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 1l8p_1_D DATA FIRST_RESID 1501 DATA SEQUENCE AVSKVYARSV YDSRGNPTVE VELTTEKGVF RSIVPSGAAT GVHEALEMRD DATA SEQUENCE GDKSKWMGKG VLHAVKNVND VIAPAFVKAN IDVKDQKAVD DFLISLDGTA DATA SEQUENCE NKSKLGANAI LGVSLAASRA AAAEKNVPLY KHLADLSKSK TSPYVLPVPF DATA SEQUENCE LNVLNGGSHA GGALALQEFM IAPTGAKTFA EALRIGSEVY HNLKSLTKKR DATA SEQUENCE YGASAGNVGD EGGVAPNIQT AEEALDLIVD AIKAAGHDGK VKIGLDCASS DATA SEQUENCE EFFKDGKYDL DFKNPNSDKS KWLTGPQLAD LYHSLMKRYP IVSIEDPFAE DATA SEQUENCE DDWEAWSHFF KTAGIQIVAD DLTVTNPKRI ATAIEKKAAD ALLLKVNQIG DATA SEQUENCE TLSESIKAAQ DSFAAGWGVM VSHRSGETED TFIADLVVGL RTGQIKTGAP DATA SEQUENCE ARSERLAKLN QLLRIEEELG DNAVFAGENF HHGDKL 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 A HA 0.000 nan 4.320 nan 0.000 0.244 1501 A C 0.000 177.618 177.584 0.057 0.000 1.274 1501 A CA 0.000 52.055 52.037 0.029 0.000 0.836 1501 A CB 0.000 19.011 19.000 0.018 0.000 0.831 1502 V N 3.238 123.201 119.914 0.082 0.000 2.415 1502 V HA 0.274 4.394 4.120 0.000 0.000 0.267 1502 V C 1.554 177.704 176.094 0.092 0.000 1.042 1502 V CA 0.910 63.280 62.300 0.116 0.000 1.000 1502 V CB 0.469 32.420 31.823 0.214 0.000 1.015 1502 V HN 1.279 nan 8.190 nan 0.000 0.478 1503 S N 3.355 119.097 115.700 0.071 0.000 2.501 1503 S HA 0.148 4.618 4.470 0.000 0.000 0.220 1503 S C 0.504 175.135 174.600 0.052 0.000 0.997 1503 S CA 0.041 58.273 58.200 0.052 0.000 0.919 1503 S CB 0.177 63.399 63.200 0.036 0.000 0.778 1503 S HN 0.753 nan 8.310 nan 0.000 0.523 1504 K N -0.199 120.233 120.400 0.054 0.000 2.587 1504 K HA 0.544 4.864 4.320 0.000 0.000 0.276 1504 K C -2.397 174.221 176.600 0.031 0.000 0.956 1504 K CA -0.744 55.572 56.287 0.048 0.000 0.857 1504 K CB 2.084 34.605 32.500 0.035 0.000 1.431 1504 K HN -0.012 nan 8.250 nan 0.000 0.420 1505 V N 3.538 123.471 119.914 0.031 0.000 2.524 1505 V HA 0.438 4.558 4.120 0.000 0.000 0.297 1505 V C -1.582 174.558 176.094 0.077 0.000 1.035 1505 V CA -0.731 61.556 62.300 -0.021 0.000 0.867 1505 V CB 1.244 32.979 31.823 -0.147 0.000 1.004 1505 V HN 0.750 nan 8.190 nan 0.000 0.426 1506 Y N 3.660 123.926 120.300 -0.058 0.000 2.512 1506 Y HA 0.866 5.416 4.550 -0.000 0.000 0.348 1506 Y C -0.259 175.615 175.900 -0.044 0.000 0.990 1506 Y CA -0.577 57.499 58.100 -0.039 0.000 1.033 1506 Y CB 2.168 40.611 38.460 -0.027 0.000 1.259 1506 Y HN 0.770 nan 8.280 nan 0.000 0.461 1507 A N 5.519 127.813 122.820 -0.878 0.000 2.475 1507 A HA 0.940 5.260 4.320 0.000 0.000 0.301 1507 A C -1.417 175.649 177.584 -0.864 0.000 1.059 1507 A CA -0.946 50.711 52.037 -0.634 0.000 0.710 1507 A CB 1.709 20.501 19.000 -0.346 0.000 1.288 1507 A HN 0.921 nan 8.150 nan 0.000 0.408 1508 R N -0.146 120.098 120.500 -0.426 0.000 2.764 1508 R HA 0.766 5.106 4.340 0.000 0.000 0.270 1508 R C -0.813 175.379 176.300 -0.179 0.000 1.014 1508 R CA -0.428 55.521 56.100 -0.252 0.000 0.904 1508 R CB 1.431 31.712 30.300 -0.031 0.000 1.236 1508 R HN 0.652 nan 8.270 nan 0.000 0.466 1509 S N 0.748 116.351 115.700 -0.162 0.000 2.499 1509 S HA 0.563 5.033 4.470 0.000 0.000 0.279 1509 S C -0.014 174.463 174.600 -0.205 0.000 1.219 1509 S CA -0.375 57.673 58.200 -0.254 0.000 1.062 1509 S CB 0.767 63.750 63.200 -0.362 0.000 0.978 1509 S HN 0.588 nan 8.310 nan 0.000 0.489 1510 V N 2.961 122.722 119.914 -0.254 0.000 3.158 1510 V HA 0.712 4.832 4.120 0.000 0.000 0.311 1510 V C -1.762 174.158 176.094 -0.290 0.000 1.181 1510 V CA -1.154 61.069 62.300 -0.127 0.000 1.054 1510 V CB 0.871 32.685 31.823 -0.015 0.000 1.085 1510 V HN 0.783 nan 8.190 nan 0.000 0.446 1511 Y N 1.297 121.568 120.300 -0.049 0.000 2.360 1511 Y HA 0.624 5.174 4.550 0.000 0.000 0.337 1511 Y C 0.350 176.231 175.900 -0.030 0.000 1.039 1511 Y CA -0.563 57.509 58.100 -0.047 0.000 1.109 1511 Y CB 1.178 39.637 38.460 -0.002 0.000 1.201 1511 Y HN 0.968 nan 8.280 nan 0.000 0.458 1512 D N -0.773 119.672 120.400 0.076 0.000 2.478 1512 D HA 0.073 4.713 4.640 0.000 0.000 0.269 1512 D C 1.075 177.421 176.300 0.076 0.000 1.232 1512 D CA -0.252 53.777 54.000 0.048 0.000 1.059 1512 D CB 0.372 41.170 40.800 -0.002 0.000 1.104 1512 D HN 0.425 nan 8.370 nan 0.000 0.566 1513 S N -1.102 114.626 115.700 0.047 0.000 2.469 1513 S HA -0.151 4.319 4.470 0.000 0.000 0.238 1513 S C 1.534 176.164 174.600 0.050 0.000 0.998 1513 S CA 0.538 58.766 58.200 0.046 0.000 0.957 1513 S CB -0.375 62.842 63.200 0.027 0.000 0.764 1513 S HN 0.501 nan 8.310 nan 0.000 0.514 1514 R N 0.424 120.957 120.500 0.055 0.000 2.334 1514 R HA 0.256 4.596 4.340 0.000 0.000 0.216 1514 R C 1.225 177.580 176.300 0.092 0.000 0.905 1514 R CA 0.437 56.575 56.100 0.063 0.000 1.064 1514 R CB 0.112 30.445 30.300 0.055 0.000 1.046 1514 R HN 0.581 nan 8.270 nan 0.000 0.508 1515 G N 1.277 110.152 108.800 0.126 0.000 2.132 1515 G HA2 -0.265 3.695 3.960 0.000 0.000 0.228 1515 G HA3 -0.265 3.695 3.960 0.000 0.000 0.228 1515 G C -0.560 174.520 174.900 0.299 0.000 1.000 1515 G CA -0.129 45.096 45.100 0.208 0.000 0.693 1515 G HN 0.386 nan 8.290 nan 0.000 0.515 1516 N N 0.959 119.754 118.700 0.159 0.000 2.361 1516 N HA 0.578 5.318 4.740 0.000 0.000 0.302 1516 N C -2.761 172.628 175.510 -0.202 0.000 1.074 1516 N CA -1.859 51.207 53.050 0.026 0.000 0.850 1516 N CB 1.984 40.469 38.487 -0.004 0.000 1.228 1516 N HN -0.005 nan 8.380 nan 0.000 0.491 1517 P HA 0.038 nan 4.420 nan 0.000 0.268 1517 P C -0.539 176.479 177.300 -0.471 0.000 1.208 1517 P CA 0.150 62.755 63.100 -0.827 0.000 0.777 1517 P CB 0.833 31.776 31.700 -1.263 0.000 0.875 1518 T N 0.463 114.770 114.554 -0.412 0.000 2.792 1518 T HA 0.380 4.730 4.350 0.000 0.000 0.303 1518 T C -1.322 173.236 174.700 -0.237 0.000 1.310 1518 T CA -0.580 61.365 62.100 -0.258 0.000 1.007 1518 T CB 0.695 69.465 68.868 -0.164 0.000 1.335 1518 T HN -0.046 nan 8.240 nan 0.000 0.504 1519 V N 2.733 122.542 119.914 -0.176 0.000 2.498 1519 V HA 0.534 4.654 4.120 0.000 0.000 0.279 1519 V C 0.208 176.229 176.094 -0.123 0.000 1.048 1519 V CA -0.319 61.886 62.300 -0.159 0.000 0.967 1519 V CB 1.184 32.925 31.823 -0.137 0.000 0.988 1519 V HN 0.847 nan 8.190 nan 0.000 0.473 1520 E N 3.867 123.994 120.200 -0.122 0.000 2.210 1520 E HA 0.657 5.007 4.350 0.000 0.000 0.266 1520 E C -1.769 174.777 176.600 -0.089 0.000 0.883 1520 E CA -0.504 55.849 56.400 -0.079 0.000 0.761 1520 E CB 2.117 31.789 29.700 -0.046 0.000 1.156 1520 E HN 0.450 nan 8.360 nan 0.000 0.412 1521 V N 3.963 123.842 119.914 -0.060 0.000 2.680 1521 V HA 0.398 4.518 4.120 0.000 0.000 0.309 1521 V C -0.649 175.447 176.094 0.003 0.000 1.052 1521 V CA -0.720 61.545 62.300 -0.059 0.000 0.908 1521 V CB 1.908 33.681 31.823 -0.084 0.000 1.001 1521 V HN 0.745 nan 8.190 nan 0.000 0.431 1522 E N 3.380 123.604 120.200 0.040 0.000 2.224 1522 E HA 0.547 4.897 4.350 0.000 0.000 0.265 1522 E C -1.525 175.110 176.600 0.058 0.000 0.878 1522 E CA -0.813 55.632 56.400 0.074 0.000 0.759 1522 E CB 2.843 32.611 29.700 0.113 0.000 1.164 1522 E HN 0.371 nan 8.360 nan 0.000 0.414 1523 L N 2.281 123.551 121.223 0.078 0.000 2.313 1523 L HA 0.385 4.725 4.340 0.000 0.000 0.283 1523 L C -0.723 176.239 176.870 0.152 0.000 1.013 1523 L CA -0.062 54.821 54.840 0.072 0.000 0.816 1523 L CB 1.911 44.004 42.059 0.057 0.000 1.236 1523 L HN 0.436 nan 8.230 nan 0.000 0.419 1524 T N 2.810 117.423 114.554 0.099 0.000 2.824 1524 T HA 0.757 5.107 4.350 0.000 0.000 0.280 1524 T C -0.081 174.694 174.700 0.125 0.000 0.995 1524 T CA -0.412 61.742 62.100 0.089 0.000 1.009 1524 T CB 1.394 70.277 68.868 0.026 0.000 0.955 1524 T HN 0.777 nan 8.240 nan 0.000 0.452 1525 T N -1.179 113.473 114.554 0.164 0.000 2.654 1525 T HA 0.399 4.749 4.350 0.000 0.000 0.289 1525 T C 0.912 175.679 174.700 0.111 0.000 1.062 1525 T CA -0.814 61.375 62.100 0.147 0.000 1.041 1525 T CB 1.368 70.350 68.868 0.190 0.000 1.417 1525 T HN 0.425 nan 8.240 nan 0.000 0.510 1526 E N 0.370 120.622 120.200 0.087 0.000 2.418 1526 E HA -0.051 4.299 4.350 0.000 0.000 0.197 1526 E C 1.008 177.653 176.600 0.075 0.000 1.026 1526 E CA 0.674 57.110 56.400 0.059 0.000 0.862 1526 E CB -0.151 29.573 29.700 0.040 0.000 0.799 1526 E HN 0.498 nan 8.360 nan 0.000 0.518 1527 K N 0.661 121.150 120.400 0.147 0.000 2.361 1527 K HA 0.223 4.543 4.320 0.000 0.000 0.196 1527 K C 1.109 177.782 176.600 0.123 0.000 1.039 1527 K CA 0.832 57.234 56.287 0.191 0.000 1.001 1527 K CB 0.887 33.579 32.500 0.319 0.000 0.795 1527 K HN 0.316 nan 8.250 nan 0.000 0.495 1528 G N -0.143 108.674 108.800 0.030 0.000 2.302 1528 G HA2 -0.026 3.934 3.960 0.000 0.000 0.264 1528 G HA3 -0.026 3.934 3.960 0.000 0.000 0.264 1528 G C -1.654 172.976 174.900 -0.451 0.000 1.335 1528 G CA -0.708 44.233 45.100 -0.266 0.000 0.982 1528 G HN -0.145 nan 8.290 nan 0.000 0.473 1529 V N 0.679 120.212 119.914 -0.635 0.000 2.417 1529 V HA 0.722 4.842 4.120 0.000 0.000 0.291 1529 V C -0.850 174.801 176.094 -0.738 0.000 1.024 1529 V CA -0.425 61.597 62.300 -0.463 0.000 0.861 1529 V CB 0.987 32.677 31.823 -0.223 0.000 0.985 1529 V HN 0.561 nan 8.190 nan 0.000 0.436 1530 F N 3.596 123.549 119.950 0.005 0.000 2.467 1530 F HA 0.666 5.193 4.527 0.000 0.000 0.336 1530 F C 0.284 176.092 175.800 0.014 0.000 1.123 1530 F CA -0.612 57.395 58.000 0.012 0.000 0.964 1530 F CB 1.600 40.607 39.000 0.011 0.000 1.136 1530 F HN 0.334 nan 8.300 nan 0.000 0.447 1531 R N 1.575 122.164 120.500 0.148 0.000 2.514 1531 R HA 0.778 5.119 4.340 0.000 0.000 0.301 1531 R C -1.177 175.184 176.300 0.101 0.000 0.962 1531 R CA -0.323 55.835 56.100 0.096 0.000 0.882 1531 R CB 1.579 31.915 30.300 0.059 0.000 1.143 1531 R HN 0.749 nan 8.270 nan 0.000 0.452 1532 S N 3.815 119.549 115.700 0.056 0.000 2.541 1532 S HA 0.564 5.034 4.470 0.000 0.000 0.280 1532 S C -0.942 173.657 174.600 -0.003 0.000 1.112 1532 S CA -0.644 57.575 58.200 0.031 0.000 0.925 1532 S CB 1.398 64.589 63.200 -0.016 0.000 1.067 1532 S HN 0.498 nan 8.310 nan 0.000 0.479 1533 I N 2.019 122.588 120.570 -0.002 0.000 2.509 1533 I HA 0.464 4.634 4.170 0.000 0.000 0.293 1533 I C -0.681 175.414 176.117 -0.036 0.000 1.020 1533 I CA -1.115 60.173 61.300 -0.020 0.000 1.088 1533 I CB 1.901 39.902 38.000 0.002 0.000 1.267 1533 I HN 0.229 nan 8.210 nan 0.000 0.430 1534 V N 7.246 127.126 119.914 -0.058 0.000 2.498 1534 V HA 0.289 4.409 4.120 0.000 0.000 0.279 1534 V C -1.740 174.325 176.094 -0.048 0.000 1.048 1534 V CA -1.177 61.086 62.300 -0.062 0.000 0.967 1534 V CB 0.935 32.712 31.823 -0.076 0.000 0.988 1534 V HN 0.628 nan 8.190 nan 0.000 0.473 1535 P HA 0.324 nan 4.420 nan 0.000 0.293 1535 P C -0.709 176.568 177.300 -0.037 0.000 1.304 1535 P CA -0.494 62.592 63.100 -0.024 0.000 0.767 1535 P CB 1.365 33.065 31.700 -0.001 0.000 1.247 1536 S N -1.456 114.222 115.700 -0.037 0.000 2.649 1536 S HA 0.584 5.054 4.470 0.000 0.000 0.274 1536 S C -0.227 174.353 174.600 -0.033 0.000 1.176 1536 S CA -0.606 57.572 58.200 -0.038 0.000 0.988 1536 S CB 0.276 63.449 63.200 -0.045 0.000 1.071 1536 S HN 0.665 nan 8.310 nan 0.000 0.478 1537 G N 2.119 110.905 108.800 -0.025 0.000 2.557 1537 G HA2 0.756 4.716 3.960 0.000 0.000 0.292 1537 G HA3 0.756 4.716 3.960 0.000 0.000 0.292 1537 G C -0.413 174.485 174.900 -0.003 0.000 1.237 1537 G CA -0.273 44.817 45.100 -0.016 0.000 0.978 1537 G HN 1.136 nan 8.290 nan 0.000 0.498 1538 A N -1.478 121.350 122.820 0.013 0.000 2.355 1538 A HA 0.770 5.090 4.320 0.000 0.000 0.317 1538 A C 0.680 178.262 177.584 -0.004 0.000 1.094 1538 A CA 0.386 52.430 52.037 0.012 0.000 0.764 1538 A CB 1.085 20.106 19.000 0.035 0.000 1.230 1538 A HN 2.627 nan 8.150 nan 0.000 0.448 1539 A N 1.679 124.489 122.820 -0.016 0.000 2.687 1539 A HA -0.036 4.284 4.320 0.000 0.000 0.299 1539 A C 0.816 178.382 177.584 -0.031 0.000 1.497 1539 A CA 1.141 53.161 52.037 -0.029 0.000 0.751 1539 A CB -2.555 16.422 19.000 -0.039 0.000 1.048 1539 A HN 2.533 nan 8.150 nan 0.000 0.464 1540 T N -1.485 113.054 114.554 -0.025 0.000 2.908 1540 T HA 0.430 4.780 4.350 0.000 0.000 0.325 1540 T C 1.021 175.697 174.700 -0.039 0.000 1.092 1540 T CA 0.040 62.125 62.100 -0.025 0.000 1.125 1540 T CB 0.864 69.719 68.868 -0.022 0.000 1.016 1540 T HN 1.994 nan 8.240 nan 0.000 0.550 1541 G N 0.631 109.412 108.800 -0.032 0.000 2.414 1541 G HA2 0.311 4.271 3.960 0.000 0.000 0.236 1541 G HA3 0.311 4.271 3.960 0.000 0.000 0.236 1541 G C 1.257 176.104 174.900 -0.087 0.000 1.293 1541 G CA -0.390 44.682 45.100 -0.046 0.000 0.869 1541 G HN 1.460 nan 8.290 nan 0.000 0.556 1542 V N -0.210 119.593 119.914 -0.185 0.000 2.828 1542 V HA -0.140 3.980 4.120 0.000 0.000 0.260 1542 V C 1.558 177.471 176.094 -0.301 0.000 1.101 1542 V CA 1.660 63.799 62.300 -0.268 0.000 1.123 1542 V CB -0.786 30.816 31.823 -0.368 0.000 0.704 1542 V HN 0.740 nan 8.190 nan 0.000 0.493 1543 H N 0.245 119.306 119.070 -0.016 0.000 2.551 1543 H HA 0.396 4.952 4.556 0.000 0.000 0.271 1543 H C 0.708 176.028 175.328 -0.014 0.000 0.984 1543 H CA -0.105 55.937 56.048 -0.010 0.000 1.164 1543 H CB 0.196 29.953 29.762 -0.008 0.000 1.437 1543 H HN 0.648 nan 8.280 nan 0.000 0.550 1544 E N 0.855 121.089 120.200 0.056 0.000 2.390 1544 E HA 0.354 4.704 4.350 0.000 0.000 0.261 1544 E C 0.243 176.853 176.600 0.016 0.000 1.076 1544 E CA -0.429 55.989 56.400 0.030 0.000 0.905 1544 E CB 1.205 30.908 29.700 0.006 0.000 0.984 1544 E HN 0.228 nan 8.360 nan 0.000 0.427 1545 A N 2.175 124.999 122.820 0.008 0.000 2.483 1545 A HA 0.056 4.376 4.320 0.000 0.000 0.238 1545 A C -0.199 177.378 177.584 -0.011 0.000 1.070 1545 A CA -0.384 51.652 52.037 -0.002 0.000 0.770 1545 A CB 0.162 19.157 19.000 -0.008 0.000 1.008 1545 A HN 0.467 nan 8.150 nan 0.000 0.497 1546 L N 1.323 122.537 121.223 -0.014 0.000 2.534 1546 L HA 0.133 4.473 4.340 0.000 0.000 0.271 1546 L C 0.649 177.504 176.870 -0.025 0.000 1.178 1546 L CA 0.675 55.504 54.840 -0.020 0.000 0.907 1546 L CB 0.162 42.208 42.059 -0.021 0.000 1.164 1546 L HN 0.753 nan 8.230 nan 0.000 0.482 1547 E N 6.302 126.486 120.200 -0.027 0.000 2.046 1547 E HA 0.156 4.506 4.350 0.000 0.000 0.279 1547 E C -0.580 176.001 176.600 -0.031 0.000 0.989 1547 E CA -0.546 55.834 56.400 -0.033 0.000 0.798 1547 E CB 0.791 30.470 29.700 -0.034 0.000 1.086 1547 E HN 0.732 nan 8.360 nan 0.000 0.399 1548 M N 5.251 124.832 119.600 -0.032 0.000 2.184 1548 M HA 0.192 4.672 4.480 0.000 0.000 0.351 1548 M C -0.824 175.465 176.300 -0.018 0.000 1.395 1548 M CA 0.002 55.288 55.300 -0.023 0.000 1.117 1548 M CB 0.265 32.854 32.600 -0.018 0.000 1.708 1548 M HN 0.307 nan 8.290 nan 0.000 0.468 1549 R N 3.447 123.945 120.500 -0.003 0.000 2.670 1549 R HA 0.260 4.600 4.340 0.000 0.000 0.289 1549 R C 0.006 176.346 176.300 0.066 0.000 0.965 1549 R CA -0.647 55.461 56.100 0.012 0.000 0.899 1549 R CB 1.343 31.645 30.300 0.004 0.000 1.173 1549 R HN 0.721 nan 8.270 nan 0.000 0.456 1550 D N 0.903 121.375 120.400 0.119 0.000 2.117 1550 D HA -0.063 4.577 4.640 0.000 0.000 0.197 1550 D C 1.060 177.453 176.300 0.155 0.000 0.987 1550 D CA 1.804 55.946 54.000 0.237 0.000 0.829 1550 D CB 0.163 41.088 40.800 0.210 0.000 0.961 1550 D HN 0.908 nan 8.370 nan 0.000 0.460 1551 G N 1.210 110.075 108.800 0.109 0.000 2.136 1551 G HA2 -0.248 3.712 3.960 0.000 0.000 0.242 1551 G HA3 -0.248 3.712 3.960 0.000 0.000 0.242 1551 G C -0.177 174.775 174.900 0.087 0.000 0.989 1551 G CA 0.206 45.354 45.100 0.081 0.000 0.682 1551 G HN 0.339 nan 8.290 nan 0.000 0.522 1552 D N 0.610 121.077 120.400 0.112 0.000 2.402 1552 D HA 0.307 4.947 4.640 0.000 0.000 0.235 1552 D C 1.633 177.980 176.300 0.079 0.000 1.226 1552 D CA -0.342 53.714 54.000 0.093 0.000 0.918 1552 D CB 0.275 41.136 40.800 0.102 0.000 1.043 1552 D HN 0.383 nan 8.370 nan 0.000 0.506 1553 K N 0.929 121.363 120.400 0.056 0.000 2.360 1553 K HA -0.124 4.197 4.320 0.000 0.000 0.201 1553 K C 1.579 178.196 176.600 0.029 0.000 1.046 1553 K CA 1.040 57.354 