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 3c4t_1_A DATA FIRST_RESID 1638 DATA SEQUENCE DAEKTLNHLI SGFETFEKKI NYRFKNKAYL LQAFTHASYH YNTITDXYQR DATA SEQUENCE LEFLGDAILD YLITKHLYED PRQHSPGVLT DLRSALVNNT IFASLAVKYD DATA SEQUENCE YHKYFKAVSP ELFHVIDDFV KFQLEKNEXX XXXXXXXXXX XXXXXXEDIE DATA SEQUENCE VPKAMGDIFE SLAGAIYMDS GMSLEVVWQV YYPMMQPLIE KFSANVPRSP DATA SEQUENCE VRELLEMEPE TAKFSPAERT YDGKVRVTVE VVGKGKFKGV GRSYRIAKSA DATA SEQUENCE AARRALRSLK 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 1638 D HA 0.000 nan 4.640 nan 0.000 0.175 1638 D C 0.000 176.273 176.300 -0.046 0.000 2.045 1638 D CA 0.000 53.975 54.000 -0.042 0.000 0.868 1638 D CB 0.000 40.770 40.800 -0.050 0.000 0.688 1639 A N 3.571 126.374 122.820 -0.029 0.000 1.832 1639 A HA -0.014 4.306 4.320 0.000 0.000 0.214 1639 A C 1.734 179.305 177.584 -0.022 0.000 1.242 1639 A CA 1.776 53.802 52.037 -0.019 0.000 0.603 1639 A CB -0.762 18.235 19.000 -0.004 0.000 0.902 1639 A HN 0.725 nan 8.150 nan 0.000 0.455 1640 E N -0.055 120.134 120.200 -0.017 0.000 2.315 1640 E HA -0.322 4.028 4.350 0.000 0.000 0.215 1640 E C 1.785 178.373 176.600 -0.020 0.000 1.069 1640 E CA 3.345 59.737 56.400 -0.013 0.000 0.859 1640 E CB -0.311 29.381 29.700 -0.013 0.000 0.743 1640 E HN 0.557 nan 8.360 nan 0.000 0.469 1641 K N -0.941 119.431 120.400 -0.047 0.000 2.276 1641 K HA 0.092 4.412 4.320 0.000 0.000 0.198 1641 K C 2.144 178.672 176.600 -0.119 0.000 1.052 1641 K CA 0.972 57.212 56.287 -0.077 0.000 0.984 1641 K CB -1.091 31.342 32.500 -0.111 0.000 0.836 1641 K HN 0.276 nan 8.250 nan 0.000 0.490 1642 T N 1.784 116.266 114.554 -0.120 0.000 2.751 1642 T HA -0.221 4.129 4.350 0.000 0.000 0.268 1642 T C 1.854 176.573 174.700 0.032 0.000 1.045 1642 T CA 1.681 63.731 62.100 -0.083 0.000 1.142 1642 T CB -0.339 68.513 68.868 -0.028 0.000 0.851 1642 T HN 0.373 nan 8.240 nan 0.000 0.474 1643 L N 1.619 122.859 121.223 0.028 0.000 2.068 1643 L HA 0.131 4.471 4.340 0.000 0.000 0.204 1643 L C 1.908 178.820 176.870 0.070 0.000 1.076 1643 L CA 1.603 56.479 54.840 0.061 0.000 0.753 1643 L CB -0.869 41.217 42.059 0.046 0.000 0.910 1643 L HN 0.107 nan 8.230 nan 0.000 0.439 1644 N N -0.804 117.931 118.700 0.059 0.000 2.223 1644 N HA -0.232 4.509 4.740 0.000 0.000 0.185 1644 N C 1.693 177.254 175.510 0.086 0.000 1.016 1644 N CA 1.336 54.421 53.050 0.058 0.000 0.863 1644 N CB -0.422 38.094 38.487 0.049 0.000 0.983 1644 N HN 0.494 nan 8.380 nan 0.000 0.429 1645 H N 1.029 120.075 119.070 -0.040 0.000 2.387 1645 H HA 0.051 4.607 4.556 -0.000 0.000 0.299 1645 H C 2.101 177.386 175.328 -0.072 0.000 1.099 1645 H CA 0.968 56.984 56.048 -0.052 0.000 1.315 1645 H CB -0.163 29.575 29.762 -0.039 0.000 1.380 1645 H HN 0.150 nan 8.280 nan 0.000 0.513 1646 L N 0.096 121.360 121.223 0.069 0.000 2.249 1646 L HA 0.026 4.366 4.340 0.000 0.000 0.207 1646 L C 1.593 178.321 176.870 -0.237 0.000 1.090 1646 L CA 0.546 55.380 54.840 -0.010 0.000 0.802 1646 L CB 0.054 42.174 42.059 0.103 0.000 0.947 1646 L HN 0.303 nan 8.230 nan 0.000 0.453 1647 I N -3.612 116.831 120.570 -0.212 0.000 3.812 1647 I HA 0.125 4.295 4.170 0.000 0.000 0.320 1647 I C 0.403 176.229 176.117 -0.485 0.000 1.276 1647 I CA -0.312 60.707 61.300 -0.469 0.000 1.164 1647 I CB -0.229 37.797 38.000 0.044 0.000 1.009 1647 I HN -0.027 nan 8.210 nan 0.000 0.431 1648 S N 2.381 117.887 115.700 -0.322 0.000 2.555 1648 S HA 0.406 4.876 4.470 0.000 0.000 0.293 1648 S C 1.195 175.629 174.600 -0.277 0.000 1.248 1648 S CA 0.319 58.389 58.200 -0.216 0.000 1.096 1648 S CB 0.690 63.788 63.200 -0.168 0.000 0.881 1648 S HN 0.818 nan 8.310 nan 0.000 0.498 1649 G N 2.038 110.768 108.800 -0.115 0.000 2.481 1649 G HA2 -0.222 3.738 3.960 0.000 0.000 0.200 1649 G HA3 -0.222 3.738 3.960 0.000 0.000 0.200 1649 G C 0.504 175.548 174.900 0.240 0.000 1.012 1649 G CA -0.310 44.804 45.100 0.023 0.000 0.676 1649 G HN 0.561 nan 8.290 nan 0.000 0.488 1650 F N 2.185 122.187 119.950 0.087 0.000 2.307 1650 F HA 0.099 4.626 4.527 0.001 0.000 0.301 1650 F C 2.371 178.178 175.800 0.012 0.000 1.076 1650 F CA 1.408 59.410 58.000 0.002 0.000 1.383 1650 F CB -0.686 38.279 39.000 -0.058 0.000 1.055 1650 F HN 0.375 nan 8.300 nan 0.000 0.526 1651 E N -0.135 120.195 120.200 0.216 0.000 2.149 1651 E HA -0.280 4.070 4.350 0.000 0.000 0.215 1651 E C 2.156 178.813 176.600 0.096 0.000 1.055 1651 E CA 2.891 59.365 56.400 0.123 0.000 0.870 1651 E CB -0.840 28.915 29.700 0.092 0.000 0.764 1651 E HN 0.272 nan 8.360 nan 0.000 0.463 1652 T N -0.046 114.595 114.554 0.145 0.000 2.821 1652 T HA -0.109 4.241 4.350 0.000 0.000 0.267 1652 T C 1.511 176.225 174.700 0.023 0.000 1.046 1652 T CA 1.099 63.273 62.100 0.124 0.000 1.139 1652 T CB -0.362 68.659 68.868 0.254 0.000 0.871 1652 T HN 0.185 nan 8.240 nan 0.000 0.454 1653 F N 2.249 122.028 119.950 -0.285 0.000 2.146 1653 F HA -0.023 4.504 4.527 0.000 0.000 0.298 1653 F C 2.207 177.824 175.800 -0.305 0.000 1.096 1653 F CA 1.183 58.805 58.000 -0.630 0.000 1.275 1653 F CB -0.289 37.789 39.000 -1.537 0.000 1.008 1653 F HN 0.149 nan 8.300 nan 0.000 0.480 1654 E N 0.397 120.464 120.200 -0.220 0.000 2.058 1654 E HA -0.224 4.126 4.350 0.000 0.000 0.194 1654 E C 2.121 178.606 176.600 -0.191 0.000 0.997 1654 E CA 1.332 57.629 56.400 -0.173 0.000 0.801 1654 E CB -0.223 29.490 29.700 0.021 0.000 0.746 1654 E HN 0.325 nan 8.360 nan 0.000 0.450 1655 K N 1.298 121.627 120.400 -0.118 0.000 2.001 1655 K HA -0.221 4.099 4.320 0.000 0.000 0.214 1655 K C 2.110 178.624 176.600 -0.143 0.000 1.050 1655 K CA 1.456 57.687 56.287 -0.094 0.000 0.934 1655 K CB -0.567 31.913 32.500 -0.033 0.000 0.718 1655 K HN 0.069 nan 8.250 nan 0.000 0.443 1656 K N 1.467 121.760 120.400 -0.178 0.000 2.074 1656 K HA -0.170 4.150 4.320 0.000 0.000 0.209 1656 K C 1.971 178.459 176.600 -0.187 0.000 1.048 1656 K CA 1.845 58.056 56.287 -0.128 0.000 0.926 1656 K CB -0.204 32.259 32.500 -0.062 0.000 0.713 1656 K HN 0.276 nan 8.250 nan 0.000 0.444 1657 I N -1.826 118.516 120.570 -0.379 0.000 3.793 1657 I HA 0.174 4.344 4.170 0.000 0.000 0.315 1657 I C -0.038 175.931 176.117 -0.246 0.000 1.275 1657 I CA -0.241 60.825 61.300 -0.390 0.000 1.214 1657 I CB -0.205 37.431 38.000 -0.608 0.000 1.018 1657 I HN 0.129 nan 8.210 nan 0.000 0.439 1658 N N 1.711 120.305 118.700 -0.177 0.000 2.714 1658 N HA -0.311 4.429 4.740 0.000 0.000 0.253 1658 N C -1.019 174.484 175.510 -0.011 0.000 1.024 1658 N CA 0.890 53.883 53.050 -0.094 0.000 0.726 1658 N CB -1.122 37.316 38.487 -0.081 0.000 0.908 1658 N HN 0.782 nan 8.380 nan 0.000 0.542 1659 Y N -0.214 119.986 120.300 -0.166 0.000 2.534 1659 Y HA 0.581 5.130 4.550 -0.002 0.000 0.345 1659 Y C -0.734 175.125 175.900 -0.069 0.000 1.031 1659 Y CA -1.139 56.880 58.100 -0.135 0.000 1.022 1659 Y CB 1.296 39.648 38.460 -0.180 0.000 1.292 1659 Y HN 0.117 nan 8.280 nan 0.000 0.459 1660 R N 5.944 125.843 120.500 -1.002 0.000 2.358 1660 R HA 0.334 4.674 4.340 0.000 0.000 0.309 1660 R C -1.596 174.260 176.300 -0.741 0.000 1.026 1660 R CA -0.686 55.039 56.100 -0.626 0.000 0.909 1660 R CB 0.234 30.348 30.300 -0.311 0.000 1.153 1660 R HN 0.717 nan 8.270 nan 0.000 0.515 1661 F N 3.776 123.455 119.950 -0.452 0.000 2.571 1661 F HA -0.085 4.444 4.527 0.003 0.000 0.390 1661 F C 1.519 177.273 175.800 -0.076 0.000 1.043 1661 F CA 0.496 58.411 58.000 -0.141 0.000 1.164 1661 F CB 0.671 39.712 39.000 0.067 0.000 1.049 1661 F HN 0.430 nan 8.300 nan 0.000 0.552 1662 K N 1.463 121.898 120.400 0.059 0.000 2.001 1662 K HA -0.148 4.172 4.320 0.000 0.000 0.208 1662 K C 0.691 177.340 176.600 0.082 0.000 1.048 1662 K CA 0.961 57.281 56.287 0.054 0.000 0.932 1662 K CB -0.165 32.352 32.500 0.028 0.000 0.715 1662 K HN 0.322 nan 8.250 nan 0.000 0.437 1663 N N 1.346 120.107 118.700 0.102 0.000 2.469 1663 N HA 0.015 4.755 4.740 0.000 0.000 0.239 1663 N C -0.035 175.538 175.510 0.104 0.000 1.053 1663 N CA 0.093 53.132 53.050 -0.018 0.000 0.937 1663 N CB 0.576 38.854 38.487 -0.347 0.000 1.163 1663 N HN -0.056 nan 8.380 nan 0.000 0.509 1664 K N 2.457 122.912 120.400 0.092 0.000 2.280 1664 K HA -0.073 4.248 4.320 0.000 0.000 0.202 1664 K C 1.341 177.967 176.600 0.044 0.000 1.047 1664 K CA 0.812 57.153 56.287 0.090 0.000 0.942 1664 K CB -0.178 32.382 32.500 0.099 0.000 0.739 1664 K HN 0.605 nan 8.250 nan 0.000 0.457 1665 A N 0.627 123.451 122.820 0.006 0.000 2.019 1665 A HA -0.156 4.164 4.320 0.000 0.000 0.219 1665 A C 1.697 179.369 177.584 0.146 0.000 1.164 1665 A CA 0.988 53.048 52.037 0.038 0.000 0.644 1665 A CB -0.494 18.489 19.000 -0.029 0.000 0.805 1665 A HN 0.169 nan 