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 2wau_1_A DATA FIRST_RESID 2350 DATA SEQUENCE DTWTDLVKNS SDINKGVLLP PRRKNLFLKI DESDICKYKR DPKLFKDFIY DATA SEQUENCE SSAISEVERL KKVYGEAKTK VVHAMKYSFA DIGSIIKGDD MMENNSSDKI DATA SEQUENCE GKILGDGVGQ NEKRKKWWDM NKYHIWESML SGYKHAYGNI SENDRKMLDI DATA SEQUENCE PNNDDEHQFL RWFQEWTENF cTKRNELYEN MVTAcNSAKc XXXXXXXDKK DATA SEQUENCE EcTEAcKNYS NFILIKKKEY QSLNSQYDMN YKETKAEKKE SPEYFKDKcN DATA SEQUENCE GEcScLSEYF KDETRWKNPY ETLDDTEVKN NcMcK 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 2350 D HA 0.000 nan 4.640 nan 0.000 0.175 2350 D C 0.000 176.335 176.300 0.059 0.000 2.045 2350 D CA 0.000 54.001 54.000 0.002 0.000 0.868 2350 D CB 0.000 40.814 40.800 0.023 0.000 0.688 2351 T N -0.125 114.449 114.554 0.034 0.000 2.928 2351 T HA 0.414 4.765 4.350 0.001 0.000 0.284 2351 T C -0.519 174.219 174.700 0.063 0.000 1.008 2351 T CA -0.287 61.884 62.100 0.117 0.000 1.057 2351 T CB 0.998 69.919 68.868 0.088 0.000 1.018 2351 T HN 0.028 nan 8.240 nan 0.000 0.493 2352 W N 3.495 124.821 121.300 0.043 0.000 2.226 2352 W HA 0.335 4.995 4.660 0.000 0.000 0.379 2352 W C 1.041 177.563 176.519 0.004 0.000 0.923 2352 W CA -0.730 56.635 57.345 0.033 0.000 1.524 2352 W CB -0.534 28.997 29.460 0.118 0.000 1.552 2352 W HN 0.738 nan 8.180 nan 0.000 0.337 2353 T N -1.772 112.821 114.554 0.066 0.000 2.828 2353 T HA 0.078 4.428 4.350 0.001 0.000 0.290 2353 T C 0.612 175.349 174.700 0.061 0.000 1.019 2353 T CA -0.454 61.674 62.100 0.045 0.000 1.031 2353 T CB 1.447 70.310 68.868 -0.009 0.000 1.001 2353 T HN 0.420 nan 8.240 nan 0.000 0.531 2354 D N 0.585 121.017 120.400 0.053 0.000 2.587 2354 D HA 0.058 4.699 4.640 0.001 0.000 0.233 2354 D C 0.495 176.827 176.300 0.054 0.000 1.213 2354 D CA -0.409 53.627 54.000 0.061 0.000 0.827 2354 D CB -0.638 40.188 40.800 0.043 0.000 1.006 2354 D HN 0.526 nan 8.370 nan 0.000 0.490 2355 L N 1.287 122.535 121.223 0.041 0.000 2.803 2355 L HA 0.126 4.467 4.340 0.001 0.000 0.241 2355 L C 0.352 177.263 176.870 0.068 0.000 1.404 2355 L CA -0.445 54.418 54.840 0.038 0.000 1.211 2355 L CB -0.376 41.692 42.059 0.015 0.000 1.585 2355 L HN 0.067 nan 8.230 nan 0.000 0.430 2356 V N -3.162 116.809 119.914 0.094 0.000 2.994 2356 V HA 0.475 4.596 4.120 0.001 0.000 0.318 2356 V C 0.187 176.332 176.094 0.085 0.000 1.085 2356 V CA -1.357 61.023 62.300 0.133 0.000 0.998 2356 V CB 1.650 33.598 31.823 0.207 0.000 1.063 2356 V HN 0.198 nan 8.190 nan 0.000 0.447 2357 K N 2.146 122.594 120.400 0.080 0.000 2.326 2357 K HA 0.277 4.598 4.320 0.001 0.000 0.275 2357 K C 0.115 176.734 176.600 0.030 0.000 1.018 2357 K CA 0.213 56.526 56.287 0.044 0.000 0.962 2357 K CB 0.006 32.527 32.500 0.035 0.000 0.953 2357 K HN 0.868 nan 8.250 nan 0.000 0.475 2358 N N 0.967 119.676 118.700 0.015 0.000 2.721 2358 N HA -0.181 4.559 4.740 0.001 0.000 0.249 2358 N C 0.344 175.853 175.510 -0.001 0.000 1.072 2358 N CA 1.245 54.295 53.050 0.001 0.000 0.710 2358 N CB -1.670 36.812 38.487 -0.010 0.000 0.993 2358 N HN 0.733 nan 8.380 nan 0.000 0.547 2359 S N -2.616 113.090 115.700 0.010 0.000 2.515 2359 S HA 0.056 4.527 4.470 0.001 0.000 0.231 2359 S C 1.610 176.204 174.600 -0.010 0.000 0.987 2359 S CA 0.761 58.966 58.200 0.008 0.000 0.936 2359 S CB 0.264 63.479 63.200 0.024 0.000 0.766 2359 S HN 0.318 nan 8.310 nan 0.000 0.528 2360 S N 1.754 117.446 115.700 -0.012 0.000 2.503 2360 S HA 0.144 4.615 4.470 0.001 0.000 0.217 2360 S C 0.290 174.872 174.600 -0.030 0.000 0.999 2360 S CA 0.391 58.579 58.200 -0.020 0.000 0.914 2360 S CB -0.070 63.121 63.200 -0.016 0.000 0.782 2360 S HN 0.693 nan 8.310 nan 0.000 0.520 2361 D N 0.748 121.129 120.400 -0.031 0.000 2.540 2361 D HA 0.193 4.834 4.640 0.001 0.000 0.229 2361 D C 1.304 177.571 176.300 -0.056 0.000 1.258 2361 D CA -0.599 53.376 54.000 -0.041 0.000 1.158 2361 D CB -0.795 39.984 40.800 -0.036 0.000 1.178 2361 D HN -0.074 nan 8.370 nan 0.000 0.541 2362 I N 0.286 120.819 120.570 -0.062 0.000 3.010 2362 I HA -0.054 4.117 4.170 0.001 0.000 0.271 2362 I C 0.226 176.289 176.117 -0.090 0.000 1.293 2362 I CA 0.946 62.193 61.300 -0.088 0.000 1.452 2362 I CB -1.424 36.521 38.000 -0.092 0.000 1.082 2362 I HN 0.187 nan 8.210 nan 0.000 0.484 2363 N N 0.612 119.278 118.700 -0.057 0.000 2.401 2363 N HA 0.187 4.928 4.740 0.001 0.000 0.264 2363 N C 0.087 175.578 175.510 -0.032 0.000 1.238 2363 N CA -0.069 52.958 53.050 -0.039 0.000 