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 2o7c_1_D DATA FIRST_RESID 1501 DATA SEQUENCE MHGSNKLPGF ATRAIHHGYD PQDHGGALVP PVYQTATFTF PTVEYGAACF DATA SEQUENCE AGEQAGHFYS RISNPTLNLL EARMASLEGG EAGLALASGM GAITSTLWTL DATA SEQUENCE LRPGDEVLLG NTLYGCTFAF LHHGIGEFGV KLRHVDMADL QALEAAMTPA DATA SEQUENCE TRVIYFESPA NPNMHMADIA GVAKIARKHG ATVVVDNTYC TPYLQRPLEL DATA SEQUENCE GADLVVHSAT XYLSGHGDIT AGIVVGSQAL VDRIRLQGLK DMTGAVLSPH DATA SEQUENCE DAALLMRGIK TLNLRMDRHC ANAQVLAEFL ARQPQVELIH YPGLASFPQY DATA SEQUENCE TLARQQMSQP GGMIAFELKG GIGAGRRFMN ALQLFSRAVS LGDAESLAQH DATA SEQUENCE PASMTHSSYT PEERAHYGIS EGLVRLSVGL EDIDDLLADV QQALKASA 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 1501 M HA 0.000 nan 4.480 nan 0.000 0.227 1501 M C 0.000 176.344 176.300 0.074 0.000 1.140 1501 M CA 0.000 55.301 55.300 0.001 0.000 0.988 1501 M CB 0.000 32.545 32.600 -0.091 0.000 1.302 1502 H N 2.147 121.166 119.070 -0.085 0.000 3.254 1502 H HA 0.224 4.780 4.556 -0.000 0.000 0.253 1502 H C 1.030 176.398 175.328 0.068 0.000 0.853 1502 H CA 0.268 56.304 56.048 -0.020 0.000 1.404 1502 H CB 0.235 29.976 29.762 -0.035 0.000 1.483 1502 H HN 0.457 nan 8.280 nan 0.000 0.522 1503 G N 2.669 111.544 108.800 0.125 0.000 2.393 1503 G HA2 0.002 3.962 3.960 -0.000 0.000 0.268 1503 G HA3 0.002 3.962 3.960 -0.000 0.000 0.268 1503 G C 0.774 175.895 174.900 0.367 0.000 1.472 1503 G CA 0.333 45.525 45.100 0.155 0.000 1.059 1503 G HN 0.555 nan 8.290 nan 0.000 0.555 1504 S N -2.192 113.741 115.700 0.389 0.000 3.657 1504 S HA 0.207 4.677 4.470 -0.000 0.000 0.183 1504 S C 1.022 175.644 174.600 0.036 0.000 0.995 1504 S CA 0.865 59.130 58.200 0.108 0.000 1.333 1504 S CB -0.197 62.827 63.200 -0.293 0.000 1.197 1504 S HN 0.711 nan 8.310 nan 0.000 0.856 1505 N N 0.506 119.213 118.700 0.011 0.000 2.900 1505 N HA -0.138 4.602 4.740 -0.000 0.000 0.240 1505 N C -0.410 175.095 175.510 -0.008 0.000 0.953 1505 N CA 1.219 54.273 53.050 0.008 0.000 0.950 1505 N CB -1.134 37.364 38.487 0.018 0.000 1.102 1505 N HN 0.537 nan 8.380 nan 0.000 0.593 1506 K N -2.042 118.344 120.400 -0.022 0.000 3.291 1506 K HA -0.128 4.192 4.320 -0.000 0.000 0.290 1506 K C 0.751 177.352 176.600 0.002 0.000 1.235 1506 K CA 1.160 57.442 56.287 -0.008 0.000 0.848 1506 K CB -1.750 30.753 32.500 0.006 0.000 1.295 1506 K HN 0.501 nan 8.250 nan 0.000 0.497 1507 L N -0.752 120.464 121.223 -0.013 0.000 2.115 1507 L HA 0.179 4.519 4.340 -0.000 0.000 0.200 1507 L C -0.940 175.915 176.870 -0.025 0.000 1.094 1507 L CA -0.063 54.760 54.840 -0.029 0.000 0.769 1507 L CB -1.211 40.810 42.059 -0.064 0.000 0.931 1507 L HN -0.004 nan 8.230 nan 0.000 0.455 1508 P HA 0.106 nan 4.420 nan 0.000 0.271 1508 P C 0.019 177.360 177.300 0.068 0.000 1.233 1508 P CA -0.102 63.003 63.100 0.009 0.000 0.789 1508 P CB 0.244 31.965 31.700 0.036 0.000 0.951 1509 G N -0.149 108.717 108.800 0.111 0.000 2.699 1509 G HA2 -0.027 3.933 3.960 -0.000 0.000 0.246 1509 G HA3 -0.027 3.933 3.960 -0.000 0.000 0.246 1509 G C 0.432 175.439 174.900 0.178 0.000 1.219 1509 G CA -0.445 44.743 45.100 0.147 0.000 0.866 1509 G HN 0.498 nan 8.290 nan 0.000 0.572 1510 F N 1.356 121.355 119.950 0.081 0.000 2.134 1510 F HA -0.080 4.447 4.527 -0.000 0.000 0.299 1510 F C 2.695 178.535 175.800 0.066 0.000 1.097 1510 F CA 2.226 60.278 58.000 0.085 0.000 1.264 1510 F CB 0.028 39.116 39.000 0.147 0.000 1.001 1510 F HN 0.394 nan 8.300 nan 0.000 0.479 1511 A N -0.637 122.391 122.820 0.347 0.000 1.930 1511 A HA -0.149 4.171 4.320 -0.000 0.000 0.217 1511 A C 2.138 179.790 177.584 0.112 0.000 1.175 1511 A CA 2.130 54.289 52.037 0.203 0.000 0.627 1511 A CB -1.356 17.739 19.000 0.158 0.000 0.815 1511 A HN 0.433 nan 8.150 nan 0.000 0.443 1512 T N -0.181 114.461 114.554 0.146 0.000 2.708 1512 T HA -0.148 4.202 4.350 -0.000 0.000 0.266 1512 T C 2.060 176.876 174.700 0.193 0.000 1.037 1512 T CA 1.626 63.849 62.100 0.206 0.000 1.146 1512 T CB -0.242 68.760 68.868 0.224 0.000 0.865 1512 T HN 0.522 nan 8.240 nan 0.000 0.435 1513 R N 0.967 121.518 120.500 0.085 0.000 2.115 1513 R HA 0.104 4.444 4.340 -0.000 0.000 0.230 1513 R C 2.699 178.971 176.300 -0.046 0.000 1.111 1513 R CA 1.099 57.224 56.100 0.040 0.000 0.976 1513 R CB -0.372 29.865 30.300 -0.104 0.000 0.870 1513 R HN 0.336 nan 8.270 nan 0.000 0.445 1514 A N 0.477 123.193 122.820 -0.173 0.000 2.121 1514 A HA -0.057 4.263 4.320 -0.000 0.000 0.218 1514 A C 1.905 179.432 177.584 -0.094 0.000 1.154 1514 A CA 1.042 52.967 52.037 -0.187 0.000 0.679 1514 A CB -0.148 18.730 19.000 -0.203 0.000 0.795 1514 A HN 0.192 nan 8.150 nan 0.000 0.458 1515 I N -2.710 117.816 120.570 -0.075 0.000 3.039 1515 I HA 0.046 4.216 4.170 -0.000 0.000 0.270 1515 I C 1.974 177.933 176.117 -0.262 0.000 1.150 1515 I CA 0.499 61.685 61.300 -0.190 0.000 1.448 1515 I CB 0.065 37.909 38.000 -0.259 0.000 1.197 1515 I HN 0.321 nan 8.210 nan 0.000 0.450 1516 H N -1.672 117.437 119.070 0.066 0.000 2.855 1516 H HA 0.171 4.727 4.556 -0.000 0.000 0.259 1516 H C 0.523 175.920 175.328 0.116 0.000 0.972 1516 H CA -0.145 55.963 56.048 0.100 0.000 1.213 1516 H CB 0.117 29.934 29.762 0.091 0.000 1.451 1516 H HN 0.191 nan 8.280 nan 0.000 0.484 1517 H N 1.277 120.430 119.070 0.139 0.000 3.195 1517 H HA -0.062 4.494 4.556 -0.000 0.000 0.302 1517 H C 1.117 176.504 175.328 0.098 0.000 0.950 1517 H CA 1.747 57.849 56.048 0.091 0.000 1.398 1517 H CB 0.261 30.032 29.762 0.015 0.000 1.377 1517 H HN 0.733 nan 8.280 nan 0.000 0.572 1518 G N 4.094 112.562 108.800 -0.553 0.000 2.212 1518 G HA2 -0.322 3.638 3.960 -0.000 0.000 0.266 1518 G HA3 -0.322 3.638 3.960 -0.000 0.000 0.266 1518 G C -0.082 174.831 174.900 0.022 0.000 0.978 1518 G CA 0.572 45.493 45.100 -0.299 0.000 0.632 1518 G HN 0.737 nan 8.290 nan 0.000 0.537 1519 Y N 1.064 121.330 120.300 -0.058 0.000 2.341 1519 Y HA 0.584 5.134 4.550 -0.000 0.000 0.338 1519 Y C -1.119 174.819 175.900 0.064 0.000 0.965 1519 Y CA -1.117 56.984 58.100 0.001 0.000 1.108 1519 Y CB 1.979 40.414 38.460 -0.040 0.000 1.180 1519 Y HN 0.045 nan 8.280 nan 0.000 0.458 1520 D N 8.504 128.606 120.400 -0.496 0.000 2.462 1520 D HA 0.321 4.961 4.640 -0.000 0.000 0.245 1520 D C -2.185 173.758 176.300 -0.595 0.000 1.122 1520 D CA -2.611 51.151 54.000 -0.397 0.000 0.864 1520 D CB 2.226 42.926 40.800 -0.166 0.000 1.098 1520 D HN 0.283 nan 8.370 nan 0.000 0.541 1521 P HA -0.199 nan 4.420 nan 0.000 0.216 1521 P C 1.270 178.510 177.300 -0.100 0.000 1.154 1521 P CA 1.240 64.161 63.100 -0.298 0.000 0.865 1521 P CB 0.343 32.010 31.700 -0.055 0.000 0.789 1522 Q N -0.975 118.760 119.800 -0.108 0.000 2.248 1522 Q HA -0.192 4.148 4.340 -0.000 0.000 0.208 1522 Q C 1.140 177.080 176.000 -0.099 0.000 0.984 1522 Q CA 1.341 57.099 55.803 -0.075 0.000 0.875 1522 Q CB -0.386 28.309 28.738 -0.072 0.000 0.910 1522 Q HN 0.273 nan 8.270 nan 0.000 0.433 1523 D N -1.401 118.905 120.400 -0.157 0.000 2.347 1523 D HA -0.026 4.614 4.640 -0.000 0.000 0.213 1523 D C -0.091 175.867 176.300 -0.570 0.000 0.985 1523 D CA 0.770 54.569 54.000 -0.334 0.000 0.879 1523 D CB 0.262 40.819 40.800 -0.406 0.000 0.919 1523 D HN 0.344 nan 8.370 nan 0.000 0.526 1524 H N -1.403 117.658 119.070 -0.016 0.000 2.624 1524 H HA 0.441 4.997 4.556 -0.000 0.000 0.233 1524 H C 1.157 176.526 175.328 0.068 0.000 1.376 1524 H CA -0.140 55.959 56.048 0.085 0.000 1.137 1524 H CB 0.709 30.613 29.762 0.236 0.000 1.867 1524 H HN -0.018 nan 8.280 nan 0.000 0.547 1525 G N 0.195 109.041 108.800 0.077 0.000 2.166 1525 G HA2 -0.232 3.728 3.960 -0.000 0.000 0.260 1525 G HA3 -0.232 3.728 3.960 -0.000 0.000 0.260 1525 G C 1.321 176.255 174.900 0.056 0.000 0.986 1525 G CA 0.590 45.724 45.100 0.056 0.000 0.683 1525 G HN 1.333 nan 8.290 nan 0.000 0.527 1526 G N -1.408 107.429 108.800 0.062 0.000 2.176 1526 G HA2 0.175 4.135 3.960 -0.000 0.000 0.253 1526 G HA3 0.175 4.135 3.960 -0.000 0.000 0.253 1526 G C 0.881 175.834 174.900 0.088 0.000 0.979 1526 G CA 1.123 46.253 45.100 0.050 0.000 0.641 1526 G HN 2.327 nan 8.290 nan 0.000 0.530 1527 A N 0.003 122.906 122.820 0.139 0.000 2.545 1527 A HA 0.547 4.867 4.320 -0.000 0.000 0.253 1527 A C 1.537 179.252 177.584 0.219 0.000 1.074 1527 A CA 0.920 53.048 52.037 0.152 0.000 0.760 1527 A CB 0.255 19.353 19.000 0.163 0.000 1.005 1527 A HN 1.254 nan 8.150 nan 0.000 0.506 1528 L N 4.451 125.761 121.223 0.144 0.000 2.017 1528 L HA -0.034 4.306 4.340 -0.000 0.000 0.208 1528 L C 0.902 177.880 176.870 0.179 0.000 1.073 1528 L CA 1.790 56.728 54.840 0.163 0.000 0.745 1528 L CB -0.140 41.968 42.059 0.081 0.000 0.894 1528 L HN 0.464 nan 8.230 nan 0.000 0.432 1529 V N 1.187 121.129 119.914 0.048 0.000 2.439 1529 V HA 0.301 4.421 4.120 -0.000 0.000 0.282 1529 V C -2.096 173.888 176.094 -0.183 0.000 1.039 1529 V CA -1.654 60.588 62.300 -0.097 0.000 0.913 1529 V CB 0.772 32.538 31.823 -0.095 0.000 0.983 1529 V HN 0.145 nan 8.190 nan 0.000 0.460 1530 P HA 0.167 nan 4.420 nan 0.000 0.265 1530 P C -2.437 174.726 177.300 -0.229 0.000 1.193 1530 P CA -0.842 61.906 63.100 -0.588 0.000 0.765 1530 P CB -0.285 30.834 31.700 -0.968 0.000 0.823 1531 P HA 0.002 nan 4.420 nan 0.000 0.271 1531 P C -0.519 176.708 177.300 -0.121 0.000 1.218 1531 P CA 0.013 63.043 63.100 -0.117 0.000 0.780 1531 P CB 0.568 32.188 31.700 -0.135 0.000 0.901 1532 V N 4.565 124.401 119.914 -0.130 0.000 2.406 1532 V HA 0.128 4.248 4.120 -0.000 0.000 0.272 1532 V C -0.641 175.397 176.094 -0.093 0.000 1.043 1532 V CA -0.531 61.734 62.300 -0.059 0.000 0.915 1532 V CB -0.594 31.202 31.823 -0.046 0.000 0.988 1532 V HN 0.308 nan 8.190 nan 0.000 0.466 1533 Y N 5.189 125.469 120.300 -0.033 0.000 2.667 1533 Y HA 0.315 4.865 4.550 -0.000 0.000 0.340 1533 Y C 0.949 176.826 175.900 -0.038 0.000 1.303 1533 Y CA 0.002 58.092 58.100 -0.017 0.000 1.769 1533 Y CB 0.248 38.734 38.460 0.043 0.000 1.804 1533 Y HN 0.702 nan 8.280 nan 0.000 0.451 1534 Q N 2.660 122.466 119.800 0.010 0.000 3.027 1534 Q HA 0.170 4.510 4.340 -0.000 0.000 0.260 1534 Q C -0.486 175.472 176.000 -0.069 0.000 1.379 1534 Q CA -0.194 55.600 55.803 -0.014 0.000 1.038 1534 Q CB -0.248 28.477 28.738 -0.022 0.000 1.578 1534 Q HN 0.532 nan 8.270 nan 0.000 0.571 1535 T N -2.804 111.691 114.554 -0.098 0.000 2.933 1535 T HA 0.744 5.094 4.350 -0.000 0.000 0.305 1535 T C 0.379 174.930 174.700 -0.249 0.000 1.092 1535 T CA -0.354 61.618 62.100 -0.214 0.000 1.008 1535 T CB 1.544 70.188 68.868 -0.374 0.000 1.102 1535 T HN 0.115 nan 8.240 nan 0.000 0.469 1536 A N 1.811 124.496 122.820 -0.225 0.000 1.903 1536 A HA 0.419 4.739 4.320 -0.000 0.000 0.213 1536 A C 1.332 178.775 177.584 -0.234 0.000 1.185 1536 A CA 0.879 52.767 52.037 -0.248 0.000 0.628 1536 A CB -0.447 18.455 19.000 -0.163 0.000 0.830 1536 A HN 0.876 nan 8.150 nan 0.000 0.446 1537 T N -1.261 113.188 114.554 -0.175 0.000 2.932 1537 T HA 0.630 4.980 4.350 -0.000 0.000 0.289 1537 T C -1.534 172.939 174.700 -0.377 0.000 1.039 1537 T CA -0.465 61.634 62.100 -0.002 0.000 1.024 1537 T CB 0.542 69.519 68.868 0.181 0.000 1.090 1537 T HN 0.079 nan 8.240 nan 0.000 0.496 1538 F N 1.223 121.194 119.950 0.036 0.000 2.563 1538 F HA 0.545 5.072 4.527 -0.000 0.000 0.316 1538 F C 0.890 176.528 175.800 -0.271 0.000 1.076 1538 F CA -0.813 57.155 58.000 -0.053 0.000 0.921 1538 F CB 2.123 41.133 39.000 0.017 0.000 1.209 1538 F HN 0.548 nan 8.300 nan 0.000 0.462 1539 T N -0.891 113.587 114.554 -0.127 0.000 2.943 1539 T HA 0.728 5.078 4.350 -0.000 0.000 0.284 1539 T C -0.787 173.695 174.700 -0.362 0.000 1.015 1539 T CA -0.538 61.375 62.100 -0.312 0.000 1.042 1539 T CB 0.830 69.635 68.868 -0.106 0.000 1.055 1539 T HN 0.277 nan 8.240 nan 0.000 0.500 1540 F N 1.582 121.619 119.950 0.144 0.000 2.450 1540 F HA 0.445 4.972 4.527 -0.000 0.000 0.332 1540 F C -0.954 174.836 175.800 -0.016 0.000 1.093 1540 F CA -2.397 55.665 58.000 0.102 0.000 1.003 1540 F CB 1.722 40.864 39.000 0.236 0.000 1.151 1540 F HN 0.447 nan 8.300 nan 0.000 0.474 1541 P HA 0.030 nan 4.420 nan 0.000 0.227 1541 P C 0.178 177.511 177.300 0.055 0.000 1.161 1541 P CA 0.833 63.916 63.100 -0.028 0.000 0.788 1541 P CB 0.683 32.282 31.700 -0.167 0.000 0.822 1542 T N -1.287 113.345 114.554 0.130 0.000 2.868 1542 T HA 0.268 4.618 4.350 -0.000 0.000 0.306 1542 T C 0.688 175.488 174.700 0.168 0.000 1.224 1542 T CA -0.502 61.678 62.100 0.134 0.000 1.012 1542 T CB 2.107 71.039 68.868 0.107 0.000 1.221 1542 T HN -0.429 nan 8.240 nan 0.000 0.499 1543 V N 2.161 122.138 119.914 0.106 0.000 2.427 1543 V HA -0.047 4.073 4.120 -0.000 0.000 0.248 1543 V C 2.053 178.142 176.094 -0.009 0.000 1.051 1543 V CA 1.964 64.299 62.300 0.058 0.000 1.048 1543 V CB -0.323 31.532 31.823 0.054 0.000 0.666 1543 V HN 0.842 nan 8.190 nan 0.000 0.456 1544 E N -1.105 119.108 120.200 0.022 0.000 2.204 1544 E HA -0.228 4.122 4.350 -0.000 0.000 0.195 1544 E C 1.832 178.414 176.600 -0.031 0.000 0.990 1544 E CA 1.346 57.743 56.400 -0.005 0.000 0.821 1544 E CB -0.292 29.420 29.700 0.021 0.000 0.750 1544 E HN 0.818 nan 8.360 nan 0.000 0.477 1545 Y N 0.201 120.432 120.300 -0.114 0.000 2.206 1545 Y HA -0.013 4.537 4.550 -0.000 0.000 0.292 1545 Y C 2.312 177.988 175.900 -0.373 0.000 1.123 1545 Y CA 1.706 59.726 58.100 -0.132 0.000 1.142 1545 Y CB -0.603 37.855 38.460 -0.002 0.000 1.006 1545 Y HN 0.031 nan 8.280 nan 0.000 0.518 1546 G N 0.281 108.737 108.800 -0.573 0.000 2.446 1546 G HA2 -0.338 3.622 3.960 -0.000 0.000 0.217 1546 G HA3 -0.338 3.622 3.960 -0.000 0.000 0.217 1546 G C 1.814 176.036 174.900 -1.129 0.000 1.168 1546 G CA 1.196 45.236 45.100 -1.767 0.000 0.771 1546 G HN 0.612 nan 8.290 nan 0.000 0.551 1547 A N 1.212 123.744 122.820 -0.480 0.000 1.908 1547 A HA 0.210 4.530 4.320 -0.000 0.000 0.218 1547 A C 2.834 180.271 177.584 -0.245 0.000 1.181 1547 A CA 2.434 54.365 52.037 -0.176 0.000 0.627 1547 A CB -0.871 18.076 19.000 -0.089 0.000 0.818 1547 A HN 0.912 nan 8.150 nan 0.000 0.445 1548 A N -1.361 121.266 122.820 -0.321 0.000 1.972 1548 A HA -0.152 4.167 4.320 -0.000 0.000 0.219 1548 A C 2.277 179.641 177.584 -0.366 0.000 1.169 1548 A CA 1.646 53.507 52.037 -0.293 0.000 0.635 1548 A CB -1.152 17.673 19.000 -0.292 0.000 0.810 1548 A HN 0.596 nan 8.150 nan 0.000 0.446 1549 C N -1.759 117.189 119.300 -0.586 0.000 2.453 1549 C HA -0.020 4.440 4.460 -0.000 0.000 0.277 1549 C C 2.380 