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 1gc3_1_F DATA FIRST_RESID 2501 DATA SEQUENCE MRGLSRRVQA MKPDAVVAVN AKALELRRQG VDLVALTAGE PDFDTPEHVK DATA SEQUENCE EAARRALAQG KTKYAPPAGI PELREALAEK FRRENGLSVT PEETIVTVGG DATA SEQUENCE SQALFNLFQA ILDPGDEVIV LSPYWVSYPE MVRFAGGVVV EVETLPEEGF DATA SEQUENCE VPDPERVRRA ITPRTKALVV NSPNNPTGAV YPKEVLEALA RLAVEHDFYL DATA SEQUENCE VSDEIYEHLL YEGEHFSPGR VAPEHTLTVN GAAKAFAMTG WRIGYACGPK DATA SEQUENCE EVIKAMASVS RQSTTSPDTI AQWATLEALT NQEASRAFVE MAREAYRRRR DATA SEQUENCE DLLLEGLTAL GLKAVRPSGA FYVLMDTSPI APDEVRAAER LLEAGVAVVP DATA SEQUENCE GTDFAAFGHV RLSYATSEEN LRKALERFAR VL 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 2501 M HA 0.000 nan 4.480 nan 0.000 0.227 2501 M C 0.000 176.302 176.300 0.003 0.000 1.140 2501 M CA 0.000 55.301 55.300 0.001 0.000 0.988 2501 M CB 0.000 32.600 32.600 0.000 0.000 1.302 2502 R N -0.113 120.389 120.500 0.003 0.000 2.707 2502 R HA 0.764 5.104 4.340 -0.000 0.000 0.272 2502 R C -1.027 175.275 176.300 0.004 0.000 1.011 2502 R CA -0.269 55.833 56.100 0.004 0.000 0.893 2502 R CB 2.560 32.863 30.300 0.005 0.000 1.233 2502 R HN 0.933 nan 8.270 nan 0.000 0.464 2503 G N 1.113 109.917 108.800 0.006 0.000 2.339 2503 G HA2 0.068 4.028 3.960 -0.000 0.000 0.381 2503 G HA3 0.068 4.028 3.960 -0.000 0.000 0.381 2503 G C -1.362 173.542 174.900 0.007 0.000 1.400 2503 G CA -1.073 44.031 45.100 0.006 0.000 1.002 2503 G HN 0.321 nan 8.290 nan 0.000 0.633 2504 L N 0.686 121.914 121.223 0.009 0.000 2.466 2504 L HA 0.526 4.866 4.340 -0.000 0.000 0.257 2504 L C 1.634 178.507 176.870 0.004 0.000 1.189 2504 L CA -0.260 54.587 54.840 0.012 0.000 0.813 2504 L CB 1.147 43.217 42.059 0.018 0.000 1.118 2504 L HN 0.903 nan 8.230 nan 0.000 0.471 2505 S N 0.471 116.175 115.700 0.005 0.000 2.592 2505 S HA 0.176 4.646 4.470 -0.000 0.000 0.271 2505 S C 0.849 175.431 174.600 -0.031 0.000 1.326 2505 S CA -0.672 57.518 58.200 -0.017 0.000 1.024 2505 S CB 1.447 64.633 63.200 -0.023 0.000 0.921 2505 S HN 0.604 nan 8.310 nan 0.000 0.527 2506 R N 1.149 121.617 120.500 -0.052 0.000 2.235 2506 R HA -0.053 4.287 4.340 -0.000 0.000 0.213 2506 R C 2.298 178.547 176.300 -0.085 0.000 1.059 2506 R CA 1.124 57.190 56.100 -0.057 0.000 0.997 2506 R CB -0.291 29.974 30.300 -0.057 0.000 0.884 2506 R HN 0.938 nan 8.270 nan 0.000 0.462 2507 R N -1.112 119.298 120.500 -0.150 0.000 2.100 2507 R HA 0.028 4.368 4.340 -0.000 0.000 0.220 2507 R C 1.974 178.205 176.300 -0.115 0.000 1.091 2507 R CA 0.894 56.834 56.100 -0.268 0.000 0.986 2507 R CB -0.670 29.260 30.300 -0.617 0.000 0.888 2507 R HN -0.059 nan 8.270 nan 0.000 0.444 2508 V N 1.565 121.478 119.914 -0.000 0.000 2.488 2508 V HA -0.138 3.982 4.120 -0.000 0.000 0.246 2508 V C 2.317 178.468 176.094 0.095 0.000 1.046 2508 V CA 1.627 64.021 62.300 0.158 0.000 1.053 2508 V CB -0.126 31.791 31.823 0.157 0.000 0.679 2508 V HN 0.398 nan 8.190 nan 0.000 0.458 2509 Q N -0.371 119.454 119.800 0.042 0.000 2.046 2509 Q HA -0.135 4.205 4.340 -0.000 0.000 0.200 2509 Q C 2.338 178.353 176.000 0.026 0.000 0.975 2509 Q CA 1.660 57.479 55.803 0.027 0.000 0.836 2509 Q CB -0.375 28.369 28.738 0.009 0.000 0.896 2509 Q HN 0.658 nan 8.270 nan 0.000 0.428 2510 A N 1.510 124.339 122.820 0.015 0.000 2.076 2510 A HA -0.114 4.206 4.320 -0.000 0.000 0.220 2510 A C 1.361 178.964 177.584 0.033 0.000 1.160 2510 A CA 0.684 52.727 52.037 0.010 0.000 0.653 2510 A CB -0.748 18.242 19.000 -0.017 0.000 0.801 2510 A HN 0.501 nan 8.150 nan 0.000 0.455 2511 M N -0.412 119.233 119.600 0.073 0.000 2.235 2511 M HA 0.432 4.912 4.480 -0.000 0.000 0.351 2511 M C -0.134 176.193 176.300 0.044 0.000 1.178 2511 M CA -0.463 54.890 55.300 0.087 0.000 1.143 2511 M CB 0.615 33.326 32.600 0.184 0.000 1.530 2511 M HN 0.143 nan 8.290 nan 0.000 0.461 2512 K N 3.657 124.067 120.400 0.018 0.000 2.118 2512 K HA 0.580 4.900 4.320 -0.000 0.000 0.267 2512 K C -2.427 174.161 176.600 -0.020 0.000 0.991 2512 K CA -1.380 54.906 56.287 -0.002 0.000 0.916 2512 K CB 0.693 33.189 32.500 -0.006 0.000 1.041 2512 K HN 0.552 nan 8.250 nan 0.000 0.455 2513 P HA -0.080 nan 4.420 nan 0.000 0.270 2513 P C -0.914 176.361 177.300 -0.041 0.000 1.221 2513 P CA 0.008 63.095 63.100 -0.022 0.000 0.788 2513 P CB 0.394 32.090 31.700 -0.007 0.000 0.904 2514 D N 0.222 120.599 120.400 -0.038 0.000 2.339 2514 D HA 0.212 4.852 4.640 -0.000 0.000 0.241 2514 D C 1.322 177.609 176.300 -0.022 0.000 1.183 2514 D CA -0.167 53.804 54.000 -0.049 0.000 0.859 2514 D CB 1.265 42.041 40.800 -0.039 0.000 1.067 2514 D HN 0.305 nan 8.370 nan 0.000 0.484 2515 A N 3.438 126.236 122.820 -0.037 0.000 1.971 2515 A HA -0.210 4.110 4.320 -0.000 0.000 0.222 2515 A C 1.971 179.593 177.584 0.064 0.000 1.182 2515 A CA 1.910 53.956 52.037 0.015 0.000 0.649 2515 A CB -0.287 18.718 19.000 0.007 0.000 0.818 2515 A HN 0.498 nan 8.150 nan 0.000 0.458 2516 V N -1.647 118.311 119.914 0.072 0.000 3.471 2516 V HA 0.075 4.195 4.120 -0.000 0.000 0.258 2516 V C 1.980 178.117 176.094 0.071 0.000 1.192 2516 V CA 1.407 63.766 62.300 0.098 0.000 1.116 2516 V CB 0.501 32.414 31.823 0.150 0.000 0.792 2516 V HN 0.259 nan 8.190 nan 0.000 0.459 2517 V N 0.400 120.342 119.914 0.047 0.000 2.719 2517 V HA 0.073 4.193 4.120 -0.000 0.000 0.252 2517 V C 2.557 178.670 176.094 0.031 0.000 1.065 2517 V CA 1.756 64.077 62.300 0.035 0.000 1.086 2517 V CB 0.046 31.880 31.823 0.018 0.000 0.700 2517 V HN 0.649 nan 8.190 nan 0.000 0.467 2518 A N 0.391 123.230 122.820 0.031 0.000 1.825 2518 A HA -0.139 4.181 4.320 -0.000 0.000 0.214 2518 A C 2.302 179.907 177.584 0.036 0.000 1.206 2518 A CA 2.361 54.415 52.037 0.030 0.000 0.609 2518 A CB -1.081 17.937 19.000 0.029 0.000 0.851 2518 A HN 0.675 nan 8.150 nan 0.000 0.445 2519 V N -0.563 119.379 119.914 0.047 0.000 2.453 2519 V HA -0.315 3.804 4.120 -0.000 0.000 0.252 2519 V C 2.070 178.191 176.094 0.045 0.000 1.068 2519 V CA 2.469 64.799 62.300 0.049 0.000 1.070 2519 V CB -1.522 30.338 31.823 0.062 0.000 0.664 2519 V HN 0.477 nan 8.190 nan 0.000 0.461 2520 N N 1.502 120.228 118.700 0.045 0.000 2.006 2520 N HA -0.122 4.618 4.740 -0.000 0.000 0.196 2520 N C 2.011 177.539 175.510 0.030 0.000 1.057 2520 N CA 2.386 55.459 53.050 0.039 0.000 0.853 2520 N CB -0.976 37.535 38.487 0.040 0.000 1.051 2520 N HN 0.551 nan 8.380 nan 0.000 0.423 2521 A N 1.178 124.014 122.820 0.026 0.000 1.917 2521 A HA -0.217 4.103 4.320 -0.000 0.000 0.219 2521 A C 1.704 179.300 177.584 0.020 0.000 1.182 2521 A CA 2.254 54.304 52.037 0.020 0.000 0.633 2521 A CB -0.672 18.338 19.000 0.017 0.000 0.819 2521 A HN 0.629 nan 8.150 nan 0.000 0.448 2522 K N -0.464 119.951 120.400 0.024 0.000 2.591 2522 K HA 0.502 4.822 4.320 -0.000 0.000 0.197 2522 K C 0.972 177.587 176.600 0.025 0.000 1.026 2522 K CA 0.650 56.951 56.287 0.023 0.000 1.127 2522 K CB -0.105 32.410 32.500 0.025 0.000 0.871 2522 K HN 0.332 nan 8.250 nan 0.000 0.507 2523 A N 1.293 124.128 122.820 0.025 0.000 3.280 2523 A HA 0.192 4.512 4.320 -0.000 0.000 0.203 2523 A C 0.376 177.971 177.584 0.019 0.000 2.143 2523 A CA -0.379 51.673 52.037 0.025 0.000 1.168 2523 A CB -0.371 18.644 19.000 0.026 0.000 1.267 2523 A HN 0.245 nan 8.150 nan 0.000 0.436 2524 L N 1.421 122.654 121.223 0.016 0.000 8.122 2524 L HA -0.199 4.141 4.340 -0.000 0.000 0.365 2524 L C 0.642 177.518 176.870 0.011 0.000 1.800 2524 L CA 2.294 57.142 54.840 0.013 0.000 0.466 2524 L CB -2.622 39.444 42.059 0.011 0.000 1.402 2524 L HN 0.916 nan 8.230 nan 0.000 0.194 2525 E N -2.581 117.626 120.200 0.012 0.000 1.624 2525 E HA 0.004 4.354 4.350 -0.000 0.000 0.181 2525 E C 0.686 177.293 176.600 0.012 0.000 0.783 2525 E CA -0.145 56.262 56.400 0.010 0.000 1.147 2525 E CB -0.787 28.919 29.700 0.011 0.000 3.415 2525 E HN 0.330 nan 8.360 nan 0.000 0.588 2526 L N 0.418 121.649 121.223 0.013 0.000 2.675 2526 L HA 0.363 4.703 4.340 -0.000 0.000 0.178 2526 L C 2.284 179.162 176.870 0.013 0.000 1.135 2526 L CA 0.457 55.306 54.840 0.015 0.000 0.855 2526 L CB 0.212 42.282 42.059 0.019 0.000 1.235 2526 L HN 0.045 nan 8.230 nan 0.000 0.499 2527 R N 0.925 121.433 120.500 0.013 0.000 2.341 2527 R HA -0.101 4.239 4.340 -0.000 0.000 0.213 2527 R C 0.744 177.048 176.300 0.008 0.000 1.082 2527 R CA 0.676 56.782 56.100 0.010 0.000 1.017 2527 R CB -0.181 30.125 30.300 0.010 0.000 0.860 2527 R HN 0.094 nan 8.270 nan 0.000 0.473 2528 R N 0.747 121.252 120.500 0.008 0.000 2.352 2528 R HA 0.081 4.421 4.340 -0.000 0.000 0.304 2528 R C -1.254 175.049 176.300 0.007 0.000 1.104 2528 R CA -0.147 55.956 56.100 0.007 0.000 0.991 2528 R CB 0.286 30.590 30.300 0.006 0.000 1.140 2528 R HN 0.407 nan 8.270 nan 0.000 0.540 2529 Q N 2.427 122.231 119.800 0.006 0.000 1.944 2529 Q HA -0.076 4.264 4.340 -0.000 0.000 0.264 2529 Q C -0.016 175.988 176.000 0.006 0.000 0.804 2529 Q CA 0.193 55.999 55.803 0.005 0.000 0.469 2529 Q CB -1.582 27.159 28.738 0.006 0.000 0.722 2529 Q HN 0.830 nan 8.270 nan 0.000 0.335 2530 G N 0.105 108.908 108.800 0.005 0.000 5.452 2530 G HA2 -0.405 3.555 3.960 -0.000 0.000 0.310 2530 G HA3 -0.405 3.555 3.960 -0.000 0.000 0.310 2530 G C 0.394 175.297 174.900 0.005 0.000 1.392 2530 G CA 0.280 45.383 45.100 0.005 0.000 0.942 2530 G HN 1.344 nan 8.290 nan 0.000 0.776 2531 V N 3.964 123.882 119.914 0.007 0.000 2.969 2531 V HA 0.118 4.238 4.120 -0.000 0.000 0.276 2531 V C 0.834 176.933 176.094 0.009 0.000 0.993 2531 V CA 1.137 63.443 62.300 0.009 0.000 1.180 2531 V CB -0.804 31.026 31.823 0.012 0.000 0.804 2531 V HN 0.790 nan 8.190 nan 0.000 0.445 2532 D N 6.406 126.809 120.400 0.006 0.000 2.264 2532 D HA 0.409 5.049 4.640 -0.000 0.000 0.250 2532 D C 0.069 176.373 176.300 0.006 0.000 1.113 2532 D CA -0.585 53.417 54.000 0.004 0.000 0.871 2532 D CB 1.974 42.774 40.800 -0.001 0.000 1.167 2532 D HN 0.449 nan 8.370 nan 0.000 0.447 2533 L N 0.076 121.304 121.223 0.009 0.000 2.664 2533 L HA 0.785 5.125 4.340 -0.000 0.000 0.253 2533 L C -0.636 176.237 176.870 0.005 0.000 1.293 2533 L CA -0.989 53.859 54.840 0.014 0.000 1.280 2533 L CB 0.550 42.624 42.059 0.024 0.000 1.993 2533 L HN 0.204 nan 8.230 nan 0.000 0.577 2534 V N -0.127 119.792 119.914 0.008 0.000 2.623 2534 V HA 0.636 4.756 4.120 -0.000 0.000 0.304 2534 V C -0.123 175.978 176.094 0.012 0.000 1.054 2534 V CA -0.435 61.861 62.300 -0.007 0.000 0.882 2534 V CB 1.490 33.293 31.823 -0.034 0.000 1.002 2534 V HN 0.903 nan 8.190 nan 0.000 0.424 2535 A N 5.605 128.430 122.820 0.008 0.000 2.540 2535 A HA 0.668 4.988 4.320 -0.000 0.000 0.340 2535 A C 0.080 177.677 177.584 0.022 0.000 1.424 2535 A CA -0.267 51.783 52.037 0.022 0.000 0.940 2535 A CB -0.083 18.929 19.000 0.019 0.000 1.149 2535 A HN 0.856 nan 8.150 nan 0.000 0.505 2536 L N 2.692 123.942 121.223 0.044 0.000 2.928 2536 L HA 0.091 4.431 4.340 -0.000 0.000 0.236 2536 L C 1.786 178.701 176.870 0.075 0.000 1.290 2536 L CA 0.399 55.270 54.840 0.051 0.000 1.099 2536 L CB -0.456 41.652 42.059 0.081 0.000 1.437 2536 L HN 0.853 nan 8.230 nan 0.000 0.493 2537 T N -3.434 111.163 114.554 0.071 0.000 3.067 2537 T HA 0.144 4.494 4.350 -0.000 0.000 0.257 2537 T C 1.173 175.945 174.700 0.119 0.000 1.105 2537 T CA 0.255 62.412 62.100 0.094 0.000 1.104 2537 T CB 0.051 68.969 68.868 0.083 0.000 0.925 2537 T HN 0.296 nan 8.240 nan 0.000 0.498 2538 A N 1.048 123.916 122.820 0.080 0.000 2.602 2538 A HA 0.370 4.690 4.320 -0.000 0.000 0.257 2538 A C 1.549 179.253 177.584 0.200 0.000 0.973 2538 A CA 0.503 52.582 52.037 0.070 0.000 0.862 2538 A CB -0.559 18.402 19.000 -0.065 0.000 0.855 2538 A HN 0.632 nan 8.150 nan 0.000 0.492 2539 G N 1.764 110.699 108.800 0.225 0.000 2.784 2539 G HA2 0.265 4.225 3.960 -0.000 0.000 0.208 2539 G HA3 0.265 4.225 3.960 -0.000 0.000 0.208 2539 G C 0.442 175.555 174.900 0.355 0.000 1.120 2539 G CA 0.493 45.842 45.100 0.416 0.000 0.774 2539 G HN 0.928 nan 8.290 nan 0.000 0.528 2540 E N 1.429 121.699 120.200 0.116 0.000 2.250 2540 E HA 0.468 4.818 4.350 -0.000 0.000 0.269 2540 E C -2.792 173.708 176.600 -0.166 0.000 1.018 2540 E CA -2.403 54.029 56.400 0.054 0.000 0.873 2540 E CB 1.890 31.637 29.700 0.079 0.000 1.134 2540 E HN -0.042 nan 8.360 nan 0.000 0.403 2541 P HA 0.006 nan 4.420 nan 0.000 0.280 2541 P C 0.080 177.400 177.300 0.033 0.000 1.244 2541 P CA -0.180 62.901 63.100 -0.032 0.000 0.784 2541 P CB 0.983 32.891 31.700 0.345 0.000 0.913 2542 D N 2.452 122.794 120.400 -0.096 0.000 2.264 2542 D HA -0.125 4.515 4.640 -0.000 0.000 0.208 2542 D C 0.367 176.604 176.300 -0.104 0.000 0.966 2542 D CA 0.532 54.438 54.000 -0.156 0.000 0.864 2542 D CB -0.462 40.172 40.800 -0.277 0.000 0.933 2542 D HN 0.274 nan 8.370 nan 0.000 0.499 2543 F N 1.273 121.319 119.950 0.161 0.000 2.539 2543 F HA 0.150 4.677 4.527 -0.000 0.000 0.340 2543 F C 1.255 177.187 175.800 0.219 0.000 1.185 2543 F CA -0.434 57.696 58.000 0.217 0.000 1.333 2543 F CB 0.328 39.534 39.000 0.342 0.000 1.152 2543 F HN -0.213 nan 8.300 nan 0.000 0.602 2544 D N -0.071 120.569 120.400 0.400 0.000 2.277 2544 D HA 0.142 4.782 4.640 -0.000 0.000 0.250 2544 D C -0.232 176.187 176.300 0.199 0.000 1.032 2544 D CA -0.360 53.787 54.000 0.244 0.000 0.947 2544 D CB 1.250 42.152 40.800 0.170 0.000 1.159 2544 D HN 0.540 nan 8.370 nan 0.000 0.460 2545 T N 0.671 115.297 114.554 0.119 0.000 2.903 2545 T HA 0.302 4.652 4.350 -0.000 0.000 0.314 2545 T C -2.261 172.265 174.700 -0.290 0.000 1.078 2545 T CA -1.068 60.971 62.100 -0.102 0.000 1.114 2545 T CB 0.624 69.485 68.868 -0.011 0.000 0.987 2545 T HN 0.137 nan 8.240 nan 0.000 0.548 2546 P HA 0.120 nan 4.420 nan 0.000 0.267 2546 P C 0.938 178.073 177.300 -0.276 0.000 1.200 2546 P CA -0.234 62.553 63.100 -0.522 0.000 0.772 2546 P CB 0.440 31.748 31.700 -0.653 0.000 0.855 2547 E N 1.671 121.823 120.200 -0.080 