D C 1.452 177.753 176.300 0.002 0.000 0.966 6919 D CA 0.624 54.625 54.000 0.002 0.000 0.864 6919 D CB 0.002 40.803 40.800 0.002 0.000 0.933 6919 D HN 0.185 nan 8.370 nan 0.000 0.499 6920 L N -1.005 120.219 121.223 0.003 0.000 2.558 6920 L HA 0.351 4.690 4.340 -0.001 0.000 0.225 6920 L C 1.952 178.824 176.870 0.004 0.000 1.128 6920 L CA 0.910 55.752 54.840 0.004 0.000 0.868 6920 L CB 0.144 42.205 42.059 0.004 0.000 1.006 6920 L HN 0.255 nan 8.230 nan 0.000 0.454 6921 G N -1.319 107.483 108.800 0.003 0.000 2.179 6921 G HA2 -0.254 3.706 3.960 -0.001 0.000 0.220 6921 G HA3 -0.254 3.706 3.960 -0.001 0.000 0.220 6921 G C 0.243 175.144 174.900 0.002 0.000 0.990 6921 G CA 0.101 45.202 45.100 0.002 0.000 0.646 6921 G HN 0.322 nan 8.290 nan 0.000 0.517 6922 D N 1.163 121.565 120.400 0.003 0.000 2.382 6922 D HA 0.394 5.033 4.640 -0.001 0.000 0.259 6922 D C 0.414 176.713 176.300 -0.003 0.000 1.224 6922 D CA 0.161 54.164 54.000 0.005 0.000 0.894 6922 D CB 1.099 41.904 40.800 0.008 0.000 1.127 6922 D HN 0.194 nan 8.370 nan 0.000 0.487 6923 V N 4.992 124.900 119.914 -0.009 0.000 2.347 6923 V HA 0.280 4.400 4.120 -0.001 0.000 0.280 6923 V C 0.128 176.204 176.094 -0.029 0.000 1.021 6923 V CA -0.794 61.491 62.300 -0.025 0.000 0.847 6923 V CB 1.581 33.379 31.823 -0.043 0.000 0.990 6923 V HN 0.334 nan 8.190 nan 0.000 0.444 6924 V N 6.044 125.945 119.914 -0.022 0.000 2.378 6924 V HA 0.449 4.569 4.120 -0.001 0.000 0.288 6924 V C -0.222 175.859 176.094 -0.022 0.000 1.016 6924 V CA -0.561 61.729 62.300 -0.017 0.000 0.840 6924 V CB 1.942 33.763 31.823 -0.004 0.000 0.994 6924 V HN 0.589 nan 8.190 nan 0.000 0.431 6925 V N 4.447 124.344 119.914 -0.029 0.000 2.357 6925 V HA 0.769 4.888 4.120 -0.001 0.000 0.284 6925 V C 0.104 176.190 176.094 -0.014 0.000 1.018 6925 V CA 0.020 62.303 62.300 -0.028 0.000 0.841 6925 V CB 1.587 33.383 31.823 -0.044 0.000 0.991 6925 V HN 0.976 nan 8.190 nan 0.000 0.437 6926 T N 2.641 117.188 114.554 -0.011 0.000 2.739 6926 T HA 0.306 4.655 4.350 -0.001 0.000 0.303 6926 T C 0.129 174.825 174.700 -0.007 0.000 1.389 6926 T CA -0.360 61.737 62.100 -0.005 0.000 1.001 6926 T CB 2.058 70.926 68.868 -0.001 0.000 1.436 6926 T HN 0.601 nan 8.240 nan 0.000 0.500 6927 N N 0.325 119.023 118.700 -0.004 0.000 2.210 6927 N HA 0.085 4.825 4.740 -0.001 0.000 0.203 6927 N C -0.780 174.727 175.510 -0.006 0.000 1.175 6927 N CA -0.020 53.027 53.050 -0.006 0.000 0.894 6927 N CB 0.445 38.929 38.487 -0.004 0.000 1.041 6927 N HN 0.552 nan 8.380 nan 0.000 0.506 6928 D N 0.359 120.757 120.400 -0.003 0.000 2.450 6928 D HA 0.093 4.733 4.640 -0.001 0.000 0.247 6928 D C 1.282 177.580 176.300 -0.004 0.000 1.162 6928 D CA 0.174 54.173 54.000 -0.002 0.000 0.879 6928 D CB 1.275 42.076 40.800 0.001 0.000 1.163 6928 D HN 0.290 nan 8.370 nan 0.000 0.472 6929 G N 1.658 110.455 108.800 -0.006 0.000 2.414 6929 G HA2 -0.206 3.753 3.960 -0.001 0.000 0.215 6929 G HA3 -0.206 3.753 3.960 -0.001 0.000 0.215 6929 G C 1.496 176.393 174.900 -0.005 0.000 1.188 6929 G CA 0.304 45.399 45.100 -0.008 0.000 0.783 6929 G HN 0.453 nan 8.290 nan 0.000 0.537 6930 V N 0.825 120.737 119.914 -0.003 0.000 2.515 6930 V HA -0.102 4.018 4.120 -0.001 0.000 0.250 6930 V C 2.969 179.064 176.094 0.000 0.000 1.058 6930 V CA 2.738 65.038 62.300 -0.001 0.000 1.064 6930 V CB -0.562 31.262 31.823 0.001 0.000 0.675 6930 V HN 0.401 nan 8.190 nan 0.000 0.461 6931 T N 0.563 115.117 114.554 0.000 0.000 2.777 6931 T HA -0.076 4.274 4.350 -0.001 0.000 0.266 6931 T C 1.752 176.452 174.700 -0.000 0.000 1.040 6931 T CA 1.968 64.069 62.100 0.001 0.000 1.141 6931 T CB -0.256 68.612 68.868 0.001 0.000 0.868 6931 T HN 0.461 nan 8.240 nan 0.000 0.444 6932 I N 0.627 121.195 120.570 -0.002 0.000 2.208 6932 I HA -0.145 4.024 4.170 -0.001 0.000 0.245 6932 I C 1.981 178.097 176.117 -0.002 0.000 1.097 6932 I CA 0.942 62.240 61.300 -0.003 0.000 1.363 6932 I CB -0.264 37.732 38.000 -0.006 0.000 1.051 6932 I HN 0.162 nan 8.210 nan 0.000 0.413 6933 L N 0.173 121.395 121.223 -0.001 0.000 2.217 6933 L HA -0.079 4.260 4.340 -0.001 0.000 0.211 6933 L C 2.458 179.330 176.870 0.004 0.000 1.107 6933 L CA 1.561 56.401 54.840 0.001 0.000 0.783 6933 L CB -0.751 41.308 42.059 0.001 0.000 0.919 6933 L HN 0.104 nan 8.230 nan 0.000 0.442 6934 R N -1.070 119.431 120.500 0.003 0.000 2.100 6934 R HA -0.035 4.305 4.340 -0.001 0.000 0.220 6934 R C 1.962 178.264 176.300 0.004 0.000 1.091 6934 R CA 0.662 56.764 56.100 0.004 0.000 0.986 6934 R CB 0.002 30.305 30.300 0.004 0.000 0.888 6934 R HN 0.273 nan 8.270 nan 0.000 0.444 6935 E N 0.983 121.185 120.200 0.003 0.000 2.086 6935 E HA -0.058 4.292 4.350 -0.001 0.000 0.190 6935 E C 1.283 177.884 176.600 0.002 0.000 0.975 6935 E CA 0.558 56.960 56.400 0.002 0.000 0.813 6935 E CB -0.104 29.596 29.700 0.001 0.000 0.768 6935 E HN 0.333 nan 8.360 nan 0.000 0.457 6936 M N -0.207 119.394 119.600 0.002 0.000 2.184 6936 M HA 0.098 4.578 4.480 -0.001 0.000 0.296 6936 M C 0.518 176.821 176.300 0.005 0.000 1.165 6936 M CA 0.361 55.663 55.300 0.002 0.000 1.175 6936 M CB 0.479 33.079 32.600 0.001 0.000 1.392 6936 M HN -0.239 nan 8.290 nan 0.000 0.457 6937 S N 1.538 117.242 115.700 0.007 0.000 2.466 6937 S HA 0.490 4.960 4.470 -0.001 0.000 0.313 6937 S C -0.893 173.716 174.600 0.015 0.000 1.078 6937 S CA -0.805 57.401 58.200 0.010 0.000 1.115 6937 S CB -0.016 63.190 63.200 0.010 0.000 1.006 6937 S HN 0.508 nan 8.310 nan 0.000 0.487 6938 V N 5.729 125.654 119.914 0.018 0.000 2.439 6938 V HA 0.426 4.545 4.120 -0.001 0.000 0.282 6938 V C 0.611 176.726 176.094 0.035 0.000 1.039 6938 V CA -0.405 61.912 62.300 0.028 0.000 0.913 6938 V CB 1.623 33.462 31.823 0.027 0.000 0.983 6938 V HN 0.793 nan 8.190 nan 0.000 0.460 6939 E N 1.144 121.375 120.200 0.052 0.000 2.228 6939 E HA 0.091 4.441 4.350 -0.001 0.000 0.197 6939 E C 0.722 177.357 176.600 0.058 0.000 0.909 6939 E CA 0.111 56.539 56.400 0.046 0.000 0.911 6939 E CB -0.005 29.722 29.700 0.044 0.000 0.887 6939 E HN 0.693 nan 8.360 nan 0.000 0.481 6940 H N 2.736 121.810 119.070 0.006 0.000 2.803 6940 H HA 0.043 4.599 4.556 -0.001 0.000 0.330 6940 H C -1.713 173.617 175.328 0.005 0.000 1.057 6940 H CA -1.410 54.642 56.048 0.007 0.000 1.458 6940 H CB 1.528 31.290 29.762 -0.001 0.000 1.470 6940 H HN -0.207 nan 8.280 nan 0.000 0.560 6941 P HA -0.147 nan 4.420 nan 0.000 0.216 6941 P C 1.075 178.484 177.300 0.183 0.000 1.150 6941 P CA 2.023 65.158 63.100 0.058 0.000 0.843 6941 P CB 0.119 31.793 31.700 -0.042 0.000 0.787 6942 A N 0.012 123.096 122.820 0.440 0.000 1.877 6942 A HA -0.090 4.229 4.320 -0.001 0.000 0.216 6942 A C 2.329 179.962 177.584 0.082 0.000 1.186 6942 A CA 2.075 54.231 52.037 0.198 0.000 0.620 6942 A CB -1.566 17.460 19.000 0.043 0.000 0.822 6942 A HN 0.201 nan 8.150 nan 0.000 0.443 6943 A N -0.364 122.506 122.820 0.083 0.000 1.969 6943 A HA -0.103 4.217 4.320 -0.001 0.000 0.218 6943 A C 2.078 179.688 177.584 0.043 0.000 1.169 6943 A CA 1.658 53.715 52.037 0.034 0.000 0.635 6943 A CB -0.359 18.657 19.000 0.027 0.000 0.810 6943 A HN 0.542 nan 8.150 nan 0.000 0.445 6944 K N -0.957 119.482 120.400 0.065 0.000 2.097 6944 K HA -0.034 4.286 4.320 -0.001 0.000 0.205 6944 K C 1.855 178.476 176.600 0.035 0.000 1.050 6944 K CA 1.291 57.604 56.287 0.043 0.000 0.938 6944 K CB -0.190 32.334 32.500 0.041 0.000 0.718 6944 K HN 0.347 nan 8.250 nan 0.000 0.442 6945 M N 0.624 120.249 119.600 0.041 0.000 2.254 6945 M HA -0.052 4.427 4.480 -0.001 0.000 0.265 6945 M C 2.169 178.483 176.300 0.024 0.000 1.066 6945 M CA 1.037 56.355 55.300 0.032 0.000 1.123 6945 M CB -0.671 31.952 32.600 0.037 0.000 1.388 6945 M HN 0.200 nan 8.290 nan 0.000 0.425 6946 L N 0.370 121.606 121.223 0.021 0.000 2.046 6946 L HA -0.217 4.123 4.340 -0.001 0.000 0.208 6946 L C 2.225 179.100 176.870 0.009 0.000 1.077 6946 L CA 1.226 56.072 54.840 0.010 0.000 0.747 6946 L CB -0.175 41.885 42.059 0.001 0.000 0.896 6946 L HN 0.156 nan 8.230 nan 0.000 0.432 6947 I N -0.333 120.244 120.570 0.012 0.000 2.208 6947 I HA -0.284 3.886 4.170 -0.001 0.000 0.245 6947 I C 2.468 178.591 176.117 0.010 0.000 1.097 6947 I CA 1.053 62.359 61.300 0.009 0.000 1.363 6947 I CB -0.404 37.603 38.000 0.012 0.000 1.051 6947 I HN 0.310 nan 8.210 nan 0.000 0.413 6948 E N 0.468 120.676 120.200 0.013 0.000 2.118 6948 E HA -0.165 4.185 4.350 -0.001 0.000 0.195 6948 E C 2.419 179.026 176.600 0.011 0.000 0.992 6948 E CA 1.161 57.569 56.400 0.012 0.000 0.804 6948 E CB -0.259 29.450 29.700 0.015 0.000 0.741 6948 E HN 0.367 nan 8.360 nan 0.000 0.458 6949 V N 1.467 121.388 119.914 0.011 0.000 2.358 6949 V HA -0.219 3.900 4.120 -0.001 0.000 0.246 6949 V C 2.461 178.559 176.094 0.006 0.000 1.047 6949 V CA 1.714 64.020 62.300 0.010 0.000 1.035 6949 V CB -0.807 31.022 31.823 0.009 0.000 0.658 6949 V HN 0.239 nan 8.190 nan 0.000 0.452 6950 A N -0.319 122.503 122.820 0.004 0.000 1.933 6950 A HA -0.223 4.097 4.320 -0.001 0.000 0.218 6950 A C 2.283 179.869 177.584 0.003 0.000 1.175 6950 A CA 1.820 53.858 52.037 0.001 0.000 0.628 6950 A CB -0.400 18.600 19.000 -0.000 0.000 0.814 6950 A HN 0.543 nan 8.150 nan 0.000 0.444 6951 K N -0.928 119.475 120.400 0.005 0.000 2.155 6951 K HA -0.062 4.258 4.320 -0.001 0.000 0.203 6951 K C 1.970 178.573 176.600 0.006 0.000 1.052 6951 K CA 1.513 57.803 56.287 0.005 0.000 0.948 6951 K CB -0.279 32.225 32.500 0.006 0.000 0.728 6951 K HN 0.460 nan 8.250 nan 0.000 0.448 6952 T N 1.191 115.749 114.554 0.007 0.000 2.777 6952 T HA -0.182 4.168 4.350 -0.001 0.000 0.266 6952 T C 1.830 176.534 174.700 0.007 0.000 1.040 6952 T CA 1.360 63.465 62.100 0.008 0.000 1.141 6952 T CB -0.128 68.746 68.868 0.010 0.000 0.868 6952 T HN 0.179 nan 8.240 nan 0.000 0.444 6953 Q N 1.395 121.198 119.800 0.005 0.000 2.096 6953 Q HA -0.128 4.212 4.340 -0.001 0.000 0.204 6953 Q C 2.100 178.102 176.000 0.004 0.000 0.982 6953 Q CA 1.922 57.727 55.803 0.004 0.000 0.850 6953 Q CB -0.264 28.474 28.738 0.001 0.000 0.901 6953 Q HN 0.679 nan 8.270 nan 0.000 0.422 6954 E N -0.741 119.461 120.200 0.003 0.000 2.072 6954 E HA -0.184 4.166 4.350 -0.001 0.000 0.191 6954 E C 1.591 178.193 176.600 0.004 0.000 0.985 6954 E CA 0.974 57.376 56.400 0.003 0.000 0.801 6954 E CB 0.063 29.765 29.700 0.003 0.000 0.750 6954 E HN 0.139 nan 8.360 nan 0.000 0.452 6955 K N 0.372 120.775 120.400 0.004 0.000 2.147 6955 K HA -0.115 4.204 4.320 -0.001 0.000 0.205 6955 K C 1.940 178.543 176.600 0.005 0.000 1.049 6955 K CA 0.999 57.289 56.287 0.005 0.000 0.936 6955 K CB 0.026 32.529 32.500 0.005 0.000 0.722 6955 K HN 0.239 nan 8.250 nan 0.000 0.446 6956 E N -0.010 120.194 120.200 0.006 0.000 2.045 6956 E HA -0.022 4.328 4.350 -0.001 0.000 0.190 6956 E C 2.228 178.832 176.600 0.006 0.000 0.968 6956 E CA 0.759 57.163 56.400 0.006 0.000 0.813 6956 E CB -0.048 29.657 29.700 0.008 0.000 0.780 6956 E HN -0.025 nan 8.360 nan 0.000 0.455 6957 V N -0.789 119.129 119.914 0.006 0.000 2.788 6957 V HA 0.207 4.326 4.120 -0.001 0.000 0.241 6957 V C 1.679 177.776 176.094 0.005 0.000 1.083 6957 V CA 1.160 63.463 62.300 0.006 0.000 1.103 6957 V CB 0.277 32.104 31.823 0.005 0.000 0.800 6957 V HN 0.508 nan 8.190 nan 0.000 0.476 6958 G N 0.296 109.099 108.800 0.004 0.000 4.677 6958 G HA2 -0.277 3.682 3.960 -0.001 0.000 0.215 6958 G HA3 -0.277 3.682 3.960 -0.001 0.000 0.215 6958 G C 0.168 175.071 174.900 0.004 0.000 1.506 6958 G CA 0.327 45.429 45.100 0.004 0.000 1.016 6958 G HN 0.482 nan 8.290 nan 0.000 0.653 6959 D N 1.668 122.071 120.400 0.005 0.000 2.377 6959 D HA 0.486 5.125 4.640 -0.001 0.000 0.245 6959 D C 1.482 177.783 176.300 0.003 0.000 1.196 6959 D CA 1.589 55.592 54.000 0.005 0.000 0.962 6959 D CB 0.390 41.195 40.800 0.008 0.000 1.127 6959 D HN 1.800 nan 8.370 nan 0.000 0.471 6960 G N 0.234 109.034 108.800 0.001 0.000 2.147 6960 G HA2 -0.303 3.657 3.960 -0.001 0.000 0.244 6960 G HA3 -0.303 3.657 3.960 -0.001 0.000 0.244 6960 G C 1.019 175.915 174.900 -0.007 0.000 1.005 6960 G CA 1.326 46.423 45.100 -0.004 0.000 0.713 6960 G HN 0.657 nan 8.290 nan 0.000 0.515 6961 T N -3.393 111.158 114.554 -0.006 0.000 2.833 6961 T HA -0.083 4.267 4.350 -0.001 0.000 0.269 6961 T C 2.202 176.895 174.700 -0.012 0.000 1.054 6961 T CA 2.460 64.556 62.100 -0.007 0.000 1.135 6961 T CB -0.365 68.500 68.868 -0.005 0.000 0.869 6961 T HN 0.308 nan 8.240 nan 0.000 0.466 6962 T N 1.884 116.430 114.554 -0.015 0.000 2.732 6962 T HA -0.044 4.305 4.350 -0.001 0.000 0.261 6962 T C 2.293 176.977 174.700 -0.027 0.000 1.040 6962 T CA 1.695 63.782 62.100 -0.021 0.000 1.145 6962 T CB -0.922 67.933 68.868 -0.022 0.000 0.866 6962 T HN 0.471 nan 8.240 nan 0.000 0.427 6963 T N 2.330 116.869 114.554 -0.026 0.000 2.665 6963 T HA -0.128 4.221 4.350 -0.001 0.000 0.268 6963 T C 2.365 177.042 174.700 -0.038 0.000 1.035 6963 T CA 1.357 63.437 62.100 -0.034 0.000 1.151 6963 T CB -0.646 68.205 68.868 -0.029 0.000 0.862 6963 T HN 0.424 nan 8.240 nan 0.000 0.438 6964 A N 0.790 123.593 122.820 -0.030 0.000 1.908 6964 A HA -0.081 4.238 4.320 -0.001 0.000 0.218 6964 A C 2.597 180.160 177.584 -0.034 0.000 1.181 6964 A CA 1.625 53.644 52.037 -0.029 0.000 0.627 6964 A CB -0.977 18.013 19.000 -0.017 0.000 0.818 6964 A HN 0.384 nan 8.150 nan 0.000 0.445 6965 V N -0.603 119.293 119.914 -0.030 0.000 2.453 6965 V HA -0.175 3.944 4.120 -0.001 0.000 0.247 6965 V C 2.545 178.613 176.094 -0.043 0.000 1.048 6965 V CA 1.711 63.992 62.300 -0.031 0.000 1.049 6965 V CB -0.592 31.215 31.823 -0.026 0.000 0.672 6965 V HN 0.365 nan 8.190 nan 0.000 0.457 6966 V N -0.197 119.689 119.914 -0.047 0.000 2.343 6966 V HA -0.214 3.906 4.120 -0.001 0.000 0.247 6966 V C 2.438 178.488 176.094 -0.074 0.000 1.051 6966 V CA 1.877 64.143 62.300 -0.056 0.000 1.036 6966 V CB -0.415 31.375 31.823 -0.055 0.000 0.654 6966 V HN 0.400 nan 8.190 nan 0.000 0.451 6967 V N 0.359 120.223 119.914 -0.083 0.000 2.295 6967 V HA -0.257 3.862 4.120 -0.001 0.000 0.246 6967 V C 2.704 178.721 176.094 -0.128 0.000 1.049 6967 V CA 2.106 64.335 62.300 -0.119 0.000 1.024 6967 V CB -1.123 30.627 31.823 -0.121 0.000 0.648 6967 V HN 0.562 nan 8.190 nan 0.000 0.447 6968 A N 0.325 123.091 122.820 -0.089 0.000 1.972 6968 A HA -0.049 4.271 4.320 -0.001 0.000 0.219 6968 A C 2.375 179.924 177.584 -0.058 0.000 1.169 6968 A CA 1.795 53.791 52.037 -0.068 0.000 0.635 6968 A CB -1.066 17.913 19.000 -0.035 0.000 0.810 6968 A HN 0.534 nan 8.150 nan 0.000 0.446 6969 G N -0.373 108.392 108.800 -0.059 0.000 2.404 6969 G HA2 -0.223 3.737 3.960 -0.001 0.000 0.215 6969 G HA3 -0.223 3.737 3.960 -0.001 0.000 0.215 6969 G C 1.483 176.350 174.900 -0.054 0.000 1.174 6969 G CA 1.275 46.345 45.100 -0.051 0.000 0.780 6969 G HN 0.544 nan 8.290 nan 0.000 0.537 6970 E N -0.001 120.155 120.200 -0.074 0.000 2.152 6970 E HA -0.033 4.317 4.350 -0.001 0.000 0.192 6970 E C 2.284 178.833 176.600 -0.086 0.000 0.983 6970 E CA 0.371 56.724 56.400 -0.078 0.000 0.818 6970 E CB -0.407 29.234 29.700 -0.098 0.000 0.758 6970 E HN 0.257 nan 8.360 nan 0.000 0.467 6971 L N 0.112 121.259 121.223 -0.126 0.000 2.083 6971 L HA -0.068 4.271 4.340 -0.001 0.000 0.209 6971 L C 2.025 178.893 176.870 -0.004 0.000 1.083 6971 L CA 1.587 56.328 54.840 -0.165 0.000 0.752 6971 L CB -0.412 41.500 42.059 -0.246 0.000 0.899 6971 L HN 0.256 nan 8.230 nan 0.000 0.433 6972 L N -1.166 120.065 121.223 0.013 0.000 2.093 6972 L HA -0.147 4.193 4.340 -0.001 0.000 0.208 6972 L C 2.732 179.627 176.870 0.042 0.000 1.085 6972 L CA 0.978 55.850 54.840 0.054 0.000 0.755 6972 L CB -0.445 41.624 42.059 0.017 0.000 0.904 6972 L HN 0.216 nan 8.230 nan 0.000 0.435 6973 R N -0.121 120.385 120.500 0.009 0.000 2.081 6973 R HA -0.120 4.220 4.340 -0.001 0.000 0.235 6973 R C 2.285 178.602 176.300 0.028 0.000 1.131 6973 R CA 0.925 57.027 56.100 0.004 0.000 0.960 6973 R CB -0.143 30.146 30.300 -0.017 0.000 0.856 6973 R HN 0.218 nan 8.270 nan 0.000 0.436 6974 K N 0.376 120.804 120.400 0.046 0.000 2.148 6974 K HA -0.028 4.292 4.320 -0.001 0.000 0.204 6974 K C 2.025 178.723 176.600 0.163 0.000 1.050 6974 K CA 1.197 57.538 56.287 0.090 0.000 0.942 6974 K CB -0.160 32.388 32.500 0.080 0.000 0.724 6974 K HN 0.142 nan 8.250 nan 0.000 0.446 6975 A N 1.605 124.557 122.820 0.219 0.000 1.898 6975 A HA -0.167 4.153 4.320 -0.001 0.000 0.216 6975 A C 2.138 179.757 177.584 0.059 0.000 1.181 6975 A CA 1.369 53.513 52.037 0.178 0.000 0.620 6975 A CB -0.288 18.850 19.000 0.231 0.000 0.819 6975 A HN 0.247 nan 8.150 nan 0.000 0.442 6976 E N 0.266 120.494 120.200 0.046 0.000 2.150 6976 E HA -0.182 4.168 4.350 -0.001 0.000 0.193 6976 E C 1.776 178.382 176.600 0.010 0.000 0.985 6976 E CA 1.282 57.689 56.400 0.012 0.000 0.814 6976 E CB -0.150 29.550 29.700 0.001 0.000 0.752 6976 E HN 0.762 nan 8.360 nan 0.000 0.466 6977 E N 0.207 120.421 120.200 0.023 0.000 2.106 6977 E HA -0.118 4.232 4.350 -0.001 0.000 0.192 6977 E C 2.345 178.956 176.600 0.019 0.000 0.984 6977 E CA 0.684 57.095 56.400 0.019 0.000 0.806 6977 E CB -0.007 29.709 29.700 0.026 0.000 0.750 6977 E HN 0.251 nan 8.360 nan 0.000 0.458 6978 L N 0.309 121.548 121.223 0.027 0.000 2.046 6978 L HA -0.198 4.141 4.340 -0.001 0.000 0.208 6978 L C 2.225 179.090 176.870 -0.009 0.000 1.077 6978 L CA 0.508 55.356 54.840 0.012 0.000 0.747 6978 L CB -0.238 41.825 42.059 0.006 0.000 0.896 6978 L HN 0.168 nan 8.230 nan 0.000 0.432 6979 L N -0.181 121.031 121.223 -0.019 0.000 2.093 6979 L HA -0.224 4.116 4.340 -0.001 0.000 0.208 6979 L C 2.105 178.961 176.870 -0.023 0.000 1.085 6979 L CA 1.719 56.538 54.840 -0.035 0.000 0.755 6979 L CB -0.787 41.248 42.059 -0.041 0.000 0.904 6979 L HN 0.247 nan 8.230 nan 0.000 0.435 6980 D N -1.279 119.114 120.400 -0.011 0.000 2.144 6980 D HA -0.171 4.468 4.640 -0.001 0.000 0.200 6980 D C 1.790 178.089 176.300 -0.002 0.000 0.978 6980 D CA 0.774 54.771 54.000 -0.006 0.000 0.833 6980 D CB 0.162 40.961 40.800 -0.002 0.000 0.961 6980 D HN 0.224 nan 8.370 nan 0.000 0.470 6981 Q N 0.083 119.883 119.800 0.001 0.000 2.466 6981 Q HA 0.010 4.349 4.340 -0.001 0.000 0.210 6981 Q C 0.208 176.210 176.000 0.004 0.000 0.961 6981 Q CA 0.191 55.998 55.803 0.005 0.000 0.953 6981 Q CB -0.078 28.666 28.738 0.011 0.000 1.011 6981 Q HN 0.319 nan 8.270 nan 0.000 0.516 6982 N N -0.616 118.083 118.700 -0.002 0.000 2.776 6982 N HA -0.154 4.586 4.740 -0.001 0.000 0.249 6982 N C -1.323 174.192 175.510 0.008 0.000 1.111 6982 N CA 0.300 53.350 53.050 0.000 0.000 0.711 6982 N CB -1.149 37.342 38.487 0.008 0.000 1.065 6982 N HN -0.025 nan 8.380 nan 0.000 0.556 6983 V N 1.927 121.840 119.914 -0.001 0.000 2.385 6983 V HA 0.126 4.245 4.120 -0.001 0.000 0.269 6983 V C 0.934 177.028 176.094 0.000 0.000 1.043 6983 V CA -0.729 61.577 62.300 0.009 0.000 0.906 6983 V CB 1.016 32.836 31.823 -0.005 0.000 0.995 6983 V HN 0.327 nan 8.190 nan 0.000 0.467 6984 H N 8.338 127.388 119.070 -0.032 0.000 3.034 6984 H HA 0.040 4.596 4.556 -0.001 0.000 0.324 6984 H C -1.684 173.613 175.328 -0.052 0.000 1.015 6984 H CA -1.221 54.807 56.048 -0.034 0.000 1.429 6984 H CB 1.644 31.389 29.762 -0.028 0.000 1.429 6984 H HN 0.380 nan 8.280 nan 0.000 0.585 6985 P HA -0.178 nan 4.420 nan 0.000 0.217 6985 P C 1.522 178.853 177.300 0.050 0.000 1.148 6985 P CA 1.801 64.837 63.100 -0.106 0.000 0.834 6985 P CB 0.069 31.665 31.700 -0.174 0.000 0.783 6986 T N -1.747 113.000 114.554 0.321 0.000 2.915 6986 T HA -0.078 4.272 4.350 -0.001 0.000 0.269 6986 T C 1.571 176.295 174.700 0.040 0.000 1.071 6986 T CA 0.755 62.946 62.100 0.151 0.000 1.132 6986 T CB -0.515 68.403 68.868 0.084 0.000 0.878 6986 T HN -0.149 nan 8.240 nan 0.000 0.479 6987 I N 0.720 121.320 120.570 0.049 0.000 2.333 6987 I HA -0.014 4.156 4.170 -0.001 0.000 0.246 6987 I C 2.539 178.593 176.117 -0.105 0.000 1.106 6987 I CA 0.814 62.102 61.300 -0.019 0.000 1.411 6987 I CB -1.313 36.690 38.000 0.004 0.000 1.082 6987 I HN 0.151 nan 8.210 nan 0.000 0.420 6988 V N 0.735 120.548 119.914 -0.168 0.000 2.343 6988 V HA -0.222 3.897 4.120 -0.001 0.000 0.247 6988 V C 2.699 178.468 176.094 -0.543 0.000 1.051 6988 V CA 1.305 63.349 62.300 -0.427 0.000 1.036 6988 V CB -0.558 31.028 31.823 -0.395 0.000 0.654 6988 V HN 0.167 nan 8.190 nan 0.000 0.451 6989 V N 0.058 119.823 119.914 -0.249 0.000 2.261 6989 V HA -0.274 3.846 4.120 -0.001 0.000 0.246 6989 V C 2.485 178.540 176.094 -0.066 0.000 1.047 6989 V CA 2.380 64.611 62.300 -0.116 0.000 1.015 6989 V CB -0.673 31.128 31.823 -0.037 0.000 0.642 6989 V HN 0.531 nan 8.190 nan 0.000 0.446 6990 K N 1.115 121.476 120.400 -0.065 0.000 2.026 6990 K HA -0.106 4.214 4.320 -0.001 0.000 0.208 6990 K C 2.051 178.628 176.600 -0.039 0.000 1.048 6990 K CA 1.946 58.209 56.287 -0.040 0.000 0.929 6990 K CB -1.168 31.311 32.500 -0.035 0.000 0.713 6990 K HN 0.387 nan 8.250 nan 0.000 0.439 6991 G N -0.808 107.961 108.800 -0.051 0.000 2.418 6991 G HA2 -0.222 3.738 3.960 -0.001 0.000 0.217 6991 G HA3 -0.222 3.738 3.960 -0.001 0.000 0.217 6991 G C 1.211 176.145 174.900 0.058 0.000 1.158 6991 G CA 0.837 45.941 45.100 0.005 0.000 0.771 6991 G HN 0.268 nan 8.290 nan 0.000 0.545 6992 Y N 0.403 120.626 120.300 -0.128 0.000 2.200 6992 Y HA -0.044 4.506 4.550 -0.001 0.000 0.290 6992 Y C 2.891 178.545 175.900 -0.409 0.000 1.137 6992 Y CA 1.076 59.015 58.100 -0.267 0.000 1.163 6992 Y CB -0.944 37.547 38.460 0.052 0.000 0.988 6992 Y HN 0.270 nan 8.280 nan 0.000 0.518 6993 Q N 0.319 120.108 119.800 -0.019 0.000 2.123 6993 Q HA -0.031 4.309 4.340 -0.001 0.000 0.199 6993 Q C 2.290 178.219 176.000 -0.118 0.000 0.966 6993 Q CA 1.528 57.300 55.803 -0.052 0.000 0.845 6993 Q CB -0.404 28.329 28.738 -0.008 0.000 0.907 6993 Q HN 0.328 nan 8.270 nan 0.000 0.439 6994 A N 0.270 123.018 122.820 -0.120 0.000 1.855 6994 A HA -0.005 4.314 4.320 -0.001 0.000 0.215 6994 A C 2.278 179.769 177.584 -0.156 0.000 1.191 6994 A CA 1.861 53.834 52.037 -0.106 0.000 0.613 6994 A CB -1.196 17.765 19.000 -0.066 0.000 0.829 6994 A HN 0.494 nan 8.150 nan 0.000 0.442 6995 A N -0.319 122.317 122.820 -0.306 0.000 1.930 6995 A HA 0.232 4.552 4.320 -0.001 0.000 0.217 6995 A C 2.458 179.792 177.584 -0.416 0.000 1.175 6995 A CA 1.874 53.683 52.037 -0.380 0.000 0.627 6995 A CB -0.904 17.731 19.000 -0.608 0.000 0.815 6995 A HN 1.028 nan 8.150 nan 0.000 0.443 6996 A N -1.077 121.364 122.820 -0.632 0.000 1.930 6996 A HA -0.156 4.164 4.320 -0.001 0.000 0.217 6996 A C 2.098 179.662 177.584 -0.033 0.000 1.175 6996 A CA 1.543 53.472 52.037 -0.180 0.000 0.627 6996 A CB -0.399 18.545 19.000 -0.093 0.000 0.815 6996 A HN 0.481 nan 8.150 nan 0.000 0.443 6997 Q N -0.071 119.691 119.800 -0.063 0.000 2.119 6997 Q HA -0.111 4.229 4.340 -0.001 0.000 0.201 6997 Q C 1.751 177.759 176.000 0.013 0.000 0.972 6997 Q CA 1.209 57.002 55.803 -0.017 0.000 0.847 6997 Q CB -0.268 28.452 28.738 -0.031 0.000 0.903 6997 Q HN 0.516 nan 8.270 nan 0.000 0.433 6998 K N 0.229 120.646 120.400 0.027 0.000 2.167 6998 K HA 0.099 4.419 4.320 -0.001 0.000 0.203 6998 K C 1.946 178.634 176.600 0.148 0.000 1.052 6998 K CA 0.802 57.149 56.287 0.100 0.000 0.956 6998 K CB -0.103 32.504 32.500 0.179 0.000 0.735 6998 K HN 0.113 nan 8.250 nan 0.000 0.451 6999 A N 1.575 124.474 122.820 0.132 0.000 1.902 6999 A HA -0.201 4.119 4.320 -0.001 0.000 0.217 6999 A C 2.131 179.779 177.584 0.107 0.000 1.181 6999 A CA 1.374 53.500 52.037 0.148 0.000 0.623 6999 A CB -0.382 18.756 19.000 0.229 0.000 0.818 6999 A HN 0.350 nan 8.150 nan 0.000 0.443 7000 Q N -0.880 118.972 119.800 0.087 0.000 2.172 7000 Q HA -0.124 4.216 4.340 -0.001 0.000 0.200 7000 Q C 1.881 177.916 176.000 0.057 0.000 0.964 7000 Q CA 1.100 56.941 55.803 0.064 0.000 0.855 7000 Q CB -0.089 28.679 28.738 0.050 0.000 0.918 7000 Q HN 0.581 nan 8.270 nan 0.000 0.444 7001 E N 0.530 120.767 120.200 0.062 0.000 2.110 7001 E HA -0.150 4.200 4.350 -0.001 0.000 0.193 7001 E C 1.948 178.593 176.600 0.075 0.000 0.988 7001 E CA 0.798 57.233 56.400 0.058 0.000 0.804 7001 E CB 0.005 29.736 29.700 0.052 0.000 0.745 7001 E HN 0.218 nan 8.360 nan 0.000 0.458 7002 L N 0.457 121.740 121.223 0.100 0.000 2.093 7002 L HA -0.096 4.244 4.340 -0.001 0.000 0.208 7002 L C 2.423 179.335 176.870 0.069 0.000 1.085 7002 L CA 1.123 56.023 54.840 0.100 0.000 0.755 7002 L CB -0.821 41.305 42.059 0.111 0.000 0.904 7002 L HN 0.095 nan 8.230 nan 0.000 0.435 7003 L N -1.031 120.229 121.223 0.062 0.000 2.093 7003 L HA -0.220 4.120 4.340 -0.001 0.000 0.208 7003 L C 2.432 179.326 176.870 0.041 0.000 1.085 7003 L CA 1.196 56.064 54.840 0.047 0.000 0.755 7003 L CB -0.451 41.634 42.059 0.043 0.000 0.904 7003 L HN 0.231 nan 8.230 nan 0.000 0.435 7004 K N -0.772 119.652 120.400 0.041 0.000 2.155 7004 K HA -0.083 4.237 4.320 -0.001 0.000 0.203 7004 K C 2.046 178.666 176.600 0.034 0.000 1.052 7004 K CA 1.444 57.751 56.287 0.033 0.000 0.948 7004 K CB -0.135 32.384 32.500 0.030 0.000 0.728 7004 K HN 0.263 nan 8.250 nan 0.000 0.448 7005 T N 1.949 116.528 114.554 0.042 0.000 2.777 7005 T HA -0.075 4.274 4.350 -0.001 0.000 0.266 7005 T C 1.851 176.574 174.700 0.037 0.000 1.040 7005 T CA 1.263 63.388 62.100 0.042 0.000 1.141 7005 T CB -0.120 68.782 68.868 0.057 0.000 0.868 7005 T HN 0.384 nan 8.240 nan 0.000 0.444 7006 I N -0.455 120.140 120.570 0.040 0.000 3.728 7006 I HA 0.474 4.643 4.170 -0.001 0.000 0.307 7006 I C 1.018 177.152 176.117 0.030 0.000 1.276 7006 I CA -0.598 60.724 61.300 0.037 0.000 1.285 7006 I CB -0.426 37.602 38.000 0.047 0.000 1.038 7006 I HN -0.056 nan 8.210 nan 0.000 0.445 7007 A N 1.501 124.338 122.820 0.028 0.000 2.567 7007 A HA 0.121 4.441 4.320 -0.001 0.000 0.240 7007 A C 0.098 177.694 177.584 0.019 0.000 1.053 7007 A CA 0.001 52.052 52.037 0.023 0.000 0.755 7007 A CB -0.185 18.828 19.000 0.022 0.000 0.978 7007 A HN 0.639 nan 8.150 nan 0.000 0.507 7008 C N 3.759 123.069 119.300 0.016 0.000 2.273 7008 C HA 0.448 4.907 4.460 -0.001 0.000 0.328 7008 C C 0.317 175.314 174.990 0.011 0.000 1.275 7008 C CA -0.682 58.344 59.018 0.013 0.000 1.704 7008 C CB -0.793 26.954 27.740 0.012 0.000 2.326 7008 C HN 0.881 nan 8.230 nan 0.000 0.517 7009 E N 3.688 123.894 120.200 0.010 0.000 2.316 7009 E HA 0.424 4.773 4.350 -0.001 0.000 0.275 7009 E C -0.112 176.492 176.600 0.007 0.000 1.029 7009 E CA -0.062 56.343 56.400 0.008 0.000 0.871 7009 E CB 1.166 30.870 29.700 0.008 0.000 1.022 7009 E HN 0.700 nan 8.360 nan 0.000 0.418 7010 V N -0.512 119.406 119.914 0.006 0.000 3.040 7010 V HA 0.730 4.849 4.120 -0.001 0.000 0.312 7010 V C 0.321 176.417 176.094 0.005 0.000 1.115 7010 V CA -1.135 61.168 62.300 0.005 0.000 0.998 7010 V CB 1.672 33.498 31.823 0.005 0.000 1.042 7010 V HN 0.660 nan 8.190 nan 0.000 0.433 7011 G N 0.606 109.408 108.800 0.004 0.000 2.365 7011 G HA2 0.481 4.441 3.960 -0.001 0.000 0.249 7011 G HA3 0.481 4.441 3.960 -0.001 0.000 0.249 7011 G C 0.965 175.867 174.900 0.004 0.000 1.288 7011 G CA 0.127 45.229 45.100 0.003 0.000 0.887 7011 G HN 1.656 nan 8.290 nan 0.000 0.524 7012 A N 2.347 125.169 122.820 0.004 0.000 1.940 7012 A HA -0.057 4.262 4.320 -0.001 0.000 0.219 7012 A C 1.942 179.528 177.584 0.004 0.000 1.176 7012 A CA 1.198 53.237 52.037 0.004 0.000 0.631 7012 A CB -0.002 19.001 19.000 0.004 0.000 0.814 7012 A HN 0.516 nan 8.150 nan 0.000 0.446 7013 Q N 0.004 119.806 119.800 0.003 0.000 2.201 7013 Q HA 0.107 4.447 4.340 -0.001 0.000 0.236 7013 Q C -0.945 175.057 176.000 0.002 0.000 0.857 7013 Q CA -0.132 55.673 55.803 0.003 0.000 1.025 7013 Q CB 0.026 28.766 28.738 0.003 0.000 1.124 7013 Q HN 0.720 nan 8.270 nan 0.000 0.473 7014 D N 0.730 121.131 120.400 0.002 0.000 2.344 7014 D HA 0.005 4.644 4.640 -0.001 0.000 0.253 7014 D C 1.251 177.551 176.300 0.001 0.000 1.255 7014 D CA 0.065 54.066 54.000 0.001 0.000 0.894 7014 D CB 0.883 41.684 40.800 0.001 0.000 1.067 7014 D HN -0.218 nan 8.370 nan 0.000 0.492 7015 K N 3.408 123.808 120.400 0.000 0.000 2.077 7015 K HA -0.293 4.027 4.320 -0.001 0.000 0.213 7015 K C 1.553 178.152 176.600 -0.002 0.000 1.051 7015 K CA 2.069 58.356 56.287 -0.001 0.000 0.929 7015 K CB -0.106 32.394 32.500 -0.001 0.000 0.715 7015 K HN 0.660 nan 8.250 nan 0.000 0.451 7016 E N -0.452 119.747 120.200 -0.003 0.000 2.023 7016 E HA -0.221 4.128 4.350 -0.001 0.000 0.196 7016 E C 1.993 178.591 176.600 -0.004 0.000 1.003 7016 E CA 1.658 58.056 56.400 -0.004 0.000 0.809 7016 E CB -0.274 29.423 29.700 -0.004 0.000 0.755 7016 E HN 0.340 nan 8.360 nan 0.000 0.449 7017 I N 0.582 121.151 120.570 -0.002 0.000 2.454 7017 I HA -0.203 3.967 4.170 -0.001 0.000 0.254 7017 I C 1.877 177.994 176.117 0.000 0.000 1.156 7017 I CA 0.727 62.027 61.300 -0.000 0.000 1.433 7017 I CB -0.059 37.942 38.000 0.002 0.000 1.082 7017 I HN 0.212 nan 8.210 nan 0.000 0.432 7018 L N 0.065 121.288 121.223 -0.000 0.000 2.141 7018 L HA -0.141 4.198 4.340 -0.001 0.000 0.209 7018 L C 2.644 179.514 176.870 -0.001 0.000 1.094 7018 L CA 2.298 57.138 54.840 0.001 0.000 0.763 7018 L CB -1.566 40.493 42.059 0.001 0.000 0.908 7018 L HN 0.493 nan 8.230 nan 0.000 0.437 7019 T N -4.950 109.602 114.554 -0.003 0.000 3.035 7019 T HA -0.068 4.281 4.350 -0.001 0.000 0.259 7019 T C 1.898 176.593 174.700 -0.009 0.000 1.078 7019 T CA 0.435 62.531 62.100 -0.006 0.000 1.132 7019 T CB -0.064 68.799 68.868 -0.008 0.000 0.900 7019 T HN 0.178 nan 8.240 nan 0.000 0.480 7020 K N 0.616 121.011 120.400 -0.007 0.000 2.057 7020 K HA 0.097 4.417 4.320 -0.001 0.000 0.206 7020 K C 2.145 178.743 176.600 -0.003 0.000 1.050 7020 K CA 0.964 57.246 56.287 -0.008 0.000 0.935 7020 K CB -0.183 32.313 32.500 -0.006 0.000 0.715 7020 K HN 0.252 nan 8.250 nan 0.000 0.439 7021 I N 1.302 121.872 120.570 0.001 0.000 2.179 7021 I HA -0.219 3.951 4.170 -0.001 0.000 0.242 7021 I C 2.518 178.638 176.117 0.006 0.000 1.088 7021 I CA 1.267 62.570 61.300 0.005 0.000 1.357 7021 I CB -1.344 36.660 38.000 0.006 0.000 1.051 7021 I HN 0.104 nan 8.210 nan 0.000 0.409 7022 A N 0.772 123.593 122.820 0.003 0.000 1.865 7022 A HA -0.233 4.087 4.320 -0.001 0.000 0.217 7022 A C 2.397 179.982 177.584 0.002 0.000 1.191 7022 A CA 1.898 53.936 52.037 0.003 0.000 0.623 7022 A CB -0.659 18.341 19.000 0.000 0.000 0.826 7022 A HN 0.356 nan 8.150 nan 0.000 0.444 7023 M N -0.837 118.760 119.600 -0.005 0.000 2.159 7023 M HA -0.123 4.357 4.480 -0.001 0.000 0.263 7023 M C 2.208 178.505 176.300 -0.006 0.000 1.063 7023 M CA 1.791 57.083 55.300 -0.014 0.000 1.110 7023 M CB -0.642 31.939 32.600 -0.031 0.000 1.374 7023 M HN 0.472 nan 8.290 nan 0.000 0.411 7024 T N -0.244 114.313 114.554 0.004 0.000 2.665 7024 T HA -0.182 4.167 4.350 -0.001 0.000 0.268 7024 T C 1.954 176.679 174.700 0.043 0.000 1.035 7024 T CA 2.021 64.137 62.100 0.026 0.000 1.151 7024 T CB -0.321 68.563 68.868 0.026 0.000 0.862 7024 T HN 0.399 nan 8.240 nan 0.000 0.438 7025 S N 0.206 115.923 115.700 0.029 0.000 2.371 7025 S HA 0.033 4.503 4.470 -0.001 0.000 0.224 7025 S C 2.057 176.679 174.600 0.037 0.000 1.029 7025 S CA 0.572 58.790 58.200 0.031 0.000 0.978 7025 S CB -0.430 62.782 63.200 0.021 0.000 0.833 7025 S HN 0.451 nan 8.310 nan 0.000 0.466 7026 I N 1.680 122.266 120.570 0.028 0.000 2.226 7026 I HA -0.105 4.064 4.170 -0.001 0.000 0.245 7026 I C 1.323 177.467 176.117 0.045 0.000 1.100 7026 I CA 0.969 62.284 61.300 0.026 0.000 1.374 7026 I CB -0.937 37.069 38.000 0.010 0.000 1.057 7026 I HN 0.415 nan 8.210 nan 0.000 0.413 7027 T N -0.406 114.180 114.554 0.054 0.000 2.903 7027 T HA 0.325 4.675 4.350 -0.001 0.000 0.314 7027 T C 1.083 175.912 174.700 0.215 0.000 1.078 7027 T CA 0.089 62.250 62.100 0.101 0.000 1.114 7027 T CB 1.224 70.117 68.868 0.042 0.000 0.987 7027 T HN 0.637 nan 8.240 nan 0.000 0.548 7028 G N 0.492 109.469 108.800 0.294 0.000 2.141 7028 G HA2 -0.201 3.759 3.960 -0.001 0.000 0.242 7028 G HA3 -0.201 3.759 3.960 -0.001 0.000 0.242 7028 G C -0.134 174.832 174.900 0.109 0.000 0.982 7028 G CA 0.317 45.549 45.100 0.220 0.000 0.662 7028 G HN 0.947 nan 8.290 nan 0.000 0.527 7029 K N -0.203 120.254 120.400 0.095 0.000 2.328 7029 K HA 0.707 5.027 4.320 -0.001 0.000 0.246 7029 K C 1.565 178.196 176.600 0.052 0.000 0.955 7029 K CA 0.179 56.500 56.287 0.058 0.000 0.817 7029 K CB 0.971 33.498 32.500 0.045 0.000 1.208 7029 K HN 0.282 nan 8.250 nan 0.000 0.432 7030 G N 1.149 109.973 108.800 0.039 0.000 2.450 7030 G HA2 -0.242 3.718 3.960 -0.001 0.000 0.220 7030 G HA3 -0.242 3.718 3.960 -0.001 0.000 0.220 7030 G C 1.048 175.964 174.900 0.028 0.000 1.130 7030 G CA 1.035 46.155 45.100 0.033 0.000 0.760 7030 G HN 0.638 nan 8.290 nan 0.000 0.557 7031 A N 1.344 124.180 