177.146 174.990 -0.373 0.000 1.262 1549 C CA 0.807 59.511 59.018 -0.524 0.000 1.718 1549 C CB -1.556 25.797 27.740 -0.644 0.000 2.031 1549 C HN 0.654 nan 8.230 nan 0.000 0.480 1550 F N 1.638 121.379 119.950 -0.348 0.000 2.216 1550 F HA -0.030 4.497 4.527 -0.000 0.000 0.300 1550 F C 2.399 178.086 175.800 -0.189 0.000 1.085 1550 F CA 1.228 59.023 58.000 -0.342 0.000 1.326 1550 F CB -1.036 37.732 39.000 -0.387 0.000 1.027 1550 F HN 0.187 nan 8.300 nan 0.000 0.497 1551 A N -0.471 122.346 122.820 -0.006 0.000 2.278 1551 A HA 0.438 4.758 4.320 -0.000 0.000 0.212 1551 A C 2.061 179.624 177.584 -0.035 0.000 1.213 1551 A CA 0.667 52.691 52.037 -0.021 0.000 0.840 1551 A CB -1.316 17.659 19.000 -0.042 0.000 0.866 1551 A HN 0.576 nan 8.150 nan 0.000 0.489 1552 G N -0.196 108.577 108.800 -0.045 0.000 2.186 1552 G HA2 -0.363 3.596 3.960 -0.000 0.000 0.266 1552 G HA3 -0.363 3.596 3.960 -0.000 0.000 0.266 1552 G C 0.644 175.505 174.900 -0.066 0.000 0.982 1552 G CA 0.990 46.065 45.100 -0.042 0.000 0.670 1552 G HN 0.658 nan 8.290 nan 0.000 0.533 1553 E N -0.983 119.162 120.200 -0.091 0.000 2.107 1553 E HA 0.033 4.383 4.350 -0.000 0.000 0.191 1553 E C 1.232 177.769 176.600 -0.106 0.000 0.982 1553 E CA 0.818 57.166 56.400 -0.087 0.000 0.809 1553 E CB 0.051 29.698 29.700 -0.089 0.000 0.756 1553 E HN 0.453 nan 8.360 nan 0.000 0.459 1554 Q N -0.295 119.403 119.800 -0.170 0.000 2.342 1554 Q HA 0.496 4.836 4.340 -0.000 0.000 0.267 1554 Q C -1.330 174.564 176.000 -0.177 0.000 1.038 1554 Q CA -0.642 55.047 55.803 -0.190 0.000 0.832 1554 Q CB 1.940 30.475 28.738 -0.338 0.000 1.323 1554 Q HN 0.149 nan 8.270 nan 0.000 0.448 1555 A N 1.479 124.238 122.820 -0.101 0.000 2.354 1555 A HA 0.767 5.087 4.320 -0.000 0.000 0.281 1555 A C 0.227 177.777 177.584 -0.056 0.000 1.174 1555 A CA 0.789 52.776 52.037 -0.084 0.000 0.828 1555 A CB -0.048 18.926 19.000 -0.043 0.000 1.099 1555 A HN 0.723 nan 8.150 nan 0.000 0.516 1556 G N 1.308 110.033 108.800 -0.124 0.000 2.427 1556 G HA2 0.539 4.499 3.960 -0.000 0.000 0.306 1556 G HA3 0.539 4.499 3.960 -0.000 0.000 0.306 1556 G C -1.480 173.231 174.900 -0.315 0.000 1.280 1556 G CA -0.672 44.409 45.100 -0.031 0.000 0.837 1556 G HN 0.853 nan 8.290 nan 0.000 0.482 1557 H N -1.620 117.382 119.070 -0.113 0.000 2.907 1557 H HA 0.700 5.256 4.556 -0.000 0.000 0.361 1557 H C 0.089 175.412 175.328 -0.009 0.000 1.194 1557 H CA -0.156 55.638 56.048 -0.424 0.000 1.152 1557 H CB 1.921 30.891 29.762 -1.321 0.000 1.867 1557 H HN 0.597 nan 8.280 nan 0.000 0.561 1558 F N -2.729 117.323 119.950 0.170 0.000 2.764 1558 F HA 0.360 4.887 4.527 -0.000 0.000 0.393 1558 F C -1.107 175.071 175.800 0.630 0.000 0.854 1558 F CA -0.429 57.807 58.000 0.395 0.000 1.003 1558 F CB 1.118 40.400 39.000 0.470 0.000 1.085 1558 F HN 0.363 nan 8.300 nan 0.000 0.592 1559 Y N 1.404 121.715 120.300 0.020 0.000 2.348 1559 Y HA 0.459 5.009 4.550 -0.000 0.000 0.321 1559 Y C 0.830 176.766 175.900 0.060 0.000 1.163 1559 Y CA -1.370 56.839 58.100 0.182 0.000 1.070 1559 Y CB 1.929 40.569 38.460 0.301 0.000 1.250 1559 Y HN 0.031 nan 8.280 nan 0.000 0.425 1560 S N 3.328 118.942 115.700 -0.144 0.000 2.440 1560 S HA -0.202 4.268 4.470 -0.000 0.000 0.238 1560 S C 1.986 176.503 174.600 -0.138 0.000 1.010 1560 S CA 1.733 59.876 58.200 -0.095 0.000 0.972 1560 S CB -0.128 63.020 63.200 -0.087 0.000 0.774 1560 S HN 0.749 nan 8.310 nan 0.000 0.501 1561 R N 0.636 121.011 120.500 -0.208 0.000 2.092 1561 R HA -0.006 4.334 4.340 -0.000 0.000 0.231 1561 R C 1.759 178.092 176.300 0.054 0.000 1.119 1561 R CA 1.299 57.392 56.100 -0.011 0.000 0.970 1561 R CB -0.250 30.136 30.300 0.143 0.000 0.864 1561 R HN 0.279 nan 8.270 nan 0.000 0.440 1562 I N -0.612 120.004 120.570 0.077 0.000 2.333 1562 I HA 0.035 4.205 4.170 -0.000 0.000 0.246 1562 I C 0.481 176.568 176.117 -0.049 0.000 1.106 1562 I CA 0.988 62.310 61.300 0.037 0.000 1.411 1562 I CB 0.260 38.288 38.000 0.046 0.000 1.082 1562 I HN 0.104 nan 8.210 nan 0.000 0.420 1563 S N 0.154 115.786 115.700 -0.114 0.000 2.570 1563 S HA 0.355 4.825 4.470 -0.000 0.000 0.286 1563 S C -1.373 173.235 174.600 0.012 0.000 1.143 1563 S CA -0.863 57.294 58.200 -0.072 0.000 0.921 1563 S CB 0.571 63.673 63.200 -0.162 0.000 1.108 1563 S HN 0.214 nan 8.310 nan 0.000 0.456 1564 N N 4.096 122.800 118.700 0.008 0.000 2.249 1564 N HA 0.481 5.221 4.740 -0.000 0.000 0.296 1564 N C -2.372 173.011 175.510 -0.212 0.000 1.051 1564 N CA -2.004 50.994 53.050 -0.087 0.000 0.815 1564 N CB 2.297 40.796 38.487 0.019 0.000 1.487 1564 N HN 0.252 nan 8.380 nan 0.000 0.475 1565 P HA -0.081 nan 4.420 nan 0.000 0.216 1565 P C 1.032 178.195 177.300 -0.227 0.000 1.150 1565 P CA 1.662 64.439 63.100 -0.539 0.000 0.843 1565 P CB 0.278 31.341 31.700 -1.062 0.000 0.787 1566 T N -0.751 113.733 114.554 -0.116 0.000 2.821 1566 T HA -0.064 4.286 4.350 -0.000 0.000 0.267 1566 T C 1.627 176.303 174.700 -0.039 0.000 1.046 1566 T CA 0.965 63.051 62.100 -0.024 0.000 1.139 1566 T CB -0.721 68.178 68.868 0.052 0.000 0.871 1566 T HN -0.038 nan 8.240 nan 0.000 0.454 1567 L N 1.597 122.802 121.223 -0.030 0.000 2.093 1567 L HA 0.022 4.362 4.340 -0.000 0.000 0.208 1567 L C 2.251 179.114 176.870 -0.012 0.000 1.085 1567 L CA 1.211 56.042 54.840 -0.016 0.000 0.755 1567 L CB -0.686 41.370 42.059 -0.005 0.000 0.904 1567 L HN 0.141 nan 8.230 nan 0.000 0.435 1568 N N -0.602 118.090 118.700 -0.014 0.000 2.149 1568 N HA -0.192 4.548 4.740 -0.000 0.000 0.188 1568 N C 1.757 177.271 175.510 0.008 0.000 1.019 1568 N CA 1.058 54.112 53.050 0.007 0.000 0.857 1568 N CB -0.420 38.085 38.487 0.030 0.000 0.997 1568 N HN 0.162 nan 8.380 nan 0.000 0.426 1569 L N 0.704 121.919 121.223 -0.013 0.000 2.027 1569 L HA -0.003 4.336 4.340 -0.000 0.000 0.206 1569 L C 1.996 178.867 176.870 0.001 0.000 1.074 1569 L CA 1.181 56.016 54.840 -0.009 0.000 0.745 1569 L CB -0.979 41.045 42.059 -0.058 0.000 0.898 1569 L HN 0.146 nan 8.230 nan 0.000 0.433 1570 L N -0.296 120.916 121.223 -0.018 0.000 2.042 1570 L HA -0.209 4.131 4.340 -0.000 0.000 0.210 1570 L C 2.292 179.165 176.870 0.005 0.000 1.076 1570 L CA 1.872 56.702 54.840 -0.016 0.000 0.749 1570 L CB -0.767 41.277 42.059 -0.025 0.000 0.893 1570 L HN 0.415 nan 8.230 nan 0.000 0.432 1571 E N -0.142 120.066 120.200 0.015 0.000 2.077 1571 E HA -0.188 4.162 4.350 -0.000 0.000 0.193 1571 E C 2.201 178.828 176.600 0.045 0.000 0.989 1571 E CA 1.190 57.606 56.400 0.026 0.000 0.800 1571 E CB -0.381 29.334 29.700 0.026 0.000 0.746 1571 E HN 0.683 nan 8.360 nan 0.000 0.452 1572 A N 1.475 124.336 122.820 0.068 0.000 1.930 1572 A HA -0.153 4.167 4.320 -0.000 0.000 0.217 1572 A C 2.062 179.762 177.584 0.193 0.000 1.175 1572 A CA 1.011 53.127 52.037 0.132 0.000 0.627 1572 A CB -0.236 18.843 19.000 0.132 0.000 0.815 1572 A HN 0.035 nan 8.150 nan 0.000 0.443 1573 R N -1.215 119.383 120.500 0.164 0.000 2.062 1573 R HA -0.048 4.292 4.340 -0.000 0.000 0.231 1573 R C 2.122 178.393 176.300 -0.048 0.000 1.136 1573 R CA 1.414 57.581 56.100 0.113 0.000 0.948 1573 R CB -0.530 29.803 30.300 0.056 0.000 0.845 1573 R HN 0.416 nan 8.270 nan 0.000 0.430 1574 M N 0.492 120.073 119.600 -0.031 0.000 2.149 1574 M HA -0.107 4.373 4.480 -0.000 0.000 0.261 1574 M C 2.384 178.661 176.300 -0.037 0.000 1.064 1574 M CA 1.505 56.776 55.300 -0.048 0.000 1.102 1574 M CB -1.088 31.496 32.600 -0.026 0.000 1.369 1574 M HN 0.150 nan 8.290 nan 0.000 0.408 1575 A N -0.720 122.089 122.820 -0.019 0.000 1.902 1575 A HA -0.167 4.153 4.320 -0.000 0.000 0.217 1575 A C 2.467 180.006 177.584 -0.076 0.000 1.181 1575 A CA 2.325 54.353 52.037 -0.014 0.000 0.623 1575 A CB -0.945 18.064 19.000 0.015 0.000 0.818 1575 A HN 0.515 nan 8.150 nan 0.000 0.443 1576 S N -0.322 115.264 115.700 -0.191 0.000 2.356 1576 S HA -0.107 4.363 4.470 -0.000 0.000 0.223 1576 S C 1.985 176.436 174.600 -0.248 0.000 1.032 1576 S CA 1.459 59.444 58.200 -0.359 0.000 1.005 1576 S CB -0.539 62.096 63.200 -0.942 0.000 0.867 1576 S HN 0.479 nan 8.310 nan 0.000 0.449 1577 L N 0.953 122.029 121.223 -0.244 0.000 2.046 1577 L HA -0.034 4.306 4.340 -0.000 0.000 0.208 1577 L C 2.775 179.666 176.870 0.036 0.000 1.077 1577 L CA 1.351 56.066 54.840 -0.208 0.000 0.747 1577 L CB -0.560 41.345 42.059 -0.257 0.000 0.896 1577 L HN 0.339 nan 8.230 nan 0.000 0.432 1578 E N 0.005 120.224 120.200 0.033 0.000 2.371 1578 E HA -0.025 4.325 4.350 -0.000 0.000 0.194 1578 E C 1.448 178.080 176.600 0.054 0.000 1.012 1578 E CA 0.801 57.253 56.400 0.086 0.000 0.860 1578 E CB 0.226 29.988 29.700 0.103 0.000 0.811 1578 E HN 0.542 nan 8.360 nan 0.000 0.502 1579 G N 1.012 109.820 108.800 0.014 0.000 2.137 1579 G HA2 -0.225 3.735 3.960 -0.000 0.000 0.237 1579 G HA3 -0.225 3.735 3.960 -0.000 0.000 0.237 1579 G C 0.487 175.393 174.900 0.009 0.000 1.002 1579 G CA 0.236 45.340 45.100 0.008 0.000 0.702 1579 G HN 0.498 nan 8.290 nan 0.000 0.515 1580 G N -1.366 107.439 108.800 0.009 0.000 2.552 1580 G HA2 0.649 4.609 3.960 -0.000 0.000 0.324 1580 G HA3 0.649 4.609 3.960 -0.000 0.000 0.324 1580 G C 0.524 175.432 174.900 0.013 0.000 1.217 1580 G CA 0.242 45.351 45.100 0.015 0.000 0.989 1580 G HN 0.237 nan 8.290 nan 0.000 0.490 1581 E N -0.624 119.588 120.200 0.019 0.000 2.112 1581 E HA 0.257 4.607 4.350 -0.000 0.000 0.190 1581 E C 0.979 177.596 176.600 0.029 0.000 0.979 1581 E CA 0.914 57.327 56.400 0.023 0.000 0.814 1581 E CB 0.288 30.002 29.700 0.022 0.000 0.762 1581 E HN 0.480 nan 8.360 nan 0.000 0.460 1582 A N 0.385 123.222 122.820 0.029 0.000 2.539 1582 A HA 0.701 5.021 4.320 -0.000 0.000 0.296 1582 A C -0.418 177.187 177.584 0.035 0.000 1.073 1582 A CA -0.250 51.806 52.037 0.032 0.000 0.700 1582 A CB 1.905 20.922 19.000 0.029 0.000 1.296 1582 A HN 0.133 nan 8.150 nan 0.000 0.405 1583 G N -0.838 107.984 108.800 0.036 0.000 2.630 1583 G HA2 0.721 4.681 3.960 -0.000 0.000 0.296 1583 G HA3 0.721 4.681 3.960 -0.000 0.000 0.296 1583 G C -1.807 173.115 174.900 0.035 0.000 1.285 1583 G CA -0.581 44.542 45.100 0.039 0.000 0.958 1583 G HN 1.418 nan 8.290 nan 0.000 0.479 1584 L N 0.235 121.481 121.223 0.039 0.000 2.493 1584 L HA 0.788 5.128 4.340 -0.000 0.000 0.265 1584 L C -0.236 176.656 176.870 0.036 0.000 0.954 1584 L CA -0.582 54.279 54.840 0.035 0.000 0.844 1584 L CB 1.798 43.880 42.059 0.038 0.000 1.302 1584 L HN 0.911 nan 8.230 nan 0.000 0.405 1585 A N 5.102 127.939 122.820 0.028 0.000 2.301 1585 A HA 0.871 5.191 4.320 -0.000 0.000 0.312 1585 A C -1.209 176.392 177.584 0.027 0.000 1.182 1585 A CA -0.318 51.735 52.037 0.026 0.000 0.826 1585 A CB 0.627 19.636 19.000 0.015 0.000 1.134 1585 A HN 0.656 nan 8.150 nan 0.000 0.501 1586 L N 0.860 122.102 121.223 0.031 0.000 2.303 1586 L HA 0.632 4.972 4.340 -0.000 0.000 0.256 1586 L C 1.411 178.298 176.870 0.029 0.000 1.034 1586 L CA -0.193 54.665 54.840 0.030 0.000 0.832 1586 L CB 1.677 43.755 42.059 0.032 0.000 1.403 1586 L HN 0.739 nan 8.230 nan 0.000 0.419 1587 A N 0.086 122.923 122.820 0.028 0.000 2.125 1587 A HA 0.196 4.516 4.320 -0.000 0.000 0.219 1587 A C 0.717 178.319 177.584 0.031 0.000 1.156 1587 A CA 1.492 53.547 52.037 0.030 0.000 0.671 1587 A CB -0.572 18.446 19.000 0.029 0.000 0.794 1587 A HN 0.777 nan 8.150 nan 0.000 0.459 1588 S N -5.149 110.568 115.700 0.029 0.000 2.643 1588 S HA 0.481 4.951 4.470 -0.000 0.000 0.266 1588 S C 0.883 175.496 174.600 0.022 0.000 1.130 1588 S CA 0.115 58.332 58.200 0.029 0.000 0.817 1588 S CB 0.595 63.816 63.200 0.033 0.000 1.107 1588 S HN 0.784 nan 8.310 nan 0.000 0.471 1589 G N 0.592 109.400 108.800 0.014 0.000 2.418 1589 G HA2 -0.068 3.892 3.960 -0.000 0.000 0.217 1589 G HA3 -0.068 3.892 3.960 -0.000 0.000 0.217 1589 G C 1.168 176.062 174.900 -0.009 0.000 1.158 1589 G CA 1.074 46.174 45.100 0.000 0.000 0.771 1589 G HN 0.520 nan 8.290 nan 0.000 0.545 1590 M N 1.294 120.893 119.600 -0.002 0.000 2.159 1590 M HA 0.021 4.501 4.480 -0.000 0.000 0.263 1590 M C 2.776 179.026 176.300 -0.082 0.000 1.063 1590 M CA 1.066 56.348 55.300 -0.029 0.000 1.110 1590 M CB -1.625 30.985 32.600 0.017 0.000 1.374 1590 M HN 0.264 nan 8.290 nan 0.000 0.411 1591 G N -0.338 108.444 108.800 -0.031 0.000 2.442 1591 G HA2 -0.092 3.868 3.960 -0.000 0.000 0.219 1591 G HA3 -0.092 3.868 3.960 -0.000 0.000 0.219 1591 G C 1.649 176.538 174.900 -0.018 0.000 1.141 1591 G CA 1.221 46.309 45.100 -0.020 0.000 0.763 1591 G HN 0.550 nan 8.290 nan 0.000 0.554 1592 A N 0.512 123.329 122.820 -0.005 0.000 1.898 1592 A HA 0.131 4.451 4.320 -0.000 0.000 0.216 1592 A C 2.394 179.974 177.584 -0.007 0.000 1.181 1592 A CA 1.147 53.192 52.037 0.012 0.000 0.620 1592 A CB -0.298 18.723 19.000 0.035 0.000 0.819 1592 A HN 0.360 nan 8.150 nan 0.000 0.442 1593 I N 0.237 120.783 120.570 -0.040 0.000 2.142 1593 I HA -0.246 3.924 4.170 -0.000 0.000 0.240 1593 I C 2.975 178.968 176.117 -0.207 0.000 1.078 1593 I CA 1.953 63.208 61.300 -0.075 0.000 1.343 1593 I CB -0.517 37.441 38.000 -0.070 0.000 1.046 1593 I HN 0.550 nan 8.210 nan 0.000 0.405 1594 T N -2.267 112.054 114.554 -0.388 0.000 2.708 1594 T HA -0.141 4.209 4.350 -0.000 0.000 0.266 1594 T C 2.002 176.660 174.700 -0.070 0.000 1.037 1594 T CA 1.631 63.379 62.100 -0.586 0.000 1.146 1594 T CB -0.670 67.787 68.868 -0.684 0.000 0.865 1594 T HN 0.191 nan 8.240 nan 0.000 0.435 1595 S N 1.219 116.943 115.700 0.039 0.000 2.383 1595 S HA -0.106 4.364 4.470 -0.000 0.000 0.229 1595 S C 2.282 176.950 174.600 0.114 0.000 1.030 1595 S CA 1.649 59.927 58.200 0.130 0.000 1.002 1595 S CB -0.897 62.350 63.200 0.077 0.000 0.829 1595 S HN 0.694 nan 8.310 nan 0.000 0.467 1596 T N 2.714 117.299 114.554 0.052 0.000 2.732 1596 T HA 0.100 4.450 4.350 -0.000 0.000 0.261 1596 T C 1.790 176.523 174.700 0.055 0.000 1.040 1596 T CA 0.922 63.054 62.100 0.053 0.000 1.145 1596 T CB -0.385 68.510 68.868 0.044 0.000 0.866 1596 T HN 0.245 nan 8.240 nan 0.000 0.427 1597 L N -0.972 120.255 121.223 0.007 0.000 2.056 1597 L HA -0.036 4.304 4.340 -0.000 0.000 0.207 1597 L C 2.466 179.371 176.870 0.058 0.000 1.078 1597 L CA 1.340 56.168 54.840 -0.020 0.000 0.749 1597 L CB -0.583 41.431 42.059 -0.075 0.000 0.901 1597 L HN 0.386 nan 8.230 nan 0.000 0.433 1598 W N 0.188 121.546 121.300 0.096 0.000 2.364 1598 W HA -0.246 4.414 4.660 -0.000 0.000 0.281 1598 W C 2.828 179.356 176.519 0.015 0.000 1.219 