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 2h02_1_A DATA FIRST_RESID 1678 DATA SEQUENCE KTSCPIKINQ FEGHFMKLQA DSNYLLSKEY EELKDVGRNQ SCDIALLPEN DATA SEQUENCE RGKNRYNNIL PYDATRVKLS XXXXXXXSDY INASYIPGNN FRREYIVTQG DATA SEQUENCE PLPGTKDDFW KMVWEQNVHN IVMVTQCVEK GRVKCDHYWP ADQDSLYYGD DATA SEQUENCE LILQMLSESV LPEWTIREFK ICGEXXXXXH RLIRHFHYTV WPDHGVPETT DATA SEQUENCE QSLIQFVRTV RDYINRSPGA GPTVVHCSAG VGRTGTFIAL DRILQQLDSK DATA SEQUENCE DSVDIYGAVH DLRLHRVHMV QTECQYVYLH QCVRDVLRAR 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 1678 K HA 0.000 nan 4.320 nan 0.000 0.191 1678 K C 0.000 176.604 176.600 0.006 0.000 0.988 1678 K CA 0.000 56.298 56.287 0.018 0.000 0.838 1678 K CB 0.000 32.495 32.500 -0.008 0.000 1.064 1679 T N 0.764 115.316 114.554 -0.004 0.000 3.353 1679 T HA 0.098 4.447 4.350 -0.001 0.000 0.420 1679 T C -1.818 172.876 174.700 -0.010 0.000 1.673 1679 T CA 0.016 61.913 62.100 -0.338 0.000 1.085 1679 T CB 0.468 69.162 68.868 -0.291 0.000 1.616 1679 T HN 1.278 nan 8.240 nan 0.000 0.467 1680 S N 0.910 116.663 115.700 0.088 0.000 4.245 1680 S HA -0.181 4.289 4.470 -0.001 0.000 0.783 1680 S C 0.144 174.811 174.600 0.111 0.000 1.082 1680 S CA 0.190 58.484 58.200 0.157 0.000 1.191 1680 S CB -1.445 61.788 63.200 0.056 0.000 1.971 1680 S HN 1.769 nan 8.310 nan 0.000 0.351 1681 C N 7.493 126.886 119.300 0.155 0.000 2.439 1681 C HA 0.635 5.094 4.460 -0.001 0.000 0.298 1681 C C -2.486 172.524 174.990 0.033 0.000 1.094 1681 C CA -2.068 56.958 59.018 0.013 0.000 1.609 1681 C CB -0.721 26.959 27.740 -0.099 0.000 1.723 1681 C HN 0.832 nan 8.230 nan 0.000 0.423 1682 P HA 0.323 nan 4.420 nan 0.000 0.276 1682 P C -0.608 176.668 177.300 -0.040 0.000 1.243 1682 P CA 0.365 63.462 63.100 -0.006 0.000 0.768 1682 P CB 0.387 32.084 31.700 -0.005 0.000 0.856 1683 I N 2.705 123.248 120.570 -0.044 0.000 2.382 1683 I HA 0.243 4.412 4.170 -0.001 0.000 0.286 1683 I C 0.493 176.608 176.117 -0.003 0.000 1.002 1683 I CA -1.339 59.928 61.300 -0.056 0.000 1.135 1683 I CB 1.166 39.109 38.000 -0.094 0.000 1.288 1683 I HN 0.145 nan 8.210 nan 0.000 0.448 1684 K N 5.653 126.052 120.400 -0.002 0.000 2.502 1684 K HA -0.079 4.241 4.320 -0.001 0.000 0.268 1684 K C 1.357 177.985 176.600 0.047 0.000 1.025 1684 K CA 0.205 56.500 56.287 0.014 0.000 1.139 1684 K CB 1.006 33.516 32.500 0.017 0.000 0.810 1684 K HN 0.534 nan 8.250 nan 0.000 0.483 1685 I N 2.204 122.786 120.570 0.019 0.000 2.145 1685 I HA -0.394 3.775 4.170 -0.001 0.000 0.244 1685 I C 1.919 178.080 176.117 0.075 0.000 1.075 1685 I CA 1.894 63.209 61.300 0.024 0.000 1.332 1685 I CB -1.028 36.958 38.000 -0.024 0.000 1.033 1685 I HN 0.638 nan 8.210 nan 0.000 0.410 1686 N N 1.659 120.393 118.700 0.056 0.000 2.396 1686 N HA -0.206 4.534 4.740 -0.001 0.000 0.180 1686 N C 1.448 177.009 175.510 0.085 0.000 1.028 1686 N CA 0.979 54.065 53.050 0.061 0.000 0.893 1686 N CB -0.566 37.944 38.487 0.038 0.000 0.967 1686 N HN 0.569 nan 8.380 nan 0.000 0.440 1687 Q N -1.131 118.727 119.800 0.097 0.000 2.392 1687 Q HA 0.099 4.439 4.340 -0.001 0.000 0.203 1687 Q C 0.996 177.087 176.000 0.152 0.000 0.917 1687 Q CA -0.181 55.683 55.803 0.102 0.000 0.939 1687 Q CB -0.090 28.688 28.738 0.067 0.000 1.063 1687 Q HN 0.335 nan 8.270 nan 0.000 0.516 1688 F N 3.507 123.492 119.950 0.059 0.000 2.075 1688 F HA -0.230 4.296 4.527 -0.001 0.000 0.297 1688 F C 2.226 178.155 175.800 0.215 0.000 1.113 1688 F CA 1.724 59.784 58.000 0.100 0.000 1.218 1688 F CB 0.128 39.139 39.000 0.018 0.000 0.984 1688 F HN 0.018 nan 8.300 nan 0.000 0.472 1689 E N 0.341 120.687 120.200 0.243 0.000 2.049 1689 E HA -0.228 4.122 4.350 -0.001 0.000 0.198 1689 E C 2.530 179.178 176.600 0.080 0.000 1.007 1689 E CA 1.500 58.009 56.400 0.183 0.000 0.809 1689 E CB -1.796 28.008 29.700 0.173 0.000 0.749 1689 E HN 0.510 nan 8.360 nan 0.000 0.450 1690 G N 0.867 109.707 108.800 0.067 0.000 2.421 1690 G HA2 -0.356 3.604 3.960 -0.001 0.000 0.216 1690 G HA3 -0.356 3.604 3.960 -0.001 0.000 0.216 1690 G C 1.546 176.452 174.900 0.010 0.000 1.171 1690 G CA 1.292 46.410 45.100 0.031 0.000 0.775 1690 G HN 0.543 nan 8.290 nan 0.000 0.543 1691 H N -0.591 118.438 119.070 -0.068 0.000 2.319 1691 H HA -0.107 4.448 4.556 -0.001 0.000 0.299 1691 H C 2.115 177.394 175.328 -0.081 0.000 1.092 1691 H CA 1.790 57.788 56.048 -0.084 0.000 1.302 1691 H CB -0.418 29.279 29.762 -0.109 0.000 1.373 1691 H HN 0.210 nan 8.280 nan 0.000 0.497 1692 F N 1.029 120.730 119.950 -0.415 0.000 2.095 1692 F HA -0.242 4.285 4.527 -0.001 0.000 0.298 1692 F C 2.312 177.964 175.800 -0.247 0.000 1.104 1692 F CA 1.884 59.646 58.000 -0.396 0.000 1.232 1692 F CB -0.720 38.044 39.000 -0.394 0.000 0.987 1692 F HN 0.277 nan 8.300 nan 0.000 0.475 1693 M N -0.001 119.424 119.600 -0.291 0.000 2.089 1693 M HA -0.323 4.156 4.480 -0.001 0.000 0.257 1693 M C 2.220 178.383 176.300 -0.228 0.000 1.071 1693 M CA 2.065 57.197 55.300 -0.280 0.000 1.096 1693 M CB -0.654 31.857 32.600 -0.148 0.000 1.330 1693 M HN 0.034 nan 8.290 nan 0.000 0.403 1694 K N 0.156 120.447 120.400 -0.182 0.000 2.020 1694 K HA -0.192 4.127 4.320 -0.001 0.000 0.212 1694 K C 1.887 178.395 176.600 -0.154 0.000 1.050 1694 K CA 1.402 57.603 56.287 -0.144 0.000 0.929 1694 K CB -0.386 32.041 32.500 -0.121 0.000 0.714 1694 K HN 0.155 nan 8.250 nan 0.000 0.443 1695 L N 1.324 122.406 121.223 -0.236 0.000 2.083 1695 L HA -0.192 4.148 4.340 -0.001 0.000 0.209 1695 L C 2.377 179.156 176.870 -0.152 0.000 1.083 1695 L CA 1.632 56.364 54.840 -0.180 0.000 0.752 1695 L CB -0.494 41.440 42.059 -0.208 0.000 0.899 1695 L HN 0.202 nan 8.230 nan 0.000 0.433 1696 Q N -0.889 118.748 119.800 -0.271 0.000 2.230 1696 Q HA 0.079 4.418 4.340 -0.001 0.000 0.202 1696 Q C 0.936 176.845 176.000 -0.152 0.000 0.963 1696 Q CA 0.519 56.155 55.803 -0.277 0.000 0.866 1696 Q CB 0.017 28.455 28.738 -0.500 0.000 0.931 1696 Q HN 0.523 nan 8.270 nan 0.000 0.452 1697 A N 1.431 124.180 122.820 -0.118 0.000 2.507 1697 A HA -0.022 4.297 4.320 -0.001 0.000 0.235 1697 A C -0.243 177.333 177.584 -0.012 0.000 1.070 1697 A CA 0.194 52.192 52.037 -0.066 0.000 0.768 1697 A CB 0.069 19.034 19.000 -0.059 0.000 1.011 1697 A HN 0.557 nan 8.150 nan 0.000 0.502 1698 D N 0.734 121.119 120.400 -0.024 0.000 2.735 1698 D HA -0.152 4.487 4.640 -0.001 0.000 0.235 1698 D C 0.240 176.561 176.300 0.035 0.000 1.175 1698 D CA 1.426 55.417 54.000 -0.015 0.000 0.683 1698 D CB -1.749 39.009 40.800 -0.070 0.000 1.008 1698 D HN 0.897 nan 8.370 nan 0.000 0.416 1699 S N 0.133 115.841 115.700 0.013 0.000 3.711 1699 S HA -0.275 4.194 4.470 -0.001 0.000 0.374 1699 S C 0.453 175.083 174.600 0.049 0.000 0.969 1699 S CA 0.733 58.948 58.200 0.025 0.000 1.198 1699 S CB -0.714 62.507 63.200 0.035 0.000 0.903 1699 S HN 0.592 nan 8.310 nan 0.000 0.493 1700 N N -1.637 117.078 118.700 0.024 0.000 2.754 1700 N HA -0.212 4.527 4.740 -0.001 0.000 0.248 1700 N C 0.197 175.742 175.510 0.058 0.000 1.093 1700 N CA 1.233 54.293 53.050 0.016 0.000 0.699 1700 N CB -1.657 36.835 38.487 0.009 0.000 1.016 1700 N HN 0.750 nan 8.380 nan 0.000 0.552 1701 Y N 0.455 120.739 120.300 -0.026 0.000 2.145 1701 Y HA -0.016 4.534 4.550 -0.001 0.000 0.286 1701 Y C 1.996 177.899 175.900 0.005 0.000 1.145 1701 Y CA 1.869 59.964 58.100 -0.008 0.000 1.148 1701 Y CB -0.180 38.270 38.460 -0.016 0.000 0.981 1701 Y HN 0.324 nan 8.280 nan 0.000 0.507 1702 L N -0.808 120.424 121.223 0.014 0.000 2.095 1702 L HA -0.146 4.193 4.340 -0.001 0.000 0.204 1702 L C 2.451 179.296 176.870 -0.042 0.000 1.080 1702 L CA 0.973 55.782 54.840 -0.052 0.000 0.759 1702 L CB -0.642 41.432 42.059 0.026 0.000 0.914 1702 L HN 0.287 nan 8.230 nan 0.000 0.439 1703 L N -0.570 120.648 121.223 -0.008 0.000 2.043 1703 L HA -0.258 4.081 4.340 -0.001 0.000 0.212 1703 L C 2.659 179.587 176.870 0.097 0.000 1.075 1703 L CA 1.508 56.389 54.840 0.069 0.000 0.752 1703 L CB -0.139 41.947 42.059 0.046 0.000 0.891 1703 L HN 0.152 nan 8.230 nan 0.000 0.432 1704 S N -0.718 114.986 115.700 0.007 0.000 2.383 1704 S HA -0.144 4.325 4.470 -0.001 0.000 0.227 1704 S C 1.928 176.517 174.600 -0.019 0.000 1.026 1704 S CA 0.902 59.105 58.200 0.006 0.000 0.981 1704 S CB -0.163 63.008 63.200 -0.047 0.000 0.818 1704 S HN 0.320 nan 8.310 nan 0.000 0.472 1705 K N 1.445 121.762 120.400 -0.138 0.000 2.009 1705 K HA -0.062 4.258 4.320 -0.001 0.000 0.210 1705 K C 2.119 178.720 176.600 0.001 0.000 1.049 1705 K CA 1.191 57.402 56.287 -0.127 0.000 0.929 1705 K CB -0.619 31.748 32.500 -0.220 0.000 0.714 1705 K HN 0.463 nan 8.250 nan 0.000 0.440 1706 E N -0.326 119.912 120.200 0.065 0.000 2.023 1706 E HA -0.227 4.122 4.350 -0.001 0.000 0.196 1706 E C 2.022 178.720 176.600 0.163 0.000 1.003 1706 E CA 1.254 57.760 56.400 0.176 0.000 0.809 1706 E CB -0.259 29.620 29.700 0.299 0.000 0.755 1706 E HN 0.257 nan 8.360 nan 0.000 0.449 1707 Y N 1.386 121.637 120.300 -0.081 0.000 2.298 1707 Y HA -0.243 4.307 4.550 -0.000 0.000 0.287 1707 Y C 2.033 177.842 175.900 -0.152 0.000 1.164 1707 Y CA 1.922 59.820 58.100 -0.337 0.000 1.229 1707 Y CB -0.014 38.290 38.460 -0.260 0.000 0.977 1707 Y HN 0.074 nan 8.280 nan 0.000 0.538 1708 E N 0.203 120.379 120.200 -0.041 0.000 2.158 1708 E HA -0.122 4.227 4.350 -0.001 0.000 0.191 1708 E C 1.964 178.525 176.600 -0.064 0.000 0.982 1708 E CA 1.163 57.521 56.400 -0.071 0.000 0.823 1708 E CB -0.111 29.588 29.700 -0.003 0.000 0.766 1708 E HN 0.584 nan 8.360 nan 0.000 0.468 1709 E N -0.322 119.889 120.200 0.019 0.000 2.153 1709 E HA -0.142 4.207 4.350 -0.001 0.000 0.194 1709 E C 1.531 178.167 176.600 0.059 0.000 0.988 1709 E CA 0.863 57.318 56.400 0.092 0.000 0.811 1709 E CB -0.028 29.817 29.700 0.241 0.000 0.746 1709 E HN 0.308 nan 8.360 nan 0.000 0.466 1710 L N 0.873 122.053 121.223 -0.072 0.000 2.552 1710 L HA -0.083 4.256 4.340 -0.001 0.000 0.227 1710 L C 2.213 178.949 176.870 -0.224 0.000 1.146 1710 L CA 0.551 55.265 54.840 -0.209 0.000 0.858 1710 