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_E DATA FIRST_RESID 1965 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 1965 V HA 0.000 nan 4.120 nan 0.000 0.244 1965 V C 0.000 176.088 176.094 -0.010 0.000 1.182 1965 V CA 0.000 62.293 62.300 -0.011 0.000 1.235 1965 V CB 0.000 31.816 31.823 -0.012 0.000 1.184 1966 L N 1.834 123.050 121.223 -0.012 0.000 2.352 1966 L HA 0.608 4.947 4.340 -0.001 0.000 0.269 1966 L C -2.291 174.574 176.870 -0.009 0.000 1.034 1966 L CA -1.673 53.161 54.840 -0.010 0.000 0.806 1966 L CB 0.690 42.741 42.059 -0.012 0.000 1.244 1966 L HN 0.139 nan 8.230 nan 0.000 0.447 1967 P HA 0.011 nan 4.420 nan 0.000 0.265 1967 P C -0.657 176.641 177.300 -0.004 0.000 1.193 1967 P CA -0.259 62.839 63.100 -0.003 0.000 0.765 1967 P CB 0.394 32.094 31.700 -0.001 0.000 0.823 1968 E N 2.893 123.091 120.200 -0.004 0.000 2.480 1968 E HA -0.051 4.299 4.350 -0.001 0.000 0.258 1968 E C 0.689 177.288 176.600 -0.001 0.000 0.984 1968 E CA 0.950 57.347 56.400 -0.005 0.000 0.930 1968 E CB -0.320 29.377 29.700 -0.005 0.000 0.936 1968 E HN 0.533 nan 8.360 nan 0.000 0.466 1969 N N 2.101 120.801 118.700 -0.000 0.000 2.879 1969 N HA -0.188 4.551 4.740 -0.001 0.000 0.156 1969 N C -0.659 174.860 175.510 0.014 0.000 1.554 1969 N CA 0.891 53.945 53.050 0.007 0.000 2.252 1969 N CB -1.206 37.287 38.487 0.010 0.000 1.232 1969 N HN 0.542 nan 8.380 nan 0.000 0.861 1970 M N 1.659 121.264 119.600 0.009 0.000 2.249 1970 M HA 0.319 4.799 4.480 -0.001 0.000 0.351 1970 M C -0.763 175.539 176.300 0.004 0.000 1.180 1970 M CA -0.097 55.213 55.300 0.017 0.000 1.127 1970 M CB 0.597 33.203 32.600 0.010 0.000 1.546 1970 M HN -0.046 nan 8.290 nan 0.000 0.461 1971 K N 4.160 124.575 120.400 0.024 0.000 2.267 1971 K HA 0.613 4.933 4.320 -0.001 0.000 0.246 1971 K C -1.005 175.570 176.600 -0.040 0.000 0.954 1971 K CA -0.758 55.505 56.287 -0.039 0.000 0.824 1971 K CB 1.851 34.341 32.500 -0.017 0.000 1.167 1971 K HN 0.674 nan 8.250 nan 0.000 0.431 1972 R N 1.575 121.951 120.500 -0.206 0.000 2.686 1972 R HA 0.446 4.786 4.340 -0.001 0.000 0.286 1972 R C -0.905 175.167 176.300 -0.380 0.000 0.969 1972 R CA -0.753 55.266 56.100 -0.135 0.000 0.898 1972 R CB 1.274 31.533 30.300 -0.067 0.000 1.183 1972 R HN 0.558 nan 8.270 nan 0.000 0.456 1973 Y N 2.425 122.740 120.300 0.026 0.000 2.536 1973 Y HA 0.578 5.128 4.550 -0.000 0.000 0.347 1973 Y C 0.583 176.496 175.900 0.022 0.000 1.000 1973 Y CA -0.982 57.134 58.100 0.026 0.000 1.051 1973 Y CB 1.973 40.457 38.460 0.040 0.000 1.259 1973 Y HN 0.362 nan 8.280 nan 0.000 0.468 1974 M N 0.816 120.512 119.600 0.159 0.000 2.520 1974 M HA 0.783 5.263 4.480 -0.001 0.000 0.280 1974 M C 0.025 176.369 176.300 0.073 0.000 1.232 1974 M CA -0.240 55.113 55.300 0.089 0.000 0.892 1974 M CB 1.276 33.902 32.600 0.044 0.000 1.728 1974 M HN 0.892 nan 8.290 nan 0.000 0.475 1975 G N 2.728 111.558 108.800 0.050 0.000 2.561 1975 G HA2 -0.287 3.673 3.960 -0.001 0.000 0.289 1975 G HA3 -0.287 3.673 3.960 -0.001 0.000 0.289 1975 G C 0.672 175.590 174.900 0.031 0.000 1.169 1975 G CA 0.529 45.648 45.100 0.032 0.000 0.980 1975 G HN 0.842 nan 8.290 nan 0.000 0.550 1976 R N 1.082 121.596 120.500 0.023 0.000 2.152 1976 R HA -0.022 4.317 4.340 -0.001 0.000 0.232 1976 R C 2.101 178.420 176.300 0.032 0.000 1.117 1976 R CA 1.784 57.893 56.100 0.015 0.000 0.981 1976 R CB -0.794 29.511 30.300 0.007 0.000 0.870 1976 R HN 0.611 nan 8.270 nan 0.000 0.451 1977 D N 0.494 120.937 120.400 0.071 0.000 2.224 1977 D HA -0.032 4.608 4.640 -0.001 0.000 0.205 1977 D C 1.691 178.057 176.300 0.109 0.000 0.965 1977 D CA 1.156 55.231 54.000 0.125 0.000 0.852 1977 D CB -0.034 40.910 40.800 0.240 0.000 0.947 1977 D HN 0.169 nan 8.370 nan 0.000 0.494 1978 A N 0.656 123.540 122.820 0.108 0.000 1.929 1978 A HA -0.160 4.160 4.320 -0.001 0.000 0.216 1978 A C 2.092 179.694 177.584 0.030 0.000 1.176 1978 A CA 0.990 53.084 52.037 0.094 0.000 0.628 1978 A CB -0.205 18.851 19.000 0.092 0.000 0.816 1978 A HN 0.036 nan 8.150 nan 0.000 0.444 1979 Q N -0.443 119.364 119.800 0.012 0.000 2.016 1979 Q HA -0.173 4.167 4.340 -0.001 0.000 0.200 1979 Q C 2.252 178.227 176.000 -0.041 0.000 0.978 1979 Q CA 1.893 57.689 55.803 -0.012 0.000 0.833 1979 Q CB -0.469 28.260 28.738 -0.015 0.000 0.895 1979 Q HN 0.631 nan 8.270 nan 0.000 0.427 1980 R N 0.915 121.385 120.500 -0.051 0.000 2.075 1980 R HA -0.031 4.308 4.340 -0.001 0.000 0.232 1980 R C 2.183 178.387 176.300 -0.161 0.000 1.126 1980 R CA 1.523 57.572 56.100 -0.085 0.000 0.963 1980 R CB -0.617 29.644 30.300 -0.065 0.000 0.858 1980 R HN 0.306 nan 8.270 nan 0.000 0.435 1981 M N 0.296 119.760 119.600 -0.227 0.000 2.082 1981 M HA -0.231 4.248 4.480 -0.001 0.000 0.258 1981 M C 1.019 177.151 176.300 -0.280 0.000 1.069 1981 M CA 2.104 57.188 55.300 -0.359 0.000 1.102 1981 M CB -0.264 32.099 32.600 -0.396 0.000 1.336 1981 M HN 0.178 nan 8.290 nan 0.000 0.404 1982 N N 0.754 119.355 118.700 -0.165 0.000 2.188 1982 N HA -0.101 4.638 4.740 -0.001 0.000 0.184 1982 N C 1.655 177.072 175.510 -0.155 0.000 1.018 1982 N CA 1.364 54.318 53.050 -0.159 0.000 0.858 1982 N CB -0.428 38.040 38.487 -0.032 0.000 0.989 1982 N HN 0.395 nan 8.380 nan 0.000 0.426 1983 I N 0.549 121.050 120.570 -0.115 0.000 2.315 1983 I HA -0.142 4.028 4.170 -0.001 0.000 0.248 1983 I C 1.850 177.899 176.117 -0.114 0.000 1.117 1983 I CA 0.683 61.930 61.300 -0.089 0.000 1.404 1983 I CB -0.830 37.133 38.000 -0.061 0.000 1.071 1983 I HN 0.053 nan 8.210 nan 0.000 0.419 1984 L N 0.998 122.130 121.223 -0.151 0.000 2.093 1984 L HA -0.054 4.286 4.340 -0.001 0.000 0.208 1984 L C 2.722 179.488 176.870 -0.173 0.000 1.085 1984 L CA 1.811 56.560 54.840 -0.153 0.000 0.755 1984 L CB -1.338 40.614 42.059 -0.178 0.000 0.904 1984 L HN 0.168 nan 8.230 nan 0.000 0.435 1985 A N -0.550 122.114 122.820 -0.261 0.000 1.902 1985 A HA -0.112 4.207 4.320 -0.001 0.000 0.217 1985 A C 2.405 179.887 177.584 -0.170 0.000 1.181 1985 A CA 1.699 53.560 52.037 -0.294 0.000 0.623 1985 A CB -1.280 17.354 19.000 -0.610 0.000 0.818 1985 A HN 0.432 nan 8.150 nan 0.000 0.443 1986 G N -0.717 107.999 108.800 -0.141 0.000 2.422 1986 G HA2 -0.202 3.758 3.960 -0.001 0.000 0.218 1986 G HA3 -0.202 3.758 3.960 -0.001 0.000 0.218 1986 G C 1.672 176.530 174.900 -0.069 0.000 1.140 1986 G CA 1.139 46.190 45.100 -0.083 0.000 0.775 1986 G HN 0.520 nan 8.290 nan 0.000 0.545 1987 R N 0.636 121.090 120.500 -0.078 0.000 2.092 1987 R HA 0.109 4.448 4.340 -0.001 0.000 0.231 1987 R C 2.400 178.665 176.300 -0.058 0.000 1.119 1987 R CA 0.986 57.048 56.100 -0.064 0.000 0.970 1987 R CB -0.649 29.613 30.300 -0.065 0.000 0.864 1987 R HN 0.427 nan 8.270 nan 0.000 0.440 1988 I N 0.101 120.632 120.570 -0.066 0.000 2.127 1988 I HA -0.293 3.877 4.170 -0.001 0.000 0.241 1988 I C 1.775 177.867 176.117 -0.041 0.000 1.075 1988 I CA 1.063 62.332 61.300 -0.052 0.000 1.334 1988 I CB -0.283 37.684 38.000 -0.056 0.000 1.040 1988 I HN 0.140 nan 8.210 nan 0.000 0.405 1989 I N 0.900 121.445 120.570 -0.042 0.000 2.233 1989 I HA -0.202 3.967 4.170 -0.001 0.000 0.243 1989 I C 2.873 178.971 176.117 -0.032 0.000 1.093 1989 I CA 1.599 62.880 61.300 -0.031 0.000 1.380 1989 I CB -1.615 36.369 38.000 -0.027 0.000 1.067 1989 I HN 0.167 nan 8.210 nan 0.000 0.413 1990 A N 0.442 123.239 122.820 -0.038 0.000 1.940 1990 A HA -0.257 4.062 4.320 -0.001 0.000 0.219 1990 A C 2.282 179.843 177.584 -0.038 0.000 1.176 1990 A CA 2.097 54.111 52.037 -0.038 0.000 0.631 1990 A CB -0.573 18.401 19.000 -0.043 0.000 0.814 1990 A HN 0.407 nan 8.150 nan 0.000 0.446 1991 E N -0.495 119.683 120.200 -0.038 0.000 2.107 1991 E HA -0.081 4.269 4.350 -0.001 0.000 0.191 1991 E C 2.013 178.595 176.600 -0.031 0.000 0.982 1991 E CA 1.777 58.156 56.400 -0.035 0.000 0.809 1991 E CB -0.513 29.166 29.700 -0.035 0.000 0.756 1991 E HN 0.505 nan 8.360 nan 0.000 0.459 1992 T N 0.113 114.650 114.554 -0.029 0.000 2.746 1992 T HA -0.139 4.210 4.350 -0.001 0.000 0.267 1992 T C 1.880 176.565 174.700 -0.025 0.000 1.039 1992 T CA 1.789 63.874 62.100 -0.025 0.000 1.142 1992 T CB -0.320 68.535 68.868 -0.022 0.000 0.866 1992 T HN 0.267 nan 8.240 nan 0.000 0.444 1993 V N 1.862 121.760 119.914 -0.026 0.000 2.649 1993 V HA 0.014 4.134 4.120 -0.001 0.000 0.248 1993 V C 2.346 178.422 176.094 -0.030 0.000 1.054 1993 V CA 1.306 63.591 62.300 -0.026 0.000 1.073 1993 V CB -0.890 30.919 31.823 -0.025 0.000 0.699 1993 V HN 0.479 nan 8.190 nan 0.000 0.463 1994 R N 2.695 123.175 120.500 -0.033 0.000 2.241 1994 R HA -0.061 4.278 4.340 -0.001 0.000 0.224 1994 R C 2.014 178.291 176.300 -0.037 0.000 1.101 1994 R CA 1.590 57.667 56.100 -0.038 0.000 0.995 1994 R CB -0.983 29.293 30.300 -0.041 0.000 0.870 1994 R HN 0.689 nan 8.270 nan 0.000 0.463 1995 S N 0.029 115.709 115.700 -0.033 0.000 2.522 1995 S HA -0.073 4.396 4.470 -0.001 0.000 0.227 1995 S C 1.690 176.270 174.600 -0.033 0.000 0.986 1995 S CA 0.682 58.862 58.200 -0.033 0.000 0.929 1995 S CB 0.080 63.263 63.200 -0.029 0.000 0.769 1995 S HN 0.550 nan 8.310 nan 0.000 0.529 1996 T N -0.945 113.591 114.554 -0.031 0.000 3.069 1996 T HA 0.353 4.703 4.350 -0.001 0.000 0.252 1996 T C 0.322 175.003 174.700 -0.033 0.000 1.053 1996 T CA -0.522 61.561 62.100 -0.029 0.000 0.964 1996 T CB -0.435 68.419 68.868 -0.023 0.000 1.005 1996 T HN 0.258 nan 8.240 nan 0.000 0.532 1997 L N 2.928 124.128 121.223 -0.038 0.000 2.462 1997 L HA 0.519 4.858 4.340 -0.001 0.000 0.272 1997 L C 0.702 177.541 176.870 -0.052 0.000 1.166 1997 L CA 1.608 56.423 54.840 -0.041 0.000 0.880 1997 L CB -0.750 41.282 42.059 -0.044 0.000 1.142 1997 L HN 0.697 nan 8.230 nan 0.000 0.473 1998 G N 4.399 113.170 108.800 -0.048 0.000 2.663 1998 G HA2 -0.132 3.828 3.960 -0.001 0.000 0.686 1998 G HA3 -0.132 3.828 3.960 -0.001 0.000 0.686 1998 G C -2.067 172.788 174.900 -0.075 0.000 1.288 1998 G CA -0.340 44.719 45.100 -0.068 0.000 0.836 1998 G HN 0.552 nan 8.290 nan 0.000 0.584 1999 P HA 0.004 nan 4.420 nan 0.000 0.222 1999 P C 1.122 178.329 177.300 -0.155 0.000 1.147 1999 P CA 1.229 64.267 63.100 -0.102 0.000 0.790 1999 P CB 0.112 31.725 31.700 -0.145 0.000 0.780 2000 K N -0.208 120.064 120.400 -0.214 0.000 2.372 2000 K HA 0.272 4.591 4.320 -0.001 0.000 0.200 2000 K C 1.172 177.712 176.600 -0.100 0.000 1.022 2000 K CA -0.140 56.047 56.287 -0.166 0.000 1.125 2000 K CB -0.113 32.260 32.500 -0.212 0.000 0.855 2000 K HN 0.067 nan 8.250 nan 0.000 0.524 2001 G N 0.228 108.978 108.800 -0.082 0.000 2.616 2001 G HA2 0.245 4.204 3.960 -0.001 0.000 0.268 2001 G HA3 0.245 4.204 3.960 -0.001 0.000 0.268 2001 G C 0.018 174.893 174.900 -0.041 0.000 1.213 2001 G CA -0.513 44.553 45.100 -0.057 0.000 0.926 2001 G HN -0.069 nan 8.290 nan 0.000 0.523 2002 M N -0.044 119.536 119.600 -0.034 0.000 2.531 2002 M HA 0.401 4.880 4.480 -0.001 0.000 0.262 2002 M C -0.231 176.057 176.300 -0.021 0.000 1.168 2002 M CA -0.677 54.607 55.300 -0.026 0.000 0.926 2002 M CB 1.115 33.700 32.600 -0.025 0.000 1.445 2002 M HN 0.726 nan 8.290 nan 0.000 0.531 2003 D N -0.591 119.798 120.400 -0.018 0.000 2.493 2003 D HA 0.562 5.202 4.640 -0.001 0.000 0.239 2003 D C -1.301 174.989 176.300 -0.017 0.000 1.049 2003 D CA -0.763 53.228 54.000 -0.016 0.000 1.008 2003 D CB 1.271 42.063 40.800 -0.013 0.000 1.398 2003 D HN 0.116 nan 8.370 nan 0.000 0.513 2004 K N 0.345 120.735 120.400 -0.016 0.000 2.259 2004 K HA 0.397 4.716 4.320 -0.001 0.000 0.252 2004 K C -0.949 175.641 176.600 -0.017 0.000 0.936 2004 K CA -0.719 55.558 56.287 -0.016 0.000 0.810 2004 K CB 1.970 34.461 32.500 -0.014 0.000 1.143 2004 K HN 0.677 nan 8.250 nan 0.000 0.427 2005 M N 4.059 123.648 119.600 -0.019 0.000 2.047 2005 M HA 0.253 4.732 4.480 -0.001 0.000 0.342 2005 M C -1.494 174.796 176.300 -0.017 0.000 1.058 2005 M CA -0.972 54.315 55.300 -0.022 0.000 0.991 2005 M CB 0.366 32.950 32.600 -0.026 0.000 1.474 2005 M HN 0.347 nan 8.290 nan 0.000 0.419 2006 L N 6.056 127.270 121.223 -0.015 0.000 2.272 2006 L HA 0.522 4.862 4.340 -0.001 0.000 0.289 2006 L C -0.798 176.066 176.870 -0.011 0.000 1.032 2006 L CA -0.254 54.579 54.840 -0.011 0.000 0.810 2006 L CB 1.670 43.725 42.059 -0.008 0.000 1.205 2006 L HN 0.414 nan 8.230 nan 0.000 0.422 2007 V N 2.813 122.722 119.914 -0.009 0.000 2.407 2007 V HA 0.370 4.490 4.120 -0.001 0.000 0.291 2007 V C -0.352 175.739 176.094 -0.004 0.000 1.018 2007 V CA -0.940 61.355 62.300 -0.009 0.000 0.842 2007 V CB 1.528 33.345 31.823 -0.010 0.000 0.996 2007 V HN 0.806 nan 8.190 nan 0.000 0.426 2008 D N 2.244 122.643 120.400 -0.002 0.000 2.478 2008 D HA 0.094 4.733 4.640 -0.001 0.000 0.269 2008 D C 0.888 177.188 176.300 0.000 0.000 1.232 2008 D CA -0.495 53.505 54.000 -0.000 0.000 1.059 2008 D CB 0.705 41.505 40.800 0.001 0.000 1.104 2008 D HN 0.400 nan 8.370 nan 0.000 0.566 2009 D N -1.738 118.663 120.400 0.001 0.000 2.264 2009 D HA -0.088 4.551 4.640 -0.001 0.000 0.208 2009 D C 1.451 177.753 176.300 0.002 0.000 0.966 2009 D CA 0.625 54.626 54.000 0.002 0.000 0.864 2009 D CB 0.002 40.803 40.800 0.002 0.000 0.933 2009 D HN 0.185 nan 8.370 nan 0.000 0.499 2010 L N -1.006 120.218 121.223 0.003 0.000 2.558 2010 L HA 0.351 4.690 4.340 -0.001 0.000 0.225 2010 L C 1.952 178.824 176.870 0.004 0.000 1.128 2010 L CA 0.910 55.752 54.840 0.004 0.000 0.868 2010 L CB 0.145 42.207 42.059 0.004 0.000 1.006 2010 L HN 0.256 nan 8.230 nan 0.000 0.454 2011 G N -1.321 107.480 108.800 0.003 0.000 2.179 2011 G HA2 -0.254 3.706 3.960 -0.001 0.000 0.220 2011 G HA3 -0.254 3.706 3.960 -0.001 0.000 0.220 2011 G C 0.243 175.144 174.900 0.002 0.000 0.990 2011 G CA 0.101 45.202 45.100 0.002 0.000 0.646 2011 G HN 0.322 nan 8.290 nan 0.000 0.517 2012 D N 1.167 121.569 120.400 0.003 0.000 2.382 2012 D HA 0.394 5.033 4.640 -0.001 0.000 0.259 2012 D C 0.415 176.713 176.300 -0.003 0.000 1.224 2012 D CA 0.161 54.164 54.000 0.005 0.000 0.894 2012 D CB 1.099 41.903 40.800 0.008 0.000 1.127 2012 D HN 0.194 nan 8.370 nan 0.000 0.487 2013 V N 4.990 124.899 119.914 -0.009 0.000 2.347 2013 V HA 0.281 4.400 4.120 -0.001 0.000 0.280 2013 V C 0.128 176.205 176.094 -0.029 0.000 1.021 2013 V CA -0.794 61.491 62.300 -0.025 0.000 0.847 2013 V CB 1.582 33.379 31.823 -0.043 0.000 0.990 2013 V HN 0.334 nan 8.190 nan 0.000 0.444 2014 V N 6.043 125.944 119.914 -0.022 0.000 2.378 2014 V HA 0.449 4.569 4.120 -0.001 0.000 0.288 2014 V C -0.222 175.858 176.094 -0.022 0.000 1.016 2014 V CA -0.561 61.729 62.300 -0.017 0.000 0.840 2014 V CB 1.943 33.763 31.823 -0.004 0.000 0.994 2014 V HN 0.589 nan 8.190 nan 0.000 0.431 2015 V N 4.447 124.343 119.914 -0.029 0.000 2.357 2015 V HA 0.769 4.889 4.120 -0.001 0.000 0.284 2015 V C 0.104 176.189 176.094 -0.014 0.000 1.018 2015 V CA 0.020 62.303 62.300 -0.028 0.000 0.841 2015 V CB 1.587 33.384 31.823 -0.044 0.000 0.991 2015 V HN 0.976 nan 8.190 nan 0.000 0.437 2016 T N 2.641 117.189 114.554 -0.011 0.000 2.739 2016 T HA 0.305 4.655 4.350 -0.001 0.000 0.303 2016 T C 0.129 174.825 174.700 -0.007 0.000 1.389 2016 T CA -0.360 61.737 62.100 -0.005 0.000 1.001 2016 T CB 2.058 70.925 68.868 -0.001 0.000 1.436 2016 T HN 0.601 nan 8.240 nan 0.000 0.500 2017 N N 0.324 119.022 118.700 -0.004 0.000 2.210 2017 N HA 0.085 4.825 4.740 -0.001 0.000 0.203 2017 N C -0.779 174.728 175.510 -0.006 0.000 1.175 2017 N CA -0.019 53.027 53.050 -0.006 0.000 0.894 2017 N CB 0.445 38.929 38.487 -0.004 0.000 1.041 2017 N HN 0.552 nan 8.380 nan 0.000 0.506 2018 D N 0.357 120.756 120.400 -0.003 0.000 2.450 2018 D HA 0.093 4.733 4.640 -0.001 0.000 0.247 2018 D C 1.281 177.579 176.300 -0.004 0.000 1.162 2018 D CA 0.174 54.173 54.000 -0.002 0.000 0.879 2018 D CB 1.276 42.077 40.800 0.001 0.000 1.163 2018 D HN 0.290 nan 8.370 nan 0.000 0.472 2019 G N 1.657 110.453 108.800 -0.006 0.000 2.414 2019 G HA2 -0.206 3.753 3.960 -0.001 0.000 0.215 2019 G HA3 -0.206 3.753 3.960 -0.001 0.000 0.215 2019 G C 1.496 176.393 174.900 -0.005 0.000 1.188 2019 G CA 0.303 45.398 45.100 -0.008 0.000 0.783 2019 G HN 0.452 nan 8.290 nan 0.000 0.537 2020 V N 0.825 120.738 119.914 -0.003 0.000 2.515 2020 V HA -0.102 4.018 4.120 -0.001 0.000 0.250 2020 V C 2.969 179.063 176.094 0.000 0.000 1.058 2020 V CA 2.739 65.038 62.300 -0.001 0.000 1.064 2020 V CB -0.562 31.262 31.823 0.001 0.000 0.675 2020 V HN 0.400 nan 8.190 nan 0.000 0.461 2021 T N 0.564 115.118 114.554 0.000 0.000 2.777 2021 T HA -0.076 4.274 4.350 -0.001 0.000 0.266 2021 T C 1.752 176.452 174.700 -0.000 0.000 1.040 2021 T CA 1.968 64.068 62.100 0.001 0.000 1.141 2021 T CB -0.256 68.612 68.868 0.001 0.000 0.868 2021 T HN 0.461 nan 8.240 nan 0.000 0.444 2022 I N 0.629 121.198 120.570 -0.002 0.000 2.208 2022 I HA -0.146 4.024 4.170 -0.001 0.000 0.245 2022 I C 1.981 178.097 176.117 -0.002 0.000 1.097 2022 I CA 0.943 62.241 61.300 -0.003 0.000 1.363 2022 I CB -0.265 37.731 38.000 -0.006 0.000 1.051 2022 I HN 0.162 nan 8.210 nan 0.000 0.413 2023 L N 0.171 121.393 121.223 -0.001 0.000 2.217 2023 L HA -0.079 4.261 4.340 -0.001 0.000 0.211 2023 L C 2.458 179.330 176.870 0.004 0.000 1.107 2023 L CA 1.560 56.401 54.840 0.001 0.000 0.783 2023 L CB -0.752 41.308 42.059 0.001 0.000 0.919 2023 L HN 0.104 nan 8.230 nan 0.000 0.442 2024 R N -1.070 119.431 120.500 0.003 0.000 2.100 2024 R HA -0.035 4.305 4.340 -0.001 0.000 0.220 2024 R C 1.963 178.266 176.300 0.004 0.000 1.091 2024 R CA 0.661 56.763 56.100 0.004 0.000 0.986 2024 R CB 0.002 30.304 30.300 0.004 0.000 0.888 2024 R HN 0.273 nan 8.270 nan 0.000 0.444 2025 E N 0.986 121.188 120.200 0.003 0.000 2.086 2025 E HA -0.059 4.291 4.350 -0.001 0.000 0.190 2025 E C 1.284 177.885 176.600 0.002 0.000 0.975 2025 E CA 0.562 56.963 56.400 0.002 0.000 0.813 2025 E CB -0.105 29.595 29.700 0.001 0.000 0.768 2025 E HN 0.333 nan 8.360 nan 0.000 0.457 2026 M N -0.209 119.392 119.600 0.002 0.000 2.184 2026 M HA 0.099 4.578 4.480 -0.001 0.000 