1598 W CA 1.255 58.633 57.345 0.056 0.000 1.220 1598 W CB -0.108 29.373 29.460 0.034 0.000 1.127 1598 W HN 0.240 nan 8.180 nan 0.000 0.556 1599 T N -1.776 112.925 114.554 0.245 0.000 3.051 1599 T HA 0.026 4.376 4.350 -0.000 0.000 0.255 1599 T C 1.477 176.239 174.700 0.103 0.000 1.085 1599 T CA 0.574 62.762 62.100 0.147 0.000 1.109 1599 T CB -0.185 68.747 68.868 0.106 0.000 0.921 1599 T HN 0.088 nan 8.240 nan 0.000 0.488 1600 L N 0.159 121.435 121.223 0.089 0.000 2.529 1600 L HA 0.384 4.724 4.340 -0.000 0.000 0.223 1600 L C -0.192 176.707 176.870 0.048 0.000 1.113 1600 L CA -0.125 54.750 54.840 0.058 0.000 0.861 1600 L CB 0.156 42.242 42.059 0.045 0.000 1.012 1600 L HN 0.241 nan 8.230 nan 0.000 0.461 1601 L N -0.020 121.240 121.223 0.061 0.000 2.346 1601 L HA 0.587 4.927 4.340 -0.000 0.000 0.274 1601 L C -0.265 176.653 176.870 0.081 0.000 1.007 1601 L CA -0.198 54.668 54.840 0.042 0.000 0.818 1601 L CB 1.600 43.651 42.059 -0.013 0.000 1.284 1601 L HN -0.059 nan 8.230 nan 0.000 0.424 1602 R N 1.746 122.282 120.500 0.059 0.000 2.774 1602 R HA 0.540 4.880 4.340 -0.000 0.000 0.272 1602 R C -2.623 173.712 176.300 0.058 0.000 1.000 1602 R CA -2.500 53.644 56.100 0.073 0.000 0.906 1602 R CB 1.516 31.850 30.300 0.056 0.000 1.227 1602 R HN 0.220 nan 8.270 nan 0.000 0.468 1603 P HA 0.044 nan 4.420 nan 0.000 0.263 1603 P C 0.666 177.984 177.300 0.030 0.000 1.175 1603 P CA 1.285 64.420 63.100 0.059 0.000 0.761 1603 P CB 0.430 32.175 31.700 0.074 0.000 0.794 1604 G N 1.676 110.484 108.800 0.014 0.000 2.258 1604 G HA2 -0.185 3.775 3.960 -0.000 0.000 0.233 1604 G HA3 -0.185 3.775 3.960 -0.000 0.000 0.233 1604 G C 0.016 174.913 174.900 -0.004 0.000 1.006 1604 G CA -0.242 44.860 45.100 0.004 0.000 0.620 1604 G HN 0.513 nan 8.290 nan 0.000 0.511 1605 D N 0.991 121.388 120.400 -0.005 0.000 2.339 1605 D HA 0.518 5.158 4.640 -0.000 0.000 0.245 1605 D C 0.392 176.669 176.300 -0.038 0.000 1.115 1605 D CA 0.196 54.188 54.000 -0.014 0.000 0.917 1605 D CB 1.322 42.117 40.800 -0.009 0.000 1.192 1605 D HN 0.550 nan 8.370 nan 0.000 0.428 1606 E N 0.240 120.416 120.200 -0.040 0.000 2.212 1606 E HA 0.495 4.845 4.350 -0.000 0.000 0.268 1606 E C -1.586 174.972 176.600 -0.070 0.000 0.902 1606 E CA -0.800 55.563 56.400 -0.062 0.000 0.779 1606 E CB 1.431 31.101 29.700 -0.051 0.000 1.172 1606 E HN 0.048 nan 8.360 nan 0.000 0.409 1607 V N 4.875 124.727 119.914 -0.105 0.000 2.407 1607 V HA 0.262 4.382 4.120 -0.000 0.000 0.291 1607 V C -0.780 175.250 176.094 -0.108 0.000 1.018 1607 V CA -0.900 61.339 62.300 -0.103 0.000 0.842 1607 V CB 1.232 32.960 31.823 -0.158 0.000 0.996 1607 V HN 0.643 nan 8.190 nan 0.000 0.426 1608 L N 6.445 127.638 121.223 -0.050 0.000 2.290 1608 L HA 0.553 4.893 4.340 -0.000 0.000 0.284 1608 L C -0.153 176.723 176.870 0.010 0.000 1.078 1608 L CA 0.239 55.056 54.840 -0.039 0.000 0.815 1608 L CB 0.908 42.959 42.059 -0.014 0.000 1.162 1608 L HN 0.473 nan 8.230 nan 0.000 0.435 1609 L N 2.096 123.291 121.223 -0.048 0.000 2.333 1609 L HA 0.697 5.037 4.340 -0.000 0.000 0.269 1609 L C 0.892 177.865 176.870 0.172 0.000 1.010 1609 L CA -0.950 53.918 54.840 0.046 0.000 0.818 1609 L CB 1.570 43.516 42.059 -0.189 0.000 1.306 1609 L HN 0.653 nan 8.230 nan 0.000 0.430 1610 G N 0.182 109.157 108.800 0.293 0.000 2.614 1610 G HA2 -0.019 3.941 3.960 -0.000 0.000 0.239 1610 G HA3 -0.019 3.941 3.960 -0.000 0.000 0.239 1610 G C 0.632 175.745 174.900 0.355 0.000 1.240 1610 G CA -0.338 44.917 45.100 0.259 0.000 0.842 1610 G HN 0.777 nan 8.290 nan 0.000 0.584 1611 N N -0.635 118.191 118.700 0.209 0.000 2.094 1611 N HA -0.104 4.636 4.740 -0.000 0.000 0.191 1611 N C 1.384 176.937 175.510 0.072 0.000 1.023 1611 N CA 1.734 54.858 53.050 0.123 0.000 0.857 1611 N CB -0.184 38.282 38.487 -0.034 0.000 1.013 1611 N HN 0.723 nan 8.380 nan 0.000 0.426 1612 T N -1.663 112.962 114.554 0.118 0.000 2.893 1612 T HA 0.753 5.103 4.350 -0.000 0.000 0.291 1612 T C -0.312 174.516 174.700 0.214 0.000 1.028 1612 T CA -0.853 61.302 62.100 0.092 0.000 0.995 1612 T CB 2.287 71.162 68.868 0.011 0.000 1.051 1612 T HN -0.079 nan 8.240 nan 0.000 0.470 1613 L N 1.204 122.575 121.223 0.247 0.000 2.415 1613 L HA 0.496 4.836 4.340 -0.000 0.000 0.256 1613 L C -0.894 176.149 176.870 0.287 0.000 1.010 1613 L CA -1.634 53.405 54.840 0.332 0.000 0.826 1613 L CB 1.997 44.352 42.059 0.495 0.000 1.405 1613 L HN 0.793 nan 8.230 nan 0.000 0.410 1614 Y N 0.823 121.229 120.300 0.177 0.000 2.811 1614 Y HA 0.015 4.565 4.550 -0.000 0.000 0.334 1614 Y C 1.280 177.293 175.900 0.189 0.000 1.247 1614 Y CA 0.868 59.056 58.100 0.146 0.000 1.526 1614 Y CB 1.210 39.754 38.460 0.141 0.000 1.284 1614 Y HN 0.712 nan 8.280 nan 0.000 0.586 1615 G N 3.461 112.002 108.800 -0.433 0.000 2.574 1615 G HA2 -0.348 3.612 3.960 -0.000 0.000 0.220 1615 G HA3 -0.348 3.612 3.960 -0.000 0.000 0.220 1615 G C 1.535 176.348 174.900 -0.145 0.000 1.173 1615 G CA 1.300 46.226 45.100 -0.290 0.000 0.772 1615 G HN 0.826 nan 8.290 nan 0.000 0.585 1616 C N 0.390 119.458 119.300 -0.387 0.000 2.435 1616 C HA 0.031 4.491 4.460 -0.000 0.000 0.279 1616 C C 3.218 178.351 174.990 0.239 0.000 1.321 1616 C CA 1.394 60.429 59.018 0.027 0.000 1.752 1616 C CB -1.084 26.741 27.740 0.143 0.000 1.959 1616 C HN 0.474 nan 8.230 nan 0.000 0.500 1617 T N 0.722 115.484 114.554 0.346 0.000 2.821 1617 T HA -0.140 4.210 4.350 -0.000 0.000 0.267 1617 T C 1.501 176.373 174.700 0.287 0.000 1.046 1617 T CA 1.342 63.649 62.100 0.345 0.000 1.139 1617 T CB -0.384 68.725 68.868 0.402 0.000 0.871 1617 T HN 0.557 nan 8.240 nan 0.000 0.454 1618 F N 2.138 122.184 119.950 0.160 0.000 2.113 1618 F HA 0.027 4.554 4.527 -0.000 0.000 0.297 1618 F C 2.499 178.356 175.800 0.095 0.000 1.103 1618 F CA 1.090 59.190 58.000 0.167 0.000 1.248 1618 F CB -0.562 38.501 39.000 0.104 0.000 0.999 1618 F HN 0.134 nan 8.300 nan 0.000 0.475 1619 A N 0.181 123.175 122.820 0.290 0.000 1.883 1619 A HA -0.257 4.063 4.320 -0.000 0.000 0.217 1619 A C 2.118 179.746 177.584 0.075 0.000 1.186 1619 A CA 1.758 53.889 52.037 0.158 0.000 0.624 1619 A CB -1.662 17.491 19.000 0.255 0.000 0.822 1619 A HN 0.567 nan 8.150 nan 0.000 0.444 1620 F N 0.553 120.494 119.950 -0.014 0.000 2.126 1620 F HA -0.136 4.391 4.527 -0.000 0.000 0.299 1620 F C 1.818 177.498 175.800 -0.199 0.000 1.096 1620 F CA 1.665 59.620 58.000 -0.074 0.000 1.255 1620 F CB -0.439 38.499 39.000 -0.103 0.000 0.997 1620 F HN 0.146 nan 8.300 nan 0.000 0.479 1621 L N -0.656 120.246 121.223 -0.536 0.000 2.023 1621 L HA -0.209 4.131 4.340 -0.000 0.000 0.205 1621 L C 2.790 179.218 176.870 -0.736 0.000 1.073 1621 L CA 1.385 55.750 54.840 -0.792 0.000 0.745 1621 L CB -1.006 40.658 42.059 -0.658 0.000 0.900 1621 L HN 0.180 nan 8.230 nan 0.000 0.435 1622 H N -1.064 117.630 119.070 -0.627 0.000 2.363 1622 H HA -0.036 4.520 4.556 -0.000 0.000 0.301 1622 H C 1.526 176.643 175.328 -0.350 0.000 1.074 1622 H CA 1.268 56.964 56.048 -0.587 0.000 1.354 1622 H CB 0.202 29.448 29.762 -0.861 0.000 1.397 1622 H HN 0.437 nan 8.280 nan 0.000 0.516 1623 H N -0.989 118.076 119.070 -0.008 0.000 2.652 1623 H HA 0.256 4.812 4.556 -0.000 0.000 0.274 1623 H C 1.576 176.933 175.328 0.048 0.000 1.021 1623 H CA 0.480 56.547 56.048 0.030 0.000 1.187 1623 H CB 0.572 30.386 29.762 0.087 0.000 1.505 1623 H HN 0.335 nan 8.280 nan 0.000 0.530 1624 G N 0.546 109.360 108.800 0.024 0.000 2.560 1624 G HA2 0.056 4.016 3.960 -0.000 0.000 0.212 1624 G HA3 0.056 4.016 3.960 -0.000 0.000 0.212 1624 G C 1.233 176.178 174.900 0.075 0.000 2.038 1624 G CA -0.090 45.075 45.100 0.107 0.000 0.728 1624 G HN 0.252 nan 8.290 nan 0.000 0.784 1625 I N 1.575 121.816 120.570 -0.549 0.000 2.567 1625 I HA -0.008 4.162 4.170 -0.000 0.000 0.257 1625 I C 2.435 178.429 176.117 -0.204 0.000 1.184 1625 I CA 1.547 62.551 61.300 -0.492 0.000 1.451 1625 I CB -0.099 37.140 38.000 -1.268 0.000 1.089 1625 I HN 0.300 nan 8.210 nan 0.000 0.441 1626 G N 0.008 108.614 108.800 -0.323 0.000 2.422 1626 G HA2 -0.192 3.768 3.960 -0.000 0.000 0.218 1626 G HA3 -0.192 3.768 3.960 -0.000 0.000 0.218 1626 G C 1.333 176.169 174.900 -0.106 0.000 1.140 1626 G CA 0.365 45.313 45.100 -0.254 0.000 0.775 1626 G HN 0.517 nan 8.290 nan 0.000 0.545 1627 E N -0.536 119.635 120.200 -0.049 0.000 2.494 1627 E HA 0.113 4.463 4.350 -0.000 0.000 0.193 1627 E C 0.106 176.541 176.600 -0.275 0.000 1.074 1627 E CA -0.140 56.184 56.400 -0.127 0.000 0.867 1627 E CB 0.012 29.627 29.700 -0.143 0.000 0.924 1627 E HN 0.522 nan 8.360 nan 0.000 0.502 1628 F N -0.020 119.937 119.950 0.012 0.000 2.791 1628 F HA 0.286 4.813 4.527 -0.000 0.000 0.308 1628 F C 1.306 177.122 175.800 0.028 0.000 1.138 1628 F CA -0.078 57.957 58.000 0.059 0.000 1.294 1628 F CB 1.328 40.431 39.000 0.171 0.000 0.975 1628 F HN 0.044 nan 8.300 nan 0.000 0.512 1629 G N 0.171 109.016 108.800 0.075 0.000 2.157 1629 G HA2 -0.230 3.730 3.960 -0.000 0.000 0.239 1629 G HA3 -0.230 3.730 3.960 -0.000 0.000 0.239 1629 G C -0.174 174.734 174.900 0.014 0.000 0.982 1629 G CA -0.045 45.079 45.100 0.040 0.000 0.650 1629 G HN 0.118 nan 8.290 nan 0.000 0.527 1630 V N 1.263 121.171 119.914 -0.010 0.000 2.432 1630 V HA 0.416 4.536 4.120 -0.000 0.000 0.275 1630 V C 0.726 176.750 176.094 -0.117 0.000 1.043 1630 V CA -0.525 61.735 62.300 -0.067 0.000 0.925 1630 V CB 1.561 33.316 31.823 -0.115 0.000 0.985 1630 V HN 0.289 nan 8.190 nan 0.000 0.466 1631 K N 4.318 124.656 120.400 -0.104 0.000 2.276 1631 K HA 0.540 4.860 4.320 -0.000 0.000 0.283 1631 K C -1.207 175.293 176.600 -0.167 0.000 1.044 1631 K CA -0.554 55.663 56.287 -0.116 0.000 0.944 1631 K CB 0.916 33.370 32.500 -0.076 0.000 1.012 1631 K HN 0.276 nan 8.250 nan 0.000 0.472 1632 L N 2.743 123.841 121.223 -0.207 0.000 2.365 1632 L HA 0.516 4.856 4.340 -0.000 0.000 0.273 1632 L C -0.568 176.179 176.870 -0.205 0.000 1.000 1632 L CA -0.441 54.230 54.840 -0.282 0.000 0.819 1632 L CB 1.620 43.386 42.059 -0.488 0.000 1.284 1632 L HN 0.574 nan 8.230 nan 0.000 0.418 1633 R N 1.406 121.781 120.500 -0.208 0.000 2.533 1633 R HA 0.452 4.792 4.340 -0.000 0.000 0.288 1633 R C -1.363 174.856 176.300 -0.134 0.000 1.039 1633 R CA -0.459 55.575 56.100 -0.110 0.000 0.909 1633 R CB 1.030 31.295 30.300 -0.057 0.000 1.195 1633 R HN 0.607 nan 8.270 nan 0.000 0.438 1634 H N 3.164 122.255 119.070 0.035 0.000 2.580 1634 H HA 0.416 4.972 4.556 -0.000 0.000 0.322 1634 H C -0.452 174.892 175.328 0.028 0.000 1.082 1634 H CA -0.143 55.940 56.048 0.058 0.000 1.383 1634 H CB 1.543 31.361 29.762 0.094 0.000 1.450 1634 H HN 0.245 nan 8.280 nan 0.000 0.505 1635 V N 2.335 122.324 119.914 0.125 0.000 3.007 1635 V HA 0.016 4.136 4.120 -0.000 0.000 0.311 1635 V C -0.005 176.111 176.094 0.037 0.000 1.120 1635 V CA -1.067 61.266 62.300 0.055 0.000 0.980 1635 V CB 2.653 34.483 31.823 0.013 0.000 1.033 1635 V HN 0.665 nan 8.190 nan 0.000 0.429 1636 D N 3.019 123.422 120.400 0.005 0.000 2.352 1636 D HA 0.175 4.815 4.640 -0.000 0.000 0.245 1636 D C 0.909 177.195 176.300 -0.022 0.000 1.224 1636 D CA -0.273 53.726 54.000 -0.001 0.000 0.879 1636 D CB 1.138 41.930 40.800 -0.014 0.000 1.057 1636 D HN 0.342 nan 8.370 nan 0.000 0.491 1637 M N 2.895 122.448 119.600 -0.079 0.000 2.700 1637 M HA -0.021 4.459 4.480 -0.000 0.000 0.249 1637 M C 1.491 177.666 176.300 -0.207 0.000 1.082 1637 M CA 0.331 55.478 55.300 -0.255 0.000 1.077 1637 M CB -0.897 31.299 32.600 -0.674 0.000 1.477 1637 M HN 0.472 nan 8.290 nan 0.000 0.529 1638 A N -0.819 121.967 122.820 -0.056 0.000 2.044 1638 A HA -0.001 4.319 4.320 -0.000 0.000 0.213 1638 A C 0.938 178.503 177.584 -0.031 0.000 1.169 1638 A CA 0.273 52.277 52.037 -0.056 0.000 0.724 1638 A CB -0.023 18.984 19.000 0.011 0.000 0.840 1638 A HN 0.304 nan 8.150 nan 0.000 0.463 1639 D N 0.907 121.299 120.400 -0.013 0.000 2.468 1639 D HA 0.297 4.937 4.640 -0.000 0.000 0.218 1639 D C 0.871 177.155 176.300 -0.027 0.000 1.155 1639 D CA -0.167 53.824 54.000 -0.015 0.000 0.924 1639 D CB 0.287 41.082 40.800 -0.008 0.000 1.029 1639 D HN 0.308 nan 8.370 nan 0.000 0.515 1640 L N 2.408 123.615 121.223 -0.028 0.000 2.362 1640 L HA -0.181 4.159 4.340 -0.000 0.000 0.219 1640 L C 1.828 178.690 176.870 -0.012 0.000 1.134 1640 L CA 0.759 55.585 54.840 -0.024 0.000 0.807 1640 L CB -0.083 41.966 42.059 -0.017 0.000 0.927 1640 L HN 0.272 nan 8.230 nan 0.000 0.447 1641 Q N 0.190 119.985 119.800 -0.010 0.000 2.123 1641 Q HA 0.006 4.346 4.340 -0.000 0.000 0.196 1641 Q C 2.488 178.483 176.000 -0.008 0.000 0.958 1641 Q CA 1.403 57.203 55.803 -0.004 0.000 0.841 1641 Q CB -0.416 28.321 28.738 -0.003 0.000 0.915 1641 Q HN 0.417 nan 8.270 nan 0.000 0.455 1642 A N 0.581 123.393 122.820 -0.012 0.000 1.930 1642 A HA -0.117 4.203 4.320 -0.000 0.000 0.217 1642 A C 2.004 179.575 177.584 -0.022 0.000 1.175 1642 A CA 1.210 53.238 52.037 -0.014 0.000 0.627 1642 A CB -0.590 18.402 19.000 -0.013 0.000 0.815 1642 A HN 0.351 nan 8.150 nan 0.000 0.443 1643 L N -0.008 121.198 121.223 -0.029 0.000 2.023 1643 L HA -0.083 4.257 4.340 -0.000 0.000 0.205 1643 L C 2.278 179.114 176.870 -0.057 0.000 1.073 1643 L CA 2.789 57.604 54.840 -0.043 0.000 0.745 1643 L CB -0.711 41.319 42.059 -0.048 0.000 0.900 1643 L HN 0.428 nan 8.230 nan 0.000 0.435 1644 E N 0.212 120.391 120.200 -0.036 0.000 2.171 1644 E HA -0.227 4.123 4.350 -0.000 0.000 0.197 1644 E C 1.947 178.527 176.600 -0.034 0.000 0.997 1644 E CA 1.671 58.056 56.400 -0.025 0.000 0.810 1644 E CB -0.400 29.317 29.700 0.028 0.000 0.738 1644 E HN 0.588 nan 8.360 nan 0.000 0.467 1645 A N 0.252 123.058 122.820 -0.024 0.000 1.968 1645 A HA 0.167 4.487 4.320 -0.000 0.000 0.217 1645 A C 2.322 179.886 177.584 -0.033 0.000 1.169 1645 A CA 1.461 53.488 52.037 -0.017 0.000 0.638 1645 A CB -0.583 18.412 19.000 -0.009 0.000 0.812 1645 A HN 0.374 nan 8.150 nan 0.000 0.446 1646 A N -1.218 121.572 122.820 -0.050 0.000 2.169 1646 A HA 0.300 4.620 4.320 -0.000 0.000 0.212 1646 A C 0.969 178.500 177.584 -0.089 0.000 1.153 1646 A CA 0.139 52.144 52.037 -0.054 0.000 0.756 1646 A CB -0.326 18.648 19.000 -0.044 0.000 0.813 1646 A HN 0.370 nan 8.150 nan 0.000 0.471 1647 M N 1.832 121.338 119.600 -0.155 0.000 2.303 1647 M HA 0.149 4.629 4.480 -0.000 0.000 0.350 1647 M C 0.659 176.868 176.300 -0.153 0.000 1.518 1647 M CA 0.561 55.691 55.300 -0.282 