0.000 2.072 2547 E HA -0.206 4.144 4.350 -0.000 0.000 0.191 2547 E C 1.779 178.363 176.600 -0.026 0.000 0.985 2547 E CA 1.342 57.731 56.400 -0.019 0.000 0.801 2547 E CB -0.483 29.236 29.700 0.032 0.000 0.750 2547 E HN 0.633 nan 8.360 nan 0.000 0.452 2548 H N -0.214 118.784 119.070 -0.120 0.000 2.457 2548 H HA -0.049 4.507 4.556 -0.000 0.000 0.297 2548 H C 2.043 177.290 175.328 -0.134 0.000 1.092 2548 H CA 1.226 57.205 56.048 -0.114 0.000 1.309 2548 H CB -0.808 28.876 29.762 -0.129 0.000 1.382 2548 H HN -0.023 nan 8.280 nan 0.000 0.535 2549 V N 1.588 121.091 119.914 -0.685 0.000 2.323 2549 V HA -0.178 3.942 4.120 -0.000 0.000 0.244 2549 V C 2.686 178.628 176.094 -0.253 0.000 1.041 2549 V CA 1.757 63.698 62.300 -0.599 0.000 1.025 2549 V CB -0.452 30.882 31.823 -0.815 0.000 0.656 2549 V HN 0.267 nan 8.190 nan 0.000 0.451 2550 K N 0.147 120.483 120.400 -0.107 0.000 2.032 2550 K HA -0.277 4.043 4.320 -0.000 0.000 0.209 2550 K C 2.250 178.906 176.600 0.094 0.000 1.048 2550 K CA 2.057 58.424 56.287 0.132 0.000 0.927 2550 K CB -0.209 32.358 32.500 0.112 0.000 0.712 2550 K HN 0.415 nan 8.250 nan 0.000 0.441 2551 E N 0.941 121.158 120.200 0.029 0.000 2.051 2551 E HA -0.162 4.188 4.350 -0.000 0.000 0.192 2551 E C 1.804 178.421 176.600 0.029 0.000 0.991 2551 E CA 1.523 57.941 56.400 0.030 0.000 0.799 2551 E CB -0.209 29.505 29.700 0.024 0.000 0.748 2551 E HN 0.295 nan 8.360 nan 0.000 0.449 2552 A N 0.787 123.614 122.820 0.011 0.000 1.948 2552 A HA -0.173 4.147 4.320 -0.000 0.000 0.220 2552 A C 2.429 180.054 177.584 0.069 0.000 1.177 2552 A CA 2.310 54.361 52.037 0.024 0.000 0.636 2552 A CB -1.089 17.913 19.000 0.003 0.000 0.815 2552 A HN 0.408 nan 8.150 nan 0.000 0.449 2553 A N -0.216 122.675 122.820 0.118 0.000 1.877 2553 A HA -0.168 4.152 4.320 -0.000 0.000 0.216 2553 A C 2.235 179.887 177.584 0.113 0.000 1.186 2553 A CA 1.547 53.706 52.037 0.202 0.000 0.620 2553 A CB -0.486 18.751 19.000 0.395 0.000 0.822 2553 A HN 0.575 nan 8.150 nan 0.000 0.443 2554 R N -1.063 119.484 120.500 0.079 0.000 2.080 2554 R HA -0.159 4.181 4.340 -0.000 0.000 0.236 2554 R C 2.494 178.795 176.300 0.003 0.000 1.137 2554 R CA 1.746 57.867 56.100 0.033 0.000 0.943 2554 R CB -0.354 29.960 30.300 0.025 0.000 0.846 2554 R HN 0.480 nan 8.270 nan 0.000 0.431 2555 R N 0.453 120.948 120.500 -0.008 0.000 2.103 2555 R HA -0.192 4.147 4.340 -0.000 0.000 0.242 2555 R C 2.247 178.493 176.300 -0.092 0.000 1.142 2555 R CA 1.830 57.901 56.100 -0.049 0.000 0.960 2555 R CB -0.340 29.929 30.300 -0.052 0.000 0.858 2555 R HN 0.310 nan 8.270 nan 0.000 0.439 2556 A N 0.272 123.045 122.820 -0.079 0.000 1.898 2556 A HA -0.120 4.199 4.320 -0.000 0.000 0.216 2556 A C 2.135 179.673 177.584 -0.077 0.000 1.181 2556 A CA 1.153 53.110 52.037 -0.134 0.000 0.620 2556 A CB -0.513 18.473 19.000 -0.022 0.000 0.819 2556 A HN 0.301 nan 8.150 nan 0.000 0.442 2557 L N -0.709 120.500 121.223 -0.022 0.000 1.989 2557 L HA -0.235 4.105 4.340 -0.000 0.000 0.211 2557 L C 3.163 180.011 176.870 -0.037 0.000 1.071 2557 L CA 1.206 56.036 54.840 -0.017 0.000 0.749 2557 L CB -0.628 41.428 42.059 -0.005 0.000 0.890 2557 L HN 0.452 nan 8.230 nan 0.000 0.431 2558 A N -0.380 122.413 122.820 -0.044 0.000 1.873 2558 A HA -0.296 4.024 4.320 -0.000 0.000 0.218 2558 A C 2.150 179.695 177.584 -0.065 0.000 1.193 2558 A CA 1.903 53.911 52.037 -0.049 0.000 0.629 2558 A CB -0.659 18.312 19.000 -0.048 0.000 0.826 2558 A HN 0.524 nan 8.150 nan 0.000 0.447 2559 Q N -1.700 118.042 119.800 -0.096 0.000 2.437 2559 Q HA 0.161 4.501 4.340 -0.000 0.000 0.210 2559 Q C 1.008 176.951 176.000 -0.095 0.000 0.972 2559 Q CA 0.482 56.216 55.803 -0.116 0.000 0.903 2559 Q CB -0.194 28.430 28.738 -0.189 0.000 0.967 2559 Q HN 1.018 nan 8.270 nan 0.000 0.486 2560 G N 1.613 110.368 108.800 -0.075 0.000 2.248 2560 G HA2 -0.204 3.756 3.960 -0.000 0.000 0.252 2560 G HA3 -0.204 3.756 3.960 -0.000 0.000 0.252 2560 G C -0.273 174.601 174.900 -0.043 0.000 1.085 2560 G CA -0.302 44.769 45.100 -0.049 0.000 0.845 2560 G HN 0.065 nan 8.290 nan 0.000 0.494 2561 K N 0.976 121.342 120.400 -0.058 0.000 2.518 2561 K HA 0.306 4.626 4.320 -0.000 0.000 0.244 2561 K C 1.180 177.822 176.600 0.070 0.000 1.232 2561 K CA 0.545 56.825 56.287 -0.012 0.000 1.189 2561 K CB 0.611 33.019 32.500 -0.153 0.000 1.737 2561 K HN 0.509 nan 8.250 nan 0.000 0.333 2562 T N -1.348 113.231 114.554 0.043 0.000 3.231 2562 T HA 0.218 4.568 4.350 -0.000 0.000 0.292 2562 T C 0.091 174.786 174.700 -0.008 0.000 1.001 2562 T CA -0.350 61.766 62.100 0.026 0.000 0.920 2562 T CB 0.249 69.114 68.868 -0.005 0.000 1.140 2562 T HN -0.012 nan 8.240 nan 0.000 0.525 2563 K N 0.533 120.947 120.400 0.023 0.000 2.240 2563 K HA 0.539 4.859 4.320 -0.000 0.000 0.237 2563 K C -0.752 175.880 176.600 0.052 0.000 1.027 2563 K CA -1.069 55.213 56.287 -0.009 0.000 0.937 2563 K CB 0.229 32.755 32.500 0.043 0.000 1.171 2563 K HN 0.281 nan 8.250 nan 0.000 0.479 2564 Y N 0.816 121.149 120.300 0.054 0.000 2.632 2564 Y HA 0.139 4.689 4.550 -0.000 0.000 0.329 2564 Y C 0.735 176.668 175.900 0.055 0.000 1.174 2564 Y CA -0.424 57.706 58.100 0.049 0.000 1.469 2564 Y CB 0.459 38.942 38.460 0.038 0.000 1.242 2564 Y HN 0.463 nan 8.280 nan 0.000 0.540 2565 A N 6.304 129.264 122.820 0.233 0.000 2.252 2565 A HA 0.624 4.944 4.320 -0.000 0.000 0.305 2565 A C -2.481 175.160 177.584 0.094 0.000 1.097 2565 A CA -1.877 50.241 52.037 0.134 0.000 0.849 2565 A CB 0.248 19.302 19.000 0.090 0.000 1.142 2565 A HN 0.487 nan 8.150 nan 0.000 0.499 2566 P HA 0.180 nan 4.420 nan 0.000 0.272 2566 P C -1.814 175.498 177.300 0.020 0.000 1.230 2566 P CA -1.129 61.987 63.100 0.026 0.000 0.788 2566 P CB 0.364 32.074 31.700 0.016 0.000 0.949 2567 P HA -0.196 nan 4.420 nan 0.000 0.216 2567 P C 0.698 178.008 177.300 0.018 0.000 1.150 2567 P CA 1.692 64.797 63.100 0.010 0.000 0.837 2567 P CB -0.193 31.507 31.700 -0.001 0.000 0.786 2568 A N -0.788 122.040 122.820 0.013 0.000 2.251 2568 A HA 0.497 4.817 4.320 -0.000 0.000 0.209 2568 A C 1.064 178.657 177.584 0.014 0.000 1.187 2568 A CA 0.636 52.683 52.037 0.016 0.000 0.823 2568 A CB -0.847 18.160 19.000 0.011 0.000 0.846 2568 A HN 0.440 nan 8.150 nan 0.000 0.486 2569 G N -0.384 108.420 108.800 0.007 0.000 2.612 2569 G HA2 0.015 3.975 3.960 -0.000 0.000 0.686 2569 G HA3 0.015 3.975 3.960 -0.000 0.000 0.686 2569 G C -0.139 174.732 174.900 -0.049 0.000 1.274 2569 G CA -0.539 44.551 45.100 -0.015 0.000 0.849 2569 G HN 1.270 nan 8.290 nan 0.000 0.595 2570 I N -0.861 119.641 120.570 -0.113 0.000 2.752 2570 I HA 0.356 4.526 4.170 -0.000 0.000 0.287 2570 I C -1.030 175.001 176.117 -0.142 0.000 1.188 2570 I CA -1.434 59.771 61.300 -0.158 0.000 1.427 2570 I CB 0.589 38.374 38.000 -0.359 0.000 1.365 2570 I HN 0.294 nan 8.210 nan 0.000 0.585 2571 P HA -0.184 nan 4.420 nan 0.000 0.213 2571 P C 1.196 178.444 177.300 -0.088 0.000 1.170 2571 P CA 1.667 64.732 63.100 -0.058 0.000 0.902 2571 P CB 0.123 31.813 31.700 -0.017 0.000 0.789 2572 E N -0.687 119.442 120.200 -0.119 0.000 2.136 2572 E HA -0.201 4.149 4.350 -0.000 0.000 0.202 2572 E C 2.009 178.511 176.600 -0.164 0.000 1.019 2572 E CA 1.022 57.346 56.400 -0.126 0.000 0.819 2572 E CB -1.086 28.521 29.700 -0.154 0.000 0.739 2572 E HN 0.194 nan 8.360 nan 0.000 0.458 2573 L N 0.034 121.113 121.223 -0.240 0.000 2.131 2573 L HA -0.081 4.259 4.340 -0.000 0.000 0.206 2573 L C 2.266 179.055 176.870 -0.134 0.000 1.087 2573 L CA 1.054 55.772 54.840 -0.203 0.000 0.767 2573 L CB -0.026 41.895 42.059 -0.231 0.000 0.917 2573 L HN 0.107 nan 8.230 nan 0.000 0.441 2574 R N -0.158 120.283 120.500 -0.099 0.000 2.073 2574 R HA -0.221 4.119 4.340 -0.000 0.000 0.234 2574 R C 2.066 178.343 176.300 -0.039 0.000 1.134 2574 R CA 1.692 57.763 56.100 -0.048 0.000 0.952 2574 R CB -0.250 30.033 30.300 -0.028 0.000 0.850 2574 R HN 0.408 nan 8.270 nan 0.000 0.433 2575 E N 0.343 120.517 120.200 -0.044 0.000 2.038 2575 E HA -0.194 4.156 4.350 -0.000 0.000 0.195 2575 E C 1.964 178.542 176.600 -0.037 0.000 1.000 2575 E CA 1.420 57.804 56.400 -0.028 0.000 0.803 2575 E CB -0.093 29.594 29.700 -0.022 0.000 0.750 2575 E HN 0.375 nan 8.360 nan 0.000 0.448 2576 A N 0.468 123.249 122.820 -0.065 0.000 2.019 2576 A HA -0.157 4.163 4.320 -0.000 0.000 0.219 2576 A C 1.982 179.493 177.584 -0.121 0.000 1.164 2576 A CA 0.825 52.813 52.037 -0.081 0.000 0.644 2576 A CB -0.329 18.613 19.000 -0.095 0.000 0.805 2576 A HN 0.194 nan 8.150 nan 0.000 0.449 2577 L N -0.402 120.739 121.223 -0.137 0.000 2.007 2577 L HA -0.005 4.335 4.340 -0.000 0.000 0.205 2577 L C 2.885 179.732 176.870 -0.039 0.000 1.073 2577 L CA 2.038 56.755 54.840 -0.205 0.000 0.744 2577 L CB -1.458 40.513 42.059 -0.147 0.000 0.898 2577 L HN 0.379 nan 8.230 nan 0.000 0.435 2578 A N -1.057 121.808 122.820 0.075 0.000 2.032 2578 A HA -0.267 4.053 4.320 -0.000 0.000 0.221 2578 A C 2.232 179.877 177.584 0.101 0.000 1.165 2578 A CA 1.946 54.069 52.037 0.145 0.000 0.645 2578 A CB -0.494 18.548 19.000 0.071 0.000 0.807 2578 A HN 0.489 nan 8.150 nan 0.000 0.453 2579 E N 0.084 120.298 120.200 0.023 0.000 2.076 2579 E HA -0.119 4.231 4.350 -0.000 0.000 0.190 2579 E C 2.049 178.644 176.600 -0.009 0.000 0.979 2579 E CA 1.307 57.712 56.400 0.008 0.000 0.807 2579 E CB -0.185 29.506 29.700 -0.014 0.000 0.761 2579 E HN 0.502 nan 8.360 nan 0.000 0.454 2580 K N -0.113 120.234 120.400 -0.088 0.000 2.026 2580 K HA -0.160 4.160 4.320 -0.000 0.000 0.208 2580 K C 1.995 178.520 176.600 -0.125 0.000 1.048 2580 K CA 1.397 57.585 56.287 -0.164 0.000 0.929 2580 K CB -0.542 31.741 32.500 -0.362 0.000 0.713 2580 K HN 0.242 nan 8.250 nan 0.000 0.439 2581 F N 1.038 120.967 119.950 -0.034 0.000 2.171 2581 F HA -0.144 4.383 4.527 -0.000 0.000 0.300 2581 F C 2.907 178.698 175.800 -0.014 0.000 1.090 2581 F CA 0.880 58.868 58.000 -0.019 0.000 1.293 2581 F CB -0.093 38.892 39.000 -0.024 0.000 1.013 2581 F HN 0.063 nan 8.300 nan 0.000 0.486 2582 R N 1.002 121.602 120.500 0.168 0.000 2.056 2582 R HA -0.087 4.253 4.340 -0.000 0.000 0.227 2582 R C 2.318 178.658 176.300 0.066 0.000 1.149 2582 R CA 1.396 57.551 56.100 0.092 0.000 0.937 2582 R CB -0.792 29.546 30.300 0.064 0.000 0.835 2582 R HN 0.158 nan 8.270 nan 0.000 0.430 2583 R N 0.694 121.223 120.500 0.049 0.000 2.132 2583 R HA -0.185 4.155 4.340 -0.000 0.000 0.233 2583 R C 2.109 178.439 176.300 0.050 0.000 1.125 2583 R CA 2.515 58.638 56.100 0.039 0.000 0.914 2583 R CB -0.247 30.068 30.300 0.025 0.000 0.845 2583 R HN 0.376 nan 8.270 nan 0.000 0.431 2584 E N -1.169 119.062 120.200 0.052 0.000 2.285 2584 E HA -0.071 4.279 4.350 -0.000 0.000 0.194 2584 E C 1.077 177.721 176.600 0.075 0.000 0.997 2584 E CA 1.051 57.491 56.400 0.067 0.000 0.845 2584 E CB 0.174 29.914 29.700 0.067 0.000 0.782 2584 E HN 0.518 nan 8.360 nan 0.000 0.491 2585 N N -1.501 117.252 118.700 0.087 0.000 2.257 2585 N HA 0.114 4.854 4.740 -0.000 0.000 0.200 2585 N C 0.759 176.282 175.510 0.022 0.000 1.163 2585 N CA 0.328 53.426 53.050 0.081 0.000 0.891 2585 N CB 1.678 40.266 38.487 0.167 0.000 1.067 2585 N HN 0.134 nan 8.380 nan 0.000 0.497 2586 G N 0.627 109.449 108.800 0.036 0.000 2.159 2586 G HA2 -0.219 3.741 3.960 -0.000 0.000 0.256 2586 G HA3 -0.219 3.741 3.960 -0.000 0.000 0.256 2586 G C -0.404 174.491 174.900 -0.007 0.000 0.977 2586 G CA -0.166 44.939 45.100 0.009 0.000 0.652 2586 G HN 0.057 nan 8.290 nan 0.000 0.531 2587 L N 1.466 122.696 121.223 0.012 0.000 2.350 2587 L HA 0.610 4.950 4.340 -0.000 0.000 0.275 2587 L C 0.939 177.812 176.870 0.006 0.000 1.099 2587 L CA -0.144 54.685 54.840 -0.019 0.000 0.808 2587 L CB 1.537 43.565 42.059 -0.053 0.000 1.149 2587 L HN 0.188 nan 8.230 nan 0.000 0.442 2588 S N 2.051 117.743 115.700 -0.014 0.000 2.497 2588 S HA 0.377 4.847 4.470 -0.000 0.000 0.193 2588 S C 0.050 174.643 174.600 -0.012 0.000 1.360 2588 S CA -0.724 57.475 58.200 -0.002 0.000 1.204 2588 S CB 0.083 63.282 63.200 -0.002 0.000 1.171 2588 S HN 0.423 nan 8.310 nan 0.000 0.502 2589 V N -0.336 119.570 119.914 -0.014 0.000 3.109 2589 V HA 0.897 5.017 4.120 -0.000 0.000 0.317 2589 V C 0.266 176.361 176.094 0.001 0.000 1.074 2589 V CA -0.569 61.715 62.300 -0.027 0.000 1.033 2589 V CB 1.314 33.094 31.823 -0.071 0.000 1.111 2589 V HN 0.546 nan 8.190 nan 0.000 0.458 2590 T N -1.786 112.767 114.554 -0.003 0.000 2.910 2590 T HA 0.613 4.963 4.350 -0.000 0.000 0.287 2590 T C -1.641 173.064 174.700 0.008 0.000 1.050 2590 T CA -1.528 60.575 62.100 0.006 0.000 1.011 2590 T CB 1.741 70.610 68.868 0.001 0.000 1.195 2590 T HN 0.579 nan 8.240 nan 0.000 0.540 2591 P HA -0.128 nan 4.420 nan 0.000 0.217 2591 P C 0.989 178.293 177.300 0.005 0.000 1.148 2591 P CA 1.264 64.370 63.100 0.010 0.000 0.828 2591 P CB 0.097 31.798 31.700 0.002 0.000 0.783 2592 E N 0.565 120.765 120.200 0.001 0.000 2.338 2592 E HA -0.127 4.223 4.350 -0.000 0.000 0.197 2592 E C 1.098 177.694 176.600 -0.007 0.000 1.007 2592 E CA 0.793 57.192 56.400 -0.002 0.000 0.849 2592 E CB -0.531 29.167 29.700 -0.003 0.000 0.774 2592 E HN 0.593 nan 8.360 nan 0.000 0.506 2593 E N 0.655 120.847 120.200 -0.013 0.000 2.423 2593 E HA 0.145 4.495 4.350 -0.000 0.000 0.198 2593 E C -0.226 176.353 176.600 -0.036 0.000 1.038 2593 E CA -0.022 56.360 56.400 -0.029 0.000 1.011 2593 E CB 0.512 30.187 29.700 -0.042 0.000 1.118 2593 E HN -0.140 nan 8.360 nan 0.000 0.451 2594 T N 1.192 115.744 114.554 -0.003 0.000 2.893 2594 T HA 0.579 4.929 4.350 -0.000 0.000 0.293 2594 T C -1.249 173.478 174.700 0.045 0.000 1.027 2594 T CA -0.474 61.646 62.100 0.033 0.000 0.988 2594 T CB 1.661 70.571 68.868 0.069 0.000 1.043 2594 T HN 0.109 nan 8.240 nan 0.000 0.461 2595 I N 2.875 123.494 120.570 0.082 0.000 2.752 2595 I HA 0.678 4.848 4.170 -0.000 0.000 