0.296 2026 M C 0.517 176.821 176.300 0.005 0.000 1.165 2026 M CA 0.360 55.661 55.300 0.002 0.000 1.175 2026 M CB 0.479 33.080 32.600 0.001 0.000 1.392 2026 M HN -0.239 nan 8.290 nan 0.000 0.457 2027 S N 1.534 117.238 115.700 0.007 0.000 2.466 2027 S HA 0.491 4.960 4.470 -0.001 0.000 0.313 2027 S C -0.895 173.714 174.600 0.015 0.000 1.078 2027 S CA -0.805 57.401 58.200 0.010 0.000 1.115 2027 S CB -0.012 63.193 63.200 0.010 0.000 1.006 2027 S HN 0.508 nan 8.310 nan 0.000 0.487 2028 V N 5.733 125.658 119.914 0.018 0.000 2.439 2028 V HA 0.426 4.545 4.120 -0.001 0.000 0.282 2028 V C 0.610 176.725 176.094 0.035 0.000 1.039 2028 V CA -0.406 61.911 62.300 0.028 0.000 0.913 2028 V CB 1.624 33.463 31.823 0.027 0.000 0.983 2028 V HN 0.793 nan 8.190 nan 0.000 0.460 2029 E N 1.145 121.377 120.200 0.052 0.000 2.228 2029 E HA 0.091 4.441 4.350 -0.001 0.000 0.197 2029 E C 0.723 177.358 176.600 0.058 0.000 0.909 2029 E CA 0.112 56.540 56.400 0.046 0.000 0.911 2029 E CB -0.005 29.722 29.700 0.044 0.000 0.887 2029 E HN 0.693 nan 8.360 nan 0.000 0.481 2030 H N 2.737 121.811 119.070 0.006 0.000 2.886 2030 H HA 0.043 4.598 4.556 -0.001 0.000 0.329 2030 H C -1.713 173.618 175.328 0.005 0.000 1.044 2030 H CA -1.408 54.644 56.048 0.007 0.000 1.456 2030 H CB 1.527 31.289 29.762 -0.001 0.000 1.464 2030 H HN -0.206 nan 8.280 nan 0.000 0.573 2031 P HA -0.147 nan 4.420 nan 0.000 0.216 2031 P C 1.075 178.485 177.300 0.183 0.000 1.150 2031 P CA 2.022 65.156 63.100 0.058 0.000 0.843 2031 P CB 0.119 31.793 31.700 -0.042 0.000 0.787 2032 A N 0.014 123.098 122.820 0.439 0.000 1.877 2032 A HA -0.091 4.229 4.320 -0.001 0.000 0.216 2032 A C 2.329 179.963 177.584 0.082 0.000 1.186 2032 A CA 2.078 54.234 52.037 0.198 0.000 0.620 2032 A CB -1.566 17.459 19.000 0.043 0.000 0.822 2032 A HN 0.201 nan 8.150 nan 0.000 0.443 2033 A N -0.364 122.506 122.820 0.083 0.000 1.969 2033 A HA -0.103 4.216 4.320 -0.001 0.000 0.218 2033 A C 2.078 179.688 177.584 0.043 0.000 1.169 2033 A CA 1.659 53.716 52.037 0.034 0.000 0.635 2033 A CB -0.360 18.656 19.000 0.027 0.000 0.810 2033 A HN 0.542 nan 8.150 nan 0.000 0.445 2034 K N -0.958 119.480 120.400 0.065 0.000 2.097 2034 K HA -0.034 4.285 4.320 -0.001 0.000 0.205 2034 K C 1.855 178.476 176.600 0.035 0.000 1.050 2034 K CA 1.293 57.606 56.287 0.043 0.000 0.938 2034 K CB -0.190 32.334 32.500 0.041 0.000 0.718 2034 K HN 0.347 nan 8.250 nan 0.000 0.442 2035 M N 0.622 120.247 119.600 0.041 0.000 2.288 2035 M HA -0.051 4.428 4.480 -0.001 0.000 0.266 2035 M C 2.168 178.482 176.300 0.024 0.000 1.072 2035 M CA 1.034 56.353 55.300 0.032 0.000 1.132 2035 M CB -0.669 31.954 32.600 0.037 0.000 1.386 2035 M HN 0.200 nan 8.290 nan 0.000 0.432 2036 L N 0.368 121.604 121.223 0.021 0.000 2.046 2036 L HA -0.216 4.123 4.340 -0.001 0.000 0.208 2036 L C 2.224 179.099 176.870 0.009 0.000 1.077 2036 L CA 1.223 56.069 54.840 0.010 0.000 0.747 2036 L CB -0.174 41.885 42.059 0.001 0.000 0.896 2036 L HN 0.156 nan 8.230 nan 0.000 0.432 2037 I N -0.331 120.246 120.570 0.012 0.000 2.208 2037 I HA -0.284 3.885 4.170 -0.001 0.000 0.245 2037 I C 2.468 178.591 176.117 0.010 0.000 1.097 2037 I CA 1.054 62.360 61.300 0.009 0.000 1.363 2037 I CB -0.403 37.604 38.000 0.012 0.000 1.051 2037 I HN 0.311 nan 8.210 nan 0.000 0.413 2038 E N 0.467 120.674 120.200 0.013 0.000 2.118 2038 E HA -0.165 4.185 4.350 -0.001 0.000 0.195 2038 E C 2.419 179.026 176.600 0.011 0.000 0.992 2038 E CA 1.161 57.568 56.400 0.012 0.000 0.804 2038 E CB -0.259 29.450 29.700 0.015 0.000 0.741 2038 E HN 0.367 nan 8.360 nan 0.000 0.458 2039 V N 1.470 121.391 119.914 0.011 0.000 2.358 2039 V HA -0.219 3.900 4.120 -0.001 0.000 0.246 2039 V C 2.462 178.559 176.094 0.006 0.000 1.047 2039 V CA 1.714 64.020 62.300 0.010 0.000 1.035 2039 V CB -0.808 31.021 31.823 0.009 0.000 0.658 2039 V HN 0.239 nan 8.190 nan 0.000 0.452 2040 A N -0.316 122.506 122.820 0.004 0.000 1.933 2040 A HA -0.224 4.096 4.320 -0.001 0.000 0.218 2040 A C 2.284 179.869 177.584 0.003 0.000 1.175 2040 A CA 1.825 53.862 52.037 0.001 0.000 0.628 2040 A CB -0.400 18.599 19.000 -0.000 0.000 0.814 2040 A HN 0.543 nan 8.150 nan 0.000 0.444 2041 K N -0.931 119.472 120.400 0.005 0.000 2.155 2041 K HA -0.062 4.258 4.320 -0.001 0.000 0.203 2041 K C 1.971 178.574 176.600 0.006 0.000 1.052 2041 K CA 1.513 57.803 56.287 0.005 0.000 0.948 2041 K CB -0.279 32.225 32.500 0.006 0.000 0.728 2041 K HN 0.460 nan 8.250 nan 0.000 0.448 2042 T N 1.191 115.749 114.554 0.007 0.000 2.777 2042 T HA -0.182 4.168 4.350 -0.001 0.000 0.266 2042 T C 1.830 176.534 174.700 0.007 0.000 1.040 2042 T CA 1.361 63.466 62.100 0.008 0.000 1.141 2042 T CB -0.128 68.746 68.868 0.010 0.000 0.868 2042 T HN 0.179 nan 8.240 nan 0.000 0.444 2043 Q N 1.394 121.197 119.800 0.005 0.000 2.096 2043 Q HA -0.128 4.212 4.340 -0.001 0.000 0.204 2043 Q C 2.099 178.102 176.000 0.004 0.000 0.982 2043 Q CA 1.922 57.727 55.803 0.004 0.000 0.850 2043 Q CB -0.264 28.474 28.738 0.001 0.000 0.901 2043 Q HN 0.679 nan 8.270 nan 0.000 0.422 2044 E N -0.740 119.462 120.200 0.003 0.000 2.072 2044 E HA -0.184 4.166 4.350 -0.001 0.000 0.191 2044 E C 1.591 178.194 176.600 0.004 0.000 0.985 2044 E CA 0.975 57.377 56.400 0.003 0.000 0.801 2044 E CB 0.062 29.764 29.700 0.003 0.000 0.750 2044 E HN 0.139 nan 8.360 nan 0.000 0.452 2045 K N 0.371 120.774 120.400 0.004 0.000 2.147 2045 K HA -0.116 4.204 4.320 -0.001 0.000 0.205 2045 K C 1.940 178.543 176.600 0.005 0.000 1.049 2045 K CA 1.000 57.290 56.287 0.005 0.000 0.936 2045 K CB 0.026 32.529 32.500 0.005 0.000 0.722 2045 K HN 0.239 nan 8.250 nan 0.000 0.446 2046 E N -0.011 120.193 120.200 0.006 0.000 2.045 2046 E HA -0.022 4.328 4.350 -0.001 0.000 0.190 2046 E C 2.228 178.831 176.600 0.006 0.000 0.968 2046 E CA 0.758 57.162 56.400 0.006 0.000 0.813 2046 E CB -0.048 29.657 29.700 0.008 0.000 0.780 2046 E HN -0.025 nan 8.360 nan 0.000 0.455 2047 V N -0.788 119.129 119.914 0.006 0.000 2.788 2047 V HA 0.207 4.327 4.120 -0.001 0.000 0.241 2047 V C 1.678 177.776 176.094 0.005 0.000 1.083 2047 V CA 1.159 63.462 62.300 0.006 0.000 1.103 2047 V CB 0.278 32.104 31.823 0.005 0.000 0.800 2047 V HN 0.509 nan 8.190 nan 0.000 0.476 2048 G N 0.297 109.099 108.800 0.004 0.000 4.677 2048 G HA2 -0.277 3.683 3.960 -0.001 0.000 0.215 2048 G HA3 -0.277 3.683 3.960 -0.001 0.000 0.215 2048 G C 0.168 175.070 174.900 0.004 0.000 1.506 2048 G CA 0.326 45.429 45.100 0.004 0.000 1.016 2048 G HN 0.481 nan 8.290 nan 0.000 0.653 2049 D N 1.670 122.073 120.400 0.005 0.000 2.377 2049 D HA 0.486 5.125 4.640 -0.001 0.000 0.245 2049 D C 1.482 177.784 176.300 0.003 0.000 1.196 2049 D CA 1.590 55.593 54.000 0.005 0.000 0.962 2049 D CB 0.389 41.194 40.800 0.008 0.000 1.127 2049 D HN 1.800 nan 8.370 nan 0.000 0.471 2050 G N 0.235 109.035 108.800 0.001 0.000 2.147 2050 G HA2 -0.303 3.657 3.960 -0.001 0.000 0.244 2050 G HA3 -0.303 3.657 3.960 -0.001 0.000 0.244 2050 G C 1.020 175.916 174.900 -0.007 0.000 1.005 2050 G CA 1.327 46.425 45.100 -0.004 0.000 0.713 2050 G HN 0.658 nan 8.290 nan 0.000 0.515 2051 T N -3.390 111.161 114.554 -0.006 0.000 2.833 2051 T HA -0.084 4.266 4.350 -0.001 0.000 0.269 2051 T C 2.202 176.895 174.700 -0.012 0.000 1.054 2051 T CA 2.462 64.557 62.100 -0.007 0.000 1.135 2051 T CB -0.366 68.499 68.868 -0.005 0.000 0.869 2051 T HN 0.308 nan 8.240 nan 0.000 0.466 2052 T N 1.881 116.426 114.554 -0.015 0.000 2.732 2052 T HA -0.044 4.306 4.350 -0.001 0.000 0.261 2052 T C 2.294 176.978 174.700 -0.027 0.000 1.040 2052 T CA 1.693 63.781 62.100 -0.021 0.000 1.145 2052 T CB -0.922 67.933 68.868 -0.022 0.000 0.866 2052 T HN 0.471 nan 8.240 nan 0.000 0.427 2053 T N 2.331 116.869 114.554 -0.026 0.000 2.665 2053 T HA -0.129 4.221 4.350 -0.001 0.000 0.268 2053 T C 2.364 177.041 174.700 -0.038 0.000 1.035 2053 T CA 1.359 63.438 62.100 -0.034 0.000 1.151 2053 T CB -0.645 68.205 68.868 -0.029 0.000 0.862 2053 T HN 0.424 nan 8.240 nan 0.000 0.438 2054 A N 0.787 123.589 122.820 -0.030 0.000 1.908 2054 A HA -0.081 4.239 4.320 -0.001 0.000 0.218 2054 A C 2.596 180.160 177.584 -0.034 0.000 1.181 2054 A CA 1.621 53.641 52.037 -0.029 0.000 0.627 2054 A CB -0.975 18.015 19.000 -0.017 0.000 0.818 2054 A HN 0.384 nan 8.150 nan 0.000 0.445 2055 V N -0.603 119.293 119.914 -0.030 0.000 2.453 2055 V HA -0.175 3.944 4.120 -0.001 0.000 0.247 2055 V C 2.545 178.613 176.094 -0.043 0.000 1.048 2055 V CA 1.710 63.991 62.300 -0.031 0.000 1.049 2055 V CB -0.591 31.217 31.823 -0.026 0.000 0.672 2055 V HN 0.365 nan 8.190 nan 0.000 0.457 2056 V N -0.195 119.691 119.914 -0.047 0.000 2.343 2056 V HA -0.214 3.906 4.120 -0.001 0.000 0.247 2056 V C 2.438 178.488 176.094 -0.074 0.000 1.051 2056 V CA 1.879 64.145 62.300 -0.056 0.000 1.036 2056 V CB -0.416 31.374 31.823 -0.055 0.000 0.654 2056 V HN 0.400 nan 8.190 nan 0.000 0.451 2057 V N 0.359 120.224 119.914 -0.083 0.000 2.295 2057 V HA -0.257 3.862 4.120 -0.001 0.000 0.246 2057 V C 2.704 178.721 176.094 -0.128 0.000 1.049 2057 V CA 2.107 64.335 62.300 -0.119 0.000 1.024 2057 V CB -1.124 30.626 31.823 -0.121 0.000 0.648 2057 V HN 0.562 nan 8.190 nan 0.000 0.447 2058 A N 0.325 123.091 122.820 -0.089 0.000 1.972 2058 A HA -0.049 4.271 4.320 -0.001 0.000 0.219 2058 A C 2.375 179.924 177.584 -0.058 0.000 1.169 2058 A CA 1.795 53.791 52.037 -0.068 0.000 0.635 2058 A CB -1.065 17.913 19.000 -0.035 0.000 0.810 2058 A HN 0.534 nan 8.150 nan 0.000 0.446 2059 G N -0.373 108.392 108.800 -0.059 0.000 2.404 2059 G HA2 -0.223 3.737 3.960 -0.001 0.000 0.215 2059 G HA3 -0.223 3.737 3.960 -0.001 0.000 0.215 2059 G C 1.483 176.350 174.900 -0.054 0.000 1.174 2059 G CA 1.274 46.344 45.100 -0.051 0.000 0.780 2059 G HN 0.544 nan 8.290 nan 0.000 0.537 2060 E N -0.001 120.155 120.200 -0.074 0.000 2.152 2060 E HA -0.033 4.316 4.350 -0.001 0.000 0.192 2060 E C 2.284 178.833 176.600 -0.086 0.000 0.983 2060 E CA 0.371 56.724 56.400 -0.078 0.000 0.818 2060 E CB -0.407 29.234 29.700 -0.098 0.000 0.758 2060 E HN 0.257 nan 8.360 nan 0.000 0.467 2061 L N 0.112 121.259 121.223 -0.126 0.000 2.083 2061 L HA -0.069 4.271 4.340 -0.001 0.000 0.209 2061 L C 2.025 178.893 176.870 -0.004 0.000 1.083 2061 L CA 1.587 56.328 54.840 -0.165 0.000 0.752 2061 L CB -0.412 41.500 42.059 -0.246 0.000 0.899 2061 L HN 0.256 nan 8.230 nan 0.000 0.433 2062 L N -1.167 120.064 121.223 0.013 0.000 2.093 2062 L HA -0.147 4.193 4.340 -0.001 0.000 0.208 2062 L C 2.732 179.627 176.870 0.042 0.000 1.085 2062 L CA 0.977 55.849 54.840 0.054 0.000 0.755 2062 L CB -0.445 41.623 42.059 0.017 0.000 0.904 2062 L HN 0.215 nan 8.230 nan 0.000 0.435 2063 R N -0.120 120.385 120.500 0.009 0.000 2.081 2063 R HA -0.120 4.220 4.340 -0.001 0.000 0.235 2063 R C 2.284 178.601 176.300 0.028 0.000 1.131 2063 R CA 0.925 57.028 56.100 0.004 0.000 0.960 2063 R CB -0.143 30.146 30.300 -0.017 0.000 0.856 2063 R HN 0.217 nan 8.270 nan 0.000 0.436 2064 K N 0.374 120.802 120.400 0.046 0.000 2.148 2064 K HA -0.027 4.293 4.320 -0.001 0.000 0.204 2064 K C 2.024 178.722 176.600 0.163 0.000 1.050 2064 K CA 1.194 57.535 56.287 0.090 0.000 0.942 2064 K CB -0.158 32.390 32.500 0.080 0.000 0.724 2064 K HN 0.142 nan 8.250 nan 0.000 0.446 2065 A N 1.604 124.556 122.820 0.219 0.000 1.898 2065 A HA -0.167 4.153 4.320 -0.001 0.000 0.216 2065 A C 2.137 179.756 177.584 0.059 0.000 1.181 2065 A CA 1.367 53.511 52.037 0.178 0.000 0.620 2065 A CB -0.287 18.851 19.000 0.231 0.000 0.819 2065 A HN 0.246 nan 8.150 nan 0.000 0.442 2066 E N 0.268 120.495 120.200 0.046 0.000 2.150 2066 E HA -0.182 4.168 4.350 -0.001 0.000 0.193 2066 E C 1.775 178.381 176.600 0.010 0.000 0.985 2066 E CA 1.282 57.689 56.400 0.012 0.000 0.814 2066 E CB -0.150 29.550 29.700 0.001 0.000 0.752 2066 E HN 0.762 nan 8.360 nan 0.000 0.466 2067 E N 0.206 120.420 120.200 0.023 0.000 2.106 2067 E HA -0.117 4.232 4.350 -0.001 0.000 0.192 2067 E C 2.345 178.956 176.600 0.019 0.000 0.984 2067 E CA 0.680 57.092 56.400 0.019 0.000 0.806 2067 E CB -0.006 29.709 29.700 0.026 0.000 0.750 2067 E HN 0.252 nan 8.360 nan 0.000 0.458 2068 L N 0.308 121.547 121.223 0.027 0.000 2.046 2068 L HA -0.198 4.142 4.340 -0.001 0.000 0.208 2068 L C 2.224 179.089 176.870 -0.009 0.000 1.077 2068 L CA 0.507 55.355 54.840 0.012 0.000 0.747 2068 L CB -0.237 41.825 42.059 0.006 0.000 0.896 2068 L HN 0.168 nan 8.230 nan 0.000 0.432 2069 L N -0.180 121.031 121.223 -0.019 0.000 2.093 2069 L HA -0.224 4.116 4.340 -0.001 0.000 0.208 2069 L C 2.105 178.961 176.870 -0.023 0.000 1.085 2069 L CA 1.719 56.538 54.840 -0.035 0.000 0.755 2069 L CB -0.787 41.247 42.059 -0.041 0.000 0.904 2069 L HN 0.247 nan 8.230 nan 0.000 0.435 2070 D N -1.279 119.115 120.400 -0.011 0.000 2.144 2070 D HA -0.171 4.468 4.640 -0.001 0.000 0.200 2070 D C 1.791 178.089 176.300 -0.002 0.000 0.978 2070 D CA 0.774 54.770 54.000 -0.006 0.000 0.833 2070 D CB 0.162 40.961 40.800 -0.002 0.000 0.961 2070 D HN 0.223 nan 8.370 nan 0.000 0.470 2071 Q N 0.084 119.884 119.800 0.001 0.000 2.466 2071 Q HA 0.010 4.349 4.340 -0.001 0.000 0.210 2071 Q C 0.208 176.211 176.000 0.004 0.000 0.961 2071 Q CA 0.193 55.999 55.803 0.005 0.000 0.953 2071 Q CB -0.080 28.664 28.738 0.011 0.000 1.011 2071 Q HN 0.319 nan 8.270 nan 0.000 0.516 2072 N N -0.619 118.080 118.700 -0.002 0.000 2.776 2072 N HA -0.154 4.585 4.740 -0.001 0.000 0.249 2072 N C -1.322 174.193 175.510 0.008 0.000 1.111 2072 N CA 0.300 53.350 53.050 0.000 0.000 0.711 2072 N CB -1.149 37.342 38.487 0.008 0.000 1.065 2072 N HN -0.025 nan 8.380 nan 0.000 0.556 2073 V N 1.926 121.839 119.914 -0.001 0.000 2.385 2073 V HA 0.126 4.245 4.120 -0.001 0.000 0.269 2073 V C 0.935 177.029 176.094 0.000 0.000 1.043 2073 V CA -0.728 61.577 62.300 0.009 0.000 0.906 2073 V CB 1.016 32.836 31.823 -0.005 0.000 0.995 2073 V HN 0.327 nan 8.190 nan 0.000 0.467 2074 H N 8.339 127.390 119.070 -0.032 0.000 3.034 2074 H HA 0.040 4.596 4.556 -0.001 0.000 0.324 2074 H C -1.685 173.612 175.328 -0.052 0.000 1.015 2074 H CA -1.221 54.807 56.048 -0.034 0.000 1.429 2074 H CB 1.644 31.390 29.762 -0.028 0.000 1.429 2074 H HN 0.380 nan 8.280 nan 0.000 0.585 2075 P HA -0.177 nan 4.420 nan 0.000 0.217 2075 P C 1.522 178.852 177.300 0.050 0.000 1.148 2075 P CA 1.796 64.832 63.100 -0.106 0.000 0.834 2075 P CB 0.069 31.665 31.700 -0.174 0.000 0.783 2076 T N -1.743 113.003 114.554 0.321 0.000 2.915 2076 T HA -0.078 4.272 4.350 -0.001 0.000 0.269 2076 T C 1.572 176.296 174.700 0.040 0.000 1.071 2076 T CA 0.755 62.946 62.100 0.152 0.000 1.132 2076 T CB -0.515 68.403 68.868 0.084 0.000 0.878 2076 T HN -0.149 nan 8.240 nan 0.000 0.479 2077 I N 0.721 121.320 120.570 0.049 0.000 2.333 2077 I HA -0.014 4.155 4.170 -0.001 0.000 0.246 2077 I C 2.539 178.593 176.117 -0.105 0.000 1.106 2077 I CA 0.815 62.103 61.300 -0.019 0.000 1.411 2077 I CB -1.315 36.688 38.000 0.004 0.000 1.082 2077 I HN 0.151 nan 8.210 nan 0.000 0.420 2078 V N 0.736 120.550 119.914 -0.168 0.000 2.343 2078 V HA -0.223 3.897 4.120 -0.001 0.000 0.247 2078 V C 2.699 178.468 176.094 -0.543 0.000 1.051 2078 V CA 1.307 63.350 62.300 -0.427 0.000 1.036 2078 V CB -0.558 31.028 31.823 -0.395 0.000 0.654 2078 V HN 0.167 nan 8.190 nan 0.000 0.451 2079 V N 0.055 119.819 119.914 -0.249 0.000 2.261 2079 V HA -0.273 3.846 4.120 -0.001 0.000 0.246 2079 V C 2.485 178.539 176.094 -0.066 0.000 1.047 2079 V CA 2.378 64.608 62.300 -0.116 0.000 1.015 2079 V CB -0.672 31.129 31.823 -0.037 0.000 0.642 2079 V HN 0.530 nan 8.190 nan 0.000 0.446 2080 K N 1.116 121.477 120.400 -0.065 0.000 2.026 2080 K HA -0.105 4.214 4.320 -0.001 0.000 0.208 2080 K C 2.051 178.628 176.600 -0.039 0.000 1.048 2080 K CA 1.945 58.208 56.287 -0.040 0.000 0.929 2080 K CB -1.167 31.311 32.500 -0.035 0.000 0.713 2080 K HN 0.387 nan 8.250 nan 0.000 0.439 2081 G N -0.807 107.962 108.800 -0.051 0.000 2.418 2081 G HA2 -0.222 3.738 3.960 -0.001 0.000 0.217 2081 G HA3 -0.222 3.738 3.960 -0.001 0.000 0.217 2081 G C 1.210 176.145 174.900 0.058 0.000 1.158 2081 G CA 0.837 45.940 45.100 0.005 0.000 0.771 2081 G HN 0.268 nan 8.290 nan 0.000 0.545 2082 Y N 0.404 120.627 120.300 -0.128 0.000 2.200 2082 Y HA -0.044 4.505 4.550 -0.001 0.000 0.290 2082 Y C 2.891 178.545 175.900 -0.409 0.000 1.137 2082 Y CA 1.077 59.017 58.100 -0.267 0.000 1.163 2082 Y CB -0.946 37.545 38.460 0.052 0.000 0.988 2082 Y HN 0.270 nan 8.280 nan 0.000 0.518 2083 Q N 0.319 120.107 119.800 -0.019 0.000 2.123 2083 Q HA -0.030 4.309 4.340 -0.001 0.000 0.199 2083 Q C 2.290 178.219 176.000 -0.118 0.000 0.966 2083 Q CA 1.526 57.298 55.803 -0.052 0.000 0.845 2083 Q CB -0.403 28.330 28.738 -0.008 0.000 0.907 2083 Q HN 0.328 nan 8.270 nan 0.000 0.439 2084 A N 0.271 123.019 122.820 -0.120 0.000 1.855 2084 A HA -0.005 4.314 4.320 -0.001 0.000 0.215 2084 A C 2.279 179.769 177.584 -0.156 0.000 1.191 2084 A CA 1.861 53.834 52.037 -0.106 0.000 0.613 2084 A CB -1.196 17.764 19.000 -0.066 0.000 0.829 2084 A HN 0.494 nan 8.150 nan 0.000 0.442 2085 A N -0.318 122.318 122.820 -0.306 0.000 1.930 2085 A HA 0.232 4.551 4.320 -0.001 0.000 0.217 2085 A C 2.458 179.793 177.584 -0.416 0.000 1.175 2085 A CA 1.876 53.685 52.037 -0.380 0.000 0.627 2085 A CB -0.905 17.730 19.000 -0.608 0.000 0.815 2085 A HN 1.028 nan 8.150 nan 0.000 0.443 2086 A N -1.077 121.364 122.820 -0.632 0.000 1.930 2086 A HA -0.156 4.163 4.320 -0.001 0.000 0.217 2086 A C 2.098 179.662 177.584 -0.033 0.000 1.175 2086 A CA 1.545 53.474 52.037 -0.180 0.000 0.627 2086 A CB -0.399 18.545 19.000 -0.093 0.000 0.815 2086 A HN 0.481 nan 8.150 nan 0.000 0.443 2087 Q N -0.071 119.691 119.800 -0.063 0.000 2.119 2087 Q HA -0.111 4.228 4.340 -0.001 0.000 0.201 2087 Q C 1.751 177.759 176.000 0.013 0.000 0.972 2087 Q CA 1.211 57.004 55.803 -0.017 0.000 0.847 2087 Q CB -0.268 28.451 28.738 -0.031 0.000 0.903 2087 Q HN 0.516 nan 