0.889 2363 N CB 0.148 38.638 38.487 0.005 0.000 1.196 2363 N HN 0.461 nan 8.380 nan 0.000 0.511 2364 K N -0.058 120.306 120.400 -0.060 0.000 2.383 2364 K HA 0.302 4.622 4.320 0.001 0.000 0.286 2364 K C 0.960 177.517 176.600 -0.071 0.000 1.051 2364 K CA 0.709 56.962 56.287 -0.056 0.000 0.974 2364 K CB 0.122 32.583 32.500 -0.065 0.000 0.968 2364 K HN 0.327 nan 8.250 nan 0.000 0.475 2365 G N 2.166 110.934 108.800 -0.052 0.000 2.175 2365 G HA2 -0.240 3.721 3.960 0.001 0.000 0.244 2365 G HA3 -0.240 3.721 3.960 0.001 0.000 0.244 2365 G C -0.028 174.855 174.900 -0.028 0.000 0.982 2365 G CA 0.014 45.068 45.100 -0.077 0.000 0.641 2365 G HN 0.520 nan 8.290 nan 0.000 0.527 2366 V N 2.270 122.217 119.914 0.054 0.000 2.479 2366 V HA 0.442 4.562 4.120 0.001 0.000 0.281 2366 V C 0.963 177.188 176.094 0.218 0.000 1.031 2366 V CA 0.279 62.706 62.300 0.212 0.000 1.038 2366 V CB 1.147 33.118 31.823 0.247 0.000 0.981 2366 V HN 0.342 nan 8.190 nan 0.000 0.478 2367 L N 5.543 126.922 121.223 0.260 0.000 2.325 2367 L HA 0.544 4.885 4.340 0.001 0.000 0.278 2367 L C -0.286 176.786 176.870 0.336 0.000 1.023 2367 L CA -0.673 54.336 54.840 0.282 0.000 0.811 2367 L CB 1.824 44.050 42.059 0.278 0.000 1.249 2367 L HN 0.442 nan 8.230 nan 0.000 0.431 2368 L N 4.863 126.129 121.223 0.072 0.000 2.257 2368 L HA 0.497 4.837 4.340 0.001 0.000 0.290 2368 L C -2.408 174.002 176.870 -0.766 0.000 1.044 2368 L CA -1.620 52.989 54.840 -0.385 0.000 0.810 2368 L CB 1.435 43.365 42.059 -0.215 0.000 1.193 2368 L HN 0.281 nan 8.230 nan 0.000 0.425 2369 P HA 0.179 nan 4.420 nan 0.000 0.268 2369 P C -2.148 174.527 177.300 -1.040 0.000 1.204 2369 P CA -1.043 61.028 63.100 -1.715 0.000 0.768 2369 P CB 0.224 31.164 31.700 -1.266 0.000 0.842 2370 P HA -0.200 nan 4.420 nan 0.000 0.215 2370 P C 1.610 178.717 177.300 -0.321 0.000 1.157 2370 P CA 1.489 64.293 63.100 -0.494 0.000 0.874 2370 P CB -0.084 31.391 31.700 -0.376 0.000 0.790 2371 R N -0.077 120.250 120.500 -0.290 0.000 2.103 2371 R HA -0.232 4.109 4.340 0.001 0.000 0.242 2371 R C 2.332 178.549 176.300 -0.138 0.000 1.142 2371 R CA 1.870 57.892 56.100 -0.130 0.000 0.960 2371 R CB -0.369 29.905 30.300 -0.044 0.000 0.858 2371 R HN -0.056 nan 8.270 nan 0.000 0.439 2372 R N 1.198 121.534 120.500 -0.274 0.000 2.073 2372 R HA -0.064 4.276 4.340 0.001 0.000 0.229 2372 R C 2.112 178.313 176.300 -0.164 0.000 1.120 2372 R CA 1.906 57.874 56.100 -0.221 0.000 0.967 2372 R CB -0.385 29.677 30.300 -0.397 0.000 0.862 2372 R HN 0.192 nan 8.270 nan 0.000 0.436 2373 K N -0.167 120.098 120.400 -0.224 0.000 2.152 2373 K HA -0.108 4.213 4.320 0.001 0.000 0.206 2373 K C 0.786 177.352 176.600 -0.056 0.000 1.048 2373 K CA 1.722 57.926 56.287 -0.138 0.000 0.933 2373 K CB -0.031 32.367 32.500 -0.170 0.000 0.721 2373 K HN 0.198 nan 8.250 nan 0.000 0.447 2374 N N 0.635 119.304 118.700 -0.052 0.000 2.412 2374 N HA -0.024 4.716 4.740 0.001 0.000 0.184 2374 N C 0.015 175.568 175.510 0.072 0.000 1.101 2374 N CA 0.141 53.199 53.050 0.014 0.000 0.881 2374 N CB 0.105 38.587 38.487 -0.009 0.000 0.969 2374 N HN 0.187 nan 8.380 nan 0.000 0.459 2375 L N 1.713 122.967 121.223 0.051 0.000 2.515 2375 L HA 0.123 4.463 4.340 0.001 0.000 0.281 2375 L C -0.510 176.428 176.870 0.113 0.000 1.131 2375 L CA -0.319 54.572 54.840 0.085 0.000 0.905 2375 L CB -0.202 41.891 42.059 0.056 0.000 1.246 2375 L HN -0.074 nan 8.230 nan 0.000 0.463 2376 F N 6.937 126.898 119.950 0.018 0.000 2.471 2376 F HA 0.370 4.898 4.527 0.001 0.000 0.365 2376 F C -0.395 175.421 175.800 0.026 0.000 1.095 2376 F CA -0.297 57.721 58.000 0.031 0.000 1.174 2376 F CB 0.797 39.820 39.000 0.038 0.000 1.105 2376 F HN 0.405 nan 8.300 nan 0.000 0.535 2377 L N 7.313 128.297 121.223 -0.399 0.000 2.487 2377 L HA 0.361 4.701 4.340 0.001 0.000 0.261 2377 L C -1.671 175.051 176.870 -0.247 0.000 1.223 2377 L CA -0.248 54.438 54.840 -0.257 0.000 0.883 2377 L CB 0.285 42.263 42.059 -0.136 0.000 1.065 2377 L HN 0.365 nan 8.230 nan 0.000 0.488 2378 K N 2.836 123.026 120.400 -0.349 0.000 2.274 2378 K HA 0.656 4.976 4.320 0.001 0.000 0.262 2378 K C -1.174 175.461 176.600 0.059 0.000 0.961 2378 K CA -0.478 55.694 56.287 -0.193 0.000 0.833 2378 K CB 2.064 34.344 32.500 -0.366 0.000 1.102 2378 K HN 0.276 nan 8.250 nan 0.000 0.436 2379 I N 2.527 123.139 120.570 0.070 0.000 2.354 2379 I HA 0.153 4.323 4.170 0.001 0.000 0.292 2379 I C 0.267 176.408 176.117 