L CB -0.354 41.456 42.059 -0.415 0.000 0.969 1710 L HN 0.099 nan 8.230 nan 0.000 0.451 1711 K N -0.387 119.895 120.400 -0.198 0.000 2.103 1711 K HA -0.191 4.128 4.320 -0.001 0.000 0.207 1711 K C 0.946 177.478 176.600 -0.112 0.000 1.048 1711 K CA 1.845 58.030 56.287 -0.171 0.000 0.930 1711 K CB -0.111 32.318 32.500 -0.119 0.000 0.716 1711 K HN 0.137 nan 8.250 nan 0.000 0.444 1712 D N 0.722 121.073 120.400 -0.082 0.000 2.349 1712 D HA 0.074 4.713 4.640 -0.001 0.000 0.214 1712 D C -0.338 175.913 176.300 -0.081 0.000 1.063 1712 D CA -0.008 53.954 54.000 -0.063 0.000 0.847 1712 D CB 0.475 41.254 40.800 -0.035 0.000 0.933 1712 D HN -0.024 nan 8.370 nan 0.000 0.513 1713 V N 0.738 120.585 119.914 -0.111 0.000 2.493 1713 V HA 0.298 4.417 4.120 -0.001 0.000 0.292 1713 V C 1.634 177.623 176.094 -0.176 0.000 1.016 1713 V CA 1.164 63.363 62.300 -0.169 0.000 1.097 1713 V CB 0.515 32.162 31.823 -0.293 0.000 0.947 1713 V HN 0.491 nan 8.190 nan 0.000 0.479 1714 G N 5.138 113.819 108.800 -0.199 0.000 2.175 1714 G HA2 -0.225 3.734 3.960 -0.001 0.000 0.244 1714 G HA3 -0.225 3.734 3.960 -0.001 0.000 0.244 1714 G C 0.885 175.602 174.900 -0.306 0.000 0.982 1714 G CA 0.080 45.015 45.100 -0.275 0.000 0.641 1714 G HN 0.541 nan 8.290 nan 0.000 0.527 1715 R N 1.176 121.575 120.500 -0.168 0.000 2.307 1715 R HA 0.074 4.413 4.340 -0.001 0.000 0.199 1715 R C 2.138 178.363 176.300 -0.125 0.000 1.000 1715 R CA 0.835 56.872 56.100 -0.105 0.000 1.023 1715 R CB -0.639 29.624 30.300 -0.061 0.000 0.908 1715 R HN 0.783 nan 8.270 nan 0.000 0.473 1716 N N 0.640 119.236 118.700 -0.174 0.000 2.512 1716 N HA -0.126 4.613 4.740 -0.001 0.000 0.183 1716 N C -0.057 175.341 175.510 -0.186 0.000 1.073 1716 N CA 0.328 53.289 53.050 -0.148 0.000 0.911 1716 N CB 0.041 38.447 38.487 -0.135 0.000 0.964 1716 N HN 0.295 nan 8.380 nan 0.000 0.447 1717 Q N 0.631 120.228 119.800 -0.337 0.000 2.235 1717 Q HA 0.393 4.732 4.340 -0.001 0.000 0.250 1717 Q C -0.499 175.439 176.000 -0.104 0.000 0.909 1717 Q CA -0.410 55.168 55.803 -0.375 0.000 0.910 1717 Q CB 1.558 29.782 28.738 -0.856 0.000 1.223 1717 Q HN -0.017 nan 8.270 nan 0.000 0.432 1718 S N 0.608 116.303 115.700 -0.008 0.000 2.632 1718 S HA 0.289 4.758 4.470 -0.001 0.000 0.271 1718 S C 0.026 174.728 174.600 0.169 0.000 1.260 1718 S CA -0.775 57.473 58.200 0.079 0.000 1.010 1718 S CB 0.603 63.823 63.200 0.034 0.000 0.965 1718 S HN 0.846 nan 8.310 nan 0.000 0.534 1719 C N 0.561 119.939 119.300 0.130 0.000 2.955 1719 C HA 0.459 4.918 4.460 -0.001 0.000 0.229 1719 C C 0.735 175.754 174.990 0.048 0.000 1.842 1719 C CA -1.014 58.070 59.018 0.110 0.000 1.539 1719 C CB -1.461 26.334 27.740 0.091 0.000 2.869 1719 C HN 0.723 nan 8.230 nan 0.000 0.503 1720 D N 1.792 122.215 120.400 0.039 0.000 2.144 1720 D HA -0.098 4.542 4.640 -0.001 0.000 0.199 1720 D C 2.065 178.350 176.300 -0.025 0.000 0.984 1720 D CA 1.231 55.235 54.000 0.006 0.000 0.834 1720 D CB 0.199 41.005 40.800 0.011 0.000 0.955 1720 D HN 0.455 nan 8.370 nan 0.000 0.465 1721 I N 1.151 121.716 120.570 -0.010 0.000 2.252 1721 I HA -0.144 4.025 4.170 -0.001 0.000 0.245 1721 I C 2.418 178.378 176.117 -0.261 0.000 1.102 1721 I CA 0.612 61.877 61.300 -0.058 0.000 1.385 1721 I CB -1.209 36.821 38.000 0.051 0.000 1.064 1721 I HN -0.111 nan 8.210 nan 0.000 0.414 1722 A N 0.653 123.324 122.820 -0.248 0.000 2.070 1722 A HA -0.086 4.234 4.320 -0.001 0.000 0.220 1722 A C 2.258 179.642 177.584 -0.333 0.000 1.159 1722 A CA 1.026 52.773 52.037 -0.484 0.000 0.656 1722 A CB -0.651 18.328 19.000 -0.035 0.000 0.800 1722 A HN 0.436 nan 8.150 nan 0.000 0.453 1723 L N -0.343 120.771 121.223 -0.181 0.000 2.558 1723 L HA 0.170 4.510 4.340 -0.001 0.000 0.225 1723 L C 0.281 177.079 176.870 -0.121 0.000 1.128 1723 L CA -0.374 54.397 54.840 -0.117 0.000 0.868 1723 L CB -0.258 41.768 42.059 -0.055 0.000 1.006 1723 L HN 0.273 nan 8.230 nan 0.000 0.454 1724 L N 1.102 122.229 121.223 -0.160 0.000 2.514 1724 L HA -0.027 4.312 4.340 -0.001 0.000 0.280 1724 L C -0.907 175.898 176.870 -0.108 0.000 1.223 1724 L CA -1.026 53.744 54.840 -0.116 0.000 0.864 1724 L CB 0.176 42.165 42.059 -0.116 0.000 1.118 1724 L HN -0.124 nan 8.230 nan 0.000 0.494 1725 P HA -0.253 nan 4.420 nan 0.000 0.217 1725 P C 1.064 178.333 177.300 -0.051 0.000 1.158 1725 P CA 1.576 64.645 63.100 -0.050 0.000 0.887 1725 P CB 0.127 31.807 31.700 -0.032 0.000 0.792 1726 E N -1.156 119.014 120.200 -0.049 0.000 2.209 1726 E HA -0.169 4.180 4.350 -0.001 0.000 0.196 1726 E C 1.360 177.934 176.600 -0.043 0.000 0.993 1726 E CA 1.106 57.485 56.400 -0.034 0.000 0.819 1726 E CB -0.959 28.730 29.700 -0.018 0.000 0.745 1726 E HN 0.303 nan 8.360 nan 0.000 0.477 1727 N N 0.544 119.179 118.700 -0.108 0.000 2.353 1727 N HA 0.028 4.767 4.740 -0.001 0.000 0.185 1727 N C 1.334 176.778 175.510 -0.109 0.000 1.098 1727 N CA 0.327 53.282 53.050 -0.160 0.000 0.872 1727 N CB 0.068 38.227 38.487 -0.547 0.000 0.970 1727 N HN 0.189 nan 8.380 nan 0.000 0.467 1728 R N 1.107 121.558 120.500 -0.081 0.000 2.094 1728 R HA -0.108 4.231 4.340 -0.001 0.000 0.239 1728 R C 1.946 178.236 176.300 -0.018 0.000 1.137 1728 R CA 2.023 58.093 56.100 -0.050 0.000 0.943 1728 R CB -0.735 29.543 30.300 -0.038 0.000 0.850 1728 R HN 0.144 nan 8.270 nan 0.000 0.433 1729 G N -0.098 108.698 108.800 -0.007 0.000 2.586 1729 G HA2 -0.196 3.763 3.960 -0.001 0.000 0.215 1729 G HA3 -0.196 3.763 3.960 -0.001 0.000 0.215 1729 G C 0.848 175.758 174.900 0.015 0.000 1.128 1729 G CA 0.557 45.657 45.100 0.000 0.000 0.774 1729 G HN 0.390 nan 8.290 nan 0.000 0.543 1730 K N 0.157 120.590 120.400 0.054 0.000 2.404 1730 K HA 0.115 4.434 4.320 -0.001 0.000 0.194 1730 K C -0.104 176.567 176.600 0.119 0.000 1.023 1730 K CA -0.201 56.152 56.287 0.110 0.000 1.094 1730 K CB 0.362 33.009 32.500 0.244 0.000 0.841 1730 K HN 0.108 nan 8.250 nan 0.000 0.523 1731 N N 1.174 119.919 118.700 0.074 0.000 2.400 1731 N HA 0.107 4.846 4.740 -0.001 0.000 0.288 1731 N C 0.262 175.738 175.510 -0.055 0.000 1.024 1731 N CA -0.146 52.934 53.050 0.049 0.000 0.894 1731 N CB 1.827 40.359 38.487 0.075 0.000 1.173 1731 N HN 0.014 nan 8.380 nan 0.000 0.487 1732 R N 1.864 122.275 120.500 -0.149 0.000 2.092 1732 R HA -0.026 4.314 4.340 -0.001 0.000 0.231 1732 R C -0.399 175.571 176.300 -0.550 0.000 1.119 1732 R CA 1.407 57.273 56.100 -0.389 0.000 0.970 1732 R CB 0.190 30.154 30.300 -0.559 0.000 0.864 1732 R HN 0.488 nan 8.270 nan 0.000 0.440 1733 Y N -0.634 119.674 120.300 0.013 0.000 2.391 1733 Y HA 0.306 4.855 4.550 -0.002 0.000 0.341 1733 Y C 0.189 176.101 175.900 0.020 0.000 0.965 1733 Y CA -1.133 56.977 58.100 0.016 0.000 1.067 1733 Y CB 1.849 40.320 38.460 0.017 0.000 1.199 1733 Y HN -0.046 nan 8.280 nan 0.000 0.450 1734 N N 1.269 120.067 118.700 0.164 0.000 2.512 1734 N HA -0.141 4.598 4.740 -0.001 0.000 0.183 1734 N C 0.571 176.135 175.510 0.091 0.000 1.073 1734 N CA 0.670 53.776 53.050 0.093 0.000 0.911 1734 N CB 0.177 38.701 38.487 0.063 0.000 0.964 1734 N HN 0.591 nan 8.380 nan 0.000 0.447 1735 N N 0.435 119.206 118.700 0.118 0.000 2.234 1735 N HA 0.047 4.787 4.740 -0.001 0.000 0.227 1735 N C -0.806 174.776 175.510 0.119 0.000 1.151 1735 N CA 0.060 53.169 53.050 0.098 0.000 0.865 1735 N CB 0.477 39.012 38.487 0.080 0.000 1.066 1735 N HN 0.001 nan 8.380 nan 0.000 0.515 1736 I N 1.808 122.460 120.570 0.137 0.000 2.466 1736 I HA 0.431 4.600 4.170 -0.001 0.000 0.279 1736 I C -0.814 175.355 176.117 0.086 0.000 1.033 1736 I CA -0.367 61.010 61.300 0.129 0.000 1.123 1736 I CB 0.987 39.095 38.000 0.181 0.000 1.237 1736 I HN -0.032 nan 8.210 nan 0.000 0.460 1737 L N 7.111 128.343 121.223 0.016 0.000 2.434 1737 L HA 0.598 4.938 4.340 -0.001 0.000 0.260 1737 L C -2.582 174.242 176.870 -0.076 0.000 0.983 1737 L CA -1.715 53.141 54.840 0.027 0.000 0.820 1737 L CB 3.207 45.288 42.059 0.037 0.000 1.361 1737 L HN 0.243 nan 8.230 nan 0.000 0.410 1738 P HA 0.135 nan 4.420 nan 0.000 0.279 1738 P C -1.186 176.086 177.300 -0.047 0.000 1.239 1738 P CA -0.348 62.700 63.100 -0.086 0.000 0.789 1738 P CB 0.421 32.124 31.700 0.004 0.000 0.933 1739 Y N 1.346 121.671 120.300 0.042 0.000 2.810 1739 Y HA -0.098 4.451 4.550 -0.001 0.000 0.332 1739 Y C 1.956 177.890 175.900 0.056 0.000 1.243 1739 Y CA 0.615 58.734 58.100 0.031 0.000 1.537 1739 Y CB -0.699 37.763 38.460 0.003 0.000 1.265 1739 Y HN 0.410 nan 8.280 nan 0.000 0.572 1740 D N 2.822 123.355 120.400 0.221 0.000 2.133 1740 D HA -0.231 4.408 4.640 -0.001 0.000 0.195 1740 D C 1.983 178.371 176.300 0.146 0.000 0.997 1740 D CA 1.792 55.885 54.000 0.155 0.000 0.840 1740 D CB -0.208 40.657 40.800 0.108 0.000 0.947 1740 D HN 0.695 nan 8.370 nan 0.000 0.452 1741 A N 0.360 123.259 122.820 0.132 0.000 2.076 1741 A HA -0.126 4.193 4.320 -0.001 0.000 0.220 1741 A C 2.005 179.683 177.584 0.158 0.000 1.160 1741 A CA 2.246 54.346 52.037 0.104 0.000 0.653 1741 A CB -0.356 18.667 19.000 0.038 0.000 0.801 1741 A HN 0.382 nan 8.150 nan 0.000 0.455 1742 T N -2.718 111.964 114.554 0.213 0.000 3.209 1742 T HA 0.295 4.645 4.350 -0.001 0.000 0.295 1742 T C 0.368 175.223 174.700 0.258 0.000 0.977 1742 T CA -0.281 61.986 62.100 0.279 0.000 0.922 1742 T CB -0.287 68.783 68.868 0.337 0.000 1.152 1742 T HN 0.665 nan 8.240 nan 0.000 0.527 1743 R N 0.861 121.466 120.500 0.175 0.000 2.582 1743 R HA 0.608 4.947 4.340 -0.001 0.000 0.271 1743 R C -0.673 175.614 176.300 -0.022 0.000 1.078 1743 R CA -0.701 55.431 56.100 0.053 0.000 1.127 1743 R CB 0.449 30.795 30.300 0.076 0.000 1.038 1743 R HN 0.012 nan 8.270 nan 0.000 0.500 1744 V N 2.835 122.582 119.914 -0.277 0.000 2.508 1744 V HA 0.117 4.236 4.120 -0.001 0.000 0.281 1744 V C 0.288 176.295 176.094 -0.144 0.000 1.041 1744 V CA -0.151 61.914 62.300 -0.391 0.000 1.016 1744 V CB 0.586 32.036 31.823 -0.622 0.000 0.984 1744 V HN 0.694 nan 8.190 nan 0.000 0.478 1745 K N 5.187 125.584 120.400 -0.005 0.000 2.159 1745 K HA 0.595 4.915 4.320 -0.001 