56.287 0.046 0.000 0.940 1553 K CB 0.082 32.602 32.500 0.033 0.000 0.748 1553 K HN 0.336 nan 8.250 nan 0.000 0.465 1554 S N 0.208 115.917 115.700 0.015 0.000 2.593 1554 S HA 0.098 4.568 4.470 0.000 0.000 0.217 1554 S C 0.144 174.709 174.600 -0.058 0.000 0.966 1554 S CA -0.207 57.982 58.200 -0.017 0.000 0.914 1554 S CB 0.134 63.321 63.200 -0.022 0.000 0.776 1554 S HN 0.052 nan 8.310 nan 0.000 0.523 1555 K N 0.606 120.987 120.400 -0.032 0.000 2.581 1555 K HA 0.213 4.533 4.320 0.000 0.000 0.249 1555 K C -1.155 175.500 176.600 0.092 0.000 0.966 1555 K CA -0.682 55.526 56.287 -0.132 0.000 0.811 1555 K CB 0.999 33.390 32.500 -0.182 0.000 1.223 1555 K HN 0.145 nan 8.250 nan 0.000 0.438 1556 W N 4.227 125.547 121.300 0.035 0.000 4.849 1556 W HA -0.257 4.404 4.660 0.000 0.000 0.358 1556 W C -0.091 176.447 176.519 0.031 0.000 1.331 1556 W CA 0.574 57.944 57.345 0.041 0.000 0.844 1556 W CB -1.762 27.709 29.460 0.018 0.000 2.434 1556 W HN 0.838 nan 8.180 nan 0.000 1.458 1557 M N -1.709 117.998 119.600 0.178 0.000 2.682 1557 M HA -0.245 4.235 4.480 0.000 0.000 0.196 1557 M C 1.367 177.739 176.300 0.120 0.000 0.542 1557 M CA 2.275 57.648 55.300 0.122 0.000 0.593 1557 M CB -2.647 30.022 32.600 0.116 0.000 2.183 1557 M HN 1.064 nan 8.290 nan 0.000 0.663 1558 G N -0.121 108.766 108.800 0.145 0.000 2.143 1558 G HA2 -0.320 3.640 3.960 0.000 0.000 0.248 1558 G HA3 -0.320 3.640 3.960 0.000 0.000 0.248 1558 G C 0.636 175.609 174.900 0.121 0.000 0.991 1558 G CA 0.804 45.979 45.100 0.124 0.000 0.689 1558 G HN 0.597 nan 8.290 nan 0.000 0.522 1559 K N 0.427 120.918 120.400 0.152 0.000 2.498 1559 K HA 0.369 4.689 4.320 0.000 0.000 0.207 1559 K C 1.481 178.069 176.600 -0.021 0.000 1.033 1559 K CA 0.081 56.407 56.287 0.065 0.000 1.138 1559 K CB 0.836 33.364 32.500 0.046 0.000 0.860 1559 K HN 0.376 nan 8.250 nan 0.000 0.490 1560 G N 0.698 109.545 108.800 0.079 0.000 2.636 1560 G HA2 0.196 4.156 3.960 0.000 0.000 0.246 1560 G HA3 0.196 4.156 3.960 0.000 0.000 0.246 1560 G C 0.578 175.375 174.900 -0.172 0.000 1.216 1560 G CA -0.410 44.620 45.100 -0.116 0.000 0.854 1560 G HN 0.116 nan 8.290 nan 0.000 0.572 1561 V N -0.092 119.633 119.914 -0.314 0.000 2.991 1561 V HA 0.309 4.429 4.120 0.000 0.000 0.355 1561 V C 1.623 177.619 176.094 -0.163 0.000 1.384 1561 V CA -0.193 61.987 62.300 -0.199 0.000 1.171 1561 V CB -0.515 31.163 31.823 -0.242 0.000 1.190 1561 V HN 0.621 nan 8.190 nan 0.000 0.540 1562 L N -0.597 120.538 121.223 -0.146 0.000 2.079 1562 L HA -0.079 4.261 4.340 0.000 0.000 0.210 1562 L C 2.877 179.657 176.870 -0.151 0.000 1.081 1562 L CA 1.888 56.639 54.840 -0.147 0.000 0.752 1562 L CB -0.823 41.157 42.059 -0.131 0.000 0.896 1562 L HN 0.477 nan 8.230 nan 0.000 0.433 1563 H N -0.277 118.774 119.070 -0.032 0.000 2.389 1563 H HA -0.051 4.506 4.556 0.000 0.000 0.299 1563 H C 2.293 177.592 175.328 -0.048 0.000 1.081 1563 H CA 1.431 57.462 56.048 -0.029 0.000 1.345 1563 H CB -0.005 29.746 29.762 -0.019 0.000 1.393 1563 H HN 0.352 nan 8.280 nan 0.000 0.520 1564 A N 0.628 123.479 122.820 0.052 0.000 1.877 1564 A HA -0.103 4.217 4.320 0.000 0.000 0.216 1564 A C 2.835 180.387 177.584 -0.052 0.000 1.186 1564 A CA 1.539 53.568 52.037 -0.013 0.000 0.620 1564 A CB -0.861 18.110 19.000 -0.049 0.000 0.822 1564 A HN 0.207 nan 8.150 nan 0.000 0.443 1565 V N 0.320 120.179 119.914 -0.091 0.000 2.407 1565 V HA -0.265 3.855 4.120 0.000 0.000 0.248 1565 V C 2.551 178.581 176.094 -0.107 0.000 1.055 1565 V CA 2.391 64.611 62.300 -0.134 0.000 1.049 1565 V CB -0.623 31.096 31.823 -0.173 0.000 0.662 1565 V HN 0.701 nan 8.190 nan 0.000 0.455 1566 K N 0.183 120.545 120.400 -0.064 0.000 2.057 1566 K HA -0.199 4.121 4.320 0.000 0.000 0.207 1566 K C 1.999 178.593 176.600 -0.010 0.000 1.049 1566 K CA 1.636 57.904 56.287 -0.031 0.000 0.931 1566 K CB -0.175 32.322 32.500 -0.004 0.000 0.714 1566 K HN 0.413 nan 8.250 nan 0.000 0.440 1567 N N 0.566 119.267 118.700 0.003 0.000 2.205 1567 N HA -0.140 4.600 4.740 0.000 0.000 0.186 1567 N C 1.726 177.234 175.510 -0.004 0.000 1.015 1567 N CA 1.078 54.132 53.050 0.007 0.000 0.862 1567 N CB -0.176 38.315 38.487 0.007 0.000 0.986 1567 N HN 0.044 nan 8.380 nan 0.000 0.429 1568 V N 1.710 121.604 119.914 -0.034 0.000 2.283 1568 V HA -0.124 3.996 4.120 0.000 0.000 0.243 1568 V C 1.854 177.929 176.094 -0.032 0.000 1.039 1568 V CA 1.293 63.565 62.300 -0.046 0.000 1.016 1568 V CB -0.388 31.374 31.823 -0.101 0.000 0.650 1568 V HN 0.311 nan 8.190 nan 0.000 0.449 1569 N N 0.250 118.918 118.700 -0.053 0.000 2.331 1569 N HA -0.118 4.622 4.740 0.000 0.000 0.180 1569 N C 1.282 176.808 175.510 0.026 0.000 1.019 1569 N CA 1.398 54.439 53.050 -0.015 0.000 0.881 1569 N CB -0.133 38.334 38.487 -0.034 0.000 0.972 1569 N HN 0.504 nan 8.380 nan 0.000 0.435 1570 D N -0.594 119.819 120.400 0.023 0.000 2.380 1570 D HA 0.091 4.731 4.640 0.000 0.000 0.212 1570 D C 1.866 178.193 176.300 0.046 0.000 1.021 1570 D CA 0.303 54.325 54.000 0.037 0.000 0.884 1570 D CB 0.580 41.399 40.800 0.032 0.000 1.001 1570 D HN 0.015 nan 8.370 nan 0.000 0.506 1571 V N 0.408 120.349 119.914 0.046 0.000 2.743 1571 V HA 0.103 4.223 4.120 0.000 0.000 0.237 1571 V C 2.334 178.484 176.094 0.094 0.000 1.113 1571 V CA 0.188 62.521 62.300 0.056 0.000 1.141 1571 V CB 0.207 32.051 31.823 0.034 0.000 0.873 1571 V HN 0.011 nan 8.190 nan 0.000 0.486 1572 I N 1.010 121.638 120.570 0.097 0.000 2.133 1572 I HA -0.152 4.018 4.170 0.000 0.000 0.238 1572 I C 2.809 179.057 176.117 0.219 0.000 1.074 1572 I CA 1.473 62.878 61.300 0.175 0.000 1.342 1572 I CB -0.643 37.430 38.000 0.122 0.000 1.053 1572 I HN 0.288 nan 8.210 nan 0.000 0.404 1573 A N 2.061 124.951 122.820 0.118 0.000 1.870 1573 A HA -0.211 4.109 4.320 0.000 0.000 0.219 1573 A C 0.305 177.985 177.584 0.161 0.000 1.224 1573 A CA 2.672 54.774 52.037 0.108 0.000 0.650 1573 A CB -2.338 16.702 19.000 0.067 0.000 0.836 1573 A HN 0.324 nan 8.150 nan 0.000 0.454 1574 P HA -0.180 nan 4.420 nan 0.000 0.215 1574 P C 1.607 179.003 177.300 0.160 0.000 1.157 1574 P CA 2.266 65.441 63.100 0.126 0.000 0.868 1574 P CB -0.264 31.494 31.700 0.097 0.000 0.788 1575 A N -0.872 122.079 122.820 0.218 0.000 1.898 1575 A HA -0.153 4.167 4.320 0.000 0.000 0.216 1575 A C 2.197 179.966 177.584 0.307 0.000 1.181 1575 A CA 1.167 53.383 52.037 0.300 0.000 0.620 1575 A CB -1.791 17.433 19.000 0.372 0.000 0.819 1575 A HN 0.105 nan 8.150 nan 0.000 0.442 1576 F N 0.736 120.779 119.950 0.155 0.000 2.075 1576 F HA -0.164 4.363 4.527 0.000 0.000 0.297 1576 F C 2.318 178.011 175.800 -0.179 0.000 1.113 1576 F CA 2.059 59.978 58.000 -0.135 0.000 1.218 1576 F CB -0.272 38.732 39.000 0.007 0.000 0.984 1576 F HN 0.033 nan 8.300 nan 0.000 0.472 1577 V N 0.499 120.565 119.914 0.252 0.000 2.407 1577 V HA -0.298 3.822 4.120 0.000 0.000 0.248 1577 V C 2.434 178.543 176.094 0.024 0.000 1.055 1577 V CA 2.130 64.516 62.300 0.144 0.000 1.049 1577 V CB -0.792 31.106 31.823 0.125 0.000 0.662 1577 V HN 0.302 nan 8.190 nan 0.000 0.455 1578 K N 0.648 121.060 120.400 0.020 0.000 2.057 1578 K HA -0.148 4.172 4.320 0.000 0.000 0.207 1578 K C 2.120 178.680 176.600 -0.067 0.000 1.049 1578 K CA 1.526 57.812 56.287 -0.001 0.000 0.931 1578 K CB -0.311 32.213 32.500 0.041 0.000 0.714 1578 K HN 0.433 nan 8.250 nan 0.000 0.440 1579 A N 1.442 124.160 122.820 -0.171 0.000 2.125 1579 A HA -0.176 4.144 4.320 0.000 0.000 0.219 1579 A C 0.621 178.044 177.584 -0.269 0.000 1.156 1579 A CA 1.130 53.003 52.037 -0.274 0.000 0.671 1579 A CB -0.821 17.802 19.000 -0.629 0.000 0.794 1579 A HN 0.774 nan 8.150 nan 0.000 0.459 1580 N N -0.684 117.881 118.700 -0.224 0.000 2.688 1580 N HA -0.159 4.581 4.740 0.000 0.000 0.258 1580 N C -0.712 174.675 175.510 -0.205 0.000 1.016 1580 N CA 0.066 53.023 53.050 -0.156 0.000 0.747 1580 N CB -0.891 37.544 38.487 -0.088 0.000 0.895 1580 N HN 0.548 nan 8.380 nan 0.000 0.543 1581 I N 0.454 120.820 120.570 -0.340 0.000 2.581 1581 I HA 0.030 4.200 4.170 0.000 0.000 0.288 1581 I C 0.736 176.757 176.117 -0.161 0.000 1.047 1581 I CA -0.421 60.680 61.300 -0.332 0.000 1.374 1581 I CB 0.698 38.323 38.000 -0.625 0.000 1.423 1581 I HN 0.219 nan 8.210 nan 0.000 0.549 1582 D N 4.595 124.930 120.400 -0.108 0.000 2.339 1582 D HA 0.104 4.744 4.640 0.000 0.000 0.241 1582 D C 0.998 177.285 176.300 -0.022 0.000 1.183 1582 D CA -0.498 53.472 54.000 -0.050 0.000 0.859 1582 D CB 1.393 42.170 40.800 -0.038 0.000 1.067 1582 D HN 0.366 nan 8.370 nan 0.000 0.484 1583 V N 2.611 122.526 119.914 0.001 0.000 2.688 1583 V HA -0.210 3.910 4.120 0.000 0.000 0.256 1583 V C 1.848 177.956 176.094 0.023 0.000 1.084 1583 V CA 1.228 63.544 62.300 0.026 0.000 1.103 1583 V CB -0.746 31.073 31.823 -0.007 0.000 0.688 1583 V HN 0.436 nan 8.190 nan 0.000 0.480 1584 K N 0.510 120.912 120.400 0.002 0.000 2.211 1584 K HA -0.087 4.233 4.320 0.000 0.000 0.203 1584 K C 1.011 177.679 176.600 0.114 0.000 1.050 1584 K CA 1.195 57.515 56.287 0.054 0.000 0.945 1584 K CB -0.221 32.293 32.500 0.023 0.000 0.732 1584 K HN 0.483 nan 8.250 nan 0.000 0.451 1585 D N 1.211 121.646 120.400 0.059 0.000 2.563 1585 D HA -0.018 4.622 4.640 0.000 0.000 0.222 1585 D C 0.913 177.248 176.300 0.058 0.000 1.145 1585 D CA 0.062 54.091 54.000 0.047 0.000 1.001 1585 D CB 0.842 41.650 40.800 0.013 0.000 1.049 1585 D HN -0.054 nan 8.370 nan 0.000 0.515 1586 Q N 2.847 122.698 119.800 0.085 0.000 2.077 1586 Q HA -0.218 4.122 4.340 0.000 0.000 0.206 1586 Q C 1.507 177.547 176.000 0.066 0.000 0.989 1586 Q CA 1.816 57.672 55.803 0.089 0.000 0.853 1586 Q CB 0.155 28.944 28.738 0.084 0.000 0.907 1586 Q HN 0.370 nan 8.270 nan 0.000 0.418 1587 K N -0.689 119.738 120.400 0.045 0.000 2.063 1587 K HA -0.149 4.171 4.320 0.000 0.000 0.208 1587 K C 2.020 178.645 176.600 0.041 0.000 1.048 1587 K CA 1.254 57.563 56.287 0.036 0.000 0.928 1587 K CB -0.311 32.202 32.500 0.021 0.000 0.713 1587 K HN 0.299 nan 8.250 nan 0.000 0.442 1588 A N 0.992 123.830 122.820 0.031 0.000 1.930 1588 A HA -0.095 4.225 4.320 0.000 0.000 0.217 1588 A C 2.385 179.993 177.584 0.039 0.000 1.175 1588 A CA 1.170 53.220 52.037 0.022 0.000 0.627 1588 A CB -0.555 18.437 19.000 -0.014 0.000 0.815 1588 A HN 0.064 nan 8.150 nan 0.000 0.443 1589 V N 0.752 120.692 119.914 0.044 0.000 2.255 1589 V HA -0.257 3.863 4.120 0.000 0.000 0.247 1589 V C 2.168 178.375 176.094 0.187 0.000 1.051 1589 V CA 2.436 64.793 62.300 0.095 0.000 1.018 1589 V CB -0.676 31.245 31.823 0.163 0.000 0.641 1589 V HN 0.538 nan 8.190 nan 0.000 0.445 1590 D N -0.543 119.939 120.400 0.137 0.000 2.149 1590 D HA -0.128 4.512 4.640 0.000 0.000 0.201 1590 D C 1.898 178.258 176.300 0.100 0.000 0.972 1590 D CA 1.049 55.121 54.000 0.120 0.000 0.835 1590 D CB -0.329 40.514 40.800 0.073 0.000 0.966 1590 D HN 0.404 nan 8.370 nan 0.000 0.476 1591 D N 0.127 120.577 120.400 0.085 0.000 2.144 1591 D HA -0.144 4.496 4.640 0.000 0.000 0.199 1591 D C 1.817 178.157 176.300 0.067 0.000 0.984 1591 D CA 0.383 54.416 54.000 0.056 0.000 0.834 1591 D CB -0.302 40.525 40.800 0.045 0.000 0.955 1591 D HN 0.189 nan 8.370 nan 0.000 0.465 1592 F N 1.322 121.256 119.950 -0.027 0.000 2.075 1592 F HA -0.131 4.396 4.527 -0.000 0.000 0.297 1592 F C 2.193 177.995 175.800 0.003 0.000 1.113 1592 F CA 1.144 59.118 58.000 -0.042 0.000 1.218 1592 F CB -0.363 38.565 39.000 -0.121 0.000 0.984 1592 F HN -0.138 nan 8.300 nan 0.000 0.472 1593 L N 0.046 121.356 121.223 0.145 0.000 2.046 1593 L HA -0.239 4.101 4.340 0.000 0.000 0.208 1593 L C 2.482 179.320 176.870 -0.053 0.000 1.077 1593 L CA 1.495 56.376 54.840 0.069 0.000 0.747 1593 L CB -0.747 41.426 42.059 0.191 0.000 0.896 1593 L HN 0.190 nan 8.230 nan 0.000 0.432 1594 I N -1.035 119.518 120.570 -0.027 0.000 2.286 1594 I HA -0.289 3.881 4.170 0.000 0.000 0.248 1594 I C 2.817 178.881 176.117 -0.087 0.000 1.115 1594 I CA 1.312 62.586 61.300 -0.043 0.000 1.392 1594 I CB -0.287 37.700 38.000 -0.021 0.000 1.065 1594 I HN 0.218 nan 8.210 nan 0.000 0.418 1595 S N 0.880 116.501 115.700 -0.130 0.000 2.383 1595 S HA -0.152 4.318 4.470 0.000 0.000 0.227 1595 S C 1.981 176.455 174.600 -0.210 0.000 1.026 1595 S CA 1.060 59.165 58.200 -0.159 0.000 0.981 1595 S CB -0.220 62.875 63.200 -0.175 0.000 0.818 1595 S HN 0.317 nan 8.310 nan 0.000 0.472 1596 L N 1.845 122.880 121.223 -0.314 0.000 2.093 1596 L HA 0.027 4.367 4.340 0.000 0.000 0.208 1596 L C 1.937 178.719 176.870 -0.147 0.000 1.085 1596 L CA 2.388 57.056 54.840 -0.286 0.000 0.755 1596 L CB -0.906 40.924 42.059 -0.381 0.000 0.904 1596 L HN 0.387 nan 8.230 nan 0.000 0.435 1597 D N -0.986 119.347 120.400 -0.112 0.000 2.097 1597 D HA -0.060 4.580 4.640 0.000 0.000 0.197 1597 D C 1.786 178.048 176.300 -0.062 0.000 0.984 1597 D CA 1.799 55.758 54.000 -0.068 0.000 0.826 1597 D CB -0.118 40.652 40.800 -0.050 0.000 0.973 1597 D HN 0.447 nan 8.370 nan 0.000 0.460 1598 G N -0.604 108.156 108.800 -0.067 0.000 2.184 1598 G HA2 -0.271 3.689 3.960 0.000 0.000 0.264 1598 G HA3 -0.271 3.689 3.960 0.000 0.000 0.264 1598 G C 0.481 175.357 174.900 -0.041 0.000 0.975 1598 G CA 1.145 46.212 45.100 -0.056 0.000 0.642 1598 G HN 0.814 nan 8.290 nan 0.000 0.536 1599 T N -2.918 111.614 114.554 -0.037 0.000 2.856 1599 T HA 0.825 5.175 4.350 0.000 0.000 0.283 1599 T C 1.386 176.071 174.700 -0.025 0.000 1.008 1599 T CA 0.341 62.424 62.100 -0.028 0.000 0.997 1599 T CB 1.977 70.829 68.868 -0.026 0.000 0.992 1599 T HN 1.353 nan 8.240 nan 0.000 0.454 1600 A N 2.924 125.732 122.820 -0.020 0.000 1.883 1600 A HA -0.134 4.186 4.320 0.000 0.000 0.217 1600 A C 2.078 179.654 177.584 -0.012 0.000 1.186 1600 A CA 1.785 53.812 52.037 -0.016 0.000 0.624 1600 A CB -0.879 18.113 19.000 -0.013 0.000 0.822 1600 A HN 0.975 nan 8.150 nan 0.000 0.444 1601 N N -0.784 117.911 118.700 -0.009 0.000 2.370 1601 N HA -0.016 4.724 4.740 0.000 0.000 0.198 1601 N C -0.295 175.208 175.510 -0.012 0.000 1.156 1601 N CA 0.688 53.735 53.050 -0.005 0.000 0.839 1601 N CB -0.306 38.182 38.487 0.001 0.000 0.989 1601 N HN 0.508 nan 8.380 nan 0.000 0.468 1602 K N -0.074 120.315 120.400 -0.018 0.000 3.096 1602 K HA -0.162 4.158 4.320 0.000 0.000 0.266 1602 K C 0.566 177.151 176.600 -0.023 0.000 1.043 1602 K CA 0.737 57.011 56.287 -0.022 0.000 0.758 1602 K CB -1.947 30.541 32.500 -0.020 0.000 1.260 1602 K HN 0.554 nan 8.250 nan 0.000 0.481 1603 S N -0.656 115.030 115.700 -0.024 0.000 2.496 1603 S HA -0.086 4.384 4.470 0.000 0.000 0.224 1603 S C 1.682 176.263 174.600 -0.031 0.000 0.996 1603 S CA 0.692 58.877 58.200 -0.026 0.000 0.927 1603 S CB 0.278 63.463 63.200 -0.024 0.000 0.774 1603 S HN 0.471 nan 8.310 nan 0.000 0.524 1604 K N 1.413 121.794 120.400 -0.031 0.000 1.991 1604 K HA 0.138 4.458 4.320 0.000 0.000 0.207 1604 K C 1.824 178.406 176.600 -0.030 0.000 1.045 1604 K CA 1.272 57.539 56.287 -0.033 0.000 0.937 1604 K CB -0.218 32.262 32.500 -0.033 0.000 0.720 1604 K HN 0.398 nan 8.250 nan 0.000 0.438 1605 L N -0.382 120.825 121.223 -0.027 0.000 2.416 1605 L HA 0.251 4.591 4.340 0.000 0.000 0.216 1605 L C 0.578 177.436 176.870 -0.021 0.000 1.098 1605 L CA 0.170 54.998 54.840 -0.020 0.000 0.840 1605 L CB 0.225 42.274 42.059 -0.017 0.000 0.981 1605 L HN 0.493 nan 8.230 nan 0.000 0.462 1606 G N -0.339 108.446 108.800 -0.025 0.000 2.907 1606 G HA2 -0.037 3.923 3.960 0.000 0.000 0.686 1606 G HA3 -0.037 3.923 3.960 0.000 0.000 0.686 1606 G C 0.485 175.367 174.900 -0.029 0.000 1.115 1606 G CA -0.344 44.739 45.100 -0.027 0.000 0.760 1606 G HN 0.132 nan 8.290 nan 0.000 0.620 1607 A N 1.978 124.781 122.820 -0.030 0.000 1.933 1607 A HA -0.057 4.263 4.320 0.000 0.000 0.218 1607 A C 2.234 179.794 177.584 -0.041 0.000 1.175 1607 A CA 2.157 54.175 52.037 -0.031 0.000 0.628 1607 A CB -0.381 18.603 19.000 -0.028 0.000 0.814 1607 A HN 1.724 nan 8.150 nan 0.000 0.444 1608 N N 