0.041 0.000 0.989 2379 I CA -1.202 60.139 61.300 0.068 0.000 1.188 2379 I CB 1.386 39.465 38.000 0.131 0.000 1.342 2379 I HN 0.604 nan 8.210 nan 0.000 0.457 2380 D N 2.723 123.140 120.400 0.028 0.000 2.264 2380 D HA 0.215 4.856 4.640 0.001 0.000 0.249 2380 D C 1.217 177.523 176.300 0.010 0.000 1.070 2380 D CA -0.250 53.759 54.000 0.015 0.000 0.912 2380 D CB 1.055 41.859 40.800 0.006 0.000 1.193 2380 D HN 0.512 nan 8.370 nan 0.000 0.427 2381 E N 0.864 121.066 120.200 0.003 0.000 2.401 2381 E HA -0.108 4.243 4.350 0.001 0.000 0.199 2381 E C 1.478 178.065 176.600 -0.021 0.000 1.023 2381 E CA 0.503 56.900 56.400 -0.005 0.000 0.859 2381 E CB 0.164 29.860 29.700 -0.006 0.000 0.780 2381 E HN 0.384 nan 8.360 nan 0.000 0.523 2382 S N 1.500 117.183 115.700 -0.029 0.000 2.345 2382 S HA -0.123 4.347 4.470 0.001 0.000 0.220 2382 S C 1.218 175.765 174.600 -0.087 0.000 1.031 2382 S CA 1.315 59.486 58.200 -0.050 0.000 0.996 2382 S CB -0.163 63.010 63.200 -0.046 0.000 0.882 2382 S HN 0.397 nan 8.310 nan 0.000 0.445 2383 D N 1.321 121.651 120.400 -0.117 0.000 2.323 2383 D HA 0.066 4.707 4.640 0.001 0.000 0.239 2383 D C 1.371 177.554 176.300 -0.196 0.000 1.129 2383 D CA -0.007 53.841 54.000 -0.253 0.000 0.865 2383 D CB -0.377 40.173 40.800 -0.417 0.000 0.913 2383 D HN 0.250 nan 8.370 nan 0.000 0.517 2384 I N 0.143 120.671 120.570 -0.070 0.000 2.454 2384 I HA -0.232 3.939 4.170 0.001 0.000 0.254 2384 I C 2.119 178.210 176.117 -0.044 0.000 1.156 2384 I CA 0.912 62.201 61.300 -0.019 0.000 1.433 2384 I CB -0.691 37.297 38.000 -0.020 0.000 1.082 2384 I HN 0.388 nan 8.210 nan 0.000 0.432 2385 C N -0.631 118.619 119.300 -0.084 0.000 2.518 2385 C HA 0.066 4.527 4.460 0.001 0.000 0.283 2385 C C 2.573 177.504 174.990 -0.098 0.000 1.351 2385 C CA 0.263 59.236 59.018 -0.075 0.000 1.745 2385 C CB -0.942 26.759 27.740 -0.066 0.000 2.107 2385 C HN 0.543 nan 8.230 nan 0.000 0.502 2386 K N 0.258 120.542 120.400 -0.194 0.000 2.113 2386 K HA -0.171 4.150 4.320 0.001 0.000 0.208 2386 K C 1.453 177.950 176.600 -0.172 0.000 1.047 2386 K CA 1.836 57.968 56.287 -0.258 0.000 0.928 2386 K CB -0.243 31.971 32.500 -0.477 0.000 0.716 2386 K HN 0.667 nan 8.250 nan 0.000 0.446 2387 Y N -0.055 120.238 120.300 -0.011 0.000 2.490 2387 Y HA -0.031 4.520 4.550 0.002 0.000 0.285 2387 Y C 2.326 178.180 175.900 -0.075 0.000 1.117 2387 Y CA 0.170 58.277 58.100 0.012 0.000 1.262 2387 Y CB 0.285 38.772 38.460 0.046 0.000 1.043 2387 Y HN -0.029 nan 8.280 nan 0.000 0.553 2388 K N 0.621 121.043 120.400 0.037 0.000 2.007 2388 K HA -0.072 4.248 4.320 0.001 0.000 0.206 2388 K C 2.100 178.700 176.600 -0.000 0.000 1.047 2388 K CA 0.943 57.213 56.287 -0.028 0.000 0.937 2388 K CB 0.097 32.570 32.500 -0.045 0.000 0.718 2388 K HN -0.069 nan 8.250 nan 0.000 0.438 2389 R N 0.555 121.059 120.500 0.007 0.000 2.193 2389 R HA -0.004 4.337 4.340 0.001 0.000 0.213 2389 R C -0.100 176.224 176.300 0.040 0.000 1.055 2389 R CA 0.641 56.750 56.100 0.015 0.000 0.995 2389 R CB -0.148 30.152 30.300 0.001 0.000 0.893 2389 R HN 0.242 nan 8.270 nan 0.000 0.459 2390 D N 0.131 120.570 120.400 0.066 0.000 2.462 2390 D HA 0.203 4.844 4.640 0.001 0.000 0.249 2390 D C -1.969 174.432 176.300 0.168 0.000 1.117 2390 D CA -2.429 51.631 54.000 0.100 0.000 0.900 2390 D CB 1.581 42.435 40.800 0.089 0.000 1.039 2390 D HN -0.143 nan 8.370 nan 0.000 0.516 2391 P HA -0.144 nan 4.420 nan 0.000 0.218 2391 P C 0.980 178.459 177.300 0.300 0.000 1.149 2391 P CA 1.301 64.534 63.100 0.222 0.000 0.817 2391 P CB 0.259 32.075 31.700 0.193 0.000 0.785 2392 K N -0.865 119.660 120.400 0.208 0.000 2.365 2392 K HA 0.015 4.335 4.320 0.001 0.000 0.197 2392 K C 1.758 178.450 176.600 0.153 0.000 1.042 2392 K CA 0.647 57.027 56.287 0.155 0.000 0.987 2392 K CB -1.177 31.367 32.500 0.073 0.000 0.779 2392 K HN -0.014 nan 8.250 nan 0.000 0.484 2393 L N 0.293 121.648 121.223 0.220 0.000 2.072 2393 L HA 0.105 4.446 4.340 0.001 0.000 0.205 2393 L C 2.026 179.126 176.870 0.384 0.000 1.079 2393 L CA 1.336 56.340 54.840 0.272 0.000 0.752 2393 L CB -0.555 41.668 42.059 0.274 0.000 0.906 2393 L HN 0.282 nan 8.230 nan 0.000 0.436 2394 F N 0.492 120.600 119.950 0.262 0.000 2.126 2394 F HA -0.234 4.293 4.527 0.000 0.000 0.299 2394 F C 2.272 178.138 175.800 0.110 0.000 1.096 2394 F CA 1.897 59.884 58.000 -0.022 0.000 1.255 2394 F CB -0.264 38.686 39.000 -0.082 0.000 0.997 2394 F HN 0.019 nan 8.300 