0.295 2595 I C -1.325 174.872 176.117 0.134 0.000 1.219 2595 I CA -0.959 60.387 61.300 0.077 0.000 1.030 2595 I CB 1.871 39.900 38.000 0.048 0.000 1.259 2595 I HN 0.413 nan 8.210 nan 0.000 0.423 2596 V N 7.331 127.309 119.914 0.107 0.000 2.313 2596 V HA 0.559 4.678 4.120 -0.000 0.000 0.278 2596 V C 0.033 176.185 176.094 0.096 0.000 1.017 2596 V CA 0.274 62.660 62.300 0.143 0.000 0.823 2596 V CB 1.377 33.272 31.823 0.118 0.000 1.010 2596 V HN 0.882 nan 8.190 nan 0.000 0.443 2597 T N 3.243 117.851 114.554 0.090 0.000 2.884 2597 T HA 0.468 4.818 4.350 -0.000 0.000 0.277 2597 T C 0.211 174.939 174.700 0.046 0.000 0.976 2597 T CA -0.551 61.584 62.100 0.060 0.000 0.956 2597 T CB 1.573 70.473 68.868 0.053 0.000 1.113 2597 T HN 0.514 nan 8.240 nan 0.000 0.554 2598 V N 2.154 122.092 119.914 0.040 0.000 1.984 2598 V HA 0.514 4.634 4.120 -0.000 0.000 0.272 2598 V C 1.255 177.361 176.094 0.019 0.000 1.706 2598 V CA 0.819 63.140 62.300 0.034 0.000 1.644 2598 V CB -1.483 30.356 31.823 0.027 0.000 1.509 2598 V HN 1.429 nan 8.190 nan 0.000 0.511 2599 G N 2.183 110.984 108.800 0.001 0.000 2.662 2599 G HA2 0.052 4.012 3.960 -0.000 0.000 0.686 2599 G HA3 0.052 4.012 3.960 -0.000 0.000 0.686 2599 G C 0.613 175.488 174.900 -0.042 0.000 1.271 2599 G CA -0.400 44.683 45.100 -0.029 0.000 0.816 2599 G HN 0.766 nan 8.290 nan 0.000 0.608 2600 G N -0.426 108.326 108.800 -0.080 0.000 2.470 2600 G HA2 0.116 4.076 3.960 -0.000 0.000 0.220 2600 G HA3 0.116 4.076 3.960 -0.000 0.000 0.220 2600 G C 1.952 176.880 174.900 0.047 0.000 1.121 2600 G CA 2.150 47.215 45.100 -0.059 0.000 0.766 2600 G HN 1.159 nan 8.290 nan 0.000 0.553 2601 S N 0.106 115.852 115.700 0.077 0.000 2.345 2601 S HA -0.137 4.333 4.470 -0.000 0.000 0.219 2601 S C 2.213 176.898 174.600 0.141 0.000 1.031 2601 S CA 1.374 59.668 58.200 0.157 0.000 0.984 2601 S CB -0.308 62.973 63.200 0.135 0.000 0.874 2601 S HN 0.585 nan 8.310 nan 0.000 0.451 2602 Q N 1.089 120.937 119.800 0.080 0.000 2.368 2602 Q HA -0.059 4.281 4.340 -0.000 0.000 0.210 2602 Q C 1.803 177.880 176.000 0.128 0.000 0.982 2602 Q CA 1.260 57.123 55.803 0.100 0.000 0.884 2602 Q CB -0.257 28.509 28.738 0.047 0.000 0.933 2602 Q HN 0.527 nan 8.270 nan 0.000 0.460 2603 A N 0.399 123.269 122.820 0.082 0.000 1.843 2603 A HA -0.062 4.258 4.320 -0.000 0.000 0.213 2603 A C 1.969 179.562 177.584 0.015 0.000 1.202 2603 A CA 0.956 53.019 52.037 0.043 0.000 0.607 2603 A CB -0.687 18.328 19.000 0.025 0.000 0.847 2603 A HN 0.435 nan 8.150 nan 0.000 0.445 2604 L N -1.784 119.471 121.223 0.055 0.000 2.079 2604 L HA -0.192 4.148 4.340 -0.000 0.000 0.210 2604 L C 2.431 179.305 176.870 0.007 0.000 1.081 2604 L CA 1.658 56.493 54.840 -0.009 0.000 0.752 2604 L CB -0.458 41.742 42.059 0.235 0.000 0.896 2604 L HN 0.532 nan 8.230 nan 0.000 0.433 2605 F N 1.189 121.165 119.950 0.044 0.000 2.009 2605 F HA -0.218 4.309 4.527 -0.000 0.000 0.293 2605 F C 2.381 178.216 175.800 0.058 0.000 1.156 2605 F CA 1.763 59.827 58.000 0.107 0.000 1.168 2605 F CB -0.418 38.617 39.000 0.058 0.000 0.981 2605 F HN 0.051 nan 8.300 nan 0.000 0.475 2606 N N 0.943 119.774 118.700 0.219 0.000 2.242 2606 N HA -0.250 4.490 4.740 -0.000 0.000 0.191 2606 N C 1.985 177.446 175.510 -0.081 0.000 1.005 2606 N CA 1.432 54.520 53.050 0.064 0.000 0.877 2606 N CB -0.713 37.835 38.487 0.101 0.000 0.983 2606 N HN 0.449 nan 8.380 nan 0.000 0.439 2607 L N -0.720 120.402 121.223 -0.169 0.000 2.005 2607 L HA -0.090 4.250 4.340 -0.000 0.000 0.207 2607 L C 1.655 178.372 176.870 -0.256 0.000 1.072 2607 L CA 1.262 55.928 54.840 -0.289 0.000 0.744 2607 L CB -0.303 41.470 42.059 -0.476 0.000 0.895 2607 L HN 0.069 nan 8.230 nan 0.000 0.433 2608 F N -0.278 119.595 119.950 -0.128 0.000 2.269 2608 F HA -0.234 4.293 4.527 -0.000 0.000 0.301 2608 F C 2.701 178.398 175.800 -0.171 0.000 1.082 2608 F CA 0.623 58.538 58.000 -0.143 0.000 1.360 2608 F CB -0.146 38.774 39.000 -0.134 0.000 1.041 2608 F HN 0.246 nan 8.300 nan 0.000 0.512 2609 Q N 0.032 119.796 119.800 -0.061 0.000 2.311 2609 Q HA -0.025 4.315 4.340 -0.000 0.000 0.203 2609 Q C 2.391 178.359 176.000 -0.053 0.000 0.954 2609 Q CA 1.105 56.853 55.803 -0.093 0.000 0.885 2609 Q CB -0.316 28.329 28.738 -0.155 0.000 0.963 2609 Q HN 0.473 nan 8.270 nan 0.000 0.471 2610 A N 1.145 123.925 122.820 -0.067 0.000 1.903 2610 A HA 0.001 4.321 4.320 -0.000 0.000 0.213 2610 A C 1.944 179.484 177.584 -0.072 0.000 1.185 2610 A CA 0.706 52.700 52.037 -0.071 0.000 0.628 2610 A CB -0.256 18.684 19.000 -0.100 0.000 0.830 2610 A HN 0.359 nan 8.150 nan 0.000 0.446 2611 I N -3.353 117.163 120.570 -0.090 0.000 4.785 2611 I HA 0.240 4.410 4.170 -0.000 0.000 0.227 2611 I C -0.023 176.108 176.117 0.022 0.000 0.968 2611 I CA -0.711 60.552 61.300 -0.062 0.000 1.561 2611 I CB -0.987 36.913 38.000 -0.167 0.000 1.418 2611 I HN -0.051 nan 8.210 nan 0.000 0.449 2612 L N 3.227 124.489 121.223 0.066 0.000 3.505 2612 L HA -0.169 4.171 4.340 -0.000 0.000 0.392 2612 L C -0.478 176.398 176.870 0.009 0.000 1.042 2612 L CA 1.175 56.043 54.840 0.046 0.000 0.788 2612 L CB -2.146 39.939 42.059 0.042 0.000 1.235 2612 L HN 0.546 nan 8.230 nan 0.000 0.694 2613 D N 5.440 125.844 120.400 0.005 0.000 2.299 2613 D HA 0.423 5.063 4.640 -0.000 0.000 0.243 2613 D C -2.308 173.978 176.300 -0.024 0.000 0.982 2613 D CA -1.808 52.187 54.000 -0.008 0.000 0.924 2613 D CB 1.658 42.461 40.800 0.003 0.000 1.238 2613 D HN 0.176 nan 8.370 nan 0.000 0.484 2614 P HA 0.094 nan 4.420 nan 0.000 0.261 2614 P C 0.633 177.910 177.300 -0.037 0.000 1.173 2614 P CA 0.944 64.018 63.100 -0.043 0.000 0.760 2614 P CB 0.462 32.136 31.700 -0.042 0.000 0.783 2615 G N 2.247 111.020 108.800 -0.046 0.000 2.225 2615 G HA2 -0.208 3.752 3.960 -0.000 0.000 0.254 2615 G HA3 -0.208 3.752 3.960 -0.000 0.000 0.254 2615 G C 0.013 174.889 174.900 -0.041 0.000 0.988 2615 G CA -0.273 44.802 45.100 -0.042 0.000 0.625 2615 G HN 0.496 nan 8.290 nan 0.000 0.527 2616 D N 1.864 122.242 120.400 -0.037 0.000 2.424 2616 D HA 0.416 5.056 4.640 -0.000 0.000 0.244 2616 D C 0.709 176.975 176.300 -0.057 0.000 1.134 2616 D CA 0.393 54.375 54.000 -0.029 0.000 0.881 2616 D CB 0.686 41.483 40.800 -0.003 0.000 1.191 2616 D HN 0.570 nan 8.370 nan 0.000 0.445 2617 E N 0.472 120.632 120.200 -0.066 0.000 2.266 2617 E HA 0.429 4.779 4.350 -0.000 0.000 0.277 2617 E C -0.686 175.846 176.600 -0.112 0.000 1.018 2617 E CA -0.808 55.534 56.400 -0.097 0.000 0.840 2617 E CB 1.869 31.507 29.700 -0.104 0.000 1.082 2617 E HN 0.069 nan 8.360 nan 0.000 0.395 2618 V N 4.514 124.346 119.914 -0.136 0.000 2.407 2618 V HA 0.275 4.395 4.120 -0.000 0.000 0.291 2618 V C -0.015 175.987 176.094 -0.153 0.000 1.018 2618 V CA -0.640 61.581 62.300 -0.132 0.000 0.842 2618 V CB 1.091 32.814 31.823 -0.167 0.000 0.996 2618 V HN 0.609 nan 8.190 nan 0.000 0.426 2619 I N 4.852 125.328 120.570 -0.157 0.000 2.588 2619 I HA 0.327 4.497 4.170 -0.000 0.000 0.283 2619 I C -0.351 175.692 176.117 -0.123 0.000 1.119 2619 I CA 0.034 61.247 61.300 -0.145 0.000 1.419 2619 I CB 1.287 39.191 38.000 -0.160 0.000 1.394 2619 I HN 0.274 nan 8.210 nan 0.000 0.562 2620 V N 7.224 127.059 119.914 -0.131 0.000 2.686 2620 V HA 0.292 4.412 4.120 -0.000 0.000 0.306 2620 V C -0.432 175.627 176.094 -0.057 0.000 1.065 2620 V CA -0.645 61.564 62.300 -0.151 0.000 0.894 2620 V CB 2.118 33.760 31.823 -0.301 0.000 1.004 2620 V HN 0.392 nan 8.190 nan 0.000 0.424 2621 L N 4.713 125.953 121.223 0.029 0.000 2.268 2621 L HA 0.469 4.809 4.340 -0.000 0.000 0.289 2621 L C 0.788 177.811 176.870 0.255 0.000 1.064 2621 L CA 0.320 55.233 54.840 0.121 0.000 0.824 2621 L CB 1.070 43.190 42.059 0.100 0.000 1.202 2621 L HN 0.760 nan 8.230 nan 0.000 0.433 2622 S N 3.154 119.023 115.700 0.281 0.000 2.584 2622 S HA 0.595 5.065 4.470 -0.000 0.000 0.273 2622 S C -2.484 172.167 174.600 0.085 0.000 1.311 2622 S CA -1.415 56.939 58.200 0.257 0.000 1.034 2622 S CB 0.762 64.093 63.200 0.218 0.000 0.939 2622 S HN 0.284 nan 8.310 nan 0.000 0.513 2623 P HA 0.270 nan 4.420 nan 0.000 0.269 2623 P C -1.040 176.260 177.300 0.001 0.000 1.209 2623 P CA -0.050 62.929 63.100 -0.202 0.000 0.776 2623 P CB 0.024 31.482 31.700 -0.402 0.000 0.876 2624 Y N -0.866 119.498 120.300 0.106 0.000 2.562 2624 Y HA 0.562 5.112 4.550 -0.000 0.000 0.345 2624 Y C -1.255 174.818 175.900 0.288 0.000 1.045 2624 Y CA -2.031 56.207 58.100 0.231 0.000 1.028 2624 Y CB 0.326 38.920 38.460 0.223 0.000 1.297 2624 Y HN 0.344 nan 8.280 nan 0.000 0.463 2625 W N 4.801 126.307 121.300 0.343 0.000 2.397 2625 W HA 0.288 4.948 4.660 -0.000 0.000 0.327 2625 W C 0.731 177.154 176.519 -0.159 0.000 1.421 2625 W CA -0.380 56.965 57.345 -0.000 0.000 1.288 2625 W CB 0.536 29.821 29.460 -0.292 0.000 1.312 2625 W HN 0.685 nan 8.180 nan 0.000 0.559 2626 V N 4.540 123.884 119.914 -0.950 0.000 2.295 2626 V HA -0.462 3.658 4.120 -0.000 0.000 0.262 2626 V C 2.246 177.851 176.094 -0.815 0.000 1.098 2626 V CA 2.807 64.517 62.300 -0.983 0.000 1.095 2626 V CB -1.272 29.959 31.823 -0.986 0.000 0.704 2626 V HN 0.764 nan 8.190 nan 0.000 0.454 2627 S N -2.698 112.156 115.700 -1.410 0.000 2.496 2627 S HA 0.021 4.491 4.470 -0.000 0.000 0.224 2627 S C 1.551 175.836 174.600 -0.525 0.000 0.996 2627 S CA 0.467 58.083 58.200 -0.973 0.000 0.927 2627 S CB -0.280 62.264 63.200 -1.093 0.000 0.774 2627 S HN 0.687 nan 8.310 nan 0.000 0.524 2628 Y N 2.286 122.351 120.300 -0.392 0.000 2.096 2628 Y HA -0.206 4.344 4.550 -0.000 0.000 0.278 2628 Y C -0.119 175.624 175.900 -0.261 0.000 1.192 2628 Y CA 1.623 59.642 58.100 -0.134 0.000 1.143 2628 Y CB -1.372 37.070 38.460 -0.029 0.000 0.963 2628 Y HN 0.350 nan 8.280 nan 0.000 0.505 2629 P HA -0.102 nan 4.420 nan 0.000 0.219 2629 P C 0.929 178.131 177.300 -0.164 0.000 1.154 2629 P CA 1.410 64.370 63.100 -0.234 0.000 0.826 2629 P CB 0.080 31.614 31.700 -0.276 0.000 0.795 2630 E N 0.452 120.567 120.200 -0.141 0.000 2.160 2630 E HA -0.140 4.210 4.350 -0.000 0.000 0.195 2630 E C 2.069 178.667 176.600 -0.004 0.000 0.991 2630 E CA 1.366 57.721 56.400 -0.075 0.000 0.810 2630 E CB -0.512 29.116 29.700 -0.119 0.000 0.742 2630 E HN 0.494 nan 8.360 nan 0.000 0.466 2631 M N -1.912 117.665 119.600 -0.038 0.000 2.516 2631 M HA 0.103 4.583 4.480 -0.000 0.000 0.259 2631 M C 2.029 178.230 176.300 -0.165 0.000 1.146 2631 M CA 0.521 55.852 55.300 0.053 0.000 1.122 2631 M CB -0.035 32.702 32.600 0.228 0.000 1.341 2631 M HN -0.199 nan 8.290 nan 0.000 0.478 2632 V N 1.953 121.600 119.914 -0.446 0.000 2.283 2632 V HA -0.157 3.963 4.120 -0.000 0.000 0.243 2632 V C 2.651 178.546 176.094 -0.331 0.000 1.039 2632 V CA 1.898 63.747 62.300 -0.751 0.000 1.016 2632 V CB -0.622 30.816 31.823 -0.642 0.000 0.650 2632 V HN 0.516 nan 8.190 nan 0.000 0.449 2633 R N -1.129 119.257 120.500 -0.190 0.000 2.096 2633 R HA -0.182 4.158 4.340 -0.000 0.000 0.235 2633 R C 2.231 178.515 176.300 -0.026 0.000 1.127 2633 R CA 1.852 57.894 56.100 -0.097 0.000 0.968 2633 R CB -0.559 29.704 30.300 -0.062 0.000 0.861 2633 R HN 0.481 nan 8.270 nan 0.000 0.440 2634 F N 1.337 121.230 119.950 -0.096 0.000 2.161 2634 F HA -0.211 4.316 4.527 -0.000 0.000 0.300 2634 F C 2.263 178.024 175.800 -0.065 0.000 1.089 2634 F CA 1.550 59.529 58.000 -0.036 0.000 1.282 2634 F CB -0.137 38.900 39.000 0.061 0.000 1.010 2634 F HN 0.001 nan 8.300 nan 0.000 0.485 2635 A N -0.713 122.122 122.820 0.024 0.000 2.119 2635 A HA 0.301 4.621 4.320 -0.000 0.000 0.217 2635 A C 1.791 179.317 177.584 -0.096 0.000 1.153 2635 A CA 1.071 53.072 52.037 -0.060 0.000 0.692 2635 A CB -1.066 17.895 19.000 -0.064 0.000 0.799 2635 A HN 0.918 nan 8.150 nan 0.000 0.458 2636 G N -2.470 106.264 108.800 -0.111 0.000 2.148 2636 G HA2 0.106 4.066 3.960 -0.000 0.000 0.157 2636 G HA3 0.106 4.066 3.960 -0.000 0.000 0.157 2636 G C 0.623 175.465 174.900 -0.097 0.000 1.012 2636 G CA 0.108 45.145 45.100 -0.104 0.000 0.677 2636 G HN 1.170 nan 8.290 nan 0.000 0.506 2637 G N -1.159 107.567 108.800 -0.123 0.000 2.553 2637 G HA2 0.628 4.588 3.960 -0.000 0.000 0.278 2637 G HA3 0.628 4.588 3.960 -0.000 0.000 0.278 2637 G C -0.367 174.458 174.900 -0.125 0.000 1.349 2637 G CA 0.072 45.089 45.100 -0.138 0.000 1.037 2637 G HN 1.077 nan 8.290 nan 0.000 0.508 2638 V N 0.613 120.448 119.914 -0.131 0.000 2.555 2638 V HA 0.241 4.361 4.120 -0.000 0.000 0.283 2638 V C 0.194 176.209 176.094 -0.132 0.000 1.020 2638 V CA -0.741 61.492 62.300 -0.112 0.000 0.883 2638 V CB 1.224 32.996 31.823 -0.086 0.000 1.030 2638 V HN 0.821 nan 8.190 nan 0.000 0.448 2639 V N 3.364 123.191 119.914 -0.146 0.000 2.655 2639 V HA 0.622 4.742 4.120 -0.000 0.000 0.300 2639 V C -0.069 175.951 176.094 -0.123 0.000 1.044 2639 V CA -0.108 62.092 62.300 -0.167 0.000 1.095 2639 V CB 1.251 32.953 31.823 -0.201 0.000 0.952 2639 V HN 0.473 nan 8.190 nan 0.000 0.485 2640 V N 5.619 125.458 119.914 -0.125 0.000 2.447 2640 V HA 0.450 4.570 4.120 -0.000 0.000 0.292 2640 V C -0.089 175.951 176.094 -0.089 0.000 1.021 2640 V CA -0.437 61.808 62.300 -0.091 0.000 0.850 2640 V CB 1.477 33.239 31.823 -0.101 0.000 1.005 2640 V HN 1.172 nan 8.190 nan 0.000 0.426 2641 E N 4.692 124.862 120.200 -0.050 0.000 2.191 2641 E HA 0.779 5.129 4.350 -0.000 0.000 0.274 2641 E C -1.463 175.149 176.600 0.021 0.000 0.948 2641 E CA -0.834 55.554 56.400 -0.020 0.000 0.802 2641 E CB 2.420 32.130 29.700 0.017 0.000 1.137 2641 E HN 0.298 nan 8.360 nan 0.000 0.397 2642 V N 2.243 122.175 119.914 0.030 0.000 2.448 2642 V HA 0.233 4.353 4.120 -0.000 0.000 0.295 2642 V C -0.064 176.074 176.094 0.074 0.000 1.025 2642 V CA -0.882 61.441 62.300 0.038 0.000 0.859 2642 V CB 1.093 32.921 31.823 0.009 0.000 0.988 2642 V HN 0.851 nan 8.190 nan 0.000 0.431 2643 E N 3.373 123.621 120.200 0.081 0.000 2.374 2643 E