0.332 119.004 118.700 -0.047 0.000 2.571 1608 N HA 0.130 4.870 4.740 0.000 0.000 0.189 1608 N C 1.060 176.530 175.510 -0.067 0.000 1.154 1608 N CA 1.257 54.270 53.050 -0.061 0.000 0.907 1608 N CB -0.259 38.187 38.487 -0.068 0.000 0.977 1608 N HN 0.399 nan 8.380 nan 0.000 0.449 1609 A N 0.463 123.250 122.820 -0.054 0.000 1.993 1609 A HA 0.342 4.662 4.320 0.000 0.000 0.207 1609 A C 2.179 179.736 177.584 -0.044 0.000 1.224 1609 A CA -0.115 51.889 52.037 -0.054 0.000 0.749 1609 A CB -0.068 18.908 19.000 -0.039 0.000 0.884 1609 A HN 0.166 nan 8.150 nan 0.000 0.467 1610 I N -0.416 120.136 120.570 -0.030 0.000 2.286 1610 I HA -0.153 4.017 4.170 0.000 0.000 0.245 1610 I C 2.381 178.482 176.117 -0.026 0.000 1.104 1610 I CA 0.855 62.149 61.300 -0.011 0.000 1.397 1610 I CB -0.162 37.837 38.000 -0.002 0.000 1.072 1610 I HN 0.362 nan 8.210 nan 0.000 0.417 1611 L N 1.442 122.636 121.223 -0.048 0.000 2.013 1611 L HA -0.149 4.191 4.340 0.000 0.000 0.212 1611 L C 2.389 179.199 176.870 -0.099 0.000 1.073 1611 L CA 2.368 57.163 54.840 -0.076 0.000 0.753 1611 L CB -1.340 40.667 42.059 -0.086 0.000 0.890 1611 L HN 0.225 nan 8.230 nan 0.000 0.432 1612 G N -1.159 107.585 108.800 -0.094 0.000 2.505 1612 G HA2 -0.253 3.707 3.960 0.000 0.000 0.220 1612 G HA3 -0.253 3.707 3.960 0.000 0.000 0.220 1612 G C 1.500 176.342 174.900 -0.097 0.000 1.145 1612 G CA 1.342 46.383 45.100 -0.098 0.000 0.761 1612 G HN 0.388 nan 8.290 nan 0.000 0.571 1613 V N 0.475 120.332 119.914 -0.096 0.000 2.379 1613 V HA -0.137 3.983 4.120 0.000 0.000 0.245 1613 V C 2.949 179.000 176.094 -0.071 0.000 1.044 1613 V CA 2.040 64.261 62.300 -0.131 0.000 1.036 1613 V CB -0.372 31.358 31.823 -0.155 0.000 0.664 1613 V HN 0.484 nan 8.190 nan 0.000 0.453 1614 S N 0.034 115.718 115.700 -0.027 0.000 2.353 1614 S HA -0.173 4.297 4.470 0.000 0.000 0.222 1614 S C 1.947 176.522 174.600 -0.042 0.000 1.035 1614 S CA 1.893 60.095 58.200 0.004 0.000 1.025 1614 S CB -0.337 62.856 63.200 -0.013 0.000 0.902 1614 S HN 0.511 nan 8.310 nan 0.000 0.440 1615 L N 0.961 122.099 121.223 -0.143 0.000 2.056 1615 L HA -0.001 4.339 4.340 0.000 0.000 0.207 1615 L C 2.964 179.806 176.870 -0.046 0.000 1.078 1615 L CA 1.124 55.821 54.840 -0.238 0.000 0.749 1615 L CB -0.742 41.012 42.059 -0.509 0.000 0.901 1615 L HN 0.405 nan 8.230 nan 0.000 0.433 1616 A N 0.258 123.060 122.820 -0.029 0.000 1.933 1616 A HA -0.140 4.180 4.320 0.000 0.000 0.218 1616 A C 2.547 180.140 177.584 0.015 0.000 1.175 1616 A CA 1.651 53.709 52.037 0.034 0.000 0.628 1616 A CB -0.596 18.415 19.000 0.017 0.000 0.814 1616 A HN 0.394 nan 8.150 nan 0.000 0.444 1617 A N 0.383 123.204 122.820 0.000 0.000 1.933 1617 A HA -0.089 4.231 4.320 0.000 0.000 0.218 1617 A C 2.508 180.088 177.584 -0.006 0.000 1.175 1617 A CA 2.256 54.300 52.037 0.012 0.000 0.628 1617 A CB -0.942 18.122 19.000 0.107 0.000 0.814 1617 A HN 1.010 nan 8.150 nan 0.000 0.444 1618 S N -0.080 115.665 115.700 0.076 0.000 2.402 1618 S HA -0.166 4.304 4.470 0.000 0.000 0.229 1618 S C 1.986 176.609 174.600 0.039 0.000 1.021 1618 S CA 1.127 59.428 58.200 0.169 0.000 0.974 1618 S CB -0.443 62.954 63.200 0.328 0.000 0.800 1618 S HN 0.629 nan 8.310 nan 0.000 0.484 1619 R N 1.400 121.900 120.500 0.000 0.000 2.073 1619 R HA 0.159 4.499 4.340 0.000 0.000 0.229 1619 R C 2.806 178.737 176.300 -0.615 0.000 1.120 1619 R CA 1.167 57.196 56.100 -0.118 0.000 0.967 1619 R CB -0.806 29.543 30.300 0.082 0.000 0.862 1619 R HN 0.561 nan 8.270 nan 0.000 0.436 1620 A N 1.502 123.805 122.820 -0.861 0.000 1.933 1620 A HA -0.114 4.206 4.320 0.000 0.000 0.218 1620 A C 2.377 179.533 177.584 -0.714 0.000 1.175 1620 A CA 1.695 52.916 52.037 -1.361 0.000 0.628 1620 A CB -0.535 18.080 19.000 -0.641 0.000 0.814 1620 A HN 0.393 nan 8.150 nan 0.000 0.444 1621 A N -0.144 122.382 122.820 -0.489 0.000 1.898 1621 A HA 0.188 4.508 4.320 0.000 0.000 0.216 1621 A C 2.499 179.707 177.584 -0.625 0.000 1.181 1621 A CA 1.961 53.697 52.037 -0.501 0.000 0.620 1621 A CB -0.990 17.690 19.000 -0.534 0.000 0.819 1621 A HN 1.052 nan 8.150 nan 0.000 0.442 1622 A N -0.140 122.302 122.820 -0.630 0.000 1.933 1622 A HA 0.158 4.478 4.320 0.000 0.000 0.218 1622 A C 2.473 179.900 177.584 -0.261 0.000 1.175 1622 A CA 2.050 53.843 52.037 -0.406 0.000 0.628 1622 A CB -0.920 17.951 19.000 -0.216 0.000 0.814 1622 A HN 1.014 nan 8.150 nan 0.000 0.444 1623 A N -0.413 122.236 122.820 -0.285 0.000 1.898 1623 A HA -0.171 4.149 4.320 0.000 0.000 0.216 1623 A C 2.029 179.553 177.584 -0.100 0.000 1.181 1623 A CA 1.726 53.689 52.037 -0.123 0.000 0.620 1623 A CB -0.553 18.430 19.000 -0.030 0.000 0.819 1623 A HN 0.654 nan 8.150 nan 0.000 0.442 1624 E N 0.029 120.130 120.200 -0.165 0.000 2.118 1624 E HA -0.217 4.133 4.350 0.000 0.000 0.195 1624 E C 1.632 178.180 176.600 -0.088 0.000 0.992 1624 E CA 1.484 57.822 56.400 -0.104 0.000 0.804 1624 E CB -0.078 29.548 29.700 -0.124 0.000 0.741 1624 E HN 0.628 nan 8.360 nan 0.000 0.458 1625 K N 0.164 120.489 120.400 -0.125 0.000 2.459 1625 K HA 0.023 4.344 4.320 0.000 0.000 0.193 1625 K C 0.323 176.886 176.600 -0.062 0.000 1.030 1625 K CA 0.403 56.639 56.287 -0.084 0.000 1.026 1625 K CB -0.081 32.365 32.500 -0.090 0.000 0.809 1625 K HN 0.193 nan 8.250 nan 0.000 0.504 1626 N N 0.702 119.362 118.700 -0.067 0.000 2.756 1626 N HA -0.166 4.574 4.740 0.000 0.000 0.248 1626 N C -1.174 174.301 175.510 -0.059 0.000 1.062 1626 N CA 0.212 53.234 53.050 -0.047 0.000 0.696 1626 N CB -0.736 37.735 38.487 -0.026 0.000 0.946 1626 N HN 0.085 nan 8.380 nan 0.000 0.548 1627 V N -2.840 117.020 119.914 -0.090 0.000 3.078 1627 V HA 0.779 4.899 4.120 0.000 0.000 0.311 1627 V C -2.521 173.459 176.094 -0.190 0.000 1.138 1627 V CA -1.794 60.431 62.300 -0.125 0.000 1.007 1627 V CB 1.735 33.496 31.823 -0.103 0.000 1.045 1627 V HN -0.110 nan 8.190 nan 0.000 0.432 1628 P HA 0.172 nan 4.420 nan 0.000 0.268 1628 P C 0.698 177.730 177.300 -0.446 0.000 1.208 1628 P CA -0.208 62.622 63.100 -0.451 0.000 0.777 1628 P CB 0.605 31.773 31.700 -0.886 0.000 0.875 1629 L N 3.689 124.746 121.223 -0.277 0.000 2.012 1629 L HA -0.223 4.117 4.340 0.000 0.000 0.210 1629 L C 2.167 178.938 176.870 -0.164 0.000 1.073 1629 L CA 1.937 56.689 54.840 -0.146 0.000 0.748 1629 L CB -1.751 40.258 42.059 -0.083 0.000 0.891 1629 L HN 0.506 nan 8.230 nan 0.000 0.431 1630 Y N -1.118 119.105 120.300 -0.130 0.000 2.256 1630 Y HA -0.167 4.383 4.550 0.000 0.000 0.288 1630 Y C 2.203 178.062 175.900 -0.068 0.000 1.155 1630 Y CA 1.462 59.477 58.100 -0.141 0.000 1.203 1630 Y CB -1.210 37.121 38.460 -0.214 0.000 0.980 1630 Y HN 0.122 nan 8.280 nan 0.000 0.530 1631 K N -0.378 119.744 120.400 -0.462 0.000 2.057 1631 K HA -0.201 4.119 4.320 0.000 0.000 0.206 1631 K C 2.010 178.623 176.600 0.022 0.000 1.050 1631 K CA 1.627 57.837 56.287 -0.130 0.000 0.935 1631 K CB -0.456 31.882 32.500 -0.271 0.000 0.715 1631 K HN 0.481 nan 8.250 nan 0.000 0.439 1632 H N 1.265 120.269 119.070 -0.109 0.000 2.389 1632 H HA 0.021 4.577 4.556 0.000 0.000 0.299 1632 H C 1.784 177.116 175.328 0.007 0.000 1.081 1632 H CA 1.205 57.225 56.048 -0.047 0.000 1.345 1632 H CB -0.109 29.610 29.762 -0.071 0.000 1.393 1632 H HN 0.029 nan 8.280 nan 0.000 0.520 1633 L N -0.454 120.712 121.223 -0.095 0.000 2.093 1633 L HA -0.072 4.268 4.340 0.000 0.000 0.208 1633 L C 2.771 179.618 176.870 -0.039 0.000 1.085 1633 L CA 0.898 55.683 54.840 -0.092 0.000 0.755 1633 L CB -0.663 41.383 42.059 -0.021 0.000 0.904 1633 L HN 0.411 nan 8.230 nan 0.000 0.435 1634 A N -0.022 122.829 122.820 0.053 0.000 1.930 1634 A HA -0.205 4.115 4.320 0.000 0.000 0.217 1634 A C 1.910 179.502 177.584 0.014 0.000 1.175 1634 A CA 1.793 53.886 52.037 0.093 0.000 0.627 1634 A CB -0.396 18.754 19.000 0.250 0.000 0.815 1634 A HN 0.347 nan 8.150 nan 0.000 0.443 1635 D N 0.285 120.670 120.400 -0.026 0.000 2.097 1635 D HA -0.108 4.532 4.640 0.000 0.000 0.197 1635 D C 1.975 178.223 176.300 -0.087 0.000 0.984 1635 D CA 1.032 55.004 54.000 -0.046 0.000 0.826 1635 D CB -0.441 40.340 40.800 -0.031 0.000 0.973 1635 D HN 0.435 nan 8.370 nan 0.000 0.460 1636 L N 1.025 122.135 121.223 -0.189 0.000 2.127 1636 L HA -0.155 4.185 4.340 0.000 0.000 0.211 1636 L C 2.163 179.000 176.870 -0.055 0.000 1.089 1636 L CA 1.422 56.172 54.840 -0.149 0.000 0.757 1636 L CB -0.425 41.505 42.059 -0.216 0.000 0.899 1636 L HN 0.079 nan 8.230 nan 0.000 0.434 1637 S N -1.857 113.825 115.700 -0.029 0.000 2.577 1637 S HA 0.084 4.554 4.470 0.000 0.000 0.219 1637 S C 0.724 175.331 174.600 0.011 0.000 0.962 1637 S CA -0.465 57.743 58.200 0.012 0.000 0.921 1637 S CB 0.033 63.263 63.200 0.050 0.000 0.789 1637 S HN 0.312 nan 8.310 nan 0.000 0.497 1638 K N 1.261 121.656 120.400 -0.008 0.000 3.035 1638 K HA -0.132 4.188 4.320 0.000 0.000 0.262 1638 K C -0.373 176.213 176.600 -0.024 0.000 1.024 1638 K CA 0.531 56.809 56.287 -0.014 0.000 0.748 1638 K CB -2.324 30.169 32.500 -0.011 0.000 1.247 1638 K HN 0.491 nan 8.250 nan 0.000 0.482 1639 S N 0.586 116.271 115.700 -0.025 0.000 2.634 1639 S HA 0.182 4.652 4.470 0.000 0.000 0.261 1639 S C 0.473 175.012 174.600 -0.101 0.000 1.271 1639 S CA -0.728 57.437 58.200 -0.059 0.000 0.985 1639 S CB 0.804 63.982 63.200 -0.037 0.000 0.968 1639 S HN 0.159 nan 8.310 nan 0.000 0.568 1640 K N 0.912 121.222 120.400 -0.149 0.000 2.355 1640 K HA 0.102 4.422 4.320 0.000 0.000 0.270 1640 K C 1.115 177.573 176.600 -0.237 0.000 1.003 1640 K CA 0.023 56.210 56.287 -0.168 0.000 0.957 1640 K CB 0.195 32.590 32.500 -0.175 0.000 0.939 1640 K HN 0.505 nan 8.250 nan 0.000 0.482 1641 T N 0.078 114.521 114.554 -0.185 0.000 2.904 1641 T HA -0.091 4.259 4.350 0.000 0.000 0.267 1641 T C 0.470 174.989 174.700 -0.302 0.000 1.059 1641 T CA 1.024 63.010 62.100 -0.190 0.000 1.137 1641 T CB -0.058 68.763 68.868 -0.078 0.000 0.879 1641 T HN 0.780 nan 8.240 nan 0.000 0.467 1642 S N 0.501 116.050 115.700 -0.251 0.000 2.552 1642 S HA 0.565 5.035 4.470 0.000 0.000 0.272 1642 S C -3.382 171.127 174.600 -0.151 0.000 1.150 1642 S CA -1.474 56.598 58.200 -0.214 0.000 0.849 1642 S CB 1.826 64.980 63.200 -0.077 0.000 1.113 1642 S HN 0.025 nan 8.310 nan 0.000 0.458 1643 P HA 0.456 nan 4.420 nan 0.000 0.285 1643 P C -1.242 175.984 177.300 -0.124 0.000 1.269 1643 P CA -0.474 62.583 63.100 -0.072 0.000 0.844 1643 P CB 0.458 32.157 31.700 -0.001 0.000 1.094 1644 Y N -0.288 120.013 120.300 0.002 0.000 2.397 1644 Y HA 0.183 4.733 4.550 0.000 0.000 0.335 1644 Y C 0.784 176.668 175.900 -0.026 0.000 1.213 1644 Y CA 0.244 58.334 58.100 -0.017 0.000 1.391 1644 Y CB 0.749 39.185 38.460 -0.039 0.000 1.293 1644 Y HN -0.005 nan 8.280 nan 0.000 0.557 1645 V N 5.303 125.288 119.914 0.119 0.000 2.384 1645 V HA 0.198 4.318 4.120 0.000 0.000 0.287 1645 V C -0.335 175.795 176.094 0.061 0.000 1.020 1645 V CA -0.997 61.344 62.300 0.068 0.000 0.850 1645 V CB 1.129 32.966 31.823 0.023 0.000 0.987 1645 V HN 0.471 nan 8.190 nan 0.000 0.436 1646 L N 8.110 129.392 121.223 0.097 0.000 2.331 1646 L HA 0.458 4.798 4.340 0.000 0.000 0.278 1646 L C -1.900 175.071 176.870 0.168 0.000 1.106 1646 L CA -1.351 53.555 54.840 0.111 0.000 0.824 1646 L CB 1.577 43.790 42.059 0.256 0.000 1.142 1646 L HN 0.432 nan 8.230 nan 0.000 0.443 1647 P HA 0.162 nan 4.420 nan 0.000 0.279 1647 P C -0.590 176.915 177.300 0.341 0.000 1.252 1647 P CA -0.492 62.704 63.100 0.160 0.000 0.811 1647 P CB 1.610 33.381 31.700 0.118 0.000 1.035 1648 V N 4.073 124.096 119.914 0.182 0.000 2.461 1648 V HA 0.213 4.333 4.120 0.000 0.000 0.275 1648 V C -1.719 174.531 176.094 0.260 0.000 1.047 1648 V CA -1.505 60.915 62.300 0.201 0.000 0.955 1648 V CB 0.795 32.597 31.823 -0.034 0.000 0.988 1648 V HN 0.593 nan 8.190 nan 0.000 0.471 1649 P HA 0.312 nan 4.420 nan 0.000 0.293 1649 P C -1.092 176.212 177.300 0.006 0.000 1.300 1649 P CA -0.432 62.783 63.100 0.192 0.000 0.792 1649 P CB 0.774 32.589 31.700 0.190 0.000 0.925 1650 F N 3.402 123.317 119.950 -0.059 0.000 2.350 1650 F HA 0.304 4.831 4.527 0.000 0.000 0.365 1650 F C 0.648 176.401 175.800 -0.079 0.000 1.122 1650 F CA -0.378 57.567 58.000 -0.091 0.000 1.139 1650 F CB 0.558 39.492 39.000 -0.111 0.000 1.220 1650 F HN 0.048 nan 8.300 nan 0.000 0.499 1651 L N 3.874 125.091 121.223 -0.010 0.000 2.261 1651 L HA 0.267 4.607 4.340 0.000 0.000 0.289 1651 L C 0.737 177.622 176.870 0.024 0.000 1.059 1651 L CA -0.270 54.559 54.840 -0.019 0.000 0.816 1651 L CB 0.489 42.505 42.059 -0.071 0.000 1.191 1651 L HN 0.550 nan 8.230 nan 0.000 0.431 1652 N N 2.937 121.664 118.700 0.045 0.000 2.605 1652 N HA 0.025 4.765 4.740 0.000 0.000 0.282 1652 N C 1.118 176.680 175.510 0.087 0.000 1.206 1652 N CA -0.398 52.700 53.050 0.079 0.000 1.074 1652 N CB 0.684 39.222 38.487 0.085 0.000 1.434 1652 N HN 0.645 nan 8.380 nan 0.000 0.506 1653 V N 1.517 121.502 119.914 0.118 0.000 3.306 1653 V HA 0.189 4.309 4.120 0.000 0.000 0.264 1653 V C 0.591 176.782 176.094 0.161 0.000 1.149 1653 V CA 0.559 62.974 62.300 0.190 0.000 1.143 1653 V CB -0.374 31.586 31.823 0.227 0.000 0.767 1653 V HN 0.462 nan 8.190 nan 0.000 0.476 1654 L N 1.876 123.183 121.223 0.141 0.000 2.476 1654 L HA 0.635 4.975 4.340 0.000 0.000 0.269 1654 L C -1.583 175.390 176.870 0.173 0.000 0.965 1654 L CA -0.439 54.456 54.840 0.092 0.000 0.845 1654 L CB 1.918 43.974 42.059 -0.005 0.000 1.259 1654 L HN 0.172 nan 8.230 nan 0.000 0.403 1655 N N 3.364 122.132 118.700 0.114 0.000 2.443 1655 N HA 0.742 5.482 4.740 0.000 0.000 0.295 1655 N C -0.163 175.456 175.510 0.181 0.000 1.076 1655 N CA -0.307 52.843 53.050 0.167 0.000 0.919 1655 N CB 2.188 40.737 38.487 0.104 0.000 1.176 1655 N HN 0.775 nan 8.380 nan 0.000 0.487 1656 G N -1.309 107.660 108.800 0.282 0.000 3.135 1656 G HA2 0.657 4.617 3.960 0.000 0.000 0.278 1656 G HA3 0.657 4.617 3.960 0.000 0.000 0.278 1656 G C 0.333 175.393 174.900 0.268 0.000 1.302 1656 G CA -0.119 45.131 45.100 0.249 0.000 0.880 1656 G HN 0.696 nan 8.290 nan 0.000 0.574 1657 G N -0.110 108.849 108.800 0.265 0.000 2.634 1657 G HA2 -0.203 3.757 3.960 0.000 0.000 0.309 1657 G HA3 -0.203 3.757 3.960 0.000 0.000 0.309 1657 G C 1.833 176.887 174.900 0.258 0.000 1.265 1657 G CA 2.056 47.378 45.100 0.370 0.000 0.998 1657 G HN 2.063 nan 8.290 nan 0.000 0.551 1658 S N -0.679 115.174 115.700 0.254 0.000 2.469 1658 S HA -0.074 4.396 4.470 0.000 0.000 0.238 1658 S C 1.524 176.057 174.600 -0.112 0.000 0.998 1658 S CA 1.935 60.165 58.200 0.050 0.000 0.957 1658 S CB -0.253 62.908 63.200 -0.064 0.000 0.764 1658 S HN 0.721 nan 8.310 nan 0.000 0.514 1659 H N 1.088 120.227 119.070 0.115 0.000 2.529 1659 H HA 0.663 5.219 4.556 0.000 0.000 0.277 1659 H C 0.712 176.072 175.328 0.054 0.000 1.004 1659 H CA 0.424 56.518 56.048 0.077 0.000 1.167 1659 H CB 0.151 29.962 29.762 0.081 0.000 1.445 1659 H HN 0.587 nan 8.280 nan 0.000 0.554 1660 A N -0.669 122.224 122.820 0.121 0.000 2.486 1660 A HA 0.627 4.947 4.320 0.000 0.000 0.289 1660 A C 1.141 178.725 177.584 0.000 0.000 1.176 1660 A CA -0.095 51.974 52.037 0.052 0.000 0.757 1660 A CB 1.041 20.064 19.000 0.038 0.000 1.337 1660 A HN 0.201 nan 8.150 nan 0.000 0.423 1661 G N -0.876 107.910 108.800 -0.024 0.000 3.062 1661 G HA2 0.434 4.394 3.960 0.000 0.000 0.228 1661 G HA3 0.434 4.394 3.960 0.000 0.000 0.228 1661 G C 0.682 175.548 174.900 -0.057 0.000 1.094 1661 G CA 0.946 46.023 45.100 -0.038 0.000 0.782 1661 G HN 1.141 nan 8.290 nan 0.000 0.541 1662 G N 0.159 108.921 108.800 -0.064 0.000 2.624 1662 G HA2 0.420 4.380 3.960 0.000 0.000 0.217 1662 G HA3 0.420 4.380 3.960 0.000 0.000 0.217 1662 G C 1.251 176.096 174.900 -0.091 0.000 1.506 1662 G CA 0.593 45.653 45.100 -0.067 0.000 1.072 1662 G HN 0.392 nan 8.290 nan 0.000 0.568 1663 A N -1.586 121.185 122.820 -0.081 0.000 2.115 1663 A HA 0.382 4.702 4.320 0.000 0.000 0.211 1663 A C 1.158 178.684 177.584 -0.097 0.000 1.169 1663 A CA -0.110 51.865 52.037 -0.103 0.000 0.787 1663 A CB -0.340 18.620 19.000 -0.067 0.000 0.858 1663 A HN 0.542 nan 8.150 nan 0.000 0.474 1664 L N 0.987 122.177 121.223 -0.054 0.000 2.771 1664 L HA 0.085 4.425 4.340 0.000 0.000 0.278 1664 L C 1.351 178.260 176.870 0.065 0.000 1.175 1664 L CA 0.582 55.426 54.840 0.008 0.000 0.973 1664 L CB 0.029 42.091 42.059 0.006 0.000 1.286 1664 L HN 0.282 nan 8.230 nan 0.000 0.481 1665 A N 6.093 128.963 122.820 0.083 0.000 1.935 1665 A HA 0.159 4.479 4.320 0.000 0.000 0.214 1665 A C 0.951 178.754 177.584 0.365 0.000 1.178 1665 A CA 0.190 52.364 52.037 0.228 0.000 0.640 1665 A CB -0.358 18.567 19.000 -0.127 0.000 0.825 1665 A HN 0.641 nan 8.150 nan 0.000 0.447 1666 L N 0.738 122.129 121.223 0.280 0.000 2.499 1666 L HA 0.005 4.345 4.340 0.000 0.000 0.273 1666 L C 1.590 178.624 176.870 0.275 0.000 1.195 1666 L CA -0.081 54.910 54.840 0.250 0.000 0.882 1666 L CB 0.466 42.557 42.059 0.053 0.000 1.133 1666 L HN 0.567 nan 8.230 nan 0.000 0.483 1667 Q N 2.685 122.600 119.800 0.192 0.000 2.046 1667 Q HA -0.050 4.290 4.340 0.000 0.000 0.200 1667 Q C -0.162 175.952 176.000 0.189 0.000 0.975 1667 Q CA 1.256 57.189 55.803 0.217 0.000 0.836 1667 Q CB 0.430 29.276 28.738 0.180 0.000 0.896 1667 Q HN 0.678 nan 8.270 nan 0.000 0.428 1668 E N -0.601 119.607 120.200 0.013 0.000 2.256 1668 E HA 0.338 4.688 4.350 0.000 0.000 0.268 1668 E C -1.650 174.831 176.600 -0.198 0.000 0.877 1668 E CA -0.466 55.947 56.400 0.021 0.000 0.757 1668 E CB 1.650 31.364 29.700 0.023 0.000 1.183 1668 E HN 0.069 nan 8.360 nan 0.000 0.418 1669 F N 2.798 122.765 119.950 0.028 0.000 2.434 1669 F HA 0.416 4.943 4.527 0.000 0.000 0.355 1669 F C -0.055 175.758 175.800 0.021 0.000 1.115 1669 F CA -0.617 57.389 58.000 0.010 0.000 1.010 1669 F CB 0.952 39.943 39.000 -0.015 0.000 1.234 1669 F HN 0.184 nan 8.300 nan 0.000 0.439 1670 M N 5.192 124.865 119.600 0.122 0.000 2.472 1670 M HA 0.616 5.096 4.480 0.000 0.000 0.331 1670 M C -0.416 175.906 176.300 0.037 0.000 1.170 1670 M CA -0.898 54.460 55.300 0.097 0.000 1.009 1670 M CB 2.337 35.025 32.600 0.146 0.000 1.672 1670 M HN 0.463 nan 8.290 nan 0.000 0.453 1671 I N -0.308 120.246 120.570 -0.028 0.000 2.525 1671 I HA 0.955 5.125 4.170 0.000 0.000 0.301 1671 I C -0.805 175.138 176.117 -0.290 0.000 0.992 1671 I CA -0.851 60.387 61.300 -0.105 0.000 1.162 1671 I CB 1.899 39.869 38.000 -0.050 0.000 1.332 1671 I HN 0.722 nan 8.210 nan 0.000 0.458 1672 A N 5.281 127.851 122.820 -0.417 0.000 2.457 1672 A HA 0.699 5.019 4.320 0.000 0.000 0.283 1672 A C -2.748 174.609 177.584 -0.378 0.000 1.166 1672 A CA -1.446 50.179 52.037 -0.687 0.000 0.740 1672 A CB 0.917 19.041 19.000 -1.460 0.000 1.181 1672 A HN 0.585 nan 8.150 nan 0.000 0.446 1673 P HA 0.111 nan 4.420 nan 0.000 0.237 1673 P C 1.164 178.470 177.300 0.010 0.000 1.788 1673 P CA 0.251 63.277 63.100 -0.123 0.000 1.061 1673 P CB 0.078 31.685 31.700 -0.155 0.000 1.967 1674 T N -2.581 111.964 114.554 -0.015 0.000 3.035 1674 T HA -0.047 4.303 4.350 0.000 0.000 0.268 1674 T C 1.797 176.608 174.700 0.186 0.000 1.109 1674 T CA 0.944 63.102 62.100 0.096 0.000 1.119 1674 T CB -0.570 68.353 68.868 0.093 0.000 0.900 1674 T HN 0.255 nan 8.240 nan 0.000 0.503 1675 G N 0.794 109.662 108.800 0.114 0.000 3.210 1675 G HA2 0.531 4.491 3.960 0.000 0.000 0.220 1675 G HA3 0.531 4.491 3.960 0.000 0.000 0.220 1675 G C 0.417 175.370 174.900 0.089 0.000 1.200 1675 G CA -0.023 45.139 45.100 0.103 0.000 0.834 1675 G HN 0.814 nan 8.290 nan 0.000 0.524 1676 A N -0.153 122.747 122.820 0.133 0.000 2.264 1676 A HA 0.686 5.006 4.320 0.000 0.000 0.304 1676 A C 1.147 178.742 177.584 0.018 0.000 1.100 1676 A CA -0.582 51.425 52.037 -0.050 0.000 0.839 1676 A CB 0.994 19.801 19.000 -0.323 0.000 1.121 1676 A HN 0.134 nan 8.150 nan 0.000 0.496 1677 K N -0.497 119.835 120.400 -0.114 0.000 2.354 1677 K HA 0.111 4.431 4.320 0.000 0.000 0.194 1677 K C 0.153 176.696 176.600 -0.096 0.000 1.045 1677 K CA 1.219 57.503 56.287 -0.006 0.000 1.026 1677 K CB 0.355 32.854 32.500 -0.003 0.000 0.866 1677 K HN 0.912 nan 8.250 nan 0.000 0.530 1678 T N -3.490 110.802 114.554 -0.436 0.000 2.812 1678 T HA 0.267 4.617 4.350 0.000 0.000 0.294 1678 T C 0.417 174.576 174.700 -0.902 0.000 1.159 1678 T CA -0.867 60.978 62.100 -0.425 0.000 1.008 1678 T CB 0.817 69.579 68.868 -0.176 0.000 1.289 1678 T HN -0.032 nan 8.240 nan 0.000 0.514 1679 F N 1.408 121.019 119.950 -0.565 0.000 2.146 1679 F HA 0.207 4.734 4.527 0.000 0.000 0.298 1679 F C 2.556 178.178 175.800 -0.297 0.000 1.096 1679 F CA 1.668 59.424 58.000 -0.406 0.000 1.275 1679 F CB -0.712 38.263 39.000 -0.042 0.000 1.008 1679 F HN 0.783 nan 8.300 nan 0.000 0.480 1680 A N 0.212 122.897 122.820 -0.224 0.000 1.883 1680 A HA -0.299 4.021 4.320 0.000 0.000 0.217 1680 A C 2.227 179.612 177.584 -0.332 0.000 1.186 1680 A CA 2.074 53.973 52.037 -0.230 0.000 0.624 1680 A CB -1.161 17.792 19.000 -0.079 0.000 0.822 1680 A HN 0.590 nan 8.150 nan 0.000 0.444 1681 E N -0.376 119.625 120.200 -0.331 0.000 2.110 1681 E HA -0.099 4.251 4.350 0.000 0.000 0.193 1681 E C 2.144 178.511 176.600 -0.388 0.000 0.988 1681 E CA 0.954 57.172 56.400 -0.303 0.000 0.804 1681 E CB -0.256 29.287 29.700 -0.263 0.000 0.745 1681 E HN 0.548 nan 8.360 nan 0.000 0.458 1682 A N 1.020 123.509 122.820 -0.551 0.000 1.902 1682 A HA -0.178 4.142 4.320 0.000 0.000 0.217 1682 A C 2.117 179.423 177.584 -0.462 0.000 1.181 1682 A CA 1.288 53.029 52.037 -0.494 0.000 0.623 1682 A CB -0.646 18.034 19.000 -0.532 0.000 0.818 1682 A HN 0.378 nan 8.150 nan 0.000 0.443 1683 L N -0.061 120.782 121.223 -0.632 0.000 2.056 1683 L HA -0.089 4.251 4.340 0.000 0.000 0.207 1683 L C 2.451 179.149 176.870 -0.287 0.000 1.078 1683 L CA 2.362 56.899 54.840 -0.505 0.000 0.749 1683 L CB -0.726 40.959 42.059 -0.622 0.000 0.901 1683 L HN 0.511 nan 8.230 nan 0.000 0.433 1684 R N -0.380 119.968 120.500 -0.254 0.000 2.073 1684 R HA -0.170 4.170 4.340 0.000 0.000 0.234 1684 R C 2.337 178.558 176.300 -0.131 0.000 1.134 1684 R CA 2.129 58.144 56.100 -0.142 0.000 0.952 1684 R CB -0.422 29.809 30.300 -0.115 0.000 0.850 1684 R HN 0.449 nan 8.270 nan 0.000 0.433 1685 I N 0.316 120.742 120.570 -0.240 0.000 2.163 1685 I HA -0.199 3.971 4.170 0.000 0.000 0.243 1685 I C 2.491 178.486 176.117 -0.203 0.000 1.085 1685 I CA 1.560 62.641 61.300 -0.365 0.000 1.347 1685 I CB -0.685 36.977 38.000 -0.564 0.000 1.044 1685 I HN 0.467 nan 8.210 nan 0.000 0.408 1686 G N 0.506 109.192 108.800 -0.190 0.000 2.440 1686 G HA2 -0.293 3.667 3.960 0.000 0.000 0.218 1686 G HA3 -0.293 3.667 3.960 0.000 0.000 0.218 1686 G C 1.791 176.657 174.900 -0.056 0.000 1.154 1686 G CA 1.166 46.192 45.100 -0.124 0.000 0.767 1686 G HN 0.522 nan 8.290 nan 0.000 0.552 1687 S N 0.526 116.189 115.700 -0.062 0.000 2.406 1687 S HA -0.021 4.449 4.470 0.000 0.000 0.228 1687 S C 1.949 176.595 174.600 0.075 0.000 1.020 1687 S CA 1.457 59.639 58.200 -0.030 0.000 0.965 1687 S CB -0.261 62.941 63.200 0.002 0.000 0.798 1687 S HN 0.589 nan 8.310 nan 0.000 0.488 1688 E N 1.069 121.349 120.200 0.133 0.000 2.051 1688 E HA -0.068 4.282 4.350 0.000 0.000 0.192 1688 E C 2.170 178.871 176.600 0.169 0.000 0.991 1688 E CA 1.294 57.818 56.400 0.207 0.000 0.799 1688 E CB -0.427 29.416 29.700 0.239 0.000 0.748 1688 E HN 0.386 nan 8.360 nan 0.000 0.449 1689 V N 0.986 120.989 119.914 0.149 0.000 2.295 1689 V HA -0.287 3.833 4.120 0.000 0.000 0.246 1689 V C 2.125 178.262 176.094 0.072 0.000 1.049 1689 V CA 1.966 64.336 62.300 0.115 0.000 1.024 1689 V CB -0.617 31.267 31.823 0.102 0.000 0.648 1689 V HN 0.306 nan 8.190 nan 0.000 0.447 1690 Y N 0.742 120.995 120.300 -0.078 0.000 2.128 1690 Y HA -0.297 4.253 4.550 0.000 0.000 0.284 1690 Y C 2.723 178.546 175.900 -0.128 0.000 1.154 1690 Y CA 2.170 60.185 58.100 -0.142 0.000 1.149 1690 Y CB -0.474 37.834 38.460 -0.254 0.000 0.976 1690 Y HN 0.373 nan 8.280 nan 0.000 0.505 1691 H N -0.293 118.764 119.070 -0.021 0.000 2.423 1691 H HA -0.124 4.432 4.556 0.000 0.000 0.297 1691 H C 2.022 177.284 175.328 -0.111 0.000 1.075 1691 H CA 1.381 57.368 56.048 -0.102 0.000 1.342 1691 H CB -0.344 29.429 29.762 0.020 0.000 1.395 1691 H HN 0.478 nan 8.280 nan 0.000 0.530 1692 N N 0.645 119.374 118.700 0.050 0.000 2.142 1692 N HA -0.112 4.628 4.740 0.000 0.000 0.186 1692 N C 2.130 177.619 175.510 -0.034 0.000 1.023 1692 N CA 0.444 53.503 53.050 0.014 0.000 0.852 1692 N CB -0.154 38.348 38.487 0.024 0.000 0.998 1692 N HN 0.185 nan 8.380 nan 0.000 0.424 1693 L N 2.202 123.379 121.223 -0.077 0.000 2.017 1693 L HA -0.127 4.213 4.340 0.000 0.000 0.208 1693 L C 2.271 179.060 176.870 -0.135 0.000 1.073 1693 L CA 1.823 56.604 54.840 -0.097 0.000 0.745 1693 L CB -0.611 41.379 42.059 -0.115 0.000 0.894 1693 L HN -0.008 nan 8.230 nan 0.000 0.432 1694 K N -0.805 119.444 120.400 -0.251 0.000 2.057 1694 K HA -0.164 4.156 4.320 0.000 0.000 0.207 1694 K C 2.227 178.776 176.600 -0.085 0.000 1.049 1694 K CA 1.547 57.702 56.287 -0.219 0.000 0.931 1694 K CB -0.193 32.105 32.500 -0.337 0.000 0.714 1694 K HN 0.623 nan 8.250 nan 0.000 0.440 1695 S N 0.634 116.301 115.700 -0.054 0.000 2.368 1695 S HA -0.123 4.347 4.470 0.000 0.000 0.224 1695 S C 2.042 176.636 174.600 -0.010 0.000 1.029 1695 S CA 0.937 59.125 58.200 -0.021 0.000 0.988 1695 S CB -0.569 62.623 63.200 -0.012 0.000 0.838 1695 S HN 0.312 nan 8.310 nan 0.000 0.462 1696 L N 1.189 122.405 121.223 -0.010 0.000 2.083 1696 L HA -0.085 4.256 4.340 0.000 0.000 0.209 1696 L C 2.994 179.893 176.870 0.047 0.000 1.083 1696 L CA 1.628 56.472 54.840 0.006 0.000 0.752 1696 L CB -1.141 40.923 42.059 0.007 0.000 0.899 1696 L HN 0.389 nan 8.230 nan 0.000 0.433 1697 T N -0.662 113.931 114.554 0.066 0.000 2.777 1697 T HA -0.178 4.173 4.350 0.000 0.000 0.266 1697 T C 1.915 176.719 174.700 0.174 0.000 1.040 1697 T CA 1.165 63.374 62.100 0.182 0.000 1.141 1697 T CB -0.052 68.849 68.868 0.056 0.000 0.868 1697 T HN 0.248 nan 8.240 nan 0.000 0.444 1698 K N 0.885 121.326 120.400 0.068 0.000 2.097 1698 K HA -0.070 4.250 4.320 0.000 0.000 0.206 1698 K C 2.387 179.007 176.600 0.034 0.000 1.049 1698 K CA 1.060 57.377 56.287 0.051 0.000 0.933 1698 K CB -0.066 32.445 32.500 0.019 0.000 0.717 1698 K HN 0.225 nan 8.250 nan 0.000 0.442 1699 K N 1.033 121.440 120.400 0.012 0.000 2.062 1699 K HA -0.106 4.214 4.320 0.000 0.000 0.205 1699 K C 1.956 178.518 176.600 -0.065 0.000 1.051 1699 K CA 1.139 57.414 56.287 -0.021 0.000 0.941 1699 K CB 0.172 32.656 32.500 -0.027 0.000 0.719 1699 K HN 0.043 nan 8.250 nan 0.000 0.440 1700 R N -1.237 119.201 120.500 -0.104 0.000 2.127 1700 R HA -0.032 4.308 4.340 0.000 0.000 0.217 1700 R C 1.584 177.595 176.300 -0.480 0.000 1.074 1700 R CA 1.095 57.004 56.100 -0.317 0.000 0.991 1700 R CB 0.044 30.071 30.300 -0.455 0.000 0.895 1700 R HN 0.263 nan 8.270 nan 0.000 0.450 1701 Y N -0.704 119.579 120.300 -0.028 0.000 2.535 1701 Y HA 0.364 4.914 4.550 0.000 0.000 0.266 1701 Y C 0.977 176.865 175.900 -0.020 0.000 1.088 1701 Y CA 0.362 58.447 58.100 -0.025 0.000 1.285 1701 Y CB 1.203 39.645 38.460 -0.030 0.000 1.166 1701 Y HN 0.152 nan 8.280 nan 0.000 0.525 1702 G N -0.540 108.327 108.800 0.111 0.000 2.375 1702 G HA2 0.210 4.170 3.960 0.000 0.000 0.663 1702 G HA3 0.210 4.170 3.960 0.000 0.000 0.663 1702 G C 0.470 175.403 174.900 0.056 0.000 1.391 1702 G CA -0.523 44.614 45.100 0.062 0.000 0.949 1702 G HN 0.306 nan 8.290 nan 0.000 0.646 1703 A N 0.519 123.359 122.820 0.033 0.000 1.927 1703 A HA 0.000 4.320 4.320 0.000 0.000 0.220 1703 A C 2.871 180.472 177.584 0.028 0.000 1.185 1703 A CA 3.608 55.660 52.037 0.026 0.000 0.639 1703 A CB -0.938 18.073 19.000 0.018 0.000 0.820 1703 A HN 2.370 nan 8.150 nan 0.000 0.451 1704 S N -0.015 115.702 115.700 0.030 0.000 2.419 1704 S HA 0.052 4.522 4.470 0.000 0.000 0.235 1704 S C 1.854 176.468 174.600 0.023 0.000 1.019 1704 S CA 1.203 59.419 58.200 0.026 0.000 0.982 1704 S CB -0.632 62.583 63.200 0.025 0.000 0.789 1704 S HN 1.037 nan 8.310 nan 0.000 0.490 1705 A N 1.148 123.987 122.820 0.032 0.000 2.239 1705 A HA 0.406 4.726 4.320 0.000 0.000 0.209 1705 A C 2.081 179.665 177.584 0.000 0.000 1.171 1705 A CA 0.847 52.891 52.037 0.012 0.000 0.768 1705 A CB -1.158 17.873 19.000 0.052 0.000 0.790 1705 A HN 0.634 nan 8.150 nan 0.000 0.478 1706 G N -0.044 108.763 108.800 0.013 0.000 2.551 1706 G HA2 -0.051 3.909 3.960 0.000 0.000 0.216 1706 G HA3 -0.051 3.909 3.960 0.000 0.000 0.216 1706 G C 0.590 175.502 174.900 0.020 0.000 1.137 1706 G CA -0.140 44.964 45.100 0.007 0.000 0.798 1706 G HN 0.663 nan 8.290 nan 0.000 0.536 1707 N N 0.102 118.817 118.700 0.025 0.000 2.395 1707 N HA 0.308 5.048 4.740 0.000 0.000 0.246 1707 N C 0.042 175.579 175.510 0.044 0.000 1.246 1707 N CA -0.138 52.934 53.050 0.037 0.000 0.879 1707 N CB 1.503 40.009 38.487 0.032 0.000 1.098 1707 N HN 0.154 nan 8.380 nan 0.000 0.444 1708 V N -0.766 119.185 119.914 0.062 0.000 2.834 1708 V HA 0.768 4.888 4.120 0.000 0.000 0.313 1708 V C 0.862 176.988 176.094 0.053 0.000 1.060 1708 V CA -0.777 61.566 62.300 0.073 0.000 0.989 1708 V CB 1.189 33.074 31.823 0.104 0.000 1.041 1708 V HN 0.641 nan 8.190 nan 0.000 0.459 1709 G N 0.921 109.747 108.800 0.043 0.000 2.525 1709 G HA2 0.294 4.254 3.960 0.000 0.000 0.287 1709 G HA3 0.294 4.254 3.960 0.000 0.000 0.287 1709 G C 0.233 175.133 174.900 0.000 0.000 1.350 1709 G CA 0.017 45.133 45.100 0.027 0.000 1.039 1709 G HN 0.785 nan 8.290 nan 0.000 0.513 1710 D N -0.231 120.154 120.400 -0.025 0.000 2.190 1710 D HA -0.104 4.536 4.640 0.000 0.000 0.200 1710 D C 1.853 178.119 176.300 -0.057 0.000 0.992 1710 D CA 1.266 55.246 54.000 -0.032 0.000 0.854 1710 D CB 0.186 40.971 40.800 -0.025 0.000 0.936 1710 D HN 0.640 nan 8.370 nan 0.000 0.462 1711 E N -0.912 119.233 120.200 -0.093 0.000 2.463 1711 E HA 0.288 4.638 4.350 0.000 0.000 0.193 1711 E C 1.161 177.760 176.600 -0.003 0.000 1.041 1711 E CA 0.277 56.657 56.400 -0.034 0.000 0.879 1711 E CB 0.774 30.462 29.700 -0.019 0.000 0.997 1711 E HN 0.269 nan 8.360 nan 0.000 0.478 1712 G N 1.232 110.033 108.800 0.000 0.000 2.194 1712 G HA2 -0.243 3.717 3.960 0.000 0.000 0.236 1712 G HA3 -0.243 3.717 3.960 0.000 0.000 0.236 1712 G C 0.570 175.523 174.900 0.088 0.000 0.987 1712 G CA -0.255 44.852 45.100 0.012 0.000 0.635 1712 G HN 0.478 nan 8.290 nan 0.000 0.520 1713 G N -0.457 108.399 108.800 0.094 0.000 2.537 1713 G HA2 0.692 4.652 3.960 0.000 0.000 0.273 1713 G HA3 0.692 4.652 3.960 0.000 0.000 0.273 1713 G C 0.573 175.558 174.900 0.142 0.000 1.189 1713 G CA 0.320 45.532 45.100 0.186 0.000 0.881 1713 G HN 1.532 nan 8.290 nan 0.000 0.535 1714 V N -1.839 118.140 119.914 0.109 0.000 2.834 1714 V HA 0.731 4.851 4.120 0.000 0.000 0.301 1714 V C 0.546 176.631 176.094 -0.015 0.000 1.066 1714 V CA -0.294 62.017 62.300 0.018 0.000 1.052 1714 V CB 1.377 33.169 31.823 -0.052 0.000 1.021 1714 V HN 1.338 nan 8.190 nan 0.000 0.480 1715 A N 3.981 126.778 122.820 -0.039 0.000 3.317 1715 A HA 0.646 4.966 4.320 0.000 0.000 0.307 1715 A C -1.907 175.606 177.584 -0.119 0.000 1.003 1715 A CA -1.130 50.874 52.037 -0.054 0.000 0.882 1715 A CB -0.230 18.776 19.000 0.011 0.000 1.136 1715 A HN 0.844 nan 8.150 nan 0.000 0.488 1716 P HA 0.143 nan 4.420 nan 0.000 0.274 1716 P C -0.717 176.382 177.300 -0.336 0.000 1.237 1716 P CA -0.416 62.452 63.100 -0.386 0.000 0.793 1716 P CB 0.704 31.876 31.700 -0.880 0.000 0.977 1717 N N 1.758 120.319 118.700 -0.231 0.000 2.498 1717 N HA 0.149 4.889 4.740 0.000 0.000 0.277 1717 N C 0.190 175.625 175.510 -0.125 0.000 1.208 1717 N CA 0.296 53.275 53.050 -0.118 0.000 1.029 1717 N CB -0.475 37.999 38.487 -0.022 0.000 1.403 1717 N HN 0.389 nan 8.380 nan 0.000 0.500 1718 I N 1.215 121.682 120.570 -0.172 0.000 2.499 1718 I HA 0.018 4.188 4.170 