nan 0.000 0.479 2395 K N 0.119 120.626 120.400 0.178 0.000 2.009 2395 K HA -0.206 4.115 4.320 0.001 0.000 0.210 2395 K C 1.821 178.324 176.600 -0.161 0.000 1.049 2395 K CA 1.820 58.165 56.287 0.097 0.000 0.929 2395 K CB -0.486 32.041 32.500 0.045 0.000 0.714 2395 K HN 0.253 nan 8.250 nan 0.000 0.440 2396 D N 0.185 120.505 120.400 -0.132 0.000 2.182 2396 D HA -0.178 4.463 4.640 0.001 0.000 0.201 2396 D C 1.667 178.017 176.300 0.083 0.000 0.986 2396 D CA 0.960 54.918 54.000 -0.071 0.000 0.847 2396 D CB -0.134 40.673 40.800 0.011 0.000 0.942 2396 D HN 0.122 nan 8.370 nan 0.000 0.467 2397 F N 1.297 121.206 119.950 -0.069 0.000 2.163 2397 F HA -0.139 4.389 4.527 0.001 0.000 0.297 2397 F C 2.388 178.133 175.800 -0.091 0.000 1.094 2397 F CA 0.716 58.667 58.000 -0.082 0.000 1.290 2397 F CB -0.361 38.522 39.000 -0.195 0.000 1.017 2397 F HN -0.196 nan 8.300 nan 0.000 0.483 2398 I N -0.654 119.696 120.570 -0.365 0.000 2.252 2398 I HA -0.257 3.913 4.170 0.001 0.000 0.245 2398 I C 2.300 178.430 176.117 0.022 0.000 1.102 2398 I CA 1.100 62.221 61.300 -0.298 0.000 1.385 2398 I CB -1.745 36.187 38.000 -0.113 0.000 1.064 2398 I HN 0.258 nan 8.210 nan 0.000 0.414 2399 Y N 1.459 121.713 120.300 -0.078 0.000 2.181 2399 Y HA -0.215 4.336 4.550 0.001 0.000 0.288 2399 Y C 2.938 178.814 175.900 -0.039 0.000 1.146 2399 Y CA 1.444 59.540 58.100 -0.008 0.000 1.164 2399 Y CB -1.247 37.229 38.460 0.025 0.000 0.982 2399 Y HN 0.433 nan 8.280 nan 0.000 0.515 2400 S N -1.762 113.998 115.700 0.099 0.000 2.461 2400 S HA -0.093 4.377 4.470 0.001 0.000 0.228 2400 S C 2.041 176.624 174.600 -0.029 0.000 1.005 2400 S CA 0.975 59.199 58.200 0.039 0.000 0.942 2400 S CB -0.546 62.695 63.200 0.068 0.000 0.776 2400 S HN 0.269 nan 8.310 nan 0.000 0.514 2401 S N 2.184 117.785 115.700 -0.165 0.000 2.368 2401 S HA 0.164 4.634 4.470 0.001 0.000 0.224 2401 S C 2.320 176.896 174.600 -0.040 0.000 1.029 2401 S CA 0.954 59.049 58.200 -0.175 0.000 0.988 2401 S CB -0.727 62.209 63.200 -0.441 0.000 0.838 2401 S HN 0.785 nan 8.310 nan 0.000 0.462 2402 A N 1.395 124.206 122.820 -0.015 0.000 1.902 2402 A HA -0.071 4.249 4.320 0.001 0.000 0.217 2402 A C 2.341 179.953 177.584 0.046 0.000 1.181 2402 A CA 1.394 53.462 52.037 0.052 0.000 0.623 2402 A CB -0.940 18.102 19.000 0.070 0.000 0.818 2402 A HN 0.379 nan 8.150 nan 0.000 0.443 2403 I N -0.095 120.492 120.570 0.027 0.000 2.127 2403 I HA -0.224 3.947 4.170 0.001 0.000 0.241 2403 I C 2.885 179.021 176.117 0.032 0.000 1.075 2403 I CA 1.941 63.252 61.300 0.019 0.000 1.334 2403 I CB -1.680 36.325 38.000 0.010 0.000 1.040 2403 I HN 0.531 nan 8.210 nan 0.000 0.405 2404 S N -0.609 115.113 115.700 0.036 0.000 2.399 2404 S HA -0.243 4.227 4.470 0.001 0.000 0.231 2404 S C 1.977 176.617 174.600 0.066 0.000 1.022 2404 S CA 1.514 59.742 58.200 0.046 0.000 0.983 2404 S CB -0.413 62.821 63.200 0.056 0.000 0.803 2404 S HN 0.675 nan 8.310 nan 0.000 0.480 2405 E N 1.547 121.796 120.200 0.081 0.000 2.077 2405 E HA -0.084 4.266 4.350 0.001 0.000 0.193 2405 E C 1.833 178.504 176.600 0.118 0.000 0.989 2405 E CA 1.020 57.484 56.400 0.107 0.000 0.800 2405 E CB -0.394 29.378 29.700 0.120 0.000 0.746 2405 E HN 0.281 nan 8.360 nan 0.000 0.452 2406 V N 0.910 120.888 119.914 0.108 0.000 2.427 2406 V HA -0.204 3.917 4.120 0.001 0.000 0.248 2406 V C 2.064 178.226 176.094 0.113 0.000 1.051 2406 V CA 2.111 64.486 62.300 0.125 0.000 1.048 2406 V CB -0.511 31.372 31.823 0.100 0.000 0.666 2406 V HN 0.294 nan 8.190 nan 0.000 0.456 2407 E N -0.158 120.089 120.200 0.078 0.000 2.150 2407 E HA -0.213 4.138 4.350 0.001 0.000 0.193 2407 E C 2.429 179.058 176.600 0.049 0.000 0.985 2407 E CA 0.918 57.350 56.400 0.054 0.000 0.814 2407 E CB -0.153 29.572 29.700 0.042 0.000 0.752 2407 E HN 0.444 nan 8.360 nan 0.000 0.466 2408 R N 0.866 121.404 120.500 0.063 0.000 2.075 2408 R HA -0.086 4.254 4.340 0.001 0.000 0.232 2408 R C 2.263 178.616 176.300 0.088 0.000 1.126 2408 R CA 0.779 56.915 56.100 0.059 0.000 0.963 2408 R CB -0.098 30.241 30.300 0.065 0.000 0.858 2408 R HN 0.167 nan 8.270 nan 0.000 0.435 2409 L N 0.888 122.198 121.223 0.144 0.000 2.083 2409 L HA -0.163 4.177 4.340 0.001 0.000 0.209 2409 L C 2.744 179.763 176.870 0.249 0.000 1.083 2409 L CA 1.346 56.328 54.840 0.238 0.000 0.752 2409 L CB -0.423 41.804 42.059 0.280 0.000 0.899 2409 L HN 0.227 nan 8.230 nan 0.000 0.433 2410 K N 0.306 120.802 120.400 