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 3izn_1_F DATA FIRST_RESID 2456 DATA SEQUENCE VLPENMKRYM GRDAQRMNIL AGRIIAETVR STLGPKGMDK MLVDDLGDVV DATA SEQUENCE VTNDGVTILR EMSVEHPAAK MLIEVAKTQE KEVGDGTTTA VVVAGELLRK DATA SEQUENCE AEELLDQNVH PTIVVKGYQA AAQKAQELLK TIACEVGAQD KEILTKIAMT DATA SEQUENCE SITGKGAEKA KEKLAEIIVE AVSAVVDDEG KVDKDLIKIE KKSGASIDDT DATA SEQUENCE ELIKGVLVDK ERVSAQMPKK VTDAKIALLN CAIEETASEM LKDMVAEIKA DATA SEQUENCE SGANVLFCQK GIDDLAQHYL AKEGIVAARR VKKSDMEKLA KATGANVITN DATA SEQUENCE IKDLSAQDLG DAGLVEERKI SGDSMIFVEE CKHPKAVTML IRGTTEHVIE DATA SEQUENCE EVARAVDDAV GVVGCTIEDG RIVSGGGSTE VELSMKLREY AEGISGREQL DATA SEQUENCE AVRAFADALE VIPRTLAENA GLDAIEILVK VRAAHASNGN KCAGLNVFTG DATA SEQUENCE AVEDMCENGV VEPLRVKTQA IQSAAESTEM LLRIDDVIAA E 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 2456 V HA 0.000 nan 4.120 nan 0.000 0.244 2456 V C 0.000 176.086 176.094 -0.014 0.000 1.182 2456 V CA 0.000 62.293 62.300 -0.012 0.000 1.235 2456 V CB 0.000 31.816 31.823 -0.011 0.000 1.184 2457 L N 2.893 124.106 121.223 -0.017 0.000 2.307 2457 L HA 0.564 4.904 4.340 0.000 0.000 0.282 2457 L C -2.217 174.641 176.870 -0.020 0.000 1.051 2457 L CA -1.513 53.315 54.840 -0.020 0.000 0.804 2457 L CB 0.749 42.792 42.059 -0.025 0.000 1.197 2457 L HN 0.164 nan 8.230 nan 0.000 0.431 2458 P HA 0.100 nan 4.420 nan 0.000 0.268 2458 P C -0.738 176.550 177.300 -0.021 0.000 1.204 2458 P CA -0.232 62.858 63.100 -0.017 0.000 0.768 2458 P CB 0.445 32.136 31.700 -0.015 0.000 0.842 2459 E N 2.208 122.397 120.200 -0.019 0.000 2.360 2459 E HA 0.050 4.400 4.350 0.000 0.000 0.269 2459 E C 0.564 177.154 176.600 -0.018 0.000 1.022 2459 E CA 0.123 56.510 56.400 -0.021 0.000 0.887 2459 E CB 0.292 29.981 29.700 -0.018 0.000 0.990 2459 E HN 0.514 nan 8.360 nan 0.000 0.426 2460 N N 1.048 119.737 118.700 -0.019 0.000 2.993 2460 N HA -0.147 4.593 4.740 0.000 0.000 0.171 2460 N C -0.739 174.766 175.510 -0.010 0.000 1.446 2460 N CA 0.703 53.746 53.050 -0.011 0.000 1.542 2460 N CB -0.482 38.001 38.487 -0.007 0.000 1.042 2460 N HN 0.321 nan 8.380 nan 0.000 0.638 2461 M N 1.525 121.116 119.600 -0.016 0.000 2.250 2461 M HA 0.297 4.777 4.480 0.000 0.000 0.344 2461 M C -0.001 176.280 176.300 -0.032 0.000 1.150 2461 M CA 0.335 55.626 55.300 -0.015 0.000 1.147 2461 M CB 0.903 33.493 32.600 -0.018 0.000 1.498 2461 M HN 0.044 nan 8.290 nan 0.000 0.461 2462 K N 1.896 122.285 120.400 -0.018 0.000 2.244 2462 K HA 0.584 4.904 4.320 0.000 0.000 0.260 2462 K C -0.497 176.053 176.600 -0.083 0.000 0.951 2462 K CA -0.636 55.608 56.287 -0.071 0.000 0.826 2462 K CB 2.404 34.930 32.500 0.044 0.000 1.108 2462 K HN 0.529 nan 8.250 nan 0.000 0.433 2463 R N 3.122 123.471 120.500 -0.251 0.000 2.538 2463 R HA 0.320 4.660 4.340 0.000 0.000 0.292 2463 R C -1.606 174.493 176.300 -0.336 0.000 1.008 2463 R CA -0.512 55.490 56.100 -0.164 0.000 0.896 2463 R CB 0.883 31.131 30.300 -0.087 0.000 1.187 2463 R HN 0.550 nan 8.270 nan 0.000 0.440 2464 Y N 3.286 123.590 120.300 0.006 0.000 2.562 2464 Y HA 0.570 5.120 4.550 -0.000 0.000 0.343 2464 Y C 0.231 176.132 175.900 0.001 0.000 1.025 2464 Y CA -0.869 57.234 58.100 0.004 0.000 1.082 2464 Y CB 2.438 40.903 38.460 0.008 0.000 1.264 2464 Y HN 0.307 nan 8.280 nan 0.000 0.478 2465 M N 0.546 120.237 119.600 0.152 0.000 2.593 2465 M HA 0.584 5.064 4.480 0.000 0.000 0.290 2465 M C 0.458 176.793 176.300 0.059 0.000 1.244 2465 M CA -0.335 55.011 55.300 0.076 0.000 0.857 2465 M CB 2.471 35.095 32.600 0.039 0.000 1.738 2465 M HN 0.889 nan 8.290 nan 0.000 0.461 2466 G N 2.016 110.832 108.800 0.026 0.000 2.556 2466 G HA2 -0.335 3.625 3.960 0.000 0.000 0.283 2466 G HA3 -0.335 3.625 3.960 0.000 0.000 0.283 2466 G C 0.505 175.399 174.900 -0.010 0.000 1.177 2466 G CA 0.792 45.892 45.100 -0.001 0.000 0.978 2466 G HN 0.988 nan 8.290 nan 0.000 0.554 2467 R N 0.510 121.002 120.500 -0.014 0.000 2.237 2467 R HA 0.064 4.404 4.340 0.000 0.000 0.219 2467 R C 1.553 177.841 176.300 -0.021 0.000 1.080 2467 R CA 2.068 58.153 56.100 -0.025 0.000 0.995 2467 R CB -0.269 30.016 30.300 -0.024 0.000 0.875 2467 R HN 0.495 nan 8.270 nan 0.000 0.462 2468 D N 1.434 121.842 120.400 0.014 0.000 2.183 2468 D HA 0.007 4.647 4.640 0.000 0.000 0.205 2468 D C 1.960 178.248 176.300 -0.020 0.000 0.962 2468 D CA 1.349 55.357 54.000 0.013 0.000 0.849 2468 D CB -0.012 40.885 40.800 0.160 0.000 0.978 2468 D HN 0.392 nan 8.370 nan 0.000 0.488 2469 A N 1.160 124.020 122.820 0.067 0.000 1.902 2469 A HA -0.183 4.137 4.320 0.000 0.000 0.217 2469 A C 2.141 179.723 177.584 -0.003 0.000 1.181 2469 A CA 1.202 53.282 52.037 0.073 0.000 0.623 2469 A CB -0.286 18.762 19.000 0.080 0.000 0.818 2469 A HN 0.052 nan 8.150 nan 0.000 0.443 2470 Q N -0.724 119.060 119.800 -0.027 0.000 2.123 2470 Q HA -0.106 4.234 4.340 0.000 0.000 0.199 2470 Q C 2.231 178.184 176.000 -0.079 0.000 0.966 2470 Q CA 1.448 57.221 55.803 -0.050 0.000 0.845 2470 Q CB -0.398 28.306 28.738 -0.057 0.000 0.907 2470 Q HN 0.769 nan 8.270 nan 0.000 0.439 2471 R N -0.096 120.348 120.500 -0.094 0.000 2.070 2471 R HA -0.081 4.259 4.340 0.000 0.000 0.233 2471 R C 2.167 178.372 176.300 -0.158 0.000 1.137 2471 R CA 1.305 57.334 56.100 -0.117 0.000 0.945 2471 R CB 0.029 30.260 30.300 -0.115 0.000 0.845 2471 R HN 0.132 nan 8.270 nan 0.000 0.430 2472 M N 0.819 120.289 119.600 -0.217 0.000 2.132 2472 M HA -0.105 4.375 4.480 0.000 0.000 0.263 2472 M C 1.732 177.907 176.300 -0.208 0.000 1.065 2472 M CA 1.450 56.597 55.300 -0.255 0.000 1.122 2472 M CB -1.135 31.209 32.600 -0.426 0.000 1.365 2472 M HN 0.165 nan 8.290 nan 0.000 0.411 2473 N N 0.658 119.279 118.700 -0.133 0.000 2.216 2473 N HA 0.002 4.742 4.740 0.000 0.000 0.183 2473 N C 1.850 177.221 175.510 -0.232 0.000 1.017 2473 N CA 1.101 54.066 53.050 -0.143 0.000 0.861 2473 N CB -0.259 38.272 38.487 0.073 0.000 0.986 2473 N HN 0.365 nan 8.380 nan 0.000 0.428 2474 I N 0.316 120.797 120.570 -0.148 0.000 2.252 2474 I HA -0.200 3.970 4.170 0.000 0.000 0.245 2474 I C 1.659 177.687 176.117 -0.148 0.000 1.102 2474 I CA 0.546 61.771 61.300 -0.126 0.000 1.385 2474 I CB -0.092 37.851 38.000 -0.096 0.000 1.064 2474 I HN 0.019 nan 8.210 nan 0.000 0.414 2475 L N 0.856 121.982 121.223 -0.162 0.000 2.127 2475 L HA -0.194 4.146 4.340 0.000 0.000 0.211 2475 L C 2.679 179.450 176.870 -0.166 0.000 1.089 2475 L CA 1.980 56.734 54.840 -0.144 0.000 0.757 2475 L CB -1.247 40.729 42.059 -0.137 0.000 0.899 2475 L HN 0.211 nan 8.230 nan 0.000 0.434 2476 A N -0.665 121.994 122.820 -0.268 0.000 1.908 2476 A HA -0.140 4.180 4.320 0.000 0.000 0.218 2476 A C 2.435 179.918 177.584 -0.168 0.000 1.181 2476 A CA 1.790 53.654 52.037 -0.290 0.000 0.627 2476 A CB -1.290 17.301 19.000 -0.681 0.000 0.818 2476 A HN 0.441 nan 8.150 nan 0.000 0.445 2477 G N -0.943 107.764 108.800 -0.154 0.000 2.402 2477 G HA2 -0.234 3.726 3.960 0.000 0.000 0.216 2477 G HA3 -0.234 3.726 3.960 0.000 0.000 0.216 2477 G C 1.727 176.588 174.900 -0.064 0.000 1.162 2477 G CA 0.860 45.912 45.100 -0.081 0.000 0.777 2477 G HN 0.450 nan 8.290 nan 0.000 0.539 2478 R N 0.503 120.959 120.500 -0.074 0.000 2.105 2478 R HA -0.024 4.316 4.340 0.000 0.000 0.239 2478 R C 2.510 178.779 176.300 -0.052 0.000 1.135 2478 R CA 1.117 57.182 56.100 -0.058 0.000 0.967 2478 R CB -0.475 29.789 30.300 -0.060 0.000 0.861 2478 R HN 0.456 nan 8.270 nan 0.000 0.442 2479 I N 0.813 121.347 120.570 -0.059 0.000 2.226 2479 I HA -0.307 3.863 4.170 0.000 0.000 0.245 2479 I C 2.214 178.310 176.117 -0.035 0.000 1.100 2479 I CA 0.845 62.117 61.300 -0.046 0.000 1.374 2479 I CB -0.229 37.741 38.000 -0.050 0.000 1.057 2479 I HN 0.113 nan 8.210 nan 0.000 0.413 2480 I N 1.027 121.577 120.570 -0.034 0.000 2.226 2480 I HA -0.254 3.916 4.170 0.000 0.000 0.245 2480 I C 2.850 178.953 176.117 -0.022 0.000 1.100 2480 I CA 1.691 62.977 61.300 -0.023 0.000 1.374 2480 I CB -1.558 36.432 38.000 -0.018 0.000 1.057 2480 I HN 0.183 nan 8.210 nan 0.000 0.413 2481 A N 0.451 123.255 122.820 -0.027 0.000 1.902 2481 A HA -0.197 4.123 4.320 0.000 0.000 0.217 2481 A C 2.231 179.799 177.584 -0.027 0.000 1.181 2481 A CA 1.441 53.462 52.037 -0.027 0.000 0.623 2481 A CB -0.608 18.374 19.000 -0.031 0.000 0.818 2481 A HN 0.470 nan 8.150 nan 0.000 0.443 2482 E N -0.894 119.289 120.200 -0.028 0.000 2.204 2482 E HA -0.106 4.244 4.350 0.000 0.000 0.194 2482 E C 1.946 178.533 176.600 -0.023 0.000 0.989 2482 E CA 1.398 57.782 56.400 -0.027 0.000 0.824 2482 E CB -0.186 29.497 29.700 -0.028 0.000 0.756 2482 E HN 0.629 nan 8.360 nan 0.000 0.477 2483 T N 0.693 115.234 114.554 -0.021 0.000 2.698 2483 T HA -0.113 4.237 4.350 0.000 0.000 0.260 2483 T C 2.174 176.864 174.700 -0.016 0.000 1.044 2483 T CA 1.545 63.635 62.100 -0.017 0.000 1.149 2483 T CB -0.151 68.709 68.868 -0.014 0.000 0.864 2483 T HN 0.190 nan 8.240 nan 0.000 0.419 2484 V N 2.130 122.035 119.914 -0.016 0.000 3.129 2484 V HA 0.032 4.152 4.120 0.000 0.000 0.259 2484 V C 2.320 178.403 176.094 -0.019 0.000 1.116 2484 V CA 1.076 63.367 62.300 -0.015 0.000 1.127 2484 V CB -1.049 30.767 31.823 -0.013 0.000 0.742 2484 V HN 0.477 nan 8.190 nan 0.000 0.474 2485 R N 2.773 123.260 120.500 -0.022 0.000 2.249 2485 R HA -0.134 4.206 4.340 0.000 0.000 0.230 2485 R C 2.015 178.299 176.300 -0.027 0.000 1.121 2485 R CA 1.779 57.864 56.100 -0.026 0.000 0.997 2485 R CB -1.208 29.075 30.300 -0.029 0.000 0.867 2485 R HN 0.706 nan 8.270 nan 0.000 0.465 2486 S N 0.293 115.979 115.700 -0.024 0.000 2.515 2486 S HA -0.084 4.386 4.470 0.000 0.000 0.231 2486 S C 1.734 176.318 174.600 -0.025 0.000 0.987 2486 S CA 0.865 59.050 58.200 -0.024 0.000 0.936 2486 S CB -0.057 63.131 63.200 -0.020 0.000 0.766 2486 S HN 0.588 nan 8.310 nan 0.000 0.528 2487 T N -0.683 113.857 114.554 -0.023 0.000 3.044 2487 T HA 0.390 4.740 4.350 0.000 0.000 0.250 2487 T C 0.514 175.197 174.700 -0.027 0.000 1.081 2487 T CA -0.476 61.611 62.100 -0.021 0.000 1.040 2487 T CB -0.501 68.358 68.868 -0.014 0.000 0.962 2487 T HN 0.301 nan 8.240 nan 0.000 0.506 2488 L N 2.220 123.424 121.223 -0.032 0.000 2.456 2488 L HA 0.503 4.843 4.340 0.000 0.000 0.272 2488 L C 1.195 178.035 176.870 -0.051 0.000 1.189 2488 L CA 0.943 55.761 54.840 -0.036 0.000 0.846 2488 L CB -0.160 41.877 42.059 -0.037 0.000 1.111 2488 L HN 0.670 nan 8.230 nan 0.000 0.475 2489 G N 3.181 111.951 108.800 -0.050 0.000 2.663 2489 G HA2 -0.132 3.828 3.960 0.000 0.000 0.686 2489 G HA3 -0.132 3.828 3.960 0.000 0.000 0.686 2489 G C -2.403 172.440 174.900 -0.095 0.000 1.246 2489 G CA -0.728 44.327 45.100 -0.076 0.000 0.795 2489 G HN 0.472 nan 8.290 nan 0.000 0.627 2490 P HA -0.009 nan 4.420 nan 0.000 0.218 2490 P C 1.256 178.366 177.300 -0.315 0.000 1.148 2490 P CA 1.293 64.287 63.100 -0.178 0.000 0.822 2490 P CB 0.159 31.708 31.700 -0.251 0.000 0.784 2491 K N -0.329 119.845 120.400 -0.378 0.000 2.576 2491 K HA 0.293 4.613 4.320 0.000 0.000 0.209 2491 K C 0.956 177.469 176.600 -0.145 0.000 1.049 2491 K CA -0.126 55.992 56.287 -0.281 0.000 1.140 2491 K CB -0.022 32.277 32.500 -0.335 0.000 0.871 2491 K HN 0.057 nan 8.250 nan 0.000 0.479 2492 G N 0.844 109.579 108.800 -0.109 0.000 2.634 2492 G HA2 0.238 4.198 3.960 0.000 0.000 0.255 2492 G HA3 0.238 4.198 3.960 0.000 0.000 0.255 2492 G C 0.281 175.154 174.900 -0.046 0.000 1.205 2492 G CA -0.393 44.667 45.100 -0.067 0.000 0.884 2492 G HN -0.027 nan 8.290 nan 0.000 0.549 2493 M N -0.152 119.428 119.600 -0.034 0.000 2.679 2493 M HA 0.441 4.921 4.480 0.000 0.000 0.287 2493 M C -0.588 175.704 176.300 -0.013 0.000 1.202 2493 M CA -0.639 54.647 55.300 -0.022 0.000 0.911 2493 M CB 1.269 33.856 32.600 -0.021 0.000 1.556 2493 M HN 0.344 nan 8.290 nan 0.000 0.511 2494 D N 0.139 120.535 120.400 -0.007 0.000 2.449 2494 D HA 0.600 5.240 4.640 0.000 0.000 0.250 2494 D C -0.698 175.602 176.300 0.001 0.000 1.050 2494 D CA -0.418 53.582 54.000 0.000 0.000 1.024 2494 D CB 1.497 42.302 40.800 0.007 0.000 1.218 2494 D HN 0.263 nan 8.370 nan 0.000 0.566 2495 K N 0.134 120.537 120.400 0.006 0.000 2.385 2495 K HA 0.547 4.867 4.320 0.000 0.000 0.248 2495 K C -0.798 175.811 176.600 0.016 0.000 0.955 2495 K CA -0.815 55.477 56.287 0.007 0.000 0.816 2495 K CB 2.825 35.328 32.500 0.005 0.000 1.250 2495 K HN 0.276 nan 8.250 nan 0.000 0.434 2496 M N 3.497 123.106 119.600 0.015 0.000 2.078 2496 M HA 0.314 4.794 4.480 0.000 0.000 0.320 2496 M C -1.871 174.443 176.300 0.024 0.000 0.969 2496 M CA -0.959 54.355 55.300 0.025 0.000 0.929 2496 M CB 0.579 33.188 32.600 0.014 0.000 1.504 2496 M HN 0.396 nan 8.290 nan 0.000 0.419 2497 L N 5.473 126.715 121.223 0.032 0.000 2.322 2497 L HA 0.626 4.966 4.340 0.000 0.000 0.281 2497 L C -0.881 176.009 176.870 0.032 0.000 1.014 2497 L CA -0.451 54.405 54.840 0.025 0.000 0.815 2497 L CB 2.164 44.234 42.059 0.019 0.000 1.247 2497 L HN 0.434 nan 8.230 nan 0.000 0.421 2498 V N 2.792 122.722 119.914 0.026 0.000 2.378 2498 V HA 0.358 4.478 4.120 0.000 0.000 0.288 2498 V C -0.313 175.792 176.094 0.019 0.000 1.016 2498 V CA -0.975 61.342 62.300 0.028 0.000 0.840 2498 V CB 1.450 33.289 31.823 0.026 0.000 0.994 2498 V HN 0.841 nan 8.190 nan 0.000 0.431 2499 D N 3.486 123.896 120.400 0.017 0.000 2.398 2499 D HA 0.003 4.643 4.640 0.000 0.000 0.264 2499 D C 1.033 177.339 176.300 0.010 0.000 1.263 2499 D CA -0.217 53.789 54.000 0.011 0.000 1.037 2499 D CB 0.469 41.273 40.800 0.007 0.000 1.101 2499 D HN 0.570 nan 8.370 nan 0.000 0.551 2500 D N -0.849 119.555 120.400 0.007 0.000 2.348 2500 D HA -0.122 4.518 4.640 0.000 0.000 0.216 2500 D C 1.660 177.964 176.300 0.006 0.000 0.970 2500 D CA 0.504 54.508 54.000 0.006 0.000 0.889 2500 D CB -0.155 40.648 40.800 0.005 0.000 0.912 2500 D HN 0.381 nan 8.370 nan 0.000 0.524 2501 L N -0.851 120.376 121.223 0.007 0.000 2.554 2501 L HA 0.306 4.646 4.340 0.000 0.000 0.225 2501 L C 1.848 178.724 176.870 0.010 0.000 1.104 2501 L CA 0.541 55.385 54.840 0.006 0.000 0.866 2501 L CB 0.259 42.320 42.059 0.004 0.000 1.047 2501 L HN 0.298 nan 8.230 nan 0.000 0.468 2502 G N -0.367 108.441 108.800 0.013 0.000 2.218 2502 G HA2 -0.252 3.708 3.960 0.000 0.000 0.216 2502 G HA3 -0.252 3.708 3.960 0.000 0.000 0.216 2502 G C 0.116 175.034 174.900 0.029 0.000 0.994 2502 G CA -0.021 45.090 45.100 0.020 0.000 0.637 2502 G HN 0.313 nan 8.290 nan 0.000 0.505 2503 D N 1.033 121.447 120.400 0.022 0.000 2.455 2503 D HA 0.394 5.034 4.640 0.000 0.000 0.241 2503 D C 0.484 176.811 176.300 0.045 0.000 1.138 2503 D CA 0.269 54.283 54.000 0.024 0.000 0.877 2503 D CB 1.237 42.036 40.800 -0.003 0.000 1.187 2503 D HN 0.273 nan 8.370 nan 0.000 0.451 2504 V N 4.370 124.341 119.914 0.095 0.000 2.398 2504 V HA 0.350 4.470 4.120 0.000 0.000 0.286 2504 V C 0.139 176.326 176.094 0.154 0.000 1.026 2504 V CA -0.807 61.592 62.300 0.165 0.000 0.868 2504 V CB 1.705 33.690 31.823 0.270 0.000 0.982 2504 V HN 0.346 nan 8.190 nan 0.000 0.443 2505 V N 5.483 125.463 119.914 0.109 0.000 2.495 2505 V HA 0.465 4.585 4.120 0.000 0.000 0.298 2505 V C -0.250 175.907 176.094 0.105 0.000 1.031 2505 V CA -0.645 61.697 62.300 0.070 0.000 0.871 2505 V CB 2.144 33.980 31.823 0.022 0.000 0.988 2505 V HN 0.598 nan 8.190 nan 0.000 0.432 2506 V N 4.197 124.183 119.914 0.120 0.000 2.347 2506 V HA 0.689 4.809 4.120 0.000 0.000 0.280 2506 V C 0.141 176.265 176.094 0.051 0.000 1.021 2506 V CA 0.059 62.413 62.300 0.091 0.000 0.847 2506 V CB 1.379 33.271 31.823 0.115 0.000 0.990 2506 V HN 1.004 nan 8.190 nan 0.000 0.444 2507 T N 2.926 117.500 114.554 0.034 0.000 2.821 2507 T HA 0.328 4.678 4.350 0.000 0.000 0.306 2507 T C 0.232 174.942 174.700 0.015 0.000 1.313 2507 T CA -0.416 61.697 62.100 0.022 0.000 1.012 2507 T CB 1.992 70.869 68.868 0.016 0.000 1.298 2507 T HN 0.634 nan 8.240 nan 0.000 0.502 2508 N N 1.039 119.746 118.700 0.011 0.000 2.210 2508 N HA 0.093 4.833 4.740 0.000 0.000 0.203 2508 N C -0.789 174.723 175.510 0.004 0.000 1.175 2508 N CA -0.020 53.033 53.050 0.006 0.000 0.894 2508 N CB 0.494 38.984 38.487 0.006 0.000 1.041 2508 N HN 0.571 nan 8.380 nan 0.000 0.506 2509 D N 0.287 120.690 120.400 0.006 0.000 2.412 2509 D HA 0.148 4.788 4.640 0.000 0.000 0.257 2509 D C 1.386 177.688 176.300 0.003 0.000 1.217 2509 D CA 0.267 54.269 54.000 0.004 0.000 0.897 2509 D CB 1.078 41.881 40.800 0.005 0.000 1.132 2509 D HN 0.305 nan 8.370 nan 0.000 0.493 2510 G N 1.818 110.618 108.800 0.001 0.000 2.421 2510 G HA2 -0.245 3.715 3.960 0.000 0.000 0.216 2510 G HA3 -0.245 3.715 3.960 0.000 0.000 0.216 2510 G C 1.584 176.485 174.900 0.001 0.000 1.171 2510 G CA 0.361 45.461 45.100 -0.001 0.000 0.775 2510 G HN 0.471 nan 8.290 nan 0.000 0.543 2511 V N 0.851 120.766 119.914 0.002 0.000 2.490 2511 V HA -0.150 3.970 4.120 0.000 0.000 0.250 2511 V C 2.952 179.048 176.094 0.003 0.000 1.061 2511 V CA 2.900 65.202 62.300 0.003 0.000 1.064 2511 V CB -0.624 31.201 31.823 0.004 0.000 0.670 2511 V HN 0.414 nan 8.190 nan 0.000 0.461 2512 T N 0.818 115.374 114.554 0.003 0.000 2.812 2512 T HA -0.052 4.298 4.350 0.000 0.000 0.264 2512 T C 1.848 176.551 174.700 0.004 0.000 1.042 2512 T CA 1.617 63.719 62.100 0.003 0.000 1.140 2512 T CB -0.185 68.686 68.868 0.004 0.000 0.870 2512 T HN 0.330 nan 8.240 nan 0.000 0.445 2513 I N 0.972 121.544 120.570 0.004 0.000 2.179 2513 I HA -0.069 4.101 4.170 0.000 0.000 0.242 2513 I C 2.175 178.295 176.117 0.004 0.000 1.088 2513 I CA 1.220 62.523 61.300 0.004 0.000 1.357 2513 I CB -1.195 36.806 38.000 0.002 0.000 1.051 2513 I HN 0.214 nan 8.210 nan 0.000 0.409 2514 L N 0.171 121.397 121.223 0.004 0.000 2.179 2514 L HA -0.042 4.298 4.340 0.000 0.000 0.208 2514 L C 2.607 179.481 176.870 0.006 0.000 1.096 2514 L CA 1.338 56.180 54.840 0.005 0.000 0.779 2514 L CB -0.964 41.098 42.059 0.004 0.000 0.922 2514 L HN 0.179 nan 8.230 nan 0.000 0.443 2515 R N -0.132 120.371 120.500 0.005 0.000 2.066 2515 R HA -0.118 4.222 4.340 0.000 0.000 0.232 