0.000 0.000 0.296 1718 I C 1.557 177.636 176.117 -0.062 0.000 0.992 1718 I CA -0.377 60.847 61.300 -0.127 0.000 1.297 1718 I CB 1.790 39.662 38.000 -0.213 0.000 1.410 1718 I HN 0.251 nan 8.210 nan 0.000 0.507 1719 Q N 3.129 122.915 119.800 -0.024 0.000 2.226 1719 Q HA 0.037 4.377 4.340 0.000 0.000 0.199 1719 Q C 0.350 176.336 176.000 -0.024 0.000 0.945 1719 Q CA 0.924 56.715 55.803 -0.019 0.000 0.861 1719 Q CB 0.439 29.180 28.738 0.004 0.000 0.953 1719 Q HN 0.838 nan 8.270 nan 0.000 0.490 1720 T N -4.458 110.080 114.554 -0.026 0.000 2.883 1720 T HA 0.741 5.091 4.350 0.000 0.000 0.296 1720 T C 0.617 175.297 174.700 -0.034 0.000 1.117 1720 T CA -0.416 61.675 62.100 -0.015 0.000 1.006 1720 T CB 1.124 69.996 68.868 0.007 0.000 1.191 1720 T HN 0.008 nan 8.240 nan 0.000 0.508 1721 A N 0.360 123.195 122.820 0.026 0.000 1.969 1721 A HA 0.026 4.346 4.320 0.000 0.000 0.218 1721 A C 1.927 179.493 177.584 -0.030 0.000 1.169 1721 A CA 1.568 53.650 52.037 0.076 0.000 0.635 1721 A CB -0.994 18.137 19.000 0.219 0.000 0.810 1721 A HN 0.892 nan 8.150 nan 0.000 0.445 1722 E N -0.158 120.049 120.200 0.012 0.000 2.106 1722 E HA -0.146 4.204 4.350 0.000 0.000 0.192 1722 E C 1.891 178.476 176.600 -0.026 0.000 0.984 1722 E CA 1.233 57.656 56.400 0.039 0.000 0.806 1722 E CB -0.201 29.587 29.700 0.146 0.000 0.750 1722 E HN 0.810 nan 8.360 nan 0.000 0.458 1723 E N 0.297 120.473 120.200 -0.041 0.000 2.047 1723 E HA -0.184 4.166 4.350 0.000 0.000 0.191 1723 E C 1.978 178.500 176.600 -0.131 0.000 0.987 1723 E CA 0.990 57.367 56.400 -0.040 0.000 0.799 1723 E CB -0.085 29.607 29.700 -0.014 0.000 0.752 1723 E HN 0.246 nan 8.360 nan 0.000 0.449 1724 A N 1.152 123.798 122.820 -0.290 0.000 1.877 1724 A HA -0.173 4.147 4.320 0.000 0.000 0.216 1724 A C 2.221 179.555 177.584 -0.417 0.000 1.186 1724 A CA 1.330 53.059 52.037 -0.513 0.000 0.620 1724 A CB -0.773 17.530 19.000 -1.162 0.000 0.822 1724 A HN 0.305 nan 8.150 nan 0.000 0.443 1725 L N -0.545 120.427 121.223 -0.418 0.000 2.083 1725 L HA -0.188 4.152 4.340 0.000 0.000 0.209 1725 L C 2.098 178.808 176.870 -0.268 0.000 1.083 1725 L CA 1.374 55.932 54.840 -0.470 0.000 0.752 1725 L CB -0.649 40.729 42.059 -1.135 0.000 0.899 1725 L HN 0.318 nan 8.230 nan 0.000 0.433 1726 D N 0.010 120.345 120.400 -0.107 0.000 2.144 1726 D HA -0.175 4.465 4.640 0.000 0.000 0.199 1726 D C 2.093 178.414 176.300 0.035 0.000 0.984 1726 D CA 1.055 55.108 54.000 0.088 0.000 0.834 1726 D CB -0.086 40.781 40.800 0.111 0.000 0.955 1726 D HN 0.144 nan 8.370 nan 0.000 0.465 1727 L N 0.961 122.175 121.223 -0.016 0.000 2.046 1727 L HA -0.146 4.194 4.340 0.000 0.000 0.208 1727 L C 2.015 178.879 176.870 -0.009 0.000 1.077 1727 L CA 1.331 56.170 54.840 -0.002 0.000 0.747 1727 L CB -0.458 41.595 42.059 -0.010 0.000 0.896 1727 L HN -0.049 nan 8.230 nan 0.000 0.432 1728 I N -1.091 119.458 120.570 -0.035 0.000 2.179 1728 I HA -0.228 3.942 4.170 0.000 0.000 0.242 1728 I C 2.561 178.697 176.117 0.032 0.000 1.088 1728 I CA 1.234 62.532 61.300 -0.005 0.000 1.357 1728 I CB -1.231 36.767 38.000 -0.002 0.000 1.051 1728 I HN 0.111 nan 8.210 nan 0.000 0.409 1729 V N 1.244 121.192 119.914 0.056 0.000 2.332 1729 V HA -0.282 3.838 4.120 0.000 0.000 0.248 1729 V C 2.221 178.352 176.094 0.062 0.000 1.055 1729 V CA 1.925 64.278 62.300 0.089 0.000 1.038 1729 V CB -0.718 31.198 31.823 0.154 0.000 0.651 1729 V HN 0.349 nan 8.190 nan 0.000 0.450 1730 D N 0.375 120.804 120.400 0.049 0.000 2.144 1730 D HA -0.133 4.507 4.640 0.000 0.000 0.199 1730 D C 2.227 178.540 176.300 0.022 0.000 0.984 1730 D CA 1.665 55.684 54.000 0.032 0.000 0.834 1730 D CB -0.274 40.540 40.800 0.025 0.000 0.955 1730 D HN 0.466 nan 8.370 nan 0.000 0.465 1731 A N 0.756 123.589 122.820 0.022 0.000 1.898 1731 A HA -0.118 4.202 4.320 0.000 0.000 0.216 1731 A C 2.392 179.995 177.584 0.032 0.000 1.181 1731 A CA 0.786 52.834 52.037 0.018 0.000 0.620 1731 A CB -0.654 18.353 19.000 0.011 0.000 0.819 1731 A HN 0.172 nan 8.150 nan 0.000 0.442 1732 I N -0.889 119.709 120.570 0.046 0.000 2.179 1732 I HA -0.265 3.905 4.170 0.000 0.000 0.242 1732 I C 2.520 178.660 176.117 0.038 0.000 1.088 1732 I CA 1.679 63.019 61.300 0.067 0.000 1.357 1732 I CB -0.231 37.813 38.000 0.073 0.000 1.051 1732 I HN 0.166 nan 8.210 nan 0.000 0.409 1733 K N 1.077 121.492 120.400 0.025 0.000 2.002 1733 K HA -0.117 4.203 4.320 0.000 0.000 0.209 1733 K C 2.164 178.748 176.600 -0.027 0.000 1.048 1733 K CA 1.696 57.985 56.287 0.003 0.000 0.930 1733 K CB -0.615 31.893 32.500 0.013 0.000 0.714 1733 K HN 0.316 nan 8.250 nan 0.000 0.438 1734 A N 0.509 123.318 122.820 -0.019 0.000 1.940 1734 A HA -0.114 4.206 4.320 0.000 0.000 0.219 1734 A C 2.219 179.766 177.584 -0.062 0.000 1.176 1734 A CA 2.008 54.027 52.037 -0.031 0.000 0.631 1734 A CB -0.816 18.175 19.000 -0.015 0.000 0.814 1734 A HN 0.323 nan 8.150 nan 0.000 0.446 1735 A N -1.858 120.920 122.820 -0.071 0.000 2.167 1735 A HA 0.382 4.702 4.320 0.000 0.000 0.214 1735 A C 1.840 179.171 177.584 -0.422 0.000 1.151 1735 A CA 1.300 53.250 52.037 -0.144 0.000 0.735 1735 A CB -0.938 18.065 19.000 0.005 0.000 0.802 1735 A HN 1.952 nan 8.150 nan 0.000 0.467 1736 G N -1.445 107.173 108.800 -0.303 0.000 2.137 1736 G HA2 -0.224 3.736 3.960 0.000 0.000 0.237 1736 G HA3 -0.224 3.736 3.960 0.000 0.000 0.237 1736 G C 0.221 174.908 174.900 -0.355 0.000 1.002 1736 G CA 0.417 45.331 45.100 -0.309 0.000 0.702 1736 G HN 0.662 nan 8.290 nan 0.000 0.515 1737 H N -0.080 118.993 119.070 0.006 0.000 2.486 1737 H HA 0.235 4.791 4.556 0.000 0.000 0.284 1737 H C 0.671 176.005 175.328 0.009 0.000 1.103 1737 H CA -0.185 55.865 56.048 0.004 0.000 1.089 1737 H CB 0.385 30.144 29.762 -0.004 0.000 1.603 1737 H HN 0.518 nan 8.280 nan 0.000 0.557 1738 D N 0.216 120.667 120.400 0.085 0.000 2.493 1738 D HA 0.155 4.795 4.640 0.000 0.000 0.240 1738 D C 1.546 177.887 176.300 0.068 0.000 1.142 1738 D CA 1.823 55.864 54.000 0.067 0.000 0.872 1738 D CB 0.431 41.256 40.800 0.041 0.000 1.173 1738 D HN 0.551 nan 8.370 nan 0.000 0.467 1739 G N 3.835 112.674 108.800 0.065 0.000 2.241 1739 G HA2 -0.310 3.650 3.960 0.000 0.000 0.244 1739 G HA3 -0.310 3.650 3.960 0.000 0.000 0.244 1739 G C 1.081 176.017 174.900 0.061 0.000 0.998 1739 G CA 0.495 45.630 45.100 0.059 0.000 0.621 1739 G HN 0.567 nan 8.290 nan 0.000 0.519 1740 K N -0.409 120.031 120.400 0.067 0.000 2.360 1740 K HA 0.465 4.785 4.320 0.000 0.000 0.196 1740 K C 0.161 176.769 176.600 0.014 0.000 1.049 1740 K CA 0.452 56.767 56.287 0.048 0.000 1.049 1740 K CB 1.619 34.147 32.500 0.046 0.000 0.881 1740 K HN 0.256 nan 8.250 nan 0.000 0.542 1741 V N 2.712 122.637 119.914 0.020 0.000 2.487 1741 V HA 0.255 4.375 4.120 0.000 0.000 0.298 1741 V C -0.274 175.810 176.094 -0.017 0.000 1.028 1741 V CA -0.985 61.301 62.300 -0.023 0.000 0.860 1741 V CB 1.657 33.474 31.823 -0.009 0.000 0.991 1741 V HN 0.010 nan 8.190 nan 0.000 0.427 1742 K N 3.805 124.161 120.400 -0.072 0.000 2.267 1742 K HA 0.721 5.041 4.320 0.000 0.000 0.236 1742 K C -0.706 175.850 176.600 -0.073 0.000 1.030 1742 K CA -0.759 55.499 56.287 -0.047 0.000 0.930 1742 K CB 2.189 34.659 32.500 -0.049 0.000 1.182 1742 K HN 0.469 nan 8.250 nan 0.000 0.474 1743 I N -0.089 120.478 120.570 -0.005 0.000 2.569 1743 I HA 0.444 4.614 4.170 0.000 0.000 0.296 1743 I C 0.214 176.372 176.117 0.067 0.000 1.028 1743 I CA -0.802 60.512 61.300 0.023 0.000 1.082 1743 I CB 2.307 40.352 38.000 0.075 0.000 1.264 1743 I HN 0.572 nan 8.210 nan 0.000 0.429 1744 G N 5.665 114.523 108.800 0.096 0.000 2.519 1744 G HA2 0.827 4.787 3.960 0.000 0.000 0.307 1744 G HA3 0.827 4.787 3.960 0.000 0.000 0.307 1744 G C -1.363 173.541 174.900 0.007 0.000 1.266 1744 G CA -0.514 44.683 45.100 0.162 0.000 0.970 1744 G HN 0.414 nan 8.290 nan 0.000 0.481 1745 L N 0.675 121.841 121.223 -0.095 0.000 2.388 1745 L HA 0.535 4.875 4.340 0.000 0.000 0.264 1745 L C -1.458 175.276 176.870 -0.227 0.000 0.998 1745 L CA -1.013 53.673 54.840 -0.257 0.000 0.817 1745 L CB 2.836 44.675 42.059 -0.366 0.000 1.338 1745 L HN 0.452 nan 8.230 nan 0.000 0.414 1746 D N 0.357 120.615 120.400 -0.236 0.000 2.440 1746 D HA 0.286 4.926 4.640 0.000 0.000 0.252 1746 D C 0.309 176.505 176.300 -0.173 0.000 1.180 1746 D CA -0.444 53.459 54.000 -0.161 0.000 0.894 1746 D CB 1.519 42.277 40.800 -0.070 0.000 1.111 1746 D HN 0.509 nan 8.370 nan 0.000 0.544 1747 C N 2.867 122.043 119.300 -0.207 0.000 2.450 1747 C HA 0.313 4.773 4.460 0.000 0.000 0.279 1747 C C 1.718 176.666 174.990 -0.069 0.000 1.335 1747 C CA 0.493 59.439 59.018 -0.119 0.000 1.749 1747 C CB -1.247 26.388 27.740 -0.176 0.000 1.963 1747 C HN 0.901 nan 8.230 nan 0.000 0.501 1748 A N 1.372 124.102 122.820 -0.150 0.000 2.704 1748 A HA -0.234 4.086 4.320 0.000 0.000 0.299 1748 A C 1.627 178.966 177.584 -0.409 0.000 1.507 1748 A CA 0.947 52.879 52.037 -0.175 0.000 0.776 1748 A CB -1.929 17.027 19.000 -0.073 0.000 1.027 1748 A HN 1.081 nan 8.150 nan 0.000 0.475 1749 S N -0.911 114.442 115.700 -0.579 0.000 2.440 1749 S HA -0.167 4.303 4.470 0.000 0.000 0.240 1749 S C 1.740 175.800 174.600 -0.901 0.000 1.014 1749 S CA 1.639 59.117 58.200 -1.204 0.000 0.980 1749 S CB -0.547 62.255 63.200 -0.663 0.000 0.775 1749 S HN 1.083 nan 8.310 nan 0.000 0.499 1750 S N 1.697 117.127 115.700 -0.448 0.000 2.400 1750 S HA -0.083 4.387 4.470 0.000 0.000 0.232 1750 S C 1.845 176.247 174.600 -0.331 0.000 1.025 1750 S CA 1.145 59.184 58.200 -0.267 0.000 0.993 1750 S CB -0.381 62.723 63.200 -0.159 0.000 0.808 1750 S HN 0.533 nan 8.310 nan 0.000 0.478 1751 E N 0.823 120.734 120.200 -0.481 0.000 2.204 1751 E HA -0.101 4.249 4.350 0.000 0.000 0.195 1751 E C 0.889 177.094 176.600 -0.658 0.000 0.990 1751 E CA 0.801 56.901 56.400 -0.499 0.000 0.821 1751 E CB -0.138 29.274 29.700 -0.480 0.000 0.750 1751 E HN 0.836 nan 8.360 nan 0.000 0.477 1752 F N -2.265 117.362 119.950 -0.539 0.000 2.814 1752 F HA 0.334 4.861 4.527 0.000 0.000 0.326 1752 F C -0.124 175.508 175.800 -0.280 0.000 1.159 1752 F CA -1.348 56.342 58.000 -0.518 0.000 1.234 1752 F CB -0.494 38.183 39.000 -0.538 0.000 1.016 1752 F HN -0.282 nan 8.300 nan 0.000 0.510 1753 F N 3.974 123.666 119.950 -0.431 0.000 2.375 1753 F HA 0.601 5.128 4.527 0.000 0.000 0.362 1753 F C -0.423 175.119 175.800 -0.430 0.000 1.129 1753 F CA -0.999 56.648 58.000 -0.588 0.000 1.154 1753 F CB 0.365 39.015 39.000 -0.583 0.000 1.205 1753 F HN 0.009 nan 8.300 nan 0.000 0.513 1754 K N 4.840 124.732 120.400 -0.847 0.000 2.427 1754 K HA 0.286 4.606 4.320 0.000 0.000 0.252 1754 K C -0.960 175.312 176.600 -0.547 0.000 0.931 1754 K CA -0.977 54.896 56.287 -0.689 0.000 0.793 1754 K CB 1.776 33.912 32.500 -0.606 0.000 1.211 1754 K HN 0.411 nan 8.250 nan 0.000 0.426 1755 D N 1.477 121.655 120.400 -0.370 0.000 2.701 1755 D HA -0.188 4.452 4.640 0.000 0.000 0.235 1755 D C 0.841 177.015 176.300 -0.209 0.000 1.155 1755 D CA 1.945 55.849 54.000 -0.161 0.000 0.649 1755 D CB -1.227 39.642 40.800 0.115 0.000 1.050 1755 D HN 1.071 nan 8.370 nan 0.000 0.425 1756 G N -1.070 107.422 108.800 -0.513 0.000 2.175 1756 G HA2 -0.393 3.567 3.960 0.000 0.000 0.265 1756 G HA3 -0.393 3.567 3.960 0.000 0.000 0.265 1756 G C 0.442 175.319 174.900 -0.039 0.000 0.979 1756 G CA 1.128 46.092 45.100 -0.226 0.000 0.663 1756 G HN 0.572 nan 8.290 nan 0.000 0.533 1757 K N -1.516 118.757 120.400 -0.212 0.000 2.378 1757 K HA 0.676 4.996 4.320 0.000 0.000 0.244 1757 K C -1.242 175.240 176.600 -0.196 0.000 1.039 1757 K CA -1.009 55.300 56.287 0.037 0.000 0.863 1757 K CB 1.397 34.056 32.500 0.265 0.000 1.326 1757 K HN 0.045 nan 8.250 nan 0.000 0.460 1758 Y N 0.438 120.830 120.300 0.154 0.000 2.328 1758 Y HA 0.168 4.718 4.550 0.000 0.000 0.336 1758 Y C -0.558 175.293 175.900 -0.082 0.000 0.960 1758 Y CA -0.924 57.273 58.100 0.162 0.000 1.134 1758 Y CB 1.433 40.099 38.460 0.343 0.000 1.166 1758 Y HN 0.462 nan 8.280 nan 0.000 0.464 1759 D N 3.764 124.042 120.400 -0.203 0.000 2.428 1759 D HA 0.214 4.854 4.640 0.000 0.000 0.221 1759 D C 0.292 176.471 176.300 -0.202 0.000 1.123 1759 D CA -0.065 53.680 54.000 -0.426 0.000 0.869 1759 D CB 0.840 41.088 40.800 -0.919 0.000 1.032 1759 D HN 0.636 nan 8.370 nan 0.000 0.506 1760 L N 2.428 123.531 121.223 -0.200 0.000 2.622 1760 L HA 0.067 4.407 4.340 0.000 0.000 0.233 1760 L C 0.825 177.623 176.870 -0.119 0.000 1.156 1760 L CA 0.529 55.186 54.840 -0.306 0.000 0.866 1760 L CB 0.027 41.957 42.059 -0.216 0.000 0.980 1760 L HN 0.339 nan 8.230 nan 0.000 0.448 1761 D N -0.987 119.404 120.400 -0.015 0.000 2.720 1761 D HA 0.006 4.646 4.640 0.000 0.000 0.285 1761 D C 1.400 177.695 176.300 -0.008 0.000 1.359 1761 D CA -0.454 53.533 54.000 -0.022 0.000 0.818 1761 D CB 0.131 40.952 40.800 0.035 0.000 1.108 1761 D HN 0.225 nan 8.370 nan 0.000 0.474 1762 F N 0.165 120.077 119.950 -0.063 0.000 2.373 1762 F HA 0.044 4.571 4.527 0.000 0.000 0.300 1762 F C 1.382 177.191 175.800 0.016 0.000 1.080 1762 F CA 0.750 58.737 58.000 -0.020 0.000 1.417 1762 F CB -0.192 38.813 39.000 0.008 0.000 1.070 1762 F HN -0.116 nan 8.300 nan 0.000 0.546 1763 K N 0.399 120.370 120.400 -0.715 0.000 2.459 1763 K HA -0.044 4.276 4.320 0.000 0.000 0.193 1763 K C 0.103 176.581 176.600 -0.202 0.000 1.030 1763 K CA 0.170 56.135 56.287 -0.536 0.000 1.026 1763 K CB -0.330 31.810 32.500 -0.601 0.000 0.809 1763 K HN 0.223 nan 8.250 nan 0.000 0.504 1764 N N 1.460 120.092 118.700 -0.112 0.000 2.426 1764 N HA 0.064 4.804 4.740 0.000 0.000 0.257 1764 N C -1.720 173.806 175.510 0.027 0.000 1.002 1764 N CA -2.174 50.858 53.050 -0.030 0.000 0.942 1764 N CB 1.288 39.771 38.487 -0.006 0.000 1.112 1764 N HN -0.191 nan 8.380 nan 0.000 0.499 1765 P HA -0.160 nan 4.420 nan 0.000 0.216 1765 P C -0.339 177.001 177.300 0.066 0.000 1.150 1765 P CA 1.305 64.433 63.100 0.047 0.000 0.843 1765 P CB 0.079 31.796 31.700 0.028 0.000 0.787 1766 N N -0.643 118.089 118.700 0.053 0.000 2.546 1766 N HA 0.052 4.792 4.740 0.000 0.000 0.286 1766 N C -0.164 175.388 175.510 0.070 0.000 1.259 1766 N CA -0.234 52.847 53.050 0.052 0.000 0.939 1766 N CB -0.046 38.456 38.487 0.026 0.000 1.243 1766 N HN -0.113 nan 8.380 nan 0.000 0.511 1767 S N 0.924 116.702 115.700 0.131 0.000 2.546 1767 S HA -0.112 4.358 4.470 0.000 0.000 0.290 1767 S C -0.105 174.587 174.600 0.153 0.000 1.290 1767 S CA -0.186 58.133 58.200 0.198 0.000 1.069 1767 S CB 0.194 63.610 63.200 0.360 0.000 0.846 1767 S HN 0.414 nan 8.310 nan 0.000 0.495 1768 D N 3.742 124.196 120.400 0.090 0.000 2.359 1768 D HA 0.152 4.792 4.640 0.000 0.000 0.250 1768 D C 1.027 177.186 176.300 -0.235 0.000 1.264 1768 D CA 0.093 54.064 54.000 -0.049 0.000 0.911 1768 D CB 0.542 41.329 40.800 -0.021 0.000 1.056 1768 D HN 0.569 nan 8.370 nan 0.000 0.499 1769 K N 1.424 121.448 120.400 -0.627 0.000 2.281 1769 K HA -0.151 4.169 4.320 0.000 0.000 0.203 1769 K C 1.857 177.983 176.600 -0.790 0.000 1.046 1769 K CA 1.207 56.577 56.287 -1.528 0.000 0.938 1769 K CB -0.055 31.602 32.500 -1.405 0.000 0.737 1769 K HN 0.463 nan 8.250 nan 0.000 0.458 1770 S N 0.956 116.437 115.700 -0.366 0.000 2.515 1770 S HA -0.058 4.412 4.470 0.000 0.000 0.231 1770 S C 1.478 176.047 174.600 -0.051 0.000 0.987 1770 S CA 0.745 58.844 58.200 -0.169 0.000 0.936 1770 S CB 0.022 63.156 63.200 -0.110 0.000 0.766 1770 S HN 0.231 nan 8.310 nan 0.000 0.528 1771 K N -0.312 120.084 120.400 -0.007 0.000 2.374 1771 K HA 0.144 4.464 4.320 0.000 0.000 0.196 1771 K C -0.568 176.200 176.600 0.280 0.000 1.023 1771 K CA -0.431 55.926 56.287 0.117 0.000 1.103 1771 K CB 0.147 32.715 32.500 0.113 0.000 0.848 1771 K HN 0.357 nan 8.250 nan 0.000 0.528 1772 W N 2.117 123.440 121.300 0.037 0.000 2.170 1772 W HA 0.125 4.785 4.660 0.000 0.000 0.342 1772 W C 0.418 176.986 176.519 0.082 0.000 1.294 1772 W CA -0.699 56.686 57.345 0.066 0.000 1.246 