0.159 0.000 2.097 2410 K HA -0.168 4.153 4.320 0.001 0.000 0.205 2410 K C 2.082 178.708 176.600 0.043 0.000 1.050 2410 K CA 1.015 57.355 56.287 0.090 0.000 0.938 2410 K CB 0.168 32.623 32.500 -0.075 0.000 0.718 2410 K HN 0.150 nan 8.250 nan 0.000 0.442 2411 K N 0.513 120.926 120.400 0.022 0.000 2.147 2411 K HA -0.094 4.227 4.320 0.001 0.000 0.205 2411 K C 2.095 178.682 176.600 -0.021 0.000 1.049 2411 K CA 0.972 57.254 56.287 -0.009 0.000 0.936 2411 K CB -0.114 32.377 32.500 -0.014 0.000 0.722 2411 K HN 0.064 nan 8.250 nan 0.000 0.446 2412 V N -0.300 119.602 119.914 -0.021 0.000 2.300 2412 V HA -0.172 3.949 4.120 0.001 0.000 0.241 2412 V C 1.943 177.922 176.094 -0.192 0.000 1.034 2412 V CA 1.421 63.627 62.300 -0.156 0.000 1.021 2412 V CB -0.545 31.119 31.823 -0.265 0.000 0.662 2412 V HN 0.112 nan 8.190 nan 0.000 0.458 2413 Y N 0.878 121.216 120.300 0.063 0.000 2.448 2413 Y HA 0.420 4.971 4.550 0.001 0.000 0.289 2413 Y C 1.756 177.705 175.900 0.081 0.000 1.114 2413 Y CA 0.307 58.453 58.100 0.077 0.000 1.235 2413 Y CB -0.632 37.893 38.460 0.108 0.000 1.045 2413 Y HN 0.351 nan 8.280 nan 0.000 0.554 2414 G N 1.943 110.871 108.800 0.213 0.000 2.415 2414 G HA2 -0.332 3.628 3.960 0.001 0.000 0.189 2414 G HA3 -0.332 3.628 3.960 0.001 0.000 0.189 2414 G C 0.331 175.332 174.900 0.169 0.000 0.317 2414 G CA 0.956 46.135 45.100 0.131 0.000 0.991 2414 G HN 0.616 nan 8.290 nan 0.000 0.415 2415 E N -1.053 119.304 120.200 0.261 0.000 3.496 2415 E HA -0.224 4.126 4.350 0.001 0.000 0.300 2415 E C 0.981 177.701 176.600 0.201 0.000 0.877 2415 E CA 1.559 58.130 56.400 0.285 0.000 1.050 2415 E CB -1.357 28.433 29.700 0.150 0.000 1.532 2415 E HN 2.134 nan 8.360 nan 0.000 0.447 2416 A N 1.018 123.967 122.820 0.214 0.000 3.000 2416 A HA 0.290 4.611 4.320 0.001 0.000 0.315 2416 A C 0.890 178.526 177.584 0.086 0.000 1.434 2416 A CA -0.065 52.052 52.037 0.134 0.000 1.108 2416 A CB 0.309 19.407 19.000 0.165 0.000 1.171 2416 A HN 0.237 nan 8.150 nan 0.000 0.524 2417 K N 0.036 120.436 120.400 -0.001 0.000 2.059 2417 K HA -0.179 4.142 4.320 0.001 0.000 0.212 2417 K C 1.792 178.373 176.600 -0.032 0.000 1.050 2417 K CA 2.353 58.575 56.287 -0.108 0.000 0.927 2417 K CB -0.157 32.235 32.500 -0.180 0.000 0.714 2417 K HN 0.667 nan 8.250 nan 0.000 0.447 2418 T N 1.444 115.979 114.554 -0.032 0.000 2.746 2418 T HA -0.092 4.258 4.350 0.001 0.000 0.267 2418 T C 1.599 176.271 174.700 -0.045 0.000 1.039 2418 T CA 1.045 63.128 62.100 -0.029 0.000 1.142 2418 T CB -0.018 68.833 68.868 -0.028 0.000 0.866 2418 T HN 0.161 nan 8.240 nan 0.000 0.444 2419 K N 0.881 121.215 120.400 -0.111 0.000 2.288 2419 K HA 0.076 4.396 4.320 0.001 0.000 0.201 2419 K C 2.243 178.566 176.600 -0.461 0.000 1.048 2419 K CA 0.568 56.658 56.287 -0.327 0.000 0.956 2419 K CB -0.356 31.909 32.500 -0.393 0.000 0.746 2419 K HN 0.300 nan 8.250 nan 0.000 0.461 2420 V N 0.531 120.356 119.914 -0.148 0.000 2.426 2420 V HA -0.118 4.002 4.120 0.001 0.000 0.242 2420 V C 2.385 178.534 176.094 0.092 0.000 1.036 2420 V CA 0.815 63.135 62.300 0.033 0.000 1.044 2420 V CB -0.206 31.776 31.823 0.264 0.000 0.688 2420 V HN -0.089 nan 8.190 nan 0.000 0.462 2421 V N 0.133 120.086 119.914 0.065 0.000 2.332 2421 V HA -0.333 3.788 4.120 0.001 0.000 0.248 2421 V C 2.406 178.533 176.094 0.055 0.000 1.055 2421 V CA 2.657 64.969 62.300 0.021 0.000 1.038 2421 V CB -0.836 30.933 31.823 -0.091 0.000 0.651 2421 V HN 0.691 nan 8.190 nan 0.000 0.450 2422 H N 0.017 119.062 119.070 -0.043 0.000 2.387 2422 H HA -0.073 4.484 4.556 0.001 0.000 0.299 2422 H C 2.141 177.463 175.328 -0.010 0.000 1.090 2422 H CA 1.646 57.656 56.048 -0.064 0.000 1.332 2422 H CB -0.025 29.707 29.762 -0.051 0.000 1.386 2422 H HN 0.409 nan 8.280 nan 0.000 0.516 2423 A N 0.056 123.003 122.820 0.212 0.000 1.970 2423 A HA -0.086 4.234 4.320 0.001 0.000 0.216 2423 A C 2.365 180.119 177.584 0.283 0.000 1.170 2423 A CA 1.107 53.335 52.037 0.319 0.000 0.645 2423 A CB -0.481 18.672 19.000 0.255 0.000 0.816 2423 A HN 0.439 nan 8.150 nan 0.000 0.447 2424 M N -0.314 119.424 119.600 0.229 0.000 2.082 2424 M HA -0.232 4.249 4.480 0.001 0.000 0.258 2424 M C 2.068 178.599 176.300 0.385 0.000 1.069 2424 M CA 1.945 57.427 55.300 0.303 0.000 1.102 2424 M CB -0.407 32.357 32.600 0.274 0.000 1.336 2424 M HN 0.329 nan 8.290 nan 0.000 0.404 2425 K N -0.828 119.684 120.400 0.187 0.000 2.147 2425 K HA -0.173 4.147 4.320 