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_M DATA FIRST_RESID 5893 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 5893 V HA 0.000 nan 4.120 nan 0.000 0.244 5893 V C 0.000 176.088 176.094 -0.010 0.000 1.182 5893 V CA 0.000 62.293 62.300 -0.011 0.000 1.235 5893 V CB 0.000 31.816 31.823 -0.012 0.000 1.184 5894 L N 1.835 123.050 121.223 -0.012 0.000 2.352 5894 L HA 0.607 4.947 4.340 -0.001 0.000 0.269 5894 L C -2.290 174.575 176.870 -0.009 0.000 1.034 5894 L CA -1.672 53.161 54.840 -0.010 0.000 0.806 5894 L CB 0.684 42.736 42.059 -0.012 0.000 1.244 5894 L HN 0.139 nan 8.230 nan 0.000 0.447 5895 P HA 0.011 nan 4.420 nan 0.000 0.265 5895 P C -0.657 176.641 177.300 -0.004 0.000 1.193 5895 P CA -0.259 62.839 63.100 -0.003 0.000 0.765 5895 P CB 0.394 32.094 31.700 -0.001 0.000 0.823 5896 E N 2.894 123.091 120.200 -0.004 0.000 2.480 5896 E HA -0.051 4.298 4.350 -0.001 0.000 0.258 5896 E C 0.689 177.288 176.600 -0.001 0.000 0.984 5896 E CA 0.952 57.349 56.400 -0.005 0.000 0.930 5896 E CB -0.321 29.376 29.700 -0.005 0.000 0.936 5896 E HN 0.533 nan 8.360 nan 0.000 0.466 5897 N N 2.104 120.804 118.700 -0.000 0.000 2.879 5897 N HA -0.188 4.552 4.740 -0.001 0.000 0.156 5897 N C -0.658 174.860 175.510 0.014 0.000 1.554 5897 N CA 0.888 53.943 53.050 0.007 0.000 2.252 5897 N CB -1.205 37.288 38.487 0.010 0.000 1.232 5897 N HN 0.542 nan 8.380 nan 0.000 0.861 5898 M N 1.662 121.268 119.600 0.009 0.000 2.249 5898 M HA 0.319 4.798 4.480 -0.001 0.000 0.351 5898 M C -0.763 175.539 176.300 0.004 0.000 1.180 5898 M CA -0.095 55.215 55.300 0.017 0.000 1.127 5898 M CB 0.596 33.202 32.600 0.010 0.000 1.546 5898 M HN -0.046 nan 8.290 nan 0.000 0.461 5899 K N 4.160 124.574 120.400 0.024 0.000 2.267 5899 K HA 0.613 4.933 4.320 -0.001 0.000 0.246 5899 K C -1.004 175.571 176.600 -0.040 0.000 0.954 5899 K CA -0.758 55.505 56.287 -0.039 0.000 0.824 5899 K CB 1.850 34.340 32.500 -0.017 0.000 1.167 5899 K HN 0.674 nan 8.250 nan 0.000 0.431 5900 R N 1.573 121.949 120.500 -0.206 0.000 2.686 5900 R HA 0.446 4.786 4.340 -0.001 0.000 0.286 5900 R C -0.906 175.167 176.300 -0.379 0.000 0.969 5900 R CA -0.753 55.266 56.100 -0.135 0.000 0.898 5900 R CB 1.274 31.534 30.300 -0.067 0.000 1.183 5900 R HN 0.558 nan 8.270 nan 0.000 0.456 5901 Y N 2.424 122.739 120.300 0.026 0.000 2.536 5901 Y HA 0.578 5.128 4.550 -0.000 0.000 0.347 5901 Y C 0.583 176.496 175.900 0.022 0.000 1.000 5901 Y CA -0.982 57.134 58.100 0.026 0.000 1.051 5901 Y CB 1.974 40.458 38.460 0.040 0.000 1.259 5901 Y HN 0.361 nan 8.280 nan 0.000 0.468 5902 M N 0.817 120.513 119.600 0.159 0.000 2.520 5902 M HA 0.784 5.263 4.480 -0.001 0.000 0.280 5902 M C 0.026 176.370 176.300 0.073 0.000 1.232 5902 M CA -0.240 55.113 55.300 0.089 0.000 0.892 5902 M CB 1.276 33.902 32.600 0.044 0.000 1.728 5902 M HN 0.892 nan 8.290 nan 0.000 0.475 5903 G N 2.728 111.559 108.800 0.050 0.000 2.561 5903 G HA2 -0.287 3.673 3.960 -0.001 0.000 0.289 5903 G HA3 -0.287 3.673 3.960 -0.001 0.000 0.289 5903 G C 0.672 175.590 174.900 0.031 0.000 1.169 5903 G CA 0.528 45.648 45.100 0.032 0.000 0.980 5903 G HN 0.842 nan 8.290 nan 0.000 0.550 5904 R N 1.082 121.596 120.500 0.023 0.000 2.152 5904 R HA -0.022 4.318 4.340 -0.001 0.000 0.232 5904 R C 2.102 178.421 176.300 0.032 0.000 1.117 5904 R CA 1.783 57.892 56.100 0.015 0.000 0.981 5904 R CB -0.794 29.511 30.300 0.007 0.000 0.870 5904 R HN 0.610 nan 8.270 nan 0.000 0.451 5905 D N 0.495 120.938 120.400 0.071 0.000 2.224 5905 D HA -0.032 4.608 4.640 -0.001 0.000 0.205 5905 D C 1.692 178.057 176.300 0.109 0.000 0.965 5905 D CA 1.157 55.232 54.000 0.125 0.000 0.852 5905 D CB -0.035 40.910 40.800 0.240 0.000 0.947 5905 D HN 0.168 nan 8.370 nan 0.000 0.494 5906 A N 0.656 123.540 122.820 0.108 0.000 1.929 5906 A HA -0.160 4.159 4.320 -0.001 0.000 0.216 5906 A C 2.092 179.694 177.584 0.030 0.000 1.176 5906 A CA 0.991 53.085 52.037 0.094 0.000 0.628 5906 A CB -0.205 18.850 19.000 0.092 0.000 0.816 5906 A HN 0.036 nan 8.150 nan 0.000 0.444 5907 Q N -0.445 119.362 119.800 0.012 0.000 2.016 5907 Q HA -0.173 4.167 4.340 -0.001 0.000 0.200 5907 Q C 2.252 178.227 176.000 -0.041 0.000 0.978 5907 Q CA 1.892 57.688 55.803 -0.012 0.000 0.833 5907 Q CB -0.469 28.260 28.738 -0.015 0.000 0.895 5907 Q HN 0.631 nan 8.270 nan 0.000 0.427 5908 R N 0.916 121.385 120.500 -0.051 0.000 2.075 5908 R HA -0.031 4.308 4.340 -0.001 0.000 0.232 5908 R C 2.183 178.387 176.300 -0.161 0.000 1.126 5908 R CA 1.521 57.570 56.100 -0.085 0.000 0.963 5908 R CB -0.617 29.644 30.300 -0.065 0.000 0.858 5908 R HN 0.306 nan 8.270 nan 0.000 0.435 5909 M N 0.296 119.760 119.600 -0.227 0.000 2.082 5909 M HA -0.231 4.249 4.480 -0.001 0.000 0.258 5909 M C 1.018 177.150 176.300 -0.280 0.000 1.069 5909 M CA 2.103 57.188 55.300 -0.359 0.000 1.102 5909 M CB -0.264 32.099 32.600 -0.396 0.000 1.336 5909 M HN 0.178 nan 8.290 nan 0.000 0.404 5910 N N 0.755 119.355 118.700 -0.165 0.000 2.188 5910 N HA -0.101 4.639 4.740 -0.001 0.000 0.184 5910 N C 1.655 177.072 175.510 -0.155 0.000 1.018 5910 N CA 1.363 54.318 53.050 -0.159 0.000 0.858 5910 N CB -0.428 38.040 38.487 -0.032 0.000 0.989 5910 N HN 0.395 nan 8.380 nan 0.000 0.426 5911 I N 0.549 121.050 120.570 -0.115 0.000 2.315 5911 I HA -0.142 4.028 4.170 -0.001 0.000 0.248 5911 I C 1.849 177.898 176.117 -0.114 0.000 1.117 5911 I CA 0.684 61.931 61.300 -0.089 0.000 1.404 5911 I CB -0.830 37.134 38.000 -0.061 0.000 1.071 5911 I HN 0.053 nan 8.210 nan 0.000 0.419 5912 L N 0.998 122.131 121.223 -0.151 0.000 2.093 5912 L HA -0.054 4.285 4.340 -0.001 0.000 0.208 5912 L C 2.722 179.489 176.870 -0.173 0.000 1.085 5912 L CA 1.811 56.560 54.840 -0.153 0.000 0.755 5912 L CB -1.339 40.614 42.059 -0.178 0.000 0.904 5912 L HN 0.168 nan 8.230 nan 0.000 0.435 5913 A N -0.549 122.114 122.820 -0.261 0.000 1.902 5913 A HA -0.112 4.207 4.320 -0.001 0.000 0.217 5913 A C 2.405 179.887 177.584 -0.170 0.000 1.181 5913 A CA 1.701 53.561 52.037 -0.294 0.000 0.623 5913 A CB -1.280 17.354 19.000 -0.610 0.000 0.818 5913 A HN 0.432 nan 8.150 nan 0.000 0.443 5914 G N -0.718 107.997 108.800 -0.141 0.000 2.422 5914 G HA2 -0.202 3.758 3.960 -0.001 0.000 0.218 5914 G HA3 -0.202 3.758 3.960 -0.001 0.000 0.218 5914 G C 1.672 176.530 174.900 -0.069 0.000 1.140 5914 G CA 1.139 46.189 45.100 -0.083 0.000 0.775 5914 G HN 0.520 nan 8.290 nan 0.000 0.545 5915 R N 0.635 121.089 120.500 -0.078 0.000 2.092 5915 R HA 0.109 4.448 4.340 -0.001 0.000 0.231 5915 R C 2.400 178.665 176.300 -0.058 0.000 1.119 5915 R CA 0.985 57.047 56.100 -0.064 0.000 0.970 5915 R CB -0.648 29.614 30.300 -0.065 0.000 0.864 5915 R HN 0.427 nan 8.270 nan 0.000 0.440 5916 I N 0.099 120.630 120.570 -0.066 0.000 2.127 5916 I HA -0.292 3.877 4.170 -0.001 0.000 0.241 5916 I C 1.774 177.867 176.117 -0.041 0.000 1.075 5916 I CA 1.061 62.330 61.300 -0.052 0.000 1.334 5916 I CB -0.282 37.684 38.000 -0.056 0.000 1.040 5916 I HN 0.140 nan 8.210 nan 0.000 0.405 5917 I N 0.900 121.445 120.570 -0.042 0.000 2.233 5917 I HA -0.202 3.967 4.170 -0.001 0.000 0.243 5917 I C 2.873 178.971 176.117 -0.032 0.000 1.093 5917 I CA 1.598 62.879 61.300 -0.031 0.000 1.380 5917 I CB -1.614 36.370 38.000 -0.027 0.000 1.067 5917 I HN 0.167 nan 8.210 nan 0.000 0.413 5918 A N 0.442 123.239 122.820 -0.038 0.000 1.940 5918 A HA -0.257 4.062 4.320 -0.001 0.000 0.219 5918 A C 2.282 179.843 177.584 -0.038 0.000 1.176 5918 A CA 2.096 54.110 52.037 -0.038 0.000 0.631 5918 A CB -0.573 18.401 19.000 -0.043 0.000 0.814 5918 A HN 0.407 nan 8.150 nan 0.000 0.446 5919 E N -0.493 119.684 120.200 -0.038 0.000 2.107 5919 E HA -0.081 4.269 4.350 -0.001 0.000 0.191 5919 E C 2.014 178.595 176.600 -0.031 0.000 0.982 5919 E CA 1.780 58.159 56.400 -0.035 0.000 0.809 5919 E CB -0.513 29.166 29.700 -0.035 0.000 0.756 5919 E HN 0.505 nan 8.360 nan 0.000 0.459 5920 T N 0.113 114.650 114.554 -0.029 0.000 2.746 5920 T HA -0.139 4.210 4.350 -0.001 0.000 0.267 5920 T C 1.880 176.565 174.700 -0.025 0.000 1.039 5920 T CA 1.790 63.875 62.100 -0.025 0.000 1.142 5920 T CB -0.321 68.534 68.868 -0.022 0.000 0.866 5920 T HN 0.267 nan 8.240 nan 0.000 0.444 5921 V N 1.865 121.764 119.914 -0.026 0.000 2.649 5921 V HA 0.014 4.133 4.120 -0.001 0.000 0.248 5921 V C 2.347 178.424 176.094 -0.030 0.000 1.054 5921 V CA 1.309 63.593 62.300 -0.026 0.000 1.073 5921 V CB -0.890 30.918 31.823 -0.025 0.000 0.699 5921 V HN 0.479 nan 8.190 nan 0.000 0.463 5922 R N 2.697 123.177 120.500 -0.033 0.000 2.241 5922 R HA -0.063 4.277 4.340 -0.001 0.000 0.224 5922 R C 2.015 178.293 176.300 -0.037 0.000 1.101 5922 R CA 1.595 57.672 56.100 -0.038 0.000 0.995 5922 R CB -0.986 29.290 30.300 -0.041 0.000 0.870 5922 R HN 0.690 nan 8.270 nan 0.000 0.463 5923 S N 0.030 115.710 115.700 -0.033 0.000 2.522 5923 S HA -0.073 4.396 4.470 -0.001 0.000 0.227 5923 S C 1.691 176.271 174.600 -0.033 0.000 0.986 5923 S CA 0.684 58.864 58.200 -0.033 0.000 0.929 5923 S CB 0.079 63.261 63.200 -0.029 0.000 0.769 5923 S HN 0.551 nan 8.310 nan 0.000 0.529 5924 T N -0.946 113.589 114.554 -0.031 0.000 3.069 5924 T HA 0.353 4.703 4.350 -0.001 0.000 0.252 5924 T C 0.323 175.003 174.700 -0.033 0.000 1.053 5924 T CA -0.522 61.561 62.100 -0.029 0.000 0.964 5924 T CB -0.436 68.419 68.868 -0.023 0.000 1.005 5924 T HN 0.258 nan 8.240 nan 0.000 0.532 5925 L N 2.928 124.128 121.223 -0.038 0.000 2.462 5925 L HA 0.519 4.858 4.340 -0.001 0.000 0.272 5925 L C 0.703 177.541 176.870 -0.052 0.000 1.166 5925 L CA 1.608 56.423 54.840 -0.041 0.000 0.880 5925 L CB -0.749 41.283 42.059 -0.044 0.000 1.142 5925 L HN 0.697 nan 8.230 nan 0.000 0.473 5926 G N 4.398 113.169 108.800 -0.048 0.000 2.663 5926 G HA2 -0.132 3.828 3.960 -0.001 0.000 0.686 5926 G HA3 -0.132 3.828 3.960 -0.001 0.000 0.686 5926 G C -2.065 172.789 174.900 -0.075 0.000 1.288 5926 G CA -0.340 44.719 45.100 -0.068 0.000 0.836 5926 G HN 0.552 nan 8.290 nan 0.000 0.584 5927 P HA 0.003 nan 4.420 nan 0.000 0.222 5927 P C 1.122 178.329 177.300 -0.155 0.000 1.147 5927 P CA 1.231 64.269 63.100 -0.103 0.000 0.790 5927 P CB 0.112 31.725 31.700 -0.145 0.000 0.780 5928 K N -0.208 120.063 120.400 -0.214 0.000 2.372 5928 K HA 0.272 4.592 4.320 -0.001 0.000 0.200 5928 K C 1.170 177.711 176.600 -0.100 0.000 1.022 5928 K CA -0.141 56.046 56.287 -0.167 0.000 1.125 5928 K CB -0.111 32.262 32.500 -0.212 0.000 0.855 5928 K HN 0.067 nan 8.250 nan 0.000 0.524 5929 G N 0.226 108.977 108.800 -0.082 0.000 2.616 5929 G HA2 0.246 4.205 3.960 -0.001 0.000 0.268 5929 G HA3 0.246 4.205 3.960 -0.001 0.000 0.268 5929 G C 0.017 174.893 174.900 -0.041 0.000 1.213 5929 G CA -0.514 44.552 45.100 -0.057 0.000 0.926 5929 G HN -0.069 nan 8.290 nan 0.000 0.523 5930 M N -0.043 119.537 119.600 -0.034 0.000 2.531 5930 M HA 0.401 4.880 4.480 -0.001 0.000 0.262 5930 M C -0.230 176.058 176.300 -0.021 0.000 1.168 5930 M CA -0.677 54.607 55.300 -0.026 0.000 0.926 5930 M CB 1.114 33.700 32.600 -0.025 0.000 1.445 5930 M HN 0.726 nan 8.290 nan 0.000 0.531 5931 D N -0.590 119.799 120.400 -0.018 0.000 2.493 5931 D HA 0.562 5.202 4.640 -0.001 0.000 0.239 5931 D C -1.301 174.989 176.300 -0.017 0.000 1.049 5931 D CA -0.762 53.228 54.000 -0.016 0.000 1.008 5931 D CB 1.271 42.063 40.800 -0.013 0.000 1.398 5931 D HN 0.116 nan 8.370 nan 0.000 0.513 5932 K N 0.344 120.735 120.400 -0.016 0.000 2.259 5932 K HA 0.396 4.716 4.320 -0.001 0.000 0.252 5932 K C -0.949 175.640 176.600 -0.017 0.000 0.936 5932 K CA -0.719 55.558 56.287 -0.016 0.000 0.810 5932 K CB 1.970 34.461 32.500 -0.014 0.000 1.143 5932 K HN 0.677 nan 8.250 nan 0.000 0.427 5933 M N 4.060 123.649 119.600 -0.019 0.000 2.047 5933 M HA 0.253 4.732 4.480 -0.001 0.000 0.342 5933 M C -1.492 174.797 176.300 -0.017 0.000 1.058 5933 M CA -0.972 54.315 55.300 -0.022 0.000 0.991 5933 M CB 0.365 32.950 32.600 -0.026 0.000 1.474 5933 M HN 0.347 nan 8.290 nan 0.000 0.419 5934 L N 6.055 127.268 121.223 -0.015 0.000 2.272 5934 L HA 0.521 4.861 4.340 -0.001 0.000 0.289 5934 L C -0.797 176.067 176.870 -0.011 0.000 1.032 5934 L CA -0.252 54.581 54.840 -0.011 0.000 0.810 5934 L CB 1.668 43.722 42.059 -0.008 0.000 1.205 5934 L HN 0.414 nan 8.230 nan 0.000 0.422 5935 V N 2.814 122.722 119.914 -0.009 0.000 2.407 5935 V HA 0.370 4.489 4.120 -0.001 0.000 0.291 5935 V C -0.351 175.740 176.094 -0.004 0.000 1.018 5935 V CA -0.941 61.354 62.300 -0.009 0.000 0.842 5935 V CB 1.528 33.344 31.823 -0.010 0.000 0.996 5935 V HN 0.806 nan 8.190 nan 0.000 0.426 5936 D N 2.245 122.643 120.400 -0.002 0.000 2.478 5936 D HA 0.094 4.733 4.640 -0.001 0.000 0.269 5936 D C 0.887 177.187 176.300 0.000 0.000 1.232 5936 D CA -0.495 53.505 54.000 -0.000 0.000 1.059 5936 D CB 0.705 41.505 40.800 0.001 0.000 1.104 5936 D HN 0.400 nan 8.370 nan 0.000 0.566 5937 D N -1.740 118.661 120.400 0.001 0.000 2.264 5937 D HA -0.088 4.552 4.640 -0.001 0.000 0.208 5937 D C 1.450 177.751 176.300 0.002 0.000 0.966 5937 D CA 0.623 54.624 54.000 0.002 0.000 0.864 5937 D CB 0.002 40.803 40.800 0.002 0.000 0.933 5937 D HN 0.185 nan 8.370 nan 0.000 0.499 5938 L N -1.008 120.216 121.223 0.003 0.000 2.558 5938 L HA 0.351 4.691 4.340 -0.001 0.000 0.225 5938 L C 1.951 178.824 176.870 0.004 0.000 1.128 5938 L CA 0.909 55.751 54.840 0.004 0.000 0.868 5938 L CB 0.148 42.210 42.059 0.004 0.000 1.006 5938 L HN 0.255 nan 8.230 nan 0.000 0.454 5939 G N -1.322 107.480 108.800 0.003 0.000 2.179 5939 G HA2 -0.254 3.706 3.960 -0.001 0.000 0.220 5939 G HA3 -0.254 3.706 3.960 -0.001 0.000 0.220 5939 G C 0.243 175.144 174.900 0.002 0.000 0.990 5939 G CA 0.100 45.201 45.100 0.002 0.000 0.646 5939 G HN 0.322 nan 8.290 nan 0.000 0.517 5940 D N 1.166 121.568 120.400 0.003 0.000 2.382 5940 D HA 0.394 5.033 4.640 -0.001 0.000 0.259 5940 D C 0.415 176.713 176.300 -0.003 0.000 1.224 5940 D CA 0.162 54.165 54.000 0.005 0.000 0.894 5940 D CB 1.098 41.903 40.800 0.008 0.000 1.127 5940 D HN 0.195 nan 8.370 nan 0.000 0.487 5941 V N 4.991 124.900 119.914 -0.009 0.000 2.347 5941 V HA 0.280 4.400 4.120 -0.001 0.000 0.280 5941 V C 0.128 176.205 176.094 -0.029 0.000 1.021 5941 V CA -0.795 61.490 62.300 -0.025 0.000 0.847 5941 V CB 1.581 33.379 31.823 -0.043 0.000 0.990 5941 V HN 0.333 nan 8.190 nan 0.000 0.444 5942 V N 6.043 125.943 119.914 -0.022 0.000 2.378 5942 V HA 0.449 4.569 4.120 -0.001 0.000 0.288 5942 V C -0.222 175.858 176.094 -0.022 0.000 1.016 5942 V CA -0.561 61.730 62.300 -0.016 0.000 0.840 5942 V CB 1.943 33.764 31.823 -0.004 0.000 0.994 5942 V HN 0.589 nan 8.190 nan 0.000 0.431 5943 V N 4.447 124.344 119.914 -0.029 0.000 2.357 5943 V HA 0.769 4.888 4.120 -0.001 0.000 0.284 5943 V C 0.104 176.189 176.094 -0.014 0.000 1.018 5943 V CA 0.019 62.303 62.300 -0.028 0.000 0.841 5943 V CB 1.587 33.384 31.823 -0.044 0.000 0.991 5943 V HN 0.976 nan 8.190 nan 0.000 0.437 5944 T N 2.642 117.189 114.554 -0.011 0.000 2.739 5944 T HA 0.305 4.655 4.350 -0.001 0.000 0.303 5944 T C 0.129 174.825 174.700 -0.006 0.000 1.389 5944 T CA -0.360 61.737 62.100 -0.005 0.000 1.001 5944 T CB 2.058 70.925 68.868 -0.001 0.000 1.436 5944 T HN 0.602 nan 8.240 nan 0.000 0.500 5945 N N 0.327 119.025 118.700 -0.004 0.000 2.210 5945 N HA 0.085 4.825 4.740 -0.001 0.000 0.203 5945 N C -0.779 174.728 175.510 -0.006 0.000 1.175 5945 N CA -0.019 53.027 53.050 -0.006 0.000 0.894 5945 N CB 0.444 38.929 38.487 -0.004 0.000 1.041 5945 N HN 0.552 nan 8.380 nan 0.000 0.506 5946 D N 0.359 120.757 120.400 -0.003 0.000 2.450 5946 D HA 0.093 4.733 4.640 -0.001 0.000 0.247 5946 D C 1.282 177.579 176.300 -0.004 0.000 1.162 5946 D CA 0.175 54.173 54.000 -0.002 0.000 0.879 5946 D CB 1.275 42.076 40.800 0.001 0.000 1.163 5946 D HN 0.290 nan 8.370 nan 0.000 0.472 5947 G N 1.659 110.456 108.800 -0.006 0.000 2.414 5947 G HA2 -0.206 3.753 3.960 -0.001 0.000 0.215 5947 G HA3 -0.206 3.753 3.960 -0.001 0.000 0.215 5947 G C 1.496 176.393 174.900 -0.005 0.000 1.188 5947 G CA 0.304 45.399 45.100 -0.008 0.000 0.783 5947 G HN 0.452 nan 8.290 nan 0.000 0.537 5948 V N 0.824 120.737 119.914 -0.003 0.000 2.515 5948 V HA -0.102 4.018 4.120 -0.001 0.000 0.250 5948 V C 2.970 179.064 176.094 0.000 0.000 1.058 5948 V CA 2.740 65.040 62.300 -0.001 0.000 1.064 5948 V CB -0.562 31.261 31.823 0.001 0.000 0.675 5948 V HN 0.401 nan 8.190 nan 0.000 0.461 5949 T N 0.565 115.119 114.554 0.000 0.000 2.777 5949 T HA -0.076 4.274 4.350 -0.001 0.000 0.266 5949 T C 1.752 176.452 174.700 -0.000 0.000 1.040 5949 T CA 1.969 64.070 62.100 0.001 0.000 1.141 5949 T CB -0.257 68.612 68.868 0.001 0.000 0.868 5949 T HN 0.461 nan 8.240 nan 0.000 0.444 5950 I N 0.627 121.196 120.570 -0.002 0.000 2.208 5950 I HA -0.146 4.024 4.170 -0.001 0.000 0.245 5950 I C 1.982 178.098 176.117 -0.002 0.000 1.097 5950 I CA 0.943 62.241 61.300 -0.003 0.000 1.363 5950 I CB -0.265 37.731 38.000 -0.006 0.000 1.051 5950 I HN 0.162 nan 8.210 nan 0.000 0.413 5951 L N 0.172 121.394 121.223 -0.001 0.000 2.217 5951 L HA -0.079 4.260 4.340 -0.001 0.000 0.211 5951 L C 2.459 179.331 176.870 0.004 0.000 1.107 5951 L CA 1.561 56.402 54.840 0.001 0.000 0.783 5951 L CB -0.751 41.308 42.059 0.001 0.000 0.919 5951 L HN 0.104 nan 8.230 nan 0.000 0.442 5952 R N -1.071 119.431 120.500 0.003 0.000 2.100 5952 R HA -0.035 4.305 4.340 -0.001 0.000 0.220 5952 R C 1.963 178.266 176.300 0.004 0.000 1.091 5952 R CA 0.661 56.764 56.100 0.004 0.000 0.986 5952 R CB 0.002 30.304 30.300 0.004 0.000 0.888 5952 R HN 0.273 nan 8.270 nan 0.000 0.444 5953 E N 0.985 121.186 120.200 0.003 0.000 2.086 5953 E HA -0.059 4.291 4.350 -0.001 0.000 0.190 5953 E C 1.283 177.884 176.600 0.002 0.000 0.975 5953 E CA 0.561 56.962 56.400 0.002 0.000 0.813 5953 E CB -0.105 29.596 29.700 0.001 0.000 0.768 5953 E HN 0.333 nan 8.360 nan 0.000 0.457 5954 M N -0.210 119.391 119.600 0.002 0.000 2.184 5954 M HA 0.099 4.579 4.480 -0.001 0.000 