2515 R C 1.936 178.239 176.300 0.005 0.000 1.131 2515 R CA 1.342 57.446 56.100 0.005 0.000 0.955 2515 R CB 0.032 30.334 30.300 0.004 0.000 0.851 2515 R HN 0.355 nan 8.270 nan 0.000 0.432 2516 E N 0.925 121.128 120.200 0.005 0.000 2.076 2516 E HA -0.063 4.287 4.350 0.000 0.000 0.190 2516 E C 1.258 177.862 176.600 0.007 0.000 0.979 2516 E CA 0.514 56.917 56.400 0.006 0.000 0.807 2516 E CB -0.257 29.447 29.700 0.006 0.000 0.761 2516 E HN 0.435 nan 8.360 nan 0.000 0.454 2517 M N -0.094 119.510 119.600 0.007 0.000 2.219 2517 M HA 0.069 4.549 4.480 0.000 0.000 0.307 2517 M C 0.459 176.764 176.300 0.009 0.000 1.116 2517 M CA 0.506 55.810 55.300 0.008 0.000 1.181 2517 M CB 0.546 33.150 32.600 0.007 0.000 1.410 2517 M HN -0.267 nan 8.290 nan 0.000 0.454 2518 S N 2.251 117.957 115.700 0.010 0.000 2.512 2518 S HA 0.467 4.937 4.470 0.000 0.000 0.291 2518 S C -0.757 173.852 174.600 0.015 0.000 1.151 2518 S CA -0.808 57.399 58.200 0.011 0.000 1.120 2518 S CB -0.138 63.068 63.200 0.010 0.000 1.029 2518 S HN 0.531 nan 8.310 nan 0.000 0.485 2519 V N 5.102 125.027 119.914 0.018 0.000 2.607 2519 V HA 0.375 4.495 4.120 0.000 0.000 0.289 2519 V C 0.859 176.972 176.094 0.033 0.000 1.053 2519 V CA -0.307 62.009 62.300 0.028 0.000 0.996 2519 V CB 1.564 33.405 31.823 0.030 0.000 0.995 2519 V HN 0.751 nan 8.190 nan 0.000 0.476 2520 E N 0.948 121.177 120.200 0.049 0.000 2.228 2520 E HA 0.077 4.427 4.350 0.000 0.000 0.197 2520 E C 0.716 177.349 176.600 0.055 0.000 0.909 2520 E CA 0.159 56.585 56.400 0.044 0.000 0.911 2520 E CB -0.047 29.679 29.700 0.043 0.000 0.887 2520 E HN 0.701 nan 8.360 nan 0.000 0.481 2521 H N 2.436 121.506 119.070 0.001 0.000 2.764 2521 H HA 0.050 4.606 4.556 -0.000 0.000 0.341 2521 H C -1.750 173.578 175.328 -0.001 0.000 1.072 2521 H CA -1.487 54.561 56.048 0.001 0.000 1.444 2521 H CB 1.604 31.363 29.762 -0.004 0.000 1.458 2521 H HN -0.209 nan 8.280 nan 0.000 0.572 2522 P HA -0.137 nan 4.420 nan 0.000 0.215 2522 P C 1.044 178.447 177.300 0.172 0.000 1.153 2522 P CA 2.169 65.283 63.100 0.024 0.000 0.853 2522 P CB 0.097 31.743 31.700 -0.089 0.000 0.788 2523 A N -0.122 122.957 122.820 0.432 0.000 1.898 2523 A HA -0.042 4.278 4.320 0.000 0.000 0.216 2523 A C 2.311 179.950 177.584 0.092 0.000 1.181 2523 A CA 1.882 54.044 52.037 0.208 0.000 0.620 2523 A CB -1.552 17.517 19.000 0.114 0.000 0.819 2523 A HN 0.185 nan 8.150 nan 0.000 0.442 2524 A N -0.159 122.720 122.820 0.099 0.000 1.972 2524 A HA -0.128 4.192 4.320 0.000 0.000 0.219 2524 A C 2.053 179.665 177.584 0.046 0.000 1.169 2524 A CA 1.698 53.756 52.037 0.036 0.000 0.635 2524 A CB -0.374 18.642 19.000 0.027 0.000 0.810 2524 A HN 0.540 nan 8.150 nan 0.000 0.446 2525 K N -0.914 119.528 120.400 0.070 0.000 2.211 2525 K HA -0.029 4.291 4.320 0.000 0.000 0.203 2525 K C 1.790 178.410 176.600 0.034 0.000 1.050 2525 K CA 1.104 57.417 56.287 0.044 0.000 0.945 2525 K CB -0.180 32.343 32.500 0.040 0.000 0.732 2525 K HN 0.354 nan 8.250 nan 0.000 0.451 2526 M N 0.234 119.858 119.600 0.039 0.000 2.229 2526 M HA -0.093 4.387 4.480 0.000 0.000 0.264 2526 M C 1.861 178.174 176.300 0.021 0.000 1.063 2526 M CA 1.223 56.540 55.300 0.029 0.000 1.114 2526 M CB -0.657 31.962 32.600 0.031 0.000 1.387 2526 M HN 0.073 nan 8.290 nan 0.000 0.420 2527 L N -0.018 121.215 121.223 0.017 0.000 2.201 2527 L HA -0.062 4.279 4.340 0.000 0.000 0.212 2527 L C 2.255 179.131 176.870 0.010 0.000 1.105 2527 L CA 1.196 56.042 54.840 0.010 0.000 0.775 2527 L CB -0.810 41.250 42.059 0.002 0.000 0.913 2527 L HN 0.214 nan 8.230 nan 0.000 0.440 2528 I N -0.941 119.637 120.570 0.012 0.000 2.226 2528 I HA -0.270 3.900 4.170 0.000 0.000 0.245 2528 I C 2.458 178.581 176.117 0.011 0.000 1.100 2528 I CA 0.999 62.306 61.300 0.011 0.000 1.374 2528 I CB -0.145 37.862 38.000 0.013 0.000 1.057 2528 I HN 0.230 nan 8.210 nan 0.000 0.413 2529 E N 0.866 121.074 120.200 0.014 0.000 2.110 2529 E HA -0.156 4.194 4.350 0.000 0.000 0.193 2529 E C 2.129 178.738 176.600 0.014 0.000 0.988 2529 E CA 1.127 57.535 56.400 0.013 0.000 0.804 2529 E CB -0.088 29.621 29.700 0.015 0.000 0.745 2529 E HN 0.241 nan 8.360 nan 0.000 0.458 2530 V N 0.597 120.520 119.914 0.015 0.000 2.343 2530 V HA -0.268 3.852 4.120 0.000 0.000 0.247 2530 V C 2.319 178.420 176.094 0.012 0.000 1.051 2530 V CA 1.843 64.152 62.300 0.015 0.000 1.036 2530 V CB -0.900 30.932 31.823 0.015 0.000 0.654 2530 V HN 0.443 nan 8.190 nan 0.000 0.451 2531 A N -0.504 122.321 122.820 0.009 0.000 1.930 2531 A HA -0.205 4.115 4.320 0.000 0.000 0.217 2531 A C 2.299 179.887 177.584 0.007 0.000 1.175 2531 A CA 1.758 53.799 52.037 0.007 0.000 0.627 2531 A CB -0.376 18.627 19.000 0.005 0.000 0.815 2531 A HN 0.538 nan 8.150 nan 0.000 0.443 2532 K N -0.576 119.829 120.400 0.008 0.000 2.097 2532 K HA -0.099 4.221 4.320 0.000 0.000 0.205 2532 K C 2.229 178.833 176.600 0.008 0.000 1.050 2532 K CA 1.716 58.007 56.287 0.007 0.000 0.938 2532 K CB -0.308 32.197 32.500 0.008 0.000 0.718 2532 K HN 0.732 nan 8.250 nan 0.000 0.442 2533 T N -1.204 113.356 114.554 0.010 0.000 2.904 2533 T HA -0.140 4.210 4.350 0.000 0.000 0.267 2533 T C 2.001 176.707 174.700 0.011 0.000 1.059 2533 T CA 0.843 62.949 62.100 0.011 0.000 1.137 2533 T CB 0.004 68.881 68.868 0.014 0.000 0.879 2533 T HN 0.012 nan 8.240 nan 0.000 0.467 2534 Q N 1.338 121.144 119.800 0.011 0.000 2.083 2534 Q HA -0.055 4.285 4.340 0.000 0.000 0.198 2534 Q C 2.394 178.398 176.000 0.008 0.000 0.969 2534 Q CA 1.569 57.378 55.803 0.010 0.000 0.838 2534 Q CB -0.415 28.329 28.738 0.009 0.000 0.900 2534 Q HN 0.625 nan 8.270 nan 0.000 0.436 2535 E N 0.544 120.748 120.200 0.007 0.000 2.051 2535 E HA -0.237 4.113 4.350 0.000 0.000 0.192 2535 E C 1.815 178.418 176.600 0.005 0.000 0.991 2535 E CA 1.480 57.883 56.400 0.005 0.000 0.799 2535 E CB -0.137 29.566 29.700 0.004 0.000 0.748 2535 E HN 0.368 nan 8.360 nan 0.000 0.449 2536 K N 0.166 120.569 120.400 0.005 0.000 2.057 2536 K HA -0.203 4.117 4.320 0.000 0.000 0.207 2536 K C 2.181 178.784 176.600 0.005 0.000 1.049 2536 K CA 1.769 58.058 56.287 0.005 0.000 0.931 2536 K CB -0.058 32.445 32.500 0.005 0.000 0.714 2536 K HN -0.066 nan 8.250 nan 0.000 0.440 2537 E N -0.415 119.789 120.200 0.007 0.000 2.086 2537 E HA -0.058 4.292 4.350 0.000 0.000 0.190 2537 E C 1.564 178.168 176.600 0.008 0.000 0.975 2537 E CA 1.110 57.515 56.400 0.008 0.000 0.813 2537 E CB 0.356 30.062 29.700 0.010 0.000 0.768 2537 E HN 0.132 nan 8.360 nan 0.000 0.457 2538 V N -1.592 118.327 119.914 0.008 0.000 2.806 2538 V HA 0.391 4.511 4.120 0.000 0.000 0.239 2538 V C 1.656 177.755 176.094 0.008 0.000 1.113 2538 V CA 0.850 63.155 62.300 0.008 0.000 1.137 2538 V CB 0.395 32.224 31.823 0.010 0.000 0.865 2538 V HN 0.506 nan 8.190 nan 0.000 0.482 2539 G N 0.131 108.935 108.800 0.007 0.000 4.391 2539 G HA2 -0.232 3.728 3.960 0.000 0.000 0.210 2539 G HA3 -0.232 3.728 3.960 0.000 0.000 0.210 2539 G C 0.143 175.047 174.900 0.007 0.000 1.547 2539 G CA 0.279 45.383 45.100 0.006 0.000 1.103 2539 G HN 0.441 nan 8.290 nan 0.000 0.637 2540 D N 1.707 122.112 120.400 0.008 0.000 2.387 2540 D HA 0.481 5.121 4.640 0.000 0.000 0.251 2540 D C 1.418 177.722 176.300 0.007 0.000 1.141 2540 D CA 1.265 55.270 54.000 0.009 0.000 0.987 2540 D CB 0.807 41.614 40.800 0.011 0.000 1.116 2540 D HN 1.722 nan 8.370 nan 0.000 0.491 2541 G N 0.431 109.234 108.800 0.005 0.000 2.143 2541 G HA2 -0.312 3.648 3.960 0.000 0.000 0.249 2541 G HA3 -0.312 3.648 3.960 0.000 0.000 0.249 2541 G C 1.010 175.911 174.900 0.001 0.000 0.981 2541 G CA 1.205 46.306 45.100 0.003 0.000 0.665 2541 G HN 0.613 nan 8.290 nan 0.000 0.528 2542 T N -3.142 111.413 114.554 0.002 0.000 2.821 2542 T HA -0.042 4.308 4.350 0.000 0.000 0.267 2542 T C 2.206 176.904 174.700 -0.002 0.000 1.046 2542 T CA 2.431 64.532 62.100 0.002 0.000 1.139 2542 T CB -0.410 68.460 68.868 0.002 0.000 0.871 2542 T HN 0.276 nan 8.240 nan 0.000 0.454 2543 T N 1.897 116.448 114.554 -0.005 0.000 2.812 2543 T HA -0.043 4.307 4.350 0.000 0.000 0.264 2543 T C 2.235 176.926 174.700 -0.014 0.000 1.042 2543 T CA 1.639 63.733 62.100 -0.010 0.000 1.140 2543 T CB -0.844 68.017 68.868 -0.012 0.000 0.870 2543 T HN 0.482 nan 8.240 nan 0.000 0.445 2544 T N 2.183 116.729 114.554 -0.013 0.000 2.684 2544 T HA -0.098 4.252 4.350 0.000 0.000 0.267 2544 T C 2.383 177.072 174.700 -0.018 0.000 1.036 2544 T CA 1.312 63.401 62.100 -0.018 0.000 1.148 2544 T CB -0.546 68.313 68.868 -0.014 0.000 0.863 2544 T HN 0.436 nan 8.240 nan 0.000 0.436 2545 A N 0.742 123.556 122.820 -0.009 0.000 1.902 2545 A HA -0.028 4.292 4.320 0.000 0.000 0.217 2545 A C 2.593 180.173 177.584 -0.006 0.000 1.181 2545 A CA 1.360 53.395 52.037 -0.003 0.000 0.623 2545 A CB -0.895 18.108 19.000 0.006 0.000 0.818 2545 A HN 0.365 nan 8.150 nan 0.000 0.443 2546 V N -0.963 118.947 119.914 -0.007 0.000 2.323 2546 V HA -0.175 3.945 4.120 0.000 0.000 0.244 2546 V C 2.468 178.552 176.094 -0.017 0.000 1.041 2546 V CA 1.787 64.082 62.300 -0.008 0.000 1.025 2546 V CB -0.631 31.188 31.823 -0.007 0.000 0.656 2546 V HN 0.375 nan 8.190 nan 0.000 0.451 2547 V N -0.376 119.524 119.914 -0.023 0.000 2.515 2547 V HA -0.168 3.952 4.120 0.000 0.000 0.250 2547 V C 2.321 178.390 176.094 -0.042 0.000 1.058 2547 V CA 1.933 64.214 62.300 -0.031 0.000 1.064 2547 V CB 0.318 32.122 31.823 -0.033 0.000 0.675 2547 V HN 0.386 nan 8.190 nan 0.000 0.461 2548 V N 0.342 120.227 119.914 -0.048 0.000 2.358 2548 V HA -0.153 3.967 4.120 0.000 0.000 0.246 2548 V C 2.771 178.828 176.094 -0.061 0.000 1.047 2548 V CA 1.890 64.144 62.300 -0.076 0.000 1.035 2548 V CB -1.069 30.701 31.823 -0.088 0.000 0.658 2548 V HN 0.618 nan 8.190 nan 0.000 0.452 2549 A N 0.496 123.300 122.820 -0.027 0.000 1.933 2549 A HA -0.098 4.222 4.320 0.000 0.000 0.218 2549 A C 2.374 179.954 177.584 -0.006 0.000 1.175 2549 A CA 2.000 54.036 52.037 -0.001 0.000 0.628 2549 A CB -1.083 17.922 19.000 0.008 0.000 0.814 2549 A HN 0.530 nan 8.150 nan 0.000 0.444 2550 G N -0.822 107.966 108.800 -0.020 0.000 2.394 2550 G HA2 -0.132 3.828 3.960 0.000 0.000 0.215 2550 G HA3 -0.132 3.828 3.960 0.000 0.000 0.215 2550 G C 1.463 176.348 174.900 -0.026 0.000 1.165 2550 G CA 1.140 46.224 45.100 -0.026 0.000 0.784 2550 G HN 0.532 nan 8.290 nan 0.000 0.535 2551 E N 0.330 120.512 120.200 -0.030 0.000 2.106 2551 E HA 0.034 4.384 4.350 0.000 0.000 0.192 2551 E C 2.498 179.095 176.600 -0.005 0.000 0.984 2551 E CA 0.475 56.857 56.400 -0.031 0.000 0.806 2551 E CB -0.331 29.337 29.700 -0.054 0.000 0.750 2551 E HN 0.426 nan 8.360 nan 0.000 0.458 2552 L N -0.329 120.899 121.223 0.009 0.000 2.046 2552 L HA -0.176 4.164 4.340 0.000 0.000 0.208 2552 L C 2.131 179.074 176.870 0.122 0.000 1.077 2552 L CA 0.527 55.446 54.840 0.133 0.000 0.747 2552 L CB -0.384 41.770 42.059 0.158 0.000 0.896 2552 L HN 0.229 nan 8.230 nan 0.000 0.432 2553 L N -0.244 120.992 121.223 0.022 0.000 2.083 2553 L HA -0.192 4.148 4.340 0.000 0.000 0.209 2553 L C 2.703 179.557 176.870 -0.027 0.000 1.083 2553 L CA 1.602 56.422 54.840 -0.033 0.000 0.752 2553 L CB -0.802 41.231 42.059 -0.044 0.000 0.899 2553 L HN 0.183 nan 8.230 nan 0.000 0.433 2554 R N -0.652 119.841 120.500 -0.011 0.000 2.073 2554 R HA -0.140 4.200 4.340 0.000 0.000 0.234 2554 R C 2.103 178.408 176.300 0.007 0.000 1.134 2554 R CA 1.150 57.241 56.100 -0.014 0.000 0.952 2554 R CB 0.053 30.343 30.300 -0.018 0.000 0.850 2554 R HN 0.132 nan 8.270 nan 0.000 0.433 2555 K N 0.111 120.537 120.400 0.044 0.000 2.155 2555 K HA 0.010 4.330 4.320 0.000 0.000 0.203 2555 K C 1.907 178.574 176.600 0.113 0.000 1.052 2555 K CA 1.089 57.424 56.287 0.080 0.000 0.948 2555 K CB -0.129 32.434 32.500 0.106 0.000 0.728 2555 K HN 0.258 nan 8.250 nan 0.000 0.448 2556 A N 1.586 124.468 122.820 0.102 0.000 1.930 2556 A HA -0.162 4.158 4.320 0.000 0.000 0.217 2556 A C 2.154 179.719 177.584 -0.032 0.000 1.175 2556 A CA 1.326 53.359 52.037 -0.006 0.000 0.627 2556 A CB -0.236 18.624 19.000 -0.234 0.000 0.815 2556 A HN 0.219 nan 8.150 nan 0.000 0.443 2557 E N -0.116 120.064 120.200 -0.033 0.000 2.106 2557 E HA -0.208 4.142 4.350 0.000 0.000 0.192 2557 E C 1.940 178.527 176.600 -0.021 0.000 0.984 2557 E CA 1.481 57.858 56.400 -0.040 0.000 0.806 2557 E CB -0.099 29.572 29.700 -0.048 0.000 0.750 2557 E HN 0.625 nan 8.360 nan 0.000 0.458 2558 E N 0.492 120.690 120.200 -0.004 0.000 2.153 2558 E HA -0.157 4.193 4.350 0.000 0.000 0.194 2558 E C 2.047 178.655 176.600 0.013 0.000 0.988 2558 E CA 0.598 57.000 56.400 0.004 0.000 0.811 2558 E CB -0.326 29.381 29.700 0.012 0.000 0.746 2558 E HN 0.182 nan 8.360 nan 0.000 0.466 2559 L N -0.131 121.109 121.223 0.028 0.000 2.109 2559 L HA 0.012 4.352 4.340 0.000 0.000 0.207 2559 L C 2.010 178.888 176.870 0.013 0.000 1.086 2559 L CA 1.420 56.283 54.840 0.038 0.000 0.760 2559 L CB -0.318 41.790 42.059 0.082 0.000 0.910 2559 L HN 0.239 nan 8.230 nan 0.000 0.437 2560 L N -0.732 120.486 121.223 -0.010 0.000 2.141 2560 L HA -0.188 4.152 4.340 0.000 0.000 0.209 2560 L C 2.147 179.003 176.870 -0.023 0.000 1.094 2560 L CA 1.425 56.247 54.840 -0.030 0.000 0.763 2560 L CB -0.599 41.428 42.059 -0.053 0.000 0.908 2560 L HN 0.318 nan 8.230 nan 0.000 0.437 2561 D N -0.573 119.816 120.400 -0.017 0.000 2.178 2561 D HA -0.186 4.454 4.640 0.000 0.000 0.202 2561 D C 2.077 178.375 176.300 -0.004 0.000 0.974 2561 D CA 0.857 54.849 54.000 -0.013 0.000 0.841 2561 D CB 0.193 40.985 40.800 -0.013 0.000 0.953 2561 D HN 0.144 nan 8.370 nan 0.000 0.478 2562 Q N 0.189 119.990 119.800 0.002 0.000 2.482 2562 Q HA 0.024 4.364 4.340 0.000 0.000 0.209 2562 Q C -0.033 175.973 176.000 0.010 0.000 0.961 2562 Q CA 0.271 56.079 55.803 0.008 0.000 0.945 2562 Q CB -0.061 28.686 28.738 0.014 0.000 1.012 2562 Q HN 0.360 nan 8.270 nan 0.000 0.515 2563 N N -0.258 118.446 118.700 0.005 0.000 2.780 2563 N HA -0.127 4.613 4.740 0.000 0.000 0.247 2563 N C -1.185 174.339 175.510 0.024 0.000 1.076 2563 N CA 0.351 53.407 53.050 0.009 0.000 0.688 2563 N CB -1.630 36.866 38.487 0.014 0.000 0.957 2563 N HN -0.015 nan 8.380 nan 0.000 0.551 2564 V N 1.659 121.586 119.914 0.021 0.000 2.350 2564 V HA 0.129 4.249 4.120 0.000 0.000 0.276 2564 V C 0.982 177.100 176.094 0.041 0.000 1.028 2564 V CA -0.733 61.594 62.300 0.044 0.000 0.860 2564 V CB 1.439 33.290 31.823 0.046 0.000 0.990 2564 V HN 0.324 nan 8.190 nan 0.000 0.453 2565 H N 8.023 127.096 119.070 0.005 0.000 3.001 2565 H HA 0.037 4.593 4.556 0.000 0.000 0.334 2565 H C -1.697 173.630 175.328 -0.002 0.000 1.034 2565 H CA -1.057 54.992 56.048 0.002 0.000 1.420 2565 H CB 1.688 31.451 29.762 0.002 0.000 1.405 2565 H HN 0.376 nan 8.280 nan 0.000 0.593 2566 P HA -0.173 nan 4.420 nan 0.000 0.218 2566 P C 1.500 178.855 177.300 0.091 0.000 1.146 2566 P CA 1.697 64.738 63.100 -0.099 0.000 0.820 2566 P CB 0.033 31.618 31.700 -0.192 0.000 0.778 2567 T N -1.877 112.898 114.554 0.369 0.000 2.929 2567 T HA -0.097 4.253 4.350 0.000 0.000 0.271 2567 T C 1.505 176.274 174.700 0.116 0.000 1.085 2567 T CA 0.843 63.074 62.100 0.218 0.000 1.125 2567 T CB -0.472 68.483 68.868 0.146 0.000 0.874 2567 T HN -0.147 nan 8.240 nan 0.000 0.494 2568 I N 0.120 120.764 120.570 0.124 0.000 2.385 2568 I HA 0.072 4.242 4.170 0.000 0.000 0.244 2568 I C 2.561 178.730 176.117 0.086 0.000 1.089 2568 I CA 0.651 62.001 61.300 0.083 0.000 1.410 2568 I CB -1.528 36.521 38.000 0.082 0.000 1.117 2568 I HN 0.112 nan 8.210 nan 0.000 0.429 2569 V N 1.082 121.041 119.914 0.074 0.000 2.469 2569 V HA -0.216 3.904 4.120 0.000 0.000 0.251 2569 V C 2.548 178.676 176.094 0.056 0.000 1.064 2569 V CA 1.588 63.932 62.300 0.074 0.000 1.066 2569 V CB -0.086 31.697 31.823 -0.066 0.000 0.667 2569 V HN 0.184 nan 8.190 nan 0.000 0.461 2570 V N -0.081 119.846 119.914 0.022 0.000 2.427 2570 V HA -0.235 3.885 4.120 0.000 0.000 0.248 2570 V C 2.391 178.531 176.094 0.076 0.000 1.051 2570 V CA 2.492 64.808 62.300 0.028 0.000 1.048 2570 V CB -0.681 31.154 31.823 0.018 0.000 0.666 2570 V HN 0.608 nan 8.190 nan 0.000 0.456 2571 K N 0.205 120.647 120.400 0.070 0.000 2.021 2571 K HA -0.068 4.252 4.320 0.000 0.000 0.205 2571 K C 2.191 178.818 176.600 0.045 0.000 1.047 2571 K CA 1.423 57.738 56.287 0.046 0.000 0.943 2571 K CB -0.538 31.978 32.500 0.027 0.000 0.725 2571 K HN 0.439 nan 8.250 nan 0.000 0.439 2572 G N -0.206 108.639 108.800 0.075 0.000 2.408 2572 G HA2 -0.234 3.726 3.960 0.000 0.000 0.217 2572 G HA3 -0.234 3.726 3.960 0.000 0.000 0.217 2572 G C 1.147 176.038 174.900 -0.015 0.000 1.150 2572 G CA 0.670 45.781 45.100 0.019 0.000 0.776 2572 G HN 0.285 nan 8.290 nan 0.000 0.542 2573 Y N 0.408 120.677 120.300 -0.050 0.000 2.293 2573 Y HA -0.078 4.472 4.550 0.000 0.000 0.291 2573 Y C 2.981 178.779 175.900 -0.170 0.000 1.137 2573 Y CA 1.367 59.432 58.100 -0.058 0.000 1.202 2573 Y CB -0.096 38.427 38.460 0.106 0.000 0.990 2573 Y HN 0.195 nan 8.280 nan 0.000 0.537 2574 Q N 0.369 120.205 119.800 0.060 0.000 2.049 2574 Q HA -0.141 4.199 4.340 0.000 0.000 0.198 2574 Q C 2.396 178.351 176.000 -0.075 0.000 0.971 2574 Q CA 1.494 57.299 55.803 0.003 0.000 0.833 2574 Q CB -0.314 28.440 28.738 0.027 0.000 0.896 2574 Q HN 0.444 nan 8.270 nan 0.000 0.434 2575 A N 0.920 123.691 122.820 -0.082 0.000 1.877 2575 A HA -0.086 4.234 4.320 0.000 0.000 0.216 2575 A C 2.326 179.879 177.584 -0.051 0.000 1.186 2575 A CA 2.175 54.183 52.037 -0.048 0.000 0.620 2575 A CB -0.918 18.028 19.000 -0.090 0.000 0.822 2575 A HN 0.495 nan 8.150 nan 0.000 0.443 2576 A N -0.353 122.286 122.820 -0.302 0.000 1.930 2576 A HA 0.221 4.541 4.320 0.000 0.000 0.217 2576 A C 2.479 179.596 177.584 -0.778 0.000 1.175 2576 A CA 1.943 53.660 52.037 -0.533 0.000 0.627 2576 A CB -0.918 17.508 19.000 -0.957 0.000 0.815 2576 A HN 1.019 nan 8.150 nan 0.000 0.443 2577 A N -0.785 121.510 122.820 -0.875 0.000 1.898 2577 A HA -0.195 4.125 4.320 0.000 0.000 