0.001 0.000 0.205 2425 K C 1.736 178.391 176.600 0.092 0.000 1.049 2425 K CA 1.331 57.617 56.287 -0.003 0.000 0.936 2425 K CB -0.159 32.146 32.500 -0.323 0.000 0.722 2425 K HN 0.284 nan 8.250 nan 0.000 0.446 2426 Y N 0.916 121.321 120.300 0.173 0.000 2.184 2426 Y HA -0.112 4.438 4.550 0.000 0.000 0.290 2426 Y C 2.656 178.688 175.900 0.219 0.000 1.129 2426 Y CA 0.824 59.042 58.100 0.197 0.000 1.144 2426 Y CB -0.457 38.117 38.460 0.190 0.000 0.995 2426 Y HN -0.046 nan 8.280 nan 0.000 0.513 2427 S N 0.093 116.029 115.700 0.392 0.000 2.368 2427 S HA -0.186 4.285 4.470 0.001 0.000 0.224 2427 S C 1.867 176.645 174.600 0.295 0.000 1.029 2427 S CA 1.216 59.594 58.200 0.296 0.000 0.988 2427 S CB -0.828 62.531 63.200 0.265 0.000 0.838 2427 S HN 0.466 nan 8.310 nan 0.000 0.462 2428 F N 2.961 123.060 119.950 0.249 0.000 2.043 2428 F HA -0.248 4.279 4.527 -0.000 0.000 0.297 2428 F C 2.362 178.289 175.800 0.210 0.000 1.121 2428 F CA 1.415 59.586 58.000 0.285 0.000 1.199 2428 F CB -0.936 38.272 39.000 0.347 0.000 0.968 2428 F HN 0.175 nan 8.300 nan 0.000 0.478 2429 A N -0.067 122.821 122.820 0.112 0.000 1.908 2429 A HA -0.223 4.098 4.320 0.001 0.000 0.218 2429 A C 2.001 179.502 177.584 -0.139 0.000 1.181 2429 A CA 2.072 54.078 52.037 -0.052 0.000 0.627 2429 A CB -1.132 17.967 19.000 0.165 0.000 0.818 2429 A HN 0.526 nan 8.150 nan 0.000 0.445 2430 D N -0.435 119.985 120.400 0.033 0.000 2.117 2430 D HA -0.108 4.532 4.640 0.001 0.000 0.197 2430 D C 2.083 178.322 176.300 -0.102 0.000 0.987 2430 D CA 1.406 55.435 54.000 0.049 0.000 0.829 2430 D CB -0.476 40.436 40.800 0.187 0.000 0.961 2430 D HN 0.275 nan 8.370 nan 0.000 0.460 2431 I N 0.667 121.154 120.570 -0.138 0.000 2.208 2431 I HA -0.166 4.004 4.170 0.001 0.000 0.245 2431 I C 2.692 178.522 176.117 -0.479 0.000 1.097 2431 I CA 1.337 62.525 61.300 -0.186 0.000 1.363 2431 I CB -1.519 36.449 38.000 -0.053 0.000 1.051 2431 I HN 0.223 nan 8.210 nan 0.000 0.413 2432 G N 0.150 108.327 108.800 -1.038 0.000 2.476 2432 G HA2 -0.278 3.683 3.960 0.001 0.000 0.218 2432 G HA3 -0.278 3.683 3.960 0.001 0.000 0.218 2432 G C 1.828 176.158 174.900 -0.950 0.000 1.164 2432 G CA 1.238 45.177 45.100 -1.935 0.000 0.768 2432 G HN 0.555 nan 8.290 nan 0.000 0.560 2433 S N 0.235 115.612 115.700 -0.537 0.000 2.368 2433 S HA -0.139 4.331 4.470 0.001 0.000 0.225 2433 S C 2.454 176.934 174.600 -0.199 0.000 1.030 2433 S CA 1.318 59.341 58.200 -0.296 0.000 0.999 2433 S CB -0.369 62.724 63.200 -0.177 0.000 0.844 2433 S HN 0.294 nan 8.310 nan 0.000 0.459 2434 I N 1.348 121.818 120.570 -0.167 0.000 2.179 2434 I HA -0.136 4.035 4.170 0.001 0.000 0.242 2434 I C 2.548 178.623 176.117 -0.071 0.000 1.088 2434 I CA 0.677 61.927 61.300 -0.083 0.000 1.357 2434 I CB -1.573 36.397 38.000 -0.051 0.000 1.051 2434 I HN 0.391 nan 8.210 nan 0.000 0.409 2435 I N -0.200 120.310 120.570 -0.099 0.000 2.142 2435 I HA -0.215 3.955 4.170 0.001 0.000 0.240 2435 I C 2.496 178.615 176.117 0.002 0.000 1.078 2435 I CA 1.504 62.812 61.300 0.013 0.000 1.343 2435 I CB -1.351 36.758 38.000 0.182 0.000 1.046 2435 I HN 0.409 nan 8.210 nan 0.000 0.405 2436 K N -0.156 120.188 120.400 -0.093 0.000 2.365 2436 K HA 0.105 4.426 4.320 0.001 0.000 0.199 2436 K C 1.694 178.269 176.600 -0.042 0.000 1.045 2436 K CA 0.872 57.131 56.287 -0.047 0.000 0.962 2436 K CB -0.091 32.336 32.500 -0.121 0.000 0.759 2436 K HN 0.667 nan 8.250 nan 0.000 0.469 2437 G N 1.513 110.277 108.800 -0.060 0.000 2.176 2437 G HA2 -0.199 3.762 3.960 0.001 0.000 0.232 2437 G HA3 -0.199 3.762 3.960 0.001 0.000 0.232 2437 G C 0.325 175.192 174.900 -0.055 0.000 0.986 2437 G CA 0.332 45.406 45.100 -0.044 0.000 0.643 2437 G HN 0.247 nan 8.290 nan 0.000 0.522 2438 D N 0.491 120.840 120.400 -0.086 0.000 2.317 2438 D HA 0.098 4.739 4.640 0.001 0.000 0.211 2438 D C 0.995 177.235 176.300 -0.100 0.000 0.966 2438 D CA 0.611 54.554 54.000 -0.096 0.000 0.876 2438 D CB 0.039 40.759 40.800 -0.132 0.000 0.927 2438 D HN 0.617 nan 8.370 nan 0.000 0.519 2439 D N -0.477 119.874 120.400 -0.082 0.000 2.449 2439 D HA 0.001 4.641 4.640 0.001 0.000 0.236 2439 D C 0.974 177.262 176.300 -0.020 0.000 1.149 2439 D CA 0.377 54.349 54.000 -0.047 0.000 0.878 2439 D CB 0.761 41.566 40.800 0.007 0.000 1.198 2439 D HN -0.141 nan 8.370 nan 0.000 0.446 2440 M N 1.804 121.412 119.600 0.013 0.000 2.308 2440 M HA 0.136 4.616 4.480 0.001 0.000 0.269 2440 M C 0.526 176.940 