0.296 5954 M C 0.518 176.821 176.300 0.005 0.000 1.165 5954 M CA 0.359 55.660 55.300 0.002 0.000 1.175 5954 M CB 0.481 33.081 32.600 0.001 0.000 1.392 5954 M HN -0.239 nan 8.290 nan 0.000 0.457 5955 S N 1.537 117.241 115.700 0.007 0.000 2.466 5955 S HA 0.490 4.960 4.470 -0.001 0.000 0.313 5955 S C -0.894 173.716 174.600 0.015 0.000 1.078 5955 S CA -0.805 57.401 58.200 0.010 0.000 1.115 5955 S CB -0.016 63.189 63.200 0.010 0.000 1.006 5955 S HN 0.508 nan 8.310 nan 0.000 0.487 5956 V N 5.734 125.659 119.914 0.018 0.000 2.439 5956 V HA 0.425 4.545 4.120 -0.001 0.000 0.282 5956 V C 0.611 176.726 176.094 0.035 0.000 1.039 5956 V CA -0.405 61.912 62.300 0.028 0.000 0.913 5956 V CB 1.621 33.461 31.823 0.027 0.000 0.983 5956 V HN 0.793 nan 8.190 nan 0.000 0.460 5957 E N 1.148 121.379 120.200 0.052 0.000 2.228 5957 E HA 0.091 4.441 4.350 -0.001 0.000 0.197 5957 E C 0.723 177.357 176.600 0.058 0.000 0.909 5957 E CA 0.112 56.540 56.400 0.046 0.000 0.911 5957 E CB -0.005 29.722 29.700 0.044 0.000 0.887 5957 E HN 0.693 nan 8.360 nan 0.000 0.481 5958 H N 2.734 121.808 119.070 0.006 0.000 2.803 5958 H HA 0.043 4.598 4.556 -0.001 0.000 0.330 5958 H C -1.713 173.618 175.328 0.005 0.000 1.057 5958 H CA -1.409 54.643 56.048 0.007 0.000 1.458 5958 H CB 1.528 31.290 29.762 -0.001 0.000 1.470 5958 H HN -0.206 nan 8.280 nan 0.000 0.560 5959 P HA -0.147 nan 4.420 nan 0.000 0.216 5959 P C 1.075 178.484 177.300 0.183 0.000 1.150 5959 P CA 2.023 65.158 63.100 0.057 0.000 0.843 5959 P CB 0.118 31.793 31.700 -0.043 0.000 0.787 5960 A N 0.013 123.096 122.820 0.439 0.000 1.877 5960 A HA -0.090 4.229 4.320 -0.001 0.000 0.216 5960 A C 2.329 179.963 177.584 0.083 0.000 1.186 5960 A CA 2.076 54.232 52.037 0.198 0.000 0.620 5960 A CB -1.566 17.460 19.000 0.043 0.000 0.822 5960 A HN 0.201 nan 8.150 nan 0.000 0.443 5961 A N -0.364 122.506 122.820 0.084 0.000 1.969 5961 A HA -0.103 4.217 4.320 -0.001 0.000 0.218 5961 A C 2.078 179.688 177.584 0.043 0.000 1.169 5961 A CA 1.657 53.715 52.037 0.034 0.000 0.635 5961 A CB -0.359 18.657 19.000 0.027 0.000 0.810 5961 A HN 0.542 nan 8.150 nan 0.000 0.445 5962 K N -0.957 119.482 120.400 0.065 0.000 2.097 5962 K HA -0.034 4.285 4.320 -0.001 0.000 0.205 5962 K C 1.856 178.477 176.600 0.035 0.000 1.050 5962 K CA 1.294 57.606 56.287 0.043 0.000 0.938 5962 K CB -0.191 32.334 32.500 0.041 0.000 0.718 5962 K HN 0.347 nan 8.250 nan 0.000 0.442 5963 M N 0.623 120.247 119.600 0.041 0.000 2.288 5963 M HA -0.052 4.428 4.480 -0.001 0.000 0.266 5963 M C 2.169 178.483 176.300 0.024 0.000 1.072 5963 M CA 1.035 56.354 55.300 0.032 0.000 1.132 5963 M CB -0.669 31.953 32.600 0.037 0.000 1.386 5963 M HN 0.200 nan 8.290 nan 0.000 0.432 5964 L N 0.370 121.606 121.223 0.021 0.000 2.046 5964 L HA -0.217 4.123 4.340 -0.001 0.000 0.208 5964 L C 2.224 179.100 176.870 0.009 0.000 1.077 5964 L CA 1.226 56.072 54.840 0.010 0.000 0.747 5964 L CB -0.175 41.885 42.059 0.001 0.000 0.896 5964 L HN 0.156 nan 8.230 nan 0.000 0.432 5965 I N -0.333 120.244 120.570 0.012 0.000 2.208 5965 I HA -0.284 3.885 4.170 -0.001 0.000 0.245 5965 I C 2.468 178.591 176.117 0.010 0.000 1.097 5965 I CA 1.054 62.360 61.300 0.010 0.000 1.363 5965 I CB -0.403 37.604 38.000 0.012 0.000 1.051 5965 I HN 0.311 nan 8.210 nan 0.000 0.413 5966 E N 0.466 120.674 120.200 0.013 0.000 2.118 5966 E HA -0.165 4.185 4.350 -0.001 0.000 0.195 5966 E C 2.419 179.026 176.600 0.011 0.000 0.992 5966 E CA 1.161 57.568 56.400 0.012 0.000 0.804 5966 E CB -0.259 29.450 29.700 0.015 0.000 0.741 5966 E HN 0.367 nan 8.360 nan 0.000 0.458 5967 V N 1.468 121.389 119.914 0.011 0.000 2.358 5967 V HA -0.219 3.901 4.120 -0.001 0.000 0.246 5967 V C 2.462 178.559 176.094 0.006 0.000 1.047 5967 V CA 1.714 64.020 62.300 0.010 0.000 1.035 5967 V CB -0.807 31.021 31.823 0.009 0.000 0.658 5967 V HN 0.239 nan 8.190 nan 0.000 0.452 5968 A N -0.317 122.505 122.820 0.004 0.000 1.933 5968 A HA -0.224 4.096 4.320 -0.001 0.000 0.218 5968 A C 2.283 179.869 177.584 0.003 0.000 1.175 5968 A CA 1.824 53.862 52.037 0.001 0.000 0.628 5968 A CB -0.401 18.599 19.000 -0.000 0.000 0.814 5968 A HN 0.543 nan 8.150 nan 0.000 0.444 5969 K N -0.930 119.473 120.400 0.005 0.000 2.155 5969 K HA -0.062 4.258 4.320 -0.001 0.000 0.203 5969 K C 1.970 178.574 176.600 0.006 0.000 1.052 5969 K CA 1.514 57.804 56.287 0.005 0.000 0.948 5969 K CB -0.279 32.224 32.500 0.006 0.000 0.728 5969 K HN 0.461 nan 8.250 nan 0.000 0.448 5970 T N 1.190 115.749 114.554 0.007 0.000 2.777 5970 T HA -0.182 4.168 4.350 -0.001 0.000 0.266 5970 T C 1.830 176.534 174.700 0.007 0.000 1.040 5970 T CA 1.361 63.465 62.100 0.008 0.000 1.141 5970 T CB -0.128 68.746 68.868 0.010 0.000 0.868 5970 T HN 0.179 nan 8.240 nan 0.000 0.444 5971 Q N 1.393 121.197 119.800 0.005 0.000 2.096 5971 Q HA -0.127 4.212 4.340 -0.001 0.000 0.204 5971 Q C 2.099 178.101 176.000 0.004 0.000 0.982 5971 Q CA 1.920 57.725 55.803 0.004 0.000 0.850 5971 Q CB -0.264 28.475 28.738 0.001 0.000 0.901 5971 Q HN 0.680 nan 8.270 nan 0.000 0.422 5972 E N -0.742 119.460 120.200 0.003 0.000 2.072 5972 E HA -0.183 4.166 4.350 -0.001 0.000 0.191 5972 E C 1.590 178.192 176.600 0.004 0.000 0.985 5972 E CA 0.970 57.372 56.400 0.003 0.000 0.801 5972 E CB 0.063 29.765 29.700 0.003 0.000 0.750 5972 E HN 0.139 nan 8.360 nan 0.000 0.452 5973 K N 0.374 120.777 120.400 0.004 0.000 2.147 5973 K HA -0.115 4.204 4.320 -0.001 0.000 0.205 5973 K C 1.940 178.543 176.600 0.005 0.000 1.049 5973 K CA 0.999 57.289 56.287 0.005 0.000 0.936 5973 K CB 0.027 32.530 32.500 0.005 0.000 0.722 5973 K HN 0.239 nan 8.250 nan 0.000 0.446 5974 E N -0.010 120.193 120.200 0.006 0.000 2.045 5974 E HA -0.022 4.328 4.350 -0.001 0.000 0.190 5974 E C 2.228 178.831 176.600 0.006 0.000 0.968 5974 E CA 0.759 57.163 56.400 0.006 0.000 0.813 5974 E CB -0.047 29.657 29.700 0.008 0.000 0.780 5974 E HN -0.025 nan 8.360 nan 0.000 0.455 5975 V N -0.790 119.128 119.914 0.006 0.000 2.788 5975 V HA 0.207 4.327 4.120 -0.001 0.000 0.241 5975 V C 1.678 177.775 176.094 0.005 0.000 1.083 5975 V CA 1.159 63.462 62.300 0.006 0.000 1.103 5975 V CB 0.279 32.106 31.823 0.005 0.000 0.800 5975 V HN 0.508 nan 8.190 nan 0.000 0.476 5976 G N 0.297 109.099 108.800 0.004 0.000 4.677 5976 G HA2 -0.277 3.683 3.960 -0.001 0.000 0.215 5976 G HA3 -0.277 3.683 3.960 -0.001 0.000 0.215 5976 G C 0.168 175.071 174.900 0.004 0.000 1.506 5976 G CA 0.327 45.429 45.100 0.004 0.000 1.016 5976 G HN 0.481 nan 8.290 nan 0.000 0.653 5977 D N 1.669 122.072 120.400 0.005 0.000 2.377 5977 D HA 0.486 5.125 4.640 -0.001 0.000 0.245 5977 D C 1.483 177.784 176.300 0.003 0.000 1.196 5977 D CA 1.590 55.593 54.000 0.005 0.000 0.962 5977 D CB 0.389 41.194 40.800 0.008 0.000 1.127 5977 D HN 1.800 nan 8.370 nan 0.000 0.471 5978 G N 0.231 109.031 108.800 0.001 0.000 2.147 5978 G HA2 -0.303 3.657 3.960 -0.001 0.000 0.244 5978 G HA3 -0.303 3.657 3.960 -0.001 0.000 0.244 5978 G C 1.020 175.915 174.900 -0.007 0.000 1.005 5978 G CA 1.327 46.425 45.100 -0.004 0.000 0.713 5978 G HN 0.658 nan 8.290 nan 0.000 0.515 5979 T N -3.390 111.160 114.554 -0.006 0.000 2.833 5979 T HA -0.084 4.266 4.350 -0.001 0.000 0.269 5979 T C 2.202 176.895 174.700 -0.012 0.000 1.054 5979 T CA 2.462 64.557 62.100 -0.007 0.000 1.135 5979 T CB -0.367 68.499 68.868 -0.005 0.000 0.869 5979 T HN 0.308 nan 8.240 nan 0.000 0.466 5980 T N 1.883 116.428 114.554 -0.015 0.000 2.732 5980 T HA -0.044 4.305 4.350 -0.001 0.000 0.261 5980 T C 2.294 176.978 174.700 -0.027 0.000 1.040 5980 T CA 1.695 63.782 62.100 -0.021 0.000 1.145 5980 T CB -0.923 67.932 68.868 -0.022 0.000 0.866 5980 T HN 0.472 nan 8.240 nan 0.000 0.427 5981 T N 2.332 116.870 114.554 -0.026 0.000 2.665 5981 T HA -0.129 4.221 4.350 -0.001 0.000 0.268 5981 T C 2.364 177.041 174.700 -0.038 0.000 1.035 5981 T CA 1.358 63.438 62.100 -0.034 0.000 1.151 5981 T CB -0.646 68.204 68.868 -0.029 0.000 0.862 5981 T HN 0.424 nan 8.240 nan 0.000 0.438 5982 A N 0.788 123.591 122.820 -0.030 0.000 1.908 5982 A HA -0.082 4.238 4.320 -0.001 0.000 0.218 5982 A C 2.597 180.160 177.584 -0.034 0.000 1.181 5982 A CA 1.626 53.645 52.037 -0.029 0.000 0.627 5982 A CB -0.977 18.013 19.000 -0.017 0.000 0.818 5982 A HN 0.384 nan 8.150 nan 0.000 0.445 5983 V N -0.606 119.290 119.914 -0.030 0.000 2.453 5983 V HA -0.175 3.945 4.120 -0.001 0.000 0.247 5983 V C 2.545 178.613 176.094 -0.043 0.000 1.048 5983 V CA 1.709 63.990 62.300 -0.031 0.000 1.049 5983 V CB -0.589 31.219 31.823 -0.026 0.000 0.672 5983 V HN 0.365 nan 8.190 nan 0.000 0.457 5984 V N -0.196 119.690 119.914 -0.047 0.000 2.343 5984 V HA -0.214 3.906 4.120 -0.001 0.000 0.247 5984 V C 2.438 178.488 176.094 -0.074 0.000 1.051 5984 V CA 1.876 64.143 62.300 -0.056 0.000 1.036 5984 V CB -0.414 31.376 31.823 -0.055 0.000 0.654 5984 V HN 0.400 nan 8.190 nan 0.000 0.451 5985 V N 0.360 120.225 119.914 -0.083 0.000 2.295 5985 V HA -0.258 3.862 4.120 -0.001 0.000 0.246 5985 V C 2.704 178.721 176.094 -0.128 0.000 1.049 5985 V CA 2.106 64.335 62.300 -0.118 0.000 1.024 5985 V CB -1.124 30.627 31.823 -0.121 0.000 0.648 5985 V HN 0.562 nan 8.190 nan 0.000 0.447 5986 A N 0.325 123.092 122.820 -0.089 0.000 1.972 5986 A HA -0.049 4.271 4.320 -0.001 0.000 0.219 5986 A C 2.375 179.924 177.584 -0.058 0.000 1.169 5986 A CA 1.795 53.791 52.037 -0.068 0.000 0.635 5986 A CB -1.066 17.913 19.000 -0.035 0.000 0.810 5986 A HN 0.534 nan 8.150 nan 0.000 0.446 5987 G N -0.374 108.391 108.800 -0.059 0.000 2.404 5987 G HA2 -0.223 3.737 3.960 -0.001 0.000 0.215 5987 G HA3 -0.223 3.737 3.960 -0.001 0.000 0.215 5987 G C 1.483 176.350 174.900 -0.054 0.000 1.174 5987 G CA 1.275 46.344 45.100 -0.051 0.000 0.780 5987 G HN 0.544 nan 8.290 nan 0.000 0.537 5988 E N -0.001 120.155 120.200 -0.074 0.000 2.152 5988 E HA -0.033 4.317 4.350 -0.001 0.000 0.192 5988 E C 2.284 178.833 176.600 -0.086 0.000 0.983 5988 E CA 0.370 56.723 56.400 -0.078 0.000 0.818 5988 E CB -0.407 29.234 29.700 -0.098 0.000 0.758 5988 E HN 0.257 nan 8.360 nan 0.000 0.467 5989 L N 0.113 121.260 121.223 -0.126 0.000 2.083 5989 L HA -0.069 4.271 4.340 -0.001 0.000 0.209 5989 L C 2.026 178.893 176.870 -0.004 0.000 1.083 5989 L CA 1.587 56.328 54.840 -0.165 0.000 0.752 5989 L CB -0.412 41.499 42.059 -0.246 0.000 0.899 5989 L HN 0.256 nan 8.230 nan 0.000 0.433 5990 L N -1.167 120.064 121.223 0.013 0.000 2.093 5990 L HA -0.147 4.193 4.340 -0.001 0.000 0.208 5990 L C 2.732 179.627 176.870 0.042 0.000 1.085 5990 L CA 0.978 55.850 54.840 0.054 0.000 0.755 5990 L CB -0.445 41.623 42.059 0.017 0.000 0.904 5990 L HN 0.216 nan 8.230 nan 0.000 0.435 5991 R N -0.121 120.384 120.500 0.009 0.000 2.081 5991 R HA -0.120 4.220 4.340 -0.001 0.000 0.235 5991 R C 2.284 178.602 176.300 0.028 0.000 1.131 5991 R CA 0.924 57.027 56.100 0.004 0.000 0.960 5991 R CB -0.143 30.146 30.300 -0.017 0.000 0.856 5991 R HN 0.217 nan 8.270 nan 0.000 0.436 5992 K N 0.375 120.803 120.400 0.046 0.000 2.148 5992 K HA -0.027 4.292 4.320 -0.001 0.000 0.204 5992 K C 2.024 178.722 176.600 0.163 0.000 1.050 5992 K CA 1.195 57.536 56.287 0.090 0.000 0.942 5992 K CB -0.159 32.390 32.500 0.080 0.000 0.724 5992 K HN 0.142 nan 8.250 nan 0.000 0.446 5993 A N 1.604 124.555 122.820 0.219 0.000 1.898 5993 A HA -0.167 4.153 4.320 -0.001 0.000 0.216 5993 A C 2.137 179.757 177.584 0.059 0.000 1.181 5993 A CA 1.367 53.511 52.037 0.178 0.000 0.620 5993 A CB -0.288 18.851 19.000 0.231 0.000 0.819 5993 A HN 0.247 nan 8.150 nan 0.000 0.442 5994 E N 0.267 120.494 120.200 0.046 0.000 2.150 5994 E HA -0.182 4.168 4.350 -0.001 0.000 0.193 5994 E C 1.775 178.381 176.600 0.010 0.000 0.985 5994 E CA 1.281 57.688 56.400 0.012 0.000 0.814 5994 E CB -0.150 29.551 29.700 0.001 0.000 0.752 5994 E HN 0.762 nan 8.360 nan 0.000 0.466 5995 E N 0.207 120.421 120.200 0.023 0.000 2.106 5995 E HA -0.118 4.232 4.350 -0.001 0.000 0.192 5995 E C 2.345 178.956 176.600 0.019 0.000 0.984 5995 E CA 0.681 57.093 56.400 0.019 0.000 0.806 5995 E CB -0.006 29.709 29.700 0.026 0.000 0.750 5995 E HN 0.252 nan 8.360 nan 0.000 0.458 5996 L N 0.308 121.547 121.223 0.027 0.000 2.046 5996 L HA -0.198 4.142 4.340 -0.001 0.000 0.208 5996 L C 2.225 179.089 176.870 -0.009 0.000 1.077 5996 L CA 0.508 55.355 54.840 0.013 0.000 0.747 5996 L CB -0.238 41.825 42.059 0.006 0.000 0.896 5996 L HN 0.168 nan 8.230 nan 0.000 0.432 5997 L N -0.180 121.032 121.223 -0.019 0.000 2.093 5997 L HA -0.224 4.116 4.340 -0.001 0.000 0.208 5997 L C 2.105 178.961 176.870 -0.023 0.000 1.085 5997 L CA 1.719 56.539 54.840 -0.035 0.000 0.755 5997 L CB -0.787 41.248 42.059 -0.041 0.000 0.904 5997 L HN 0.247 nan 8.230 nan 0.000 0.435 5998 D N -1.280 119.113 120.400 -0.011 0.000 2.144 5998 D HA -0.171 4.469 4.640 -0.001 0.000 0.200 5998 D C 1.791 178.090 176.300 -0.002 0.000 0.978 5998 D CA 0.773 54.770 54.000 -0.006 0.000 0.833 5998 D CB 0.162 40.961 40.800 -0.002 0.000 0.961 5998 D HN 0.224 nan 8.370 nan 0.000 0.470 5999 Q N 0.083 119.884 119.800 0.001 0.000 2.466 5999 Q HA 0.010 4.349 4.340 -0.001 0.000 0.210 5999 Q C 0.207 176.210 176.000 0.004 0.000 0.961 5999 Q CA 0.191 55.997 55.803 0.005 0.000 0.953 5999 Q CB -0.078 28.666 28.738 0.011 0.000 1.011 5999 Q HN 0.319 nan 8.270 nan 0.000 0.516 6000 N N -0.616 118.084 118.700 -0.002 0.000 2.776 6000 N HA -0.154 4.586 4.740 -0.001 0.000 0.249 6000 N C -1.323 174.192 175.510 0.008 0.000 1.111 6000 N CA 0.300 53.350 53.050 0.000 0.000 0.711 6000 N CB -1.150 37.342 38.487 0.008 0.000 1.065 6000 N HN -0.025 nan 8.380 nan 0.000 0.556 6001 V N 1.927 121.841 119.914 -0.001 0.000 2.385 6001 V HA 0.126 4.245 4.120 -0.001 0.000 0.269 6001 V C 0.935 177.029 176.094 0.000 0.000 1.043 6001 V CA -0.729 61.576 62.300 0.009 0.000 0.906 6001 V CB 1.016 32.836 31.823 -0.005 0.000 0.995 6001 V HN 0.327 nan 8.190 nan 0.000 0.467 6002 H N 8.340 127.390 119.070 -0.032 0.000 3.034 6002 H HA 0.040 4.596 4.556 -0.001 0.000 0.324 6002 H C -1.684 173.612 175.328 -0.052 0.000 1.015 6002 H CA -1.221 54.807 56.048 -0.034 0.000 1.429 6002 H CB 1.644 31.389 29.762 -0.028 0.000 1.429 6002 H HN 0.380 nan 8.280 nan 0.000 0.585 6003 P HA -0.178 nan 4.420 nan 0.000 0.217 6003 P C 1.523 178.853 177.300 0.050 0.000 1.148 6003 P CA 1.798 64.835 63.100 -0.106 0.000 0.834 6003 P CB 0.069 31.665 31.700 -0.174 0.000 0.783 6004 T N -1.743 113.003 114.554 0.321 0.000 2.915 6004 T HA -0.078 4.271 4.350 -0.001 0.000 0.269 6004 T C 1.572 176.296 174.700 0.040 0.000 1.071 6004 T CA 0.757 62.947 62.100 0.152 0.000 1.132 6004 T CB -0.515 68.403 68.868 0.084 0.000 0.878 6004 T HN -0.149 nan 8.240 nan 0.000 0.479 6005 I N 0.721 121.320 120.570 0.049 0.000 2.333 6005 I HA -0.014 4.155 4.170 -0.001 0.000 0.246 6005 I C 2.539 178.594 176.117 -0.105 0.000 1.106 6005 I CA 0.814 62.103 61.300 -0.019 0.000 1.411 6005 I CB -1.315 36.687 38.000 0.004 0.000 1.082 6005 I HN 0.151 nan 8.210 nan 0.000 0.420 6006 V N 0.736 120.550 119.914 -0.167 0.000 2.343 6006 V HA -0.223 3.897 4.120 -0.001 0.000 0.247 6006 V C 2.700 178.468 176.094 -0.543 0.000 1.051 6006 V CA 1.308 63.351 62.300 -0.427 0.000 1.036 6006 V CB -0.559 31.027 31.823 -0.395 0.000 0.654 6006 V HN 0.167 nan 8.190 nan 0.000 0.451 6007 V N 0.058 119.822 119.914 -0.249 0.000 2.261 6007 V HA -0.274 3.845 4.120 -0.001 0.000 0.246 6007 V C 2.485 178.540 176.094 -0.066 0.000 1.047 6007 V CA 2.381 64.611 62.300 -0.116 0.000 1.015 6007 V CB -0.673 31.127 31.823 -0.037 0.000 0.642 6007 V HN 0.531 nan 8.190 nan 0.000 0.446 6008 K N 1.115 121.476 120.400 -0.065 0.000 2.026 6008 K HA -0.105 4.214 4.320 -0.001 0.000 0.208 6008 K C 2.051 178.627 176.600 -0.039 0.000 1.048 6008 K CA 1.945 58.208 56.287 -0.040 0.000 0.929 6008 K CB -1.167 31.312 32.500 -0.035 0.000 0.713 6008 K HN 0.387 nan 8.250 nan 0.000 0.439 6009 G N -0.808 107.962 108.800 -0.051 0.000 2.418 6009 G HA2 -0.222 3.738 3.960 -0.001 0.000 0.217 6009 G HA3 -0.222 3.738 3.960 -0.001 0.000 0.217 6009 G C 1.210 176.145 174.900 0.058 0.000 1.158 6009 G CA 0.837 45.940 45.100 0.005 0.000 0.771 6009 G HN 0.268 nan 8.290 nan 0.000 0.545 6010 Y N 0.405 120.628 120.300 -0.128 0.000 2.200 6010 Y HA -0.044 4.505 4.550 -0.001 0.000 0.290 6010 Y C 2.891 178.546 175.900 -0.410 0.000 1.137 6010 Y CA 1.077 59.017 58.100 -0.267 0.000 1.163 6010 Y CB -0.947 37.544 38.460 0.052 0.000 0.988 6010 Y HN 0.270 nan 8.280 nan 0.000 0.518 6011 Q N 0.319 120.108 119.800 -0.019 0.000 2.123 6011 Q HA -0.031 4.308 4.340 -0.001 0.000 0.199 6011 Q C 2.290 178.219 176.000 -0.118 0.000 0.966 6011 Q CA 1.528 57.300 55.803 -0.052 0.000 0.845 6011 Q CB -0.404 28.329 28.738 -0.008 0.000 0.907 6011 Q HN 0.329 nan 8.270 nan 0.000 0.439 6012 A N 0.270 123.018 122.820 -0.120 0.000 1.855 6012 A HA -0.006 4.314 4.320 -0.001 0.000 0.215 6012 A C 2.279 179.769 177.584 -0.157 0.000 1.191 6012 A CA 1.861 53.835 52.037 -0.106 0.000 0.613 6012 A CB -1.196 17.764 19.000 -0.066 0.000 0.829 6012 A HN 0.494 nan 8.150 nan 0.000 0.442 6013 A N -0.319 122.317 122.820 -0.307 0.000 1.930 6013 A HA 0.232 4.551 4.320 -0.001 0.000 0.217 6013 A C 2.458 179.793 177.584 -0.416 0.000 1.175 6013 A CA 1.876 53.684 52.037 -0.381 0.000 0.627 6013 A CB -0.905 17.730 19.000 -0.609 0.000 0.815 6013 A HN 1.028 nan 8.150 nan 0.000 0.443 6014 A N -1.079 121.362 122.820 -0.632 0.000 1.930 6014 A HA -0.156 4.164 4.320 -0.001 0.000 0.217 6014 A C 2.098 179.662 177.584 -0.033 0.000 1.175 6014 A CA 1.543 53.472 52.037 -0.180 0.000 0.627 6014 A CB -0.399 18.546 19.000 -0.093 0.000 0.815 6014 A HN 0.481 nan 8.150 nan 0.000 0.443 6015 Q N -0.071 119.692 119.800 -0.063 0.000 2.119 6015 Q HA -0.111 4.229 4.340 -0.001 0.000 0.201 6015 Q C 1.750 177.758 176.000 0.013 0.000 0.972 6015 Q CA 1.210 57.002 55.803 -0.017 0.000 0.847 6015 Q CB -0.267 28.452 28.738 -0.031 0.000 0.903 6015 Q HN 0.516 nan 