8.270 nan 0.000 0.433 2088 K N 0.229 120.646 120.400 0.027 0.000 2.167 2088 K HA 0.099 4.419 4.320 -0.001 0.000 0.203 2088 K C 1.945 178.634 176.600 0.148 0.000 1.052 2088 K CA 0.801 57.148 56.287 0.100 0.000 0.956 2088 K CB -0.103 32.505 32.500 0.179 0.000 0.735 2088 K HN 0.113 nan 8.250 nan 0.000 0.451 2089 A N 1.575 124.474 122.820 0.132 0.000 1.902 2089 A HA -0.201 4.119 4.320 -0.001 0.000 0.217 2089 A C 2.132 179.780 177.584 0.107 0.000 1.181 2089 A CA 1.374 53.500 52.037 0.148 0.000 0.623 2089 A CB -0.382 18.756 19.000 0.229 0.000 0.818 2089 A HN 0.350 nan 8.150 nan 0.000 0.443 2090 Q N -0.879 118.973 119.800 0.087 0.000 2.172 2090 Q HA -0.124 4.216 4.340 -0.001 0.000 0.200 2090 Q C 1.883 177.917 176.000 0.057 0.000 0.964 2090 Q CA 1.101 56.942 55.803 0.064 0.000 0.855 2090 Q CB -0.090 28.678 28.738 0.050 0.000 0.918 2090 Q HN 0.582 nan 8.270 nan 0.000 0.444 2091 E N 0.530 120.767 120.200 0.062 0.000 2.110 2091 E HA -0.150 4.200 4.350 -0.001 0.000 0.193 2091 E C 1.949 178.593 176.600 0.075 0.000 0.988 2091 E CA 0.799 57.234 56.400 0.058 0.000 0.804 2091 E CB 0.004 29.736 29.700 0.052 0.000 0.745 2091 E HN 0.218 nan 8.360 nan 0.000 0.458 2092 L N 0.456 121.739 121.223 0.100 0.000 2.093 2092 L HA -0.096 4.244 4.340 -0.001 0.000 0.208 2092 L C 2.423 179.335 176.870 0.069 0.000 1.085 2092 L CA 1.123 56.023 54.840 0.100 0.000 0.755 2092 L CB -0.820 41.305 42.059 0.111 0.000 0.904 2092 L HN 0.095 nan 8.230 nan 0.000 0.435 2093 L N -1.032 120.228 121.223 0.062 0.000 2.093 2093 L HA -0.219 4.120 4.340 -0.001 0.000 0.208 2093 L C 2.430 179.325 176.870 0.041 0.000 1.085 2093 L CA 1.193 56.062 54.840 0.047 0.000 0.755 2093 L CB -0.450 41.635 42.059 0.043 0.000 0.904 2093 L HN 0.231 nan 8.230 nan 0.000 0.435 2094 K N -0.772 119.653 120.400 0.041 0.000 2.155 2094 K HA -0.083 4.237 4.320 -0.001 0.000 0.203 2094 K C 2.045 178.665 176.600 0.034 0.000 1.052 2094 K CA 1.442 57.749 56.287 0.033 0.000 0.948 2094 K CB -0.134 32.384 32.500 0.030 0.000 0.728 2094 K HN 0.263 nan 8.250 nan 0.000 0.448 2095 T N 1.950 116.530 114.554 0.042 0.000 2.777 2095 T HA -0.075 4.274 4.350 -0.001 0.000 0.266 2095 T C 1.852 176.574 174.700 0.037 0.000 1.040 2095 T CA 1.263 63.388 62.100 0.042 0.000 1.141 2095 T CB -0.120 68.782 68.868 0.056 0.000 0.868 2095 T HN 0.384 nan 8.240 nan 0.000 0.444 2096 I N -0.453 120.141 120.570 0.040 0.000 3.728 2096 I HA 0.473 4.643 4.170 -0.001 0.000 0.307 2096 I C 1.018 177.153 176.117 0.030 0.000 1.276 2096 I CA -0.597 60.725 61.300 0.037 0.000 1.285 2096 I CB -0.426 37.602 38.000 0.047 0.000 1.038 2096 I HN -0.056 nan 8.210 nan 0.000 0.445 2097 A N 1.501 124.338 122.820 0.028 0.000 2.567 2097 A HA 0.122 4.442 4.320 -0.001 0.000 0.240 2097 A C 0.097 177.692 177.584 0.019 0.000 1.053 2097 A CA -0.001 52.050 52.037 0.023 0.000 0.755 2097 A CB -0.183 18.830 19.000 0.022 0.000 0.978 2097 A HN 0.638 nan 8.150 nan 0.000 0.507 2098 C N 3.756 123.066 119.300 0.016 0.000 2.273 2098 C HA 0.448 4.908 4.460 -0.001 0.000 0.328 2098 C C 0.316 175.313 174.990 0.011 0.000 1.275 2098 C CA -0.681 58.344 59.018 0.013 0.000 1.704 2098 C CB -0.791 26.957 27.740 0.012 0.000 2.326 2098 C HN 0.881 nan 8.230 nan 0.000 0.517 2099 E N 3.685 123.891 120.200 0.010 0.000 2.316 2099 E HA 0.424 4.774 4.350 -0.001 0.000 0.275 2099 E C -0.114 176.490 176.600 0.007 0.000 1.029 2099 E CA -0.063 56.342 56.400 0.008 0.000 0.871 2099 E CB 1.168 30.873 29.700 0.008 0.000 1.022 2099 E HN 0.700 nan 8.360 nan 0.000 0.418 2100 V N -0.512 119.406 119.914 0.006 0.000 3.040 2100 V HA 0.729 4.849 4.120 -0.001 0.000 0.312 2100 V C 0.320 176.417 176.094 0.005 0.000 1.115 2100 V CA -1.135 61.169 62.300 0.005 0.000 0.998 2100 V CB 1.673 33.499 31.823 0.005 0.000 1.042 2100 V HN 0.660 nan 8.190 nan 0.000 0.433 2101 G N 0.612 109.415 108.800 0.004 0.000 2.365 2101 G HA2 0.481 4.441 3.960 -0.001 0.000 0.249 2101 G HA3 0.481 4.441 3.960 -0.001 0.000 0.249 2101 G C 0.965 175.867 174.900 0.004 0.000 1.288 2101 G CA 0.127 45.229 45.100 0.003 0.000 0.887 2101 G HN 1.657 nan 8.290 nan 0.000 0.524 2102 A N 2.346 125.168 122.820 0.004 0.000 1.940 2102 A HA -0.057 4.263 4.320 -0.001 0.000 0.219 2102 A C 1.942 179.528 177.584 0.004 0.000 1.176 2102 A CA 1.197 53.236 52.037 0.004 0.000 0.631 2102 A CB -0.002 19.001 19.000 0.004 0.000 0.814 2102 A HN 0.516 nan 8.150 nan 0.000 0.446 2103 Q N 0.006 119.808 119.800 0.003 0.000 2.201 2103 Q HA 0.107 4.447 4.340 -0.001 0.000 0.236 2103 Q C -0.946 175.056 176.000 0.002 0.000 0.857 2103 Q CA -0.132 55.673 55.803 0.003 0.000 1.025 2103 Q CB 0.026 28.766 28.738 0.003 0.000 1.124 2103 Q HN 0.720 nan 8.270 nan 0.000 0.473 2104 D N 0.728 121.129 120.400 0.002 0.000 2.344 2104 D HA 0.005 4.644 4.640 -0.001 0.000 0.253 2104 D C 1.251 177.551 176.300 0.001 0.000 1.255 2104 D CA 0.064 54.065 54.000 0.001 0.000 0.894 2104 D CB 0.883 41.684 40.800 0.001 0.000 1.067 2104 D HN -0.218 nan 8.370 nan 0.000 0.492 2105 K N 3.409 123.809 120.400 0.000 0.000 2.077 2105 K HA -0.293 4.026 4.320 -0.001 0.000 0.213 2105 K C 1.553 178.151 176.600 -0.002 0.000 1.051 2105 K CA 2.071 58.358 56.287 -0.001 0.000 0.929 2105 K CB -0.107 32.393 32.500 -0.001 0.000 0.715 2105 K HN 0.660 nan 8.250 nan 0.000 0.451 2106 E N -0.452 119.746 120.200 -0.003 0.000 2.023 2106 E HA -0.222 4.128 4.350 -0.001 0.000 0.196 2106 E C 1.993 178.591 176.600 -0.004 0.000 1.003 2106 E CA 1.661 58.059 56.400 -0.004 0.000 0.809 2106 E CB -0.275 29.422 29.700 -0.004 0.000 0.755 2106 E HN 0.340 nan 8.360 nan 0.000 0.449 2107 I N 0.580 121.149 120.570 -0.002 0.000 2.454 2107 I HA -0.203 3.967 4.170 -0.001 0.000 0.254 2107 I C 1.879 177.996 176.117 0.000 0.000 1.156 2107 I CA 0.729 62.029 61.300 -0.000 0.000 1.433 2107 I CB -0.060 37.941 38.000 0.002 0.000 1.082 2107 I HN 0.212 nan 8.210 nan 0.000 0.432 2108 L N 0.063 121.286 121.223 -0.000 0.000 2.141 2108 L HA -0.140 4.199 4.340 -0.001 0.000 0.209 2108 L C 2.643 179.512 176.870 -0.001 0.000 1.094 2108 L CA 2.295 57.136 54.840 0.001 0.000 0.763 2108 L CB -1.564 40.495 42.059 0.001 0.000 0.908 2108 L HN 0.493 nan 8.230 nan 0.000 0.437 2109 T N -4.955 109.597 114.554 -0.003 0.000 3.035 2109 T HA -0.068 4.282 4.350 -0.001 0.000 0.259 2109 T C 1.898 176.593 174.700 -0.009 0.000 1.078 2109 T CA 0.432 62.529 62.100 -0.006 0.000 1.132 2109 T CB -0.064 68.799 68.868 -0.008 0.000 0.900 2109 T HN 0.178 nan 8.240 nan 0.000 0.480 2110 K N 0.617 121.012 120.400 -0.007 0.000 2.057 2110 K HA 0.098 4.417 4.320 -0.001 0.000 0.206 2110 K C 2.144 178.742 176.600 -0.003 0.000 1.050 2110 K CA 0.965 57.247 56.287 -0.008 0.000 0.935 2110 K CB -0.183 32.314 32.500 -0.006 0.000 0.715 2110 K HN 0.252 nan 8.250 nan 0.000 0.439 2111 I N 1.301 121.872 120.570 0.001 0.000 2.179 2111 I HA -0.218 3.951 4.170 -0.001 0.000 0.242 2111 I C 2.518 178.638 176.117 0.006 0.000 1.088 2111 I CA 1.265 62.568 61.300 0.005 0.000 1.357 2111 I CB -1.344 36.660 38.000 0.006 0.000 1.051 2111 I HN 0.104 nan 8.210 nan 0.000 0.409 2112 A N 0.772 123.593 122.820 0.003 0.000 1.865 2112 A HA -0.233 4.086 4.320 -0.001 0.000 0.217 2112 A C 2.397 179.982 177.584 0.002 0.000 1.191 2112 A CA 1.899 53.938 52.037 0.003 0.000 0.623 2112 A CB -0.659 18.341 19.000 0.000 0.000 0.826 2112 A HN 0.356 nan 8.150 nan 0.000 0.444 2113 M N -0.840 118.757 119.600 -0.005 0.000 2.159 2113 M HA -0.123 4.357 4.480 -0.001 0.000 0.263 2113 M C 2.209 178.505 176.300 -0.006 0.000 1.063 2113 M CA 1.792 57.084 55.300 -0.014 0.000 1.110 2113 M CB -0.642 31.939 32.600 -0.031 0.000 1.374 2113 M HN 0.472 nan 8.290 nan 0.000 0.411 2114 T N -0.245 114.312 114.554 0.004 0.000 2.665 2114 T HA -0.182 4.168 4.350 -0.001 0.000 0.268 2114 T C 1.954 176.679 174.700 0.043 0.000 1.035 2114 T CA 2.021 64.136 62.100 0.026 0.000 1.151 2114 T CB -0.320 68.564 68.868 0.026 0.000 0.862 2114 T HN 0.399 nan 8.240 nan 0.000 0.438 2115 S N 0.203 115.920 115.700 0.029 0.000 2.371 2115 S HA 0.034 4.504 4.470 -0.001 0.000 0.224 2115 S C 2.057 176.679 174.600 0.037 0.000 1.029 2115 S CA 0.566 58.785 58.200 0.031 0.000 0.978 2115 S CB -0.428 62.784 63.200 0.021 0.000 0.833 2115 S HN 0.451 nan 8.310 nan 0.000 0.466 2116 I N 1.682 122.268 120.570 0.028 0.000 2.226 2116 I HA -0.105 4.065 4.170 -0.001 0.000 0.245 2116 I C 1.323 177.466 176.117 0.045 0.000 1.100 2116 I CA 0.967 62.283 61.300 0.026 0.000 1.374 2116 I CB -0.936 37.070 38.000 0.010 0.000 1.057 2116 I HN 0.415 nan 8.210 nan 0.000 0.413 2117 T N -0.408 114.179 114.554 0.054 0.000 2.903 2117 T HA 0.326 4.675 4.350 -0.001 0.000 0.314 2117 T C 1.083 175.912 174.700 0.215 0.000 1.078 2117 T CA 0.090 62.250 62.100 0.101 0.000 1.114 2117 T CB 1.225 70.118 68.868 0.042 0.000 0.987 2117 T HN 0.636 nan 8.240 nan 0.000 0.548 2118 G N 0.492 109.468 108.800 0.294 0.000 2.141 2118 G HA2 -0.201 3.759 3.960 -0.001 0.000 0.242 2118 G HA3 -0.201 3.759 3.960 -0.001 0.000 0.242 2118 G C -0.134 174.831 174.900 0.109 0.000 0.982 2118 G CA 0.317 45.549 45.100 0.220 0.000 0.662 2118 G HN 0.947 nan 8.290 nan 0.000 0.527 2119 K N -0.204 120.253 120.400 0.095 0.000 2.328 2119 K HA 0.707 5.027 4.320 -0.001 0.000 0.246 2119 K C 1.565 178.196 176.600 0.052 0.000 0.955 2119 K CA 0.179 56.500 56.287 0.058 0.000 0.817 2119 K CB 0.971 33.498 32.500 0.045 0.000 1.208 2119 K HN 0.282 nan 8.250 nan 0.000 0.432 2120 G N 1.151 109.974 108.800 0.039 0.000 2.450 2120 G HA2 -0.242 3.718 3.960 -0.001 0.000 0.220 2120 G HA3 -0.242 3.718 3.960 -0.001 0.000 0.220 2120 G C 1.048 175.965 174.900 0.028 0.000 1.130 2120 G CA 1.035 46.155 45.100 0.033 0.000 0.760 2120 G HN 0.638 nan 8.290 nan 0.000 0.557 2121 A N 1.346 124.182 122.820 0.027 0.000 2.209 2121 A HA 0.092 4.411 4.320 -0.001 0.000 0.212 2121 A C 2.090 179.683 177.584 0.015 0.000 1.158 2121 A CA 1.497 53.546 52.037 0.020 0.000 0.742 2121 A CB -0.380 18.632 19.000 0.020 0.000 0.790 2121 A HN 0.660 nan 8.150 nan 0.000 0.472 2122 E N 1.378 121.589 120.200 0.019 0.000 2.333 2122 E HA -0.283 4.067 4.350 -0.001 0.000 0.198 2122 E C 1.557 178.154 176.600 -0.006 0.000 1.007 2122 E CA 1.301 57.704 56.400 0.005 0.000 0.845 2122 E CB -0.541 29.164 29.700 0.009 0.000 0.766 2122 E HN 0.792 nan 8.360 nan 0.000 0.507 2123 K N 0.801 121.202 120.400 0.002 0.000 2.281 2123 K HA -0.080 4.239 4.320 -0.001 0.000 0.203 2123 K C 1.466 178.063 176.600 -0.005 0.000 1.046 2123 K CA 1.466 57.752 56.287 -0.002 0.000 0.938 2123 K CB -0.009 32.494 32.500 0.005 0.000 0.737 2123 K HN 0.164 nan 8.250 nan 0.000 0.458 2124 A N 1.784 124.602 122.820 -0.003 0.000 2.610 2124 A HA 0.137 4.457 4.320 -0.001 0.000 0.291 2124 A C 1.348 178.928 177.584 -0.006 0.000 1.116 2124 A CA -0.561 51.474 52.037 -0.004 0.000 0.963 2124 A CB -0.041 18.960 19.000 0.001 0.000 1.220 2124 A HN 0.414 nan 8.150 nan 0.000 0.530 2125 K N 0.189 120.583 120.400 -0.011 0.000 2.281 2125 K HA -0.198 4.121 4.320 -0.001 0.000 0.203 2125 K C 0.835 177.426 176.600 -0.015 0.000 1.046 2125 K CA 1.908 58.186 56.287 -0.014 0.000 0.938 2125 K CB -0.115 32.369 32.500 -0.026 0.000 0.737 2125 K HN 0.313 nan 8.250 nan 0.000 0.458 2126 E N 1.298 121.488 120.200 -0.016 0.000 2.072 2126 E HA -0.098 4.252 4.350 -0.001 0.000 0.190 2126 E C 1.755 178.351 176.600 -0.008 0.000 0.982 2126 E CA 1.246 57.638 56.400 -0.014 0.000 0.803 2126 E CB 0.049 29.740 29.700 -0.015 0.000 0.755 2126 E HN 0.258 nan 8.360 nan 0.000 0.453 2127 K N 0.332 120.729 120.400 -0.005 0.000 2.057 2127 K HA 0.005 4.325 4.320 -0.001 0.000 0.206 2127 K C 1.972 178.572 176.600 0.001 0.000 1.050 2127 K CA 0.752 57.038 56.287 -0.001 0.000 0.935 2127 K CB -0.308 32.193 32.500 0.001 0.000 0.715 2127 K HN 0.057 nan 8.250 nan 0.000 0.439 2128 L N 0.103 121.326 121.223 0.000 0.000 2.046 2128 L HA -0.187 4.153 4.340 -0.001 0.000 0.208 2128 L C 2.374 179.244 176.870 0.001 0.000 1.077 2128 L CA 1.406 56.248 54.840 0.002 0.000 0.747 2128 L CB -0.604 41.456 42.059 0.003 0.000 0.896 2128 L HN 0.196 nan 8.230 nan 0.000 0.432 2129 A N -0.240 122.579 122.820 -0.002 0.000 1.933 2129 A HA -0.245 4.075 4.320 -0.001 0.000 0.218 2129 A C 2.176 179.759 177.584 -0.001 0.000 1.175 2129 A CA 1.811 53.847 52.037 -0.003 0.000 0.628 2129 A CB -0.428 18.568 19.000 -0.007 0.000 0.814 2129 A HN 0.387 nan 8.150 nan 0.000 0.444 2130 E N 0.198 120.398 120.200 -0.001 0.000 2.051 2130 E HA -0.162 4.188 4.350 -0.001 0.000 0.192 2130 E C 1.755 178.357 176.600 0.003 0.000 0.991 2130 E CA 1.426 57.826 56.400 0.000 0.000 0.799 2130 E CB -0.230 29.470 29.700 -0.000 0.000 0.748 2130 E HN 0.468 nan 8.360 nan 0.000 0.449 2131 I N 0.274 120.847 120.570 0.004 0.000 2.226 2131 I HA -0.200 3.970 4.170 -0.001 0.000 0.245 2131 I C 2.136 178.257 176.117 0.006 0.000 1.100 2131 I CA 0.955 62.259 61.300 0.006 0.000 1.374 2131 I CB -0.799 37.206 38.000 0.008 0.000 1.057 2131 I HN 0.197 nan 8.210 nan 0.000 0.413 2132 I N -0.063 120.510 120.570 0.004 0.000 2.406 2132 I HA -0.149 4.021 4.170 -0.001 0.000 0.249 2132 I C 2.487 178.606 176.117 0.004 0.000 1.122 2132 I CA 0.897 62.199 61.300 0.004 0.000 1.431 2132 I CB -0.405 37.597 38.000 0.004 0.000 1.087 2132 I HN -0.095 nan 8.210 nan 0.000 0.424 2133 V N 0.282 120.197 119.914 0.003 0.000 2.358 2133 V HA -0.198 3.922 4.120 -0.001 0.000 0.246 2133 V C 2.449 178.545 176.094 0.004 0.000 1.047 2133 V CA 1.530 63.831 62.300 0.003 0.000 1.035 2133 V CB -0.581 31.243 31.823 0.002 0.000 0.658 2133 V HN 0.380 nan 8.190 nan 0.000 0.452 2134 E N 0.386 120.588 120.200 0.004 0.000 2.072 2134 E HA -0.132 4.218 4.350 -0.001 0.000 0.191 2134 E C 2.378 178.982 176.600 0.006 0.000 0.985 2134 E CA 1.414 57.817 56.400 0.005 0.000 0.801 2134 E CB -0.458 29.245 29.700 0.006 0.000 0.750 2134 E HN 0.555 nan 8.360 nan 0.000 0.452 2135 A N 1.137 123.961 122.820 0.006 0.000 1.902 2135 A HA -0.137 4.182 4.320 -0.001 0.000 0.217 2135 A C 2.623 180.210 177.584 0.005 0.000 1.181 2135 A CA 1.447 53.488 52.037 0.006 0.000 0.623 2135 A CB -0.689 18.314 19.000 0.005 0.000 0.818 2135 A HN 0.124 nan 8.150 nan 0.000 0.443 2136 V N -0.260 119.657 119.914 0.004 0.000 2.261 2136 V HA -0.212 3.907 4.120 -0.001 0.000 0.246 2136 V C 2.762 178.859 176.094 0.005 0.000 1.047 2136 V CA 2.368 64.671 62.300 0.004 0.000 1.015 2136 V CB -0.833 30.992 31.823 0.004 0.000 0.642 2136 V HN 0.549 nan 8.190 nan 0.000 0.446 2137 S N 0.010 115.713 115.700 0.005 0.000 2.419 2137 S HA -0.125 4.345 4.470 -0.001 0.000 0.233 2137 S C 2.138 176.742 174.600 0.007 0.000 1.016 2137 S CA 1.237 59.441 58.200 0.006 0.000 0.974 2137 S CB -0.394 62.810 63.200 0.006 0.000 0.786 2137 S HN 0.645 nan 8.310 nan 0.000 0.492 2138 A N 1.057 123.881 122.820 0.008 0.000 1.930 2138 A HA -0.020 4.300 4.320 -0.001 0.000 0.217 2138 A C 2.240 179.830 177.584 0.011 0.000 1.175 2138 A CA 1.655 53.697 52.037 0.010 0.000 0.627 2138 A CB -0.538 18.468 19.000 0.009 0.000 0.815 2138 A HN 0.579 nan 8.150 nan 0.000 0.443 2139 V N -3.656 116.262 119.914 0.008 0.000 3.660 2139 V HA 0.134 4.253 4.120 -0.001 0.000 0.276 2139 V C 1.871 177.969 176.094 0.006 0.000 1.317 2139 V CA 0.869 63.174 62.300 0.007 0.000 1.097 2139 V CB -0.303 31.523 31.823 0.004 0.000 0.863 2139 V HN 0.155 nan 8.190 nan 0.000 0.438 2140 V N 1.000 120.917 119.914 0.006 0.000 2.568 2140 V HA -0.185 3.935 4.120 -0.001 0.000 0.253 2140 V C 1.624 177.721 176.094 0.006 0.000 1.072 2140 V CA 2.603 64.907 62.300 0.005 0.000 1.084 2140 V CB -0.596 31.230 31.823 0.005 0.000 0.676 2140 V HN 0.897 nan 8.190 nan 0.000 0.469 2141 D N -1.058 119.347 120.400 0.008 0.000 4.438 2141 D HA -0.222 4.417 4.640 -0.001 0.000 0.158 2141 D C 0.616 176.920 176.300 0.007 0.000 0.686 2141 D CA 1.919 55.924 54.000 0.008 0.000 1.183 2141 D CB -1.235 39.568 40.800 0.005 0.000 0.623 2141 D HN 0.573 nan 8.370 nan 0.000 0.521 2142 D N 1.619 122.021 120.400 0.004 0.000 2.414 2142 D HA 0.216 4.855 4.640 -0.001 0.000 0.251 2142 D C -0.199 176.103 176.300 0.004 0.000 1.252 2142 D CA 0.300 54.302 54.000 0.003 0.000 0.999 2142 D CB 0.406 41.207 40.800 0.002 0.000 1.093 2142 D HN 0.199 nan 8.370 nan 0.000 0.515 2143 E N -0.304 119.898 120.200 0.003 0.000 2.373 2143 E HA 0.549 4.898 4.350 -0.001 0.000 0.233 2143 E C -0.238 176.364 176.600 0.003 0.000 1.035 2143 E CA -0.622 55.780 56.400 0.004 0.000 0.930 2143 E CB 0.625 30.327 29.700 0.004 0.000 1.278 2143 E HN 0.450 nan 8.360 nan 0.000 0.452 2144 G N 1.452 110.254 108.800 0.003 0.000 2.340 2144 G HA2 0.259 4.218 3.960 -0.001 0.000 0.298 2144 G HA3 0.259 4.218 3.960 -0.001 0.000 0.298 2144 G C -1.745 173.157 174.900 0.003 0.000 1.498 2144 G CA -0.736 44.366 45.100 0.003 0.000 0.847 2144 G HN 0.021 nan 8.290 nan 0.000 0.594 2145 K N 0.465 120.867 120.400 0.003 0.000 2.550 2145 K HA 0.542 4.861 4.320 -0.001 0.000 0.252 2145 K C -1.384 175.217 176.600 0.003 0.000 0.943 2145 K CA -0.542 55.747 56.287 0.003 0.000 0.806 2145 K CB 2.262 34.763 32.500 0.002 0.000 1.289 2145 K HN 0.512 nan 8.250 nan 0.000 0.435 2146 V N 3.415 123.330 119.914 0.003 0.000 2.370 2146 V HA 0.205 4.325 4.120 -0.001 0.000 0.279 2146 V C -0.250 175.844 176.094 0.002 0.000 1.029 2146 V CA -0.718 61.584 62.300 0.002 0.000 0.870 2146 V CB 1.319 33.144 31.823 0.003 0.000 0.984 2146 V HN 0.606 nan 8.190 nan 0.000 0.451 2147 D N 4.021 124.422 120.400 0.001 0.000 2.427 2147 D HA 0.198 4.837 4.640 -0.001 0.000 0.226 2147 D C 0.974 177.273 176.300 -0.002 0.000 1.076 2147 D CA -0.386 53.613 54.000 -0.001 0.000 0.849 2147 D CB 1.428 42.227 40.800 -0.002 0.000 1.052 2147 D HN 0.511 nan 8.370 nan 0.000 0.515 2148 K N 2.754 123.153 120.400 -0.002 0.000 2.218 2148 K HA -0.231 4.089 4.320 -0.001 0.000 0.205 2148 K C 0.964 177.560 176.600 -0.006 0.000 1.046 2148 K CA 1.319 57.604 56.287 -0.003 0.000 0.933 2148 K CB 0.161 32.660 32.500 -0.002 0.000 0.728 2148 K HN 0.331 nan 8.250 nan 0.000 0.454 2149 D N 0.191 120.587 120.400 -0.007 0.000 2.309 2149 D HA -0.110 4.530 4.640 -0.001 0.000 0.212 2149 D C 1.389 177.682 176.300 -0.012 0.000 0.968 2149 D CA 0.699 54.693 54.000 -0.010 0.000 0.882 2149 D CB 0.129 40.923 40.800 -0.010 0.000 0.918 2149 D HN 0.263 nan 8.370 nan 0.000 0.503 2150 L N -0.304 120.913 121.223 -0.009 0.000 2.554 2150 L HA 0.171 4.511 4.340 -0.001 0.000 0.226 2150 L C 0.372 177.236 176.870 -0.010 0.000 1.137 2150 L CA 0.181 55.016 54.840 -0.009 0.000 0.863 2150 L CB 0.085 42.141 42.059 -0.004 0.000 0.985 2150 L HN 0.009 nan 8.230 nan 0.000 0.451 2151 I N 0.270 120.834 120.570 -0.010 0.000 2.382 2151 I HA 0.235 4.404 4.170 -0.001 0.000 0.286 2151 I C 0.076 176.184 176.117 -0.015 0.000 1.002 2151 I CA -0.460 60.834 61.300 -0.010 0.000 1.135 2151 I CB 1.680 39.677 38.000 -0.005 0.000 1.288 2151 I HN -0.113 nan 8.210 nan 0.000 0.448 2152 K N 6.626 127.013 120.400 -0.021 0.000 2.172 2152 K HA 0.427 4.747 4.320 -0.001 0.000 0.276 2152 K C -0.706 175.881 176.600 -0.023 0.000 1.013 2152 K CA -0.595 55.675 56.287 -0.028 0.000 0.913 2152 K CB 1.266 33.741 32.500 -0.042 0.000 1.055 2152 K HN 0.452 nan 8.250 nan 0.000 0.461 2153 I N 3.975 124.532 120.570 -0.021 0.000 2.307 2153 I HA 0.174 4.344 4.170 -0.001 0.000 0.287 2153 I C 0.099 176.203 176.117 -0.022 0.000 1.054 2153 I CA -0.583 60.707 61.300 -0.016 0.000 1.218 2153 I CB 0.581 38.575 38.000 -0.010 0.000 1.398 2153 I HN 0.517 nan 8.210 nan 0.000 0.475 2154 E N 7.313 127.498 120.200 -0.025 0.000 2.199 2154 E HA 0.548 4.898 4.350 -0.001 0.000 0.269 2154 E C -0.948 175.641 176.600 -0.019 0.000 0.899 2154 E CA -0.745 55.636 56.400 -0.032 0.000 0.772 2154 E CB 1.405 31.072 29.700 -0.054 0.000 1.155 2154 E HN 0.541 nan 8.360 nan 0.000 0.408 2155 K N 2.911 123.300 120.400 -0.019 0.000 2.471 2155 K HA 0.612 4.932 4.320 -0.001 0.000 0.252 2155 K C -0.929 175.662 176.600 -0.014 0.000 0.938 2155 K CA -1.104 55.176 56.287 -0.011 0.000 0.796 2155 K CB 1.591 34.085 32.500 -0.009 0.000 1.161 2155 K HN 0.097 nan 8.250 nan 0.000 0.425 2156 K N 2.028 122.425 120.400 -0.006 0.000 2.507 2156 K HA 0.218 4.537 4.320 -0.001 0.000 0.251 2156 K C -0.643 175.955 176.600 -0.002 0.000 0.943 2156 K CA -0.582 55.702 56.287 -0.005 0.000 0.794 2156 K CB 2.138 34.644 32.500 0.009 0.000 1.188 2156 K HN 0.992 nan 8.250 nan 0.000 0.428 2157 S N 0.430 116.122 115.700 -0.014 0.000 2.584 2157 S HA 0.674 5.143 4.470 -0.001 0.000 0.270 2157 S C 0.565 175.164 174.600 -0.001 0.000 1.346 2157 S CA 0.326 58.518 58.200 -0.013 0.000 1.018 2157 S CB 0.822 64.004 63.200 -0.029 0.000 0.899 2157 S HN 0.931 nan 8.310 nan 0.000 0.542 2158 G N -0.193 108.608 108.800 0.002 0.000 2.640 2158 G HA2 0.475 4.435 3.960 -0.001 0.000 0.686 2158 G HA3 0.475 4.435 3.960 -0.001 0.000 0.686 2158 G C -0.042 174.864 174.900 0.010 0.000 1.229 2158 G CA -0.125 44.980 45.100 0.007 0.000 0.796 2158 G HN 2.405 nan 8.290 nan 0.000 0.654 2159 A N -0.331 122.495 122.820 0.009 0.000 5.953 2159 A HA 0.387 4.707 4.320 -0.001 0.000 0.267 2159 A C 1.188 178.777 177.584 0.009 0.000 2.116 2159 A CA 1.972 54.015 52.037 0.010 0.000 0.711 2159 A CB -1.624 17.384 19.000 0.012 0.000 1.100 2159 A HN 2.749 nan 8.150 nan 0.000 0.364 2160 S N -2.834 112.872 115.700 0.009 0.000 2.851 2160 S HA 0.691 5.161 4.470 -0.001 0.000 0.317 2160 S C 1.196 175.802 174.600 0.010 0.000 1.144 2160 S CA -0.109 58.097 58.200 0.010 0.000 0.862 2160 S CB 0.628 63.834 63.200 0.008 0.000 1.259 2160 S HN 1.018 nan 8.310 nan 0.000 0.564 2161 I N 2.009 122.585 120.570 0.010 0.000 2.546 2161 I HA -0.033 4.137 4.170 -0.001 0.000 0.255 2161 I C 1.514 177.636 176.117 0.009 0.000 1.163 2161 I CA 1.180 62.486 61.300 0.010 0.000 1.457 2161 I CB -1.347 36.660 38.000 0.011 0.000 1.092 2161 I HN 0.586 nan 8.210 nan 0.000 0.434 2162 D N 1.250 121.654 120.400 0.007 0.000 2.218 2162 D HA -0.172 4.467 4.640 -0.001 0.000 0.204 2162 D C 1.340 177.645 176.300 0.007 0.000 0.976 2162 D CA 1.196 55.199 54.000 0.005 0.000 0.853 2162 D CB -0.116 40.686 40.800 0.004 0.000 0.939 2162 D HN 0.432 nan 8.370 nan 0.000 0.481 2163 D N -0.174 120.232 120.400 0.009 0.000 2.347 2163 D HA -0.034 4.605 4.640 -0.001 0.000 0.215 2163 D C 0.329 176.638 176.300 0.016 0.000 0.976 2163 D CA 0.424 54.431 54.000 0.012 0.000 0.884 2163 D CB -0.014 40.794 40.800 0.012 0.000 0.915 2163 D HN -0.045 nan 8.370 nan 0.000 0.526 2164 T N 1.784 116.348 114.554 0.016 0.000 2.905 2164 T HA 0.063 4.413 4.350 -0.001 0.000 0.299 2164 T C 0.228 174.940 174.700 0.020 0.000 1.024 2164 T CA 0.381 62.492 62.100 0.019 0.000 1.151 2164 T CB 0.225 69.101 68.868 0.014 0.000 0.987 2164 T HN 0.303 nan 8.240 nan 0.000 0.535 2165 E N 2.039 122.256 120.200 0.027 0.000 2.408 2165 E HA 0.596 4.946 4.350 -0.001 0.000 0.275 2165 E C -1.490 175.130 176.600 0.033 0.000 0.935 2165 E CA -1.188 55.229 56.400 0.029 0.000 0.775 2165 E CB 1.303 31.023 29.700 0.034 0.000 1.277 2165 E HN 0.326 nan 8.360 nan 0.000 0.455 2166 L N 2.506 123.746 121.223 0.028 0.000 2.275 2166 L HA 0.484 4.824 4.340 -0.001 0.000 0.288 2166 L C -1.234 175.659 176.870 0.038 0.000 1.046 2166 L CA -0.389 54.467 54.840 0.028 0.000 0.805 2166 L CB 0.881 42.951 42.059 0.018 0.000 1.193 2166 L HN 0.610 nan 8.230 nan 0.000 0.426 2167 I N 5.221 125.820 120.570 0.047 0.000 2.359 2167 I HA 0.257 4.427 4.170 -0.001 0.000 0.284 2167 I C -0.128 176.017 176.117 0.047 0.000 1.018 2167 I CA -0.855 60.486 61.300 0.068 0.000 1.173 2167 I CB 0.995 39.070 38.000 0.124 0.000 1.326 2167 I HN 0.477 nan 8.210 nan 0.000 0.462 2168 K N 5.298 125.722 120.400 0.039 0.000 2.081 2168 K HA 0.441 4.761 4.320 -0.001 0.000 0.230 2168 K C 0.307 176.924 176.600 0.029 0.000 1.199 2168 K CA -0.077 56.225 56.287 0.026 0.000 1.130 2168 K CB -0.033 32.478 32.500 0.018 0.000 1.386 2168 K HN 0.848 nan 8.250 nan 0.000 0.280 2169 G N -1.254 107.562 108.800 0.027 0.000 2.335 2169 G HA2 0.268 4.227 3.960 -0.001 0.000 0.291 2169 G HA3 0.268 4.227 3.960 -0.001 0.000 0.291 2169 G C -1.704 173.194 174.900 -0.003 0.000 1.261 2169 G CA -0.803 44.311 45.100 0.022 0.000 0.871 2169 G HN 0.033 nan 8.290 nan 0.000 0.491 2170 V N 0.715 120.616 119.914 -0.022 0.000 2.409 2170 V HA 0.655 4.775 4.120 -0.001 0.000 0.291 2170 V C -0.720 175.298 176.094 -0.126 0.000 1.020 2170 V CA -0.602 61.651 62.300 -0.077 0.000 0.848 2170 V CB 1.242 33.001 31.823 -0.106 0.000 0.990 2170 V HN 0.818 nan 8.190 nan 0.000 0.430 2171 L N 7.910 129.017 121.223 -0.193 0.000 2.313 2171 L HA 0.853 5.192 4.340 -0.001 0.000 0.283 2171 L C -0.350 176.357 176.870 -0.271 0.000 1.013 2171 L CA -0.151 54.464 54.840 -0.375 0.000 0.816 2171 L CB 1.752 43.490 42.059 -0.535 0.000 1.236 2171 L HN 0.562 nan 8.230 nan 0.000 0.419 2172 V N 1.534 121.298 119.914 -0.250 0.000 2.864 2172 V HA 0.611 4.730 4.120 -0.001 0.000 0.314 2172 V C -0.358 175.662 176.094 -0.123 0.000 1.073 2172 V CA -0.516 61.697 62.300 -0.145 0.000 0.956 2172 V CB 1.857 33.631 31.823 -0.082 0.000 1.023 2172 V HN 0.828 nan 8.190 nan 0.000 0.435 2173 D N 1.060 121.415 120.400 -0.076 0.000 3.085 2173 D HA 0.287 4.926 4.640 -0.001 0.000 0.243 2173 D C -0.153 176.141 176.300 -0.010 0.000 1.232 2173 D CA -0.276 53.695 54.000 -0.048 0.000 0.913 2173 D CB 0.309 41.086 40.800 -0.040 0.000 1.108 2173 D HN 0.527 nan 8.370 nan 0.000 0.468 2174 K N 0.474 120.880 120.400 0.009 0.000 2.340 2174 K HA 0.418 4.738 4.320 -0.001 0.000 0.244 2174 K C 0.160 176.784 176.600 0.041 0.000 0.973 2174 K CA -0.810 55.500 56.287 0.038 0.000 0.828 2174 K CB 2.272 34.824 32.500 0.087 0.000 1.226 2174 K HN 0.265 nan 8.250 nan 0.000 0.437 2175 E N 0.546 120.763 120.200 0.029 0.000 2.334 2175 E HA 0.490 4.839 4.350 -0.001 0.000 0.256 2175 E C -0.657 175.943 176.600 0.000 0.000 0.958 2175 E CA -1.153 55.261 56.400 0.023 0.000 0.821 2175 E CB 0.899 30.609 29.700 0.017 0.000 1.269 2175 E HN 0.091 nan 8.360 nan 0.000 0.413 2176 R N 1.202 121.698 120.500 -0.006 0.000 2.242 2176 R HA 0.084 4.423 4.340 -0.001 0.000 0.334 2176 R C 0.853 177.134 176.300 -0.032 0.000 1.071 2176 R CA -0.154 55.928 56.100 -0.030 0.000 0.922 2176 R CB 0.878 31.164 30.300 -0.022 0.000 1.023 2176 R HN 0.581 nan 8.270 nan 0.000 0.458 2177 V N 1.977 121.862 119.914 -0.048 0.000 2.546 2177 V HA -0.177 3.943 4.120 -0.001 0.000 0.254 2177 V C 0.737 176.801 176.094 -0.050 0.000 1.076 2177 V CA 2.010 64.281 62.300 -0.050 0.000 1.087 2177 V CB 0.032 31.816 31.823 -0.065 0.000 0.674 2177 V HN 0.714 nan 8.190 nan 0.000 0.470 2178 S N -2.206 113.468 115.700 -0.044 0.000 2.536 2178 S HA 0.672 5.141 4.470 -0.001 0.000 0.287 2178 S C 0.749 175.341 174.600 -0.012 0.000 1.101 2178 S CA -0.183 57.997 58.200 -0.032 0.000 0.950 2178 S CB 1.840 65.017 63.200 -0.038 0.000 1.056 2178 S HN 0.516 nan 8.310 nan 0.000 0.481 2179 A N 2.987 125.806 122.820 -0.002 0.000 2.125 2179 A HA -0.068 4.251 4.320 -0.001 0.000 0.219 2179 A C 1.868 179.459 177.584 0.011 0.000 1.156 2179 A CA 1.622 53.662 52.037 0.006 0.000 0.671 2179 A CB -0.585 18.421 19.000 0.009 0.000 0.794 2179 A HN 0.894 nan 8.150 nan 0.000 0.459 2180 Q N -1.087 118.724 119.800 0.018 0.000 2.389 2180 Q HA 0.118 4.458 4.340 -0.001 0.000 0.204 2180 Q C 0.488 176.499 176.000 0.018 0.000 0.944 2180 Q CA 0.046 55.864 55.803 0.026 0.000 0.908 2180 Q CB -0.062 28.706 28.738 0.050 0.000 1.002 2180 Q HN 0.684 nan 8.270 nan 0.000 0.493 2181 M N 1.901 121.505 119.600 0.007 0.000 2.255 2181 M HA 0.275 4.755 4.480 -0.001 0.000 0.336 2181 M C -2.080 174.219 176.300 -0.002 0.000 1.135 2181 M CA -2.021 53.278 55.300 -0.001 0.000 1.145 2181 M CB 0.683 33.273 32.600 -0.017 0.000 1.473 2181 M HN -0.083 nan 8.290 nan 0.000 0.462 2182 P HA 0.015 nan 4.420 nan 0.000 0.266 2182 P C -0.470 176.828 177.300 -0.003 0.000 1.193 2182 P CA 0.280 63.379 63.100 -0.001 0.000 0.770 2182 P CB 0.455 32.153 31.700 -0.002 0.000 0.836 2183 K N 1.445 121.847 120.400 0.003 0.000 2.393 2183 K HA 0.045 4.365 4.320 -0.001 0.000 0.193 2183 K C 0.591 177.201 176.600 0.016 0.000 1.026 2183 K CA 0.546 56.838 56.287 0.009 0.000 1.064 2183 K CB 0.093 32.599 32.500 0.010 0.000 0.833 2183 K HN 0.507 nan 8.250 nan 0.000 0.521 2184 K N -0.872 119.535 120.400 0.012 0.000 2.568 2184 K HA 0.395 4.715 4.320 -0.001 0.000 0.273 2184 K C -1.329 175.279 176.600 0.014 0.000 0.951 2184 K CA -0.920 55.378 56.287 0.019 0.000 0.854 2184 K CB 2.126 34.636 32.500 0.017 0.000 1.424 2184 K HN -0.279 nan 8.250 nan 0.000 0.427 2185 V N 1.447 121.373 119.914 0.021 0.000 2.525 2185 V HA 0.401 4.520 4.120 -0.001 0.000 0.299 2185 V C -0.404 175.704 176.094 0.025 0.000 1.034 2185 V CA -0.598 61.712 62.300 0.017 0.000 0.863 2185 V CB 1.809 33.640 31.823 0.013 0.000 0.999 2185 V HN 1.005 nan 8.190 nan 0.000 0.423 2186 T N -0.053 114.512 114.554 0.018 0.000 2.902 2186 T HA 0.539 4.888 4.350 -0.001 0.000 0.283 2186 T C 0.166 174.877 174.700 0.018 0.000 1.009 2186 T CA -0.222 61.889 62.100 0.018 0.000 1.051 2186 T CB 1.275 70.150 68.868 0.011 0.000 0.999 2186 T HN 0.799 nan 8.240 nan 0.000 0.474 2187 D N 0.400 120.812 120.400 0.019 0.000 2.689 2187 D HA -0.161 4.479 4.640 -0.001 0.000 0.237 2187 D C 0.324 176.639 176.300 0.025 0.000 1.148 2187 D CA 0.836 54.848 54.000 0.019 0.000 0.656 2187 D CB -1.257 39.551 40.800 0.014 0.000 1.050 2187 D HN 1.107 nan 8.370 nan 0.000 0.426 2188 A N 1.398 124.238 122.820 0.034 0.000 2.477 2188 A HA 0.352 4.672 4.320 -0.001 0.000 0.246 2188 A C 0.505 178.117 177.584 0.047 0.000 1.078 2188 A CA 0.189 52.252 52.037 0.043 0.000 0.770 2188 A CB 0.547 19.584 19.000 0.062 0.000 1.011 2188 A HN 0.156 nan 8.150 nan 0.000 0.494 2189 K N 3.021 123.447 120.400 0.044 0.000 2.347 2189 K HA 0.386 4.705 4.320 -0.001 0.000 0.262 2189 K C -1.193 175.443 176.600 0.061 0.000 1.052 2189 K CA -0.244 56.070 56.287 0.046 0.000 0.946 2189 K CB 0.930 33.450 32.500 0.032 0.000 1.220 2189 K HN 0.525 nan 8.250 nan 0.000 0.450 2190 I N 2.142 122.765 120.570 0.088 0.000 2.371 2190 I HA 0.202 4.371 4.170 -0.001 0.000 0.290 2190 I C 0.373 176.562 176.117 0.120 0.000 1.028 2190 I CA -0.170 61.215 61.300 0.142 0.000 1.345 2190 I CB 1.360 39.480 38.000 0.199 0.000 1.407 2190 I HN 0.507 nan 8.210 nan 0.000 0.501 2191 A N 7.591 130.486 122.820 0.125 0.000 2.330 2191 A HA 0.847 5.166 4.320 -0.001 0.000 0.327 2191 A C -0.767 176.904 177.584 0.145 0.000 1.155 2191 A CA -0.562 51.535 52.037 0.099 0.000 0.803 2191 A CB 0.640 19.675 19.000 0.058 0.000 1.208 2191 A HN 0.658 nan 8.150 nan 0.000 0.477 2192 L N 3.453 124.741 121.223 0.108 0.000 2.318 2192 L HA 0.463 4.803 4.340 -0.001 0.000 0.277 2192 L C -1.045 175.866 176.870 0.069 0.000 1.008 2192 L CA -0.101 54.802 54.840 0.105 0.000 0.846 2192 L CB 1.039 43.138 42.059 0.067 0.000 1.220 2192 L HN 0.571 nan 8.230 nan 0.000 0.423 2193 L N 3.118 124.384 121.223 0.071 0.000 2.341 2193 L HA 0.370 4.710 4.340 -0.001 0.000 0.278 2193 L C 0.530 177.427 176.870 0.044 0.000 1.005 2193 L CA -0.568 54.301 54.840 0.047 0.000 0.818 2193 L CB 1.963 44.045 42.059 0.039 0.000 1.259 2193 L HN 0.584 nan 8.230 nan 0.000 0.418 2194 N N 0.192 118.910 118.700 0.031 0.000 2.353 2194 N HA -0.019 4.720 4.740 -0.001 0.000 0.185 2194 N C 0.239 175.761 175.510 0.020 0.000 1.098 2194 N CA -0.209 52.856 53.050 0.025 0.000 0.872 2194 N CB 0.173 38.670 38.487 0.018 0.000 0.970 2194 N HN 0.412 nan 8.380 nan 0.000 0.467 2195 C N 1.505 120.817 119.300 0.019 0.000 2.435 2195 C HA 0.767 5.227 4.460 -0.001 0.000 0.375 2195 C C 0.948 175.947 174.990 0.015 0.000 1.281 2195 C CA -0.986 58.041 59.018 0.015 0.000 1.963 2195 C CB -1.247 26.502 27.740 0.015 0.000 2.490 2195 C HN 0.577 nan 8.230 nan 0.000 0.557 2196 A N 6.574 129.400 122.820 0.010 0.000 2.520 2196 A HA 0.363 4.682 4.320 -0.001 0.000 0.235 2196 A C 0.420 178.007 177.584 0.005 0.000 1.065 2196 A CA 0.003 52.044 52.037 0.006 0.000 0.764 2196 A CB 0.072 19.074 19.000 0.003 0.000 1.002 2196 A HN 0.815 nan 8.150 nan 0.000 0.502 2197 I N 2.440 123.010 120.570 0.001 0.000 2.191 2197 I HA 0.187 4.356 4.170 -0.001 0.000 0.289 2197 I C 0.115 176.229 176.117 -0.005 0.000 1.141 2197 I CA 0.727 62.027 61.300 0.001 0.000 1.430 2197 I CB -1.538 36.460 38.000 -0.004 0.000 1.497 2197 I HN 0.609 nan 8.210 nan 0.000 0.636 2198 E N 2.944 123.144 120.200 -0.000 0.000 2.283 2198 E HA 0.453 4.802 4.350 -0.001 0.000 0.258 2198 E C -0.794 175.809 176.600 0.006 0.000 0.893 2198 E CA -0.488 55.910 56.400 -0.003 0.000 0.798 2198 E CB 2.334 32.031 29.700 -0.006 0.000 1.242 2198 E HN 0.199 nan 8.360 nan 0.000 0.414 2199 E N 1.893 122.099 120.200 0.009 0.000 2.278 2199 E HA 0.180 4.530 4.350 -0.001 0.000 0.272 2199 E C -1.154 175.457 176.600 0.018 0.000 0.890 2199 E CA -0.553 55.857 56.400 0.017 0.000 0.770 2199 E CB 1.894 31.611 29.700 0.028 0.000 1.212 2199 E HN 0.276 nan 8.360 nan 0.000 0.415 2200 T N 2.892 117.455 114.554 0.016 0.000 2.940 2200 T HA 0.483 4.832 4.350 -0.001 0.000 0.309 2200 T C -0.242 174.474 174.700 0.026 0.000 1.056 2200 T CA 0.893 63.003 62.100 0.017 0.000 1.137 2200 T CB -0.253 68.623 68.868 0.013 0.000 0.976 2200 T HN 1.324 nan 8.240 nan 0.000 0.547 2201 A N 3.178 126.016 122.820 0.029 0.000 2.435 2201 A HA -0.046 4.274 4.320 -0.001 0.000 0.686 2201 A C 1.256 178.882 177.584 0.069 0.000 0.138 2201 A CA 0.500 52.562 52.037 0.042 0.000 0.024 2201 A CB -1.854 17.168 19.000 0.036 0.000 3.974 2201 A HN 1.874 nan 8.150 nan 0.000 0.548 2202 S N 0.627 116.384 115.700 0.096 0.000 2.489 2202 S HA -0.013 4.456 4.470 -0.001 0.000 0.228 2202 S C 1.367 176.087 174.600 0.199 0.000 0.995 2202 S CA 1.430 59.745 58.200 0.192 0.000 0.934 2202 S CB 0.076 63.413 63.200 0.229 0.000 0.771 2202 S HN 1.163 nan 8.310 nan 0.000 0.522 2203 E N 1.882 122.143 120.200 0.102 0.000 2.046 2203 E HA 0.046 4.396 4.350 -0.001 0.000 0.190 2203 E C 1.994 178.622 176.600 0.046 0.000 0.982 2203 E CA 1.404 57.836 56.400 0.053 0.000 0.800 2203 E CB -0.417 29.302 29.700 0.032 0.000 0.756 2203 E HN 0.594 nan 8.360 nan 0.000 0.449 2204 M N -0.521 119.110 119.600 0.053 0.000 2.200 2204 M HA -0.041 4.439 4.480 -0.001 0.000 0.265 2204 M C 2.037 178.373 176.300 0.060 0.000 1.066 2204 M CA 0.647 55.973 55.300 0.043 0.000 1.127 2204 M CB -0.109 32.512 32.600 0.035 0.000 1.379 2204 M HN 0.194 nan 8.290 nan 0.000 0.420 2205 L N 0.958 122.237 121.223 0.093 0.000 2.093 2205 L HA -0.152 4.188 4.340 -0.001 0.000 0.208 2205 L C 2.410 179.391 176.870 0.186 0.000 1.085 2205 L CA 1.825 56.739 54.840 0.123 0.000 0.755 2205 L CB -0.697 41.437 42.059 0.125 0.000 0.904 2205 L HN 0.146 nan 8.230 nan 0.000 0.435 2206 K N -0.371 120.153 120.400 0.207 0.000 2.057 2206 K HA -0.198 4.122 4.320 -0.001 0.000 0.207 2206 K C 1.567 178.165 176.600 -0.004 0.000 1.049 2206 K CA 1.824 58.141 56.287 0.049 0.000 0.931 2206 K CB -0.298 32.078 32.500 -0.206 0.000 0.714 2206 K HN 0.374 nan 8.250 nan 0.000 0.440 2207 D N 0.616 121.022 120.400 0.009 0.000 2.178 2207 D HA -0.111 4.529 4.640 -0.001 0.000 0.202 2207 D C 2.014 178.323 176.300 0.015 0.000 0.974 2207 D CA 1.025 55.026 54.000 0.001 0.000 0.841 2207 D CB -0.083 40.720 40.800 0.005 0.000 0.953 2207 D HN 0.290 nan 8.370 nan 0.000 0.478 2208 M N -0.132 119.489 119.600 0.034 0.000 2.117 2208 M HA -0.127 4.353 4.480 -0.001 0.000 0.262 2208 M C 2.252 178.574 176.300 0.037 0.000 1.065 2208 M CA 0.866 56.188 55.300 0.036 0.000 1.114 2208 M CB -0.043 32.583 32.600 0.044 0.000 1.361 2208 M HN -0.115 nan 8.290 nan 0.000 0.408 2209 V N 0.203 120.151 119.914 0.056 0.000 2.358 2209 V HA -0.208 3.911 4.120 -0.001 0.000 0.246 2209 V C 2.579 178.689 176.094 0.026 0.000 1.047 2209 V CA 1.905 64.240 62.300 0.058 0.000 1.035 2209 V CB -1.128 30.766 31.823 0.117 0.000 0.658 2209 V HN 0.511 nan 8.190 nan 0.000 0.452 2210 A N -0.084 122.739 122.820 0.006 0.000 1.969 2210 A HA -0.227 4.093 4.320 -0.001 0.000 0.218 2210 A C 2.175 179.759 177.584 -0.001 0.000 1.169 2210 A CA 