HA 0.484 4.834 4.350 -0.000 0.000 0.260 2643 E C -0.049 176.611 176.600 0.101 0.000 1.101 2643 E CA -0.190 56.272 56.400 0.104 0.000 0.907 2643 E CB 1.239 31.004 29.700 0.108 0.000 1.014 2643 E HN 0.845 nan 8.360 nan 0.000 0.427 2644 T N 2.591 117.237 114.554 0.155 0.000 2.815 2644 T HA 0.419 4.769 4.350 -0.000 0.000 0.289 2644 T C -0.371 174.482 174.700 0.254 0.000 1.000 2644 T CA -1.090 61.117 62.100 0.177 0.000 0.958 2644 T CB 0.394 69.406 68.868 0.240 0.000 0.944 2644 T HN 0.237 nan 8.240 nan 0.000 0.442 2645 L N 5.318 126.597 121.223 0.093 0.000 2.461 2645 L HA 0.312 4.652 4.340 -0.000 0.000 0.272 2645 L C -0.989 175.705 176.870 -0.294 0.000 1.197 2645 L CA -2.036 52.804 54.840 0.001 0.000 0.836 2645 L CB 0.273 42.315 42.059 -0.027 0.000 1.105 2645 L HN 0.519 nan 8.230 nan 0.000 0.477 2646 P HA -0.016 nan 4.420 nan 0.000 0.249 2646 P C 0.532 177.538 177.300 -0.490 0.000 1.229 2646 P CA 0.508 63.015 63.100 -0.989 0.000 0.788 2646 P CB 0.467 31.881 31.700 -0.477 0.000 1.072 2647 E N 1.295 121.335 120.200 -0.266 0.000 2.166 2647 E HA -0.103 4.247 4.350 -0.000 0.000 0.192 2647 E C 1.066 177.573 176.600 -0.155 0.000 0.967 2647 E CA 0.716 57.025 56.400 -0.152 0.000 0.840 2647 E CB -0.742 28.910 29.700 -0.081 0.000 0.795 2647 E HN 0.473 nan 8.360 nan 0.000 0.470 2648 E N 1.498 121.599 120.200 -0.165 0.000 2.296 2648 E HA 0.267 4.617 4.350 -0.000 0.000 0.196 2648 E C 0.657 177.168 176.600 -0.148 0.000 1.143 2648 E CA 0.163 56.493 56.400 -0.116 0.000 1.145 2648 E CB -0.495 29.162 29.700 -0.071 0.000 1.215 2648 E HN 0.227 nan 8.360 nan 0.000 0.447 2649 G N 1.746 110.392 108.800 -0.256 0.000 2.449 2649 G HA2 -0.349 3.611 3.960 -0.000 0.000 0.304 2649 G HA3 -0.349 3.611 3.960 -0.000 0.000 0.304 2649 G C 0.189 175.038 174.900 -0.084 0.000 0.962 2649 G CA 0.457 45.406 45.100 -0.251 0.000 0.943 2649 G HN 0.582 nan 8.290 nan 0.000 0.514 2650 F N -4.152 115.822 119.950 0.040 0.000 2.667 2650 F HA -0.134 4.393 4.527 -0.000 0.000 0.250 2650 F C 0.560 176.410 175.800 0.085 0.000 1.029 2650 F CA 0.542 58.577 58.000 0.058 0.000 0.944 2650 F CB -1.462 37.587 39.000 0.083 0.000 0.994 2650 F HN 0.272 nan 8.300 nan 0.000 0.842 2651 V N 2.529 122.507 119.914 0.106 0.000 2.532 2651 V HA 0.380 4.500 4.120 -0.000 0.000 0.294 2651 V C -1.720 174.262 176.094 -0.186 0.000 1.036 2651 V CA -1.658 60.589 62.300 -0.087 0.000 0.876 2651 V CB 2.332 34.172 31.823 0.028 0.000 1.012 2651 V HN 0.151 nan 8.190 nan 0.000 0.432 2652 P HA -0.015 nan 4.420 nan 0.000 0.266 2652 P C -0.975 176.242 177.300 -0.139 0.000 1.180 2652 P CA 0.231 63.196 63.100 -0.224 0.000 0.765 2652 P CB 0.789 32.303 31.700 -0.310 0.000 0.806 2653 D N 2.806 123.161 120.400 -0.075 0.000 2.441 2653 D HA 0.256 4.896 4.640 -0.000 0.000 0.231 2653 D C -1.739 174.538 176.300 -0.039 0.000 1.073 2653 D CA -2.687 51.284 54.000 -0.048 0.000 0.850 2653 D CB 0.825 41.608 40.800 -0.029 0.000 1.062 2653 D HN -0.023 nan 8.370 nan 0.000 0.524 2654 P HA -0.216 nan 4.420 nan 0.000 0.217 2654 P C 1.007 178.301 177.300 -0.010 0.000 1.158 2654 P CA 1.211 64.300 63.100 -0.019 0.000 0.887 2654 P CB 0.356 32.049 31.700 -0.012 0.000 0.792 2655 E N -0.623 119.572 120.200 -0.008 0.000 2.209 2655 E HA -0.220 4.130 4.350 -0.000 0.000 0.196 2655 E C 1.954 178.551 176.600 -0.006 0.000 0.993 2655 E CA 1.241 57.640 56.400 -0.002 0.000 0.819 2655 E CB -0.339 29.360 29.700 -0.001 0.000 0.745 2655 E HN 0.296 nan 8.360 nan 0.000 0.477 2656 R N -1.445 119.048 120.500 -0.011 0.000 2.265 2656 R HA 0.131 4.471 4.340 -0.000 0.000 0.194 2656 R C 1.616 177.904 176.300 -0.020 0.000 0.931 2656 R CA 0.569 56.662 56.100 -0.012 0.000 1.032 2656 R CB 0.007 30.303 30.300 -0.006 0.000 0.980 2656 R HN 0.004 nan 8.270 nan 0.000 0.497 2657 V N 1.462 121.361 119.914 -0.024 0.000 2.719 2657 V HA -0.064 4.056 4.120 -0.000 0.000 0.252 2657 V C 2.598 178.662 176.094 -0.050 0.000 1.065 2657 V CA 1.703 63.984 62.300 -0.032 0.000 1.086 2657 V CB -0.541 31.270 31.823 -0.019 0.000 0.700 2657 V HN 0.379 nan 8.190 nan 0.000 0.467 2658 R N 1.784 122.259 120.500 -0.041 0.000 2.070 2658 R HA -0.164 4.176 4.340 -0.000 0.000 0.232 2658 R C 2.087 178.339 176.300 -0.080 0.000 1.138 2658 R CA 1.722 57.782 56.100 -0.066 0.000 0.936 2658 R CB -0.307 29.983 30.300 -0.017 0.000 0.839 2658 R HN 0.579 nan 8.270 nan 0.000 0.429 2659 R N 0.094 120.569 120.500 -0.041 0.000 2.845 2659 R HA 0.076 4.416 4.340 -0.000 0.000 0.220 2659 R C 0.435 176.708 176.300 -0.045 0.000 1.528 2659 R CA 0.701 56.781 56.100 -0.033 0.000 1.374 2659 R CB 0.131 30.424 30.300 -0.013 0.000 1.104 2659 R HN 0.251 nan 8.270 nan 0.000 0.510 2660 A N 0.504 123.279 122.820 -0.075 0.000 2.548 2660 A HA 0.306 4.626 4.320 -0.000 0.000 0.236 2660 A C 0.462 177.969 177.584 -0.128 0.000 1.246 2660 A CA -0.532 51.455 52.037 -0.084 0.000 0.993 2660 A CB 0.554 19.505 19.000 -0.081 0.000 1.209 2660 A HN 0.258 nan 8.150 nan 0.000 0.570 2661 I N 2.270 122.744 120.570 -0.160 0.000 2.474 2661 I HA 0.337 4.507 4.170 -0.000 0.000 0.287 2661 I C 0.675 176.725 176.117 -0.111 0.000 1.048 2661 I CA 0.300 61.472 61.300 -0.213 0.000 1.383 2661 I CB 1.467 39.274 38.000 -0.323 0.000 1.412 2661 I HN 0.363 nan 8.210 nan 0.000 0.531 2662 T N 2.748 117.243 114.554 -0.098 0.000 2.865 2662 T HA 0.416 4.766 4.350 -0.000 0.000 0.294 2662 T C -2.262 172.427 174.700 -0.019 0.000 1.119 2662 T CA -1.641 60.435 62.100 -0.039 0.000 1.007 2662 T CB 2.047 70.886 68.868 -0.047 0.000 1.225 2662 T HN 0.351 nan 8.240 nan 0.000 0.515 2663 P HA 0.072 nan 4.420 nan 0.000 0.239 2663 P C 0.835 178.141 177.300 0.010 0.000 1.184 2663 P CA 0.402 63.518 63.100 0.027 0.000 0.760 2663 P CB 0.172 31.888 31.700 0.027 0.000 0.884 2664 R N -0.832 119.658 120.500 -0.016 0.000 2.189 2664 R HA 0.121 4.461 4.340 -0.000 0.000 0.203 2664 R C 0.746 177.020 176.300 -0.043 0.000 1.012 2664 R CA 0.449 56.535 56.100 -0.023 0.000 1.015 2664 R CB -1.033 29.246 30.300 -0.035 0.000 0.938 2664 R HN 0.014 nan 8.270 nan 0.000 0.472 2665 T N 1.342 115.843 114.554 -0.089 0.000 2.738 2665 T HA -0.059 4.291 4.350 -0.000 0.000 0.277 2665 T C 0.869 175.489 174.700 -0.133 0.000 0.981 2665 T CA 0.811 62.800 62.100 -0.186 0.000 1.211 2665 T CB 0.429 69.086 68.868 -0.352 0.000 0.932 2665 T HN 0.166 nan 8.240 nan 0.000 0.522 2666 K N 1.445 121.804 120.400 -0.069 0.000 2.391 2666 K HA 0.498 4.818 4.320 -0.000 0.000 0.197 2666 K C 0.376 177.123 176.600 0.244 0.000 1.087 2666 K CA -0.018 56.335 56.287 0.109 0.000 1.012 2666 K CB 0.616 33.196 32.500 0.133 0.000 0.925 2666 K HN 0.680 nan 8.250 nan 0.000 0.547 2667 A N 0.841 123.723 122.820 0.102 0.000 2.594 2667 A HA 0.580 4.900 4.320 -0.000 0.000 0.295 2667 A C -2.236 175.397 177.584 0.082 0.000 1.071 2667 A CA -0.743 51.446 52.037 0.253 0.000 0.685 2667 A CB 1.421 20.595 19.000 0.290 0.000 1.285 2667 A HN 0.080 nan 8.150 nan 0.000 0.405 2668 L N 1.113 122.475 121.223 0.232 0.000 2.381 2668 L HA 0.851 5.191 4.340 -0.000 0.000 0.268 2668 L C -1.378 175.567 176.870 0.126 0.000 0.997 2668 L CA -0.578 54.346 54.840 0.141 0.000 0.818 2668 L CB 2.187 44.445 42.059 0.330 0.000 1.310 2668 L HN 0.526 nan 8.230 nan 0.000 0.416 2669 V N 5.460 125.388 119.914 0.025 0.000 2.357 2669 V HA 0.479 4.599 4.120 -0.000 0.000 0.281 2669 V C -0.431 175.620 176.094 -0.070 0.000 1.015 2669 V CA -0.669 61.597 62.300 -0.056 0.000 0.827 2669 V CB 1.405 33.102 31.823 -0.210 0.000 1.018 2669 V HN 0.629 nan 8.190 nan 0.000 0.432 2670 V N 5.112 125.046 119.914 0.035 0.000 2.532 2670 V HA 0.628 4.748 4.120 -0.000 0.000 0.295 2670 V C -0.290 175.888 176.094 0.141 0.000 1.041 2670 V CA -0.269 62.121 62.300 0.150 0.000 0.926 2670 V CB 1.817 33.771 31.823 0.218 0.000 0.992 2670 V HN 0.984 nan 8.190 nan 0.000 0.457 2671 N N 3.621 122.446 118.700 0.208 0.000 2.519 2671 N HA 0.466 5.206 4.740 -0.000 0.000 0.286 2671 N C -1.626 173.795 175.510 -0.150 0.000 1.079 2671 N CA -0.169 52.955 53.050 0.124 0.000 0.878 2671 N CB 1.587 40.241 38.487 0.279 0.000 1.375 2671 N HN 0.752 nan 8.380 nan 0.000 0.514 2672 S N 3.947 119.516 115.700 -0.220 0.000 2.614 2672 S HA 0.500 4.970 4.470 -0.000 0.000 0.275 2672 S C -3.047 171.513 174.600 -0.066 0.000 1.161 2672 S CA -0.946 56.987 58.200 -0.444 0.000 0.969 2672 S CB 1.664 64.456 63.200 -0.680 0.000 1.059 2672 S HN 0.325 nan 8.310 nan 0.000 0.482 2673 P HA 0.185 nan 4.420 nan 0.000 0.271 2673 P C -0.480 176.656 177.300 -0.275 0.000 1.226 2673 P CA -0.317 62.665 63.100 -0.197 0.000 0.765 2673 P CB 0.328 31.925 31.700 -0.172 0.000 0.835 2674 N N 3.641 122.167 118.700 -0.290 0.000 2.454 2674 N HA -0.029 4.711 4.740 -0.000 0.000 0.254 2674 N C -0.389 174.966 175.510 -0.257 0.000 1.228 2674 N CA 0.636 53.556 53.050 -0.217 0.000 0.900 2674 N CB 0.020 38.439 38.487 -0.113 0.000 1.089 2674 N HN 0.338 nan 8.380 nan 0.000 0.449 2675 N N 3.613 122.180 118.700 -0.223 0.000 2.410 2675 N HA 0.364 5.104 4.740 -0.000 0.000 0.287 2675 N C -2.460 172.986 175.510 -0.107 0.000 1.044 2675 N CA -1.864 50.999 53.050 -0.312 0.000 0.881 2675 N CB 2.182 40.382 38.487 -0.479 0.000 1.405 2675 N HN 0.303 nan 8.380 nan 0.000 0.490 2676 P HA 0.082 nan 4.420 nan 0.000 0.261 2676 P C 0.787 177.915 177.300 -0.286 0.000 1.268 2676 P CA 0.335 63.179 63.100 -0.426 0.000 0.833 2676 P CB 0.449 31.704 31.700 -0.742 0.000 1.231 2677 T N -1.475 112.914 114.554 -0.274 0.000 3.067 2677 T HA 0.163 4.513 4.350 -0.000 0.000 0.261 2677 T C 1.617 176.299 174.700 -0.031 0.000 1.110 2677 T CA 1.497 63.448 62.100 -0.249 0.000 1.113 2677 T CB -1.038 67.473 68.868 -0.595 0.000 0.917 2677 T HN 0.211 nan 8.240 nan 0.000 0.499 2678 G N 0.907 109.684 108.800 -0.038 0.000 2.184 2678 G HA2 -0.166 3.794 3.960 -0.000 0.000 0.264 2678 G HA3 -0.166 3.794 3.960 -0.000 0.000 0.264 2678 G C 0.426 175.332 174.900 0.010 0.000 0.975 2678 G CA 0.297 45.394 45.100 -0.005 0.000 0.642 2678 G HN 1.188 nan 8.290 nan 0.000 0.536 2679 A N -0.892 121.959 122.820 0.052 0.000 2.448 2679 A HA 0.622 4.942 4.320 -0.000 0.000 0.239 2679 A C 0.411 177.980 177.584 -0.026 0.000 1.080 2679 A CA 0.772 52.876 52.037 0.111 0.000 0.779 2679 A CB 1.268 20.440 19.000 0.286 0.000 1.026 2679 A HN 1.584 nan 8.150 nan 0.000 0.499 2680 V N 3.114 123.044 119.914 0.027 0.000 2.447 2680 V HA 0.424 4.544 4.120 -0.000 0.000 0.292 2680 V C -1.046 175.113 176.094 0.108 0.000 1.021 2680 V CA -0.621 61.650 62.300 -0.049 0.000 0.850 2680 V CB 0.647 32.465 31.823 -0.007 0.000 1.005 2680 V HN 0.779 nan 8.190 nan 0.000 0.426 2681 Y N 6.620 126.966 120.300 0.077 0.000 2.425 2681 Y HA 0.296 4.846 4.550 -0.000 0.000 0.331 2681 Y C -1.757 174.172 175.900 0.047 0.000 1.157 2681 Y CA -2.155 55.984 58.100 0.065 0.000 1.372 2681 Y CB 0.409 38.910 38.460 0.069 0.000 1.253 2681 Y HN 0.482 nan 8.280 nan 0.000 0.536 2682 P HA -0.033 nan 4.420 nan 0.000 0.268 2682 P C 0.573 177.888 177.300 0.025 0.000 1.205 2682 P CA -0.217 62.927 63.100 0.074 0.000 0.771 2682 P CB 0.839 32.563 31.700 0.041 0.000 0.858 2683 K N 2.580 122.934 120.400 -0.078 0.000 2.107 2683 K HA -0.257 4.063 4.320 -0.000 0.000 0.211 2683 K C 0.696 177.101 176.600 -0.325 0.000 1.049 2683 K CA 2.019 58.115 56.287 -0.320 0.000 0.927 2683 K CB -0.066 32.123 32.500 -0.519 0.000 0.714 2683 K HN 0.471 nan 8.250 nan 0.000 0.452 2684 E N -0.164 119.920 120.200 -0.192 0.000 2.485 2684 E HA -0.019 4.331 4.350 -0.000 0.000 0.194 2684 E C 1.193 177.763 176.600 -0.050 0.000 1.098 2684 E CA 0.158 56.480 56.400 -0.129 0.000 0.878 2684 E CB 0.399 30.037 29.700 -0.103 0.000 0.939 2684 E HN 0.088 nan 8.360 nan 0.000 0.503 2685 V N -0.209 119.699 119.914 -0.010 0.000 3.013 2685 V HA -0.011 4.109 4.120 -0.000 0.000 0.238 2685 V C 1.553 177.682 176.094 0.059 0.000 1.161 2685 V CA 0.175 62.481 62.300 0.010 0.000 1.170 2685 V CB -0.008 31.814 31.823 -0.002 0.000 0.917 2685 V HN 0.250 nan 8.190 nan 0.000 0.478 2686 L N 0.564 121.865 121.223 0.129 0.000 2.083 2686 L HA -0.127 4.213 4.340 -0.000 0.000 0.209 2686 L C 2.401 179.379 176.870 0.180 0.000 1.083 2686 L CA 2.024 56.987 54.840 0.205 0.000 0.752 2686 L CB -1.166 41.094 42.059 0.334 0.000 0.899 2686 L HN 0.475 nan 8.230 nan 0.000 0.433 2687 E N -0.025 120.259 120.200 0.140 0.000 2.023 2687 E HA -0.205 4.145 4.350 -0.000 0.000 0.196 2687 E C 2.265 178.897 176.600 0.053 0.000 1.003 2687 E CA 1.623 58.087 56.400 0.107 0.000 0.809 2687 E CB -0.068 29.621 29.700 -0.019 0.000 0.755 2687 E HN 0.362 nan 8.360 nan 0.000 0.449 2688 A N 0.318 123.153 122.820 0.024 0.000 1.873 2688 A HA -0.219 4.101 4.320 -0.000 0.000 0.218 2688 A C 2.126 179.724 177.584 0.023 0.000 1.193 2688 A CA 1.802 53.848 52.037 0.014 0.000 0.629 2688 A CB -0.909 18.092 19.000 0.002 0.000 0.826 2688 A HN 0.325 nan 8.150 nan 0.000 0.447 2689 L N -0.469 120.777 121.223 0.038 0.000 2.046 2689 L HA -0.115 4.225 4.340 -0.000 0.000 0.208 2689 L C 2.994 179.886 176.870 0.036 0.000 1.077 2689 L CA 1.901 56.773 54.840 0.053 0.000 0.747 2689 L CB -1.147 40.955 42.059 0.071 0.000 0.896 2689 L HN 0.415 nan 8.230 nan 0.000 0.432 2690 A N -0.933 121.905 122.820 0.029 0.000 2.019 2690 A HA -0.235 4.085 4.320 -0.000 0.000 0.219 2690 A C 2.532 180.053 177.584 -0.105 0.000 1.164 2690 A CA 1.678 53.703 52.037 -0.021 0.000 0.644 2690 A CB -0.534 18.479 19.000 0.020 0.000 0.805 2690 A HN 0.362 nan 8.150 nan 0.000 0.449 2691 R N -0.324 120.138 120.500 -0.064 0.000 2.090 2691 R HA 0.035 4.375 4.340 -0.000 0.000 0.228 2691 R C 1.855 178.097 176.300 -0.097 0.000 1.110 2691 R CA 1.135 57.183 56.100 -0.088 0.000 0.973 2691 R CB -0.315 29.963 30.300 -0.035 0.000 0.869 2691 R HN 0.538 nan 8.270 nan 0.000 0.440 2692 L N -0.130 121.073 121.223 -0.033 0.000 2.093 2692 L HA -0.059 4.281 4.340 -0.000 0.000 0.208 2692 L C 2.604 179.348 