8.270 nan 0.000 0.433 6016 K N 0.227 120.643 120.400 0.027 0.000 2.167 6016 K HA 0.099 4.419 4.320 -0.001 0.000 0.203 6016 K C 1.945 178.634 176.600 0.148 0.000 1.052 6016 K CA 0.800 57.147 56.287 0.100 0.000 0.956 6016 K CB -0.101 32.506 32.500 0.179 0.000 0.735 6016 K HN 0.113 nan 8.250 nan 0.000 0.451 6017 A N 1.575 124.474 122.820 0.132 0.000 1.902 6017 A HA -0.201 4.119 4.320 -0.001 0.000 0.217 6017 A C 2.131 179.779 177.584 0.107 0.000 1.181 6017 A CA 1.374 53.500 52.037 0.148 0.000 0.623 6017 A CB -0.381 18.756 19.000 0.229 0.000 0.818 6017 A HN 0.350 nan 8.150 nan 0.000 0.443 6018 Q N -0.880 118.972 119.800 0.087 0.000 2.172 6018 Q HA -0.124 4.216 4.340 -0.001 0.000 0.200 6018 Q C 1.882 177.916 176.000 0.057 0.000 0.964 6018 Q CA 1.099 56.940 55.803 0.064 0.000 0.855 6018 Q CB -0.089 28.679 28.738 0.051 0.000 0.918 6018 Q HN 0.582 nan 8.270 nan 0.000 0.444 6019 E N 0.530 120.767 120.200 0.062 0.000 2.110 6019 E HA -0.150 4.200 4.350 -0.001 0.000 0.193 6019 E C 1.948 178.593 176.600 0.075 0.000 0.988 6019 E CA 0.799 57.234 56.400 0.058 0.000 0.804 6019 E CB 0.004 29.736 29.700 0.052 0.000 0.745 6019 E HN 0.218 nan 8.360 nan 0.000 0.458 6020 L N 0.456 121.739 121.223 0.100 0.000 2.093 6020 L HA -0.096 4.244 4.340 -0.001 0.000 0.208 6020 L C 2.423 179.335 176.870 0.069 0.000 1.085 6020 L CA 1.123 56.023 54.840 0.100 0.000 0.755 6020 L CB -0.821 41.305 42.059 0.111 0.000 0.904 6020 L HN 0.095 nan 8.230 nan 0.000 0.435 6021 L N -1.031 120.229 121.223 0.062 0.000 2.093 6021 L HA -0.220 4.120 4.340 -0.001 0.000 0.208 6021 L C 2.431 179.325 176.870 0.041 0.000 1.085 6021 L CA 1.194 56.062 54.840 0.047 0.000 0.755 6021 L CB -0.450 41.635 42.059 0.043 0.000 0.904 6021 L HN 0.231 nan 8.230 nan 0.000 0.435 6022 K N -0.773 119.652 120.400 0.041 0.000 2.155 6022 K HA -0.082 4.237 4.320 -0.001 0.000 0.203 6022 K C 2.045 178.665 176.600 0.034 0.000 1.052 6022 K CA 1.442 57.749 56.287 0.033 0.000 0.948 6022 K CB -0.134 32.384 32.500 0.030 0.000 0.728 6022 K HN 0.263 nan 8.250 nan 0.000 0.448 6023 T N 1.950 116.529 114.554 0.042 0.000 2.777 6023 T HA -0.075 4.275 4.350 -0.001 0.000 0.266 6023 T C 1.852 176.574 174.700 0.037 0.000 1.040 6023 T CA 1.263 63.388 62.100 0.042 0.000 1.141 6023 T CB -0.120 68.782 68.868 0.057 0.000 0.868 6023 T HN 0.384 nan 8.240 nan 0.000 0.444 6024 I N -0.452 120.142 120.570 0.040 0.000 3.728 6024 I HA 0.473 4.643 4.170 -0.001 0.000 0.307 6024 I C 1.019 177.154 176.117 0.030 0.000 1.276 6024 I CA -0.597 60.725 61.300 0.037 0.000 1.285 6024 I CB -0.427 37.601 38.000 0.047 0.000 1.038 6024 I HN -0.056 nan 8.210 nan 0.000 0.445 6025 A N 1.501 124.338 122.820 0.028 0.000 2.567 6025 A HA 0.121 4.441 4.320 -0.001 0.000 0.240 6025 A C 0.098 177.693 177.584 0.019 0.000 1.053 6025 A CA 0.001 52.052 52.037 0.023 0.000 0.755 6025 A CB -0.184 18.829 19.000 0.022 0.000 0.978 6025 A HN 0.639 nan 8.150 nan 0.000 0.507 6026 C N 3.757 123.067 119.300 0.016 0.000 2.273 6026 C HA 0.448 4.908 4.460 -0.001 0.000 0.328 6026 C C 0.316 175.313 174.990 0.011 0.000 1.275 6026 C CA -0.682 58.344 59.018 0.013 0.000 1.704 6026 C CB -0.791 26.956 27.740 0.012 0.000 2.326 6026 C HN 0.881 nan 8.230 nan 0.000 0.517 6027 E N 3.688 123.893 120.200 0.010 0.000 2.316 6027 E HA 0.424 4.773 4.350 -0.001 0.000 0.275 6027 E C -0.114 176.490 176.600 0.007 0.000 1.029 6027 E CA -0.063 56.343 56.400 0.008 0.000 0.871 6027 E CB 1.167 30.872 29.700 0.008 0.000 1.022 6027 E HN 0.700 nan 8.360 nan 0.000 0.418 6028 V N -0.512 119.406 119.914 0.006 0.000 3.040 6028 V HA 0.730 4.849 4.120 -0.001 0.000 0.312 6028 V C 0.320 176.417 176.094 0.005 0.000 1.115 6028 V CA -1.135 61.168 62.300 0.005 0.000 0.998 6028 V CB 1.673 33.499 31.823 0.005 0.000 1.042 6028 V HN 0.660 nan 8.190 nan 0.000 0.433 6029 G N 0.610 109.413 108.800 0.004 0.000 2.365 6029 G HA2 0.481 4.441 3.960 -0.001 0.000 0.249 6029 G HA3 0.481 4.441 3.960 -0.001 0.000 0.249 6029 G C 0.966 175.868 174.900 0.004 0.000 1.288 6029 G CA 0.127 45.229 45.100 0.003 0.000 0.887 6029 G HN 1.657 nan 8.290 nan 0.000 0.524 6030 A N 2.345 125.167 122.820 0.004 0.000 1.940 6030 A HA -0.057 4.262 4.320 -0.001 0.000 0.219 6030 A C 1.943 179.529 177.584 0.004 0.000 1.176 6030 A CA 1.198 53.238 52.037 0.004 0.000 0.631 6030 A CB -0.002 19.000 19.000 0.004 0.000 0.814 6030 A HN 0.516 nan 8.150 nan 0.000 0.446 6031 Q N 0.005 119.807 119.800 0.003 0.000 2.201 6031 Q HA 0.107 4.447 4.340 -0.001 0.000 0.236 6031 Q C -0.945 175.057 176.000 0.002 0.000 0.857 6031 Q CA -0.132 55.673 55.803 0.003 0.000 1.025 6031 Q CB 0.026 28.766 28.738 0.003 0.000 1.124 6031 Q HN 0.721 nan 8.270 nan 0.000 0.473 6032 D N 0.728 121.129 120.400 0.002 0.000 2.344 6032 D HA 0.005 4.644 4.640 -0.001 0.000 0.253 6032 D C 1.251 177.551 176.300 0.001 0.000 1.255 6032 D CA 0.065 54.065 54.000 0.001 0.000 0.894 6032 D CB 0.883 41.684 40.800 0.001 0.000 1.067 6032 D HN -0.218 nan 8.370 nan 0.000 0.492 6033 K N 3.409 123.809 120.400 0.000 0.000 2.077 6033 K HA -0.292 4.027 4.320 -0.001 0.000 0.213 6033 K C 1.553 178.152 176.600 -0.002 0.000 1.051 6033 K CA 2.067 58.353 56.287 -0.001 0.000 0.929 6033 K CB -0.105 32.394 32.500 -0.001 0.000 0.715 6033 K HN 0.660 nan 8.250 nan 0.000 0.451 6034 E N -0.451 119.748 120.200 -0.003 0.000 2.023 6034 E HA -0.222 4.128 4.350 -0.001 0.000 0.196 6034 E C 1.992 178.590 176.600 -0.004 0.000 1.003 6034 E CA 1.659 58.056 56.400 -0.004 0.000 0.809 6034 E CB -0.274 29.423 29.700 -0.004 0.000 0.755 6034 E HN 0.340 nan 8.360 nan 0.000 0.449 6035 I N 0.581 121.150 120.570 -0.002 0.000 2.454 6035 I HA -0.203 3.967 4.170 -0.001 0.000 0.254 6035 I C 1.878 177.995 176.117 0.000 0.000 1.156 6035 I CA 0.727 62.027 61.300 -0.000 0.000 1.433 6035 I CB -0.059 37.942 38.000 0.002 0.000 1.082 6035 I HN 0.212 nan 8.210 nan 0.000 0.432 6036 L N 0.065 121.288 121.223 -0.000 0.000 2.141 6036 L HA -0.141 4.198 4.340 -0.001 0.000 0.209 6036 L C 2.644 179.514 176.870 -0.001 0.000 1.094 6036 L CA 2.298 57.138 54.840 0.001 0.000 0.763 6036 L CB -1.566 40.493 42.059 0.001 0.000 0.908 6036 L HN 0.493 nan 8.230 nan 0.000 0.437 6037 T N -4.947 109.605 114.554 -0.003 0.000 3.035 6037 T HA -0.068 4.281 4.350 -0.001 0.000 0.259 6037 T C 1.898 176.593 174.700 -0.009 0.000 1.078 6037 T CA 0.436 62.532 62.100 -0.006 0.000 1.132 6037 T CB -0.065 68.798 68.868 -0.008 0.000 0.900 6037 T HN 0.178 nan 8.240 nan 0.000 0.480 6038 K N 0.616 121.011 120.400 -0.007 0.000 2.057 6038 K HA 0.098 4.417 4.320 -0.001 0.000 0.206 6038 K C 2.145 178.744 176.600 -0.003 0.000 1.050 6038 K CA 0.965 57.247 56.287 -0.008 0.000 0.935 6038 K CB -0.183 32.313 32.500 -0.006 0.000 0.715 6038 K HN 0.252 nan 8.250 nan 0.000 0.439 6039 I N 1.303 121.874 120.570 0.001 0.000 2.179 6039 I HA -0.219 3.951 4.170 -0.001 0.000 0.242 6039 I C 2.518 178.638 176.117 0.006 0.000 1.088 6039 I CA 1.266 62.569 61.300 0.005 0.000 1.357 6039 I CB -1.344 36.659 38.000 0.006 0.000 1.051 6039 I HN 0.104 nan 8.210 nan 0.000 0.409 6040 A N 0.773 123.594 122.820 0.003 0.000 1.865 6040 A HA -0.233 4.086 4.320 -0.001 0.000 0.217 6040 A C 2.397 179.982 177.584 0.002 0.000 1.191 6040 A CA 1.900 53.938 52.037 0.003 0.000 0.623 6040 A CB -0.660 18.341 19.000 0.000 0.000 0.826 6040 A HN 0.356 nan 8.150 nan 0.000 0.444 6041 M N -0.839 118.758 119.600 -0.005 0.000 2.159 6041 M HA -0.123 4.357 4.480 -0.001 0.000 0.263 6041 M C 2.208 178.505 176.300 -0.006 0.000 1.063 6041 M CA 1.792 57.083 55.300 -0.014 0.000 1.110 6041 M CB -0.641 31.940 32.600 -0.031 0.000 1.374 6041 M HN 0.472 nan 8.290 nan 0.000 0.411 6042 T N -0.245 114.312 114.554 0.004 0.000 2.665 6042 T HA -0.182 4.168 4.350 -0.001 0.000 0.268 6042 T C 1.954 176.679 174.700 0.043 0.000 1.035 6042 T CA 2.020 64.135 62.100 0.026 0.000 1.151 6042 T CB -0.319 68.564 68.868 0.026 0.000 0.862 6042 T HN 0.399 nan 8.240 nan 0.000 0.438 6043 S N 0.204 115.921 115.700 0.029 0.000 2.371 6043 S HA 0.034 4.504 4.470 -0.001 0.000 0.224 6043 S C 2.057 176.679 174.600 0.037 0.000 1.029 6043 S CA 0.568 58.786 58.200 0.031 0.000 0.978 6043 S CB -0.428 62.784 63.200 0.021 0.000 0.833 6043 S HN 0.451 nan 8.310 nan 0.000 0.466 6044 I N 1.680 122.267 120.570 0.028 0.000 2.226 6044 I HA -0.105 4.065 4.170 -0.001 0.000 0.245 6044 I C 1.322 177.466 176.117 0.045 0.000 1.100 6044 I CA 0.967 62.283 61.300 0.026 0.000 1.374 6044 I CB -0.934 37.072 38.000 0.010 0.000 1.057 6044 I HN 0.415 nan 8.210 nan 0.000 0.413 6045 T N -0.408 114.179 114.554 0.055 0.000 2.903 6045 T HA 0.326 4.675 4.350 -0.001 0.000 0.314 6045 T C 1.083 175.912 174.700 0.215 0.000 1.078 6045 T CA 0.090 62.250 62.100 0.101 0.000 1.114 6045 T CB 1.225 70.118 68.868 0.042 0.000 0.987 6045 T HN 0.637 nan 8.240 nan 0.000 0.548 6046 G N 0.494 109.471 108.800 0.294 0.000 2.141 6046 G HA2 -0.201 3.759 3.960 -0.001 0.000 0.242 6046 G HA3 -0.201 3.759 3.960 -0.001 0.000 0.242 6046 G C -0.134 174.831 174.900 0.109 0.000 0.982 6046 G CA 0.317 45.548 45.100 0.220 0.000 0.662 6046 G HN 0.947 nan 8.290 nan 0.000 0.527 6047 K N -0.202 120.255 120.400 0.095 0.000 2.328 6047 K HA 0.707 5.027 4.320 -0.001 0.000 0.246 6047 K C 1.565 178.197 176.600 0.052 0.000 0.955 6047 K CA 0.179 56.501 56.287 0.058 0.000 0.817 6047 K CB 0.971 33.498 32.500 0.045 0.000 1.208 6047 K HN 0.282 nan 8.250 nan 0.000 0.432 6048 G N 1.151 109.974 108.800 0.039 0.000 2.450 6048 G HA2 -0.242 3.717 3.960 -0.001 0.000 0.220 6048 G HA3 -0.242 3.717 3.960 -0.001 0.000 0.220 6048 G C 1.049 175.966 174.900 0.028 0.000 1.130 6048 G CA 1.036 46.156 45.100 0.033 0.000 0.760 6048 G HN 0.638 nan 8.290 nan 0.000 0.557 6049 A N 1.346 124.182 122.820 0.027 0.000 2.209 6049 A HA 0.092 4.411 4.320 -0.001 0.000 0.212 6049 A C 2.090 179.683 177.584 0.015 0.000 1.158 6049 A CA 1.498 53.547 52.037 0.020 0.000 0.742 6049 A CB -0.381 18.631 19.000 0.020 0.000 0.790 6049 A HN 0.661 nan 8.150 nan 0.000 0.472 6050 E N 1.378 121.589 120.200 0.019 0.000 2.333 6050 E HA -0.283 4.067 4.350 -0.001 0.000 0.198 6050 E C 1.558 178.154 176.600 -0.006 0.000 1.007 6050 E CA 1.301 57.704 56.400 0.005 0.000 0.845 6050 E CB -0.541 29.165 29.700 0.009 0.000 0.766 6050 E HN 0.792 nan 8.360 nan 0.000 0.507 6051 K N 0.802 121.203 120.400 0.002 0.000 2.281 6051 K HA -0.081 4.239 4.320 -0.001 0.000 0.203 6051 K C 1.467 178.064 176.600 -0.005 0.000 1.046 6051 K CA 1.467 57.753 56.287 -0.002 0.000 0.938 6051 K CB -0.010 32.493 32.500 0.005 0.000 0.737 6051 K HN 0.164 nan 8.250 nan 0.000 0.458 6052 A N 1.782 124.600 122.820 -0.003 0.000 2.606 6052 A HA 0.137 4.457 4.320 -0.001 0.000 0.290 6052 A C 1.347 178.928 177.584 -0.006 0.000 1.174 6052 A CA -0.561 51.474 52.037 -0.004 0.000 0.958 6052 A CB -0.041 18.960 19.000 0.001 0.000 1.194 6052 A HN 0.414 nan 8.150 nan 0.000 0.526 6053 K N 0.187 120.580 120.400 -0.011 0.000 2.281 6053 K HA -0.197 4.122 4.320 -0.001 0.000 0.203 6053 K C 0.834 177.425 176.600 -0.015 0.000 1.046 6053 K CA 1.905 58.184 56.287 -0.014 0.000 0.938 6053 K CB -0.114 32.370 32.500 -0.026 0.000 0.737 6053 K HN 0.314 nan 8.250 nan 0.000 0.458 6054 E N 1.299 121.490 120.200 -0.016 0.000 2.072 6054 E HA -0.098 4.252 4.350 -0.001 0.000 0.190 6054 E C 1.754 178.349 176.600 -0.008 0.000 0.982 6054 E CA 1.244 57.636 56.400 -0.014 0.000 0.803 6054 E CB 0.050 29.740 29.700 -0.015 0.000 0.755 6054 E HN 0.258 nan 8.360 nan 0.000 0.453 6055 K N 0.331 120.728 120.400 -0.005 0.000 2.057 6055 K HA 0.006 4.325 4.320 -0.001 0.000 0.206 6055 K C 1.971 178.572 176.600 0.001 0.000 1.050 6055 K CA 0.751 57.037 56.287 -0.001 0.000 0.935 6055 K CB -0.306 32.194 32.500 0.001 0.000 0.715 6055 K HN 0.057 nan 8.250 nan 0.000 0.439 6056 L N 0.101 121.325 121.223 0.000 0.000 2.046 6056 L HA -0.186 4.154 4.340 -0.001 0.000 0.208 6056 L C 2.373 179.244 176.870 0.001 0.000 1.077 6056 L CA 1.405 56.247 54.840 0.002 0.000 0.747 6056 L CB -0.603 41.458 42.059 0.003 0.000 0.896 6056 L HN 0.196 nan 8.230 nan 0.000 0.432 6057 A N -0.242 122.577 122.820 -0.002 0.000 1.933 6057 A HA -0.245 4.075 4.320 -0.001 0.000 0.218 6057 A C 2.176 179.759 177.584 -0.001 0.000 1.175 6057 A CA 1.809 53.845 52.037 -0.003 0.000 0.628 6057 A CB -0.427 18.569 19.000 -0.007 0.000 0.814 6057 A HN 0.387 nan 8.150 nan 0.000 0.444 6058 E N 0.198 120.397 120.200 -0.001 0.000 2.051 6058 E HA -0.161 4.188 4.350 -0.001 0.000 0.192 6058 E C 1.755 178.356 176.600 0.003 0.000 0.991 6058 E CA 1.423 57.823 56.400 0.000 0.000 0.799 6058 E CB -0.229 29.471 29.700 -0.000 0.000 0.748 6058 E HN 0.468 nan 8.360 nan 0.000 0.449 6059 I N 0.275 120.847 120.570 0.004 0.000 2.226 6059 I HA -0.200 3.970 4.170 -0.001 0.000 0.245 6059 I C 2.135 178.255 176.117 0.006 0.000 1.100 6059 I CA 0.954 62.257 61.300 0.006 0.000 1.374 6059 I CB -0.798 37.207 38.000 0.008 0.000 1.057 6059 I HN 0.197 nan 8.210 nan 0.000 0.413 6060 I N -0.063 120.510 120.570 0.004 0.000 2.406 6060 I HA -0.149 4.021 4.170 -0.001 0.000 0.249 6060 I C 2.487 178.606 176.117 0.004 0.000 1.122 6060 I CA 0.898 62.200 61.300 0.004 0.000 1.431 6060 I CB -0.405 37.598 38.000 0.004 0.000 1.087 6060 I HN -0.095 nan 8.210 nan 0.000 0.424 6061 V N 0.281 120.197 119.914 0.003 0.000 2.358 6061 V HA -0.198 3.922 4.120 -0.001 0.000 0.246 6061 V C 2.449 178.545 176.094 0.004 0.000 1.047 6061 V CA 1.530 63.831 62.300 0.003 0.000 1.035 6061 V CB -0.580 31.244 31.823 0.002 0.000 0.658 6061 V HN 0.380 nan 8.190 nan 0.000 0.452 6062 E N 0.384 120.587 120.200 0.004 0.000 2.072 6062 E HA -0.132 4.218 4.350 -0.001 0.000 0.191 6062 E C 2.378 178.982 176.600 0.006 0.000 0.985 6062 E CA 1.414 57.817 56.400 0.005 0.000 0.801 6062 E CB -0.459 29.245 29.700 0.006 0.000 0.750 6062 E HN 0.555 nan 8.360 nan 0.000 0.452 6063 A N 1.138 123.961 122.820 0.006 0.000 1.902 6063 A HA -0.138 4.182 4.320 -0.001 0.000 0.217 6063 A C 2.623 180.210 177.584 0.005 0.000 1.181 6063 A CA 1.448 53.489 52.037 0.006 0.000 0.623 6063 A CB -0.689 18.314 19.000 0.005 0.000 0.818 6063 A HN 0.124 nan 8.150 nan 0.000 0.443 6064 V N -0.260 119.656 119.914 0.004 0.000 2.261 6064 V HA -0.212 3.907 4.120 -0.001 0.000 0.246 6064 V C 2.763 178.860 176.094 0.005 0.000 1.047 6064 V CA 2.369 64.671 62.300 0.004 0.000 1.015 6064 V CB -0.833 30.992 31.823 0.004 0.000 0.642 6064 V HN 0.549 nan 8.190 nan 0.000 0.446 6065 S N 0.011 115.715 115.700 0.005 0.000 2.419 6065 S HA -0.126 4.344 4.470 -0.001 0.000 0.233 6065 S C 2.138 176.742 174.600 0.007 0.000 1.016 6065 S CA 1.239 59.442 58.200 0.006 0.000 0.974 6065 S CB -0.395 62.808 63.200 0.006 0.000 0.786 6065 S HN 0.645 nan 8.310 nan 0.000 0.492 6066 A N 1.056 123.881 122.820 0.008 0.000 1.930 6066 A HA -0.020 4.300 4.320 -0.001 0.000 0.217 6066 A C 2.240 179.830 177.584 0.011 0.000 1.175 6066 A CA 1.656 53.699 52.037 0.010 0.000 0.627 6066 A CB -0.538 18.468 19.000 0.009 0.000 0.815 6066 A HN 0.580 nan 8.150 nan 0.000 0.443 6067 V N -3.656 116.263 119.914 0.008 0.000 3.660 6067 V HA 0.134 4.254 4.120 -0.001 0.000 0.276 6067 V C 1.871 177.968 176.094 0.006 0.000 1.317 6067 V CA 0.869 63.173 62.300 0.007 0.000 1.097 6067 V CB -0.302 31.524 31.823 0.004 0.000 0.863 6067 V HN 0.156 nan 8.190 nan 0.000 0.438 6068 V N 0.999 120.917 119.914 0.006 0.000 2.568 6068 V HA -0.184 3.936 4.120 -0.001 0.000 0.253 6068 V C 1.623 177.720 176.094 0.006 0.000 1.072 6068 V CA 2.602 64.905 62.300 0.005 0.000 1.084 6068 V CB -0.596 31.230 31.823 0.005 0.000 0.676 6068 V HN 0.897 nan 8.190 nan 0.000 0.469 6069 D N -1.055 119.350 120.400 0.008 0.000 4.438 6069 D HA -0.222 4.417 4.640 -0.001 0.000 0.158 6069 D C 0.616 176.920 176.300 0.007 0.000 0.686 6069 D CA 1.919 55.924 54.000 0.008 0.000 1.183 6069 D CB -1.235 39.568 40.800 0.005 0.000 0.623 6069 D HN 0.573 nan 8.370 nan 0.000 0.521 6070 D N 1.619 122.022 120.400 0.004 0.000 2.414 6070 D HA 0.216 4.855 4.640 -0.001 0.000 0.251 6070 D C -0.199 176.103 176.300 0.004 0.000 1.252 6070 D CA 0.300 54.302 54.000 0.003 0.000 0.999 6070 D CB 0.406 41.207 40.800 0.002 0.000 1.093 6070 D HN 0.199 nan 8.370 nan 0.000 0.515 6071 E N -0.303 119.899 120.200 0.003 0.000 2.373 6071 E HA 0.549 4.898 4.350 -0.001 0.000 0.233 6071 E C -0.237 176.365 176.600 0.003 0.000 1.035 6071 E CA -0.622 55.781 56.400 0.004 0.000 0.930 6071 E CB 0.623 30.326 29.700 0.004 0.000 1.278 6071 E HN 0.450 nan 8.360 nan 0.000 0.452 6072 G N 1.451 110.253 108.800 0.003 0.000 2.340 6072 G HA2 0.258 4.218 3.960 -0.001 0.000 0.298 6072 G HA3 0.258 4.218 3.960 -0.001 0.000 0.298 6072 G C -1.745 173.157 174.900 0.003 0.000 1.498 6072 G CA -0.736 44.366 45.100 0.003 0.000 0.847 6072 G HN 0.021 nan 8.290 nan 0.000 0.594 6073 K N 0.467 120.869 120.400 0.003 0.000 2.550 6073 K HA 0.541 4.861 4.320 -0.001 0.000 0.252 6073 K C -1.382 175.219 176.600 0.003 0.000 0.943 6073 K CA -0.542 55.747 56.287 0.003 0.000 0.806 6073 K CB 2.261 34.763 32.500 0.002 0.000 1.289 6073 K HN 0.512 nan 8.250 nan 0.000 0.435 6074 V N 3.416 123.331 119.914 0.003 0.000 2.370 6074 V HA 0.205 4.324 4.120 -0.001 0.000 0.279 6074 V C -0.248 175.847 176.094 0.002 0.000 1.029 6074 V CA -0.716 61.586 62.300 0.002 0.000 0.870 6074 V CB 1.318 33.143 31.823 0.003 0.000 0.984 6074 V HN 0.606 nan 8.190 nan 0.000 0.451 6075 D N 4.023 124.423 120.400 0.001 0.000 2.427 6075 D HA 0.198 4.837 4.640 -0.001 0.000 0.226 6075 D C 0.974 177.273 176.300 -0.002 0.000 1.076 6075 D CA -0.386 53.613 54.000 -0.001 0.000 0.849 6075 D CB 1.426 42.225 40.800 -0.002 0.000 1.052 6075 D HN 0.511 nan 8.370 nan 0.000 0.515 6076 K N 2.755 123.154 120.400 -0.002 0.000 2.160 6076 K HA -0.231 4.088 4.320 -0.001 0.000 0.206 6076 K C 0.965 177.561 176.600 -0.006 0.000 1.047 6076 K CA 1.322 57.607 56.287 -0.003 0.000 0.930 6076 K CB 0.161 32.659 32.500 -0.002 0.000 0.720 6076 K HN 0.331 nan 8.250 nan 0.000 0.450 6077 D N 0.193 120.589 120.400 -0.007 0.000 2.309 6077 D HA -0.110 4.529 4.640 -0.001 0.000 0.212 6077 D C 1.390 177.682 176.300 -0.012 0.000 0.968 6077 D CA 0.702 54.696 54.000 -0.010 0.000 0.882 6077 D CB 0.128 40.922 40.800 -0.010 0.000 0.918 6077 D HN 0.263 nan 8.370 nan 0.000 0.503 6078 L N -0.305 120.913 121.223 -0.009 0.000 2.554 6078 L HA 0.172 4.511 4.340 -0.001 0.000 0.226 6078 L C 0.370 177.234 176.870 -0.010 0.000 1.137 6078 L CA 0.180 55.014 54.840 -0.009 0.000 0.863 6078 L CB 0.085 42.142 42.059 -0.004 0.000 0.985 6078 L HN 0.009 nan 8.230 nan 0.000 0.451 6079 I N 0.270 120.834 120.570 -0.010 0.000 2.382 6079 I HA 0.235 4.404 4.170 -0.001 0.000 0.286 6079 I C 0.075 176.183 176.117 -0.015 0.000 1.002 6079 I CA -0.460 60.834 61.300 -0.010 0.000 1.135 6079 I CB 1.679 39.676 38.000 -0.005 0.000 1.288 6079 I HN -0.113 nan 8.210 nan 0.000 0.448 6080 K N 6.626 127.013 120.400 -0.021 0.000 2.172 6080 K HA 0.427 4.747 4.320 -0.001 0.000 0.276 6080 K C -0.704 175.882 176.600 -0.023 0.000 1.013 6080 K CA -0.595 55.675 56.287 -0.028 0.000 0.913 6080 K CB 1.267 33.741 32.500 -0.042 0.000 1.055 6080 K HN 0.452 nan 8.250 nan 0.000 0.461 6081 I N 3.974 124.532 120.570 -0.021 0.000 2.307 6081 I HA 0.174 4.344 4.170 -0.001 0.000 0.287 6081 I C 0.099 176.203 176.117 -0.022 0.000 1.054 6081 I CA -0.582 60.708 61.300 -0.016 0.000 1.218 6081 I CB 0.579 38.573 38.000 -0.010 0.000 1.398 6081 I HN 0.517 nan 8.210 nan 0.000 0.475 6082 E N 7.313 127.498 120.200 -0.025 0.000 2.199 6082 E HA 0.548 4.898 4.350 -0.001 0.000 0.269 6082 E C -0.949 175.640 176.600 -0.019 0.000 0.899 6082 E CA -0.746 55.635 56.400 -0.032 0.000 0.772 6082 E CB 1.407 31.074 29.700 -0.054 0.000 1.155 6082 E HN 0.541 nan 8.360 nan 0.000 0.408 6083 K N 2.911 123.300 120.400 -0.019 0.000 2.471 6083 K HA 0.613 4.932 4.320 -0.001 0.000 0.252 6083 K C -0.929 175.663 176.600 -0.014 0.000 0.938 6083 K CA -1.104 55.176 56.287 -0.011 0.000 0.796 6083 K CB 1.591 34.085 32.500 -0.009 0.000 1.161 6083 K HN 0.097 nan 8.250 nan 0.000 0.425 6084 K N 2.029 122.425 120.400 -0.006 0.000 2.507 6084 K HA 0.218 4.537 4.320 -0.001 0.000 0.251 6084 K C -0.644 175.955 176.600 -0.002 0.000 0.943 6084 K CA -0.582 55.702 56.287 -0.005 0.000 0.794 6084 K CB 2.138 34.644 32.500 0.009 0.000 1.188 6084 K HN 0.992 nan 8.250 nan 0.000 0.428 6085 S N 0.430 116.122 115.700 -0.014 0.000 2.584 6085 S HA 0.674 5.144 4.470 -0.001 0.000 0.270 6085 S C 0.565 175.164 174.600 -0.001 0.000 1.346 6085 S CA 0.326 58.518 58.200 -0.013 0.000 1.018 6085 S CB 0.823 64.005 63.200 -0.029 0.000 0.899 6085 S HN 0.931 nan 8.310 nan 0.000 0.542 6086 G N -0.195 108.606 108.800 0.002 0.000 2.640 6086 G HA2 0.475 4.435 3.960 -0.001 0.000 0.686 6086 G HA3 0.475 4.435 3.960 -0.001 0.000 0.686 6086 G C -0.042 174.864 174.900 0.010 0.000 1.229 6086 G CA -0.125 44.980 45.100 0.007 0.000 0.796 6086 G HN 2.406 nan 8.290 nan 0.000 0.654 6087 A N -0.332 122.494 122.820 0.009 0.000 5.953 6087 A HA 0.387 4.707 4.320 -0.001 0.000 0.267 6087 A C 1.186 178.776 177.584 0.009 0.000 2.116 6087 A CA 1.970 54.013 52.037 0.010 0.000 0.711 6087 A CB -1.624 17.384 19.000 0.012 0.000 1.100 6087 A HN 2.749 nan 8.150 nan 0.000 0.364 6088 S N -2.832 112.874 115.700 0.009 0.000 2.851 6088 S HA 0.691 5.161 4.470 -0.001 0.000 0.317 6088 S C 1.196 175.803 174.600 0.010 0.000 1.144 6088 S CA -0.109 58.097 58.200 0.010 0.000 0.862 6088 S CB 0.629 63.834 63.200 0.008 0.000 1.259 6088 S HN 1.019 nan 8.310 nan 0.000 0.564 6089 I N 2.010 122.586 120.570 0.010 0.000 2.546 6089 I HA -0.033 4.136 4.170 -0.001 0.000 0.255 6089 I C 1.514 177.637 176.117 0.009 0.000 1.163 6089 I CA 1.182 62.488 61.300 0.010 0.000 1.457 6089 I CB -1.347 36.659 38.000 0.011 0.000 1.092 6089 I HN 0.586 nan 8.210 nan 0.000 0.434 6090 D N 1.248 121.652 120.400 0.007 0.000 2.218 6090 D HA -0.172 4.467 4.640 -0.001 0.000 0.204 6090 D C 1.342 177.646 176.300 0.007 0.000 0.976 6090 D CA 1.194 55.197 54.000 0.005 0.000 0.853 6090 D CB -0.116 40.686 40.800 0.004 0.000 0.939 6090 D HN 0.432 nan 8.370 nan 0.000 0.481 6091 D N -0.172 120.233 120.400 0.009 0.000 2.347 6091 D HA -0.035 4.605 4.640 -0.001 0.000 0.215 6091 D C 0.331 176.640 176.300 0.016 0.000 0.976 6091 D CA 0.426 54.432 54.000 0.012 0.000 0.884 6091 D CB -0.016 40.792 40.800 0.012 0.000 0.915 6091 D HN -0.045 nan 8.370 nan 0.000 0.526 6092 T N 1.783 116.346 114.554 0.016 0.000 2.905 6092 T HA 0.063 4.413 4.350 -0.001 0.000 0.299 6092 T C 0.228 174.939 174.700 0.020 0.000 1.024 6092 T CA 0.382 62.493 62.100 0.019 0.000 1.151 6092 T CB 0.224 69.101 68.868 0.014 0.000 0.987 6092 T HN 0.303 nan 8.240 nan 0.000 0.535 6093 E N 2.037 122.253 120.200 0.027 0.000 2.408 6093 E HA 0.596 4.945 4.350 -0.001 0.000 0.275 6093 E C -1.490 175.130 176.600 0.033 0.000 0.935 6093 E CA -1.188 55.229 56.400 0.029 0.000 0.775 6093 E CB 1.303 31.023 29.700 0.034 0.000 1.277 6093 E HN 0.326 nan 8.360 nan 0.000 0.455 6094 L N 2.509 123.749 121.223 0.028 0.000 2.275 6094 L HA 0.484 4.823 4.340 -0.001 0.000 0.288 6094 L C -1.234 175.659 176.870 0.038 0.000 1.046 6094 L CA -0.389 54.467 54.840 0.028 0.000 0.805 6094 L CB 0.880 42.950 42.059 0.018 0.000 1.193 6094 L HN 0.610 nan 8.230 nan 0.000 0.426 6095 I N 5.222 125.820 120.570 0.047 0.000 2.359 6095 I HA 0.257 4.427 4.170 -0.001 0.000 0.284 6095 I C -0.127 176.018 176.117 0.047 0.000 1.018 6095 I CA -0.855 60.486 61.300 0.068 0.000 1.173 6095 I CB 0.995 39.070 38.000 0.124 0.000 1.326 6095 I HN 0.477 nan 8.210 nan 0.000 0.462 6096 K N 5.299 125.722 120.400 0.039 0.000 2.081 6096 K HA 0.441 4.761 4.320 -0.001 0.000 0.230 6096 K C 0.306 176.924 176.600 0.029 0.000 1.199 6096 K CA -0.077 56.225 56.287 0.026 0.000 1.130 6096 K CB -0.033 32.478 32.500 0.018 0.000 1.386 6096 K HN 0.848 nan 8.250 nan 0.000 0.280 6097 G N -1.255 107.561 108.800 0.027 0.000 2.335 6097 G HA2 0.268 4.227 3.960 -0.001 0.000 0.291 6097 G HA3 0.268 4.227 3.960 -0.001 0.000 0.291 6097 G C -1.704 173.194 174.900 -0.003 0.000 1.261 6097 G CA -0.803 44.310 45.100 0.022 0.000 0.871 6097 G HN 0.033 nan 8.290 nan 0.000 0.491 6098 V N 0.714 120.615 119.914 -0.022 0.000 2.409 6098 V HA 0.655 4.775 4.120 -0.001 0.000 0.291 6098 V C -0.719 175.299 176.094 -0.126 0.000 1.020 6098 V CA -0.603 61.651 62.300 -0.077 0.000 0.848 6098 V CB 1.242 33.002 31.823 -0.106 0.000 0.990 6098 V HN 0.818 nan 8.190 nan 0.000 0.430 6099 L N 7.911 129.018 121.223 -0.193 0.000 2.313 6099 L HA 0.852 5.192 4.340 -0.001 0.000 0.283 6099 L C -0.350 176.358 176.870 -0.271 0.000 1.013 6099 L CA -0.150 54.465 54.840 -0.375 0.000 0.816 6099 L CB 1.750 43.488 42.059 -0.535 0.000 1.236 6099 L HN 0.562 nan 8.230 nan 0.000 0.419 6100 V N 1.533 121.297 119.914 -0.250 0.000 2.864 6100 V HA 0.611 4.730 4.120 -0.001 0.000 0.314 6100 V C -0.356 175.664 176.094 -0.123 0.000 1.073 6100 V CA -0.516 61.697 62.300 -0.145 0.000 0.956 6100 V CB 1.857 33.631 31.823 -0.082 0.000 1.023 6100 V HN 0.828 nan 8.190 nan 0.000 0.435 6101 D N 1.052 121.407 120.400 -0.076 0.000 3.085 6101 D HA 0.286 4.926 4.640 -0.001 0.000 0.243 6101 D C -0.152 176.142 176.300 -0.010 0.000 1.232 6101 D CA -0.275 53.696 54.000 -0.048 0.000 0.913 6101 D CB 0.308 41.084 40.800 -0.040 0.000 1.108 6101 D HN 0.527 nan 8.370 nan 0.000 0.468 6102 K N 0.473 120.879 120.400 0.009 0.000 2.340 6102 K HA 0.418 4.738 4.320 -0.001 0.000 0.244 6102 K C 0.161 176.786 176.600 0.041 0.000 0.973 6102 K CA -0.810 55.500 56.287 0.038 0.000 0.828 6102 K CB 2.270 34.822 32.500 0.087 0.000 1.226 6102 K HN 0.265 nan 8.250 nan 0.000 0.437 6103 E N 0.549 120.766 120.200 0.029 0.000 2.334 6103 E HA 0.489 4.839 4.350 -0.001 0.000 0.256 6103 E C -0.657 175.943 176.600 0.000 0.000 0.958 6103 E CA -1.152 55.261 56.400 0.023 0.000 0.821 6103 E CB 0.899 30.609 29.700 0.017 0.000 1.269 6103 E HN 0.091 nan 8.360 nan 0.000 0.413 6104 R N 1.202 121.699 120.500 -0.006 0.000 2.242 6104 R HA 0.083 4.423 4.340 -0.001 0.000 0.334 6104 R C 0.854 177.134 176.300 -0.032 0.000 1.071 6104 R CA -0.154 55.928 56.100 -0.030 0.000 0.922 6104 R CB 0.877 31.163 30.300 -0.022 0.000 1.023 6104 R HN 0.581 nan 8.270 nan 0.000 0.458 6105 V N 1.977 121.862 119.914 -0.048 0.000 2.546 6105 V HA -0.177 3.943 4.120 -0.001 0.000 0.254 6105 V C 0.737 176.801 176.094 -0.050 0.000 1.076 6105 V CA 2.010 64.281 62.300 -0.050 0.000 1.087 6105 V CB 0.032 31.816 31.823 -0.065 0.000 0.674 6105 V HN 0.714 nan 8.190 nan 0.000 0.470 6106 S N -2.208 113.466 115.700 -0.044 0.000 2.536 6106 S HA 0.672 5.141 4.470 -0.001 0.000 0.287 6106 S C 0.749 175.341 174.600 -0.012 0.000 1.101 6106 S CA -0.183 57.997 58.200 -0.032 0.000 0.950 6106 S CB 1.840 65.018 63.200 -0.038 0.000 1.056 6106 S HN 0.516 nan 8.310 nan 0.000 0.481 6107 A N 2.985 125.804 122.820 -0.002 0.000 2.125 6107 A HA -0.068 4.251 4.320 -0.001 0.000 0.219 6107 A C 1.868 179.459 177.584 0.011 0.000 1.156 6107 A CA 1.622 53.662 52.037 0.006 0.000 0.671 6107 A CB -0.586 18.420 19.000 0.009 0.000 0.794 6107 A HN 0.894 nan 8.150 nan 0.000 0.459 6108 Q N -1.087 118.724 119.800 0.018 0.000 2.389 6108 Q HA 0.118 4.457 4.340 -0.001 0.000 0.204 6108 Q C 0.488 176.499 176.000 0.018 0.000 0.944 6108 Q CA 0.047 55.866 55.803 0.026 0.000 0.908 6108 Q CB -0.062 28.706 28.738 0.050 0.000 1.002 6108 Q HN 0.684 nan 8.270 nan 0.000 0.493 6109 M N 1.896 121.501 119.600 0.007 0.000 2.255 6109 M HA 0.276 4.755 4.480 -0.001 0.000 0.336 6109 M C -2.080 174.219 176.300 -0.002 0.000 1.135 6109 M CA -2.023 53.276 55.300 -0.001 0.000 1.145 6109 M CB 0.686 33.276 32.600 -0.017 0.000 1.473 6109 M HN -0.084 nan 8.290 nan 0.000 0.462 6110 P HA 0.015 nan 4.420 nan 0.000 0.266 6110 P C -0.470 176.828 177.300 -0.003 0.000 1.193 6110 P CA 0.280 63.379 63.100 -0.001 0.000 0.770 6110 P CB 0.455 32.154 31.700 -0.002 0.000 0.836 6111 K N 1.444 121.846 120.400 0.003 0.000 2.393 6111 K HA 0.045 4.365 4.320 -0.001 0.000 0.193 6111 K C 0.592 177.202 176.600 0.016 0.000 1.026 6111 K CA 0.546 56.838 56.287 0.009 0.000 1.064 6111 K CB 0.094 32.600 32.500 0.010 0.000 0.833 6111 K HN 0.507 nan 8.250 nan 0.000 0.521 6112 K N -0.871 119.537 120.400 0.012 0.000 2.568 6112 K HA 0.396 4.715 4.320 -0.001 0.000 0.273 6112 K C -1.328 175.280 176.600 0.014 0.000 0.951 6112 K CA -0.921 55.378 56.287 0.019 0.000 0.854 6112 K CB 2.128 34.638 32.500 0.017 0.000 1.424 6112 K HN -0.279 nan 8.250 nan 0.000 0.427 6113 V N 1.447 121.373 119.914 0.021 0.000 2.525 6113 V HA 0.400 4.520 4.120 -0.001 0.000 0.299 6113 V C -0.404 175.705 176.094 0.025 0.000 1.034 6113 V CA -0.598 61.712 62.300 0.017 0.000 0.863 6113 V CB 1.807 33.638 31.823 0.013 0.000 0.999 6113 V HN 1.005 nan 8.190 nan 0.000 0.423 6114 T N -0.052 114.513 114.554 0.018 0.000 2.902 6114 T HA 0.539 4.888 4.350 -0.001 0.000 0.283 6114 T C 0.167 174.878 174.700 0.018 0.000 1.009 6114 T CA -0.220 61.890 62.100 0.018 0.000 1.051 6114 T CB 1.275 70.150 68.868 0.011 0.000 0.999 6114 T HN 0.799 nan 8.240 nan 0.000 0.474 6115 D N 0.398 120.809 120.400 0.019 0.000 2.689 6115 D HA -0.161 4.479 4.640 -0.001 0.000 0.237 6115 D C 0.323 176.639 176.300 0.025 0.000 1.148 6115 D CA 0.836 54.848 54.000 0.019 0.000 0.656 6115 D CB -1.258 39.551 40.800 0.014 0.000 1.050 6115 D HN 1.107 nan 8.370 nan 0.000 0.426 6116 A N 1.395 124.235 122.820 0.034 0.000 2.477 6116 A HA 0.352 4.672 4.320 -0.001 0.000 0.246 6116 A C 0.505 178.118 177.584 0.047 0.000 1.078 6116 A CA 0.190 52.253 52.037 0.043 0.000 0.770 6116 A CB 0.546 19.583 19.000 0.062 0.000 1.011 6116 A HN 0.156 nan 8.150 nan 0.000 0.494 6117 K N 3.022 123.449 120.400 0.044 0.000 2.347 6117 K HA 0.386 4.705 4.320 -0.001 0.000 0.262 6117 K C -1.194 175.443 176.600 0.061 0.000 1.052 6117 K CA -0.244 56.071 56.287 0.046 0.000 0.946 6117 K CB 0.932 33.452 32.500 0.032 0.000 1.220 6117 K HN 0.525 nan 8.250 nan 0.000 0.450 6118 I N 2.142 122.765 120.570 0.088 0.000 2.371 6118 I HA 0.202 4.371 4.170 -0.001 0.000 0.290 6118 I C 0.372 176.561 176.117 0.120 0.000 1.028 6118 I CA -0.170 61.215 61.300 0.142 0.000 1.345 6118 I CB 1.362 39.481 38.000 0.199 0.000 1.407 6118 I HN 0.507 nan 8.210 nan 0.000 0.501 6119 A N 7.591 130.486 122.820 0.125 0.000 2.330 6119 A HA 0.846 5.166 4.320 -0.001 0.000 0.327 6119 A C -0.767 176.905 177.584 0.145 0.000 1.155 6119 A CA -0.562 51.535 52.037 0.099 0.000 0.803 6119 A CB 0.640 19.674 19.000 0.058 0.000 1.208 6119 A HN 0.658 nan 8.150 nan 0.000 0.477 6120 L N 3.455 124.743 121.223 0.108 0.000 2.318 6120 L HA 0.463 4.803 4.340 -0.001 0.000 0.277 6120 L C -1.045 175.866 176.870 0.069 0.000 1.008 6120 L CA -0.101 54.802 54.840 0.105 0.000 0.846 6120 L CB 1.037 43.136 42.059 0.067 0.000 1.220 6120 L HN 0.571 nan 8.230 nan 0.000 0.423 6121 L N 3.118 124.384 121.223 0.071 0.000 2.341 6121 L HA 0.370 4.710 4.340 -0.001 0.000 0.278 6121 L C 0.531 177.428 176.870 0.044 0.000 1.005 6121 L CA -0.567 54.301 54.840 0.047 0.000 0.818 6121 L CB 1.962 44.044 42.059 0.039 0.000 1.259 6121 L HN 0.584 nan 8.230 nan 0.000 0.418 6122 N N 0.191 118.909 118.700 0.031 0.000 2.353 6122 N HA -0.019 4.720 4.740 -0.001 0.000 0.185 6122 N C 0.239 175.760 175.510 0.020 0.000 1.098 6122 N CA -0.209 52.856 53.050 0.025 0.000 0.872 6122 N CB 0.173 38.670 38.487 0.018 0.000 0.970 6122 N HN 0.412 nan 8.380 nan 0.000 0.467 6123 C N 1.507 120.819 119.300 0.019 0.000 2.435 6123 C HA 0.767 5.227 4.460 -0.001 0.000 0.375 6123 C C 0.949 175.947 174.990 0.015 0.000 1.281 6123 C CA -0.986 58.041 59.018 0.015 0.000 1.963 6123 C CB -1.248 26.501 27.740 0.015 0.000 2.490 6123 C HN 0.577 nan 8.230 nan 0.000 0.557 6124 A N 6.574 129.401 122.820 0.010 0.000 2.520 6124 A HA 0.363 4.682 4.320 -0.001 0.000 0.235 6124 A C 0.420 178.007 177.584 0.005 0.000 1.065 6124 A CA 0.003 52.044 52.037 0.006 0.000 0.764 6124 A CB 0.072 19.074 19.000 0.003 0.000 1.002 6124 A HN 0.815 nan 8.150 nan 0.000 0.502 6125 I N 2.439 123.009 120.570 0.001 0.000 2.191 6125 I HA 0.187 4.356 4.170 -0.001 0.000 0.289 6125 I C 0.115 176.229 176.117 -0.005 0.000 1.141 6125 I CA 0.727 62.027 61.300 0.001 0.000 1.430 6125 I CB -1.538 36.459 38.000 -0.004 0.000 1.497 6125 I HN 0.609 nan 8.210 nan 0.000 0.636 6126 E N 2.942 123.142 120.200 -0.000 0.000 2.283 6126 E HA 0.452 4.802 4.350 -0.001 0.000 0.258 6126 E C -0.795 175.809 176.600 0.006 0.000 0.893 6126 E CA -0.488 55.910 56.400 -0.003 0.000 0.798 6126 E CB 2.335 32.032 29.700 -0.006 0.000 1.242 6126 E HN 0.199 nan 8.360 nan 0.000 0.414 6127 E N 1.893 122.098 120.200 0.009 0.000 2.278 6127 E HA 0.180 4.530 4.350 -0.001 0.000 0.272 6127 E C -1.155 175.456 176.600 0.018 0.000 0.890 6127 E CA -0.553 55.857 56.400 0.017 0.000 0.770 6127 E CB 1.894 31.611 29.700 0.028 0.000 1.212 6127 E HN 0.276 nan 8.360 nan 0.000 0.415 6128 T N 2.893 117.457 114.554 0.016 0.000 2.940 6128 T HA 0.483 4.832 4.350 -0.001 0.000 0.309 6128 T C -0.242 174.474 174.700 0.026 0.000 1.056 6128 T CA 0.894 63.004 62.100 0.017 0.000 1.137 6128 T CB -0.255 68.621 68.868 0.013 0.000 0.976 6128 T HN 1.324 nan 8.240 nan 0.000 0.547 6129 A N 3.181 126.019 122.820 0.029 0.000 2.435 6129 A HA -0.046 4.274 4.320 -0.001 0.000 0.686 6129 A C 1.255 178.880 177.584 0.069 0.000 0.138 6129 A CA 0.499 52.561 52.037 0.042 0.000 0.024 6129 A CB -1.853 17.169 19.000 0.036 0.000 3.974 6129 A HN 1.873 nan 8.150 nan 0.000 0.548 6130 S N 0.624 116.382 115.700 0.096 0.000 2.489 6130 S HA -0.012 4.458 4.470 -0.001 0.000 0.228 6130 S C 1.366 176.086 174.600 0.199 0.000 0.995 6130 S CA 1.427 59.742 58.200 0.192 0.000 0.934 6130 S CB 0.078 63.415 63.200 0.229 0.000 0.771 6130 S HN 1.162 nan 8.310 nan 0.000 0.522 6131 E N 1.885 122.146 120.200 0.102 0.000 2.046 6131 E HA 0.046 4.396 4.350 -0.001 0.000 0.190 6131 E C 1.994 178.622 176.600 0.046 0.000 0.982 6131 E CA 1.405 57.837 56.400 0.053 0.000 0.800 6131 E CB -0.418 29.302 29.700 0.032 0.000 0.756 6131 E HN 0.594 nan 8.360 nan 0.000 0.449 6132 M N -0.521 119.111 119.600 0.053 0.000 2.200 6132 M HA -0.041 4.439 4.480 -0.001 0.000 0.265 6132 M C 2.038 178.375 176.300 0.060 0.000 1.066 6132 M CA 0.649 55.975 55.300 0.043 0.000 1.127 6132 M CB -0.110 32.511 32.600 0.035 0.000 1.379 6132 M HN 0.194 nan 8.290 nan 0.000 0.420 6133 L N 0.959 122.238 121.223 0.093 0.000 2.093 6133 L HA -0.152 4.187 4.340 -0.001 0.000 0.208 6133 L C 2.410 179.391 176.870 0.185 0.000 1.085 6133 L CA 1.825 56.739 54.840 0.123 0.000 0.755 6133 L CB -0.697 41.437 42.059 0.125 0.000 0.904 6133 L HN 0.147 nan 8.230 nan 0.000 0.435 6134 K N -0.373 120.151 120.400 0.207 0.000 2.057 6134 K HA -0.198 4.122 4.320 -0.001 0.000 0.207 6134 K C 1.568 178.165 176.600 -0.004 0.000 1.049 6134 K CA 1.825 58.141 56.287 0.048 0.000 0.931 6134 K CB -0.298 32.078 32.500 -0.207 0.000 0.714 6134 K HN 0.374 nan 8.250 nan 0.000 0.440 6135 D N 0.615 121.020 120.400 0.009 0.000 2.178 6135 D HA -0.110 4.529 4.640 -0.001 0.000 0.202 6135 D C 2.013 178.322 176.300 0.015 0.000 0.974 6135 D CA 1.024 55.025 54.000 0.001 0.000 0.841 6135 D CB -0.082 40.721 40.800 0.005 0.000 0.953 6135 D HN 0.290 nan 8.370 nan 0.000 0.478 6136 M N -0.132 119.488 119.600 0.034 0.000 2.117 6136 M HA -0.127 4.353 4.480 -0.001 0.000 0.262 6136 M C 2.251 178.574 176.300 0.037 0.000 1.065 6136 M CA 0.865 56.186 55.300 0.036 0.000 1.114 6136 M CB -0.042 32.585 32.600 0.044 0.000 1.361 6136 M HN -0.115 nan 8.290 nan 0.000 0.408 6137 V N 0.204 120.152 119.914 0.056 0.000 2.358 6137 V HA -0.208 3.911 4.120 -0.001 0.000 0.246 6137 V C 2.580 178.689 176.094 0.026 0.000 1.047 6137 V CA 1.905 64.240 62.300 0.058 0.000 1.035 6137 V CB -1.128 30.766 31.823 0.117 0.000 0.658 6137 V HN 0.511 nan 8.190 nan 0.000 0.452 6138 A N -0.083 122.740 122.820 0.006 0.000 1.969 6138 A HA -0.228 4.092 4.320 -0.001 0.000 0.218 6138 A C 2.176 179.759 177.584 -0.001 0.000 1.169 6138 A CA 