0.216 2577 A C 2.186 179.706 177.584 -0.107 0.000 1.181 2577 A CA 1.739 53.562 52.037 -0.355 0.000 0.620 2577 A CB -0.558 18.384 19.000 -0.096 0.000 0.819 2577 A HN 0.643 nan 8.150 nan 0.000 0.442 2578 Q N -0.700 119.043 119.800 -0.095 0.000 2.119 2578 Q HA -0.224 4.116 4.340 0.000 0.000 0.201 2578 Q C 2.018 177.989 176.000 -0.047 0.000 0.972 2578 Q CA 1.901 57.682 55.803 -0.037 0.000 0.847 2578 Q CB -0.063 28.666 28.738 -0.015 0.000 0.903 2578 Q HN 0.453 nan 8.270 nan 0.000 0.433 2579 K N 0.273 120.629 120.400 -0.073 0.000 2.103 2579 K HA 0.002 4.322 4.320 0.000 0.000 0.204 2579 K C 1.699 178.247 176.600 -0.086 0.000 1.052 2579 K CA 1.302 57.505 56.287 -0.140 0.000 0.945 2579 K CB -0.473 31.854 32.500 -0.288 0.000 0.722 2579 K HN 0.266 nan 8.250 nan 0.000 0.443 2580 A N 0.698 123.498 122.820 -0.033 0.000 1.933 2580 A HA -0.227 4.093 4.320 0.000 0.000 0.218 2580 A C 2.205 179.813 177.584 0.039 0.000 1.175 2580 A CA 1.834 53.903 52.037 0.053 0.000 0.628 2580 A CB -0.638 18.482 19.000 0.199 0.000 0.814 2580 A HN 0.580 nan 8.150 nan 0.000 0.444 2581 Q N -0.346 119.470 119.800 0.025 0.000 2.084 2581 Q HA -0.222 4.118 4.340 0.000 0.000 0.202 2581 Q C 1.898 177.898 176.000 0.001 0.000 0.978 2581 Q CA 1.821 57.636 55.803 0.020 0.000 0.844 2581 Q CB -0.158 28.590 28.738 0.017 0.000 0.898 2581 Q HN 0.788 nan 8.270 nan 0.000 0.426 2582 E N 0.227 120.415 120.200 -0.020 0.000 2.110 2582 E HA -0.168 4.182 4.350 0.000 0.000 0.193 2582 E C 2.144 178.727 176.600 -0.028 0.000 0.988 2582 E CA 1.038 57.419 56.400 -0.031 0.000 0.804 2582 E CB -0.042 29.623 29.700 -0.058 0.000 0.745 2582 E HN 0.393 nan 8.360 nan 0.000 0.458 2583 L N 0.615 121.820 121.223 -0.030 0.000 2.056 2583 L HA -0.188 4.152 4.340 0.000 0.000 0.207 2583 L C 2.433 179.306 176.870 0.004 0.000 1.078 2583 L CA 0.836 55.666 54.840 -0.017 0.000 0.749 2583 L CB -0.344 41.706 42.059 -0.015 0.000 0.901 2583 L HN 0.174 nan 8.230 nan 0.000 0.433 2584 L N -0.380 120.850 121.223 0.011 0.000 2.046 2584 L HA -0.211 4.129 4.340 0.000 0.000 0.208 2584 L C 2.589 179.466 176.870 0.012 0.000 1.077 2584 L CA 1.383 56.233 54.840 0.016 0.000 0.747 2584 L CB -0.431 41.641 42.059 0.021 0.000 0.896 2584 L HN 0.211 nan 8.230 nan 0.000 0.432 2585 K N -0.810 119.594 120.400 0.006 0.000 2.217 2585 K HA -0.080 4.240 4.320 0.000 0.000 0.202 2585 K C 2.057 178.658 176.600 0.001 0.000 1.051 2585 K CA 1.434 57.723 56.287 0.004 0.000 0.952 2585 K CB -0.136 32.364 32.500 -0.000 0.000 0.736 2585 K HN 0.275 nan 8.250 nan 0.000 0.453 2586 T N 2.059 116.612 114.554 -0.002 0.000 2.737 2586 T HA -0.077 4.273 4.350 0.000 0.000 0.265 2586 T C 1.898 176.601 174.700 0.005 0.000 1.038 2586 T CA 1.315 63.413 62.100 -0.003 0.000 1.144 2586 T CB -0.147 68.715 68.868 -0.010 0.000 0.866 2586 T HN 0.376 nan 8.240 nan 0.000 0.434 2587 I N -0.031 120.548 120.570 0.014 0.000 3.251 2587 I HA 0.395 4.565 4.170 0.000 0.000 0.277 2587 I C 1.113 177.241 176.117 0.018 0.000 1.268 2587 I CA -0.448 60.865 61.300 0.022 0.000 1.449 2587 I CB -0.555 37.470 38.000 0.042 0.000 1.083 2587 I HN -0.041 nan 8.210 nan 0.000 0.464 2588 A N 1.575 124.403 122.820 0.014 0.000 2.566 2588 A HA 0.124 4.444 4.320 0.000 0.000 0.245 2588 A C 0.112 177.702 177.584 0.010 0.000 1.056 2588 A CA -0.004 52.040 52.037 0.013 0.000 0.757 2588 A CB -0.300 18.706 19.000 0.010 0.000 0.979 2588 A HN 0.639 nan 8.150 nan 0.000 0.508 2589 C N 3.471 122.777 119.300 0.011 0.000 2.295 2589 C HA 0.481 4.941 4.460 0.000 0.000 0.331 2589 C C 0.524 175.518 174.990 0.007 0.000 1.280 2589 C CA -0.652 58.371 59.018 0.008 0.000 1.746 2589 C CB -0.295 27.450 27.740 0.009 0.000 2.328 2589 C HN 0.945 nan 8.230 nan 0.000 0.521 2590 E N 3.807 124.010 120.200 0.005 0.000 2.366 2590 E HA 0.424 4.774 4.350 0.000 0.000 0.266 2590 E C -0.257 176.345 176.600 0.004 0.000 1.015 2590 E CA -0.025 56.377 56.400 0.004 0.000 0.906 2590 E CB 0.728 30.430 29.700 0.003 0.000 0.979 2590 E HN 0.716 nan 8.360 nan 0.000 0.443 2591 V N 1.050 120.967 119.914 0.005 0.000 3.102 2591 V HA 0.718 4.838 4.120 0.000 0.000 0.312 2591 V C 0.364 176.460 176.094 0.004 0.000 1.135 2591 V CA -0.687 61.616 62.300 0.004 0.000 1.022 2591 V CB 1.506 33.332 31.823 0.005 0.000 1.056 2591 V HN 0.702 nan 8.190 nan 0.000 0.436 2592 G N 0.526 109.328 108.800 0.003 0.000 2.313 2592 G HA2 0.460 4.420 3.960 0.000 0.000 0.250 2592 G HA3 0.460 4.420 3.960 0.000 0.000 0.250 2592 G C 0.989 175.891 174.900 0.004 0.000 1.281 2592 G CA 0.222 45.324 45.100 0.003 0.000 0.917 2592 G HN 1.660 nan 8.290 nan 0.000 0.501 2593 A N 2.540 125.362 122.820 0.004 0.000 1.908 2593 A HA -0.093 4.227 4.320 0.000 0.000 0.218 2593 A C 2.056 179.643 177.584 0.004 0.000 1.181 2593 A CA 1.299 53.338 52.037 0.004 0.000 0.627 2593 A CB -0.068 18.934 19.000 0.004 0.000 0.818 2593 A HN 0.568 nan 8.150 nan 0.000 0.445 2594 Q N -0.317 119.486 119.800 0.004 0.000 2.198 2594 Q HA 0.058 4.398 4.340 0.000 0.000 0.209 2594 Q C -0.733 175.269 176.000 0.004 0.000 0.848 2594 Q CA -0.111 55.694 55.803 0.004 0.000 0.974 2594 Q CB 0.079 28.820 28.738 0.005 0.000 1.115 2594 Q HN 0.746 nan 8.270 nan 0.000 0.494 2595 D N 1.143 121.546 120.400 0.004 0.000 2.389 2595 D HA -0.050 4.590 4.640 0.000 0.000 0.263 2595 D C 1.226 177.528 176.300 0.003 0.000 1.255 2595 D CA 0.144 54.146 54.000 0.003 0.000 0.914 2595 D CB 0.875 41.677 40.800 0.003 0.000 1.116 2595 D HN -0.228 nan 8.370 nan 0.000 0.502 2596 K N 3.627 124.029 120.400 0.003 0.000 2.015 2596 K HA -0.300 4.020 4.320 0.000 0.000 0.220 2596 K C 1.582 178.184 176.600 0.002 0.000 1.055 2596 K CA 2.239 58.527 56.287 0.003 0.000 0.951 2596 K CB -0.299 32.203 32.500 0.002 0.000 0.725 2596 K HN 0.682 nan 8.250 nan 0.000 0.449 2597 E N -0.544 119.657 120.200 0.001 0.000 2.048 2597 E HA -0.243 4.107 4.350 0.000 0.000 0.202 2597 E C 2.029 178.630 176.600 0.001 0.000 1.021 2597 E CA 1.898 58.297 56.400 -0.001 0.000 0.825 2597 E CB -0.325 29.374 29.700 -0.001 0.000 0.756 2597 E HN 0.353 nan 8.360 nan 0.000 0.454 2598 I N 0.360 120.932 120.570 0.002 0.000 2.493 2598 I HA -0.183 3.987 4.170 0.000 0.000 0.254 2598 I C 1.862 177.982 176.117 0.006 0.000 1.160 2598 I CA 0.713 62.016 61.300 0.004 0.000 1.445 2598 I CB 0.001 38.004 38.000 0.005 0.000 1.086 2598 I HN 0.199 nan 8.210 nan 0.000 0.433 2599 L N -0.103 121.124 121.223 0.005 0.000 2.156 2599 L HA -0.094 4.246 4.340 0.000 0.000 0.208 2599 L C 2.631 179.505 176.870 0.006 0.000 1.095 2599 L CA 2.124 56.968 54.840 0.006 0.000 0.770 2599 L CB -1.438 40.625 42.059 0.006 0.000 0.914 2599 L HN 0.448 nan 8.230 nan 0.000 0.439 2600 T N -4.401 110.156 114.554 0.004 0.000 2.942 2600 T HA -0.108 4.242 4.350 0.000 0.000 0.265 2600 T C 1.893 176.595 174.700 0.003 0.000 1.062 2600 T CA 0.623 62.724 62.100 0.003 0.000 1.139 2600 T CB -0.146 68.722 68.868 -0.000 0.000 0.883 2600 T HN 0.185 nan 8.240 nan 0.000 0.468 2601 K N 0.755 121.157 120.400 0.003 0.000 2.097 2601 K HA 0.163 4.483 4.320 0.000 0.000 0.205 2601 K C 2.157 178.765 176.600 0.014 0.000 1.050 2601 K CA 1.105 57.395 56.287 0.005 0.000 0.938 2601 K CB -0.333 32.169 32.500 0.004 0.000 0.718 2601 K HN 0.373 nan 8.250 nan 0.000 0.442 2602 I N 1.031 121.610 120.570 0.014 0.000 2.163 2602 I HA -0.279 3.891 4.170 0.000 0.000 0.240 2602 I C 2.529 178.658 176.117 0.020 0.000 1.081 2602 I CA 1.142 62.452 61.300 0.018 0.000 1.353 2602 I CB -0.392 37.616 38.000 0.014 0.000 1.054 2602 I HN 0.132 nan 8.210 nan 0.000 0.407 2603 A N 0.652 123.481 122.820 0.016 0.000 1.883 2603 A HA -0.250 4.070 4.320 0.000 0.000 0.217 2603 A C 2.380 179.976 177.584 0.021 0.000 1.186 2603 A CA 1.862 53.909 52.037 0.016 0.000 0.624 2603 A CB -0.636 18.371 19.000 0.012 0.000 0.822 2603 A HN 0.340 nan 8.150 nan 0.000 0.444 2604 M N -0.308 119.303 119.600 0.019 0.000 2.099 2604 M HA -0.136 4.344 4.480 0.000 0.000 0.262 2604 M C 2.449 178.778 176.300 0.048 0.000 1.067 2604 M CA 2.092 57.406 55.300 0.023 0.000 1.124 2604 M CB -0.778 31.825 32.600 0.004 0.000 1.353 2604 M HN 0.711 nan 8.290 nan 0.000 0.410 2605 T N -2.692 111.893 114.554 0.052 0.000 2.915 2605 T HA -0.088 4.262 4.350 0.000 0.000 0.269 2605 T C 1.869 176.609 174.700 0.066 0.000 1.071 2605 T CA 1.547 63.694 62.100 0.080 0.000 1.132 2605 T CB -0.448 68.461 68.868 0.069 0.000 0.878 2605 T HN 0.317 nan 8.240 nan 0.000 0.479 2606 S N 1.112 116.839 115.700 0.045 0.000 2.355 2606 S HA 0.013 4.483 4.470 0.000 0.000 0.222 2606 S C 2.007 176.630 174.600 0.038 0.000 1.031 2606 S CA 0.879 59.099 58.200 0.035 0.000 0.993 2606 S CB -0.619 62.596 63.200 0.025 0.000 0.859 2606 S HN 0.598 nan 8.310 nan 0.000 0.453 2607 I N 1.757 122.352 120.570 0.042 0.000 2.361 2607 I HA -0.088 4.082 4.170 0.000 0.000 0.251 2607 I C 1.307 177.460 176.117 0.060 0.000 1.133 2607 I CA 0.877 62.203 61.300 0.044 0.000 1.413 2607 I CB -0.897 37.127 38.000 0.040 0.000 1.073 2607 I HN 0.444 nan 8.210 nan 0.000 0.424 2608 T N -0.620 113.987 114.554 0.089 0.000 2.903 2608 T HA 0.310 4.660 4.350 0.000 0.000 0.314 2608 T C 1.179 175.912 174.700 0.055 0.000 1.078 2608 T CA 0.103 62.277 62.100 0.124 0.000 1.114 2608 T CB 1.250 70.265 68.868 0.245 0.000 0.987 2608 T HN 0.595 nan 8.240 nan 0.000 0.548 2609 G N 1.295 110.111 108.800 0.026 0.000 2.159 2609 G HA2 -0.205 3.755 3.960 0.000 0.000 0.256 2609 G HA3 -0.205 3.755 3.960 0.000 0.000 0.256 2609 G C -0.077 174.824 174.900 0.002 0.000 0.977 2609 G CA 0.412 45.503 45.100 -0.015 0.000 0.652 2609 G HN 0.946 nan 8.290 nan 0.000 0.531 2610 K N -0.989 119.424 120.400 0.021 0.000 2.395 2610 K HA 0.595 4.915 4.320 0.000 0.000 0.247 2610 K C 1.482 178.100 176.600 0.029 0.000 0.973 2610 K CA -0.608 55.692 56.287 0.022 0.000 0.828 2610 K CB 1.488 34.003 32.500 0.025 0.000 1.272 2610 K HN 0.188 nan 8.250 nan 0.000 0.439 2611 G N 0.626 109.442 108.800 0.027 0.000 2.462 2611 G HA2 -0.274 3.686 3.960 0.000 0.000 0.220 2611 G HA3 -0.274 3.686 3.960 0.000 0.000 0.220 2611 G C 1.197 176.118 174.900 0.034 0.000 1.121 2611 G CA 1.223 46.341 45.100 0.030 0.000 0.758 2611 G HN 0.624 nan 8.290 nan 0.000 0.559 2612 A N 1.294 124.134 122.820 0.034 0.000 2.168 2612 A HA 0.102 4.422 4.320 0.000 0.000 0.215 2612 A C 2.105 179.712 177.584 0.039 0.000 1.152 2612 A CA 1.480 53.537 52.037 0.033 0.000 0.716 2612 A CB -0.347 18.670 19.000 0.029 0.000 0.794 2612 A HN 0.649 nan 8.150 nan 0.000 0.465 2613 E N 1.497 121.727 120.200 0.051 0.000 2.267 2613 E HA -0.301 4.049 4.350 0.000 0.000 0.197 2613 E C 1.633 178.268 176.600 0.058 0.000 0.998 2613 E CA 1.395 57.837 56.400 0.069 0.000 0.830 2613 E CB -0.562 29.204 29.700 0.111 0.000 0.751 2613 E HN 0.782 nan 8.360 nan 0.000 0.491 2614 K N 0.930 121.359 120.400 0.048 0.000 2.218 2614 K HA -0.109 4.211 4.320 0.000 0.000 0.205 2614 K C 1.315 177.929 176.600 0.024 0.000 1.046 2614 K CA 1.581 57.890 56.287 0.037 0.000 0.933 2614 K CB -0.072 32.447 32.500 0.032 0.000 0.728 2614 K HN 0.164 nan 8.250 nan 0.000 0.454 2615 A N 1.695 124.529 122.820 0.023 0.000 2.674 2615 A HA 0.167 4.487 4.320 0.000 0.000 0.286 2615 A C 1.096 178.688 177.584 0.014 0.000 0.980 2615 A CA -0.677 51.369 52.037 0.015 0.000 1.028 2615 A CB 0.067 19.076 19.000 0.015 0.000 1.199 2615 A HN 0.408 nan 8.150 nan 0.000 0.499 2616 K N -0.131 120.279 120.400 0.016 0.000 2.280 2616 K HA -0.151 4.169 4.320 0.000 0.000 0.202 2616 K C 0.813 177.417 176.600 0.006 0.000 1.047 2616 K CA 1.808 58.105 56.287 0.016 0.000 0.942 2616 K CB -0.027 32.488 32.500 0.025 0.000 0.739 2616 K HN 0.311 nan 8.250 nan 0.000 0.457 2617 E N 1.550 121.748 120.200 -0.003 0.000 2.072 2617 E HA -0.135 4.215 4.350 0.000 0.000 0.190 2617 E C 1.886 178.486 176.600 -0.002 0.000 0.982 2617 E CA 1.236 57.631 56.400 -0.008 0.000 0.803 2617 E CB -0.037 29.653 29.700 -0.015 0.000 0.755 2617 E HN 0.251 nan 8.360 nan 0.000 0.453 2618 K N 0.652 121.053 120.400 0.002 0.000 2.097 2618 K HA -0.030 4.290 4.320 0.000 0.000 0.205 2618 K C 1.764 178.368 176.600 0.008 0.000 1.050 2618 K CA 0.933 57.223 56.287 0.005 0.000 0.938 2618 K CB -0.212 32.292 32.500 0.007 0.000 0.718 2618 K HN 0.084 nan 8.250 nan 0.000 0.442 2619 L N -0.166 121.063 121.223 0.010 0.000 2.056 2619 L HA -0.088 4.252 4.340 0.000 0.000 0.207 2619 L C 2.451 179.327 176.870 0.010 0.000 1.078 2619 L CA 1.206 56.053 54.840 0.012 0.000 0.749 2619 L CB -0.636 41.431 42.059 0.015 0.000 0.901 2619 L HN 0.254 nan 8.230 nan 0.000 0.433 2620 A N -0.158 122.668 122.820 0.009 0.000 1.933 2620 A HA -0.264 4.056 4.320 0.000 0.000 0.218 2620 A C 2.258 179.846 177.584 0.006 0.000 1.175 2620 A CA 1.887 53.929 52.037 0.008 0.000 0.628 2620 A CB -0.502 18.501 19.000 0.005 0.000 0.814 2620 A HN 0.494 nan 8.150 nan 0.000 0.444 2621 E N 0.320 120.523 120.200 0.005 0.000 2.031 2621 E HA -0.203 4.147 4.350 0.000 0.000 0.193 2621 E C 1.936 178.540 176.600 0.007 0.000 0.994 2621 E CA 1.762 58.165 56.400 0.005 0.000 0.800 2621 E CB -0.334 29.369 29.700 0.004 0.000 0.752 2621 E HN 0.773 nan 8.360 nan 0.000 0.447 2622 I N -1.663 118.913 120.570 0.009 0.000 2.761 2622 I HA -0.065 4.105 4.170 0.000 0.000 0.261 2622 I C 1.896 178.019 176.117 0.011 0.000 1.198 2622 I CA 0.509 61.816 61.300 0.011 0.000 1.482 2622 I CB -0.058 37.951 38.000 0.015 0.000 1.100 2622 I HN 0.044 nan 8.210 nan 0.000 0.445 2623 I N 0.837 121.412 120.570 0.010 0.000 2.406 2623 I HA -0.101 4.069 4.170 0.000 0.000 0.249 2623 I C 2.373 178.495 176.117 0.008 0.000 1.122 2623 I CA 1.052 62.357 61.300 0.009 0.000 1.431 2623 I CB -0.144 37.862 38.000 0.009 0.000 1.087 2623 I HN 0.042 nan 8.210 nan 0.000 0.424 2624 V N 0.183 120.102 119.914 0.008 0.000 2.453 2624 V HA -0.157 3.963 4.120 0.000 0.000 0.247 2624 V C 2.388 178.486 176.094 0.007 0.000 1.048 2624 V CA 1.358 63.663 62.300 0.007 0.000 1.049 2624 V CB -0.581 31.246 31.823 0.006 0.000 0.672 2624 V HN 0.359 nan 8.190 nan 0.000 0.457 2625 E N 0.527 120.732 120.200 0.008 0.000 2.106 2625 E HA -0.139 4.211 4.350 0.000 0.000 0.192 2625 E C 2.371 178.976 176.600 0.010 0.000 0.984 2625 E CA 1.373 57.778 56.400 0.009 0.000 0.806 2625 E CB -0.409 29.297 29.700 0.010 0.000 0.750 2625 E HN 0.559 nan 8.360 nan 0.000 0.458 2626 A N 1.090 123.915 122.820 0.009 0.000 1.902 2626 A HA -0.146 4.174 4.320 0.000 0.000 0.217 2626 A C 2.614 180.202 177.584 0.006 0.000 1.181 2626 A CA 1.511 53.552 52.037 0.008 0.000 0.623 2626 A CB -0.662 18.342 19.000 0.007 0.000 0.818 2626 A HN 0.131 nan 8.150 nan 0.000 0.443 2627 V N -0.335 119.582 119.914 0.006 0.000 2.307 2627 V HA -0.193 3.927 4.120 0.000 0.000 0.245 2627 V C 2.759 178.857 176.094 0.007 0.000 1.045 2627 V CA 2.283 64.587 62.300 0.006 0.000 1.024 2627 V CB -0.843 30.983 31.823 0.006 0.000 0.651 2627 V HN 0.545 nan 8.190 nan 0.000 0.449 2628 S N 0.185 115.890 115.700 0.008 0.000 2.399 2628 S HA -0.165 4.305 4.470 0.000 0.000 0.231 2628 S C 2.167 176.774 174.600 0.012 0.000 1.022 2628 S CA 1.354 59.559 58.200 0.009 0.000 0.983 2628 S CB -0.441 62.765 63.200 0.009 0.000 0.803 2628 S HN 0.646 nan 8.310 nan 0.000 0.480 2629 A N 1.173 124.001 122.820 0.012 0.000 1.873 2629 A HA -0.044 4.276 4.320 0.000 0.000 0.215 2629 A C 2.378 179.972 177.584 0.017 0.000 1.186 2629 A CA 1.760 53.806 52.037 0.016 0.000 0.616 2629 A CB -0.734 18.274 19.000 0.014 0.000 0.823 2629 A HN 0.562 nan 8.150 nan 0.000 0.442 2630 V N -3.413 116.508 119.914 0.011 0.000 3.174 2630 V HA 0.051 4.171 4.120 0.000 0.000 0.254 2630 V C 2.049 178.147 176.094 0.008 0.000 1.120 2630 V CA 1.218 63.523 62.300 0.009 0.000 1.114 2630 V CB -0.399 31.426 31.823 0.004 0.000 0.756 2630 V HN 0.192 nan 8.190 nan 0.000 0.467 2631 V N 0.734 120.653 119.914 0.007 0.000 2.626 2631 V HA -0.125 3.995 4.120 0.000 0.000 0.252 2631 V C 1.638 177.734 176.094 0.005 0.000 1.067 2631 V CA 2.549 64.852 62.300 0.005 0.000 1.081 2631 V CB -0.521 31.305 31.823 0.005 0.000 0.686 2631 V HN 0.848 nan 8.190 nan 0.000 0.468 2632 D N -0.731 119.673 120.400 0.008 0.000 4.438 2632 D HA -0.222 4.418 4.640 0.000 0.000 0.158 2632 D C 0.614 176.915 176.300 0.003 0.000 0.686 2632 D CA 1.958 55.962 54.000 0.006 0.000 1.183 2632 D CB -1.283 39.518 40.800 0.001 0.000 0.623 2632 D HN 0.586 nan 8.370 nan 0.000 0.521 2633 D N 1.133 121.532 120.400 -0.001 0.000 2.398 2633 D HA 0.316 4.956 4.640 0.000 0.000 0.247 2633 D C -0.310 175.990 176.300 -0.000 0.000 1.227 2633 D CA 0.211 54.210 54.000 -0.002 0.000 0.980 2633 D CB 0.491 41.288 40.800 -0.005 0.000 1.106 2633 D HN 0.119 nan 8.370 nan 0.000 0.493 2634 E N -0.408 119.791 120.200 -0.000 0.000 2.261 2634 E HA 0.618 4.968 4.350 0.000 0.000 0.239 2634 E C -0.235 176.365 176.600 0.000 0.000 0.991 2634 E CA -0.485 55.915 56.400 0.001 0.000 0.847 2634 E CB 0.970 30.671 29.700 0.001 0.000 1.223 2634 E HN 0.509 nan 8.360 nan 0.000 0.446 2635 G N 1.159 109.959 108.800 0.000 0.000 2.340 2635 G HA2 0.359 4.319 3.960 0.000 0.000 0.300 2635 G HA3 0.359 4.319 3.960 0.000 0.000 0.300 2635 G C -1.719 173.182 174.900 0.001 0.000 1.488 2635 G CA -0.906 44.194 45.100 0.001 0.000 0.878 2635 G HN 0.074 nan 8.290 nan 0.000 0.618 2636 K N 0.623 121.023 120.400 0.001 0.000 2.553 2636 K HA 0.572 4.892 4.320 0.000 0.000 0.250 2636 K C -1.327 175.273 176.600 0.001 0.000 0.953 2636 K CA -0.522 55.766 56.287 0.001 0.000 0.800 2636 K CB 2.150 34.650 32.500 -0.000 0.000 1.243 2636 K HN 0.527 nan 8.250 nan 0.000 0.435 2637 V N 3.293 123.208 119.914 0.002 0.000 2.398 2637 V HA 0.304 4.424 4.120 0.000 0.000 0.286 2637 V C -0.417 175.677 176.094 0.001 0.000 1.026 2637 V CA -0.712 61.589 62.300 0.001 0.000 0.868 2637 V CB 1.549 33.373 31.823 0.003 0.000 0.982 2637 V HN 0.652 nan 8.190 nan 0.000 0.443 2638 D N 3.479 123.878 120.400 -0.001 0.000 2.471 2638 D HA 0.317 4.957 4.640 0.000 0.000 0.245 2638 D C 0.739 177.037 176.300 -0.003 0.000 1.116 2638 D CA -0.583 53.416 54.000 -0.002 0.000 0.853 2638 D CB 1.791 42.588 40.800 -0.004 0.000 1.123 2638 D HN 0.417 nan 8.370 nan 0.000 0.540 2639 K N 1.989 122.387 120.400 -0.003 0.000 2.442 2639 K HA -0.139 4.181 4.320 0.000 0.000 0.198 2639 K C 0.916 177.511 176.600 -0.008 0.000 1.044 2639 K CA 0.757 57.041 56.287 -0.005 0.000 0.948 2639 K CB 0.262 32.760 32.500 -0.003 0.000 0.762 2639 K HN 0.362 nan 8.250 nan 0.000 0.472 2640 D N 0.331 120.725 120.400 -0.009 0.000 2.219 2640 D HA -0.113 4.527 4.640 0.000 0.000 0.205 2640 D C 1.076 177.365 176.300 -0.017 0.000 0.970 2640 D CA 0.707 54.699 54.000 -0.014 0.000 0.851 2640 D CB 0.242 41.034 40.800 -0.013 0.000 0.943 2640 D HN -0.027 nan 8.370 nan 0.000 0.488 2641 L N 0.523 121.738 121.223 -0.014 0.000 2.591 2641 L HA 0.246 4.586 4.340 0.000 0.000 0.228 2641 L C 0.057 176.917 176.870 -0.016 0.000 1.133 2641 L CA 0.471 55.302 54.840 -0.016 0.000 0.880 2641 L CB -0.525 41.528 42.059 -0.010 0.000 1.033 2641 L HN 0.161 nan 8.230 nan 0.000 0.450 2642 I N 0.319 120.880 120.570 -0.015 0.000 2.437 2642 I HA 0.196 4.366 4.170 0.000 0.000 0.279 2642 I C 0.320 176.426 176.117 -0.019 0.000 1.028 2642 I CA -0.351 60.940 61.300 -0.014 0.000 1.142 2642 I CB 1.697 39.693 38.000 -0.007 0.000 1.266 2642 I HN -0.038 nan 8.210 nan 0.000 0.461 2643 K N 6.467 126.851 120.400 -0.027 0.000 2.174 2643 K HA 0.478 4.798 4.320 0.000 0.000 0.275 2643 K C -0.709 175.873 176.600 -0.030 0.000 1.015 2643 K CA -0.542 55.723 56.287 -0.035 0.000 0.933 2643 K CB 1.061 33.529 32.500 -0.053 0.000 1.025 2643 K HN 0.438 nan 8.250 nan 0.000 0.463 2644 I N 4.694 125.247 120.570 -0.029 0.000 2.337 2644 I HA 0.238 4.408 4.170 0.000 0.000 0.285 2644 I C -0.154 175.945 176.117 -0.030 0.000 1.041 2644 I CA -0.406 60.880 61.300 -0.023 0.000 1.199 2644 I CB 0.958 38.949 38.000 -0.016 0.000 1.370 2644 I HN 0.610 nan 8.210 nan 0.000 0.470 2645 E N 6.322 126.503 120.200 -0.031 0.000 2.202 2645 E HA 0.516 4.866 4.350 0.000 0.000 0.272 2645 E C -0.363 176.226 176.600 -0.019 0.000 0.951 2645 E CA -0.643 55.735 56.400 -0.037 0.000 0.813 2645 E CB 2.953 32.617 29.700 -0.062 0.000 1.151 2645 E HN 0.507 nan 8.360 nan 0.000 0.398 2646 K N 0.583 120.972 120.400 -0.018 0.000 2.468 2646 K HA 0.674 4.994 4.320 0.000 0.000 0.252 2646 K C -0.959 175.638 176.600 -0.005 0.000 0.932 2646 K CA -1.050 55.232 56.287 -0.008 0.000 0.794 2646 K CB 2.148 34.640 32.500 -0.014 0.000 1.241 2646 K HN 0.132 nan 8.250 nan 0.000 0.428 2647 K N 1.636 122.041 120.400 0.008 0.000 2.619 2647 K HA 0.187 4.507 4.320 0.000 0.000 0.251 2647 K C -1.086 175.526 176.600 0.020 0.000 0.987 2647 K CA -0.322 55.974 56.287 0.014 0.000 0.844 2647 K CB 1.811 34.328 32.500 0.027 0.000 1.237 2647 K HN 0.835 nan 8.250 nan 0.000 0.447 2648 S N 1.863 117.573 115.700 0.016 0.000 2.576 2648 S HA 0.694 5.164 4.470 0.000 0.000 0.272 2648 S C 0.496 175.111 174.600 0.025 0.000 1.352 2648 S CA 0.326 58.539 58.200 0.022 0.000 1.021 2648 S CB 0.698 63.912 63.200 0.024 0.000 0.887 2648 S HN 1.339 nan 8.310 nan 0.000 0.542 2649 G N -0.110 108.705 108.800 0.026 0.000 2.453 2649 G HA2 0.505 4.465 3.960 0.000 0.000 0.665 2649 G HA3 0.505 4.465 3.960 0.000 0.000 0.665 2649 G C -0.132 174.782 174.900 0.023 0.000 1.411 2649 G CA -0.131 44.983 45.100 0.024 0.000 0.889 2649 G HN 2.323 nan 8.290 nan 0.000 0.651 2650 A N -0.406 122.426 122.820 0.020 0.000 6.088 2650 A HA 0.406 4.726 4.320 0.000 0.000 0.261 2650 A C 1.368 178.963 177.584 0.018 0.000 2.138 2650 A CA 2.034 54.081 52.037 0.017 0.000 0.708 2650 A CB -1.815 17.196 19.000 0.018 0.000 1.068 2650 A HN 2.924 nan 8.150 nan 0.000 0.364 2651 S N -1.507 114.203 115.700 0.017 0.000 2.766 2651 S HA 0.781 5.251 4.470 0.000 0.000 0.307 2651 S C 1.071 175.682 174.600 0.019 0.000 1.121 2651 S CA -0.086 58.125 58.200 0.017 0.000 0.980 2651 S CB 1.089 64.297 63.200 0.014 0.000 1.159 2651 S HN 1.124 nan 8.310 nan 0.000 0.546 2652 I N 0.580 121.161 120.570 0.019 0.000 2.493 2652 I HA -0.093 4.077 4.170 0.000 0.000 0.254 2652 I C 2.167 178.294 176.117 0.017 0.000 1.160 2652 I CA 1.434 62.746 61.300 0.019 0.000 1.445 2652 I CB -0.493 37.519 38.000 0.020 0.000 1.086 2652 I HN 0.780 nan 8.210 nan 0.000 0.433 2653 D N 1.373 121.781 120.400 0.014 0.000 2.182 2653 D HA -0.223 4.417 4.640 0.000 0.000 0.201 2653 D C 1.387 177.695 176.300 0.013 0.000 0.986 2653 D CA 1.381 55.388 54.000 0.012 0.000 0.847 2653 D CB -0.024 40.781 40.800 0.009 0.000 0.942 2653 D HN 0.340 nan 8.370 nan 0.000 0.467 2654 D N -0.883 119.526 120.400 0.015 0.000 2.348 2654 D HA -0.019 4.621 4.640 0.000 0.000 0.216 2654 D C 0.246 176.561 176.300 0.024 0.000 0.970 2654 D CA 0.509 54.519 54.000 0.017 0.000 0.889 2654 D CB -0.068 40.742 40.800 0.017 0.000 0.912 2654 D HN 0.094 nan 8.370 nan 0.000 0.524 2655 T N 1.615 116.184 114.554 0.025 0.000 2.933 2655 T HA 0.099 4.449 4.350 0.000 0.000 0.306 2655 T C 0.271 174.989 174.700 0.031 0.000 1.045 2655 T CA 0.280 62.398 62.100 0.030 0.000 1.143 2655 T CB 0.339 69.222 68.868 0.024 0.000 1.003 2655 T HN 0.312 nan 8.240 nan 0.000 0.540 2656 E N 1.754 121.980 120.200 0.042 0.000 2.408 2656 E HA 0.602 4.952 4.350 0.000 0.000 0.275 2656 E C -1.563 175.069 176.600 0.053 0.000 0.935 2656 E CA -1.175 55.251 56.400 0.044 0.000 0.775 2656 E CB 1.257 30.985 29.700 0.047 0.000 1.277 2656 E HN 0.338 nan 8.360 nan 0.000 0.455 2657 L N 1.961 123.210 121.223 0.045 0.000 2.289 2657 L HA 0.478 4.818 4.340 0.000 0.000 0.285 2657 L C -1.430 175.477 176.870 0.061 0.000 1.049 2657 L CA -0.491 54.375 54.840 0.044 0.000 0.804 2657 L CB 1.064 43.140 42.059 0.028 0.000 1.195 2657 L HN 0.601 nan 8.230 nan 0.000 0.428 2658 I N 5.080 125.693 120.570 0.073 0.000 2.354 2658 I HA 0.290 4.460 4.170 0.000 0.000 0.286 2658 I C 0.205 176.358 176.117 0.060 0.000 1.007 2658 I CA -0.293 61.067 61.300 0.101 0.000 1.167 2658 I CB 1.186 39.292 38.000 0.176 0.000 1.320 2658 I HN 0.522 nan 8.210 nan 0.000 0.458 2659 K N 6.047 126.477 120.400 0.050 0.000 2.054 2659 K HA 0.474 4.795 4.320 0.000 0.000 0.242 2659 K C 0.322 176.940 176.600 0.030 0.000 1.157 2659 K CA 0.257 56.562 56.287 0.030 0.000 1.079 2659 K CB -0.404 32.108 32.500 0.020 0.000 1.331 2659 K HN 0.947 nan 8.250 nan 0.000 0.317 2660 G N 0.568 109.382 108.800 0.022 0.000 2.491 2660 G HA2 0.061 4.021 3.960 0.000 0.000 0.183 2660 G HA3 0.061 4.021 3.960 0.000 0.000 0.183 2660 G C -1.647 173.243 174.900 -0.017 0.000 1.221 2660 G CA -0.647 44.459 45.100 0.010 0.000 0.996 2660 G HN 0.171 nan 8.290 nan 0.000 0.474 2661 V N 0.805 120.694 119.914 -0.041 0.000 2.487 2661 V HA 0.704 4.824 4.120 0.000 0.000 0.298 2661 V C -0.832 175.177 176.094 -0.143 0.000 1.028 2661 V CA -0.594 61.645 62.300 -0.102 0.000 0.860 2661 V CB 1.451 33.183 31.823 -0.153 0.000 0.991 2661 V HN 0.945 nan 8.190 nan 0.000 0.427 2662 L N 7.515 128.617 121.223 -0.201 0.000 2.305 2662 L HA 0.839 5.179 4.340 0.000 0.000 0.284 2662 L C -0.367 176.336 176.870 -0.279 0.000 1.013 2662 L CA -0.174 54.447 54.840 -0.364 0.000 0.819 2662 L CB 1.689 43.435 42.059 -0.521 0.000 1.227 2662 L HN 0.581 nan 8.230 nan 0.000 0.417 2663 V N 1.564 121.327 119.914 -0.252 0.000 2.715 2663 V HA 0.632 4.752 4.120 0.000 0.000 0.310 2663 V C -0.353 175.669 176.094 -0.120 0.000 1.054 2663 V CA -0.516 61.692 62.300 -0.153 0.000 0.928 2663 V CB 1.789 33.548 31.823 -0.106 0.000 1.007 2663 V HN 0.823 nan 8.190 nan 0.000 0.437 2664 D N 1.664 122.018 120.400 -0.076 0.000 3.134 2664 D HA 0.253 4.893 4.640 0.000 0.000 0.248 2664 D C 0.050 176.348 176.300 -0.004 0.000 1.273 2664 D CA -0.186 53.787 54.000 -0.045 0.000 0.904 2664 D CB -0.001 40.775 40.800 -0.040 0.000 1.089 2664 D HN 0.504 nan 8.370 nan 0.000 0.478 2665 K N 0.715 121.127 120.400 0.021 0.000 2.306 2665 K HA 0.413 4.733 4.320 0.000 0.000 0.236 2665 K C 0.525 177.157 176.600 0.053 0.000 1.013 2665 K CA -0.650 55.669 56.287 0.054 0.000 0.857 2665 K CB 2.336 34.904 32.500 0.114 0.000 1.214 2665 K HN 0.359 nan 8.250 nan 0.000 0.449 2666 E N 0.928 121.153 120.200 0.042 0.000 2.359 2666 E HA 0.360 4.710 4.350 0.000 0.000 0.266 2666 E C -0.687 175.919 176.600 0.010 0.000 0.920 2666 E CA -0.934 55.484 56.400 0.030 0.000 0.788 2666 E CB 1.283 30.997 29.700 0.023 0.000 1.279 2666 E HN 0.214 nan 8.360 nan 0.000 0.438 2667 R N 1.371 121.872 120.500 0.002 0.000 2.296 2667 R HA 0.097 4.437 4.340 0.000 0.000 0.323 2667 R C 1.380 177.672 176.300 -0.013 0.000 1.067 2667 R CA 0.231 56.319 56.100 -0.020 0.000 0.946 2667 R CB 0.416 30.706 30.300 -0.018 0.000 0.991 2667 R HN 0.568 nan 8.270 nan 0.000 0.448 2668 V N 0.010 119.912 119.914 -0.020 0.000 2.720 2668 V HA -0.090 4.030 4.120 0.000 0.000 0.256 2668 V C 0.922 177.014 176.094 -0.004 0.000 1.082 2668 V CA 1.150 63.444 62.300 -0.009 0.000 1.101 2668 V CB -0.255 31.562 31.823 -0.009 0.000 0.693 2668 V HN 0.521 nan 8.190 nan 0.000 0.479 2669 S N -1.079 114.618 115.700 -0.005 0.000 2.526 2669 S HA 0.777 5.247 4.470 0.000 0.000 0.293 2669 S C 0.897 175.495 174.600 -0.004 0.000 1.092 2669 S CA -0.135 58.063 58.200 -0.002 0.000 0.980 2669 S CB 1.875 65.083 63.200 0.013 0.000 1.048 2669 S HN 0.708 nan 8.310 nan 0.000 0.483 2670 A N 2.947 125.762 122.820 -0.009 0.000 2.019 2670 A HA -0.082 4.238 4.320 0.000 0.000 0.219 2670 A C 1.907 179.490 177.584 -0.001 0.000 1.164 2670 A CA 1.719 53.752 52.037 -0.006 0.000 0.644 2670 A CB -0.651 18.342 19.000 -0.012 0.000 0.805 2670 A HN 0.901 nan 8.150 nan 0.000 0.449 2671 Q N -1.087 118.716 119.800 0.005 0.000 2.389 2671 Q HA 0.130 4.470 4.340 0.000 0.000 0.204 2671 Q C 0.491 176.503 176.000 0.020 0.000 0.944 2671 Q CA -0.096 55.719 55.803 0.020 0.000 0.908 2671 Q CB -0.098 28.668 28.738 0.046 0.000 1.002 2671 Q HN 0.675 nan 8.270 nan 0.000 0.493 2672 M N 2.285 121.891 119.600 0.011 0.000 2.243 2672 M HA 0.186 4.666 4.480 0.000 0.000 0.341 2672 M C -2.026 174.271 176.300 -0.005 0.000 1.130 2672 M CA -1.787 53.512 55.300 -0.001 0.000 1.162 2672 M CB 0.406 32.997 32.600 -0.014 0.000 1.497 2672 M HN -0.044 nan 8.290 nan 0.000 0.456 2673 P HA 0.007 nan 4.420 nan 0.000 0.266 2673 P C -0.515 176.780 177.300 -0.009 0.000 1.193 2673 P CA 0.313 63.407 63.100 -0.010 0.000 0.770 2673 P CB 0.442 32.133 31.700 -0.015 0.000 0.836 2674 K N 0.946 121.345 120.400 -0.001 0.000 2.367 2674 K HA 0.108 4.428 4.320 0.000 0.000 0.194 2674 K C 0.509 177.116 176.600 0.012 0.000 1.027 2674 K CA 0.349 56.640 56.287 0.006 0.000 1.075 2674 K CB 0.349 32.854 32.500 0.009 0.000 0.845 2674 K HN 0.330 nan 8.250 nan 0.000 0.529 2675 K N 0.973 121.376 120.400 0.006 0.000 2.550 2675 K HA 0.257 4.577 4.320 0.000 0.000 0.252 2675 K C -1.835 174.767 176.600 0.004 0.000 0.943 2675 K CA -0.494 55.798 56.287 0.010 0.000 0.806 2675 K CB 2.085 34.588 32.500 0.005 0.000 1.289 2675 K HN -0.239 nan 8.250 nan 0.000 0.435 2676 V N 2.888 122.808 119.914 0.010 0.000 2.531 2676 V HA 0.448 4.568 4.120 0.000 0.000 0.301 2676 V C -0.278 175.824 176.094 0.013 0.000 1.034 2676 V CA -0.716 61.587 62.300 0.006 0.000 0.865 2676 V CB 1.755 33.578 31.823 0.001 0.000 0.995 2676 V HN 0.936 nan 8.190 nan 0.000 0.424 2677 T N -0.086 114.472 114.554 0.007 0.000 2.859 2677 T HA 0.557 4.907 4.350 0.000 0.000 0.281 2677 T C -0.003 174.701 174.700 0.007 0.000 1.005 2677 T CA -0.333 61.771 62.100 0.007 0.000 1.025 2677 T CB 1.301 70.170 68.868 0.002 0.000 0.977 2677 T HN 0.778 nan 8.240 nan 0.000 0.458 2678 D N 0.666 121.071 120.400 0.008 0.000 2.697 2678 D HA -0.147 4.493 4.640 0.000 0.000 0.238 2678 D C 0.333 176.640 176.300 0.012 0.000 1.152 2678 D CA 0.867 54.871 54.000 0.008 0.000 0.666 2678 D CB -1.225 39.577 40.800 0.003 0.000 1.037 2678 D HN 1.118 nan 8.370 nan 0.000 0.423 2679 A N 1.481 124.313 122.820 0.020 0.000 2.462 2679 A HA 0.407 4.727 4.320 0.000 0.000 0.243 2679 A C 0.492 178.094 177.584 0.029 0.000 1.076 2679 A CA 0.129 52.181 52.037 0.026 0.000 0.773 2679 A CB 0.604 19.631 19.000 0.045 0.000 1.010 2679 A HN 0.159 nan 8.150 nan 0.000 0.493 2680 K N 2.638 123.051 120.400 0.023 0.000 2.389 2680 K HA 0.419 4.739 4.320 0.000 0.000 0.261 2680 K C -1.317 175.304 176.600 0.035 0.000 1.014 2680 K CA -0.162 56.139 56.287 0.024 0.000 0.920 2680 K CB 1.066 33.572 32.500 0.010 0.000 1.149 2680 K HN 0.530 nan 8.250 nan 0.000 0.444 2681 I N 2.071 122.679 120.570 0.063 0.000 2.331 2681 I HA 0.281 4.451 4.170 0.000 0.000 0.292 2681 I C 0.278 176.451 176.117 0.093 0.000 0.998 2681 I CA -0.318 61.047 61.300 0.109 0.000 1.267 2681 I CB 1.615 39.720 38.000 0.176 0.000 1.386 2681 I HN 0.502 nan 8.210 nan 0.000 0.476 2682 A N 7.369 130.244 122.820 0.092 0.000 2.330 2682 A HA 0.857 5.177 4.320 0.000 0.000 0.327 2682 A C -0.765 176.891 177.584 0.120 0.000 1.155 2682 A CA -0.561 51.521 52.037 0.075 0.000 0.803 2682 A CB 0.732 19.752 19.000 0.033 0.000 1.208 2682 A HN 0.674 nan 8.150 nan 0.000 0.477 2683 L N 3.183 124.463 121.223 0.094 0.000 2.324 2683 L HA 0.372 4.712 4.340 0.000 0.000 0.274 2683 L C -1.256 175.652 176.870 0.064 0.000 1.012 2683 L CA -0.552 54.347 54.840 0.098 0.000 0.859 2683 L CB 1.037 43.136 42.059 0.065 0.000 1.224 2683 L HN 0.499 nan 8.230 nan 0.000 0.429 2684 L N 2.769 124.033 121.223 0.068 0.000 2.309 2684 L HA 0.357 4.697 4.340 0.000 0.000 0.282 2684 L C 0.739 177.634 176.870 0.043 0.000 1.036 2684 L CA 0.210 55.077 54.840 0.045 0.000 0.806 2684 L CB 1.493 43.574 42.059 0.036 0.000 1.220 2684 L HN 0.422 nan 8.230 nan 0.000 0.429 2685 N N 0.455 119.173 118.700 0.030 0.000 2.407 2685 N HA 0.008 4.748 4.740 0.000 0.000 0.182 2685 N C 0.126 175.649 175.510 0.022 0.000 1.079 2685 N CA 0.012 53.078 53.050 0.025 0.000 0.882 2685 N CB 0.377 38.875 38.487 0.019 0.000 1.106 2685 N HN 0.586 nan 8.380 nan 0.000 0.461 2686 C N 1.915 121.227 119.300 0.020 0.000 2.585 2686 C HA 0.746 5.206 4.460 0.000 0.000 0.406 2686 C C 0.843 175.845 174.990 0.019 0.000 1.312 2686 C CA -0.959 58.070 59.018 0.018 0.000 1.924 2686 C CB -1.442 26.307 27.740 0.016 0.000 2.578 2686 C HN 0.507 nan 8.230 nan 0.000 0.580 2687 A N 6.293 129.123 122.820 0.018 0.000 2.540 2687 A HA 0.305 4.625 4.320 0.000 0.000 0.239 2687 A C 0.328 177.923 177.584 0.019 0.000 1.061 2687 A CA 0.121 52.169 52.037 0.019 0.000 0.758 2687 A CB -0.046 18.964 19.000 0.017 0.000 0.991 2687 A HN 0.898 nan 8.150 nan 0.000 0.502 2688 I N 2.587 123.169 120.570 0.020 0.000 2.204 2688 I HA 0.135 4.305 4.170 0.000 0.000 0.291 2688 I C -0.057 176.074 176.117 0.025 0.000 1.153 2688 I CA 0.615 61.928 61.300 0.022 0.000 1.546 2688 I CB -0.558 37.455 38.000 0.021 0.000 1.490 2688 I HN 0.627 nan 8.210 nan 0.000 0.697 2689 E N 4.659 124.873 120.200 0.022 0.000 2.302 2689 E HA 0.397 4.747 4.350 0.000 0.000 0.263 2689 E C -0.989 175.623 176.600 0.019 0.000 0.897 2689 E CA -0.599 55.814 56.400 0.021 0.000 0.809 2689 E CB 2.044 31.755 29.700 0.018 0.000 1.270 2689 E HN 0.235 nan 8.360 nan 0.000 0.410 2690 E N 1.904 122.116 120.200 0.020 0.000 2.275 2690 E HA 0.235 4.585 4.350 0.000 0.000 0.270 2690 E C -0.738 175.870 176.600 0.014 0.000 0.882 2690 E CA -0.612 55.798 56.400 0.017 0.000 0.758 2690 E CB 2.269 31.980 29.700 0.019 0.000 1.195 2690 E HN 0.287 nan 8.360 nan 0.000 0.419 2691 T N 1.492 116.052 114.554 0.010 0.000 2.946 2691 T HA 0.358 4.708 4.350 0.000 0.000 0.311 2691 T C 0.180 174.884 174.700 0.005 0.000 1.063 2691 T CA 0.840 62.944 62.100 0.007 0.000 1.139 2691 T CB 0.286 69.158 68.868 0.006 0.000 0.994 2691 T HN 0.732 nan 8.240 nan 0.000 0.547 2692 A N 2.898 125.719 122.820 0.002 0.000 2.435 2692 A HA -0.084 4.236 4.320 0.000 0.000 0.686 2692 A C 1.365 178.945 177.584 -0.006 0.000 0.138 2692 A CA 0.081 52.116 52.037 -0.003 0.000 0.024 2692 A CB -1.532 17.466 19.000 -0.004 0.000 3.974 2692 A HN 0.801 nan 8.150 nan 0.000 0.548 2693 S N 0.523 116.213 115.700 -0.018 0.000 2.406 2693 S HA -0.078 4.392 4.470 0.000 0.000 0.228 2693 S C 1.689 176.262 174.600 -0.045 0.000 1.020 2693 S CA 1.334 59.513 58.200 -0.035 0.000 0.965 2693 S CB -0.173 62.995 63.200 -0.054 0.000 0.798 2693 S HN 0.736 nan 8.310 nan 0.000 0.488 2694 E N 1.136 121.315 120.200 -0.036 0.000 2.072 2694 E HA -0.010 4.340 4.350 0.000 0.000 0.191 2694 E C 1.962 178.558 176.600 -0.006 0.000 0.985 2694 E CA 0.859 57.240 56.400 -0.030 0.000 0.801 2694 E CB -0.233 29.453 29.700 -0.023 0.000 0.750 2694 E HN 0.409 nan 8.360 nan 0.000 0.452 2695 M N 0.013 119.613 119.600 0.000 0.000 2.200 2695 M HA -0.065 4.415 4.480 0.000 0.000 0.265 2695 M C 2.315 178.629 176.300 0.024 0.000 1.066 2695 M CA 0.730 56.037 55.300 0.012 0.000 1.127 2695 M CB -0.810 31.796 32.600 0.009 0.000 1.379 2695 M HN 0.090 nan 8.290 nan 0.000 0.420 2696 L N 0.669 121.906 121.223 0.024 0.000 2.072 2696 L HA -0.069 4.271 4.340 0.000 0.000 0.205 2696 L C 2.119 179.037 176.870 0.079 0.000 1.079 2696 L CA 1.841 56.706 54.840 0.041 0.000 0.752 2696 L CB -0.570 41.509 42.059 0.034 0.000 0.906 2696 L HN 0.162 nan 8.230 nan 0.000 0.436 2697 K N -0.674 119.772 120.400 0.077 0.000 2.283 2697 K HA -0.170 4.150 4.320 0.000 0.000 0.202 2697 K C 1.691 178.418 176.600 0.212 0.000 1.048 2697 K CA 1.084 57.482 56.287 0.185 0.000 0.948 2697 K CB -0.156 32.303 32.500 -0.067 0.000 0.742 2697 K HN 0.315 nan 8.250 nan 0.000 0.458 2698 D N 0.837 121.299 120.400 0.103 0.000 2.117 2698 D HA -0.131 4.509 4.640 0.000 0.000 0.197 2698 D C 1.796 178.134 176.300 0.064 0.000 0.987 2698 D CA 1.100 55.147 54.000 0.077 0.000 0.829 2698 D CB 0.174 41.000 40.800 0.043 0.000 0.961 2698 D HN -0.012 nan 8.370 nan 0.000 0.460 2699 M N -0.043 119.592 119.600 0.058 0.000 2.117 2699 M HA -0.095 4.385 4.480 0.000 0.000 0.262 2699 M C 2.332 178.647 176.300 0.024 0.000 1.065 2699 M CA 0.640 55.962 55.300 0.037 0.000 1.114 2699 M CB -0.878 31.743 32.600 0.035 0.000 1.361 2699 M HN -0.017 nan 8.290 nan 0.000 0.408 2700 V N 0.479 120.420 119.914 0.045 0.000 2.358 2700 V HA -0.193 3.927 4.120 0.000 0.000 0.246 2700 V C 2.717 178.751 176.094 -0.100 0.000 1.047 2700 V