8.150 nan 0.000 0.449 1666 Y N -0.913 119.467 120.300 0.133 0.000 2.242 1666 Y HA -0.107 4.442 4.550 -0.001 0.000 0.291 1666 Y C 2.213 178.113 175.900 -0.000 0.000 1.137 1666 Y CA 0.577 58.773 58.100 0.161 0.000 1.181 1666 Y CB -0.870 37.797 38.460 0.346 0.000 0.989 1666 Y HN 0.294 nan 8.280 nan 0.000 0.527 1667 L N 0.058 121.171 121.223 -0.184 0.000 1.989 1667 L HA -0.188 4.152 4.340 0.000 0.000 0.211 1667 L C 2.335 179.141 176.870 -0.107 0.000 1.071 1667 L CA 1.577 56.074 54.840 -0.571 0.000 0.749 1667 L CB -1.508 40.007 42.059 -0.907 0.000 0.890 1667 L HN 0.282 nan 8.230 nan 0.000 0.431 1668 L N -0.023 121.234 121.223 0.057 0.000 1.970 1668 L HA -0.257 4.083 4.340 0.000 0.000 0.212 1668 L C 2.599 179.627 176.870 0.263 0.000 1.071 1668 L CA 2.517 57.519 54.840 0.269 0.000 0.751 1668 L CB -1.323 40.913 42.059 0.295 0.000 0.889 1668 L HN 0.619 nan 8.230 nan 0.000 0.432 1669 Q N -0.350 119.587 119.800 0.228 0.000 2.096 1669 Q HA -0.284 4.056 4.340 0.000 0.000 0.208 1669 Q C 2.093 178.254 176.000 0.268 0.000 0.993 1669 Q CA 2.506 58.452 55.803 0.238 0.000 0.862 1669 Q CB -0.443 28.442 28.738 0.246 0.000 0.915 1669 Q HN 0.685 nan 8.270 nan 0.000 0.416 1670 A N -0.637 122.301 122.820 0.195 0.000 2.032 1670 A HA -0.179 4.141 4.320 0.000 0.000 0.221 1670 A C 1.456 179.101 177.584 0.103 0.000 1.165 1670 A CA 1.497 53.580 52.037 0.077 0.000 0.645 1670 A CB -0.541 18.382 19.000 -0.129 0.000 0.807 1670 A HN 0.558 nan 8.150 nan 0.000 0.453 1671 F N -0.932 119.151 119.950 0.222 0.000 2.724 1671 F HA 0.148 4.675 4.527 -0.000 0.000 0.306 1671 F C 0.693 176.693 175.800 0.333 0.000 1.100 1671 F CA 0.252 58.417 58.000 0.275 0.000 1.255 1671 F CB 0.248 39.270 39.000 0.037 0.000 1.072 1671 F HN -0.135 nan 8.300 nan 0.000 0.589 1672 T N 1.066 115.858 114.554 0.397 0.000 2.743 1672 T HA 0.039 4.389 4.350 0.000 0.000 0.290 1672 T C 0.011 174.782 174.700 0.118 0.000 0.908 1672 T CA 0.096 62.308 62.100 0.186 0.000 1.092 1672 T CB -0.211 68.754 68.868 0.162 0.000 0.882 1672 T HN 0.130 nan 8.240 nan 0.000 0.531 1673 H N 2.859 121.922 119.070 -0.011 0.000 2.326 1673 H HA 0.473 5.029 4.556 -0.000 0.000 0.358 1673 H C 1.392 176.656 175.328 -0.106 0.000 1.834 1673 H CA 0.407 56.405 56.048 -0.083 0.000 1.427 1673 H CB 0.325 30.120 29.762 0.056 0.000 1.638 1673 H HN 0.501 nan 8.280 nan 0.000 0.567 1674 A N -0.166 121.996 122.820 -1.097 0.000 1.935 1674 A HA -0.033 4.287 4.320 0.000 0.000 0.214 1674 A C 2.248 179.611 177.584 -0.368 0.000 1.178 1674 A CA 1.098 52.762 52.037 -0.622 0.000 0.640 1674 A CB -0.936 17.726 19.000 -0.563 0.000 0.825 1674 A HN 0.703 nan 8.150 nan 0.000 0.447 1675 S N -1.942 113.508 115.700 -0.418 0.000 2.603 1675 S HA -0.025 4.446 4.470 0.000 0.000 0.229 1675 S C 0.531 175.195 174.600 0.107 0.000 0.972 1675 S CA 0.157 58.357 58.200 0.000 0.000 0.935 1675 S CB -0.576 62.768 63.200 0.240 0.000 0.769 1675 S HN 0.430 nan 8.310 nan 0.000 0.536 1676 Y N 5.021 125.285 120.300 -0.060 0.000 2.636 1676 Y HA 0.189 4.739 4.550 0.000 0.000 0.334 1676 Y C 1.588 177.419 175.900 -0.116 0.000 1.286 1676 Y CA -1.438 56.590 58.100 -0.121 0.000 1.688 1676 Y CB -0.561 37.839 38.460 -0.101 0.000 1.662 1676 Y HN 0.421 nan 8.280 nan 0.000 0.465 1677 H N 1.514 120.407 119.070 -0.295 0.000 2.567 1677 H HA -0.139 4.417 4.556 0.000 0.000 0.276 1677 H C 0.408 175.708 175.328 -0.047 0.000 1.016 1677 H CA 0.963 56.926 56.048 -0.143 0.000 1.186 1677 H CB -0.532 29.166 29.762 -0.106 0.000 1.351 1677 H HN 0.740 nan 8.280 nan 0.000 0.605 1678 Y N 0.677 120.478 120.300 -0.831 0.000 2.365 1678 Y HA -0.066 4.484 4.550 -0.000 0.000 0.293 1678 Y C 1.169 176.937 175.900 -0.219 0.000 1.119 1678 Y CA -0.101 57.621 58.100 -0.630 0.000 1.203 1678 Y CB 0.309 38.244 38.460 -0.875 0.000 1.026 1678 Y HN 0.183 nan 8.280 nan 0.000 0.549 1679 N N 0.963 119.727 118.700 0.108 0.000 2.422 1679 N HA -0.006 4.734 4.740 0.000 0.000 0.264 1679 N C 0.178 175.759 175.510 0.119 0.000 1.063 1679 N CA 0.447 53.615 53.050 0.198 0.000 0.959 1679 N CB 1.110 39.790 38.487 0.321 0.000 1.087 1679 N HN 0.166 nan 8.380 nan 0.000 0.483 1680 T N 0.536 115.146 114.554 0.092 0.000 3.170 1680 T HA 0.204 4.555 4.350 0.000 0.000 0.288 1680 T C 1.297 176.035 174.700 0.064 0.000 0.992 1680 T CA -0.291 61.849 62.100 0.067 0.000 0.909 1680 T CB -0.792 68.104 68.868 0.047 0.000 1.133 1680 T HN 0.557 nan 8.240 nan 0.000 0.530 1681 I N -0.639 119.979 120.570 0.080 0.000 4.288 1681 I HA 0.396 4.566 4.170 0.000 0.000 0.331 1681 I C 0.423 176.591 176.117 0.085 0.000 1.322 1681 I CA -0.466 60.877 61.300 0.072 0.000 1.149 1681 I CB 0.451 38.492 38.000 0.067 0.000 1.112 1681 I HN 0.237 nan 8.210 nan 0.000 0.403 1682 T N -2.739 111.876 114.554 0.102 0.000 2.841 1682 T HA 0.435 4.785 4.350 0.000 0.000 0.296 1682 T C -0.669 174.092 174.700 0.102 0.000 1.166 1682 T CA -0.633 61.535 62.100 0.113 0.000 1.007 1682 T CB 2.460 71.415 68.868 0.145 0.000 1.253 1682 T HN -0.074 nan 8.240 nan 0.000 0.511 1686 Q N 1.746 121.746 119.800 0.332 0.000 2.152 1686 Q HA -0.148 4.192 4.340 0.000 0.000 0.206 1686 Q C 1.764 177.938 176.000 0.289 0.000 0.985 1686 Q CA 2.382 58.431 55.803 0.408 0.000 0.863 1686 Q CB -0.082 28.742 28.738 0.144 0.000 0.904 1686 Q HN 0.535 nan 8.270 nan 0.000 0.422 1687 R N -0.362 120.255 120.500 0.194 0.000 2.235 1687 R HA -0.025 4.315 4.340 0.000 0.000 0.213 1687 R C 1.866 178.289 176.300 0.206 0.000 1.059 1687 R CA 0.561 56.754 56.100 0.155 0.000 0.997 1687 R CB 0.081 30.441 30.300 0.100 0.000 0.884 1687 R HN 0.295 nan 8.270 nan 0.000 0.462 1688 L N -0.028 121.314 121.223 0.198 0.000 2.513 1688 L HA 0.020 4.360 4.340 0.000 0.000 0.222 1688 L C 2.320 179.235 176.870 0.075 0.000 1.096 1688 L CA 0.304 55.218 54.840 0.123 0.000 0.857 1688 L CB -0.012 42.113 42.059 0.109 0.000 1.026 1688 L HN 0.198 nan 8.230 nan 0.000 0.469 1689 E N 0.368 120.643 120.200 0.126 0.000 2.038 1689 E HA -0.291 4.060 4.350 0.000 0.000 0.195 1689 E C 2.005 178.669 176.600 0.107 0.000 1.000 1689 E CA 1.759 58.194 56.400 0.057 0.000 0.803 1689 E CB -0.094 29.693 29.700 0.144 0.000 0.750 1689 E HN 0.353 nan 8.360 nan 0.000 0.448 1690 F N 1.606 121.568 119.950 0.021 0.000 2.010 1690 F HA -0.284 4.243 4.527 0.000 0.000 0.296 1690 F C 2.277 178.059 175.800 -0.031 0.000 1.146 1690 F CA 1.678 59.683 58.000 0.009 0.000 1.181 1690 F CB -0.960 38.054 39.000 0.023 0.000 0.965 1690 F HN 0.132 nan 8.300 nan 0.000 0.480 1691 L N 1.288 122.464 121.223 -0.079 0.000 2.030 1691 L HA -0.221 4.119 4.340 0.000 0.000 0.222 1691 L C 2.389 179.094 176.870 -0.274 0.000 1.082 1691 L CA 2.520 57.226 54.840 -0.223 0.000 0.785 1691 L CB -1.785 40.237 42.059 -0.061 0.000 0.895 1691 L HN 0.378 nan 8.230 nan 0.000 0.439 1692 G N -1.710 106.976 108.800 -0.190 0.000 2.402 1692 G HA2 -0.323 3.637 3.960 0.000 0.000 0.216 1692 G HA3 -0.323 3.637 3.960 0.000 0.000 0.216 1692 G C 1.233 175.999 174.900 -0.223 0.000 1.162 1692 G CA 0.858 45.816 45.100 -0.237 0.000 0.777 1692 G HN 0.539 nan 8.290 nan 0.000 0.539 1693 D N 0.835 121.150 120.400 -0.142 0.000 2.205 1693 D HA -0.190 4.450 4.640 0.000 0.000 0.190 1693 D C 2.767 179.010 176.300 -0.095 0.000 1.002 1693 D CA 2.349 56.317 54.000 -0.052 0.000 0.848 1693 D CB -0.370 40.396 40.800 -0.056 0.000 0.975 1693 D HN 0.245 nan 8.370 nan 0.000 0.449 1694 A N 0.136 122.836 122.820 -0.200 0.000 1.896 1694 A HA -0.273 4.047 4.320 0.000 0.000 0.220 1694 A C 2.470 179.971 177.584 -0.139 0.000 1.206 1694 A CA 2.189 54.109 52.037 -0.195 0.000 0.647 1694 A CB -1.170 17.646 19.000 -0.306 0.000 0.828 1694 A HN 0.467 nan 8.150 nan 0.000 0.455 1695 I N -0.454 119.989 120.570 -0.211 0.000 2.069 1695 I HA -0.305 3.865 4.170 0.000 0.000 0.237 1695 I C 2.457 178.522 176.117 -0.087 0.000 1.053 1695 I CA 1.666 62.859 61.300 -0.179 0.000 1.311 1695 I CB -0.586 37.227 38.000 -0.312 0.000 1.030 1695 I HN 0.320 nan 8.210 nan 0.000 0.398 1696 L N 0.335 121.487 121.223 -0.120 0.000 2.129 1696 L HA -0.272 4.068 4.340 0.000 0.000 0.212 1696 L C 2.213 179.116 176.870 0.055 0.000 1.087 1696 L CA 1.555 56.380 54.840 -0.026 0.000 0.757 1696 L CB -0.834 41.202 42.059 -0.039 0.000 0.896 1696 L HN 0.409 nan 8.230 nan 0.000 0.434 1697 D N -0.141 120.286 120.400 0.045 0.000 2.081 1697 D HA -0.305 4.336 4.640 0.000 0.000 0.194 1697 D C 2.096 178.379 176.300 -0.027 0.000 0.986 1697 D CA 1.467 55.487 54.000 0.035 0.000 0.837 1697 D CB -0.310 40.501 40.800 0.018 0.000 0.985 1697 D HN 0.273 nan 8.370 nan 0.000 0.448 1698 Y N 0.517 120.746 120.300 -0.119 0.000 2.228 1698 Y HA -0.200 4.349 4.550 -0.001 0.000 