1.925 53.957 52.037 -0.010 0.000 0.635 2210 A CB -0.410 18.574 19.000 -0.027 0.000 0.810 2210 A HN 0.551 nan 8.150 nan 0.000 0.445 2211 E N 0.284 120.488 120.200 0.006 0.000 2.107 2211 E HA -0.082 4.268 4.350 -0.001 0.000 0.191 2211 E C 1.654 178.260 176.600 0.011 0.000 0.982 2211 E CA 1.154 57.559 56.400 0.008 0.000 0.809 2211 E CB -0.357 29.349 29.700 0.011 0.000 0.756 2211 E HN 0.644 nan 8.360 nan 0.000 0.459 2212 I N 0.245 120.824 120.570 0.014 0.000 2.252 2212 I HA -0.223 3.947 4.170 -0.001 0.000 0.245 2212 I C 2.271 178.394 176.117 0.011 0.000 1.102 2212 I CA 1.137 62.446 61.300 0.014 0.000 1.385 2212 I CB -0.239 37.770 38.000 0.016 0.000 1.064 2212 I HN 0.061 nan 8.210 nan 0.000 0.414 2213 K N 1.796 122.201 120.400 0.009 0.000 2.063 2213 K HA -0.134 4.185 4.320 -0.001 0.000 0.208 2213 K C 2.035 178.638 176.600 0.005 0.000 1.048 2213 K CA 1.731 58.021 56.287 0.006 0.000 0.928 2213 K CB -0.392 32.109 32.500 0.002 0.000 0.713 2213 K HN 0.270 nan 8.250 nan 0.000 0.442 2214 A N 0.278 123.100 122.820 0.004 0.000 1.972 2214 A HA -0.166 4.154 4.320 -0.001 0.000 0.219 2214 A C 2.140 179.728 177.584 0.007 0.000 1.169 2214 A CA 2.138 54.177 52.037 0.004 0.000 0.635 2214 A CB -1.015 17.987 19.000 0.003 0.000 0.810 2214 A HN 0.568 nan 8.150 nan 0.000 0.446 2215 S N -1.668 114.038 115.700 0.009 0.000 2.442 2215 S HA 0.238 4.708 4.470 -0.001 0.000 0.236 2215 S C 1.647 176.255 174.600 0.013 0.000 1.007 2215 S CA 1.455 59.662 58.200 0.012 0.000 0.965 2215 S CB -0.560 62.650 63.200 0.016 0.000 0.773 2215 S HN 1.988 nan 8.310 nan 0.000 0.504 2216 G N 0.656 109.463 108.800 0.011 0.000 2.175 2216 G HA2 -0.069 3.890 3.960 -0.001 0.000 0.244 2216 G HA3 -0.069 3.890 3.960 -0.001 0.000 0.244 2216 G C 0.254 175.162 174.900 0.014 0.000 0.982 2216 G CA 0.028 45.135 45.100 0.012 0.000 0.641 2216 G HN 1.368 nan 8.290 nan 0.000 0.527 2217 A N 0.001 122.831 122.820 0.015 0.000 2.498 2217 A HA 0.594 4.914 4.320 -0.001 0.000 0.239 2217 A C 1.171 178.760 177.584 0.008 0.000 1.068 2217 A CA 0.960 53.008 52.037 0.017 0.000 0.766 2217 A CB 0.196 19.207 19.000 0.020 0.000 1.003 2217 A HN 0.363 nan 8.150 nan 0.000 0.497 2218 N N 0.337 119.042 118.700 0.007 0.000 2.382 2218 N HA 0.114 4.853 4.740 -0.001 0.000 0.200 2218 N C -0.643 174.850 175.510 -0.027 0.000 1.122 2218 N CA 0.491 53.539 53.050 -0.004 0.000 0.870 2218 N CB 0.884 39.374 38.487 0.004 0.000 1.176 2218 N HN 0.381 nan 8.380 nan 0.000 0.474 2219 V N 2.357 122.253 119.914 -0.030 0.000 2.495 2219 V HA 0.441 4.560 4.120 -0.001 0.000 0.298 2219 V C -0.875 175.147 176.094 -0.119 0.000 1.031 2219 V CA -0.825 61.414 62.300 -0.103 0.000 0.871 2219 V CB 2.366 34.162 31.823 -0.045 0.000 0.988 2219 V HN 0.002 nan 8.190 nan 0.000 0.432 2220 L N 5.629 126.705 121.223 -0.245 0.000 2.372 2220 L HA 0.670 5.010 4.340 -0.001 0.000 0.274 2220 L C -1.325 175.348 176.870 -0.329 0.000 0.988 2220 L CA 0.013 54.751 54.840 -0.170 0.000 0.833 2220 L CB 1.286 43.291 42.059 -0.089 0.000 1.236 2220 L HN 0.472 nan 8.230 nan 0.000 0.410 2221 F N 4.946 124.897 119.950 0.002 0.000 2.361 2221 F HA 0.419 4.945 4.527 -0.001 0.000 0.364 2221 F C 0.256 176.054 175.800 -0.003 0.000 1.117 2221 F CA -0.314 57.684 58.000 -0.003 0.000 1.071 2221 F CB 1.240 40.237 39.000 -0.004 0.000 1.188 2221 F HN 0.489 nan 8.300 nan 0.000 0.464 2222 C N 5.166 124.541 119.300 0.125 0.000 2.295 2222 C HA 0.220 4.679 4.460 -0.001 0.000 0.331 2222 C C 1.680 176.716 174.990 0.077 0.000 1.280 2222 C CA -0.462 58.601 59.018 0.076 0.000 1.746 2222 C CB 0.638 28.395 27.740 0.029 0.000 2.328 2222 C HN 0.937 nan 8.230 nan 0.000 0.521 2223 Q N 3.339 123.175 119.800 0.061 0.000 2.084 2223 Q HA -0.054 4.285 4.340 -0.001 0.000 0.202 2223 Q C 0.851 176.869 176.000 0.029 0.000 0.978 2223 Q CA 1.630 57.459 55.803 0.043 0.000 0.844 2223 Q CB 0.172 28.927 28.738 0.029 0.000 0.898 2223 Q HN 0.760 nan 8.270 nan 0.000 0.426 2224 K N -1.145 119.269 120.400 0.023 0.000 2.646 2224 K HA 0.421 4.741 4.320 -0.001 0.000 0.270 2224 K C 0.393 176.998 176.600 0.009 0.000 1.026 2224 K CA -0.191 56.104 56.287 0.013 0.000 1.043 2224 K CB 0.063 32.568 32.500 0.009 0.000 1.383 2224 K HN 0.105 nan 8.250 nan 0.000 0.513 2225 G N 0.279 109.079 108.800 0.000 0.000 2.634 2225 G HA2 0.397 4.357 3.960 -0.001 0.000 0.255 2225 G HA3 0.397 4.357 3.960 -0.001 0.000 0.255 2225 G C -0.499 174.392 174.900 -0.015 0.000 1.205 2225 G CA -0.523 44.572 45.100 -0.009 0.000 0.884 2225 G HN 0.371 nan 8.290 nan 0.000 0.549 2226 I N 0.450 121.003 120.570 -0.028 0.000 2.447 2226 I HA 0.161 4.331 4.170 -0.001 0.000 0.287 2226 I C -0.518 175.564 176.117 -0.059 0.000 1.023 2226 I CA -0.747 60.528 61.300 -0.041 0.000 1.083 2226 I CB 2.041 40.011 38.000 -0.049 0.000 1.245 2226 I HN 0.414 nan 8.210 nan 0.000 0.434 2227 D N 5.366 125.730 120.400 -0.059 0.000 2.414 2227 D HA -0.042 4.598 4.640 -0.001 0.000 0.242 2227 D C 0.667 176.891 176.300 -0.127 0.000 1.129 2227 D CA 0.160 54.116 54.000 -0.074 0.000 0.885 2227 D CB 1.316 42.081 40.800 -0.058 0.000 1.198 2227 D HN 0.500 nan 8.370 nan 0.000 0.437 2228 D N 3.190 123.503 120.400 -0.144 0.000 2.190 2228 D HA -0.183 4.457 4.640 -0.001 0.000 0.200 2228 D C 1.845 177.927 176.300 -0.362 0.000 0.992 2228 D CA 0.555 54.405 54.000 -0.251 0.000 0.854 2228 D CB 0.155 40.849 40.800 -0.177 0.000 0.936 2228 D HN 0.475 nan 8.370 nan 0.000 0.462 2229 L N 0.529 121.632 121.223 -0.201 0.000 2.056 2229 L HA -0.158 4.182 4.340 -0.001 0.000 0.207 2229 L C 2.328 178.981 176.870 -0.362 0.000 1.078 2229 L CA 1.248 55.959 54.840 -0.215 0.000 0.749 2229 L CB -0.144 41.818 42.059 -0.162 0.000 0.901 2229 L HN -0.046 nan 8.230 nan 0.000 0.433 2230 A N -0.847 121.840 122.820 -0.221 0.000 1.969 2230 A HA -0.242 4.077 4.320 -0.001 0.000 0.218 2230 A C 2.063 179.579 177.584 -0.114 0.000 1.169 2230 A CA 1.449 53.411 52.037 -0.125 0.000 0.635 2230 A CB -0.408 18.562 19.000 -0.050 0.000 0.810 2230 A HN 0.595 nan 8.150 nan 0.000 0.445 2231 Q N -1.117 118.564 119.800 -0.199 0.000 2.170 2231 Q HA -0.170 4.169 4.340 -0.001 0.000 0.203 2231 Q C 1.933 177.841 176.000 -0.154 0.000 0.976 2231 Q CA 1.359 57.047 55.803 -0.192 0.000 0.858 2231 Q CB -0.252 28.317 28.738 -0.280 0.000 0.907 2231 Q HN 0.748 nan 8.270 nan 0.000 0.433 2232 H N -0.799 118.205 119.070 -0.110 0.000 2.326 2232 H HA -0.123 4.433 4.556 -0.001 0.000 0.301 2232 H C 1.744 177.113 175.328 0.068 0.000 1.081 2232 H CA 1.260 57.261 56.048 -0.077 0.000 1.334 2232 H CB -0.216 29.433 29.762 -0.189 0.000 1.385 2232 H HN 0.305 nan 8.280 nan 0.000 0.504 2233 Y N 0.658 121.026 120.300 0.113 0.000 2.314 2233 Y HA -0.057 4.493 4.550 -0.001 0.000 0.293 2233 Y C 2.809 178.726 175.900 0.028 0.000 1.129 2233 Y CA 0.110 58.244 58.100 0.057 0.000 1.201 2233 Y CB -0.902 37.582 38.460 0.041 0.000 0.999 2233 Y HN 0.056 nan 8.280 nan 0.000 0.541 2234 L N -0.761 120.562 121.223 0.167 0.000 2.046 2234 L HA -0.223 4.116 4.340 -0.001 0.000 0.208 2234 L C 2.631 179.535 176.870 0.056 0.000 1.077 2234 L CA 1.254 56.139 54.840 0.076 0.000 0.747 2234 L CB -0.779 41.293 42.059 0.021 0.000 0.896 2234 L HN 0.157 nan 8.230 nan 0.000 0.432 2235 A N -0.049 122.809 122.820 0.065 0.000 1.930 2235 A HA -0.199 4.120 4.320 -0.001 0.000 0.217 2235 A C 2.299 179.923 177.584 0.066 0.000 1.175 2235 A CA 1.509 53.579 52.037 0.056 0.000 0.627 2235 A CB -0.308 18.732 19.000 0.067 0.000 0.815 2235 A HN 0.313 nan 8.150 nan 0.000 0.443 2236 K N -0.383 120.077 120.400 0.100 0.000 2.211 2236 K HA -0.084 4.235 4.320 -0.001 0.000 0.203 2236 K C 1.190 177.817 176.600 0.044 0.000 1.050 2236 K CA 1.163 57.498 56.287 0.079 0.000 0.945 2236 K CB 0.006 32.572 32.500 0.110 0.000 0.732 2236 K HN 0.359 nan 8.250 nan 0.000 0.451 2237 E N -0.471 119.756 120.200 0.045 0.000 2.489 2237 E HA 0.024 4.373 4.350 -0.001 0.000 0.193 2237 E C 0.876 177.485 176.600 0.016 0.000 1.057 2237 E CA 0.420 56.834 56.400 0.022 0.000 0.866 2237 E CB 0.643 30.356 29.700 0.022 0.000 0.916 2237 E HN 0.451 nan 8.360 nan 0.000 0.500 2238 G N 1.920 110.731 108.800 0.019 0.000 2.147 2238 G HA2 -0.289 3.670 3.960 -0.001 0.000 0.244 2238 G HA3 -0.289 3.670 3.960 -0.001 0.000 0.244 2238 G C 0.234 175.135 174.900 0.000 0.000 1.005 2238 G CA 0.174 45.279 45.100 0.010 0.000 0.713 2238 G HN 0.269 nan 8.290 nan 0.000 0.515 2239 I N 1.044 121.614 120.570 -0.000 0.000 2.342 2239 I HA 0.422 4.592 4.170 -0.001 0.000 0.291 2239 I C 1.018 177.113 176.117 -0.036 0.000 1.010 2239 I CA -1.088 60.202 61.300 -0.017 0.000 1.308 2239 I CB 1.551 39.544 38.000 -0.012 0.000 1.400 2239 I HN 0.148 nan 8.210 nan 0.000 0.488 2240 V N 3.807 123.685 119.914 -0.061 0.000 2.509 2240 V HA 0.911 5.031 4.120 -0.001 0.000 0.284 2240 V C 0.063 176.062 176.094 -0.158 0.000 1.047 2240 V CA -0.282 61.963 62.300 -0.092 0.000 0.952 2240 V CB 1.172 32.942 31.823 -0.089 0.000 0.988 2240 V HN 0.820 nan 8.190 nan 0.000 0.469 2241 A N 3.623 126.345 122.820 -0.162 0.000 2.515 2241 A HA 0.999 5.318 4.320 -0.001 0.000 0.298 2241 A C -0.329 177.137 177.584 -0.197 0.000 1.059 2241 A CA -0.314 51.601 52.037 -0.202 0.000 0.698 2241 A CB 1.877 20.805 19.000 -0.121 0.000 1.289 2241 A HN 2.330 nan 8.150 nan 0.000 0.404 2242 A N 1.912 124.589 122.820 -0.237 0.000 2.359 2242 A HA 0.739 5.059 4.320 -0.001 0.000 0.303 2242 A C -0.008 177.562 177.584 -0.023 0.000 1.066 2242 A CA -0.649 51.322 52.037 -0.109 0.000 0.730 2242 A CB 0.780 19.735 19.000 -0.076 0.000 1.211 2242 A HN 1.205 nan 8.150 nan 0.000 0.439 2243 R N 1.838 122.334 120.500 -0.007 0.000 2.700 2243 R HA 0.718 5.057 4.340 -0.001 0.000 0.253 2243 R C -0.363 175.954 176.300 0.027 0.000 1.091 2243 R CA -0.782 55.323 56.100 0.009 0.000 1.104 2243 R CB 0.406 30.699 30.300 -0.012 0.000 1.202 2243 R HN 0.493 nan 8.270 nan 0.000 0.532 2244 R N -0.925 119.589 120.500 0.023 0.000 3.516 2244 R HA -0.111 4.229 4.340 -0.001 0.000 0.271 2244 R C -0.681 175.638 176.300 0.032 0.000 1.098 2244 R CA 0.569 56.681 56.100 0.021 0.000 0.732 2244 R CB -2.619 27.688 30.300 0.010 0.000 1.152 2244 R HN 0.528 nan 8.270 nan 0.000 0.455 2245 V N 1.412 121.358 119.914 0.053 0.000 2.572 2245 V HA 0.036 4.155 4.120 -0.001 0.000 0.291 2245 V C 1.468 177.576 176.094 0.024 0.000 1.039 2245 V CA -0.021 62.316 62.300 0.061 0.000 1.055 2245 V CB 1.181 33.072 31.823 0.114 0.000 0.969 2245 V HN 0.153 nan 8.190 nan 0.000 0.482 2246 K N 3.310 123.713 120.400 0.005 0.000 2.382 2246 K HA 0.030 4.350 4.320 -0.001 0.000 0.275 2246 K C 1.209 177.800 176.600 -0.015 0.000 1.009 2246 K CA -0.318 55.964 56.287 -0.008 0.000 0.970 2246 K CB 0.548 33.038 32.500 -0.017 0.000 0.934 2246 K HN 0.608 nan 8.250 nan 0.000 0.479 2247 K N 1.975 122.368 120.400 -0.012 0.000 2.074 2247 K HA -0.198 4.121 4.320 -0.001 0.000 0.209 2247 K C 1.914 178.499 176.600 -0.026 0.000 1.048 2247 K CA 2.226 58.505 56.287 -0.014 0.000 0.926 2247 K CB -0.552 31.943 32.500 -0.010 0.000 0.713 2247 K HN 0.582 nan 8.250 nan 0.000 0.444 2248 S N 0.183 115.866 115.700 -0.029 0.000 2.359 2248 S HA -0.170 4.299 4.470 -0.001 0.000 0.224 2248 S C 1.401 175.966 174.600 -0.058 0.000 1.035 2248 S CA 1.784 59.962 58.200 -0.038 0.000 1.018 2248 S CB -0.555 62.625 63.200 -0.034 0.000 0.876 2248 S HN 0.424 nan 8.310 nan 0.000 0.448 2249 D N 0.917 121.276 120.400 -0.067 0.000 2.144 2249 D HA -0.060 4.579 4.640 -0.001 0.000 0.199 2249 D C 2.002 178.214 176.300 -0.146 0.000 0.984 2249 D CA 0.980 54.914 54.000 -0.111 0.000 0.834 2249 D CB -0.274 40.465 40.800 -0.101 0.000 0.955 2249 D HN 0.382 nan 8.370 nan 0.000 0.465 2250 M N 0.480 120.022 119.600 -0.096 0.000 2.159 2250 M HA -0.087 4.392 4.480 -0.001 0.000 0.263 2250 M C 1.889 178.141 176.300 -0.080 0.000 1.063 2250 M CA 1.201 56.451 55.300 -0.085 0.000 1.110 2250 M CB -0.754 31.828 32.600 -0.031 0.000 1.374 2250 M HN 0.119 nan 8.290 nan 0.000 0.411 2251 E N 0.015 120.176 120.200 -0.065 0.000 2.076 2251 E HA -0.121 4.228 4.350 -0.001 0.000 0.190 2251 E C 2.064 178.625 176.600 -0.064 0.000 0.979 2251 E CA 0.794 57.162 56.400 -0.052 0.000 0.807 2251 E CB 0.015 29.692 29.700 -0.038 0.000 0.761 2251 E HN 0.494 nan 8.360 nan 0.000 0.454 2252 K N 0.679 121.030 120.400 -0.082 0.000 2.097 2252 K HA -0.093 4.227 4.320 -0.001 0.000 0.206 2252 K C 2.197 178.732 176.600 -0.107 0.000 1.049 2252 K CA 0.832 57.067 56.287 -0.086 0.000 0.933 2252 K CB -0.083 32.360 32.500 -0.095 0.000 0.717 2252 K HN 0.106 nan 8.250 nan 0.000 0.442 2253 L N 0.475 121.601 121.223 -0.162 0.000 2.093 2253 L HA -0.164 4.176 4.340 -0.001 0.000 0.208 2253 L C 2.580 179.385 176.870 -0.108 0.000 1.085 2253 L CA 1.031 55.751 54.840 -0.200 0.000 0.755 2253 L CB -0.537 41.296 42.059 -0.377 0.000 0.904 2253 L HN 0.193 nan 8.230 nan 0.000 0.435 2254 A N 0.087 122.860 122.820 -0.078 0.000 1.930 2254 A HA -0.198 4.121 4.320 -0.001 0.000 0.217 2254 A C 2.321 179.890 177.584 -0.025 0.000 1.175 2254 A CA 1.526 53.540 52.037 -0.037 0.000 0.627 2254 A CB -0.280 18.703 19.000 -0.028 0.000 0.815 2254 A HN 0.306 nan 8.150 nan 0.000 0.443 2255 K N -0.314 120.067 120.400 -0.032 0.000 2.026 2255 K HA -0.041 4.279 4.320 -0.001 0.000 0.208 2255 K C 2.333 178.928 176.600 -0.008 0.000 1.048 2255 K CA 1.197 57.473 56.287 -0.019 0.000 0.929 2255 K CB -0.283 32.202 32.500 -0.024 0.000 0.713 2255 K HN 0.437 nan 8.250 nan 0.000 0.439 2256 A N 1.023 123.831 122.820 -0.020 0.000 1.855 2256 A HA -0.124 4.195 4.320 -0.001 0.000 0.213 2256 A C 2.287 179.877 177.584 0.010 0.000 1.195 2256 A CA 2.035 54.067 52.037 -0.007 0.000 0.610 2256 A CB -0.942 18.042 19.000 -0.027 0.000 0.837 2256 A HN 0.452 nan 8.150 nan 0.000 0.444 2257 T N -4.299 110.255 114.554 0.001 0.000 3.043 2257 T HA 0.357 4.707 4.350 -0.001 0.000 0.263 2257 T C 1.485 176.203 174.700 0.030 0.000 1.094 2257 T CA 1.235 63.347 62.100 0.020 0.000 1.127 2257 T CB -0.134 68.746 68.868 0.021 0.000 0.905 2257 T HN 1.772 nan 8.240 nan 0.000 0.490 2258 G N 1.527 110.339 108.800 0.020 0.000 2.143 2258 G HA2 -0.052 3.907 3.960 -0.001 0.000 0.248 2258 G HA3 -0.052 3.907 3.960 -0.001 0.000 0.248 2258 G C 0.282 175.194 174.900 0.020 0.000 0.991 2258 G CA 0.036 45.149 45.100 0.022 0.000 0.689 2258 G HN 1.209 nan 8.290 nan 0.000 0.522 2259 A N -0.326 122.505 122.820 0.018 0.000 2.445 2259 A HA 0.560 4.880 4.320 -0.001 0.000 0.242 2259 A C 0.459 178.053 177.584 0.017 0.000 1.075 2259 A CA 0.551 52.603 52.037 0.025 0.000 0.777 2259 A CB 0.377 19.397 19.000 0.034 0.000 1.013 2259 A HN 0.817 nan 8.150 nan 0.000 0.493 2260 N N 1.663 120.376 118.700 0.021 0.000 2.444 2260 N HA 0.358 5.098 4.740 -0.001 0.000 0.262 2260 N C -0.872 174.650 175.510 0.020 0.000 0.974 2260 N CA -0.356 52.704 53.050 0.016 0.000 0.933 2260 N CB 1.157 39.653 38.487 0.015 0.000 1.137 2260 N HN 0.288 nan 8.380 nan 0.000 0.498 2261 V N 4.914 124.836 119.914 0.014 0.000 2.485 2261 V HA 0.140 4.260 4.120 -0.001 0.000 0.287 2261 V C 0.401 176.505 176.094 0.017 0.000 1.022 2261 V CA -0.063 62.247 62.300 0.017 0.000 1.067 2261 V CB -0.126 31.703 31.823 0.009 0.000 0.967 2261 V HN 0.516 nan 8.190 nan 0.000 0.479 2262 I N 4.133 124.716 120.570 0.022 0.000 2.441 2262 I HA 0.438 4.608 4.170 -0.001 0.000 0.295 2262 I C 0.986 177.114 176.117 0.018 0.000 0.994 2262 I CA -0.338 60.974 61.300 0.019 0.000 1.144 2262 I CB 1.314 39.327 38.000 0.021 0.000 1.314 2262 I HN 0.635 nan 8.210 nan 0.000 0.445 2263 A N 5.622 128.451 122.820 0.014 0.000 1.832 2263 A HA 0.355 4.674 4.320 -0.001 0.000 0.214 2263 A C 1.079 178.671 177.584 0.014 0.000 1.204 2263 A CA 1.095 53.139 52.037 0.013 0.000 0.606 2263 A CB -0.177 18.829 19.000 0.010 0.000 0.849 2263 A HN 0.733 nan 8.150 nan 0.000 0.445 2264 A N -1.022 121.806 122.820 0.013 0.000 2.317 2264 A HA 0.645 4.964 4.320 -0.001 0.000 0.327 2264 A C 0.738 178.330 177.584 0.014 0.000 1.178 2264 A CA -0.593 51.451 52.037 0.013 0.000 0.817 2264 A CB 0.401 19.407 19.000 0.011 0.000 1.189 2264 A HN 0.364 nan 8.150 nan 0.000 0.489 2265 I N 1.822 122.401 120.570 0.015 0.000 2.335 2265 I HA -0.332 3.837 4.170 -0.001 0.000 0.251 2265 I C 2.756 178.881 176.117 0.014 0.000 1.129 2265 I CA 1.638 62.948 61.300 0.016 0.000 1.402 2265 I CB -0.247 37.763 38.000 0.016 0.000 1.069 2265 I HN 0.779 nan 8.210 nan 0.000 0.424 2266 A N 0.819 123.646 122.820 0.012 0.000 1.917 2266 A HA -0.233 4.086 4.320 -0.001 0.000 0.219 2266 A C 2.505 180.095 177.584 0.010 0.000 1.182 2266 A CA 2.093 54.136 52.037 0.010 0.000 0.633 2266 A CB -0.747 18.259 19.000 0.009 0.000 0.819 2266 A HN 0.460 nan 8.150 nan 0.000 0.448 2267 A N -1.299 121.528 122.820 0.011 0.000 2.067 2267 A HA 0.291 4.611 4.320 -0.001 0.000 0.217 2267 A C 1.024 178.615 177.584 0.012 0.000 1.156 2267 A CA 0.473 52.517 52.037 0.011 0.000 0.683 2267 A CB -0.451 18.555 19.000 0.010 0.000 0.808 2267 A HN 0.598 nan 8.150 nan 0.000 0.455 2268 L N 1.819 123.051 121.223 0.014 0.000 2.477 2268 L HA 0.360 4.699 4.340 -0.001 0.000 0.272 2268 L C 0.379 177.258 176.870 0.015 0.000 1.157 2268 L CA 0.502 55.352 54.840 0.016 0.000 0.889 2268 L CB 0.386 42.457 42.059 0.019 0.000 1.158 2268 L HN 0.344 nan 8.230 nan 0.000 0.473 2269 S N 3.376 119.085 115.700 0.015 0.000 2.704 2269 S HA 0.781 5.251 4.470 -0.001 0.000 0.296 2269 S C 0.837 175.446 174.600 0.016 0.000 1.138 2269 S CA -0.349 57.859 58.200 0.014 0.000 0.875 2269 S CB 1.277 64.484 63.200 0.012 0.000 1.151 2269 S HN 0.810 nan 8.310 nan 0.000 0.500 2270 A N 0.371 123.200 122.820 0.015 0.000 2.024 2270 A HA -0.082 4.238 4.320 -0.001 0.000 0.220 2270 A C 2.021 179.616 177.584 0.018 0.000 1.164 2270 A CA 1.526 53.573 52.037 0.016 0.000 0.643 2270 A CB -1.059 17.950 19.000 0.014 0.000 0.806 2270 A HN 0.857 nan 8.150 nan 0.000 0.451 2271 Q N -0.519 119.290 119.800 0.016 0.000 2.436 2271 Q HA -0.100 4.240 4.340 -0.001 0.000 0.209 2271 Q C 0.545 176.556 176.000 0.018 0.000 0.965 2271 Q CA 0.978 56.791 