1.929 53.960 52.037 -0.010 0.000 0.635 6138 A CB -0.410 18.573 19.000 -0.027 0.000 0.810 6138 A HN 0.551 nan 8.150 nan 0.000 0.445 6139 E N 0.282 120.485 120.200 0.006 0.000 2.107 6139 E HA -0.081 4.268 4.350 -0.001 0.000 0.191 6139 E C 1.654 178.260 176.600 0.011 0.000 0.982 6139 E CA 1.152 57.556 56.400 0.008 0.000 0.809 6139 E CB -0.358 29.349 29.700 0.011 0.000 0.756 6139 E HN 0.644 nan 8.360 nan 0.000 0.459 6140 I N 0.247 120.826 120.570 0.014 0.000 2.252 6140 I HA -0.223 3.946 4.170 -0.001 0.000 0.245 6140 I C 2.271 178.395 176.117 0.011 0.000 1.102 6140 I CA 1.139 62.447 61.300 0.014 0.000 1.385 6140 I CB -0.240 37.770 38.000 0.016 0.000 1.064 6140 I HN 0.061 nan 8.210 nan 0.000 0.414 6141 K N 1.795 122.200 120.400 0.009 0.000 2.063 6141 K HA -0.135 4.185 4.320 -0.001 0.000 0.208 6141 K C 2.035 178.638 176.600 0.005 0.000 1.048 6141 K CA 1.731 58.022 56.287 0.006 0.000 0.928 6141 K CB -0.392 32.109 32.500 0.002 0.000 0.713 6141 K HN 0.270 nan 8.250 nan 0.000 0.442 6142 A N 0.279 123.102 122.820 0.004 0.000 1.972 6142 A HA -0.166 4.153 4.320 -0.001 0.000 0.219 6142 A C 2.141 179.729 177.584 0.007 0.000 1.169 6142 A CA 2.141 54.181 52.037 0.004 0.000 0.635 6142 A CB -1.017 17.985 19.000 0.003 0.000 0.810 6142 A HN 0.568 nan 8.150 nan 0.000 0.446 6143 S N -1.667 114.039 115.700 0.009 0.000 2.442 6143 S HA 0.238 4.708 4.470 -0.001 0.000 0.236 6143 S C 1.647 176.255 174.600 0.013 0.000 1.007 6143 S CA 1.455 59.663 58.200 0.012 0.000 0.965 6143 S CB -0.561 62.649 63.200 0.016 0.000 0.773 6143 S HN 1.989 nan 8.310 nan 0.000 0.504 6144 G N 0.654 109.461 108.800 0.011 0.000 2.175 6144 G HA2 -0.069 3.890 3.960 -0.001 0.000 0.244 6144 G HA3 -0.069 3.890 3.960 -0.001 0.000 0.244 6144 G C 0.253 175.162 174.900 0.014 0.000 0.982 6144 G CA 0.028 45.135 45.100 0.012 0.000 0.641 6144 G HN 1.368 nan 8.290 nan 0.000 0.527 6145 A N 0.000 122.830 122.820 0.015 0.000 2.498 6145 A HA 0.595 4.915 4.320 -0.001 0.000 0.239 6145 A C 1.171 178.760 177.584 0.008 0.000 1.068 6145 A CA 0.958 53.006 52.037 0.017 0.000 0.766 6145 A CB 0.196 19.208 19.000 0.020 0.000 1.003 6145 A HN 0.363 nan 8.150 nan 0.000 0.497 6146 N N 0.336 119.040 118.700 0.007 0.000 2.382 6146 N HA 0.114 4.853 4.740 -0.001 0.000 0.200 6146 N C -0.643 174.851 175.510 -0.027 0.000 1.122 6146 N CA 0.492 53.539 53.050 -0.004 0.000 0.870 6146 N CB 0.884 39.373 38.487 0.004 0.000 1.176 6146 N HN 0.381 nan 8.380 nan 0.000 0.474 6147 V N 2.356 122.252 119.914 -0.030 0.000 2.495 6147 V HA 0.441 4.560 4.120 -0.001 0.000 0.298 6147 V C -0.875 175.147 176.094 -0.119 0.000 1.031 6147 V CA -0.825 61.414 62.300 -0.103 0.000 0.871 6147 V CB 2.367 34.163 31.823 -0.045 0.000 0.988 6147 V HN 0.002 nan 8.190 nan 0.000 0.432 6148 L N 5.627 126.703 121.223 -0.245 0.000 2.372 6148 L HA 0.670 5.009 4.340 -0.001 0.000 0.274 6148 L C -1.325 175.347 176.870 -0.329 0.000 0.988 6148 L CA 0.014 54.752 54.840 -0.170 0.000 0.833 6148 L CB 1.285 43.291 42.059 -0.089 0.000 1.236 6148 L HN 0.473 nan 8.230 nan 0.000 0.410 6149 F N 4.947 124.898 119.950 0.002 0.000 2.361 6149 F HA 0.419 4.945 4.527 -0.001 0.000 0.364 6149 F C 0.256 176.054 175.800 -0.003 0.000 1.117 6149 F CA -0.315 57.684 58.000 -0.003 0.000 1.071 6149 F CB 1.239 40.237 39.000 -0.004 0.000 1.188 6149 F HN 0.489 nan 8.300 nan 0.000 0.464 6150 C N 5.165 124.540 119.300 0.125 0.000 2.295 6150 C HA 0.219 4.679 4.460 -0.001 0.000 0.331 6150 C C 1.681 176.717 174.990 0.077 0.000 1.280 6150 C CA -0.462 58.601 59.018 0.076 0.000 1.746 6150 C CB 0.637 28.395 27.740 0.029 0.000 2.328 6150 C HN 0.937 nan 8.230 nan 0.000 0.521 6151 Q N 3.339 123.176 119.800 0.061 0.000 2.084 6151 Q HA -0.055 4.285 4.340 -0.001 0.000 0.202 6151 Q C 0.852 176.869 176.000 0.029 0.000 0.978 6151 Q CA 1.630 57.459 55.803 0.043 0.000 0.844 6151 Q CB 0.172 28.927 28.738 0.029 0.000 0.898 6151 Q HN 0.760 nan 8.270 nan 0.000 0.426 6152 K N -1.144 119.270 120.400 0.023 0.000 2.646 6152 K HA 0.421 4.741 4.320 -0.001 0.000 0.270 6152 K C 0.393 176.998 176.600 0.009 0.000 1.026 6152 K CA -0.191 56.104 56.287 0.013 0.000 1.043 6152 K CB 0.062 32.568 32.500 0.009 0.000 1.383 6152 K HN 0.105 nan 8.250 nan 0.000 0.513 6153 G N 0.279 109.079 108.800 0.000 0.000 2.634 6153 G HA2 0.397 4.357 3.960 -0.001 0.000 0.255 6153 G HA3 0.397 4.357 3.960 -0.001 0.000 0.255 6153 G C -0.499 174.392 174.900 -0.015 0.000 1.205 6153 G CA -0.523 44.571 45.100 -0.009 0.000 0.884 6153 G HN 0.371 nan 8.290 nan 0.000 0.549 6154 I N 0.451 121.005 120.570 -0.028 0.000 2.447 6154 I HA 0.161 4.331 4.170 -0.001 0.000 0.287 6154 I C -0.517 175.565 176.117 -0.059 0.000 1.023 6154 I CA -0.748 60.528 61.300 -0.040 0.000 1.083 6154 I CB 2.040 40.010 38.000 -0.049 0.000 1.245 6154 I HN 0.414 nan 8.210 nan 0.000 0.434 6155 D N 5.367 125.732 120.400 -0.059 0.000 2.414 6155 D HA -0.042 4.598 4.640 -0.001 0.000 0.242 6155 D C 0.668 176.892 176.300 -0.127 0.000 1.129 6155 D CA 0.162 54.117 54.000 -0.074 0.000 0.885 6155 D CB 1.314 42.079 40.800 -0.058 0.000 1.198 6155 D HN 0.499 nan 8.370 nan 0.000 0.437 6156 D N 3.191 123.504 120.400 -0.144 0.000 2.190 6156 D HA -0.183 4.457 4.640 -0.001 0.000 0.200 6156 D C 1.844 177.927 176.300 -0.362 0.000 0.992 6156 D CA 0.555 54.404 54.000 -0.251 0.000 0.854 6156 D CB 0.155 40.849 40.800 -0.177 0.000 0.936 6156 D HN 0.475 nan 8.370 nan 0.000 0.462 6157 L N 0.527 121.630 121.223 -0.201 0.000 2.056 6157 L HA -0.157 4.183 4.340 -0.001 0.000 0.207 6157 L C 2.327 178.980 176.870 -0.362 0.000 1.078 6157 L CA 1.245 55.956 54.840 -0.215 0.000 0.749 6157 L CB -0.144 41.818 42.059 -0.162 0.000 0.901 6157 L HN -0.046 nan 8.230 nan 0.000 0.433 6158 A N -0.848 121.840 122.820 -0.221 0.000 1.969 6158 A HA -0.242 4.078 4.320 -0.001 0.000 0.218 6158 A C 2.063 179.579 177.584 -0.114 0.000 1.169 6158 A CA 1.445 53.408 52.037 -0.125 0.000 0.635 6158 A CB -0.407 18.564 19.000 -0.050 0.000 0.810 6158 A HN 0.595 nan 8.150 nan 0.000 0.445 6159 Q N -1.116 118.565 119.800 -0.199 0.000 2.170 6159 Q HA -0.170 4.170 4.340 -0.001 0.000 0.203 6159 Q C 1.933 177.840 176.000 -0.154 0.000 0.976 6159 Q CA 1.357 57.045 55.803 -0.192 0.000 0.858 6159 Q CB -0.252 28.318 28.738 -0.280 0.000 0.907 6159 Q HN 0.748 nan 8.270 nan 0.000 0.433 6160 H N -0.795 118.209 119.070 -0.110 0.000 2.321 6160 H HA -0.123 4.432 4.556 -0.001 0.000 0.300 6160 H C 1.745 177.114 175.328 0.068 0.000 1.087 6160 H CA 1.262 57.263 56.048 -0.077 0.000 1.319 6160 H CB -0.218 29.431 29.762 -0.189 0.000 1.379 6160 H HN 0.305 nan 8.280 nan 0.000 0.501 6161 Y N 0.657 121.025 120.300 0.113 0.000 2.314 6161 Y HA -0.057 4.492 4.550 -0.001 0.000 0.293 6161 Y C 2.810 178.727 175.900 0.028 0.000 1.129 6161 Y CA 0.110 58.245 58.100 0.057 0.000 1.201 6161 Y CB -0.902 37.582 38.460 0.041 0.000 0.999 6161 Y HN 0.056 nan 8.280 nan 0.000 0.541 6162 L N -0.763 120.560 121.223 0.167 0.000 2.046 6162 L HA -0.223 4.117 4.340 -0.001 0.000 0.208 6162 L C 2.631 179.535 176.870 0.056 0.000 1.077 6162 L CA 1.252 56.137 54.840 0.076 0.000 0.747 6162 L CB -0.778 41.294 42.059 0.021 0.000 0.896 6162 L HN 0.157 nan 8.230 nan 0.000 0.432 6163 A N -0.048 122.810 122.820 0.065 0.000 1.930 6163 A HA -0.199 4.120 4.320 -0.001 0.000 0.217 6163 A C 2.299 179.923 177.584 0.066 0.000 1.175 6163 A CA 1.508 53.579 52.037 0.056 0.000 0.627 6163 A CB -0.308 18.732 19.000 0.067 0.000 0.815 6163 A HN 0.313 nan 8.150 nan 0.000 0.443 6164 K N -0.382 120.079 120.400 0.100 0.000 2.211 6164 K HA -0.085 4.235 4.320 -0.001 0.000 0.203 6164 K C 1.192 177.819 176.600 0.044 0.000 1.050 6164 K CA 1.165 57.499 56.287 0.079 0.000 0.945 6164 K CB 0.005 32.572 32.500 0.110 0.000 0.732 6164 K HN 0.359 nan 8.250 nan 0.000 0.451 6165 E N -0.471 119.756 120.200 0.045 0.000 2.489 6165 E HA 0.024 4.373 4.350 -0.001 0.000 0.193 6165 E C 0.876 177.486 176.600 0.016 0.000 1.057 6165 E CA 0.422 56.835 56.400 0.022 0.000 0.866 6165 E CB 0.640 30.354 29.700 0.022 0.000 0.916 6165 E HN 0.451 nan 8.360 nan 0.000 0.500 6166 G N 1.922 110.734 108.800 0.019 0.000 2.160 6166 G HA2 -0.289 3.670 3.960 -0.001 0.000 0.251 6166 G HA3 -0.289 3.670 3.960 -0.001 0.000 0.251 6166 G C 0.234 175.134 174.900 0.000 0.000 1.008 6166 G CA 0.174 45.280 45.100 0.010 0.000 0.724 6166 G HN 0.269 nan 8.290 nan 0.000 0.514 6167 I N 1.042 121.612 120.570 -0.000 0.000 2.342 6167 I HA 0.422 4.592 4.170 -0.001 0.000 0.291 6167 I C 1.018 177.113 176.117 -0.036 0.000 1.010 6167 I CA -1.088 60.202 61.300 -0.017 0.000 1.308 6167 I CB 1.550 39.543 38.000 -0.012 0.000 1.400 6167 I HN 0.148 nan 8.210 nan 0.000 0.488 6168 V N 3.808 123.686 119.914 -0.061 0.000 2.509 6168 V HA 0.911 5.031 4.120 -0.001 0.000 0.284 6168 V C 0.063 176.063 176.094 -0.158 0.000 1.047 6168 V CA -0.282 61.963 62.300 -0.092 0.000 0.952 6168 V CB 1.172 32.941 31.823 -0.089 0.000 0.988 6168 V HN 0.820 nan 8.190 nan 0.000 0.469 6169 A N 3.623 126.346 122.820 -0.162 0.000 2.515 6169 A HA 0.999 5.318 4.320 -0.001 0.000 0.298 6169 A C -0.329 177.137 177.584 -0.197 0.000 1.059 6169 A CA -0.315 51.600 52.037 -0.202 0.000 0.698 6169 A CB 1.878 20.805 19.000 -0.121 0.000 1.289 6169 A HN 2.329 nan 8.150 nan 0.000 0.404 6170 A N 1.911 124.589 122.820 -0.237 0.000 2.359 6170 A HA 0.739 5.058 4.320 -0.001 0.000 0.303 6170 A C -0.008 177.562 177.584 -0.023 0.000 1.066 6170 A CA -0.649 51.322 52.037 -0.109 0.000 0.730 6170 A CB 0.778 19.733 19.000 -0.076 0.000 1.211 6170 A HN 1.204 nan 8.150 nan 0.000 0.439 6171 R N 1.841 122.337 120.500 -0.007 0.000 2.700 6171 R HA 0.717 5.057 4.340 -0.001 0.000 0.253 6171 R C -0.363 175.954 176.300 0.027 0.000 1.091 6171 R CA -0.782 55.323 56.100 0.009 0.000 1.104 6171 R CB 0.405 30.698 30.300 -0.012 0.000 1.202 6171 R HN 0.493 nan 8.270 nan 0.000 0.532 6172 R N -0.926 119.589 120.500 0.023 0.000 3.516 6172 R HA -0.111 4.229 4.340 -0.001 0.000 0.271 6172 R C -0.681 175.638 176.300 0.032 0.000 1.098 6172 R CA 0.569 56.681 56.100 0.021 0.000 0.732 6172 R CB -2.619 27.687 30.300 0.010 0.000 1.152 6172 R HN 0.528 nan 8.270 nan 0.000 0.455 6173 V N 1.410 121.356 119.914 0.053 0.000 2.572 6173 V HA 0.036 4.156 4.120 -0.001 0.000 0.291 6173 V C 1.468 177.576 176.094 0.024 0.000 1.039 6173 V CA -0.023 62.314 62.300 0.061 0.000 1.055 6173 V CB 1.183 33.074 31.823 0.114 0.000 0.969 6173 V HN 0.154 nan 8.190 nan 0.000 0.482 6174 K N 3.308 123.711 120.400 0.005 0.000 2.382 6174 K HA 0.030 4.349 4.320 -0.001 0.000 0.275 6174 K C 1.209 177.800 176.600 -0.015 0.000 1.009 6174 K CA -0.318 55.965 56.287 -0.008 0.000 0.970 6174 K CB 0.548 33.038 32.500 -0.017 0.000 0.934 6174 K HN 0.608 nan 8.250 nan 0.000 0.479 6175 K N 1.976 122.369 120.400 -0.012 0.000 2.074 6175 K HA -0.199 4.121 4.320 -0.001 0.000 0.209 6175 K C 1.914 178.499 176.600 -0.026 0.000 1.048 6175 K CA 2.228 58.507 56.287 -0.014 0.000 0.926 6175 K CB -0.554 31.941 32.500 -0.010 0.000 0.713 6175 K HN 0.583 nan 8.250 nan 0.000 0.444 6176 S N 0.182 115.865 115.700 -0.029 0.000 2.359 6176 S HA -0.171 4.299 4.470 -0.001 0.000 0.224 6176 S C 1.401 175.966 174.600 -0.058 0.000 1.035 6176 S CA 1.786 59.963 58.200 -0.038 0.000 1.018 6176 S CB -0.555 62.624 63.200 -0.034 0.000 0.876 6176 S HN 0.424 nan 8.310 nan 0.000 0.448 6177 D N 0.914 121.274 120.400 -0.067 0.000 2.144 6177 D HA -0.060 4.579 4.640 -0.001 0.000 0.199 6177 D C 2.001 178.214 176.300 -0.146 0.000 0.984 6177 D CA 0.979 54.913 54.000 -0.111 0.000 0.834 6177 D CB -0.273 40.466 40.800 -0.101 0.000 0.955 6177 D HN 0.382 nan 8.370 nan 0.000 0.465 6178 M N 0.479 120.022 119.600 -0.096 0.000 2.159 6178 M HA -0.087 4.393 4.480 -0.001 0.000 0.263 6178 M C 1.888 178.140 176.300 -0.080 0.000 1.063 6178 M CA 1.200 56.450 55.300 -0.085 0.000 1.110 6178 M CB -0.753 31.829 32.600 -0.031 0.000 1.374 6178 M HN 0.119 nan 8.290 nan 0.000 0.411 6179 E N 0.015 120.176 120.200 -0.065 0.000 2.076 6179 E HA -0.121 4.228 4.350 -0.001 0.000 0.190 6179 E C 2.064 178.625 176.600 -0.064 0.000 0.979 6179 E CA 0.794 57.162 56.400 -0.052 0.000 0.807 6179 E CB 0.015 29.692 29.700 -0.038 0.000 0.761 6179 E HN 0.494 nan 8.360 nan 0.000 0.454 6180 K N 0.679 121.030 120.400 -0.082 0.000 2.097 6180 K HA -0.093 4.227 4.320 -0.001 0.000 0.206 6180 K C 2.197 178.732 176.600 -0.107 0.000 1.049 6180 K CA 0.832 57.067 56.287 -0.086 0.000 0.933 6180 K CB -0.083 32.360 32.500 -0.095 0.000 0.717 6180 K HN 0.106 nan 8.250 nan 0.000 0.442 6181 L N 0.474 121.600 121.223 -0.162 0.000 2.093 6181 L HA -0.164 4.176 4.340 -0.001 0.000 0.208 6181 L C 2.580 179.385 176.870 -0.108 0.000 1.085 6181 L CA 1.030 55.750 54.840 -0.200 0.000 0.755 6181 L CB -0.537 41.296 42.059 -0.377 0.000 0.904 6181 L HN 0.193 nan 8.230 nan 0.000 0.435 6182 A N 0.087 122.860 122.820 -0.078 0.000 1.930 6182 A HA -0.198 4.121 4.320 -0.001 0.000 0.217 6182 A C 2.321 179.890 177.584 -0.025 0.000 1.175 6182 A CA 1.526 53.541 52.037 -0.037 0.000 0.627 6182 A CB -0.280 18.703 19.000 -0.028 0.000 0.815 6182 A HN 0.306 nan 8.150 nan 0.000 0.443 6183 K N -0.315 120.066 120.400 -0.032 0.000 2.026 6183 K HA -0.040 4.279 4.320 -0.001 0.000 0.208 6183 K C 2.333 178.928 176.600 -0.008 0.000 1.048 6183 K CA 1.197 57.473 56.287 -0.019 0.000 0.929 6183 K CB -0.283 32.203 32.500 -0.024 0.000 0.713 6183 K HN 0.437 nan 8.250 nan 0.000 0.439 6184 A N 1.022 123.830 122.820 -0.020 0.000 1.855 6184 A HA -0.124 4.196 4.320 -0.001 0.000 0.213 6184 A C 2.287 179.876 177.584 0.010 0.000 1.195 6184 A CA 2.034 54.066 52.037 -0.007 0.000 0.610 6184 A CB -0.941 18.043 19.000 -0.027 0.000 0.837 6184 A HN 0.452 nan 8.150 nan 0.000 0.444 6185 T N -4.300 110.255 114.554 0.001 0.000 3.043 6185 T HA 0.357 4.707 4.350 -0.001 0.000 0.263 6185 T C 1.485 176.203 174.700 0.030 0.000 1.094 6185 T CA 1.235 63.346 62.100 0.020 0.000 1.127 6185 T CB -0.135 68.746 68.868 0.021 0.000 0.905 6185 T HN 1.772 nan 8.240 nan 0.000 0.490 6186 G N 1.528 110.340 108.800 0.020 0.000 2.143 6186 G HA2 -0.052 3.908 3.960 -0.001 0.000 0.248 6186 G HA3 -0.052 3.908 3.960 -0.001 0.000 0.248 6186 G C 0.282 175.194 174.900 0.020 0.000 0.991 6186 G CA 0.036 45.149 45.100 0.022 0.000 0.689 6186 G HN 1.208 nan 8.290 nan 0.000 0.522 6187 A N -0.328 122.503 122.820 0.018 0.000 2.445 6187 A HA 0.560 4.880 4.320 -0.001 0.000 0.242 6187 A C 0.459 178.053 177.584 0.017 0.000 1.075 6187 A CA 0.550 52.602 52.037 0.025 0.000 0.777 6187 A CB 0.377 19.398 19.000 0.034 0.000 1.013 6187 A HN 0.818 nan 8.150 nan 0.000 0.493 6188 N N 1.659 120.371 118.700 0.021 0.000 2.444 6188 N HA 0.358 5.098 4.740 -0.001 0.000 0.262 6188 N C -0.874 174.648 175.510 0.020 0.000 0.974 6188 N CA -0.356 52.703 53.050 0.016 0.000 0.933 6188 N CB 1.159 39.654 38.487 0.015 0.000 1.137 6188 N HN 0.288 nan 8.380 nan 0.000 0.498 6189 V N 4.912 124.834 119.914 0.014 0.000 2.485 6189 V HA 0.141 4.261 4.120 -0.001 0.000 0.287 6189 V C 0.400 176.505 176.094 0.017 0.000 1.022 6189 V CA -0.064 62.246 62.300 0.017 0.000 1.067 6189 V CB -0.124 31.704 31.823 0.009 0.000 0.967 6189 V HN 0.516 nan 8.190 nan 0.000 0.479 6190 I N 4.132 124.715 120.570 0.022 0.000 2.441 6190 I HA 0.438 4.608 4.170 -0.001 0.000 0.295 6190 I C 0.986 177.114 176.117 0.018 0.000 0.994 6190 I CA -0.338 60.974 61.300 0.019 0.000 1.144 6190 I CB 1.315 39.328 38.000 0.021 0.000 1.314 6190 I HN 0.635 nan 8.210 nan 0.000 0.445 6191 A N 5.619 128.448 122.820 0.014 0.000 1.832 6191 A HA 0.355 4.675 4.320 -0.001 0.000 0.214 6191 A C 1.079 178.671 177.584 0.014 0.000 1.204 6191 A CA 1.094 53.139 52.037 0.013 0.000 0.606 6191 A CB -0.175 18.831 19.000 0.010 0.000 0.849 6191 A HN 0.733 nan 8.150 nan 0.000 0.445 6192 A N -1.021 121.806 122.820 0.013 0.000 2.317 6192 A HA 0.645 4.965 4.320 -0.001 0.000 0.327 6192 A C 0.737 178.329 177.584 0.014 0.000 1.178 6192 A CA -0.594 51.451 52.037 0.013 0.000 0.817 6192 A CB 0.403 19.409 19.000 0.011 0.000 1.189 6192 A HN 0.364 nan 8.150 nan 0.000 0.489 6193 I N 1.820 122.398 120.570 0.015 0.000 2.335 6193 I HA -0.331 3.838 4.170 -0.001 0.000 0.251 6193 I C 2.755 178.880 176.117 0.014 0.000 1.129 6193 I CA 1.635 62.944 61.300 0.016 0.000 1.402 6193 I CB -0.246 37.764 38.000 0.016 0.000 1.069 6193 I HN 0.779 nan 8.210 nan 0.000 0.424 6194 A N 0.820 123.647 122.820 0.012 0.000 1.917 6194 A HA -0.232 4.087 4.320 -0.001 0.000 0.219 6194 A C 2.505 180.095 177.584 0.010 0.000 1.182 6194 A CA 2.090 54.133 52.037 0.010 0.000 0.633 6194 A CB -0.745 18.261 19.000 0.009 0.000 0.819 6194 A HN 0.459 nan 8.150 nan 0.000 0.448 6195 A N -1.296 121.530 122.820 0.011 0.000 2.067 6195 A HA 0.291 4.610 4.320 -0.001 0.000 0.217 6195 A C 1.024 178.615 177.584 0.012 0.000 1.156 6195 A CA 0.473 52.516 52.037 0.011 0.000 0.683 6195 A CB -0.451 18.555 19.000 0.010 0.000 0.808 6195 A HN 0.598 nan 8.150 nan 0.000 0.455 6196 L N 1.818 123.050 121.223 0.014 0.000 2.477 6196 L HA 0.360 4.700 4.340 -0.001 0.000 0.272 6196 L C 0.378 177.257 176.870 0.015 0.000 1.157 6196 L CA 0.503 55.353 54.840 0.016 0.000 0.889 6196 L CB 0.387 42.458 42.059 0.019 0.000 1.158 6196 L HN 0.343 nan 8.230 nan 0.000 0.473 6197 S N 3.375 119.084 115.700 0.015 0.000 2.704 6197 S HA 0.781 5.250 4.470 -0.001 0.000 0.296 6197 S C 0.837 175.446 174.600 0.016 0.000 1.138 6197 S CA -0.350 57.859 58.200 0.014 0.000 0.875 6197 S CB 1.277 64.484 63.200 0.012 0.000 1.151 6197 S HN 0.811 nan 8.310 nan 0.000 0.500 6198 A N 0.377 123.205 122.820 0.015 0.000 2.024 6198 A HA -0.083 4.237 4.320 -0.001 0.000 0.220 6198 A C 2.021 179.616 177.584 0.018 0.000 1.164 6198 A CA 1.532 53.579 52.037 0.016 0.000 0.643 6198 A CB -1.061 17.948 19.000 0.014 0.000 0.806 6198 A HN 0.857 nan 8.150 nan 0.000 0.451 6199 Q N -0.522 119.288 119.800 0.016 0.000 2.436 6199 Q HA -0.100 4.240 4.340 -0.001 0.000 0.209 6199 Q C 0.545 176.556 176.000 0.018 0.000 0.965 6199 Q CA 0.979 56.792 