0.000 1.070 1647 M CB -0.390 31.768 32.600 -0.737 0.000 1.910 1647 M HN 0.498 nan 8.290 nan 0.000 0.458 1648 T N 1.397 115.896 114.554 -0.092 0.000 2.888 1648 T HA 0.694 5.044 4.350 -0.000 0.000 0.288 1648 T C -2.108 172.610 174.700 0.031 0.000 1.063 1648 T CA -1.341 60.752 62.100 -0.011 0.000 1.010 1648 T CB 2.029 70.889 68.868 -0.014 0.000 1.214 1648 T HN 0.468 nan 8.240 nan 0.000 0.533 1649 P HA 0.214 nan 4.420 nan 0.000 0.237 1649 P C 0.929 178.251 177.300 0.037 0.000 1.178 1649 P CA 0.318 63.454 63.100 0.060 0.000 0.766 1649 P CB -0.208 31.520 31.700 0.047 0.000 0.876 1650 A N -0.679 122.152 122.820 0.017 0.000 2.267 1650 A HA 0.145 4.465 4.320 -0.000 0.000 0.213 1650 A C 1.015 178.598 177.584 -0.002 0.000 1.192 1650 A CA 0.262 52.303 52.037 0.007 0.000 0.851 1650 A CB -0.956 18.043 19.000 -0.002 0.000 0.881 1650 A HN 0.083 nan 8.150 nan 0.000 0.494 1651 T N 1.030 115.579 114.554 -0.007 0.000 2.754 1651 T HA 0.080 4.430 4.350 -0.000 0.000 0.282 1651 T C 1.192 175.893 174.700 0.003 0.000 0.923 1651 T CA 0.060 62.148 62.100 -0.019 0.000 1.164 1651 T CB 0.440 69.278 68.868 -0.049 0.000 0.873 1651 T HN 0.346 nan 8.240 nan 0.000 0.537 1652 R N 2.492 122.993 120.500 0.001 0.000 2.206 1652 R HA 0.208 4.547 4.340 -0.000 0.000 0.198 1652 R C 0.579 176.892 176.300 0.021 0.000 0.986 1652 R CA 0.538 56.647 56.100 0.015 0.000 1.029 1652 R CB 0.414 30.721 30.300 0.011 0.000 0.966 1652 R HN 0.585 nan 8.270 nan 0.000 0.487 1653 V N -1.451 118.472 119.914 0.015 0.000 3.114 1653 V HA 0.556 4.676 4.120 -0.000 0.000 0.308 1653 V C -1.217 174.908 176.094 0.051 0.000 1.168 1653 V CA -1.021 61.300 62.300 0.036 0.000 1.015 1653 V CB 2.725 34.570 31.823 0.036 0.000 1.050 1653 V HN -0.047 nan 8.190 nan 0.000 0.433 1654 I N 4.150 124.775 120.570 0.092 0.000 2.447 1654 I HA 0.528 4.698 4.170 -0.000 0.000 0.287 1654 I C -1.459 174.778 176.117 0.200 0.000 1.023 1654 I CA -0.507 60.881 61.300 0.148 0.000 1.083 1654 I CB 1.854 39.950 38.000 0.160 0.000 1.245 1654 I HN 0.861 nan 8.210 nan 0.000 0.434 1655 Y N 8.692 129.043 120.300 0.086 0.000 2.425 1655 Y HA 0.781 5.330 4.550 -0.000 0.000 0.344 1655 Y C -1.199 174.797 175.900 0.160 0.000 0.969 1655 Y CA -0.879 57.223 58.100 0.005 0.000 1.052 1655 Y CB 1.531 39.973 38.460 -0.030 0.000 1.215 1655 Y HN 0.486 nan 8.280 nan 0.000 0.451 1656 F N 1.176 120.803 119.950 -0.539 0.000 2.842 1656 F HA 0.595 5.122 4.527 -0.000 0.000 0.319 1656 F C -1.998 173.559 175.800 -0.406 0.000 1.159 1656 F CA -1.303 56.515 58.000 -0.304 0.000 0.902 1656 F CB 1.021 39.971 39.000 -0.082 0.000 1.311 1656 F HN 0.392 nan 8.300 nan 0.000 0.453 1657 E N 0.293 120.522 120.200 0.048 0.000 2.212 1657 E HA 0.676 5.026 4.350 -0.000 0.000 0.270 1657 E C -1.400 175.304 176.600 0.172 0.000 0.956 1657 E CA -1.342 55.032 56.400 -0.045 0.000 0.825 1657 E CB 2.011 31.666 29.700 -0.075 0.000 1.167 1657 E HN 0.656 nan 8.360 nan 0.000 0.400 1658 S N 2.091 117.834 115.700 0.073 0.000 2.599 1658 S HA 0.283 4.753 4.470 -0.000 0.000 0.269 1658 S C -2.777 171.857 174.600 0.056 0.000 1.135 1658 S CA -1.254 57.013 58.200 0.111 0.000 1.027 1658 S CB 0.766 64.099 63.200 0.222 0.000 1.129 1658 S HN 0.288 nan 8.310 nan 0.000 0.458 1659 P HA 0.473 nan 4.420 nan 0.000 0.272 1659 P C -1.082 176.221 177.300 0.006 0.000 1.230 1659 P CA -0.444 62.703 63.100 0.078 0.000 0.788 1659 P CB 0.745 32.529 31.700 0.140 0.000 0.949 1660 A N 1.945 124.804 122.820 0.065 0.000 2.355 1660 A HA 0.433 4.753 4.320 -0.000 0.000 0.317 1660 A C 0.159 177.787 177.584 0.073 0.000 1.094 1660 A CA -0.778 51.277 52.037 0.031 0.000 0.764 1660 A CB 0.507 19.575 19.000 0.113 0.000 1.230 1660 A HN 0.492 nan 8.150 nan 0.000 0.448 1661 N N 1.930 120.653 118.700 0.039 0.000 2.340 1661 N HA 0.183 4.923 4.740 -0.000 0.000 0.236 1661 N C -1.730 173.801 175.510 0.035 0.000 1.296 1661 N CA -0.804 52.295 53.050 0.083 0.000 0.896 1661 N CB 0.610 39.161 38.487 0.106 0.000 1.127 1661 N HN 0.433 nan 8.380 nan 0.000 0.442 1662 P HA 0.128 nan 4.420 nan 0.000 0.245 1662 P C -0.107 177.142 177.300 -0.086 0.000 1.199 1662 P CA 0.812 63.900 63.100 -0.020 0.000 0.807 1662 P CB 0.326 31.983 31.700 -0.071 0.000 1.002 1663 N N 0.402 119.016 118.700 -0.143 0.000 2.268 1663 N HA 0.176 4.916 4.740 -0.000 0.000 0.204 1663 N C -0.109 175.523 175.510 0.204 0.000 1.124 1663 N CA -0.191 52.711 53.050 -0.247 0.000 0.838 1663 N CB -0.162 38.133 38.487 -0.321 0.000 0.994 1663 N HN -0.249 nan 8.380 nan 0.000 0.489 1664 M N 0.287 120.024 119.600 0.229 0.000 2.537 1664 M HA -0.197 4.283 4.480 -0.000 0.000 0.205 1664 M C -0.201 176.314 176.300 0.358 0.000 0.450 1664 M CA 0.723 56.207 55.300 0.306 0.000 0.553 1664 M CB -3.033 29.769 32.600 0.337 0.000 2.046 1664 M HN 0.392 nan 8.290 nan 0.000 0.797 1665 H N 1.033 120.194 119.070 0.153 0.000 2.928 1665 H HA 0.392 4.948 4.556 -0.000 0.000 0.338 1665 H C 0.413 175.800 175.328 0.098 0.000 1.047 1665 H CA 0.808 56.911 56.048 0.092 0.000 1.435 1665 H CB 0.624 30.396 29.762 0.016 0.000 1.428 1665 H HN 0.330 nan 8.280 nan 0.000 0.590 1666 M N 3.101 122.420 119.600 -0.467 0.000 2.573 1666 M HA 0.559 5.039 4.480 -0.000 0.000 0.309 1666 M C -0.063 175.961 176.300 -0.460 0.000 1.202 1666 M CA -0.915 54.210 55.300 -0.292 0.000 0.975 1666 M CB 1.614 34.148 32.600 -0.110 0.000 1.600 1666 M HN 0.696 nan 8.290 nan 0.000 0.479 1667 A N 0.427 123.102 122.820 -0.242 0.000 2.423 1667 A HA 0.514 4.834 4.320 -0.000 0.000 0.304 1667 A C -1.018 176.456 177.584 -0.184 0.000 1.104 1667 A CA -0.551 51.302 52.037 -0.307 0.000 0.757 1667 A CB 1.158 19.787 19.000 -0.618 0.000 1.313 1667 A HN 0.744 nan 8.150 nan 0.000 0.423 1668 D N 2.031 122.324 120.400 -0.177 0.000 2.522 1668 D HA 0.276 4.916 4.640 -0.000 0.000 0.218 1668 D C 1.218 177.494 176.300 -0.041 0.000 1.149 1668 D CA -0.199 53.749 54.000 -0.086 0.000 0.981 1668 D CB -0.245 40.512 40.800 -0.072 0.000 1.041 1668 D HN 0.433 nan 8.370 nan 0.000 0.518 1669 I N 1.686 122.277 120.570 0.035 0.000 2.113 1669 I HA -0.374 3.796 4.170 -0.000 0.000 0.242 1669 I C 2.317 178.487 176.117 0.088 0.000 1.064 1669 I CA 1.527 62.912 61.300 0.142 0.000 1.320 1669 I CB -0.244 37.843 38.000 0.144 0.000 1.028 1669 I HN 0.339 nan 8.210 nan 0.000 0.406 1670 A N 0.817 123.664 122.820 0.045 0.000 1.930 1670 A HA -0.075 4.245 4.320 -0.000 0.000 0.217 1670 A C 2.433 180.033 177.584 0.027 0.000 1.175 1670 A CA 1.790 53.847 52.037 0.033 0.000 0.627 1670 A CB -1.330 17.681 19.000 0.018 0.000 0.815 1670 A HN 0.499 nan 8.150 nan 0.000 0.443 1671 G N -0.539 108.268 108.800 0.012 0.000 2.404 1671 G HA2 -0.089 3.871 3.960 -0.000 0.000 0.215 1671 G HA3 -0.089 3.871 3.960 -0.000 0.000 0.215 1671 G C 1.513 176.421 174.900 0.013 0.000 1.174 1671 G CA 1.199 46.302 45.100 0.004 0.000 0.780 1671 G HN 0.293 nan 8.290 nan 0.000 0.537 1672 V N 1.641 121.561 119.914 0.010 0.000 2.295 1672 V HA -0.131 3.989 4.120 -0.000 0.000 0.246 1672 V C 3.351 179.489 176.094 0.073 0.000 1.049 1672 V CA 2.037 64.354 62.300 0.029 0.000 1.024 1672 V CB -0.887 30.951 31.823 0.026 0.000 0.648 1672 V HN 0.466 nan 8.190 nan 0.000 0.447 1673 A N 0.055 122.927 122.820 0.086 0.000 1.940 1673 A HA -0.277 4.043 4.320 -0.000 0.000 0.219 1673 A C 2.362 179.984 177.584 0.064 0.000 1.176 1673 A CA 2.204 54.288 52.037 0.079 0.000 0.631 1673 A CB -0.512 18.528 19.000 0.068 0.000 0.814 1673 A HN 0.560 nan 8.150 nan 0.000 0.446 1674 K N -0.164 120.267 120.400 0.053 0.000 2.097 1674 K HA -0.067 4.253 4.320 -0.000 0.000 0.205 1674 K C 1.819 178.459 176.600 0.067 0.000 1.050 1674 K CA 1.555 57.870 56.287 0.048 0.000 0.938 1674 K CB -0.299 32.222 32.500 0.034 0.000 0.718 1674 K HN 0.484 nan 8.250 nan 0.000 0.442 1675 I N 1.380 121.999 120.570 0.081 0.000 2.286 1675 I HA -0.196 3.974 4.170 -0.000 0.000 0.245 1675 I C 2.534 178.768 176.117 0.195 0.000 1.104 1675 I CA 1.098 62.479 61.300 0.134 0.000 1.397 1675 I CB -0.257 37.797 38.000 0.089 0.000 1.072 1675 I HN 0.234 nan 8.210 nan 0.000 0.417 1676 A N 0.322 123.216 122.820 0.123 0.000 2.015 1676 A HA -0.154 4.166 4.320 -0.000 0.000 0.219 1676 A C 2.300 179.955 177.584 0.120 0.000 1.163 1676 A CA 1.162 53.272 52.037 0.121 0.000 0.646 1676 A CB -0.364 18.690 19.000 0.090 0.000 0.806 1676 A HN 0.213 nan 8.150 nan 0.000 0.448 1677 R N 0.371 120.925 120.500 0.090 0.000 2.115 1677 R HA -0.112 4.228 4.340 -0.000 0.000 0.230 1677 R C 2.063 178.390 176.300 0.045 0.000 1.111 1677 R CA 1.720 57.856 56.100 0.060 0.000 0.976 1677 R CB -0.419 29.907 30.300 0.043 0.000 0.870 1677 R HN 0.866 nan 8.270 nan 0.000 0.445 1678 K N -1.061 119.366 120.400 0.045 0.000 2.305 1678 K HA -0.027 4.293 4.320 -0.000 0.000 0.199 1678 K C 1.290 177.815 176.600 -0.125 0.000 1.047 1678 K CA 1.087 57.348 56.287 -0.043 0.000 0.976 1678 K CB -0.038 32.416 32.500 -0.076 0.000 0.765 1678 K HN 0.224 nan 8.250 nan 0.000 0.474 1679 H N 0.010 119.088 119.070 0.014 0.000 2.592 1679 H HA 0.137 4.693 4.556 -0.000 0.000 0.265 1679 H C 0.726 176.063 175.328 0.014 0.000 0.955 1679 H CA 0.800 56.856 56.048 0.013 0.000 1.175 1679 H CB 1.063 30.834 29.762 0.014 0.000 1.433 1679 H HN 0.575 nan 8.280 nan 0.000 0.537 1680 G N 1.113 109.978 108.800 0.109 0.000 2.137 1680 G HA2 -0.231 3.729 3.960 -0.000 0.000 0.237 1680 G HA3 -0.231 3.729 3.960 -0.000 0.000 0.237 1680 G C 0.321 175.266 174.900 0.075 0.000 1.002 1680 G CA 0.305 45.448 45.100 0.071 0.000 0.702 1680 G HN 0.644 nan 8.290 nan 0.000 0.515 1681 A N -0.430 122.445 122.820 0.091 0.000 2.293 1681 A HA 0.825 5.145 4.320 -0.000 0.000 0.302 1681 A C 0.543 178.162 177.584 0.058 0.000 1.119 1681 A CA 0.504 52.582 52.037 0.068 0.000 0.823 1681 A CB 0.867 19.904 19.000 0.061 0.000 1.097 1681 A HN 0.681 nan 8.150 nan 0.000 0.491 1682 T N 1.536 116.119 114.554 0.049 0.000 2.767 1682 T HA 0.455 4.805 4.350 -0.000 0.000 0.288 1682 T C -0.327 174.402 174.700 0.048 0.000 0.963 1682 T CA -0.142 61.984 62.100 0.044 0.000 1.019 1682 T CB 0.740 69.632 68.868 0.039 0.000 0.923 1682 T HN 0.389 nan 8.240 nan 0.000 0.468 1683 V N 4.883 124.820 119.914 0.038 0.000 2.383 1683 V HA 0.515 4.635 4.120 -0.000 0.000 0.275 1683 V C 0.062 176.125 176.094 -0.052 0.000 1.036 1683 V CA -0.642 61.671 62.300 0.022 0.000 0.889 1683 V CB 1.319 33.172 31.823 0.050 0.000 0.985 1683 V HN 0.670 nan 8.190 nan 0.000 0.459 1684 V N 6.815 126.663 119.914 -0.110 0.000 2.487 1684 V HA 0.748 4.868 4.120 -0.000 0.000 0.298 1684 V C -0.735 175.054 176.094 -0.509 0.000 1.028 1684 V CA -0.252 61.947 62.300 -0.169 0.000 0.860 1684 V CB 2.086 33.928 31.823 0.031 0.000 0.991 1684 V HN 0.563 nan 8.190 nan 0.000 0.427 1685 V N 5.456 125.045 119.914 -0.543 0.000 2.495 1685 V HA 0.451 4.570 4.120 -0.000 0.000 0.298 1685 V C -0.381 175.372 176.094 -0.569 0.000 1.031 1685 V CA -0.510 61.319 62.300 -0.784 0.000 0.871 1685 V CB 1.758 33.192 31.823 -0.648 0.000 0.988 1685 V HN 0.992 nan 8.190 nan 0.000 0.432 1686 D N 3.914 123.943 120.400 -0.617 0.000 2.374 1686 D HA 0.032 4.672 4.640 -0.000 0.000 0.240 1686 D C 0.549 176.656 176.300 -0.322 0.000 1.229 1686 D CA 0.307 54.071 54.000 -0.394 0.000 0.895 1686 D CB 0.294 40.920 40.800 -0.290 0.000 1.046 1686 D HN 0.635 nan 8.370 nan 0.000 0.498 1687 N N 2.812 121.271 118.700 -0.402 0.000 2.327 1687 N HA -0.011 4.729 4.740 -0.000 0.000 0.231 1687 N C 0.586 176.074 175.510 -0.037 0.000 1.130 1687 N CA -0.161 52.737 53.050 -0.253 0.000 0.845 1687 N CB 0.438 38.765 38.487 -0.266 0.000 1.073 1687 N HN 0.285 nan 8.380 nan 0.000 0.496 1688 T N 0.142 114.717 114.554 0.035 0.000 2.652 1688 T HA -0.158 4.192 4.350 -0.000 0.000 0.267 1688 T C 1.237 176.241 174.700 0.506 0.000 1.039 1688 T CA 1.268 63.562 62.100 0.323 0.000 1.153 1688 T CB -0.271 68.730 68.868 0.222 0.000 0.863 1688 T HN 0.336 nan 8.240 nan 0.000 0.428 1689 Y N 0.729 121.142 120.300 0.188 0.000 2.181 1689 Y HA -0.109 4.441 4.550 -0.000 0.000 0.288 1689 Y C 2.918 178.893 175.900 0.125 0.000 1.146 1689 Y CA -0.381 57.868 58.100 0.249 0.000 1.164 1689 Y CB -1.148 37.410 38.460 0.163 0.000 0.982 1689 Y HN 0.300 nan 8.280 nan 0.000 0.515 1690 C N -1.091 118.346 119.300 0.228 0.000 2.505 1690 C HA 0.113 4.573 4.460 -0.000 0.000 0.279 1690 C C 1.053 176.076 174.990 0.055 0.000 1.316 1690 C CA 1.073 60.129 59.018 0.064 0.000 1.720 1690 C CB -1.249 26.522 27.740 0.051 0.000 2.050 1690 C HN 0.787 nan 8.230 nan 0.000 0.493 1691 T N -2.107 112.568 114.554 0.202 0.000 0.541 1691 T HA -0.131 4.219 4.350 -0.000 0.000 0.774 1691 T C -2.061 172.771 174.700 0.220 0.000 0.992 1691 T CA 0.119 62.357 62.100 0.230 0.000 4.077 1691 T CB -1.623 67.326 68.868 0.135 0.000 2.303 1691 T HN 0.165 nan 8.240 nan 0.000 0.398 1692 P HA -0.045 nan 4.420 nan 0.000 0.228 1692 P C 1.246 178.701 177.300 0.259 0.000 1.151 1692 P CA 1.275 64.536 63.100 0.269 0.000 0.770 1692 P CB -0.252 31.622 31.700 0.291 0.000 0.786 1693 Y N 0.854 121.153 120.300 -0.002 0.000 2.314 1693 Y HA -0.016 4.534 4.550 -0.000 0.000 0.293 1693 Y C 2.083 177.788 175.900 -0.324 0.000 1.129 1693 Y CA 1.233 59.038 58.100 -0.492 0.000 1.201 1693 Y CB -0.585 37.574 38.460 -0.502 0.000 0.999 1693 Y HN -0.199 nan 8.280 nan 0.000 0.541 1694 L N -0.652 120.427 121.223 -0.240 0.000 2.515 1694 L HA 0.179 4.519 4.340 -0.000 0.000 0.223 1694 L C 0.248 177.019 176.870 -0.165 0.000 1.079 1694 L CA 0.283 54.950 54.840 -0.288 0.000 0.857 1694 L CB 0.333 42.274 42.059 -0.196 0.000 1.050 1694 L HN 0.050 nan 8.230 nan 0.000 0.476 1695 Q N 0.211 119.971 119.800 -0.066 0.000 2.352 1695 Q HA 0.369 4.709 4.340 -0.000 0.000 0.270 1695 Q C -1.201 174.818 176.000 0.031 0.000 1.006 1695 Q CA -0.583 55.205 55.803 -0.025 0.000 0.880 1695 Q CB 2.306 31.037 28.738 -0.012 0.000 1.392 1695 Q HN 0.060 nan 8.270 nan 0.000 0.401 1696 R N 4.149 124.664 120.500 0.025 0.000 2.443 1696 R HA 0.271 4.611 4.340 -0.000 0.000 0.287 1696 R C -2.072 174.243 176.300 0.025 0.000 1.425 1696 R CA -1.628 54.501 56.100 0.049 0.000 1.300 1696 R CB 1.163 31.497 30.300 0.058 0.000 1.129 1696 R HN 0.430 nan 8.270 nan 0.000 0.577 1697 P HA -0.201 nan 4.420 nan 0.000 0.217 1697 P C 0.915 178.214 177.300 -0.000 0.000 1.148 1697 P CA 1.190 64.286 63.100 -0.006 0.000 0.828 1697 P CB 0.275 31.939 31.700 -0.060 0.000 0.783 1698 L N -0.619 120.606 121.223 0.005 0.000 2.131 1698 L HA -0.168 