55.803 0.016 0.000 0.910 2271 Q CB 0.013 28.758 28.738 0.013 0.000 0.980 2271 Q HN 0.612 nan 8.270 nan 0.000 0.491 2272 D N -0.203 120.209 120.400 0.020 0.000 2.350 2272 D HA 0.015 4.655 4.640 -0.001 0.000 0.213 2272 D C -0.147 176.170 176.300 0.028 0.000 1.031 2272 D CA 0.222 54.235 54.000 0.022 0.000 0.861 2272 D CB 0.375 41.187 40.800 0.021 0.000 0.926 2272 D HN 0.096 nan 8.370 nan 0.000 0.520 2273 L N 0.967 122.209 121.223 0.031 0.000 2.380 2273 L HA 0.325 4.664 4.340 -0.001 0.000 0.273 2273 L C 1.284 178.178 176.870 0.040 0.000 1.138 2273 L CA -0.031 54.832 54.840 0.039 0.000 0.832 2273 L CB 1.013 43.093 42.059 0.036 0.000 1.124 2273 L HN -0.174 nan 8.230 nan 0.000 0.454 2274 G N 1.184 110.013 108.800 0.048 0.000 2.488 2274 G HA2 0.535 4.495 3.960 -0.001 0.000 0.318 2274 G HA3 0.535 4.495 3.960 -0.001 0.000 0.318 2274 G C -1.111 173.820 174.900 0.051 0.000 1.188 2274 G CA -0.461 44.667 45.100 0.046 0.000 0.944 2274 G HN 0.529 nan 8.290 nan 0.000 0.495 2275 D N -0.394 120.035 120.400 0.047 0.000 2.350 2275 D HA 0.661 5.301 4.640 -0.001 0.000 0.245 2275 D C -0.250 176.076 176.300 0.044 0.000 1.036 2275 D CA 0.066 54.093 54.000 0.045 0.000 0.848 2275 D CB 1.971 42.794 40.800 0.039 0.000 1.307 2275 D HN 0.592 nan 8.370 nan 0.000 0.469 2276 A N 0.304 123.151 122.820 0.046 0.000 2.488 2276 A HA 0.623 4.942 4.320 -0.001 0.000 0.298 2276 A C 0.961 178.567 177.584 0.037 0.000 1.044 2276 A CA -0.413 51.651 52.037 0.045 0.000 0.693 2276 A CB 1.614 20.655 19.000 0.069 0.000 1.272 2276 A HN 0.487 nan 8.150 nan 0.000 0.402 2277 G N 0.327 109.142 108.800 0.025 0.000 2.408 2277 G HA2 0.300 4.259 3.960 -0.001 0.000 0.217 2277 G HA3 0.300 4.259 3.960 -0.001 0.000 0.217 2277 G C 0.284 175.200 174.900 0.026 0.000 1.150 2277 G CA 1.652 46.762 45.100 0.018 0.000 0.776 2277 G HN 1.220 nan 8.290 nan 0.000 0.542 2278 L N 0.121 121.368 121.223 0.039 0.000 2.562 2278 L HA 0.584 4.923 4.340 -0.001 0.000 0.266 2278 L C -1.332 175.585 176.870 0.077 0.000 0.949 2278 L CA -0.733 54.135 54.840 0.047 0.000 0.879 2278 L CB 2.421 44.500 42.059 0.033 0.000 1.278 2278 L HN -0.148 nan 8.230 nan 0.000 0.404 2279 V N 4.494 124.459 119.914 0.084 0.000 2.334 2279 V HA 0.625 4.745 4.120 -0.001 0.000 0.281 2279 V C -0.365 175.791 176.094 0.103 0.000 1.016 2279 V CA -0.426 61.947 62.300 0.121 0.000 0.832 2279 V CB 1.391 33.296 31.823 0.136 0.000 0.999 2279 V HN 0.823 nan 8.190 nan 0.000 0.439 2280 E N 3.267 123.550 120.200 0.138 0.000 2.292 2280 E HA 0.388 4.738 4.350 -0.001 0.000 0.272 2280 E C -0.881 175.819 176.600 0.167 0.000 0.881 2280 E CA -0.681 55.784 56.400 0.108 0.000 0.754 2280 E CB 2.066 31.800 29.700 0.057 0.000 1.201 2280 E HN 0.743 nan 8.360 nan 0.000 0.425 2281 E N 4.422 124.690 120.200 0.114 0.000 2.129 2281 E HA 0.200 4.549 4.350 -0.001 0.000 0.283 2281 E C -0.865 175.801 176.600 0.110 0.000 1.080 2281 E CA -0.158 56.319 56.400 0.128 0.000 0.867 2281 E CB 0.601 30.344 29.700 0.072 0.000 1.056 2281 E HN 0.346 nan 8.360 nan 0.000 0.404 2282 R N 3.596 124.206 120.500 0.183 0.000 2.750 2282 R HA 0.412 4.752 4.340 -0.001 0.000 0.281 2282 R C -0.682 175.708 176.300 0.149 0.000 0.972 2282 R CA -0.924 55.229 56.100 0.088 0.000 0.912 2282 R CB 1.967 32.185 30.300 -0.137 0.000 1.187 2282 R HN 0.329 nan 8.270 nan 0.000 0.464 2283 K N 1.970 122.413 120.400 0.071 0.000 2.159 2283 K HA 0.459 4.778 4.320 -0.001 0.000 0.266 2283 K C -0.756 175.888 176.600 0.073 0.000 0.975 2283 K CA -0.458 55.873 56.287 0.074 0.000 0.865 2283 K CB 1.736 34.259 32.500 0.038 0.000 1.087 2283 K HN 0.434 nan 8.250 nan 0.000 0.446 2284 I N 1.412 122.037 120.570 0.091 0.000 2.468 2284 I HA 0.056 4.226 4.170 -0.001 0.000 0.285 2284 I C -0.635 175.512 176.117 0.051 0.000 1.039 2284 I CA -0.018 61.330 61.300 0.080 0.000 1.074 2284 I CB 1.325 39.404 38.000 0.132 0.000 1.228 2284 I HN 0.700 nan 8.210 nan 0.000 0.436 2285 S N 4.743 120.463 115.700 0.033 0.000 3.587 2285 S HA -0.198 4.272 4.470 -0.001 0.000 0.337 2285 S C 1.070 175.682 174.600 0.019 0.000 1.119 2285 S CA 1.183 59.395 58.200 0.021 0.000 0.976 2285 S CB -1.611 61.599 63.200 0.018 0.000 0.922 2285 S HN 1.594 nan 8.310 nan 0.000 0.503 2286 G N 0.089 108.903 108.800 0.022 0.000 2.284 2286 G HA2 -0.250 3.710 3.960 -0.001 0.000 0.230 2286 G HA3 -0.250 3.710 3.960 -0.001 0.000 0.230 2286 G C -0.416 174.499 174.900 0.026 0.000 1.021 2286 G CA 0.123 45.235 45.100 0.020 0.000 0.619 2286 G HN 0.596 nan 8.290 nan 0.000 0.510 2287 D N 1.262 121.680 120.400 0.031 0.000 2.308 2287 D HA 0.471 5.110 4.640 -0.001 0.000 0.251 2287 D C 0.303 176.635 176.300 0.054 0.000 1.127 2287 D CA 0.498 54.518 54.000 0.034 0.000 0.876 2287 D CB 1.614 42.429 40.800 0.025 0.000 1.176 2287 D HN 0.197 nan 8.370 nan 0.000 0.446 2288 S N 2.908 118.637 115.700 0.048 0.000 2.481 2288 S HA 0.400 4.869 4.470 -0.001 0.000 0.276 2288 S C -0.229 174.413 174.600 0.070 0.000 1.247 2288 S CA -0.403 57.837 58.200 0.066 0.000 1.053 2288 S CB 0.036 63.264 63.200 0.047 0.000 0.925 2288 S HN 0.313 nan 8.310 nan 0.000 0.491 2289 M N 4.476 124.146 119.600 0.117 0.000 2.619 2289 M HA 0.532 5.012 4.480 -0.001 0.000 0.297 2289 M C -1.068 175.306 176.300 0.124 0.000 1.229 2289 M CA -0.638 54.700 55.300 0.062 0.000 0.860 2289 M CB 2.152 34.736 32.600 -0.026 0.000 1.741 2289 M HN 0.438 nan 8.290 nan 0.000 0.462 2290 I N 1.687 122.270 120.570 0.021 0.000 2.339 2290 I HA 0.362 4.532 4.170 -0.001 0.000 0.290 2290 I C -1.345 174.754 176.117 -0.030 0.000 0.994 2290 I CA -0.368 61.002 61.300 0.116 0.000 1.191 2290 I CB 0.931 39.033 38.000 0.169 0.000 1.343 2290 I HN 0.437 nan 8.210 nan 0.000 0.458 2291 F N 5.971 125.958 119.950 0.061 0.000 2.385 2291 F HA 0.379 4.905 4.527 -0.001 0.000 0.360 2291 F C 0.093 175.927 175.800 0.056 0.000 1.122 2291 F CA -0.771 57.255 58.000 0.044 0.000 1.090 2291 F CB 1.360 40.376 39.000 0.027 0.000 1.150 2291 F HN 0.016 nan 8.300 nan 0.000 0.472 2292 V N 4.424 124.432 119.914 0.157 0.000 2.311 2292 V HA 0.397 4.517 4.120 -0.001 0.000 0.275 2292 V C -0.299 175.852 176.094 0.094 0.000 1.022 2292 V CA -0.533 61.837 62.300 0.117 0.000 0.830 2292 V CB 0.563 32.420 31.823 0.057 0.000 1.012 2292 V HN 0.838 nan 8.190 nan 0.000 0.452 2293 E N 3.139 123.398 120.200 0.097 0.000 2.446 2293 E HA 0.622 4.972 4.350 -0.001 0.000 0.276 2293 E C -0.668 175.958 176.600 0.044 0.000 0.969 2293 E CA -0.877 55.566 56.400 0.072 0.000 0.800 2293 E CB 1.683 31.438 29.700 0.091 0.000 1.341 2293 E HN 0.220 nan 8.360 nan 0.000 0.460 2294 E N -1.202 119.012 120.200 0.023 0.000 3.181 2294 E HA -0.156 4.194 4.350 -0.001 0.000 0.293 2294 E C -0.553 176.041 176.600 -0.009 0.000 0.936 2294 E CA 0.747 57.148 56.400 0.002 0.000 0.975 2294 E CB -2.397 27.307 29.700 0.006 0.000 1.496 2294 E HN 0.593 nan 8.360 nan 0.000 0.429 2295 C N 0.969 120.266 119.300 -0.005 0.000 2.689 2295 C HA 0.068 4.528 4.460 -0.001 0.000 0.409 2295 C C 2.304 177.257 174.990 -0.061 0.000 1.293 2295 C CA -0.027 58.984 59.018 -0.011 0.000 2.136 2295 C CB 0.420 28.163 27.740 0.005 0.000 2.719 2295 C HN 0.355 nan 8.230 nan 0.000 0.644 2296 K N 0.419 120.776 120.400 -0.072 0.000 2.001 2296 K HA -0.133 4.187 4.320 -0.001 0.000 0.214 2296 K C 0.064 176.375 176.600 -0.481 0.000 1.050 2296 K CA 1.784 57.938 56.287 -0.221 0.000 0.934 2296 K CB -0.137 32.325 32.500 -0.065 0.000 0.718 2296 K HN 0.732 nan 8.250 nan 0.000 0.443 2297 H N -0.403 118.672 119.070 0.007 0.000 2.488 2297 H HA 0.202 4.757 4.556 -0.001 0.000 0.237 2297 H C -2.591 172.738 175.328 0.002 0.000 1.395 2297 H CA -1.752 54.299 56.048 0.005 0.000 1.491 2297 H CB 0.699 30.463 29.762 0.003 0.000 1.567 2297 H HN 0.121 nan 8.280 nan 0.000 0.508 2298 P HA 0.063 nan 4.420 nan 0.000 0.271 2298 P C 0.147 177.471 177.300 0.040 0.000 1.220 2298 P CA -0.518 62.604 63.100 0.037 0.000 0.768 2298 P CB 1.569 33.278 31.700 0.015 0.000 0.848 2299 K N 1.052 121.468 120.400 0.027 0.000 2.399 2299 K HA 0.459 4.778 4.320 -0.001 0.000 0.204 2299 K C 0.373 176.975 176.600 0.004 0.000 1.023 2299 K CA -0.292 56.007 56.287 0.019 0.000 1.127 2299 K CB 0.493 33.002 32.500 0.015 0.000 0.856 2299 K HN 0.542 nan 8.250 nan 0.000 0.514 2300 A N 0.514 123.333 122.820 -0.002 0.000 2.486 2300 A HA 0.662 4.981 4.320 -0.001 0.000 0.300 2300 A C -0.598 176.981 177.584 -0.010 0.000 1.048 2300 A CA -0.726 51.304 52.037 -0.012 0.000 0.696 2300 A CB 1.474 20.458 19.000 -0.027 0.000 1.278 2300 A HN -0.040 nan 8.150 nan 0.000 0.405 2301 V N -1.087 118.821 119.914 -0.010 0.000 3.074 2301 V HA 0.966 5.086 4.120 -0.001 0.000 0.314 2301 V C -0.434 175.652 176.094 -0.014 0.000 1.117 2301 V CA -0.578 61.718 62.300 -0.006 0.000 1.014 2301 V CB 1.714 33.539 31.823 0.003 0.000 1.057 2301 V HN 0.852 nan 8.190 nan 0.000 0.438 2302 T N 4.099 118.647 114.554 -0.010 0.000 2.841 2302 T HA 0.513 4.863 4.350 -0.001 0.000 0.285 2302 T C -0.515 174.183 174.700 -0.003 0.000 0.991 2302 T CA -0.212 61.876 62.100 -0.021 0.000 0.966 2302 T CB 1.346 70.184 68.868 -0.049 0.000 0.962 2302 T HN 0.957 nan 8.240 nan 0.000 0.438 2303 M N 4.895 124.491 119.600 -0.006 0.000 2.063 2303 M HA 0.477 4.956 4.480 -0.001 0.000 0.348 2303 M C -1.153 175.149 176.300 0.003 0.000 1.180 2303 M CA -0.708 54.594 55.300 0.004 0.000 1.059 2303 M CB 0.273 32.874 32.600 0.002 0.000 1.544 2303 M HN 0.532 nan 8.290 nan 0.000 0.447 2304 L N 7.304 128.538 121.223 0.019 0.000 2.259 2304 L HA 0.466 4.806 4.340 -0.001 0.000 0.288 2304 L C -1.041 175.844 176.870 0.025 0.000 1.051 2304 L CA -0.410 54.445 54.840 0.025 0.000 0.824 2304 L CB 0.441 42.539 42.059 0.064 0.000 1.206 2304 L HN 0.754 nan 8.230 nan 0.000 0.429 2305 I N 5.533 126.112 120.570 0.014 0.000 2.325 2305 I HA 0.318 4.488 4.170 -0.001 0.000 0.291 2305 I C 0.227 176.353 176.117 0.014 0.000 1.019 2305 I CA -0.304 61.004 61.300 0.013 0.000 1.302 2305 I CB 0.860 38.864 38.000 0.007 0.000 1.401 2305 I HN 0.578 nan 8.210 nan 0.000 0.485 2306 R N 4.031 124.541 120.500 0.016 0.000 2.828 2306 R HA 0.898 5.237 4.340 -0.001 0.000 0.264 2306 R C -0.238 176.069 176.300 0.012 0.000 1.022 2306 R CA -0.975 55.135 56.100 0.016 0.000 1.021 2306 R CB 2.154 32.466 30.300 0.020 0.000 1.163 2306 R HN 0.831 nan 8.270 nan 0.000 0.494 2307 G N -0.905 107.901 108.800 0.010 0.000 2.340 2307 G HA2 -0.002 3.958 3.960 -0.001 0.000 0.298 2307 G HA3 -0.002 3.958 3.960 -0.001 0.000 0.298 2307 G C -0.090 174.815 174.900 0.007 0.000 1.498 2307 G CA -0.479 44.627 45.100 0.010 0.000 0.847 2307 G HN 0.413 nan 8.290 nan 0.000 0.594 2308 T N -0.670 113.890 114.554 0.010 0.000 2.995 2308 T HA 0.279 4.628 4.350 -0.001 0.000 0.269 2308 T C 0.783 175.487 174.700 0.006 0.000 1.091 2308 T CA 2.172 64.277 62.100 0.009 0.000 1.128 2308 T CB -0.219 68.657 68.868 0.013 0.000 0.891 2308 T HN 0.701 nan 8.240 nan 0.000 0.492 2309 T N 1.031 115.588 114.554 0.006 0.000 2.956 2309 T HA 0.272 4.622 4.350 -0.001 0.000 0.312 2309 T C 0.275 174.960 174.700 -0.026 0.000 1.151 2309 T CA -0.776 61.321 62.100 -0.004 0.000 1.024 2309 T CB 2.165 71.050 68.868 0.029 0.000 1.140 2309 T HN -0.108 nan 8.240 nan 0.000 0.473 2310 E N 1.015 121.159 120.200 -0.093 0.000 2.070 2310 E HA -0.198 4.152 4.350 -0.001 0.000 0.197 2310 E C 1.667 178.192 176.600 -0.125 0.000 1.004 2310 E CA 1.673 57.983 56.400 -0.151 0.000 0.805 2310 E CB -0.071 29.469 29.700 -0.266 0.000 0.744 2310 E HN 0.560 nan 8.360 nan 0.000 0.451 2311 H N -0.238 118.835 119.070 0.005 0.000 2.491 2311 H HA -0.010 4.546 4.556 -0.001 0.000 0.290 2311 H C 2.266 177.596 175.328 0.005 0.000 1.050 2311 H CA 0.615 56.666 56.048 0.004 0.000 1.309 2311 H CB -0.041 29.723 29.762 0.004 0.000 1.392 2311 H HN -0.009 nan 8.280 nan 0.000 0.554 2312 V N 1.895 121.875 119.914 0.109 0.000 2.323 2312 V HA -0.181 3.938 4.120 -0.001 0.000 0.244 2312 V C 2.582 178.702 176.094 0.044 0.000 1.041 2312 V CA 1.604 63.944 62.300 0.065 0.000 1.025 2312 V CB -0.456 31.395 31.823 0.046 0.000 0.656 2312 V HN 0.413 nan 8.190 nan 0.000 0.451 2313 I N -1.906 118.681 120.570 0.028 0.000 3.111 2313 I HA -0.035 4.135 4.170 -0.001 0.000 0.272 2313 I C 2.062 178.190 176.117 0.019 0.000 1.268 2313 I CA 1.216 62.526 61.300 0.017 0.000 1.467 2313 I CB -0.557 37.446 38.000 0.004 0.000 1.087 2313 I HN 0.279 nan 8.210 nan 0.000 0.467 2314 E N 1.534 121.754 120.200 0.032 0.000 2.106 2314 E HA -0.162 4.187 4.350 -0.001 0.000 0.192 2314 E C 1.961 178.584 176.600 0.039 0.000 0.984 2314 E CA 1.117 57.542 56.400 0.042 0.000 0.806 2314 E CB 0.040 29.789 29.700 0.082 0.000 0.750 2314 E HN 0.538 nan 8.360 nan 0.000 0.458 2315 E N 0.330 120.556 120.200 0.043 0.000 2.107 2315 E HA -0.099 4.251 4.350 -0.001 0.000 0.191 2315 E C 2.316 178.931 176.600 0.025 0.000 0.982 2315 E CA 0.554 56.973 56.400 0.032 0.000 0.809 2315 E CB -0.043 29.677 29.700 0.034 0.000 0.756 2315 E HN 0.126 nan 8.360 nan 0.000 0.459 2316 V N 1.841 121.769 119.914 0.024 0.000 2.358 2316 V HA -0.235 3.884 4.120 -0.001 0.000 0.246 2316 V C 2.499 178.601 176.094 0.014 0.000 1.047 2316 V CA 1.724 64.035 62.300 0.018 0.000 1.035 2316 V CB -0.886 30.947 31.823 0.017 0.000 0.658 2316 V HN 0.223 nan 8.190 nan 0.000 0.452 2317 A N 0.442 123.269 122.820 0.013 0.000 1.892 2317 A HA -0.306 4.013 4.320 -0.001 0.000 0.218 2317 A C 2.318 179.908 177.584 0.009 0.000 1.188 2317 A CA 2.479 54.521 52.037 0.009 0.000 0.631 2317 A CB -0.550 18.455 19.000 0.007 0.000 0.822 2317 A HN 0.467 nan 8.150 nan 0.000 0.447 2318 R N -0.070 120.437 120.500 0.012 0.000 2.090 2318 R HA 0.070 4.409 4.340 -0.001 0.000 0.228 2318 R C 2.160 178.467 176.300 0.011 0.000 1.110 2318 R CA 1.758 57.865 56.100 0.011 0.000 0.973 2318 R CB -0.882 29.425 30.300 0.012 0.000 0.869 2318 R HN 0.389 nan 8.270 nan 0.000 0.440 2319 A N 0.144 122.972 122.820 0.013 0.000 1.908 2319 A HA -0.130 4.190 4.320 -0.001 0.000 0.218 2319 A C 2.160 179.751 177.584 0.012 0.000 1.181 2319 A CA 1.971 54.017 52.037 0.014 0.000 0.627 2319 A CB -0.852 18.158 19.000 0.017 0.000 0.818 2319 A HN 0.314 nan 8.150 nan 0.000 0.445 2320 V N -2.278 117.642 119.914 0.010 0.000 2.951 2320 V HA -0.046 4.074 4.120 -0.001 0.000 0.255 2320 V C 1.775 177.873 176.094 0.006 0.000 1.088 2320 V CA 2.140 64.445 62.300 0.008 0.000 1.109 2320 V CB -0.665 31.162 31.823 0.007 0.000 0.724 2320 V HN 0.452 nan 8.190 nan 0.000 0.471 2321 D N 1.154 121.557 120.400 0.005 0.000 2.178 2321 D HA -0.189 4.450 4.640 -0.001 0.000 0.201 2321 D C 1.682 177.985 176.300 0.004 0.000 0.980 2321 D CA 1.775 55.777 54.000 0.004 0.000 0.842 2321 D CB -0.043 40.759 40.800 0.003 0.000 0.948 2321 D HN 0.514 nan 8.370 nan 0.000 0.472 2322 D N -0.511 119.892 120.400 0.006 0.000 2.149 2322 D HA 0.034 4.674 4.640 -0.001 0.000 0.206 2322 D C 2.042 178.347 176.300 0.007 0.000 0.967 2322 D CA 1.254 55.258 54.000 0.007 0.000 0.848 2322 D CB -0.612 40.193 40.800 0.009 0.000 0.998 2322 D HN 0.253 nan 8.370 nan 0.000 0.474 2323 A N 0.848 123.673 122.820 0.008 0.000 1.908 2323 A HA -0.156 4.163 4.320 -0.001 0.000 0.218 2323 A C 2.368 179.955 177.584 0.006 0.000 1.181 2323 A CA 1.424 53.466 52.037 0.008 0.000 0.627 2323 A CB -0.923 18.082 19.000 0.008 0.000 0.818 2323 A HN 0.188 nan 8.150 nan 0.000 0.445 2324 V N -0.155 119.762 119.914 0.005 0.000 2.759 2324 V HA -0.072 4.047 4.120 -0.001 0.000 0.256 2324 V C 2.258 178.354 176.094 0.004 0.000 1.080 2324 V CA 2.111 64.413 62.300 0.004 0.000 1.101 2324 V CB -0.614 31.211 31.823 0.003 0.000 0.698 2324 V HN 0.569 nan 8.190 nan 0.000 0.477 2325 G N -0.240 108.562 108.800 0.004 0.000 2.395 2325 G HA2 -0.152 3.808 3.960 -0.001 0.000 0.214 2325 G HA3 -0.152 3.808 3.960 -0.001 0.000 0.214 2325 G C 1.615 176.518 174.900 0.005 0.000 1.177 2325 G CA 1.218 46.321 45.100 0.004 0.000 0.794 2325 G HN 0.660 nan 8.290 nan 0.000 0.532 2326 V N -1.076 118.842 119.914 0.006 0.000 2.871 2326 V HA 0.003 4.122 4.120 -0.001 0.000 0.256 2326 V C 2.573 178.671 176.094 0.006 0.000 1.082 2326 V CA 1.196 63.500 62.300 0.007 0.000 1.105 2326 V CB -0.360 31.468 31.823 0.008 0.000 0.713 2326 V HN 0.114 nan 8.190 nan 0.000 0.473 2327 V N 2.011 121.929 119.914 0.006 0.000 2.379 2327 V HA -0.005 4.115 4.120 -0.001 0.000 0.245 2327 V C 2.919 179.016 176.094 0.005 0.000 1.044 2327 V CA 2.123 64.426 62.300 0.005 0.000 1.036 2327 V CB -1.314 30.511 31.823 0.004 0.000 0.664 2327 V HN 0.605 nan 8.190 nan 0.000 0.453 2328 G N -1.367 107.435 108.800 0.005 0.000 2.418 2328 G HA2 -0.333 3.627 3.960 -0.001 0.000 0.217 2328 G HA3 -0.333 3.627 3.960 -0.001 0.000 0.217 2328 G C 1.887 176.790 174.900 0.005 0.000 1.158 2328 G CA 1.199 46.302 45.100 0.004 0.000 0.771 2328 G HN 0.529 nan 8.290 nan 0.000 0.545 2329 C N 0.535 119.838 119.300 0.005 0.000 2.429 2329 C HA -0.021 4.438 4.460 -0.001 0.000 0.277 2329 C C 3.150 178.144 174.990 0.007 0.000 1.262 2329 C CA 2.000 61.022 59.018 0.006 0.000 1.733 2329 C CB -1.051 26.693 27.740 0.007 0.000 2.010 2329 C HN 0.400 nan 8.230 nan 0.000 0.483 2330 T N 1.018 115.576 114.554 0.007 0.000 2.833 2330 T HA -0.088 4.261 4.350 -0.001 0.000 0.269 2330 T C 1.570 176.273 174.700 0.006 0.000 1.054 2330 T CA 1.813 63.917 62.100 0.007 0.000 1.135 2330 T CB -0.247 68.625 68.868 0.006 0.000 0.869 2330 T HN 0.591 nan 8.240 nan 0.000 0.466 2331 I N 0.632 121.205 120.570 0.005 0.000 2.286 2331 I HA -0.074 4.096 4.170 -0.001 0.000 0.245 2331 I C 2.538 178.658 176.117 0.005 0.000 1.104 2331 I CA 1.204 62.507 61.300 0.005 0.000 1.397 2331 I CB -0.254 37.749 38.000 0.005 0.000 1.072 2331 I HN 0.261 nan 8.210 nan 0.000 0.417 2332 E N 0.161 120.365 120.200 0.005 0.000 2.152 2332 E HA -0.081 4.269 4.350 -0.001 0.000 0.192 2332 E C -0.115 176.489 176.600 0.006 0.000 0.983 2332 E CA 0.699 57.102 56.400 0.005 0.000 0.818 2332 E CB 0.221 29.924 29.700 0.005 0.000 0.758 2332 E HN 0.375 nan 8.360 nan 0.000 0.467 2333 D N -0.534 119.870 120.400 0.007 0.000 