122.820 0.027 0.000 2.209 7031 A HA 0.093 4.412 4.320 -0.001 0.000 0.212 7031 A C 2.089 179.683 177.584 0.015 0.000 1.158 7031 A CA 1.494 53.543 52.037 0.020 0.000 0.742 7031 A CB -0.380 18.632 19.000 0.020 0.000 0.790 7031 A HN 0.660 nan 8.150 nan 0.000 0.472 7032 E N 1.379 121.590 120.200 0.019 0.000 2.333 7032 E HA -0.282 4.067 4.350 -0.001 0.000 0.198 7032 E C 1.557 178.153 176.600 -0.006 0.000 1.007 7032 E CA 1.301 57.704 56.400 0.005 0.000 0.845 7032 E CB -0.540 29.165 29.700 0.009 0.000 0.766 7032 E HN 0.792 nan 8.360 nan 0.000 0.507 7033 K N 0.799 121.200 120.400 0.002 0.000 2.281 7033 K HA -0.080 4.240 4.320 -0.001 0.000 0.203 7033 K C 1.467 178.064 176.600 -0.005 0.000 1.046 7033 K CA 1.465 57.751 56.287 -0.002 0.000 0.938 7033 K CB -0.008 32.495 32.500 0.005 0.000 0.737 7033 K HN 0.164 nan 8.250 nan 0.000 0.458 7034 A N 1.785 124.603 122.820 -0.003 0.000 2.606 7034 A HA 0.137 4.456 4.320 -0.001 0.000 0.290 7034 A C 1.348 178.929 177.584 -0.006 0.000 1.174 7034 A CA -0.562 51.473 52.037 -0.004 0.000 0.958 7034 A CB -0.042 18.959 19.000 0.001 0.000 1.194 7034 A HN 0.414 nan 8.150 nan 0.000 0.526 7035 K N 0.187 120.580 120.400 -0.011 0.000 2.281 7035 K HA -0.197 4.122 4.320 -0.001 0.000 0.203 7035 K C 0.834 177.425 176.600 -0.015 0.000 1.046 7035 K CA 1.905 58.184 56.287 -0.014 0.000 0.938 7035 K CB -0.114 32.370 32.500 -0.026 0.000 0.737 7035 K HN 0.313 nan 8.250 nan 0.000 0.458 7036 E N 1.299 121.489 120.200 -0.016 0.000 2.072 7036 E HA -0.098 4.252 4.350 -0.001 0.000 0.190 7036 E C 1.754 178.350 176.600 -0.008 0.000 0.982 7036 E CA 1.244 57.636 56.400 -0.014 0.000 0.803 7036 E CB 0.049 29.740 29.700 -0.015 0.000 0.755 7036 E HN 0.258 nan 8.360 nan 0.000 0.453 7037 K N 0.333 120.730 120.400 -0.005 0.000 2.057 7037 K HA 0.005 4.325 4.320 -0.001 0.000 0.206 7037 K C 1.972 178.572 176.600 0.001 0.000 1.050 7037 K CA 0.753 57.039 56.287 -0.001 0.000 0.935 7037 K CB -0.308 32.192 32.500 0.001 0.000 0.715 7037 K HN 0.057 nan 8.250 nan 0.000 0.439 7038 L N 0.103 121.326 121.223 0.000 0.000 2.046 7038 L HA -0.186 4.153 4.340 -0.001 0.000 0.208 7038 L C 2.374 179.244 176.870 0.001 0.000 1.077 7038 L CA 1.406 56.247 54.840 0.002 0.000 0.747 7038 L CB -0.604 41.457 42.059 0.003 0.000 0.896 7038 L HN 0.196 nan 8.230 nan 0.000 0.432 7039 A N -0.241 122.577 122.820 -0.002 0.000 1.933 7039 A HA -0.245 4.075 4.320 -0.001 0.000 0.218 7039 A C 2.176 179.759 177.584 -0.001 0.000 1.175 7039 A CA 1.810 53.846 52.037 -0.003 0.000 0.628 7039 A CB -0.427 18.569 19.000 -0.007 0.000 0.814 7039 A HN 0.387 nan 8.150 nan 0.000 0.444 7040 E N 0.198 120.397 120.200 -0.001 0.000 2.051 7040 E HA -0.161 4.188 4.350 -0.001 0.000 0.192 7040 E C 1.755 178.357 176.600 0.003 0.000 0.991 7040 E CA 1.422 57.822 56.400 0.000 0.000 0.799 7040 E CB -0.229 29.471 29.700 -0.000 0.000 0.748 7040 E HN 0.468 nan 8.360 nan 0.000 0.449 7041 I N 0.275 120.847 120.570 0.004 0.000 2.226 7041 I HA -0.200 3.970 4.170 -0.001 0.000 0.245 7041 I C 2.135 178.255 176.117 0.006 0.000 1.100 7041 I CA 0.953 62.257 61.300 0.006 0.000 1.374 7041 I CB -0.797 37.207 38.000 0.008 0.000 1.057 7041 I HN 0.197 nan 8.210 nan 0.000 0.413 7042 I N -0.062 120.510 120.570 0.004 0.000 2.406 7042 I HA -0.149 4.021 4.170 -0.001 0.000 0.249 7042 I C 2.487 178.606 176.117 0.004 0.000 1.122 7042 I CA 0.897 62.200 61.300 0.004 0.000 1.431 7042 I CB -0.404 37.598 38.000 0.004 0.000 1.087 7042 I HN -0.095 nan 8.210 nan 0.000 0.424 7043 V N 0.281 120.196 119.914 0.003 0.000 2.358 7043 V HA -0.198 3.922 4.120 -0.001 0.000 0.246 7043 V C 2.449 178.545 176.094 0.004 0.000 1.047 7043 V CA 1.529 63.831 62.300 0.003 0.000 1.035 7043 V CB -0.581 31.243 31.823 0.002 0.000 0.658 7043 V HN 0.380 nan 8.190 nan 0.000 0.452 7044 E N 0.386 120.588 120.200 0.004 0.000 2.072 7044 E HA -0.131 4.218 4.350 -0.001 0.000 0.191 7044 E C 2.378 178.982 176.600 0.006 0.000 0.985 7044 E CA 1.414 57.817 56.400 0.005 0.000 0.801 7044 E CB -0.458 29.245 29.700 0.006 0.000 0.750 7044 E HN 0.555 nan 8.360 nan 0.000 0.452 7045 A N 1.138 123.961 122.820 0.006 0.000 1.902 7045 A HA -0.138 4.182 4.320 -0.001 0.000 0.217 7045 A C 2.623 180.210 177.584 0.005 0.000 1.181 7045 A CA 1.448 53.489 52.037 0.006 0.000 0.623 7045 A CB -0.689 18.314 19.000 0.005 0.000 0.818 7045 A HN 0.124 nan 8.150 nan 0.000 0.443 7046 V N -0.262 119.655 119.914 0.004 0.000 2.261 7046 V HA -0.212 3.908 4.120 -0.001 0.000 0.246 7046 V C 2.762 178.859 176.094 0.005 0.000 1.047 7046 V CA 2.367 64.670 62.300 0.004 0.000 1.015 7046 V CB -0.832 30.993 31.823 0.004 0.000 0.642 7046 V HN 0.549 nan 8.190 nan 0.000 0.446 7047 S N 0.012 115.715 115.700 0.005 0.000 2.419 7047 S HA -0.125 4.345 4.470 -0.001 0.000 0.233 7047 S C 2.138 176.742 174.600 0.007 0.000 1.016 7047 S CA 1.237 59.441 58.200 0.006 0.000 0.974 7047 S CB -0.394 62.810 63.200 0.006 0.000 0.786 7047 S HN 0.644 nan 8.310 nan 0.000 0.492 7048 A N 1.058 123.882 122.820 0.008 0.000 1.930 7048 A HA -0.020 4.300 4.320 -0.001 0.000 0.217 7048 A C 2.240 179.830 177.584 0.011 0.000 1.175 7048 A CA 1.655 53.698 52.037 0.010 0.000 0.627 7048 A CB -0.538 18.468 19.000 0.009 0.000 0.815 7048 A HN 0.580 nan 8.150 nan 0.000 0.443 7049 V N -3.656 116.263 119.914 0.008 0.000 3.660 7049 V HA 0.134 4.254 4.120 -0.001 0.000 0.276 7049 V C 1.871 177.969 176.094 0.006 0.000 1.317 7049 V CA 0.869 63.173 62.300 0.007 0.000 1.097 7049 V CB -0.302 31.523 31.823 0.004 0.000 0.863 7049 V HN 0.156 nan 8.190 nan 0.000 0.438 7050 V N 1.001 120.918 119.914 0.006 0.000 2.568 7050 V HA -0.184 3.935 4.120 -0.001 0.000 0.253 7050 V C 1.623 177.721 176.094 0.006 0.000 1.072 7050 V CA 2.602 64.905 62.300 0.005 0.000 1.084 7050 V CB -0.597 31.230 31.823 0.005 0.000 0.676 7050 V HN 0.897 nan 8.190 nan 0.000 0.469 7051 D N -1.055 119.350 120.400 0.008 0.000 4.438 7051 D HA -0.222 4.417 4.640 -0.001 0.000 0.158 7051 D C 0.617 176.921 176.300 0.007 0.000 0.686 7051 D CA 1.920 55.925 54.000 0.008 0.000 1.183 7051 D CB -1.234 39.569 40.800 0.005 0.000 0.623 7051 D HN 0.573 nan 8.370 nan 0.000 0.521 7052 D N 1.620 122.022 120.400 0.004 0.000 2.414 7052 D HA 0.216 4.855 4.640 -0.001 0.000 0.251 7052 D C -0.200 176.103 176.300 0.004 0.000 1.252 7052 D CA 0.300 54.302 54.000 0.003 0.000 0.999 7052 D CB 0.406 41.207 40.800 0.002 0.000 1.093 7052 D HN 0.199 nan 8.370 nan 0.000 0.515 7053 E N -0.304 119.898 120.200 0.003 0.000 2.373 7053 E HA 0.549 4.899 4.350 -0.001 0.000 0.233 7053 E C -0.238 176.363 176.600 0.003 0.000 1.035 7053 E CA -0.622 55.780 56.400 0.004 0.000 0.930 7053 E CB 0.626 30.328 29.700 0.004 0.000 1.278 7053 E HN 0.450 nan 8.360 nan 0.000 0.452 7054 G N 1.454 110.256 108.800 0.003 0.000 2.340 7054 G HA2 0.259 4.218 3.960 -0.001 0.000 0.298 7054 G HA3 0.259 4.218 3.960 -0.001 0.000 0.298 7054 G C -1.745 173.157 174.900 0.003 0.000 1.498 7054 G CA -0.735 44.367 45.100 0.003 0.000 0.847 7054 G HN 0.021 nan 8.290 nan 0.000 0.594 7055 K N 0.464 120.866 120.400 0.003 0.000 2.550 7055 K HA 0.542 4.861 4.320 -0.001 0.000 0.252 7055 K C -1.385 175.217 176.600 0.003 0.000 0.943 7055 K CA -0.542 55.747 56.287 0.003 0.000 0.806 7055 K CB 2.262 34.763 32.500 0.002 0.000 1.289 7055 K HN 0.512 nan 8.250 nan 0.000 0.435 7056 V N 3.415 123.330 119.914 0.003 0.000 2.370 7056 V HA 0.205 4.325 4.120 -0.001 0.000 0.279 7056 V C -0.250 175.844 176.094 0.002 0.000 1.029 7056 V CA -0.718 61.584 62.300 0.002 0.000 0.870 7056 V CB 1.319 33.144 31.823 0.003 0.000 0.984 7056 V HN 0.606 nan 8.190 nan 0.000 0.451 7057 D N 4.022 124.423 120.400 0.001 0.000 2.427 7057 D HA 0.198 4.837 4.640 -0.001 0.000 0.226 7057 D C 0.974 177.273 176.300 -0.002 0.000 1.076 7057 D CA -0.386 53.614 54.000 -0.001 0.000 0.849 7057 D CB 1.427 42.226 40.800 -0.002 0.000 1.052 7057 D HN 0.511 nan 8.370 nan 0.000 0.515 7058 K N 2.756 123.155 120.400 -0.002 0.000 2.160 7058 K HA -0.231 4.089 4.320 -0.001 0.000 0.206 7058 K C 0.964 177.561 176.600 -0.006 0.000 1.047 7058 K CA 1.320 57.606 56.287 -0.003 0.000 0.930 7058 K CB 0.161 32.660 32.500 -0.002 0.000 0.720 7058 K HN 0.331 nan 8.250 nan 0.000 0.450 7059 D N 0.192 120.588 120.400 -0.007 0.000 2.309 7059 D HA -0.110 4.529 4.640 -0.001 0.000 0.212 7059 D C 1.389 177.682 176.300 -0.012 0.000 0.968 7059 D CA 0.701 54.695 54.000 -0.010 0.000 0.882 7059 D CB 0.129 40.923 40.800 -0.010 0.000 0.918 7059 D HN 0.263 nan 8.370 nan 0.000 0.503 7060 L N -0.303 120.914 121.223 -0.009 0.000 2.554 7060 L HA 0.172 4.511 4.340 -0.001 0.000 0.226 7060 L C 0.370 177.234 176.870 -0.010 0.000 1.137 7060 L CA 0.179 55.014 54.840 -0.009 0.000 0.863 7060 L CB 0.086 42.142 42.059 -0.004 0.000 0.985 7060 L HN 0.009 nan 8.230 nan 0.000 0.451 7061 I N 0.271 120.835 120.570 -0.010 0.000 2.382 7061 I HA 0.235 4.404 4.170 -0.001 0.000 0.286 7061 I C 0.076 176.184 176.117 -0.015 0.000 1.002 7061 I CA -0.460 60.833 61.300 -0.010 0.000 1.135 7061 I CB 1.679 39.676 38.000 -0.005 0.000 1.288 7061 I HN -0.113 nan 8.210 nan 0.000 0.448 7062 K N 6.627 127.014 120.400 -0.021 0.000 2.172 7062 K HA 0.427 4.747 4.320 -0.001 0.000 0.276 7062 K C -0.705 175.881 176.600 -0.023 0.000 1.013 7062 K CA -0.595 55.675 56.287 -0.028 0.000 0.913 7062 K CB 1.265 33.739 32.500 -0.042 0.000 1.055 7062 K HN 0.451 nan 8.250 nan 0.000 0.461 7063 I N 3.975 124.532 120.570 -0.021 0.000 2.307 7063 I HA 0.174 4.344 4.170 -0.001 0.000 0.287 7063 I C 0.100 176.204 176.117 -0.022 0.000 1.054 7063 I CA -0.583 60.707 61.300 -0.016 0.000 1.218 7063 I CB 0.582 38.576 38.000 -0.010 0.000 1.398 7063 I HN 0.517 nan 8.210 nan 0.000 0.475 7064 E N 7.317 127.502 120.200 -0.025 0.000 2.199 7064 E HA 0.548 4.898 4.350 -0.001 0.000 0.269 7064 E C -0.949 175.639 176.600 -0.019 0.000 0.899 7064 E CA -0.746 55.635 56.400 -0.032 0.000 0.772 7064 E CB 1.405 31.073 29.700 -0.054 0.000 1.155 7064 E HN 0.541 nan 8.360 nan 0.000 0.408 7065 K N 2.911 123.299 120.400 -0.019 0.000 2.471 7065 K HA 0.613 4.933 4.320 -0.001 0.000 0.252 7065 K C -0.929 175.663 176.600 -0.014 0.000 0.938 7065 K CA -1.105 55.176 56.287 -0.011 0.000 0.796 7065 K CB 1.592 34.087 32.500 -0.009 0.000 1.161 7065 K HN 0.097 nan 8.250 nan 0.000 0.425 7066 K N 2.028 122.424 120.400 -0.006 0.000 2.507 7066 K HA 0.217 4.537 4.320 -0.001 0.000 0.251 7066 K C -0.644 175.955 176.600 -0.002 0.000 0.943 7066 K CA -0.582 55.702 56.287 -0.005 0.000 0.794 7066 K CB 2.138 34.643 32.500 0.009 0.000 1.188 7066 K HN 0.992 nan 8.250 nan 0.000 0.428 7067 S N 0.432 116.124 115.700 -0.014 0.000 2.584 7067 S HA 0.673 5.143 4.470 -0.001 0.000 0.270 7067 S C 0.565 175.165 174.600 -0.001 0.000 1.346 7067 S CA 0.328 58.520 58.200 -0.013 0.000 1.018 7067 S CB 0.820 64.003 63.200 -0.029 0.000 0.899 7067 S HN 0.931 nan 8.310 nan 0.000 0.542 7068 G N -0.191 108.610 108.800 0.002 0.000 2.640 7068 G HA2 0.475 4.435 3.960 -0.001 0.000 0.686 7068 G HA3 0.475 4.435 3.960 -0.001 0.000 0.686 7068 G C -0.042 174.864 174.900 0.010 0.000 1.229 7068 G CA -0.124 44.980 45.100 0.007 0.000 0.796 7068 G HN 2.406 nan 8.290 nan 0.000 0.654 7069 A N -0.334 122.491 122.820 0.009 0.000 5.953 7069 A HA 0.387 4.707 4.320 -0.001 0.000 0.267 7069 A C 1.188 178.777 177.584 0.009 0.000 2.116 7069 A CA 1.973 54.016 52.037 0.010 0.000 0.711 7069 A CB -1.624 17.384 19.000 0.012 0.000 1.100 7069 A HN 2.749 nan 8.150 nan 0.000 0.364 7070 S N -2.834 112.872 115.700 0.009 0.000 2.851 7070 S HA 0.691 5.160 4.470 -0.001 0.000 0.317 7070 S C 1.197 175.803 174.600 0.010 0.000 1.144 7070 S CA -0.109 58.097 58.200 0.010 0.000 0.862 7070 S CB 0.628 63.833 63.200 0.008 0.000 1.259 7070 S HN 1.019 nan 8.310 nan 0.000 0.564 7071 I N 2.010 122.587 120.570 0.010 0.000 2.546 7071 I HA -0.034 4.136 4.170 -0.001 0.000 0.255 7071 I C 1.515 177.637 176.117 0.009 0.000 1.163 7071 I CA 1.183 62.489 61.300 0.010 0.000 1.457 7071 I CB -1.347 36.659 38.000 0.011 0.000 1.092 7071 I HN 0.586 nan 8.210 nan 0.000 0.434 7072 D N 1.247 121.651 120.400 0.007 0.000 2.218 7072 D HA -0.172 4.467 4.640 -0.001 0.000 0.204 7072 D C 1.342 177.646 176.300 0.007 0.000 0.976 7072 D CA 1.194 55.197 54.000 0.005 0.000 0.853 7072 D CB -0.116 40.686 40.800 0.004 0.000 0.939 7072 D HN 0.432 nan 8.370 nan 0.000 0.481 7073 D N -0.174 120.231 120.400 0.009 0.000 2.347 7073 D HA -0.034 4.605 4.640 -0.001 0.000 0.215 7073 D C 0.329 176.639 176.300 0.016 0.000 0.976 7073 D CA 0.425 54.432 54.000 0.012 0.000 0.884 7073 D CB -0.015 40.793 40.800 0.012 0.000 0.915 7073 D HN -0.045 nan 8.370 nan 0.000 0.526 7074 T N 1.785 116.348 114.554 0.016 0.000 2.905 7074 T HA 0.063 4.413 4.350 -0.001 0.000 0.299 7074 T C 0.228 174.940 174.700 0.020 0.000 1.024 7074 T CA 0.381 62.492 62.100 0.019 0.000 1.151 7074 T CB 0.225 69.101 68.868 0.014 0.000 0.987 7074 T HN 0.302 nan 8.240 nan 0.000 0.535 7075 E N 2.039 122.255 120.200 0.027 0.000 2.408 7075 E HA 0.596 4.945 4.350 -0.001 0.000 0.275 7075 E C -1.489 175.131 176.600 0.033 0.000 0.935 7075 E CA -1.188 55.229 56.400 0.029 0.000 0.775 7075 E CB 1.303 31.023 29.700 0.034 0.000 1.277 7075 E HN 0.326 nan 8.360 nan 0.000 0.455 7076 L N 2.508 123.748 121.223 0.028 0.000 2.275 7076 L HA 0.484 4.823 4.340 -0.001 0.000 0.288 7076 L C -1.233 175.660 176.870 0.038 0.000 1.046 7076 L CA -0.390 54.467 54.840 0.028 0.000 0.805 7076 L CB 0.881 42.951 42.059 0.018 0.000 1.193 7076 L HN 0.610 nan 8.230 nan 0.000 0.426 7077 I N 5.221 125.820 120.570 0.047 0.000 2.359 7077 I HA 0.257 4.427 4.170 -0.001 0.000 0.284 7077 I C -0.129 176.016 176.117 0.047 0.000 1.018 7077 I CA -0.854 60.486 61.300 0.068 0.000 1.173 7077 I CB 0.994 39.069 38.000 0.124 0.000 1.326 7077 I HN 0.477 nan 8.210 nan 0.000 0.462 7078 K N 5.299 125.723 120.400 0.039 0.000 2.081 7078 K HA 0.442 4.761 4.320 -0.001 0.000 0.230 7078 K C 0.306 176.924 176.600 0.029 0.000 1.199 7078 K CA -0.077 56.225 56.287 0.026 0.000 1.130 7078 K CB -0.030 32.481 32.500 0.018 0.000 1.386 7078 K HN 0.848 nan 8.250 nan 0.000 0.280 7079 G N -1.251 107.565 108.800 0.027 0.000 2.335 7079 G HA2 0.267 4.227 3.960 -0.001 0.000 0.291 7079 G HA3 0.267 4.227 3.960 -0.001 0.000 0.291 7079 G C -1.704 173.194 174.900 -0.004 0.000 1.261 7079 G CA -0.803 44.310 45.100 0.022 0.000 0.871 7079 G HN 0.033 nan 8.290 nan 0.000 0.491 7080 V N 0.714 120.614 119.914 -0.022 0.000 2.409 7080 V HA 0.655 4.775 4.120 -0.001 0.000 0.291 7080 V C -0.719 175.299 176.094 -0.126 0.000 1.020 7080 V CA -0.603 61.651 62.300 -0.077 0.000 0.848 7080 V CB 1.243 33.002 31.823 -0.106 0.000 0.990 7080 V HN 0.818 nan 8.190 nan 0.000 0.430 7081 L N 7.909 129.016 121.223 -0.193 0.000 2.313 7081 L HA 0.852 5.192 4.340 -0.001 0.000 0.283 7081 L C -0.350 176.358 176.870 -0.271 0.000 1.013 7081 L CA -0.150 54.465 54.840 -0.376 0.000 0.816 7081 L CB 1.750 43.488 42.059 -0.535 0.000 1.236 7081 L HN 0.562 nan 8.230 nan 0.000 0.419 7082 V N 1.532 121.296 119.914 -0.250 0.000 2.864 7082 V HA 0.611 4.730 4.120 -0.001 0.000 0.314 7082 V C -0.359 175.661 176.094 -0.124 0.000 1.073 7082 V CA -0.516 61.697 62.300 -0.145 0.000 0.956 7082 V CB 1.858 33.631 31.823 -0.083 0.000 1.023 7082 V HN 0.828 nan 8.190 nan 0.000 0.435 7083 D N 1.053 121.407 120.400 -0.076 0.000 3.085 7083 D HA 0.287 4.927 4.640 -0.001 0.000 0.243 7083 D C -0.153 176.141 176.300 -0.010 0.000 1.232 7083 D CA -0.276 53.696 54.000 -0.048 0.000 0.913 7083 D CB 0.310 41.086 40.800 -0.040 0.000 1.108 7083 D HN 0.528 nan 8.370 nan 0.000 0.468 7084 K N 0.473 120.878 120.400 0.009 0.000 2.340 7084 K HA 0.419 4.738 4.320 -0.001 0.000 0.244 7084 K C 0.159 176.784 176.600 0.041 0.000 0.973 7084 K CA -0.810 55.500 56.287 0.038 0.000 0.828 7084 K CB 2.271 34.823 32.500 0.087 0.000 1.226 7084 K HN 0.265 nan 8.250 nan 0.000 0.437 7085 E N 0.543 120.760 120.200 0.029 0.000 2.334 7085 E HA 0.489 4.839 4.350 -0.001 0.000 0.256 7085 E C -0.658 175.942 176.600 0.000 0.000 0.958 7085 E CA -1.153 55.261 56.400 0.023 0.000 0.821 7085 E CB 0.899 30.609 29.700 0.017 0.000 1.269 7085 E HN 0.091 nan 8.360 nan 0.000 0.413 7086 R N 1.202 121.699 120.500 -0.006 0.000 2.242 7086 R HA 0.083 4.423 4.340 -0.001 0.000 0.334 7086 R C 0.854 177.135 176.300 -0.032 0.000 1.071 7086 R CA -0.153 55.929 56.100 -0.030 0.000 0.922 7086 R CB 0.875 31.162 30.300 -0.022 0.000 1.023 7086 R HN 0.581 nan 8.270 nan 0.000 0.458 7087 V N 1.977 121.862 119.914 -0.048 0.000 2.546 7087 V HA -0.177 3.943 4.120 -0.001 0.000 0.254 7087 V C 0.737 176.801 176.094 -0.050 0.000 1.076 7087 V CA 2.010 64.280 62.300 -0.050 0.000 1.087 7087 V CB 0.032 31.816 31.823 -0.065 0.000 0.674 7087 V HN 0.714 nan 8.190 nan 0.000 0.470 7088 S N -2.206 113.468 115.700 -0.044 0.000 2.536 7088 S HA 0.671 5.141 4.470 -0.001 0.000 0.287 7088 S C 0.749 175.341 174.600 -0.012 0.000 1.101 7088 S CA -0.183 57.997 58.200 -0.032 0.000 0.950 7088 S CB 1.840 65.017 63.200 -0.038 0.000 1.056 7088 S HN 0.516 nan 8.310 nan 0.000 0.481 7089 A N 2.987 125.806 122.820 -0.002 0.000 2.125 7089 A HA -0.068 4.251 4.320 -0.001 0.000 0.219 7089 A C 1.868 179.459 177.584 0.011 0.000 1.156 7089 A CA 1.622 53.663 52.037 0.006 0.000 0.671 7089 A CB -0.585 18.420 19.000 0.009 0.000 0.794 7089 A HN 0.894 nan 8.150 nan 0.000 0.459 7090 Q N -1.087 118.724 119.800 0.018 0.000 2.389 7090 Q HA 0.118 4.458 4.340 -0.001 0.000 0.204 7090 Q C 0.489 176.500 176.000 0.018 0.000 0.944 7090 Q CA 0.046 55.865 55.803 0.026 0.000 0.908 7090 Q CB -0.062 28.706 28.738 0.050 0.000 1.002 7090 Q HN 0.684 nan 8.270 nan 0.000 0.493 7091 M N 1.897 121.501 119.600 0.007 0.000 2.255 7091 M HA 0.276 4.755 4.480 -0.001 0.000 0.336 7091 M C -2.080 174.219 176.300 -0.002 0.000 1.135 7091 M CA -2.022 53.277 55.300 -0.001 0.000 1.145 7091 M CB 0.685 33.275 32.600 -0.017 0.000 1.473 7091 M HN -0.084 nan 8.290 nan 0.000 0.462 7092 P HA 0.015 nan 4.420 nan 0.000 0.266 7092 P C -0.470 176.828 177.300 -0.003 0.000 1.193 7092 P CA 0.280 63.379 63.100 -0.001 0.000 0.770 7092 P CB 0.455 32.154 31.700 -0.002 0.000 0.836 7093 K N 1.444 121.846 120.400 0.003 0.000 2.393 7093 K HA 0.045 4.365 4.320 -0.001 0.000 0.193 7093 K C 0.592 177.202 176.600 0.016 0.000 1.026 7093 K CA 0.547 56.839 56.287 0.009 0.000 1.064 7093 K CB 0.094 32.600 32.500 0.010 0.000 0.833 7093 K HN 0.507 nan 8.250 nan 0.000 0.521 7094 K N -0.870 119.538 120.400 0.012 0.000 2.568 7094 K HA 0.396 4.715 4.320 -0.001 0.000 0.273 7094 K C -1.328 175.280 176.600 0.014 0.000 0.951 7094 K CA -0.921 55.378 56.287 0.019 0.000 0.854 7094 K CB 2.128 34.638 32.500 0.017 0.000 1.424 7094 K HN -0.279 nan 8.250 nan 0.000 0.427 7095 V N 1.445 121.372 119.914 0.021 0.000 2.525 7095 V HA 0.400 4.520 4.120 -0.001 0.000 0.299 7095 V C -0.404 175.704 176.094 0.025 0.000 1.034 7095 V CA -0.599 61.712 62.300 0.018 0.000 0.863 7095 V CB 1.808 33.639 31.823 0.013 0.000 0.999 7095 V HN 1.005 nan 8.190 nan 0.000 0.423 7096 T N -0.052 114.513 114.554 0.018 0.000 2.902 7096 T HA 0.539 4.888 4.350 -0.001 0.000 0.283 7096 T C 0.167 174.878 174.700 0.018 0.000 1.009 7096 T CA -0.221 61.889 62.100 0.018 0.000 1.051 7096 T CB 1.275 70.150 68.868 0.011 0.000 0.999 7096 T HN 0.799 nan 8.240 nan 0.000 0.474 7097 D N 0.397 120.809 120.400 0.019 0.000 2.689 7097 D HA -0.160 4.479 4.640 -0.001 0.000 0.237 7097 D C 0.323 176.638 176.300 0.025 0.000 1.148 7097 D CA 0.836 54.848 54.000 0.019 0.000 0.656 7097 D CB -1.257 39.551 40.800 0.014 0.000 1.050 7097 D HN 1.107 nan 8.370 nan 0.000 0.426 7098 A N 1.397 124.237 122.820 0.034 0.000 2.477 7098 A HA 0.353 4.673 4.320 -0.001 0.000 0.246 7098 A C 0.504 178.117 177.584 0.047 0.000 1.078 7098 A CA 0.188 52.251 52.037 0.043 0.000 0.770 7098 A CB 0.548 19.585 19.000 0.062 0.000 1.011 7098 A HN 0.156 nan 8.150 nan 0.000 0.494 7099 K N 3.015 123.441 120.400 0.044 0.000 2.347 7099 K HA 0.386 4.706 4.320 -0.001 0.000 0.262 7099 K C -1.196 175.440 176.600 0.061 0.000 1.052 7099 K CA -0.244 56.070 56.287 0.046 0.000 0.946 7099 K CB 0.935 33.455 32.500 0.032 0.000 1.220 7099 K HN 0.524 nan 8.250 nan 0.000 0.450 7100 I N 2.143 122.766 120.570 0.088 0.000 2.342 7100 I HA 0.202 4.372 4.170 -0.001 0.000 0.291 7100 I C 0.371 176.560 176.117 0.120 0.000 1.010 7100 I CA -0.171 61.214 61.300 0.142 0.000 1.308 7100 I CB 1.362 39.481 38.000 0.199 0.000 1.400 7100 I HN 0.508 nan 8.210 nan 0.000 0.488 7101 A N 7.592 130.487 122.820 0.125 0.000 2.330 7101 A HA 0.846 5.166 4.320 -0.001 0.000 0.327 7101 A C -0.767 176.905 177.584 0.145 0.000 1.155 7101 A CA -0.562 51.535 52.037 0.099 0.000 0.803 7101 A CB 0.639 19.673 19.000 0.058 0.000 1.208 7101 A HN 0.658 nan 8.150 nan 0.000 0.477 7102 L N 3.456 124.744 121.223 0.108 0.000 2.318 7102 L HA 0.463 4.803 4.340 -0.001 0.000 0.277 7102 L C -1.044 175.867 176.870 0.069 0.000 1.008 7102 L CA -0.101 54.802 54.840 0.105 0.000 0.846 7102 L CB 1.037 43.136 42.059 0.067 0.000 1.220 7102 L HN 0.571 nan 8.230 nan 0.000 0.423 7103 L N 3.118 124.384 121.223 0.071 0.000 2.341 7103 L HA 0.370 4.710 4.340 -0.001 0.000 0.278 7103 L C 0.530 177.426 176.870 0.044 0.000 1.005 7103 L CA -0.568 54.300 54.840 0.047 0.000 0.818 7103 L CB 1.964 44.046 42.059 0.039 0.000 1.259 7103 L HN 0.584 nan 8.230 nan 0.000 0.418 7104 N N 0.189 118.907 118.700 0.031 0.000 2.353 7104 N HA -0.019 4.720 4.740 -0.001 0.000 0.185 7104 N C 0.239 175.761 175.510 0.020 0.000 1.098 7104 N CA -0.209 52.856 53.050 0.025 0.000 0.872 7104 N CB 0.173 38.670 38.487 0.018 0.000 0.970 7104 N HN 0.412 nan 8.380 nan 0.000 0.467 7105 C N 1.507 120.818 119.300 0.019 0.000 2.435 7105 C HA 0.767 5.227 4.460 -0.001 0.000 0.375 7105 C C 0.949 175.947 174.990 0.015 0.000 1.281 7105 C CA -0.986 58.041 59.018 0.015 0.000 1.963 7105 C CB -1.248 26.501 27.740 0.015 0.000 2.490 7105 C HN 0.577 nan 8.230 nan 0.000 0.557 7106 A N 6.573 129.400 122.820 0.010 0.000 2.520 7106 A HA 0.363 4.682 4.320 -0.001 0.000 0.235 7106 A C 0.420 178.007 177.584 0.005 0.000 1.065 7106 A CA 0.004 52.044 52.037 0.006 0.000 0.764 7106 A CB 0.072 19.074 19.000 0.003 0.000 1.002 7106 A HN 0.815 nan 8.150 nan 0.000 0.502 7107 I N 2.438 123.009 120.570 0.001 0.000 2.191 7107 I HA 0.187 4.356 4.170 -0.001 0.000 0.289 7107 I C 0.116 176.229 176.117 -0.005 0.000 1.141 7107 I CA 0.727 62.027 61.300 0.001 0.000 1.430 7107 I CB -1.539 36.459 38.000 -0.004 0.000 1.497 7107 I HN 0.609 nan 8.210 nan 0.000 0.636 7108 E N 2.939 123.139 120.200 -0.000 0.000 2.283 7108 E HA 0.453 4.802 4.350 -0.001 0.000 0.258 7108 E C -0.794 175.809 176.600 0.006 0.000 0.893 7108 E CA -0.488 55.910 56.400 -0.003 0.000 0.798 7108 E CB 2.336 32.032 29.700 -0.006 0.000 1.242 7108 E HN 0.198 nan 8.360 nan 0.000 0.414 7109 E N 1.893 122.098 120.200 0.009 0.000 2.278 7109 E HA 0.180 4.530 4.350 -0.001 0.000 0.272 7109 E C -1.155 175.456 176.600 0.018 0.000 0.890 7109 E CA -0.553 55.857 56.400 0.017 0.000 0.770 7109 E CB 1.894 31.611 29.700 0.028 0.000 1.212 7109 E HN 0.276 nan 8.360 nan 0.000 0.415 7110 T N 2.891 117.454 114.554 0.016 0.000 2.940 7110 T HA 0.483 4.833 4.350 -0.001 0.000 0.309 7110 T C -0.241 174.475 174.700 0.026 0.000 1.056 7110 T CA 0.893 63.003 62.100 0.017 0.000 1.137 7110 T CB -0.253 68.623 68.868 0.013 0.000 0.976 7110 T HN 1.324 nan 8.240 nan 0.000 0.547 7111 A N 3.178 126.015 122.820 0.029 0.000 2.435 7111 A HA -0.046 4.274 4.320 -0.001 0.000 0.686 7111 A C 1.255 178.880 177.584 0.069 0.000 0.138 7111 A CA 0.499 52.562 52.037 0.042 0.000 0.024 7111 A CB -1.853 17.169 19.000 0.036 0.000 3.974 7111 A HN 1.874 nan 8.150 nan 0.000 0.548 7112 S N 0.623 116.380 115.700 0.096 0.000 2.489 7112 S HA -0.012 4.458 4.470 -0.001 0.000 0.228 7112 S C 1.366 176.085 174.600 0.199 0.000 0.995 7112 S CA 1.427 59.742 58.200 0.192 0.000 0.934 7112 S CB 0.078 63.416 63.200 0.229 0.000 0.771 7112 S HN 1.161 nan 8.310 nan 0.000 0.522 7113 E N 1.884 122.145 120.200 0.102 0.000 2.046 7113 E HA 0.047 4.396 4.350 -0.001 0.000 0.190 7113 E C 1.993 178.621 176.600 0.046 0.000 0.982 7113 E CA 1.404 57.836 56.400 0.053 0.000 0.800 7113 E CB -0.417 29.302 29.700 0.032 0.000 0.756 7113 E HN 0.594 nan 8.360 nan 0.000 0.449 7114 M N -0.523 119.108 119.600 0.053 0.000 2.200 7114 M HA -0.040 4.439 4.480 -0.001 0.000 0.265 7114 M C 2.036 178.373 176.300 0.060 0.000 1.066 7114 M CA 0.646 55.971 55.300 0.043 0.000 1.127 7114 M CB -0.108 32.513 32.600 0.035 0.000 1.379 7114 M HN 0.194 nan 8.290 nan 0.000 0.420 7115 L N 0.960 122.239 121.223 0.093 0.000 2.093 7115 L HA -0.152 4.187 4.340 -0.001 0.000 0.208 7115 L C 2.410 179.391 176.870 0.186 0.000 1.085 7115 L CA 1.825 56.739 54.840 0.123 0.000 0.755 7115 L CB -0.697 41.437 42.059 0.125 0.000 0.904 7115 L HN 0.147 nan 8.230 nan 0.000 0.435 7116 K N -0.371 120.153 120.400 0.207 0.000 2.057 7116 K HA -0.198 4.121 4.320 -0.001 0.000 0.207 7116 K C 1.568 178.166 176.600 -0.004 0.000 1.049 7116 K CA 1.825 58.141 56.287 0.049 0.000 0.931 7116 K CB -0.298 32.078 32.500 -0.207 0.000 0.714 7116 K HN 0.374 nan 8.250 nan 0.000 0.440 7117 D N 0.617 121.022 120.400 0.009 0.000 2.178 7117 D HA -0.111 4.528 4.640 -0.001 0.000 0.202 7117 D C 2.014 178.323 176.300 0.015 0.000 0.974 7117 D CA 1.027 55.027 54.000 0.001 0.000 0.841 7117 D CB -0.084 40.719 40.800 0.005 0.000 0.953 7117 D HN 0.290 nan 8.370 nan 0.000 0.478 7118 M N -0.130 119.490 119.600 0.034 0.000 2.117 7118 M HA -0.127 4.353 4.480 -0.001 0.000 0.262 7118 M C 2.252 178.575 176.300 0.037 0.000 1.065 7118 M CA 0.866 56.188 55.300 0.036 0.000 1.114 7118 M CB -0.045 32.582 32.600 0.044 0.000 1.361 7118 M HN -0.115 nan 8.290 nan 0.000 0.408 7119 V N 0.205 120.153 119.914 0.056 0.000 2.358 7119 V HA -0.209 3.911 4.120 -0.001 0.000 0.246 7119 V C 2.580 178.689 176.094 0.026 0.000 1.047 7119 V CA 1.906 64.240 62.300 0.058 0.000 1.035 7119 V CB -1.129 30.764 31.823 0.117 0.000 0.658 7119 V HN 0.511 nan 8.190 nan 0.000 0.452 7120 A N -0.084 122.740 122.820 0.006 0.000 1.969 7120 A HA -0.227 4.092 4.320 -0.001 0.000 0.218 7120 A C 2.176 179.759 177.584 -0.001 0.000 1.169 7120 A CA 1.927 53.958 52.037 -0.010 0.000 0.635 7120 A CB -0.410 18.573 19.000 -0.027 0.000 0.810 7120 A HN 0.551 nan 8.150 nan 0.000 0.445 7121 E N 0.283 120.486 120.200 0.006 0.000 2.107 7121 E HA -0.082 4.268 4.350 -0.001 0.000 0.191 7121 E C 1.654 178.260 176.600 0.011 0.000 0.982 7121 E CA 1.153 57.558 56.400 0.008 0.000 0.809 7121 E CB -0.358 29.349 29.700 0.011 0.000 0.756 7121 E HN 0.644 nan 8.360 nan 0.000 0.459 7122 I N 0.246 120.824 120.570 0.014 0.000 2.252 7122 I HA -0.223 3.946 4.170 -0.001 0.000 0.245 7122 I C 2.271 178.394 176.117 0.011 0.000 1.102 7122 I CA 1.138 62.446 61.300 0.014 0.000 1.385 7122 I CB -0.240 37.770 38.000 0.016 0.000 1.064 7122 I HN 0.061 nan 8.210 nan 0.000 0.414 7123 K N 1.796 122.201 120.400 0.009 0.000 2.063 7123 K HA -0.135 4.185 4.320 -0.001 0.000 0.208 7123 K C 2.036 178.638 176.600 0.005 0.000 1.048 7123 K CA 1.731 58.022 56.287 0.006 0.000 0.928 7123 K CB -0.393 32.109 32.500 0.002 0.000 0.713 7123 K HN 0.270 nan 8.250 nan 0.000 0.442 7124 A N 0.278 123.101 122.820 0.004 0.000 1.972 7124 A HA -0.166 4.154 4.320 -0.001 0.000 0.219 7124 A C 2.140 179.728 177.584 0.007 0.000 1.169 7124 A CA 2.141 54.180 52.037 0.004 0.000 0.635 7124 A CB -1.015 17.986 19.000 0.003 0.000 0.810 7124 A HN 0.568 nan 8.150 nan 0.000 0.446 7125 S N -1.672 114.034 115.700 0.009 0.000 2.447 7125 S HA 0.239 4.709 4.470 -0.001 0.000 0.233 7125 S C 1.646 176.254 174.600 0.013 0.000 1.006 7125 S CA 1.453 59.660 58.200 0.012 0.000 0.957 7125 S CB -0.558 62.651 63.200 0.016 0.000 0.773 7125 S HN 1.988 nan 8.310 nan 0.000 0.507 7126 G N 0.656 109.462 108.800 0.011 0.000 2.175 7126 G HA2 -0.069 3.890 3.960 -0.001 0.000 0.244 7126 G HA3 -0.069 3.890 3.960 -0.001 0.000 0.244 7126 G C 0.254 175.162 174.900 0.014 0.000 0.982 7126 G CA 0.027 45.134 45.100 0.012 0.000 0.641 7126 G HN 1.367 nan 8.290 nan 0.000 0.527 7127 A N -0.000 122.829 122.820 0.015 0.000 2.498 7127 A HA 0.595 4.914 4.320 -0.001 0.000 0.239 7127 A C 1.171 178.760 177.584 0.008 0.000 1.068 7127 A CA 0.960 53.008 52.037 0.017 0.000 0.766 7127 A CB 0.196 19.208 19.000 0.020 0.000 1.003 7127 A HN 0.363 nan 8.150 nan 0.000 0.497 7128 N N 0.332 119.036 118.700 0.007 0.000 2.382 7128 N HA 0.114 4.853 4.740 -0.001 0.000 0.200 7128 N C -0.644 174.850 175.510 -0.027 0.000 1.122 7128 N CA 0.491 53.539 53.050 -0.004 0.000 0.870 7128 N CB 0.884 39.374 38.487 0.004 0.000 1.176 7128 N HN 0.381 nan 8.380 nan 0.000 0.474 7129 V N 2.357 122.253 119.914 -0.030 0.000 2.495 7129 V HA 0.441 4.561 4.120 -0.001 0.000 0.298 7129 V C -0.876 175.147 176.094 -0.119 0.000 1.031 7129 V CA -0.825 61.414 62.300 -0.103 0.000 0.871 7129 V CB 2.366 34.163 31.823 -0.045 0.000 0.988 7129 V HN 0.002 nan 8.190 nan 0.000 0.432 7130 L N 5.626 126.702 121.223 -0.245 0.000 2.372 7130 L HA 0.670 5.010 4.340 -0.001 0.000 0.274 7130 L C -1.326 175.347 176.870 -0.329 0.000 0.988 7130 L CA 0.013 54.752 54.840 -0.170 0.000 0.833 7130 L CB 1.286 43.292 42.059 -0.089 0.000 1.236 7130 L HN 0.472 nan 8.230 nan 0.000 0.410 7131 F N 4.946 124.897 119.950 0.002 0.000 2.361 7131 F HA 0.419 4.945 4.527 -0.001 0.000 0.364 7131 F C 0.256 176.054 175.800 -0.003 0.000 1.117 7131 F CA -0.315 57.684 58.000 -0.003 0.000 1.071 7131 F CB 1.240 40.238 39.000 -0.004 0.000 1.188 7131 F HN 0.489 nan 8.300 nan 0.000 0.464 7132 C N 5.167 124.542 119.300 0.125 0.000 2.295 7132 C HA 0.220 4.679 4.460 -0.001 0.000 0.331 7132 C C 1.680 176.716 174.990 0.077 0.000 1.280 7132 C CA -0.462 58.601 59.018 0.076 0.000 1.746 7132 C CB 0.637 28.395 27.740 0.029 0.000 2.328 7132 C HN 0.937 nan 8.230 nan 0.000 0.521 7133 Q N 3.339 123.176 119.800 0.061 0.000 2.084 7133 Q HA -0.054 4.285 4.340 -0.001 0.000 0.202 7133 Q C 0.852 176.869 176.000 0.029 0.000 0.978 7133 Q CA 1.630 57.459 55.803 0.043 0.000 0.844 7133 Q CB 0.172 28.927 28.738 0.029 0.000 0.898 7133 Q HN 0.760 nan 8.270 nan 0.000 0.426 7134 K N -1.143 119.270 120.400 0.023 0.000 2.646 7134 K HA 0.421 4.740 4.320 -0.001 0.000 0.270 7134 K C 0.393 176.998 176.600 0.009 0.000 1.026 7134 K CA -0.190 56.104 56.287 0.013 0.000 1.043 7134 K CB 0.062 32.568 32.500 0.009 0.000 1.383 7134 K HN 0.105 nan 8.250 nan 0.000 0.513 7135 G N 0.279 109.079 108.800 0.000 0.000 2.634 7135 G HA2 0.397 4.357 3.960 -0.001 0.000 0.255 7135 G HA3 0.397 4.357 3.960 -0.001 0.000 0.255 7135 G C -0.499 174.392 174.900 -0.015 0.000 1.205 7135 G CA -0.524 44.571 45.100 -0.009 0.000 0.884 7135 G HN 0.371 nan 8.290 nan 0.000 0.549 7136 I N 0.452 121.006 120.570 -0.028 0.000 2.447 7136 I HA 0.161 4.331 4.170 -0.001 0.000 0.287 7136 I C -0.517 175.565 176.117 -0.059 0.000 1.023 7136 I CA -0.747 60.528 61.300 -0.041 0.000 1.083 7136 I CB 2.039 40.010 38.000 -0.049 0.000 1.245 7136 I HN 0.414 nan 8.210 nan 0.000 0.434 7137 D N 5.368 125.732 120.400 -0.059 0.000 2.414 7137 D HA -0.042 4.598 4.640 -0.001 0.000 0.242 7137 D C 0.668 176.891 176.300 -0.127 0.000 1.129 7137 D CA 0.162 54.117 54.000 -0.074 0.000 0.885 7137 D CB 1.315 42.080 40.800 -0.058 0.000 1.198 7137 D HN 0.500 nan 8.370 nan 0.000 0.437 7138 D N 3.191 123.505 120.400 -0.144 0.000 2.190 7138 D HA -0.183 4.457 4.640 -0.001 0.000 0.200 7138 D C 1.844 177.927 176.300 -0.362 0.000 0.992 7138 D CA 0.554 54.403 54.000 -0.251 0.000 0.854 7138 D CB 0.155 40.849 40.800 -0.177 0.000 0.936 7138 D HN 0.475 nan 8.370 nan 0.000 0.462 7139 L N 0.528 121.630 121.223 -0.201 0.000 2.056 7139 L HA -0.157 4.183 4.340 -0.001 0.000 0.207 7139 L C 2.327 178.980 176.870 -0.362 0.000 1.078 7139 L CA 1.247 55.958 54.840 -0.215 0.000 0.749 7139 L CB -0.144 41.818 42.059 -0.162 0.000 0.901 7139 L HN -0.046 nan 8.230 nan 0.000 0.433 7140 A N -0.849 121.838 122.820 -0.221 0.000 1.969 7140 A HA -0.242 4.078 4.320 -0.001 0.000 0.218 7140 A C 2.063 179.579 177.584 -0.114 0.000 1.169 7140 A CA 1.444 53.406 52.037 -0.125 0.000 0.635 7140 A CB -0.406 18.564 19.000 -0.050 0.000 0.810 7140 A HN 0.595 nan 8.150 nan 0.000 0.445 7141 Q N -1.115 118.565 119.800 -0.199 0.000 2.170 7141 Q HA -0.170 4.170 4.340 -0.001 0.000 0.203 7141 Q C 1.932 177.840 176.000 -0.154 0.000 0.976 7141 Q CA 1.358 57.045 55.803 -0.192 0.000 0.858 7141 Q CB -0.252 28.317 28.738 -0.280 0.000 0.907 7141 Q HN 0.748 nan 8.270 nan 0.000 0.433 7142 H N -0.797 118.208 119.070 -0.110 0.000 2.321 7142 H HA -0.123 4.433 4.556 -0.001 0.000 0.300 7142 H C 1.744 177.112 175.328 0.067 0.000 1.087 7142 H CA 1.261 