CA 1.724 64.007 62.300 -0.027 0.000 1.035 2700 V CB -1.331 30.495 31.823 0.006 0.000 0.658 2700 V HN 0.474 nan 8.190 nan 0.000 0.452 2701 A N -0.464 122.347 122.820 -0.015 0.000 1.930 2701 A HA -0.223 4.097 4.320 0.000 0.000 0.217 2701 A C 2.178 179.747 177.584 -0.025 0.000 1.175 2701 A CA 1.755 53.779 52.037 -0.021 0.000 0.627 2701 A CB -0.420 18.631 19.000 0.085 0.000 0.815 2701 A HN 0.614 nan 8.150 nan 0.000 0.443 2702 E N -0.387 119.809 120.200 -0.006 0.000 2.106 2702 E HA -0.116 4.234 4.350 0.000 0.000 0.192 2702 E C 1.838 178.426 176.600 -0.019 0.000 0.984 2702 E CA 0.991 57.388 56.400 -0.006 0.000 0.806 2702 E CB -0.250 29.452 29.700 0.005 0.000 0.750 2702 E HN 0.709 nan 8.360 nan 0.000 0.458 2703 I N 1.116 121.667 120.570 -0.032 0.000 2.179 2703 I HA -0.282 3.888 4.170 0.000 0.000 0.242 2703 I C 2.485 178.572 176.117 -0.050 0.000 1.088 2703 I CA 1.060 62.337 61.300 -0.039 0.000 1.357 2703 I CB -0.151 37.818 38.000 -0.050 0.000 1.051 2703 I HN -0.021 nan 8.210 nan 0.000 0.409 2704 K N 1.629 121.983 120.400 -0.076 0.000 2.057 2704 K HA -0.124 4.196 4.320 0.000 0.000 0.207 2704 K C 2.038 178.610 176.600 -0.047 0.000 1.049 2704 K CA 1.727 57.967 56.287 -0.079 0.000 0.931 2704 K CB -0.406 32.021 32.500 -0.121 0.000 0.714 2704 K HN 0.277 nan 8.250 nan 0.000 0.440 2705 A N -0.101 122.697 122.820 -0.036 0.000 1.933 2705 A HA -0.121 4.199 4.320 0.000 0.000 0.218 2705 A C 2.177 179.752 177.584 -0.014 0.000 1.175 2705 A CA 2.088 54.114 52.037 -0.019 0.000 0.628 2705 A CB -0.755 18.239 19.000 -0.010 0.000 0.814 2705 A HN 0.365 nan 8.150 nan 0.000 0.444 2706 S N -1.742 113.950 115.700 -0.014 0.000 2.474 2706 S HA 0.248 4.718 4.470 0.000 0.000 0.235 2706 S C 1.509 176.104 174.600 -0.008 0.000 0.997 2706 S CA 1.158 59.353 58.200 -0.008 0.000 0.949 2706 S CB -0.140 63.057 63.200 -0.005 0.000 0.766 2706 S HN 1.678 nan 8.310 nan 0.000 0.517 2707 G N 0.689 109.479 108.800 -0.015 0.000 2.159 2707 G HA2 -0.128 3.832 3.960 0.000 0.000 0.227 2707 G HA3 -0.128 3.832 3.960 0.000 0.000 0.227 2707 G C 0.108 174.998 174.900 -0.017 0.000 0.986 2707 G CA -0.176 44.915 45.100 -0.015 0.000 0.651 2707 G HN 0.827 nan 8.290 nan 0.000 0.523 2708 A N 0.037 122.844 122.820 -0.021 0.000 2.477 2708 A HA 0.638 4.958 4.320 0.000 0.000 0.246 2708 A C 1.106 178.668 177.584 -0.037 0.000 1.078 2708 A CA 0.721 52.745 52.037 -0.021 0.000 0.770 2708 A CB 0.217 19.205 19.000 -0.020 0.000 1.011 2708 A HN 0.333 nan 8.150 nan 0.000 0.494 2709 N N 0.607 119.288 118.700 -0.032 0.000 2.257 2709 N HA 0.125 4.865 4.740 0.000 0.000 0.200 2709 N C -0.679 174.793 175.510 -0.063 0.000 1.163 2709 N CA 0.449 53.472 53.050 -0.044 0.000 0.891 2709 N CB 1.047 39.516 38.487 -0.029 0.000 1.067 2709 N HN 0.383 nan 8.380 nan 0.000 0.497 2710 V N 2.513 122.390 119.914 -0.062 0.000 2.540 2710 V HA 0.458 4.578 4.120 0.000 0.000 0.302 2710 V C -0.696 175.311 176.094 -0.145 0.000 1.035 2710 V CA -0.733 61.492 62.300 -0.125 0.000 0.873 2710 V CB 2.992 34.780 31.823 -0.058 0.000 0.992 2710 V HN 0.023 nan 8.190 nan 0.000 0.428 2711 L N 5.633 126.684 121.223 -0.287 0.000 2.446 2711 L HA 0.603 4.943 4.340 0.000 0.000 0.268 2711 L C -1.829 174.831 176.870 -0.351 0.000 0.975 2711 L CA -0.103 54.615 54.840 -0.203 0.000 0.848 2711 L CB 1.470 43.455 42.059 -0.123 0.000 1.225 2711 L HN 0.581 nan 8.230 nan 0.000 0.410 2712 F N 4.420 124.368 119.950 -0.004 0.000 2.361 2712 F HA 0.335 4.862 4.527 -0.000 0.000 0.364 2712 F C 0.528 176.326 175.800 -0.004 0.000 1.117 2712 F CA -0.406 57.591 58.000 -0.005 0.000 1.071 2712 F CB 1.345 40.341 39.000 -0.007 0.000 1.188 2712 F HN 0.445 nan 8.300 nan 0.000 0.464 2713 C N 5.261 124.643 119.300 0.137 0.000 2.303 2713 C HA 0.218 4.678 4.460 0.000 0.000 0.326 2713 C C 1.630 176.670 174.990 0.085 0.000 1.285 2713 C CA -0.463 58.605 59.018 0.084 0.000 1.675 2713 C CB 0.644 28.410 27.740 0.042 0.000 2.289 2713 C HN 0.952 nan 8.230 nan 0.000 0.512 2714 Q N 3.201 123.040 119.800 0.066 0.000 2.124 2714 Q HA -0.054 4.286 4.340 0.000 0.000 0.202 2714 Q C 1.088 177.109 176.000 0.035 0.000 0.977 2714 Q CA 1.591 57.422 55.803 0.046 0.000 0.850 2714 Q CB 0.198 28.954 28.738 0.030 0.000 0.901 2714 Q HN 0.704 nan 8.270 nan 0.000 0.429 2715 K N -0.710 119.709 120.400 0.031 0.000 2.842 2715 K HA 0.350 4.670 4.320 0.000 0.000 0.310 2715 K C 0.495 177.111 176.600 0.026 0.000 0.992 2715 K CA 0.059 56.361 56.287 0.024 0.000 1.207 2715 K CB -0.739 31.773 32.500 0.020 0.000 1.478 2715 K HN 0.131 nan 8.250 nan 0.000 0.601 2716 G N 0.259 109.071 108.800 0.021 0.000 2.562 2716 G HA2 0.535 4.495 3.960 0.000 0.000 0.275 2716 G HA3 0.535 4.495 3.960 0.000 0.000 0.275 2716 G C -0.473 174.439 174.900 0.019 0.000 1.196 2716 G CA -0.558 44.554 45.100 0.019 0.000 0.908 2716 G HN 0.313 nan 8.290 nan 0.000 0.524 2717 I N 0.677 121.258 120.570 0.018 0.000 2.478 2717 I HA 0.166 4.336 4.170 0.000 0.000 0.287 2717 I C -0.530 175.600 176.117 0.022 0.000 1.042 2717 I CA -0.766 60.545 61.300 0.019 0.000 1.067 2717 I CB 2.037 40.044 38.000 0.012 0.000 1.233 2717 I HN 0.415 nan 8.210 nan 0.000 0.431 2718 D N 4.933 125.349 120.400 0.027 0.000 2.443 2718 D HA -0.049 4.591 4.640 0.000 0.000 0.239 2718 D C 0.613 176.937 176.300 0.040 0.000 1.136 2718 D CA 0.176 54.195 54.000 0.031 0.000 0.879 2718 D CB 1.340 42.160 40.800 0.033 0.000 1.195 2718 D HN 0.484 nan 8.370 nan 0.000 0.443 2719 D N 2.791 123.212 120.400 0.036 0.000 2.158 2719 D HA -0.185 4.455 4.640 0.000 0.000 0.197 2719 D C 1.770 178.118 176.300 0.079 0.000 0.995 2719 D CA 0.610 54.635 54.000 0.042 0.000 0.846 2719 D CB -0.032 40.783 40.800 0.024 0.000 0.941 2719 D HN 0.454 nan 8.370 nan 0.000 0.456 2720 L N 0.186 121.458 121.223 0.082 0.000 2.056 2720 L HA -0.139 4.201 4.340 0.000 0.000 0.207 2720 L C 2.183 179.135 176.870 0.136 0.000 1.078 2720 L CA 1.414 56.321 54.840 0.112 0.000 0.749 2720 L CB -0.164 41.935 42.059 0.067 0.000 0.901 2720 L HN -0.021 nan 8.230 nan 0.000 0.433 2721 A N -0.637 122.246 122.820 0.105 0.000 1.933 2721 A HA -0.250 4.070 4.320 0.000 0.000 0.218 2721 A C 2.085 179.733 177.584 0.107 0.000 1.175 2721 A CA 1.644 53.747 52.037 0.110 0.000 0.628 2721 A CB -0.485 18.556 19.000 0.069 0.000 0.814 2721 A HN 0.638 nan 8.150 nan 0.000 0.444 2722 Q N -1.418 118.438 119.800 0.093 0.000 2.084 2722 Q HA -0.217 4.123 4.340 0.000 0.000 0.202 2722 Q C 2.050 178.135 176.000 0.142 0.000 0.978 2722 Q CA 1.627 57.477 55.803 0.079 0.000 0.844 2722 Q CB -0.388 28.383 28.738 0.054 0.000 0.898 2722 Q HN 0.943 nan 8.270 nan 0.000 0.426 2723 H N -0.856 118.247 119.070 0.055 0.000 2.293 2723 H HA -0.196 4.360 4.556 0.000 0.000 0.300 2723 H C 1.941 177.349 175.328 0.134 0.000 1.082 2723 H CA 1.173 57.264 56.048 0.070 0.000 1.308 2723 H CB 0.114 29.910 29.762 0.057 0.000 1.375 2723 H HN 0.237 nan 8.280 nan 0.000 0.495 2724 Y N 1.303 121.599 120.300 -0.008 0.000 2.293 2724 Y HA -0.132 4.418 4.550 -0.000 0.000 0.291 2724 Y C 2.334 178.213 175.900 -0.036 0.000 1.137 2724 Y CA 0.920 58.964 58.100 -0.094 0.000 1.202 2724 Y CB -0.557 37.854 38.460 -0.082 0.000 0.990 2724 Y HN 0.206 nan 8.280 nan 0.000 0.537 2725 L N -0.576 120.643 121.223 -0.007 0.000 2.042 2725 L HA -0.255 4.085 4.340 0.000 0.000 0.210 2725 L C 2.713 179.543 176.870 -0.066 0.000 1.076 2725 L CA 1.340 56.120 54.840 -0.100 0.000 0.749 2725 L CB -0.882 41.149 42.059 -0.047 0.000 0.893 2725 L HN 0.234 nan 8.230 nan 0.000 0.432 2726 A N -0.161 122.670 122.820 0.017 0.000 1.933 2726 A HA -0.212 4.108 4.320 0.000 0.000 0.218 2726 A C 2.290 179.893 177.584 0.031 0.000 1.175 2726 A CA 1.581 53.640 52.037 0.036 0.000 0.628 2726 A CB -0.317 18.739 19.000 0.094 0.000 0.814 2726 A HN 0.331 nan 8.150 nan 0.000 0.444 2727 K N -0.405 120.024 120.400 0.048 0.000 2.211 2727 K HA -0.067 4.253 4.320 0.000 0.000 0.203 2727 K C 1.136 177.721 176.600 -0.024 0.000 1.050 2727 K CA 1.109 57.424 56.287 0.046 0.000 0.945 2727 K CB 0.025 32.605 32.500 0.133 0.000 0.732 2727 K HN 0.391 nan 8.250 nan 0.000 0.451 2728 E N -0.399 119.727 120.200 -0.122 0.000 2.479 2728 E HA 0.027 4.377 4.350 0.000 0.000 0.193 2728 E C 0.808 177.350 176.600 -0.097 0.000 1.049 2728 E CA 0.379 56.685 56.400 -0.158 0.000 0.870 2728 E CB 0.745 30.262 29.700 -0.305 0.000 0.944 2728 E HN 0.447 nan 8.360 nan 0.000 0.492 2729 G N 2.043 110.804 108.800 -0.066 0.000 2.160 2729 G HA2 -0.288 3.672 3.960 0.000 0.000 0.251 2729 G HA3 -0.288 3.672 3.960 0.000 0.000 0.251 2729 G C 0.235 175.100 174.900 -0.058 0.000 1.008 2729 G CA 0.179 45.252 45.100 -0.046 0.000 0.724 2729 G HN 0.265 nan 8.290 nan 0.000 0.514 2730 I N 0.936 121.459 120.570 -0.078 0.000 2.331 2730 I HA 0.438 4.608 4.170 0.000 0.000 0.292 2730 I C 0.984 177.050 176.117 -0.083 0.000 0.998 2730 I CA -1.155 60.093 61.300 -0.087 0.000 1.267 2730 I CB 1.634 39.569 38.000 -0.108 0.000 1.386 2730 I HN 0.144 nan 8.210 nan 0.000 0.476 2731 V N 3.749 123.605 119.914 -0.096 0.000 2.509 2731 V HA 0.914 5.034 4.120 0.000 0.000 0.284 2731 V C 0.050 176.035 176.094 -0.181 0.000 1.047 2731 V CA -0.259 61.972 62.300 -0.115 0.000 0.952 2731 V CB 1.160 32.918 31.823 -0.108 0.000 0.988 2731 V HN 0.829 nan 8.190 nan 0.000 0.469 2732 A N 3.607 126.326 122.820 -0.169 0.000 2.515 2732 A HA 1.007 5.327 4.320 0.000 0.000 0.298 2732 A C -0.350 177.131 177.584 -0.172 0.000 1.059 2732 A CA -0.298 51.620 52.037 -0.197 0.000 0.698 2732 A CB 1.858 20.790 19.000 -0.113 0.000 1.289 2732 A HN 2.349 nan 8.150 nan 0.000 0.404 2733 A N 1.758 124.461 122.820 -0.195 0.000 2.374 2733 A HA 0.772 5.092 4.320 0.000 0.000 0.305 2733 A C -0.081 177.505 177.584 0.003 0.000 1.053 2733 A CA -0.674 51.321 52.037 -0.071 0.000 0.726 2733 A CB 0.931 19.915 19.000 -0.027 0.000 1.229 2733 A HN 1.237 nan 8.150 nan 0.000 0.431 2734 R N 1.663 122.175 120.500 0.020 0.000 2.607 2734 R HA 0.734 5.074 4.340 0.000 0.000 0.261 2734 R C -0.401 175.927 176.300 0.046 0.000 1.051 2734 R CA -0.787 55.333 56.100 0.033 0.000 1.110 2734 R CB 0.446 30.758 30.300 0.020 0.000 1.158 2734 R HN 0.523 nan 8.270 nan 0.000 0.543 2735 R N -0.893 119.631 120.500 0.040 0.000 3.525 2735 R HA -0.109 4.231 4.340 0.000 0.000 0.276 2735 R C -0.746 175.579 176.300 0.041 0.000 1.116 2735 R CA 0.537 56.657 56.100 0.033 0.000 0.745 2735 R CB -2.606 27.708 30.300 0.024 0.000 1.185 2735 R HN 0.534 nan 8.270 nan 0.000 0.454 2736 V N 1.490 121.441 119.914 0.061 0.000 2.572 2736 V HA 0.049 4.169 4.120 0.000 0.000 0.291 2736 V C 1.473 177.581 176.094 0.023 0.000 1.039 2736 V CA -0.175 62.163 62.300 0.065 0.000 1.055 2736 V CB 1.239 33.136 31.823 0.123 0.000 0.969 2736 V HN 0.147 nan 8.190 nan 0.000 0.482 2737 K N 3.484 123.883 120.400 -0.001 0.000 2.484 2737 K HA -0.045 4.275 4.320 0.000 0.000 0.280 2737 K C 1.203 177.791 176.600 -0.021 0.000 1.013 2737 K CA -0.137 56.142 56.287 -0.014 0.000 1.029 2737 K CB 0.423 32.907 32.500 -0.027 0.000 0.902 2737 K HN 0.607 nan 8.250 nan 0.000 0.481 2738 K N 2.349 122.741 120.400 -0.014 0.000 2.103 2738 K HA -0.168 4.152 4.320 0.000 0.000 0.207 2738 K C 1.889 178.473 176.600 -0.026 0.000 1.048 2738 K CA 2.047 58.325 56.287 -0.014 0.000 0.930 2738 K CB -0.407 32.088 32.500 -0.008 0.000 0.716 2738 K HN 0.577 nan 8.250 nan 0.000 0.444 2739 S N 0.247 115.929 115.700 -0.030 0.000 2.368 2739 S HA -0.144 4.326 4.470 0.000 0.000 0.225 2739 S C 1.339 175.904 174.600 -0.058 0.000 1.030 2739 S CA 1.656 59.833 58.200 -0.038 0.000 0.999 2739 S CB -0.466 62.713 63.200 -0.035 0.000 0.844 2739 S HN 0.395 nan 8.310 nan 0.000 0.459 2740 D N 0.848 121.205 120.400 -0.072 0.000 2.218 2740 D HA -0.037 4.603 4.640 0.000 0.000 0.204 2740 D C 1.947 178.158 176.300 -0.148 0.000 0.976 2740 D CA 0.797 54.727 54.000 -0.116 0.000 0.853 2740 D CB -0.207 40.518 40.800 -0.125 0.000 0.939 2740 D HN 0.390 nan 8.370 nan 0.000 0.481 2741 M N 0.345 119.884 119.600 -0.101 0.000 2.117 2741 M HA -0.105 4.375 4.480 0.000 0.000 0.262 2741 M C 2.023 178.278 176.300 -0.075 0.000 1.065 2741 M CA 1.013 56.261 55.300 -0.087 0.000 1.114 2741 M CB -0.776 31.805 32.600 -0.032 0.000 1.361 2741 M HN 0.047 nan 8.290 nan 0.000 0.408 2742 E N 0.994 121.158 120.200 -0.059 0.000 2.150 2742 E HA -0.154 4.196 4.350 0.000 0.000 0.193 2742 E C 1.775 178.341 176.600 -0.057 0.000 0.985 2742 E CA 1.040 57.412 56.400 -0.046 0.000 0.814 2742 E CB 0.085 29.764 29.700 -0.034 0.000 0.752 2742 E HN 0.488 nan 8.360 nan 0.000 0.466 2743 K N 0.203 120.556 120.400 -0.077 0.000 2.057 2743 K HA -0.070 4.250 4.320 0.000 0.000 0.206 2743 K C 2.422 178.963 176.600 -0.098 0.000 1.050 2743 K CA 0.999 57.236 56.287 -0.083 0.000 0.935 2743 K CB -0.103 32.338 32.500 -0.099 0.000 0.715 2743 K HN 0.157 nan 8.250 nan 0.000 0.439 2744 L N 0.524 121.660 121.223 -0.144 0.000 2.093 2744 L HA -0.154 4.186 4.340 0.000 0.000 0.208 2744 L C 2.580 179.403 176.870 -0.079 0.000 1.085 2744 L CA 0.939 55.682 54.840 -0.161 0.000 0.755 2744 L CB -0.525 41.359 42.059 -0.292 0.000 0.904 2744 L HN 0.199 nan 8.230 nan 0.000 0.435 2745 A N -0.223 122.563 122.820 -0.057 0.000 1.898 2745 A HA -0.167 4.153 4.320 0.000 0.000 0.216 2745 A C 2.351 179.926 177.584 -0.015 0.000 1.181 2745 A CA 1.350 53.373 52.037 -0.024 0.000 0.620 2745 A CB -0.245 18.743 19.000 -0.019 0.000 0.819 2745 A HN 0.172 nan 8.150 nan 0.000 0.442 2746 K N -0.139 120.248 120.400 -0.022 0.000 2.057 2746 K HA -0.012 4.308 4.320 0.000 0.000 0.206 2746 K C 2.317 178.915 176.600 -0.003 0.000 1.050 2746 K CA 1.289 57.570 56.287 -0.011 0.000 0.935 2746 K CB -0.682 31.808 32.500 -0.016 0.000 0.715 2746 K HN 0.442 nan 8.250 nan 0.000 0.439 2747 A N 1.240 124.051 122.820 -0.016 0.000 1.832 2747 A HA -0.139 4.181 4.320 0.000 0.000 0.214 2747 A C 2.337 179.924 177.584 0.005 0.000 1.200 2747 A CA 2.619 54.651 52.037 -0.009 0.000 0.610 2747 A CB -1.074 17.907 19.000 -0.030 0.000 0.842 2747 A HN 0.475 nan 8.150 nan 0.000 0.444 2748 T N -4.201 110.353 114.554 -0.000 0.000 3.067 2748 T HA 0.364 4.714 4.350 0.000 0.000 0.261 2748 T C 1.419 176.134 174.700 0.025 0.000 1.110 2748 T CA 1.222 63.331 62.100 0.015 0.000 1.113 2748 T CB -0.130 68.752 68.868 0.023 0.000 0.917 2748 T HN 1.862 nan 8.240 nan 0.000 0.499 2749 G N 1.390 110.203 108.800 0.021 0.000 2.147 2749 G HA2 -0.004 3.956 3.960 0.000 0.000 0.244 2749 G HA3 -0.004 3.956 3.960 0.000 0.000 0.244 2749 G C 0.215 175.128 174.900 0.022 0.000 1.005 2749 G CA -0.036 45.078 45.100 0.024 0.000 0.713 2749 G HN 1.172 nan 8.290 nan 0.000 0.515 2750 A N -0.414 122.418 122.820 0.020 0.000 2.371 2750 A HA 0.643 4.963 4.320 0.000 0.000 0.257 2750 A C 0.384 177.979 177.584 0.019 0.000 1.089 2750 A CA 0.278 52.331 52.037 0.026 0.000 0.794 2750 A CB 0.522 19.545 19.000 0.038 0.000 1.029 2750 A HN 0.755 nan 8.150 nan 0.000 0.488 2751 N N 1.277 119.989 118.700 0.022 0.000 2.424 2751 N HA 0.369 5.109 4.740 0.000 0.000 0.271 2751 N C -0.917 174.605 175.510 0.020 0.000 0.985 2751 N CA -0.344 52.715 53.050 0.016 0.000 0.921 2751 N CB 1.275 39.770 38.487 0.015 0.000 1.149 2751 N HN 0.280 nan 8.380 nan 0.000 0.492 2752 V N 4.927 124.850 119.914 0.014 0.000 2.446 2752 V HA 0.147 4.267 4.120 0.000 0.000 0.276 2752 V C 0.481 176.584 176.094 0.016 0.000 1.030 2752 V CA -0.168 62.142 62.300 0.016 0.000 1.033 2752 V CB -0.837 30.991 31.823 0.009 0.000 0.993 2752 V HN 0.579 nan 8.190 nan 0.000 0.477 2753 I N 2.372 122.954 120.570 0.020 0.000 2.603 2753 I HA 0.633 4.803 4.170 0.000 0.000 0.300 2753 I C 0.663 176.790 176.117 0.016 0.000 1.017 2753 I CA 0.108 61.418 61.300 0.016 0.000 1.098 2753 I CB 1.964 39.974 38.000 0.017 0.000 1.279 2753 I HN 0.341 nan 8.210 nan 0.000 0.437 2754 T N 1.391 115.953 114.554 0.013 0.000 2.815 2754 T HA 0.091 4.441 4.350 0.000 0.000 0.244 2754 T C 0.727 175.435 174.700 0.013 0.000 1.040 2754 T CA 0.873 62.980 62.100 0.013 0.000 1.176 2754 T CB -0.260 68.614 68.868 0.010 0.000 0.880 2754 T HN 0.677 nan 8.240 nan 0.000 0.414 2755 N N 1.125 119.832 118.700 0.011 0.000 2.472 2755 N HA 0.240 4.980 4.740 0.000 0.000 0.277 2755 N C 0.873 176.390 175.510 0.012 0.000 1.081 2755 N CA -0.128 52.928 53.050 0.011 0.000 0.973 2755 N CB 0.673 39.166 38.487 0.010 0.000 1.105 2755 N HN 0.175 nan 8.380 nan 0.000 0.470 2756 I N 2.350 122.928 120.570 0.012 0.000 2.361 2756 I HA -0.248 3.922 4.170 0.000 0.000 0.251 2756 I C 2.019 178.142 176.117 0.010 0.000 1.133 2756 I CA 0.856 62.163 61.300 0.012 0.000 1.413 2756 I CB -0.041 37.967 38.000 0.013 0.000 1.073 2756 I HN 0.509 nan 8.210 nan 0.000 0.424 2757 K N 1.388 121.795 120.400 0.010 0.000 2.103 2757 K HA -0.221 4.099 4.320 0.000 0.000 0.207 2757 K C 1.331 177.936 176.600 0.008 0.000 1.048 2757 K CA 1.779 58.071 56.287 0.009 0.000 0.930 2757 K CB -0.230 32.275 32.500 0.009 0.000 0.716 2757 K HN 0.252 nan 8.250 nan 0.000 0.444 2758 D N -0.509 119.896 120.400 0.009 0.000 2.277 2758 D HA -0.029 4.611 4.640 0.000 0.000 0.208 2758 D C -0.171 176.135 176.300 0.009 0.000 0.962 2758 D CA 0.172 54.177 54.000 0.008 0.000 0.865 2758 D CB -0.012 40.793 40.800 0.009 0.000 0.939 2758 D HN 0.089 nan 8.370 nan 0.000 0.510 2759 L N 1.172 122.401 121.223 0.009 0.000 2.601 2759 L HA 0.103 4.443 4.340 0.000 0.000 0.277 2759 L C 0.160 177.034 176.870 0.007 0.000 1.219 2759 L CA 0.311 55.157 54.840 0.009 0.000 0.915 2759 L CB 0.046 42.110 42.059 0.009 0.000 1.160 2759 L HN -0.007 nan 8.230 nan 0.000 0.494 2760 S N 3.292 118.997 115.700 0.008 0.000 2.661 2760 S HA 0.788 5.258 4.470 0.000 0.000 0.285 2760 S C 0.775 175.379 174.600 0.007 0.000 1.138 2760 S CA -0.393 57.810 58.200 0.006 0.000 0.855 2760 S CB 1.269 64.473 63.200 0.006 0.000 1.136 2760 S HN 0.842 nan 8.310 nan 0.000 0.484 2761 A N 0.560 123.383 122.820 0.005 0.000 1.978 2761 A HA -0.083 4.237 4.320 0.000 0.000 0.220 2761 A C 1.992 179.581 177.584 0.009 0.000 1.170 2761 A CA 1.353 53.394 52.037 0.006 0.000 0.636 2761 A CB -0.869 18.134 