0.285 1698 Y C 1.824 177.605 175.900 -0.198 0.000 1.178 1698 Y CA 1.540 59.550 58.100 -0.151 0.000 1.202 1698 Y CB -0.387 37.969 38.460 -0.173 0.000 0.974 1698 Y HN 0.114 nan 8.280 nan 0.000 0.527 1699 L N -0.698 120.242 121.223 -0.471 0.000 2.056 1699 L HA -0.094 4.246 4.340 0.000 0.000 0.202 1699 L C 2.384 178.914 176.870 -0.567 0.000 1.086 1699 L CA 0.990 55.385 54.840 -0.742 0.000 0.758 1699 L CB -0.601 41.086 42.059 -0.620 0.000 0.912 1699 L HN 0.049 nan 8.230 nan 0.000 0.446 1700 I N -0.180 120.265 120.570 -0.208 0.000 2.576 1700 I HA -0.352 3.818 4.170 0.000 0.000 0.263 1700 I C 2.097 178.219 176.117 0.009 0.000 1.183 1700 I CA 1.279 62.604 61.300 0.042 0.000 1.432 1700 I CB -0.520 37.565 38.000 0.143 0.000 1.100 1700 I HN 0.398 nan 8.210 nan 0.000 0.452 1701 T N -0.460 114.011 114.554 -0.139 0.000 2.953 1701 T HA -0.081 4.269 4.350 0.000 0.000 0.247 1701 T C 1.911 176.529 174.700 -0.136 0.000 1.029 1701 T CA 0.569 62.613 62.100 -0.094 0.000 1.144 1701 T CB 0.073 68.871 68.868 -0.117 0.000 0.870 1701 T HN 0.252 nan 8.240 nan 0.000 0.446 1702 K N 0.169 120.344 120.400 -0.374 0.000 2.113 1702 K HA -0.257 4.063 4.320 0.000 0.000 0.208 1702 K C 2.101 178.605 176.600 -0.159 0.000 1.047 1702 K CA 1.726 57.785 56.287 -0.379 0.000 0.928 1702 K CB -0.150 31.935 32.500 -0.692 0.000 0.716 1702 K HN 0.376 nan 8.250 nan 0.000 0.446 1703 H N 0.580 119.515 119.070 -0.226 0.000 2.269 1703 H HA -0.069 4.486 4.556 -0.001 0.000 0.299 1703 H C 1.964 177.333 175.328 0.069 0.000 1.058 1703 H CA 2.299 58.320 56.048 -0.045 0.000 1.246 1703 H CB -0.461 29.343 29.762 0.070 0.000 1.376 1703 H HN 0.094 nan 8.280 nan 0.000 0.503 1704 L N -0.622 120.659 121.223 0.097 0.000 2.103 1704 L HA -0.298 4.042 4.340 0.000 0.000 0.215 1704 L C 2.276 179.191 176.870 0.075 0.000 1.080 1704 L CA 1.893 56.789 54.840 0.094 0.000 0.764 1704 L CB -0.605 41.533 42.059 0.132 0.000 0.890 1704 L HN 0.451 nan 8.230 nan 0.000 0.435 1705 Y N 0.327 120.594 120.300 -0.056 0.000 2.509 1705 Y HA -0.156 4.394 4.550 0.000 0.000 0.293 1705 Y C 2.222 178.073 175.900 -0.082 0.000 1.133 1705 Y CA 1.121 59.192 58.100 -0.049 0.000 1.283 1705 Y CB 0.132 38.557 38.460 -0.057 0.000 1.001 1705 Y HN 0.192 nan 8.280 nan 0.000 0.555 1706 E N -0.051 120.173 120.200 0.040 0.000 2.447 1706 E HA -0.073 4.278 4.350 0.000 0.000 0.195 1706 E C 0.089 176.605 176.600 -0.139 0.000 1.028 1706 E CA -0.040 56.346 56.400 -0.023 0.000 0.876 1706 E CB 0.079 29.765 29.700 -0.025 0.000 0.885 1706 E HN 0.257 nan 8.360 nan 0.000 0.500 1707 D N 1.565 121.853 120.400 -0.186 0.000 2.520 1707 D HA -0.071 4.569 4.640 0.000 0.000 0.243 1707 D C -1.356 174.836 176.300 -0.179 0.000 1.160 1707 D CA -1.346 52.549 54.000 -0.175 0.000 0.877 1707 D CB 1.056 41.789 40.800 -0.112 0.000 1.150 1707 D HN -0.019 nan 8.370 nan 0.000 0.494 1708 P HA -0.155 nan 4.420 nan 0.000 0.221 1708 P C 0.996 178.195 177.300 -0.168 0.000 1.145 1708 P CA 0.741 63.766 63.100 -0.126 0.000 0.795 1708 P CB 0.172 31.827 31.700 -0.075 0.000 0.775 1709 R N -0.531 119.835 120.500 -0.223 0.000 2.371 1709 R HA -0.095 4.245 4.340 0.000 0.000 0.226 1709 R C 1.401 177.459 176.300 -0.403 0.000 1.132 1709 R CA 1.026 56.930 56.100 -0.327 0.000 1.027 1709 R CB -1.221 28.800 30.300 -0.465 0.000 0.848 1709 R HN 0.238 nan 8.270 nan 0.000 0.479 1710 Q N 1.825 121.421 119.800 -0.340 0.000 2.386 1710 Q HA -0.217 4.123 4.340 0.000 0.000 0.361 1710 Q C -0.381 175.468 176.000 -0.252 0.000 1.325 1710 Q CA 1.451 57.078 55.803 -0.293 0.000 1.097 1710 Q CB -2.524 26.081 28.738 -0.222 0.000 1.303 1710 Q HN 0.503 nan 8.270 nan 0.000 0.377 1711 H N 0.545 119.540 119.070 -0.125 0.000 3.073 1711 H HA 0.175 4.731 4.556 -0.000 0.000 0.340 1711 H C 1.481 176.750 175.328 -0.099 0.000 1.054 1711 H CA 0.776 56.769 56.048 -0.091 0.000 1.372 1711 H CB 0.568 30.291 29.762 -0.064 0.000 1.314 1711 H HN 1.075 nan 8.280 nan 0.000 0.603 1712 S N 3.302 119.038 115.700 0.059 0.000 2.549 1712 S HA -0.035 4.435 4.470 0.000 0.000 0.278 1712 S C -1.559 173.054 174.600 0.021 0.000 1.344 1712 S CA -0.851 57.357 58.200 0.013 0.000 1.025 1712 S CB 0.787 63.989 63.200 0.004 0.000 0.851 1712 S HN 0.531 nan 8.310 nan 0.000 0.530 1713 P HA 0.154 nan 4.420 nan 0.000 0.230 1713 P C 1.561 178.858 177.300 -0.004 0.000 1.168 1713 P CA 0.990 64.095 63.100 0.008 0.000 0.793 1713 P CB -0.480 31.225 31.700 0.009 0.000 0.851 1714 G N 0.609 109.401 108.800 -0.013 0.000 2.404 1714 G HA2 -0.200 3.760 3.960 0.000 0.000 0.215 1714 G HA3 -0.200 3.760 3.960 0.000 0.000 0.215 1714 G C 1.637 176.513 174.900 -0.040 0.000 1.174 1714 G CA 0.513 45.599 45.100 -0.024 0.000 0.780 1714 G HN 0.235 nan 8.290 nan 0.000 0.537 1715 V N 0.552 120.438 119.914 -0.048 0.000 2.809 1715 V HA 0.083 4.203 4.120 0.000 0.000 0.256 1715 V C 2.792 178.806 176.094 -0.134 0.000 1.080 1715 V CA 0.918 63.159 62.300 -0.098 0.000 1.102 1715 V CB -0.137 31.618 31.823 -0.113 0.000 0.705 1715 V HN 0.388 nan 8.190 nan 0.000 0.475 1716 L N -0.209 120.968 121.223 -0.077 0.000 2.093 1716 L HA -0.136 4.204 4.340 0.000 0.000 0.208 1716 L C 2.525 179.369 176.870 -0.043 0.000 1.085 1716 L CA 2.125 56.931 54.840 -0.058 0.000 0.755 1716 L CB -0.810 41.257 42.059 0.013 0.000 0.904 1716 L HN 0.438 nan 8.230 nan 0.000 0.435 1717 T N -2.563 111.970 114.554 -0.036 0.000 2.896 1717 T HA -0.095 4.255 4.350 0.000 0.000 0.263 1717 T C 1.361 176.033 174.700 -0.047 0.000 1.050 1717 T CA 0.746 62.828 62.100 -0.030 0.000 1.140 1717 T CB -0.264 68.592 68.868 -0.021 0.000 0.877 1717 T HN 0.213 nan 8.240 nan 0.000 0.457 1718 D N 1.949 122.309 120.400 -0.066 0.000 2.137 1718 D HA -0.104 4.536 4.640 0.000 0.000 0.189 1718 D C 2.193 178.435 176.300 -0.098 0.000 0.998 1718 D CA 1.005 54.951 54.000 -0.090 0.000 0.839 1718 D CB -0.599 40.133 40.800 -0.112 0.000 0.962 1718 D HN 0.261 nan 8.370 nan 0.000 0.446 1719 L N 0.214 121.372 121.223 -0.110 0.000 1.971 1719 L HA -0.229 4.111 4.340 0.000 0.000 0.215 1719 L C 2.738 179.617 176.870 0.014 0.000 1.072 1719 L CA 1.537 56.338 54.840 -0.065 0.000 0.758 1719 L CB -0.540 41.456 42.059 -0.104 0.000 0.889 1719 L HN 0.068 nan 8.230 nan 0.000 0.433 1720 R N 0.043 120.545 120.500 0.003 0.000 2.133 1720 R HA -0.219 4.121 4.340 0.000 0.000 0.245 1720 R C 2.321 178.620 176.300 -0.001 0.000 1.137 1720 R CA 2.358 58.468 56.100 0.016 0.000 0.947 1720 R CB -0.430 29.872 30.300 0.004 0.000 0.865 1720 R HN 0.136 nan 8.270 nan 0.000 0.437 1721 S N -0.792 114.893 115.700 -0.025 0.000 2.447 1721 S HA -0.005 4.465 4.470 0.000 0.000 0.233 1721 S C 1.611 176.187 174.600 -0.040 0.000 1.006 1721 S CA 0.910 59.086 58.200 -0.041 0.000 0.957 1721 S CB 0.037 63.208 63.200 -0.048 0.000 0.773 1721 S HN 0.612 nan 8.310 nan 0.000 0.507 1722 A N 0.356 123.170 122.820 -0.010 0.000 1.956 1722 A HA 0.298 4.618 4.320 0.000 0.000 0.212 1722 A C 1.922 179.624 177.584 0.196 0.000 1.188 1722 A CA 0.398 52.455 52.037 0.034 0.000 0.675 1722 A CB -0.260 18.660 19.000 -0.133 0.000 0.845 1722 A HN 0.404 nan 8.150 nan 0.000 0.455 1723 L N -0.105 121.241 121.223 0.205 0.000 2.022 1723 L HA 0.017 4.357 4.340 0.000 0.000 0.204 1723 L C 0.594 177.427 176.870 -0.062 0.000 1.076 1723 L CA 0.380 55.302 54.840 0.137 0.000 0.749 1723 L CB -0.493 41.678 42.059 0.187 0.000 0.903 1723 L HN 0.071 nan 8.230 nan 0.000 0.439 1724 V N 1.656 121.520 119.914 -0.084 0.000 2.529 1724 V HA 0.145 4.265 4.120 0.000 0.000 0.292 1724 V C -0.267 175.586 176.094 -0.403 0.000 1.028 1724 V CA 0.096 62.198 62.300 -0.330 0.000 1.074 1724 V CB 0.304 32.047 31.823 -0.134 0.000 0.958 1724 V HN 0.549 nan 8.190 nan 0.000 0.481 1725 N N 3.597 121.870 118.700 -0.712 0.000 5.121 1725 N HA -0.025 4.715 4.740 0.000 0.000 0.158 1725 N C 0.291 175.507 175.510 -0.490 0.000 1.033 1725 N CA -0.363 52.440 53.050 -0.412 0.000 1.122 1725 N CB 0.540 38.897 38.487 -0.216 0.000 1.541 1725 N HN 0.525 nan 8.380 nan 0.000 0.993 1726 N N 1.737 120.268 118.700 -0.281 0.000 2.519 1726 N HA -0.098 4.642 4.740 0.000 0.000 0.186 1726 N C 0.203 175.667 175.510 -0.077 0.000 1.062 1726 N CA 1.630 54.602 53.050 -0.130 0.000 0.910 1726 N CB 0.323 38.791 38.487 -0.031 0.000 0.958 1726 N HN 0.584 nan 8.380 nan 0.000 0.445 1727 T N 0.536 115.033 114.554 -0.094 0.000 3.054 1727 T HA 0.122 4.472 4.350 0.000 0.000 0.259 1727 T C 1.783 176.481 174.700 -0.003 0.000 1.092 1727 T CA -0.015 62.068 62.100 -0.028 0.000 1.121 1727 T CB 0.331 69.200 68.868 0.001 0.000 0.912 1727 T HN 0.153 nan 8.240 nan 0.000 0.489 1728 I N 0.561 121.081 120.570 -0.082 0.000 2.400 1728 I HA 0.078 4.248 4.170 0.000 