176.870 -0.211 0.000 1.085 2692 L CA 1.123 56.003 54.840 0.067 0.000 0.755 2692 L CB -0.712 41.430 42.059 0.138 0.000 0.904 2692 L HN 0.290 nan 8.230 nan 0.000 0.435 2693 A N -0.201 122.301 122.820 -0.530 0.000 1.908 2693 A HA -0.191 4.129 4.320 -0.000 0.000 0.218 2693 A C 2.418 179.443 177.584 -0.932 0.000 1.181 2693 A CA 2.103 53.385 52.037 -1.258 0.000 0.627 2693 A CB -0.806 17.818 19.000 -0.625 0.000 0.818 2693 A HN 0.224 nan 8.150 nan 0.000 0.445 2694 V N -0.439 119.026 119.914 -0.749 0.000 2.535 2694 V HA -0.125 3.995 4.120 -0.000 0.000 0.246 2694 V C 2.290 178.158 176.094 -0.376 0.000 1.045 2694 V CA 2.249 63.995 62.300 -0.924 0.000 1.058 2694 V CB -0.186 31.185 31.823 -0.754 0.000 0.689 2694 V HN 0.743 nan 8.190 nan 0.000 0.461 2695 E N -0.717 119.351 120.200 -0.220 0.000 2.106 2695 E HA -0.232 4.118 4.350 -0.000 0.000 0.192 2695 E C 1.605 178.122 176.600 -0.139 0.000 0.984 2695 E CA 1.555 57.880 56.400 -0.124 0.000 0.806 2695 E CB -0.018 29.654 29.700 -0.046 0.000 0.750 2695 E HN 0.832 nan 8.360 nan 0.000 0.458 2696 H N -0.306 118.738 119.070 -0.042 0.000 2.586 2696 H HA 0.154 4.710 4.556 -0.000 0.000 0.273 2696 H C -0.711 174.700 175.328 0.138 0.000 0.997 2696 H CA 0.482 56.599 56.048 0.114 0.000 1.177 2696 H CB 0.457 30.413 29.762 0.323 0.000 1.471 2696 H HN 0.109 nan 8.280 nan 0.000 0.538 2697 D N 0.454 120.901 120.400 0.079 0.000 3.908 2697 D HA -0.197 4.443 4.640 -0.000 0.000 0.237 2697 D C -1.093 175.302 176.300 0.159 0.000 1.091 2697 D CA 0.932 54.992 54.000 0.100 0.000 1.147 2697 D CB -1.077 39.770 40.800 0.078 0.000 0.857 2697 D HN 0.423 nan 8.370 nan 0.000 0.410 2698 F N 0.352 120.356 119.950 0.090 0.000 2.725 2698 F HA 0.529 5.056 4.527 -0.000 0.000 0.309 2698 F C -1.078 174.740 175.800 0.031 0.000 1.132 2698 F CA -1.583 56.417 58.000 0.001 0.000 0.957 2698 F CB 0.613 39.654 39.000 0.068 0.000 1.286 2698 F HN -0.085 nan 8.300 nan 0.000 0.440 2699 Y N 2.285 122.774 120.300 0.315 0.000 2.457 2699 Y HA 0.407 4.957 4.550 -0.000 0.000 0.341 2699 Y C 0.201 176.261 175.900 0.267 0.000 1.240 2699 Y CA -0.391 57.827 58.100 0.197 0.000 1.437 2699 Y CB 0.626 39.160 38.460 0.123 0.000 1.328 2699 Y HN 0.645 nan 8.280 nan 0.000 0.588 2700 L N 3.200 124.613 121.223 0.316 0.000 2.356 2700 L HA 0.551 4.891 4.340 -0.000 0.000 0.277 2700 L C -1.538 175.435 176.870 0.171 0.000 0.996 2700 L CA -0.908 54.069 54.840 0.229 0.000 0.822 2700 L CB 1.327 43.458 42.059 0.120 0.000 1.256 2700 L HN 0.399 nan 8.230 nan 0.000 0.413 2701 V N 3.792 123.790 119.914 0.139 0.000 2.334 2701 V HA 0.278 4.398 4.120 -0.000 0.000 0.281 2701 V C 0.208 176.338 176.094 0.061 0.000 1.016 2701 V CA -0.291 62.049 62.300 0.067 0.000 0.832 2701 V CB 1.497 33.339 31.823 0.031 0.000 0.999 2701 V HN 0.796 nan 8.190 nan 0.000 0.439 2702 S N 3.074 118.809 115.700 0.059 0.000 2.429 2702 S HA 0.344 4.814 4.470 -0.000 0.000 0.302 2702 S C -0.396 174.265 174.600 0.101 0.000 1.115 2702 S CA -0.565 57.682 58.200 0.078 0.000 1.095 2702 S CB 0.835 64.074 63.200 0.064 0.000 0.987 2702 S HN 0.830 nan 8.310 nan 0.000 0.474 2703 D N 3.888 124.372 120.400 0.139 0.000 2.564 2703 D HA 0.247 4.887 4.640 -0.000 0.000 0.226 2703 D C 1.039 177.429 176.300 0.151 0.000 1.149 2703 D CA -0.112 53.996 54.000 0.179 0.000 0.994 2703 D CB 0.476 41.473 40.800 0.328 0.000 1.029 2703 D HN 0.654 nan 8.370 nan 0.000 0.517 2704 E N 2.290 122.571 120.200 0.135 0.000 2.077 2704 E HA -0.167 4.183 4.350 -0.000 0.000 0.193 2704 E C 2.037 178.627 176.600 -0.017 0.000 0.989 2704 E CA 0.314 56.786 56.400 0.120 0.000 0.800 2704 E CB 0.117 29.936 29.700 0.199 0.000 0.746 2704 E HN 0.575 nan 8.360 nan 0.000 0.452 2705 I N 0.399 120.931 120.570 -0.063 0.000 3.038 2705 I HA -0.459 3.711 4.170 -0.000 0.000 0.218 2705 I C 1.250 177.146 176.117 -0.368 0.000 0.794 2705 I CA 1.832 62.996 61.300 -0.226 0.000 1.207 2705 I CB -0.215 37.621 38.000 -0.273 0.000 0.952 2705 I HN 0.233 nan 8.210 nan 0.000 0.364 2706 Y N 1.380 121.522 120.300 -0.263 0.000 2.471 2706 Y HA -0.028 4.522 4.550 -0.000 0.000 0.286 2706 Y C 2.051 177.732 175.900 -0.364 0.000 1.188 2706 Y CA 0.620 58.533 58.100 -0.311 0.000 1.286 2706 Y CB -0.365 37.897 38.460 -0.329 0.000 1.072 2706 Y HN 0.468 nan 8.280 nan 0.000 0.517 2707 E N -0.275 119.680 120.200 -0.409 0.000 2.114 2707 E HA -0.324 4.026 4.350 -0.000 0.000 0.199 2707 E C 0.852 177.133 176.600 -0.531 0.000 1.008 2707 E CA 2.272 58.200 56.400 -0.785 0.000 0.810 2707 E CB -0.593 28.415 29.700 -1.155 0.000 0.739 2707 E HN 0.628 nan 8.360 nan 0.000 0.456 2708 H N 0.018 118.942 119.070 -0.243 0.000 2.547 2708 H HA 0.201 4.757 4.556 -0.000 0.000 0.272 2708 H C 0.305 175.591 175.328 -0.071 0.000 0.989 2708 H CA 0.275 56.240 56.048 -0.139 0.000 1.214 2708 H CB 0.221 29.905 29.762 -0.129 0.000 1.389 2708 H HN 0.102 nan 8.280 nan 0.000 0.577 2709 L N 1.963 123.184 121.223 -0.003 0.000 2.475 2709 L HA 0.233 4.573 4.340 -0.000 0.000 0.253 2709 L C -1.092 175.561 176.870 -0.361 0.000 1.137 2709 L CA -0.548 54.291 54.840 -0.003 0.000 1.058 2709 L CB 0.585 42.684 42.059 0.067 0.000 1.382 2709 L HN 0.108 nan 8.230 nan 0.000 0.416 2710 L N 0.907 121.948 121.223 -0.304 0.000 2.372 2710 L HA 0.344 4.684 4.340 -0.000 0.000 0.273 2710 L C -0.057 176.688 176.870 -0.208 0.000 0.989 2710 L CA -0.149 54.477 54.840 -0.357 0.000 0.841 2710 L CB 1.146 43.125 42.059 -0.132 0.000 1.225 2710 L HN 0.228 nan 8.230 nan 0.000 0.414 2711 Y N 2.231 122.584 120.300 0.089 0.000 2.231 2711 Y HA 0.203 4.753 4.550 -0.000 0.000 0.294 2711 Y C 0.530 176.467 175.900 0.061 0.000 1.120 2711 Y CA 0.070 58.216 58.100 0.077 0.000 1.141 2711 Y CB 0.414 38.921 38.460 0.079 0.000 1.022 2711 Y HN 0.482 nan 8.280 nan 0.000 0.523 2712 E N 0.715 121.007 120.200 0.154 0.000 2.502 2712 E HA 0.570 4.920 4.350 -0.000 0.000 0.261 2712 E C -0.332 176.312 176.600 0.074 0.000 0.974 2712 E CA -0.273 56.192 56.400 0.108 0.000 0.795 2712 E CB 1.306 31.074 29.700 0.114 0.000 1.385 2712 E HN 0.352 nan 8.360 nan 0.000 0.400 2713 G N 1.908 110.747 108.800 0.065 0.000 2.345 2713 G HA2 0.188 4.148 3.960 -0.000 0.000 0.285 2713 G HA3 0.188 4.148 3.960 -0.000 0.000 0.285 2713 G C -1.756 173.185 174.900 0.068 0.000 1.297 2713 G CA -0.565 44.572 45.100 0.062 0.000 0.875 2713 G HN 0.453 nan 8.290 nan 0.000 0.506 2714 E N -0.110 120.136 120.200 0.078 0.000 2.224 2714 E HA 0.456 4.806 4.350 -0.000 0.000 0.265 2714 E C -1.547 175.136 176.600 0.138 0.000 0.878 2714 E CA -0.806 55.654 56.400 0.100 0.000 0.759 2714 E CB 1.802 31.551 29.700 0.082 0.000 1.164 2714 E HN 0.596 nan 8.360 nan 0.000 0.414 2715 H N 4.509 123.615 119.070 0.060 0.000 2.934 2715 H HA 0.306 4.862 4.556 -0.000 0.000 0.273 2715 H C -1.655 173.755 175.328 0.138 0.000 1.121 2715 H CA -0.253 55.831 56.048 0.059 0.000 1.451 2715 H CB 0.030 29.780 29.762 -0.020 0.000 1.469 2715 H HN 0.420 nan 8.280 nan 0.000 0.476 2716 F N 3.700 123.410 119.950 -0.400 0.000 2.450 2716 F HA 0.493 5.019 4.527 -0.000 0.000 0.332 2716 F C -0.562 175.000 175.800 -0.397 0.000 1.093 2716 F CA -0.548 57.286 58.000 -0.277 0.000 1.003 2716 F CB 1.413 40.339 39.000 -0.123 0.000 1.151 2716 F HN 0.439 nan 8.300 nan 0.000 0.474 2717 S N 6.324 121.505 115.700 -0.865 0.000 2.475 2717 S HA 0.359 4.829 4.470 -0.000 0.000 0.298 2717 S C -2.210 171.942 174.600 -0.747 0.000 1.119 2717 S CA -1.063 56.790 58.200 -0.579 0.000 1.085 2717 S CB 1.809 64.809 63.200 -0.332 0.000 1.028 2717 S HN 0.497 nan 8.310 nan 0.000 0.489 2718 P HA 0.143 nan 4.420 nan 0.000 0.240 2718 P C 1.327 178.543 177.300 -0.139 0.000 1.190 2718 P CA 0.185 63.196 63.100 -0.149 0.000 0.781 2718 P CB -0.013 31.688 31.700 0.003 0.000 0.931 2719 G N 0.025 108.728 108.800 -0.162 0.000 2.625 2719 G HA2 -0.179 3.781 3.960 -0.000 0.000 0.214 2719 G HA3 -0.179 3.781 3.960 -0.000 0.000 0.214 2719 G C 1.555 176.382 174.900 -0.122 0.000 1.132 2719 G CA 0.156 45.186 45.100 -0.116 0.000 0.782 2719 G HN 0.231 nan 8.290 nan 0.000 0.538 2720 R N -0.574 119.811 120.500 -0.192 0.000 2.062 2720 R HA 0.060 4.400 4.340 -0.000 0.000 0.226 2720 R C 2.534 178.802 176.300 -0.054 0.000 1.125 2720 R CA 0.909 56.921 56.100 -0.148 0.000 0.966 2720 R CB -0.293 29.841 30.300 -0.276 0.000 0.861 2720 R HN 0.280 nan 8.270 nan 0.000 0.433 2721 V N 0.356 120.250 119.914 -0.033 0.000 2.407 2721 V HA -0.007 4.113 4.120 -0.000 0.000 0.245 2721 V C 0.977 177.063 176.094 -0.014 0.000 1.041 2721 V CA 1.506 63.821 62.300 0.026 0.000 1.040 2721 V CB 0.049 31.934 31.823 0.104 0.000 0.671 2721 V HN 0.338 nan 8.190 nan 0.000 0.455 2722 A N 0.215 123.017 122.820 -0.031 0.000 3.216 2722 A HA 0.509 4.829 4.320 -0.000 0.000 0.321 2722 A C -1.385 176.210 177.584 0.017 0.000 1.042 2722 A CA -0.800 51.214 52.037 -0.039 0.000 0.838 2722 A CB 0.352 19.282 19.000 -0.117 0.000 1.136 2722 A HN 0.289 nan 8.150 nan 0.000 0.483 2723 P HA -0.196 nan 4.420 nan 0.000 0.222 2723 P C 0.774 178.091 177.300 0.030 0.000 1.147 2723 P CA 1.301 64.404 63.100 0.005 0.000 0.790 2723 P CB 0.282 31.974 31.700 -0.012 0.000 0.780 2724 E N -1.023 119.224 120.200 0.078 0.000 2.463 2724 E HA -0.063 4.287 4.350 -0.000 0.000 0.193 2724 E C 0.466 177.020 176.600 -0.077 0.000 1.041 2724 E CA 0.174 56.586 56.400 0.021 0.000 0.879 2724 E CB -0.324 29.373 29.700 -0.005 0.000 0.997 2724 E HN 0.346 nan 8.360 nan 0.000 0.478 2725 H N -0.356 118.683 119.070 -0.053 0.000 2.735 2725 H HA 0.219 4.775 4.556 -0.000 0.000 0.250 2725 H C 0.049 175.413 175.328 0.060 0.000 0.948 2725 H CA 0.540 56.546 56.048 -0.071 0.000 1.137 2725 H CB 0.826 30.490 29.762 -0.164 0.000 1.440 2725 H HN -0.065 nan 8.280 nan 0.000 0.444 2726 T N 1.913 116.554 114.554 0.144 0.000 2.884 2726 T HA 0.376 4.726 4.350 -0.000 0.000 0.298 2726 T C -0.365 174.361 174.700 0.044 0.000 0.998 2726 T CA -0.131 62.021 62.100 0.087 0.000 1.124 2726 T CB 0.243 69.124 68.868 0.022 0.000 0.931 2726 T HN 0.079 nan 8.240 nan 0.000 0.531 2727 L N 4.035 125.276 121.223 0.030 0.000 2.342 2727 L HA 0.366 4.706 4.340 -0.000 0.000 0.276 2727 L C 0.045 176.890 176.870 -0.041 0.000 0.997 2727 L CA -0.625 54.195 54.840 -0.034 0.000 0.838 2727 L CB 1.675 43.697 42.059 -0.062 0.000 1.224 2727 L HN 0.641 nan 8.230 nan 0.000 0.416 2728 T N 2.474 116.973 114.554 -0.091 0.000 2.738 2728 T HA 0.403 4.753 4.350 -0.000 0.000 0.298 2728 T C -0.028 174.677 174.700 0.010 0.000 0.962 2728 T CA -0.483 61.583 62.100 -0.058 0.000 0.972 2728 T CB 1.147 69.929 68.868 -0.143 0.000 0.928 2728 T HN 0.112 nan 8.240 nan 0.000 0.474 2729 V N 5.019 124.979 119.914 0.076 0.000 2.394 2729 V HA 0.514 4.634 4.120 -0.000 0.000 0.282 2729 V C 0.301 176.476 176.094 0.135 0.000 1.031 2729 V CA -0.721 61.644 62.300 0.107 0.000 0.881 2729 V CB 1.203 33.065 31.823 0.065 0.000 0.982 2729 V HN 0.841 nan 8.190 nan 0.000 0.451 2730 N N 1.972 120.757 118.700 0.141 0.000 3.157 2730 N HA 0.783 5.523 4.740 -0.000 0.000 0.291 2730 N C -0.671 174.615 175.510 -0.373 0.000 1.515 2730 N CA 0.066 53.126 53.050 0.016 0.000 0.807 2730 N CB 2.811 41.444 38.487 0.244 0.000 1.672 2730 N HN 0.839 nan 8.380 nan 0.000 0.592 2731 G N -1.464 106.987 108.800 -0.581 0.000 2.547 2731 G HA2 0.522 4.482 3.960 -0.000 0.000 0.291 2731 G HA3 0.522 4.482 3.960 -0.000 0.000 0.291 2731 G C -0.066 174.497 174.900 -0.562 0.000 1.471 2731 G CA 0.209 44.750 45.100 -0.932 0.000 0.798 2731 G HN 0.595 nan 8.290 nan 0.000 0.504 2732 A N 0.129 122.712 122.820 -0.394 0.000 1.929 2732 A HA 0.388 4.708 4.320 -0.000 0.000 0.216 2732 A C 2.808 180.316 177.584 -0.127 0.000 1.176 2732 A CA 2.390 54.381 52.037 -0.076 0.000 0.628 2732 A CB -0.987 18.097 19.000 0.139 0.000 0.816 2732 A HN 2.130 nan 8.150 nan 0.000 0.444 2733 A N 0.636 123.384 122.820 -0.120 0.000 1.883 2733 A HA -0.348 3.972 4.320 -0.000 0.000 0.226 2733 A C 2.113 179.665 177.584 -0.053 0.000 1.512 2733 A CA 2.512 54.512 52.037 -0.062 0.000 0.738 2733 A CB -0.701 18.252 19.000 -0.078 0.000 0.848 2733 A HN 0.429 nan 8.150 nan 0.000 0.477 2734 K N -0.689 119.602 120.400 -0.181 0.000 2.026 2734 K HA -0.051 4.269 4.320 -0.000 0.000 0.208 2734 K C 2.395 178.965 176.600 -0.050 0.000 1.048 2734 K CA 1.425 57.611 56.287 -0.168 0.000 0.929 2734 K CB -0.921 31.243 32.500 -0.560 0.000 0.713 2734 K HN 0.547 nan 8.250 nan 0.000 0.439 2735 A N 1.123 123.822 122.820 -0.203 0.000 1.841 2735 A HA -0.067 4.253 4.320 -0.000 0.000 0.214 2735 A C 1.819 179.433 177.584 0.050 0.000 1.195 2735 A CA 1.152 53.063 52.037 -0.210 0.000 0.611 2735 A CB -0.850 17.785 19.000 -0.608 0.000 0.835 2735 A HN 0.300 nan 8.150 nan 0.000 0.443 2736 F N -0.534 119.500 119.950 0.141 0.000 2.693 2736 F HA 0.403 4.930 4.527 -0.000 0.000 0.303 2736 F C 1.530 177.376 175.800 0.077 0.000 1.143 2736 F CA 0.225 58.287 58.000 0.104 0.000 1.389 2736 F CB -0.114 38.820 39.000 -0.110 0.000 1.060 2736 F HN 0.381 nan 8.300 nan 0.000 0.535 2737 A N 0.237 123.290 122.820 0.389 0.000 2.790 2737 A HA -0.307 4.012 4.320 -0.000 0.000 0.277 2737 A C 1.218 178.933 177.584 0.219 0.000 1.435 2737 A CA 1.177 53.417 52.037 0.338 0.000 0.877 2737 A CB -2.212 17.061 19.000 0.454 0.000 1.007 2737 A HN 0.575 nan 8.150 nan 0.000 0.613 2738 M N 0.174 119.862 119.600 0.147 0.000 2.581 2738 M HA -0.031 4.449 4.480 -0.000 0.000 0.224 2738 M C 2.069 178.528 176.300 0.265 0.000 1.171 2738 M CA 0.929 56.302 55.300 0.123 0.000 0.993 2738 M CB -0.418 32.099 32.600 -0.140 0.000 1.685 2738 M HN 0.819 nan 8.290 nan 0.000 0.479 2739 T N -1.374 113.301 114.554 0.202 0.000 2.564 2739 T HA -0.253 4.097 4.350 -0.000 0.000 0.264 2739 T C 1.865 176.675 174.700 0.185 0.000 1.100 2739 T CA 2.023 64.217 62.100 0.156 0.000 1.171 2739 T CB -1.440 67.504 68.868 0.126 0.000 0.863 2739 T HN 0.555 nan 8.240 nan 0.000 0.430 2740 G N -0.184 108.737 108.800 0.202 0.000 2.501 2740 G HA2 -0.103 3.857 3.960 -0.000 0.000 0.220 2740 G HA3 -0.103 3.857 3.960 -0.000 0.000 0.220 2740 G C 1.102 176.074 174.900 0.120 0.000 1.114 2740 G CA 0.554 45.720 45.100 0.110 0.000 0.757 2740 G HN 0.708 nan 8.290 nan 0.000 0.559 2741 W N -0.285 121.024 121.300 0.015 0.000 2.595 2741 W HA 0.249 4.909 4.660 -0.000 0.000 0.257 2741 W C 0.683 177.209 176.519 0.012 0.000 1.267 2741 W CA 0.009 57.363 57.345 0.014 0.000 1.300 2741 W CB 0.269 29.741 29.460 0.019 0.000 1.120 2741 W HN -0.035 nan 8.180 nan 0.000 0.618 2742 R N -0.479 120.154 120.500 0.221 0.000 3.152 2742 R HA -0.200 4.140 4.340 -0.000 0.000 0.252 2742 R C -1.321 175.040 176.300 0.101 0.000 0.930 2742 R CA 0.379 56.550 56.100 0.118 0.000 0.642 2742 R CB -2.904 27.444 30.300 0.082 0.000 1.205 2742 R HN 0.178 nan 8.270 nan 0.000 0.452 2743 I N -0.379 120.233 120.570 0.070 0.000 2.512 2743 I HA 0.631 4.801 4.170 -0.000 0.000 0.287 2743 I C 0.638 176.690 176.117 -0.110 0.000 1.069 2743 I CA -0.048 61.272 61.300 0.033 0.000 1.056 2743 I CB 2.201 40.255 38.000 0.089 0.000 1.229 2743 I HN 0.396 nan 8.210 nan 0.000 0.429 2744 G N 4.854 113.567 108.800 -0.146 0.000 2.658 2744 G HA2 0.793 4.753 3.960 -0.000 0.000 0.292 2744 G HA3 0.793 4.753 3.960 -0.000 0.000 0.292 2744 G C -1.947 172.806 174.900 -0.246 0.000 1.320 2744 G CA -0.508 44.359 45.100 -0.388 0.000 0.933 2744 G HN 0.424 nan 8.290 nan 0.000 0.476 2745 Y N -2.615 117.721 120.300 0.061 0.000 2.638 2745 Y HA 0.874 5.424 4.550 -0.000 0.000 0.335 2745 Y C -0.105 175.900 175.900 0.174 0.000 1.155 2745 Y CA -1.528 56.636 58.100 0.107 0.000 1.046 2745 Y CB 1.168 39.696 38.460 0.113 0.000 1.303 2745 Y HN 1.136 nan 8.280 nan 0.000 0.460 2746 A N 0.094 123.138 122.820 0.374 0.000 2.588 2746 A HA 0.922 5.242 4.320 -0.000 0.000 0.290 2746 A C -1.205 176.388 177.584 0.014 0.000 1.136 2746 A CA -0.320 51.836 52.037 0.198 0.000 0.681 2746 A CB 1.025 20.064 19.000 0.066 0.000 1.282 2746 A HN 1.894 nan 8.150 nan 0.000 0.421 2747 C N -1.478 117.684 119.300 -0.231 0.000 3.239 2747 C HA 1.065 5.525 4.460 -0.000 0.000 0.317 2747 C C 0.247 175.096 174.990 -0.235 0.000 1.310 2747 C CA 0.229 59.061 59.018 -0.309 0.000 1.371 2747 C CB 1.078 28.423 27.740 -0.658 0.000 1.714 2747 C HN 2.814 nan 8.230 nan 0.000 0.473 2748 G N 0.766 109.471 108.800 -0.157 0.000 2.344 2748 G HA2 0.538 4.498 3.960 -0.000 0.000 0.282 2748 G HA3 0.538 4.498 3.960 -0.000 0.000 0.282 2748 G C -3.574 171.295 174.900 -0.051 0.000 1.281 2748 G CA -0.684 44.359 45.100 -0.094 0.000 0.877 2748 G HN 0.584 nan 8.290 nan 0.000 0.494 2749 P HA 0.137 nan 4.420 nan 0.000 0.257 2749 P C 0.857 178.153 177.300 -0.007 0.000 1.189 2749 P CA 0.180 63.282 63.100 0.003 0.000 0.780 2749 P CB 0.906 32.636 31.700 0.051 0.000 0.772 2750 K N 4.765 125.157 120.400 -0.013 0.000 2.144 2750 K HA -0.283 4.037 4.320 -0.000 0.000 0.209 2750 K C 1.749 178.343 176.600 -0.009 0.000 1.047 2750 K CA 1.911 58.190 56.287 -0.013 0.000 0.927 2750 K CB 0.000 32.494 32.500 -0.011 0.000 0.716 2750 K HN 0.566 nan 8.250 nan 0.000 0.454 2751 E N 0.706 120.906 120.200 -0.000 0.000 2.097 2751 E HA -0.186 4.164 4.350 -0.000 0.000 0.196 2751 E C 1.895 178.491 176.600 -0.007 0.000 1.000 2751 E CA 1.895 58.298 56.400 0.004 0.000 0.804 2751 E CB -0.580 29.131 29.700 0.019 0.000 0.740 2751 E HN 0.307 nan 8.360 nan 0.000 0.454 2752 V N -0.107 119.795 119.914 -0.019 0.000 2.788 2752 V HA 0.048 4.168 4.120 -0.000 0.000 0.251 2752 V C 2.080 178.133 176.094 -0.068 0.000 1.068 2752 V CA 0.710 62.967 62.300 -0.072 0.000 1.090 2752 V CB -0.478 31.249 31.823 -0.161 0.000 0.710 2752 V HN 0.205 nan 8.190 nan 0.000 0.467 2753 I N 1.878 122.420 120.570 -0.047 0.000 3.688 2753 I HA 0.132 4.302 4.170 -0.000 0.000 0.307 2753 I C 1.569 177.674 176.117 -0.020 0.000 1.287 2753 I CA 0.771 62.050 61.300 -0.036 0.000 1.192 2753 I CB -0.566 37.415 38.000 -0.033 0.000 1.043 2753 I HN 0.599 nan 8.210 nan 0.000 0.442 2754 K N -1.071 119.317 120.400 -0.020 0.000 2.613 2754 K HA 0.334 4.654 4.320 -0.000 0.000 0.209 2754 K C 1.176 177.769 176.600 -0.012 0.000 1.556 2754 K CA 0.302 56.583 56.287 -0.011 0.000 1.017 2754 K CB 0.091 32.586 32.500 -0.008 0.000 1.291 2754 K HN 0.010 nan 8.250 nan 0.000 0.629 2755 A N 1.877 124.684 122.820 -0.022 0.000 1.871 2755 A HA 0.177 4.497 4.320 -0.000 0.000 0.211 2755 A C 2.205 179.776 177.584 -0.021 0.000 1.207 2755 A CA 0.758 52.781 52.037 -0.023 0.000 0.620 2755 A CB -0.394 18.582 19.000 -0.041 0.000 0.860 2755 A HN 0.190 nan 8.150 nan 0.000 0.450 2756 M N -0.093 119.488 119.600 -0.032 0.000 2.073 2756 M HA -0.222 4.258 4.480 -0.000 0.000 0.258 2756 M C 2.507 178.809 176.300 0.005 0.000 1.070 2756 M CA 1.771 57.059 55.300 -0.020 0.000 1.103 2756 M CB -0.468 32.113 32.600 -0.031 0.000 1.321 2756 M HN 0.486 nan 8.290 nan 0.000 0.405 2757 A N -1.104 121.718 122.820 0.003 0.000 1.978 2757 A HA -0.171 4.149 4.320 -0.000 0.000 0.220 2757 A C 2.238 179.829 177.584 0.012 0.000 1.170 2757 A CA 2.193 54.236 52.037 0.011 0.000 0.636 2757 A CB -0.771 18.233 19.000 0.006 0.000 0.810 2757 A HN 0.486 nan 8.150 nan 0.000 0.448 2758 S N -1.035 114.670 115.700 0.008 0.000 2.406 2758 S HA -0.057 4.413 4.470 -0.000 0.000 0.228 2758 S C 1.834 176.446 174.600 0.019 0.000 1.020 2758 S CA 1.223 59.428 58.200 0.009 0.000 0.965 2758 S CB -0.314 62.889 63.200 0.004 0.000 0.798 2758 S HN 0.299 nan 8.310 nan 0.000 0.488 2759 V N 0.768 120.699 119.914 0.028 0.000 2.323 2759 V HA -0.078 4.042 4.120 -0.000 0.000 0.244 2759 V C 2.592 178.723 176.094 0.062 0.000 1.041 2759 V CA 1.907 64.237 62.300 0.051 0.000 1.025 2759 V CB -0.943 30.916 31.823 0.062 0.000 0.656 2759 V HN 0.539 nan 8.190 nan 0.000 0.451 2760 S N 0.056 115.788 115.700 0.054 0.000 2.387 2760 S HA -0.284 4.186 4.470 -0.000 0.000 0.230 2760 S C 2.248 176.870 174.600 0.037 0.000 1.035 2760 S CA 2.097 60.329 58.200 0.053 0.000 1.014 2760 S CB -0.390 62.836 63.200 0.044 0.000 0.836 2760 S HN 0.603 nan 8.310 nan 0.000 0.466 2761 R N 0.428 120.941 120.500 0.021 0.000 2.148 2761 R HA 0.057 4.397 4.340 -0.000 0.000 0.223 2761 R C 0.719 177.022 176.300 0.004 0.000 1.088 2761 R CA 1.157 57.259 56.100 0.002 0.000 0.985 2761 R CB -0.280 30.012 30.300 -0.015 0.000 0.880 2761 R HN 0.484 nan 8.270 nan 0.000 0.451 2762 Q N 0.722 120.535 119.800 0.022 0.000 2.201 2762 Q HA 0.128 4.468 4.340 -0.000 0.000 0.236 2762 Q C 0.427 176.456 176.000 0.048 0.000 0.857 2762 Q CA 0.284 56.103 55.803 0.028 0.000 1.025 2762 Q CB 1.350 30.105 28.738 0.028 0.000 1.124 2762 Q HN 0.465 nan 8.270 nan 0.000 0.473 2763 S N -1.322 114.409 115.700 0.051 0.000 3.792 2763 S HA -0.014 4.456 4.470 -0.000 0.000 0.229 2763 S C 1.719 176.343 174.600 0.040 0.000 1.118 2763 S CA 0.535 58.772 58.200 0.061 0.000 0.877 2763 S CB -0.062 63.194 63.200 0.093 0.000 1.077 2763 S HN 0.241 nan 8.310 nan 0.000 0.546 2764 T N -2.345 112.234 114.554 0.041 0.000 2.985 2764 T HA 0.350 4.700 4.350 -0.000 0.000 0.254 2764 T C 0.970 175.702 174.700 0.053 0.000 1.021 2764 T CA 0.986 63.110 62.100 0.041 0.000 0.957 2764 T CB 0.240 69.131 68.868 0.038 0.000 1.047 2764 T HN 0.381 nan 8.240 nan 0.000 0.511 2765 T N 0.323 114.898 114.554 0.035 0.000 11.087 2765 T HA -0.200 4.150 4.350 -0.000 0.000 0.385 2765 T C 0.090 174.807 174.700 0.029 0.000 1.679 2765 T CA 1.777 63.883 62.100 0.011 0.000 2.690 2765 T CB -1.808 67.065 68.868 0.009 0.000 2.619 2765 T HN 1.232 nan 8.240 nan 0.000 0.900 2766 S N -0.033 115.705 115.700 0.062 0.000 2.802 2766 S HA 0.365 4.835 4.470 -0.000 0.000 0.272 2766 S C -3.254 171.394 174.600 0.081 0.000 0.788 2766 S CA -0.648 57.593 58.200 0.069 0.000 1.016 2766 S CB 0.327 63.571 63.200 0.073 0.000 1.278 2766 S HN 0.108 nan 8.310 nan 0.000 0.494 2767 P HA 0.173 nan 4.420 nan 0.000 0.266 2767 P C -0.869 176.480 177.300 0.082 0.000 1.195 2767 P CA 0.140 63.282 63.100 0.070 0.000 0.768 2767 P CB 0.149 31.887 31.700 0.063 0.000 0.838 2768 D N 1.942 122.393 120.400 0.085 0.000 2.554 2768 D HA -0.081 4.559 4.640 -0.000 0.000 0.251 2768 D C 0.670 177.036 176.300 0.109 0.000 1.213 2768 D CA 0.706 54.760 54.000 0.090 0.000 0.900 2768 D CB 0.137 40.986 40.800 0.081 0.000 1.135 2768 D HN 0.247 nan 8.370 nan 0.000 0.522 2769 T N 4.749 119.372 114.554 0.115 0.000 2.620 2769 T HA -0.229 4.121 4.350 -0.000 0.000 0.267 2769 T C 1.851 176.688 174.700 0.229 0.000 1.044 2769 T CA 1.247 63.437 62.100 0.151 0.000 1.161 2769 T CB -0.161 68.818 68.868 0.185 0.000 0.862 2769 T HN 0.501 nan 8.240 nan 0.000 0.438 2770 I N 1.898 122.606 120.570 0.229 0.000 2.151 2770 I HA -0.194 3.976 4.170 -0.000 0.000 0.243 2770 I C 2.944 179.249 176.117 0.314 0.000 1.080 2770 I CA 1.561 63.025 61.300 0.273 0.000 1.339 2770 I CB -1.762 36.350 38.000 0.186 0.000 1.039 2770 I HN 0.250 nan 8.210 nan 0.000 0.409 2771 A N 0.028 123.027 122.820 0.299 0.000 2.067 2771 A HA -0.179 4.141 4.320 -0.000 0.000 0.219 2771 A C 2.228 179.908 177.584 0.160 0.000 1.158 2771 A CA 0.981 53.231 52.037 0.355 0.000 0.661 2771 A CB -0.387 18.859 19.000 0.409 0.000 0.801 2771 A HN 0.534 nan 8.150 nan 0.000 0.452 2772 Q N -1.161 118.695 119.800 0.093 0.000 1.941 2772 Q HA -0.217 4.123 4.340 -0.000 0.000 0.201 2772 Q C 1.979 177.917 176.000 -0.104 0.000 0.982 2772 Q CA 1.707 57.472 55.803 -0.064 0.000 0.839 2772 Q CB -0.408 28.222 28.738 -0.180 0.000 0.904 2772 Q HN 0.880 nan 8.270 nan 0.000 0.427 2773 W N 0.876 122.197 121.300 0.036 0.000 2.313 2773 W HA -0.244 4.416 4.660 -0.000 0.000 0.293 2773 W C 2.443 178.945 176.519 -0.028 0.000 1.216 2773 W CA 1.058 58.409 57.345 0.009 0.000 1.223 2773 W CB -0.221 29.252 29.460 0.022 0.000 1.138 2773 W HN 0.284 nan 8.180 nan 0.000 0.535 2774 A N -0.607 122.313 122.820 0.166 0.000 1.897 2774 A HA -0.137 4.182 4.320 -0.000 0.000 0.215 2774 A C 1.874 179.351 177.584 -0.179 0.000 1.181 2774 A CA 2.016 54.034 52.037 -0.031 0.000 0.620 2774 A CB -1.140 17.792 19.000 -0.113 0.000 0.821 2774 A HN 0.207 nan 8.150 nan 0.000 0.443 2775 T N 0.370 114.840 114.554 -0.140 0.000 2.777 2775 T HA -0.095 4.255 4.350 -0.000 0.000 0.266 2775 T C 1.853 176.482 174.700 -0.119 0.000 1.040 2775 T CA 1.177 63.196 62.100 -0.135 0.000 1.141 2775 T CB -0.436 68.424 68.868 -0.014 0.000 0.868 2775 T HN 0.358 nan 8.240 nan 0.000 0.444 2776 L N 0.875 122.042 121.223 -0.094 0.000 2.021 2776 L HA -0.275 4.065 4.340 -0.000 0.000 0.215 2776 L C 2.723 179.558 176.870 -0.060 0.000 1.074 2776 L CA 2.065 56.854 54.840 -0.085 0.000 0.760 2776 L CB -0.294 41.728 42.059 -0.060 0.000 0.889 2776 L HN 0.279 nan 8.230 nan 0.000 0.433 2777 E N -0.195 119.978 120.200 -0.045 0.000 2.077 2777 E HA -0.228 4.122 4.350 -0.000 0.000 0.193 2777 E C 1.951 178.473 176.600 -0.130 0.000 0.989 2777 E CA 1.606 57.973 56.400 -0.054 0.000 0.800 2777 E CB -0.180 29.494 29.700 -0.043 0.000 0.746 2777 E HN 0.543 nan 8.360 nan 0.000 0.452 2778 A N 0.296 122.935 122.820 -0.301 0.000 1.930 2778 A HA -0.085 4.235 4.320 -0.000 0.000 0.217 2778 A C 2.229 179.589 177.584 -0.374 0.000 1.175 2778 A CA 1.284 52.998 52.037 -0.538 0.000 0.627 2778 A CB -0.554 17.841 19.000 -1.007 0.000 0.815 2778 A HN 0.346 nan 8.150 nan 0.000 0.443 2779 L N -0.327 120.782 121.223 -0.189 0.000 2.179 2779 L HA -0.086 4.254 4.340 -0.000 0.000 0.208 2779 L C 2.801 179.631 176.870 -0.067 0.000 1.096 2779 L CA 1.642 56.436 54.840 -0.077 0.000 0.779 2779 L CB -0.633 41.372 42.059 -0.090 0.000 0.922 2779 L HN 0.629 nan 8.230 nan 0.000 0.443 2780 T N -4.332 110.183 114.554 -0.066 0.000 3.035 2780 T HA -0.048 4.302 4.350 -0.000 0.000 0.259 2780 T C 1.202 175.881 174.700 -0.036 0.000 1.078 2780 T CA 0.074 62.150 62.100 -0.040 0.000 1.132 2780 T CB -0.241 68.615 68.868 -0.020 0.000 0.900 2780 T HN 0.055 nan 8.240 nan 0.000 0.480 2781 N N 1.730 120.403 118.700 -0.044 0.000 2.968 2781 N HA 0.163 4.903 4.740 -0.000 0.000 0.271 2781 N C 0.815 176.277 175.510 -0.079 0.000 1.174 2781 N CA -0.045 52.971 53.050 -0.057 0.000 1.096 2781 N CB 0.723 39.182 38.487 -0.046 0.000 1.403 2781 N HN 0.426 nan 8.380 nan 0.000 0.522 2782 Q N 0.838 120.604 119.800 -0.056 0.000 1.985 2782 Q HA -0.166 4.174 4.340 -0.000 0.000 0.207 2782 Q C 0.748 176.710 176.000 -0.063 0.000 0.996 2782 Q CA 1.799 57.576 55.803 -0.044 0.000 0.851 2782 Q CB -0.034 28.690 28.738 -0.023 0.000 0.921 2782 Q HN 0.422 nan 8.270 nan 0.000 0.418 2783 E N -0.950 119.208 120.200 -0.070 0.000 2.527 2783 E HA -0.079 4.271 4.350 -0.000 0.000 0.204 2783 E C 0.513 177.036 176.600 -0.128 0.000 1.132 2783 E CA 0.647 56.999 56.400 -0.081 0.000 0.905 2783 E CB -0.050 29.614 29.700 -0.060 0.000 0.875 2783 E HN 0.415 nan 8.360 nan 0.000 0.548 2784 A N -1.341 121.355 122.820 -0.206 0.000 1.993 2784 A HA 0.104 4.424 4.320 -0.000 0.000 0.202 2784 A C 2.123 179.565 177.584 -0.235 0.000 1.461 2784 A CA 0.432 52.254 52.037 -0.359 0.000 0.824 2784 A CB -0.138 18.380 19.000 -0.804 0.000 1.024 2784 A HN 0.185 nan 8.150 nan 0.000 0.507 2785 S N 0.063 115.670 115.700 -0.155 0.000 2.382 2785 S HA -0.159 4.311 4.470 -0.000 0.000 0.228 2785 S C 2.025 176.670 174.600 0.074 0.000 1.027 2785 S CA 1.416 59.622 58.200 0.010 0.000 0.991 2785 S CB -0.364 62.787 63.200 -0.083 0.000 0.823 2785 S HN 0.570 nan 8.310 nan 0.000 0.469 2786 R N 1.199 121.704 120.500 0.009 0.000 2.159 2786 R HA -0.095 4.245 4.340 -0.000 0.000 0.237 2786 R C 2.102 178.402 176.300 0.001 0.000 1.131 2786 R CA 1.268 57.370 56.100 0.003 0.000 0.982 2786 R CB -0.306 29.987 30.300 -0.012 0.000 0.868 2786 R HN 0.416 nan 8.270 nan 0.000 0.453 2787 A N 0.027 122.849 122.820 0.003 0.000 1.903 2787 A HA -0.070 4.250 4.320 -0.000 0.000 0.213 2787 A C 1.816 179.404 177.584 0.006 0.000 1.185 2787 A CA 0.512 52.545 52.037 -0.007 