55.803 0.016 0.000 0.910 6199 Q CB 0.012 28.758 28.738 0.013 0.000 0.980 6199 Q HN 0.612 nan 8.270 nan 0.000 0.491 6200 D N -0.205 120.207 120.400 0.020 0.000 2.350 6200 D HA 0.015 4.655 4.640 -0.001 0.000 0.213 6200 D C -0.148 176.169 176.300 0.028 0.000 1.031 6200 D CA 0.221 54.234 54.000 0.022 0.000 0.861 6200 D CB 0.376 41.188 40.800 0.021 0.000 0.926 6200 D HN 0.096 nan 8.370 nan 0.000 0.520 6201 L N 0.966 122.207 121.223 0.031 0.000 2.380 6201 L HA 0.326 4.665 4.340 -0.001 0.000 0.273 6201 L C 1.284 178.177 176.870 0.040 0.000 1.138 6201 L CA -0.034 54.830 54.840 0.039 0.000 0.832 6201 L CB 1.018 43.098 42.059 0.036 0.000 1.124 6201 L HN -0.174 nan 8.230 nan 0.000 0.454 6202 G N 1.182 110.011 108.800 0.048 0.000 2.488 6202 G HA2 0.535 4.494 3.960 -0.001 0.000 0.318 6202 G HA3 0.535 4.494 3.960 -0.001 0.000 0.318 6202 G C -1.111 173.820 174.900 0.052 0.000 1.188 6202 G CA -0.460 44.668 45.100 0.046 0.000 0.944 6202 G HN 0.529 nan 8.290 nan 0.000 0.495 6203 D N -0.395 120.033 120.400 0.047 0.000 2.350 6203 D HA 0.661 5.301 4.640 -0.001 0.000 0.245 6203 D C -0.251 176.075 176.300 0.044 0.000 1.036 6203 D CA 0.066 54.093 54.000 0.045 0.000 0.848 6203 D CB 1.971 42.794 40.800 0.039 0.000 1.307 6203 D HN 0.592 nan 8.370 nan 0.000 0.469 6204 A N 0.303 123.150 122.820 0.046 0.000 2.488 6204 A HA 0.622 4.942 4.320 -0.001 0.000 0.298 6204 A C 0.961 178.567 177.584 0.037 0.000 1.044 6204 A CA -0.413 51.651 52.037 0.045 0.000 0.693 6204 A CB 1.613 20.655 19.000 0.069 0.000 1.272 6204 A HN 0.487 nan 8.150 nan 0.000 0.402 6205 G N 0.330 109.145 108.800 0.025 0.000 2.408 6205 G HA2 0.300 4.259 3.960 -0.001 0.000 0.217 6205 G HA3 0.300 4.259 3.960 -0.001 0.000 0.217 6205 G C 0.284 175.200 174.900 0.026 0.000 1.150 6205 G CA 1.653 46.764 45.100 0.018 0.000 0.776 6205 G HN 1.221 nan 8.290 nan 0.000 0.542 6206 L N 0.117 121.364 121.223 0.039 0.000 2.562 6206 L HA 0.584 4.923 4.340 -0.001 0.000 0.266 6206 L C -1.333 175.583 176.870 0.077 0.000 0.949 6206 L CA -0.733 54.135 54.840 0.047 0.000 0.879 6206 L CB 2.420 44.499 42.059 0.033 0.000 1.278 6206 L HN -0.148 nan 8.230 nan 0.000 0.404 6207 V N 4.495 124.460 119.914 0.084 0.000 2.334 6207 V HA 0.625 4.744 4.120 -0.001 0.000 0.281 6207 V C -0.365 175.791 176.094 0.103 0.000 1.016 6207 V CA -0.426 61.947 62.300 0.121 0.000 0.832 6207 V CB 1.391 33.295 31.823 0.136 0.000 0.999 6207 V HN 0.823 nan 8.190 nan 0.000 0.439 6208 E N 3.269 123.552 120.200 0.138 0.000 2.292 6208 E HA 0.389 4.739 4.350 -0.001 0.000 0.272 6208 E C -0.879 175.821 176.600 0.167 0.000 0.881 6208 E CA -0.682 55.783 56.400 0.108 0.000 0.754 6208 E CB 2.066 31.800 29.700 0.057 0.000 1.201 6208 E HN 0.742 nan 8.360 nan 0.000 0.425 6209 E N 4.420 124.688 120.200 0.114 0.000 2.129 6209 E HA 0.199 4.549 4.350 -0.001 0.000 0.283 6209 E C -0.866 175.800 176.600 0.110 0.000 1.080 6209 E CA -0.158 56.319 56.400 0.128 0.000 0.867 6209 E CB 0.601 30.344 29.700 0.072 0.000 1.056 6209 E HN 0.346 nan 8.360 nan 0.000 0.404 6210 R N 3.598 124.208 120.500 0.183 0.000 2.750 6210 R HA 0.412 4.751 4.340 -0.001 0.000 0.281 6210 R C -0.682 175.707 176.300 0.149 0.000 0.972 6210 R CA -0.924 55.229 56.100 0.088 0.000 0.912 6210 R CB 1.968 32.186 30.300 -0.136 0.000 1.187 6210 R HN 0.329 nan 8.270 nan 0.000 0.464 6211 K N 1.975 122.417 120.400 0.071 0.000 2.159 6211 K HA 0.459 4.778 4.320 -0.001 0.000 0.266 6211 K C -0.755 175.889 176.600 0.073 0.000 0.975 6211 K CA -0.458 55.873 56.287 0.074 0.000 0.865 6211 K CB 1.736 34.259 32.500 0.038 0.000 1.087 6211 K HN 0.435 nan 8.250 nan 0.000 0.446 6212 I N 1.411 122.035 120.570 0.091 0.000 2.468 6212 I HA 0.056 4.226 4.170 -0.001 0.000 0.285 6212 I C -0.634 175.513 176.117 0.051 0.000 1.039 6212 I CA -0.018 61.330 61.300 0.080 0.000 1.074 6212 I CB 1.325 39.404 38.000 0.132 0.000 1.228 6212 I HN 0.700 nan 8.210 nan 0.000 0.436 6213 S N 4.743 120.464 115.700 0.033 0.000 3.587 6213 S HA -0.198 4.272 4.470 -0.001 0.000 0.337 6213 S C 1.070 175.681 174.600 0.019 0.000 1.119 6213 S CA 1.183 59.395 58.200 0.021 0.000 0.976 6213 S CB -1.611 61.599 63.200 0.018 0.000 0.922 6213 S HN 1.594 nan 8.310 nan 0.000 0.503 6214 G N 0.088 108.901 108.800 0.022 0.000 2.284 6214 G HA2 -0.249 3.710 3.960 -0.001 0.000 0.230 6214 G HA3 -0.249 3.710 3.960 -0.001 0.000 0.230 6214 G C -0.417 174.499 174.900 0.026 0.000 1.021 6214 G CA 0.123 45.235 45.100 0.020 0.000 0.619 6214 G HN 0.596 nan 8.290 nan 0.000 0.510 6215 D N 1.262 121.681 120.400 0.031 0.000 2.308 6215 D HA 0.471 5.110 4.640 -0.001 0.000 0.251 6215 D C 0.303 176.635 176.300 0.054 0.000 1.127 6215 D CA 0.496 54.517 54.000 0.034 0.000 0.876 6215 D CB 1.614 42.429 40.800 0.025 0.000 1.176 6215 D HN 0.196 nan 8.370 nan 0.000 0.446 6216 S N 2.908 118.638 115.700 0.048 0.000 2.481 6216 S HA 0.399 4.869 4.470 -0.001 0.000 0.276 6216 S C -0.229 174.413 174.600 0.070 0.000 1.247 6216 S CA -0.400 57.840 58.200 0.067 0.000 1.053 6216 S CB 0.035 63.264 63.200 0.047 0.000 0.925 6216 S HN 0.313 nan 8.310 nan 0.000 0.491 6217 M N 4.475 124.145 119.600 0.117 0.000 2.619 6217 M HA 0.532 5.011 4.480 -0.001 0.000 0.297 6217 M C -1.069 175.305 176.300 0.124 0.000 1.229 6217 M CA -0.637 54.700 55.300 0.062 0.000 0.860 6217 M CB 2.152 34.736 32.600 -0.026 0.000 1.741 6217 M HN 0.438 nan 8.290 nan 0.000 0.462 6218 I N 1.688 122.271 120.570 0.021 0.000 2.339 6218 I HA 0.362 4.532 4.170 -0.001 0.000 0.290 6218 I C -1.346 174.753 176.117 -0.030 0.000 0.994 6218 I CA -0.368 61.002 61.300 0.116 0.000 1.191 6218 I CB 0.929 39.031 38.000 0.169 0.000 1.343 6218 I HN 0.437 nan 8.210 nan 0.000 0.458 6219 F N 5.971 125.958 119.950 0.061 0.000 2.385 6219 F HA 0.379 4.906 4.527 -0.001 0.000 0.360 6219 F C 0.093 175.926 175.800 0.056 0.000 1.122 6219 F CA -0.772 57.255 58.000 0.044 0.000 1.090 6219 F CB 1.361 40.377 39.000 0.027 0.000 1.150 6219 F HN 0.016 nan 8.300 nan 0.000 0.472 6220 V N 4.422 124.430 119.914 0.157 0.000 2.311 6220 V HA 0.398 4.518 4.120 -0.001 0.000 0.275 6220 V C -0.299 175.851 176.094 0.094 0.000 1.022 6220 V CA -0.534 61.837 62.300 0.117 0.000 0.830 6220 V CB 0.568 32.425 31.823 0.057 0.000 1.012 6220 V HN 0.838 nan 8.190 nan 0.000 0.452 6221 E N 3.141 123.400 120.200 0.097 0.000 2.446 6221 E HA 0.622 4.972 4.350 -0.001 0.000 0.276 6221 E C -0.668 175.958 176.600 0.044 0.000 0.969 6221 E CA -0.876 55.567 56.400 0.072 0.000 0.800 6221 E CB 1.684 31.439 29.700 0.091 0.000 1.341 6221 E HN 0.220 nan 8.360 nan 0.000 0.460 6222 E N -1.204 119.010 120.200 0.023 0.000 3.181 6222 E HA -0.156 4.194 4.350 -0.001 0.000 0.293 6222 E C -0.552 176.042 176.600 -0.009 0.000 0.936 6222 E CA 0.747 57.149 56.400 0.002 0.000 0.975 6222 E CB -2.397 27.307 29.700 0.006 0.000 1.496 6222 E HN 0.593 nan 8.360 nan 0.000 0.429 6223 C N 0.970 120.267 119.300 -0.005 0.000 2.689 6223 C HA 0.068 4.528 4.460 -0.001 0.000 0.409 6223 C C 2.304 177.257 174.990 -0.061 0.000 1.293 6223 C CA -0.025 58.986 59.018 -0.011 0.000 2.136 6223 C CB 0.419 28.162 27.740 0.005 0.000 2.719 6223 C HN 0.355 nan 8.230 nan 0.000 0.644 6224 K N 0.416 120.773 120.400 -0.072 0.000 2.001 6224 K HA -0.133 4.187 4.320 -0.001 0.000 0.214 6224 K C 0.063 176.375 176.600 -0.481 0.000 1.050 6224 K CA 1.784 57.938 56.287 -0.221 0.000 0.934 6224 K CB -0.137 32.325 32.500 -0.064 0.000 0.718 6224 K HN 0.732 nan 8.250 nan 0.000 0.443 6225 H N -0.406 118.668 119.070 0.007 0.000 2.488 6225 H HA 0.201 4.757 4.556 -0.001 0.000 0.237 6225 H C -2.592 172.737 175.328 0.002 0.000 1.395 6225 H CA -1.750 54.300 56.048 0.005 0.000 1.491 6225 H CB 0.701 30.465 29.762 0.003 0.000 1.567 6225 H HN 0.121 nan 8.280 nan 0.000 0.508 6226 P HA 0.064 nan 4.420 nan 0.000 0.271 6226 P C 0.147 177.471 177.300 0.040 0.000 1.220 6226 P CA -0.520 62.603 63.100 0.037 0.000 0.768 6226 P CB 1.571 33.280 31.700 0.015 0.000 0.848 6227 K N 1.052 121.468 120.400 0.027 0.000 2.399 6227 K HA 0.458 4.778 4.320 -0.001 0.000 0.204 6227 K C 0.374 176.976 176.600 0.004 0.000 1.023 6227 K CA -0.291 56.007 56.287 0.019 0.000 1.127 6227 K CB 0.493 33.002 32.500 0.015 0.000 0.856 6227 K HN 0.542 nan 8.250 nan 0.000 0.514 6228 A N 0.515 123.334 122.820 -0.002 0.000 2.486 6228 A HA 0.662 4.981 4.320 -0.001 0.000 0.300 6228 A C -0.596 176.982 177.584 -0.010 0.000 1.048 6228 A CA -0.726 51.304 52.037 -0.012 0.000 0.696 6228 A CB 1.474 20.458 19.000 -0.027 0.000 1.278 6228 A HN -0.040 nan 8.150 nan 0.000 0.405 6229 V N -1.086 118.822 119.914 -0.010 0.000 3.074 6229 V HA 0.966 5.086 4.120 -0.001 0.000 0.314 6229 V C -0.434 175.652 176.094 -0.014 0.000 1.117 6229 V CA -0.578 61.718 62.300 -0.006 0.000 1.014 6229 V CB 1.714 33.539 31.823 0.003 0.000 1.057 6229 V HN 0.853 nan 8.190 nan 0.000 0.438 6230 T N 4.097 118.645 114.554 -0.010 0.000 2.841 6230 T HA 0.513 4.862 4.350 -0.001 0.000 0.285 6230 T C -0.516 174.183 174.700 -0.003 0.000 0.991 6230 T CA -0.212 61.876 62.100 -0.021 0.000 0.966 6230 T CB 1.345 70.184 68.868 -0.049 0.000 0.962 6230 T HN 0.957 nan 8.240 nan 0.000 0.438 6231 M N 4.894 124.491 119.600 -0.006 0.000 2.063 6231 M HA 0.477 4.956 4.480 -0.001 0.000 0.348 6231 M C -1.153 175.149 176.300 0.003 0.000 1.180 6231 M CA -0.708 54.594 55.300 0.004 0.000 1.059 6231 M CB 0.274 32.875 32.600 0.002 0.000 1.544 6231 M HN 0.532 nan 8.290 nan 0.000 0.447 6232 L N 7.305 128.539 121.223 0.019 0.000 2.259 6232 L HA 0.467 4.806 4.340 -0.001 0.000 0.288 6232 L C -1.042 175.843 176.870 0.025 0.000 1.051 6232 L CA -0.411 54.444 54.840 0.025 0.000 0.824 6232 L CB 0.444 42.541 42.059 0.064 0.000 1.206 6232 L HN 0.754 nan 8.230 nan 0.000 0.429 6233 I N 5.534 126.112 120.570 0.014 0.000 2.325 6233 I HA 0.318 4.488 4.170 -0.001 0.000 0.291 6233 I C 0.226 176.352 176.117 0.014 0.000 1.019 6233 I CA -0.304 61.004 61.300 0.013 0.000 1.302 6233 I CB 0.860 38.865 38.000 0.007 0.000 1.401 6233 I HN 0.578 nan 8.210 nan 0.000 0.485 6234 R N 4.031 124.541 120.500 0.016 0.000 2.828 6234 R HA 0.898 5.237 4.340 -0.001 0.000 0.264 6234 R C -0.240 176.068 176.300 0.012 0.000 1.022 6234 R CA -0.976 55.134 56.100 0.016 0.000 1.021 6234 R CB 2.156 32.468 30.300 0.020 0.000 1.163 6234 R HN 0.831 nan 8.270 nan 0.000 0.494 6235 G N -0.905 107.901 108.800 0.010 0.000 2.340 6235 G HA2 -0.001 3.958 3.960 -0.001 0.000 0.298 6235 G HA3 -0.001 3.958 3.960 -0.001 0.000 0.298 6235 G C -0.089 174.815 174.900 0.007 0.000 1.498 6235 G CA -0.479 44.627 45.100 0.010 0.000 0.847 6235 G HN 0.413 nan 8.290 nan 0.000 0.594 6236 T N -0.668 113.892 114.554 0.010 0.000 2.995 6236 T HA 0.278 4.627 4.350 -0.001 0.000 0.269 6236 T C 0.784 175.487 174.700 0.006 0.000 1.091 6236 T CA 2.172 64.278 62.100 0.009 0.000 1.128 6236 T CB -0.219 68.657 68.868 0.013 0.000 0.891 6236 T HN 0.701 nan 8.240 nan 0.000 0.492 6237 T N 1.030 115.587 114.554 0.006 0.000 2.956 6237 T HA 0.272 4.622 4.350 -0.001 0.000 0.312 6237 T C 0.275 174.960 174.700 -0.026 0.000 1.151 6237 T CA -0.776 61.321 62.100 -0.004 0.000 1.024 6237 T CB 2.165 71.050 68.868 0.029 0.000 1.140 6237 T HN -0.108 nan 8.240 nan 0.000 0.473 6238 E N 1.014 121.158 120.200 -0.093 0.000 2.070 6238 E HA -0.198 4.152 4.350 -0.001 0.000 0.197 6238 E C 1.668 178.193 176.600 -0.125 0.000 1.004 6238 E CA 1.673 57.983 56.400 -0.151 0.000 0.805 6238 E CB -0.071 29.469 29.700 -0.266 0.000 0.744 6238 E HN 0.560 nan 8.360 nan 0.000 0.451 6239 H N -0.238 118.834 119.070 0.005 0.000 2.491 6239 H HA -0.009 4.546 4.556 -0.001 0.000 0.290 6239 H C 2.266 177.597 175.328 0.005 0.000 1.050 6239 H CA 0.615 56.666 56.048 0.004 0.000 1.309 6239 H CB -0.041 29.723 29.762 0.004 0.000 1.392 6239 H HN -0.009 nan 8.280 nan 0.000 0.554 6240 V N 1.896 121.876 119.914 0.109 0.000 2.323 6240 V HA -0.181 3.938 4.120 -0.001 0.000 0.244 6240 V C 2.581 178.702 176.094 0.044 0.000 1.041 6240 V CA 1.605 63.944 62.300 0.065 0.000 1.025 6240 V CB -0.456 31.395 31.823 0.046 0.000 0.656 6240 V HN 0.413 nan 8.190 nan 0.000 0.451 6241 I N -1.905 118.682 120.570 0.028 0.000 3.111 6241 I HA -0.035 4.135 4.170 -0.001 0.000 0.272 6241 I C 2.061 178.189 176.117 0.019 0.000 1.268 6241 I CA 1.215 62.525 61.300 0.017 0.000 1.467 6241 I CB -0.556 37.446 38.000 0.004 0.000 1.087 6241 I HN 0.279 nan 8.210 nan 0.000 0.467 6242 E N 1.534 121.754 120.200 0.032 0.000 2.106 6242 E HA -0.162 4.187 4.350 -0.001 0.000 0.192 6242 E C 1.960 178.584 176.600 0.039 0.000 0.984 6242 E CA 1.116 57.541 56.400 0.042 0.000 0.806 6242 E CB 0.040 29.789 29.700 0.082 0.000 0.750 6242 E HN 0.538 nan 8.360 nan 0.000 0.458 6243 E N 0.331 120.557 120.200 0.043 0.000 2.107 6243 E HA -0.099 4.251 4.350 -0.001 0.000 0.191 6243 E C 2.317 178.931 176.600 0.025 0.000 0.982 6243 E CA 0.554 56.973 56.400 0.032 0.000 0.809 6243 E CB -0.044 29.676 29.700 0.034 0.000 0.756 6243 E HN 0.126 nan 8.360 nan 0.000 0.459 6244 V N 1.843 121.771 119.914 0.024 0.000 2.358 6244 V HA -0.236 3.884 4.120 -0.001 0.000 0.246 6244 V C 2.499 178.602 176.094 0.014 0.000 1.047 6244 V CA 1.725 64.036 62.300 0.018 0.000 1.035 6244 V CB -0.887 30.946 31.823 0.017 0.000 0.658 6244 V HN 0.223 nan 8.190 nan 0.000 0.452 6245 A N 0.442 123.270 122.820 0.013 0.000 1.892 6245 A HA -0.307 4.013 4.320 -0.001 0.000 0.218 6245 A C 2.318 179.908 177.584 0.009 0.000 1.188 6245 A CA 2.481 54.523 52.037 0.009 0.000 0.631 6245 A CB -0.550 18.454 19.000 0.007 0.000 0.822 6245 A HN 0.468 nan 8.150 nan 0.000 0.447 6246 R N -0.070 120.437 120.500 0.012 0.000 2.092 6246 R HA 0.069 4.408 4.340 -0.001 0.000 0.231 6246 R C 2.161 178.467 176.300 0.011 0.000 1.119 6246 R CA 1.759 57.866 56.100 0.011 0.000 0.970 6246 R CB -0.882 29.425 30.300 0.012 0.000 0.864 6246 R HN 0.390 nan 8.270 nan 0.000 0.440 6247 A N 0.142 122.970 122.820 0.013 0.000 1.908 6247 A HA -0.130 4.189 4.320 -0.001 0.000 0.218 6247 A C 2.161 179.752 177.584 0.012 0.000 1.181 6247 A CA 1.974 54.019 52.037 0.014 0.000 0.627 6247 A CB -0.852 18.158 19.000 0.017 0.000 0.818 6247 A HN 0.314 nan 8.150 nan 0.000 0.445 6248 V N -2.281 117.639 119.914 0.010 0.000 2.951 6248 V HA -0.046 4.074 4.120 -0.001 0.000 0.255 6248 V C 1.776 177.874 176.094 0.006 0.000 1.088 6248 V CA 2.139 64.444 62.300 0.008 0.000 1.109 6248 V CB -0.665 31.162 31.823 0.007 0.000 0.724 6248 V HN 0.452 nan 8.190 nan 0.000 0.471 6249 D N 1.154 121.557 120.400 0.005 0.000 2.178 6249 D HA -0.189 4.450 4.640 -0.001 0.000 0.201 6249 D C 1.683 177.985 176.300 0.004 0.000 0.980 6249 D CA 1.776 55.778 54.000 0.004 0.000 0.842 6249 D CB -0.043 40.759 40.800 0.003 0.000 0.948 6249 D HN 0.514 nan 8.370 nan 0.000 0.472 6250 D N -0.512 119.892 120.400 0.006 0.000 2.149 6250 D HA 0.034 4.674 4.640 -0.001 0.000 0.206 6250 D C 2.042 178.346 176.300 0.007 0.000 0.967 6250 D CA 1.254 55.258 54.000 0.007 0.000 0.848 6250 D CB -0.612 40.194 40.800 0.009 0.000 0.998 6250 D HN 0.253 nan 8.370 nan 0.000 0.474 6251 A N 0.848 123.673 122.820 0.008 0.000 1.908 6251 A HA -0.156 4.163 4.320 -0.001 0.000 0.218 6251 A C 2.368 179.955 177.584 0.006 0.000 1.181 6251 A CA 1.423 53.464 52.037 0.008 0.000 0.627 6251 A CB -0.922 18.082 19.000 0.008 0.000 0.818 6251 A HN 0.188 nan 8.150 nan 0.000 0.445 6252 V N -0.155 119.762 119.914 0.005 0.000 2.759 6252 V HA -0.072 4.047 4.120 -0.001 0.000 0.256 6252 V C 2.259 178.355 176.094 0.004 0.000 1.080 6252 V CA 2.112 64.414 62.300 0.004 0.000 1.101 6252 V CB -0.614 31.210 31.823 0.003 0.000 0.698 6252 V HN 0.569 nan 8.190 nan 0.000 0.477 6253 G N -0.240 108.562 108.800 0.004 0.000 2.395 6253 G HA2 -0.152 3.808 3.960 -0.001 0.000 0.214 6253 G HA3 -0.152 3.808 3.960 -0.001 0.000 0.214 6253 G C 1.616 176.519 174.900 0.005 0.000 1.177 6253 G CA 1.219 46.322 45.100 0.004 0.000 0.794 6253 G HN 0.660 nan 8.290 nan 0.000 0.532 6254 V N -1.074 118.844 119.914 0.006 0.000 2.871 6254 V HA 0.002 4.121 4.120 -0.001 0.000 0.256 6254 V C 2.574 178.672 176.094 0.006 0.000 1.082 6254 V CA 1.199 63.503 62.300 0.007 0.000 1.105 6254 V CB -0.364 31.464 31.823 0.008 0.000 0.713 6254 V HN 0.114 nan 8.190 nan 0.000 0.473 6255 V N 2.013 121.931 119.914 0.006 0.000 2.379 6255 V HA -0.006 4.114 4.120 -0.001 0.000 0.245 6255 V C 2.920 179.017 176.094 0.005 0.000 1.044 6255 V CA 2.126 64.429 62.300 0.005 0.000 1.036 6255 V CB -1.320 30.506 31.823 0.004 0.000 0.664 6255 V HN 0.605 nan 8.190 nan 0.000 0.453 6256 G N -1.366 107.436 108.800 0.005 0.000 2.418 6256 G HA2 -0.333 3.626 3.960 -0.001 0.000 0.217 6256 G HA3 -0.333 3.626 3.960 -0.001 0.000 0.217 6256 G C 1.887 176.790 174.900 0.005 0.000 1.158 6256 G CA 1.200 46.303 45.100 0.004 0.000 0.771 6256 G HN 0.529 nan 8.290 nan 0.000 0.545 6257 C N 0.536 119.839 119.300 0.005 0.000 2.429 6257 C HA -0.022 4.438 4.460 -0.001 0.000 0.277 6257 C C 3.151 178.145 174.990 0.007 0.000 1.262 6257 C CA 2.002 61.023 59.018 0.006 0.000 1.733 6257 C CB -1.052 26.692 27.740 0.007 0.000 2.010 6257 C HN 0.400 nan 8.230 nan 0.000 0.483 6258 T N 1.018 115.576 114.554 0.007 0.000 2.833 6258 T HA -0.088 4.261 4.350 -0.001 0.000 0.269 6258 T C 1.570 176.274 174.700 0.006 0.000 1.054 6258 T CA 1.813 63.917 62.100 0.007 0.000 1.135 6258 T CB -0.247 68.624 68.868 0.006 0.000 0.869 6258 T HN 0.591 nan 8.240 nan 0.000 0.466 6259 I N 0.633 121.206 120.570 0.005 0.000 2.286 6259 I HA -0.074 4.096 4.170 -0.001 0.000 0.245 6259 I C 2.538 178.658 176.117 0.005 0.000 1.104 6259 I CA 1.203 62.507 61.300 0.005 0.000 1.397 6259 I CB -0.254 37.748 38.000 0.005 0.000 1.072 6259 I HN 0.261 nan 8.210 nan 0.000 0.417 6260 E N 0.162 120.366 120.200 0.005 0.000 2.152 6260 E HA -0.081 4.268 4.350 -0.001 0.000 0.192 6260 E C -0.114 176.489 176.600 0.006 0.000 0.983 6260 E CA 0.700 57.103 56.400 0.005 0.000 0.818 6260 E CB 0.220 29.924 29.700 0.005 0.000 0.758 6260 E HN 0.375 nan 8.360 nan 0.000 0.467 6261 D N -0.533 119.871 120.400 0.007 0.000 