0.000 0.266 1745 K C -0.750 175.856 176.600 0.010 0.000 0.975 1745 K CA -0.603 55.696 56.287 0.019 0.000 0.865 1745 K CB 1.724 34.271 32.500 0.078 0.000 1.087 1745 K HN 0.500 nan 8.250 nan 0.000 0.446 1746 L N 2.205 123.426 121.223 -0.003 0.000 2.397 1746 L HA 0.091 4.430 4.340 -0.001 0.000 0.271 1746 L C 1.152 178.050 176.870 0.046 0.000 1.148 1746 L CA -0.219 54.630 54.840 0.016 0.000 0.825 1746 L CB 0.981 43.045 42.059 0.008 0.000 1.117 1746 L HN 0.793 nan 8.230 nan 0.000 0.456 1756 D N 0.765 121.222 120.400 0.095 0.000 2.339 1756 D HA 0.119 4.758 4.640 -0.001 0.000 0.217 1756 D C 0.286 176.636 176.300 0.083 0.000 1.050 1756 D CA -0.197 53.852 54.000 0.081 0.000 0.856 1756 D CB -0.545 40.301 40.800 0.078 0.000 0.922 1756 D HN 0.561 nan 8.370 nan 0.000 0.518 1757 Y N 1.242 121.547 120.300 0.008 0.000 2.436 1757 Y HA 0.405 4.954 4.550 -0.002 0.000 0.343 1757 Y C -0.517 175.375 175.900 -0.013 0.000 1.008 1757 Y CA -0.895 57.204 58.100 -0.001 0.000 1.241 1757 Y CB 0.257 38.717 38.460 -0.000 0.000 1.153 1757 Y HN -0.025 nan 8.280 nan 0.000 0.521 1758 I N 6.292 126.374 120.570 -0.814 0.000 2.608 1758 I HA 0.297 4.467 4.170 -0.001 0.000 0.295 1758 I C -0.709 174.782 176.117 -1.043 0.000 1.049 1758 I CA -0.983 59.849 61.300 -0.780 0.000 1.063 1758 I CB 1.454 39.239 38.000 -0.358 0.000 1.248 1758 I HN 0.597 nan 8.210 nan 0.000 0.424 1759 N N 6.425 124.712 118.700 -0.688 0.000 2.498 1759 N HA 0.366 5.105 4.740 -0.001 0.000 0.277 1759 N C -1.159 174.206 175.510 -0.242 0.000 1.208 1759 N CA 0.298 53.143 53.050 -0.342 0.000 1.029 1759 N CB 0.019 38.461 38.487 -0.074 0.000 1.403 1759 N HN 0.673 nan 8.380 nan 0.000 0.500 1760 A N 1.509 124.174 122.820 -0.259 0.000 2.604 1760 A HA 0.695 5.014 4.320 -0.001 0.000 0.295 1760 A C -1.093 176.367 177.584 -0.205 0.000 1.067 1760 A CA -0.640 51.269 52.037 -0.213 0.000 0.683 1760 A CB 1.238 20.085 19.000 -0.255 0.000 1.281 1760 A HN 0.350 nan 8.150 nan 0.000 0.407 1761 S N -0.024 115.573 115.700 -0.172 0.000 2.541 1761 S HA 0.653 5.122 4.470 -0.001 0.000 0.280 1761 S C -1.410 173.129 174.600 -0.102 0.000 1.112 1761 S CA -0.361 57.781 58.200 -0.098 0.000 0.925 1761 S CB 0.840 64.043 63.200 0.004 0.000 1.067 1761 S HN 0.484 nan 8.310 nan 0.000 0.479 1762 Y N 1.963 122.299 120.300 0.060 0.000 2.309 1762 Y HA 0.493 5.045 4.550 0.002 0.000 0.327 1762 Y C 0.388 176.307 175.900 0.030 0.000 1.172 1762 Y CA -0.586 57.543 58.100 0.048 0.000 1.280 1762 Y CB 0.484 38.969 38.460 0.042 0.000 1.234 1762 Y HN 0.374 nan 8.280 nan 0.000 0.512 1763 I N 4.469 125.140 120.570 0.168 0.000 2.569 1763 I HA 0.301 4.471 4.170 -0.001 0.000 0.290 1763 I C -2.751 173.367 176.117 0.002 0.000 1.088 1763 I CA -2.902 58.418 61.300 0.034 0.000 1.047 1763 I CB 1.934 40.014 38.000 0.133 0.000 1.237 1763 I HN 0.318 nan 8.210 nan 0.000 0.421 1764 P HA 0.305 nan 4.420 nan 0.000 0.271 1764 P C 0.155 177.457 177.300 0.004 0.000 1.218 1764 P CA 0.088 63.105 63.100 -0.137 0.000 0.780 1764 P CB 1.043 32.631 31.700 -0.188 0.000 0.901 1765 G N 0.846 109.569 108.800 -0.128 0.000 3.107 1765 G HA2 0.135 4.094 3.960 -0.001 0.000 0.232 1765 G HA3 0.135 4.094 3.960 -0.001 0.000 0.232 1765 G C 0.832 175.675 174.900 -0.096 0.000 1.339 1765 G CA -0.393 44.688 45.100 -0.032 0.000 1.033 1765 G HN 0.410 nan 8.290 nan 0.000 0.567 1766 N N -0.032 118.618 118.700 -0.083 0.000 2.192 1766 N HA -0.126 4.614 4.740 -0.001 0.000 0.188 1766 N C 1.430 176.899 175.510 -0.069 0.000 1.013 1766 N CA 2.175 55.186 53.050 -0.064 0.000 0.863 1766 N CB 0.072 38.521 38.487 -0.063 0.000 0.990 1766 N HN 0.446 nan 8.380 nan 0.000 0.430 1767 N N -1.650 116.967 118.700 -0.138 0.000 2.445 1767 N HA 0.128 4.868 4.740 -0.001 0.000 0.204 1767 N C -0.526 175.055 175.510 0.118 0.000 1.098 1767 N CA 0.275 53.312 53.050 -0.021 0.000 0.859 1767 N CB 0.776 39.273 38.487 0.016 0.000 1.249 1767 N HN 0.297 nan 8.380 nan 0.000 0.462 1768 F N -1.804 118.093 119.950 -0.089 0.000 2.668 1768 F HA 0.542 5.067 4.527 -0.002 0.000 0.309 1768 F C 0.978 176.721 175.800 -0.096 0.000 1.117 1768 F CA -1.160 56.785 58.000 -0.091 0.000 0.951 1768 F CB 1.267 40.206 39.000 -0.103 0.000 1.323 1768 F HN -0.464 nan 8.300 nan 0.000 0.451 1769 R N -0.062 120.500 120.500 0.103 0.000 2.115 1769 R HA 0.154 4.493 4.340 -0.001 0.000 0.230 1769 R C 0.406 176.694 176.300 -0.019 0.000 1.111 1769 R CA 1.137 57.236 56.100 -0.003 0.000 0.976 1769 R CB -0.070 30.230 30.300 -0.001 0.000 0.870 1769 R HN 0.558 nan 8.270 nan 0.000 0.445 1770 R N -0.028 120.527 120.500 0.092 0.000 3.472 1770 R HA 0.098 4.437 4.340 -0.001 0.000 0.322 1770 R C 0.188 176.530 176.300 0.069 0.000 1.330 1770 R CA -0.099 56.039 56.100 0.063 0.000 1.387 1770 R CB 0.661 30.945 30.300 -0.027 0.000 1.446 1770 R HN 0.200 nan 8.270 nan 0.000 0.628 1771 E N 0.475 120.511 120.200 -0.273 0.000 2.152 1771 E HA -0.061 4.288 4.350 -0.001 0.000 0.192 1771 E C -0.492 175.686 176.600 -0.703 0.000 0.983 1771 E CA 1.095 56.974 56.400 -0.869 0.000 0.818 1771 E CB 0.348 29.234 29.700 -1.357 0.000 0.758 1771 E HN 0.305 nan 8.360 nan 0.000 0.467 1772 Y N -0.857 119.409 120.300 -0.057 0.000 2.536 1772 Y HA 0.481 5.031 4.550 -0.001 0.000 0.347 1772 Y C -0.415 175.510 175.900 0.042 0.000 1.000 1772 Y CA -1.100 57.000 58.100 -0.001 0.000 1.051 1772 Y CB 1.448 39.902 38.460 -0.011 0.000 1.259 1772 Y HN -0.186 nan 8.280 nan 0.000 0.468 1773 I N 2.143 122.815 120.570 0.170 0.000 2.404 1773 I HA 0.488 4.657 4.170 -0.001 0.000 0.293 1773 I C -1.013 175.125 176.117 0.035 0.000 0.992 1773 I CA -0.867 60.453 61.300 0.032 0.000 1.149 1773 I CB 1.666 39.611 38.000 -0.091 0.000 1.315 1773 I HN 0.294 nan 8.210 nan 0.000 0.446 1774 V N 5.021 124.931 119.914 -0.007 0.000 2.555 1774 V HA 0.631 4.750 4.120 -0.001 0.000 0.302 1774 V C -0.169 175.906 176.094 -0.032 0.000 1.038 1774 V CA -0.191 62.111 62.300 0.002 0.000 0.887 1774 V CB 2.185 34.010 31.823 0.003 0.000 0.991 1774 V HN 0.811 nan 8.190 nan 0.000 0.434 1775 T N 3.260 117.813 114.554 -0.001 0.000 2.864 1775 T HA 0.421 4.770 4.350 -0.001 0.000 0.299 1775 T C -0.748 173.938 174.700 -0.023 0.000 1.166 1775 T CA -0.589 61.486 62.100 -0.040 0.000 1.007 1775 T CB 1.904 70.738 68.868 -0.056 0.000 1.219 1775 T HN 0.866 nan 8.240 nan 0.000 0.506 1776 Q N 1.171 120.933 119.800 -0.063 0.000 2.492 1776 Q HA 0.449 4.788 4.340 -0.001 0.000 0.238 1776 Q C 0.573 176.469 176.000 -0.174 0.000 1.045 1776 Q CA -0.468 55.298 55.803 -0.062 0.000 0.934 1776 Q CB -0.030 28.669 28.738 -0.065 0.000 1.276 1776 Q HN 0.766 nan 8.270 nan 0.000 0.521 1777 G N 2.250 110.980 108.800 -0.117 0.000 2.299 1777 G HA2 0.261 4.221 3.960 -0.001 0.000 0.256 1777 G HA3 0.261 4.221 3.960 -0.001 0.000 0.256 1777 G C -2.337 172.355 174.900 -0.347 0.000 1.259 1777 G CA -0.926 44.033 45.100 -0.236 0.000 0.943 1777 G HN 0.489 nan 8.290 nan 0.000 0.479 1778 P HA 0.033 nan 4.420 nan 0.000 0.266 1778 P C 0.083 177.239 177.300 -0.240 0.000 1.193 1778 P CA 0.163 62.966 63.100 -0.495 0.000 0.770 1778 P CB 0.659 31.826 31.700 -0.888 0.000 0.836 1779 L N 5.238 126.359 121.223 -0.168 0.000 2.352 1779 L HA 0.346 4.686 4.340 -0.001 0.000 0.269 1779 L C -1.244 175.598 176.870 -0.048 0.000 1.034 1779 L CA -2.108 52.673 54.840 -0.098 0.000 0.806 1779 L CB 1.125 43.130 42.059 -0.089 0.000 1.244 1779 L HN 0.276 nan 8.230 nan 0.000 0.447 1780 P HA -0.153 nan 4.420 nan 0.000 0.217 1780 P C 1.124 178.442 177.300 0.029 0.000 1.148 1780 P CA 1.204 64.314 63.100 0.016 0.000 0.828 1780 P CB 0.178 31.882 31.700 0.008 0.000 0.783 1781 G N -1.807 106.998 108.800 0.009 0.000 2.985 1781 G HA2 -0.047 3.912 3.960 -0.001 0.000 0.209 1781 G HA3 -0.047 3.912 3.960 -0.001 0.000 0.209 1781 G C 1.060 175.975 174.900 0.024 0.000 1.165 1781 G CA 0.940 46.052 45.100 0.020 0.000 0.776 1781 G HN 0.395 nan 8.290 nan 0.000 0.541 1782 T N -1.875 112.680 114.554 0.002 0.000 3.040 1782 T HA 0.131 4.480 4.350 -0.001 0.000 0.266 1782 T C 1.951 176.649 174.700 -0.003 0.000 1.005 1782 T CA 0.541 62.637 62.100 -0.008 0.000 0.906 1782 T CB 0.187 69.025 68.868 -0.049 0.000 1.082 1782 T HN 0.399 nan 8.240 nan 0.000 0.531 1783 K N 1.671 122.081 120.400 0.017 0.000 2.103 1783 K HA -0.176 4.143 4.320 -0.001 0.000 0.207 1783 K C 1.187 177.943 176.600 0.260 0.000 1.048 1783 K CA 1.945 58.262 56.287 0.049 0.000 0.930 1783 K CB -0.496 32.089 32.500 0.142 0.000 0.716 1783 K HN 0.160 nan 8.250 nan 0.000 0.444 1784 D N 1.700 122.288 120.400 0.313 0.000 2.149 1784 D HA -0.162 4.477 4.640 -0.001 0.000 0.198 1784 D C 1.547 177.980 176.300 0.221 0.000 0.990 1784 D CA 1.279 55.479 54.000 0.334 0.000 0.839 1784 D CB -0.391 40.556 40.800 0.244 0.000 0.948 1784 D HN 0.325 nan 8.370 nan 0.000 0.460 1785 D N -0.225 120.251 120.400 0.127 0.000 2.144 1785 D HA -0.122 4.517 4.640 -0.001 0.000 0.200 1785 D C 1.835 178.147 176.300 0.020 0.000 0.978 1785 D CA 0.330 54.366 54.000 0.060 0.000 0.833 1785 D CB -0.400 40.408 40.800 0.013 0.000 0.961 1785 D HN 0.253 nan 8.370 nan 0.000 0.470 1786 F N -0.390 119.448 119.950 -0.186 0.000 2.146 1786 F HA -0.114 4.413 4.527 -0.000 0.000 0.298 1786 F C 1.988 177.618 175.800 -0.284 0.000 1.096 1786 F CA 1.260 59.040 58.000 -0.366 0.000 1.275 1786 F CB -0.422 38.176 39.000 -0.670 0.000 1.008 1786 F HN -0.079 nan 8.300 nan 0.000 0.480 1787 W N 1.098 122.405 121.300 0.012 0.000 2.418 1787 W HA -0.040 4.619 4.660 -0.001 0.000 0.292 1787 W C 2.612 179.118 176.519 -0.022 0.000 1.213 1787 W CA 1.020 58.330 57.345 -0.057 0.000 1.283 1787 W CB -0.308 29.164 29.460 0.020 0.000 1.119 1787 W HN -0.067 nan 8.180 nan 0.000 0.542 1788 K N 0.741 121.276 120.400 0.224 0.000 2.032 1788 K HA -0.268 4.051 4.320 -0.001 0.000 0.209 1788 K C 2.112 178.786 176.600 0.124 0.000 1.048 1788 K CA 1.893 58.284 56.287 0.173 0.000 0.927 1788 K CB -0.475 32.097 32.500 0.120 0.000 0.712 1788 K HN 0.107 nan 8.250 nan 0.000 0.441 1789 M N 0.513 120.097 119.600 -0.028 0.000 2.108 1789 M