4.172 4.340 -0.000 0.000 0.210 1698 L C 2.133 179.012 176.870 0.015 0.000 1.092 1698 L CA 1.548 56.394 54.840 0.009 0.000 0.759 1698 L CB -0.898 41.171 42.059 0.017 0.000 0.903 1698 L HN 0.057 nan 8.230 nan 0.000 0.435 1699 E N -0.065 120.146 120.200 0.019 0.000 2.427 1699 E HA -0.064 4.286 4.350 -0.000 0.000 0.196 1699 E C 1.752 178.361 176.600 0.015 0.000 1.028 1699 E CA 0.406 56.816 56.400 0.017 0.000 0.864 1699 E CB 0.187 29.899 29.700 0.019 0.000 0.813 1699 E HN 0.482 nan 8.360 nan 0.000 0.514 1700 L N -1.095 120.139 121.223 0.017 0.000 2.667 1700 L HA 0.281 4.621 4.340 -0.000 0.000 0.232 1700 L C 1.269 178.156 176.870 0.028 0.000 1.138 1700 L CA 0.250 55.102 54.840 0.021 0.000 0.921 1700 L CB 0.676 42.750 42.059 0.025 0.000 1.180 1700 L HN 0.269 nan 8.230 nan 0.000 0.487 1701 G N -0.377 108.438 108.800 0.025 0.000 2.284 1701 G HA2 -0.209 3.751 3.960 -0.000 0.000 0.201 1701 G HA3 -0.209 3.751 3.960 -0.000 0.000 0.201 1701 G C 0.489 175.407 174.900 0.029 0.000 0.998 1701 G CA -0.205 44.913 45.100 0.030 0.000 0.651 1701 G HN 0.388 nan 8.290 nan 0.000 0.489 1702 A N 0.586 123.419 122.820 0.021 0.000 2.520 1702 A HA 0.486 4.806 4.320 -0.000 0.000 0.235 1702 A C 1.144 178.726 177.584 -0.004 0.000 1.065 1702 A CA 1.136 53.172 52.037 -0.002 0.000 0.764 1702 A CB 0.222 19.193 19.000 -0.049 0.000 1.002 1702 A HN 0.250 nan 8.150 nan 0.000 0.502 1703 D N 0.164 120.560 120.400 -0.007 0.000 2.240 1703 D HA 0.190 4.830 4.640 -0.000 0.000 0.206 1703 D C 0.033 176.331 176.300 -0.004 0.000 0.963 1703 D CA 1.139 55.141 54.000 0.003 0.000 0.863 1703 D CB 0.158 40.966 40.800 0.013 0.000 0.973 1703 D HN 0.438 nan 8.370 nan 0.000 0.501 1704 L N 0.152 121.360 121.223 -0.026 0.000 2.465 1704 L HA 0.358 4.698 4.340 -0.000 0.000 0.257 1704 L C -0.933 175.891 176.870 -0.077 0.000 0.988 1704 L CA -1.032 53.792 54.840 -0.027 0.000 0.827 1704 L CB 2.943 45.000 42.059 -0.003 0.000 1.397 1704 L HN -0.260 nan 8.230 nan 0.000 0.410 1705 V N -0.121 119.753 119.914 -0.067 0.000 2.735 1705 V HA 0.906 5.026 4.120 -0.000 0.000 0.310 1705 V C -0.561 175.458 176.094 -0.127 0.000 1.061 1705 V CA -0.798 61.415 62.300 -0.146 0.000 0.913 1705 V CB 1.843 33.587 31.823 -0.131 0.000 1.005 1705 V HN 0.549 nan 8.190 nan 0.000 0.428 1706 V N 1.261 121.042 119.914 -0.222 0.000 2.769 1706 V HA 0.841 4.961 4.120 -0.000 0.000 0.312 1706 V C -0.851 175.067 176.094 -0.293 0.000 1.061 1706 V CA -0.404 61.819 62.300 -0.128 0.000 0.931 1706 V CB 1.600 33.418 31.823 -0.009 0.000 1.010 1706 V HN 1.112 nan 8.190 nan 0.000 0.433 1707 H N 1.145 120.225 119.070 0.016 0.000 2.806 1707 H HA 0.660 5.216 4.556 -0.000 0.000 0.367 1707 H C -0.511 174.825 175.328 0.013 0.000 1.136 1707 H CA -0.213 55.849 56.048 0.025 0.000 1.178 1707 H CB 2.062 31.852 29.762 0.045 0.000 1.718 1707 H HN 0.884 nan 8.280 nan 0.000 0.540 1708 S N 2.050 117.834 115.700 0.139 0.000 2.592 1708 S HA 0.370 4.840 4.470 -0.000 0.000 0.305 1708 S C 1.123 175.777 174.600 0.089 0.000 1.118 1708 S CA -0.192 58.041 58.200 0.055 0.000 1.075 1708 S CB -0.166 63.011 63.200 -0.038 0.000 1.107 1708 S HN 0.781 nan 8.310 nan 0.000 0.503 1709 A N 4.348 127.219 122.820 0.085 0.000 2.178 1709 A HA 0.098 4.418 4.320 -0.000 0.000 0.218 1709 A C 1.397 179.005 177.584 0.040 0.000 1.157 1709 A CA 0.910 52.982 52.037 0.058 0.000 0.689 1709 A CB -0.900 18.122 19.000 0.037 0.000 0.787 1709 A HN 0.702 nan 8.150 nan 0.000 0.465 1713 L N 0.131 121.460 121.223 0.176 0.000 1.990 1713 L HA -0.281 4.059 4.340 -0.000 0.000 0.213 1713 L C 2.506 179.432 176.870 0.093 0.000 1.072 1713 L CA 2.353 57.249 54.840 0.093 0.000 0.755 1713 L CB -0.568 41.500 42.059 0.015 0.000 0.889 1713 L HN 0.371 nan 8.230 nan 0.000 0.432 1714 S N -0.678 115.074 115.700 0.086 0.000 2.357 1714 S HA -0.083 4.387 4.470 -0.000 0.000 0.221 1714 S C 1.799 176.525 174.600 0.211 0.000 1.031 1714 S CA 1.441 59.706 58.200 0.109 0.000 0.982 1714 S CB -0.254 62.990 63.200 0.074 0.000 0.853 1714 S HN 0.648 nan 8.310 nan 0.000 0.458 1715 G N 0.136 109.005 108.800 0.114 0.000 2.257 1715 G HA2 -0.292 3.668 3.960 -0.000 0.000 0.267 1715 G HA3 -0.292 3.668 3.960 -0.000 0.000 0.267 1715 G C 0.468 175.238 174.900 -0.216 0.000 0.984 1715 G CA 1.057 46.160 45.100 0.005 0.000 0.626 1715 G HN 0.726 nan 8.290 nan 0.000 0.540 1716 H N -0.488 118.591 119.070 0.015 0.000 2.674 1716 H HA 0.461 5.017 4.556 -0.000 0.000 0.274 1716 H C 1.836 177.162 175.328 -0.003 0.000 1.121 1716 H CA 0.307 56.358 56.048 0.005 0.000 1.132 1716 H CB 0.457 30.217 29.762 -0.004 0.000 1.606 1716 H HN 1.117 nan 8.280 nan 0.000 0.558 1717 G N 2.061 110.902 108.800 0.070 0.000 2.321 1717 G HA2 -0.345 3.615 3.960 -0.000 0.000 0.287 1717 G HA3 -0.345 3.615 3.960 -0.000 0.000 0.287 1717 G C 0.366 175.296 174.900 0.050 0.000 1.018 1717 G CA 1.015 46.138 45.100 0.038 0.000 0.855 1717 G HN 0.633 nan 8.290 nan 0.000 0.507 1718 D N -1.028 119.410 120.400 0.063 0.000 2.431 1718 D HA 0.286 4.926 4.640 -0.000 0.000 0.213 1718 D C 1.013 177.345 176.300 0.052 0.000 1.130 1718 D CA 0.364 54.396 54.000 0.053 0.000 0.834 1718 D CB -0.089 40.741 40.800 0.049 0.000 0.985 1718 D HN 0.975 nan 8.370 nan 0.000 0.504 1719 I N -2.974 117.624 120.570 0.046 0.000 2.994 1719 I HA 0.655 4.825 4.170 -0.000 0.000 0.306 1719 I C -1.176 174.965 176.117 0.040 0.000 1.195 1719 I CA -1.058 60.270 61.300 0.046 0.000 1.001 1719 I CB 2.598 40.619 38.000 0.035 0.000 1.244 1719 I HN -0.160 nan 8.210 nan 0.000 0.437 1720 T N 1.855 116.434 114.554 0.041 0.000 2.807 1720 T HA 0.925 5.275 4.350 -0.000 0.000 0.279 1720 T C -0.500 174.221 174.700 0.036 0.000 0.993 1720 T CA -0.255 61.867 62.100 0.037 0.000 0.970 1720 T CB 1.444 70.337 68.868 0.041 0.000 0.950 1720 T HN 1.430 nan 8.240 nan 0.000 0.441 1721 A N 2.053 124.893 122.820 0.033 0.000 2.610 1721 A HA 0.971 5.291 4.320 -0.000 0.000 0.291 1721 A C -0.270 177.336 177.584 0.037 0.000 1.086 1721 A CA -0.594 51.462 52.037 0.032 0.000 0.677 1721 A CB 1.322 20.338 19.000 0.028 0.000 1.278 1721 A HN 1.492 nan 8.150 nan 0.000 0.414 1722 G N -0.238 108.586 108.800 0.040 0.000 2.619 1722 G HA2 0.672 4.632 3.960 -0.000 0.000 0.296 1722 G HA3 0.672 4.632 3.960 -0.000 0.000 0.296 1722 G C -1.357 173.581 174.900 0.064 0.000 1.334 1722 G CA -0.497 44.636 45.100 0.055 0.000 0.934 1722 G HN 0.627 nan 8.290 nan 0.000 0.476 1723 I N 0.336 120.967 120.570 0.100 0.000 2.722 1723 I HA 0.459 4.629 4.170 -0.000 0.000 0.295 1723 I C -0.819 175.376 176.117 0.129 0.000 1.161 1723 I CA -0.826 60.539 61.300 0.108 0.000 1.032 1723 I CB 1.998 40.066 38.000 0.113 0.000 1.244 1723 I HN 0.209 nan 8.210 nan 0.000 0.421 1724 V N 5.628 125.599 119.914 0.095 0.000 2.656 1724 V HA 0.645 4.765 4.120 -0.000 0.000 0.307 1724 V C -0.430 175.710 176.094 0.076 0.000 1.051 1724 V CA -0.674 61.673 62.300 0.078 0.000 0.893 1724 V CB 2.757 34.612 31.823 0.055 0.000 0.999 1724 V HN 0.465 nan 8.190 nan 0.000 0.426 1725 V N 3.003 122.960 119.914 0.072 0.000 2.760 1725 V HA 1.032 5.152 4.120 -0.000 0.000 0.309 1725 V C 0.368 176.486 176.094 0.039 0.000 1.077 1725 V CA 0.378 62.714 62.300 0.061 0.000 0.910 1725 V CB 1.582 33.455 31.823 0.082 0.000 1.008 1725 V HN 1.186 nan 8.190 nan 0.000 0.424 1726 G N 2.272 111.091 108.800 0.032 0.000 2.364 1726 G HA2 0.497 4.457 3.960 -0.000 0.000 0.286 1726 G HA3 0.497 4.457 3.960 -0.000 0.000 0.286 1726 G C -0.446 174.468 174.900 0.024 0.000 1.241 1726 G CA 0.088 45.202 45.100 0.024 0.000 0.887 1726 G HN 1.037 nan 8.290 nan 0.000 0.484 1727 S N -0.446 115.267 115.700 0.022 0.000 2.584 1727 S HA 0.234 4.704 4.470 -0.000 0.000 0.270 1727 S C 1.282 175.895 174.600 0.023 0.000 1.346 1727 S CA 0.792 59.005 58.200 0.021 0.000 1.018 1727 S CB 1.663 64.875 63.200 0.020 0.000 0.899 1727 S HN 0.801 nan 8.310 nan 0.000 0.542 1728 Q N 1.922 121.734 119.800 0.021 0.000 2.050 1728 Q HA -0.040 4.300 4.340 -0.000 0.000 0.202 1728 Q C 2.298 178.311 176.000 0.022 0.000 0.980 1728 Q CA 2.226 58.042 55.803 0.021 0.000 0.840 1728 Q CB -1.110 27.639 28.738 0.018 0.000 0.898 1728 Q HN 0.957 nan 8.270 nan 0.000 0.424 1729 A N -0.014 122.819 122.820 0.021 0.000 1.873 1729 A HA -0.195 4.125 4.320 -0.000 0.000 0.218 1729 A C 1.936 179.536 177.584 0.025 0.000 1.193 1729 A CA 1.666 53.716 52.037 0.021 0.000 0.629 1729 A CB -0.878 18.134 19.000 0.020 0.000 0.826 1729 A HN 0.436 nan 8.150 nan 0.000 0.447 1730 L N -0.465 120.774 121.223 0.026 0.000 2.027 1730 L HA -0.076 4.264 4.340 -0.000 0.000 0.206 1730 L C 2.641 179.531 176.870 0.033 0.000 1.074 1730 L CA 1.449 56.307 54.840 0.030 0.000 0.745 1730 L CB -0.944 41.132 42.059 0.029 0.000 0.898 1730 L HN 0.213 nan 8.230 nan 0.000 0.433 1731 V N -0.322 119.611 119.914 0.032 0.000 2.407 1731 V HA -0.264 3.856 4.120 -0.000 0.000 0.248 1731 V C 2.194 178.309 176.094 0.034 0.000 1.055 1731 V CA 1.562 63.883 62.300 0.034 0.000 1.049 1731 V CB -0.553 31.289 31.823 0.032 0.000 0.662 1731 V HN 0.373 nan 8.190 nan 0.000 0.455 1732 D N 0.004 120.422 120.400 0.031 0.000 2.097 1732 D HA -0.140 4.500 4.640 -0.000 0.000 0.195 1732 D C 2.430 178.753 176.300 0.038 0.000 0.989 1732 D CA 1.228 55.248 54.000 0.032 0.000 0.827 1732 D CB -0.243 40.573 40.800 0.028 0.000 0.966 1732 D HN 0.383 nan 8.370 nan 0.000 0.456 1733 R N 0.106 120.629 120.500 0.038 0.000 2.083 1733 R HA -0.060 4.280 4.340 -0.000 0.000 0.237 1733 R C 2.560 178.889 176.300 0.049 0.000 1.137 1733 R CA 0.848 56.973 56.100 0.041 0.000 0.951 1733 R CB -0.396 29.928 30.300 0.040 0.000 0.851 1733 R HN 0.254 nan 8.270 nan 0.000 0.434 1734 I N 0.351 120.951 120.570 0.050 0.000 2.286 1734 I HA -0.281 3.889 4.170 -0.000 0.000 0.248 1734 I C 2.838 178.989 176.117 0.056 0.000 1.115 1734 I CA 1.167 62.502 61.300 0.058 0.000 1.392 1734 I CB -0.291 37.743 38.000 0.056 0.000 1.065 1734 I HN 0.170 nan 8.210 nan 0.000 0.418 1735 R N 1.535 122.065 120.500 0.049 0.000 2.062 1735 R HA -0.132 4.208 4.340 -0.000 0.000 0.231 1735 R C 2.208 178.543 176.300 0.058 0.000 1.136 1735 R CA 1.512 57.642 56.100 0.049 0.000 0.948 1735 R CB -0.231 30.094 30.300 0.041 0.000 0.845 1735 R HN 0.317 nan 8.270 nan 0.000 0.430 1736 L N 0.033 121.292 121.223 0.059 0.000 2.478 1736 L HA -0.065 4.275 4.340 -0.000 0.000 0.223 1736 L C 1.693 178.597 176.870 0.056 0.000 1.140 1736 L CA 0.822 55.702 54.840 0.067 0.000 0.842 1736 L CB -0.037 42.061 42.059 0.065 0.000 0.953 1736 L HN 0.375 nan 8.230 nan 0.000 0.452 1737 Q N -1.331 118.499 119.800 0.050 0.000 2.474 1737 Q HA 0.155 4.495 4.340 -0.000 0.000 0.191 1737 Q C 2.182 178.206 176.000 0.040 0.000 0.700 1737 Q CA 0.515 56.341 55.803 0.039 0.000 0.849 1737 Q CB -0.451 28.311 28.738 0.039 0.000 1.232 1737 Q HN 0.239 nan 8.270 nan 0.000 0.563 1738 G N 1.990 110.829 108.800 0.065 0.000 2.476 1738 G HA2 -0.260 3.700 3.960 -0.000 0.000 0.218 1738 G HA3 -0.260 3.700 3.960 -0.000 0.000 0.218 1738 G C 1.337 176.278 174.900 0.068 0.000 1.164 1738 G CA 0.804 45.959 45.100 0.091 0.000 0.768 1738 G HN 0.161 nan 8.290 nan 0.000 0.560 1739 L N -0.082 121.177 121.223 0.061 0.000 2.034 1739 L HA 0.102 4.442 4.340 -0.000 0.000 0.203 1739 L C 2.840 179.741 176.870 0.052 0.000 1.074 1739 L CA 1.925 56.798 54.840 0.054 0.000 0.748 1739 L CB -0.450 41.640 42.059 0.053 0.000 0.905 1739 L HN 0.285 nan 8.230 nan 0.000 0.439 1740 K N -0.318 120.119 120.400 0.061 0.000 1.991 1740 K HA -0.225 4.095 4.320 -0.000 0.000 0.212 1740 K C 1.572 178.203 176.600 0.051 0.000 1.049 1740 K CA 2.307 58.639 56.287 0.076 0.000 0.932 1740 K CB 0.025 32.580 32.500 0.091 0.000 0.717 1740 K HN 0.371 nan 8.250 nan 0.000 0.441 1741 D N -0.417 119.996 120.400 0.021 0.000 2.259 1741 D HA 0.050 4.690 4.640 -0.000 0.000 0.216 1741 D C 0.582 176.845 176.300 -0.062 0.000 0.961 1741 D CA 0.824 54.814 54.000 -0.016 0.000 0.878 1741 D CB 0.213 40.997 40.800 -0.027 0.000 1.009 1741 D HN 0.216 nan 8.370 nan 0.000 0.490 1742 M N -0.118 119.434 119.600 -0.080 0.000 2.478 1742 M HA 0.214 4.694 4.480 -0.000 0.000 0.327 1742 M C 1.255 177.512 176.300 -0.071 0.000 1.187 1742 M CA -0.149 55.050 55.300 -0.168 0.000 1.022 1742 M CB 2.129 34.563 32.600 -0.278 0.000 1.629 1742 M HN 0.138 nan 8.290 nan 0.000 0.461 1743 T N -1.058 113.451 114.554 -0.075 0.000 12.724 1743 T HA -0.294 4.056 4.350 -0.000 0.000 0.418 1743 T C 1.289 175.999 174.700 0.017 0.000 1.446 1743 T CA 2.049 64.154 62.100 0.009 0.000 2.382 1743 T CB -2.328 66.578 68.868 0.063 0.000 2.829 1743 T HN 2.062 nan 8.240 nan 0.000 0.744 1744 G N 2.418 111.232 108.800 0.023 0.000 2.249 1744 G HA2 0.167 4.127 3.960 -0.000 0.000 0.273 1744 G HA3 0.167 4.127 3.960 -0.000 0.000 0.273 1744 G C 0.443 175.366 174.900 0.038 0.000 1.036 1744 G CA 0.852 45.975 45.100 0.038 0.000 0.824 1744 G HN 2.233 nan 8.290 nan 0.000 0.504 1745 A N 0.114 122.956 122.820 0.037 0.000 3.026 1745 A HA 0.588 4.908 4.320 -0.000 0.000 0.272 1745 A C 0.800 178.403 177.584 0.031 0.000 1.782 1745 A CA 0.091 52.147 52.037 0.033 0.000 1.451 1745 A CB 0.143 19.161 19.000 0.030 0.000 1.081 1745 A HN 1.010 nan 8.150 nan 0.000 0.611 1746 V N 2.784 122.715 119.914 0.028 0.000 2.488 1746 V HA 0.137 4.257 4.120 -0.000 0.000 0.277 1746 V C 0.310 176.414 176.094 0.017 0.000 1.046 1746 V CA -0.410 61.901 62.300 0.020 0.000 0.986 1746 V CB 1.074 32.902 31.823 0.009 0.000 0.989 1746 V HN 0.703 nan 8.190 nan 0.000 0.475 1747 L N 5.192 126.425 121.223 0.017 0.000 2.331 1747 L HA 0.381 4.721 4.340 -0.000 0.000 0.278 1747 L C 0.672 177.555 176.870 0.021 0.000 1.106 1747 L CA 0.794 55.647 54.840 0.022 0.000 0.824 1747 L CB 1.506 43.577 42.059 0.021 0.000 1.142 1747 L HN 0.731 nan 8.230 nan 0.000 0.443 1748 S N 5.827 121.547 115.700 0.034 0.000 2.533 1748 S HA 0.273 4.743 4.470 -0.000 0.000 0.282 1748 S C -1.613 173.022 174.600 0.058 0.000 1.304 1748 S CA -0.895 57.331 58.200 0.045 0.000 1.063 1748 S CB 0.725 63.965 63.200 0.068 0.000 0.881 1748 S HN 0.643 nan 8.310 nan 0.000 0.493 1749 P HA -0.160 nan 4.420 nan 0.000 0.219 1749 P C 1.315 178.647 177.300 0.053 0.000 1.146 1749 P CA 1.028 64.156 63.100 0.047 0.000 0.808 1749 P CB -0.109 31.628 31.700 0.061 0.000 0.779 1750 H N 0.354 119.410 119.070 -0.023 0.000 2.321 1750 H HA -0.117 4.439 4.556 -0.000 0.000 0.300 1750 H C 1.024 176.334 175.328 -0.031 0.000 1.087 1750 H CA 1.885 57.914 56.048 -0.032 0.000 1.319 1750 H CB -0.377 29.366 29.762 -0.031 0.000 1.379 1750 H HN -0.002 nan 8.280 nan 0.000 0.501 1751 D N 0.626 121.075 120.400 0.081 0.000 2.183 1751 D HA -0.019 4.621 4.640 -0.000 0.000 0.203 1751 D C 2.303 178.568 176.300 -0.057 0.000 0.969 1751 D CA 1.233 55.233 54.000 0.001 0.000 0.842 1751 D CB -0.423 40.430 40.800 0.088 0.000 0.957 1751 D HN 0.491 nan 8.370 nan 0.000 0.484 1752 A N 0.806 123.607 122.820 -0.032 0.000 1.933 1752 A HA -0.024 4.296 4.320 -0.000 0.000 0.218 1752 A C 2.255 179.790 177.584 -0.081 0.000 1.175 1752 A CA 1.980 53.992 52.037 -0.041 0.000 0.628 1752 A CB -0.671 18.315 19.000 -0.022 0.000 0.814 1752 A HN 0.230 nan 8.150 nan 0.000 0.444 1753 A N -0.393 122.358 122.820 -0.115 0.000 1.898 1753 A HA 0.019 4.339 4.320 -0.000 0.000 0.216 1753 A C 2.136 179.615 177.584 -0.176 0.000 1.181 1753 A CA 1.342 53.289 52.037 -0.150 0.000 0.620 1753 A CB -0.547 18.355 19.000 -0.163 0.000 0.819 1753 A HN 0.451 nan 8.150 nan 0.000 0.442 1754 L N -0.906 120.184 121.223 -0.223 0.000 2.131 1754 L HA -0.149 4.191 4.340 -0.000 0.000 0.210 1754 L C 2.514 179.307 176.870 -0.129 0.000 1.092 1754 L CA 0.925 55.641 54.840 -0.207 0.000 0.759 1754 L CB -0.318 41.597 42.059 -0.239 0.000 0.903 1754 L HN 0.493 nan 8.230 nan 0.000 0.435 1755 L N -0.491 120.676 121.223 -0.093 0.000 2.044 1755 L HA -0.168 4.172 4.340 -0.000 0.000 0.205 1755 L C 2.387 179.223 176.870 -0.056 0.000 1.075 1755 L CA 1.710 56.521 54.840 -0.049 0.000 0.747 1755 L CB -0.346 41.694 42.059 -0.032 0.000 0.903 1755 L HN 0.146 nan 8.230 nan 0.000 0.435 1756 M N -0.983 118.569 119.600 -0.079 0.000 2.213 1756 M HA -0.211 4.269 4.480 -0.000 0.000 0.263 1756 M C 2.435 178.678 176.300 -0.095 0.000 1.062 1756 M CA 1.513 56.761 55.300 -0.087 0.000 1.105 1756 M CB -0.355 32.179 32.600 -0.110 0.000 1.385 1756 M HN 0.269 nan 8.290 nan 0.000 0.417 1757 R N 0.235 120.667 120.500 -0.114 0.000 2.081 1757 R HA -0.117 4.223 4.340 -0.000 0.000 0.235 1757 R C 2.208 178.451 176.300 -0.096 0.000 1.131 1757 R CA 1.671 57.696 56.100 -0.126 0.000 0.960 1757 R CB -0.470 29.732 30.300 -0.164 0.000 0.856 1757 R HN 0.446 nan 8.270 nan 0.000 0.436 1758 G N 0.984 109.745 108.800 -0.065 0.000 2.418 1758 G HA2 -0.225 3.735 3.960 -0.000 0.000 0.217 1758 G HA3 -0.225 3.735 3.960 -0.000 0.000 0.217 1758 G C 1.445 176.380 174.900 0.059 0.000 1.158 1758 G CA 0.686 45.813 45.100 0.044 0.000 0.771 1758 G HN 0.277 nan 8.290 nan 0.000 0.545 1759 I N 0.246 120.824 120.570 0.012 0.000 2.530 1759 I HA -0.136 4.034 4.170 -0.000 0.000 0.257 1759 I C 2.616 178.725 176.117 -0.013 0.000 1.179 1759 I CA 0.895 62.197 61.300 0.004 0.000 1.440 1759 I CB -0.038 37.945 38.000 -0.029 0.000 1.087 1759 I HN 0.113 nan 8.210 nan 0.000 0.440 1760 K N 0.117 120.497 120.400 -0.032 0.000 2.362 1760 K HA -0.099 4.221 4.320 -0.000 0.000 0.200 1760 K C 1.344 177.930 176.600 -0.025 0.000 1.046 1760 K CA 1.629 57.888 56.287 -0.048 0.000 0.952 1760 K CB -0.032 32.423 32.500 -0.075 0.000 0.753 1760 K HN 0.434 nan 8.250 nan 0.000 0.466 1761 T N -2.083 112.472 114.554 0.002 0.000 3.252 1761 T HA 0.131 4.481 4.350 -0.000 0.000 0.286 1761 T C 1.148 175.836 174.700 -0.020 0.000 1.013 1761 T CA -0.447 61.652 62.100 -0.001 0.000 0.914 1761 T CB 0.161 69.049 68.868 0.033 0.000 1.131 1761 T HN -0.054 nan 8.240 nan 0.000 0.529 1762 L N 3.424 124.637 121.223 -0.017 0.000 1.971 1762 L HA -0.140 4.200 4.340 -0.000 0.000 0.215 1762 L C 2.444 179.147 176.870 -0.279 0.000 1.072 1762 L CA 2.455 57.268 54.840 -0.045 0.000 0.758 1762 L CB -0.767 41.321 42.059 0.050 0.000 0.889 1762 L HN 0.511 nan 8.230 nan 0.000 0.433 1763 N N -0.020 118.383 118.700 -0.496 0.000 2.104 1763 N HA -0.261 4.479 4.740 -0.000 0.000 0.190 1763 N C 1.894 177.103 175.510 -0.503 0.000 1.024 1763 N CA 2.406 54.758 53.050 -1.163 0.000 0.853 1763 N CB -0.933 37.065 38.487 -0.815 0.000 1.008 1763 N HN 0.519 nan 8.380 nan 0.000 0.424 1764 L N 0.108 121.195 121.223 -0.225 0.000 2.056 1764 L HA 0.004 4.344 4.340 -0.000 0.000 0.207 1764 L C 2.948 179.764 176.870 -0.091 0.000 1.078 1764 L CA 0.969 55.745 54.840 -0.106 0.000 0.749 1764 L CB -0.328 41.692 42.059 -0.064 0.000 0.901 1764 L HN 0.121 nan 8.230 nan 0.000 0.433 1765 R N -0.752 119.695 120.500 -0.088 0.000 2.075 1765 R HA -0.091 4.248 4.340 -0.000 0.000 0.232 1765 R C 2.331 178.624 176.300 -0.011 0.000 1.126 1765 R CA 1.118 57.165 56.100 -0.088 0.000 0.963 1765 R CB -0.187 30.107 30.300 -0.011 0.000 0.858 1765 R HN 0.207 nan 8.270 nan 0.000 0.435 1766 M N 0.834 120.473 119.600 0.064 0.000 2.159 1766 M HA -0.140 4.340 4.480 -0.000 0.000 0.263 1766 M C 1.324 177.710 176.300 0.143 0.000 1.063 1766 M CA 1.520 56.906 55.300 0.143 0.000 1.110 1766 M CB -0.795 31.916 32.600 0.185 0.000 1.374 1766 M HN -0.001 nan 8.290 nan 0.000 0.411 1767 D N -0.326 120.142 120.400 0.115 0.000 2.117 1767 D HA -0.163 4.477 4.640 -0.000 0.000 0.197 1767 D C 2.173 178.498 176.300 0.042 0.000 0.987 1767 D CA 1.134 55.194 54.000 0.100 0.000 0.829 1767 D CB -0.168 40.677 40.800 0.074 0.000 0.961 1767 D HN 0.150 nan 8.370 nan 0.000 0.460 1768 R N 0.040 120.528 120.500 -0.019 0.000 2.073 1768 R HA -0.071 4.269 4.340 -0.000 0.000 0.229 1768 R C 2.132 178.414 176.300 -0.030 0.000 1.120 1768 R CA 1.309 57.372 56.100 -0.062 0.000 0.967 1768 R CB -0.674 29.538 30.300 -0.145 0.000 0.862 1768 R HN 0.279 nan 8.270 nan 0.000 0.436 1769 H N -0.606 118.479 119.070 0.025 0.000 2.290 1769 H HA -0.150 4.406 4.556 -0.000 0.000 0.298 1769 H C 2.144 177.506 175.328 0.057 0.000 1.087 1769 H CA 1.976 58.054 56.048 0.050 0.000 1.291 1769 H CB -0.595 29.212 29.762 0.074 0.000 1.369 1769 H HN 0.259 nan 8.280 nan 0.000 0.492 1770 C N 0.573 119.984 119.300 0.185 0.000 2.453 1770 C HA -0.037 4.423 4.460 -0.000 0.000 0.277 1770 C C 3.153 178.218 174.990 0.125 0.000 1.262 1770 C CA 0.797 59.906 59.018 0.152 0.000 1.718 1770 C CB -1.100 26.697 27.740 0.094 0.000 2.031 1770 C HN 0.637 nan 8.230 nan 0.000 0.480 1771 A N 1.197 124.064 122.820 0.079 0.000 1.908 1771 A HA -0.198 4.122 4.320 -0.000 0.000 0.218 1771 A C 1.903 179.508 177.584 0.036 0.000 1.181 1771 A CA 2.109 54.177 52.037 0.051 0.000 0.627 1771 A CB -0.620 18.397 19.000 0.027 0.000 0.818 1771 A HN 0.629 nan 8.150 nan 0.000 0.445 1772 N N 0.232 118.952 118.700 0.033 0.000 2.142 1772 N HA -0.054 4.686 4.740 -0.000 0.000 0.186 1772 N C 1.892 177.406 175.510 0.007 0.000 1.023 1772 N CA 1.563 54.623 53.050 0.017 0.000 0.852 1772 N CB -0.589 37.910 38.487 0.019 0.000 0.998 1772 N HN 0.444 nan 8.380 nan 0.000 0.424 1773 A N 0.670 123.504 122.820 0.023 0.000 1.902 1773 A HA -0.212 4.108 4.320 -0.000 0.000 0.217 1773 A C 2.212 179.597 177.584 -0.331 0.000 1.181 1773 A CA 1.745 53.718 52.037 -0.106 0.000 0.623 1773 A CB -0.758 18.249 19.000 0.011 0.000 0.818 1773 A HN 0.297 nan 8.150 nan 0.000 0.443 1774 Q N -0.130 119.596 119.800 -0.124 0.000 2.096 1774 Q HA -0.132 4.208 4.340 -0.000 0.000 0.204 1774 Q C 1.849 177.808 176.000 -0.069 0.000 0.982 1774 Q CA 2.312 58.081 55.803 -0.056 0.000 0.850 1774 Q CB -0.537 28.275 28.738 0.124 0.000 0.901 1774 Q HN 0.361 nan 8.270 nan 0.000 0.422 1775 V N 0.282 120.174 119.914 -0.036 0.000 2.427 1775 V HA -0.201 3.919 4.120 -0.000 0.000 0.248 1775 V C 2.253 178.342 176.094 -0.008 0.000 1.051 1775 V CA 1.556 63.849 62.300 -0.011 0.000 1.048 1775 V CB -0.530 31.285 31.823 -0.012 0.000 0.666 1775 V HN 0.433 nan 8.190 nan 0.000 0.456 1776 L N -0.079 121.116 121.223 -0.047 0.000 2.056 1776 L HA -0.112 4.228 4.340 -0.000 0.000 0.207 1776 L C 2.627 179.470 176.870 -0.045 0.000 1.078 1776 L CA 1.587 56.420 54.840 -0.012 0.000 0.749 1776 L CB -0.503 41.556 42.059 -0.001 0.000 0.901 1776 L HN 0.372 nan 8.230 nan 0.000 0.433 1777 A N -0.257 122.438 122.820 -0.208 0.000 1.908 1777 A HA -0.251 4.069 4.320 -0.000 0.000 0.218 1777 A C 2.012 179.543 177.584 -0.089 0.000 1.181 1777 A CA 1.814 53.709 52.037 -0.236 0.000 0.627 1777 A CB -0.447 18.240 19.000 -0.523 0.000 0.818 1777 A HN 0.539 nan 8.150 nan 0.000 0.445 1778 E N -1.648 118.532 120.200 -0.033 0.000 2.152 1778 E HA -0.095 4.255 4.350 -0.000 0.000 0.192 1778 E C 1.688 178.305 176.600 0.029 0.000 0.983 1778 E CA 1.012 57.417 56.400 0.010 0.000 0.818 1778 E CB -0.199 29.521 29.700 0.033 0.000 0.758 1778 E HN 0.776 nan 8.360 nan 0.000 0.467 1779 F N 1.102 120.997 119.950 -0.093 0.000 2.206 1779 F HA -0.072 4.455 4.527 -0.000 0.000 0.298 1779 F C 1.813 177.537 175.800 -0.127 0.000 1.090 1779 F CA 0.901 58.848 58.000 -0.088 0.000 1.323 1779 F CB 0.078 39.032 39.000 -0.076 0.000 1.028 1779 F HN -0.103 nan 8.300 nan 0.000 0.492 1780 L N 0.234 121.365 121.223 -0.154 0.000 2.093 1780 L HA -0.146 4.194 4.340 -0.000 0.000 0.208 1780 L C 2.785 179.465 176.870 -0.316 0.000 1.085 1780 L CA 1.031 55.656 54.840 -0.358 0.000 0.755 1780 L CB -1.007 40.807 42.059 -0.408 0.000 0.904 1780 L HN 0.263 nan 8.230 nan 0.000 0.435 1781 A N 0.111 122.813 122.820 -0.196 0.000 2.070 1781 A HA -0.162 4.158 4.320 -0.000 0.000 0.220 1781 A C 2.151 179.640 177.584 -0.158 0.000 1.159 1781 A CA 1.209 53.164 52.037 -0.137 0.000 0.656 1781 A CB -0.397 18.561 19.000 -0.069 0.000 0.800 1781 A HN 0.414 nan 8.150 nan 0.000 0.453 1782 R N -0.612 119.753 120.500 -0.225 0.000 2.334 1782 R HA 0.105 4.445 4.340 -0.000 0.000 0.216 1782 R C -0.398 175.736 176.300 -0.276 0.000 0.905 1782 R CA -0.057 55.911 56.100 -0.220 0.000 1.064 1782 R CB 0.173 30.348 30.300 -0.208 0.000 1.046 1782 R HN 0.407 nan 8.270 nan 0.000 0.508 1783 Q N 1.537 121.135 119.800 -0.337 0.000 2.279 1783 Q HA 0.146 4.486 4.340 -0.000 0.000 0.256 1783 Q C -1.640 174.251 176.000 -0.182 0.000 0.937 1783 Q CA -2.264 53.355 55.803 -0.306 0.000 0.933 1783 Q CB 1.268 29.777 28.738 -0.381 0.000 1.189 1783 Q HN -0.021 nan 8.270 nan 0.000 0.417 1784 P HA -0.136 nan 4.420 nan 0.000 0.221 1784 P C 0.630 177.888 177.300 -0.070 0.000 1.150 1784 P CA 1.072 64.120 63.100 -0.086 0.000 0.800 1784 P CB 0.543 32.204 31.700 -0.066 0.000 0.787 1785 Q N -0.592 119.163 119.800 -0.076 0.000 2.436 1785 Q HA 0.045 4.385 4.340 -0.000 0.000 0.209 1785 Q C 0.281 176.255 176.000 -0.043 0.000 0.965 1785 Q CA 0.314 56.087 55.803 -0.050 0.000 0.910 1785 Q CB 0.100 28.815 28.738 -0.038 0.000 0.980 1785 Q HN 0.108 nan 8.270 nan 0.000 0.491 1786 V N 0.873 120.745 119.914 -0.071 0.000 2.407 1786 V HA 0.040 4.160 4.120 -0.000 0.000 0.278 1786 V C 0.801 176.880 176.094 -0.025 0.000 1.037 1786 V CA -0.063 62.217 62.300 -0.032 0.000 0.900 1786 V CB 1.584 33.330 31.823 -0.127 0.000 0.983 1786 V HN 0.219 nan 8.190 nan 0.000 0.459 1787 E N 3.408 123.614 120.200 0.010 0.000 2.075 1787 E HA 0.102 4.452 4.350 -0.000 0.000 0.190 1787 E C -0.098 176.493 176.600 -0.014 0.000 0.969 1787 E CA 0.448 56.846 56.400 -0.004 0.000 0.815 1787 E CB 0.517 30.220 29.700 0.005 0.000 0.776 1787 E HN 0.456 nan 8.360 nan 0.000 0.457 1788 L N 0.535 121.751 121.223 -0.012 0.000 2.466 1788 L HA 0.482 4.822 4.340 -0.000 0.000 0.258 1788 L C -1.746 175.045 176.870 -0.133 0.000 0.973 1788 L CA -0.558 54.233 54.840 -0.082 0.000 0.826 1788 L CB 2.114 44.114 42.059 -0.099 0.000 1.372 1788 L HN -0.070 nan 8.230 nan 0.000 0.409 1789 I N 2.884 123.343 120.570 -0.184 0.000 2.466 1789 I HA 0.332 4.502 4.170 -0.000 0.000 0.289 1789 I C -1.180 174.866 176.117 -0.118 0.000 1.026 1789 I CA -0.584 60.657 61.300 -0.099 0.000 1.078 1789 I CB 1.802 39.817 38.000 0.024 0.000 1.249 1789 I HN 0.633 nan 8.210 nan 0.000 0.429 1790 H N 5.900 125.158 119.070 0.313 0.000 2.700 1790 H HA 0.382 4.938 4.556 -0.000 0.000 0.269 1790 H C -1.386 174.167 175.328 0.375 0.000 1.222 1790 H CA -0.428 55.856 56.048 0.394 0.000 1.254 1790 H CB 0.315 30.281 29.762 0.340 0.000 1.413 1790 H HN 0.429 nan 8.280 nan 0.000 0.507 1791 Y N 3.614 124.034 120.300 0.199 0.000 2.332 1791 Y HA 0.268 4.818 4.550 -0.000 0.000 0.325 1791 Y C -2.430 173.208 175.900 -0.436 0.000 1.054 1791 Y CA -3.127 54.939 58.100 -0.057 0.000 1.119 1791 Y CB 2.003 40.477 38.460 0.024 0.000 1.168 1791 Y HN 0.281 nan 8.280 nan 0.000 0.439 1792 P HA -0.098 nan 4.420 nan 0.000 0.220 1792 P C 1.330 178.218 177.300 -0.687 0.000 1.144 1792 P CA 2.080 64.252 63.100 -1.547 0.000 0.800 1792 P CB 0.282 31.338 31.700 -1.073 0.000 0.772 1793 G N -1.088 107.215 108.800 -0.829 0.000 2.572 1793 G HA2 -0.033 3.927 3.960 -0.000 0.000 0.216 1793 G HA3 -0.033 3.927 3.960 -0.000 0.000 0.216 1793 G C 0.481 175.537 174.900 0.260 0.000 1.133 1793 G CA -0.035 45.004 45.100 -0.102 0.000 0.791 1793 G HN 0.219 nan 8.290 nan 0.000 0.538 1794 L N 0.910 122.284 121.223 0.252 0.000 2.349 1794 L HA 0.320 4.660 4.340 -0.000 0.000 0.275 1794 L C 1.897 178.774 176.870 0.012 0.000 1.115 1794 L CA -0.517 54.431 54.840 0.179 0.000 0.820 1794 L CB 1.474 43.653 42.059 0.200 0.000 1.135 1794 L HN 0.134 nan 8.230 nan 0.000 0.445 1795 A N 1.950 124.616 122.820 -0.256 0.000 2.024 1795 A HA -0.152 4.168 4.320 -0.000 0.000 0.220 1795 A C 2.095 179.447 177.584 -0.388 0.000 1.164 1795 A CA 1.798 53.399 52.037 -0.727 0.000 0.643 1795 A CB -0.427 18.289 19.000 -0.473 0.000 0.806 1795 A HN 0.849 nan 8.150 nan 0.000 0.451 1796 S N -1.543 114.091 115.700 -0.110 0.000 2.603 1796 S HA 0.145 4.615 4.470 -0.000 0.000 0.220 1796 S C 0.349 175.002 174.600 0.088 0.000 0.967 1796 S CA -0.476 57.713 58.200 -0.019 0.000 0.920 1796 S CB -0.650 62.548 63.200 -0.002 0.000 0.773 1796 S HN 0.342 nan 8.310 nan 0.000 0.529 1797 F N 4.256 124.215 119.950 0.015 0.000 2.590 1797 F HA 0.279 4.806 4.527 -0.000 0.000 0.389 1797 F C -1.580 174.287 175.800 0.112 0.000 1.049 1797 F CA -2.354 55.711 58.000 0.107 0.000 1.199 1797 F CB 0.421 39.532 39.000 0.185 0.000 1.058 1797 F HN -0.000 nan 8.300 nan 0.000 0.556 1798 P HA -0.250 nan 4.420 nan 0.000 0.218 1798 P C 0.394 177.532 177.300 -0.269 0.000 1.154 1798 P CA 1.909 64.826 63.100 -0.304 0.000 0.872 1798 P CB 0.080 31.588 31.700 -0.320 0.000 0.790 1799 Q N -2.899 116.588 119.800 -0.522 0.000 2.201 1799 Q HA 0.073 4.413 4.340 -0.000 0.000 0.236 1799 Q C 1.017 177.155 176.000 0.230 0.000 0.857 1799 Q CA -0.427 55.292 55.803 -0.141 0.000 1.025 1799 Q CB -0.395 28.241 28.738 -0.170 0.000 1.124 1799 Q HN 0.204 nan 8.270 nan 0.000 0.473 1800 Y N 0.408 120.848 120.300 0.234 0.000 2.102 1800 Y HA -0.366 4.184 