57.263 56.048 -0.077 0.000 1.319 7142 H CB -0.217 29.432 29.762 -0.189 0.000 1.379 7142 H HN 0.305 nan 8.280 nan 0.000 0.501 7143 Y N 0.657 121.025 120.300 0.113 0.000 2.314 7143 Y HA -0.057 4.493 4.550 -0.001 0.000 0.293 7143 Y C 2.810 178.726 175.900 0.028 0.000 1.129 7143 Y CA 0.109 58.243 58.100 0.057 0.000 1.201 7143 Y CB -0.902 37.583 38.460 0.041 0.000 0.999 7143 Y HN 0.056 nan 8.280 nan 0.000 0.541 7144 L N -0.761 120.562 121.223 0.167 0.000 2.046 7144 L HA -0.224 4.116 4.340 -0.001 0.000 0.208 7144 L C 2.631 179.534 176.870 0.056 0.000 1.077 7144 L CA 1.255 56.141 54.840 0.076 0.000 0.747 7144 L CB -0.778 41.293 42.059 0.021 0.000 0.896 7144 L HN 0.157 nan 8.230 nan 0.000 0.432 7145 A N -0.052 122.807 122.820 0.065 0.000 1.930 7145 A HA -0.199 4.121 4.320 -0.001 0.000 0.217 7145 A C 2.299 179.923 177.584 0.066 0.000 1.175 7145 A CA 1.506 53.576 52.037 0.056 0.000 0.627 7145 A CB -0.308 18.733 19.000 0.067 0.000 0.815 7145 A HN 0.313 nan 8.150 nan 0.000 0.443 7146 K N -0.381 120.079 120.400 0.100 0.000 2.211 7146 K HA -0.084 4.235 4.320 -0.001 0.000 0.203 7146 K C 1.190 177.816 176.600 0.044 0.000 1.050 7146 K CA 1.163 57.497 56.287 0.079 0.000 0.945 7146 K CB 0.006 32.572 32.500 0.110 0.000 0.732 7146 K HN 0.359 nan 8.250 nan 0.000 0.451 7147 E N -0.469 119.758 120.200 0.045 0.000 2.489 7147 E HA 0.024 4.373 4.350 -0.001 0.000 0.193 7147 E C 0.876 177.485 176.600 0.016 0.000 1.057 7147 E CA 0.421 56.834 56.400 0.022 0.000 0.866 7147 E CB 0.642 30.355 29.700 0.022 0.000 0.916 7147 E HN 0.451 nan 8.360 nan 0.000 0.500 7148 G N 1.920 110.731 108.800 0.019 0.000 2.147 7148 G HA2 -0.289 3.670 3.960 -0.001 0.000 0.244 7148 G HA3 -0.289 3.670 3.960 -0.001 0.000 0.244 7148 G C 0.234 175.135 174.900 0.000 0.000 1.005 7148 G CA 0.174 45.280 45.100 0.010 0.000 0.713 7148 G HN 0.269 nan 8.290 nan 0.000 0.515 7149 I N 1.043 121.612 120.570 -0.000 0.000 2.342 7149 I HA 0.422 4.592 4.170 -0.001 0.000 0.291 7149 I C 1.018 177.113 176.117 -0.036 0.000 1.010 7149 I CA -1.089 60.201 61.300 -0.017 0.000 1.308 7149 I CB 1.552 39.545 38.000 -0.012 0.000 1.400 7149 I HN 0.148 nan 8.210 nan 0.000 0.488 7150 V N 3.807 123.685 119.914 -0.061 0.000 2.509 7150 V HA 0.911 5.031 4.120 -0.001 0.000 0.284 7150 V C 0.063 176.062 176.094 -0.158 0.000 1.047 7150 V CA -0.282 61.963 62.300 -0.092 0.000 0.952 7150 V CB 1.171 32.941 31.823 -0.089 0.000 0.988 7150 V HN 0.820 nan 8.190 nan 0.000 0.469 7151 A N 3.624 126.346 122.820 -0.162 0.000 2.515 7151 A HA 0.999 5.318 4.320 -0.001 0.000 0.298 7151 A C -0.329 177.137 177.584 -0.197 0.000 1.059 7151 A CA -0.315 51.601 52.037 -0.202 0.000 0.698 7151 A CB 1.878 20.805 19.000 -0.121 0.000 1.289 7151 A HN 2.330 nan 8.150 nan 0.000 0.404 7152 A N 1.911 124.588 122.820 -0.237 0.000 2.359 7152 A HA 0.739 5.058 4.320 -0.001 0.000 0.303 7152 A C -0.008 177.562 177.584 -0.023 0.000 1.066 7152 A CA -0.649 51.322 52.037 -0.109 0.000 0.730 7152 A CB 0.779 19.733 19.000 -0.076 0.000 1.211 7152 A HN 1.205 nan 8.150 nan 0.000 0.439 7153 R N 1.840 122.336 120.500 -0.007 0.000 2.700 7153 R HA 0.718 5.057 4.340 -0.001 0.000 0.253 7153 R C -0.363 175.954 176.300 0.027 0.000 1.091 7153 R CA -0.782 55.324 56.100 0.009 0.000 1.104 7153 R CB 0.406 30.698 30.300 -0.012 0.000 1.202 7153 R HN 0.493 nan 8.270 nan 0.000 0.532 7154 R N -0.926 119.588 120.500 0.023 0.000 3.516 7154 R HA -0.111 4.229 4.340 -0.001 0.000 0.271 7154 R C -0.682 175.637 176.300 0.032 0.000 1.098 7154 R CA 0.568 56.681 56.100 0.021 0.000 0.732 7154 R CB -2.619 27.687 30.300 0.010 0.000 1.152 7154 R HN 0.528 nan 8.270 nan 0.000 0.455 7155 V N 1.411 121.357 119.914 0.053 0.000 2.572 7155 V HA 0.036 4.156 4.120 -0.001 0.000 0.291 7155 V C 1.467 177.576 176.094 0.024 0.000 1.039 7155 V CA -0.022 62.315 62.300 0.061 0.000 1.055 7155 V CB 1.183 33.074 31.823 0.114 0.000 0.969 7155 V HN 0.153 nan 8.190 nan 0.000 0.482 7156 K N 3.309 123.712 120.400 0.005 0.000 2.382 7156 K HA 0.031 4.350 4.320 -0.001 0.000 0.275 7156 K C 1.209 177.800 176.600 -0.015 0.000 1.009 7156 K CA -0.319 55.963 56.287 -0.008 0.000 0.970 7156 K CB 0.549 33.039 32.500 -0.017 0.000 0.934 7156 K HN 0.608 nan 8.250 nan 0.000 0.479 7157 K N 1.974 122.367 120.400 -0.012 0.000 2.074 7157 K HA -0.199 4.121 4.320 -0.001 0.000 0.209 7157 K C 1.914 178.499 176.600 -0.026 0.000 1.048 7157 K CA 2.229 58.508 56.287 -0.014 0.000 0.926 7157 K CB -0.553 31.941 32.500 -0.010 0.000 0.713 7157 K HN 0.582 nan 8.250 nan 0.000 0.444 7158 S N 0.180 115.863 115.700 -0.029 0.000 2.359 7158 S HA -0.170 4.299 4.470 -0.001 0.000 0.224 7158 S C 1.401 175.966 174.600 -0.058 0.000 1.035 7158 S CA 1.784 59.961 58.200 -0.038 0.000 1.018 7158 S CB -0.554 62.625 63.200 -0.034 0.000 0.876 7158 S HN 0.424 nan 8.310 nan 0.000 0.448 7159 D N 0.915 121.275 120.400 -0.067 0.000 2.144 7159 D HA -0.060 4.580 4.640 -0.001 0.000 0.199 7159 D C 2.002 178.214 176.300 -0.145 0.000 0.984 7159 D CA 0.979 54.912 54.000 -0.111 0.000 0.834 7159 D CB -0.273 40.466 40.800 -0.101 0.000 0.955 7159 D HN 0.382 nan 8.370 nan 0.000 0.465 7160 M N 0.480 120.023 119.600 -0.096 0.000 2.159 7160 M HA -0.087 4.393 4.480 -0.001 0.000 0.263 7160 M C 1.889 178.141 176.300 -0.080 0.000 1.063 7160 M CA 1.202 56.451 55.300 -0.085 0.000 1.110 7160 M CB -0.754 31.828 32.600 -0.031 0.000 1.374 7160 M HN 0.118 nan 8.290 nan 0.000 0.411 7161 E N 0.015 120.176 120.200 -0.065 0.000 2.076 7161 E HA -0.122 4.228 4.350 -0.001 0.000 0.190 7161 E C 2.064 178.625 176.600 -0.064 0.000 0.979 7161 E CA 0.795 57.163 56.400 -0.052 0.000 0.807 7161 E CB 0.014 29.692 29.700 -0.038 0.000 0.761 7161 E HN 0.494 nan 8.360 nan 0.000 0.454 7162 K N 0.680 121.031 120.400 -0.082 0.000 2.097 7162 K HA -0.093 4.227 4.320 -0.001 0.000 0.206 7162 K C 2.197 178.733 176.600 -0.107 0.000 1.049 7162 K CA 0.833 57.068 56.287 -0.086 0.000 0.933 7162 K CB -0.084 32.359 32.500 -0.095 0.000 0.717 7162 K HN 0.106 nan 8.250 nan 0.000 0.442 7163 L N 0.476 121.602 121.223 -0.162 0.000 2.093 7163 L HA -0.164 4.175 4.340 -0.001 0.000 0.208 7163 L C 2.580 179.385 176.870 -0.108 0.000 1.085 7163 L CA 1.032 55.752 54.840 -0.200 0.000 0.755 7163 L CB -0.537 41.295 42.059 -0.377 0.000 0.904 7163 L HN 0.193 nan 8.230 nan 0.000 0.435 7164 A N 0.087 122.860 122.820 -0.078 0.000 1.930 7164 A HA -0.198 4.121 4.320 -0.001 0.000 0.217 7164 A C 2.321 179.890 177.584 -0.025 0.000 1.175 7164 A CA 1.525 53.540 52.037 -0.037 0.000 0.627 7164 A CB -0.280 18.703 19.000 -0.028 0.000 0.815 7164 A HN 0.306 nan 8.150 nan 0.000 0.443 7165 K N -0.313 120.068 120.400 -0.032 0.000 2.026 7165 K HA -0.041 4.279 4.320 -0.001 0.000 0.208 7165 K C 2.333 178.928 176.600 -0.008 0.000 1.048 7165 K CA 1.198 57.474 56.287 -0.019 0.000 0.929 7165 K CB -0.283 32.202 32.500 -0.024 0.000 0.713 7165 K HN 0.437 nan 8.250 nan 0.000 0.439 7166 A N 1.023 123.831 122.820 -0.020 0.000 1.855 7166 A HA -0.124 4.195 4.320 -0.001 0.000 0.213 7166 A C 2.287 179.877 177.584 0.010 0.000 1.195 7166 A CA 2.034 54.067 52.037 -0.007 0.000 0.610 7166 A CB -0.943 18.041 19.000 -0.027 0.000 0.837 7166 A HN 0.452 nan 8.150 nan 0.000 0.444 7167 T N -4.296 110.258 114.554 0.001 0.000 3.043 7167 T HA 0.357 4.706 4.350 -0.001 0.000 0.263 7167 T C 1.485 176.203 174.700 0.030 0.000 1.094 7167 T CA 1.235 63.347 62.100 0.020 0.000 1.127 7167 T CB -0.136 68.745 68.868 0.021 0.000 0.905 7167 T HN 1.773 nan 8.240 nan 0.000 0.490 7168 G N 1.526 110.338 108.800 0.020 0.000 2.143 7168 G HA2 -0.052 3.908 3.960 -0.001 0.000 0.248 7168 G HA3 -0.052 3.908 3.960 -0.001 0.000 0.248 7168 G C 0.282 175.193 174.900 0.020 0.000 0.991 7168 G CA 0.036 45.149 45.100 0.022 0.000 0.689 7168 G HN 1.208 nan 8.290 nan 0.000 0.522 7169 A N -0.328 122.503 122.820 0.018 0.000 2.445 7169 A HA 0.561 4.880 4.320 -0.001 0.000 0.242 7169 A C 0.458 178.052 177.584 0.017 0.000 1.075 7169 A CA 0.549 52.601 52.037 0.025 0.000 0.777 7169 A CB 0.378 19.398 19.000 0.034 0.000 1.013 7169 A HN 0.817 nan 8.150 nan 0.000 0.493 7170 N N 1.657 120.369 118.700 0.021 0.000 2.444 7170 N HA 0.358 5.098 4.740 -0.001 0.000 0.262 7170 N C -0.873 174.648 175.510 0.020 0.000 0.974 7170 N CA -0.356 52.704 53.050 0.016 0.000 0.933 7170 N CB 1.159 39.655 38.487 0.015 0.000 1.137 7170 N HN 0.288 nan 8.380 nan 0.000 0.498 7171 V N 4.911 124.834 119.914 0.014 0.000 2.485 7171 V HA 0.141 4.261 4.120 -0.001 0.000 0.287 7171 V C 0.400 176.504 176.094 0.017 0.000 1.022 7171 V CA -0.064 62.246 62.300 0.017 0.000 1.067 7171 V CB -0.123 31.705 31.823 0.009 0.000 0.967 7171 V HN 0.516 nan 8.190 nan 0.000 0.479 7172 I N 4.132 124.715 120.570 0.022 0.000 2.441 7172 I HA 0.438 4.608 4.170 -0.001 0.000 0.295 7172 I C 0.986 177.114 176.117 0.018 0.000 0.994 7172 I CA -0.338 60.974 61.300 0.019 0.000 1.144 7172 I CB 1.314 39.327 38.000 0.021 0.000 1.314 7172 I HN 0.635 nan 8.210 nan 0.000 0.445 7173 A N 5.620 128.449 122.820 0.014 0.000 1.832 7173 A HA 0.355 4.674 4.320 -0.001 0.000 0.214 7173 A C 1.079 178.671 177.584 0.014 0.000 1.204 7173 A CA 1.095 53.140 52.037 0.013 0.000 0.606 7173 A CB -0.175 18.831 19.000 0.010 0.000 0.849 7173 A HN 0.733 nan 8.150 nan 0.000 0.445 7174 A N -1.023 121.805 122.820 0.013 0.000 2.317 7174 A HA 0.645 4.965 4.320 -0.001 0.000 0.327 7174 A C 0.737 178.329 177.584 0.014 0.000 1.178 7174 A CA -0.594 51.451 52.037 0.013 0.000 0.817 7174 A CB 0.403 19.409 19.000 0.011 0.000 1.189 7174 A HN 0.364 nan 8.150 nan 0.000 0.489 7175 I N 1.821 122.400 120.570 0.015 0.000 2.335 7175 I HA -0.332 3.838 4.170 -0.001 0.000 0.251 7175 I C 2.756 178.881 176.117 0.014 0.000 1.129 7175 I CA 1.637 62.946 61.300 0.016 0.000 1.402 7175 I CB -0.247 37.763 38.000 0.016 0.000 1.069 7175 I HN 0.779 nan 8.210 nan 0.000 0.424 7176 A N 0.819 123.646 122.820 0.012 0.000 1.917 7176 A HA -0.233 4.087 4.320 -0.001 0.000 0.219 7176 A C 2.505 180.095 177.584 0.010 0.000 1.182 7176 A CA 2.092 54.135 52.037 0.010 0.000 0.633 7176 A CB -0.746 18.259 19.000 0.009 0.000 0.819 7176 A HN 0.460 nan 8.150 nan 0.000 0.448 7177 A N -1.298 121.529 122.820 0.011 0.000 2.067 7177 A HA 0.291 4.610 4.320 -0.001 0.000 0.217 7177 A C 1.024 178.615 177.584 0.012 0.000 1.156 7177 A CA 0.474 52.518 52.037 0.011 0.000 0.683 7177 A CB -0.451 18.555 19.000 0.010 0.000 0.808 7177 A HN 0.598 nan 8.150 nan 0.000 0.455 7178 L N 1.817 123.049 121.223 0.014 0.000 2.477 7178 L HA 0.360 4.700 4.340 -0.001 0.000 0.272 7178 L C 0.378 177.257 176.870 0.015 0.000 1.157 7178 L CA 0.503 55.353 54.840 0.016 0.000 0.889 7178 L CB 0.388 42.459 42.059 0.019 0.000 1.158 7178 L HN 0.343 nan 8.230 nan 0.000 0.473 7179 S N 3.375 119.084 115.700 0.015 0.000 2.704 7179 S HA 0.781 5.250 4.470 -0.001 0.000 0.296 7179 S C 0.836 175.446 174.600 0.016 0.000 1.138 7179 S CA -0.350 57.859 58.200 0.014 0.000 0.875 7179 S CB 1.277 64.484 63.200 0.012 0.000 1.151 7179 S HN 0.811 nan 8.310 nan 0.000 0.500 7180 A N 0.375 123.204 122.820 0.015 0.000 2.024 7180 A HA -0.082 4.237 4.320 -0.001 0.000 0.220 7180 A C 2.022 179.616 177.584 0.018 0.000 1.164 7180 A CA 1.531 53.578 52.037 0.016 0.000 0.643 7180 A CB -1.060 17.948 19.000 0.014 0.000 0.806 7180 A HN 0.857 nan 8.150 nan 0.000 0.451 7181 Q N -0.521 119.289 119.800 0.016 0.000 2.436 7181 Q HA -0.100 4.239 4.340 -0.001 0.000 0.209 7181 Q C 0.548 176.559 176.000 0.018 0.000 0.965 7181 Q CA 0.982 56.794 55.803 0.016 0.000 0.910 7181 Q CB 0.011 28.757 28.738 0.013 0.000 0.980 7181 Q HN 0.613 nan 8.270 nan 0.000 0.491 7182 D N -0.203 120.209 120.400 0.020 0.000 2.350 7182 D HA 0.015 4.655 4.640 -0.001 0.000 0.213 7182 D C -0.146 176.171 176.300 0.028 0.000 1.031 7182 D CA 0.223 54.236 54.000 0.022 0.000 0.861 7182 D CB 0.373 41.186 40.800 0.021 0.000 0.926 7182 D HN 0.096 nan 8.370 nan 0.000 0.520 7183 L N 0.967 122.208 121.223 0.031 0.000 2.380 7183 L HA 0.325 4.664 4.340 -0.001 0.000 0.273 7183 L C 1.284 178.178 176.870 0.040 0.000 1.138 7183 L CA -0.030 54.833 54.840 0.039 0.000 0.832 7183 L CB 1.014 43.094 42.059 0.036 0.000 1.124 7183 L HN -0.174 nan 8.230 nan 0.000 0.454 7184 G N 1.184 110.013 108.800 0.048 0.000 2.488 7184 G HA2 0.535 4.494 3.960 -0.001 0.000 0.318 7184 G HA3 0.535 4.494 3.960 -0.001 0.000 0.318 7184 G C -1.111 173.820 174.900 0.052 0.000 1.188 7184 G CA -0.461 44.667 45.100 0.046 0.000 0.944 7184 G HN 0.529 nan 8.290 nan 0.000 0.495 7185 D N -0.394 120.034 120.400 0.047 0.000 2.350 7185 D HA 0.661 5.301 4.640 -0.001 0.000 0.245 7185 D C -0.251 176.076 176.300 0.044 0.000 1.036 7185 D CA 0.066 54.093 54.000 0.045 0.000 0.848 7185 D CB 1.972 42.795 40.800 0.039 0.000 1.307 7185 D HN 0.592 nan 8.370 nan 0.000 0.469 7186 A N 0.303 123.151 122.820 0.046 0.000 2.488 7186 A HA 0.622 4.942 4.320 -0.001 0.000 0.298 7186 A C 0.961 178.567 177.584 0.037 0.000 1.044 7186 A CA -0.413 51.650 52.037 0.045 0.000 0.693 7186 A CB 1.614 20.655 19.000 0.069 0.000 1.272 7186 A HN 0.487 nan 8.150 nan 0.000 0.402 7187 G N 0.329 109.144 108.800 0.025 0.000 2.408 7187 G HA2 0.300 4.259 3.960 -0.001 0.000 0.217 7187 G HA3 0.300 4.259 3.960 -0.001 0.000 0.217 7187 G C 0.284 175.200 174.900 0.026 0.000 1.150 7187 G CA 1.652 46.763 45.100 0.018 0.000 0.776 7187 G HN 1.220 nan 8.290 nan 0.000 0.542 7188 L N 0.119 121.365 121.223 0.039 0.000 2.562 7188 L HA 0.583 4.923 4.340 -0.001 0.000 0.266 7188 L C -1.332 175.584 176.870 0.077 0.000 0.949 7188 L CA -0.733 54.136 54.840 0.047 0.000 0.879 7188 L CB 2.420 44.499 42.059 0.033 0.000 1.278 7188 L HN -0.148 nan 8.230 nan 0.000 0.404 7189 V N 4.494 124.459 119.914 0.085 0.000 2.334 7189 V HA 0.625 4.744 4.120 -0.001 0.000 0.281 7189 V C -0.364 175.792 176.094 0.104 0.000 1.016 7189 V CA -0.426 61.947 62.300 0.121 0.000 0.832 7189 V CB 1.390 33.294 31.823 0.136 0.000 0.999 7189 V HN 0.823 nan 8.190 nan 0.000 0.439 7190 E N 3.269 123.552 120.200 0.138 0.000 2.292 7190 E HA 0.389 4.738 4.350 -0.001 0.000 0.272 7190 E C -0.880 175.820 176.600 0.167 0.000 0.881 7190 E CA -0.681 55.784 56.400 0.108 0.000 0.754 7190 E CB 2.066 31.800 29.700 0.057 0.000 1.201 7190 E HN 0.742 nan 8.360 nan 0.000 0.425 7191 E N 4.421 124.689 120.200 0.114 0.000 2.129 7191 E HA 0.199 4.549 4.350 -0.001 0.000 0.283 7191 E C -0.866 175.800 176.600 0.110 0.000 1.080 7191 E CA -0.159 56.318 56.400 0.128 0.000 0.867 7191 E CB 0.601 30.344 29.700 0.072 0.000 1.056 7191 E HN 0.346 nan 8.360 nan 0.000 0.404 7192 R N 3.599 124.208 120.500 0.183 0.000 2.750 7192 R HA 0.412 4.752 4.340 -0.001 0.000 0.281 7192 R C -0.682 175.708 176.300 0.149 0.000 0.972 7192 R CA -0.923 55.229 56.100 0.088 0.000 0.912 7192 R CB 1.968 32.185 30.300 -0.137 0.000 1.187 7192 R HN 0.328 nan 8.270 nan 0.000 0.464 7193 K N 1.975 122.418 120.400 0.071 0.000 2.159 7193 K HA 0.458 4.778 4.320 -0.001 0.000 0.266 7193 K C -0.756 175.889 176.600 0.073 0.000 0.975 7193 K CA -0.458 55.873 56.287 0.074 0.000 0.865 7193 K CB 1.736 34.259 32.500 0.038 0.000 1.087 7193 K HN 0.435 nan 8.250 nan 0.000 0.446 7194 I N 1.413 122.037 120.570 0.091 0.000 2.468 7194 I HA 0.056 4.226 4.170 -0.001 0.000 0.285 7194 I C -0.635 175.513 176.117 0.051 0.000 1.039 7194 I CA -0.018 61.331 61.300 0.080 0.000 1.074 7194 I CB 1.324 39.404 38.000 0.132 0.000 1.228 7194 I HN 0.700 nan 8.210 nan 0.000 0.436 7195 S N 4.743 120.463 115.700 0.033 0.000 3.587 7195 S HA -0.198 4.272 4.470 -0.001 0.000 0.337 7195 S C 1.070 175.681 174.600 0.019 0.000 1.119 7195 S CA 1.182 59.395 58.200 0.021 0.000 0.976 7195 S CB -1.612 61.599 63.200 0.018 0.000 0.922 7195 S HN 1.595 nan 8.310 nan 0.000 0.503 7196 G N 0.089 108.902 108.800 0.022 0.000 2.284 7196 G HA2 -0.250 3.710 3.960 -0.001 0.000 0.230 7196 G HA3 -0.250 3.710 3.960 -0.001 0.000 0.230 7196 G C -0.416 174.499 174.900 0.026 0.000 1.021 7196 G CA 0.124 45.236 45.100 0.020 0.000 0.619 7196 G HN 0.596 nan 8.290 nan 0.000 0.510 7197 D N 1.260 121.679 120.400 0.031 0.000 2.308 7197 D HA 0.471 5.111 4.640 -0.001 0.000 0.251 7197 D C 0.302 176.635 176.300 0.054 0.000 1.127 7197 D CA 0.497 54.517 54.000 0.034 0.000 0.876 7197 D CB 1.614 42.429 40.800 0.025 0.000 1.176 7197 D HN 0.197 nan 8.370 nan 0.000 0.446 7198 S N 2.910 118.639 115.700 0.048 0.000 2.481 7198 S