176.300 0.191 0.000 1.040 2440 M CA -0.260 55.074 55.300 0.056 0.000 1.024 2440 M CB 0.352 32.909 32.600 -0.072 0.000 1.465 2440 M HN 0.463 nan 8.290 nan 0.000 0.517 2441 M N 1.113 120.865 119.600 0.252 0.000 2.248 2441 M HA -0.017 4.464 4.480 0.001 0.000 0.337 2441 M C 0.952 177.309 176.300 0.094 0.000 1.121 2441 M CA 0.644 56.052 55.300 0.180 0.000 1.155 2441 M CB 0.890 33.578 32.600 0.146 0.000 1.514 2441 M HN 0.163 nan 8.290 nan 0.000 0.452 2442 E N 1.822 122.062 120.200 0.068 0.000 2.016 2442 E HA -0.125 4.225 4.350 0.001 0.000 0.190 2442 E C 0.173 176.789 176.600 0.028 0.000 0.985 2442 E CA 1.171 57.596 56.400 0.043 0.000 0.802 2442 E CB 0.089 29.810 29.700 0.035 0.000 0.762 2442 E HN 0.676 nan 8.360 nan 0.000 0.448 2443 N N 1.507 120.219 118.700 0.021 0.000 2.575 2443 N HA 0.003 4.744 4.740 0.001 0.000 0.275 2443 N C 0.193 175.704 175.510 0.001 0.000 1.202 2443 N CA -0.005 53.050 53.050 0.010 0.000 0.945 2443 N CB -0.481 38.010 38.487 0.007 0.000 1.247 2443 N HN 0.307 nan 8.380 nan 0.000 0.510 2444 N N -0.255 118.451 118.700 0.011 0.000 2.515 2444 N HA -0.129 4.612 4.740 0.001 0.000 0.185 2444 N C 0.023 175.533 175.510 0.001 0.000 1.109 2444 N CA 0.420 53.474 53.050 0.006 0.000 0.903 2444 N CB -0.026 38.477 38.487 0.027 0.000 0.969 2444 N HN 0.057 nan 8.380 nan 0.000 0.450 2445 S N -1.421 114.281 115.700 0.004 0.000 3.581 2445 S HA -0.276 4.195 4.470 0.001 0.000 0.354 2445 S C 0.939 175.549 174.600 0.016 0.000 1.059 2445 S CA 0.752 58.959 58.200 0.011 0.000 1.060 2445 S CB -2.532 60.679 63.200 0.018 0.000 0.908 2445 S HN 0.529 nan 8.310 nan 0.000 0.475 2446 S N 0.603 116.307 115.700 0.007 0.000 2.406 2446 S HA -0.039 4.431 4.470 0.001 0.000 0.228 2446 S C 1.435 176.029 174.600 -0.009 0.000 1.020 2446 S CA 1.295 59.495 58.200 -0.000 0.000 0.965 2446 S CB -0.350 62.847 63.200 -0.005 0.000 0.798 2446 S HN 0.706 nan 8.310 nan 0.000 0.488 2447 D N 1.249 121.644 120.400 -0.007 0.000 2.117 2447 D HA -0.054 4.587 4.640 0.001 0.000 0.197 2447 D C 2.045 178.333 176.300 -0.020 0.000 0.987 2447 D CA 1.189 55.181 54.000 -0.013 0.000 0.829 2447 D CB -0.100 40.695 40.800 -0.009 0.000 0.961 2447 D HN 0.426 nan 8.370 nan 0.000 0.460 2448 K N 0.004 120.397 120.400 -0.011 0.000 2.097 2448 K HA -0.033 4.288 4.320 0.001 0.000 0.205 2448 K C 2.176 178.750 176.600 -0.043 0.000 1.050 2448 K CA 0.626 56.905 56.287 -0.012 0.000 0.938 2448 K CB -0.066 32.444 32.500 0.017 0.000 0.718 2448 K HN 0.061 nan 8.250 nan 0.000 0.442 2449 I N 0.586 121.133 120.570 -0.039 0.000 2.226 2449 I HA -0.135 4.035 4.170 0.001 0.000 0.245 2449 I C 2.572 178.595 176.117 -0.155 0.000 1.100 2449 I CA 1.564 62.802 61.300 -0.104 0.000 1.374 2449 I CB -1.606 36.384 38.000 -0.018 0.000 1.057 2449 I HN 0.494 nan 8.210 nan 0.000 0.413 2450 G N 0.218 108.966 108.800 -0.088 0.000 2.440 2450 G HA2 -0.344 3.617 3.960 0.001 0.000 0.218 2450 G HA3 -0.344 3.617 3.960 0.001 0.000 0.218 2450 G C 1.965 176.811 174.900 -0.090 0.000 1.154 2450 G CA 1.585 46.640 45.100 -0.076 0.000 0.767 2450 G HN 0.599 nan 8.290 nan 0.000 0.552 2451 K N 0.334 120.683 120.400 -0.085 0.000 2.025 2451 K HA 0.125 4.445 4.320 0.001 0.000 0.207 2451 K C 2.552 179.079 176.600 -0.122 0.000 1.049 2451 K CA 1.427 57.665 56.287 -0.081 0.000 0.933 2451 K CB -1.038 31.427 32.500 -0.058 0.000 0.714 2451 K HN 0.261 nan 8.250 nan 0.000 0.438 2452 I N 1.353 121.813 120.570 -0.184 0.000 2.127 2452 I HA -0.140 4.031 4.170 0.001 0.000 0.241 2452 I C 2.406 178.321 176.117 -0.337 0.000 1.075 2452 I CA 1.203 62.331 61.300 -0.286 0.000 1.334 2452 I CB -0.792 36.920 38.000 -0.480 0.000 1.040 2452 I HN 0.456 nan 8.210 nan 0.000 0.405 2453 L N 0.594 121.596 121.223 -0.369 0.000 2.693 2453 L HA 0.261 4.601 4.340 0.001 0.000 0.242 2453 L C 1.765 178.562 176.870 -0.122 0.000 1.157 2453 L CA 0.681 55.345 54.840 -0.293 0.000 0.929 2453 L CB -1.069 40.804 42.059 -0.310 0.000 1.103 2453 L HN 0.598 nan 8.230 nan 0.000 0.430 2454 G N 0.126 108.864 108.800 -0.105 0.000 2.198 2454 G HA2 -0.310 3.650 3.960 0.001 0.000 0.260 2454 G HA3 -0.310 3.650 3.960 0.001 0.000 0.260 2454 G C 0.388 175.270 174.900 -0.030 0.000 1.025 2454 G CA 0.637 45.706 45.100 -0.052 0.000 0.769 2454 G HN 0.378 nan 8.290 nan 0.000 0.507 2455 D N -0.242 120.136 120.400 -0.037 0.000 2.844 2455 D HA 0.447 5.087 4.640 0.001 0.000 0.271 2455 D C 1.804 178.092 176.300 -0.021 0.000 1.386 2455 D CA 