HA -0.184 4.295 4.480 -0.001 0.000 0.261 1789 M C 1.816 178.051 176.300 -0.108 0.000 1.066 1789 M CA 1.616 56.850 55.300 -0.109 0.000 1.107 1789 M CB -0.000 32.453 32.600 -0.245 0.000 1.356 1789 M HN 0.072 nan 8.290 nan 0.000 0.406 1790 V N -0.047 119.754 119.914 -0.189 0.000 2.343 1790 V HA -0.322 3.797 4.120 -0.001 0.000 0.247 1790 V C 2.096 178.274 176.094 0.140 0.000 1.051 1790 V CA 2.202 64.453 62.300 -0.082 0.000 1.036 1790 V CB -1.011 30.757 31.823 -0.092 0.000 0.654 1790 V HN 0.759 nan 8.190 nan 0.000 0.451 1791 W N 1.117 122.451 121.300 0.056 0.000 2.354 1791 W HA -0.171 4.489 4.660 -0.001 0.000 0.315 1791 W C 2.319 178.875 176.519 0.061 0.000 1.206 1791 W CA 2.017 59.413 57.345 0.085 0.000 1.290 1791 W CB -0.173 29.343 29.460 0.094 0.000 1.152 1791 W HN 0.335 nan 8.180 nan 0.000 0.489 1792 E N -0.434 119.873 120.200 0.178 0.000 2.204 1792 E HA -0.222 4.128 4.350 -0.001 0.000 0.194 1792 E C 1.924 178.511 176.600 -0.021 0.000 0.989 1792 E CA 0.899 57.341 56.400 0.069 0.000 0.824 1792 E CB -0.108 29.669 29.700 0.128 0.000 0.756 1792 E HN 0.221 nan 8.360 nan 0.000 0.477 1793 Q N -0.020 119.772 119.800 -0.014 0.000 2.280 1793 Q HA 0.082 4.422 4.340 -0.001 0.000 0.201 1793 Q C -0.155 175.818 176.000 -0.045 0.000 0.890 1793 Q CA -0.039 55.761 55.803 -0.006 0.000 0.947 1793 Q CB 0.598 29.343 28.738 0.012 0.000 1.081 1793 Q HN 0.238 nan 8.270 nan 0.000 0.502 1794 N N -0.092 118.557 118.700 -0.086 0.000 2.776 1794 N HA -0.139 4.600 4.740 -0.001 0.000 0.249 1794 N C -0.736 174.725 175.510 -0.082 0.000 1.111 1794 N CA 0.352 53.344 53.050 -0.097 0.000 0.711 1794 N CB -1.479 36.931 38.487 -0.128 0.000 1.065 1794 N HN 0.023 nan 8.380 nan 0.000 0.556 1795 V N 0.589 120.517 119.914 0.023 0.000 2.530 1795 V HA 0.078 4.198 4.120 -0.001 0.000 0.282 1795 V C 1.470 177.734 176.094 0.283 0.000 1.048 1795 V CA 0.194 62.529 62.300 0.058 0.000 0.997 1795 V CB 1.174 33.031 31.823 0.057 0.000 0.987 1795 V HN 0.327 nan 8.190 nan 0.000 0.477 1796 H N 2.245 121.383 119.070 0.114 0.000 2.874 1796 H HA 0.325 4.881 4.556 -0.000 0.000 0.264 1796 H C -0.065 175.388 175.328 0.208 0.000 1.007 1796 H CA -0.358 55.780 56.048 0.152 0.000 1.207 1796 H CB 0.748 30.585 29.762 0.125 0.000 1.487 1796 H HN 0.527 nan 8.280 nan 0.000 0.505 1797 N N 1.276 120.163 118.700 0.312 0.000 2.371 1797 N HA 0.346 5.085 4.740 -0.001 0.000 0.291 1797 N C -1.282 174.395 175.510 0.277 0.000 1.053 1797 N CA -0.298 52.953 53.050 0.336 0.000 0.870 1797 N CB 3.019 41.681 38.487 0.293 0.000 1.503 1797 N HN 0.052 nan 8.380 nan 0.000 0.485 1798 I N 1.456 122.222 120.570 0.326 0.000 2.498 1798 I HA 0.401 4.570 4.170 -0.001 0.000 0.290 1798 I C -0.540 175.645 176.117 0.113 0.000 1.032 1798 I CA -0.970 60.477 61.300 0.245 0.000 1.073 1798 I CB 2.367 40.605 38.000 0.396 0.000 1.251 1798 I HN 0.016 nan 8.210 nan 0.000 0.426 1799 V N 6.700 126.587 119.914 -0.044 0.000 2.448 1799 V HA 0.457 4.576 4.120 -0.001 0.000 0.295 1799 V C -0.248 175.620 176.094 -0.376 0.000 1.025 1799 V CA -0.542 61.635 62.300 -0.206 0.000 0.859 1799 V CB 1.801 33.322 31.823 -0.504 0.000 0.988 1799 V HN 0.709 nan 8.190 nan 0.000 0.431 1800 M N 6.323 125.672 119.600 -0.418 0.000 2.181 1800 M HA 0.539 5.018 4.480 -0.001 0.000 0.323 1800 M C -0.336 175.825 176.300 -0.232 0.000 1.004 1800 M CA -0.586 54.344 55.300 -0.617 0.000 0.941 1800 M CB 1.505 33.674 32.600 -0.719 0.000 1.579 1800 M HN 0.535 nan 8.290 nan 0.000 0.427 1801 V N 1.090 120.853 119.914 -0.252 0.000 2.854 1801 V HA 0.447 4.567 4.120 -0.001 0.000 0.366 1801 V C -0.256 175.797 176.094 -0.068 0.000 1.322 1801 V CA -0.249 62.014 62.300 -0.061 0.000 1.243 1801 V CB -0.114 31.640 31.823 -0.116 0.000 1.337 1801 V HN 0.859 nan 8.190 nan 0.000 0.585 1802 T N 0.639 115.198 114.554 0.007 0.000 2.906 1802 T HA 0.522 4.871 4.350 -0.001 0.000 0.295 1802 T C -0.540 174.312 174.700 0.253 0.000 1.061 1802 T CA -0.266 61.874 62.100 0.066 0.000 1.000 1802 T CB 2.226 71.108 68.868 0.023 0.000 1.103 1802 T HN 0.627 nan 8.240 nan 0.000 0.486 1803 Q N 1.090 121.022 119.800 0.221 0.000 2.312 1803 Q HA 0.279 4.618 4.340 -0.001 0.000 0.236 1803 Q C 1.075 177.209 176.000 0.223 0.000 0.965 1803 Q CA -0.753 55.212 55.803 0.271 0.000 0.894 1803 Q CB 0.795 29.634 28.738 0.168 0.000 1.225 1803 Q HN 0.787 nan 8.270 nan 0.000 0.478 1804 C N 0.567 120.013 119.300 0.244 0.000 2.422 1804 C HA 0.017 4.476 4.460 -0.001 0.000 0.279 1804 C C 0.787 175.848 174.990 0.118 0.000 1.305 1804 C CA 0.032 59.154 59.018 0.174 0.000 1.757 1804 C CB -0.078 27.756 27.740 0.157 0.000 1.962 1804 C HN 0.473 nan 8.230 nan 0.000 0.499 1805 V N 0.537 120.518 119.914 0.113 0.000 2.808 1805 V HA 0.354 4.473 4.120 -0.001 0.000 0.308 1805 V C -1.081 175.062 176.094 0.082 0.000 1.099 1805 V CA -0.525 61.825 62.300 0.082 0.000 0.920 1805 V CB 1.946 33.808 31.823 0.064 0.000 1.014 1805 V HN 0.294 nan 8.190 nan 0.000 0.425 1806 E N 3.033 123.277 120.200 0.073 0.000 2.185 1806 E HA 0.510 4.859 4.350 -0.001 0.000 0.261 1806 E C -0.733 175.902 176.600 0.058 0.000 0.879 1806 E CA -0.839 55.601 56.400 0.067 0.000 0.756 1806 E CB 1.684 31.425 29.700 0.069 0.000 1.152 1806 E HN 0.614 nan 8.360 nan 0.000 0.416 1807 K N 1.587 122.016 120.400 0.049 0.000 3.096 1807 K HA -0.295 4.024 4.320 -0.001 0.000 0.266 1807 K C 0.794 177.418 176.600 0.040 0.000 1.043 1807 K CA 0.561 56.873 56.287 0.041 0.000 0.758 1807 K CB -1.509 31.017 32.500 0.043 0.000 1.260 1807 K HN 1.097 nan 8.250 nan 0.000 0.481 1808 G N -0.334 108.490 108.800 0.039 0.000 2.267 1808 G HA2 -0.391 3.568 3.960 -0.001 0.000 0.257 1808 G HA3 -0.391 3.568 3.960 -0.001 0.000 0.257 1808 G C 0.056 174.981 174.900 0.042 0.000 0.998 1808 G CA 0.656 45.778 45.100 0.036 0.000 0.620 1808 G HN 0.398 nan 8.290 nan 0.000 0.529 1809 R N 0.413 120.945 120.500 0.052 0.000 2.265 1809 R HA 0.522 4.861 4.340 -0.001 0.000 0.314 1809 R C 0.336 176.677 176.300 0.067 0.000 1.053 1809 R CA -0.562 55.575 56.100 0.062 0.000 0.931 1809 R CB 1.770 32.116 30.300 0.076 0.000 1.024 1809 R HN 0.098 nan 8.270 nan 0.000 0.457 1810 V N 3.963 123.914 119.914 0.061 0.000 2.715 1810 V HA 0.017 4.136 4.120 -0.001 0.000 0.299 1810 V C 0.905 177.042 176.094 0.071 0.000 1.054 1810 V CA 0.384 62.715 62.300 0.052 0.000 1.077 1810 V CB 1.224 33.064 31.823 0.027 0.000 0.972 1810 V HN 0.800 nan 8.190 nan 0.000 0.484 1811 K N 1.464 121.908 120.400 0.072 0.000 2.550 1811 K HA 0.323 4.642 4.320 -0.001 0.000 0.205 1811 K C -0.176 176.463 176.600 0.065 0.000 1.429 1811 K CA 0.357 56.699 56.287 0.092 0.000 0.997 1811 K CB 0.882 33.438 32.500 0.093 0.000 1.328 1811 K HN 0.642 nan 8.250 nan 0.000 0.546 1812 C N 1.786 121.123 119.300 0.062 0.000 3.199 1812 C HA 0.325 4.784 4.460 -0.001 0.000 0.392 1812 C C -1.419 173.607 174.990 0.060 0.000 1.050 1812 C CA -1.063 57.995 59.018 0.067 0.000 1.222 1812 C CB 1.207 29.048 27.740 0.168 0.000 1.595 1812 C HN 0.486 nan 8.230 nan 0.000 0.560 1813 D N 1.717 122.137 120.400 0.033 0.000 2.339 1813 D HA 0.166 4.806 4.640 -0.001 0.000 0.245 1813 D C 0.215 176.518 176.300 0.005 0.000 1.115 1813 D CA 0.306 54.322 54.000 0.027 0.000 0.917 1813 D CB 0.530 41.338 40.800 0.014 0.000 1.192 1813 D HN 0.658 nan 8.370 nan 0.000 0.428 1814 H N 3.414 122.347 119.070 -0.229 0.000 3.045 1814 H HA 0.013 4.569 4.556 -0.001 0.000 0.254 1814 H C -0.235 174.714 175.328 -0.632 0.000 1.747 1814 H CA -0.043 55.599 56.048 -0.676 0.000 1.444 1814 H CB -0.425 28.963 29.762 -0.624 0.000 1.778 1814 H HN 0.542 nan 8.280 nan 0.000 0.544 1815 Y N 2.106 122.171 120.300 -0.391 0.000 2.461 1815 Y HA 0.168 4.718 4.550 -0.000 0.000 0.277 1815 Y C -0.157 175.827 175.900 0.140 0.000 1.182 1815 Y CA -1.291 56.757 58.100 -0.086 0.000 1.276 1815 Y CB -0.705 37.587 38.460 -0.279 0.000 1.087 1815 Y HN 0.287 nan 8.280 nan 0.000 0.519 1816 W N 0.263 121.360 121.300 -0.339 0.000 2.671 1816 W HA 0.802 5.461 4.660 -0.001 0.000 0.360 1816 W C -3.021 173.577 176.519 0.130 0.000 1.128 1816 W CA -3.378 53.840 57.345 -0.211 0.000 1.184 1816 W CB 0.084 29.172 29.460 -0.620 0.000 1.415 1816 W HN -0.350 nan 8.180 nan 0.000 0.604 1817 P HA 0.110 nan 4.420 nan 0.000 0.271 1817 P C 0.771 178.206 177.300 0.225 0.000 1.216 1817 P CA 0.450 63.682 63.100 0.219 0.000 0.771 1817 P CB 1.069 32.900 31.700 0.217 0.000 0.864 1818 A N 3.435 126.276 122.820 0.036 0.000 1.985 1818 A HA -0.220 4.100 4.320 -0.001 0.000 0.223 1818 A C 0.782 178.443 177.584 0.128 0.000 1.189 1818 A CA 2.464 54.492 52.037 -0.015 0.000 0.658 1818 A CB -1.071 17.858 19.000 -0.119 0.000 0.820 1818 A HN 0.750 nan 8.150 nan 0.000 0.464 1819 D N -5.364 115.122 120.400 0.142 0.000 3.376 1819 D HA 0.159 4.798 4.640 -0.001 0.000 0.344 1819 D C 0.286 176.658 176.300 0.120 0.000 1.428 1819 D CA -0.280 53.793 54.000 0.121 0.000 0.949 1819 D CB -0.537 40.299 40.800 0.060 0.000 1.451 1819 D HN -0.009 nan 8.370 nan 0.000 0.578 1820 Q N -0.092 119.752 119.800 0.074 0.000 2.488 1820 Q HA 0.030 4.369 4.340 -0.001 0.000 0.211 1820 Q C -0.351 175.672 176.000 0.039 0.000 0.967 1820 Q CA 0.797 56.634 55.803 0.057 0.000 0.926 1820 Q CB -0.445 28.312 28.738 0.032 0.000 0.992 1820 Q HN 0.508 nan 8.270 nan 0.000 0.506 1821 D N 1.326 121.744 120.400 0.031 0.000 2.458 1821 D HA -0.026 4.614 4.640 -0.001 0.000 0.243 1821 D C -0.031 176.268 176.300 -0.002 0.000 1.146 1821 D CA 0.097 54.099 54.000 0.003 0.000 0.877 1821 D CB 0.743 41.540 40.800 -0.005 0.000 1.176 1821 D HN -0.047 nan 8.370 nan 0.000 0.461 1822 S N 2.144 117.817 115.700 -0.044 0.000 2.585 1822 S HA 0.547 5.016 4.470 -0.001 0.000 0.273 1822 S C 0.233 174.746 174.600 -0.146 0.000 1.339 1822 S CA -0.868 57.275 58.200 -0.094 0.000 1.028 1822 S CB 0.790 63.900 63.200 -0.151 0.000 0.906 1822 S HN 0.548 nan 8.310 nan 0.000 0.528 1823 L N 1.123 122.222 121.223 -0.207 0.000 2.434 1823 L HA 0.438 4.777 4.340 -0.001 0.000 0.260 1823 L C -1.255 175.353 176.870 -0.436 0.000 0.983 1823 L CA -0.979 53.679 54.840 -0.302 0.000 0.820 1823 L CB 1.783 43.641 42.059 -0.337 0.000 1.361 1823 L HN 0.744 nan 8.230 nan 0.000 0.410 1824 Y N 0.954 121.042 120.300 -0.355 0.000 2.346 1824 Y HA 0.227 4.776 4.550 -0.001 0.000 0.330 1824 Y C -0.698 174.819 175.900 -0.638 0.000 1.178 1824 Y CA 0.340 58.230 58.100 -0.349 0.000 1.331 1824 Y CB 0.597 38.929 38.460 -0.213 0.000 1.253 1824 Y HN 0.259 nan 8.280 nan 0.000 0.529 1825 Y N 1.556 121.907 120.300 0.084 0.000 2.363 1825 Y HA 0.449 4.998 4.550 -0.001 0.000 0.325 1825 Y C 0.847 176.803 175.900 0.093 0.000 0.984 1825 Y CA -0.482 57.677 58.100 0.098 0.000 1.248 1825 Y CB 1.300 39.823 38.460 0.106 0.000 1.116 1825 Y HN 0.905 nan 8.280 nan 0.000 0.470 1826 G N 2.457 111.351 108.800 0.155 0.000 2.634 1826 G HA2 -0.380 3.580 3.960 -0.001 0.000 0.318 1826 G HA3 -0.380 3.580 3.960 -0.001 0.000 0.318 1826 G C 0.555 175.472 174.900 0.028 0.000 1.207 1826 G CA 1.022 46.168 45.100 0.076 0.000 0.987 1826 G HN 0.565 nan 8.290 nan 0.000 0.547 1827 D N 1.180 121.588 120.400 0.014 0.000 2.368 1827 D HA 0.336 4.975 4.640 -0.001 0.000 0.218 1827 D C 0.956 177.226 176.300 -0.049 0.000 1.112 1827 D CA 0.211 54.194 54.000 -0.027 0.000 0.834 1827 D CB 0.247 41.009 40.800 -0.064 0.000 0.953 1827 D HN 0.357 nan 8.370 nan 0.000 0.505 1828 L N 0.629 121.841 121.223 -0.017 0.000 2.334 1828 L HA 0.527 4.866 4.340 -0.001 0.000 0.272 1828 L C 0.100 176.956 176.870 -0.024 0.000 1.020 1828 L CA -0.831 53.937 54.840 -0.121 0.000 0.812 1828 L CB 2.136 44.104 42.059 -0.152 0.000 1.264 1828 L HN -0.305 nan 8.230 nan 0.000 0.439 1829 I N 2.608 123.079 120.570 -0.165 0.000 2.509 1829 I HA 0.467 4.636 4.170 -0.001 0.000 0.293 1829 I C -0.851 175.141 176.117 -0.209 0.000 1.020 1829 I CA -0.555 60.569 61.300 -0.293 0.000 1.088 1829 I CB 2.457 40.212 38.000 -0.409 0.000 1.267 1829 I HN 0.398 nan 8.210 nan 0.000 0.430 1830 L N 5.168 126.283 121.223 -0.181 0.000 2.386 1830 L HA 0.490 4.830 4.340 -0.001 0.000 0.271 1830 L C -0.888 175.941 176.870 -0.068 0.000 0.993 1830 L CA -0.314 54.434 54.840 -0.152 0.000 0.819 1830 L CB 2.331 44.225 42.059 -0.274 0.000 1.294 1830 L HN 0.602 nan 8.230 nan 0.000 0.414 1831 Q N 3.716 123.517 119.800 0.002 0.000 2.337 1831 Q HA 0.401 4.741 4.340 -0.001 0.000 0.270 1831 Q C -0.930 175.188 176.000 0.197 0.000 1.043 1831 Q CA -0.612 55.226 55.803 0.059 0.000 0.794 1831 Q CB 2.395 31.131 28.738 -0.003 0.000 1.281 1831 Q HN 0.619 nan 8.270 nan 0.000 0.446 1832 M N 5.420 125.180 119.600 0.266 0.000 2.220 1832 M HA 0.118 4.598 4.480 -0.001 0.000 0.343 1832 M C -0.274 176.044 176.300 0.030 0.000 1.470 1832 M CA 0.171 55.599 55.300 0.213 0.000 1.161 1832 M CB 0.370 33.132 32.600 0.270 0.000 1.737 1832 M HN 0.810 nan 8.290 nan 0.000 0.464 1833 L N 3.064 124.256 121.223 -0.052 0.000 2.179 1833 L HA 0.083 4.422 4.340 -0.001 0.000 0.208 1833 L C 0.741 177.574 176.870 -0.062 0.000 1.096 1833 L CA 0.272 55.084 54.840 -0.047 0.000 0.779 1833 L CB -0.398 41.637 42.059 -0.040 0.000 0.922 1833 L HN 0.839 nan 8.230 nan 0.000 0.443 1834 S N -1.060 114.567 115.700 -0.122 0.000 2.558 1834 S HA 0.363 4.833 4.470 -0.001 0.000 0.277 1834 S C -0.998 173.517 174.600 -0.141 0.000 1.143 1834 S CA -0.867 57.275 58.200 -0.097 0.000 0.865 1834 S CB 2.360 65.514 63.200 -0.077 0.000 1.102 1834 S HN 0.170 nan 8.310 nan 0.000 0.454 1835 E N 1.783 121.940 120.200 -0.072 0.000 2.502 1835 E HA 0.419 4.769 4.350 -0.001 0.000 0.261 1835 E C -1.416 175.176 176.600 -0.013 0.000 0.974 1835 E CA -0.471 55.897 56.400 -0.053 0.000 0.795 1835 E CB 1.309 31.013 29.700 0.006 0.000 1.385 1835 E HN 0.706 nan 8.360 nan 0.000 0.400 1836 S N 2.620 118.313 115.700 -0.013 0.000 2.410 1836 S HA 0.324 4.793 4.470 -0.001 0.000 0.304 1836 S C 0.115 174.728 174.600 0.022 0.000 1.095 1836 S CA -0.768 57.439 58.200 0.012 0.000 1.089 1836 S CB 1.344 64.562 63.200 0.030 0.000 0.968 1836 S HN 0.289 nan 8.310 nan 0.000 0.480 1837 V N 5.046 124.963 119.914 0.005 0.000 2.530 1837 V HA 0.359 4.478 4.120 -0.001 0.000 0.282 1837 V C 0.083 176.131 176.094 -0.078 0.000 1.048 1837 V CA -0.306 61.982 62.300 -0.020 0.000 0.997 1837 V CB 0.291 32.105 31.823 -0.014 0.000 0.987 1837 V HN 0.739 nan 8.190 nan 0.000 0.477 1838 L N 5.526 126.651 121.223 -0.163 0.000 2.256 1838 L HA 0.538 4.877 4.340 -0.001 0.000 0.261 1838 L C -1.531 175.148 176.870 -0.320 0.000 1.022 1838 L CA -1.578 53.087 54.840 -0.292 0.000 0.828 1838 L CB 1.236 42.995 42.059 -0.501 0.000 1.374 1838 L HN 0.308 nan 8.230 nan 0.000 0.436 1839 P HA -0.106 nan 4.420 nan 0.000 0.218 1839 P C 0.491 177.603 177.300 -0.313 0.000 1.148 1839 P CA 1.294 64.233 63.100 -0.268 0.000 0.822 1839 P CB 0.321 31.883 31.700 -0.229 0.000 0.784 1840 E N -3.243 116.667 120.200 -0.483 0.000 2.572 1840 E HA 0.141 4.491 4.350 -0.001 0.000 0.220 1840 E C -0.251 176.219 176.600 -0.217 0.000 0.945 1840 E CA -0.249 55.916 56.400 -0.393 0.000 1.070 1840 E CB 0.394 29.918 29.700 -0.293 0.000 1.090 1840 E HN 0.311 nan 8.360 nan 0.000 0.506 1841 W N -1.018 120.203 121.300 -0.131 0.000 3.074 1841 W HA 0.610 5.270 4.660 -0.000 0.000 0.332 1841 W C -1.193 175.336 176.519 0.017 0.000 1.253 1841 W CA -0.924 56.384 57.345 -0.062 0.000 1.180 1841 W CB 0.544 30.110 29.460 0.177 0.000 1.445 1841 W HN -0.442 nan 8.180 nan 0.000 0.573 1842 T N 2.510 117.245 114.554 0.303 0.000 2.848 1842 T HA 0.591 4.940 4.350 -0.001 0.000 0.285 1842 T C -0.746 174.087 174.700 0.221 0.000 0.995 1842 T CA -0.562 61.655 62.100 0.195 0.000 0.970 1842 T CB 0.957 69.897 68.868 0.120 0.000 0.976 1842 T HN 0.381 nan 8.240 nan 0.000 0.441 1843 I N 3.542 124.179 120.570 0.112 0.000 2.330 1843 I HA 0.482 4.652 4.170 -0.001 0.000 0.289 1843 I C 0.282 176.284 176.117 -0.192 0.000 1.001 1843 I CA -0.751 60.483 61.300 -0.110 0.000 1.193 1843 I CB 1.294 39.226 38.000 -0.113 0.000 1.345 1843 I HN 0.323 nan 8.210 nan 0.000 0.461 1844 R N 4.484 124.794 120.500 -0.317 0.000 2.732 1844 R HA 0.611 4.950 4.340 -0.001 0.000 0.278 1844 R C -0.840 175.082 176.300 -0.630 0.000 0.976 1844 R CA -0.754 55.045 56.100 -0.500 0.000 0.963 1844 R CB 2.083 31.929 30.300 -0.756 0.000 1.150 1844 R HN 0.519 nan 8.270 nan 0.000 0.478 1845 E N 1.503 121.310 120.200 -0.655 0.000 2.222 1845 E HA 0.352 4.701 4.350 -0.001 0.000 0.267 1845 E C -1.270 174.966 176.600 -0.606 0.000 0.884 1845 E CA -0.486 55.625 56.400 -0.481 0.000 0.764 1845 E CB 1.606 31.173 29.700 -0.221 0.000 1.169 1845 E HN 0.265 nan 8.360 nan 0.000 0.413 1846 F N 1.476 121.428 119.950 0.004 0.000 2.538 1846 F HA 0.440 4.966 4.527 -0.001 0.000 0.325 1846 F C 0.256 176.054 175.800 -0.005 0.000 1.066 1846 F CA -0.989 57.005 58.000 -0.010 0.000 0.946 1846 F CB 1.602 40.586 39.000 -0.028 0.000 1.199 1846 F HN 0.100 nan 8.300 nan 0.000 0.473 1847 K N 3.431 123.925 120.400 0.156 0.000 2.274 1847 K HA 0.634 4.954 4.320 -0.001 0.000 0.262 1847 K C -1.502 175.114 176.600 0.028 0.000 0.961 1847 K CA -0.345 55.976 56.287 0.056 0.000 0.833 1847 K CB 1.065 33.551 32.500 -0.024 0.000 1.102 1847 K HN 0.682 nan 8.250 nan 0.000 0.436 1848 I N 4.452 125.063 120.570 0.069 0.000 2.433 1848 I HA 0.295 4.464 4.170 -0.001 0.000 0.292 1848 I C -0.716 175.447 176.117 0.078 0.000 1.001 1848 I CA -1.080 60.257 61.300 0.062 0.000 1.119 1848 I CB 1.837 39.973 38.000 0.225 0.000 1.289 1848 I HN 0.655 nan 8.210 nan 0.000 0.438 1849 C N 5.236 124.479 119.300 -0.094 0.000 2.281 1849 C HA 0.773 5.232 4.460 -0.001 0.000 0.323 1849 C C 0.884 175.630 174.990 -0.407 0.000 1.270 1849 C CA -0.434 58.501 59.018 -0.137 0.000 1.559 1849 C CB 0.016 27.682 27.740 -0.122 0.000 2.239 1849 C HN 0.987 nan 8.230 nan 0.000 0.488 1850 G N 2.389 110.803 108.800 -0.643 0.000 3.217 1850 G HA2 0.644 4.603 3.960 -0.001 0.000 0.213 1850 G HA3 0.644 4.603 3.960 -0.001 0.000 0.213 1850 G C -0.894 173.794 174.900 -0.353 0.000 1.294 1850 G CA -0.316 44.059 45.100 -1.209 0.000 0.987 1850 G HN 0.691 nan 8.290 nan 0.000 0.584 1858 R N 1.259 121.916 120.500 0.261 0.000 2.349 1858 R HA 0.450 4.789 4.340 -0.001 0.000 0.299 1858 R C -0.209 176.168 176.300 0.129 0.000 1.027 1858 R CA -0.870 55.306 56.100 0.126 0.000 0.958 1858 R CB 1.883 32.221 30.300 0.063 0.000 1.047 1858 R HN 0.045 nan 8.270 nan 0.000 0.468 1859 L N 4.178 125.433 121.223 0.053 0.000 2.264 1859 L HA 0.388 4.727 4.340 -0.001 0.000 0.289 1859 L C -0.279 176.637 176.870 0.076 0.000 1.044 1859 L CA -0.662 54.221 54.840 0.072 0.000 0.807 1859 L CB 0.999 43.097 42.059 0.065 0.000 1.192 1859 L HN 0.339 nan 8.230 nan 0.000 0.425 1860 I N 3.650 124.325 120.570 0.176 0.000 2.404 1860 I HA 0.445 4.614 4.170 -0.001 0.000 0.293 1860 I C 0.106 176.349 176.117 0.209 0.000 0.992 1860 I CA -0.476 60.989 61.300 0.276 0.000 1.149 1860 I CB 1.624 39.891 38.000 0.445 0.000 1.315 1860 I HN 0.602 nan 8.210 nan 0.000 0.446 1861 R N 3.947 124.549 120.500 0.169 0.000 2.460 1861 R HA 0.400 4.740 4.340 -0.001 0.000 0.303 1861 R C -0.665 175.610 176.300 -0.042 0.000 0.968 1861 R CA -0.639 55.403 56.100 -0.097 0.000 0.889 1861 R CB 1.742 31.929 30.300 -0.189 0.000 1.123 1861 R HN 0.596 nan 8.270 nan 0.000 0.455 1862 H N 3.912 122.760 119.070 -0.370 0.000 2.547 1862 H HA 0.289 4.845 4.556 -0.001 0.000 0.342 1862 H C -1.368 173.673 175.328 -0.479 0.000 1.048 1862 H CA -0.539 55.397 56.048 -0.187 0.000 1.204 1862 H CB 0.831 30.617 29.762 0.041 0.000 1.493 1862 H HN 0.428 nan 8.280 nan 0.000 0.511 1863 F N 4.479 124.290 119.950 -0.233 0.000 2.382 1863 F HA 0.196 4.723 4.527 -0.001 0.000 0.361 1863 F C 0.253 176.085 175.800 0.053 0.000 1.109 1863 F CA -0.562 57.415 58.000 -0.039 0.000 1.031 1863 F CB 0.802 39.708 39.000 -0.156 0.000 1.234 1863 F HN 0.536 nan 8.300 nan 0.000 0.445 1864 H N 3.872 123.035 119.070 0.156 0.000 2.673 1864 H HA 0.217 4.772 4.556 -0.001 0.000 0.293 1864 H C -1.350 174.066 175.328 0.145 0.000 1.065 1864 H CA -0.856 55.222 56.048 0.049 0.000 1.236 1864 H CB 0.725 30.494 29.762 0.011 