0.000 0.628 2787 A CB -0.573 18.415 19.000 -0.019 0.000 0.830 2787 A HN 0.455 nan 8.150 nan 0.000 0.446 2788 F N 1.160 121.066 119.950 -0.073 0.000 2.102 2788 F HA -0.171 4.356 4.527 -0.000 0.000 0.298 2788 F C 2.207 177.937 175.800 -0.117 0.000 1.105 2788 F CA 2.003 59.947 58.000 -0.093 0.000 1.239 2788 F CB -0.454 38.536 39.000 -0.016 0.000 0.991 2788 F HN 0.028 nan 8.300 nan 0.000 0.474 2789 V N 0.629 120.520 119.914 -0.037 0.000 2.255 2789 V HA -0.308 3.812 4.120 -0.000 0.000 0.247 2789 V C 2.499 178.476 176.094 -0.195 0.000 1.051 2789 V CA 2.252 64.475 62.300 -0.128 0.000 1.018 2789 V CB -0.817 30.972 31.823 -0.056 0.000 0.641 2789 V HN 0.277 nan 8.190 nan 0.000 0.445 2790 E N -0.513 119.613 120.200 -0.124 0.000 2.130 2790 E HA -0.273 4.077 4.350 -0.000 0.000 0.196 2790 E C 2.041 178.533 176.600 -0.181 0.000 0.998 2790 E CA 1.728 58.063 56.400 -0.107 0.000 0.806 2790 E CB -0.385 29.278 29.700 -0.063 0.000 0.738 2790 E HN 0.585 nan 8.360 nan 0.000 0.459 2791 M N -0.064 119.362 119.600 -0.289 0.000 2.098 2791 M HA -0.100 4.380 4.480 -0.000 0.000 0.262 2791 M C 2.196 178.171 176.300 -0.542 0.000 1.072 2791 M CA 1.558 56.640 55.300 -0.364 0.000 1.133 2791 M CB -0.182 32.177 32.600 -0.403 0.000 1.344 2791 M HN 0.055 nan 8.290 nan 0.000 0.414 2792 A N 0.992 123.301 122.820 -0.851 0.000 1.873 2792 A HA -0.258 4.062 4.320 -0.000 0.000 0.218 2792 A C 2.275 179.390 177.584 -0.782 0.000 1.193 2792 A CA 2.176 53.571 52.037 -1.071 0.000 0.629 2792 A CB -1.004 17.379 19.000 -1.028 0.000 0.826 2792 A HN 0.635 nan 8.150 nan 0.000 0.447 2793 R N -0.576 119.760 120.500 -0.273 0.000 2.080 2793 R HA -0.180 4.160 4.340 -0.000 0.000 0.236 2793 R C 1.964 178.286 176.300 0.036 0.000 1.137 2793 R CA 1.823 57.991 56.100 0.113 0.000 0.943 2793 R CB -0.351 30.073 30.300 0.207 0.000 0.846 2793 R HN 0.497 nan 8.270 nan 0.000 0.431 2794 E N 0.276 120.440 120.200 -0.061 0.000 2.160 2794 E HA -0.183 4.167 4.350 -0.000 0.000 0.195 2794 E C 1.794 178.332 176.600 -0.103 0.000 0.991 2794 E CA 1.208 57.569 56.400 -0.066 0.000 0.810 2794 E CB -0.233 29.426 29.700 -0.067 0.000 0.742 2794 E HN 0.484 nan 8.360 nan 0.000 0.466 2795 A N 0.669 123.389 122.820 -0.166 0.000 1.832 2795 A HA -0.174 4.146 4.320 -0.000 0.000 0.214 2795 A C 2.093 179.655 177.584 -0.037 0.000 1.200 2795 A CA 1.341 53.315 52.037 -0.104 0.000 0.610 2795 A CB -1.224 17.733 19.000 -0.071 0.000 0.842 2795 A HN 0.324 nan 8.150 nan 0.000 0.444 2796 Y N -0.577 119.785 120.300 0.104 0.000 2.256 2796 Y HA -0.235 4.314 4.550 -0.000 0.000 0.288 2796 Y C 2.620 178.362 175.900 -0.264 0.000 1.155 2796 Y CA 1.278 59.436 58.100 0.097 0.000 1.203 2796 Y CB -0.214 38.456 38.460 0.350 0.000 0.980 2796 Y HN 0.273 nan 8.280 nan 0.000 0.530 2797 R N 1.218 121.540 120.500 -0.297 0.000 2.096 2797 R HA -0.190 4.150 4.340 -0.000 0.000 0.235 2797 R C 2.417 178.524 176.300 -0.322 0.000 1.127 2797 R CA 1.485 57.256 56.100 -0.548 0.000 0.968 2797 R CB -0.209 29.886 30.300 -0.341 0.000 0.861 2797 R HN 0.334 nan 8.270 nan 0.000 0.440 2798 R N 0.351 120.742 120.500 -0.181 0.000 2.073 2798 R HA -0.062 4.278 4.340 -0.000 0.000 0.229 2798 R C 2.188 178.403 176.300 -0.142 0.000 1.120 2798 R CA 1.202 57.224 56.100 -0.131 0.000 0.967 2798 R CB -0.051 30.203 30.300 -0.076 0.000 0.862 2798 R HN 0.182 nan 8.270 nan 0.000 0.436 2799 R N 0.044 120.473 120.500 -0.119 0.000 2.096 2799 R HA -0.065 4.275 4.340 -0.000 0.000 0.235 2799 R C 2.482 178.604 176.300 -0.297 0.000 1.127 2799 R CA 0.977 57.018 56.100 -0.099 0.000 0.968 2799 R CB -0.440 29.894 30.300 0.058 0.000 0.861 2799 R HN 0.122 nan 8.270 nan 0.000 0.440 2800 R N 1.520 121.676 120.500 -0.573 0.000 2.083 2800 R HA -0.160 4.180 4.340 -0.000 0.000 0.237 2800 R C 1.124 177.161 176.300 -0.438 0.000 1.137 2800 R CA 1.837 57.376 56.100 -0.935 0.000 0.951 2800 R CB -0.441 29.335 30.300 -0.873 0.000 0.851 2800 R HN 0.246 nan 8.270 nan 0.000 0.434 2801 D N 0.231 120.462 120.400 -0.281 0.000 2.277 2801 D HA -0.113 4.527 4.640 -0.000 0.000 0.208 2801 D C 1.578 177.813 176.300 -0.110 0.000 0.962 2801 D CA 0.490 54.396 54.000 -0.157 0.000 0.865 2801 D CB 0.120 40.849 40.800 -0.118 0.000 0.939 2801 D HN 0.160 nan 8.370 nan 0.000 0.510 2802 L N 0.497 121.650 121.223 -0.117 0.000 2.592 2802 L HA 0.151 4.491 4.340 -0.000 0.000 0.227 2802 L C 1.391 178.231 176.870 -0.051 0.000 1.127 2802 L CA 0.594 55.391 54.840 -0.071 0.000 0.884 2802 L CB 0.015 42.036 42.059 -0.063 0.000 1.065 2802 L HN -0.046 nan 8.230 nan 0.000 0.457 2803 L N -1.966 119.220 121.223 -0.062 0.000 2.269 2803 L HA 0.034 4.374 4.340 -0.000 0.000 0.200 2803 L C 2.058 178.942 176.870 0.024 0.000 1.069 2803 L CA 0.348 55.189 54.840 0.002 0.000 0.804 2803 L CB -0.025 42.057 42.059 0.039 0.000 0.987 2803 L HN 0.167 nan 8.230 nan 0.000 0.468 2804 L N 0.432 121.647 121.223 -0.015 0.000 2.042 2804 L HA -0.198 4.142 4.340 -0.000 0.000 0.210 2804 L C 2.698 179.579 176.870 0.018 0.000 1.076 2804 L CA 1.602 56.449 54.840 0.010 0.000 0.749 2804 L CB -1.130 40.918 42.059 -0.019 0.000 0.893 2804 L HN 0.352 nan 8.230 nan 0.000 0.432 2805 E N -0.344 119.855 120.200 -0.000 0.000 2.016 2805 E HA -0.107 4.243 4.350 -0.000 0.000 0.190 2805 E C 2.155 178.768 176.600 0.021 0.000 0.985 2805 E CA 1.256 57.659 56.400 0.006 0.000 0.802 2805 E CB -0.566 29.129 29.700 -0.008 0.000 0.762 2805 E HN 0.435 nan 8.360 nan 0.000 0.448 2806 G N 1.407 110.219 108.800 0.020 0.000 2.450 2806 G HA2 -0.229 3.731 3.960 -0.000 0.000 0.220 2806 G HA3 -0.229 3.731 3.960 -0.000 0.000 0.220 2806 G C 1.759 176.701 174.900 0.071 0.000 1.130 2806 G CA 0.553 45.673 45.100 0.034 0.000 0.760 2806 G HN 0.130 nan 8.290 nan 0.000 0.557 2807 L N -0.188 121.089 121.223 0.090 0.000 2.005 2807 L HA -0.056 4.284 4.340 -0.000 0.000 0.207 2807 L C 3.158 180.077 176.870 0.082 0.000 1.072 2807 L CA 1.542 56.458 54.840 0.126 0.000 0.744 2807 L CB -0.540 41.603 42.059 0.140 0.000 0.895 2807 L HN 0.173 nan 8.230 nan 0.000 0.433 2808 T N -0.551 114.039 114.554 0.060 0.000 2.881 2808 T HA -0.143 4.207 4.350 -0.000 0.000 0.270 2808 T C 1.727 176.449 174.700 0.037 0.000 1.068 2808 T CA 1.187 63.313 62.100 0.044 0.000 1.131 2808 T CB -0.017 68.872 68.868 0.035 0.000 0.871 2808 T HN 0.453 nan 8.240 nan 0.000 0.479 2809 A N 0.530 123.373 122.820 0.038 0.000 1.930 2809 A HA 0.190 4.510 4.320 -0.000 0.000 0.215 2809 A C 2.188 179.794 177.584 0.037 0.000 1.176 2809 A CA 0.735 52.791 52.037 0.032 0.000 0.632 2809 A CB -0.567 18.449 19.000 0.027 0.000 0.819 2809 A HN 0.483 nan 8.150 nan 0.000 0.445 2810 L N -1.677 119.578 121.223 0.053 0.000 2.275 2810 L HA 0.003 4.343 4.340 -0.000 0.000 0.215 2810 L C 2.002 178.897 176.870 0.042 0.000 1.119 2810 L CA 1.030 55.906 54.840 0.059 0.000 0.790 2810 L CB -0.064 42.054 42.059 0.099 0.000 0.919 2810 L HN 0.643 nan 8.230 nan 0.000 0.443 2811 G N -0.723 108.099 108.800 0.036 0.000 2.339 2811 G HA2 -0.241 3.719 3.960 -0.000 0.000 0.209 2811 G HA3 -0.241 3.719 3.960 -0.000 0.000 0.209 2811 G C 0.220 175.130 174.900 0.017 0.000 1.015 2811 G CA -0.208 44.906 45.100 0.022 0.000 0.635 2811 G HN 0.126 nan 8.290 nan 0.000 0.499 2812 L N 1.771 123.003 121.223 0.016 0.000 2.514 2812 L HA 0.361 4.701 4.340 -0.000 0.000 0.280 2812 L C 0.748 177.630 176.870 0.020 0.000 1.223 2812 L CA 0.456 55.295 54.840 -0.002 0.000 0.864 2812 L CB 0.389 42.432 42.059 -0.026 0.000 1.118 2812 L HN 0.201 nan 8.230 nan 0.000 0.494 2813 K N 2.693 123.101 120.400 0.014 0.000 2.156 2813 K HA 0.830 5.150 4.320 -0.000 0.000 0.271 2813 K C -0.565 176.084 176.600 0.082 0.000 0.995 2813 K CA -0.509 55.803 56.287 0.042 0.000 0.890 2813 K CB 1.728 34.246 32.500 0.031 0.000 1.073 2813 K HN 0.669 nan 8.250 nan 0.000 0.454 2814 A N 1.363 124.244 122.820 0.102 0.000 2.594 2814 A HA 0.519 4.839 4.320 -0.000 0.000 0.295 2814 A C -1.023 176.644 177.584 0.138 0.000 1.071 2814 A CA -0.935 51.188 52.037 0.143 0.000 0.685 2814 A CB 1.182 20.266 19.000 0.141 0.000 1.285 2814 A HN 0.432 nan 8.150 nan 0.000 0.405 2815 V N 0.079 120.099 119.914 0.177 0.000 2.432 2815 V HA 0.541 4.661 4.120 -0.000 0.000 0.275 2815 V C 0.638 176.829 176.094 0.160 0.000 1.043 2815 V CA -0.820 61.580 62.300 0.166 0.000 0.925 2815 V CB 0.909 32.879 31.823 0.246 0.000 0.985 2815 V HN 0.902 nan 8.190 nan 0.000 0.466 2816 R N 6.250 126.825 120.500 0.124 0.000 2.421 2816 R HA 0.271 4.611 4.340 -0.000 0.000 0.305 2816 R C -2.195 174.195 176.300 0.150 0.000 1.039 2816 R CA -1.115 55.056 56.100 0.117 0.000 1.003 2816 R CB 0.863 31.212 30.300 0.083 0.000 0.959 2816 R HN 0.686 nan 8.270 nan 0.000 0.427 2817 P HA 0.150 nan 4.420 nan 0.000 0.281 2817 P C -0.605 176.833 177.300 0.230 0.000 1.249 2817 P CA -0.399 62.827 63.100 0.210 0.000 0.810 2817 P CB 1.653 33.525 31.700 0.286 0.000 1.008 2818 S N -0.287 115.513 115.700 0.167 0.000 2.524 2818 S HA 0.342 4.812 4.470 -0.000 0.000 0.222 2818 S C 0.827 175.393 174.600 -0.056 0.000 1.040 2818 S CA 0.261 58.548 58.200 0.145 0.000 0.915 2818 S CB 0.380 63.632 63.200 0.087 0.000 0.831 2818 S HN 0.811 nan 8.310 nan 0.000 0.492 2819 G N 0.025 108.747 108.800 -0.130 0.000 2.725 2819 G HA2 0.710 4.670 3.960 -0.000 0.000 0.288 2819 G HA3 0.710 4.670 3.960 -0.000 0.000 0.288 2819 G C -0.540 174.207 174.900 -0.255 0.000 1.399 2819 G CA -0.064 44.801 45.100 -0.391 0.000 0.859 2819 G HN 0.770 nan 8.290 nan 0.000 0.479 2820 A N -1.282 121.340 122.820 -0.330 0.000 6.643 2820 A HA 0.193 4.513 4.320 -0.000 0.000 0.230 2820 A C 0.118 177.504 177.584 -0.330 0.000 2.273 2820 A CA 1.202 52.950 52.037 -0.482 0.000 0.690 2820 A CB -1.388 17.143 19.000 -0.782 0.000 0.908 2820 A HN 2.295 nan 8.150 nan 0.000 0.366 2821 F N -2.854 116.685 119.950 -0.685 0.000 2.881 2821 F HA 0.696 5.223 4.527 -0.000 0.000 0.343 2821 F C -0.276 174.622 175.800 -1.503 0.000 1.233 2821 F CA -0.959 56.380 58.000 -1.102 0.000 1.262 2821 F CB -0.803 37.542 39.000 -1.092 0.000 0.980 2821 F HN 0.480 nan 8.300 nan 0.000 0.506 2822 Y N -0.745 119.405 120.300 -0.250 0.000 2.587 2822 Y HA 0.807 5.357 4.550 -0.000 0.000 0.337 2822 Y C -0.397 175.549 175.900 0.077 0.000 1.065 2822 Y CA -1.823 56.193 58.100 -0.140 0.000 1.126 2822 Y CB 2.401 40.747 38.460 -0.190 0.000 1.279 2822 Y HN -0.181 nan 8.280 nan 0.000 0.489 2823 V N 2.753 122.818 119.914 0.252 0.000 2.752 2823 V HA 0.235 4.355 4.120 -0.000 0.000 0.302 2823 V C -0.972 175.196 176.094 0.123 0.000 1.133 2823 V CA -0.868 61.570 62.300 0.230 0.000 0.919 2823 V CB 2.124 34.126 31.823 0.300 0.000 1.026 2823 V HN 0.584 nan 8.190 nan 0.000 0.429 2824 L N 5.108 126.376 121.223 0.075 0.000 2.260 2824 L HA 0.557 4.897 4.340 -0.000 0.000 0.289 2824 L C -0.024 176.959 176.870 0.188 0.000 1.057 2824 L CA -0.040 54.822 54.840 0.036 0.000 0.811 2824 L CB 1.309 43.291 42.059 -0.129 0.000 1.184 2824 L HN 0.689 nan 8.230 nan 0.000 0.429 2825 M N 3.304 123.006 119.600 0.171 0.000 2.318 2825 M HA 0.216 4.696 4.480 -0.000 0.000 0.347 2825 M C -0.517 175.845 176.300 0.104 0.000 1.175 2825 M CA -0.491 54.894 55.300 0.142 0.000 1.075 2825 M CB 1.456 34.086 32.600 0.049 0.000 1.614 2825 M HN 0.368 nan 8.290 nan 0.000 0.456 2826 D N 2.300 122.699 120.400 -0.001 0.000 2.422 2826 D HA 0.089 4.729 4.640 -0.000 0.000 0.227 2826 D C 1.038 177.233 176.300 -0.175 0.000 1.190 2826 D CA 0.048 53.902 54.000 -0.244 0.000 0.905 2826 D CB 0.790 41.480 40.800 -0.184 0.000 1.034 2826 D HN 0.699 nan 8.370 nan 0.000 0.507 2827 T N 0.027 114.474 114.554 -0.179 0.000 3.155 2827 T HA -0.142 4.208 4.350 -0.000 0.000 0.264 2827 T C 1.935 176.569 174.700 -0.110 0.000 1.160 2827 T CA 0.734 62.755 62.100 -0.132 0.000 1.075 2827 T CB -0.171 68.640 68.868 -0.096 0.000 0.921 2827 T HN 0.212 nan 8.240 nan 0.000 0.533 2828 S N 2.847 118.473 115.700 -0.123 0.000 2.409 2828 S HA -0.095 4.375 4.470 -0.000 0.000 0.237 2828 S C -0.086 174.479 174.600 -0.059 0.000 1.060 2828 S CA 1.716 59.865 58.200 -0.085 0.000 1.052 2828 S CB -0.856 62.293 63.200 -0.085 0.000 0.871 2828 S HN 0.685 nan 8.310 nan 0.000 0.465 2829 P HA 0.316 nan 4.420 nan 0.000 0.282 2829 P C 0.986 178.258 177.300 -0.047 0.000 1.327 2829 P CA -0.081 62.993 63.100 -0.044 0.000 0.949 2829 P CB 0.202 31.880 31.700 -0.037 0.000 1.445 2830 I N -0.531 120.000 120.570 -0.065 0.000 3.645 2830 I HA 0.361 4.531 4.170 -0.000 0.000 0.300 2830 I C 0.584 176.672 176.117 -0.049 0.000 1.260 2830 I CA 0.050 61.309 61.300 -0.069 0.000 1.365 2830 I CB 0.259 38.188 38.000 -0.118 0.000 1.077 2830 I HN -0.121 nan 8.210 nan 0.000 0.439 2831 A N 0.344 123.138 122.820 -0.044 0.000 2.410 2831 A HA 0.484 4.804 4.320 -0.000 0.000 0.300 2831 A C -2.448 175.119 177.584 -0.028 0.000 1.077 2831 A CA -0.372 51.647 52.037 -0.029 0.000 0.610 2831 A CB -0.228 18.756 19.000 -0.026 0.000 1.371 2831 A HN -0.096 nan 8.150 nan 0.000 0.510 2832 P HA 0.165 nan 4.420 nan 0.000 0.218 2832 P C -0.094 177.198 177.300 -0.012 0.000 1.147 2832 P CA 1.411 64.501 63.100 -0.017 0.000 0.863 2832 P CB 0.073 31.765 31.700 -0.013 0.000 0.812 2833 D N -0.630 119.767 120.400 -0.005 0.000 2.616 2833 D HA 0.036 4.676 4.640 -0.000 0.000 0.260 2833 D C 0.637 176.947 176.300 0.016 0.000 1.158 2833 D CA -0.422 53.584 54.000 0.010 0.000 1.085 2833 D CB 0.377 41.182 40.800 0.009 0.000 1.222 2833 D HN -0.044 nan 8.370 nan 0.000 0.626 2834 E N -0.205 120.024 120.200 0.048 0.000 2.463 2834 E HA 0.066 4.416 4.350 -0.000 0.000 0.193 2834 E C 0.657 177.288 176.600 0.050 0.000 1.041 2834 E CA 0.127 56.558 56.400 0.052 0.000 0.879 2834 E CB -0.050 29.707 29.700 0.096 0.000 0.997 2834 E HN 0.270 nan 8.360 nan 0.000 0.478 2835 V N 0.142 120.082 119.914 0.043 0.000 3.307 2835 V HA 0.159 4.279 4.120 -0.000 0.000 0.244 2835 V C 2.315 178.423 176.094 0.024 0.000 1.196 