1772 W CB -0.109 29.386 29.460 0.058 0.000 1.156 1772 W HN -0.083 nan 8.180 nan 0.000 0.572 1773 L N 2.785 124.204 121.223 0.327 0.000 2.334 1773 L HA 0.468 4.808 4.340 0.000 0.000 0.275 1773 L C 1.090 178.149 176.870 0.314 0.000 1.036 1773 L CA -0.869 54.118 54.840 0.245 0.000 0.807 1773 L CB 1.130 43.276 42.059 0.144 0.000 1.231 1773 L HN 0.433 nan 8.230 nan 0.000 0.438 1774 T N -1.623 113.070 114.554 0.231 0.000 2.814 1774 T HA 0.276 4.626 4.350 0.000 0.000 0.284 1774 T C 1.272 176.115 174.700 0.240 0.000 0.998 1774 T CA -0.053 62.190 62.100 0.239 0.000 0.935 1774 T CB 1.225 70.174 68.868 0.135 0.000 1.167 1774 T HN 0.659 nan 8.240 nan 0.000 0.545 1775 G N 0.873 109.784 108.800 0.186 0.000 2.480 1775 G HA2 -0.082 3.878 3.960 0.000 0.000 0.216 1775 G HA3 -0.082 3.878 3.960 0.000 0.000 0.216 1775 G C -0.863 174.004 174.900 -0.054 0.000 1.200 1775 G CA 0.767 45.892 45.100 0.042 0.000 0.782 1775 G HN 0.636 nan 8.290 nan 0.000 0.554 1776 P HA -0.085 nan 4.420 nan 0.000 0.216 1776 P C 1.965 179.298 177.300 0.056 0.000 1.150 1776 P CA 1.358 64.417 63.100 -0.069 0.000 0.837 1776 P CB -0.057 31.563 31.700 -0.133 0.000 0.786 1777 Q N -1.188 118.635 119.800 0.038 0.000 2.079 1777 Q HA -0.148 4.192 4.340 0.000 0.000 0.200 1777 Q C 2.073 178.044 176.000 -0.049 0.000 0.974 1777 Q CA 0.994 56.815 55.803 0.029 0.000 0.840 1777 Q CB -0.836 27.932 28.738 0.049 0.000 0.898 1777 Q HN 0.179 nan 8.270 nan 0.000 0.430 1778 L N 0.787 121.953 121.223 -0.095 0.000 2.093 1778 L HA -0.064 4.276 4.340 0.000 0.000 0.208 1778 L C 2.156 178.685 176.870 -0.570 0.000 1.085 1778 L CA 1.949 56.563 54.840 -0.377 0.000 0.755 1778 L CB -0.829 40.982 42.059 -0.414 0.000 0.904 1778 L HN 0.118 nan 8.230 nan 0.000 0.435 1779 A N -0.961 121.771 122.820 -0.147 0.000 1.933 1779 A HA -0.217 4.103 4.320 0.000 0.000 0.218 1779 A C 2.034 179.618 177.584 -0.001 0.000 1.175 1779 A CA 1.851 53.841 52.037 -0.079 0.000 0.628 1779 A CB -0.758 18.432 19.000 0.316 0.000 0.814 1779 A HN 0.526 nan 8.150 nan 0.000 0.444 1780 D N -0.549 119.910 120.400 0.097 0.000 2.144 1780 D HA -0.112 4.528 4.640 0.000 0.000 0.200 1780 D C 1.853 178.206 176.300 0.088 0.000 0.978 1780 D CA 1.224 55.338 54.000 0.190 0.000 0.833 1780 D CB -0.226 40.657 40.800 0.138 0.000 0.961 1780 D HN 0.381 nan 8.370 nan 0.000 0.470 1781 L N 0.273 121.439 121.223 -0.094 0.000 2.056 1781 L HA -0.183 4.157 4.340 0.000 0.000 0.207 1781 L C 2.010 178.854 176.870 -0.042 0.000 1.078 1781 L CA 1.584 56.355 54.840 -0.114 0.000 0.749 1781 L CB -0.932 40.968 42.059 -0.264 0.000 0.901 1781 L HN -0.042 nan 8.230 nan 0.000 0.433 1782 Y N -0.268 119.954 120.300 -0.132 0.000 2.165 1782 Y HA -0.246 4.304 4.550 0.000 0.000 0.286 1782 Y C 2.927 178.835 175.900 0.013 0.000 1.155 1782 Y CA 1.588 59.590 58.100 -0.163 0.000 1.164 1782 Y CB -1.218 36.950 38.460 -0.488 0.000 0.978 1782 Y HN 0.366 nan 8.280 nan 0.000 0.513 1783 H N -0.972 118.277 119.070 0.298 0.000 2.387 1783 H HA -0.101 4.455 4.556 0.000 0.000 0.299 1783 H C 2.343 177.767 175.328 0.160 0.000 1.090 1783 H CA 1.517 57.710 56.048 0.242 0.000 1.332 1783 H CB -0.366 29.523 29.762 0.211 0.000 1.386 1783 H HN 0.248 nan 8.280 nan 0.000 0.516 1784 S N 0.471 116.320 115.700 0.249 0.000 2.382 1784 S HA -0.061 4.409 4.470 0.000 0.000 0.228 1784 S C 2.478 177.185 174.600 0.180 0.000 1.027 1784 S CA 0.624 58.925 58.200 0.168 0.000 0.991 1784 S CB -0.144 63.131 63.200 0.125 0.000 0.823 1784 S HN 0.257 nan 8.310 nan 0.000 0.469 1785 L N 0.480 121.844 121.223 0.235 0.000 2.072 1785 L HA -0.015 4.325 4.340 0.000 0.000 0.205 1785 L C 2.461 179.526 176.870 0.325 0.000 1.079 1785 L CA 1.052 56.099 54.840 0.345 0.000 0.752 1785 L CB -0.524 41.725 42.059 0.315 0.000 0.906 1785 L HN 0.301 nan 8.230 nan 0.000 0.436 1786 M N -0.139 119.609 119.600 0.247 0.000 2.213 1786 M HA -0.219 4.261 4.480 0.000 0.000 0.263 1786 M C 2.330 178.719 176.300 0.148 0.000 1.062 1786 M CA 1.630 57.051 55.300 0.202 0.000 1.105 1786 M CB -0.255 32.465 32.600 0.200 0.000 1.385 1786 M HN 0.137 nan 8.290 nan 0.000 0.417 1787 K N -0.076 120.400 120.400 0.126 0.000 2.103 1787 K HA -0.097 4.223 4.320 0.000 0.000 0.204 1787 K C 1.871 178.454 176.600 -0.028 0.000 1.052 1787 K CA 0.949 57.269 56.287 0.056 0.000 0.945 1787 K CB 0.232 32.766 32.500 0.057 0.000 0.722 1787 K HN 0.135 nan 8.250 nan 0.000 0.443 1788 R N -0.459 119.974 120.500 -0.112 0.000 2.254 1788 R HA 0.107 4.447 4.340 0.000 0.000 0.195 1788 R C -0.090 175.848 176.300 -0.603 0.000 0.957 1788 R CA 0.470 56.327 56.100 -0.405 0.000 1.024 1788 R CB 0.198 30.119 30.300 -0.632 0.000 0.952 1788 R HN 0.142 nan 8.270 nan 0.000 0.484 1789 Y N 0.395 120.738 120.300 0.072 0.000 2.499 1789 Y HA 0.343 4.893 4.550 0.000 0.000 0.347 1789 Y C -1.850 174.092 175.900 0.069 0.000 0.987 1789 Y CA -3.057 55.086 58.100 0.072 0.000 1.044 1789 Y CB 1.547 40.059 38.460 0.088 0.000 1.245 1789 Y HN -0.137 nan 8.280 nan 0.000 0.461 1790 P HA 0.123 nan 4.420 nan 0.000 0.232 1790 P C -0.473 176.910 177.300 0.139 0.000 1.738 1790 P CA 0.589 63.775 63.100 0.143 0.000 0.948 1790 P CB -0.524 31.245 31.700 0.114 0.000 1.943 1791 I N 1.543 122.206 120.570 0.154 0.000 2.396 1791 I HA 0.021 4.191 4.170 0.000 0.000 0.289 1791 I C 1.692 177.880 176.117 0.120 0.000 1.056 1791 I CA -0.345 61.031 61.300 0.127 0.000 1.365 1791 I CB 1.636 39.711 38.000 0.125 0.000 1.407 1791 I HN -0.028 nan 8.210 nan 0.000 0.509 1792 V N 1.594 121.594 119.914 0.143 0.000 3.528 1792 V HA 0.331 4.451 4.120 0.000 0.000 0.294 1792 V C 0.358 176.591 176.094 0.232 0.000 1.404 1792 V CA -0.015 62.410 62.300 0.207 0.000 1.065 1792 V CB 0.397 32.418 31.823 0.329 0.000 0.904 1792 V HN 0.654 nan 8.190 nan 0.000 0.435 1793 S N 0.044 115.836 115.700 0.154 0.000 2.543 1793 S HA 0.768 5.238 4.470 0.000 0.000 0.273 1793 S C -1.367 173.223 174.600 -0.016 0.000 1.152 1793 S CA -0.499 57.753 58.200 0.086 0.000 0.910 1793 S CB 1.668 64.921 63.200 0.088 0.000 1.105 1793 S HN 0.351 nan 8.310 nan 0.000 0.465 1794 I N 3.281 123.805 120.570 -0.076 0.000 2.478 1794 I HA 0.436 4.606 4.170 0.000 0.000 0.287 1794 I C -0.266 175.742 176.117 -0.182 0.000 1.042 1794 I CA -0.498 60.688 61.300 -0.189 0.000 1.067 1794 I CB 1.958 39.791 38.000 -0.278 0.000 1.233 1794 I HN 0.611 nan 8.210 nan 0.000 0.431 1795 E N 5.691 125.771 120.200 -0.200 0.000 2.191 1795 E HA 0.165 4.515 4.350 0.000 0.000 0.278 1795 E C -0.786 175.708 176.600 -0.177 0.000 0.972 1795 E CA -0.478 55.848 56.400 -0.123 0.000 0.804 1795 E CB 0.969 30.612 29.700 -0.094 0.000 1.110 1795 E HN 0.505 nan 8.360 nan 0.000 0.394 1796 D N 4.260 124.647 120.400 -0.021 0.000 2.704 1796 D HA -0.154 4.487 4.640 0.000 0.000 0.232 1796 D C -1.766 174.217 176.300 -0.528 0.000 1.183 1796 D CA 0.435 54.403 54.000 -0.054 0.000 0.647 1796 D CB -0.410 40.397 40.800 0.010 0.000 1.013 1796 D HN 0.475 nan 8.370 nan 0.000 0.415 1797 P HA -0.117 nan 4.420 nan 0.000 0.222 1797 P C 0.287 176.618 177.300 -1.615 0.000 1.147 1797 P CA 0.965 63.279 63.100 -1.310 0.000 0.790 1797 P CB 0.254 31.020 31.700 -1.556 0.000 0.780 1798 F N -0.650 118.701 119.950 -0.998 0.000 2.620 1798 F HA 0.593 5.120 4.527 0.000 0.000 0.320 1798 F C 0.507 176.188 175.800 -0.198 0.000 1.069 1798 F CA -1.685 55.894 58.000 -0.702 0.000 0.953 1798 F CB 0.471 38.923 39.000 -0.914 0.000 1.322 1798 F HN -0.224 nan 8.300 nan 0.000 0.479 1799 A N 0.760 123.615 122.820 0.057 0.000 2.583 1799 A HA 0.069 4.389 4.320 0.000 0.000 0.231 1799 A C 1.404 179.004 177.584 0.026 0.000 1.065 1799 A CA 0.318 52.256 52.037 -0.166 0.000 0.760 1799 A CB -0.155 18.293 19.000 -0.920 0.000 1.001 1799 A HN 0.955 nan 8.150 nan 0.000 0.509 1800 E N 0.260 120.426 120.200 -0.057 0.000 2.396 1800 E HA -0.184 4.166 4.350 0.000 0.000 0.200 1800 E C -0.352 176.091 176.600 -0.263 0.000 1.023 1800 E CA 1.570 57.908 56.400 -0.103 0.000 0.857 1800 E CB -0.019 29.670 29.700 -0.019 0.000 0.775 1800 E HN 0.679 nan 8.360 nan 0.000 0.525 1801 D N 0.390 120.643 120.400 -0.244 0.000 2.539 1801 D HA 0.008 4.648 4.640 0.000 0.000 0.232 1801 D C -0.405 175.734 176.300 -0.268 0.000 1.256 1801 D CA -0.093 53.742 54.000 -0.276 0.000 0.810 1801 D CB 0.351 41.193 40.800 0.070 0.000 1.090 1801 D HN 0.010 nan 8.370 nan 0.000 0.519 1802 D N 0.101 120.351 120.400 -0.250 0.000 2.845 1802 D HA 0.028 4.668 4.640 0.000 0.000 0.235 1802 D C 1.031 177.397 176.300 0.110 0.000 1.158 1802 D CA -0.377 53.580 54.000 -0.072 0.000 0.990 1802 D CB -0.376 40.298 40.800 -0.209 0.000 1.094 1802 D HN 0.112 nan 8.370 nan 0.000 0.486 1803 W N 0.741 122.125 121.300 0.140 0.000 2.304 1803 W HA -0.200 4.460 4.660 0.000 0.000 0.315 1803 W C 2.307 178.923 176.519 0.163 0.000 1.233 1803 W CA 1.106 58.521 57.345 0.116 0.000 1.261 1803 W CB -0.220 29.255 29.460 0.025 0.000 1.150 1803 W HN 0.327 nan 8.180 nan 0.000 0.494 1804 E N 0.246 120.649 120.200 0.337 0.000 2.118 1804 E HA -0.242 4.108 4.350 0.000 0.000 0.195 1804 E C 2.257 178.938 176.600 0.136 0.000 0.992 1804 E CA 1.597 58.129 56.400 0.220 0.000 0.804 1804 E CB -0.316 29.479 29.700 0.159 0.000 0.741 1804 E HN 0.195 nan 8.360 nan 0.000 0.458 1805 A N 0.207 123.034 122.820 0.013 0.000 1.902 1805 A HA -0.174 4.146 4.320 0.000 0.000 0.217 1805 A C 1.753 179.051 177.584 -0.478 0.000 1.181 1805 A CA 1.382 53.175 52.037 -0.406 0.000 0.623 1805 A CB -1.051 17.570 19.000 -0.632 0.000 0.818 1805 A HN 0.475 nan 8.150 nan 0.000 0.443 1806 W N 0.553 121.739 121.300 -0.191 0.000 2.354 1806 W HA -0.112 4.548 4.660 0.000 0.000 0.315 1806 W C 2.874 179.510 176.519 0.195 0.000 1.206 1806 W CA 1.730 59.140 57.345 0.107 0.000 1.290 1806 W CB -0.789 28.748 29.460 0.127 0.000 1.152 1806 W HN 0.259 nan 8.180 nan 0.000 0.489 1807 S N -1.272 114.683 115.700 0.426 0.000 2.370 1807 S HA -0.301 4.169 4.470 0.000 0.000 0.226 1807 S C 1.718 176.500 174.600 0.304 0.000 1.033 1807 S CA 1.665 60.068 58.200 0.339 0.000 1.011 1807 S CB -0.870 62.494 63.200 0.273 0.000 0.852 1807 S HN 0.389 nan 8.310 nan 0.000 0.457 1808 H N 0.032 119.204 119.070 0.170 0.000 2.321 1808 H HA -0.104 4.452 4.556 0.000 0.000 0.300 1808 H C 2.114 177.579 175.328 0.227 0.000 1.087 1808 H CA 1.716 57.849 56.048 0.143 0.000 1.319 1808 H CB -0.414 29.380 29.762 0.054 0.000 1.379 1808 H HN 0.434 nan 8.280 nan 0.000 0.501 1809 F N 0.825 120.822 119.950 0.078 0.000 2.146 1809 F HA -0.143 4.384 4.527 0.000 0.000 0.298 1809 F C 2.347 178.227 175.800 0.134 0.000 1.096 1809 F CA 1.001 59.075 58.000 0.124 0.000 1.275 1809 F CB -1.121 38.068 39.000 0.314 0.000 1.008 1809 F HN 0.104 nan 8.300 nan 0.000 0.480 1810 F N 1.512 121.461 119.950 -0.000 0.000 2.250 1810 F HA -0.197 4.330 4.527 0.000 0.000 0.301 1810 F C 2.197 177.913 175.800 -0.140 0.000 1.077 1810 F CA 1.675 59.602 58.000 -0.123 0.000 1.348 1810 F CB -0.526 38.498 39.000 0.040 0.000 1.040 1810 F HN -0.081 nan 8.300 nan 0.000 0.509 1811 K N -1.001 119.372 120.400 -0.044 0.000 2.103 1811 K HA -0.173 4.147 4.320 0.000 0.000 0.207 1811 K C 1.654 178.122 176.600 -0.219 0.000 1.048 1811 K CA 1.955 58.175 56.287 -0.112 0.000 0.930 1811 K CB -0.426 32.028 32.500 -0.076 0.000 0.716 1811 K HN 0.449 nan 8.250 nan 0.000 0.444 1812 T N -3.757 110.659 114.554 -0.230 0.000 3.043 1812 T HA 0.382 4.732 4.350 0.000 0.000 0.272 1812 T C 1.652 176.238 174.700 -0.189 0.000 0.990 1812 T CA 0.193 62.189 62.100 -0.175 0.000 0.897 1812 T CB 0.588 69.412 68.868 -0.074 0.000 1.111 1812 T HN 0.078 nan 8.240 nan 0.000 0.529 1813 A N 2.331 124.822 122.820 -0.548 0.000 1.870 1813 A HA 0.264 4.584 4.320 0.000 0.000 0.219 1813 A C 2.475 179.854 177.584 -0.342 0.000 1.224 1813 A CA 2.344 53.931 52.037 -0.750 0.000 0.650 1813 A CB -1.614 16.773 19.000 -1.022 0.000 0.836 1813 A HN 1.705 nan 8.150 nan 0.000 0.454 1814 G N -2.080 106.498 108.800 -0.370 0.000 2.179 1814 G HA2 -0.194 3.766 3.960 0.000 0.000 0.260 1814 G HA3 -0.194 3.766 3.960 0.000 0.000 0.260 1814 G C 0.276 175.058 174.900 -0.197 0.000 0.977 1814 G CA 0.822 45.779 45.100 -0.238 0.000 0.641 1814 G HN 1.729 nan 8.290 nan 0.000 0.533 1815 I N -2.642 117.796 120.570 -0.219 0.000 3.264 1815 I HA 0.730 4.900 4.170 0.000 0.000 0.315 1815 I C -0.114 175.891 176.117 -0.187 0.000 1.154 1815 I CA -1.975 59.232 61.300 -0.155 0.000 0.962 1815 I CB 1.021 38.991 38.000 -0.049 0.000 1.265 1815 I HN 0.176 nan 8.210 nan 0.000 0.463 1816 Q N 1.811 121.518 119.800 -0.155 0.000 2.300 1816 Q HA 0.290 4.630 4.340 0.000 0.000 0.280 1816 Q C -1.351 174.623 176.000 -0.043 0.000 1.033 1816 Q CA 0.086 55.802 55.803 -0.145 0.000 0.903 1816 Q CB 0.563 29.294 28.738 -0.010 0.000 1.195 1816 Q HN 0.505 nan 8.270 nan 0.000 0.386 1817 I N 5.751 126.318 120.570 -0.005 0.000 2.382 1817 I HA 0.234 4.405 4.170 0.000 0.000 0.285 1817 I C -0.516 175.618 176.117 0.030 0.000 1.007 1817 I CA -0.626 60.710 61.300 0.060 0.000 1.142 1817 I CB 1.266 39.397 38.000 0.219 0.000 1.289 1817 I HN 0.429 nan 8.210 nan 0.000 0.453 1818 V N 5.540 125.474 119.914 0.034 0.000 2.465 1818 V HA 0.608 4.728 4.120 0.000 0.000 0.279 1818 V C 0.682 176.865 176.094 0.148 0.000 1.045 1818 V CA -0.686 61.627 62.300 0.021 0.000 0.938 1818 V CB 1.441 33.242 31.823 -0.036 0.000 0.986 1818 V HN 0.828 nan 8.190 nan 0.000 0.467 1819 A N 2.888 125.737 122.820 0.047 0.000 2.276 1819 A HA 0.632 4.952 4.320 0.000 0.000 0.316 1819 A C 0.170 177.760 177.584 0.011 0.000 1.229 1819 A CA -0.265 51.765 52.037 -0.010 0.000 0.851 1819 A CB 0.976 19.860 19.000 -0.193 0.000 1.165 1819 A HN 0.900 nan 8.150 nan 0.000 0.513 1820 D N 0.743 121.160 120.400 0.030 0.000 3.137 1820 D HA 0.005 4.645 4.640 0.000 0.000 0.236 1820 D C 0.649 176.948 176.300 -0.001 0.000 1.557 1820 D CA 0.535 54.546 54.000 0.018 0.000 1.305 1820 D CB 0.250 41.068 40.800 0.030 0.000 1.065 1820 D HN 0.371 nan 8.370 nan 0.000 0.290 1821 D N 0.264 120.668 120.400 0.008 0.000 2.269 1821 D HA -0.059 4.581 4.640 0.000 0.000 0.208 1821 D C 2.052 178.333 176.300 -0.031 0.000 0.963 1821 D CA 0.208 54.209 54.000 0.002 0.000 0.864 1821 D CB 0.218 41.017 40.800 -0.002 0.000 0.936 1821 D HN 0.178 nan 8.370 nan 0.000 0.505 1822 L N 0.840 121.975 121.223 -0.146 0.000 2.056 1822 L HA -0.135 4.205 4.340 0.000 0.000 0.207 1822 L C 2.245 178.953 176.870 -0.270 0.000 1.078 1822 L CA 1.898 56.494 54.840 -0.407 0.000 0.749 1822 L CB -0.583 40.914 42.059 -0.936 0.000 0.901 1822 L HN 0.052 nan 8.230 nan 0.000 0.433 1823 T N -4.040 110.422 114.554 -0.153 0.000 3.015 1823 T HA 0.096 4.446 4.350 0.000 0.000 0.250 1823 T C 1.027 175.712 174.700 -0.024 0.000 1.057 1823 T CA 0.442 62.508 62.100 -0.055 0.000 1.066 1823 T CB -0.588 68.280 68.868 0.001 0.000 0.959 1823 T HN 0.629 nan 8.240 nan 0.000 0.488 1824 V N 0.448 120.357 119.914 -0.008 0.000 5.043 1824 V HA -0.269 3.851 4.120 0.000 0.000 0.267 1824 V C 0.437 176.533 176.094 0.003 0.000 0.597 1824 V CA 0.859 63.167 62.300 0.013 0.000 0.703 1824 V CB -3.550 28.302 31.823 0.048 0.000 0.558 1824 V HN 0.742 nan 8.190 nan 0.000 1.038 1825 T N -1.216 113.336 114.554 -0.003 0.000 3.935 1825 T HA -0.267 4.083 4.350 0.000 0.000 0.346 1825 T C 0.254 174.940 174.700 -0.024 0.000 0.758 1825 T CA 1.589 63.681 62.100 -0.012 0.000 1.874 1825 T CB -1.535 67.331 68.868 -0.003 0.000 1.875 1825 T HN 1.324 nan 8.240 nan 0.000 0.802 1826 N N 1.164 119.845 118.700 -0.030 0.000 2.446 1826 N HA 0.256 4.996 4.740 0.000 0.000 0.265 1826 N C -1.197 174.274 175.510 -0.065 0.000 0.975 1826 N CA -2.336 50.690 53.050 -0.040 0.000 0.928 1826 N CB 2.050 40.518 38.487 -0.032 0.000 1.160 1826 N HN -0.006 nan 8.380 nan 0.000 0.495 1827 P HA -0.183 nan 4.420 nan 0.000 0.217 1827 P C 0.642 177.876 177.300 -0.111 0.000 1.148 1827 P CA 1.403 64.439 63.100 -0.106 0.000 0.828 1827 P CB 0.661 32.306 31.700 -0.092 0.000 0.783 1828 K N -0.007 120.340 120.400 -0.088 