2.505 6261 D HA 0.140 4.779 4.640 -0.001 0.000 0.250 6261 D C -0.061 176.243 176.300 0.008 0.000 1.164 6261 D CA -0.165 53.840 54.000 0.008 0.000 0.870 6261 D CB 1.719 42.525 40.800 0.009 0.000 1.160 6261 D HN 0.084 nan 8.370 nan 0.000 0.549 6262 G N 2.061 110.865 108.800 0.008 0.000 3.279 6262 G HA2 0.005 3.965 3.960 -0.001 0.000 0.230 6262 G HA3 0.005 3.965 3.960 -0.001 0.000 0.230 6262 G C 0.615 175.521 174.900 0.009 0.000 1.230 6262 G CA -0.096 45.008 45.100 0.007 0.000 0.891 6262 G HN 0.095 nan 8.290 nan 0.000 0.518 6263 R N -0.067 120.439 120.500 0.010 0.000 2.437 6263 R HA 0.608 4.948 4.340 -0.001 0.000 0.310 6263 R C -0.476 175.832 176.300 0.012 0.000 0.955 6263 R CA -0.574 55.533 56.100 0.012 0.000 0.851 6263 R CB 1.518 31.826 30.300 0.013 0.000 1.161 6263 R HN 0.305 nan 8.270 nan 0.000 0.446 6264 I N -0.196 120.381 120.570 0.013 0.000 3.042 6264 I HA 0.843 5.013 4.170 -0.001 0.000 0.310 6264 I C -0.547 175.580 176.117 0.016 0.000 1.117 6264 I CA -1.246 60.062 61.300 0.013 0.000 1.003 6264 I CB 2.160 40.167 38.000 0.011 0.000 1.228 6264 I HN 0.315 nan 8.210 nan 0.000 0.443 6265 V N 0.134 120.058 119.914 0.017 0.000 3.130 6265 V HA 0.839 4.959 4.120 -0.001 0.000 0.310 6265 V C 0.071 176.178 176.094 0.023 0.000 1.158 6265 V CA -0.405 61.908 62.300 0.021 0.000 1.029 6265 V CB 1.161 32.998 31.823 0.024 0.000 1.057 6265 V HN 1.156 nan 8.190 nan 0.000 0.436 6266 S N 1.514 117.230 115.700 0.028 0.000 2.576 6266 S HA 0.701 5.170 4.470 -0.001 0.000 0.276 6266 S C 0.488 175.106 174.600 0.031 0.000 1.339 6266 S CA 0.154 58.372 58.200 0.030 0.000 1.039 6266 S CB 0.898 64.120 63.200 0.037 0.000 0.902 6266 S HN 1.803 nan 8.310 nan 0.000 0.516 6267 G N 0.071 108.889 108.800 0.031 0.000 2.641 6267 G HA2 0.556 4.516 3.960 -0.001 0.000 0.239 6267 G HA3 0.556 4.516 3.960 -0.001 0.000 0.239 6267 G C 0.893 175.811 174.900 0.031 0.000 1.402 6267 G CA -0.564 44.554 45.100 0.029 0.000 1.046 6267 G HN 2.025 nan 8.290 nan 0.000 0.565 6268 G N -2.224 106.593 108.800 0.029 0.000 2.155 6268 G HA2 0.237 4.196 3.960 -0.001 0.000 0.257 6268 G HA3 0.237 4.196 3.960 -0.001 0.000 0.257 6268 G C 1.460 176.361 174.900 0.003 0.000 0.983 6268 G CA 1.158 46.273 45.100 0.025 0.000 0.676 6268 G HN 2.515 nan 8.290 nan 0.000 0.528 6269 G N -1.293 107.501 108.800 -0.009 0.000 2.157 6269 G HA2 -0.084 3.876 3.960 -0.001 0.000 0.248 6269 G HA3 -0.084 3.876 3.960 -0.001 0.000 0.248 6269 G C 1.418 176.288 174.900 -0.049 0.000 0.979 6269 G CA 1.654 46.733 45.100 -0.036 0.000 0.650 6269 G HN 1.938 nan 8.290 nan 0.000 0.529 6270 S N 0.057 115.753 115.700 -0.007 0.000 2.368 6270 S HA -0.163 4.307 4.470 -0.001 0.000 0.225 6270 S C 2.800 177.390 174.600 -0.016 0.000 1.030 6270 S CA 2.803 61.018 58.200 0.026 0.000 0.999 6270 S CB -0.528 62.739 63.200 0.112 0.000 0.844 6270 S HN 1.410 nan 8.310 nan 0.000 0.459 6271 T N -0.396 114.159 114.554 0.001 0.000 2.701 6271 T HA -0.046 4.303 4.350 -0.001 0.000 0.263 6271 T C 1.565 176.230 174.700 -0.058 0.000 1.040 6271 T CA 1.541 63.641 62.100 -0.001 0.000 1.147 6271 T CB -0.874 67.999 68.868 0.008 0.000 0.865 6271 T HN 0.405 nan 8.240 nan 0.000 0.426 6272 E N 1.052 121.207 120.200 -0.076 0.000 2.130 6272 E HA -0.076 4.273 4.350 -0.001 0.000 0.196 6272 E C 2.289 178.797 176.600 -0.153 0.000 0.998 6272 E CA 1.077 57.414 56.400 -0.105 0.000 0.806 6272 E CB -0.766 28.873 29.700 -0.101 0.000 0.738 6272 E HN 0.434 nan 8.360 nan 0.000 0.459 6273 V N 0.436 120.212 119.914 -0.230 0.000 2.323 6273 V HA -0.221 3.898 4.120 -0.001 0.000 0.244 6273 V C 2.285 178.140 176.094 -0.399 0.000 1.041 6273 V CA 1.841 63.926 62.300 -0.360 0.000 1.025 6273 V CB -0.436 31.054 31.823 -0.555 0.000 0.656 6273 V HN 0.212 nan 8.190 nan 0.000 0.451 6274 E N 0.619 120.578 120.200 -0.401 0.000 2.097 6274 E HA -0.232 4.118 4.350 -0.001 0.000 0.196 6274 E C 2.033 178.599 176.600 -0.057 0.000 1.000 6274 E CA 1.715 58.081 56.400 -0.056 0.000 0.804 6274 E CB -0.398 29.383 29.700 0.135 0.000 0.740 6274 E HN 0.557 nan 8.360 nan 0.000 0.454 6275 L N -0.149 121.030 121.223 -0.072 0.000 2.056 6275 L HA -0.147 4.193 4.340 -0.001 0.000 0.207 6275 L C 2.541 179.363 176.870 -0.080 0.000 1.078 6275 L CA 1.269 56.075 54.840 -0.056 0.000 0.749 6275 L CB -0.389 41.654 42.059 -0.027 0.000 0.901 6275 L HN 0.111 nan 8.230 nan 0.000 0.433 6276 S N -0.562 115.078 115.700 -0.099 0.000 2.382 6276 S HA -0.147 4.322 4.470 -0.001 0.000 0.228 6276 S C 2.015 176.560 174.600 -0.091 0.000 1.027 6276 S CA 1.222 59.368 58.200 -0.091 0.000 0.991 6276 S CB -0.109 63.029 63.200 -0.104 0.000 0.823 6276 S HN 0.270 nan 8.310 nan 0.000 0.469 6277 M N 1.385 120.926 119.600 -0.097 0.000 2.064 6277 M HA -0.049 4.431 4.480 -0.001 0.000 0.260 6277 M C 2.042 178.258 176.300 -0.140 0.000 1.073 6277 M CA 1.608 56.861 55.300 -0.077 0.000 1.124 6277 M CB -1.106 31.483 32.600 -0.018 0.000 1.326 6277 M HN 0.224 nan 8.290 nan 0.000 0.410 6278 K N 0.254 120.524 120.400 -0.216 0.000 2.103 6278 K HA 0.001 4.321 4.320 -0.001 0.000 0.204 6278 K C 2.061 178.148 176.600 -0.854 0.000 1.052 6278 K CA 0.874 56.869 56.287 -0.486 0.000 0.945 6278 K CB -0.180 32.047 32.500 -0.455 0.000 0.722 6278 K HN 0.261 nan 8.250 nan 0.000 0.443 6279 L N 0.536 121.466 121.223 -0.488 0.000 2.201 6279 L HA -0.118 4.221 4.340 -0.001 0.000 0.212 6279 L C 2.341 179.154 176.870 -0.095 0.000 1.105 6279 L CA 0.966 55.648 54.840 -0.262 0.000 0.775 6279 L CB -0.276 41.777 42.059 -0.009 0.000 0.913 6279 L HN 0.130 nan 8.230 nan 0.000 0.440 6280 R N 0.043 120.484 120.500 -0.098 0.000 2.115 6280 R HA -0.149 4.191 4.340 -0.001 0.000 0.230 6280 R C 2.083 178.380 176.300 -0.005 0.000 1.111 6280 R CA 1.223 57.306 56.100 -0.027 0.000 0.976 6280 R CB -0.126 30.157 30.300 -0.028 0.000 0.870 6280 R HN 0.463 nan 8.270 nan 0.000 0.445 6281 E N -0.522 119.647 120.200 -0.051 0.000 2.107 6281 E HA -0.143 4.206 4.350 -0.001 0.000 0.191 6281 E C 1.575 178.296 176.600 0.202 0.000 0.982 6281 E CA 0.809 57.236 56.400 0.044 0.000 0.809 6281 E CB 0.015 29.728 29.700 0.023 0.000 0.756 6281 E HN 0.320 nan 8.360 nan 0.000 0.459 6282 Y N 0.653 120.969 120.300 0.026 0.000 2.224 6282 Y HA -0.087 4.463 4.550 -0.001 0.000 0.289 6282 Y C 2.399 178.311 175.900 0.019 0.000 1.146 6282 Y CA 0.587 58.699 58.100 0.020 0.000 1.182 6282 Y CB -1.157 37.315 38.460 0.020 0.000 0.983 6282 Y HN 0.033 nan 8.280 nan 0.000 0.524 6283 A N 0.267 123.199 122.820 0.186 0.000 1.940 6283 A HA -0.168 4.152 4.320 -0.001 0.000 0.219 6283 A C 2.175 179.809 177.584 0.085 0.000 1.176 6283 A CA 1.671 53.777 52.037 0.114 0.000 0.631 6283 A CB -0.394 18.661 19.000 0.092 0.000 0.814 6283 A HN 0.318 nan 8.150 nan 0.000 0.446 6284 E N -0.546 119.705 120.200 0.084 0.000 2.106 6284 E HA -0.111 4.239 4.350 -0.001 0.000 0.192 6284 E C 2.147 178.780 176.600 0.055 0.000 0.984 6284 E CA 1.138 57.575 56.400 0.062 0.000 0.806 6284 E CB -0.609 29.125 29.700 0.058 0.000 0.750 6284 E HN 0.595 nan 8.360 nan 0.000 0.458 6285 G N 0.918 109.759 108.800 0.069 0.000 2.430 6285 G HA2 -0.132 3.827 3.960 -0.001 0.000 0.216 6285 G HA3 -0.132 3.827 3.960 -0.001 0.000 0.216 6285 G C 1.742 176.658 174.900 0.027 0.000 1.146 6285 G CA 0.161 45.286 45.100 0.043 0.000 0.793 6285 G HN 0.142 nan 8.290 nan 0.000 0.537 6286 I N -0.105 120.487 120.570 0.037 0.000 2.163 6286 I HA -0.025 4.145 4.170 -0.001 0.000 0.240 6286 I C 1.762 177.891 176.117 0.019 0.000 1.081 6286 I CA 0.831 62.145 61.300 0.023 0.000 1.353 6286 I CB -0.305 37.715 38.000 0.034 0.000 1.054 6286 I HN 0.308 nan 8.210 nan 0.000 0.407 6287 S N -1.137 114.580 115.700 0.028 0.000 3.513 6287 S HA -0.119 4.351 4.470 -0.001 0.000 0.636 6287 S C 0.448 175.058 174.600 0.017 0.000 2.452 6287 S CA 0.755 58.969 58.200 0.022 0.000 2.644 6287 S CB -1.419 61.791 63.200 0.016 0.000 0.331 6287 S HN 1.458 nan 8.310 nan 0.000 1.787 6288 G N 0.665 109.472 108.800 0.013 0.000 2.601 6288 G HA2 -0.286 3.673 3.960 -0.001 0.000 0.261 6288 G HA3 -0.286 3.673 3.960 -0.001 0.000 0.261 6288 G C 0.329 175.236 174.900 0.011 0.000 1.289 6288 G CA 0.967 46.072 45.100 0.008 0.000 0.920 6288 G HN 1.090 nan 8.290 nan 0.000 0.571 6289 R N 0.213 120.717 120.500 0.007 0.000 2.115 6289 R HA 0.026 4.365 4.340 -0.001 0.000 0.226 6289 R C 2.534 178.841 176.300 0.011 0.000 1.100 6289 R CA 1.372 57.478 56.100 0.010 0.000 0.980 6289 R CB -0.234 30.070 30.300 0.007 0.000 0.875 6289 R HN 0.716 nan 8.270 nan 0.000 0.445 6290 E N 0.951 121.155 120.200 0.007 0.000 2.171 6290 E HA -0.262 4.087 4.350 -0.001 0.000 0.197 6290 E C 2.058 178.676 176.600 0.030 0.000 0.997 6290 E CA 1.075 57.480 56.400 0.008 0.000 0.810 6290 E CB 0.101 29.801 29.700 0.001 0.000 0.738 6290 E HN 0.205 nan 8.360 nan 0.000 0.467 6291 Q N 0.596 120.416 119.800 0.035 0.000 2.226 6291 Q HA -0.164 4.175 4.340 -0.001 0.000 0.204 6291 Q C 2.144 178.182 176.000 0.063 0.000 0.975 6291 Q CA 0.923 56.757 55.803 0.051 0.000 0.866 6291 Q CB -0.067 28.697 28.738 0.043 0.000 0.915 6291 Q HN 0.430 nan 8.270 nan 0.000 0.440 6292 L N 0.050 121.305 121.223 0.053 0.000 2.027 6292 L HA -0.140 4.199 4.340 -0.001 0.000 0.206 6292 L C 2.607 179.535 176.870 0.096 0.000 1.074 6292 L CA 1.267 56.143 54.840 0.060 0.000 0.745 6292 L CB -0.658 41.425 42.059 0.039 0.000 0.898 6292 L HN 0.166 nan 8.230 nan 0.000 0.433 6293 A N -0.550 122.325 122.820 0.092 0.000 1.929 6293 A HA -0.093 4.226 4.320 -0.001 0.000 0.216 6293 A C 2.312 180.098 177.584 0.336 0.000 1.176 6293 A CA 1.284 53.421 52.037 0.166 0.000 0.628 6293 A CB -0.680 18.303 19.000 -0.029 0.000 0.816 6293 A HN 0.178 nan 8.150 nan 0.000 0.444 6294 V N 0.134 120.173 119.914 0.209 0.000 2.343 6294 V HA -0.229 3.891 4.120 -0.001 0.000 0.247 6294 V C 2.672 178.896 176.094 0.217 0.000 1.051 6294 V CA 2.326 64.746 62.300 0.200 0.000 1.036 6294 V CB -0.789 31.101 31.823 0.112 0.000 0.654 6294 V HN 0.623 nan 8.190 nan 0.000 0.451 6295 R N 1.131 121.727 120.500 0.160 0.000 2.081 6295 R HA -0.065 4.275 4.340 -0.001 0.000 0.235 6295 R C 2.159 178.533 176.300 0.124 0.000 1.131 6295 R CA 1.924 58.095 56.100 0.118 0.000 0.960 6295 R CB -0.993 29.355 30.300 0.081 0.000 0.856 6295 R HN 0.431 nan 8.270 nan 0.000 0.436 6296 A N -0.454 122.465 122.820 0.165 0.000 1.933 6296 A HA -0.120 4.199 4.320 -0.001 0.000 0.218 6296 A C 2.158 179.808 177.584 0.111 0.000 1.175 6296 A CA 1.333 53.461 52.037 0.151 0.000 0.628 6296 A CB -0.840 18.291 19.000 0.218 0.000 0.814 6296 A HN 0.486 nan 8.150 nan 0.000 0.444 6297 F N 0.982 120.943 119.950 0.018 0.000 2.075 6297 F HA -0.103 4.424 4.527 -0.001 0.000 0.297 6297 F C 2.536 178.258 175.800 -0.130 0.000 1.113 6297 F CA 1.516 59.400 58.000 -0.195 0.000 1.218 6297 F CB -0.398 38.517 39.000 -0.142 0.000 0.984 6297 F HN 0.245 nan 8.300 nan 0.000 0.472 6298 A N -0.169 122.723 122.820 0.120 0.000 1.902 6298 A HA -0.187 4.133 4.320 -0.001 0.000 0.217 6298 A C 1.889 179.420 177.584 -0.089 0.000 1.181 6298 A CA 1.966 54.011 52.037 0.014 0.000 0.623 6298 A CB -0.978 18.063 19.000 0.069 0.000 0.818 6298 A HN 0.457 nan 8.150 nan 0.000 0.443 6299 D N 0.020 120.386 120.400 -0.058 0.000 2.219 6299 D HA 0.024 4.664 4.640 -0.001 0.000 0.205 6299 D C 2.116 178.348 176.300 -0.113 0.000 0.970 6299 D CA 1.190 55.150 54.000 -0.067 0.000 0.851 6299 D CB -0.350 40.434 40.800 -0.027 0.000 0.943 6299 D HN 0.426 nan 8.370 nan 0.000 0.488 6300 A N 0.620 123.337 122.820 -0.172 0.000 2.024 6300 A HA -0.129 4.190 4.320 -0.001 0.000 0.220 6300 A C 2.244 179.696 177.584 -0.220 0.000 1.164 6300 A CA 0.766 52.675 52.037 -0.215 0.000 0.643 6300 A CB -0.714 18.086 19.000 -0.333 0.000 0.806 6300 A HN 0.244 nan 8.150 nan 0.000 0.451 6301 L N -0.359 120.718 121.223 -0.243 0.000 2.265 6301 L HA -0.141 4.199 4.340 -0.001 0.000 0.215 6301 L C 2.016 178.801 176.870 -0.142 0.000 1.117 6301 L CA 0.773 55.491 54.840 -0.202 0.000 0.782 6301 L CB -0.453 41.489 42.059 -0.195 0.000 0.914 6301 L HN 0.326 nan 8.230 nan 0.000 0.441 6302 E N -0.322 119.804 120.200 -0.123 0.000 2.409 6302 E HA -0.141 4.208 4.350 -0.001 0.000 0.198 6302 E C 2.181 178.731 176.600 -0.084 0.000 1.024 6302 E CA 0.607 56.950 56.400 -0.095 0.000 0.861 6302 E CB -0.192 29.460 29.700 -0.080 0.000 0.788 6302 E HN 0.306 nan 8.360 nan 0.000 0.521 6303 V N 0.864 120.723 119.914 -0.092 0.000 2.759 6303 V HA -0.187 3.932 4.120 -0.001 0.000 0.256 6303 V C 1.780 177.830 176.094 -0.073 0.000 1.080 6303 V CA 0.910 63.163 62.300 -0.079 0.000 1.101 6303 V CB -0.165 31.608 31.823 -0.084 0.000 0.698 6303 V HN 0.128 nan 8.190 nan 0.000 0.477 6304 I N 0.490 121.012 120.570 -0.080 0.000 2.296 6304 I HA 0.018 4.188 4.170 -0.001 0.000 0.242 6304 I C 0.128 176.207 176.117 -0.063 0.000 1.087 6304 I CA 1.181 62.439 61.300 -0.071 0.000 1.393 6304 I CB -2.733 35.222 38.000 -0.074 0.000 1.093 6304 I HN 0.307 nan 8.210 nan 0.000 0.421 6305 P HA -0.161 nan 4.420 nan 0.000 0.216 6305 P C 1.826 179.094 177.300 -0.053 0.000 1.150 6305 P CA 1.424 64.489 63.100 -0.058 0.000 0.843 6305 P CB -0.094 31.567 31.700 -0.065 0.000 0.787 6306 R N -0.626 119.841 120.500 -0.055 0.000 2.052 6306 R HA -0.013 4.327 4.340 -0.001 0.000 0.226 6306 R C 1.931 178.202 176.300 -0.048 0.000 1.145 6306 R CA 1.993 58.064 56.100 -0.049 0.000 0.952 6306 R CB -1.290 28.981 30.300 -0.049 0.000 0.847 6306 R HN 0.057 nan 8.270 nan 0.000 0.431 6307 T N 2.606 117.129 114.554 -0.051 0.000 2.833 6307 T HA -0.137 4.213 4.350 -0.001 0.000 0.269 6307 T C 1.723 176.391 174.700 -0.054 0.000 1.054 6307 T CA 1.135 63.205 62.100 -0.050 0.000 1.135 6307 T CB -0.218 68.619 68.868 -0.051 0.000 0.869 6307 T HN 0.113 nan 8.240 nan 0.000 0.466 6308 L N 1.609 122.798 121.223 -0.057 0.000 1.994 6308 L HA 0.076 4.416 4.340 -0.001 0.000 0.208 6308 L C 2.618 179.447 176.870 -0.068 0.000 1.071 6308 L CA 2.044 56.845 54.840 -0.065 0.000 0.745 6308 L CB -1.064 40.959 42.059 -0.061 0.000 0.892 6308 L HN 0.206 nan 8.230 nan 0.000 0.431 6309 A N -1.176 121.609 122.820 -0.057 0.000 2.019 6309 A HA -0.225 4.095 4.320 -0.001 0.000 0.219 6309 A C 2.210 179.764 177.584 -0.050 0.000 1.164 6309 A CA 1.650 53.655 52.037 -0.053 0.000 0.644 6309 A CB -0.632 18.343 19.000 -0.042 0.000 0.805 6309 A HN 0.574 nan 8.150 nan 0.000 0.449 6310 E N 0.581 120.752 120.200 -0.048 0.000 2.072 6310 E HA -0.144 4.205 4.350 -0.001 0.000 0.191 6310 E C 1.705 178.277 176.600 -0.047 0.000 0.985 6310 E CA 1.448 57.822 56.400 -0.043 0.000 0.801 6310 E CB -0.163 29.513 29.700 -0.041 0.000 0.750 6310 E HN 0.548 nan 8.360 nan 0.000 0.452 6311 N N -0.052 118.615 118.700 -0.055 0.000 2.309 6311 N HA -0.090 4.649 4.740 -0.001 0.000 0.182 6311 N C 1.272 176.739 175.510 -0.071 0.000 1.018 6311 N CA 1.140 54.154 53.050 -0.061 0.000 0.876 6311 N CB -0.252 38.195 38.487 -0.067 0.000 0.972 6311 N HN 0.246 nan 8.380 nan 0.000 0.434 6312 A N -0.076 122.697 122.820 -0.079 0.000 2.119 6312 A HA 0.315 4.634 4.320 -0.001 0.000 0.216 6312 A C 1.482 179.030 177.584 -0.060 0.000 1.152 6312 A CA 1.033 53.018 52.037 -0.086 0.000 0.708 6312 A CB -0.397 18.546 19.000 -0.096 0.000 0.805 6312 A HN 0.309 nan 8.150 nan 0.000 0.460 6313 G N -1.276 107.496 108.800 -0.048 0.000 2.149 6313 G HA2 -0.185 3.775 3.960 -0.001 0.000 0.235 6313 G HA3 -0.185 3.775 3.960 -0.001 0.000 0.235 6313 G C -0.032 174.850 174.900 -0.030 0.000 1.018 6313 G CA 0.342 45.421 45.100 -0.036 0.000 0.728 6313 G HN 0.443 nan 8.290 nan 0.000 0.508 6314 L N -0.213 120.990 121.223 -0.033 0.000 2.387 6314 L HA 0.504 4.843 4.340 -0.001 0.000 0.266 6314 L C 0.540 177.395 176.870 -0.024 0.000 1.059 6314 L CA -1.115 53.709 54.840 -0.027 0.000 0.801 6314 L CB 0.780 42.822 42.059 -0.029 0.000 1.223 6314 L HN 0.099 nan 8.230 nan 0.000 0.456 6315 D N 0.802 121.190 120.400 -0.019 0.000 2.363 6315 D HA 0.085 4.725 4.640 -0.001 0.000 0.263 6315 D C 0.748 177.035 176.300 -0.021 0.000 1.258 6315 D CA 0.171 54.160 54.000 -0.018 0.000 0.907 6315 D CB 1.742 42.534 40.800 -0.014 0.000 1.107 6315 D HN 0.629 nan 8.370 nan 0.000 0.495 6316 A N 5.316 128.122 122.820 -0.023 0.000 1.940 6316 A HA -0.192 4.127 4.320 -0.001 0.000 0.219 6316 A C 2.071 179.640 177.584 -0.024 0.000 1.176 6316 A CA 0.944 52.966 52.037 -0.026 0.000 0.631 6316 A CB -0.179 18.805 19.000 -0.027 0.000 0.814 6316 A HN 0.698 nan 8.150 nan 0.000 0.446 6317 I N -0.710 119.848 120.570 -0.020 0.000 2.296 6317 I HA -0.119 4.050 4.170 -0.001 0.000 0.242 6317 I C 2.436 178.544 176.117 -0.015 0.000 1.087 6317 I CA 1.583 62.872 61.300 -0.018 0.000 1.393 6317 I CB -1.525 36.466 38.000 -0.015 0.000 1.093 6317 I HN 0.562 nan 8.210 nan 0.000 0.421 6318 E N 1.256 121.449 120.200 -0.013 0.000 2.077 6318 E HA -0.208 4.142 4.350 -0.001 0.000 0.193 6318 E C 2.326 178.921 176.600 -0.010 0.000 0.989 6318 E CA 1.162 57.556 56.400 -0.010 0.000 0.800 6318 E CB 0.177 29.873 29.700 -0.008 0.000 0.746 6318 E HN 0.208 nan 8.360 nan 0.000 0.452 6319 I N 0.875 121.437 120.570 -0.013 0.000 2.127 6319 I HA -0.273 3.897 4.170 -0.001 0.000 0.241 6319 I C 2.416 178.524 176.117 -0.014 0.000 1.075 6319 I CA 1.013 62.305 61.300 -0.013 0.000 1.334 6319 I CB -0.982 37.007 38.000 -0.019 0.000 1.040 6319 I HN 0.275 nan 8.210 nan 0.000 0.405 6320 L N 0.009 121.219 121.223 -0.020 0.000 2.131 6320 L HA -0.149 4.190 4.340 -0.001 0.000 0.210 6320 L C 2.541 179.399 176.870 -0.019 0.000 1.092 6320 L CA 1.253 56.078 54.840 -0.025 0.000 0.759 6320 L CB -0.952 41.089 42.059 -0.031 0.000 0.903 6320 L HN 0.004 nan 8.230 nan 0.000 0.435 6321 V N -1.155 118.751 119.914 -0.013 0.000 2.323 6321 V HA -0.237 3.883 4.120 -0.001 0.000 0.244 6321 V C 2.487 178.582 176.094 0.001 0.000 1.041 6321 V CA 1.377 63.673 62.300 -0.006 0.000 1.025 6321 V CB -0.391 31.429 31.823 -0.005 0.000 0.656 6321 V HN 0.300 nan 8.190 nan 0.000 0.451 6322 K N -0.184 120.216 120.400 0.001 0.000 2.155 6322 K HA -0.030 4.290 4.320 -0.001 0.000 