19.000 0.004 0.000 0.810 2761 A HN 0.735 nan 8.150 nan 0.000 0.448 2762 Q N 0.058 119.864 119.800 0.009 0.000 2.437 2762 Q HA -0.101 4.239 4.340 0.000 0.000 0.210 2762 Q C 0.575 176.583 176.000 0.013 0.000 0.972 2762 Q CA 1.065 56.875 55.803 0.011 0.000 0.903 2762 Q CB -0.216 28.528 28.738 0.009 0.000 0.967 2762 Q HN 0.671 nan 8.270 nan 0.000 0.486 2763 D N -0.406 120.002 120.400 0.014 0.000 2.354 2763 D HA 0.021 4.661 4.640 0.000 0.000 0.209 2763 D C 0.070 176.383 176.300 0.022 0.000 1.015 2763 D CA 0.013 54.023 54.000 0.017 0.000 0.867 2763 D CB 0.464 41.274 40.800 0.016 0.000 0.933 2763 D HN 0.104 nan 8.370 nan 0.000 0.520 2764 L N 0.924 122.160 121.223 0.022 0.000 2.397 2764 L HA 0.370 4.710 4.340 0.000 0.000 0.271 2764 L C 1.218 178.105 176.870 0.030 0.000 1.148 2764 L CA -0.103 54.754 54.840 0.028 0.000 0.825 2764 L CB 1.161 43.233 42.059 0.022 0.000 1.117 2764 L HN -0.176 nan 8.230 nan 0.000 0.456 2765 G N 1.067 109.890 108.800 0.038 0.000 2.491 2765 G HA2 0.555 4.515 3.960 0.000 0.000 0.327 2765 G HA3 0.555 4.515 3.960 0.000 0.000 0.327 2765 G C -1.329 173.594 174.900 0.038 0.000 1.189 2765 G CA -0.414 44.708 45.100 0.037 0.000 0.956 2765 G HN 0.570 nan 8.290 nan 0.000 0.491 2766 D N -0.686 119.734 120.400 0.033 0.000 2.350 2766 D HA 0.651 5.291 4.640 0.000 0.000 0.245 2766 D C -0.200 176.115 176.300 0.026 0.000 1.036 2766 D CA 0.141 54.157 54.000 0.027 0.000 0.848 2766 D CB 2.007 42.818 40.800 0.018 0.000 1.307 2766 D HN 0.610 nan 8.370 nan 0.000 0.469 2767 A N 0.648 123.486 122.820 0.030 0.000 2.488 2767 A HA 0.624 4.944 4.320 0.000 0.000 0.298 2767 A C 1.000 178.599 177.584 0.026 0.000 1.044 2767 A CA -0.498 51.557 52.037 0.031 0.000 0.693 2767 A CB 1.509 20.542 19.000 0.055 0.000 1.272 2767 A HN 0.585 nan 8.150 nan 0.000 0.402 2768 G N 0.624 109.433 108.800 0.015 0.000 2.408 2768 G HA2 0.245 4.205 3.960 0.000 0.000 0.217 2768 G HA3 0.245 4.205 3.960 0.000 0.000 0.217 2768 G C 0.393 175.304 174.900 0.020 0.000 1.150 2768 G CA 0.888 45.994 45.100 0.010 0.000 0.776 2768 G HN 0.612 nan 8.290 nan 0.000 0.542 2769 L N 0.262 121.505 121.223 0.033 0.000 2.436 2769 L HA 0.523 4.863 4.340 0.000 0.000 0.268 2769 L C -1.383 175.533 176.870 0.077 0.000 0.974 2769 L CA -0.806 54.060 54.840 0.043 0.000 0.826 2769 L CB 3.083 45.161 42.059 0.032 0.000 1.291 2769 L HN -0.222 nan 8.230 nan 0.000 0.406 2770 V N 2.467 122.429 119.914 0.080 0.000 2.409 2770 V HA 0.493 4.613 4.120 0.000 0.000 0.290 2770 V C -0.579 175.574 176.094 0.098 0.000 1.017 2770 V CA -0.442 61.929 62.300 0.118 0.000 0.841 2770 V CB 1.833 33.728 31.823 0.119 0.000 1.003 2770 V HN 0.783 nan 8.190 nan 0.000 0.426 2771 E N 3.037 123.320 120.200 0.138 0.000 2.343 2771 E HA 0.394 4.744 4.350 0.000 0.000 0.278 2771 E C -1.157 175.544 176.600 0.168 0.000 0.910 2771 E CA -0.659 55.806 56.400 0.108 0.000 0.757 2771 E CB 2.351 32.085 29.700 0.057 0.000 1.218 2771 E HN 0.747 nan 8.360 nan 0.000 0.435 2772 E N 4.133 124.401 120.200 0.113 0.000 2.152 2772 E HA 0.252 4.602 4.350 0.000 0.000 0.285 2772 E C -0.942 175.725 176.600 0.112 0.000 1.043 2772 E CA -0.256 56.220 56.400 0.127 0.000 0.839 2772 E CB 0.673 30.416 29.700 0.072 0.000 1.069 2772 E HN 0.322 nan 8.360 nan 0.000 0.399 2773 R N 3.669 124.276 120.500 0.178 0.000 2.686 2773 R HA 0.386 4.726 4.340 0.000 0.000 0.286 2773 R C -0.739 175.647 176.300 0.144 0.000 0.969 2773 R CA -0.911 55.252 56.100 0.105 0.000 0.898 2773 R CB 2.008 32.289 30.300 -0.032 0.000 1.183 2773 R HN 0.319 nan 8.270 nan 0.000 0.456 2774 K N 2.418 122.863 120.400 0.076 0.000 2.211 2774 K HA 0.380 4.700 4.320 0.000 0.000 0.275 2774 K C -0.672 175.970 176.600 0.071 0.000 1.024 2774 K CA -0.468 55.863 56.287 0.073 0.000 0.887 2774 K CB 1.097 33.623 32.500 0.043 0.000 1.084 2774 K HN 0.295 nan 8.250 nan 0.000 0.463 2775 I N 2.043 122.667 120.570 0.090 0.000 2.390 2775 I HA 0.069 4.239 4.170 0.000 0.000 0.283 2775 I C -0.029 176.120 176.117 0.054 0.000 1.016 2775 I CA -0.062 61.285 61.300 0.078 0.000 1.151 2775 I CB 1.659 39.731 38.000 0.120 0.000 1.293 2775 I HN 0.593 nan 8.210 nan 0.000 0.458 2776 S N 4.344 120.067 115.700 0.039 0.000 3.698 2776 S HA -0.178 4.292 4.470 0.000 0.000 0.338 2776 S C 1.312 175.929 174.600 0.028 0.000 1.089 2776 S CA 0.975 59.193 58.200 0.030 0.000 0.991 2776 S CB -1.412 61.806 63.200 0.029 0.000 0.909 2776 S HN 1.454 nan 8.310 nan 0.000 0.485 2777 G N 0.641 109.459 108.800 0.029 0.000 2.579 2777 G HA2 -0.287 3.673 3.960 0.000 0.000 0.222 2777 G HA3 -0.287 3.673 3.960 0.000 0.000 0.222 2777 G C -0.351 174.568 174.900 0.032 0.000 1.201 2777 G CA 0.107 45.223 45.100 0.026 0.000 0.710 2777 G HN 0.614 nan 8.290 nan 0.000 0.516 2778 D N 2.483 122.904 120.400 0.034 0.000 2.401 2778 D HA 0.435 5.075 4.640 0.000 0.000 0.254 2778 D C 1.041 177.373 176.300 0.054 0.000 1.192 2778 D CA 0.990 55.011 54.000 0.036 0.000 0.885 2778 D CB 1.235 42.053 40.800 0.030 0.000 1.147 2778 D HN 0.687 nan 8.370 nan 0.000 0.478 2779 S N 2.596 118.327 115.700 0.052 0.000 2.565 2779 S HA 0.585 5.055 4.470 0.000 0.000 0.274 2779 S C 0.103 174.748 174.600 0.074 0.000 1.309 2779 S CA -0.667 57.577 58.200 0.072 0.000 1.043 2779 S CB 1.292 64.527 63.200 0.057 0.000 0.939 2779 S HN 0.397 nan 8.310 nan 0.000 0.504 2780 M N 2.058 121.728 119.600 0.117 0.000 2.593 2780 M HA 0.509 4.989 4.480 0.000 0.000 0.290 2780 M C -1.237 175.137 176.300 0.124 0.000 1.244 2780 M CA -0.594 54.745 55.300 0.064 0.000 0.857 2780 M CB 2.239 34.822 32.600 -0.028 0.000 1.738 2780 M HN 0.566 nan 8.290 nan 0.000 0.461 2781 I N 1.659 122.248 120.570 0.032 0.000 2.339 2781 I HA 0.373 4.543 4.170 0.000 0.000 0.290 2781 I C -1.364 174.750 176.117 -0.005 0.000 0.994 2781 I CA -0.370 61.010 61.300 0.133 0.000 1.191 2781 I CB 0.921 39.048 38.000 0.210 0.000 1.343 2781 I HN 0.425 nan 8.210 nan 0.000 0.458 2782 F N 5.911 125.906 119.950 0.075 0.000 2.405 2782 F HA 0.365 4.893 4.527 0.000 0.000 0.355 2782 F C 0.193 176.035 175.800 0.071 0.000 1.121 2782 F CA -0.736 57.296 58.000 0.053 0.000 1.112 2782 F CB 1.378 40.397 39.000 0.032 0.000 1.126 2782 F HN 0.031 nan 8.300 nan 0.000 0.481 2783 V N 4.353 124.369 119.914 0.170 0.000 2.275 2783 V HA 0.316 4.436 4.120 0.000 0.000 0.272 2783 V C -0.304 175.850 176.094 0.099 0.000 1.028 2783 V CA -0.579 61.800 62.300 0.131 0.000 0.810 2783 V CB 0.255 32.120 31.823 0.070 0.000 1.043 2783 V HN 0.806 nan 8.190 nan 0.000 0.453 2784 E N 3.000 123.266 120.200 0.110 0.000 2.378 2784 E HA 0.679 5.029 4.350 0.000 0.000 0.265 2784 E C -0.619 176.009 176.600 0.046 0.000 0.932 2784 E CA -0.889 55.560 56.400 0.082 0.000 0.795 2784 E CB 1.700 31.464 29.700 0.106 0.000 1.296 2784 E HN 0.207 nan 8.360 nan 0.000 0.438 2785 E N -0.841 119.374 120.200 0.025 0.000 2.596 2785 E HA -0.147 4.203 4.350 0.000 0.000 0.272 2785 E C -0.663 175.929 176.600 -0.014 0.000 1.039 2785 E CA 0.513 56.914 56.400 0.001 0.000 0.804 2785 E CB -2.239 27.462 29.700 0.002 0.000 1.373 2785 E HN 0.597 nan 8.360 nan 0.000 0.404 2786 C N 0.711 120.004 119.300 -0.012 0.000 2.689 2786 C HA 0.068 4.528 4.460 0.000 0.000 0.409 2786 C C 2.296 177.239 174.990 -0.079 0.000 1.293 2786 C CA -0.078 58.926 59.018 -0.024 0.000 2.136 2786 C CB 0.444 28.179 27.740 -0.007 0.000 2.719 2786 C HN 0.384 nan 8.230 nan 0.000 0.644 2787 K N 0.618 120.953 120.400 -0.107 0.000 1.969 2787 K HA -0.090 4.230 4.320 0.000 0.000 0.216 2787 K C 0.416 176.715 176.600 -0.502 0.000 1.048 2787 K CA 1.378 57.498 56.287 -0.279 0.000 0.948 2787 K CB -0.087 32.303 32.500 -0.183 0.000 0.726 2787 K HN 0.686 nan 8.250 nan 0.000 0.442 2788 H N 0.195 119.268 119.070 0.006 0.000 2.488 2788 H HA 0.240 4.796 4.556 -0.000 0.000 0.237 2788 H C -2.535 172.794 175.328 0.001 0.000 1.395 2788 H CA -1.998 54.052 56.048 0.003 0.000 1.491 2788 H CB 0.749 30.513 29.762 0.002 0.000 1.567 2788 H HN 0.192 nan 8.280 nan 0.000 0.508 2789 P HA 0.132 nan 4.420 nan 0.000 0.275 2789 P C 0.266 177.591 177.300 0.040 0.000 1.227 2789 P CA -0.511 62.612 63.100 0.038 0.000 0.781 2789 P CB 1.807 33.515 31.700 0.014 0.000 0.906 2790 K N 0.668 121.083 120.400 0.024 0.000 2.374 2790 K HA 0.449 4.769 4.320 0.000 0.000 0.202 2790 K C 0.285 176.886 176.600 0.002 0.000 1.040 2790 K CA 0.039 56.335 56.287 0.015 0.000 1.085 2790 K CB 0.696 33.203 32.500 0.011 0.000 0.873 2790 K HN 0.534 nan 8.250 nan 0.000 0.539 2791 A N 0.522 123.340 122.820 -0.004 0.000 2.449 2791 A HA 0.686 5.006 4.320 0.000 0.000 0.302 2791 A C -0.901 176.674 177.584 -0.014 0.000 1.048 2791 A CA -0.771 51.257 52.037 -0.015 0.000 0.708 2791 A CB 1.253 20.235 19.000 -0.030 0.000 1.274 2791 A HN -0.004 nan 8.150 nan 0.000 0.410 2792 V N -1.153 118.752 119.914 -0.014 0.000 3.074 2792 V HA 0.978 5.098 4.120 0.000 0.000 0.314 2792 V C -0.427 175.655 176.094 -0.020 0.000 1.117 2792 V CA -0.585 61.709 62.300 -0.010 0.000 1.014 2792 V CB 1.659 33.483 31.823 0.002 0.000 1.057 2792 V HN 0.880 nan 8.190 nan 0.000 0.438 2793 T N 3.304 117.848 114.554 -0.016 0.000 2.886 2793 T HA 0.633 4.983 4.350 0.000 0.000 0.292 2793 T C -0.558 174.140 174.700 -0.003 0.000 1.012 2793 T CA -0.352 61.731 62.100 -0.028 0.000 0.982 2793 T CB 1.492 70.319 68.868 -0.068 0.000 1.018 2793 T HN 0.748 nan 8.240 nan 0.000 0.451 2794 M N 3.403 123.000 119.600 -0.005 0.000 2.072 2794 M HA 0.382 4.862 4.480 0.000 0.000 0.331 2794 M C -0.954 175.352 176.300 0.011 0.000 1.004 2794 M CA -0.905 54.403 55.300 0.013 0.000 0.952 2794 M CB 1.324 33.930 32.600 0.010 0.000 1.511 2794 M HN 0.343 nan 8.290 nan 0.000 0.422 2795 L N 5.787 127.032 121.223 0.036 0.000 2.315 2795 L HA 0.465 4.805 4.340 0.000 0.000 0.283 2795 L C -0.795 176.100 176.870 0.042 0.000 1.089 2795 L CA 0.250 55.115 54.840 0.042 0.000 0.833 2795 L CB 0.248 42.370 42.059 0.105 0.000 1.170 2795 L HN 0.557 nan 8.230 nan 0.000 0.442 2796 I N 6.030 126.616 120.570 0.026 0.000 2.331 2796 I HA 0.391 4.561 4.170 0.000 0.000 0.292 2796 I C 0.336 176.469 176.117 0.027 0.000 0.998 2796 I CA -0.420 60.894 61.300 0.023 0.000 1.267 2796 I CB 0.733 38.740 38.000 0.013 0.000 1.386 2796 I HN 0.611 nan 8.210 nan 0.000 0.476 2797 R N 3.701 124.218 120.500 0.029 0.000 2.828 2797 R HA 0.896 5.236 4.340 0.000 0.000 0.264 2797 R C -0.350 175.965 176.300 0.024 0.000 1.022 2797 R CA -0.968 55.149 56.100 0.028 0.000 1.021 2797 R CB 2.206 32.524 30.300 0.031 0.000 1.163 2797 R HN 0.843 nan 8.270 nan 0.000 0.494 2798 G N -0.773 108.042 108.800 0.024 0.000 2.340 2798 G HA2 0.032 3.992 3.960 0.000 0.000 0.298 2798 G HA3 0.032 3.992 3.960 0.000 0.000 0.298 2798 G C 0.034 174.950 174.900 0.027 0.000 1.498 2798 G CA -0.677 44.438 45.100 0.025 0.000 0.847 2798 G HN 0.398 nan 8.290 nan 0.000 0.594 2799 T N 0.341 114.912 114.554 0.028 0.000 2.881 2799 T HA 0.158 4.508 4.350 0.000 0.000 0.270 2799 T C 0.919 175.640 174.700 0.035 0.000 1.068 2799 T CA 2.098 64.215 62.100 0.028 0.000 1.131 2799 T CB -0.179 68.704 68.868 0.025 0.000 0.871 2799 T HN 0.673 nan 8.240 nan 0.000 0.479 2800 T N 0.176 114.757 114.554 0.045 0.000 2.868 2800 T HA 0.230 4.580 4.350 0.000 0.000 0.306 2800 T C 0.359 175.099 174.700 0.067 0.000 1.224 2800 T CA -0.798 61.341 62.100 0.065 0.000 1.012 2800 T CB 2.435 71.352 68.868 0.082 0.000 1.221 2800 T HN -0.179 nan 8.240 nan 0.000 0.499 2801 E N 0.649 120.888 120.200 0.066 0.000 2.097 2801 E HA -0.180 4.170 4.350 0.000 0.000 0.196 2801 E C 1.566 178.140 176.600 -0.044 0.000 1.000 2801 E CA 1.822 58.220 56.400 -0.003 0.000 0.804 2801 E CB -0.107 29.569 29.700 -0.040 0.000 0.740 2801 E HN 0.605 nan 8.360 nan 0.000 0.454 2802 H N -0.494 118.580 119.070 0.007 0.000 2.457 2802 H HA -0.026 4.530 4.556 -0.000 0.000 0.294 2802 H C 2.120 177.452 175.328 0.007 0.000 1.064 2802 H CA 0.954 57.005 56.048 0.006 0.000 1.330 2802 H CB 0.113 29.878 29.762 0.005 0.000 1.395 2802 H HN -0.061 nan 8.280 nan 0.000 0.541 2803 V N 1.277 121.264 119.914 0.120 0.000 2.323 2803 V HA -0.194 3.926 4.120 0.000 0.000 0.244 2803 V C 2.320 178.439 176.094 0.041 0.000 1.041 2803 V CA 1.803 64.145 62.300 0.070 0.000 1.025 2803 V CB -0.471 31.385 31.823 0.055 0.000 0.656 2803 V HN 0.544 nan 8.190 nan 0.000 0.451 2804 I N -1.724 118.863 120.570 0.029 0.000 2.830 2804 I HA -0.100 4.070 4.170 0.000 0.000 0.263 2804 I C 2.109 178.226 176.117 0.000 0.000 1.230 2804 I CA 1.429 62.737 61.300 0.013 0.000 1.480 2804 I CB -0.578 37.427 38.000 0.008 0.000 1.095 2804 I HN 0.303 nan 8.210 nan 0.000 0.455 2805 E N 1.486 121.681 120.200 -0.009 0.000 2.072 2805 E HA -0.247 4.103 4.350 0.000 0.000 0.191 2805 E C 2.010 178.610 176.600 0.001 0.000 0.985 2805 E CA 1.471 57.858 56.400 -0.021 0.000 0.801 2805 E CB 0.009 29.676 29.700 -0.054 0.000 0.750 2805 E HN 0.559 nan 8.360 nan 0.000 0.452 2806 E N 0.605 120.817 120.200 0.019 0.000 2.106 2806 E HA -0.131 4.220 4.350 0.000 0.000 0.192 2806 E C 1.929 178.540 176.600 0.019 0.000 0.984 2806 E CA 0.807 57.221 56.400 0.023 0.000 0.806 2806 E CB 0.026 29.747 29.700 0.034 0.000 0.750 2806 E HN 0.003 nan 8.360 nan 0.000 0.458 2807 V N 0.950 120.875 119.914 0.019 0.000 2.343 2807 V HA -0.240 3.880 4.120 0.000 0.000 0.247 2807 V C 2.404 178.505 176.094 0.011 0.000 1.051 2807 V CA 1.744 64.054 62.300 0.017 0.000 1.036 2807 V CB -0.957 30.877 31.823 0.018 0.000 0.654 2807 V HN 0.474 nan 8.190 nan 0.000 0.451 2808 A N -0.126 122.698 122.820 0.006 0.000 1.940 2808 A HA -0.202 4.118 4.320 0.000 0.000 0.219 2808 A C 2.354 179.939 177.584 0.002 0.000 1.176 2808 A CA 1.500 53.537 52.037 0.000 0.000 0.631 2808 A CB -0.408 18.587 19.000 -0.008 0.000 0.814 2808 A HN 0.416 nan 8.150 nan 0.000 0.446 2809 R N -0.582 119.921 120.500 0.004 0.000 2.115 2809 R HA 0.048 4.388 4.340 0.000 0.000 0.226 2809 R C 2.388 178.694 176.300 0.009 0.000 1.100 2809 R CA 1.207 57.310 56.100 0.006 0.000 0.980 2809 R CB -0.939 29.365 30.300 0.007 0.000 0.875 2809 R HN 0.526 nan 8.270 nan 0.000 0.445 2810 A N 1.163 123.991 122.820 0.013 0.000 1.898 2810 A HA -0.116 4.204 4.320 0.000 0.000 0.216 2810 A C 2.270 179.862 177.584 0.015 0.000 1.181 2810 A CA 1.799 53.846 52.037 0.017 0.000 0.620 2810 A CB -0.521 18.491 19.000 0.021 0.000 0.819 2810 A HN 0.209 nan 8.150 nan 0.000 0.442 2811 V N -2.493 117.428 119.914 0.012 0.000 2.951 2811 V HA -0.050 4.070 4.120 0.000 0.000 0.255 2811 V C 1.834 177.932 176.094 0.007 0.000 1.088 2811 V CA 2.091 64.397 62.300 0.010 0.000 1.109 2811 V CB -0.544 31.285 31.823 0.008 0.000 0.724 2811 V HN 0.392 nan 8.190 nan 0.000 0.471 2812 D N 1.235 121.638 120.400 0.005 0.000 2.117 2812 D HA -0.164 4.476 4.640 0.000 0.000 0.198 2812 D C 1.764 178.067 176.300 0.005 0.000 0.982 2812 D CA 1.725 55.726 54.000 0.002 0.000 0.828 2812 D CB -0.132 40.668 40.800 0.001 0.000 0.967 2812 D HN 0.488 nan 8.370 nan 0.000 0.464 2813 D N -0.299 120.105 120.400 0.007 0.000 2.103 2813 D HA -0.018 4.622 4.640 0.000 0.000 0.199 2813 D C 1.954 178.261 176.300 0.010 0.000 0.978 2813 D CA 1.383 55.388 54.000 0.009 0.000 0.829 2813 D CB -0.471 40.336 40.800 0.011 0.000 0.981 2813 D HN 0.241 nan 8.370 nan 0.000 0.464 2814 A N 0.648 123.476 122.820 0.012 0.000 1.877 2814 A HA -0.128 4.192 4.320 0.000 0.000 0.216 2814 A C 2.380 179.970 177.584 0.010 0.000 1.186 2814 A CA 1.286 53.331 52.037 0.013 0.000 0.620 2814 A CB -0.904 18.105 19.000 0.015 0.000 0.822 2814 A HN 0.181 nan 8.150 nan 0.000 0.443 2815 V N -0.023 119.896 119.914 0.008 0.000 2.759 2815 V HA -0.081 4.039 4.120 0.000 0.000 0.256 2815 V C 2.299 178.396 176.094 0.006 0.000 1.080 2815 V CA 2.090 64.394 62.300 0.006 0.000 1.101 2815 V CB -0.677 31.149 31.823 0.004 0.000 0.698 2815 V HN 0.570 nan 8.190 nan 0.000 0.477 2816 G N -0.124 108.679 108.800 0.006 0.000 2.404 2816 G HA2 -0.176 3.784 3.960 0.000 0.000 0.214 2816 G HA3 -0.176 3.784 3.960 0.000 0.000 0.214 2816 G C 1.618 176.522 174.900 0.007 0.000 1.189 2816 G CA 1.328 46.431 45.100 0.006 0.000 0.789 2816 G HN 0.661 nan 8.290 nan 0.000 0.533 2817 V N -1.062 118.858 119.914 0.009 0.000 2.809 2817 V HA -0.007 4.113 4.120 0.000 0.000 0.256 2817 V C 2.630 178.730 176.094 0.010 0.000 1.080 2817 V CA 1.122 63.428 62.300 0.010 0.000 1.102 2817 V CB -0.427 31.404 31.823 0.012 0.000 0.705 2817 V HN 0.118 nan 8.190 nan 0.000 0.475 2818 V N 2.104 122.023 119.914 0.009 0.000 2.407 2818 V HA -0.081 4.039 4.120 0.000 0.000 0.248 2818 V C 2.850 178.948 176.094 0.007 0.000 1.055 2818 V CA 2.319 64.624 62.300 0.008 0.000 1.049 2818 V CB -1.326 30.502 31.823 0.008 0.000 0.662 2818 V HN 0.629 nan 8.190 nan 0.000 0.455 2819 G N -1.460 107.344 108.800 0.006 0.000 2.403 2819 G HA2 -0.224 3.736 3.960 0.000 0.000 0.216 2819 G HA3 -0.224 3.736 3.960 0.000 0.000 0.216 2819 G C 1.717 176.621 174.900 0.006 0.000 1.154 2819 G CA 1.143 46.247 45.100 0.005 0.000 0.784 2819 G HN 0.529 nan 8.290 nan 0.000 0.538 2820 C N 0.568 119.872 119.300 0.007 0.000 2.425 2820 C HA -0.015 4.445 4.460 0.000 0.000 0.277 2820 C C 3.192 178.187 174.990 0.007 0.000 1.280 2820 C CA 1.536 60.558 59.018 0.007 0.000 1.744 2820 C CB -0.917 26.828 27.740 0.008 0.000 1.989 2820 C HN 0.412 nan 8.230 nan 0.000 0.491 2821 T N 0.963 115.521 114.554 0.008 0.000 2.951 2821 T HA 0.024 4.374 4.350 0.000 0.000 0.268 2821 T C 1.552 176.256 174.700 0.006 0.000 1.073 2821 T CA 0.957 63.062 62.100 0.008 0.000 1.134 2821 T CB -0.195 68.678 68.868 0.008 0.000 0.884 2821 T HN 0.497 nan 8.240 nan 0.000 0.479 2822 I N 0.744 121.318 120.570 0.006 0.000 2.439 2822 I HA -0.078 4.092 4.170 0.000 0.000 0.251 2822 I C 2.466 178.586 176.117 0.004 0.000 1.139 2822 I CA 1.189 62.492 61.300 0.005 0.000 1.438 2822 I CB -0.201 37.802 38.000 0.005 0.000 1.085 2822 I HN 0.298 nan 8.210 nan 0.000 0.427 2823 E N 0.124 120.327 120.200 0.005 0.000 2.086 2823 E HA -0.047 4.303 4.350 0.000 0.000 0.190 2823 E C 0.004 176.607 176.600 0.004 0.000 0.975 2823 E CA 0.660 57.063 56.400 