0.000 0.248 1728 I C 1.906 177.981 176.117 -0.069 0.000 1.109 1728 I CA 0.596 61.852 61.300 -0.074 0.000 1.425 1728 I CB -1.237 36.690 38.000 -0.123 0.000 1.094 1728 I HN 0.161 nan 8.210 nan 0.000 0.425 1729 F N 1.822 121.628 119.950 -0.240 0.000 2.202 1729 F HA -0.161 4.367 4.527 0.001 0.000 0.301 1729 F C 2.563 178.065 175.800 -0.496 0.000 1.082 1729 F CA 1.011 58.730 58.000 -0.468 0.000 1.313 1729 F CB -1.188 37.698 39.000 -0.189 0.000 1.024 1729 F HN 0.069 nan 8.300 nan 0.000 0.495 1730 A N -0.764 122.046 122.820 -0.018 0.000 2.021 1730 A HA -0.055 4.265 4.320 0.000 0.000 0.216 1730 A C 2.238 179.858 177.584 0.060 0.000 1.163 1730 A CA 1.307 53.332 52.037 -0.020 0.000 0.676 1730 A CB -0.753 18.218 19.000 -0.050 0.000 0.818 1730 A HN 0.357 nan 8.150 nan 0.000 0.453 1731 S N -0.307 115.424 115.700 0.052 0.000 2.478 1731 S HA 0.079 4.549 4.470 0.000 0.000 0.222 1731 S C 1.715 176.285 174.600 -0.050 0.000 1.008 1731 S CA 0.772 59.008 58.200 0.059 0.000 0.928 1731 S CB -0.518 62.700 63.200 0.029 0.000 0.781 1731 S HN 0.383 nan 8.310 nan 0.000 0.518 1732 L N 1.590 122.714 121.223 -0.165 0.000 2.056 1732 L HA 0.054 4.394 4.340 0.000 0.000 0.207 1732 L C 3.140 180.000 176.870 -0.018 0.000 1.078 1732 L CA 1.210 55.958 54.840 -0.153 0.000 0.749 1732 L CB -0.822 40.923 42.059 -0.525 0.000 0.901 1732 L HN 0.422 nan 8.230 nan 0.000 0.433 1733 A N 0.030 122.747 122.820 -0.172 0.000 1.940 1733 A HA -0.191 4.129 4.320 0.000 0.000 0.219 1733 A C 2.374 180.183 177.584 0.375 0.000 1.176 1733 A CA 2.181 54.193 52.037 -0.041 0.000 0.631 1733 A CB -0.965 17.977 19.000 -0.097 0.000 0.814 1733 A HN 0.344 nan 8.150 nan 0.000 0.446 1734 V N -1.432 118.625 119.914 0.239 0.000 2.649 1734 V HA -0.084 4.036 4.120 0.000 0.000 0.248 1734 V C 2.130 178.342 176.094 0.196 0.000 1.054 1734 V CA 2.220 64.669 62.300 0.248 0.000 1.073 1734 V CB -0.797 31.003 31.823 -0.039 0.000 0.699 1734 V HN 0.560 nan 8.190 nan 0.000 0.463 1735 K N -0.657 119.767 120.400 0.040 0.000 2.218 1735 K HA -0.204 4.116 4.320 0.000 0.000 0.205 1735 K C 1.526 177.969 176.600 -0.262 0.000 1.046 1735 K CA 2.276 58.459 56.287 -0.174 0.000 0.933 1735 K CB -0.316 32.000 32.500 -0.308 0.000 0.728 1735 K HN 0.653 nan 8.250 nan 0.000 0.454 1736 Y N -0.000 120.496 120.300 0.326 0.000 2.507 1736 Y HA 0.132 4.682 4.550 0.001 0.000 0.254 1736 Y C -0.146 176.083 175.900 0.548 0.000 1.171 1736 Y CA -0.101 58.252 58.100 0.421 0.000 1.238 1736 Y CB 0.833 39.584 38.460 0.485 0.000 1.148 1736 Y HN 0.162 nan 8.280 nan 0.000 0.525 1737 D N -2.942 117.848 120.400 0.650 0.000 2.876 1737 D HA -0.256 4.384 4.640 0.000 0.000 0.196 1737 D C 0.840 177.458 176.300 0.530 0.000 1.014 1737 D CA 0.720 54.983 54.000 0.438 0.000 1.012 1737 D CB -1.632 39.417 40.800 0.414 0.000 1.080 1737 D HN 0.315 nan 8.370 nan 0.000 0.438 1738 Y N 0.389 121.057 120.300 0.612 0.000 2.219 1738 Y HA -0.286 4.264 4.550 -0.000 0.000 0.283 1738 Y C 2.455 178.653 175.900 0.496 0.000 1.191 1738 Y CA 2.162 60.625 58.100 0.605 0.000 1.199 1738 Y CB -0.518 38.276 38.460 0.558 0.000 0.972 1738 Y HN 0.579 nan 8.280 nan 0.000 0.527 1739 H N -1.468 117.887 119.070 0.474 0.000 2.551 1739 H HA 0.115 4.671 4.556 0.000 0.000 0.266 1739 H C 1.416 176.904 175.328 0.267 0.000 0.977 1739 H CA 0.799 57.054 56.048 0.346 0.000 1.163 1739 H CB -0.162 29.756 29.762 0.261 0.000 1.381 1739 H HN 0.309 nan 8.280 nan 0.000 0.581 1740 K N 0.268 120.462 120.400 -0.342 0.000 2.365 1740 K HA 0.018 4.338 4.320 0.000 0.000 0.197 1740 K C 0.294 176.464 176.600 -0.716 0.000 1.042 1740 K CA 0.621 56.549 56.287 -0.598 0.000 0.987 1740 K CB 0.295 32.242 32.500 -0.923 0.000 0.779 1740 K HN 0.354 nan 8.250 nan 0.000 0.484 1741 Y N -1.458 118.760 120.300 -0.137 0.000 2.500 1741 Y HA 0.176 4.727 4.550 0.001 0.000 0.246 1741 Y C 0.198 175.988 175.900 -0.183 0.000 1.146 1741 Y CA -1.173 56.778 58.100 -0.249 0.000 1.230 1741 Y CB 0.161 38.216 38.460 -0.675 0.000 1.214 1741 Y HN -0.128 nan 8.280 nan 0.000 0.526 1742 F N 3.956 123.940 119.950 0.056 0.000 2.578 1742 F HA 0.178 4.705 4.527 -0.000 0.000 0.381 1742 F C 0.148 176.046 175.800 0.165 0.000 1.069 1742 F CA -0.697 57.456 58.000 0.255 0.000 1.231 1742 F CB 0.506 39.682 39.000 0.293 0.000 1.086 1742 F HN -0.155 nan 8.300 nan 0.000 0.564 1743 K N 6.625 126.761 120.400 -0.440 0.000 2.316 1743 K HA 0.729 5.050 4.320 0.000 0.000 0.267 1743 K C -0.564 175.539 176.600 -0.829 0.000 1.025 1743 K CA -0.454 55.335 56.287 -0.829 0.000 0.896 1743 K CB 1.272 33.025 32.500 -1.246 0.000 1.124 1743 K HN 0.726 nan 8.250 nan 0.000 0.451 1744 A N 1.782 124.409 122.820 -0.322 0.000 2.568 1744 A HA 0.691 5.011 4.320 0.000 0.000 0.291 1744 A C -1.410 176.411 177.584 0.394 0.000 1.159 1744 A CA -0.668 51.422 52.037 0.088 0.000 0.679 1744 A CB 1.504 20.361 19.000 -0.238 0.000 1.285 1744 A HN 0.236 nan 8.150 nan 0.000 0.428 1745 V N 0.952 121.056 119.914 0.317 0.000 2.380 1745 V HA 0.759 4.880 4.120 0.000 0.000 0.286 1745 V C -0.190 176.070 176.094 0.277 0.000 1.015 1745 V CA 0.168 62.607 62.300 0.230 0.000 0.834 1745 V CB 0.654 32.525 31.823 0.079 0.000 1.009 1745 V HN 1.315 nan 8.190 nan 0.000 0.428 1746 S N 6.537 122.468 115.700 0.385 0.000 2.514 1746 S HA 0.227 4.697 4.470 0.000 0.000 0.183 1746 S C -1.964 172.969 174.600 0.555 0.000 0.656 1746 S CA -0.236 58.174 58.200 0.350 0.000 0.872 1746 S CB 1.368 64.716 63.200 0.246 0.000 1.436 1746 S HN 0.439 nan 8.310 nan 0.000 0.427 1747 P HA -0.179 nan 4.420 nan 0.000 0.214 1747 P C 1.676 179.147 177.300 0.284 0.000 1.169 1747 P CA 2.720 65.988 63.100 0.279 0.000 0.908 1747 P CB -0.244 31.541 31.700 0.141 0.000 0.791 1748 E N 0.415 120.732 120.200 0.195 0.000 2.095 1748 E HA -0.268 4.082 4.350 0.000 0.000 0.212 1748 E C 2.053 178.758 176.600 0.176 0.000 1.044 1748 E CA 2.350 58.842 56.400 0.153 0.000 0.857 1748 E CB -1.757 28.011 29.700 0.113 0.000 0.764 1748 E HN 0.264 nan 8.360 nan 0.000 0.462 1749 L N -0.950 120.371 121.223 0.163 0.000 2.156 1749 L HA 0.146 4.486 4.340 0.000 0.000 0.208 1749 L C 2.375 179.261 176.870 0.027 0.000 1.095 1749 L CA 1.781 56.651 54.840 0.049 0.000 0.770 1749 L CB -0.555 41.485 42.059 -0.033 0.000 0.914 1749 L HN 0.376 nan 8.230 nan 0.000 0.439 1750 F N -1.021 119.021 119.950 0.154 0.000 2.206 1750 F HA -0.164 4.363 4.527 0.000 0.000 0.298 1750 F C 2.698 178.591 175.800 0.156 0.000 1.090 1750 F CA 1.738 59.835 58.000 0.162 0.000 1.323 1750 F CB -0.591 38.505 39.000 0.159 0.000 1.028 1750 F HN 0.295 nan 8.300 nan 0.000 0.492 1751 H N 0.113 119.330 119.070 0.244 0.000 2.387 1751 H HA -0.140 4.416 4.556 0.000 0.000 0.299 1751 H C 2.093 177.493 175.328 0.120 0.000 1.099 1751 H CA 1.980 58.121 56.048 0.155 0.000 1.315 1751 H CB -0.057 29.772 29.762 0.112 0.000 1.380 1751 H HN 0.120 nan 8.280 nan 0.000 0.513 1752 V N 1.433 121.422 119.914 0.124 0.000 2.216 1752 V HA -0.260 3.860 4.120 0.000 0.000 0.243 1752 V C 2.916 179.030 176.094 0.033 0.000 1.044 1752 V CA 1.849 64.169 62.300 0.033 0.000 0.995 1752 V CB -0.779 31.050 31.823 0.009 0.000 0.633 1752 V HN 0.342 nan 8.190 nan 0.000 0.446 1753 I N 0.422 120.999 120.570 0.012 0.000 2.229 1753 I HA -0.338 3.832 4.170 0.000 0.000 0.250 1753 I C 2.221 178.414 176.117 0.126 0.000 1.096 1753 I CA 2.039 63.350 61.300 0.019 0.000 1.358 1753 I CB -0.426 37.530 38.000 -0.073 0.000 1.047 1753 I HN 0.411 nan 8.210 nan 0.000 0.422 1754 D N 0.424 120.899 120.400 0.124 0.000 2.110 1754 D HA -0.142 4.498 4.640 0.000 0.000 0.202 1754 D C 1.769 178.081 176.300 0.020 0.000 0.975 1754 D CA 1.067 55.124 54.000 0.096 0.000 0.839 1754 D CB -0.280 40.597 40.800 0.128 0.000 0.996 1754 D HN 0.176 nan 8.370 nan 0.000 0.464 1755 D N -0.511 119.840 120.400 -0.081 0.000 2.190 1755 D HA -0.175 4.465 4.640 0.000 0.000 0.200 1755 D C 1.610 177.920 176.300 0.017 0.000 0.992 1755 D CA 0.571 54.501 54.000 -0.117 0.000 0.854 1755 D CB -0.233 40.404 40.800 -0.272 0.000 0.936 1755 D HN 0.183 nan 8.370 nan 0.000 0.462 1756 F N 0.509 120.413 119.950 -0.076 0.000 2.098 1756 F HA -0.181 4.346 4.527 -0.000 0.000 0.294 1756 F C 2.177 177.974 175.800 -0.004 0.000 1.107 1756 F CA 0.903 58.884 58.000 -0.031 0.000 1.234 1756 F CB -0.131 38.832 39.000 -0.062 0.000 1.002 1756 F HN -0.187 nan 8.300 nan 0.000 0.472 1757 V N 0.808 120.702 119.914 -0.034 0.000 2.392 1757 V HA -0.347 3.773 4.120 0.000 0.000 0.249 1757 V C 2.680 178.683 176.094 -0.151 0.000 1.059 1757 V CA 2.582 64.773 62.300 -0.182 0.000 1.051 1757 V CB -1.875 29.824 31.823 -0.205 0.000 0.658 1757 V HN 0.481 nan 8.190 nan 0.000 0.455 1758 K N -0.263 