HA 0.400 4.869 4.470 -0.001 0.000 0.276 7198 S C -0.229 174.413 174.600 0.070 0.000 1.247 7198 S CA -0.403 57.837 58.200 0.067 0.000 1.053 7198 S CB 0.036 63.264 63.200 0.047 0.000 0.925 7198 S HN 0.313 nan 8.310 nan 0.000 0.491 7199 M N 4.476 124.146 119.600 0.117 0.000 2.619 7199 M HA 0.532 5.012 4.480 -0.001 0.000 0.297 7199 M C -1.068 175.307 176.300 0.124 0.000 1.229 7199 M CA -0.638 54.700 55.300 0.063 0.000 0.860 7199 M CB 2.151 34.736 32.600 -0.026 0.000 1.741 7199 M HN 0.438 nan 8.290 nan 0.000 0.462 7200 I N 1.686 122.269 120.570 0.021 0.000 2.339 7200 I HA 0.362 4.532 4.170 -0.001 0.000 0.290 7200 I C -1.346 174.753 176.117 -0.030 0.000 0.994 7200 I CA -0.369 61.001 61.300 0.116 0.000 1.191 7200 I CB 0.932 39.034 38.000 0.169 0.000 1.343 7200 I HN 0.437 nan 8.210 nan 0.000 0.458 7201 F N 5.970 125.957 119.950 0.061 0.000 2.385 7201 F HA 0.379 4.906 4.527 -0.001 0.000 0.360 7201 F C 0.093 175.926 175.800 0.056 0.000 1.122 7201 F CA -0.772 57.255 58.000 0.044 0.000 1.090 7201 F CB 1.359 40.376 39.000 0.027 0.000 1.150 7201 F HN 0.016 nan 8.300 nan 0.000 0.472 7202 V N 4.423 124.432 119.914 0.157 0.000 2.311 7202 V HA 0.398 4.518 4.120 -0.001 0.000 0.275 7202 V C -0.298 175.852 176.094 0.094 0.000 1.022 7202 V CA -0.534 61.837 62.300 0.117 0.000 0.830 7202 V CB 0.567 32.424 31.823 0.057 0.000 1.012 7202 V HN 0.838 nan 8.190 nan 0.000 0.452 7203 E N 3.141 123.399 120.200 0.097 0.000 2.446 7203 E HA 0.622 4.972 4.350 -0.001 0.000 0.276 7203 E C -0.669 175.958 176.600 0.044 0.000 0.969 7203 E CA -0.877 55.566 56.400 0.072 0.000 0.800 7203 E CB 1.683 31.438 29.700 0.091 0.000 1.341 7203 E HN 0.220 nan 8.360 nan 0.000 0.460 7204 E N -1.202 119.012 120.200 0.023 0.000 3.181 7204 E HA -0.156 4.194 4.350 -0.001 0.000 0.293 7204 E C -0.552 176.042 176.600 -0.009 0.000 0.936 7204 E CA 0.747 57.148 56.400 0.002 0.000 0.975 7204 E CB -2.397 27.307 29.700 0.006 0.000 1.496 7204 E HN 0.593 nan 8.360 nan 0.000 0.429 7205 C N 0.967 120.263 119.300 -0.005 0.000 2.689 7205 C HA 0.068 4.528 4.460 -0.001 0.000 0.409 7205 C C 2.304 177.257 174.990 -0.061 0.000 1.293 7205 C CA -0.027 58.984 59.018 -0.011 0.000 2.136 7205 C CB 0.420 28.163 27.740 0.005 0.000 2.719 7205 C HN 0.355 nan 8.230 nan 0.000 0.644 7206 K N 0.414 120.770 120.400 -0.072 0.000 2.001 7206 K HA -0.132 4.187 4.320 -0.001 0.000 0.214 7206 K C 0.064 176.375 176.600 -0.481 0.000 1.050 7206 K CA 1.783 57.937 56.287 -0.221 0.000 0.934 7206 K CB -0.136 32.325 32.500 -0.065 0.000 0.718 7206 K HN 0.732 nan 8.250 nan 0.000 0.443 7207 H N -0.405 118.669 119.070 0.007 0.000 2.488 7207 H HA 0.202 4.757 4.556 -0.001 0.000 0.237 7207 H C -2.592 172.738 175.328 0.002 0.000 1.395 7207 H CA -1.751 54.299 56.048 0.005 0.000 1.491 7207 H CB 0.698 30.462 29.762 0.003 0.000 1.567 7207 H HN 0.121 nan 8.280 nan 0.000 0.508 7208 P HA 0.063 nan 4.420 nan 0.000 0.271 7208 P C 0.147 177.471 177.300 0.040 0.000 1.220 7208 P CA -0.519 62.604 63.100 0.037 0.000 0.768 7208 P CB 1.571 33.280 31.700 0.015 0.000 0.848 7209 K N 1.049 121.465 120.400 0.027 0.000 2.399 7209 K HA 0.459 4.778 4.320 -0.001 0.000 0.204 7209 K C 0.373 176.975 176.600 0.004 0.000 1.023 7209 K CA -0.291 56.007 56.287 0.019 0.000 1.127 7209 K CB 0.494 33.002 32.500 0.015 0.000 0.856 7209 K HN 0.543 nan 8.250 nan 0.000 0.514 7210 A N 0.514 123.333 122.820 -0.002 0.000 2.486 7210 A HA 0.662 4.982 4.320 -0.001 0.000 0.300 7210 A C -0.598 176.980 177.584 -0.010 0.000 1.048 7210 A CA -0.726 51.304 52.037 -0.012 0.000 0.696 7210 A CB 1.475 20.459 19.000 -0.027 0.000 1.278 7210 A HN -0.040 nan 8.150 nan 0.000 0.405 7211 V N -1.090 118.818 119.914 -0.010 0.000 3.074 7211 V HA 0.966 5.086 4.120 -0.001 0.000 0.314 7211 V C -0.435 175.651 176.094 -0.014 0.000 1.117 7211 V CA -0.578 61.718 62.300 -0.006 0.000 1.014 7211 V CB 1.714 33.538 31.823 0.003 0.000 1.057 7211 V HN 0.853 nan 8.190 nan 0.000 0.438 7212 T N 4.096 118.644 114.554 -0.010 0.000 2.841 7212 T HA 0.513 4.863 4.350 -0.001 0.000 0.285 7212 T C -0.516 174.182 174.700 -0.003 0.000 0.991 7212 T CA -0.212 61.875 62.100 -0.021 0.000 0.966 7212 T CB 1.347 70.186 68.868 -0.049 0.000 0.962 7212 T HN 0.957 nan 8.240 nan 0.000 0.438 7213 M N 4.893 124.489 119.600 -0.006 0.000 2.063 7213 M HA 0.477 4.956 4.480 -0.001 0.000 0.348 7213 M C -1.153 175.149 176.300 0.003 0.000 1.180 7213 M CA -0.709 54.594 55.300 0.004 0.000 1.059 7213 M CB 0.274 32.875 32.600 0.002 0.000 1.544 7213 M HN 0.532 nan 8.290 nan 0.000 0.447 7214 L N 7.303 128.538 121.223 0.019 0.000 2.259 7214 L HA 0.466 4.806 4.340 -0.001 0.000 0.288 7214 L C -1.041 175.844 176.870 0.025 0.000 1.051 7214 L CA -0.410 54.446 54.840 0.025 0.000 0.824 7214 L CB 0.441 42.538 42.059 0.064 0.000 1.206 7214 L HN 0.754 nan 8.230 nan 0.000 0.429 7215 I N 5.534 126.112 120.570 0.014 0.000 2.325 7215 I HA 0.318 4.488 4.170 -0.001 0.000 0.291 7215 I C 0.227 176.352 176.117 0.014 0.000 1.019 7215 I CA -0.305 61.003 61.300 0.013 0.000 1.302 7215 I CB 0.862 38.866 38.000 0.007 0.000 1.401 7215 I HN 0.578 nan 8.210 nan 0.000 0.485 7216 R N 4.031 124.541 120.500 0.016 0.000 2.828 7216 R HA 0.898 5.237 4.340 -0.001 0.000 0.264 7216 R C -0.239 176.069 176.300 0.012 0.000 1.022 7216 R CA -0.975 55.134 56.100 0.016 0.000 1.021 7216 R CB 2.154 32.466 30.300 0.020 0.000 1.163 7216 R HN 0.831 nan 8.270 nan 0.000 0.494 7217 G N -0.905 107.901 108.800 0.010 0.000 2.340 7217 G HA2 -0.002 3.958 3.960 -0.001 0.000 0.298 7217 G HA3 -0.002 3.958 3.960 -0.001 0.000 0.298 7217 G C -0.089 174.815 174.900 0.007 0.000 1.498 7217 G CA -0.479 44.627 45.100 0.010 0.000 0.847 7217 G HN 0.413 nan 8.290 nan 0.000 0.594 7218 T N -0.668 113.892 114.554 0.010 0.000 2.995 7218 T HA 0.278 4.628 4.350 -0.001 0.000 0.269 7218 T C 0.783 175.487 174.700 0.006 0.000 1.091 7218 T CA 2.172 64.277 62.100 0.009 0.000 1.128 7218 T CB -0.219 68.657 68.868 0.013 0.000 0.891 7218 T HN 0.701 nan 8.240 nan 0.000 0.492 7219 T N 1.031 115.588 114.554 0.006 0.000 2.956 7219 T HA 0.272 4.622 4.350 -0.001 0.000 0.312 7219 T C 0.276 174.960 174.700 -0.026 0.000 1.151 7219 T CA -0.776 61.321 62.100 -0.004 0.000 1.024 7219 T CB 2.165 71.050 68.868 0.029 0.000 1.140 7219 T HN -0.108 nan 8.240 nan 0.000 0.473 7220 E N 1.015 121.158 120.200 -0.093 0.000 2.070 7220 E HA -0.198 4.152 4.350 -0.001 0.000 0.197 7220 E C 1.667 178.192 176.600 -0.125 0.000 1.004 7220 E CA 1.673 57.982 56.400 -0.150 0.000 0.805 7220 E CB -0.071 29.470 29.700 -0.266 0.000 0.744 7220 E HN 0.560 nan 8.360 nan 0.000 0.451 7221 H N -0.238 118.835 119.070 0.005 0.000 2.491 7221 H HA -0.009 4.546 4.556 -0.001 0.000 0.290 7221 H C 2.266 177.597 175.328 0.005 0.000 1.050 7221 H CA 0.615 56.665 56.048 0.004 0.000 1.309 7221 H CB -0.040 29.724 29.762 0.004 0.000 1.392 7221 H HN -0.009 nan 8.280 nan 0.000 0.554 7222 V N 1.897 121.877 119.914 0.109 0.000 2.323 7222 V HA -0.182 3.938 4.120 -0.001 0.000 0.244 7222 V C 2.582 178.702 176.094 0.044 0.000 1.041 7222 V CA 1.607 63.946 62.300 0.065 0.000 1.025 7222 V CB -0.457 31.394 31.823 0.046 0.000 0.656 7222 V HN 0.413 nan 8.190 nan 0.000 0.451 7223 I N -1.904 118.683 120.570 0.028 0.000 3.111 7223 I HA -0.035 4.135 4.170 -0.001 0.000 0.272 7223 I C 2.061 178.190 176.117 0.019 0.000 1.268 7223 I CA 1.217 62.527 61.300 0.017 0.000 1.467 7223 I CB -0.557 37.446 38.000 0.004 0.000 1.087 7223 I HN 0.280 nan 8.210 nan 0.000 0.467 7224 E N 1.533 121.752 120.200 0.032 0.000 2.106 7224 E HA -0.162 4.187 4.350 -0.001 0.000 0.192 7224 E C 1.960 178.584 176.600 0.039 0.000 0.984 7224 E CA 1.115 57.540 56.400 0.042 0.000 0.806 7224 E CB 0.041 29.790 29.700 0.082 0.000 0.750 7224 E HN 0.537 nan 8.360 nan 0.000 0.458 7225 E N 0.330 120.556 120.200 0.043 0.000 2.107 7225 E HA -0.099 4.251 4.350 -0.001 0.000 0.191 7225 E C 2.316 178.931 176.600 0.025 0.000 0.982 7225 E CA 0.553 56.972 56.400 0.032 0.000 0.809 7225 E CB -0.043 29.677 29.700 0.034 0.000 0.756 7225 E HN 0.126 nan 8.360 nan 0.000 0.459 7226 V N 1.842 121.770 119.914 0.024 0.000 2.358 7226 V HA -0.236 3.884 4.120 -0.001 0.000 0.246 7226 V C 2.499 178.602 176.094 0.014 0.000 1.047 7226 V CA 1.725 64.036 62.300 0.018 0.000 1.035 7226 V CB -0.886 30.947 31.823 0.017 0.000 0.658 7226 V HN 0.223 nan 8.190 nan 0.000 0.452 7227 A N 0.441 123.269 122.820 0.013 0.000 1.892 7227 A HA -0.306 4.013 4.320 -0.001 0.000 0.218 7227 A C 2.318 179.908 177.584 0.009 0.000 1.188 7227 A CA 2.479 54.522 52.037 0.009 0.000 0.631 7227 A CB -0.550 18.454 19.000 0.007 0.000 0.822 7227 A HN 0.468 nan 8.150 nan 0.000 0.447 7228 R N -0.070 120.438 120.500 0.012 0.000 2.092 7228 R HA 0.069 4.408 4.340 -0.001 0.000 0.231 7228 R C 2.161 178.467 176.300 0.011 0.000 1.119 7228 R CA 1.759 57.866 56.100 0.011 0.000 0.970 7228 R CB -0.882 29.425 30.300 0.012 0.000 0.864 7228 R HN 0.390 nan 8.270 nan 0.000 0.440 7229 A N 0.142 122.970 122.820 0.013 0.000 1.908 7229 A HA -0.130 4.189 4.320 -0.001 0.000 0.218 7229 A C 2.161 179.752 177.584 0.012 0.000 1.181 7229 A CA 1.974 54.019 52.037 0.014 0.000 0.627 7229 A CB -0.852 18.159 19.000 0.017 0.000 0.818 7229 A HN 0.314 nan 8.150 nan 0.000 0.445 7230 V N -2.284 117.636 119.914 0.010 0.000 2.951 7230 V HA -0.045 4.075 4.120 -0.001 0.000 0.255 7230 V C 1.775 177.873 176.094 0.006 0.000 1.088 7230 V CA 2.137 64.442 62.300 0.008 0.000 1.109 7230 V CB -0.664 31.163 31.823 0.007 0.000 0.724 7230 V HN 0.452 nan 8.190 nan 0.000 0.471 7231 D N 1.154 121.557 120.400 0.005 0.000 2.178 7231 D HA -0.189 4.450 4.640 -0.001 0.000 0.201 7231 D C 1.682 177.985 176.300 0.004 0.000 0.980 7231 D CA 1.775 55.777 54.000 0.004 0.000 0.842 7231 D CB -0.042 40.760 40.800 0.003 0.000 0.948 7231 D HN 0.514 nan 8.370 nan 0.000 0.472 7232 D N -0.512 119.892 120.400 0.006 0.000 2.149 7232 D HA 0.035 4.674 4.640 -0.001 0.000 0.206 7232 D C 2.042 178.347 176.300 0.007 0.000 0.967 7232 D CA 1.254 55.258 54.000 0.007 0.000 0.848 7232 D CB -0.612 40.193 40.800 0.009 0.000 0.998 7232 D HN 0.253 nan 8.370 nan 0.000 0.474 7233 A N 0.848 123.673 122.820 0.008 0.000 1.908 7233 A HA -0.156 4.163 4.320 -0.001 0.000 0.218 7233 A C 2.368 179.955 177.584 0.006 0.000 1.181 7233 A CA 1.424 53.465 52.037 0.008 0.000 0.627 7233 A CB -0.923 18.082 19.000 0.008 0.000 0.818 7233 A HN 0.188 nan 8.150 nan 0.000 0.445 7234 V N -0.155 119.761 119.914 0.005 0.000 2.759 7234 V HA -0.072 4.047 4.120 -0.001 0.000 0.256 7234 V C 2.258 178.354 176.094 0.004 0.000 1.080 7234 V CA 2.112 64.414 62.300 0.004 0.000 1.101 7234 V CB -0.614 31.211 31.823 0.003 0.000 0.698 7234 V HN 0.569 nan 8.190 nan 0.000 0.477 7235 G N -0.241 108.562 108.800 0.004 0.000 2.395 7235 G HA2 -0.152 3.808 3.960 -0.001 0.000 0.214 7235 G HA3 -0.152 3.808 3.960 -0.001 0.000 0.214 7235 G C 1.616 176.519 174.900 0.005 0.000 1.177 7235 G CA 1.218 46.321 45.100 0.004 0.000 0.794 7235 G HN 0.660 nan 8.290 nan 0.000 0.532 7236 V N -1.075 118.843 119.914 0.006 0.000 2.871 7236 V HA 0.002 4.122 4.120 -0.001 0.000 0.256 7236 V C 2.573 178.671 176.094 0.006 0.000 1.082 7236 V CA 1.198 63.502 62.300 0.007 0.000 1.105 7236 V CB -0.361 31.466 31.823 0.008 0.000 0.713 7236 V HN 0.114 nan 8.190 nan 0.000 0.473 7237 V N 2.012 121.929 119.914 0.006 0.000 2.379 7237 V HA -0.005 4.115 4.120 -0.001 0.000 0.245 7237 V C 2.919 179.016 176.094 0.005 0.000 1.044 7237 V CA 2.123 64.426 62.300 0.005 0.000 1.036 7237 V CB -1.316 30.510 31.823 0.004 0.000 0.664 7237 V HN 0.605 nan 8.190 nan 0.000 0.453 7238 G N -1.366 107.437 108.800 0.005 0.000 2.418 7238 G HA2 -0.333 3.626 3.960 -0.001 0.000 0.217 7238 G HA3 -0.333 3.626 3.960 -0.001 0.000 0.217 7238 G C 1.887 176.790 174.900 0.005 0.000 1.158 7238 G CA 1.200 46.303 45.100 0.004 0.000 0.771 7238 G HN 0.529 nan 8.290 nan 0.000 0.545 7239 C N 0.534 119.838 119.300 0.005 0.000 2.429 7239 C HA -0.022 4.438 4.460 -0.001 0.000 0.277 7239 C C 3.150 178.144 174.990 0.007 0.000 1.262 7239 C CA 2.001 61.023 59.018 0.006 0.000 1.733 7239 C CB -1.052 26.692 27.740 0.007 0.000 2.010 7239 C HN 0.400 nan 8.230 nan 0.000 0.483 7240 T N 1.018 115.576 114.554 0.007 0.000 2.833 7240 T HA -0.088 4.261 4.350 -0.001 0.000 0.269 7240 T C 1.570 176.273 174.700 0.006 0.000 1.054 7240 T CA 1.813 63.917 62.100 0.007 0.000 1.135 7240 T CB -0.247 68.624 68.868 0.006 0.000 0.869 7240 T HN 0.591 nan 8.240 nan 0.000 0.466 7241 I N 0.633 121.206 120.570 0.005 0.000 2.286 7241 I HA -0.074 4.096 4.170 -0.001 0.000 0.245 7241 I C 2.538 178.658 176.117 0.005 0.000 1.104 7241 I CA 1.204 62.507 61.300 0.005 0.000 1.397 7241 I CB -0.254 37.748 38.000 0.005 0.000 1.072 7241 I HN 0.261 nan 8.210 nan 0.000 0.417 7242 E N 0.162 120.365 120.200 0.005 0.000 2.152 7242 E HA -0.081 4.269 4.350 -0.001 0.000 0.192 7242 E C -0.115 176.489 176.600 0.006 0.000 0.983 7242 E CA 0.699 57.103 56.400 0.005 0.000 0.818 7242 E CB 0.220 29.924 29.700 0.005 0.000 0.758 7242 E HN 0.375 nan 8.360 nan 0.000 0.467 7243 D N -0.531 119.873 120.400 0.007 0.000 2.505 7243 D HA 0.139 4.779 4.640 -0.001 0.000 0.250 7243 D C -0.060 176.244 176.300 0.008 0.000 1.164 7243 D CA -0.165 53.840 54.000 0.008 0.000 0.870 7243 D CB 1.719 42.524 40.800 0.009 0.000 1.160 7243 D HN 0.084 nan 8.370 nan 0.000 0.549 7244 G N 2.060 110.865 108.800 0.008 0.000 3.279 7244 G HA2 0.004 3.964 3.960 -0.001 0.000 0.230 7244 G HA3 0.004 3.964 3.960 -0.001 0.000 0.230 7244 G C 0.616 175.521 174.900 0.009 0.000 1.230 7244 G CA -0.095 45.010 45.100 0.007 0.000 0.891 7244 G HN 0.095 nan 8.290 nan 0.000 0.518 7245 R N -0.068 120.438 120.500 0.010 0.000 2.437 7245 R HA 0.608 4.947 4.340 -0.001 0.000 0.310 7245 R C -0.477 175.831 176.300 0.012 0.000 0.955 7245 R CA -0.574 55.533 56.100 0.012 0.000 0.851 7245 R CB 1.518 31.826 30.300 0.013 0.000 1.161 7245 R HN 0.305 nan 8.270 nan 0.000 0.446 7246 I N -0.192 120.385 120.570 0.013 0.000 3.042 7246 I HA 0.843 5.012 4.170 -0.001 0.000 0.310 7246 I C -0.545 175.581 176.117 0.016 0.000 1.117 7246 I CA -1.245 60.063 61.300 0.013 0.000 1.003 7246 I CB 2.160 40.167 38.000 0.011 0.000 1.228 7246 I HN 0.315 nan 8.210 nan 0.000 0.443 7247 V N 0.144 120.069 119.914 0.017 0.000 3.130 7247 V HA 0.840 4.959 4.120 -0.001 0.000 0.310 7247 V C 0.072 176.179 176.094 0.023 0.000 1.158 7247 V CA -0.405 61.908 62.300 0.021 0.000 1.029 7247 V CB 1.162 32.999 31.823 0.024 0.000 1.057 7247 V HN 1.155 nan 8.190 nan 0.000 0.436 7248 S N 1.513 117.230 115.700 0.028 0.000 2.576 7248 S HA 0.701 5.171 4.470 -0.001 0.000 0.276 7248 S C 0.487 175.106 174.600 0.031 0.000 1.339 7248 S CA 0.153 58.371 58.200 0.030 0.000 1.039 7248 S CB 0.898 64.121 63.200 0.037 0.000 0.902 7248 S HN 1.802 nan 8.310 nan 0.000 0.516 7249 G N 0.068 108.886 108.800 0.031 0.000 2.641 7249 G HA2 0.556 4.516 3.960 -0.001 0.000 0.239 7249 G HA3 0.556 4.516 3.960 -0.001 0.000 0.239 7249 G C 0.893 175.812 174.900 0.031 0.000 1.402 7249 G CA -0.564 44.554 45.100 0.029 0.000 1.046 7249 G HN 2.025 nan 8.290 nan 0.000 0.565 7250 G N -2.228 106.590 108.800 0.029 0.000 2.155 7250 G HA2 0.237 4.196 3.960 -0.001 0.000 0.257 7250 G HA3 0.237 4.196 3.960 -0.001 0.000 0.257 7250 G C 1.460 176.362 174.900 0.003 0.000 0.983 7250 G CA 1.158 46.273 45.100 0.025 0.000 0.676 7250 G HN 2.515 nan 8.290 nan 0.000 0.528 7251 G N -1.291 107.503 108.800 -0.009 0.000 2.157 7251 G HA2 -0.083 3.876 3.960 -0.001 0.000 0.248 7251 G HA3 -0.083 3.876 3.960 -0.001 0.000 0.248 7251 G C 1.417 176.288 174.900 -0.049 0.000 0.979 7251 G CA 1.654 46.733 45.100 -0.036 0.000 0.650 7251 G HN 1.938 nan 8.290 nan 0.000 0.529 7252 S N 0.058 115.754 115.700 -0.007 0.000 2.368 7252 S HA -0.162 4.307 4.470 -0.001 0.000 0.225 7252 S C 2.800 177.391 174.600 -0.015 0.000 1.030 7252 S CA 2.802 61.018 58.200 0.026 0.000 0.999 7252 S CB -0.529 62.738 63.200 0.112 0.000 0.844 7252 S HN 1.410 nan 8.310 nan 0.000 0.459 7253 T N -0.394 114.161 114.554 0.001 0.000 2.701 7253 T HA -0.047 4.303 4.350 -0.001 0.000 0.263 7253 T C 1.565 176.230 174.700 -0.058 0.000 1.040 7253 T CA 1.542 63.642 62.100 -0.001 0.000 1.147 7253 T CB -0.874 67.998 68.868 0.008 0.000 0.865 7253 T HN 0.405 nan 8.240 nan 0.000 0.426 7254 E N 1.051 121.205 120.200 -0.076 0.000 2.130 7254 