2835 V CA 0.404 62.727 62.300 0.039 0.000 1.132 2835 V CB -0.153 31.696 31.823 0.043 0.000 0.875 2835 V HN 0.073 nan 8.190 nan 0.000 0.468 2836 R N 1.120 121.629 120.500 0.015 0.000 2.062 2836 R HA 0.031 4.371 4.340 -0.000 0.000 0.229 2836 R C 2.523 178.825 176.300 0.004 0.000 1.128 2836 R CA 1.424 57.529 56.100 0.008 0.000 0.960 2836 R CB -0.607 29.695 30.300 0.003 0.000 0.855 2836 R HN 0.476 nan 8.270 nan 0.000 0.432 2837 A N 1.653 124.472 122.820 -0.003 0.000 1.884 2837 A HA -0.256 4.063 4.320 -0.000 0.000 0.219 2837 A C 2.419 179.995 177.584 -0.012 0.000 1.197 2837 A CA 2.114 54.140 52.037 -0.018 0.000 0.637 2837 A CB -0.968 18.015 19.000 -0.030 0.000 0.827 2837 A HN 0.431 nan 8.150 nan 0.000 0.450 2838 A N -0.388 122.435 122.820 0.005 0.000 1.892 2838 A HA -0.243 4.077 4.320 -0.000 0.000 0.218 2838 A C 1.937 179.536 177.584 0.025 0.000 1.188 2838 A CA 1.915 53.963 52.037 0.019 0.000 0.631 2838 A CB -0.632 18.388 19.000 0.035 0.000 0.822 2838 A HN 0.694 nan 8.150 nan 0.000 0.447 2839 E N -1.131 119.083 120.200 0.023 0.000 2.107 2839 E HA -0.182 4.168 4.350 -0.000 0.000 0.191 2839 E C 2.221 178.835 176.600 0.024 0.000 0.982 2839 E CA 1.113 57.528 56.400 0.025 0.000 0.809 2839 E CB -0.155 29.557 29.700 0.021 0.000 0.756 2839 E HN 0.598 nan 8.360 nan 0.000 0.459 2840 R N 1.389 121.898 120.500 0.015 0.000 2.105 2840 R HA -0.129 4.211 4.340 -0.000 0.000 0.239 2840 R C 1.958 178.274 176.300 0.026 0.000 1.135 2840 R CA 1.214 57.322 56.100 0.014 0.000 0.967 2840 R CB -0.358 29.942 30.300 0.000 0.000 0.861 2840 R HN 0.162 nan 8.270 nan 0.000 0.442 2841 L N -0.250 120.989 121.223 0.027 0.000 2.240 2841 L HA -0.020 4.320 4.340 -0.000 0.000 0.211 2841 L C 2.261 179.183 176.870 0.086 0.000 1.106 2841 L CA 0.554 55.431 54.840 0.062 0.000 0.793 2841 L CB -0.240 41.847 42.059 0.047 0.000 0.927 2841 L HN 0.291 nan 8.230 nan 0.000 0.446 2842 L N -0.309 120.951 121.223 0.062 0.000 2.217 2842 L HA -0.165 4.175 4.340 -0.000 0.000 0.211 2842 L C 2.103 179.003 176.870 0.050 0.000 1.107 2842 L CA 1.217 56.093 54.840 0.059 0.000 0.783 2842 L CB -0.070 42.017 42.059 0.047 0.000 0.919 2842 L HN 0.339 nan 8.230 nan 0.000 0.442 2843 E N -0.454 119.772 120.200 0.045 0.000 2.418 2843 E HA -0.087 4.263 4.350 -0.000 0.000 0.197 2843 E C 1.409 178.035 176.600 0.044 0.000 1.026 2843 E CA 0.670 57.092 56.400 0.037 0.000 0.862 2843 E CB 0.131 29.849 29.700 0.030 0.000 0.799 2843 E HN 0.431 nan 8.360 nan 0.000 0.518 2844 A N 0.155 123.011 122.820 0.061 0.000 2.460 2844 A HA 0.388 4.708 4.320 -0.000 0.000 0.258 2844 A C 1.084 178.709 177.584 0.069 0.000 1.300 2844 A CA 0.339 52.419 52.037 0.071 0.000 0.913 2844 A CB -0.119 18.945 19.000 0.107 0.000 1.031 2844 A HN 0.183 nan 8.150 nan 0.000 0.512 2845 G N -0.763 108.071 108.800 0.057 0.000 2.359 2845 G HA2 -0.004 3.956 3.960 -0.000 0.000 0.298 2845 G HA3 -0.004 3.956 3.960 -0.000 0.000 0.298 2845 G C -0.195 174.738 174.900 0.054 0.000 1.030 2845 G CA 0.546 45.673 45.100 0.045 0.000 1.149 2845 G HN 1.522 nan 8.290 nan 0.000 0.512 2846 V N -0.117 119.848 119.914 0.084 0.000 2.663 2846 V HA 0.712 4.832 4.120 -0.000 0.000 0.286 2846 V C 0.180 176.348 176.094 0.123 0.000 1.085 2846 V CA 0.002 62.366 62.300 0.107 0.000 0.916 2846 V CB 1.316 33.241 31.823 0.170 0.000 1.039 2846 V HN 1.766 nan 8.190 nan 0.000 0.453 2847 A N 6.772 129.646 122.820 0.090 0.000 2.347 2847 A HA 0.750 5.070 4.320 -0.000 0.000 0.287 2847 A C -0.062 177.583 177.584 0.101 0.000 1.199 2847 A CA 0.218 52.305 52.037 0.084 0.000 0.851 2847 A CB 0.685 19.723 19.000 0.062 0.000 1.118 2847 A HN 1.769 nan 8.150 nan 0.000 0.525 2848 V N 0.817 120.792 119.914 0.101 0.000 3.103 2848 V HA 0.853 4.973 4.120 -0.000 0.000 0.318 2848 V C -0.307 175.834 176.094 0.078 0.000 1.114 2848 V CA -0.863 61.496 62.300 0.099 0.000 1.020 2848 V CB 1.703 33.585 31.823 0.097 0.000 1.085 2848 V HN 0.533 nan 8.190 nan 0.000 0.446 2849 V N 1.832 121.785 119.914 0.066 0.000 2.378 2849 V HA 0.453 4.573 4.120 -0.000 0.000 0.288 2849 V C -2.504 173.624 176.094 0.058 0.000 1.016 2849 V CA -1.856 60.492 62.300 0.082 0.000 0.840 2849 V CB 1.321 33.210 31.823 0.111 0.000 0.994 2849 V HN 0.865 nan 8.190 nan 0.000 0.431 2850 P HA 0.092 nan 4.420 nan 0.000 0.264 2850 P C 1.111 178.485 177.300 0.124 0.000 1.193 2850 P CA 0.234 63.388 63.100 0.091 0.000 0.763 2850 P CB 0.759 32.522 31.700 0.105 0.000 0.810 2851 G N 2.297 111.132 108.800 0.059 0.000 2.708 2851 G HA2 -0.181 3.779 3.960 -0.000 0.000 0.210 2851 G HA3 -0.181 3.779 3.960 -0.000 0.000 0.210 2851 G C 1.208 176.156 174.900 0.080 0.000 1.141 2851 G CA 0.482 45.593 45.100 0.019 0.000 0.788 2851 G HN 0.386 nan 8.290 nan 0.000 0.531 2852 T N 1.222 115.870 114.554 0.157 0.000 2.653 2852 T HA -0.159 4.191 4.350 -0.000 0.000 0.268 2852 T C 1.576 176.317 174.700 0.069 0.000 1.035 2852 T CA 1.704 63.927 62.100 0.206 0.000 1.154 2852 T CB -0.213 68.801 68.868 0.243 0.000 0.862 2852 T HN 0.251 nan 8.240 nan 0.000 0.441 2853 D N -0.114 120.299 120.400 0.022 0.000 2.328 2853 D HA 0.153 4.793 4.640 -0.000 0.000 0.226 2853 D C 0.484 176.456 176.300 -0.546 0.000 1.066 2853 D CA 0.203 54.078 54.000 -0.208 0.000 0.861 2853 D CB -0.128 40.508 40.800 -0.274 0.000 0.912 2853 D HN 0.427 nan 8.370 nan 0.000 0.521 2854 F N -0.246 119.414 119.950 -0.483 0.000 2.706 2854 F HA 0.390 4.917 4.527 -0.000 0.000 0.313 2854 F C 1.270 176.464 175.800 -1.011 0.000 1.096 2854 F CA -0.355 57.195 58.000 -0.750 0.000 1.219 2854 F CB 0.227 38.951 39.000 -0.459 0.000 1.051 2854 F HN -0.118 nan 8.300 nan 0.000 0.568 2855 A N 0.825 123.182 122.820 -0.772 0.000 2.869 2855 A HA -0.015 4.305 4.320 -0.000 0.000 0.280 2855 A C 0.654 177.691 177.584 -0.912 0.000 1.458 2855 A CA 0.684 52.106 52.037 -1.024 0.000 0.776 2855 A CB -1.971 16.701 19.000 -0.547 0.000 1.028 2855 A HN 0.738 nan 8.150 nan 0.000 0.547 2856 A N 0.026 122.408 122.820 -0.729 0.000 2.923 2856 A HA 0.658 4.978 4.320 -0.000 0.000 0.343 2856 A C -0.166 177.283 177.584 -0.225 0.000 1.199 2856 A CA -0.442 51.362 52.037 -0.389 0.000 0.878 2856 A CB -0.226 18.580 19.000 -0.323 0.000 1.104 2856 A HN 0.808 nan 8.150 nan 0.000 0.483 2857 F N 0.785 120.805 119.950 0.116 0.000 2.456 2857 F HA 0.445 4.972 4.527 -0.000 0.000 0.358 2857 F C 1.541 177.438 175.800 0.161 0.000 1.095 2857 F CA 0.934 59.003 58.000 0.115 0.000 1.216 2857 F CB 1.122 40.167 39.000 0.076 0.000 1.125 2857 F HN 0.717 nan 8.300 nan 0.000 0.549 2858 G N 1.805 110.760 108.800 0.258 0.000 2.182 2858 G HA2 -0.251 3.709 3.960 -0.000 0.000 0.248 2858 G HA3 -0.251 3.709 3.960 -0.000 0.000 0.248 2858 G C -0.690 174.123 174.900 -0.145 0.000 1.042 2858 G CA -0.337 44.798 45.100 0.058 0.000 0.775 2858 G HN 0.881 nan 8.290 nan 0.000 0.501 2859 H N -2.585 116.505 119.070 0.034 0.000 3.017 2859 H HA 0.737 5.293 4.556 -0.000 0.000 0.346 2859 H C -0.916 174.390 175.328 -0.037 0.000 1.286 2859 H CA -0.486 55.557 56.048 -0.008 0.000 1.120 2859 H CB 2.489 32.235 29.762 -0.026 0.000 1.860 2859 H HN 0.380 nan 8.280 nan 0.000 0.542 2860 V N 1.356 121.314 119.914 0.074 0.000 2.888 2860 V HA 0.371 4.491 4.120 -0.000 0.000 0.309 2860 V C -0.804 175.269 176.094 -0.035 0.000 1.114 2860 V CA -0.771 61.530 62.300 0.002 0.000 0.940 2860 V CB 2.211 34.032 31.823 -0.003 0.000 1.021 2860 V HN 0.651 nan 8.190 nan 0.000 0.426 2861 R N 4.941 125.373 120.500 -0.114 0.000 2.220 2861 R HA 0.523 4.863 4.340 -0.000 0.000 0.340 2861 R C -0.927 175.374 176.300 0.003 0.000 1.076 2861 R CA -0.288 55.724 56.100 -0.146 0.000 0.920 2861 R CB 0.298 30.344 30.300 -0.424 0.000 1.062 2861 R HN 0.619 nan 8.270 nan 0.000 0.469 2862 L N 1.588 122.862 121.223 0.085 0.000 2.439 2862 L HA 0.345 4.685 4.340 -0.000 0.000 0.259 2862 L C 0.435 177.400 176.870 0.158 0.000 1.129 2862 L CA -0.468 54.466 54.840 0.157 0.000 0.803 2862 L CB 1.645 43.840 42.059 0.226 0.000 1.161 2862 L HN 0.496 nan 8.230 nan 0.000 0.462 2863 S N -0.625 115.144 115.700 0.115 0.000 2.496 2863 S HA 0.255 4.725 4.470 -0.000 0.000 0.221 2863 S C 0.070 174.606 174.600 -0.106 0.000 1.260 2863 S CA -0.703 57.487 58.200 -0.017 0.000 1.181 2863 S CB 0.173 63.401 63.200 0.048 0.000 1.136 2863 S HN 0.489 nan 8.310 nan 0.000 0.467 2864 Y N 2.047 122.345 120.300 -0.003 0.000 2.665 2864 Y HA 0.379 4.929 4.550 -0.000 0.000 0.320 2864 Y C 1.531 177.348 175.900 -0.137 0.000 1.204 2864 Y CA 0.295 58.368 58.100 -0.044 0.000 1.315 2864 Y CB -0.762 37.700 38.460 0.003 0.000 1.033 2864 Y HN 0.618 nan 8.280 nan 0.000 0.509 2865 A N 0.510 123.045 122.820 -0.474 0.000 2.235 2865 A HA 0.056 4.376 4.320 -0.000 0.000 0.208 2865 A C 1.529 178.901 177.584 -0.352 0.000 1.172 2865 A CA 0.733 52.351 52.037 -0.699 0.000 0.786 2865 A CB -1.058 16.946 19.000 -1.660 0.000 0.804 2865 A HN 0.570 nan 8.150 nan 0.000 0.479 2866 T N -2.686 111.751 114.554 -0.194 0.000 2.920 2866 T HA 0.476 4.825 4.350 -0.000 0.000 0.292 2866 T C 0.697 175.330 174.700 -0.112 0.000 1.093 2866 T CA 0.157 62.172 62.100 -0.143 0.000 0.944 2866 T CB 0.291 69.103 68.868 -0.093 0.000 1.605 2866 T HN 0.515 nan 8.240 nan 0.000 0.590 2867 S N -0.461 115.176 115.700 -0.105 0.000 2.584 2867 S HA 0.096 4.566 4.470 -0.000 0.000 0.270 2867 S C 1.155 175.719 174.600 -0.059 0.000 1.346 2867 S CA -0.406 57.736 58.200 -0.096 0.000 1.018 2867 S CB 0.180 63.326 63.200 -0.090 0.000 0.899 2867 S HN 0.698 nan 8.310 nan 0.000 0.542 2868 E N 0.849 121.016 120.200 -0.056 0.000 2.153 2868 E HA -0.145 4.205 4.350 -0.000 0.000 0.194 2868 E C 1.507 178.083 176.600 -0.042 0.000 0.988 2868 E CA 1.249 57.626 56.400 -0.038 0.000 0.811 2868 E CB -0.096 29.583 29.700 -0.036 0.000 0.746 2868 E HN 0.831 nan 8.360 nan 0.000 0.466 2869 E N 0.354 120.527 120.200 -0.046 0.000 2.481 2869 E HA 0.017 4.367 4.350 -0.000 0.000 0.195 2869 E C 1.250 177.818 176.600 -0.052 0.000 1.047 2869 E CA 0.437 56.810 56.400 -0.045 0.000 0.867 2869 E CB -0.036 29.640 29.700 -0.040 0.000 0.858 2869 E HN 0.241 nan 8.360 nan 0.000 0.513 2870 N N -0.954 117.712 118.700 -0.056 0.000 2.402 2870 N HA 0.048 4.788 4.740 -0.000 0.000 0.174 2870 N C 1.395 176.854 175.510 -0.086 0.000 1.027 2870 N CA 0.222 53.234 53.050 -0.065 0.000 0.891 2870 N CB 0.258 38.711 38.487 -0.057 0.000 1.016 2870 N HN 0.140 nan 8.380 nan 0.000 0.439 2871 L N 0.753 121.933 121.223 -0.072 0.000 2.109 2871 L HA -0.060 4.280 4.340 -0.000 0.000 0.207 2871 L C 2.495 179.295 176.870 -0.117 0.000 1.086 2871 L CA 0.878 55.666 54.840 -0.086 0.000 0.760 2871 L CB -0.170 41.870 42.059 -0.032 0.000 0.910 2871 L HN 0.040 nan 8.230 nan 0.000 0.437 2872 R N 0.399 120.849 120.500 -0.084 0.000 2.081 2872 R HA -0.158 4.182 4.340 -0.000 0.000 0.235 2872 R C 2.231 178.474 176.300 -0.096 0.000 1.131 2872 R CA 1.517 57.571 56.100 -0.077 0.000 0.960 2872 R CB 0.007 30.275 30.300 -0.053 0.000 0.856 2872 R HN 0.236 nan 8.270 nan 0.000 0.436 2873 K N -0.835 119.505 120.400 -0.100 0.000 2.031 2873 K HA 0.032 4.352 4.320 -0.000 0.000 0.205 2873 K C 2.078 178.581 176.600 -0.162 0.000 1.049 2873 K CA 1.171 57.398 56.287 -0.100 0.000 0.939 2873 K CB -0.143 32.312 32.500 -0.076 0.000 0.717 2873 K HN 0.174 nan 8.250 nan 0.000 0.438 2874 A N 1.321 124.001 122.820 -0.233 0.000 1.978 2874 A HA -0.136 4.184 4.320 -0.000 0.000 0.220 2874 A C 2.084 179.220 177.584 -0.746 0.000 1.170 2874 A CA 1.294 53.070 52.037 -0.435 0.000 0.636 2874 A CB -0.598 18.142 19.000 -0.433 0.000 0.810 2874 A HN 0.177 nan 8.150 nan 0.000 0.448 2875 L N -1.293 119.639 121.223 -0.484 0.000 2.156 2875 L HA -0.126 4.214 4.340 -0.000 0.000 0.208 2875 L C 2.534 179.309 176.870 -0.158 0.000 1.095 2875 L CA 1.448 56.076 54.840 -0.352 0.000 0.770 2875 L CB -0.212 41.750 42.059 -0.160 0.000 0.914 2875 L HN 0.538 nan 8.230 nan 0.000 0.439 2876 E N 0.052 120.174 120.200 -0.130 0.000 2.028 2876 E HA -0.182 4.168 4.350 -0.000 0.000 0.190 2876 E C 2.274 178.867 176.600 -0.013 0.000 0.984 2876 E CA 0.869 57.239 56.400 -0.049 0.000 0.800 2876 E CB 0.139 29.812 29.700 -0.045 0.000 0.758 2876 E HN 0.316 nan 8.360 nan 0.000 0.448 2877 R N -0.373 120.103 120.500 -0.040 0.000 2.193 2877 R HA -0.094 4.246 4.340 -0.000 0.000 0.229 2877 R C 2.214 178.631 176.300 0.196 0.000 1.110 2877 R CA 0.873 56.999 56.100 0.044 0.000 0.988 2877 R CB -0.207 30.108 30.300 0.026 0.000 0.871 2877 R HN 0.320 nan 8.270 nan 0.000 0.458 2878 F N 0.825 120.783 119.950 0.014 0.000 2.098 2878 F HA -0.133 4.394 4.527 -0.000 0.000 0.294 2878 F C 2.811 178.618 175.800 0.012 0.000 1.107 2878 F CA 0.207 58.216 58.000 0.015 0.000 1.234 2878 F CB -0.323 38.688 39.000 0.018 0.000 1.002 2878 F HN 0.091 nan 8.300 nan 0.000 0.472 2879 A N 1.074 124.030 122.820 0.228 0.000 1.915 2879 A HA -0.299 4.021 4.320 -0.000 0.000 0.220 2879 A C 2.099 179.733 177.584 0.084 0.000 1.198 2879 A CA 2.296 54.406 52.037 0.121 0.000 0.647 2879 A CB -0.929 18.116 19.000 0.075 0.000 0.825 2879 A HN 0.383 nan 8.150 nan 0.000 0.456 2880 R N -1.321 119.226 120.500 0.077 0.000 2.075 2880 R HA -0.006 4.334 4.340 -0.000 0.000 0.232 2880 R C 2.060 178.392 176.300 0.053 0.000 1.126 2880 R CA 1.099 57.232 56.100 0.054 0.000 0.963 2880 R CB -0.824 29.503 30.300 0.045 0.000 0.858 2880 R HN 0.350 nan 8.270 nan 0.000 0.435 2881 V N 2.271 122.227 119.914 0.070 0.000 2.278 2881 V HA -0.213 3.907 4.120 -0.000 0.000 0.251 2881 V C 1.561 177.674 176.094 0.031 0.000 1.062 2881 V CA 1.569 63.900 62.300 0.051 0.000 1.038 2881 V CB -0.267 31.593 31.823 0.062 0.000 0.646 2881 V HN 0.140 nan 8.190 nan 0.000 0.447 2882 L N 0.000 121.244 121.223 0.035 0.000 2.949 2882 L HA 0.000 4.340 4.340 -0.000 0.000 0.249 2882 L CA 0.000 54.852 54.840 0.020 0.000 0.813 2882 L CB 0.000 42.073 42.059 0.024 0.000 0.961 2882 L HN 0.000 nan 8.230 nan 0.000 0.502