120.099 120.400 -0.064 0.000 2.057 1758 K HA -0.150 4.171 4.320 0.000 0.000 0.206 1758 K C 2.018 178.602 176.600 -0.027 0.000 1.050 1758 K CA 1.658 57.927 56.287 -0.030 0.000 0.935 1758 K CB -1.127 31.376 32.500 0.005 0.000 0.715 1758 K HN 0.526 nan 8.250 nan 0.000 0.439 1759 F N 1.718 121.551 119.950 -0.195 0.000 2.065 1759 F HA -0.333 4.194 4.527 0.000 0.000 0.298 1759 F C 2.676 178.337 175.800 -0.232 0.000 1.112 1759 F CA 1.911 59.787 58.000 -0.207 0.000 1.212 1759 F CB 0.191 39.039 39.000 -0.254 0.000 0.975 1759 F HN 0.238 nan 8.300 nan 0.000 0.476 1760 Q N 0.458 120.021 119.800 -0.395 0.000 2.077 1760 Q HA -0.241 4.099 4.340 0.000 0.000 0.206 1760 Q C 2.490 178.276 176.000 -0.356 0.000 0.989 1760 Q CA 1.819 57.345 55.803 -0.461 0.000 0.853 1760 Q CB -0.949 27.552 28.738 -0.395 0.000 0.907 1760 Q HN 0.517 nan 8.270 nan 0.000 0.418 1761 L N 0.298 121.374 121.223 -0.244 0.000 2.072 1761 L HA -0.173 4.167 4.340 0.000 0.000 0.205 1761 L C 2.432 179.202 176.870 -0.167 0.000 1.079 1761 L CA 1.025 55.760 54.840 -0.174 0.000 0.752 1761 L CB -0.228 41.767 42.059 -0.108 0.000 0.906 1761 L HN 0.250 nan 8.230 nan 0.000 0.436 1762 E N 0.623 120.723 120.200 -0.167 0.000 2.048 1762 E HA -0.324 4.026 4.350 0.000 0.000 0.202 1762 E C 2.119 178.612 176.600 -0.177 0.000 1.021 1762 E CA 1.716 58.032 56.400 -0.140 0.000 0.825 1762 E CB -0.131 29.500 29.700 -0.114 0.000 0.756 1762 E HN 0.047 nan 8.360 nan 0.000 0.454 1763 K N 0.291 120.515 120.400 -0.294 0.000 2.318 1763 K HA -0.214 4.106 4.320 0.000 0.000 0.204 1763 K C 0.151 176.631 176.600 -0.200 0.000 1.044 1763 K CA 1.331 57.435 56.287 -0.304 0.000 0.932 1763 K CB -0.313 31.882 32.500 -0.508 0.000 0.734 1763 K HN 0.253 nan 8.250 nan 0.000 0.473 1764 N N 1.486 120.083 118.700 -0.173 0.000 2.453 1764 N HA 0.050 4.790 4.740 0.000 0.000 0.270 1764 N C -0.792 174.660 175.510 -0.096 0.000 1.195 1764 N CA 0.052 53.020 53.050 -0.136 0.000 0.902 1764 N CB 0.760 39.156 38.487 -0.151 0.000 1.186 1764 N HN 0.245 nan 8.380 nan 0.000 0.510 1785 D N 2.098 122.457 120.400 -0.068 0.000 2.456 1785 D HA 0.341 4.981 4.640 0.000 0.000 0.219 1785 D C -0.777 175.363 176.300 -0.267 0.000 1.126 1785 D CA -0.121 53.810 54.000 -0.114 0.000 0.890 1785 D CB -0.005 40.749 40.800 -0.077 0.000 1.025 1785 D HN 0.188 nan 8.370 nan 0.000 0.511 1786 I N 3.197 123.597 120.570 -0.282 0.000 2.611 1786 I HA 0.084 4.254 4.170 0.000 0.000 0.287 1786 I C 0.269 176.342 176.117 -0.074 0.000 1.184 1786 I CA -0.601 60.485 61.300 -0.356 0.000 1.054 1786 I CB 1.792 39.247 38.000 -0.909 0.000 1.257 1786 I HN 0.382 nan 8.210 nan 0.000 0.435 1787 E N 5.107 125.287 120.200 -0.032 0.000 2.391 1787 E HA 0.395 4.746 4.350 0.000 0.000 0.255 1787 E C -1.276 175.325 176.600 0.003 0.000 1.187 1787 E CA -0.175 56.221 56.400 -0.007 0.000 0.941 1787 E CB 1.687 31.369 29.700 -0.030 0.000 1.010 1787 E HN 0.319 nan 8.360 nan 0.000 0.458 1788 V N 4.191 124.017 119.914 -0.147 0.000 2.487 1788 V HA 0.262 4.382 4.120 0.000 0.000 0.298 1788 V C -2.194 173.608 176.094 -0.485 0.000 1.028 1788 V CA -1.583 60.432 62.300 -0.474 0.000 0.860 1788 V CB 1.565 33.208 31.823 -0.300 0.000 0.991 1788 V HN 0.635 nan 8.190 nan 0.000 0.427 1789 P HA 0.139 nan 4.420 nan 0.000 0.266 1789 P C 0.576 177.648 177.300 -0.379 0.000 1.419 1789 P CA -0.021 62.792 63.100 -0.478 0.000 1.112 1789 P CB 0.714 32.086 31.700 -0.545 0.000 1.438 1790 K N 3.751 124.009 120.400 -0.236 0.000 2.032 1790 K HA -0.258 4.062 4.320 0.000 0.000 0.218 1790 K C 2.018 178.528 176.600 -0.150 0.000 1.054 1790 K CA 2.224 58.421 56.287 -0.149 0.000 0.941 1790 K CB -0.656 31.806 32.500 -0.063 0.000 0.720 1790 K HN 0.366 nan 8.250 nan 0.000 0.449 1791 A N 0.373 123.097 122.820 -0.160 0.000 2.159 1791 A HA -0.217 4.103 4.320 0.000 0.000 0.222 1791 A C 1.852 179.279 177.584 -0.263 0.000 1.163 1791 A CA 1.837 53.774 52.037 -0.166 0.000 0.664 1791 A CB -0.441 18.411 19.000 -0.247 0.000 0.803 1791 A HN 0.338 nan 8.150 nan 0.000 0.470 1792 M N -1.652 117.791 119.600 -0.261 0.000 2.509 1792 M HA 0.065 4.545 4.480 0.000 0.000 0.250 1792 M C 2.091 178.331 176.300 -0.100 0.000 1.132 1792 M CA 1.012 56.192 55.300 -0.199 0.000 1.080 1792 M CB -0.799 31.699 32.600 -0.171 0.000 1.408 1792 M HN 0.447 nan 8.290 nan 0.000 0.484 1793 G N 0.740 109.503 108.800 -0.062 0.000 2.396 1793 G HA2 -0.144 3.816 3.960 0.000 0.000 0.214 1793 G HA3 -0.144 3.816 3.960 0.000 0.000 0.214 1793 G C 1.100 176.022 174.900 0.037 0.000 1.166 1793 G CA 0.336 45.484 45.100 0.080 0.000 0.793 1793 G HN 0.321 nan 8.290 nan 0.000 0.533 1794 D N 1.067 121.434 120.400 -0.055 0.000 2.190 1794 D HA -0.148 4.492 4.640 0.000 0.000 0.200 1794 D C 2.548 178.625 176.300 -0.373 0.000 0.992 1794 D CA 1.271 55.179 54.000 -0.154 0.000 0.854 1794 D CB -0.121 40.600 40.800 -0.132 0.000 0.936 1794 D HN 0.607 nan 8.370 nan 0.000 0.462 1795 I N -2.997 117.366 120.570 -0.345 0.000 3.030 1795 I HA 0.025 4.195 4.170 0.000 0.000 0.270 1795 I C 2.114 178.153 176.117 -0.130 0.000 1.211 1795 I CA 0.158 61.238 61.300 -0.367 0.000 1.479 1795 I CB -0.372 37.475 38.000 -0.254 0.000 1.105 1795 I HN -0.264 nan 8.210 nan 0.000 0.447 1796 F N 2.717 122.493 119.950 -0.291 0.000 2.234 1796 F HA -0.082 4.445 4.527 0.001 0.000 0.299 1796 F C 2.264 177.888 175.800 -0.295 0.000 1.087 1796 F CA 1.623 59.425 58.000 -0.331 0.000 1.340 1796 F CB -0.023 38.692 39.000 -0.474 0.000 1.031 1796 F HN 0.095 nan 8.300 nan 0.000 0.500 1797 E N -0.145 119.917 120.200 -0.231 0.000 2.004 1797 E HA -0.198 4.152 4.350 0.000 0.000 0.192 1797 E C 2.374 178.815 176.600 -0.265 0.000 0.987 1797 E CA 1.549 57.755 56.400 -0.322 0.000 0.822 1797 E CB -0.517 29.074 29.700 -0.182 0.000 0.779 1797 E HN 0.409 nan 8.360 nan 0.000 0.458 1798 S N 1.508 117.068 115.700 -0.232 0.000 2.414 1798 S HA -0.293 4.177 4.470 0.000 0.000 0.241 1798 S C 2.052 176.579 174.600 -0.122 0.000 1.079 1798 S CA 1.660 59.754 58.200 -0.177 0.000 1.087 1798 S CB -0.679 62.354 63.200 -0.279 0.000 0.927 1798 S HN 0.178 nan 8.310 nan 0.000 0.456 1799 L N 2.190 123.341 121.223 -0.120 0.000 2.005 1799 L HA 0.128 4.468 4.340 0.000 0.000 0.207 1799 L C 2.877 179.786 176.870 0.065 0.000 1.072 1799 L CA 1.821 56.671 54.840 0.015 0.000 0.744 1799 L CB -1.346 40.806 42.059 0.154 0.000 0.895 1799 L HN 0.376 nan 8.230 nan 0.000 0.433 1800 A N -0.444 122.326 122.820 -0.084 0.000 1.915 1800 A HA -0.267 4.053 4.320 0.000 0.000 0.220 1800 A C 2.322 179.832 177.584 -0.124 0.000 1.198 1800 A CA 2.233 54.111 52.037 -0.265 0.000 0.647 1800 A CB -1.770 16.837 19.000 -0.655 0.000 0.825 1800 A HN 0.565 nan 8.150 nan 0.000 0.456 1801 G N -0.901 107.822 108.800 -0.128 0.000 2.511 1801 G HA2 -0.030 3.930 3.960 0.000 0.000 0.216 1801 G HA3 -0.030 3.930 3.960 0.000 0.000 0.216 1801 G C 1.851 176.766 174.900 0.024 0.000 1.218 1801 G CA 2.199 47.254 45.100 -0.074 0.000 0.788 1801 G HN 1.060 nan 8.290 nan 0.000 0.560 1802 A N 1.023 123.871 122.820 0.047 0.000 1.893 1802 A HA -0.243 4.077 4.320 0.000 0.000 0.222 1802 A C 2.434 180.149 177.584 0.218 0.000 1.309 1802 A CA 2.138 54.267 52.037 0.154 0.000 0.681 1802 A CB -0.759 18.413 19.000 0.286 0.000 0.842 1802 A HN 0.397 nan 8.150 nan 0.000 0.468 1803 I N -2.224 118.455 120.570 0.181 0.000 2.163 1803 I HA -0.287 3.883 4.170 0.000 0.000 0.243 1803 I C 2.495 178.544 176.117 -0.114 0.000 1.085 1803 I CA 2.240 63.473 61.300 -0.112 0.000 1.347 1803 I CB -0.676 37.185 38.000 -0.231 0.000 1.044 1803 I HN 0.641 nan 8.210 nan 0.000 0.408 1804 Y N 1.635 121.843 120.300 -0.152 0.000 2.030 1804 Y HA -0.338 4.214 4.550 0.002 0.000 0.274 1804 Y C 2.732 178.577 175.900 -0.092 0.000 1.153 1804 Y CA 1.913 59.939 58.100 -0.123 0.000 1.115 1804 Y CB -0.285 38.105 38.460 -0.117 0.000 0.969 1804 Y HN 0.006 nan 8.280 nan 0.000 0.488 1805 M N 0.316 119.922 119.600 0.010 0.000 2.337 1805 M HA -0.225 4.255 4.480 0.000 0.000 0.261 1805 M C 1.579 177.836 176.300 -0.071 0.000 1.067 1805 M CA 1.939 57.142 55.300 -0.162 0.000 1.074 1805 M CB -1.237 31.149 32.600 -0.357 0.000 1.395 1805 M HN 0.479 nan 8.290 nan 0.000 0.431 1806 D N 0.004 120.434 120.400 0.050 0.000 2.162 1806 D HA -0.039 4.601 4.640 0.000 0.000 0.205 1806 D C 1.436 177.796 176.300 0.100 0.000 0.964 1806 D CA 1.231 55.386 54.000 0.257 0.000 0.847 1806 D CB 0.217 41.145 40.800 0.213 0.000 0.988 1806 D HN 0.314 nan 8.370 nan 0.000 0.480 1807 S N -0.971 114.710 115.700 -0.031 0.000 2.754 1807 S HA 0.339 4.809 4.470 0.000 0.000 0.223 1807 S C 1.448 175.978 174.600 -0.116 0.000 0.951 1807 S CA 0.191 58.359 58.200 -0.052 0.000 0.954 