0.000 2.057 1828 K HA -0.073 4.247 4.320 0.000 0.000 0.206 1828 K C 2.500 179.040 176.600 -0.099 0.000 1.050 1828 K CA 1.236 57.468 56.287 -0.092 0.000 0.935 1828 K CB -0.227 32.228 32.500 -0.075 0.000 0.715 1828 K HN 0.113 nan 8.250 nan 0.000 0.439 1829 R N 0.470 120.926 120.500 -0.074 0.000 2.153 1829 R HA 0.064 4.404 4.340 0.000 0.000 0.218 1829 R C 2.255 178.551 176.300 -0.006 0.000 1.072 1829 R CA 0.694 56.780 56.100 -0.024 0.000 0.990 1829 R CB -0.147 30.147 30.300 -0.010 0.000 0.889 1829 R HN 0.179 nan 8.270 nan 0.000 0.452 1830 I N 0.665 121.186 120.570 -0.081 0.000 2.252 1830 I HA -0.235 3.936 4.170 0.000 0.000 0.245 1830 I C 2.527 178.497 176.117 -0.244 0.000 1.102 1830 I CA 1.145 62.345 61.300 -0.168 0.000 1.385 1830 I CB -0.337 37.507 38.000 -0.260 0.000 1.064 1830 I HN 0.162 nan 8.210 nan 0.000 0.414 1831 A N 0.274 122.966 122.820 -0.213 0.000 1.972 1831 A HA -0.193 4.127 4.320 0.000 0.000 0.219 1831 A C 2.358 179.823 177.584 -0.199 0.000 1.169 1831 A CA 2.344 54.253 52.037 -0.213 0.000 0.635 1831 A CB -0.980 17.916 19.000 -0.173 0.000 0.810 1831 A HN 0.382 nan 8.150 nan 0.000 0.446 1832 T N 0.180 114.608 114.554 -0.211 0.000 2.777 1832 T HA 0.021 4.371 4.350 0.000 0.000 0.266 1832 T C 2.239 176.754 174.700 -0.307 0.000 1.040 1832 T CA 1.455 63.342 62.100 -0.356 0.000 1.141 1832 T CB -0.411 68.134 68.868 -0.539 0.000 0.868 1832 T HN 0.588 nan 8.240 nan 0.000 0.444 1833 A N 1.020 123.828 122.820 -0.020 0.000 1.972 1833 A HA -0.001 4.319 4.320 0.000 0.000 0.219 1833 A C 2.256 179.961 177.584 0.201 0.000 1.169 1833 A CA 1.108 53.307 52.037 0.270 0.000 0.635 1833 A CB -0.737 18.540 19.000 0.462 0.000 0.810 1833 A HN 0.535 nan 8.150 nan 0.000 0.446 1834 I N -0.814 119.785 120.570 0.048 0.000 2.202 1834 I HA -0.212 3.958 4.170 0.000 0.000 0.242 1834 I C 2.523 178.641 176.117 0.002 0.000 1.091 1834 I CA 1.678 62.996 61.300 0.030 0.000 1.368 1834 I CB -0.345 37.535 38.000 -0.200 0.000 1.058 1834 I HN 0.422 nan 8.210 nan 0.000 0.410 1835 E N 1.978 122.134 120.200 -0.074 0.000 2.058 1835 E HA -0.243 4.107 4.350 0.000 0.000 0.194 1835 E C 1.855 178.424 176.600 -0.052 0.000 0.997 1835 E CA 1.756 58.107 56.400 -0.082 0.000 0.801 1835 E CB -0.071 29.542 29.700 -0.145 0.000 0.746 1835 E HN 0.320 nan 8.360 nan 0.000 0.450 1836 K N 0.152 120.514 120.400 -0.064 0.000 2.444 1836 K HA 0.094 4.414 4.320 0.000 0.000 0.193 1836 K C -0.307 176.336 176.600 0.071 0.000 1.024 1836 K CA 0.288 56.574 56.287 -0.003 0.000 1.077 1836 K CB 0.181 32.666 32.500 -0.025 0.000 0.833 1836 K HN 0.031 nan 8.250 nan 0.000 0.517 1837 K N -0.302 120.126 120.400 0.047 0.000 3.257 1837 K HA -0.240 4.080 4.320 0.000 0.000 0.270 1837 K C 0.529 177.036 176.600 -0.155 0.000 0.984 1837 K CA 0.243 56.505 56.287 -0.041 0.000 0.739 1837 K CB -1.500 31.052 32.500 0.086 0.000 1.351 1837 K HN 0.347 nan 8.250 nan 0.000 0.463 1838 A N -0.066 122.719 122.820 -0.059 0.000 1.975 1838 A HA 0.448 4.769 4.320 0.000 0.000 0.215 1838 A C 0.876 178.414 177.584 -0.077 0.000 1.170 1838 A CA 1.403 53.489 52.037 0.082 0.000 0.656 1838 A CB 0.267 19.383 19.000 0.193 0.000 0.821 1838 A HN 0.730 nan 8.150 nan 0.000 0.449 1839 A N -0.782 121.709 122.820 -0.549 0.000 2.557 1839 A HA 0.560 4.880 4.320 0.000 0.000 0.292 1839 A C -1.363 175.436 177.584 -1.310 0.000 1.139 1839 A CA 0.229 51.869 52.037 -0.662 0.000 0.665 1839 A CB 0.347 19.153 19.000 -0.323 0.000 1.285 1839 A HN 0.280 nan 8.150 nan 0.000 0.433 1840 D N -1.373 118.399 120.400 -1.047 0.000 2.636 1840 D HA 0.547 5.187 4.640 0.000 0.000 0.270 1840 D C -0.254 175.550 176.300 -0.826 0.000 1.430 1840 D CA 0.706 53.933 54.000 -1.288 0.000 0.796 1840 D CB 0.492 41.190 40.800 -0.171 0.000 1.117 1840 D HN 1.231 nan 8.370 nan 0.000 0.480 1841 A N 0.161 122.508 122.820 -0.787 0.000 2.547 1841 A HA 0.636 4.956 4.320 0.000 0.000 0.297 1841 A C -1.981 175.576 177.584 -0.045 0.000 1.056 1841 A CA -0.933 51.003 52.037 -0.168 0.000 0.688 1841 A CB 1.520 20.507 19.000 -0.021 0.000 1.282 1841 A HN 0.205 nan 8.150 nan 0.000 0.400 1842 L N 1.945 123.256 121.223 0.147 0.000 2.322 1842 L HA 0.786 5.126 4.340 0.000 0.000 0.281 1842 L C -1.158 175.729 176.870 0.028 0.000 1.014 1842 L CA -0.670 54.255 54.840 0.141 0.000 0.815 1842 L CB 1.500 43.653 42.059 0.157 0.000 1.247 1842 L HN 0.696 nan 8.230 nan 0.000 0.421 1843 L N 5.751 126.984 121.223 0.017 0.000 2.260 1843 L HA 0.430 4.770 4.340 0.000 0.000 0.289 1843 L C -0.809 176.066 176.870 0.008 0.000 1.057 1843 L CA 0.130 54.968 54.840 -0.003 0.000 0.811 1843 L CB 0.906 42.964 42.059 -0.001 0.000 1.184 1843 L HN 0.717 nan 8.230 nan 0.000 0.429 1844 L N 6.204 127.431 121.223 0.006 0.000 2.261 1844 L HA 0.404 4.744 4.340 0.000 0.000 0.289 1844 L C -0.580 176.313 176.870 0.038 0.000 1.059 1844 L CA -0.285 54.563 54.840 0.014 0.000 0.816 1844 L CB 0.089 42.153 42.059 0.007 0.000 1.191 1844 L HN 0.636 nan 8.230 nan 0.000 0.431 1845 K N 4.470 124.891 120.400 0.034 0.000 2.521 1845 K HA 0.161 4.481 4.320 0.000 0.000 0.248 1845 K C 0.980 177.596 176.600 0.027 0.000 0.978 1845 K CA -0.397 55.915 56.287 0.042 0.000 0.947 1845 K CB 1.818 34.340 32.500 0.036 0.000 1.165 1845 K HN 0.606 nan 8.250 nan 0.000 0.445 1846 V N 0.376 120.309 119.914 0.033 0.000 2.380 1846 V HA -0.315 3.805 4.120 0.000 0.000 0.251 1846 V C 1.615 177.696 176.094 -0.021 0.000 1.063 1846 V CA 2.090 64.391 62.300 0.001 0.000 1.055 1846 V CB -0.528 31.279 31.823 -0.028 0.000 0.657 1846 V HN 0.865 nan 8.190 nan 0.000 0.455 1847 N N 0.065 118.755 118.700 -0.017 0.000 2.461 1847 N HA -0.100 4.640 4.740 0.000 0.000 0.188 1847 N C 1.657 177.157 175.510 -0.016 0.000 1.134 1847 N CA 1.055 54.090 53.050 -0.026 0.000 0.878 1847 N CB -0.127 38.343 38.487 -0.029 0.000 0.972 1847 N HN 0.727 nan 8.380 nan 0.000 0.456 1848 Q N -0.334 119.462 119.800 -0.005 0.000 2.269 1848 Q HA 0.085 4.425 4.340 0.000 0.000 0.201 1848 Q C 1.300 177.299 176.000 -0.002 0.000 0.946 1848 Q CA 0.646 56.449 55.803 -0.000 0.000 0.877 1848 Q CB 0.277 29.020 28.738 0.008 0.000 0.963 1848 Q HN 0.319 nan 8.270 nan 0.000 0.472 1849 I N -1.565 119.000 120.570 -0.007 0.000 3.172 1849 I HA 0.164 4.334 4.170 0.000 0.000 0.278 1849 I C 1.205 177.313 176.117 -0.015 0.000 1.174 1849 I CA 1.497 62.791 61.300 -0.010 0.000 1.445 1849 I CB 0.729 38.722 38.000 -0.012 0.000 1.175 1849 I HN 0.235 nan 8.210 nan 0.000 0.447 1850 G N 0.058 108.845 108.800 -0.021 0.000 2.253 1850 G HA2 -0.182 3.778 3.960 0.000 0.000 0.209 1850 G HA3 -0.182 3.778 3.960 0.000 0.000 0.209 1850 G C 0.551 175.433 174.900 -0.029 0.000 0.997 1850 G CA 0.309 45.393 45.100 -0.027 0.000 0.640 1850 G HN 0.750 nan 8.290 nan 0.000 0.496 1851 T N -2.295 112.245 114.554 -0.024 0.000 2.883 1851 T HA 0.654 5.004 4.350 0.000 0.000 0.301 1851 T C 0.892 175.581 174.700 -0.019 0.000 1.158 1851 T CA 0.100 62.188 62.100 -0.019 0.000 1.007 1851 T CB 1.990 70.862 68.868 0.007 0.000 1.186 1851 T HN 0.984 nan 8.240 nan 0.000 0.499 1852 L N 1.840 123.051 121.223 -0.019 0.000 2.056 1852 L HA 0.110 4.450 4.340 0.000 0.000 0.207 1852 L C 2.564 179.456 176.870 0.037 0.000 1.078 1852 L CA 2.010 56.857 54.840 0.012 0.000 0.749 1852 L CB -1.208 40.871 42.059 0.032 0.000 0.901 1852 L HN 0.849 nan 8.230 nan 0.000 0.433 1853 S N -0.196 115.523 115.700 0.033 0.000 2.353 1853 S HA -0.236 4.234 4.470 0.000 0.000 0.222 1853 S C 1.784 176.393 174.600 0.013 0.000 1.035 1853 S CA 1.792 60.008 58.200 0.027 0.000 1.025 1853 S CB -0.390 62.827 63.200 0.028 0.000 0.902 1853 S HN 0.567 nan 8.310 nan 0.000 0.440 1854 E N 0.812 121.015 120.200 0.005 0.000 2.153 1854 E HA -0.081 4.269 4.350 0.000 0.000 0.194 1854 E C 2.255 178.849 176.600 -0.009 0.000 0.988 1854 E CA 1.192 57.588 56.400 -0.007 0.000 0.811 1854 E CB -0.126 29.567 29.700 -0.011 0.000 0.746 1854 E HN 0.339 nan 8.360 nan 0.000 0.466 1855 S N 0.738 116.440 115.700 0.003 0.000 2.368 1855 S HA -0.082 4.388 4.470 0.000 0.000 0.224 1855 S C 2.018 176.625 174.600 0.011 0.000 1.029 1855 S CA 0.649 58.855 58.200 0.009 0.000 0.988 1855 S CB -0.088 63.130 63.200 0.031 0.000 0.838 1855 S HN 0.206 nan 8.310 nan 0.000 0.462 1856 I N 1.292 121.879 120.570 0.028 0.000 2.226 1856 I HA -0.188 3.982 4.170 0.000 0.000 0.245 1856 I C 2.499 178.620 176.117 0.007 0.000 1.100 1856 I CA 1.130 62.450 61.300 0.033 0.000 1.374 1856 I CB -0.219 37.807 38.000 0.043 0.000 1.057 1856 I HN 0.184 nan 8.210 nan 0.000 0.413 1857 K N 1.691 122.086 120.400 -0.009 0.000 2.097 1857 K HA -0.114 4.206 4.320 0.000 0.000 0.206 1857 K C 2.031 178.594 176.600 -0.061 0.000 1.049 1857 K CA 1.683 57.952 56.287 -0.029 0.000 0.933 1857 K CB -0.386 32.096 32.500 -0.031 0.000 0.717 1857 K HN 0.264 nan 8.250 nan 0.000 0.442 1858 A N 0.528 123.307 122.820 -0.067 0.000 1.908 1858 A HA -0.080 4.240 4.320 0.000 0.000 0.218 1858 A C 2.385 179.876 177.584 -0.155 0.000 1.181 1858 A CA 2.124 54.099 52.037 -0.104 0.000 0.627 1858 A CB -1.097 17.858 19.000 -0.075 0.000 0.818 1858 A HN 0.429 nan 8.150 nan 0.000 0.445 1859 A N -0.735 122.000 122.820 -0.142 0.000 1.898 1859 A HA -0.193 4.127 4.320 0.000 0.000 0.216 1859 A C 2.129 179.548 177.584 -0.275 0.000 1.181 1859 A CA 1.623 53.495 52.037 -0.276 0.000 0.620 1859 A CB -0.575 18.339 19.000 -0.144 0.000 0.819 1859 A HN 0.659 nan 8.150 nan 0.000 0.442 1860 Q N -0.369 119.399 119.800 -0.054 0.000 2.084 1860 Q HA -0.179 4.161 4.340 0.000 0.000 0.202 1860 Q C 1.494 177.476 176.000 -0.030 0.000 0.978 1860 Q CA 1.434 57.266 55.803 0.049 0.000 0.844 1860 Q CB -0.258 28.505 28.738 0.041 0.000 0.898 1860 Q HN 0.577 nan 8.270 nan 0.000 0.426 1861 D N 0.130 120.459 120.400 -0.119 0.000 2.144 1861 D HA -0.099 4.541 4.640 0.000 0.000 0.199 1861 D C 2.024 178.154 176.300 -0.283 0.000 0.984 1861 D CA 1.133 55.023 54.000 -0.183 0.000 0.834 1861 D CB -0.100 40.571 40.800 -0.216 0.000 0.955 1861 D HN 0.075 nan 8.370 nan 0.000 0.465 1862 S N 0.417 115.914 115.700 -0.339 0.000 2.348 1862 S HA -0.124 4.346 4.470 0.000 0.000 0.221 1862 S C 1.848 176.365 174.600 -0.139 0.000 1.033 1862 S CA 0.680 58.637 58.200 -0.405 0.000 1.010 1862 S CB -0.441 62.580 63.200 -0.298 0.000 0.891 1862 S HN 0.154 nan 8.310 nan 0.000 0.442 1863 F N 2.101 122.044 119.950 -0.013 0.000 2.126 1863 F HA -0.058 4.469 4.527 0.000 0.000 0.299 1863 F C 2.648 178.445 175.800 -0.005 0.000 1.096 1863 F CA 0.344 58.359 58.000 0.025 0.000 1.255 1863 F CB -1.283 37.722 39.000 0.009 0.000 0.997 1863 F HN 0.190 nan 8.300 nan 0.000 0.479 1864 A N -0.301 122.599 122.820 0.133 0.000 2.024 1864 A HA 0.017 4.337 4.320 0.000 0.000 0.220 1864 A C 2.192 179.782 177.584 0.009 0.000 1.164 1864 A CA 1.573 53.636 52.037 0.042 0.000 0.643 1864 A CB -1.081 17.911 19.000 -0.013 0.000 0.806 1864 A HN 0.271 nan 8.150 nan 0.000 0.451 1865 A N -1.938 120.855 122.820 -0.045 0.000 2.307 1865 A HA 0.449 4.769 4.320 0.000 0.000 0.218 1865 A C 1.624 179.319 177.584 0.185 0.000 1.228 1865 A CA 1.001 53.011 52.037 -0.044 0.000 0.857 1865 A CB -0.873 17.923 19.000 -0.340 0.000 0.897 1865 A HN 1.835 nan 8.150 nan 0.000 0.495 1866 G N -2.291 106.655 108.800 0.243 0.000 2.143 1866 G HA2 -0.257 3.703 3.960 0.000 0.000 0.249 1866 G HA3 -0.257 3.703 3.960 0.000 0.000 0.249 1866 G C -0.109 175.126 174.900 0.558 0.000 0.981 1866 G CA 0.230 45.543 45.100 0.356 0.000 0.665 1866 G HN 0.362 nan 8.290 nan 0.000 0.528 1867 W N 0.262 121.661 121.300 0.165 0.000 2.253 1867 W HA 0.662 5.323 4.660 0.000 0.000 0.348 1867 W C 0.989 177.506 176.519 -0.003 0.000 1.229 1867 W CA 0.153 57.551 57.345 0.089 0.000 1.335 1867 W CB 0.551 30.010 29.460 -0.002 0.000 1.165 1867 W HN 0.430 nan 8.180 nan 0.000 0.631 1868 G N -0.271 108.550 108.800 0.034 0.000 2.521 1868 G HA2 0.618 4.578 3.960 0.000 0.000 0.323 1868 G HA3 0.618 4.578 3.960 0.000 0.000 0.323 1868 G C -1.821 173.080 174.900 0.001 0.000 1.211 1868 G CA -0.710 44.327 45.100 -0.105 0.000 0.979 1868 G HN 0.254 nan 8.290 nan 0.000 0.490 1869 V N 0.894 120.819 119.914 0.017 0.000 2.567 1869 V HA 0.393 4.513 4.120 0.000 0.000 0.298 1869 V C -0.346 175.757 176.094 0.015 0.000 1.047 1869 V CA -0.459 61.790 62.300 -0.085 0.000 0.880 1869 V CB 1.650 33.259 31.823 -0.358 0.000 1.009 1869 V HN 0.798 nan 8.190 nan 0.000 0.429 1870 M N 5.654 125.242 119.600 -0.020 0.000 2.066 1870 M HA 0.529 5.009 4.480 0.000 0.000 0.340 1870 M C -0.890 175.398 176.300 -0.020 0.000 1.053 1870 M CA -0.461 54.813 55.300 -0.042 0.000 0.983 1870 M CB 1.245 33.751 32.600 -0.156 0.000 1.520 1870 M HN 0.483 nan 8.290 nan 0.000 0.428 1871 V N 3.856 123.779 119.914 0.014 0.000 2.655 1871 V HA 0.234 4.355 4.120 0.000 0.000 0.300 1871 V C 0.232 176.338 176.094 0.021 0.000 1.044 1871 V CA 0.137 62.457 62.300 0.034 0.000 1.095 1871 V CB 1.210 33.067 31.823 0.056 0.000 0.952 1871 V HN 0.908 nan 8.190 nan 0.000 0.485 1872 S N 2.800 118.529 115.700 0.049 0.000 2.569 1872 S HA 0.573 5.043 4.470 0.000 0.000 0.280 1872 S C -0.483 174.215 174.600 0.164 0.000 1.111 1872 S CA -0.816 57.426 58.200 0.069 0.000 0.887 1872 S CB 1.270 64.517 63.200 0.078 0.000 1.095 1872 S HN 0.982 nan 8.310 nan 0.000 0.476 1873 H N 1.540 120.634 119.070 0.039 0.000 2.417 1873 H HA 0.747 5.303 4.556 0.000 0.000 0.325 1873 H C -0.268 175.077 175.328 0.028 0.000 1.549 1873 H CA -1.190 54.882 56.048 0.039 0.000 1.476 1873 H CB 0.477 30.261 29.762 0.037 0.000 1.732 1873 H HN 0.301 nan 8.280 nan 0.000 0.695 1874 R N -0.326 120.125 120.500 -0.080 0.000 2.892 1874 R HA 0.125 4.465 4.340 0.000 0.000 0.265 1874 R C 1.138 177.199 176.300 -0.398 0.000 1.025 1874 R CA -0.272 55.727 56.100 -0.168 0.000 0.982 1874 R CB 1.515 31.777 30.300 -0.064 0.000 1.185 1874 R HN 0.929 nan 8.270 nan 0.000 0.484 1875 S N -0.526 115.024 115.700 -0.251 0.000 2.400 1875 S HA -0.080 4.390 4.470 0.000 0.000 0.232 1875 S C 1.043 175.555 174.600 -0.146 0.000 1.025 1875 S CA 0.922 58.996 58.200 -0.211 0.000 0.993 1875 S CB -0.153 63.035 63.200 -0.020 0.000 0.808 1875 S HN 0.684 nan 8.310 nan 0.000 0.478 1876 G N 1.474 110.216 108.800 -0.097 0.000 2.428 1876 G HA2 0.558 4.518 3.960 0.000 0.000 0.320 1876 G HA3 0.558 4.518 3.960 0.000 0.000 0.320 1876 G C -0.498 174.370 174.900 -0.054 0.000 1.098 1876 G CA -0.447 44.623 45.100 -0.052 0.000 0.984 1876 G HN 0.114 nan 8.290 nan 0.000 0.444 1877 E N 0.320 120.499 120.200 -0.035 0.000 2.396 1877 E HA 0.726 5.076 4.350 0.000 0.000 0.251 1877 E C 0.375 176.988 176.600 0.022 0.000 0.949 1877 E CA -0.436 55.963 56.400 -0.000 0.000 0.834 1877 E CB 2.156 31.872 29.700 0.027 0.000 1.309 1877 E HN 0.602 nan 8.360 nan 0.000 0.405 1878 T N -2.970 111.608 114.554 0.039 0.000 2.696 1878 T HA 0.226 4.576 4.350 0.000 0.000 0.291 1878 T C 0.649 175.383 174.700 0.056 0.000 1.095 1878 T CA -0.645 61.481 62.100 0.043 0.000 1.026 1878 T CB 0.913 69.801 68.868 0.033 0.000 1.390 1878 T HN 0.390 nan 8.240 nan 0.000 0.513 1879 E N 0.337 120.570 120.200 0.055 0.000 2.516 1879 E HA -0.061 4.289 4.350 0.000 0.000 0.199 1879 E C 0.177 176.817 176.600 0.067 0.000 1.069 1879 E CA 0.087 56.522 56.400 0.058 0.000 0.876 1879 E CB -0.316 29.415 29.700 0.053 0.000 0.843 1879 E HN 0.711 nan 8.360 nan 0.000 0.530 1880 D N 2.157 122.601 120.400 0.074 0.000 2.443 1880 D HA -0.038 4.602 4.640 0.000 0.000 0.239 1880 D C 0.322 176.690 176.300 0.114 0.000 1.136 1880 D CA 0.823 54.881 54.000 0.097 0.000 0.879 1880 D CB 1.087 41.945 40.800 0.096 0.000 1.195 1880 D HN 0.130 nan 8.370 nan 0.000 0.443 1881 T N 1.061 115.691 114.554 0.128 0.000 3.228 1881 T HA 0.047 4.397 4.350 0.000 0.000 0.278 1881 T C 1.528 176.302 174.700 0.124 0.000 1.014 1881 T CA -0.607 61.558 62.100 0.108 0.000 0.904 1881 T CB -0.527 68.380 68.868 0.066 0.000 1.110 1881 T HN 0.361 nan 8.240 nan 0.000 0.541 1882 F N 3.362 123.341 119.950 0.049 0.000 2.063 1882 F HA -0.126 4.402 4.527 0.000 