0.000 1.389 1864 H HN 0.662 nan 8.280 nan 0.000 0.481 1865 Y N 4.609 124.871 120.300 -0.063 0.000 2.336 1865 Y HA 0.064 4.613 4.550 -0.001 0.000 0.335 1865 Y C 0.767 176.604 175.900 -0.104 0.000 1.046 1865 Y CA 0.186 58.099 58.100 -0.311 0.000 1.198 1865 Y CB 1.110 39.023 38.460 -0.911 0.000 1.182 1865 Y HN 0.663 nan 8.280 nan 0.000 0.502 1866 T N 0.926 115.215 114.554 -0.441 0.000 3.040 1866 T HA 0.124 4.473 4.350 -0.001 0.000 0.266 1866 T C 0.169 174.748 174.700 -0.200 0.000 1.005 1866 T CA 0.490 62.407 62.100 -0.305 0.000 0.906 1866 T CB -0.478 68.173 68.868 -0.362 0.000 1.082 1866 T HN 0.522 nan 8.240 nan 0.000 0.531 1867 V N -2.619 117.098 119.914 -0.328 0.000 2.778 1867 V HA 0.532 4.651 4.120 -0.001 0.000 0.356 1867 V C -0.873 175.303 176.094 0.138 0.000 1.283 1867 V CA -1.082 61.138 62.300 -0.133 0.000 1.247 1867 V CB -0.411 31.280 31.823 -0.221 0.000 1.408 1867 V HN 0.421 nan 8.190 nan 0.000 0.620 1868 W N 3.906 125.262 121.300 0.094 0.000 2.363 1868 W HA 0.667 5.327 4.660 -0.001 0.000 0.314 1868 W C -3.008 173.539 176.519 0.047 0.000 0.994 1868 W CA -3.224 54.209 57.345 0.147 0.000 1.449 1868 W CB 1.624 31.217 29.460 0.222 0.000 1.248 1868 W HN 0.257 nan 8.180 nan 0.000 0.409 1869 P HA -0.064 nan 4.420 nan 0.000 0.264 1869 P C 0.071 177.455 177.300 0.141 0.000 1.193 1869 P CA 0.428 63.660 63.100 0.219 0.000 0.763 1869 P CB 0.692 32.493 31.700 0.169 0.000 0.810 1870 D N 2.724 123.127 120.400 0.004 0.000 2.548 1870 D HA -0.150 4.489 4.640 -0.001 0.000 0.231 1870 D C 1.088 177.322 176.300 -0.110 0.000 1.142 1870 D CA 0.922 54.812 54.000 -0.185 0.000 0.866 1870 D CB 0.090 40.745 40.800 -0.243 0.000 1.190 1870 D HN 0.529 nan 8.370 nan 0.000 0.469 1871 H N -0.288 118.762 119.070 -0.033 0.000 3.612 1871 H HA -0.191 4.365 4.556 -0.001 0.000 0.212 1871 H C 0.875 176.242 175.328 0.064 0.000 1.041 1871 H CA 1.211 57.258 56.048 -0.002 0.000 1.205 1871 H CB -1.551 28.199 29.762 -0.020 0.000 1.159 1871 H HN 0.439 nan 8.280 nan 0.000 0.323 1872 G N 0.049 108.967 108.800 0.198 0.000 2.990 1872 G HA2 0.665 4.625 3.960 -0.001 0.000 0.208 1872 G HA3 0.665 4.625 3.960 -0.001 0.000 0.208 1872 G C 0.017 175.115 174.900 0.330 0.000 1.334 1872 G CA 0.065 45.291 45.100 0.210 0.000 1.024 1872 G HN 0.517 nan 8.290 nan 0.000 0.574 1873 V N -3.358 116.611 119.914 0.091 0.000 3.007 1873 V HA 0.727 4.847 4.120 -0.001 0.000 0.311 1873 V C -2.956 172.840 176.094 -0.496 0.000 1.120 1873 V CA -2.379 59.696 62.300 -0.376 0.000 0.980 1873 V CB 1.660 33.166 31.823 -0.527 0.000 1.033 1873 V HN 0.533 nan 8.190 nan 0.000 0.429 1874 P HA 0.206 nan 4.420 nan 0.000 0.270 1874 P C 0.782 177.973 177.300 -0.182 0.000 1.223 1874 P CA -0.025 62.824 63.100 -0.419 0.000 0.785 1874 P CB 0.659 32.105 31.700 -0.423 0.000 0.923 1875 E N 0.204 120.380 120.200 -0.039 0.000 2.130 1875 E HA -0.152 4.198 4.350 -0.001 0.000 0.196 1875 E C 0.371 177.007 176.600 0.061 0.000 0.998 1875 E CA 1.351 57.760 56.400 0.015 0.000 0.806 1875 E CB 0.122 29.836 29.700 0.024 0.000 0.738 1875 E HN 0.640 nan 8.360 nan 0.000 0.459 1876 T N -3.923 110.688 114.554 0.096 0.000 2.901 1876 T HA 0.217 4.566 4.350 -0.001 0.000 0.293 1876 T C 1.050 175.895 174.700 0.241 0.000 1.084 1876 T CA -0.149 62.041 62.100 0.150 0.000 1.008 1876 T CB 1.563 70.496 68.868 0.108 0.000 1.170 1876 T HN 0.017 nan 8.240 nan 0.000 0.509 1877 T N -0.910 113.739 114.554 0.158 0.000 2.777 1877 T HA -0.118 4.231 4.350 -0.001 0.000 0.266 1877 T C 1.791 176.503 174.700 0.020 0.000 1.040 1877 T CA 0.803 62.890 62.100 -0.021 0.000 1.141 1877 T CB -0.502 68.249 68.868 -0.194 0.000 0.868 1877 T HN 0.548 nan 8.240 nan 0.000 0.444 1878 Q N 0.933 120.769 119.800 0.060 0.000 2.084 1878 Q HA -0.109 4.231 4.340 -0.001 0.000 0.202 1878 Q C 2.757 178.856 176.000 0.164 0.000 0.978 1878 Q CA 1.800 57.653 55.803 0.082 0.000 0.844 1878 Q CB -0.604 28.184 28.738 0.083 0.000 0.898 1878 Q HN 0.693 nan 8.270 nan 0.000 0.426 1879 S N 0.492 116.328 115.700 0.226 0.000 2.359 1879 S HA -0.172 4.297 4.470 -0.001 0.000 0.224 1879 S C 1.913 176.768 174.600 0.426 0.000 1.035 1879 S CA 1.201 59.643 58.200 0.403 0.000 1.018 1879 S CB -0.144 63.292 63.200 0.393 0.000 0.876 1879 S HN 0.296 nan 8.310 nan 0.000 0.448 1880 L N 0.951 122.288 121.223 0.189 0.000 2.131 1880 L HA 0.324 4.664 4.340 -0.001 0.000 0.206 1880 L C 2.111 178.980 176.870 -0.002 0.000 1.087 1880 L CA 1.260 56.079 54.840 -0.036 0.000 0.767 1880 L CB -0.588 41.334 42.059 -0.230 0.000 0.917 1880 L HN 0.396 nan 8.230 nan 0.000 0.441 1881 I N -0.564 120.002 120.570 -0.006 0.000 2.208 1881 I HA -0.316 3.853 4.170 -0.001 0.000 0.245 1881 I C 2.287 178.395 176.117 -0.015 0.000 1.097 1881 I CA 1.104 62.373 61.300 -0.052 0.000 1.363 1881 I CB -0.319 37.642 38.000 -0.065 0.000 1.051 1881 I HN 0.345 nan 8.210 nan 0.000 0.413 1882 Q N -0.407 119.444 119.800 0.085 0.000 2.187 1882 Q HA -0.134 4.206 4.340 -0.001 0.000 0.199 1882 Q C 2.086 178.065 176.000 -0.035 0.000 0.957 1882 Q CA 1.300 57.174 55.803 0.117 0.000 0.857 1882 Q CB -0.644 28.280 28.738 0.311 0.000 0.929 1882 Q HN 0.480 nan 8.270 nan 0.000 0.453 1883 F N 1.392 121.110 119.950 -0.387 0.000 2.075 1883 F HA -0.214 4.313 4.527 -0.001 0.000 0.297 1883 F C 2.082 177.689 175.800 -0.322 0.000 1.113 1883 F CA 1.148 58.706 58.000 -0.737 0.000 1.218 1883 F CB -0.265 38.351 39.000 -0.640 0.000 0.984 1883 F HN -0.169 nan 8.300 nan 0.000 0.472 1884 V N 0.905 120.701 119.914 -0.196 0.000 2.392 1884 V HA -0.311 3.808 4.120 -0.001 0.000 0.249 1884 V C 2.547 178.461 176.094 -0.300 0.000 1.059 1884 V CA 2.278 64.382 62.300 -0.328 0.000 1.051 1884 V CB -0.763 30.813 31.823 -0.412 0.000 0.658 1884 V HN 0.304 nan 8.190 nan 0.000 0.455 1885 R N -0.374 120.000 120.500 -0.211 0.000 2.075 1885 R HA -0.110 4.230 4.340 -0.001 0.000 0.232 1885 R C 2.461 178.678 176.300 -0.138 0.000 1.126 1885 R CA 1.847 57.858 56.100 -0.148 0.000 0.963 1885 R CB -0.592 29.657 30.300 -0.085 0.000 0.858 1885 R HN 0.559 nan 8.270 nan 0.000 0.435 1886 T N 0.741 115.204 114.554 -0.152 0.000 2.674 1886 T HA -0.124 4.225 4.350 -0.001 0.000 0.265 1886 T C 2.023 176.640 174.700 -0.137 0.000 1.039 1886 T CA 1.537 63.590 62.100 -0.078 0.000 1.150 1886 T CB -0.336 68.518 68.868 -0.023 0.000 0.864 1886 T HN -0.018 nan 8.240 nan 0.000 0.427 1887 V N 2.040 121.657 119.914 -0.494 0.000 2.252 1887 V HA -0.232 3.888 4.120 -0.001 0.000 0.249 1887 V C 2.664 178.566 176.094 -0.321 0.000 1.056 1887 V CA 1.979 63.863 62.300 -0.692 0.000 1.022 1887 V CB -0.715 30.651 31.823 -0.761 0.000 0.641 1887 V HN 0.265 nan 8.190 nan 0.000 0.445 1888 R N 0.884 121.256 120.500 -0.213 0.000 2.103 1888 R HA -0.219 4.120 4.340 -0.001 0.000 0.242 1888 R C 2.021 178.270 176.300 -0.086 0.000 1.142 1888 R CA 2.239 58.263 56.100 -0.126 0.000 0.960 1888 R CB -1.272 28.949 30.300 -0.132 0.000 0.858 1888 R HN 0.599 nan 8.270 nan 0.000 0.439 1889 D N -0.842 119.502 120.400 -0.093 0.000 2.106 1889 D HA -0.212 4.427 4.640 -0.001 0.000 0.191 1889 D C 1.810 178.045 176.300 -0.108 0.000 0.997 1889 D CA 1.605 55.540 54.000 -0.108 0.000 0.834 1889 D CB -0.353 40.362 40.800 -0.142 0.000 0.956 1889 D HN 0.362 nan 8.370 nan 0.000 0.448 1890 Y N 0.680 120.940 120.300 -0.066 0.000 2.165 1890 Y HA -0.109 4.440 4.550 -0.002 0.000 0.286 1890 Y C 2.609 178.514 175.900 0.008 0.000 1.155 1890 Y CA 0.831 58.937 58.100 0.011 0.000 1.164 1890 Y CB -0.271 38.244 38.460 0.092 0.000 0.978 1890 Y HN 0.039 nan 8.280 nan 0.000 0.513 1891 I N -0.107 120.521 120.570 0.098 0.000 2.179 1891 I HA -0.347 3.823 4.170 -0.001 0.000 0.242 1891 I C 1.907 178.055 176.117 0.051 0.000 1.088 1891 I CA 1.241 62.579 61.300 0.064 0.000 1.357 1891 I CB -0.466 37.535 38.000 0.002 0.000 1.051 1891 I HN 0.276 nan 8.210 nan 0.000 0.409 1892 N N 1.320 120.029 118.700 0.015 0.000 2.094 1892 N HA -0.194 4.545 4.740 -0.001 0.000 0.191 1892 N C 1.532 177.052 175.510 0.016 0.000 1.023 1892 N CA 1.377 54.430 53.050 0.004 0.000 0.857 1892 N CB -0.378 38.095 38.487 -0.023 0.000 1.013 1892 N HN 0.345 nan 8.380 nan 0.000 0.426 1893 R N 0.014 120.527 120.500 0.021 0.000 2.423 1893 R HA 0.219 4.558 4.340 -0.001 0.000 0.248 1893 R C -0.217 176.135 176.300 0.086 0.000 1.019 1893 R CA 0.020 56.139 56.100 0.033 0.000 1.119 1893 R CB 0.252 30.554 30.300 0.004 0.000 1.176 1893 R HN -0.065 nan 8.270 nan 0.000 0.526 1894 S N 2.230 117.993 115.700 0.104 0.000 2.252 1894 S HA 0.228 4.698 4.470 -0.001 0.000 0.180 1894 S C -2.333 172.327 174.600 0.100 0.000 1.534 1894 S CA -1.186 57.108 58.200 0.157 0.000 1.141 1894 S CB 1.004 64.329 63.200 0.209 0.000 1.122 1894 S HN 0.100 nan 8.310 nan 0.000 0.475 1895 P HA 0.221 nan 4.420 nan 0.000 0.267 1895 P C 0.976 178.299 177.300 0.039 0.000 1.205 1895 P CA 0.758 63.878 63.100 0.034 0.000 0.765 1895 P CB 0.510 32.228 31.700 0.030 0.000 0.828 1896 G N 1.924 110.706 108.800 -0.030 0.000 2.176 1896 G HA2 -0.175 3.784 3.960 -0.001 0.000 0.253 1896 G HA3 -0.175 3.784 3.960 -0.001 0.000 0.253 1896 G C 0.401 175.205 174.900 -0.160 0.000 0.979 1896 G CA 0.062 45.129 45.100 -0.055 0.000 0.641 1896 G HN 0.893 nan 8.290 nan 0.000 0.530 1897 A N 0.551 123.216 122.820 -0.258 0.000 2.425 1897 A HA 0.717 5.037 4.320 -0.001 0.000 0.249 1897 A C 1.403 178.796 177.584 -0.318 0.000 1.084 1897 A CA 1.141 52.821 52.037 -0.595 0.000 0.781 1897 A CB 0.312 19.066 19.000 -0.409 0.000 1.019 1897 A HN 1.695 nan 8.150 nan 0.000 0.490 1898 G N 1.212 109.828 108.800 -0.306 0.000 2.447 1898 G HA2 0.434 4.393 3.960 -0.001 0.000 0.269 1898 G HA3 0.434 4.393 3.960 -0.001 0.000 0.269 1898 G C -2.448 172.436 174.900 -0.026 0.000 1.455 1898 G CA -0.908 44.119 45.100 -0.121 0.000 1.061 1898 G HN 0.582 nan 8.290 nan 0.000 0.545 1899 P HA 0.157 nan 4.420 nan 0.000 0.267 1899 P C -0.058 177.267 177.300 0.042 0.000 1.200 1899 P CA 0.263 63.407 63.100 0.073 0.000 0.772 1899 P CB 0.416 32.189 31.700 0.122 0.000 0.855 1900 T N 2.378 116.949 