0.004 0.000 0.813 2823 E CB 0.281 29.984 29.700 0.004 0.000 0.768 2823 E HN 0.328 nan 8.360 nan 0.000 0.457 2824 D N -0.133 120.270 120.400 0.005 0.000 2.453 2824 D HA 0.147 4.787 4.640 0.000 0.000 0.238 2824 D C 0.022 176.325 176.300 0.006 0.000 1.088 2824 D CA -0.122 53.882 54.000 0.006 0.000 0.854 2824 D CB 1.603 42.407 40.800 0.007 0.000 1.076 2824 D HN 0.107 nan 8.370 nan 0.000 0.533 2825 G N 2.167 110.970 108.800 0.005 0.000 3.279 2825 G HA2 -0.030 3.930 3.960 0.000 0.000 0.230 2825 G HA3 -0.030 3.930 3.960 0.000 0.000 0.230 2825 G C 0.712 175.615 174.900 0.006 0.000 1.230 2825 G CA -0.038 45.065 45.100 0.005 0.000 0.891 2825 G HN 0.074 nan 8.290 nan 0.000 0.518 2826 R N -0.297 120.207 120.500 0.007 0.000 2.589 2826 R HA 0.741 5.081 4.340 0.000 0.000 0.293 2826 R C -0.854 175.452 176.300 0.010 0.000 0.963 2826 R CA -0.646 55.459 56.100 0.008 0.000 0.905 2826 R CB 1.872 32.177 30.300 0.007 0.000 1.144 2826 R HN 0.172 nan 8.270 nan 0.000 0.459 2827 I N 2.417 122.993 120.570 0.011 0.000 2.828 2827 I HA 0.642 4.812 4.170 0.000 0.000 0.302 2827 I C -1.097 175.029 176.117 0.016 0.000 1.101 2827 I CA -1.114 60.194 61.300 0.013 0.000 1.031 2827 I CB 2.015 40.022 38.000 0.013 0.000 1.231 2827 I HN 0.472 nan 8.210 nan 0.000 0.427 2828 V N 2.385 122.309 119.914 0.018 0.000 2.914 2828 V HA 0.669 4.789 4.120 0.000 0.000 0.314 2828 V C -0.106 176.004 176.094 0.025 0.000 1.084 2828 V CA -0.614 61.699 62.300 0.022 0.000 0.963 2828 V CB 1.382 33.219 31.823 0.023 0.000 1.025 2828 V HN 0.811 nan 8.190 nan 0.000 0.432 2829 S N 2.207 117.925 115.700 0.031 0.000 2.562 2829 S HA 0.634 5.104 4.470 0.000 0.000 0.281 2829 S C 0.525 175.145 174.600 0.033 0.000 1.333 2829 S CA 0.185 58.406 58.200 0.035 0.000 1.052 2829 S CB 0.781 64.007 63.200 0.043 0.000 0.884 2829 S HN 1.775 nan 8.310 nan 0.000 0.506 2830 G N 0.428 109.249 108.800 0.035 0.000 2.782 2830 G HA2 0.566 4.526 3.960 0.000 0.000 0.201 2830 G HA3 0.566 4.526 3.960 0.000 0.000 0.201 2830 G C 0.861 175.779 174.900 0.031 0.000 1.374 2830 G CA -0.559 44.560 45.100 0.031 0.000 1.039 2830 G HN 2.024 nan 8.290 nan 0.000 0.576 2831 G N -1.844 106.973 108.800 0.028 0.000 2.225 2831 G HA2 0.242 4.202 3.960 0.000 0.000 0.267 2831 G HA3 0.242 4.202 3.960 0.000 0.000 0.267 2831 G C 1.456 176.358 174.900 0.003 0.000 1.024 2831 G CA 1.218 46.330 45.100 0.019 0.000 0.784 2831 G HN 2.470 nan 8.290 nan 0.000 0.507 2832 G N -1.453 107.343 108.800 -0.005 0.000 2.162 2832 G HA2 -0.122 3.838 3.960 0.000 0.000 0.260 2832 G HA3 -0.122 3.838 3.960 0.000 0.000 0.260 2832 G C 1.485 176.372 174.900 -0.023 0.000 0.976 2832 G CA 1.680 46.768 45.100 -0.020 0.000 0.655 2832 G HN 1.972 nan 8.290 nan 0.000 0.533 2833 S N 0.050 115.749 115.700 -0.001 0.000 2.368 2833 S HA -0.164 4.306 4.470 0.000 0.000 0.225 2833 S C 2.807 177.394 174.600 -0.022 0.000 1.030 2833 S CA 2.754 60.960 58.200 0.010 0.000 0.999 2833 S CB -0.581 62.650 63.200 0.052 0.000 0.844 2833 S HN 1.376 nan 8.310 nan 0.000 0.459 2834 T N 0.127 114.675 114.554 -0.010 0.000 2.595 2834 T HA -0.102 4.248 4.350 0.000 0.000 0.264 2834 T C 1.572 176.240 174.700 -0.054 0.000 1.058 2834 T CA 1.638 63.729 62.100 -0.016 0.000 1.166 2834 T CB -1.082 67.787 68.868 0.001 0.000 0.863 2834 T HN 0.426 nan 8.240 nan 0.000 0.415 2835 E N 1.028 121.197 120.200 -0.050 0.000 2.187 2835 E HA -0.094 4.256 4.350 0.000 0.000 0.199 2835 E C 2.284 178.824 176.600 -0.100 0.000 1.004 2835 E CA 1.085 57.447 56.400 -0.065 0.000 0.813 2835 E CB -0.863 28.800 29.700 -0.063 0.000 0.736 2835 E HN 0.421 nan 8.360 nan 0.000 0.468 2836 V N 1.002 120.832 119.914 -0.140 0.000 2.307 2836 V HA -0.232 3.888 4.120 0.000 0.000 0.245 2836 V C 2.386 178.251 176.094 -0.382 0.000 1.045 2836 V CA 1.873 64.039 62.300 -0.224 0.000 1.024 2836 V CB -0.447 31.236 31.823 -0.232 0.000 0.651 2836 V HN 0.301 nan 8.190 nan 0.000 0.449 2837 E N 0.325 120.240 120.200 -0.474 0.000 2.118 2837 E HA -0.207 4.143 4.350 0.000 0.000 0.195 2837 E C 2.155 178.676 176.600 -0.131 0.000 0.992 2837 E CA 1.490 57.639 56.400 -0.418 0.000 0.804 2837 E CB -0.144 29.504 29.700 -0.087 0.000 0.741 2837 E HN 0.586 nan 8.360 nan 0.000 0.458 2838 L N 0.149 121.323 121.223 -0.081 0.000 2.027 2838 L HA -0.137 4.203 4.340 0.000 0.000 0.206 2838 L C 2.859 179.739 176.870 0.015 0.000 1.074 2838 L CA 1.297 56.136 54.840 -0.002 0.000 0.745 2838 L CB -0.578 41.498 42.059 0.029 0.000 0.898 2838 L HN 0.105 nan 8.230 nan 0.000 0.433 2839 S N -0.451 115.233 115.700 -0.027 0.000 2.368 2839 S HA -0.174 4.296 4.470 0.000 0.000 0.225 2839 S C 2.137 176.736 174.600 -0.001 0.000 1.030 2839 S CA 1.108 59.301 58.200 -0.011 0.000 0.999 2839 S CB -0.005 63.168 63.200 -0.043 0.000 0.844 2839 S HN 0.195 nan 8.310 nan 0.000 0.459 2840 M N 0.957 120.538 119.600 -0.031 0.000 2.086 2840 M HA -0.019 4.461 4.480 0.000 0.000 0.261 2840 M C 2.243 178.567 176.300 0.039 0.000 1.067 2840 M CA 1.650 56.953 55.300 0.005 0.000 1.116 2840 M CB -1.255 31.352 32.600 0.011 0.000 1.348 2840 M HN 0.266 nan 8.290 nan 0.000 0.407 2841 K N 0.669 121.092 120.400 0.038 0.000 2.062 2841 K HA 0.013 4.333 4.320 0.000 0.000 0.205 2841 K C 1.892 178.538 176.600 0.076 0.000 1.051 2841 K CA 0.994 57.307 56.287 0.045 0.000 0.941 2841 K CB -0.321 32.189 32.500 0.017 0.000 0.719 2841 K HN 0.263 nan 8.250 nan 0.000 0.440 2842 L N 0.250 121.528 121.223 0.092 0.000 2.275 2842 L HA -0.058 4.282 4.340 0.000 0.000 0.215 2842 L C 2.356 179.310 176.870 0.140 0.000 1.119 2842 L CA 0.873 55.812 54.840 0.165 0.000 0.790 2842 L CB -0.264 41.900 42.059 0.175 0.000 0.919 2842 L HN 0.153 nan 8.230 nan 0.000 0.443 2843 R N 0.016 120.569 120.500 0.088 0.000 2.081 2843 R HA -0.200 4.140 4.340 0.000 0.000 0.235 2843 R C 2.186 178.524 176.300 0.064 0.000 1.131 2843 R CA 1.511 57.646 56.100 0.058 0.000 0.960 2843 R CB -0.176 30.147 30.300 0.038 0.000 0.856 2843 R HN 0.376 nan 8.270 nan 0.000 0.436 2844 E N -0.250 120.000 120.200 0.082 0.000 2.152 2844 E HA -0.202 4.148 4.350 0.000 0.000 0.192 2844 E C 1.589 178.270 176.600 0.136 0.000 0.983 2844 E CA 0.698 57.149 56.400 0.085 0.000 0.818 2844 E CB -0.014 29.730 29.700 0.073 0.000 0.758 2844 E HN 0.253 nan 8.360 nan 0.000 0.467 2845 Y N 0.931 121.226 120.300 -0.007 0.000 2.181 2845 Y HA -0.137 4.413 4.550 0.000 0.000 0.288 2845 Y C 2.051 177.938 175.900 -0.022 0.000 1.146 2845 Y CA 1.267 59.356 58.100 -0.018 0.000 1.164 2845 Y CB -0.825 37.617 38.460 -0.030 0.000 0.982 2845 Y HN 0.130 nan 8.280 nan 0.000 0.515 2846 A N 0.155 122.957 122.820 -0.030 0.000 1.908 2846 A HA -0.180 4.140 4.320 0.000 0.000 0.218 2846 A C 2.145 179.682 177.584 -0.079 0.000 1.181 2846 A CA 1.894 53.864 52.037 -0.110 0.000 0.627 2846 A CB -0.524 18.449 19.000 -0.045 0.000 0.818 2846 A HN 0.478 nan 8.150 nan 0.000 0.445 2847 E N -0.569 119.619 120.200 -0.021 0.000 2.106 2847 E HA -0.105 4.245 4.350 0.000 0.000 0.192 2847 E C 2.175 178.767 176.600 -0.013 0.000 0.984 2847 E CA 1.103 57.498 56.400 -0.009 0.000 0.806 2847 E CB -0.638 29.070 29.700 0.013 0.000 0.750 2847 E HN 0.591 nan 8.360 nan 0.000 0.458 2848 G N 1.104 109.905 108.800 0.002 0.000 2.403 2848 G HA2 -0.163 3.797 3.960 0.000 0.000 0.216 2848 G HA3 -0.163 3.797 3.960 0.000 0.000 0.216 2848 G C 1.748 176.625 174.900 -0.039 0.000 1.154 2848 G CA 0.287 45.396 45.100 0.015 0.000 0.784 2848 G HN 0.152 nan 8.290 nan 0.000 0.538 2849 I N -0.171 120.319 120.570 -0.132 0.000 2.202 2849 I HA -0.013 4.157 4.170 0.000 0.000 0.242 2849 I C 1.740 177.796 176.117 -0.102 0.000 1.091 2849 I CA 0.762 61.956 61.300 -0.176 0.000 1.368 2849 I CB -0.281 37.518 38.000 -0.334 0.000 1.058 2849 I HN 0.313 nan 8.210 nan 0.000 0.410 2850 S N -1.115 114.534 115.700 -0.087 0.000 3.443 2850 S HA -0.141 4.329 4.470 0.000 0.000 0.635 2850 S C 0.561 175.132 174.600 -0.049 0.000 2.555 2850 S CA 0.870 59.039 58.200 -0.052 0.000 2.778 2850 S CB -1.385 61.795 63.200 -0.034 0.000 0.331 2850 S HN 1.356 nan 8.310 nan 0.000 1.765 2851 G N 0.781 109.563 108.800 -0.030 0.000 2.547 2851 G HA2 -0.319 3.641 3.960 0.000 0.000 0.271 2851 G HA3 -0.319 3.641 3.960 0.000 0.000 0.271 2851 G C 0.366 175.257 174.900 -0.016 0.000 1.209 2851 G CA 1.067 46.154 45.100 -0.022 0.000 0.959 2851 G HN 1.147 nan 8.290 nan 0.000 0.563 2852 R N 0.572 121.066 120.500 -0.010 0.000 2.127 2852 R HA 0.135 4.475 4.340 0.000 0.000 0.217 2852 R C 2.483 178.785 176.300 0.003 0.000 1.074 2852 R CA 1.508 57.611 56.100 0.005 0.000 0.991 2852 R CB -0.188 30.122 30.300 0.018 0.000 0.895 2852 R HN 0.603 nan 8.270 nan 0.000 0.450 2853 E N 1.265 121.455 120.200 -0.018 0.000 2.204 2853 E HA -0.236 4.114 4.350 0.000 0.000 0.195 2853 E C 1.984 178.550 176.600 -0.057 0.000 0.990 2853 E CA 1.415 57.794 56.400 -0.034 0.000 0.821 2853 E CB -0.092 29.564 29.700 -0.072 0.000 0.750 2853 E HN 0.469 nan 8.360 nan 0.000 0.477 2854 Q N 0.200 119.963 119.800 -0.062 0.000 2.170 2854 Q HA -0.168 4.172 4.340 0.000 0.000 0.203 2854 Q C 1.716 177.696 176.000 -0.033 0.000 0.976 2854 Q CA 1.042 56.804 55.803 -0.069 0.000 0.858 2854 Q CB -0.209 28.496 28.738 -0.054 0.000 0.907 2854 Q HN 0.205 nan 8.270 nan 0.000 0.433 2855 L N 1.075 122.295 121.223 -0.004 0.000 2.093 2855 L HA -0.015 4.325 4.340 0.000 0.000 0.208 2855 L C 2.533 179.432 176.870 0.048 0.000 1.085 2855 L CA 1.868 56.721 54.840 0.022 0.000 0.755 2855 L CB -0.980 41.099 42.059 0.034 0.000 0.904 2855 L HN 0.393 nan 8.230 nan 0.000 0.435 2856 A N -1.324 121.537 122.820 0.069 0.000 1.929 2856 A HA -0.093 4.227 4.320 0.000 0.000 0.216 2856 A C 2.321 179.857 177.584 -0.080 0.000 1.176 2856 A CA 1.548 53.677 52.037 0.153 0.000 0.628 2856 A CB -0.738 18.410 19.000 0.247 0.000 0.816 2856 A HN 0.192 nan 8.150 nan 0.000 0.444 2857 V N -0.001 119.854 119.914 -0.098 0.000 2.427 2857 V HA -0.190 3.930 4.120 0.000 0.000 0.248 2857 V C 2.635 178.699 176.094 -0.050 0.000 1.051 2857 V CA 2.195 64.411 62.300 -0.139 0.000 1.048 2857 V CB -0.781 30.941 31.823 -0.168 0.000 0.666 2857 V HN 0.599 nan 8.190 nan 0.000 0.456 2858 R N 1.205 121.687 120.500 -0.030 0.000 2.081 2858 R HA -0.061 4.279 4.340 0.000 0.000 0.235 2858 R C 2.154 178.452 176.300 -0.003 0.000 1.131 2858 R CA 1.850 57.949 56.100 -0.003 0.000 0.960 2858 R CB -0.920 29.381 30.300 0.002 0.000 0.856 2858 R HN 0.435 nan 8.270 nan 0.000 0.436 2859 A N -0.503 122.314 122.820 -0.005 0.000 1.930 2859 A HA -0.121 4.199 4.320 0.000 0.000 0.217 2859 A C 2.161 179.701 177.584 -0.074 0.000 1.175 2859 A CA 1.336 53.381 52.037 0.015 0.000 0.627 2859 A CB -0.821 18.268 19.000 0.149 0.000 0.815 2859 A HN 0.481 nan 8.150 nan 0.000 0.443 2860 F N 0.880 120.569 119.950 -0.435 0.000 2.075 2860 F HA -0.065 4.462 4.527 0.000 0.000 0.297 2860 F C 2.554 178.237 175.800 -0.194 0.000 1.113 2860 F CA 1.537 59.248 58.000 -0.481 0.000 1.218 2860 F CB -0.348 38.263 39.000 -0.649 0.000 0.984 2860 F HN 0.244 nan 8.300 nan 0.000 0.472 2861 A N -0.160 122.721 122.820 0.102 0.000 1.933 2861 A HA -0.188 4.132 4.320 0.000 0.000 0.218 2861 A C 1.892 179.449 177.584 -0.045 0.000 1.175 2861 A CA 2.006 54.082 52.037 0.064 0.000 0.628 2861 A CB -0.962 18.094 19.000 0.093 0.000 0.814 2861 A HN 0.463 nan 8.150 nan 0.000 0.444 2862 D N -0.051 120.322 120.400 -0.046 0.000 2.149 2862 D HA 0.022 4.662 4.640 0.000 0.000 0.201 2862 D C 2.187 178.440 176.300 -0.078 0.000 0.972 2862 D CA 1.347 55.318 54.000 -0.048 0.000 0.835 2862 D CB -0.367 40.418 40.800 -0.024 0.000 0.966 2862 D HN 0.415 nan 8.370 nan 0.000 0.476 2863 A N 0.476 123.225 122.820 -0.117 0.000 1.969 2863 A HA -0.117 4.203 4.320 0.000 0.000 0.218 2863 A C 2.019 179.497 177.584 -0.177 0.000 1.169 2863 A CA 0.763 52.718 52.037 -0.137 0.000 0.635 2863 A CB -0.529 18.378 19.000 -0.154 0.000 0.810 2863 A HN 0.140 nan 8.150 nan 0.000 0.445 2864 L N 0.273 121.351 121.223 -0.242 0.000 2.191 2864 L HA -0.139 4.201 4.340 0.000 0.000 0.212 2864 L C 1.998 178.794 176.870 -0.124 0.000 1.103 2864 L CA 1.659 56.371 54.840 -0.212 0.000 0.769 2864 L CB -0.754 41.176 42.059 -0.215 0.000 0.908 2864 L HN 0.479 nan 8.230 nan 0.000 0.438 2865 E N -1.383 118.757 120.200 -0.099 0.000 2.515 2865 E HA -0.130 4.220 4.350 0.000 0.000 0.201 2865 E C 2.188 178.750 176.600 -0.064 0.000 1.071 2865 E CA 0.260 56.617 56.400 -0.072 0.000 0.880 2865 E CB -0.064 29.602 29.700 -0.058 0.000 0.828 2865 E HN 0.294 nan 8.360 nan 0.000 0.540 2866 V N 1.044 120.915 119.914 -0.071 0.000 2.594 2866 V HA -0.238 3.882 4.120 0.000 0.000 0.253 2866 V C 1.716 177.779 176.094 -0.053 0.000 1.069 2866 V CA 1.238 63.503 62.300 -0.059 0.000 1.082 2866 V CB -0.172 31.613 31.823 -0.062 0.000 0.680 2866 V HN 0.275 nan 8.190 nan 0.000 0.469 2867 I N 0.352 120.888 120.570 -0.057 0.000 2.162 2867 I HA -0.017 4.153 4.170 0.000 0.000 0.238 2867 I C 0.244 176.334 176.117 -0.045 0.000 1.076 2867 I CA 1.411 62.682 61.300 -0.049 0.000 1.353 2867 I CB -2.837 35.135 38.000 -0.048 0.000 1.063 2867 I HN 0.304 nan 8.210 nan 0.000 0.408 2868 P HA -0.193 nan 4.420 nan 0.000 0.216 2868 P C 1.842 179.119 177.300 -0.038 0.000 1.157 2868 P CA 1.542 64.618 63.100 -0.040 0.000 0.880 2868 P CB -0.218 31.457 31.700 -0.042 0.000 0.791 2869 R N -0.011 120.465 120.500 -0.039 0.000 2.096 2869 R HA -0.140 4.200 4.340 0.000 0.000 0.240 2869 R C 1.921 178.200 176.300 -0.036 0.000 1.139 2869 R CA 2.767 58.846 56.100 -0.036 0.000 0.952 2869 R CB -1.485 28.793 30.300 -0.036 0.000 0.854 2869 R HN 0.283 nan 8.270 nan 0.000 0.436 2870 T N -1.582 112.949 114.554 -0.039 0.000 3.067 2870 T HA 0.020 4.370 4.350 0.000 0.000 0.257 2870 T C 2.006 176.678 174.700 -0.046 0.000 1.105 2870 T CA 0.097 62.173 62.100 -0.040 0.000 1.104 2870 T CB -0.042 68.802 68.868 -0.039 0.000 0.925 2870 T HN 0.025 nan 8.240 nan 0.000 0.498 2871 L N 1.677 122.871 121.223 -0.049 0.000 2.083 2871 L HA 0.229 4.569 4.340 0.000 0.000 0.209 2871 L C 2.927 179.757 176.870 -0.066 0.000 1.083 2871 L CA 1.629 56.432 54.840 -0.061 0.000 0.752 2871 L CB -1.201 40.825 42.059 -0.055 0.000 0.899 2871 L HN 0.455 nan 8.230 nan 0.000 0.433 2872 A N -1.537 121.253 122.820 -0.050 0.000 1.935 2872 A HA -0.117 4.203 4.320 0.000 0.000 0.214 2872 A C 2.230 179.789 177.584 -0.043 0.000 1.178 2872 A CA 1.009 53.018 52.037 -0.046 0.000 0.640 2872 A CB -0.366 18.614 19.000 -0.033 0.000 0.825 2872 A HN 0.342 nan 8.150 nan 0.000 0.447 2873 E N 1.614 121.791 120.200 -0.038 0.000 2.033 2873 E HA -0.258 4.092 4.350 0.000 0.000 0.199 2873 E C 1.682 178.260 176.600 -0.036 0.000 1.011 2873 E CA 2.053 58.433 56.400 -0.034 0.000 0.815 2873 E CB -0.253 29.428 29.700 -0.031 0.000 0.755 2873 E HN 0.768 nan 8.360 nan 0.000 0.451 2874 N N -0.125 118.550 118.700 -0.042 0.000 2.467 2874 N HA 0.014 4.754 4.740 0.000 0.000 0.184 2874 N C 1.076 176.554 175.510 -0.054 0.000 1.106 2874 N CA 1.055 54.078 53.050 -0.044 0.000 0.892 2874 N CB -0.196 38.265 38.487 -0.044 0.000 0.969 2874 N HN 0.189 nan 8.380 nan 0.000 0.454 2875 A N -0.223 122.558 122.820 -0.065 0.000 2.208 2875 A HA 0.480 4.800 4.320 0.000 0.000 0.209 2875 A C 1.626 179.177 177.584 -0.054 0.000 1.161 2875 A CA 0.467 52.457 52.037 -0.078 0.000 0.782 2875 A CB -0.769 18.169 19.000 -0.103 0.000 0.816 2875 A HN 0.615 nan 8.150 nan 0.000 0.477 2876 G N -1.627 107.150 108.800 -0.040 0.000 2.132 2876 G HA2 -0.147 3.813 3.960 0.000 0.000 0.234 2876 G HA3 -0.147 3.813 3.960 0.000 0.000 0.234 2876 G C -0.169 174.717 174.900 -0.023 0.000 0.989 2876 G CA 0.198 45.281 45.100 -0.028 0.000 0.676 2876 G HN 0.279 nan 8.290 nan 0.000 0.522 2877 L N 0.788 121.995 121.223 -0.027 0.000 2.344 2877 L HA 0.517 4.857 4.340 0.000 0.000 0.272 2877 L C 0.284 177.143 176.870 -0.019 0.000 1.035 2877 L CA -0.847 53.981 54.840 -0.021 0.000 0.807 2877 L CB 1.368 43.413 42.059 -0.023 0.000 1.237 2877 L HN 0.211 nan 8.230 nan 0.000 0.442 2878 D N 1.426 121.817 120.400 -0.014 0.000 2.346 2878 D HA 0.112 4.752 4.640 0.000 0.000 0.260 2878 D C 0.828 177.120 176.300 -0.015 0.000 1.252 2878 D CA 0.112 54.104 54.000 -0.013 0.000 0.895 2878 D CB 1.602 42.396 40.800 -0.009 0.000 1.097 2878 D HN 0.642 nan 8.370 nan 0.000 0.489 2879 A N 5.457 128.266 122.820 -0.017 0.000 1.908 2879 A HA -0.192 4.128 4.320 0.000 0.000 0.218 2879 A C 2.139 179.713 177.584 -0.016 0.000 1.181 2879 A CA 0.880 52.905 52.037 -0.019 0.000 0.627 2879 A CB -0.234 18.752 19.000 -0.022 0.000 0.818 2879 A HN 0.710 nan 8.150 nan 0.000 0.445 2880 I N -0.258 120.304 120.570 -0.013 0.000 2.163 2880 I HA -0.200 3.970 4.170 0.000 0.000 0.240 2880 I C 2.475 178.588 176.117 -0.007 0.000 1.081 2880 I CA 1.856 63.150 61.300 -0.010 0.000 1.353 2880 I CB -1.516 36.479 38.000 -0.009 0.000 1.054 2880 I HN 0.572 nan 8.210 nan 0.000 0.407 2881 E N 0.938 121.135 120.200 -0.006 0.000 2.077 2881 E HA -0.206 4.144 4.350 0.000 0.000 0.193 2881 E C 2.313 178.911 176.600 -0.002 0.000 0.989 2881 E CA 1.121 57.519 56.400 -0.003 0.000 0.800 2881 E CB 0.191 29.890 29.700 -0.003 0.000 0.746 2881 E HN 0.238 nan 8.360 nan 0.000 0.452 2882 I N 0.860 121.427 120.570 -0.005 0.000 2.202 2882 I HA -0.234 3.936 4.170 0.000 0.000 0.242 2882 I C 2.397 178.512 176.117 -0.003 0.000 1.091 2882 I CA 0.808 62.106 61.300 -0.003 0.000 1.368 2882 I CB -0.963 37.032 38.000 -0.008 0.000 1.058 2882 I HN 0.244 nan 8.210 nan 0.000 0.410 2883 L N 0.135 121.354 121.223 -0.008 0.000 2.131 2883 L HA -0.146 4.194 4.340 0.000 0.000 0.210 2883 L C 2.574 179.442 176.870 -0.003 0.000 1.092 2883 L CA 1.265 56.099 54.840 -0.010 0.000 0.759 2883 L CB -1.001 41.049 42.059 -0.016 0.000 0.903 2883 L HN -0.001 nan 8.230 nan 0.000 0.435 2884 V N -0.824 119.090 119.914 -0.000 0.000 2.358 2884 V HA -0.272 3.848 4.120 0.000 0.000 0.246 2884 V C 2.422 178.523 176.094 0.011 0.000 1.047 2884 V CA 1.563 63.866 62.300 0.004 0.000 1.035 2884 V CB -0.492 31.334 31.823 0.003 0.000 0.658 2884 V HN 0.427 nan 8.190 nan 0.000 0.452 