4.550 -0.000 0.000 0.280 1800 Y C 2.009 177.986 175.900 0.129 0.000 1.178 1800 Y CA 2.401 60.675 58.100 0.290 0.000 1.146 1800 Y CB -0.033 38.543 38.460 0.194 0.000 0.968 1800 Y HN 0.126 nan 8.280 nan 0.000 0.504 1801 T N 1.147 115.792 114.554 0.150 0.000 2.777 1801 T HA -0.187 4.163 4.350 -0.000 0.000 0.266 1801 T C 2.046 176.722 174.700 -0.039 0.000 1.040 1801 T CA 1.401 63.513 62.100 0.019 0.000 1.141 1801 T CB -0.583 68.326 68.868 0.068 0.000 0.868 1801 T HN 0.392 nan 8.240 nan 0.000 0.444 1802 L N 0.653 121.873 121.223 -0.005 0.000 2.027 1802 L HA -0.072 4.268 4.340 -0.000 0.000 0.206 1802 L C 2.840 179.686 176.870 -0.039 0.000 1.074 1802 L CA 1.485 56.311 54.840 -0.023 0.000 0.745 1802 L CB -0.683 41.361 42.059 -0.024 0.000 0.898 1802 L HN 0.288 nan 8.230 nan 0.000 0.433 1803 A N 0.111 122.923 122.820 -0.014 0.000 1.883 1803 A HA -0.241 4.079 4.320 -0.000 0.000 0.217 1803 A C 2.213 179.706 177.584 -0.152 0.000 1.186 1803 A CA 1.570 53.574 52.037 -0.055 0.000 0.624 1803 A CB -0.591 18.394 19.000 -0.025 0.000 0.822 1803 A HN 0.418 nan 8.150 nan 0.000 0.444 1804 R N -0.408 119.949 120.500 -0.239 0.000 2.152 1804 R HA -0.138 4.202 4.340 -0.000 0.000 0.232 1804 R C 2.072 178.278 176.300 -0.156 0.000 1.117 1804 R CA 1.465 57.410 56.100 -0.258 0.000 0.981 1804 R CB -0.364 29.719 30.300 -0.361 0.000 0.870 1804 R HN 0.725 nan 8.270 nan 0.000 0.451 1805 Q N -0.125 119.607 119.800 -0.114 0.000 2.331 1805 Q HA -0.061 4.279 4.340 -0.000 0.000 0.203 1805 Q C 1.551 177.512 176.000 -0.065 0.000 0.944 1805 Q CA 0.839 56.596 55.803 -0.076 0.000 0.892 1805 Q CB 0.341 29.047 28.738 -0.053 0.000 0.983 1805 Q HN 0.462 nan 8.270 nan 0.000 0.482 1806 Q N -0.870 118.888 119.800 -0.069 0.000 2.391 1806 Q HA 0.205 4.545 4.340 -0.000 0.000 0.243 1806 Q C 0.040 175.997 176.000 -0.072 0.000 0.874 1806 Q CA 0.176 55.947 55.803 -0.053 0.000 0.950 1806 Q CB 0.827 29.547 28.738 -0.030 0.000 1.103 1806 Q HN 0.250 nan 8.270 nan 0.000 0.544 1807 M N 0.114 119.652 119.600 -0.103 0.000 2.294 1807 M HA 0.237 4.717 4.480 -0.000 0.000 0.335 1807 M C 0.734 176.935 176.300 -0.166 0.000 1.079 1807 M CA -0.409 54.812 55.300 -0.131 0.000 0.982 1807 M CB 1.933 34.451 32.600 -0.136 0.000 1.651 1807 M HN -0.050 nan 8.290 nan 0.000 0.437 1808 S N 1.452 117.032 115.700 -0.200 0.000 2.428 1808 S HA 0.017 4.487 4.470 -0.000 0.000 0.230 1808 S C 0.448 174.919 174.600 -0.216 0.000 1.014 1808 S CA 0.561 58.626 58.200 -0.225 0.000 0.957 1808 S CB -0.036 62.973 63.200 -0.318 0.000 0.784 1808 S HN 0.805 nan 8.310 nan 0.000 0.499 1809 Q N 0.284 119.953 119.800 -0.218 0.000 2.379 1809 Q HA 0.347 4.686 4.340 -0.000 0.000 0.278 1809 Q C -2.514 173.381 176.000 -0.174 0.000 1.068 1809 Q CA -2.339 53.361 55.803 -0.171 0.000 0.816 1809 Q CB 2.204 30.850 28.738 -0.154 0.000 1.387 1809 Q HN 0.003 nan 8.270 nan 0.000 0.413 1810 P HA -0.126 nan 4.420 nan 0.000 0.229 1810 P C 0.393 177.537 177.300 -0.260 0.000 1.150 1810 P CA 1.536 64.446 63.100 -0.317 0.000 0.765 1810 P CB 0.179 31.620 31.700 -0.433 0.000 0.783 1811 G N -0.858 107.888 108.800 -0.090 0.000 2.746 1811 G HA2 0.010 3.970 3.960 -0.000 0.000 0.685 1811 G HA3 0.010 3.970 3.960 -0.000 0.000 0.685 1811 G C 0.526 175.511 174.900 0.141 0.000 1.350 1811 G CA -0.557 44.526 45.100 -0.027 0.000 0.837 1811 G HN 0.299 nan 8.290 nan 0.000 0.564 1812 G N -0.608 108.246 108.800 0.091 0.000 3.337 1812 G HA2 0.474 4.434 3.960 -0.000 0.000 0.246 1812 G HA3 0.474 4.434 3.960 -0.000 0.000 0.246 1812 G C 0.633 175.660 174.900 0.212 0.000 1.131 1812 G CA 0.250 45.464 45.100 0.189 0.000 0.773 1812 G HN 0.541 nan 8.290 nan 0.000 0.544 1813 M N 1.060 120.792 119.600 0.220 0.000 2.300 1813 M HA 0.545 5.025 4.480 -0.000 0.000 0.348 1813 M C -0.838 175.660 176.300 0.330 0.000 1.151 1813 M CA -0.647 54.771 55.300 0.197 0.000 1.046 1813 M CB 1.687 34.330 32.600 0.070 0.000 1.647 1813 M HN -0.150 nan 8.290 nan 0.000 0.451 1814 I N 1.804 122.548 120.570 0.291 0.000 2.533 1814 I HA 0.698 4.868 4.170 -0.000 0.000 0.290 1814 I C -0.479 175.844 176.117 0.343 0.000 1.056 1814 I CA -0.761 60.737 61.300 0.330 0.000 1.057 1814 I CB 2.269 40.386 38.000 0.195 0.000 1.240 1814 I HN 0.773 nan 8.210 nan 0.000 0.423 1815 A N 6.243 129.301 122.820 0.396 0.000 2.365 1815 A HA 0.963 5.283 4.320 -0.000 0.000 0.318 1815 A C -1.096 176.770 177.584 0.470 0.000 1.091 1815 A CA -0.391 51.871 52.037 0.375 0.000 0.763 1815 A CB 1.250 20.469 19.000 0.366 0.000 1.248 1815 A HN 0.671 nan 8.150 nan 0.000 0.442 1816 F N -0.760 119.284 119.950 0.157 0.000 2.713 1816 F HA 0.789 5.316 4.527 -0.000 0.000 0.311 1816 F C -0.931 174.872 175.800 0.005 0.000 1.141 1816 F CA -0.848 57.165 58.000 0.022 0.000 0.939 1816 F CB 1.182 40.141 39.000 -0.068 0.000 1.325 1816 F HN 0.487 nan 8.300 nan 0.000 0.453 1817 E N 2.170 122.408 120.200 0.064 0.000 2.187 1817 E HA 0.553 4.903 4.350 -0.000 0.000 0.268 1817 E C -1.362 175.247 176.600 0.016 0.000 0.896 1817 E CA -0.774 55.598 56.400 -0.047 0.000 0.766 1817 E CB 2.367 32.088 29.700 0.034 0.000 1.142 1817 E HN 0.604 nan 8.360 nan 0.000 0.408 1818 L N 3.432 124.597 121.223 -0.097 0.000 2.292 1818 L HA 0.307 4.646 4.340 -0.000 0.000 0.284 1818 L C 0.167 177.020 176.870 -0.028 0.000 1.065 1818 L CA -0.497 54.318 54.840 -0.043 0.000 0.806 1818 L CB 0.683 42.663 42.059 -0.133 0.000 1.175 1818 L HN 0.326 nan 8.230 nan 0.000 0.431 1819 K N 2.152 122.546 120.400 -0.010 0.000 2.448 1819 K HA 0.241 4.561 4.320 -0.000 0.000 0.278 1819 K C 0.874 177.469 176.600 -0.009 0.000 1.009 1819 K CA 0.695 56.977 56.287 -0.008 0.000 0.995 1819 K CB 0.457 32.952 32.500 -0.009 0.000 0.917 1819 K HN 0.884 nan 8.250 nan 0.000 0.481 1820 G N 2.401 111.199 108.800 -0.003 0.000 2.171 1820 G HA2 -0.241 3.719 3.960 -0.000 0.000 0.238 1820 G HA3 -0.241 3.719 3.960 -0.000 0.000 0.238 1820 G C 0.768 175.670 174.900 0.003 0.000 1.039 1820 G CA -0.000 45.101 45.100 0.002 0.000 0.759 1820 G HN 1.032 nan 8.290 nan 0.000 0.501 1821 G N 0.060 108.862 108.800 0.003 0.000 3.304 1821 G HA2 -0.285 3.675 3.960 -0.000 0.000 0.859 1821 G HA3 -0.285 3.675 3.960 -0.000 0.000 0.859 1821 G C 1.050 175.976 174.900 0.043 0.000 0.958 1821 G CA 0.573 45.683 45.100 0.017 0.000 0.765 1821 G HN 1.496 nan 8.290 nan 0.000 1.149 1822 I N 1.771 122.402 120.570 0.103 0.000 2.948 1822 I HA 0.215 4.385 4.170 -0.000 0.000 0.303 1822 I C 1.788 177.962 176.117 0.094 0.000 1.224 1822 I CA 2.196 63.596 61.300 0.166 0.000 1.442 1822 I CB 0.434 38.497 38.000 0.104 0.000 1.328 1822 I HN 1.340 nan 8.210 nan 0.000 0.578 1823 G N 4.331 113.194 108.800 0.106 0.000 2.956 1823 G HA2 -0.314 3.646 3.960 -0.000 0.000 0.210 1823 G HA3 -0.314 3.646 3.960 -0.000 0.000 0.210 1823 G C 0.977 175.897 174.900 0.033 0.000 1.316 1823 G CA 0.382 45.518 45.100 0.059 0.000 0.819 1823 G HN 0.916 nan 8.290 nan 0.000 0.544 1824 A N 0.830 123.652 122.820 0.004 0.000 1.897 1824 A HA 0.442 4.762 4.320 -0.000 0.000 0.215 1824 A C 2.775 180.323 177.584 -0.059 0.000 1.181 1824 A CA 2.352 54.385 52.037 -0.008 0.000 0.620 1824 A CB -1.024 17.962 19.000 -0.023 0.000 0.821 1824 A HN 1.753 nan 8.150 nan 0.000 0.443 1825 G N -0.505 108.157 108.800 -0.230 0.000 2.402 1825 G HA2 -0.227 3.733 3.960 -0.000 0.000 0.216 1825 G HA3 -0.227 3.733 3.960 -0.000 0.000 0.216 1825 G C 1.755 176.412 174.900 -0.404 0.000 1.162 1825 G CA 0.946 45.647 45.100 -0.664 0.000 0.777 1825 G HN 0.510 nan 8.290 nan 0.000 0.539 1826 R N 0.433 120.889 120.500 -0.075 0.000 2.075 1826 R HA 0.019 4.359 4.340 -0.000 0.000 0.232 1826 R C 2.662 179.009 176.300 0.078 0.000 1.126 1826 R CA 1.062 57.233 56.100 0.119 0.000 0.963 1826 R CB -0.280 30.109 30.300 0.150 0.000 0.858 1826 R HN 0.259 nan 8.270 nan 0.000 0.435 1827 R N -0.547 119.993 120.500 0.066 0.000 2.075 1827 R HA -0.124 4.216 4.340 -0.000 0.000 0.232 1827 R C 2.170 178.520 176.300 0.084 0.000 1.126 1827 R CA 1.725 57.864 56.100 0.065 0.000 0.963 1827 R CB -0.472 29.865 30.300 0.062 0.000 0.858 1827 R HN 0.229 nan 8.270 nan 0.000 0.435 1828 F N 1.253 121.176 119.950 -0.045 0.000 2.026 1828 F HA -0.307 4.220 4.527 -0.000 0.000 0.296 1828 F C 2.173 177.959 175.800 -0.024 0.000 1.133 1828 F CA 1.580 59.560 58.000 -0.033 0.000 1.188 1828 F CB -0.116 38.853 39.000 -0.051 0.000 0.968 1828 F HN -0.132 nan 8.300 nan 0.000 0.476 1829 M N 0.666 120.317 119.600 0.085 0.000 2.103 1829 M HA -0.335 4.145 4.480 -0.000 0.000 0.255 1829 M C 1.863 178.125 176.300 -0.063 0.000 1.074 1829 M CA 2.056 57.354 55.300 -0.003 0.000 1.090 1829 M CB -1.965 30.709 32.600 0.123 0.000 1.325 1829 M HN 0.392 nan 8.290 nan 0.000 0.403 1830 N N -0.312 118.377 118.700 -0.018 0.000 2.453 1830 N HA -0.006 4.734 4.740 -0.000 0.000 0.183 1830 N C 1.457 176.937 175.510 -0.051 0.000 1.041 1830 N CA 0.721 53.761 53.050 -0.016 0.000 0.900 1830 N CB 0.039 38.533 38.487 0.012 0.000 0.961 1830 N HN 0.364 nan 8.380 nan 0.000 0.443 1831 A N 0.680 123.437 122.820 -0.106 0.000 2.147 1831 A HA 0.153 4.473 4.320 -0.000 0.000 0.211 1831 A C 0.815 178.308 177.584 -0.152 0.000 1.160 1831 A CA -0.147 51.822 52.037 -0.113 0.000 0.781 1831 A CB -0.004 18.932 19.000 -0.107 0.000 0.842 1831 A HN 0.108 nan 8.150 nan 0.000 0.475 1832 L N 0.127 121.213 121.223 -0.228 0.000 2.543 1832 L HA -0.041 4.299 4.340 -0.000 0.000 0.285 1832 L C 1.221 178.061 176.870 -0.050 0.000 1.236 1832 L CA 0.357 55.092 54.840 -0.175 0.000 0.871 1832 L CB 0.373 42.331 42.059 -0.168 0.000 1.121 1832 L HN 0.460 nan 8.230 nan 0.000 0.501 1833 Q N 1.339 121.136 119.800 -0.006 0.000 2.210 1833 Q HA 0.073 4.413 4.340 -0.000 0.000 0.252 1833 Q C 0.934 176.947 176.000 0.021 0.000 0.811 1833 Q CA -0.148 55.658 55.803 0.005 0.000 0.953 1833 Q CB 0.689 29.423 28.738 -0.006 0.000 1.136 1833 Q HN 0.637 nan 8.270 nan 0.000 0.491 1834 L N -0.948 120.306 121.223 0.052 0.000 2.433 1834 L HA 0.375 4.714 4.340 -0.000 0.000 0.200 1834 L C -0.085 176.786 176.870 0.002 0.000 1.059 1834 L CA 0.744 55.589 54.840 0.007 0.000 0.835 1834 L CB 0.222 42.271 42.059 -0.018 0.000 1.076 1834 L HN -0.063 nan 8.230 nan 0.000 0.481 1835 F N 0.733 120.666 119.950 -0.027 0.000 2.563 1835 F HA 0.187 4.714 4.527 -0.000 0.000 0.363 1835 F C 1.080 176.874 175.800 -0.009 0.000 1.123 1835 F CA 0.573 58.570 58.000 -0.005 0.000 1.307 1835 F CB 0.533 39.536 39.000 0.005 0.000 1.115 1835 F HN -0.107 nan 8.300 nan 0.000 0.592 1836 S N 2.978 118.781 115.700 0.173 0.000 2.525 1836 S HA 0.486 4.956 4.470 -0.000 0.000 0.290 1836 S C -0.263 174.415 174.600 0.131 0.000 1.152 1836 S CA -0.854 57.411 58.200 0.108 0.000 1.072 1836 S CB 0.993 64.226 63.200 0.056 0.000 1.027 1836 S HN 0.415 nan 8.310 nan 0.000 0.500 1837 R N 2.018 122.573 120.500 0.092 0.000 2.220 1837 R HA 0.631 4.971 4.340 -0.000 0.000 0.340 1837 R C -0.252 176.093 176.300 0.075 0.000 1.076 1837 R CA -0.093 56.060 56.100 0.089 0.000 0.920 1837 R CB 0.534 30.873 30.300 0.066 0.000 1.062 1837 R HN 0.615 nan 8.270 nan 0.000 0.469 1838 A N 1.946 124.816 122.820 0.083 0.000 2.566 1838 A HA 0.495 4.815 4.320 -0.000 0.000 0.290 1838 A C -0.685 176.943 177.584 0.074 0.000 1.071 1838 A CA -0.866 51.211 52.037 0.067 0.000 0.658 1838 A CB 0.765 19.798 19.000 0.056 0.000 1.285 1838 A HN 0.366 nan 8.150 nan 0.000 0.427 1839 V N -1.352 118.602 119.914 0.067 0.000 3.262 1839 V HA 0.943 5.062 4.120 -0.000 0.000 0.313 1839 V C 0.604 176.743 176.094 0.075 0.000 1.070 1839 V CA 0.237 62.586 62.300 0.081 0.000 1.049 1839 V CB 0.774 32.647 31.823 0.084 0.000 1.157 1839 V HN 2.679 nan 8.190 nan 0.000 0.454 1840 S N -0.236 115.518 115.700 0.090 0.000 4.055 1840 S HA 0.061 4.531 4.470 -0.000 0.000 0.663 1840 S C -1.018 173.576 174.600 -0.010 0.000 1.078 1840 S CA 0.372 58.601 58.200 0.048 0.000 1.223 1840 S CB -0.940 62.275 63.200 0.023 0.000 0.379 1840 S HN 2.510 nan 8.310 nan 0.000 1.117 1841 L N -1.341 119.814 121.223 -0.112 0.000 2.892 1841 L HA 0.840 5.180 4.340 -0.000 0.000 0.269 1841 L C 0.792 177.370 176.870 -0.485 0.000 1.058 1841 L CA -0.031 54.652 54.840 -0.261 0.000 0.923 1841 L CB 0.802 42.665 42.059 -0.326 0.000 1.518 1841 L HN 2.227 nan 8.230 nan 0.000 0.402 1842 G N -0.350 107.966 108.800 -0.808 0.000 2.176 1842 G HA2 -0.165 3.795 3.960 -0.000 0.000 0.252 1842 G HA3 -0.165 3.795 3.960 -0.000 0.000 0.252 1842 G C -0.405 174.245 174.900 -0.416 0.000 1.024 1842 G CA 0.428 44.818 45.100 -1.182 0.000 0.755 1842 G HN 0.799 nan 8.290 nan 0.000 0.507 1843 D N -1.070 119.201 120.400 -0.216 0.000 2.326 1843 D HA 0.691 5.331 4.640 -0.000 0.000 0.251 1843 D C 1.440 177.748 176.300 0.013 0.000 1.023 1843 D CA 0.145 54.093 54.000 -0.086 0.000 0.966 1843 D CB 1.187 41.946 40.800 -0.070 0.000 1.156 1843 D HN 0.253 nan 8.370 nan 0.000 0.494 1844 A N 0.728 123.507 122.820 -0.068 0.000 1.969 1844 A HA -0.101 4.219 4.320 -0.000 0.000 0.218 1844 A C 0.667 178.216 177.584 -0.058 0.000 1.169 1844 A CA 1.148 53.136 52.037 -0.082 0.000 0.635 1844 A CB -0.294 18.617 19.000 -0.148 0.000 0.810 1844 A HN 0.497 nan 8.150 nan 0.000 0.445 1845 E N 0.722 120.888 120.200 -0.057 0.000 2.289 1845 E HA 0.399 4.749 4.350 -0.000 0.000 0.278 1845 E C -0.378 176.164 176.600 -0.096 0.000 1.032 1845 E CA -0.043 56.309 56.400 -0.080 0.000 0.854 1845 E CB 1.035 30.702 29.700 -0.055 0.000 1.046 1845 E HN 0.193 nan 8.360 nan 0.000 0.409 1846 S N 2.791 118.366 115.700 -0.208 0.000 2.531 1846 S HA 0.271 4.741 4.470 -0.000 0.000 0.279 1846 S C -0.219 174.320 174.600 -0.102 0.000 1.305 1846 S CA -0.408 57.605 58.200 -0.312 0.000 1.058 1846 S CB 0.069 62.672 63.200 -0.996 0.000 0.899 1846 S HN 0.282 nan 8.310 nan 0.000 0.493 1847 L N 2.280 123.574 121.223 0.119 0.000 2.341 1847 L HA 0.918 5.258 4.340 -0.000 0.000 0.267 1847 L C -0.098 176.996 176.870 0.373 0.000 1.009 1847 L CA -0.895 54.075 54.840 0.217 0.000 0.819 1847 L CB 1.792 43.912 42.059 0.102 0.000 1.323 1847 L HN 0.654 nan 8.230 nan 0.000 0.425 1848 A N 2.073 125.071 122.820 0.298 0.000 2.515 1848 A HA 0.771 5.091 4.320 -0.000 0.000 0.298 1848 A C -1.438 176.250 177.584 0.172 0.000 1.059 1848 A CA -0.483 51.699 52.037 0.241 0.000 0.698 1848 A CB 2.152 21.275 19.000 0.204 0.000 1.289 1848 A HN 0.728 nan 8.150 nan 0.000 0.404 1849 Q N 1.193 121.087 119.800 0.157 0.000 2.340 1849 Q HA 0.497 4.837 4.340 -0.000 0.000 0.276 1849 Q C -1.759 