E HA -0.076 4.273 4.350 -0.001 0.000 0.196 7254 E C 2.289 178.798 176.600 -0.153 0.000 0.998 7254 E CA 1.077 57.414 56.400 -0.105 0.000 0.806 7254 E CB -0.766 28.873 29.700 -0.101 0.000 0.738 7254 E HN 0.434 nan 8.360 nan 0.000 0.459 7255 V N 0.437 120.213 119.914 -0.230 0.000 2.323 7255 V HA -0.221 3.898 4.120 -0.001 0.000 0.244 7255 V C 2.286 178.140 176.094 -0.399 0.000 1.041 7255 V CA 1.842 63.926 62.300 -0.360 0.000 1.025 7255 V CB -0.436 31.054 31.823 -0.555 0.000 0.656 7255 V HN 0.212 nan 8.190 nan 0.000 0.451 7256 E N 0.619 120.578 120.200 -0.402 0.000 2.097 7256 E HA -0.232 4.118 4.350 -0.001 0.000 0.196 7256 E C 2.033 178.599 176.600 -0.057 0.000 1.000 7256 E CA 1.715 58.082 56.400 -0.056 0.000 0.804 7256 E CB -0.399 29.382 29.700 0.135 0.000 0.740 7256 E HN 0.557 nan 8.360 nan 0.000 0.454 7257 L N -0.148 121.032 121.223 -0.072 0.000 2.056 7257 L HA -0.148 4.192 4.340 -0.001 0.000 0.207 7257 L C 2.542 179.364 176.870 -0.080 0.000 1.078 7257 L CA 1.271 56.078 54.840 -0.056 0.000 0.749 7257 L CB -0.391 41.652 42.059 -0.027 0.000 0.901 7257 L HN 0.110 nan 8.230 nan 0.000 0.433 7258 S N -0.563 115.078 115.700 -0.099 0.000 2.382 7258 S HA -0.147 4.322 4.470 -0.001 0.000 0.228 7258 S C 2.015 176.560 174.600 -0.091 0.000 1.027 7258 S CA 1.223 59.369 58.200 -0.091 0.000 0.991 7258 S CB -0.109 63.028 63.200 -0.104 0.000 0.823 7258 S HN 0.270 nan 8.310 nan 0.000 0.469 7259 M N 1.385 120.926 119.600 -0.098 0.000 2.064 7259 M HA -0.049 4.431 4.480 -0.001 0.000 0.260 7259 M C 2.042 178.258 176.300 -0.140 0.000 1.073 7259 M CA 1.607 56.861 55.300 -0.077 0.000 1.124 7259 M CB -1.106 31.483 32.600 -0.018 0.000 1.326 7259 M HN 0.224 nan 8.290 nan 0.000 0.410 7260 K N 0.254 120.524 120.400 -0.217 0.000 2.103 7260 K HA 0.001 4.321 4.320 -0.001 0.000 0.204 7260 K C 2.061 178.148 176.600 -0.854 0.000 1.052 7260 K CA 0.874 56.869 56.287 -0.486 0.000 0.945 7260 K CB -0.179 32.048 32.500 -0.455 0.000 0.722 7260 K HN 0.261 nan 8.250 nan 0.000 0.443 7261 L N 0.534 121.464 121.223 -0.488 0.000 2.201 7261 L HA -0.118 4.222 4.340 -0.001 0.000 0.212 7261 L C 2.341 179.154 176.870 -0.096 0.000 1.105 7261 L CA 0.964 55.646 54.840 -0.262 0.000 0.775 7261 L CB -0.276 41.778 42.059 -0.009 0.000 0.913 7261 L HN 0.129 nan 8.230 nan 0.000 0.440 7262 R N 0.044 120.485 120.500 -0.098 0.000 2.115 7262 R HA -0.149 4.191 4.340 -0.001 0.000 0.230 7262 R C 2.083 178.379 176.300 -0.005 0.000 1.111 7262 R CA 1.224 57.307 56.100 -0.027 0.000 0.976 7262 R CB -0.126 30.157 30.300 -0.028 0.000 0.870 7262 R HN 0.463 nan 8.270 nan 0.000 0.445 7263 E N -0.523 119.646 120.200 -0.051 0.000 2.107 7263 E HA -0.143 4.206 4.350 -0.001 0.000 0.191 7263 E C 1.575 178.296 176.600 0.202 0.000 0.982 7263 E CA 0.808 57.235 56.400 0.044 0.000 0.809 7263 E CB 0.015 29.729 29.700 0.023 0.000 0.756 7263 E HN 0.320 nan 8.360 nan 0.000 0.459 7264 Y N 0.653 120.969 120.300 0.026 0.000 2.224 7264 Y HA -0.087 4.463 4.550 -0.001 0.000 0.289 7264 Y C 2.399 178.310 175.900 0.019 0.000 1.146 7264 Y CA 0.587 58.699 58.100 0.020 0.000 1.182 7264 Y CB -1.156 37.316 38.460 0.020 0.000 0.983 7264 Y HN 0.033 nan 8.280 nan 0.000 0.524 7265 A N 0.265 123.197 122.820 0.186 0.000 1.940 7265 A HA -0.168 4.152 4.320 -0.001 0.000 0.219 7265 A C 2.175 179.809 177.584 0.085 0.000 1.176 7265 A CA 1.670 53.775 52.037 0.114 0.000 0.631 7265 A CB -0.393 18.662 19.000 0.092 0.000 0.814 7265 A HN 0.318 nan 8.150 nan 0.000 0.446 7266 E N -0.545 119.706 120.200 0.084 0.000 2.106 7266 E HA -0.111 4.239 4.350 -0.001 0.000 0.192 7266 E C 2.147 178.780 176.600 0.055 0.000 0.984 7266 E CA 1.138 57.575 56.400 0.062 0.000 0.806 7266 E CB -0.609 29.125 29.700 0.058 0.000 0.750 7266 E HN 0.595 nan 8.360 nan 0.000 0.458 7267 G N 0.919 109.760 108.800 0.069 0.000 2.430 7267 G HA2 -0.133 3.827 3.960 -0.001 0.000 0.216 7267 G HA3 -0.133 3.827 3.960 -0.001 0.000 0.216 7267 G C 1.742 176.658 174.900 0.027 0.000 1.146 7267 G CA 0.162 45.288 45.100 0.043 0.000 0.793 7267 G HN 0.142 nan 8.290 nan 0.000 0.537 7268 I N -0.104 120.488 120.570 0.037 0.000 2.163 7268 I HA -0.025 4.144 4.170 -0.001 0.000 0.240 7268 I C 1.762 177.891 176.117 0.019 0.000 1.081 7268 I CA 0.832 62.146 61.300 0.023 0.000 1.353 7268 I CB -0.306 37.714 38.000 0.034 0.000 1.054 7268 I HN 0.308 nan 8.210 nan 0.000 0.407 7269 S N -1.138 114.578 115.700 0.028 0.000 3.633 7269 S HA -0.118 4.351 4.470 -0.001 0.000 0.637 7269 S C 0.447 175.058 174.600 0.017 0.000 2.289 7269 S CA 0.755 58.968 58.200 0.022 0.000 2.476 7269 S CB -1.419 61.791 63.200 0.016 0.000 0.330 7269 S HN 1.459 nan 8.310 nan 0.000 1.787 7270 G N 0.664 109.472 108.800 0.013 0.000 2.601 7270 G HA2 -0.286 3.673 3.960 -0.001 0.000 0.261 7270 G HA3 -0.286 3.673 3.960 -0.001 0.000 0.261 7270 G C 0.328 175.235 174.900 0.011 0.000 1.289 7270 G CA 0.966 46.071 45.100 0.008 0.000 0.920 7270 G HN 1.090 nan 8.290 nan 0.000 0.571 7271 R N 0.213 120.717 120.500 0.007 0.000 2.115 7271 R HA 0.026 4.365 4.340 -0.001 0.000 0.226 7271 R C 2.534 178.841 176.300 0.011 0.000 1.100 7271 R CA 1.370 57.476 56.100 0.010 0.000 0.980 7271 R CB -0.234 30.070 30.300 0.007 0.000 0.875 7271 R HN 0.716 nan 8.270 nan 0.000 0.445 7272 E N 0.952 121.156 120.200 0.007 0.000 2.171 7272 E HA -0.262 4.087 4.350 -0.001 0.000 0.197 7272 E C 2.058 178.676 176.600 0.030 0.000 0.997 7272 E CA 1.076 57.481 56.400 0.008 0.000 0.810 7272 E CB 0.100 29.801 29.700 0.001 0.000 0.738 7272 E HN 0.205 nan 8.360 nan 0.000 0.467 7273 Q N 0.596 120.417 119.800 0.035 0.000 2.226 7273 Q HA -0.164 4.175 4.340 -0.001 0.000 0.204 7273 Q C 2.144 178.182 176.000 0.063 0.000 0.975 7273 Q CA 0.925 56.758 55.803 0.051 0.000 0.866 7273 Q CB -0.068 28.696 28.738 0.043 0.000 0.915 7273 Q HN 0.431 nan 8.270 nan 0.000 0.440 7274 L N 0.050 121.305 121.223 0.053 0.000 2.027 7274 L HA -0.140 4.199 4.340 -0.001 0.000 0.206 7274 L C 2.606 179.534 176.870 0.096 0.000 1.074 7274 L CA 1.267 56.143 54.840 0.060 0.000 0.745 7274 L CB -0.657 41.426 42.059 0.039 0.000 0.898 7274 L HN 0.167 nan 8.230 nan 0.000 0.433 7275 A N -0.551 122.324 122.820 0.092 0.000 1.929 7275 A HA -0.093 4.227 4.320 -0.001 0.000 0.216 7275 A C 2.312 180.097 177.584 0.336 0.000 1.176 7275 A CA 1.281 53.417 52.037 0.166 0.000 0.628 7275 A CB -0.679 18.304 19.000 -0.029 0.000 0.816 7275 A HN 0.178 nan 8.150 nan 0.000 0.444 7276 V N 0.138 120.177 119.914 0.209 0.000 2.343 7276 V HA -0.229 3.890 4.120 -0.001 0.000 0.247 7276 V C 2.673 178.897 176.094 0.217 0.000 1.051 7276 V CA 2.328 64.748 62.300 0.200 0.000 1.036 7276 V CB -0.790 31.101 31.823 0.112 0.000 0.654 7276 V HN 0.623 nan 8.190 nan 0.000 0.451 7277 R N 1.129 121.725 120.500 0.160 0.000 2.081 7277 R HA -0.065 4.275 4.340 -0.001 0.000 0.235 7277 R C 2.159 178.533 176.300 0.124 0.000 1.131 7277 R CA 1.923 58.094 56.100 0.118 0.000 0.960 7277 R CB -0.993 29.356 30.300 0.081 0.000 0.856 7277 R HN 0.431 nan 8.270 nan 0.000 0.436 7278 A N -0.453 122.466 122.820 0.165 0.000 1.933 7278 A HA -0.120 4.199 4.320 -0.001 0.000 0.218 7278 A C 2.157 179.808 177.584 0.111 0.000 1.175 7278 A CA 1.334 53.462 52.037 0.151 0.000 0.628 7278 A CB -0.841 18.290 19.000 0.218 0.000 0.814 7278 A HN 0.486 nan 8.150 nan 0.000 0.444 7279 F N 0.982 120.943 119.950 0.018 0.000 2.075 7279 F HA -0.103 4.424 4.527 -0.001 0.000 0.297 7279 F C 2.536 178.258 175.800 -0.130 0.000 1.113 7279 F CA 1.517 59.400 58.000 -0.195 0.000 1.218 7279 F CB -0.398 38.517 39.000 -0.142 0.000 0.984 7279 F HN 0.245 nan 8.300 nan 0.000 0.472 7280 A N -0.171 122.721 122.820 0.121 0.000 1.902 7280 A HA -0.186 4.133 4.320 -0.001 0.000 0.217 7280 A C 1.889 179.420 177.584 -0.089 0.000 1.181 7280 A CA 1.965 54.010 52.037 0.014 0.000 0.623 7280 A CB -0.977 18.064 19.000 0.069 0.000 0.818 7280 A HN 0.457 nan 8.150 nan 0.000 0.443 7281 D N 0.021 120.386 120.400 -0.058 0.000 2.219 7281 D HA 0.024 4.664 4.640 -0.001 0.000 0.205 7281 D C 2.116 178.349 176.300 -0.113 0.000 0.970 7281 D CA 1.190 55.150 54.000 -0.067 0.000 0.851 7281 D CB -0.350 40.434 40.800 -0.027 0.000 0.943 7281 D HN 0.426 nan 8.370 nan 0.000 0.488 7282 A N 0.620 123.337 122.820 -0.172 0.000 2.024 7282 A HA -0.130 4.190 4.320 -0.001 0.000 0.220 7282 A C 2.244 179.696 177.584 -0.220 0.000 1.164 7282 A CA 0.767 52.675 52.037 -0.215 0.000 0.643 7282 A CB -0.714 18.086 19.000 -0.333 0.000 0.806 7282 A HN 0.245 nan 8.150 nan 0.000 0.451 7283 L N -0.359 120.718 121.223 -0.243 0.000 2.265 7283 L HA -0.140 4.200 4.340 -0.001 0.000 0.215 7283 L C 2.013 178.798 176.870 -0.142 0.000 1.117 7283 L CA 0.769 55.488 54.840 -0.202 0.000 0.782 7283 L CB -0.452 41.490 42.059 -0.195 0.000 0.914 7283 L HN 0.326 nan 8.230 nan 0.000 0.441 7284 E N -0.323 119.803 120.200 -0.123 0.000 2.409 7284 E HA -0.141 4.209 4.350 -0.001 0.000 0.198 7284 E C 2.180 178.729 176.600 -0.084 0.000 1.024 7284 E CA 0.605 56.948 56.400 -0.095 0.000 0.861 7284 E CB -0.189 29.463 29.700 -0.080 0.000 0.788 7284 E HN 0.305 nan 8.360 nan 0.000 0.521 7285 V N 0.863 120.721 119.914 -0.092 0.000 2.759 7285 V HA -0.187 3.933 4.120 -0.001 0.000 0.256 7285 V C 1.779 177.829 176.094 -0.073 0.000 1.080 7285 V CA 0.907 63.160 62.300 -0.079 0.000 1.101 7285 V CB -0.164 31.608 31.823 -0.084 0.000 0.698 7285 V HN 0.127 nan 8.190 nan 0.000 0.477 7286 I N 0.495 121.017 120.570 -0.080 0.000 2.296 7286 I HA 0.018 4.188 4.170 -0.001 0.000 0.242 7286 I C 0.128 176.207 176.117 -0.063 0.000 1.087 7286 I CA 1.182 62.440 61.300 -0.071 0.000 1.393 7286 I CB -2.734 35.222 38.000 -0.074 0.000 1.093 7286 I HN 0.307 nan 8.210 nan 0.000 0.421 7287 P HA -0.162 nan 4.420 nan 0.000 0.216 7287 P C 1.826 179.094 177.300 -0.053 0.000 1.150 7287 P CA 1.425 64.490 63.100 -0.058 0.000 0.843 7287 P CB -0.094 31.567 31.700 -0.065 0.000 0.787 7288 R N -0.626 119.841 120.500 -0.055 0.000 2.052 7288 R HA -0.013 4.326 4.340 -0.001 0.000 0.226 7288 R C 1.932 178.203 176.300 -0.048 0.000 1.145 7288 R CA 1.994 58.064 56.100 -0.049 0.000 0.952 7288 R CB -1.291 28.980 30.300 -0.049 0.000 0.847 7288 R HN 0.057 nan 8.270 nan 0.000 0.431 7289 T N 2.609 117.132 114.554 -0.051 0.000 2.833 7289 T HA -0.137 4.212 4.350 -0.001 0.000 0.269 7289 T C 1.724 176.392 174.700 -0.054 0.000 1.054 7289 T CA 1.139 63.209 62.100 -0.050 0.000 1.135 7289 T CB -0.219 68.618 68.868 -0.051 0.000 0.869 7289 T HN 0.113 nan 8.240 nan 0.000 0.466 7290 L N 1.607 122.796 121.223 -0.057 0.000 1.994 7290 L HA 0.076 4.415 4.340 -0.001 0.000 0.208 7290 L C 2.618 179.447 176.870 -0.068 0.000 1.071 7290 L CA 2.045 56.846 54.840 -0.065 0.000 0.745 7290 L CB -1.064 40.958 42.059 -0.061 0.000 0.892 7290 L HN 0.206 nan 8.230 nan 0.000 0.431 7291 A N -1.178 121.608 122.820 -0.057 0.000 2.019 7291 A HA -0.224 4.095 4.320 -0.001 0.000 0.219 7291 A C 2.210 179.764 177.584 -0.050 0.000 1.164 7291 A CA 1.649 53.654 52.037 -0.053 0.000 0.644 7291 A CB -0.632 18.343 19.000 -0.042 0.000 0.805 7291 A HN 0.574 nan 8.150 nan 0.000 0.449 7292 E N 0.581 120.753 120.200 -0.048 0.000 2.072 7292 E HA -0.144 4.205 4.350 -0.001 0.000 0.191 7292 E C 1.705 178.277 176.600 -0.047 0.000 0.985 7292 E CA 1.447 57.821 56.400 -0.043 0.000 0.801 7292 E CB -0.163 29.513 29.700 -0.041 0.000 0.750 7292 E HN 0.547 nan 8.360 nan 0.000 0.452 7293 N N -0.051 118.616 118.700 -0.055 0.000 2.309 7293 N HA -0.091 4.649 4.740 -0.001 0.000 0.182 7293 N C 1.273 176.740 175.510 -0.071 0.000 1.018 7293 N CA 1.141 54.155 53.050 -0.061 0.000 0.876 7293 N CB -0.253 38.194 38.487 -0.067 0.000 0.972 7293 N HN 0.246 nan 8.380 nan 0.000 0.434 7294 A N -0.077 122.696 122.820 -0.079 0.000 2.119 7294 A HA 0.315 4.634 4.320 -0.001 0.000 0.216 7294 A C 1.482 179.030 177.584 -0.060 0.000 1.152 7294 A CA 1.035 53.020 52.037 -0.086 0.000 0.708 7294 A CB -0.396 18.547 19.000 -0.096 0.000 0.805 7294 A HN 0.309 nan 8.150 nan 0.000 0.460 7295 G N -1.278 107.493 108.800 -0.048 0.000 2.149 7295 G HA2 -0.185 3.775 3.960 -0.001 0.000 0.235 7295 G HA3 -0.185 3.775 3.960 -0.001 0.000 0.235 7295 G C -0.033 174.849 174.900 -0.030 0.000 1.018 7295 G CA 0.340 45.419 45.100 -0.036 0.000 0.728 7295 G HN 0.443 nan 8.290 nan 0.000 0.508 7296 L N -0.211 120.992 121.223 -0.033 0.000 2.387 7296 L HA 0.504 4.843 4.340 -0.001 0.000 0.266 7296 L C 0.539 177.395 176.870 -0.024 0.000 1.059 7296 L CA -1.115 53.709 54.840 -0.027 0.000 0.801 7296 L CB 0.781 42.823 42.059 -0.029 0.000 1.223 7296 L HN 0.100 nan 8.230 nan 0.000 0.456 7297 D N 0.801 121.189 120.400 -0.019 0.000 2.363 7297 D HA 0.085 4.725 4.640 -0.001 0.000 0.263 7297 D C 0.747 177.034 176.300 -0.021 0.000 1.258 7297 D CA 0.171 54.160 54.000 -0.018 0.000 0.907 7297 D CB 1.743 42.535 40.800 -0.014 0.000 1.107 7297 D HN 0.629 nan 8.370 nan 0.000 0.495 7298 A N 5.316 128.122 122.820 -0.023 0.000 1.940 7298 A HA -0.192 4.128 4.320 -0.001 0.000 0.219 7298 A C 2.071 179.640 177.584 -0.024 0.000 1.176 7298 A CA 0.943 52.965 52.037 -0.026 0.000 0.631 7298 A CB -0.178 18.805 19.000 -0.027 0.000 0.814 7298 A HN 0.698 nan 8.150 nan 0.000 0.446 7299 I N -0.708 119.851 120.570 -0.020 0.000 2.296 7299 I HA -0.119 4.050 4.170 -0.001 0.000 0.242 7299 I C 2.436 178.544 176.117 -0.015 0.000 1.087 7299 I CA 1.584 62.874 61.300 -0.018 0.000 1.393 7299 I CB -1.525 36.467 38.000 -0.015 0.000 1.093 7299 I HN 0.563 nan 8.210 nan 0.000 0.421 7300 E N 1.256 121.448 120.200 -0.013 0.000 2.077 7300 E HA -0.207 4.142 4.350 -0.001 0.000 0.193 7300 E C 2.326 178.921 176.600 -0.010 0.000 0.989 7300 E CA 1.159 57.553 56.400 -0.010 0.000 0.800 7300 E CB 0.178 29.873 29.700 -0.008 0.000 0.746 7300 E HN 0.208 nan 8.360 nan 0.000 0.452 7301 I N 0.877 121.439 120.570 -0.013 0.000 2.127 7301 I HA -0.273 3.896 4.170 -0.001 0.000 0.241 7301 I C 2.416 178.524 176.117 -0.014 0.000 1.075 7301 I CA 1.014 62.306 61.300 -0.013 0.000 1.334 7301 I CB -0.983 37.006 38.000 -0.019 0.000 1.040 7301 I HN 0.275 nan 8.210 nan 0.000 0.405 7302 L N 0.009 121.220 121.223 -0.020 0.000 2.131 7302 L HA -0.149 4.190 4.340 -0.001 0.000 0.210 7302 L C 2.541 179.400 176.870 -0.019 0.000 1.092 7302 L CA 1.253 56.078 54.840 -0.025 0.000 0.759 7302 L CB -0.952 41.088 42.059 -0.031 0.000 0.903 7302 L HN 0.004 nan 8.230 nan 0.000 0.435 7303 V N -1.153 118.753 119.914 -0.013 0.000 2.323 7303 V HA -0.237 3.882 4.120 -0.001 0.000 0.244 7303 V C 2.487 178.582 176.094 0.001 0.000 1.041 7303 V CA 1.378 63.674 62.300 -0.006 0.000 1.025 7303 V CB -0.391 31.428 31.823 -0.005 0.000 0.656 7303 V HN 0.300 nan 8.190 nan 0.000 0.451 7304 K N -0.185 120.216 120.400 0.001 0.000 2.155 7304 K HA -0.030 4.290 4.320 -0.001 0.000 0.203 7304 K C 1.864 178.473 176.600 0.015 0.000 1.052 7304 K CA 0.853 57.145 56.287 0.007 0.000 0.948 7304 K CB -0.438 32.065 32.500 0.005 0.000 0.728 7304 K HN 0.313 nan 8.250 nan 0.000 0.448 7305 V N 0.505 120.427 119.914 0.012 0.000 2.346 7305 V HA -0.156 3.963 4.120 -0.001 0.000 0.244 7305 V C 2.064 178.184 176.094 0.043 0.000 1.037 7305 V CA 1.529 63.843 62.300 0.023 0.000 1.029 7305 V CB -0.296 31.528 31.823 0.002 0.000 0.663 7305 V HN 0.224 nan 8.190 nan 0.000 0.454 7306 R N 0.153 120.663 120.500 0.017 0.000 2.115 7306 R HA -0.055 4.284 4.340 -0.001 0.000 0.230 7306 R C 2.390 178.727 176.300 0.061 0.000 1.111 7306 R CA 1.324 57.439 56.100 0.024 0.000 0.976 7306 R CB -0.491 29.801 30.300 -0.012 0.000 0.870 7306 R HN 0.534 nan 8.270 nan 0.000 0.445 7307 A N 1.273 124.117 122.820 0.039 0.000 1.873 7307 A HA -0.064 4.255 4.320 -0.001 0.000 0.215 7307 A C 2.364 179.972 177.584 0.040 0.000 1.186 7307 A CA 1.553 53.610 52.037 0.034 0.000 0.616 7307 A CB -0.611 18.400 19.000 0.019 0.000 0.823 7307 A HN 0.365 nan 8.150 nan 0.000 0.442 7308 A N -1.070 121.777 122.820 0.045 0.000 1.933 7308 A HA -0.157 4.162 4.320 -0.001 0.000 0.218 7308 A C 2.006 179.616 177.584 0.044 0.000 1.175 7308 A CA 2.072 54.131 52.037 0.037 0.000 0.628 7308 A CB -0.856 18.166 19.000 0.036 0.000 0.814 7308 A HN 0.781 nan 8.150 nan 0.000 0.444 7309 H N -0.210 118.856 119.070 -0.007 0.000 2.326 7309 H HA 0.055 4.610 4.556 -0.001 0.000 0.301 7309 H C 2.216 177.539 175.328 -0.008 0.000 1.081 7309 H CA 1.968 58.011 56.048 -0.008 0.000 1.334 7309 H CB -0.198 29.557 29.762 -0.012 0.000 