114.554 0.028 0.000 2.779 1900 T HA 0.151 4.501 4.350 -0.001 0.000 0.296 1900 T C 0.290 175.076 174.700 0.143 0.000 0.938 1900 T CA -0.263 61.893 62.100 0.094 0.000 1.119 1900 T CB 0.015 68.955 68.868 0.119 0.000 0.891 1900 T HN 0.041 nan 8.240 nan 0.000 0.526 1901 V N 5.370 125.349 119.914 0.109 0.000 2.521 1901 V HA 0.205 4.324 4.120 -0.001 0.000 0.286 1901 V C 0.235 176.389 176.094 0.099 0.000 1.034 1901 V CA -0.137 62.222 62.300 0.099 0.000 1.045 1901 V CB 0.842 32.700 31.823 0.058 0.000 0.974 1901 V HN 0.648 nan 8.190 nan 0.000 0.480 1902 V N 5.664 125.622 119.914 0.073 0.000 2.588 1902 V HA 0.600 4.719 4.120 -0.001 0.000 0.304 1902 V C -0.540 175.573 176.094 0.032 0.000 1.042 1902 V CA -0.718 61.559 62.300 -0.038 0.000 0.877 1902 V CB 1.718 33.483 31.823 -0.096 0.000 0.996 1902 V HN 1.157 nan 8.190 nan 0.000 0.425 1903 H N 1.996 121.009 119.070 -0.095 0.000 2.928 1903 H HA 0.876 5.431 4.556 -0.001 0.000 0.371 1903 H C -0.112 175.142 175.328 -0.123 0.000 1.186 1903 H CA -0.237 55.755 56.048 -0.095 0.000 1.134 1903 H CB 1.678 31.390 29.762 -0.085 0.000 1.824 1903 H HN 0.769 nan 8.280 nan 0.000 0.554 1904 C N -0.136 119.155 119.300 -0.014 0.000 4.171 1904 C HA 0.608 5.068 4.460 -0.001 0.000 0.169 1904 C C 1.936 176.974 174.990 0.079 0.000 3.202 1904 C CA 0.309 59.280 59.018 -0.078 0.000 1.826 1904 C CB 0.868 28.468 27.740 -0.234 0.000 3.952 1904 C HN 0.818 nan 8.230 nan 0.000 0.458 1905 S N 0.404 116.114 115.700 0.016 0.000 2.339 1905 S HA 0.222 4.691 4.470 -0.001 0.000 0.213 1905 S C 1.912 176.623 174.600 0.186 0.000 1.033 1905 S CA 1.402 59.668 58.200 0.109 0.000 0.950 1905 S CB -0.729 62.551 63.200 0.135 0.000 0.893 1905 S HN 1.069 nan 8.310 nan 0.000 0.492 1906 A N -0.402 122.534 122.820 0.194 0.000 2.095 1906 A HA 0.503 4.823 4.320 -0.001 0.000 0.212 1906 A C 1.525 179.160 177.584 0.085 0.000 1.162 1906 A CA 0.942 53.116 52.037 0.229 0.000 0.753 1906 A CB -0.774 18.290 19.000 0.105 0.000 0.840 1906 A HN 1.418 nan 8.150 nan 0.000 0.468 1907 G N -1.028 107.787 108.800 0.025 0.000 2.212 1907 G HA2 -0.140 3.819 3.960 -0.001 0.000 0.255 1907 G HA3 -0.140 3.819 3.960 -0.001 0.000 0.255 1907 G C 0.734 175.626 174.900 -0.013 0.000 1.062 1907 G CA 0.817 45.917 45.100 -0.000 0.000 0.815 1907 G HN 1.672 nan 8.290 nan 0.000 0.497 1908 V N -4.497 115.401 119.914 -0.027 0.000 3.177 1908 V HA 0.675 4.795 4.120 -0.001 0.000 0.219 1908 V C 2.180 178.265 176.094 -0.015 0.000 1.344 1908 V CA 1.499 63.801 62.300 0.004 0.000 1.324 1908 V CB -0.480 31.385 31.823 0.070 0.000 1.165 1908 V HN 0.944 nan 8.190 nan 0.000 0.510 1909 G N 0.723 109.482 108.800 -0.069 0.000 2.473 1909 G HA2 -0.006 3.953 3.960 -0.001 0.000 0.212 1909 G HA3 -0.006 3.953 3.960 -0.001 0.000 0.212 1909 G C 1.633 176.453 174.900 -0.133 0.000 1.211 1909 G CA 0.733 45.802 45.100 -0.051 0.000 0.813 1909 G HN 0.477 nan 8.290 nan 0.000 0.541 1910 R N -0.056 120.198 120.500 -0.410 0.000 2.090 1910 R HA 0.035 4.374 4.340 -0.001 0.000 0.228 1910 R C 2.767 178.739 176.300 -0.548 0.000 1.110 1910 R CA 1.406 56.950 56.100 -0.928 0.000 0.973 1910 R CB -0.731 28.572 30.300 -1.660 0.000 0.869 1910 R HN 0.235 nan 8.270 nan 0.000 0.440 1911 T N 0.418 114.790 114.554 -0.303 0.000 2.635 1911 T HA -0.170 4.179 4.350 -0.001 0.000 0.267 1911 T C 1.951 176.647 174.700 -0.007 0.000 1.040 1911 T CA 1.800 63.828 62.100 -0.119 0.000 1.156 1911 T CB -0.568 68.243 68.868 -0.095 0.000 0.863 1911 T HN 0.575 nan 8.240 nan 0.000 0.430 1912 G N 0.563 109.359 108.800 -0.006 0.000 2.408 1912 G HA2 -0.173 3.786 3.960 -0.001 0.000 0.217 1912 G HA3 -0.173 3.786 3.960 -0.001 0.000 0.217 1912 G C 1.716 176.674 174.900 0.097 0.000 1.150 1912 G CA 1.356 46.478 45.100 0.036 0.000 0.776 1912 G HN 0.468 nan 8.290 nan 0.000 0.542 1913 T N 0.770 115.433 114.554 0.182 0.000 2.777 1913 T HA -0.102 4.248 4.350 -0.001 0.000 0.266 1913 T C 1.912 176.792 174.700 0.300 0.000 1.040 1913 T CA 0.989 63.274 62.100 0.308 0.000 1.141 1913 T CB -0.296 68.898 68.868 0.544 0.000 0.868 1913 T HN 0.260 nan 8.240 nan 0.000 0.444 1914 F N 1.550 121.635 119.950 0.225 0.000 2.091 1914 F HA -0.102 4.423 4.527 -0.002 0.000 0.299 1914 F C 1.930 177.714 175.800 -0.027 0.000 1.103 1914 F CA 1.269 59.360 58.000 0.152 0.000 1.228 1914 F CB -0.336 38.735 39.000 0.117 0.000 0.984 1914 F HN 0.081 nan 8.300 nan 0.000 0.477 1915 I N -0.189 120.364 120.570 -0.028 0.000 2.406 1915 I HA -0.179 3.990 4.170 -0.001 0.000 0.249 1915 I C 2.642 178.611 176.117 -0.247 0.000 1.122 1915 I CA 0.930 62.046 61.300 -0.307 0.000 1.431 1915 I CB -0.762 36.949 38.000 -0.482 0.000 1.087 1915 I HN 0.230 nan 8.210 nan 0.000 0.424 1916 A N 0.683 123.434 122.820 -0.115 0.000 1.940 1916 A HA -0.231 4.088 4.320 -0.001 0.000 0.219 1916 A C 2.226 179.730 177.584 -0.133 0.000 1.176 1916 A CA 1.581 53.574 52.037 -0.072 0.000 0.631 1916 A CB -0.726 18.287 19.000 0.021 0.000 0.814 1916 A HN 0.369 nan 8.150 nan 0.000 0.446 1917 L N 0.200 121.317 121.223 -0.178 0.000 2.027 1917 L HA -0.120 4.220 4.340 -0.001 0.000 0.206 1917 L C 2.008 178.691 176.870 -0.312 0.000 1.074 1917 L CA 2.663 57.356 54.840 -0.244 0.000 0.745 1917 L CB -0.749 41.163 42.059 -0.245 0.000 0.898 1917 L HN 0.479 nan 8.230 nan 0.000 0.433 1918 D N -0.572 119.565 120.400 -0.438 0.000 2.106 1918 D HA -0.242 4.397 4.640 -0.001 0.000 0.191 1918 D C 2.276 178.462 176.300 -0.189 0.000 0.997 1918 D CA 1.640 55.418 54.000 -0.370 0.000 0.834 1918 D CB -0.015 40.536 40.800 -0.415 0.000 0.956 1918 D HN 0.275 nan 8.370 nan 0.000 0.448 1919 R N 0.109 120.527 120.500 -0.136 0.000 2.083 1919 R HA -0.101 4.239 4.340 -0.001 0.000 0.237 1919 R C 2.604 178.838 176.300 -0.111 0.000 1.137 1919 R CA 1.646 57.697 56.100 -0.082 0.000 0.951 1919 R CB -0.693 29.581 30.300 -0.044 0.000 0.851 1919 R HN 0.473 nan 8.270 nan 0.000 0.434 1920 I N -1.099 119.384 120.570 -0.145 0.000 2.617 1920 I HA -0.115 4.055 4.170 -0.001 0.000 0.256 1920 I C 1.656 177.662 176.117 -0.186 0.000 1.167 1920 I CA 1.396 62.595 61.300 -0.167 0.000 1.469 1920 I CB -0.271 37.605 38.000 -0.207 0.000 1.098 1920 I HN 0.106 nan 8.210 nan 0.000 0.436 1921 L N 0.775 121.884 121.223 -0.190 0.000 2.217 1921 L HA -0.088 4.252 4.340 -0.001 0.000 0.211 1921 L C 2.754 179.536 176.870 -0.146 0.000 1.107 1921 L CA 0.991 55.721 54.840 -0.183 0.000 0.783 1921 L CB -0.446 41.499 42.059 -0.190 0.000 0.919 1921 L HN 0.315 nan 8.230 nan 0.000 0.442 1922 Q N -0.391 119.331 119.800 -0.130 0.000 2.083 1922 Q HA -0.215 4.124 4.340 -0.001 0.000 0.198 1922 Q C 2.186 178.130 176.000 -0.093 0.000 0.969 1922 Q CA 1.203 56.944 55.803 -0.102 0.000 0.838 1922 Q CB -0.078 28.607 28.738 -0.088 0.000 0.900 1922 Q HN 0.532 nan 8.270 nan 0.000 0.436 1923 Q N 0.483 120.222 119.800 -0.101 0.000 2.084 1923 Q HA -0.132 4.207 4.340 -0.001 0.000 0.202 1923 Q C 2.146 178.084 176.000 -0.103 0.000 0.978 1923 Q CA 1.062 56.809 55.803 -0.093 0.000 0.844 1923 Q CB -0.075 28.605 28.738 -0.098 0.000 0.898 1923 Q HN 0.375 nan 8.270 nan 0.000 0.426 1924 L N 0.704 121.848 121.223 -0.132 0.000 2.042 1924 L HA -0.237 4.102 4.340 -0.001 0.000 0.210 1924 L C 1.676 178.484 176.870 -0.103 0.000 1.076 1924 L CA 1.057 55.815 54.840 -0.138 0.000 0.749 1924 L CB -0.500 41.455 42.059 -0.173 0.000 0.893 1924 L HN 0.263 nan 8.230 nan 0.000 0.432 1925 D N -1.097 119.247 120.400 -0.093 0.000 2.144 1925 D HA -0.149 4.491 4.640 -0.001 0.000 0.200 1925 D C 2.326 178.590 176.300 -0.061 0.000 0.978 1925 D CA 1.311 55.267 54.000 -0.073 0.000 0.833 1925 D CB 0.109 40.867 40.800 -0.069 0.000 0.961 1925 D HN 0.102 nan 8.370 nan 0.000 0.470 1926 S N -1.293 114.369 115.700 -0.063 0.000 2.492 1926 S HA 0.102 4.571 4.470 -0.001 0.000 0.218 1926 S C 0.543 175.116 174.600 -0.044 0.000 1.016 1926 S CA 0.233 58.403 58.200 -0.050 0.000 0.916 1926 S CB 0.413 63.582 63.200 -0.052 0.000 0.791 1926 S HN -0.007 nan 8.310 nan 0.000 0.513 1927 K N -0.045 120.325 120.400 -0.050 0.000 2.555 1927 K HA 0.273 4.592 4.320 -0.001 0.000 0.279 1927 K C -1.383 175.189 176.600 -0.046 0.000 0.986 1927 K CA -0.452 55.808 56.287 -0.044 0.000 0.880 1927 K CB 1.459 33.929 32.500 -0.049 0.000 1.474 1927 K HN -0.155 nan 8.250 nan 0.000 0.433 1928 D N 0.007 120.385 120.400 -0.036 0.000 2.340 1928 D HA 0.066 4.705 4.640 -0.001 0.000 0.220 1928 D C -0.322 175.957 176.300 -0.035 0.000 1.039 1928 D CA 0.615 54.596 54.000 -0.032 0.000 0.866 1928 D CB 0.507 41.295 40.800 -0.021 0.000 0.913 1928 D HN 0.119 nan 8.370 nan 0.000 0.523 1929 S N -0.484 115.190 115.700 -0.044 0.000 2.568 1929 S HA 0.584 5.053 4.470 -0.001 0.000 0.293 1929 S C -1.117 173.439 174.600 -0.074 0.000 1.089 1929 S CA -0.771 57.401 58.200 -0.046 0.000 0.945 1929 S CB 2.798 65.979 63.200 -0.030 0.000 1.077 1929 S HN -0.101 nan 8.310 nan 0.000 0.485 1930 V N 2.007 121.871 119.914 -0.083 0.000 2.487 1930 V HA 0.493 4.613 4.120 -0.001 0.000 0.298 1930 V C -1.415 174.640 176.094 -0.065 0.000 1.028 1930 V CA -0.580 61.646 62.300 -0.123 0.000 0.860 1930 V CB 1.866 33.528 31.823 -0.267 0.000 0.991 1930 V HN 0.910 nan 8.190 nan 0.000 0.427 1931 D N 5.266 125.638 120.400 -0.048 0.000 2.551 1931 D HA 0.362 5.001 4.640 -0.001 0.000 0.294 1931 D C 1.114 177.436 176.300 0.037 0.000 1.201 1931 D CA -0.176 53.836 54.000 0.019 0.000 0.941 1931 D CB 0.541 41.362 40.800 0.036 0.000 0.995 1931 D HN 0.495 nan 8.370 nan 0.000 0.502 1932 I N 0.935 121.513 120.570 0.015 0.000 2.179 1932 I HA -0.263 3.906 4.170 -0.001 0.000 0.242 1932 I C 1.872 178.132 176.117 0.237 0.000 1.088 1932 I CA 0.928 62.236 61.300 0.013 0.000 1.357 1932 I CB -0.281 37.559 38.000 -0.267 0.000 1.051 1932 I HN 0.370 nan 8.210 nan 0.000 0.409 1933 Y N 1.773 122.222 120.300 0.248 0.000 2.181 1933 Y HA -0.182 4.367 4.550 -0.002 0.000 0.288 1933 Y C 2.431 178.470 175.900 0.232 0.000 1.146 1933 Y CA 1.771 60.073 58.100 0.337 0.000 1.164 1933 Y CB -0.548 38.090 38.460 0.297 0.000 0.982 1933 Y HN 0.072 