2.505 2333 D HA 0.140 4.779 4.640 -0.001 0.000 0.250 2333 D C -0.061 176.244 176.300 0.008 0.000 1.164 2333 D CA -0.165 53.840 54.000 0.008 0.000 0.870 2333 D CB 1.720 42.525 40.800 0.009 0.000 1.160 2333 D HN 0.084 nan 8.370 nan 0.000 0.549 2334 G N 2.060 110.865 108.800 0.008 0.000 3.279 2334 G HA2 0.005 3.964 3.960 -0.001 0.000 0.230 2334 G HA3 0.005 3.964 3.960 -0.001 0.000 0.230 2334 G C 0.616 175.521 174.900 0.009 0.000 1.230 2334 G CA -0.096 45.009 45.100 0.007 0.000 0.891 2334 G HN 0.095 nan 8.290 nan 0.000 0.518 2335 R N -0.069 120.437 120.500 0.010 0.000 2.437 2335 R HA 0.608 4.948 4.340 -0.001 0.000 0.310 2335 R C -0.477 175.831 176.300 0.012 0.000 0.955 2335 R CA -0.575 55.532 56.100 0.012 0.000 0.851 2335 R CB 1.520 31.828 30.300 0.013 0.000 1.161 2335 R HN 0.304 nan 8.270 nan 0.000 0.446 2336 I N -0.197 120.381 120.570 0.013 0.000 3.042 2336 I HA 0.843 5.013 4.170 -0.001 0.000 0.310 2336 I C -0.548 175.579 176.117 0.016 0.000 1.117 2336 I CA -1.245 60.063 61.300 0.013 0.000 1.003 2336 I CB 2.162 40.169 38.000 0.011 0.000 1.228 2336 I HN 0.315 nan 8.210 nan 0.000 0.443 2337 V N 0.145 120.069 119.914 0.018 0.000 3.130 2337 V HA 0.839 4.959 4.120 -0.001 0.000 0.310 2337 V C 0.072 176.179 176.094 0.023 0.000 1.158 2337 V CA -0.405 61.908 62.300 0.021 0.000 1.029 2337 V CB 1.162 32.999 31.823 0.024 0.000 1.057 2337 V HN 1.156 nan 8.190 nan 0.000 0.436 2338 S N 1.523 117.239 115.700 0.028 0.000 2.576 2338 S HA 0.700 5.170 4.470 -0.001 0.000 0.276 2338 S C 0.488 175.107 174.600 0.031 0.000 1.339 2338 S CA 0.154 58.372 58.200 0.030 0.000 1.039 2338 S CB 0.897 64.119 63.200 0.037 0.000 0.902 2338 S HN 1.803 nan 8.310 nan 0.000 0.516 2339 G N 0.072 108.890 108.800 0.031 0.000 2.641 2339 G HA2 0.556 4.516 3.960 -0.001 0.000 0.239 2339 G HA3 0.556 4.516 3.960 -0.001 0.000 0.239 2339 G C 0.893 175.811 174.900 0.031 0.000 1.402 2339 G CA -0.564 44.554 45.100 0.029 0.000 1.046 2339 G HN 2.025 nan 8.290 nan 0.000 0.565 2340 G N -2.224 106.593 108.800 0.029 0.000 2.155 2340 G HA2 0.237 4.196 3.960 -0.001 0.000 0.257 2340 G HA3 0.237 4.196 3.960 -0.001 0.000 0.257 2340 G C 1.459 176.361 174.900 0.003 0.000 0.983 2340 G CA 1.158 46.273 45.100 0.025 0.000 0.676 2340 G HN 2.515 nan 8.290 nan 0.000 0.528 2341 G N -1.294 107.501 108.800 -0.009 0.000 2.157 2341 G HA2 -0.083 3.876 3.960 -0.001 0.000 0.248 2341 G HA3 -0.083 3.876 3.960 -0.001 0.000 0.248 2341 G C 1.418 176.288 174.900 -0.049 0.000 0.979 2341 G CA 1.654 46.733 45.100 -0.036 0.000 0.650 2341 G HN 1.938 nan 8.290 nan 0.000 0.529 2342 S N 0.057 115.753 115.700 -0.007 0.000 2.368 2342 S HA -0.163 4.307 4.470 -0.001 0.000 0.225 2342 S C 2.800 177.391 174.600 -0.015 0.000 1.030 2342 S CA 2.803 61.018 58.200 0.026 0.000 0.999 2342 S CB -0.529 62.739 63.200 0.112 0.000 0.844 2342 S HN 1.410 nan 8.310 nan 0.000 0.459 2343 T N -0.393 114.161 114.554 0.001 0.000 2.701 2343 T HA -0.047 4.303 4.350 -0.001 0.000 0.263 2343 T C 1.564 176.230 174.700 -0.058 0.000 1.040 2343 T CA 1.542 63.642 62.100 -0.001 0.000 1.147 2343 T CB -0.875 67.998 68.868 0.008 0.000 0.865 2343 T HN 0.405 nan 8.240 nan 0.000 0.426 2344 E N 1.053 121.207 120.200 -0.076 0.000 2.130 2344 E HA -0.076 4.273 4.350 -0.001 0.000 0.196 2344 E C 2.290 178.798 176.600 -0.153 0.000 0.998 2344 E CA 1.078 57.415 56.400 -0.105 0.000 0.806 2344 E CB -0.767 28.872 29.700 -0.101 0.000 0.738 2344 E HN 0.434 nan 8.360 nan 0.000 0.459 2345 V N 0.438 120.214 119.914 -0.230 0.000 2.323 2345 V HA -0.221 3.898 4.120 -0.001 0.000 0.244 2345 V C 2.286 178.140 176.094 -0.399 0.000 1.041 2345 V CA 1.842 63.926 62.300 -0.360 0.000 1.025 2345 V CB -0.437 31.053 31.823 -0.555 0.000 0.656 2345 V HN 0.212 nan 8.190 nan 0.000 0.451 2346 E N 0.619 120.578 120.200 -0.401 0.000 2.097 2346 E HA -0.232 4.118 4.350 -0.001 0.000 0.196 2346 E C 2.033 178.599 176.600 -0.057 0.000 1.000 2346 E CA 1.715 58.082 56.400 -0.056 0.000 0.804 2346 E CB -0.399 29.383 29.700 0.136 0.000 0.740 2346 E HN 0.557 nan 8.360 nan 0.000 0.454 2347 L N -0.149 121.030 121.223 -0.072 0.000 2.056 2347 L HA -0.147 4.193 4.340 -0.001 0.000 0.207 2347 L C 2.542 179.364 176.870 -0.080 0.000 1.078 2347 L CA 1.269 56.076 54.840 -0.056 0.000 0.749 2347 L CB -0.390 41.653 42.059 -0.027 0.000 0.901 2347 L HN 0.110 nan 8.230 nan 0.000 0.433 2348 S N -0.561 115.080 115.700 -0.099 0.000 2.382 2348 S HA -0.147 4.322 4.470 -0.001 0.000 0.228 2348 S C 2.015 176.560 174.600 -0.091 0.000 1.027 2348 S CA 1.224 59.369 58.200 -0.091 0.000 0.991 2348 S CB -0.109 63.028 63.200 -0.104 0.000 0.823 2348 S HN 0.270 nan 8.310 nan 0.000 0.469 2349 M N 1.383 120.925 119.600 -0.098 0.000 2.064 2349 M HA -0.049 4.430 4.480 -0.001 0.000 0.260 2349 M C 2.042 178.258 176.300 -0.140 0.000 1.073 2349 M CA 1.607 56.861 55.300 -0.077 0.000 1.124 2349 M CB -1.105 31.485 32.600 -0.018 0.000 1.326 2349 M HN 0.225 nan 8.290 nan 0.000 0.410 2350 K N 0.252 120.522 120.400 -0.216 0.000 2.103 2350 K HA 0.002 4.322 4.320 -0.001 0.000 0.204 2350 K C 2.061 178.149 176.600 -0.854 0.000 1.052 2350 K CA 0.872 56.867 56.287 -0.486 0.000 0.945 2350 K CB -0.177 32.050 32.500 -0.455 0.000 0.722 2350 K HN 0.261 nan 8.250 nan 0.000 0.443 2351 L N 0.534 121.465 121.223 -0.488 0.000 2.201 2351 L HA -0.118 4.222 4.340 -0.001 0.000 0.212 2351 L C 2.340 179.153 176.870 -0.096 0.000 1.105 2351 L CA 0.963 55.646 54.840 -0.262 0.000 0.775 2351 L CB -0.275 41.778 42.059 -0.009 0.000 0.913 2351 L HN 0.129 nan 8.230 nan 0.000 0.440 2352 R N 0.043 120.484 120.500 -0.098 0.000 2.115 2352 R HA -0.149 4.191 4.340 -0.001 0.000 0.230 2352 R C 2.082 178.379 176.300 -0.005 0.000 1.111 2352 R CA 1.223 57.307 56.100 -0.027 0.000 0.976 2352 R CB -0.126 30.157 30.300 -0.028 0.000 0.870 2352 R HN 0.463 nan 8.270 nan 0.000 0.445 2353 E N -0.523 119.646 120.200 -0.051 0.000 2.107 2353 E HA -0.143 4.206 4.350 -0.001 0.000 0.191 2353 E C 1.575 178.296 176.600 0.202 0.000 0.982 2353 E CA 0.809 57.235 56.400 0.044 0.000 0.809 2353 E CB 0.015 29.729 29.700 0.023 0.000 0.756 2353 E HN 0.320 nan 8.360 nan 0.000 0.459 2354 Y N 0.653 120.968 120.300 0.026 0.000 2.224 2354 Y HA -0.087 4.463 4.550 -0.001 0.000 0.289 2354 Y C 2.399 178.310 175.900 0.019 0.000 1.146 2354 Y CA 0.587 58.699 58.100 0.020 0.000 1.182 2354 Y CB -1.157 37.315 38.460 0.020 0.000 0.983 2354 Y HN 0.033 nan 8.280 nan 0.000 0.524 2355 A N 0.266 123.198 122.820 0.186 0.000 1.940 2355 A HA -0.168 4.152 4.320 -0.001 0.000 0.219 2355 A C 2.175 179.810 177.584 0.085 0.000 1.176 2355 A CA 1.671 53.776 52.037 0.114 0.000 0.631 2355 A CB -0.394 18.661 19.000 0.092 0.000 0.814 2355 A HN 0.318 nan 8.150 nan 0.000 0.446 2356 E N -0.546 119.705 120.200 0.084 0.000 2.106 2356 E HA -0.111 4.238 4.350 -0.001 0.000 0.192 2356 E C 2.147 178.781 176.600 0.055 0.000 0.984 2356 E CA 1.139 57.576 56.400 0.062 0.000 0.806 2356 E CB -0.610 29.124 29.700 0.058 0.000 0.750 2356 E HN 0.595 nan 8.360 nan 0.000 0.458 2357 G N 0.919 109.760 108.800 0.069 0.000 2.430 2357 G HA2 -0.133 3.827 3.960 -0.001 0.000 0.216 2357 G HA3 -0.133 3.827 3.960 -0.001 0.000 0.216 2357 G C 1.742 176.658 174.900 0.027 0.000 1.146 2357 G CA 0.163 45.288 45.100 0.043 0.000 0.793 2357 G HN 0.142 nan 8.290 nan 0.000 0.537 2358 I N -0.105 120.487 120.570 0.037 0.000 2.163 2358 I HA -0.025 4.145 4.170 -0.001 0.000 0.240 2358 I C 1.762 177.890 176.117 0.019 0.000 1.081 2358 I CA 0.831 62.145 61.300 0.023 0.000 1.353 2358 I CB -0.306 37.715 38.000 0.034 0.000 1.054 2358 I HN 0.308 nan 8.210 nan 0.000 0.407 2359 S N -1.137 114.580 115.700 0.028 0.000 3.633 2359 S HA -0.118 4.351 4.470 -0.001 0.000 0.637 2359 S C 0.448 175.058 174.600 0.017 0.000 2.289 2359 S CA 0.755 58.968 58.200 0.022 0.000 2.476 2359 S CB -1.419 61.791 63.200 0.016 0.000 0.330 2359 S HN 1.458 nan 8.310 nan 0.000 1.787 2360 G N 0.665 109.473 108.800 0.013 0.000 2.601 2360 G HA2 -0.286 3.673 3.960 -0.001 0.000 0.261 2360 G HA3 -0.286 3.673 3.960 -0.001 0.000 0.261 2360 G C 0.328 175.235 174.900 0.011 0.000 1.289 2360 G CA 0.967 46.071 45.100 0.008 0.000 0.920 2360 G HN 1.091 nan 8.290 nan 0.000 0.571 2361 R N 0.214 120.718 120.500 0.007 0.000 2.115 2361 R HA 0.026 4.365 4.340 -0.001 0.000 0.226 2361 R C 2.534 178.841 176.300 0.011 0.000 1.100 2361 R CA 1.371 57.477 56.100 0.010 0.000 0.980 2361 R CB -0.234 30.070 30.300 0.007 0.000 0.875 2361 R HN 0.716 nan 8.270 nan 0.000 0.445 2362 E N 0.951 121.155 120.200 0.007 0.000 2.171 2362 E HA -0.262 4.087 4.350 -0.001 0.000 0.197 2362 E C 2.058 178.676 176.600 0.030 0.000 0.997 2362 E CA 1.074 57.479 56.400 0.008 0.000 0.810 2362 E CB 0.101 29.802 29.700 0.001 0.000 0.738 2362 E HN 0.205 nan 8.360 nan 0.000 0.467 2363 Q N 0.597 120.418 119.800 0.035 0.000 2.226 2363 Q HA -0.164 4.175 4.340 -0.001 0.000 0.204 2363 Q C 2.144 178.182 176.000 0.063 0.000 0.975 2363 Q CA 0.923 56.757 55.803 0.051 0.000 0.866 2363 Q CB -0.067 28.696 28.738 0.043 0.000 0.915 2363 Q HN 0.430 nan 8.270 nan 0.000 0.440 2364 L N 0.051 121.306 121.223 0.053 0.000 2.027 2364 L HA -0.141 4.199 4.340 -0.001 0.000 0.206 2364 L C 2.606 179.534 176.870 0.096 0.000 1.074 2364 L CA 1.269 56.145 54.840 0.060 0.000 0.745 2364 L CB -0.658 41.425 42.059 0.039 0.000 0.898 2364 L HN 0.167 nan 8.230 nan 0.000 0.433 2365 A N -0.553 122.323 122.820 0.092 0.000 1.929 2365 A HA -0.092 4.227 4.320 -0.001 0.000 0.216 2365 A C 2.312 180.097 177.584 0.336 0.000 1.176 2365 A CA 1.279 53.415 52.037 0.166 0.000 0.628 2365 A CB -0.678 18.305 19.000 -0.029 0.000 0.816 2365 A HN 0.178 nan 8.150 nan 0.000 0.444 2366 V N 0.136 120.175 119.914 0.209 0.000 2.343 2366 V HA -0.229 3.891 4.120 -0.001 0.000 0.247 2366 V C 2.672 178.896 176.094 0.217 0.000 1.051 2366 V CA 2.327 64.747 62.300 0.200 0.000 1.036 2366 V CB -0.789 31.102 31.823 0.112 0.000 0.654 2366 V HN 0.623 nan 8.190 nan 0.000 0.451 2367 R N 1.128 121.724 120.500 0.160 0.000 2.081 2367 R HA -0.064 4.276 4.340 -0.001 0.000 0.235 2367 R C 2.158 178.532 176.300 0.124 0.000 1.131 2367 R CA 1.921 58.092 56.100 0.118 0.000 0.960 2367 R CB -0.991 29.358 30.300 0.081 0.000 0.856 2367 R HN 0.431 nan 8.270 nan 0.000 0.436 2368 A N -0.453 122.466 122.820 0.165 0.000 1.933 2368 A HA -0.120 4.200 4.320 -0.001 0.000 0.218 2368 A C 2.157 179.808 177.584 0.111 0.000 1.175 2368 A CA 1.332 53.459 52.037 0.151 0.000 0.628 2368 A CB -0.840 18.291 19.000 0.218 0.000 0.814 2368 A HN 0.486 nan 8.150 nan 0.000 0.444 2369 F N 0.983 120.944 119.950 0.018 0.000 2.075 2369 F HA -0.104 4.423 4.527 -0.001 0.000 0.297 2369 F C 2.536 178.258 175.800 -0.130 0.000 1.113 2369 F CA 1.520 59.403 58.000 -0.194 0.000 1.218 2369 F CB -0.397 38.518 39.000 -0.142 0.000 0.984 2369 F HN 0.245 nan 8.300 nan 0.000 0.472 2370 A N -0.173 122.719 122.820 0.121 0.000 1.902 2370 A HA -0.186 4.133 4.320 -0.001 0.000 0.217 2370 A C 1.888 179.419 177.584 -0.089 0.000 1.181 2370 A CA 1.963 54.009 52.037 0.014 0.000 0.623 2370 A CB -0.976 18.065 19.000 0.069 0.000 0.818 2370 A HN 0.457 nan 8.150 nan 0.000 0.443 2371 D N 0.021 120.386 120.400 -0.058 0.000 2.219 2371 D HA 0.025 4.664 4.640 -0.001 0.000 0.205 2371 D C 2.116 178.349 176.300 -0.113 0.000 0.970 2371 D CA 1.190 55.150 54.000 -0.067 0.000 0.851 2371 D CB -0.349 40.434 40.800 -0.027 0.000 0.943 2371 D HN 0.426 nan 8.370 nan 0.000 0.488 2372 A N 0.621 123.337 122.820 -0.172 0.000 2.024 2372 A HA -0.129 4.190 4.320 -0.001 0.000 0.220 2372 A C 2.244 179.696 177.584 -0.220 0.000 1.164 2372 A CA 0.766 52.675 52.037 -0.215 0.000 0.643 2372 A CB -0.714 18.086 19.000 -0.333 0.000 0.806 2372 A HN 0.245 nan 8.150 nan 0.000 0.451 2373 L N -0.358 120.720 121.223 -0.243 0.000 2.265 2373 L HA -0.140 4.199 4.340 -0.001 0.000 0.215 2373 L C 2.014 178.799 176.870 -0.142 0.000 1.117 2373 L CA 0.770 55.489 54.840 -0.202 0.000 0.782 2373 L CB -0.452 41.489 42.059 -0.195 0.000 0.914 2373 L HN 0.326 nan 8.230 nan 0.000 0.441 2374 E N -0.323 119.803 120.200 -0.123 0.000 2.409 2374 E HA -0.141 4.209 4.350 -0.001 0.000 0.198 2374 E C 2.181 178.731 176.600 -0.084 0.000 1.024 2374 E CA 0.606 56.949 56.400 -0.095 0.000 0.861 2374 E CB -0.191 29.461 29.700 -0.080 0.000 0.788 2374 E HN 0.306 nan 8.360 nan 0.000 0.521 2375 V N 0.865 120.723 119.914 -0.092 0.000 2.759 2375 V HA -0.187 3.933 4.120 -0.001 0.000 0.256 2375 V C 1.780 177.830 176.094 -0.073 0.000 1.080 2375 V CA 0.910 63.163 62.300 -0.079 0.000 1.101 2375 V CB -0.165 31.608 31.823 -0.084 0.000 0.698 2375 V HN 0.128 nan 8.190 nan 0.000 0.477 2376 I N 0.490 121.012 120.570 -0.080 0.000 2.296 2376 I HA 0.018 4.187 4.170 -0.001 0.000 0.242 2376 I C 0.129 176.208 176.117 -0.063 0.000 1.087 2376 I CA 1.183 62.440 61.300 -0.071 0.000 1.393 2376 I CB -2.733 35.222 38.000 -0.074 0.000 1.093 2376 I HN 0.307 nan 8.210 nan 0.000 0.421 2377 P HA -0.162 nan 4.420 nan 0.000 0.216 2377 P C 1.826 179.094 177.300 -0.053 0.000 1.150 2377 P CA 1.425 64.490 63.100 -0.058 0.000 0.843 2377 P CB -0.094 31.567 31.700 -0.065 0.000 0.787 2378 R N -0.627 119.840 120.500 -0.055 0.000 2.052 2378 R HA -0.013 4.327 4.340 -0.001 0.000 0.226 2378 R C 1.931 178.202 176.300 -0.048 0.000 1.145 2378 R CA 1.994 58.064 56.100 -0.049 0.000 0.952 2378 R CB -1.291 28.980 30.300 -0.049 0.000 0.847 2378 R HN 0.057 nan 8.270 nan 0.000 0.431 2379 T N 2.607 117.131 114.554 -0.051 0.000 2.833 2379 T HA -0.137 4.213 4.350 -0.001 0.000 0.269 2379 T C 1.723 176.391 174.700 -0.054 0.000 1.054 2379 T CA 1.135 63.205 62.100 -0.050 0.000 1.135 2379 T CB -0.218 68.619 68.868 -0.051 0.000 0.869 2379 T HN 0.113 nan 8.240 nan 0.000 0.466 2380 L N 1.609 122.798 121.223 -0.057 0.000 1.994 2380 L HA 0.076 4.416 4.340 -0.001 0.000 0.208 2380 L C 2.618 179.447 176.870 -0.068 0.000 1.071 2380 L CA 2.044 56.846 54.840 -0.065 0.000 0.745 2380 L CB -1.065 40.958 42.059 -0.061 0.000 0.892 2380 L HN 0.206 nan 8.230 nan 0.000 0.431 2381 A N -1.176 121.609 122.820 -0.057 0.000 2.019 2381 A HA -0.225 4.095 4.320 -0.001 0.000 0.219 2381 A C 2.210 179.764 177.584 -0.050 0.000 1.164 2381 A CA 1.650 53.656 52.037 -0.053 0.000 0.644 2381 A CB -0.632 18.343 19.000 -0.042 0.000 0.805 2381 A HN 0.574 nan 8.150 nan 0.000 0.449 2382 E N 0.579 120.750 120.200 -0.048 0.000 2.072 2382 E HA -0.144 4.205 4.350 -0.001 0.000 0.191 2382 E C 1.705 178.277 176.600 -0.047 0.000 0.985 2382 E CA 1.446 57.820 56.400 -0.043 0.000 0.801 2382 E CB -0.162 29.514 29.700 -0.041 0.000 0.750 2382 E HN 0.548 nan 8.360 nan 0.000 0.452 2383 N N -0.052 118.615 118.700 -0.055 0.000 2.309 2383 N HA -0.090 4.649 4.740 -0.001 0.000 0.182 2383 N C 1.272 176.740 175.510 -0.071 0.000 1.018 2383 N CA 1.140 54.154 53.050 -0.061 0.000 0.876 2383 N CB -0.252 38.195 38.487 -0.067 0.000 0.972 2383 N HN 0.246 nan 8.380 nan 0.000 0.434 2384 A N -0.076 122.697 122.820 -0.079 0.000 2.119 2384 A HA 0.315 4.634 4.320 -0.001 0.000 0.216 2384 A C 1.482 179.030 177.584 -0.060 0.000 1.152 2384 A CA 1.034 53.019 52.037 -0.086 0.000 0.708 2384 A CB -0.397 18.546 19.000 -0.096 0.000 0.805 2384 A HN 0.309 nan 8.150 nan 0.000 0.460 2385 G N -1.278 107.494 108.800 -0.048 0.000 2.149 2385 G HA2 -0.185 3.775 3.960 -0.001 0.000 0.235 2385 G HA3 -0.185 3.775 3.960 -0.001 0.000 0.235 2385 G C -0.032 174.850 174.900 -0.030 0.000 1.018 2385 G CA 0.342 45.420 45.100 -0.036 0.000 0.728 2385 G HN 0.443 nan 8.290 nan 0.000 0.508 2386 L N -0.213 120.990 121.223 -0.033 0.000 2.387 2386 L HA 0.504 4.843 4.340 -0.001 0.000 0.266 2386 L C 0.540 177.396 176.870 -0.024 0.000 1.059 2386 L CA -1.115 53.709 54.840 -0.027 0.000 0.801 2386 L CB 0.779 42.820 42.059 -0.029 0.000 1.223 2386 L HN 0.100 nan 8.230 nan 0.000 0.456 2387 D N 0.799 121.187 120.400 -0.019 0.000 2.363 2387 D HA 0.086 4.725 4.640 -0.001 0.000 0.263 2387 D C 0.747 177.034 176.300 -0.021 0.000 1.258 2387 D CA 0.170 54.159 54.000 -0.018 0.000 0.907 2387 D CB 1.743 42.535 40.800 -0.014 0.000 1.107 2387 D HN 0.628 nan 8.370 nan 0.000 0.495 2388 A N 5.316 128.122 122.820 -0.023 0.000 1.940 2388 A HA -0.192 4.128 4.320 -0.001 0.000 0.219 2388 A C 2.070 179.640 177.584 -0.024 0.000 1.176 2388 A CA 0.943 52.965 52.037 -0.026 0.000 0.631 2388 A CB -0.178 18.805 19.000 -0.027 0.000 0.814 2388 A HN 0.698 nan 8.150 nan 0.000 0.446 2389 I N -0.709 119.850 120.570 -0.020 0.000 2.296 2389 I HA -0.119 4.050 4.170 -0.001 0.000 0.242 2389 I C 2.436 178.544 176.117 -0.015 0.000 1.087 2389 I CA 1.583 62.873 61.300 -0.018 0.000 1.393 2389 I CB -1.525 36.467 38.000 -0.015 0.000 1.093 2389 I HN 0.562 nan 8.210 nan 0.000 0.421 2390 E N 1.256 121.448 120.200 -0.013 0.000 2.077 2390 E HA -0.207 4.142 4.350 -0.001 0.000 0.193 2390 E C 2.326 178.921 176.600 -0.010 0.000 0.989 2390 E CA 1.159 57.554 56.400 -0.010 0.000 0.800 2390 E CB 0.178 29.873 29.700 -0.008 0.000 0.746 2390 E HN 0.209 nan 8.360 nan 0.000 0.452 2391 I N 0.876 121.438 120.570 -0.013 0.000 2.127 2391 I HA -0.273 3.896 4.170 -0.001 0.000 0.241 2391 I C 2.416 178.524 176.117 -0.014 0.000 1.075 2391 I CA 1.014 62.306 61.300 -0.013 0.000 1.334 2391 I CB -0.983 37.006 38.000 -0.019 0.000 1.040 2391 I HN 0.275 nan 8.210 nan 0.000 0.405 2392 L N 0.010 121.221 121.223 -0.020 0.000 2.131 2392 L HA -0.149 4.190 4.340 -0.001 0.000 0.210 2392 L C 2.541 179.400 176.870 -0.019 0.000 1.092 2392 L CA 1.254 56.079 54.840 -0.025 0.000 0.759 2392 L CB -0.953 41.088 42.059 -0.031 0.000 0.903 2392 L HN 0.004 nan 8.230 nan 0.000 0.435 2393 V N -1.155 118.752 119.914 -0.013 0.000 2.323 2393 V HA -0.237 3.883 4.120 -0.001 0.000 0.244 2393 V C 2.487 178.581 176.094 0.001 0.000 1.041 2393 V CA 1.376 63.672 62.300 -0.006 0.000 1.025 2393 V CB -0.391 31.429 31.823 -0.005 0.000 0.656 2393 V HN 0.300 nan 8.190 nan 0.000 0.451 2394 K N -0.185 120.216 120.400 0.001 0.000 2.155 2394 K HA -0.030 4.290 4.320 -0.001 0.000 