174.338 176.000 0.161 0.000 1.048 1849 Q CA -0.689 55.199 55.803 0.141 0.000 0.832 1849 Q CB 1.641 30.447 28.738 0.114 0.000 1.373 1849 Q HN 0.898 nan 8.270 nan 0.000 0.409 1850 H N 3.616 122.705 119.070 0.033 0.000 2.675 1850 H HA 0.250 4.806 4.556 -0.000 0.000 0.258 1850 H C -2.177 173.153 175.328 0.003 0.000 1.271 1850 H CA -2.272 53.775 56.048 -0.002 0.000 1.462 1850 H CB 1.600 31.369 29.762 0.012 0.000 1.467 1850 H HN 0.520 nan 8.280 nan 0.000 0.501 1851 P HA -0.252 nan 4.420 nan 0.000 0.217 1851 P C 1.471 178.617 177.300 -0.257 0.000 1.158 1851 P CA 2.321 65.360 63.100 -0.102 0.000 0.887 1851 P CB 0.134 31.817 31.700 -0.029 0.000 0.792 1852 A N -0.386 122.126 122.820 -0.512 0.000 1.986 1852 A HA -0.211 4.109 4.320 -0.000 0.000 0.220 1852 A C 2.134 179.470 177.584 -0.413 0.000 1.171 1852 A CA 2.555 54.299 52.037 -0.488 0.000 0.640 1852 A CB -1.311 17.377 19.000 -0.520 0.000 0.811 1852 A HN 0.403 nan 8.150 nan 0.000 0.451 1853 S N -3.230 112.152 115.700 -0.531 0.000 2.603 1853 S HA 0.485 4.955 4.470 -0.000 0.000 0.232 1853 S C 1.099 175.652 174.600 -0.079 0.000 1.016 1853 S CA 0.238 58.340 58.200 -0.163 0.000 0.976 1853 S CB 0.066 63.298 63.200 0.055 0.000 0.921 1853 S HN 0.440 nan 8.310 nan 0.000 0.516 1854 M N 1.288 120.820 119.600 -0.113 0.000 3.189 1854 M HA 0.164 4.644 4.480 -0.000 0.000 0.161 1854 M C 2.290 178.529 176.300 -0.102 0.000 1.808 1854 M CA 1.031 56.295 55.300 -0.060 0.000 1.610 1854 M CB -0.504 32.088 32.600 -0.013 0.000 0.903 1854 M HN 0.297 nan 8.290 nan 0.000 0.577 1855 T N -1.637 112.842 114.554 -0.124 0.000 2.788 1855 T HA -0.142 4.208 4.350 -0.000 0.000 0.268 1855 T C 0.983 175.394 174.700 -0.482 0.000 1.044 1855 T CA 1.581 63.530 62.100 -0.253 0.000 1.139 1855 T CB -0.620 68.107 68.868 -0.236 0.000 0.867 1855 T HN 0.406 nan 8.240 nan 0.000 0.454 1856 H N 0.060 118.957 119.070 -0.289 0.000 2.469 1856 H HA 0.545 5.101 4.556 -0.000 0.000 0.286 1856 H C 1.918 177.077 175.328 -0.282 0.000 1.106 1856 H CA 0.066 55.833 56.048 -0.468 0.000 1.055 1856 H CB 0.340 29.728 29.762 -0.624 0.000 1.618 1856 H HN 0.280 nan 8.280 nan 0.000 0.559 1857 S N 0.324 115.956 115.700 -0.114 0.000 2.382 1857 S HA -0.199 4.271 4.470 -0.000 0.000 0.228 1857 S C 2.345 176.950 174.600 0.008 0.000 1.027 1857 S CA 1.567 59.730 58.200 -0.060 0.000 0.991 1857 S CB -0.142 63.025 63.200 -0.055 0.000 0.823 1857 S HN 0.640 nan 8.310 nan 0.000 0.469 1858 S N -0.273 115.452 115.700 0.041 0.000 2.442 1858 S HA -0.026 4.444 4.470 -0.000 0.000 0.236 1858 S C 0.695 175.432 174.600 0.228 0.000 1.007 1858 S CA 0.218 58.490 58.200 0.120 0.000 0.965 1858 S CB -0.628 62.652 63.200 0.135 0.000 0.773 1858 S HN 0.505 nan 8.310 nan 0.000 0.504 1859 Y N 3.153 123.426 120.300 -0.045 0.000 2.220 1859 Y HA 0.461 5.011 4.550 -0.000 0.000 0.347 1859 Y C 1.447 177.275 175.900 -0.121 0.000 1.311 1859 Y CA -0.941 57.103 58.100 -0.092 0.000 1.593 1859 Y CB -0.139 38.257 38.460 -0.107 0.000 1.419 1859 Y HN 0.286 nan 8.280 nan 0.000 0.614 1860 T N -2.353 112.176 114.554 -0.042 0.000 2.952 1860 T HA 0.366 4.716 4.350 -0.000 0.000 0.286 1860 T C -2.188 172.429 174.700 -0.139 0.000 1.024 1860 T CA -2.273 59.770 62.100 -0.095 0.000 1.029 1860 T CB 1.969 70.752 68.868 -0.141 0.000 1.094 1860 T HN 0.179 nan 8.240 nan 0.000 0.515 1861 P HA -0.146 nan 4.420 nan 0.000 0.216 1861 P C 1.141 178.285 177.300 -0.260 0.000 1.157 1861 P CA 1.359 64.381 63.100 -0.131 0.000 0.880 1861 P CB 0.066 31.719 31.700 -0.079 0.000 0.791 1862 E N -0.222 119.760 120.200 -0.364 0.000 2.017 1862 E HA -0.187 4.162 4.350 -0.000 0.000 0.193 1862 E C 2.037 177.949 176.600 -1.145 0.000 0.997 1862 E CA 1.239 57.117 56.400 -0.871 0.000 0.804 1862 E CB -0.944 28.462 29.700 -0.490 0.000 0.757 1862 E HN 0.370 nan 8.360 nan 0.000 0.448 1863 E N 0.567 120.342 120.200 -0.708 0.000 2.035 1863 E HA -0.267 4.083 4.350 -0.000 0.000 0.204 1863 E C 2.279 178.380 176.600 -0.831 0.000 1.025 1863 E CA 1.311 57.184 56.400 -0.879 0.000 0.835 1863 E CB -0.150 29.114 29.700 -0.727 0.000 0.764 1863 E HN 0.116 nan 8.360 nan 0.000 0.457 1864 R N 0.012 120.315 120.500 -0.329 0.000 2.122 1864 R HA -0.230 4.110 4.340 -0.000 0.000 0.236 1864 R C 2.412 178.631 176.300 -0.136 0.000 1.129 1864 R CA 1.484 57.502 56.100 -0.135 0.000 0.925 1864 R CB -0.509 29.730 30.300 -0.102 0.000 0.850 1864 R HN 0.176 nan 8.270 nan 0.000 0.431 1865 A N 0.998 123.721 122.820 -0.161 0.000 1.859 1865 A HA -0.207 4.112 4.320 -0.000 0.000 0.217 1865 A C 1.677 179.351 177.584 0.151 0.000 1.198 1865 A CA 1.867 53.897 52.037 -0.012 0.000 0.629 1865 A CB -1.002 18.016 19.000 0.029 0.000 0.830 1865 A HN 0.444 nan 8.150 nan 0.000 0.446 1866 H N -2.238 116.832 119.070 0.001 0.000 2.568 1866 H HA -0.035 4.521 4.556 -0.000 0.000 0.281 1866 H C 0.291 175.846 175.328 0.379 0.000 1.028 1866 H CA 0.711 56.828 56.048 0.115 0.000 1.199 1866 H CB -0.378 29.437 29.762 0.088 0.000 1.352 1866 H HN 0.648 nan 8.280 nan 0.000 0.605 1867 Y N -1.247 119.072 120.300 0.031 0.000 2.500 1867 Y HA 0.389 4.939 4.550 -0.000 0.000 0.246 1867 Y C 1.869 177.704 175.900 -0.110 0.000 1.146 1867 Y CA -0.162 57.912 58.100 -0.043 0.000 1.230 1867 Y CB 0.687 39.132 38.460 -0.025 0.000 1.214 1867 Y HN 0.306 nan 8.280 nan 0.000 0.526 1868 G N 0.493 109.333 108.800 0.067 0.000 2.232 1868 G HA2 -0.255 3.705 3.960 -0.000 0.000 0.226 1868 G HA3 -0.255 3.705 3.960 -0.000 0.000 0.226 1868 G C 0.110 174.972 174.900 -0.064 0.000 0.996 1868 G CA -0.123 44.961 45.100 -0.026 0.000 0.626 1868 G HN 0.180 nan 8.290 nan 0.000 0.509 1869 I N 2.594 123.108 120.570 -0.093 0.000 2.352 1869 I HA 0.491 4.661 4.170 -0.000 0.000 0.290 1869 I C 1.040 177.110 176.117 -0.078 0.000 1.036 1869 I CA -0.208 61.016 61.300 -0.128 0.000 1.336 1869 I CB 1.638 39.487 38.000 -0.250 0.000 1.407 1869 I HN 0.191 nan 8.210 nan 0.000 0.497 1870 S N 4.459 120.132 115.700 -0.046 0.000 2.614 1870 S HA 0.137 4.607 4.470 -0.000 0.000 0.265 1870 S C 1.143 175.736 174.600 -0.013 0.000 1.303 1870 S CA -0.378 57.814 58.200 -0.013 0.000 1.000 1870 S CB 0.878 64.088 63.200 0.018 0.000 0.935 1870 S HN 0.598 nan 8.310 nan 0.000 0.551 1871 E N 2.087 122.293 120.200 0.009 0.000 2.358 1871 E HA 0.067 4.416 4.350 -0.000 0.000 0.195 1871 E C 1.289 177.979 176.600 0.150 0.000 1.010 1871 E CA 0.779 57.202 56.400 0.039 0.000 0.856 1871 E CB -0.292 29.425 29.700 0.028 0.000 0.795 1871 E HN 0.769 nan 8.360 nan 0.000 0.504 1872 G N 1.062 109.908 108.800 0.077 0.000 3.863 1872 G HA2 0.218 4.178 3.960 -0.000 0.000 0.290 1872 G HA3 0.218 4.178 3.960 -0.000 0.000 0.290 1872 G C -0.052 174.786 174.900 -0.105 0.000 1.018 1872 G CA -0.393 44.711 45.100 0.006 0.000 0.824 1872 G HN 0.090 nan 8.290 nan 0.000 0.507 1873 L N 1.848 123.064 121.223 -0.012 0.000 2.278 1873 L HA 0.711 5.051 4.340 -0.000 0.000 0.287 1873 L C -0.134 176.675 176.870 -0.102 0.000 1.072 1873 L CA -0.703 54.085 54.840 -0.087 0.000 0.819 1873 L CB 1.437 43.492 42.059 -0.007 0.000 1.176 1873 L HN -0.044 nan 8.230 nan 0.000 0.435 1874 V N 4.968 124.632 119.914 -0.417 0.000 2.680 1874 V HA 0.656 4.776 4.120 -0.000 0.000 0.309 1874 V C -0.756 175.209 176.094 -0.215 0.000 1.052 1874 V CA -0.745 61.362 62.300 -0.322 0.000 0.908 1874 V CB 1.794 33.303 31.823 -0.523 0.000 1.001 1874 V HN 1.002 nan 8.190 nan 0.000 0.431 1875 R N 4.576 125.083 120.500 0.011 0.000 2.514 1875 R HA 0.764 5.104 4.340 -0.000 0.000 0.301 1875 R C -1.637 174.765 176.300 0.170 0.000 0.962 1875 R CA -0.776 55.397 56.100 0.122 0.000 0.882 1875 R CB 1.682 32.068 30.300 0.144 0.000 1.143 1875 R HN 0.909 nan 8.270 nan 0.000 0.452 1876 L N 1.855 123.213 121.223 0.224 0.000 2.362 1876 L HA 0.418 4.758 4.340 -0.000 0.000 0.271 1876 L C -0.235 176.784 176.870 0.248 0.000 1.002 1876 L CA -0.845 54.158 54.840 0.271 0.000 0.818 1876 L CB 2.132 44.368 42.059 0.296 0.000 1.298 1876 L HN 0.532 nan 8.230 nan 0.000 0.420 1877 S N 2.047 117.893 115.700 0.244 0.000 2.461 1877 S HA 0.342 4.812 4.470 -0.000 0.000 0.322 1877 S C -0.618 174.097 174.600 0.191 0.000 1.063 1877 S CA -0.493 57.776 58.200 0.115 0.000 1.120 1877 S CB 1.117 64.310 63.200 -0.012 0.000 0.968 1877 S HN 0.393 nan 8.310 nan 0.000 0.467 1878 V N 6.508 126.551 119.914 0.215 0.000 2.508 1878 V HA 0.610 4.730 4.120 -0.000 0.000 0.281 1878 V C 1.122 177.351 176.094 0.225 0.000 1.041 1878 V CA 0.511 62.940 62.300 0.216 0.000 1.016 1878 V CB 0.453 32.404 31.823 0.213 0.000 0.984 1878 V HN 0.975 nan 8.190 nan 0.000 0.478 1879 G N 5.061 113.894 108.800 0.055 0.000 2.494 1879 G HA2 0.340 4.300 3.960 -0.000 0.000 0.270 1879 G HA3 0.340 4.300 3.960 -0.000 0.000 0.270 1879 G C 0.358 175.237 174.900 -0.035 0.000 1.423 1879 G CA -0.612 44.533 45.100 0.076 0.000 1.055 1879 G HN 0.759 nan 8.290 nan 0.000 0.536 1880 L N -0.299 120.837 121.223 -0.145 0.000 2.667 1880 L HA 0.267 4.607 4.340 -0.000 0.000 0.232 1880 L C 0.513 177.300 176.870 -0.138 0.000 1.138 1880 L CA -0.073 54.645 54.840 -0.203 0.000 0.921 1880 L CB -0.121 41.784 42.059 -0.257 0.000 1.180 1880 L HN 0.354 nan 8.230 nan 0.000 0.487 1881 E N 0.269 120.390 120.200 -0.132 0.000 2.416 1881 E HA 0.026 4.376 4.350 -0.000 0.000 0.254 1881 E C -0.170 176.371 176.600 -0.097 0.000 1.241 1881 E CA -0.149 56.181 56.400 -0.117 0.000 0.969 1881 E CB 0.414 30.029 29.700 -0.143 0.000 0.999 1881 E HN 0.028 nan 8.360 nan 0.000 0.481 1882 D N 1.038 121.390 120.400 -0.081 0.000 2.434 1882 D HA -0.065 4.575 4.640 -0.000 0.000 0.252 1882 D C 1.077 177.336 176.300 -0.069 0.000 1.185 1882 D CA 0.027 53.987 54.000 -0.067 0.000 0.886 1882 D CB 0.863 41.630 40.800 -0.056 0.000 1.148 1882 D HN 0.310 nan 8.370 nan 0.000 0.483 1883 I N 3.178 123.711 120.570 -0.062 0.000 2.236 1883 I HA -0.309 3.861 4.170 -0.000 0.000 0.249 1883 I C 1.677 177.745 176.117 -0.081 0.000 1.102 1883 I CA 1.729 62.991 61.300 -0.063 0.000 1.365 1883 I CB -0.265 37.703 38.000 -0.053 0.000 1.051 1883 I HN 0.394 nan 8.210 nan 0.000 0.420 1884 D N -0.312 120.042 120.400 -0.077 0.000 2.178 1884 D HA -0.175 4.465 4.640 -0.000 0.000 0.202 1884 D C 1.739 177.989 176.300 -0.084 0.000 0.974 1884 D CA 1.100 55.045 54.000 -0.091 0.000 0.841 1884 D CB -0.047 40.712 40.800 -0.068 0.000 0.953 1884 D HN 0.379 nan 8.370 nan 0.000 0.478 1885 D N -0.393 119.967 120.400 -0.065 0.000 2.117 1885 D HA -0.107 4.533 4.640 -0.000 0.000 0.198 1885 D C 1.967 178.244 176.300 -0.037 0.000 0.982 1885 D CA 0.399 54.367 54.000 -0.052 0.000 0.828 1885 D CB -0.086 40.681 40.800 -0.055 0.000 0.967 1885 D HN 0.209 nan 8.370 nan 0.000 0.464 1886 L N 0.471 121.670 121.223 -0.040 0.000 2.027 1886 L HA -0.102 4.238 4.340 -0.000 0.000 0.206 1886 L C 2.272 179.181 176.870 0.066 0.000 1.074 1886 L CA 0.991 55.858 54.840 0.046 0.000 0.745 1886 L CB -0.980 41.087 42.059 0.015 0.000 0.898 1886 L HN 0.060 nan 8.230 nan 0.000 0.433 1887 L N -0.520 120.639 121.223 -0.105 0.000 2.083 1887 L HA -0.110 4.230 4.340 -0.000 0.000 0.209 1887 L C 2.555 179.260 176.870 -0.275 0.000 1.083 1887 L CA 1.912 56.542 54.840 -0.349 0.000 0.752 1887 L CB -1.332 40.410 42.059 -0.528 0.000 0.899 1887 L HN 0.260 nan 8.230 nan 0.000 0.433 1888 A N -1.221 121.513 122.820 -0.143 0.000 1.969 1888 A HA -0.232 4.088 4.320 -0.000 0.000 0.218 1888 A C 2.108 179.684 177.584 -0.014 0.000 1.169 1888 A CA 1.724 53.717 52.037 -0.073 0.000 0.635 1888 A CB -0.578 18.392 19.000 -0.050 0.000 0.810 1888 A HN 0.445 nan 8.150 nan 0.000 0.445 1889 D N -0.526 119.887 120.400 0.022 0.000 2.103 1889 D HA -0.092 4.548 4.640 -0.000 0.000 0.199 1889 D C 1.856 178.176 176.300 0.034 0.000 0.978 1889 D CA 1.397 55.430 54.000 0.055 0.000 0.829 1889 D CB -0.077 40.819 40.800 0.161 0.000 0.981 1889 D HN 0.124 nan 8.370 nan 0.000 0.464 1890 V N 0.553 120.515 119.914 0.079 0.000 2.343 1890 V HA -0.218 3.902 4.120 -0.000 0.000 0.247 1890 V C 2.564 178.805 176.094 0.245 0.000 1.051 1890 V CA 1.912 64.305 62.300 0.155 0.000 1.036 1890 V CB -0.603 31.335 31.823 0.193 0.000 0.654 1890 V HN 0.329 nan 8.190 nan 0.000 0.451 1891 Q N -0.315 119.601 119.800 0.192 0.000 2.050 1891 Q HA -0.281 4.059 4.340 -0.000 0.000 0.202 1891 Q C 2.441 178.531 176.000 0.151 0.000 0.980 1891 Q CA 2.030 57.984 55.803 0.251 0.000 0.840 1891 Q CB -0.267 28.588 28.738 0.194 0.000 0.898 1891 Q HN 0.659 nan 8.270 nan 0.000 0.424 1892 Q N 0.007 119.855 119.800 0.080 0.000 2.084 1892 Q HA -0.169 4.171 4.340 -0.000 0.000 0.202 1892 Q C 1.785 177.803 176.000 0.031 0.000 0.978 1892 Q CA 1.762 57.591 55.803 0.042 0.000 0.844 1892 Q CB -0.236 28.509 28.738 0.012 0.000 0.898 1892 Q HN 0.464 nan 8.270 nan 0.000 0.426 1893 A N 0.683 123.498 122.820 -0.008 0.000 1.968 1893 A HA -0.098 4.222 4.320 -0.000 0.000 0.217 1893 A C 2.053 179.733 177.584 0.161 0.000 1.169 1893 A CA 0.873 52.855 52.037 -0.092 0.000 0.638 1893 A CB -0.434 18.235 19.000 -0.551 0.000 0.812 1893 A HN 0.385 nan 8.150 nan 0.000 0.446 1894 L N 0.012 121.416 121.223 0.302 0.000 2.046 1894 L HA -0.098 4.242 4.340 -0.000 0.000 0.208 1894 L C 2.286 179.253 176.870 0.162 0.000 1.077 1894 L CA 1.997 57.023 54.840 0.310 0.000 0.747 1894 L CB -0.799 41.396 42.059 0.226 0.000 0.896 1894 L HN 0.422 nan 8.230 nan 0.000 0.432 1895 K N -1.100 119.370 120.400 0.117 0.000 2.097 1895 K HA -0.123 4.197 4.320 -0.000 0.000 0.206 1895 K C 1.949 178.588 176.600 0.065 0.000 1.049 1895 K CA 1.208 57.539 56.287 0.074 0.000 0.933 1895 K CB 0.030 32.565 32.500 0.059 0.000 0.717 1895 K HN 0.325 nan 8.250 nan 0.000 0.442 1896 A N 0.695 123.555 122.820 0.066 0.000 1.968 1896 A HA -0.112 4.208 4.320 -0.000 0.000 0.217 1896 A C 1.984 179.608 177.584 0.067 0.000 1.169 1896 A CA 1.780 53.847 52.037 0.049 0.000 0.638 1896 A CB -0.491 18.523 19.000 0.023 0.000 0.812 1896 A HN 0.473 nan 8.150 nan 0.000 0.446 1897 S N 0.280 116.048 115.700 0.114 0.000 2.474 1897 S HA 0.292 4.762 4.470 -0.000 0.000 0.235 1897 S C 1.261 175.903 174.600 0.071 0.000 0.997 1897 S CA 0.638 58.910 58.200 0.119 0.000 0.949 1897 S CB -0.877 62.445 63.200 0.203 0.000 0.766 1897 S HN 0.955 nan 8.310 nan 0.000 0.517 1898 A N 0.000 122.856 122.820 0.061 0.000 2.254 1898 A HA 0.000 4.320 4.320 -0.000 0.000 0.244 1898 A CA 0.000 52.060 52.037 0.038 0.000 0.836 1898 A CB 0.000 19.020 19.000 0.033 0.000 0.831 1898 A HN 0.000 nan 8.150 nan 0.000 0.486