1807 S CB -0.103 63.041 63.200 -0.093 0.000 0.780 1807 S HN 0.458 nan 8.310 nan 0.000 0.509 1808 G N 1.847 110.564 108.800 -0.137 0.000 2.212 1808 G HA2 -0.299 3.661 3.960 0.000 0.000 0.255 1808 G HA3 -0.299 3.661 3.960 0.000 0.000 0.255 1808 G C 0.266 174.954 174.900 -0.352 0.000 1.062 1808 G CA -0.176 44.826 45.100 -0.164 0.000 0.815 1808 G HN 0.701 nan 8.290 nan 0.000 0.497 1809 M N -1.215 117.966 119.600 -0.698 0.000 2.417 1809 M HA -0.158 4.322 4.480 0.000 0.000 0.205 1809 M C 0.555 176.357 176.300 -0.831 0.000 0.452 1809 M CA 1.088 55.488 55.300 -1.501 0.000 0.512 1809 M CB -1.885 30.250 32.600 -0.775 0.000 1.774 1809 M HN 0.999 nan 8.290 nan 0.000 0.874 1810 S N 0.358 115.770 115.700 -0.479 0.000 2.410 1810 S HA 0.513 4.983 4.470 0.000 0.000 0.304 1810 S C 1.033 175.678 174.600 0.075 0.000 1.095 1810 S CA -0.849 57.272 58.200 -0.132 0.000 1.089 1810 S CB 0.806 63.959 63.200 -0.079 0.000 0.968 1810 S HN 0.529 nan 8.310 nan 0.000 0.480 1811 L N 3.711 125.036 121.223 0.171 0.000 2.081 1811 L HA -0.141 4.199 4.340 0.000 0.000 0.212 1811 L C 2.168 179.141 176.870 0.172 0.000 1.080 1811 L CA 1.447 56.403 54.840 0.194 0.000 0.754 1811 L CB -0.378 41.767 42.059 0.143 0.000 0.893 1811 L HN 0.578 nan 8.230 nan 0.000 0.433 1812 E N -0.523 119.752 120.200 0.125 0.000 2.072 1812 E HA -0.140 4.210 4.350 0.000 0.000 0.190 1812 E C 2.205 178.892 176.600 0.145 0.000 0.982 1812 E CA 0.709 57.198 56.400 0.149 0.000 0.803 1812 E CB -0.620 29.133 29.700 0.089 0.000 0.755 1812 E HN 0.131 nan 8.360 nan 0.000 0.453 1813 V N 0.538 120.491 119.914 0.065 0.000 2.231 1813 V HA -0.275 3.845 4.120 0.000 0.000 0.248 1813 V C 2.261 178.351 176.094 -0.007 0.000 1.054 1813 V CA 1.720 64.017 62.300 -0.004 0.000 1.015 1813 V CB -0.500 31.277 31.823 -0.077 0.000 0.638 1813 V HN 0.138 nan 8.190 nan 0.000 0.444 1814 V N -1.062 118.876 119.914 0.040 0.000 2.380 1814 V HA -0.334 3.786 4.120 0.000 0.000 0.251 1814 V C 2.043 178.265 176.094 0.213 0.000 1.063 1814 V CA 2.514 64.860 62.300 0.076 0.000 1.055 1814 V CB -0.643 31.246 31.823 0.110 0.000 0.657 1814 V HN 0.760 nan 8.190 nan 0.000 0.455 1815 W N 0.117 121.425 121.300 0.013 0.000 2.388 1815 W HA -0.199 4.460 4.660 -0.003 0.000 0.294 1815 W C 2.466 179.020 176.519 0.058 0.000 1.212 1815 W CA 1.423 58.795 57.345 0.046 0.000 1.271 1815 W CB -0.035 29.436 29.460 0.018 0.000 1.126 1815 W HN 0.309 nan 8.180 nan 0.000 0.535 1816 Q N -0.137 119.688 119.800 0.041 0.000 2.133 1816 Q HA -0.264 4.076 4.340 0.000 0.000 0.208 1816 Q C 2.010 177.928 176.000 -0.137 0.000 0.991 1816 Q CA 2.879 58.644 55.803 -0.063 0.000 0.867 1816 Q CB -0.500 28.223 28.738 -0.024 0.000 0.911 1816 Q HN 0.140 nan 8.270 nan 0.000 0.417 1817 V N -1.144 118.695 119.914 -0.125 0.000 2.379 1817 V HA -0.212 3.908 4.120 0.000 0.000 0.245 1817 V C 1.455 177.369 176.094 -0.299 0.000 1.044 1817 V CA 1.673 63.851 62.300 -0.203 0.000 1.036 1817 V CB -0.474 31.216 31.823 -0.221 0.000 0.664 1817 V HN 0.360 nan 8.190 nan 0.000 0.453 1818 Y N -1.950 118.136 120.300 -0.356 0.000 2.436 1818 Y HA -0.015 4.535 4.550 -0.001 0.000 0.288 1818 Y C 2.315 177.858 175.900 -0.596 0.000 1.112 1818 Y CA 0.846 58.706 58.100 -0.400 0.000 1.220 1818 Y CB -0.290 38.009 38.460 -0.268 0.000 1.073 1818 Y HN 0.192 nan 8.280 nan 0.000 0.552 1819 Y N 1.937 121.572 120.300 -1.109 0.000 2.003 1819 Y HA -0.328 4.224 4.550 0.002 0.000 0.261 1819 Y C -0.843 174.736 175.900 -0.536 0.000 1.211 1819 Y CA 2.298 59.677 58.100 -1.203 0.000 1.098 1819 Y CB -1.906 35.787 38.460 -1.278 0.000 0.925 1819 Y HN 0.049 nan 8.280 nan 0.000 0.498 1820 P HA -0.270 nan 4.420 nan 0.000 0.218 1820 P C 1.811 178.872 177.300 -0.398 0.000 1.152 1820 P CA 2.801 65.648 63.100 -0.422 0.000 0.857 1820 P CB -0.339 31.185 31.700 -0.294 0.000 0.787 1821 M N -2.670 116.693 119.600 -0.394 0.000 2.334 1821 M HA 0.053 4.533 4.480 0.000 0.000 0.266 1821 M C 1.957 178.207 176.300 -0.084 0.000 1.082 1821 M CA 1.478 56.612 55.300 -0.277 0.000 1.141 1821 M CB -0.505 31.879 32.600 -0.360 0.000 1.380 1821 M HN -0.017 nan 8.290 nan 0.000 0.440 1822 M N -0.968 118.545 119.600 -0.144 0.000 2.514 1822 M HA 0.055 4.535 4.480 0.000 0.000 0.258 1822 M C 1.926 178.089 176.300 -0.228 0.000 1.159 1822 M CA 0.356 55.600 55.300 -0.093 0.000 1.116 1822 M CB -0.606 32.028 32.600 0.056 0.000 1.333 1822 M HN 0.192 nan 8.290 nan 0.000 0.487 1823 Q N 2.534 122.027 119.800 -0.513 0.000 2.156 1823 Q HA -0.173 4.167 4.340 0.000 0.000 0.211 1823 Q C -0.863 174.966 176.000 -0.285 0.000 0.995 1823 Q CA 2.499 57.895 55.803 -0.678 0.000 0.877 1823 Q CB -1.163 26.797 28.738 -1.297 0.000 0.920 1823 Q HN 0.349 nan 8.270 nan 0.000 0.416 1824 P HA -0.089 nan 4.420 nan 0.000 0.217 1824 P C 1.702 178.926 177.300 -0.125 0.000 1.154 1824 P CA 0.595 63.618 63.100 -0.128 0.000 0.841 1824 P CB -0.205 31.435 31.700 -0.100 0.000 0.790 1825 L N -0.116 121.006 121.223 -0.169 0.000 2.027 1825 L HA -0.045 4.295 4.340 0.000 0.000 0.206 1825 L C 2.585 179.274 176.870 -0.301 0.000 1.074 1825 L CA 1.497 56.166 54.840 -0.285 0.000 0.745 1825 L CB -1.396 40.470 42.059 -0.322 0.000 0.898 1825 L HN -0.215 nan 8.230 nan 0.000 0.433 1826 I N -0.577 119.900 120.570 -0.156 0.000 2.264 1826 I HA -0.298 3.872 4.170 0.000 0.000 0.248 1826 I C 2.454 178.615 176.117 0.075 0.000 1.111 1826 I CA 1.437 62.726 61.300 -0.018 0.000 1.382 1826 I CB -0.104 37.955 38.000 0.099 0.000 1.060 1826 I HN 0.361 nan 8.210 nan 0.000 0.418 1827 E N 1.582 121.811 120.200 0.048 0.000 2.072 1827 E HA -0.192 4.159 4.350 0.000 0.000 0.190 1827 E C 2.217 178.879 176.600 0.104 0.000 0.982 1827 E CA 2.086 58.547 56.400 0.102 0.000 0.803 1827 E CB -0.217 29.528 29.700 0.075 0.000 0.755 1827 E HN 0.304 nan 8.360 nan 0.000 0.453 1828 K N -0.174 120.258 120.400 0.054 0.000 2.362 1828 K HA -0.055 4.265 4.320 0.000 0.000 0.200 1828 K C 1.898 178.652 176.600 0.257 0.000 1.046 1828 K CA 1.180 57.525 56.287 0.097 0.000 0.952 1828 K CB -0.816 31.706 32.500 0.036 0.000 0.753 1828 K HN 0.148 nan 8.250 nan 0.000 0.466 1829 F N 1.020 120.988 119.950 0.031 0.000 2.234 1829 F HA 0.047 4.574 4.527 0.000 0.000 0.296 1829 F C 2.497 178.311 175.800 0.024 0.000 1.089 1829 F CA 0.938 58.949 58.000 0.018 0.000 1.343 1829 F CB -0.187 38.821 39.000 0.013 0.000 1.040 1829 F HN 0.191 nan 8.300 nan 0.000 0.498 1830 S N -0.158 115.701 115.700 0.266 0.000 2.406 1830 S HA 0.042 4.512 4.470 0.000 0.000 0.224 1830 S C 2.322 177.023 174.600 0.169 0.000 1.030 1830 S CA 0.663 58.984 58.200 0.203 0.000 0.958 1830 S CB -0.523 62.839 63.200 0.269 0.000 0.811 1830 S HN 0.263 nan 8.310 nan 0.000 0.489 1831 A N 2.018 124.923 122.820 0.143 0.000 2.032 1831 A HA -0.101 4.219 4.320 0.000 0.000 0.221 1831 A C 0.915 178.546 177.584 0.079 0.000 1.165 1831 A CA 1.358 53.455 52.037 0.100 0.000 0.645 1831 A CB -0.493 18.556 19.000 0.082 0.000 0.807 1831 A HN 0.503 nan 8.150 nan 0.000 0.453 1832 N N -0.575 118.173 118.700 0.080 0.000 3.170 1832 N HA 0.408 5.148 4.740 0.000 0.000 0.305 1832 N C -0.821 174.692 175.510 0.004 0.000 1.499 1832 N CA 0.295 53.369 53.050 0.040 0.000 1.110 1832 N CB 1.106 39.620 38.487 0.044 0.000 1.390 1832 N HN 0.340 nan 8.380 nan 0.000 0.508 1833 V N -3.157 116.767 119.914 0.017 0.000 3.206 1833 V HA 0.672 4.792 4.120 0.000 0.000 0.305 1833 V C -2.520 173.583 176.094 0.015 0.000 1.257 1833 V CA -2.467 59.830 62.300 -0.004 0.000 1.057 1833 V CB 1.014 32.838 31.823 0.001 0.000 1.075 1833 V HN -0.089 nan 8.190 nan 0.000 0.443 1834 P HA 0.095 nan 4.420 nan 0.000 0.247 1834 P C -0.292 177.031 177.300 0.038 0.000 1.141 1834 P CA 0.222 63.328 63.100 0.010 0.000 0.858 1834 P CB -0.058 31.640 31.700 -0.004 0.000 0.804 1835 R N 2.562 123.077 120.500 0.024 0.000 2.637 1835 R HA 0.004 4.344 4.340 0.000 0.000 0.331 1835 R C 0.555 176.858 176.300 0.004 0.000 1.166 1835 R CA 0.186 56.296 56.100 0.016 0.000 0.993 1835 R CB -0.735 29.565 30.300 0.000 0.000 1.012 1835 R HN 0.362 nan 8.270 nan 0.000 0.461 1836 S N 4.395 120.101 115.700 0.010 0.000 3.074 1836 S HA -0.027 4.443 4.470 0.000 0.000 0.359 1836 S C -1.155 173.431 174.600 -0.022 0.000 1.207 1836 S CA -0.967 57.226 58.200 -0.011 0.000 1.061 1836 S CB 0.527 63.715 63.200 -0.022 0.000 0.769 1836 S HN 0.368 nan 8.310 nan 0.000 0.512 1837 P HA 0.028 nan 4.420 nan 0.000 0.226 1837 P C 1.478 178.787 177.300 0.015 0.000 1.161 1837 P CA 0.243 63.338 63.100 -0.009 0.000 0.804 1837 P CB -0.021 31.672 31.700 -0.012 0.000 0.829 1838 V N 0.802 120.725 119.914 0.016 0.000 2.216 1838 V HA -0.231 3.889 4.120 0.000 0.000 0.243 1838 V C 2.719 