nan 8.280 nan 0.000 0.515 1934 G N -0.409 108.568 108.800 0.295 0.000 2.403 1934 G HA2 -0.185 3.775 3.960 -0.001 0.000 0.216 1934 G HA3 -0.185 3.775 3.960 -0.001 0.000 0.216 1934 G C 1.797 176.778 174.900 0.134 0.000 1.154 1934 G CA 0.722 45.932 45.100 0.183 0.000 0.784 1934 G HN 0.597 nan 8.290 nan 0.000 0.538 1935 A N 0.399 123.281 122.820 0.103 0.000 1.873 1935 A HA -0.034 4.285 4.320 -0.001 0.000 0.218 1935 A C 2.592 180.223 177.584 0.079 0.000 1.193 1935 A CA 2.133 54.214 52.037 0.074 0.000 0.629 1935 A CB -0.816 18.205 19.000 0.035 0.000 0.826 1935 A HN 0.276 nan 8.150 nan 0.000 0.447 1936 V N -0.241 119.727 119.914 0.089 0.000 2.453 1936 V HA -0.224 3.896 4.120 -0.001 0.000 0.247 1936 V C 2.510 178.588 176.094 -0.027 0.000 1.048 1936 V CA 1.978 64.318 62.300 0.066 0.000 1.049 1936 V CB -1.011 30.908 31.823 0.160 0.000 0.672 1936 V HN 0.799 nan 8.190 nan 0.000 0.457 1937 H N 0.478 119.439 119.070 -0.180 0.000 2.290 1937 H HA -0.230 4.325 4.556 -0.002 0.000 0.298 1937 H C 2.194 177.500 175.328 -0.036 0.000 1.087 1937 H CA 2.450 58.386 56.048 -0.187 0.000 1.291 1937 H CB -0.154 29.456 29.762 -0.255 0.000 1.369 1937 H HN 0.458 nan 8.280 nan 0.000 0.492 1938 D N 0.133 120.624 120.400 0.153 0.000 2.117 1938 D HA -0.109 4.530 4.640 -0.001 0.000 0.197 1938 D C 2.782 179.196 176.300 0.190 0.000 0.987 1938 D CA 0.817 54.931 54.000 0.188 0.000 0.829 1938 D CB -0.236 40.681 40.800 0.196 0.000 0.961 1938 D HN 0.349 nan 8.370 nan 0.000 0.460 1939 L N 0.006 121.291 121.223 0.105 0.000 2.017 1939 L HA -0.141 4.198 4.340 -0.001 0.000 0.208 1939 L C 2.580 179.504 176.870 0.089 0.000 1.073 1939 L CA 1.013 55.915 54.840 0.103 0.000 0.745 1939 L CB -0.332 41.756 42.059 0.047 0.000 0.894 1939 L HN 0.055 nan 8.230 nan 0.000 0.432 1940 R N 0.012 120.500 120.500 -0.020 0.000 2.148 1940 R HA -0.078 4.262 4.340 -0.001 0.000 0.227 1940 R C 2.134 178.395 176.300 -0.065 0.000 1.103 1940 R CA 0.955 57.018 56.100 -0.061 0.000 0.983 1940 R CB -0.515 29.680 30.300 -0.175 0.000 0.874 1940 R HN 0.427 nan 8.270 nan 0.000 0.451 1941 L N -0.096 121.032 121.223 -0.160 0.000 2.201 1941 L HA -0.145 4.194 4.340 -0.001 0.000 0.212 1941 L C 2.175 178.831 176.870 -0.357 0.000 1.105 1941 L CA 1.088 55.752 54.840 -0.294 0.000 0.775 1941 L CB -0.387 41.457 42.059 -0.357 0.000 0.913 1941 L HN 0.271 nan 8.230 nan 0.000 0.440 1942 H N -1.113 118.016 119.070 0.098 0.000 2.465 1942 H HA 0.209 4.764 4.556 -0.003 0.000 0.289 1942 H C 0.638 176.089 175.328 0.205 0.000 1.022 1942 H CA 0.325 56.472 56.048 0.165 0.000 1.340 1942 H CB 0.641 30.471 29.762 0.113 0.000 1.437 1942 H HN 0.178 nan 8.280 nan 0.000 0.539 1943 R N 0.483 121.091 120.500 0.181 0.000 2.594 1943 R HA 0.244 4.583 4.340 -0.001 0.000 0.265 1943 R C -1.254 174.963 176.300 -0.139 0.000 1.070 1943 R CA -0.450 55.592 56.100 -0.096 0.000 0.909 1943 R CB 2.329 32.600 30.300 -0.048 0.000 1.243 1943 R HN -0.063 nan 8.270 nan 0.000 0.455 1944 V N 4.803 124.465 119.914 -0.419 0.000 3.061 1944 V HA -0.023 4.097 4.120 -0.001 0.000 0.306 1944 V C 0.377 176.359 176.094 -0.186 0.000 1.118 1944 V CA 1.154 63.245 62.300 -0.349 0.000 1.231 1944 V CB 0.218 31.732 31.823 -0.515 0.000 0.956 1944 V HN 1.058 nan 8.190 nan 0.000 0.499 1945 H N 2.294 121.346 119.070 -0.031 0.000 2.932 1945 H HA -0.170 4.385 4.556 -0.000 0.000 0.290 1945 H C 0.504 175.833 175.328 0.003 0.000 1.108 1945 H CA 1.008 57.047 56.048 -0.015 0.000 1.172 1945 H CB -1.250 28.507 29.762 -0.008 0.000 1.325 1945 H HN 0.513 nan 8.280 nan 0.000 0.354 1946 M N 0.592 120.237 119.600 0.074 0.000 2.260 1946 M HA 0.001 4.481 4.480 -0.001 0.000 0.348 1946 M C 1.275 177.642 176.300 0.113 0.000 1.342 1946 M CA 0.674 56.017 55.300 0.071 0.000 1.040 1946 M CB 0.120 32.745 32.600 0.043 0.000 1.810 1946 M HN 0.099 nan 8.290 nan 0.000 0.453 1947 V N 3.422 123.421 119.914 0.142 0.000 4.190 1947 V HA -0.207 3.912 4.120 -0.001 0.000 0.437 1947 V C 1.005 177.265 176.094 0.278 0.000 0.680 1947 V CA 0.747 63.185 62.300 0.229 0.000 1.799 1947 V CB -1.283 30.727 31.823 0.312 0.000 2.188 1947 V HN 1.052 nan 8.190 nan 0.000 0.488 1948 Q N 1.898 121.831 119.800 0.222 0.000 2.352 1948 Q HA 0.112 4.452 4.340 -0.001 0.000 0.212 1948 Q C 0.813 176.958 176.000 0.242 0.000 0.888 1948 Q CA 1.245 57.173 55.803 0.208 0.000 0.934 1948 Q CB 0.972 29.770 28.738 0.100 0.000 1.093 1948 Q HN 1.084 nan 8.270 nan 0.000 0.523 1949 T N -3.754 110.926 114.554 0.211 0.000 2.903 1949 T HA 0.268 4.617 4.350 -0.001 0.000 0.299 1949 T C 0.414 175.005 174.700 -0.182 0.000 1.093 1949 T CA -0.715 61.429 62.100 0.075 0.000 1.002 1949 T CB 1.663 70.575 68.868 0.072 0.000 1.127 1949 T HN 0.106 nan 8.240 nan 0.000 0.488 1950 E N -0.278 119.606 120.200 -0.528 0.000 2.208 1950 E HA -0.144 4.205 4.350 -0.001 0.000 0.193 1950 E C 2.102 178.571 176.600 -0.217 0.000 0.988 1950 E CA 1.527 57.386 56.400 -0.902 0.000 0.828 1950 E CB -0.220 29.093 29.700 -0.644 0.000 0.763 1950 E HN 0.798 nan 8.360 nan 0.000 0.478 1951 C N 0.019 119.275 119.300 -0.073 0.000 2.440 1951 C HA -0.019 4.441 4.460 -0.001 0.000 0.278 1951 C C 2.545 177.621 174.990 0.143 0.000 1.295 1951 C CA 0.720 59.770 59.018 0.054 0.000 1.738 1951 C CB -0.915 26.859 27.740 0.056 0.000 1.987 1951 C HN 0.399 nan 8.230 nan 0.000 0.492 1952 Q N -0.772 119.123 119.800 0.159 0.000 2.084 1952 Q HA -0.155 4.184 4.340 -0.001 0.000 0.202 1952 Q C 2.112 178.317 176.000 0.342 0.000 0.978 1952 Q CA 2.025 57.992 55.803 0.274 0.000 0.844 1952 Q CB -0.451 28.465 28.738 0.297 0.000 0.898 1952 Q HN 0.853 nan 8.270 nan 0.000 0.426 1953 Y N 0.699 121.089 120.300 0.150 0.000 2.128 1953 Y HA -0.276 4.273 4.550 -0.001 0.000 0.284 1953 Y C 2.087 178.144 175.900 0.262 0.000 1.154 1953 Y CA 1.212 59.444 58.100 0.221 0.000 1.149 1953 Y CB -0.368 38.195 38.460 0.171 0.000 0.976 1953 Y HN -0.129 nan 8.280 nan 0.000 0.505 1954 V N -0.493 119.543 119.914 0.205 0.000 2.252 1954 V HA -0.378 3.741 4.120 -0.001 0.000 0.249 1954 V C 2.095 178.298 176.094 0.183 0.000 1.056 1954 V CA 2.353 64.757 62.300 0.174 0.000 1.022 1954 V CB -1.312 30.633 31.823 0.204 0.000 0.641 1954 V HN 0.571 nan 8.190 nan 0.000 0.445 1955 Y N 0.464 120.812 120.300 0.081 0.000 2.193 1955 Y HA -0.268 4.281 4.550 -0.001 0.000 0.285 1955 Y C 2.199 178.084 175.900 -0.025 0.000 1.166 1955 Y CA 1.696 59.815 58.100 0.031 0.000 1.181 1955 Y CB -0.338 38.132 38.460 0.018 0.000 0.976 1955 Y HN 0.166 nan 8.280 nan 0.000 0.520 1956 L N -0.990 120.235 121.223 0.003 0.000 2.042 1956 L HA -0.296 4.043 4.340 -0.001 0.000 0.210 1956 L C 2.304 178.988 176.870 -0.310 0.000 1.076 1956 L CA 1.844 56.580 54.840 -0.173 0.000 0.749 1956 L CB -0.738 41.259 42.059 -0.103 0.000 0.893 1956 L HN 0.265 nan 8.230 nan 0.000 0.432 1957 H N -0.666 118.173 119.070 -0.384 0.000 2.357 1957 H HA -0.151 4.405 4.556 -0.001 0.000 0.301 1957 H C 2.385 177.340 175.328 -0.622 0.000 1.082 1957 H CA 1.301 57.034 56.048 -0.526 0.000 1.342 1957 H CB -0.061 29.098 29.762 -1.006 0.000 1.389 1957 H HN 0.334 nan 8.280 nan 0.000 0.511 1958 Q N -0.691 118.896 119.800 -0.355 0.000 2.181 1958 Q HA -0.155 4.185 4.340 -0.001 0.000 0.205 1958 Q C 2.348 178.211 176.000 -0.228 0.000 0.980 1958 Q CA 1.449 57.162 55.803 -0.150 0.000 0.862 1958 Q CB -0.116 28.617 28.738 -0.008 0.000 0.905 1958 Q HN 0.470 nan 8.270 nan 0.000 0.429 1959 C N -0.541 118.519 119.300 -0.401 0.000 2.453 1959 C HA -0.075 4.385 4.460 -0.001 0.000 0.277 1959 C C 2.662 177.466 174.990 -0.309 0.000 1.262 1959 C CA 0.295 59.076 59.018 -0.396 0.000 1.718 1959 C CB -0.724 26.719 27.740 -0.495 0.000 2.031 1959 C HN 0.348 nan 8.230 nan 0.000 0.480 1960 V N 1.303 120.986 119.914 -0.386 0.000 2.252 1960 V HA -0.272 3.848 4.120 -0.001 0.000 0.249 1960 V C 2.710 178.586 176.094 -0.363 0.000 1.056 1960 V CA 2.279 64.275 62.300 -0.506 0.000 1.022 1960 V CB -0.826 30.438 31.823 -0.931 0.000 0.641 1960 V HN 0.509 nan 8.190 nan 0.000 0.445 1961 R N 0.106 120.518 120.500 -0.146 0.000 2.094 1961 R HA -0.235 4.104 4.340 -0.001 0.000 0.239 1961 R C 2.068 178.388 176.300 0.033 0.000 1.137 1961 R CA 2.471 58.642 56.100 0.118 0.000 0.943 1961 R CB -0.591 29.902 30.300 0.322 0.000 0.850 1961 R HN 0.553 nan 8.270 nan 0.000 0.433 1962 D N -0.091 120.298 120.400 -0.017 0.000 2.117 1962 D HA -0.124 4.515 4.640 -0.001 0.000 0.197 1962 D C 1.956 178.226 176.300 -0.050 0.000 0.987 1962 D CA 1.047 55.033 54.000 -0.023 0.000 0.829 1962 D CB -0.213 40.563 40.800 -0.040 0.000 0.961 1962 D HN 0.117 nan 8.370 nan 0.000 0.460 1963 V N 0.780 120.633 119.914 -0.102 0.000 2.515 1963 V HA -0.162 3.957 4.120 -0.001 0.000 0.250 1963 V C 2.453 178.498 176.094 -0.083 0.000 1.058 1963 V CA 1.022 63.261 62.300 -0.103 0.000 1.064 1963 V CB -0.257 31.477 31.823 -0.149 0.000 0.675 1963 V HN 0.206 nan 8.190 nan 0.000 0.461 1964 L N -1.001 120.172 121.223 -0.084 0.000 2.127 1964 L HA -0.030 4.309 4.340 -0.001 0.000 0.203 1964 L C 2.719 179.587 176.870 -0.003 0.000 1.080 1964 L CA 1.089 55.898 54.840 -0.051 0.000 0.768 1964 L CB -0.531 41.496 42.059 -0.054 0.000 0.924 1964 L HN 0.170 nan 8.230 nan 0.000 0.444 1965 R N 0.322 120.833 120.500 0.019 0.000 2.091 1965 R HA -0.169 4.170 4.340 -0.001 0.000 0.238 1965 R C 2.305 178.612 176.300 0.013 0.000 1.136 1965 R CA 1.547 57.664 56.100 0.029 0.000 0.959 1965 R CB -0.442 29.884 30.300 0.043 0.000 0.856 1965 R HN 0.341 nan 8.270 nan 0.000 0.437 1966 A N 1.472 124.291 122.820 -0.001 0.000 2.067 1966 A HA -0.076 4.244 4.320 -0.001 0.000 0.217 1966 A C 1.272 178.851 177.584 -0.007 0.000 1.156 1966 A CA 0.363 52.398 52.037 -0.003 0.000 0.683 1966 A CB -0.265 18.730 19.000 -0.009 0.000 0.808 1966 A HN 0.235 nan 8.150 nan 0.000 0.455 1967 R N 0.000 120.492 120.500 -0.014 0.000 2.786 1967 R HA 0.000 4.339 4.340 -0.001 0.000 0.208 1967 R CA 0.000 56.090 56.100 -0.016 0.000 0.921 1967 R CB 0.000 30.282 30.300 -0.030 0.000 0.687 1967 R HN 0.000 nan 8.270 nan 0.000 0.535