0.203 2394 K C 1.864 178.473 176.600 0.015 0.000 1.052 2394 K CA 0.852 57.144 56.287 0.007 0.000 0.948 2394 K CB -0.438 32.065 32.500 0.005 0.000 0.728 2394 K HN 0.313 nan 8.250 nan 0.000 0.448 2395 V N 0.505 120.427 119.914 0.012 0.000 2.346 2395 V HA -0.156 3.963 4.120 -0.001 0.000 0.244 2395 V C 2.064 178.184 176.094 0.043 0.000 1.037 2395 V CA 1.530 63.844 62.300 0.023 0.000 1.029 2395 V CB -0.296 31.528 31.823 0.002 0.000 0.663 2395 V HN 0.223 nan 8.190 nan 0.000 0.454 2396 R N 0.151 120.661 120.500 0.017 0.000 2.115 2396 R HA -0.055 4.285 4.340 -0.001 0.000 0.230 2396 R C 2.390 178.726 176.300 0.061 0.000 1.111 2396 R CA 1.323 57.438 56.100 0.024 0.000 0.976 2396 R CB -0.490 29.802 30.300 -0.013 0.000 0.870 2396 R HN 0.534 nan 8.270 nan 0.000 0.445 2397 A N 1.271 124.115 122.820 0.039 0.000 1.873 2397 A HA -0.064 4.256 4.320 -0.001 0.000 0.215 2397 A C 2.364 179.972 177.584 0.040 0.000 1.186 2397 A CA 1.551 53.608 52.037 0.034 0.000 0.616 2397 A CB -0.610 18.401 19.000 0.019 0.000 0.823 2397 A HN 0.365 nan 8.150 nan 0.000 0.442 2398 A N -1.067 121.779 122.820 0.045 0.000 1.933 2398 A HA -0.157 4.162 4.320 -0.001 0.000 0.218 2398 A C 2.005 179.616 177.584 0.044 0.000 1.175 2398 A CA 2.072 54.132 52.037 0.037 0.000 0.628 2398 A CB -0.857 18.165 19.000 0.036 0.000 0.814 2398 A HN 0.781 nan 8.150 nan 0.000 0.444 2399 H N -0.208 118.858 119.070 -0.007 0.000 2.326 2399 H HA 0.054 4.609 4.556 -0.001 0.000 0.301 2399 H C 2.216 177.539 175.328 -0.008 0.000 1.081 2399 H CA 1.971 58.015 56.048 -0.008 0.000 1.334 2399 H CB -0.198 29.557 29.762 -0.012 0.000 1.385 2399 H HN 0.388 nan 8.280 nan 0.000 0.504 2400 A N -0.639 122.243 122.820 0.104 0.000 1.908 2400 A HA -0.195 4.125 4.320 -0.001 0.000 0.218 2400 A C 2.568 180.141 177.584 -0.019 0.000 1.181 2400 A CA 2.061 54.130 52.037 0.053 0.000 0.627 2400 A CB -1.064 17.974 19.000 0.063 0.000 0.818 2400 A HN 0.515 nan 8.150 nan 0.000 0.445 2401 S N -0.641 115.047 115.700 -0.019 0.000 2.341 2401 S HA -0.081 4.388 4.470 -0.001 0.000 0.216 2401 S C 1.876 176.447 174.600 -0.048 0.000 1.034 2401 S CA 1.058 59.243 58.200 -0.025 0.000 0.964 2401 S CB -0.397 62.797 63.200 -0.011 0.000 0.882 2401 S HN 0.597 nan 8.310 nan 0.000 0.469 2402 N N 1.086 119.752 118.700 -0.058 0.000 2.354 2402 N HA 0.231 4.971 4.740 -0.001 0.000 0.179 2402 N C 1.064 176.509 175.510 -0.109 0.000 1.021 2402 N CA 1.018 54.029 53.050 -0.065 0.000 0.887 2402 N CB -0.132 38.328 38.487 -0.044 0.000 0.974 2402 N HN 0.623 nan 8.380 nan 0.000 0.437 2403 G N 0.669 109.345 108.800 -0.206 0.000 2.498 2403 G HA2 -0.231 3.728 3.960 -0.001 0.000 0.651 2403 G HA3 -0.231 3.728 3.960 -0.001 0.000 0.651 2403 G C 0.146 174.786 174.900 -0.434 0.000 1.284 2403 G CA 0.043 44.960 45.100 -0.305 0.000 0.950 2403 G HN 0.349 nan 8.290 nan 0.000 0.511 2404 N N -0.307 118.192 118.700 -0.335 0.000 2.446 2404 N HA 0.003 4.743 4.740 -0.001 0.000 0.179 2404 N C 1.593 177.099 175.510 -0.007 0.000 1.054 2404 N CA 1.611 54.600 53.050 -0.101 0.000 0.905 2404 N CB -0.077 38.454 38.487 0.073 0.000 0.973 2404 N HN 0.883 nan 8.380 nan 0.000 0.448 2405 K N -1.001 119.376 120.400 -0.037 0.000 2.374 2405 K HA 0.265 4.585 4.320 -0.001 0.000 0.196 2405 K C -0.320 176.272 176.600 -0.013 0.000 1.023 2405 K CA -0.014 56.266 56.287 -0.012 0.000 1.103 2405 K CB 0.079 32.571 32.500 -0.015 0.000 0.848 2405 K HN 0.118 nan 8.250 nan 0.000 0.528 2406 C N 1.523 120.807 119.300 -0.027 0.000 3.114 2406 C HA 0.689 5.148 4.460 -0.001 0.000 0.215 2406 C C 0.142 175.132 174.990 -0.001 0.000 1.759 2406 C CA -0.707 58.301 59.018 -0.017 0.000 1.455 2406 C CB -0.571 27.148 27.740 -0.035 0.000 2.528 2406 C HN 0.598 nan 8.230 nan 0.000 0.511 2407 A N 0.077 122.918 122.820 0.034 0.000 2.593 2407 A HA 1.004 5.324 4.320 -0.001 0.000 0.304 2407 A C -0.076 177.553 177.584 0.075 0.000 1.233 2407 A CA 0.222 52.307 52.037 0.079 0.000 0.661 2407 A CB 0.342 19.452 19.000 0.183 0.000 1.338 2407 A HN 1.915 nan 8.150 nan 0.000 0.495 2408 G N -2.105 106.741 108.800 0.077 0.000 2.699 2408 G HA2 0.414 4.373 3.960 -0.001 0.000 0.686 2408 G HA3 0.414 4.373 3.960 -0.001 0.000 0.686 2408 G C -0.982 173.940 174.900 0.038 0.000 1.301 2408 G CA -0.096 45.033 45.100 0.048 0.000 0.816 2408 G HN 2.064 nan 8.290 nan 0.000 0.595 2409 L N 0.538 121.776 121.223 0.026 0.000 2.289 2409 L HA 0.774 5.113 4.340 -0.001 0.000 0.285 2409 L C 0.181 177.075 176.870 0.039 0.000 1.049 2409 L CA -1.027 53.825 54.840 0.021 0.000 0.804 2409 L CB 1.603 43.660 42.059 -0.002 0.000 1.195 2409 L HN 0.721 nan 8.230 nan 0.000 0.428 2410 N N 2.996 121.728 118.700 0.054 0.000 2.527 2410 N HA 0.212 4.952 4.740 -0.001 0.000 0.236 2410 N C 0.766 176.314 175.510 0.064 0.000 0.999 2410 N CA -0.222 52.891 53.050 0.105 0.000 0.935 2410 N CB 1.056 39.617 38.487 0.124 0.000 1.132 2410 N HN 0.525 nan 8.380 nan 0.000 0.511 2411 V N 1.324 121.229 119.914 -0.015 0.000 2.970 2411 V HA 0.022 4.142 4.120 -0.001 0.000 0.260 2411 V C 1.345 177.341 176.094 -0.164 0.000 1.100 2411 V CA 1.122 63.342 62.300 -0.134 0.000 1.122 2411 V CB -1.154 30.518 31.823 -0.251 0.000 0.721 2411 V HN 0.398 nan 8.190 nan 0.000 0.483 2412 F N 2.703 122.650 119.950 -0.004 0.000 2.234 2412 F HA -0.020 4.506 4.527 -0.001 0.000 0.299 2412 F C 2.595 178.394 175.800 -0.003 0.000 1.087 2412 F CA 1.870 59.868 58.000 -0.003 0.000 1.340 2412 F CB -0.569 38.430 39.000 -0.002 0.000 1.031 2412 F HN 0.424 nan 8.300 nan 0.000 0.500 2413 T N -4.561 110.093 114.554 0.167 0.000 2.985 2413 T HA 0.415 4.764 4.350 -0.001 0.000 0.254 2413 T C 1.428 176.156 174.700 0.046 0.000 1.021 2413 T CA 0.370 62.524 62.100 0.089 0.000 0.957 2413 T CB 0.346 69.258 68.868 0.075 0.000 1.047 2413 T HN 0.343 nan 8.240 nan 0.000 0.511 2414 G N 1.171 109.990 108.800 0.032 0.000 2.291 2414 G HA2 0.289 4.248 3.960 -0.001 0.000 0.271 2414 G HA3 0.289 4.248 3.960 -0.001 0.000 0.271 2414 G C 0.025 174.931 174.900 0.010 0.000 1.099 2414 G CA -0.220 44.883 45.100 0.005 0.000 0.919 2414 G HN 1.401 nan 8.290 nan 0.000 0.496 2415 A N -1.347 121.485 122.820 0.019 0.000 2.604 2415 A HA 0.883 5.203 4.320 -0.001 0.000 0.295 2415 A C 0.028 177.626 177.584 0.023 0.000 1.067 2415 A CA 0.096 52.144 52.037 0.018 0.000 0.683 2415 A CB 1.674 20.686 19.000 0.021 0.000 1.281 2415 A HN 1.783 nan 8.150 nan 0.000 0.407 2416 V N 1.866 121.791 119.914 0.019 0.000 2.599 2416 V HA 0.428 4.547 4.120 -0.001 0.000 0.300 2416 V C -0.223 175.888 176.094 0.027 0.000 1.034 2416 V CA 0.862 63.176 62.300 0.023 0.000 1.115 2416 V CB 0.537 32.373 31.823 0.021 0.000 0.934 2416 V HN 0.872 nan 8.190 nan 0.000 0.485 2417 E N 3.680 123.900 120.200 0.033 0.000 2.458 2417 E HA 0.315 4.665 4.350 -0.001 0.000 0.278 2417 E C -1.424 175.195 176.600 0.031 0.000 1.004 2417 E CA -0.716 55.703 56.400 0.032 0.000 0.823 2417 E CB 1.472 31.195 29.700 0.039 0.000 1.396 2417 E HN 0.715 nan 8.360 nan 0.000 0.463 2418 D N 1.922 122.336 120.400 0.024 0.000 2.393 2418 D HA 0.099 4.738 4.640 -0.001 0.000 0.232 2418 D C 0.928 177.242 176.300 0.023 0.000 1.192 2418 D CA -0.153 53.859 54.000 0.020 0.000 0.882 2418 D CB 0.542 41.348 40.800 0.010 0.000 1.038 2418 D HN 0.214 nan 8.370 nan 0.000 0.499 2419 M N 2.189 121.807 119.600 0.031 0.000 2.159 2419 M HA -0.145 4.335 4.480 -0.001 0.000 0.263 2419 M C 2.347 178.660 176.300 0.023 0.000 1.063 2419 M CA 0.642 55.962 55.300 0.034 0.000 1.110 2419 M CB -1.182 31.443 32.600 0.042 0.000 1.374 2419 M HN 0.535 nan 8.290 nan 0.000 0.411 2420 C N 0.712 120.023 119.300 0.019 0.000 2.453 2420 C HA -0.165 4.295 4.460 -0.001 0.000 0.277 2420 C C 2.689 177.682 174.990 0.005 0.000 1.262 2420 C CA 1.360 60.385 59.018 0.012 0.000 1.718 2420 C CB -0.915 26.831 27.740 0.010 0.000 2.031 2420 C HN 0.638 nan 8.230 nan 0.000 0.480 2421 E N 0.157 120.359 120.200 0.004 0.000 2.118 2421 E HA -0.204 4.146 4.350 -0.001 0.000 0.195 2421 E C 1.391 177.989 176.600 -0.004 0.000 0.992 2421 E CA 1.348 57.748 56.400 -0.000 0.000 0.804 2421 E CB -0.208 29.492 29.700 0.000 0.000 0.741 2421 E HN 0.661 nan 8.360 nan 0.000 0.458 2422 N N -0.414 118.285 118.700 -0.002 0.000 2.461 2422 N HA -0.004 4.735 4.740 -0.001 0.000 0.188 2422 N C 0.769 176.267 175.510 -0.020 0.000 1.134 2422 N CA 0.935 53.978 53.050 -0.013 0.000 0.878 2422 N CB 0.906 39.389 38.487 -0.007 0.000 0.972 2422 N HN 0.343 nan 8.380 nan 0.000 0.456 2423 G N 0.460 109.254 108.800 -0.010 0.000 2.147 2423 G HA2 -0.259 3.700 3.960 -0.001 0.000 0.244 2423 G HA3 -0.259 3.700 3.960 -0.001 0.000 0.244 2423 G C -0.001 174.897 174.900 -0.004 0.000 1.005 2423 G CA 0.049 45.143 45.100 -0.010 0.000 0.713 2423 G HN 0.197 nan 8.290 nan 0.000 0.515 2424 V N 1.478 121.396 119.914 0.007 0.000 2.222 2424 V HA 0.503 4.623 4.120 -0.001 0.000 0.253 2424 V C 0.830 176.939 176.094 0.026 0.000 1.210 2424 V CA 0.158 62.473 62.300 0.024 0.000 1.079 2424 V CB 0.408 32.259 31.823 0.047 0.000 1.265 2424 V HN 1.047 nan 8.190 nan 0.000 0.494 2425 V N 1.924 121.850 119.914 0.020 0.000 3.130 2425 V HA 0.939 5.058 4.120 -0.001 0.000 0.310 2425 V C -0.759 175.345 176.094 0.018 0.000 1.158 2425 V CA -0.909 61.402 62.300 0.019 0.000 1.029 2425 V CB 2.437 34.268 31.823 0.014 0.000 1.057 2425 V HN 0.776 nan 8.190 nan 0.000 0.436 2426 E N 0.956 121.166 120.200 0.017 0.000 2.390 2426 E HA 0.658 5.007 4.350 -0.001 0.000 0.277 2426 E C -3.278 173.330 176.600 0.013 0.000 0.939 2426 E CA -2.370 54.039 56.400 0.015 0.000 0.769 2426 E CB 2.337 32.046 29.700 0.015 0.000 1.251 2426 E HN 0.453 nan 8.360 nan 0.000 0.450 2427 P HA -0.046 nan 4.420 nan 0.000 0.266 2427 P C 0.518 177.826 177.300 0.013 0.000 1.195 2427 P CA -0.339 62.768 63.100 0.012 0.000 0.768 2427 P CB 0.507 32.213 31.700 0.010 0.000 0.838 2428 L N 4.472 125.704 121.223 0.014 0.000 2.012 2428 L HA -0.174 4.166 4.340 -0.001 0.000 0.210 2428 L C 2.418 179.297 176.870 0.016 0.000 1.073 2428 L CA 1.865 56.715 54.840 0.016 0.000 0.748 2428 L CB -0.835 41.234 42.059 0.017 0.000 0.891 2428 L HN 0.311 nan 8.230 nan 0.000 0.431 2429 R N -0.968 119.541 120.500 0.014 0.000 2.133 2429 R HA -0.187 4.153 4.340 -0.001 0.000 0.247 2429 R C 2.030 178.337 176.300 0.012 0.000 1.151 2429 R CA 2.133 58.241 56.100 0.013 0.000 0.971 2429 R CB -0.405 29.902 30.300 0.012 0.000 0.866 2429 R HN 0.395 nan 8.270 nan 0.000 0.447 2430 V N 1.043 120.964 119.914 0.011 0.000 2.295 2430 V HA -0.237 3.883 4.120 -0.001 0.000 0.246 2430 V C 2.333 178.431 176.094 0.007 0.000 1.049 2430 V CA 2.084 64.389 62.300 0.008 0.000 1.024 2430 V CB -0.483 31.345 31.823 0.008 0.000 0.648 2430 V HN 0.283 nan 8.190 nan 0.000 0.447 2431 K N 0.790 121.196 120.400 0.009 0.000 2.103 2431 K HA -0.123 4.197 4.320 -0.001 0.000 0.204 2431 K C 2.224 178.832 176.600 0.014 0.000 1.052 2431 K CA 1.930 58.222 56.287 0.008 0.000 0.945 2431 K CB -0.668 31.838 32.500 0.011 0.000 0.722 2431 K HN 0.678 nan 8.250 nan 0.000 0.443 2432 T N -2.127 112.439 114.554 0.019 0.000 2.942 2432 T HA -0.072 4.278 4.350 -0.001 0.000 0.265 2432 T C 1.875 176.590 174.700 0.026 0.000 1.062 2432 T CA 0.817 62.933 62.100 0.027 0.000 1.139 2432 T CB -0.153 68.731 68.868 0.027 0.000 0.883 2432 T HN 0.104 nan 8.240 nan 0.000 0.468 2433 Q N 1.901 121.713 119.800 0.019 0.000 2.123 2433 Q HA 0.258 4.598 4.340 -0.001 0.000 0.199 2433 Q C 2.417 178.426 176.000 0.015 0.000 0.966 2433 Q CA 1.725 57.539 55.803 0.017 0.000 0.845 2433 Q CB -0.995 27.751 28.738 0.013 0.000 0.907 2433 Q HN 0.627 nan 8.270 nan 0.000 0.439 2434 A N 0.575 123.401 122.820 0.009 0.000 1.908 2434 A HA -0.170 4.150 4.320 -0.001 0.000 0.218 2434 A C 1.946 179.532 177.584 0.003 0.000 1.181 2434 A CA 1.643 53.680 52.037 -0.001 0.000 0.627 2434 A CB -0.719 18.273 19.000 -0.012 0.000 0.818 2434 A HN 0.453 nan 8.150 nan 0.000 0.445 2435 I N -0.470 120.112 120.570 0.019 0.000 2.202 2435 I HA -0.207 3.963 4.170 -0.001 0.000 0.242 2435 I C 2.646 178.806 176.117 0.072 0.000 1.091 2435 I CA 1.937 63.268 61.300 0.051 0.000 1.368 2435 I CB -1.435 36.614 38.000 0.082 0.000 1.058 2435 I HN 0.471 nan 8.210 nan 0.000 0.410 2436 Q N 1.263 121.096 119.800 0.055 0.000 2.030 2436 Q HA -0.161 4.178 4.340 -0.001 0.000 0.204 2436 Q C 2.412 178.441 176.000 0.048 0.000 0.986 2436 Q CA 2.595 58.429 55.803 0.052 0.000 0.843 2436 Q CB -0.301 28.459 28.738 0.037 0.000 0.904 2436 Q HN 0.345 nan 8.270 nan 0.000 0.420 2437 S N 0.013 115.733 115.700 0.034 0.000 2.368 2437 S HA -0.097 4.372 4.470 -0.001 0.000 0.225 2437 S C 1.902 176.520 174.600 0.031 0.000 1.030 2437 S CA 0.972 59.188 58.200 0.028 0.000 0.999 2437 S CB -0.630 62.580 63.200 0.017 0.000 0.844 2437 S HN 0.596 nan 8.310 nan 0.000 0.459 2438 A N 1.568 124.403 122.820 0.025 0.000 1.877 2438 A HA 0.127 4.447 4.320 -0.001 0.000 0.216 2438 A C 2.353 179.968 177.584 0.053 0.000 1.186 2438 A CA 1.709 53.755 52.037 0.016 0.000 0.620 2438 A CB -1.108 17.877 19.000 -0.025 0.000 0.822 2438 A HN 0.508 nan 8.150 nan 0.000 0.443 2439 A N 0.737 123.616 122.820 0.097 0.000 1.898 2439 A HA -0.172 4.148 4.320 -0.001 0.000 0.216 2439 A C 1.996 179.660 177.584 0.133 0.000 1.181 2439 A CA 1.740 53.877 52.037 0.168 0.000 0.620 2439 A CB -0.639 18.485 19.000 0.206 0.000 0.819 2439 A HN 0.786 nan 8.150 nan 0.000 0.442 2440 E N 0.286 120.540 120.200 0.091 0.000 2.208 2440 E HA -0.117 4.233 4.350 -0.001 0.000 0.193 2440 E C 1.819 178.459 176.600 0.065 0.000 0.988 2440 E CA 1.396 57.839 56.400 0.072 0.000 0.828 2440 E CB -0.345 29.386 29.700 0.052 0.000 0.763 2440 E HN 0.633 nan 8.360 nan 0.000 0.478 2441 S N 0.289 116.026 115.700 0.061 0.000 2.446 2441 S HA -0.038 4.432 4.470 -0.001 0.000 0.225 2441 S C 2.005 176.643 174.600 0.063 0.000 1.016 2441 S CA 0.949 59.179 58.200 0.050 0.000 0.943 2441 S CB -0.278 62.943 63.200 0.035 0.000 0.786 2441 S HN 0.205 nan 8.310 nan 0.000 0.508 2442 T N 2.291 116.898 114.554 0.089 0.000 2.737 2442 T HA -0.043 4.306 4.350 -0.001 0.000 0.265 2442 T C 1.737 176.519 174.700 0.136 0.000 1.038 2442 T CA 1.571 63.747 62.100 0.128 0.000 1.144 2442 T CB -0.384 68.602 68.868 0.196 0.000 0.866 2442 T HN 0.661 nan 8.240 nan 0.000 0.434 2443 E N 0.719 121.002 120.200 0.137 0.000 2.110 2443 E HA -0.138 4.211 4.350 -0.001 0.000 0.193 2443 E C 2.231 178.869 176.600 0.063 0.000 0.988 2443 E CA 0.850 57.310 56.400 0.099 0.000 0.804 2443 E CB -0.211 29.545 29.700 0.092 0.000 0.745 2443 E HN 0.451 nan 8.360 nan 0.000 0.458 2444 M N 0.688 120.323 119.600 0.059 0.000 2.073 2444 M HA -0.235 4.245 4.480 -0.001 0.000 0.258 2444 M C 2.359 178.683 176.300 0.040 0.000 1.070 2444 M CA 1.601 56.927 55.300 0.044 0.000 1.103 2444 M CB -0.202 32.422 32.600 0.041 0.000 1.321 2444 M HN 0.338 nan 8.290 nan 0.000 0.405 2445 L N 0.526 121.776 121.223 0.045 0.000 2.012 2445 L HA -0.241 4.098 4.340 -0.001 0.000 0.210 2445 L C 2.249 179.138 176.870 0.031 0.000 1.073 2445 L CA 1.451 56.314 54.840 0.038 0.000 0.748 2445 L CB -0.324 41.758 42.059 0.038 0.000 0.891 2445 L HN 0.419 nan 8.230 nan 0.000 0.431 2446 L N -0.683 120.561 121.223 0.034 0.000 2.131 2446 L HA -0.213 4.127 4.340 -0.001 0.000 0.210 2446 L C 2.685 179.561 176.870 0.011 0.000 1.092 2446 L CA 1.133 55.982 54.840 0.015 0.000 0.759 2446 L CB -0.470 41.597 42.059 0.013 0.000 0.903 2446 L HN 0.246 nan 8.230 nan 0.000 0.435 2447 R N -0.202 120.311 120.500 0.022 0.000 2.189 2447 R HA 0.061 4.400 4.340 -0.001 0.000 0.218 2447 R C 0.436 176.747 176.300 0.019 0.000 1.074 2447 R CA 0.527 56.640 56.100 0.021 0.000 0.991 2447 R CB -0.072 30.243 30.300 0.025 0.000 0.883 2447 R HN 0.279 nan 8.270 nan 0.000 0.457 2448 I N 0.835 121.417 120.570 0.020 0.000 2.331 2448 I HA 0.040 4.209 4.170 -0.001 0.000 0.292 2448 I C 0.264 176.392 176.117 0.017 0.000 0.998 2448 I CA 0.023 61.336 61.300 0.021 0.000 1.267 2448 I CB 1.520 39.536 38.000 0.028 0.000 1.386 2448 I HN -0.117 nan 8.210 nan 0.000 0.476 2449 D N 3.375 123.784 120.400 0.016 0.000 2.539 2449 D HA 0.111 4.750 4.640 -0.001 0.000 0.232 2449 D C -0.798 175.513 176.300 0.019 0.000 1.256 2449 D CA 0.238 54.245 54.000 0.011 0.000 0.810 2449 D CB 0.514 41.315 40.800 0.002 0.000 1.090 2449 D HN 0.432 nan 8.370 nan 0.000 0.519 2450 D N 0.036 120.450 120.400 0.023 0.000 2.861 2450 D HA 0.199 4.839 4.640 -0.001 0.000 0.216 2450 D C -1.363 174.951 176.300 0.024 0.000 1.323 2450 D CA -0.403 53.611 54.000 0.024 0.000 0.917 2450 D CB 1.903 42.714 40.800 0.018 0.000 1.582 2450 D HN -0.263 nan 8.370 nan 0.000 0.576 2451 V N 5.178 125.109 119.914 0.028 0.000 2.347 2451 V HA 0.477 4.597 4.120 -0.001 0.000 0.280 2451 V C 0.409 176.509 176.094 0.010 0.000 1.021 2451 V CA -0.551 61.761 62.300 0.021 0.000 0.847 2451 V CB 1.276 33.116 31.823 0.028 0.000 0.990 2451 V HN 0.477 nan 8.190 nan 0.000 0.444 2452 I N 4.913 125.485 120.570 0.003 0.000 2.371 2452 I HA 0.646 4.816 4.170 -0.001 0.000 0.282 2452 I C 0.396 176.507 176.117 -0.009 0.000 1.031 2452 I CA -0.210 61.090 61.300 -0.001 0.000 1.180 2452 I CB 1.294 39.294 38.000 0.001 0.000 1.336 2452 I HN 0.657 nan 8.210 nan 0.000 0.467 2453 A N 4.867 127.678 122.820 -0.015 0.000 2.337 2453 A HA 0.890 5.210 4.320 -0.001 0.000 0.329 2453 A C 0.105 177.679 177.584 -0.017 0.000 1.146 2453 A CA -0.500 51.524 52.037 -0.023 0.000 0.800 2453 A CB 1.205 20.182 19.000 -0.039 0.000 1.220 2453 A HN 0.718 nan 8.150 nan 0.000 0.472 2454 A N 1.764 124.575 122.820 -0.016 0.000 2.313 2454 A HA 0.548 4.867 4.320 -0.001 0.000 0.261 2454 A C 0.413 177.989 177.584 -0.014 0.000 1.090 2454 A CA -0.270 51.760 52.037 -0.013 0.000 0.807 2454 A CB -0.175 18.819 19.000 -0.010 0.000 1.055 2454 A HN 0.893 nan 8.150 nan 0.000 0.492 2455 E N 0.000 120.193 120.200 -0.011 0.000 2.725 2455 E HA 0.000 4.350 4.350 -0.001 0.000 0.291 2455 E CA 0.000 56.394 56.400 -0.011 0.000 0.976 2455 E CB 0.000 29.695 29.700 -0.008 0.000 0.812 2455 E HN 0.000 nan 8.360 nan 0.000 0.440