178.839 176.094 0.043 0.000 1.044 1838 V CA 2.068 64.408 62.300 0.066 0.000 0.995 1838 V CB -1.138 30.675 31.823 -0.016 0.000 0.633 1838 V HN -0.030 nan 8.190 nan 0.000 0.446 1839 R N 0.188 120.682 120.500 -0.009 0.000 2.096 1839 R HA -0.227 4.114 4.340 0.000 0.000 0.240 1839 R C 2.278 178.564 176.300 -0.023 0.000 1.139 1839 R CA 2.094 58.177 56.100 -0.028 0.000 0.952 1839 R CB -0.766 29.494 30.300 -0.068 0.000 0.854 1839 R HN 0.680 nan 8.270 nan 0.000 0.436 1840 E N -0.958 119.228 120.200 -0.023 0.000 2.197 1840 E HA -0.242 4.109 4.350 0.000 0.000 0.205 1840 E C 1.168 177.759 176.600 -0.017 0.000 1.029 1840 E CA 2.289 58.677 56.400 -0.021 0.000 0.828 1840 E CB -0.059 29.629 29.700 -0.019 0.000 0.737 1840 E HN 0.329 nan 8.360 nan 0.000 0.464 1841 L N -0.639 120.582 121.223 -0.003 0.000 3.184 1841 L HA 0.380 4.721 4.340 0.000 0.000 0.283 1841 L C 1.641 178.508 176.870 -0.006 0.000 1.218 1841 L CA -0.054 54.780 54.840 -0.009 0.000 1.028 1841 L CB -0.579 41.465 42.059 -0.025 0.000 1.400 1841 L HN 0.102 nan 8.230 nan 0.000 0.591 1842 L N 0.008 121.241 121.223 0.017 0.000 1.989 1842 L HA -0.167 4.173 4.340 0.000 0.000 0.211 1842 L C 3.216 180.081 176.870 -0.009 0.000 1.071 1842 L CA 2.103 56.949 54.840 0.010 0.000 0.749 1842 L CB -0.873 41.205 42.059 0.032 0.000 0.890 1842 L HN 0.708 nan 8.230 nan 0.000 0.431 1843 E N 0.424 120.616 120.200 -0.013 0.000 2.028 1843 E HA -0.349 4.001 4.350 0.000 0.000 0.217 1843 E C 1.891 178.479 176.600 -0.019 0.000 1.039 1843 E CA 2.223 58.612 56.400 -0.018 0.000 0.882 1843 E CB -0.971 28.715 29.700 -0.024 0.000 0.794 1843 E HN 0.312 nan 8.360 nan 0.000 0.488 1844 M N 0.175 119.763 119.600 -0.020 0.000 3.948 1844 M HA -0.213 4.267 4.480 0.000 0.000 0.286 1844 M C 0.691 176.977 176.300 -0.023 0.000 0.972 1844 M CA 2.063 57.349 55.300 -0.023 0.000 1.017 1844 M CB -1.160 31.423 32.600 -0.028 0.000 1.295 1844 M HN 0.550 nan 8.290 nan 0.000 0.629 1845 E N -0.377 119.806 120.200 -0.028 0.000 2.267 1845 E HA 0.223 4.573 4.350 0.000 0.000 0.248 1845 E C -1.792 174.789 176.600 -0.033 0.000 0.899 1845 E CA -1.563 54.819 56.400 -0.029 0.000 0.764 1845 E CB 2.130 31.810 29.700 -0.033 0.000 1.227 1845 E HN 0.227 nan 8.360 nan 0.000 0.421 1846 P HA -0.215 nan 4.420 nan 0.000 0.202 1846 P C 0.904 178.191 177.300 -0.021 0.000 1.171 1846 P CA 1.560 64.648 63.100 -0.019 0.000 0.925 1846 P CB 0.283 31.975 31.700 -0.014 0.000 0.760 1847 E N -0.068 120.120 120.200 -0.019 0.000 2.474 1847 E HA -0.003 4.347 4.350 0.000 0.000 0.195 1847 E C 0.867 177.449 176.600 -0.030 0.000 1.039 1847 E CA 0.639 57.027 56.400 -0.019 0.000 0.881 1847 E CB -1.046 28.648 29.700 -0.011 0.000 0.970 1847 E HN 0.301 nan 8.360 nan 0.000 0.486 1848 T N -1.511 113.021 114.554 -0.036 0.000 3.223 1848 T HA 0.633 4.983 4.350 0.000 0.000 0.259 1848 T C 0.290 174.953 174.700 -0.061 0.000 1.015 1848 T CA -0.074 62.002 62.100 -0.040 0.000 0.908 1848 T CB 0.156 69.008 68.868 -0.027 0.000 1.054 1848 T HN 0.251 nan 8.240 nan 0.000 0.567 1849 A N 0.099 122.861 122.820 -0.097 0.000 2.408 1849 A HA 0.829 5.149 4.320 0.000 0.000 0.295 1849 A C -0.307 177.125 177.584 -0.254 0.000 1.040 1849 A CA -0.855 51.079 52.037 -0.173 0.000 0.707 1849 A CB 1.230 20.107 19.000 -0.205 0.000 1.235 1849 A HN 0.689 nan 8.150 nan 0.000 0.418 1850 K N 1.163 121.397 120.400 -0.276 0.000 2.318 1850 K HA 0.841 5.161 4.320 0.000 0.000 0.249 1850 K C -1.629 174.806 176.600 -0.275 0.000 0.942 1850 K CA -0.533 55.625 56.287 -0.215 0.000 0.808 1850 K CB 1.279 33.733 32.500 -0.076 0.000 1.189 1850 K HN 0.676 nan 8.250 nan 0.000 0.428 1851 F N 1.642 121.618 119.950 0.042 0.000 2.449 1851 F HA 0.368 4.895 4.527 -0.000 0.000 0.342 1851 F C 1.199 177.042 175.800 0.071 0.000 1.127 1851 F CA -1.034 57.002 58.000 0.061 0.000 0.975 1851 F CB 2.005 41.042 39.000 0.061 0.000 1.146 1851 F HN 0.643 nan 8.300 nan 0.000 0.444 1852 S N 4.334 120.207 115.700 0.288 0.000 2.558 1852 S HA 0.222 4.692 4.470 0.000 0.000 0.287 1852 S C -2.367 172.332 174.600 0.166 0.000 1.321 1852 S CA -1.068 57.235 58.200 0.172 0.000 1.048 1852 S CB 0.085 63.365 63.200 0.132 0.000 0.844 1852 S HN 0.328 nan 8.310 nan 0.000 0.512 1853 P HA 0.180 nan 4.420 nan 0.000 0.271 1853 P C -0.475 176.807 177.300 -0.030 0.000 1.228 1853 P CA 0.126 63.241 63.100 0.024 0.000 0.797 1853 P CB 0.069 31.763 31.700 -0.010 0.000 0.914 1854 A N 0.766 123.459 122.820 -0.211 0.000 2.316 1854 A HA 0.457 4.777 4.320 0.000 0.000 0.284 1854 A C 0.081 177.561 177.584 -0.173 0.000 1.115 1854 A CA -0.209 51.647 52.037 -0.303 0.000 0.812 1854 A CB 0.025 18.563 19.000 -0.769 0.000 1.064 1854 A HN 0.624 nan 8.150 nan 0.000 0.489 1855 E N 2.066 122.198 120.200 -0.112 0.000 2.292 1855 E HA 0.502 4.852 4.350 0.000 0.000 0.272 1855 E C -0.385 176.164 176.600 -0.086 0.000 0.881 1855 E CA -1.008 55.338 56.400 -0.091 0.000 0.754 1855 E CB 1.424 31.085 29.700 -0.065 0.000 1.201 1855 E HN 0.727 nan 8.360 nan 0.000 0.425 1856 R N 1.919 122.369 120.500 -0.083 0.000 2.531 1856 R HA 0.501 4.841 4.340 0.000 0.000 0.260 1856 R C -0.477 175.772 176.300 -0.085 0.000 1.144 1856 R CA 0.135 56.194 56.100 -0.069 0.000 1.171 1856 R CB 0.640 30.909 30.300 -0.053 0.000 1.199 1856 R HN 0.743 nan 8.270 nan 0.000 0.594 1857 T N -3.087 111.426 114.554 -0.068 0.000 2.831 1857 T HA 0.363 4.713 4.350 0.000 0.000 0.287 1857 T C 0.797 175.477 174.700 -0.033 0.000 1.070 1857 T CA -0.681 61.350 62.100 -0.114 0.000 1.010 1857 T CB 0.576 69.389 68.868 -0.092 0.000 1.264 1857 T HN 0.365 nan 8.240 nan 0.000 0.532 1858 Y N 1.145 121.445 120.300 0.000 0.000 2.200 1858 Y HA 0.042 4.592 4.550 0.000 0.000 0.290 1858 Y C 2.140 178.040 175.900 0.000 0.000 1.137 1858 Y CA 1.587 59.687 58.100 -0.000 0.000 1.163 1858 Y CB -0.475 37.986 38.460 0.001 0.000 0.988 1858 Y HN 0.736 nan 8.280 nan 0.000 0.518 1859 D N -0.623 119.871 120.400 0.156 0.000 2.519 1859 D HA 0.124 4.764 4.640 0.000 0.000 0.238 1859 D C 1.169 177.501 176.300 0.053 0.000 1.192 1859 D CA 0.593 54.645 54.000 0.086 0.000 0.835 1859 D CB -0.665 40.175 40.800 0.068 0.000 0.975 1859 D HN 0.351 nan 8.370 nan 0.000 0.490 1860 G N 1.780 110.610 108.800 0.050 0.000 2.371 1860 G HA2 -0.293 3.668 3.960 0.000 0.000 0.299 1860 G HA3 -0.293 3.668 3.960 0.000 0.000 0.299 1860 G C 0.034 174.943 174.900 0.015 0.000 1.014 1860 G CA 0.192 45.308 45.100 0.026 0.000 1.097 1860 G HN 0.463 nan 8.290 nan 0.000 0.512 1861 K N -0.924 119.481 120.400 0.009 0.000 2.313 1861 K HA 0.752 5.072 4.320 0.000 0.000 0.235 1861 K C 0.012 176.608 176.600 -0.007 0.000 1.035 1861 K CA -1.098 55.192 56.287 0.005 0.000 0.868 1861 K CB 1.725 34.231 32.500 0.010 0.000 1.232 1861 K HN 0.077 nan 8.250 nan 0.000 0.459 1862 V N 1.235 121.151 119.914 0.003 0.000 2.509 1862 V HA 0.372 4.492 4.120 0.000 0.000 0.284 1862 V C 0.349 176.450 176.094 0.012 0.000 1.047 1862 V CA -0.626 61.672 62.300 -0.004 0.000 0.952 1862 V CB 1.062 32.901 31.823 0.027 0.000 0.988 1862 V HN 0.710 nan 8.190 nan 0.000 0.469 1863 R N 2.996 123.494 120.500 -0.004 0.000 2.807 1863 R HA 0.889 5.229 4.340 0.000 0.000 0.276 1863 R C -1.905 174.421 176.300 0.043 0.000 0.979 1863 R CA -0.405 55.706 56.100 0.019 0.000 0.928 1863 R CB 2.276 32.572 30.300 -0.008 0.000 1.191 1863 R HN 0.511 nan 8.270 nan 0.000 0.471 1864 V N 0.680 120.644 119.914 0.084 0.000 3.188 1864 V HA 0.572 4.692 4.120 0.000 0.000 0.305 1864 V C -0.988 175.199 176.094 0.155 0.000 1.232 1864 V CA -0.841 61.540 62.300 0.135 0.000 1.043 1864 V CB 2.566 34.503 31.823 0.189 0.000 1.068 1864 V HN 0.884 nan 8.190 nan 0.000 0.439 1865 T N 1.254 115.929 114.554 0.202 0.000 2.952 1865 T HA 0.563 4.913 4.350 0.000 0.000 0.305 1865 T C -1.495 173.348 174.700 0.238 0.000 1.064 1865 T CA -0.332 61.881 62.100 0.188 0.000 1.008 1865 T CB 1.968 70.896 68.868 0.100 0.000 1.078 1865 T HN 0.629 nan 8.240 nan 0.000 0.459 1866 V N 2.454 122.495 119.914 0.211 0.000 2.495 1866 V HA 0.867 4.987 4.120 0.000 0.000 0.298 1866 V C -0.126 175.983 176.094 0.026 0.000 1.031 1866 V CA -0.151 62.195 62.300 0.077 0.000 0.871 1866 V CB 1.223 33.064 31.823 0.029 0.000 0.988 1866 V HN 1.105 nan 8.190 nan 0.000 0.432 1867 E N 4.267 124.434 120.200 -0.056 0.000 2.212 1867 E HA 0.797 5.147 4.350 0.000 0.000 0.270 1867 E C -1.233 175.335 176.600 -0.053 0.000 0.956 1867 E CA -0.413 55.953 56.400 -0.056 0.000 0.825 1867 E CB 2.151 31.817 29.700 -0.057 0.000 1.167 1867 E HN 0.789 nan 8.360 nan 0.000 0.400 1868 V N 0.568 120.469 119.914 -0.022 0.000 3.160 1868 V HA 0.388 4.508 4.120 0.000 0.000 0.310 1868 V C -0.075 176.014 176.094 -0.008 0.000 1.181 1868 V CA -0.732 61.568 62.300 -0.001 0.000 1.047 1868 V CB 2.554 34.421 31.823 0.073 0.000 1.068 1868 V HN 0.784 nan 8.190 nan 0.000 0.441 1869 V N 2.936 122.846 119.914 -0.007 0.000 2.519 1869 V HA 0.169 4.289 4.120 0.000 0.000 0.258 1869 V C 1.555 177.648 176.094 -0.001 0.000 0.989 1869 V CA 1.071 63.366 62.300 -0.008 0.000 1.170 1869 V CB -0.924 30.894 31.823 -0.008 0.000 1.066 1869 V HN 1.425 nan 8.190 nan 0.000 0.469 1870 G N 3.391 112.184 108.800 -0.011 0.000 2.380 1870 G HA2 -0.331 3.630 3.960 0.000 0.000 0.298 1870 G HA3 -0.331 3.630 3.960 0.000 0.000 0.298 1870 G C 0.661 175.560 174.900 -0.001 0.000 0.989 1870 G CA 0.928 46.020 45.100 -0.012 0.000 0.836 1870 G HN 1.199 nan 8.290 nan 0.000 0.511 1871 K N -0.655 119.753 120.400 0.013 0.000 2.438 1871 K HA 0.710 5.030 4.320 0.000 0.000 0.205 1871 K C 2.169 178.781 176.600 0.020 0.000 1.033 1871 K CA 1.177 57.501 56.287 0.061 0.000 1.089 1871 K CB -0.145 32.423 32.500 0.113 0.000 0.857 1871 K HN 2.321 nan 8.250 nan 0.000 0.522 1872 G N -0.596 108.154 108.800 -0.083 0.000 2.641 1872 G HA2 0.272 4.232 3.960 0.000 0.000 0.254 1872 G HA3 0.272 4.232 3.960 0.000 0.000 0.254 1872 G C 0.121 174.767 174.900 -0.424 0.000 1.315 1872 G CA 0.320 45.279 45.100 -0.236 0.000 0.907 1872 G HN 1.497 nan 8.290 nan 0.000 0.572 1873 K N -1.005 119.009 120.400 -0.643 0.000 2.426 1873 K HA 0.792 5.112 4.320 0.000 0.000 0.254 1873 K C -0.648 175.531 176.600 -0.701 0.000 0.936 1873 K CA -0.334 55.638 56.287 -0.524 0.000 0.801 1873 K CB 1.231 33.597 32.500 -0.223 0.000 1.139 1873 K HN 1.044 nan 8.250 nan 0.000 0.424 1874 F N 1.101 121.055 119.950 0.007 0.000 2.556 1874 F HA 0.602 5.129 4.527 0.000 0.000 0.327 1874 F C 0.654 176.486 175.800 0.052 0.000 1.059 1874 F CA -1.040 56.975 58.000 0.025 0.000 0.953 1874 F CB 2.590 41.604 39.000 0.024 0.000 1.227 1874 F HN 0.487 nan 8.300 nan 0.000 0.478 1875 K N 0.927 121.467 120.400 0.233 0.000 2.502 1875 K HA 0.767 5.087 4.320 0.000 0.000 0.254 1875 K C -0.764 175.910 176.600 0.123 0.000 0.947 1875 K CA -0.799 55.571 56.287 0.139 0.000 0.834 1875 K CB 1.915 34.464 32.500 0.083 0.000 1.112 1875 K HN 0.804 nan 8.250 nan 0.000 0.427 1876 G N 1.439 110.308 108.800 0.114 0.000 2.453 1876 G HA2 0.643 4.603 3.960 0.000 0.000 0.323 1876 G HA3 0.643 4.603 3.960 0.000 0.000 0.323 1876 G C -1.148 173.786 174.900 0.058 0.000 1.198 1876 G CA -0.798 44.352 45.100 0.084 0.000 0.959 1876 G HN 0.344 nan 8.290 nan 0.000 0.482 1877 V N -0.204 119.734 119.914 0.041 0.000 2.841 1877 V HA 0.969 5.089 4.120 0.000 0.000 0.310 1877 V C 0.394 176.502 176.094 0.023 0.000 1.090 1877 V CA -0.067 62.251 62.300 0.030 0.000 0.930 1877 V CB 1.571 33.407 31.823 0.021 0.000 1.014 1877 V HN 1.391 nan 8.190 nan 0.000 0.425 1878 G N 2.794 111.607 108.800 0.023 0.000 2.576 1878 G HA2 0.499 4.459 3.960 0.000 0.000 0.290 1878 G HA3 0.499 4.459 3.960 0.000 0.000 0.290 1878 G C -0.141 174.771 174.900 0.020 0.000 1.442 1878 G CA -0.365 44.745 45.100 0.017 0.000 0.792 1878 G HN 0.741 nan 8.290 nan 0.000 0.491 1879 R N -0.420 120.089 120.500 0.016 0.000 2.237 1879 R HA 0.210 4.550 4.340 0.000 0.000 0.219 1879 R C 1.352 177.666 176.300 0.023 0.000 1.080 1879 R CA 1.250 57.360 56.100 0.016 0.000 0.995 1879 R CB -0.241 30.066 30.300 0.012 0.000 0.875 1879 R HN 0.576 nan 8.270 nan 0.000 0.462 1880 S N -1.695 114.023 115.700 0.030 0.000 2.715 1880 S HA 0.207 4.677 4.470 0.000 0.000 0.307 1880 S C 0.521 175.183 174.600 0.103 0.000 1.119 1880 S CA -1.079 57.153 58.200 0.054 0.000 0.937 1880 S CB 0.915 64.138 63.200 0.039 0.000 1.150 1880 S HN 0.236 nan 8.310 nan 0.000 0.521 1881 Y N 1.545 121.816 120.300 -0.048 0.000 2.060 1881 Y HA -0.163 4.387 4.550 0.000 0.000 0.276 1881 Y C 2.856 178.700 175.900 -0.093 0.000 1.127 1881 Y CA 1.795 59.854 58.100 -0.068 0.000 1.104 1881 Y CB -0.402 38.018 38.460 -0.066 0.000 0.983 1881 Y HN 0.892 nan 8.280 nan 0.000 0.483 1882 R N 0.816 121.234 120.500 -0.137 0.000 2.189 1882 R HA -0.286 4.054 4.340 0.000 0.000 0.252 1882 R C 1.936 178.123 176.300 -0.188 0.000 1.134 1882 R CA 2.950 58.897 56.100 -0.255 0.000 0.954 1882 R CB -0.858 29.360 30.300 -0.137 0.000 0.890 1882 R HN 0.588 nan 8.270 nan 0.000 0.443 1883 I N 0.263 120.783 120.570 -0.083 0.000 2.202 1883 I HA -0.183 3.987 4.170 0.000 0.000 0.242 1883 I C 2.689 178.777 176.117 -0.048 0.000 1.091 1883 I CA 1.163 62.430 61.300 -0.056 0.000 1.368 1883 I CB -0.699 37.289 38.000 -0.020 0.000 1.058 1883 I HN 0.410 nan 8.210 nan 0.000 0.410 1884 A N 0.952 123.768 122.820 -0.007 0.000 1.917 1884 A HA -0.263 4.057 4.320 0.000 0.000 0.219 1884 A C 2.407 179.970 177.584 -0.035 0.000 1.182 1884 A CA 1.805 53.855 52.037 0.021 0.000 0.633 1884 A CB -0.571 18.488 19.000 0.098 0.000 0.819 1884 A HN 0.300 nan 8.150 nan 0.000 0.448 1885 K N -0.072 120.230 120.400 -0.163 0.000 1.991 1885 K HA -0.171 4.149 4.320 0.000 0.000 0.212 1885 K C 2.534 179.003 176.600 -0.218 0.000 1.049 1885 K CA 1.962 58.029 56.287 -0.367 0.000 0.932 1885 K CB -0.335 31.722 32.500 -0.738 0.000 0.717 1885 K HN 0.697 nan 8.250 nan 0.000 0.441 1886 S N 0.567 116.168 115.700 -0.166 0.000 2.399 1886 S HA -0.102 4.368 4.470 0.000 0.000 0.231 1886 S C 2.226 176.817 174.600 -0.014 0.000 1.022 1886 S CA 1.053 59.210 58.200 -0.072 0.000 0.983 1886 S CB -0.280 62.876 63.200 -0.074 0.000 0.803 1886 S HN 0.343 nan 8.310 nan 0.000 0.480 1887 A N 2.255 125.066 122.820 -0.015 0.000 1.940 1887 A HA 0.191 4.511 4.320 0.000 0.000 0.219 1887 A C 2.536 180.147 177.584 0.045 0.000 1.176 1887 A CA 1.903 53.946 52.037 0.010 0.000 0.631 1887 A CB -1.476 17.531 19.000 0.012 0.000 0.814 1887 A HN 0.850 nan 8.150 nan 0.000 0.446 1888 A N -0.195 122.672 122.820 0.079 0.000 1.873 1888 A HA 0.185 4.505 4.320 0.000 0.000 0.215 1888 A C 2.538 180.222 177.584 0.168 0.000 1.186 1888 A CA 2.084 54.218 52.037 0.163 0.000 0.616 1888 A CB -1.102 18.044 19.000 0.244 0.000 0.823 1888 A HN 1.088 nan 8.150 nan 0.000 0.442 1889 A N -0.291 122.640 122.820 0.185 0.000 1.908 1889 A HA -0.202 4.118 4.320 0.000 0.000 0.218 1889 A C 2.227 179.811 177.584 -0.000 0.000 1.181 1889 A CA 2.027 54.148 52.037 0.140 0.000 0.627 1889 A CB -0.501 18.601 19.000 0.170 0.000 0.818 1889 A HN 0.538 nan 8.150 nan 0.000 0.445 1890 R N -0.680 119.816 120.500 -0.006 0.000 2.083 1890 R HA -0.129 4.211 4.340 0.000 0.000 0.237 1890 R C 2.472 178.716 176.300 -0.094 0.000 1.137 1890 R CA 1.843 57.917 56.100 -0.043 0.000 0.951 1890 R CB -0.304 29.982 30.300 -0.024 0.000 0.851 1890 R HN 0.538 nan 8.270 nan 0.000 0.434 1891 R N -0.271 120.179 120.500 -0.082 0.000 2.096 1891 R HA -0.118 4.222 4.340 0.000 0.000 0.235 1891 R C 2.002 178.040 176.300 -0.436 0.000 1.127 1891 R CA 1.399 57.421 56.100 -0.131 0.000 0.968 1891 R CB -0.245 30.062 30.300 0.011 0.000 0.861 1891 R HN 0.333 nan 8.270 nan 0.000 0.440 1892 A N 1.280 123.771 122.820 -0.549 0.000 1.828 1892 A HA -0.175 4.145 4.320 0.000 0.000 0.215 1892 A C 2.150 179.389 177.584 -0.576 0.000 1.203 1892 A CA 1.344 52.781 52.037 -0.999 0.000 0.614 1892 A CB -0.921 17.820 19.000 -0.432 0.000 0.844 1892 A HN 0.338 nan 8.150 nan 0.000 0.445 1893 L N -0.794 120.258 121.223 -0.284 0.000 2.085 1893 L HA -0.324 4.016 4.340 0.000 0.000 0.218 1893 L C 2.866 179.627 176.870 -0.183 0.000 1.080 1893 L CA 2.183 56.917 54.840 -0.177 0.000 0.776 1893 L CB -0.528 41.471 42.059 -0.101 0.000 0.891 1893 L HN 0.560 nan 8.230 nan 0.000 0.437 1894 R N -0.174 120.203 120.500 -0.205 0.000 2.070 1894 R HA -0.215 4.125 4.340 0.000 0.000 0.232 1894 R C 2.607 178.821 176.300 -0.143 0.000 1.138 1894 R CA 1.937 57.949 56.100 -0.148 0.000 0.936 1894 R CB -0.384 29.843 30.300 -0.121 0.000 0.839 1894 R HN 0.346 nan 8.270 nan 0.000 0.429 1895 S N 0.804 116.370 115.700 -0.224 0.000 2.389 1895 S HA -0.232 4.238 4.470 0.000 0.000 0.229 1895 S C 1.678 176.245 174.600 -0.056 0.000 1.048 1895 S CA 1.748 59.882 58.200 -0.110 0.000 1.117 1895 S CB -0.491 62.629 63.200 -0.133 0.000 1.020 1895 S HN 0.424 nan 8.310 nan 0.000 0.430 1896 L N 1.402 122.571 121.223 -0.089 0.000 2.869 1896 L HA 0.259 4.599 4.340 0.000 0.000 0.259 1896 L C 0.732 177.580 176.870 -0.038 0.000 1.162 1896 L CA 0.776 55.592 54.840 -0.040 0.000 0.975 1896 L CB -1.230 40.803 42.059 -0.044 0.000 1.217 1896 L HN 0.593 nan 8.230 nan 0.000 0.418 1897 K N 0.000 120.376 120.400 -0.040 0.000 2.780 1897 K HA 0.000 4.320 4.320 0.000 0.000 0.191 1897 K CA 0.000 56.272 56.287 -0.025 0.000 0.838 1897 K CB 0.000 32.482 32.500 -0.030 0.000 1.064 1897 K HN 0.000 nan 8.250 nan 0.000 0.543