0.203 6322 K C 1.864 178.474 176.600 0.015 0.000 1.052 6322 K CA 0.853 57.145 56.287 0.007 0.000 0.948 6322 K CB -0.438 32.065 32.500 0.005 0.000 0.728 6322 K HN 0.313 nan 8.250 nan 0.000 0.448 6323 V N 0.508 120.429 119.914 0.012 0.000 2.346 6323 V HA -0.157 3.963 4.120 -0.001 0.000 0.244 6323 V C 2.065 178.185 176.094 0.043 0.000 1.037 6323 V CA 1.531 63.845 62.300 0.023 0.000 1.029 6323 V CB -0.297 31.528 31.823 0.002 0.000 0.663 6323 V HN 0.224 nan 8.190 nan 0.000 0.454 6324 R N 0.153 120.663 120.500 0.017 0.000 2.115 6324 R HA -0.056 4.284 4.340 -0.001 0.000 0.230 6324 R C 2.390 178.727 176.300 0.061 0.000 1.111 6324 R CA 1.325 57.439 56.100 0.024 0.000 0.976 6324 R CB -0.492 29.801 30.300 -0.012 0.000 0.870 6324 R HN 0.534 nan 8.270 nan 0.000 0.445 6325 A N 1.275 124.118 122.820 0.039 0.000 1.873 6325 A HA -0.064 4.255 4.320 -0.001 0.000 0.215 6325 A C 2.365 179.973 177.584 0.040 0.000 1.186 6325 A CA 1.553 53.610 52.037 0.034 0.000 0.616 6325 A CB -0.612 18.399 19.000 0.019 0.000 0.823 6325 A HN 0.365 nan 8.150 nan 0.000 0.442 6326 A N -1.066 121.780 122.820 0.045 0.000 1.933 6326 A HA -0.158 4.161 4.320 -0.001 0.000 0.218 6326 A C 2.006 179.617 177.584 0.044 0.000 1.175 6326 A CA 2.074 54.134 52.037 0.037 0.000 0.628 6326 A CB -0.858 18.163 19.000 0.036 0.000 0.814 6326 A HN 0.781 nan 8.150 nan 0.000 0.444 6327 H N -0.209 118.857 119.070 -0.007 0.000 2.326 6327 H HA 0.053 4.609 4.556 -0.001 0.000 0.301 6327 H C 2.216 177.539 175.328 -0.008 0.000 1.081 6327 H CA 1.972 58.016 56.048 -0.008 0.000 1.334 6327 H CB -0.198 29.557 29.762 -0.012 0.000 1.385 6327 H HN 0.388 nan 8.280 nan 0.000 0.504 6328 A N -0.639 122.243 122.820 0.104 0.000 1.908 6328 A HA -0.194 4.125 4.320 -0.001 0.000 0.218 6328 A C 2.568 180.141 177.584 -0.019 0.000 1.181 6328 A CA 2.060 54.129 52.037 0.053 0.000 0.627 6328 A CB -1.064 17.974 19.000 0.063 0.000 0.818 6328 A HN 0.515 nan 8.150 nan 0.000 0.445 6329 S N -0.639 115.050 115.700 -0.019 0.000 2.341 6329 S HA -0.081 4.388 4.470 -0.001 0.000 0.216 6329 S C 1.876 176.447 174.600 -0.048 0.000 1.034 6329 S CA 1.060 59.245 58.200 -0.025 0.000 0.964 6329 S CB -0.397 62.796 63.200 -0.011 0.000 0.882 6329 S HN 0.596 nan 8.310 nan 0.000 0.469 6330 N N 1.086 119.751 118.700 -0.058 0.000 2.354 6330 N HA 0.231 4.971 4.740 -0.001 0.000 0.179 6330 N C 1.064 176.508 175.510 -0.109 0.000 1.021 6330 N CA 1.018 54.029 53.050 -0.065 0.000 0.887 6330 N CB -0.132 38.328 38.487 -0.044 0.000 0.974 6330 N HN 0.623 nan 8.380 nan 0.000 0.437 6331 G N 0.668 109.344 108.800 -0.206 0.000 2.498 6331 G HA2 -0.231 3.728 3.960 -0.001 0.000 0.651 6331 G HA3 -0.231 3.728 3.960 -0.001 0.000 0.651 6331 G C 0.146 174.786 174.900 -0.433 0.000 1.284 6331 G CA 0.043 44.960 45.100 -0.304 0.000 0.950 6331 G HN 0.349 nan 8.290 nan 0.000 0.511 6332 N N -0.308 118.191 118.700 -0.335 0.000 2.446 6332 N HA 0.003 4.743 4.740 -0.001 0.000 0.179 6332 N C 1.592 177.098 175.510 -0.006 0.000 1.054 6332 N CA 1.611 54.601 53.050 -0.101 0.000 0.905 6332 N CB -0.077 38.454 38.487 0.073 0.000 0.973 6332 N HN 0.883 nan 8.380 nan 0.000 0.448 6333 K N -1.002 119.376 120.400 -0.037 0.000 2.374 6333 K HA 0.266 4.585 4.320 -0.001 0.000 0.196 6333 K C -0.321 176.271 176.600 -0.013 0.000 1.023 6333 K CA -0.015 56.264 56.287 -0.012 0.000 1.103 6333 K CB 0.078 32.570 32.500 -0.015 0.000 0.848 6333 K HN 0.118 nan 8.250 nan 0.000 0.528 6334 C N 1.520 120.804 119.300 -0.027 0.000 3.114 6334 C HA 0.688 5.148 4.460 -0.001 0.000 0.215 6334 C C 0.142 175.132 174.990 -0.001 0.000 1.759 6334 C CA -0.706 58.302 59.018 -0.017 0.000 1.455 6334 C CB -0.569 27.150 27.740 -0.035 0.000 2.528 6334 C HN 0.599 nan 8.230 nan 0.000 0.511 6335 A N 0.077 122.917 122.820 0.034 0.000 2.593 6335 A HA 1.004 5.324 4.320 -0.001 0.000 0.304 6335 A C -0.075 177.553 177.584 0.075 0.000 1.233 6335 A CA 0.222 52.306 52.037 0.079 0.000 0.661 6335 A CB 0.342 19.452 19.000 0.183 0.000 1.338 6335 A HN 1.915 nan 8.150 nan 0.000 0.495 6336 G N -2.105 106.741 108.800 0.077 0.000 2.699 6336 G HA2 0.414 4.373 3.960 -0.001 0.000 0.686 6336 G HA3 0.414 4.373 3.960 -0.001 0.000 0.686 6336 G C -0.982 173.941 174.900 0.037 0.000 1.301 6336 G CA -0.096 45.032 45.100 0.048 0.000 0.816 6336 G HN 2.063 nan 8.290 nan 0.000 0.595 6337 L N 0.539 121.778 121.223 0.026 0.000 2.289 6337 L HA 0.773 5.113 4.340 -0.001 0.000 0.285 6337 L C 0.182 177.076 176.870 0.039 0.000 1.049 6337 L CA -1.026 53.827 54.840 0.021 0.000 0.804 6337 L CB 1.601 43.659 42.059 -0.002 0.000 1.195 6337 L HN 0.721 nan 8.230 nan 0.000 0.428 6338 N N 2.998 121.730 118.700 0.054 0.000 2.527 6338 N HA 0.212 4.951 4.740 -0.001 0.000 0.236 6338 N C 0.766 176.315 175.510 0.064 0.000 0.999 6338 N CA -0.222 52.891 53.050 0.105 0.000 0.935 6338 N CB 1.054 39.615 38.487 0.124 0.000 1.132 6338 N HN 0.525 nan 8.380 nan 0.000 0.511 6339 V N 1.322 121.227 119.914 -0.015 0.000 2.970 6339 V HA 0.022 4.141 4.120 -0.001 0.000 0.260 6339 V C 1.345 177.341 176.094 -0.164 0.000 1.100 6339 V CA 1.123 63.342 62.300 -0.134 0.000 1.122 6339 V CB -1.155 30.517 31.823 -0.251 0.000 0.721 6339 V HN 0.398 nan 8.190 nan 0.000 0.483 6340 F N 2.702 122.650 119.950 -0.004 0.000 2.234 6340 F HA -0.021 4.506 4.527 -0.001 0.000 0.299 6340 F C 2.596 178.394 175.800 -0.003 0.000 1.087 6340 F CA 1.870 59.868 58.000 -0.003 0.000 1.340 6340 F CB -0.570 38.428 39.000 -0.002 0.000 1.031 6340 F HN 0.424 nan 8.300 nan 0.000 0.500 6341 T N -4.557 110.097 114.554 0.167 0.000 2.985 6341 T HA 0.415 4.765 4.350 -0.001 0.000 0.254 6341 T C 1.428 176.156 174.700 0.046 0.000 1.021 6341 T CA 0.370 62.523 62.100 0.089 0.000 0.957 6341 T CB 0.345 69.258 68.868 0.075 0.000 1.047 6341 T HN 0.344 nan 8.240 nan 0.000 0.511 6342 G N 1.169 109.988 108.800 0.032 0.000 2.291 6342 G HA2 0.289 4.248 3.960 -0.001 0.000 0.271 6342 G HA3 0.289 4.248 3.960 -0.001 0.000 0.271 6342 G C 0.025 174.931 174.900 0.010 0.000 1.099 6342 G CA -0.221 44.883 45.100 0.005 0.000 0.919 6342 G HN 1.401 nan 8.290 nan 0.000 0.496 6343 A N -1.347 121.484 122.820 0.019 0.000 2.604 6343 A HA 0.883 5.203 4.320 -0.001 0.000 0.295 6343 A C 0.027 177.625 177.584 0.023 0.000 1.067 6343 A CA 0.096 52.144 52.037 0.018 0.000 0.683 6343 A CB 1.674 20.686 19.000 0.021 0.000 1.281 6343 A HN 1.783 nan 8.150 nan 0.000 0.407 6344 V N 1.865 121.790 119.914 0.019 0.000 2.599 6344 V HA 0.428 4.548 4.120 -0.001 0.000 0.300 6344 V C -0.223 175.887 176.094 0.027 0.000 1.034 6344 V CA 0.862 63.176 62.300 0.023 0.000 1.115 6344 V CB 0.539 32.374 31.823 0.021 0.000 0.934 6344 V HN 0.872 nan 8.190 nan 0.000 0.485 6345 E N 3.679 123.898 120.200 0.033 0.000 2.458 6345 E HA 0.315 4.665 4.350 -0.001 0.000 0.278 6345 E C -1.424 175.194 176.600 0.031 0.000 1.004 6345 E CA -0.716 55.703 56.400 0.032 0.000 0.823 6345 E CB 1.473 31.197 29.700 0.039 0.000 1.396 6345 E HN 0.715 nan 8.360 nan 0.000 0.463 6346 D N 1.924 122.338 120.400 0.024 0.000 2.393 6346 D HA 0.099 4.738 4.640 -0.001 0.000 0.232 6346 D C 0.927 177.241 176.300 0.023 0.000 1.192 6346 D CA -0.153 53.859 54.000 0.020 0.000 0.882 6346 D CB 0.542 41.349 40.800 0.010 0.000 1.038 6346 D HN 0.214 nan 8.370 nan 0.000 0.499 6347 M N 2.191 121.810 119.600 0.031 0.000 2.159 6347 M HA -0.144 4.335 4.480 -0.001 0.000 0.263 6347 M C 2.346 178.660 176.300 0.023 0.000 1.063 6347 M CA 0.638 55.959 55.300 0.034 0.000 1.110 6347 M CB -1.181 31.445 32.600 0.042 0.000 1.374 6347 M HN 0.535 nan 8.290 nan 0.000 0.411 6348 C N 0.714 120.025 119.300 0.019 0.000 2.453 6348 C HA -0.165 4.295 4.460 -0.001 0.000 0.277 6348 C C 2.688 177.682 174.990 0.005 0.000 1.262 6348 C CA 1.360 60.385 59.018 0.012 0.000 1.718 6348 C CB -0.915 26.831 27.740 0.010 0.000 2.031 6348 C HN 0.638 nan 8.230 nan 0.000 0.480 6349 E N 0.158 120.360 120.200 0.004 0.000 2.118 6349 E HA -0.204 4.145 4.350 -0.001 0.000 0.195 6349 E C 1.391 177.988 176.600 -0.004 0.000 0.992 6349 E CA 1.352 57.752 56.400 -0.000 0.000 0.804 6349 E CB -0.209 29.491 29.700 0.000 0.000 0.741 6349 E HN 0.661 nan 8.360 nan 0.000 0.458 6350 N N -0.417 118.281 118.700 -0.002 0.000 2.461 6350 N HA -0.004 4.735 4.740 -0.001 0.000 0.188 6350 N C 0.769 176.267 175.510 -0.020 0.000 1.134 6350 N CA 0.935 53.978 53.050 -0.013 0.000 0.878 6350 N CB 0.907 39.389 38.487 -0.007 0.000 0.972 6350 N HN 0.343 nan 8.380 nan 0.000 0.456 6351 G N 0.458 109.252 108.800 -0.010 0.000 2.147 6351 G HA2 -0.259 3.700 3.960 -0.001 0.000 0.244 6351 G HA3 -0.259 3.700 3.960 -0.001 0.000 0.244 6351 G C -0.002 174.896 174.900 -0.004 0.000 1.005 6351 G CA 0.048 45.142 45.100 -0.010 0.000 0.713 6351 G HN 0.197 nan 8.290 nan 0.000 0.515 6352 V N 1.479 121.397 119.914 0.007 0.000 2.222 6352 V HA 0.504 4.623 4.120 -0.001 0.000 0.253 6352 V C 0.829 176.939 176.094 0.026 0.000 1.210 6352 V CA 0.157 62.472 62.300 0.024 0.000 1.079 6352 V CB 0.410 32.261 31.823 0.047 0.000 1.265 6352 V HN 1.047 nan 8.190 nan 0.000 0.494 6353 V N 1.926 121.852 119.914 0.020 0.000 3.130 6353 V HA 0.939 5.058 4.120 -0.001 0.000 0.310 6353 V C -0.760 175.345 176.094 0.018 0.000 1.158 6353 V CA -0.909 61.403 62.300 0.019 0.000 1.029 6353 V CB 2.437 34.268 31.823 0.014 0.000 1.057 6353 V HN 0.777 nan 8.190 nan 0.000 0.436 6354 E N 0.955 121.165 120.200 0.017 0.000 2.390 6354 E HA 0.658 5.007 4.350 -0.001 0.000 0.277 6354 E C -3.278 173.330 176.600 0.013 0.000 0.939 6354 E CA -2.370 54.039 56.400 0.015 0.000 0.769 6354 E CB 2.337 32.046 29.700 0.015 0.000 1.251 6354 E HN 0.453 nan 8.360 nan 0.000 0.450 6355 P HA -0.046 nan 4.420 nan 0.000 0.266 6355 P C 0.518 177.826 177.300 0.013 0.000 1.195 6355 P CA -0.339 62.768 63.100 0.012 0.000 0.768 6355 P CB 0.507 32.213 31.700 0.010 0.000 0.838 6356 L N 4.473 125.704 121.223 0.014 0.000 2.012 6356 L HA -0.174 4.166 4.340 -0.001 0.000 0.210 6356 L C 2.418 179.297 176.870 0.016 0.000 1.073 6356 L CA 1.865 56.714 54.840 0.016 0.000 0.748 6356 L CB -0.835 41.235 42.059 0.017 0.000 0.891 6356 L HN 0.311 nan 8.230 nan 0.000 0.431 6357 R N -0.968 119.540 120.500 0.014 0.000 2.133 6357 R HA -0.187 4.153 4.340 -0.001 0.000 0.247 6357 R C 2.030 178.337 176.300 0.012 0.000 1.151 6357 R CA 2.133 58.241 56.100 0.013 0.000 0.971 6357 R CB -0.405 29.902 30.300 0.012 0.000 0.866 6357 R HN 0.395 nan 8.270 nan 0.000 0.447 6358 V N 1.042 120.963 119.914 0.011 0.000 2.295 6358 V HA -0.237 3.883 4.120 -0.001 0.000 0.246 6358 V C 2.332 178.431 176.094 0.007 0.000 1.049 6358 V CA 2.082 64.387 62.300 0.008 0.000 1.024 6358 V CB -0.482 31.345 31.823 0.008 0.000 0.648 6358 V HN 0.283 nan 8.190 nan 0.000 0.447 6359 K N 0.792 121.198 120.400 0.009 0.000 2.103 6359 K HA -0.123 4.196 4.320 -0.001 0.000 0.204 6359 K C 2.225 178.833 176.600 0.014 0.000 1.052 6359 K CA 1.933 58.225 56.287 0.008 0.000 0.945 6359 K CB -0.670 31.837 32.500 0.011 0.000 0.722 6359 K HN 0.677 nan 8.250 nan 0.000 0.443 6360 T N -2.123 112.442 114.554 0.019 0.000 2.942 6360 T HA -0.072 4.277 4.350 -0.001 0.000 0.265 6360 T C 1.875 176.591 174.700 0.026 0.000 1.062 6360 T CA 0.820 62.936 62.100 0.027 0.000 1.139 6360 T CB -0.154 68.730 68.868 0.027 0.000 0.883 6360 T HN 0.104 nan 8.240 nan 0.000 0.468 6361 Q N 1.899 121.711 119.800 0.019 0.000 2.123 6361 Q HA 0.259 4.598 4.340 -0.001 0.000 0.199 6361 Q C 2.417 178.426 176.000 0.015 0.000 0.966 6361 Q CA 1.724 57.537 55.803 0.017 0.000 0.845 6361 Q CB -0.995 27.751 28.738 0.013 0.000 0.907 6361 Q HN 0.627 nan 8.270 nan 0.000 0.439 6362 A N 0.574 123.400 122.820 0.009 0.000 1.908 6362 A HA -0.170 4.150 4.320 -0.001 0.000 0.218 6362 A C 1.946 179.531 177.584 0.003 0.000 1.181 6362 A CA 1.643 53.679 52.037 -0.001 0.000 0.627 6362 A CB -0.718 18.274 19.000 -0.012 0.000 0.818 6362 A HN 0.453 nan 8.150 nan 0.000 0.445 6363 I N -0.471 120.110 120.570 0.019 0.000 2.202 6363 I HA -0.206 3.963 4.170 -0.001 0.000 0.242 6363 I C 2.645 178.806 176.117 0.072 0.000 1.091 6363 I CA 1.936 63.266 61.300 0.051 0.000 1.368 6363 I CB -1.434 36.615 38.000 0.082 0.000 1.058 6363 I HN 0.470 nan 8.210 nan 0.000 0.410 6364 Q N 1.262 121.095 119.800 0.055 0.000 2.030 6364 Q HA -0.161 4.178 4.340 -0.001 0.000 0.204 6364 Q C 2.412 178.441 176.000 0.048 0.000 0.986 6364 Q CA 2.592 58.427 55.803 0.052 0.000 0.843 6364 Q CB -0.300 28.460 28.738 0.037 0.000 0.904 6364 Q HN 0.345 nan 8.270 nan 0.000 0.420 6365 S N 0.011 115.732 115.700 0.034 0.000 2.368 6365 S HA -0.096 4.373 4.470 -0.001 0.000 0.225 6365 S C 1.901 176.520 174.600 0.031 0.000 1.030 6365 S CA 0.970 59.187 58.200 0.028 0.000 0.999 6365 S CB -0.630 62.581 63.200 0.017 0.000 0.844 6365 S HN 0.595 nan 8.310 nan 0.000 0.459 6366 A N 1.568 124.403 122.820 0.025 0.000 1.877 6366 A HA 0.127 4.446 4.320 -0.001 0.000 0.216 6366 A C 2.353 179.968 177.584 0.053 0.000 1.186 6366 A CA 1.709 53.756 52.037 0.016 0.000 0.620 6366 A CB -1.108 17.878 19.000 -0.025 0.000 0.822 6366 A HN 0.508 nan 8.150 nan 0.000 0.443 6367 A N 0.737 123.616 122.820 0.097 0.000 1.898 6367 A HA -0.172 4.148 4.320 -0.001 0.000 0.216 6367 A C 1.996 179.660 177.584 0.133 0.000 1.181 6367 A CA 1.740 53.877 52.037 0.168 0.000 0.620 6367 A CB -0.639 18.484 19.000 0.206 0.000 0.819 6367 A HN 0.786 nan 8.150 nan 0.000 0.442 6368 E N 0.286 120.541 120.200 0.091 0.000 2.208 6368 E HA -0.117 4.233 4.350 -0.001 0.000 0.193 6368 E C 1.819 178.458 176.600 0.065 0.000 0.988 6368 E CA 1.396 57.839 56.400 0.072 0.000 0.828 6368 E CB -0.344 29.387 29.700 0.052 0.000 0.763 6368 E HN 0.634 nan 8.360 nan 0.000 0.478 6369 S N 0.288 116.025 115.700 0.061 0.000 2.446 6369 S HA -0.038 4.432 4.470 -0.001 0.000 0.225 6369 S C 2.005 176.642 174.600 0.063 0.000 1.016 6369 S CA 0.948 59.178 58.200 0.050 0.000 0.943 6369 S CB -0.277 62.944 63.200 0.035 0.000 0.786 6369 S HN 0.205 nan 8.310 nan 0.000 0.508 6370 T N 2.292 116.900 114.554 0.089 0.000 2.737 6370 T HA -0.043 4.306 4.350 -0.001 0.000 0.265 6370 T C 1.737 176.519 174.700 0.136 0.000 1.038 6370 T CA 1.571 63.748 62.100 0.128 0.000 1.144 6370 T CB -0.384 68.601 68.868 0.196 0.000 0.866 6370 T HN 0.661 nan 8.240 nan 0.000 0.434 6371 E N 0.717 120.999 120.200 0.137 0.000 2.110 6371 E HA -0.138 4.211 4.350 -0.001 0.000 0.193 6371 E C 2.231 178.869 176.600 0.063 0.000 0.988 6371 E CA 0.849 57.309 56.400 0.099 0.000 0.804 6371 E CB -0.210 29.545 29.700 0.092 0.000 0.745 6371 E HN 0.451 nan 8.360 nan 0.000 0.458 6372 M N 0.686 120.321 119.600 0.059 0.000 2.073 6372 M HA -0.234 4.245 4.480 -0.001 0.000 0.258 6372 M C 2.359 178.683 176.300 0.040 0.000 1.070 6372 M CA 1.598 56.925 55.300 0.044 0.000 1.103 6372 M CB -0.201 32.423 32.600 0.041 0.000 1.321 6372 M HN 0.338 nan 8.290 nan 0.000 0.405 6373 L N 0.527 121.777 121.223 0.045 0.000 2.012 6373 L HA -0.241 4.098 4.340 -0.001 0.000 0.210 6373 L C 2.248 179.137 176.870 0.031 0.000 1.073 6373 L CA 1.451 56.314 54.840 0.038 0.000 0.748 6373 L CB -0.323 41.759 42.059 0.038 0.000 0.891 6373 L HN 0.419 nan 8.230 nan 0.000 0.431 6374 L N -0.685 120.559 121.223 0.034 0.000 2.131 6374 L HA -0.212 4.128 4.340 -0.001 0.000 0.210 6374 L C 2.683 179.560 176.870 0.011 0.000 1.092 6374 L CA 1.129 55.978 54.840 0.015 0.000 0.759 6374 L CB -0.468 41.598 42.059 0.013 0.000 0.903 6374 L HN 0.246 nan 8.230 nan 0.000 0.435 6375 R N -0.202 120.311 120.500 0.022 0.000 2.189 6375 R HA 0.062 4.401 4.340 -0.001 0.000 0.218 6375 R C 0.434 176.746 176.300 0.019 0.000 1.074 6375 R CA 0.525 56.638 56.100 0.021 0.000 0.991 6375 R CB -0.070 30.245 30.300 0.025 0.000 0.883 6375 R HN 0.278 nan 8.270 nan 0.000 0.457 6376 I N 0.834 121.417 120.570 0.020 0.000 2.331 6376 I HA 0.040 4.209 4.170 -0.001 0.000 0.292 6376 I C 0.265 176.392 176.117 0.017 0.000 0.998 6376 I CA 0.024 61.337 61.300 0.021 0.000 1.267 6376 I CB 1.519 39.536 38.000 0.028 0.000 1.386 6376 I HN -0.117 nan 8.210 nan 0.000 0.476 6377 D N 3.373 123.783 120.400 0.016 0.000 2.539 6377 D HA 0.110 4.750 4.640 -0.001 0.000 0.232 6377 D C -0.798 175.513 176.300 0.019 0.000 1.256 6377 D CA 0.238 54.245 54.000 0.011 0.000 0.810 6377 D CB 0.514 41.315 40.800 0.002 0.000 1.090 6377 D HN 0.432 nan 8.370 nan 0.000 0.519 6378 D N 0.037 120.451 120.400 0.023 0.000 2.861 6378 D HA 0.199 4.838 4.640 -0.001 0.000 0.216 6378 D C -1.362 174.952 176.300 0.024 0.000 1.323 6378 D CA -0.403 53.611 54.000 0.024 0.000 0.917 6378 D CB 1.903 42.714 40.800 0.018 0.000 1.582 6378 D HN -0.263 nan 8.370 nan 0.000 0.576 6379 V N 5.178 125.109 119.914 0.028 0.000 2.347 6379 V HA 0.477 4.596 4.120 -0.001 0.000 0.280 6379 V C 0.410 176.511 176.094 0.010 0.000 1.021 6379 V CA -0.551 61.761 62.300 0.021 0.000 0.847 6379 V CB 1.274 33.114 31.823 0.028 0.000 0.990 6379 V HN 0.477 nan 8.190 nan 0.000 0.444 6380 I N 4.915 125.487 120.570 0.003 0.000 2.371 6380 I HA 0.645 4.815 4.170 -0.001 0.000 0.282 6380 I C 0.397 176.509 176.117 -0.009 0.000 1.031 6380 I CA -0.208 61.091 61.300 -0.001 0.000 1.180 6380 I CB 1.290 39.291 38.000 0.001 0.000 1.336 6380 I HN 0.657 nan 8.210 nan 0.000 0.467 6381 A N 4.865 127.676 122.820 -0.015 0.000 2.337 6381 A HA 0.890 5.209 4.320 -0.001 0.000 0.329 6381 A C 0.107 177.681 177.584 -0.017 0.000 1.146 6381 A CA -0.499 51.524 52.037 -0.023 0.000 0.800 6381 A CB 1.204 20.180 19.000 -0.039 0.000 1.220 6381 A HN 0.718 nan 8.150 nan 0.000 0.472 6382 A N 1.766 124.576 122.820 -0.016 0.000 2.313 6382 A HA 0.547 4.867 4.320 -0.001 0.000 0.261 6382 A C 0.413 177.989 177.584 -0.014 0.000 1.090 6382 A CA -0.270 51.760 52.037 -0.013 0.000 0.807 6382 A CB -0.176 18.818 19.000 -0.010 0.000 1.055 6382 A HN 0.893 nan 8.150 nan 0.000 0.492 6383 E N 0.000 120.193 120.200 -0.011 0.000 2.725 6383 E HA 0.000 4.350 4.350 -0.001 0.000 0.291 6383 E CA 0.000 56.394 56.400 -0.011 0.000 0.976 6383 E CB 0.000 29.695 29.700 -0.008 0.000 0.812 6383 E HN 0.000 nan 8.360 nan 0.000 0.440