1.385 7309 H HN 0.388 nan 8.280 nan 0.000 0.504 7310 A N -0.638 122.244 122.820 0.104 0.000 1.908 7310 A HA -0.194 4.125 4.320 -0.001 0.000 0.218 7310 A C 2.568 180.141 177.584 -0.019 0.000 1.181 7310 A CA 2.059 54.128 52.037 0.053 0.000 0.627 7310 A CB -1.064 17.974 19.000 0.063 0.000 0.818 7310 A HN 0.515 nan 8.150 nan 0.000 0.445 7311 S N -0.639 115.049 115.700 -0.019 0.000 2.341 7311 S HA -0.081 4.388 4.470 -0.001 0.000 0.216 7311 S C 1.875 176.446 174.600 -0.048 0.000 1.034 7311 S CA 1.060 59.245 58.200 -0.025 0.000 0.964 7311 S CB -0.397 62.796 63.200 -0.011 0.000 0.882 7311 S HN 0.596 nan 8.310 nan 0.000 0.469 7312 N N 1.086 119.751 118.700 -0.058 0.000 2.354 7312 N HA 0.231 4.971 4.740 -0.001 0.000 0.179 7312 N C 1.063 176.508 175.510 -0.109 0.000 1.021 7312 N CA 1.018 54.029 53.050 -0.065 0.000 0.887 7312 N CB -0.129 38.331 38.487 -0.044 0.000 0.974 7312 N HN 0.623 nan 8.380 nan 0.000 0.437 7313 G N 0.669 109.346 108.800 -0.206 0.000 2.498 7313 G HA2 -0.231 3.729 3.960 -0.001 0.000 0.651 7313 G HA3 -0.231 3.729 3.960 -0.001 0.000 0.651 7313 G C 0.144 174.784 174.900 -0.433 0.000 1.284 7313 G CA 0.042 44.960 45.100 -0.304 0.000 0.950 7313 G HN 0.349 nan 8.290 nan 0.000 0.511 7314 N N -0.310 118.190 118.700 -0.335 0.000 2.446 7314 N HA 0.004 4.743 4.740 -0.001 0.000 0.179 7314 N C 1.592 177.098 175.510 -0.006 0.000 1.054 7314 N CA 1.609 54.599 53.050 -0.101 0.000 0.905 7314 N CB -0.076 38.455 38.487 0.073 0.000 0.973 7314 N HN 0.883 nan 8.380 nan 0.000 0.448 7315 K N -1.002 119.376 120.400 -0.037 0.000 2.374 7315 K HA 0.265 4.585 4.320 -0.001 0.000 0.196 7315 K C -0.321 176.272 176.600 -0.013 0.000 1.023 7315 K CA -0.015 56.265 56.287 -0.012 0.000 1.103 7315 K CB 0.079 32.570 32.500 -0.015 0.000 0.848 7315 K HN 0.118 nan 8.250 nan 0.000 0.528 7316 C N 1.524 120.808 119.300 -0.027 0.000 3.114 7316 C HA 0.689 5.148 4.460 -0.001 0.000 0.215 7316 C C 0.142 175.131 174.990 -0.001 0.000 1.759 7316 C CA -0.706 58.302 59.018 -0.017 0.000 1.455 7316 C CB -0.571 27.148 27.740 -0.035 0.000 2.528 7316 C HN 0.598 nan 8.230 nan 0.000 0.511 7317 A N 0.077 122.917 122.820 0.034 0.000 2.593 7317 A HA 1.004 5.324 4.320 -0.001 0.000 0.304 7317 A C -0.077 177.552 177.584 0.075 0.000 1.233 7317 A CA 0.222 52.307 52.037 0.079 0.000 0.661 7317 A CB 0.343 19.453 19.000 0.183 0.000 1.338 7317 A HN 1.915 nan 8.150 nan 0.000 0.495 7318 G N -2.105 106.741 108.800 0.077 0.000 2.699 7318 G HA2 0.414 4.374 3.960 -0.001 0.000 0.686 7318 G HA3 0.414 4.374 3.960 -0.001 0.000 0.686 7318 G C -0.983 173.939 174.900 0.038 0.000 1.301 7318 G CA -0.097 45.032 45.100 0.048 0.000 0.816 7318 G HN 2.064 nan 8.290 nan 0.000 0.595 7319 L N 0.539 121.777 121.223 0.026 0.000 2.289 7319 L HA 0.773 5.113 4.340 -0.001 0.000 0.285 7319 L C 0.182 177.075 176.870 0.039 0.000 1.049 7319 L CA -1.027 53.826 54.840 0.021 0.000 0.804 7319 L CB 1.601 43.659 42.059 -0.002 0.000 1.195 7319 L HN 0.721 nan 8.230 nan 0.000 0.428 7320 N N 2.997 121.729 118.700 0.054 0.000 2.527 7320 N HA 0.212 4.951 4.740 -0.001 0.000 0.236 7320 N C 0.766 176.315 175.510 0.064 0.000 0.999 7320 N CA -0.221 52.892 53.050 0.105 0.000 0.935 7320 N CB 1.054 39.615 38.487 0.124 0.000 1.132 7320 N HN 0.525 nan 8.380 nan 0.000 0.511 7321 V N 1.323 121.228 119.914 -0.015 0.000 2.970 7321 V HA 0.023 4.142 4.120 -0.001 0.000 0.260 7321 V C 1.345 177.340 176.094 -0.164 0.000 1.100 7321 V CA 1.121 63.341 62.300 -0.134 0.000 1.122 7321 V CB -1.155 30.517 31.823 -0.251 0.000 0.721 7321 V HN 0.398 nan 8.190 nan 0.000 0.483 7322 F N 2.703 122.650 119.950 -0.004 0.000 2.234 7322 F HA -0.021 4.506 4.527 -0.001 0.000 0.299 7322 F C 2.596 178.394 175.800 -0.003 0.000 1.087 7322 F CA 1.871 59.869 58.000 -0.003 0.000 1.340 7322 F CB -0.569 38.430 39.000 -0.002 0.000 1.031 7322 F HN 0.424 nan 8.300 nan 0.000 0.500 7323 T N -4.557 110.098 114.554 0.167 0.000 2.985 7323 T HA 0.415 4.764 4.350 -0.001 0.000 0.254 7323 T C 1.428 176.156 174.700 0.046 0.000 1.021 7323 T CA 0.370 62.523 62.100 0.089 0.000 0.957 7323 T CB 0.345 69.258 68.868 0.075 0.000 1.047 7323 T HN 0.344 nan 8.240 nan 0.000 0.511 7324 G N 1.170 109.989 108.800 0.032 0.000 2.291 7324 G HA2 0.289 4.248 3.960 -0.001 0.000 0.271 7324 G HA3 0.289 4.248 3.960 -0.001 0.000 0.271 7324 G C 0.025 174.931 174.900 0.010 0.000 1.099 7324 G CA -0.220 44.883 45.100 0.005 0.000 0.919 7324 G HN 1.401 nan 8.290 nan 0.000 0.496 7325 A N -1.348 121.484 122.820 0.019 0.000 2.604 7325 A HA 0.883 5.203 4.320 -0.001 0.000 0.295 7325 A C 0.027 177.625 177.584 0.023 0.000 1.067 7325 A CA 0.096 52.144 52.037 0.018 0.000 0.683 7325 A CB 1.673 20.686 19.000 0.021 0.000 1.281 7325 A HN 1.783 nan 8.150 nan 0.000 0.407 7326 V N 1.863 121.789 119.914 0.019 0.000 2.599 7326 V HA 0.428 4.548 4.120 -0.001 0.000 0.300 7326 V C -0.223 175.887 176.094 0.027 0.000 1.034 7326 V CA 0.861 63.175 62.300 0.023 0.000 1.115 7326 V CB 0.540 32.375 31.823 0.021 0.000 0.934 7326 V HN 0.873 nan 8.190 nan 0.000 0.485 7327 E N 3.678 123.897 120.200 0.033 0.000 2.458 7327 E HA 0.315 4.665 4.350 -0.001 0.000 0.278 7327 E C -1.425 175.194 176.600 0.031 0.000 1.004 7327 E CA -0.716 55.703 56.400 0.032 0.000 0.823 7327 E CB 1.473 31.196 29.700 0.039 0.000 1.396 7327 E HN 0.715 nan 8.360 nan 0.000 0.463 7328 D N 1.921 122.336 120.400 0.024 0.000 2.393 7328 D HA 0.099 4.738 4.640 -0.001 0.000 0.232 7328 D C 0.928 177.242 176.300 0.023 0.000 1.192 7328 D CA -0.153 53.859 54.000 0.020 0.000 0.882 7328 D CB 0.543 41.350 40.800 0.010 0.000 1.038 7328 D HN 0.214 nan 8.370 nan 0.000 0.499 7329 M N 2.192 121.811 119.600 0.031 0.000 2.159 7329 M HA -0.145 4.335 4.480 -0.001 0.000 0.263 7329 M C 2.347 178.660 176.300 0.023 0.000 1.063 7329 M CA 0.641 55.961 55.300 0.034 0.000 1.110 7329 M CB -1.181 31.444 32.600 0.042 0.000 1.374 7329 M HN 0.535 nan 8.290 nan 0.000 0.411 7330 C N 0.712 120.024 119.300 0.019 0.000 2.453 7330 C HA -0.165 4.295 4.460 -0.001 0.000 0.277 7330 C C 2.689 177.682 174.990 0.005 0.000 1.262 7330 C CA 1.360 60.385 59.018 0.012 0.000 1.718 7330 C CB -0.915 26.831 27.740 0.010 0.000 2.031 7330 C HN 0.638 nan 8.230 nan 0.000 0.480 7331 E N 0.158 120.361 120.200 0.004 0.000 2.118 7331 E HA -0.204 4.146 4.350 -0.001 0.000 0.195 7331 E C 1.392 177.989 176.600 -0.004 0.000 0.992 7331 E CA 1.352 57.752 56.400 -0.000 0.000 0.804 7331 E CB -0.209 29.491 29.700 0.000 0.000 0.741 7331 E HN 0.661 nan 8.360 nan 0.000 0.458 7332 N N -0.416 118.282 118.700 -0.002 0.000 2.461 7332 N HA -0.005 4.735 4.740 -0.001 0.000 0.188 7332 N C 0.769 176.268 175.510 -0.020 0.000 1.134 7332 N CA 0.935 53.978 53.050 -0.013 0.000 0.878 7332 N CB 0.906 39.389 38.487 -0.007 0.000 0.972 7332 N HN 0.343 nan 8.380 nan 0.000 0.456 7333 G N 0.460 109.254 108.800 -0.010 0.000 2.147 7333 G HA2 -0.259 3.700 3.960 -0.001 0.000 0.244 7333 G HA3 -0.259 3.700 3.960 -0.001 0.000 0.244 7333 G C -0.002 174.896 174.900 -0.004 0.000 1.005 7333 G CA 0.048 45.142 45.100 -0.010 0.000 0.713 7333 G HN 0.197 nan 8.290 nan 0.000 0.515 7334 V N 1.478 121.396 119.914 0.007 0.000 2.222 7334 V HA 0.503 4.623 4.120 -0.001 0.000 0.253 7334 V C 0.829 176.939 176.094 0.026 0.000 1.210 7334 V CA 0.158 62.472 62.300 0.024 0.000 1.079 7334 V CB 0.410 32.261 31.823 0.047 0.000 1.265 7334 V HN 1.047 nan 8.190 nan 0.000 0.494 7335 V N 1.927 121.853 119.914 0.020 0.000 3.130 7335 V HA 0.939 5.058 4.120 -0.001 0.000 0.310 7335 V C -0.760 175.345 176.094 0.018 0.000 1.158 7335 V CA -0.909 61.402 62.300 0.019 0.000 1.029 7335 V CB 2.437 34.268 31.823 0.014 0.000 1.057 7335 V HN 0.777 nan 8.190 nan 0.000 0.436 7336 E N 0.954 121.164 120.200 0.017 0.000 2.390 7336 E HA 0.658 5.007 4.350 -0.001 0.000 0.277 7336 E C -3.278 173.330 176.600 0.013 0.000 0.939 7336 E CA -2.369 54.040 56.400 0.015 0.000 0.769 7336 E CB 2.337 32.047 29.700 0.015 0.000 1.251 7336 E HN 0.453 nan 8.360 nan 0.000 0.450 7337 P HA -0.046 nan 4.420 nan 0.000 0.266 7337 P C 0.518 177.826 177.300 0.013 0.000 1.195 7337 P CA -0.340 62.767 63.100 0.012 0.000 0.768 7337 P CB 0.507 32.213 31.700 0.010 0.000 0.838 7338 L N 4.470 125.702 121.223 0.014 0.000 2.012 7338 L HA -0.174 4.166 4.340 -0.001 0.000 0.210 7338 L C 2.417 179.297 176.870 0.016 0.000 1.073 7338 L CA 1.865 56.715 54.840 0.016 0.000 0.748 7338 L CB -0.835 41.234 42.059 0.017 0.000 0.891 7338 L HN 0.311 nan 8.230 nan 0.000 0.431 7339 R N -0.967 119.541 120.500 0.014 0.000 2.133 7339 R HA -0.187 4.153 4.340 -0.001 0.000 0.247 7339 R C 2.030 178.337 176.300 0.012 0.000 1.151 7339 R CA 2.134 58.242 56.100 0.013 0.000 0.971 7339 R CB -0.406 29.901 30.300 0.012 0.000 0.866 7339 R HN 0.395 nan 8.270 nan 0.000 0.447 7340 V N 1.043 120.963 119.914 0.011 0.000 2.295 7340 V HA -0.237 3.882 4.120 -0.001 0.000 0.246 7340 V C 2.333 178.431 176.094 0.007 0.000 1.049 7340 V CA 2.084 64.389 62.300 0.008 0.000 1.024 7340 V CB -0.483 31.345 31.823 0.008 0.000 0.648 7340 V HN 0.283 nan 8.190 nan 0.000 0.447 7341 K N 0.789 121.195 120.400 0.009 0.000 2.103 7341 K HA -0.123 4.197 4.320 -0.001 0.000 0.204 7341 K C 2.224 178.832 176.600 0.014 0.000 1.052 7341 K CA 1.930 58.222 56.287 0.008 0.000 0.945 7341 K CB -0.668 31.839 32.500 0.011 0.000 0.722 7341 K HN 0.678 nan 8.250 nan 0.000 0.443 7342 T N -2.129 112.437 114.554 0.019 0.000 2.942 7342 T HA -0.072 4.278 4.350 -0.001 0.000 0.265 7342 T C 1.875 176.590 174.700 0.026 0.000 1.062 7342 T CA 0.816 62.932 62.100 0.027 0.000 1.139 7342 T CB -0.153 68.732 68.868 0.027 0.000 0.883 7342 T HN 0.104 nan 8.240 nan 0.000 0.468 7343 Q N 1.902 121.713 119.800 0.019 0.000 2.123 7343 Q HA 0.258 4.598 4.340 -0.001 0.000 0.199 7343 Q C 2.417 178.426 176.000 0.015 0.000 0.966 7343 Q CA 1.726 57.539 55.803 0.017 0.000 0.845 7343 Q CB -0.995 27.750 28.738 0.013 0.000 0.907 7343 Q HN 0.626 nan 8.270 nan 0.000 0.439 7344 A N 0.577 123.403 122.820 0.009 0.000 1.908 7344 A HA -0.170 4.149 4.320 -0.001 0.000 0.218 7344 A C 1.946 179.532 177.584 0.003 0.000 1.181 7344 A CA 1.645 53.682 52.037 -0.001 0.000 0.627 7344 A CB -0.720 18.272 19.000 -0.012 0.000 0.818 7344 A HN 0.453 nan 8.150 nan 0.000 0.445 7345 I N -0.471 120.110 120.570 0.019 0.000 2.202 7345 I HA -0.206 3.963 4.170 -0.001 0.000 0.242 7345 I C 2.646 178.806 176.117 0.072 0.000 1.091 7345 I CA 1.937 63.268 61.300 0.051 0.000 1.368 7345 I CB -1.435 36.614 38.000 0.082 0.000 1.058 7345 I HN 0.471 nan 8.210 nan 0.000 0.410 7346 Q N 1.263 121.096 119.800 0.055 0.000 2.030 7346 Q HA -0.161 4.178 4.340 -0.001 0.000 0.204 7346 Q C 2.412 178.441 176.000 0.048 0.000 0.986 7346 Q CA 2.595 58.429 55.803 0.052 0.000 0.843 7346 Q CB -0.301 28.459 28.738 0.037 0.000 0.904 7346 Q HN 0.345 nan 8.270 nan 0.000 0.420 7347 S N 0.012 115.732 115.700 0.034 0.000 2.368 7347 S HA -0.097 4.373 4.470 -0.001 0.000 0.225 7347 S C 1.901 176.520 174.600 0.031 0.000 1.030 7347 S CA 0.971 59.188 58.200 0.028 0.000 0.999 7347 S CB -0.631 62.580 63.200 0.017 0.000 0.844 7347 S HN 0.596 nan 8.310 nan 0.000 0.459 7348 A N 1.570 124.405 122.820 0.025 0.000 1.877 7348 A HA 0.126 4.446 4.320 -0.001 0.000 0.216 7348 A C 2.353 179.969 177.584 0.053 0.000 1.186 7348 A CA 1.711 53.757 52.037 0.016 0.000 0.620 7348 A CB -1.110 17.875 19.000 -0.025 0.000 0.822 7348 A HN 0.508 nan 8.150 nan 0.000 0.443 7349 A N 0.737 123.615 122.820 0.097 0.000 1.898 7349 A HA -0.172 4.147 4.320 -0.001 0.000 0.216 7349 A C 1.996 179.660 177.584 0.133 0.000 1.181 7349 A CA 1.741 53.879 52.037 0.168 0.000 0.620 7349 A CB -0.641 18.483 19.000 0.206 0.000 0.819 7349 A HN 0.786 nan 8.150 nan 0.000 0.442 7350 E N 0.286 120.541 120.200 0.091 0.000 2.208 7350 E HA -0.117 4.232 4.350 -0.001 0.000 0.193 7350 E C 1.820 178.459 176.600 0.065 0.000 0.988 7350 E CA 1.397 57.840 56.400 0.072 0.000 0.828 7350 E CB -0.345 29.386 29.700 0.052 0.000 0.763 7350 E HN 0.634 nan 8.360 nan 0.000 0.478 7351 S N 0.286 116.023 115.700 0.061 0.000 2.446 7351 S HA -0.037 4.432 4.470 -0.001 0.000 0.225 7351 S C 2.005 176.642 174.600 0.063 0.000 1.016 7351 S CA 0.947 59.177 58.200 0.050 0.000 0.943 7351 S CB -0.275 62.946 63.200 0.035 0.000 0.786 7351 S HN 0.205 nan 8.310 nan 0.000 0.508 7352 T N 2.293 116.900 114.554 0.089 0.000 2.737 7352 T HA -0.043 4.307 4.350 -0.001 0.000 0.265 7352 T C 1.737 176.519 174.700 0.136 0.000 1.038 7352 T CA 1.570 63.747 62.100 0.128 0.000 1.144 7352 T CB -0.384 68.602 68.868 0.196 0.000 0.866 7352 T HN 0.660 nan 8.240 nan 0.000 0.434 7353 E N 0.718 121.001 120.200 0.137 0.000 2.110 7353 E HA -0.139 4.211 4.350 -0.001 0.000 0.193 7353 E C 2.231 178.869 176.600 0.063 0.000 0.988 7353 E CA 0.852 57.311 56.400 0.099 0.000 0.804 7353 E CB -0.210 29.545 29.700 0.092 0.000 0.745 7353 E HN 0.451 nan 8.360 nan 0.000 0.458 7354 M N 0.686 120.321 119.600 0.059 0.000 2.073 7354 M HA -0.234 4.245 4.480 -0.001 0.000 0.258 7354 M C 2.359 178.683 176.300 0.040 0.000 1.070 7354 M CA 1.600 56.926 55.300 0.044 0.000 1.103 7354 M CB -0.202 32.422 32.600 0.041 0.000 1.321 7354 M HN 0.338 nan 8.290 nan 0.000 0.405 7355 L N 0.528 121.778 121.223 0.045 0.000 2.012 7355 L HA -0.241 4.098 4.340 -0.001 0.000 0.210 7355 L C 2.249 179.138 176.870 0.031 0.000 1.073 7355 L CA 1.453 56.316 54.840 0.038 0.000 0.748 7355 L CB -0.324 41.758 42.059 0.038 0.000 0.891 7355 L HN 0.419 nan 8.230 nan 0.000 0.431 7356 L N -0.684 120.560 121.223 0.034 0.000 2.131 7356 L HA -0.213 4.127 4.340 -0.001 0.000 0.210 7356 L C 2.685 179.561 176.870 0.011 0.000 1.092 7356 L CA 1.133 55.982 54.840 0.015 0.000 0.759 7356 L CB -0.470 41.597 42.059 0.013 0.000 0.903 7356 L HN 0.246 nan 8.230 nan 0.000 0.435 7357 R N -0.201 120.312 120.500 0.022 0.000 2.189 7357 R HA 0.061 4.400 4.340 -0.001 0.000 0.218 7357 R C 0.435 176.747 176.300 0.019 0.000 1.074 7357 R CA 0.527 56.640 56.100 0.021 0.000 0.991 7357 R CB -0.072 30.242 30.300 0.025 0.000 0.883 7357 R HN 0.279 nan 8.270 nan 0.000 0.457 7358 I N 0.837 121.419 120.570 0.020 0.000 2.331 7358 I HA 0.040 4.209 4.170 -0.001 0.000 0.292 7358 I C 0.265 176.392 176.117 0.017 0.000 0.998 7358 I CA 0.024 61.336 61.300 0.021 0.000 1.267 7358 I CB 1.518 39.535 38.000 0.028 0.000 1.386 7358 I HN -0.117 nan 8.210 nan 0.000 0.476 7359 D N 3.378 123.787 120.400 0.016 0.000 2.539 7359 D HA 0.110 4.750 4.640 -0.001 0.000 0.232 7359 D C -0.798 175.513 176.300 0.019 0.000 1.256 7359 D CA 0.238 54.245 54.000 0.011 0.000 0.810 7359 D CB 0.513 41.314 40.800 0.002 0.000 1.090 7359 D HN 0.432 nan 8.370 nan 0.000 0.519 7360 D N 0.037 120.451 120.400 0.023 0.000 2.861 7360 D HA 0.199 4.839 4.640 -0.001 0.000 0.216 7360 D C -1.362 174.953 176.300 0.024 0.000 1.323 7360 D CA -0.403 53.611 54.000 0.024 0.000 0.917 7360 D CB 1.903 42.714 40.800 0.018 0.000 1.582 7360 D HN -0.263 nan 8.370 nan 0.000 0.576 7361 V N 5.179 125.110 119.914 0.028 0.000 2.347 7361 V HA 0.477 4.597 4.120 -0.001 0.000 0.280 7361 V C 0.410 176.510 176.094 0.010 0.000 1.021 7361 V CA -0.551 61.761 62.300 0.021 0.000 0.847 7361 V CB 1.275 33.115 31.823 0.028 0.000 0.990 7361 V HN 0.477 nan 8.190 nan 0.000 0.444 7362 I N 4.914 125.485 120.570 0.003 0.000 2.371 7362 I HA 0.646 4.815 4.170 -0.001 0.000 0.282 7362 I C 0.397 176.508 176.117 -0.009 0.000 1.031 7362 I CA -0.210 61.090 61.300 -0.001 0.000 1.180 7362 I CB 1.294 39.294 38.000 0.001 0.000 1.336 7362 I HN 0.657 nan 8.210 nan 0.000 0.467 7363 A N 4.868 127.679 122.820 -0.015 0.000 2.337 7363 A HA 0.890 5.209 4.320 -0.001 0.000 0.329 7363 A C 0.106 177.680 177.584 -0.017 0.000 1.146 7363 A CA -0.499 51.524 52.037 -0.023 0.000 0.800 7363 A CB 1.204 20.181 19.000 -0.039 0.000 1.220 7363 A HN 0.718 nan 8.150 nan 0.000 0.472 7364 A N 1.765 124.575 122.820 -0.016 0.000 2.313 7364 A HA 0.548 4.867 4.320 -0.001 0.000 0.261 7364 A C 0.413 177.989 177.584 -0.014 0.000 1.090 7364 A CA -0.271 51.759 52.037 -0.013 0.000 0.807 7364 A CB -0.175 18.819 19.000 -0.010 0.000 1.055 7364 A HN 0.893 nan 8.150 nan 0.000 0.492 7365 E N 0.000 120.193 120.200 -0.011 0.000 2.725 7365 E HA 0.000 4.350 4.350 -0.001 0.000 0.291 7365 E CA 0.000 56.394 56.400 -0.011 0.000 0.976 7365 E CB 0.000 29.695 29.700 -0.008 0.000 0.812 7365 E HN 0.000 nan 8.360 nan 0.000 0.440