0.000 0.298 1882 F C 1.898 177.728 175.800 0.050 0.000 1.109 1882 F CA 2.126 60.157 58.000 0.052 0.000 1.212 1882 F CB -0.286 38.744 39.000 0.049 0.000 0.973 1882 F HN 0.367 nan 8.300 nan 0.000 0.480 1883 I N -1.102 119.607 120.570 0.231 0.000 2.530 1883 I HA -0.156 4.014 4.170 0.000 0.000 0.257 1883 I C 2.223 178.332 176.117 -0.013 0.000 1.179 1883 I CA 1.347 62.724 61.300 0.128 0.000 1.440 1883 I CB -1.241 36.853 38.000 0.157 0.000 1.087 1883 I HN 0.156 nan 8.210 nan 0.000 0.440 1884 A N 1.732 124.527 122.820 -0.042 0.000 1.873 1884 A HA -0.189 4.131 4.320 0.000 0.000 0.215 1884 A C 1.816 179.319 177.584 -0.134 0.000 1.186 1884 A CA 2.122 54.105 52.037 -0.089 0.000 0.616 1884 A CB -0.850 18.102 19.000 -0.080 0.000 0.823 1884 A HN 0.485 nan 8.150 nan 0.000 0.442 1885 D N -0.743 119.556 120.400 -0.169 0.000 2.178 1885 D HA -0.082 4.558 4.640 0.000 0.000 0.202 1885 D C 1.775 177.968 176.300 -0.180 0.000 0.974 1885 D CA 0.917 54.828 54.000 -0.149 0.000 0.841 1885 D CB -0.096 40.592 40.800 -0.188 0.000 0.953 1885 D HN 0.325 nan 8.370 nan 0.000 0.478 1886 L N 0.249 121.290 121.223 -0.304 0.000 2.027 1886 L HA -0.082 4.258 4.340 0.000 0.000 0.206 1886 L C 2.146 179.009 176.870 -0.012 0.000 1.074 1886 L CA 1.254 55.995 54.840 -0.164 0.000 0.745 1886 L CB -0.618 41.406 42.059 -0.059 0.000 0.898 1886 L HN 0.006 nan 8.230 nan 0.000 0.433 1887 V N -1.231 118.678 119.914 -0.009 0.000 2.469 1887 V HA -0.229 3.891 4.120 0.000 0.000 0.251 1887 V C 2.320 178.435 176.094 0.034 0.000 1.064 1887 V CA 1.927 64.245 62.300 0.030 0.000 1.066 1887 V CB -0.007 31.826 31.823 0.015 0.000 0.667 1887 V HN 0.347 nan 8.190 nan 0.000 0.461 1888 V N 0.470 120.377 119.914 -0.011 0.000 2.407 1888 V HA -0.011 4.109 4.120 0.000 0.000 0.245 1888 V C 2.700 178.889 176.094 0.157 0.000 1.041 1888 V CA 1.809 64.112 62.300 0.005 0.000 1.040 1888 V CB -1.156 30.549 31.823 -0.195 0.000 0.671 1888 V HN 0.610 nan 8.190 nan 0.000 0.455 1889 G N -0.226 108.665 108.800 0.152 0.000 2.422 1889 G HA2 -0.194 3.766 3.960 0.000 0.000 0.218 1889 G HA3 -0.194 3.766 3.960 0.000 0.000 0.218 1889 G C 1.482 176.480 174.900 0.164 0.000 1.146 1889 G CA 0.722 45.951 45.100 0.215 0.000 0.769 1889 G HN 0.490 nan 8.290 nan 0.000 0.547 1890 L N -0.758 120.547 121.223 0.136 0.000 2.558 1890 L HA 0.225 4.565 4.340 0.000 0.000 0.225 1890 L C 1.196 178.150 176.870 0.140 0.000 1.128 1890 L CA -0.150 54.789 54.840 0.166 0.000 0.868 1890 L CB 0.058 42.244 42.059 0.213 0.000 1.006 1890 L HN 0.175 nan 8.230 nan 0.000 0.454 1891 R N -0.722 119.839 120.500 0.102 0.000 3.502 1891 R HA -0.229 4.111 4.340 0.000 0.000 0.266 1891 R C 1.537 177.866 176.300 0.048 0.000 1.077 1891 R CA 0.687 56.813 56.100 0.044 0.000 0.718 1891 R CB -2.473 27.798 30.300 -0.048 0.000 1.120 1891 R HN 0.526 nan 8.270 nan 0.000 0.457 1892 T N -3.452 111.202 114.554 0.167 0.000 2.867 1892 T HA -0.009 4.341 4.350 0.000 0.000 0.268 1892 T C 1.729 176.531 174.700 0.169 0.000 1.057 1892 T CA 1.399 63.662 62.100 0.271 0.000 1.136 1892 T CB 0.110 69.158 68.868 0.299 0.000 0.874 1892 T HN 0.924 nan 8.240 nan 0.000 0.466 1893 G N 1.213 110.084 108.800 0.118 0.000 2.176 1893 G HA2 -0.210 3.750 3.960 0.000 0.000 0.253 1893 G HA3 -0.210 3.750 3.960 0.000 0.000 0.253 1893 G C -0.116 174.887 174.900 0.171 0.000 0.979 1893 G CA 0.290 45.453 45.100 0.104 0.000 0.641 1893 G HN 1.136 nan 8.290 nan 0.000 0.530 1894 Q N -1.086 118.819 119.800 0.176 0.000 2.327 1894 Q HA 0.772 5.113 4.340 0.000 0.000 0.265 1894 Q C -1.210 174.860 176.000 0.116 0.000 0.993 1894 Q CA -1.117 54.805 55.803 0.199 0.000 0.885 1894 Q CB 2.188 31.055 28.738 0.216 0.000 1.379 1894 Q HN 0.750 nan 8.270 nan 0.000 0.408 1895 I N 1.226 121.886 120.570 0.151 0.000 2.686 1895 I HA 0.538 4.708 4.170 0.000 0.000 0.295 1895 I C -1.839 174.321 176.117 0.071 0.000 1.114 1895 I CA -0.828 60.517 61.300 0.075 0.000 1.038 1895 I CB 2.372 40.411 38.000 0.065 0.000 1.238 1895 I HN 0.763 nan 8.210 nan 0.000 0.420 1896 K N 4.511 124.885 120.400 -0.044 0.000 2.449 1896 K HA 0.379 4.699 4.320 0.000 0.000 0.257 1896 K C -0.590 175.752 176.600 -0.430 0.000 0.989 1896 K CA -0.240 55.971 56.287 -0.128 0.000 0.916 1896 K CB 1.325 33.758 32.500 -0.111 0.000 1.136 1896 K HN 0.642 nan 8.250 nan 0.000 0.439 1897 T N 2.285 116.563 114.554 -0.460 0.000 3.460 1897 T HA 0.363 4.714 4.350 0.000 0.000 0.304 1897 T C -0.160 174.317 174.700 -0.371 0.000 0.991 1897 T CA 0.397 62.115 62.100 -0.637 0.000 0.975 1897 T CB -0.056 68.718 68.868 -0.158 0.000 1.196 1897 T HN 0.959 nan 8.240 nan 0.000 0.490 1898 G N 1.028 109.651 108.800 -0.294 0.000 2.592 1898 G HA2 0.348 4.308 3.960 0.000 0.000 0.684 1898 G HA3 0.348 4.308 3.960 0.000 0.000 0.684 1898 G C -0.202 174.676 174.900 -0.037 0.000 1.291 1898 G CA -0.448 44.689 45.100 0.060 0.000 0.891 1898 G HN 0.764 nan 8.290 nan 0.000 0.544 1899 A N 0.411 123.188 122.820 -0.070 0.000 2.287 1899 A HA 0.828 5.148 4.320 0.000 0.000 0.273 1899 A C -1.142 176.246 177.584 -0.328 0.000 1.091 1899 A CA -0.540 51.364 52.037 -0.221 0.000 0.817 1899 A CB 0.550 19.389 19.000 -0.270 0.000 1.069 1899 A HN 0.868 nan 8.150 nan 0.000 0.492 1900 P HA 0.298 nan 4.420 nan 0.000 0.228 1900 P C -0.564 176.462 177.300 -0.457 0.000 1.748 1900 P CA 0.777 63.634 63.100 -0.406 0.000 0.909 1900 P CB -0.381 31.095 31.700 -0.373 0.000 1.882 1901 A N 1.011 123.612 122.820 -0.364 0.000 2.547 1901 A HA 0.711 5.031 4.320 0.000 0.000 0.297 1901 A C -0.673 176.865 177.584 -0.076 0.000 1.056 1901 A CA -0.745 51.173 52.037 -0.197 0.000 0.688 1901 A CB 1.313 20.190 19.000 -0.206 0.000 1.282 1901 A HN 0.164 nan 8.150 nan 0.000 0.400 1902 R N 1.097 121.589 120.500 -0.013 0.000 1.210 1902 R HA -0.104 4.236 4.340 0.000 0.000 0.422 1902 R C 0.477 176.787 176.300 0.016 0.000 1.319 1902 R CA 0.517 56.624 56.100 0.013 0.000 0.951 1902 R CB -1.496 28.813 30.300 0.015 0.000 3.017 1902 R HN 0.854 nan 8.270 nan 0.000 0.506 1903 S N 1.678 117.394 115.700 0.027 0.000 2.493 1903 S HA -0.165 4.305 4.470 0.000 0.000 0.243 1903 S C 1.641 176.267 174.600 0.042 0.000 0.991 1903 S CA 1.406 59.625 58.200 0.032 0.000 0.957 1903 S CB -0.098 63.123 63.200 0.034 0.000 0.756 1903 S HN 0.714 nan 8.310 nan 0.000 0.521 1904 E N 1.124 121.351 120.200 0.046 0.000 2.478 1904 E HA -0.087 4.263 4.350 0.000 0.000 0.198 1904 E C 1.359 178.006 176.600 0.078 0.000 1.046 1904 E CA 0.475 56.910 56.400 0.059 0.000 0.870 1904 E CB 0.026 29.758 29.700 0.053 0.000 0.818 1904 E HN 0.359 nan 8.360 nan 0.000 0.527 1905 R N 0.158 120.696 120.500 0.064 0.000 2.102 1905 R HA 0.202 4.542 4.340 0.000 0.000 0.208 1905 R C 2.409 178.735 176.300 0.044 0.000 1.131 1905 R CA -0.001 56.140 56.100 0.068 0.000 1.054 1905 R CB -0.752 29.573 30.300 0.042 0.000 0.954 1905 R HN 0.138 nan 8.270 nan 0.000 0.465 1906 L N 1.647 122.886 121.223 0.025 0.000 2.127 1906 L HA -0.025 4.315 4.340 0.000 0.000 0.211 1906 L C 2.415 179.313 176.870 0.048 0.000 1.089 1906 L CA 1.780 56.638 54.840 0.030 0.000 0.757 1906 L CB -1.606 40.464 42.059 0.018 0.000 0.899 1906 L HN 0.140 nan 8.230 nan 0.000 0.434 1907 A N -0.087 122.762 122.820 0.048 0.000 1.908 1907 A HA -0.248 4.072 4.320 0.000 0.000 0.218 1907 A C 2.376 179.990 177.584 0.050 0.000 1.181 1907 A CA 1.836 53.903 52.037 0.050 0.000 0.627 1907 A CB -0.313 18.719 19.000 0.054 0.000 0.818 1907 A HN 0.255 nan 8.150 nan 0.000 0.445 1908 K N -0.176 120.256 120.400 0.055 0.000 2.062 1908 K HA 0.109 4.429 4.320 0.000 0.000 0.205 1908 K C 1.762 178.384 176.600 0.037 0.000 1.051 1908 K CA 1.066 57.378 56.287 0.041 0.000 0.941 1908 K CB -0.501 32.027 32.500 0.047 0.000 0.719 1908 K HN 0.492 nan 8.250 nan 0.000 0.440 1909 L N 0.942 122.218 121.223 0.089 0.000 2.093 1909 L HA -0.176 4.164 4.340 0.000 0.000 0.208 1909 L C 1.690 178.677 176.870 0.195 0.000 1.085 1909 L CA 0.965 55.926 54.840 0.201 0.000 0.755 1909 L CB -0.460 41.715 42.059 0.193 0.000 0.904 1909 L HN 0.218 nan 8.230 nan 0.000 0.435 1910 N N -0.229 118.536 118.700 0.109 0.000 2.188 1910 N HA -0.204 4.536 4.740 0.000 0.000 0.184 1910 N C 1.887 177.429 175.510 0.053 0.000 1.018 1910 N CA 0.948 54.051 53.050 0.089 0.000 0.858 1910 N CB -0.186 38.337 38.487 0.059 0.000 0.989 1910 N HN 0.284 nan 8.380 nan 0.000 0.426 1911 Q N 0.960 120.772 119.800 0.020 0.000 2.124 1911 Q HA 0.064 4.404 4.340 0.000 0.000 0.202 1911 Q C 1.940 177.884 176.000 -0.094 0.000 0.977 1911 Q CA 1.041 56.833 55.803 -0.019 0.000 0.850 1911 Q CB -0.291 28.438 28.738 -0.016 0.000 0.901 1911 Q HN 0.361 nan 8.270 nan 0.000 0.429 1912 L N -0.463 120.652 121.223 -0.179 0.000 2.093 1912 L HA -0.147 4.193 4.340 0.000 0.000 0.208 1912 L C 2.230 178.913 176.870 -0.311 0.000 1.085 1912 L CA 0.752 55.318 54.840 -0.457 0.000 0.755 1912 L CB -0.377 41.038 42.059 -1.072 0.000 0.904 1912 L HN 0.286 nan 8.230 nan 0.000 0.435 1913 L N -0.638 120.583 121.223 -0.004 0.000 2.046 1913 L HA -0.206 4.134 4.340 0.000 0.000 0.208 1913 L C 2.826 179.714 176.870 0.029 0.000 1.077 1913 L CA 1.320 56.241 54.840 0.136 0.000 0.747 1913 L CB -0.409 41.755 42.059 0.174 0.000 0.896 1913 L HN 0.221 nan 8.230 nan 0.000 0.432 1914 R N -0.172 120.326 120.500 -0.003 0.000 2.090 1914 R HA -0.073 4.267 4.340 0.000 0.000 0.228 1914 R C 2.269 178.547 176.300 -0.037 0.000 1.110 1914 R CA 1.131 57.228 56.100 -0.005 0.000 0.973 1914 R CB -0.316 29.989 30.300 0.008 0.000 0.869 1914 R HN 0.322 nan 8.270 nan 0.000 0.440 1915 I N 0.899 121.405 120.570 -0.106 0.000 2.179 1915 I HA -0.276 3.894 4.170 0.000 0.000 0.242 1915 I C 2.662 178.653 176.117 -0.211 0.000 1.088 1915 I CA 1.392 62.561 61.300 -0.219 0.000 1.357 1915 I CB -0.324 37.422 38.000 -0.423 0.000 1.051 1915 I HN 0.274 nan 8.210 nan 0.000 0.409 1916 E N 1.215 121.319 120.200 -0.160 0.000 2.058 1916 E HA -0.325 4.026 4.350 0.000 0.000 0.194 1916 E C 2.144 178.727 176.600 -0.028 0.000 0.997 1916 E CA 1.801 58.155 56.400 -0.076 0.000 0.801 1916 E CB -0.120 29.584 29.700 0.007 0.000 0.746 1916 E HN 0.460 nan 8.360 nan 0.000 0.450 1917 E N 0.476 120.670 120.200 -0.010 0.000 2.058 1917 E HA -0.299 4.051 4.350 0.000 0.000 0.194 1917 E C 2.098 178.702 176.600 0.007 0.000 0.997 1917 E CA 1.606 58.010 56.400 0.007 0.000 0.801 1917 E CB -0.149 29.559 29.700 0.014 0.000 0.746 1917 E HN 0.383 nan 8.360 nan 0.000 0.450 1918 E N 0.223 120.425 120.200 0.002 0.000 2.110 1918 E HA -0.183 4.167 4.350 0.000 0.000 0.193 1918 E C 2.292 178.909 176.600 0.029 0.000 0.988 1918 E CA 0.911 57.326 56.400 0.025 0.000 0.804 1918 E CB -0.058 29.674 29.700 0.053 0.000 0.745 1918 E HN 0.354 nan 8.360 nan 0.000 0.458 1919 L N -0.087 121.135 121.223 -0.003 0.000 2.156 1919 L HA 0.024 4.364 4.340 0.000 0.000 0.208 1919 L C 1.797 178.692 176.870 0.041 0.000 1.095 1919 L CA 0.621 55.472 54.840 0.018 0.000 0.770 1919 L CB -0.766 41.274 42.059 -0.031 0.000 0.914 1919 L HN 0.478 nan 8.230 nan 0.000 0.439 1920 G N 1.382 110.200 108.800 0.029 0.000 2.591 1920 G HA2 -0.455 3.505 3.960 0.000 0.000 0.298 1920 G HA3 -0.455 3.505 3.960 0.000 0.000 0.298 1920 G C 0.482 175.409 174.900 0.044 0.000 1.195 1920 G CA 0.529 45.650 45.100 0.035 0.000 0.989 1920 G HN 0.488 nan 8.290 nan 0.000 0.551 1921 D N 0.960 121.387 120.400 0.046 0.000 2.371 1921 D HA -0.041 4.599 4.640 0.000 0.000 0.221 1921 D C 1.394 177.730 176.300 0.060 0.000 0.986 1921 D CA 1.118 55.147 54.000 0.048 0.000 0.899 1921 D CB -0.634 40.190 40.800 0.040 0.000 0.902 1921 D HN 0.601 nan 8.370 nan 0.000 0.530 1922 N N -0.016 118.730 118.700 0.077 0.000 2.484 1922 N HA 0.272 5.012 4.740 0.000 0.000 0.245 1922 N C -0.780 174.811 175.510 0.135 0.000 1.184 1922 N CA -0.232 52.882 53.050 0.108 0.000 0.884 1922 N CB -0.016 38.558 38.487 0.145 0.000 1.182 1922 N HN 0.207 nan 8.380 nan 0.000 0.493 1923 A N 0.059 122.939 122.820 0.100 0.000 2.594 1923 A HA 0.558 4.878 4.320 0.000 0.000 0.295 1923 A C -0.999 176.643 177.584 0.097 0.000 1.071 1923 A CA -0.623 51.477 52.037 0.106 0.000 0.685 1923 A CB 1.510 20.561 19.000 0.084 0.000 1.285 1923 A HN 0.083 nan 8.150 nan 0.000 0.405 1924 V N -1.280 118.700 119.914 0.109 0.000 2.925 1924 V HA 0.868 4.988 4.120 0.000 0.000 0.311 1924 V C -0.806 175.405 176.094 0.195 0.000 1.104 1924 V CA -0.852 61.526 62.300 0.129 0.000 0.954 1924 V CB 1.580 33.453 31.823 0.082 0.000 1.022 1924 V HN 1.296 nan 8.190 nan 0.000 0.427 1925 F N 3.677 123.667 119.950 0.068 0.000 2.404 1925 F HA 0.772 5.299 4.527 0.000 0.000 0.345 1925 F C 1.269 177.129 175.800 0.099 0.000 1.110 1925 F CA -0.073 57.983 58.000 0.093 0.000 1.130 1925 F CB 1.747 40.803 39.000 0.094 0.000 1.129 1925 F HN 0.901 nan 8.300 nan 0.000 0.500 1926 A N 5.065 127.589 122.820 -0.494 0.000 1.908 1926 A HA 0.176 4.496 4.320 0.000 0.000 0.218 1926 A C 1.971 179.307 177.584 -0.412 0.000 1.181 1926 A CA 1.599 53.419 52.037 -0.360 0.000 0.627 1926 A CB -1.621 17.251 19.000 -0.215 0.000 0.818 1926 A HN 1.726 nan 8.150 nan 0.000 0.445 1927 G N -0.683 107.523 108.800 -0.991 0.000 2.634 1927 G HA2 -0.408 3.552 3.960 0.000 0.000 0.309 1927 G HA3 -0.408 3.552 3.960 0.000 0.000 0.309 1927 G C 0.612 175.532 174.900 0.033 0.000 1.265 1927 G CA 0.718 45.620 45.100 -0.330 0.000 0.998 1927 G HN 0.558 nan 8.290 nan 0.000 0.551 1928 E N 1.397 121.664 120.200 0.112 0.000 2.333 1928 E HA -0.056 4.294 4.350 0.000 0.000 0.198 1928 E C 1.339 177.977 176.600 0.063 0.000 1.007 1928 E CA 0.851 57.352 56.400 0.169 0.000 0.845 1928 E CB -0.123 29.640 29.700 0.105 0.000 0.766 1928 E HN 0.417 nan 8.360 nan 0.000 0.507 1929 N N 0.963 119.670 118.700 0.010 0.000 2.295 1929 N HA 0.008 4.748 4.740 0.000 0.000 0.221 1929 N C 0.996 176.453 175.510 -0.088 0.000 1.129 1929 N CA 0.002 53.011 53.050 -0.068 0.000 0.836 1929 N CB -0.024 38.454 38.487 -0.016 0.000 1.040 1929 N HN 0.261 nan 8.380 nan 0.000 0.494 1930 F N 0.922 120.877 119.950 0.009 0.000 2.120 1930 F HA -0.219 4.308 4.527 0.000 0.000 0.300 1930 F C 2.376 178.217 175.800 0.069 0.000 1.095 1930 F CA 1.269 59.289 58.000 0.033 0.000 1.249 1930 F CB -0.891 38.174 39.000 0.108 0.000 0.995 1930 F HN 0.103 nan 8.300 nan 0.000 0.480 1931 H N -0.315 118.323 119.070 -0.721 0.000 2.353 1931 H HA -0.158 4.398 4.556 0.000 0.000 0.298 1931 H C 0.828 175.968 175.328 -0.314 0.000 1.103 1931 H CA 2.318 58.075 56.048 -0.484 0.000 1.293 1931 H CB -0.470 28.844 29.762 -0.745 0.000 1.372 1931 H HN 0.378 nan 8.280 nan 0.000 0.501 1932 H N -0.666 118.314 119.070 -0.150 0.000 2.507 1932 H HA 0.246 4.802 4.556 0.000 0.000 0.281 1932 H C 1.724 176.992 175.328 -0.100 0.000 1.160 1932 H CA 0.415 56.381 56.048 -0.137 0.000 0.981 1932 H CB 0.056 29.766 29.762 -0.085 0.000 1.665 1932 H HN 0.560 nan 8.280 nan 0.000 0.554 1933 G N 1.205 110.023 108.800 0.029 0.000 2.469 1933 G HA2 -0.306 3.654 3.960 0.000 0.000 0.220 1933 G HA3 -0.306 3.654 3.960 0.000 0.000 0.220 1933 G C 1.493 176.348 174.900 -0.075 0.000 1.136 1933 G CA 1.056 46.159 45.100 0.004 0.000 0.759 1933 G HN 0.485 nan 8.290 nan 0.000 0.562 1934 D N 0.753 121.038 120.400 -0.191 0.000 2.310 1934 D HA -0.074 4.566 4.640 0.000 0.000 0.212 1934 D C 1.833 177.969 176.300 -0.275 0.000 0.965 1934 D CA 0.725 54.495 54.000 -0.384 0.000 0.879 1934 D CB -0.350 39.834 40.800 -1.027 0.000 0.921 1934 D HN 0.325 nan 8.370 nan 0.000 0.510 1935 K N -0.033 120.261 120.400 -0.176 0.000 2.444 1935 K HA 0.191 4.511 4.320 0.000 0.000 0.193 1935 K C 0.935 177.476 176.600 -0.099 0.000 1.024 1935 K CA -0.143 56.059 56.287 -0.142 0.000 1.077 1935 K CB 0.508 32.925 32.500 -0.137 0.000 0.833 1935 K HN 0.198 nan 8.250 nan 0.000 0.517 1936 L N 0.000 121.173 121.223 -0.084 0.000 2.949 1936 L HA 0.000 4.340 4.340 0.000 0.000 0.249 1936 L CA 0.000 54.806 54.840 -0.057 0.000 0.813 1936 L CB 0.000 42.037 42.059 -0.037 0.000 0.961 1936 L HN 0.000 nan 8.230 nan 0.000 0.502