2885 K N -0.407 119.999 120.400 0.010 0.000 2.097 2885 K HA -0.075 4.245 4.320 0.000 0.000 0.205 2885 K C 2.018 178.632 176.600 0.023 0.000 1.050 2885 K CA 1.114 57.410 56.287 0.015 0.000 0.938 2885 K CB -0.204 32.303 32.500 0.012 0.000 0.718 2885 K HN 0.324 nan 8.250 nan 0.000 0.442 2886 V N 1.155 121.082 119.914 0.022 0.000 2.346 2886 V HA -0.164 3.956 4.120 0.000 0.000 0.244 2886 V C 2.135 178.259 176.094 0.051 0.000 1.037 2886 V CA 1.453 63.773 62.300 0.033 0.000 1.029 2886 V CB -0.388 31.445 31.823 0.017 0.000 0.663 2886 V HN 0.230 nan 8.190 nan 0.000 0.454 2887 R N 0.379 120.897 120.500 0.030 0.000 2.096 2887 R HA -0.104 4.236 4.340 0.000 0.000 0.235 2887 R C 2.410 178.752 176.300 0.071 0.000 1.127 2887 R CA 1.475 57.596 56.100 0.035 0.000 0.968 2887 R CB -0.587 29.717 30.300 0.006 0.000 0.861 2887 R HN 0.530 nan 8.270 nan 0.000 0.440 2888 A N 1.258 124.109 122.820 0.050 0.000 1.898 2888 A HA -0.069 4.251 4.320 0.000 0.000 0.216 2888 A C 2.376 179.992 177.584 0.054 0.000 1.181 2888 A CA 1.537 53.602 52.037 0.047 0.000 0.620 2888 A CB -0.607 18.411 19.000 0.029 0.000 0.819 2888 A HN 0.382 nan 8.150 nan 0.000 0.442 2889 A N -1.184 121.670 122.820 0.057 0.000 1.933 2889 A HA -0.224 4.096 4.320 0.000 0.000 0.218 2889 A C 2.137 179.759 177.584 0.062 0.000 1.175 2889 A CA 1.776 53.843 52.037 0.050 0.000 0.628 2889 A CB -0.913 18.115 19.000 0.047 0.000 0.814 2889 A HN 0.766 nan 8.150 nan 0.000 0.444 2890 H N 0.011 119.084 119.070 0.004 0.000 2.299 2890 H HA -0.046 4.510 4.556 0.000 0.000 0.302 2890 H C 2.330 177.660 175.328 0.004 0.000 1.078 2890 H CA 1.768 57.819 56.048 0.004 0.000 1.323 2890 H CB -0.282 29.483 29.762 0.005 0.000 1.381 2890 H HN 0.390 nan 8.280 nan 0.000 0.498 2891 A N 0.014 122.901 122.820 0.112 0.000 1.940 2891 A HA -0.178 4.142 4.320 0.000 0.000 0.219 2891 A C 2.775 180.345 177.584 -0.023 0.000 1.176 2891 A CA 2.100 54.168 52.037 0.052 0.000 0.631 2891 A CB -0.825 18.225 19.000 0.083 0.000 0.814 2891 A HN 0.518 nan 8.150 nan 0.000 0.446 2892 S N -0.656 115.033 115.700 -0.017 0.000 2.341 2892 S HA -0.067 4.403 4.470 0.000 0.000 0.216 2892 S C 1.860 176.432 174.600 -0.047 0.000 1.034 2892 S CA 0.964 59.150 58.200 -0.023 0.000 0.964 2892 S CB -0.386 62.811 63.200 -0.006 0.000 0.882 2892 S HN 0.639 nan 8.310 nan 0.000 0.469 2893 N N 0.985 119.652 118.700 -0.055 0.000 2.416 2893 N HA 0.214 4.954 4.740 0.000 0.000 0.177 2893 N C 1.043 176.494 175.510 -0.098 0.000 1.036 2893 N CA 0.942 53.958 53.050 -0.058 0.000 0.901 2893 N CB 0.461 38.929 38.487 -0.033 0.000 0.976 2893 N HN 0.595 nan 8.380 nan 0.000 0.444 2894 G N 0.650 109.336 108.800 -0.189 0.000 2.352 2894 G HA2 -0.183 3.777 3.960 0.000 0.000 0.324 2894 G HA3 -0.183 3.777 3.960 0.000 0.000 0.324 2894 G C -0.113 174.548 174.900 -0.399 0.000 1.249 2894 G CA -0.191 44.754 45.100 -0.258 0.000 1.053 2894 G HN 0.242 nan 8.290 nan 0.000 0.492 2895 N N -0.274 118.280 118.700 -0.242 0.000 2.368 2895 N HA 0.096 4.836 4.740 0.000 0.000 0.176 2895 N C 1.616 177.143 175.510 0.030 0.000 1.021 2895 N CA 0.912 53.908 53.050 -0.090 0.000 0.888 2895 N CB 0.108 38.598 38.487 0.006 0.000 0.995 2895 N HN 0.281 nan 8.380 nan 0.000 0.437 2896 K N -0.208 120.189 120.400 -0.005 0.000 2.374 2896 K HA 0.271 4.592 4.320 0.000 0.000 0.196 2896 K C -0.646 175.963 176.600 0.015 0.000 1.023 2896 K CA 0.147 56.444 56.287 0.016 0.000 1.103 2896 K CB 0.545 33.048 32.500 0.005 0.000 0.848 2896 K HN 0.115 nan 8.250 nan 0.000 0.528 2897 C N 1.004 120.305 119.300 0.001 0.000 3.094 2897 C HA 0.816 5.277 4.460 0.000 0.000 0.262 2897 C C 0.351 175.357 174.990 0.027 0.000 1.459 2897 C CA -0.723 58.297 59.018 0.003 0.000 1.570 2897 C CB -1.226 26.499 27.740 -0.024 0.000 2.056 2897 C HN 0.467 nan 8.230 nan 0.000 0.499 2898 A N 0.476 123.335 122.820 0.064 0.000 5.650 2898 A HA 0.952 5.272 4.320 0.000 0.000 0.194 2898 A C 0.231 177.860 177.584 0.075 0.000 0.895 2898 A CA 0.396 52.487 52.037 0.091 0.000 0.804 2898 A CB -0.452 18.655 19.000 0.178 0.000 2.103 2898 A HN 2.020 nan 8.150 nan 0.000 1.022 2899 G N -1.920 106.922 108.800 0.071 0.000 2.888 2899 G HA2 0.251 4.211 3.960 0.000 0.000 0.441 2899 G HA3 0.251 4.211 3.960 0.000 0.000 0.441 2899 G C -0.831 174.089 174.900 0.033 0.000 1.461 2899 G CA -0.069 45.056 45.100 0.041 0.000 0.897 2899 G HN 1.441 nan 8.290 nan 0.000 0.547 2900 L N 0.508 121.743 121.223 0.020 0.000 2.292 2900 L HA 0.497 4.837 4.340 0.000 0.000 0.284 2900 L C 0.578 177.464 176.870 0.027 0.000 1.065 2900 L CA -0.454 54.394 54.840 0.013 0.000 0.806 2900 L CB 1.611 43.665 42.059 -0.010 0.000 1.175 2900 L HN 0.626 nan 8.230 nan 0.000 0.431 2901 N N 1.204 119.928 118.700 0.040 0.000 2.699 2901 N HA 0.211 4.951 4.740 0.000 0.000 0.232 2901 N C 0.843 176.378 175.510 0.042 0.000 1.027 2901 N CA -0.360 52.738 53.050 0.080 0.000 0.920 2901 N CB 0.962 39.511 38.487 0.105 0.000 1.148 2901 N HN 0.445 nan 8.380 nan 0.000 0.509 2902 V N 0.783 120.668 119.914 -0.048 0.000 2.913 2902 V HA -0.034 4.086 4.120 0.000 0.000 0.260 2902 V C 1.440 177.425 176.094 -0.181 0.000 1.098 2902 V CA 1.229 63.437 62.300 -0.153 0.000 1.121 2902 V CB -1.201 30.464 31.823 -0.265 0.000 0.714 2902 V HN 0.409 nan 8.190 nan 0.000 0.487 2903 F N 2.505 122.456 119.950 0.001 0.000 2.206 2903 F HA -0.055 4.472 4.527 0.000 0.000 0.298 2903 F C 2.728 178.529 175.800 0.002 0.000 1.090 2903 F CA 1.863 59.864 58.000 0.002 0.000 1.323 2903 F CB -0.387 38.615 39.000 0.002 0.000 1.028 2903 F HN 0.366 nan 8.300 nan 0.000 0.492 2904 T N -3.770 110.891 114.554 0.179 0.000 3.022 2904 T HA 0.364 4.714 4.350 0.000 0.000 0.250 2904 T C 1.436 176.168 174.700 0.052 0.000 1.060 2904 T CA 0.421 62.578 62.100 0.096 0.000 1.013 2904 T CB 0.271 69.186 68.868 0.079 0.000 0.982 2904 T HN 0.376 nan 8.240 nan 0.000 0.508 2905 G N 1.055 109.877 108.800 0.037 0.000 2.291 2905 G HA2 0.287 4.247 3.960 0.000 0.000 0.271 2905 G HA3 0.287 4.247 3.960 0.000 0.000 0.271 2905 G C 0.036 174.943 174.900 0.012 0.000 1.099 2905 G CA -0.230 44.874 45.100 0.008 0.000 0.919 2905 G HN 1.394 nan 8.290 nan 0.000 0.496 2906 A N -1.508 121.324 122.820 0.020 0.000 2.601 2906 A HA 0.903 5.223 4.320 0.000 0.000 0.291 2906 A C 0.036 177.634 177.584 0.024 0.000 1.075 2906 A CA 0.110 52.159 52.037 0.020 0.000 0.671 2906 A CB 1.397 20.411 19.000 0.023 0.000 1.277 2906 A HN 1.818 nan 8.150 nan 0.000 0.417 2907 V N 1.421 121.348 119.914 0.022 0.000 2.673 2907 V HA 0.450 4.570 4.120 0.000 0.000 0.303 2907 V C -0.040 176.073 176.094 0.032 0.000 1.046 2907 V CA 0.936 63.253 62.300 0.027 0.000 1.126 2907 V CB 0.514 32.353 31.823 0.026 0.000 0.934 2907 V HN 0.908 nan 8.190 nan 0.000 0.487 2908 E N 3.617 123.839 120.200 0.037 0.000 2.350 2908 E HA 0.448 4.798 4.350 0.000 0.000 0.243 2908 E C -1.649 174.973 176.600 0.037 0.000 0.959 2908 E CA -0.716 55.706 56.400 0.037 0.000 0.883 2908 E CB 0.866 30.592 29.700 0.044 0.000 1.820 2908 E HN 0.659 nan 8.360 nan 0.000 0.441 2909 D N 1.402 121.822 120.400 0.033 0.000 2.427 2909 D HA 0.234 4.874 4.640 0.000 0.000 0.226 2909 D C 1.085 177.406 176.300 0.035 0.000 1.076 2909 D CA -0.304 53.714 54.000 0.030 0.000 0.849 2909 D CB 1.022 41.834 40.800 0.019 0.000 1.052 2909 D HN 0.162 nan 8.370 nan 0.000 0.515 2910 M N 0.386 120.012 119.600 0.043 0.000 2.099 2910 M HA -0.123 4.357 4.480 0.000 0.000 0.262 2910 M C 2.285 178.607 176.300 0.036 0.000 1.067 2910 M CA 0.885 56.213 55.300 0.047 0.000 1.124 2910 M CB -0.826 31.804 32.600 0.051 0.000 1.353 2910 M HN 0.502 nan 8.290 nan 0.000 0.410 2911 C N 0.700 120.018 119.300 0.031 0.000 2.429 2911 C HA -0.162 4.298 4.460 0.000 0.000 0.277 2911 C C 2.707 177.706 174.990 0.015 0.000 1.262 2911 C CA 1.345 60.376 59.018 0.022 0.000 1.733 2911 C CB -0.929 26.823 27.740 0.020 0.000 2.010 2911 C HN 0.633 nan 8.230 nan 0.000 0.483 2912 E N 0.131 120.340 120.200 0.014 0.000 2.118 2912 E HA -0.202 4.148 4.350 0.000 0.000 0.195 2912 E C 1.206 177.809 176.600 0.005 0.000 0.992 2912 E CA 1.355 57.760 56.400 0.008 0.000 0.804 2912 E CB -0.144 29.560 29.700 0.008 0.000 0.741 2912 E HN 0.630 nan 8.360 nan 0.000 0.458 2913 N N -0.527 118.180 118.700 0.011 0.000 2.398 2913 N HA 0.041 4.781 4.740 0.000 0.000 0.188 2913 N C 0.590 176.098 175.510 -0.002 0.000 1.122 2913 N CA 0.910 53.962 53.050 0.003 0.000 0.866 2913 N CB 0.945 39.441 38.487 0.015 0.000 0.970 2913 N HN 0.320 nan 8.380 nan 0.000 0.462 2914 G N 0.150 108.953 108.800 0.005 0.000 2.160 2914 G HA2 -0.260 3.700 3.960 0.000 0.000 0.251 2914 G HA3 -0.260 3.700 3.960 0.000 0.000 0.251 2914 G C -0.076 174.834 174.900 0.017 0.000 1.008 2914 G CA 0.150 45.252 45.100 0.005 0.000 0.724 2914 G HN 0.196 nan 8.290 nan 0.000 0.514 2915 V N 1.377 121.312 119.914 0.034 0.000 2.222 2915 V HA 0.483 4.603 4.120 0.000 0.000 0.253 2915 V C 0.788 176.911 176.094 0.047 0.000 1.210 2915 V CA 0.111 62.446 62.300 0.058 0.000 1.079 2915 V CB 0.494 32.370 31.823 0.088 0.000 1.265 2915 V HN 1.022 nan 8.190 nan 0.000 0.494 2916 V N 1.232 121.169 119.914 0.038 0.000 2.876 2916 V HA 0.795 4.915 4.120 0.000 0.000 0.312 2916 V C -0.704 175.408 176.094 0.029 0.000 1.085 2916 V CA -0.820 61.498 62.300 0.031 0.000 0.945 2916 V CB 2.485 34.322 31.823 0.023 0.000 1.017 2916 V HN 0.625 nan 8.190 nan 0.000 0.428 2917 E N 2.856 123.071 120.200 0.025 0.000 2.317 2917 E HA 0.533 4.883 4.350 0.000 0.000 0.270 2917 E C -2.972 173.639 176.600 0.018 0.000 0.885 2917 E CA -2.264 54.149 56.400 0.022 0.000 0.760 2917 E CB 2.745 32.457 29.700 0.021 0.000 1.227 2917 E HN 0.550 nan 8.360 nan 0.000 0.434 2918 P HA -0.098 nan 4.420 nan 0.000 0.266 2918 P C 0.507 177.815 177.300 0.014 0.000 1.193 2918 P CA -0.099 63.009 63.100 0.014 0.000 0.770 2918 P CB 0.529 32.236 31.700 0.013 0.000 0.836 2919 L N 4.077 125.308 121.223 0.014 0.000 2.042 2919 L HA -0.172 4.168 4.340 0.000 0.000 0.210 2919 L C 2.345 179.223 176.870 0.014 0.000 1.076 2919 L CA 1.868 56.716 54.840 0.014 0.000 0.749 2919 L CB -0.839 41.227 42.059 0.013 0.000 0.893 2919 L HN 0.308 nan 8.230 nan 0.000 0.432 2920 R N -0.967 119.541 120.500 0.013 0.000 2.105 2920 R HA -0.151 4.189 4.340 0.000 0.000 0.239 2920 R C 2.045 178.354 176.300 0.014 0.000 1.135 2920 R CA 1.792 57.901 56.100 0.013 0.000 0.967 2920 R CB -0.299 30.008 30.300 0.012 0.000 0.861 2920 R HN 0.395 nan 8.270 nan 0.000 0.442 2921 V N 1.440 121.363 119.914 0.014 0.000 2.255 2921 V HA -0.275 3.845 4.120 0.000 0.000 0.247 2921 V C 2.285 178.388 176.094 0.014 0.000 1.051 2921 V CA 1.876 64.184 62.300 0.013 0.000 1.018 2921 V CB -0.358 31.473 31.823 0.013 0.000 0.641 2921 V HN 0.292 nan 8.190 nan 0.000 0.445 2922 K N -0.391 120.018 120.400 0.015 0.000 2.167 2922 K HA -0.008 4.312 4.320 0.000 0.000 0.203 2922 K C 2.176 178.790 176.600 0.023 0.000 1.052 2922 K CA 1.292 57.588 56.287 0.016 0.000 0.956 2922 K CB -0.656 31.853 32.500 0.015 0.000 0.735 2922 K HN 0.495 nan 8.250 nan 0.000 0.451 2923 T N 1.373 115.941 114.554 0.023 0.000 2.812 2923 T HA -0.133 4.217 4.350 0.000 0.000 0.264 2923 T C 1.911 176.630 174.700 0.031 0.000 1.042 2923 T CA 1.289 63.406 62.100 0.028 0.000 1.140 2923 T CB -0.033 68.848 68.868 0.022 0.000 0.870 2923 T HN 0.121 nan 8.240 nan 0.000 0.445 2924 Q N 1.321 121.137 119.800 0.025 0.000 2.123 2924 Q HA 0.170 4.510 4.340 0.000 0.000 0.199 2924 Q C 2.248 178.264 176.000 0.028 0.000 0.966 2924 Q CA 1.522 57.340 55.803 0.025 0.000 0.845 2924 Q CB -0.669 28.081 28.738 0.019 0.000 0.907 2924 Q HN 0.471 nan 8.270 nan 0.000 0.439 2925 A N 0.524 123.358 122.820 0.024 0.000 1.883 2925 A HA -0.156 4.164 4.320 0.000 0.000 0.217 2925 A C 1.939 179.541 177.584 0.030 0.000 1.186 2925 A CA 1.594 53.643 52.037 0.020 0.000 0.624 2925 A CB -0.681 18.326 19.000 0.011 0.000 0.822 2925 A HN 0.444 nan 8.150 nan 0.000 0.444 2926 I N -0.369 120.228 120.570 0.044 0.000 2.252 2926 I HA -0.178 3.992 4.170 0.000 0.000 0.245 2926 I C 2.661 178.839 176.117 0.101 0.000 1.102 2926 I CA 1.161 62.510 61.300 0.081 0.000 1.385 2926 I CB -1.430 36.631 38.000 0.103 0.000 1.064 2926 I HN 0.361 nan 8.210 nan 0.000 0.414 2927 Q N 0.702 120.547 119.800 0.074 0.000 2.002 2927 Q HA -0.149 4.191 4.340 0.000 0.000 0.204 2927 Q C 2.506 178.546 176.000 0.067 0.000 0.988 2927 Q CA 1.882 57.727 55.803 0.069 0.000 0.843 2927 Q CB -0.550 28.216 28.738 0.047 0.000 0.908 2927 Q HN 0.387 nan 8.270 nan 0.000 0.420 2928 S N 0.821 116.552 115.700 0.051 0.000 2.356 2928 S HA -0.132 4.338 4.470 0.000 0.000 0.223 2928 S C 1.944 176.576 174.600 0.052 0.000 1.032 2928 S CA 1.151 59.378 58.200 0.044 0.000 1.005 2928 S CB -0.277 62.942 63.200 0.031 0.000 0.867 2928 S HN 0.517 nan 8.310 nan 0.000 0.449 2929 A N 1.397 124.250 122.820 0.054 0.000 1.873 2929 A HA 0.165 4.485 4.320 0.000 0.000 0.215 2929 A C 2.332 179.973 177.584 0.095 0.000 1.186 2929 A CA 1.708 53.776 52.037 0.051 0.000 0.616 2929 A CB -1.072 17.942 19.000 0.023 0.000 0.823 2929 A HN 0.515 nan 8.150 nan 0.000 0.442 2930 A N -0.690 122.223 122.820 0.154 0.000 1.898 2930 A HA -0.026 4.294 4.320 0.000 0.000 0.214 2930 A C 1.961 179.675 177.584 0.216 0.000 1.183 2930 A CA 1.912 54.122 52.037 0.288 0.000 0.622 2930 A CB -0.395 18.873 19.000 0.446 0.000 0.824 2930 A HN 0.489 nan 8.150 nan 0.000 0.444 2931 E N 0.069 120.352 120.200 0.139 0.000 2.150 2931 E HA -0.112 4.238 4.350 0.000 0.000 0.193 2931 E C 2.135 178.779 176.600 0.074 0.000 0.985 2931 E CA 1.356 57.814 56.400 0.096 0.000 0.814 2931 E CB -0.328 29.413 29.700 0.069 0.000 0.752 2931 E HN 0.459 nan 8.360 nan 0.000 0.466 2932 S N -1.304 114.437 115.700 0.068 0.000 2.368 2932 S HA -0.131 4.339 4.470 0.000 0.000 0.224 2932 S C 1.898 176.523 174.600 0.041 0.000 1.029 2932 S CA 1.761 59.989 58.200 0.047 0.000 0.988 2932 S CB -0.540 62.683 63.200 0.039 0.000 0.838 2932 S HN 0.421 nan 8.310 nan 0.000 0.462 2933 T N 1.832 116.424 114.554 0.063 0.000 2.674 2933 T HA -0.082 4.268 4.350 0.000 0.000 0.265 2933 T C 1.841 176.542 174.700 0.002 0.000 1.039 2933 T CA 1.401 63.524 62.100 0.038 0.000 1.150 2933 T CB -0.491 68.446 68.868 0.115 0.000 0.864 2933 T HN 0.426 nan 8.240 nan 0.000 0.427 2934 E N 0.797 121.038 120.200 0.068 0.000 2.204 2934 E HA -0.122 4.229 4.350 0.000 0.000 0.195 2934 E C 2.117 178.727 176.600 0.017 0.000 0.990 2934 E CA 0.825 57.254 56.400 0.047 0.000 0.821 2934 E CB -0.236 29.528 29.700 0.108 0.000 0.750 2934 E HN 0.502 nan 8.360 nan 0.000 0.477 2935 M N -0.172 119.442 119.600 0.024 0.000 2.077 2935 M HA -0.177 4.303 4.480 0.000 0.000 0.261 2935 M C 1.880 178.180 176.300 0.001 0.000 1.070 2935 M CA 1.059 56.368 55.300 0.016 0.000 1.125 2935 M CB 0.008 32.622 32.600 0.022 0.000 1.339 2935 M HN 0.097 nan 8.290 nan 0.000 0.409 2936 L N 0.759 121.979 121.223 -0.005 0.000 2.201 2936 L HA -0.103 4.237 4.340 0.000 0.000 0.212 2936 L C 2.150 178.999 176.870 -0.035 0.000 1.105 2936 L CA 1.497 56.329 54.840 -0.013 0.000 0.775 2936 L CB -1.067 40.983 42.059 -0.014 0.000 0.913 2936 L HN 0.389 nan 8.230 nan 0.000 0.440 2937 L N -1.270 119.915 121.223 -0.063 0.000 2.265 2937 L HA -0.190 4.150 4.340 0.000 0.000 0.215 2937 L C 2.501 179.339 176.870 -0.053 0.000 1.117 2937 L CA 0.846 55.631 54.840 -0.091 0.000 0.782 2937 L CB -0.360 41.606 42.059 -0.155 0.000 0.914 2937 L HN 0.233 nan 8.230 nan 0.000 0.441 2938 R N -0.368 120.116 120.500 -0.026 0.000 2.153 2938 R HA 0.013 4.353 4.340 0.000 0.000 0.218 2938 R C 0.183 176.480 176.300 -0.005 0.000 1.072 2938 R CA 0.370 56.466 56.100 -0.007 0.000 0.990 2938 R CB -0.050 30.252 30.300 0.004 0.000 0.889 2938 R HN 0.123 nan 8.270 nan 0.000 0.452 2939 I N 1.426 121.992 120.570 -0.006 0.000 2.396 2939 I HA -0.036 4.134 4.170 0.000 0.000 0.289 2939 I C 0.470 176.586 176.117 -0.001 0.000 1.056 2939 I CA 0.510 61.811 61.300 0.002 0.000 1.365 2939 I CB 1.155 39.160 38.000 0.009 0.000 1.407 2939 I HN -0.102 nan 8.210 nan 0.000 0.509 2940 D N 3.544 123.946 120.400 0.003 0.000 2.535 2940 D HA 0.138 4.778 4.640 0.000 0.000 0.229 2940 D C -0.909 175.400 176.300 0.015 0.000 1.238 2940 D CA 0.144 54.145 54.000 0.003 0.000 0.824 2940 D CB 0.243 41.039 40.800 -0.006 0.000 1.045 2940 D HN 0.446 nan 8.370 nan 0.000 0.500 2941 D N -0.259 120.152 120.400 0.019 0.000 2.931 2941 D HA 0.208 4.848 4.640 0.000 0.000 0.215 2941 D C -1.480 174.830 176.300 0.017 0.000 1.297 2941 D CA -0.438 53.574 54.000 0.021 0.000 0.892 2941 D CB 1.885 42.693 40.800 0.014 0.000 1.642 2941 D HN -0.256 nan 8.370 nan 0.000 0.560 2942 V N 4.981 124.906 119.914 0.019 0.000 2.378 2942 V HA 0.527 4.647 4.120 0.000 0.000 0.288 2942 V C 0.137 176.224 176.094 -0.011 0.000 1.016 2942 V CA -0.547 61.752 62.300 -0.002 0.000 0.840 2942 V CB 1.371 33.186 31.823 -0.013 0.000 0.994 2942 V HN 0.489 nan 8.190 nan 0.000 0.431 2943 I N 4.518 125.077 120.570 -0.018 0.000 2.411 2943 I HA 0.688 4.858 4.170 0.000 0.000 0.284 2943 I C 0.237 176.338 176.117 -0.027 0.000 1.012 2943 I CA -0.462 60.827 61.300 -0.018 0.000 1.119 2943 I CB 1.745 39.738 38.000 -0.011 0.000 1.261 2943 I HN 0.647 nan 8.210 nan 0.000 0.448 2944 A N 5.118 127.919 122.820 -0.032 0.000 2.304 2944 A HA 0.862 5.182 4.320 0.000 0.000 0.323 2944 A C 0.160 177.729 177.584 -0.024 0.000 1.195 2944 A CA -0.485 51.531 52.037 -0.035 0.000 0.826 2944 A CB 1.069 20.039 19.000 -0.049 0.000 1.184 2944 A HN 0.775 nan 8.150 nan 0.000 0.496 2945 A N 2.393 125.201 122.820 -0.020 0.000 2.386 2945 A HA 0.476 4.796 4.320 0.000 0.000 0.248 2945 A C 0.454 178.029 177.584 -0.015 0.000 1.082 2945 A CA -0.196 51.832 52.037 -0.015 0.000 0.789 2945 A CB 0.010 19.002 19.000 -0.012 0.000 1.025 2945 A HN 0.875 nan 8.150 nan 0.000 0.490 2946 E N 0.000 120.193 120.200 -0.012 0.000 2.725 2946 E HA 0.000 4.350 4.350 0.000 0.000 0.291 2946 E CA 0.000 56.394 56.400 -0.010 0.000 0.976 2946 E CB 0.000 29.695 29.700 -0.009 0.000 0.812 2946 E HN 0.000 nan 8.360 nan 0.000 0.440