2.205 56.194 54.000 -0.018 0.000 1.053 2455 D CB -0.396 40.397 40.800 -0.011 0.000 1.107 2455 D HN 1.473 nan 8.370 nan 0.000 0.395 2456 G N 0.258 109.041 108.800 -0.028 0.000 2.894 2456 G HA2 -0.235 3.725 3.960 0.001 0.000 0.247 2456 G HA3 -0.235 3.725 3.960 0.001 0.000 0.247 2456 G C 0.528 175.418 174.900 -0.017 0.000 1.442 2456 G CA 0.043 45.127 45.100 -0.026 0.000 0.897 2456 G HN 1.131 nan 8.290 nan 0.000 0.550 2457 V N -0.185 119.719 119.914 -0.016 0.000 4.253 2457 V HA -0.018 4.103 4.120 0.001 0.000 0.233 2457 V C 2.108 178.196 176.094 -0.011 0.000 0.511 2457 V CA 3.297 65.589 62.300 -0.013 0.000 0.872 2457 V CB -0.956 30.860 31.823 -0.011 0.000 0.899 2457 V HN 3.241 nan 8.190 nan 0.000 1.196 2458 G N -0.649 108.144 108.800 -0.012 0.000 2.171 2458 G HA2 -0.260 3.701 3.960 0.001 0.000 0.238 2458 G HA3 -0.260 3.701 3.960 0.001 0.000 0.238 2458 G C -0.214 174.681 174.900 -0.007 0.000 1.039 2458 G CA 0.873 45.967 45.100 -0.010 0.000 0.759 2458 G HN 1.202 nan 8.290 nan 0.000 0.501 2459 Q N -0.495 119.302 119.800 -0.005 0.000 2.239 2459 Q HA 0.759 5.100 4.340 0.001 0.000 0.193 2459 Q C 1.250 177.253 176.000 0.005 0.000 1.004 2459 Q CA -0.038 55.766 55.803 0.001 0.000 1.040 2459 Q CB 0.610 29.350 28.738 0.003 0.000 1.149 2459 Q HN 0.245 nan 8.270 nan 0.000 0.535 2460 N N -1.946 116.763 118.700 0.015 0.000 2.072 2460 N HA 0.006 4.746 4.740 0.001 0.000 0.246 2460 N C 0.574 176.112 175.510 0.048 0.000 1.215 2460 N CA 0.008 53.073 53.050 0.026 0.000 0.799 2460 N CB 0.485 38.984 38.487 0.020 0.000 1.407 2460 N HN 0.393 nan 8.380 nan 0.000 0.489 2461 E N 1.886 122.112 120.200 0.045 0.000 2.049 2461 E HA -0.174 4.176 4.350 0.001 0.000 0.198 2461 E C 1.433 178.082 176.600 0.083 0.000 1.007 2461 E CA 1.202 57.638 56.400 0.059 0.000 0.809 2461 E CB 0.093 29.820 29.700 0.045 0.000 0.749 2461 E HN 0.310 nan 8.360 nan 0.000 0.450 2462 K N 0.359 120.803 120.400 0.075 0.000 2.025 2462 K HA -0.138 4.183 4.320 0.001 0.000 0.207 2462 K C 2.177 178.868 176.600 0.152 0.000 1.049 2462 K CA 1.196 57.541 56.287 0.097 0.000 0.933 2462 K CB -0.358 32.177 32.500 0.058 0.000 0.714 2462 K HN 0.228 nan 8.250 nan 0.000 0.438 2463 R N 1.004 121.578 120.500 0.122 0.000 2.189 2463 R HA -0.004 4.336 4.340 0.001 0.000 0.218 2463 R C 2.038 178.499 176.300 0.268 0.000 1.074 2463 R CA 1.094 57.295 56.100 0.169 0.000 0.991 2463 R CB -0.153 30.188 30.300 0.068 0.000 0.883 2463 R HN 0.022 nan 8.270 nan 0.000 0.457 2464 K N 1.472 121.996 120.400 0.207 0.000 2.062 2464 K HA -0.094 4.227 4.320 0.001 0.000 0.205 2464 K C 2.034 178.798 176.600 0.274 0.000 1.051 2464 K CA 1.254 57.678 56.287 0.228 0.000 0.941 2464 K CB 0.109 32.695 32.500 0.144 0.000 0.719 2464 K HN 0.099 nan 8.250 nan 0.000 0.440 2465 K N -0.589 119.946 120.400 0.226 0.000 2.155 2465 K HA -0.165 4.156 4.320 0.001 0.000 0.203 2465 K C 1.797 178.533 176.600 0.226 0.000 1.052 2465 K CA 1.163 57.561 56.287 0.185 0.000 0.948 2465 K CB -0.179 32.405 32.500 0.140 0.000 0.728 2465 K HN 0.249 nan 8.250 nan 0.000 0.448 2466 W N 0.924 122.318 121.300 0.157 0.000 2.355 2466 W HA -0.236 4.424 4.660 0.000 0.000 0.309 2466 W C 1.956 178.622 176.519 0.245 0.000 1.206 2466 W CA 1.680 59.141 57.345 0.193 0.000 1.284 2466 W CB -0.323 29.264 29.460 0.212 0.000 1.145 2466 W HN 0.293 nan 8.180 nan 0.000 0.502 2467 W N 1.536 123.087 121.300 0.418 0.000 2.333 2467 W HA -0.286 4.373 4.660 -0.001 0.000 0.316 2467 W C 1.766 178.308 176.519 0.038 0.000 1.215 2467 W CA 2.122 59.607 57.345 0.234 0.000 1.278 2467 W CB -1.044 28.541 29.460 0.209 0.000 1.154 2467 W HN -0.068 nan 8.180 nan 0.000 0.486 2468 D N 0.351 120.703 120.400 -0.080 0.000 2.190 2468 D HA -0.245 4.396 4.640 0.001 0.000 0.200 2468 D C 2.138 178.286 176.300 -0.254 0.000 0.992 2468 D CA 1.916 55.786 54.000 -0.216 0.000 0.854 2468 D CB -0.367 40.426 40.800 -0.011 0.000 0.936 2468 D HN -0.023 nan 8.370 nan 0.000 0.462 2469 M N -0.609 118.858 119.600 -0.222 0.000 2.541 2469 M HA 0.105 4.585 4.480 0.001 0.000 0.252 2469 M C 0.743 176.905 176.300 -0.229 0.000 1.125 2469 M CA 0.677 55.856 55.300 -0.201 0.000 1.091 2469 M CB -0.174 32.323 32.600 -0.171 0.000 1.420 2469 M HN 0.006 nan 8.290 nan 0.000 0.486 2470 N N -0.257 118.199 118.700 -0.406 0.000 2.210 2470 N HA 0.063 4.804 4.740 0.001 0.000 0.203 2470 N C 1.154 176.451 175.510 -0.355 0.000 1.175 2470 N CA 0.012 52.861 53.050 -0.335 0.000 0.894 2470 N CB 0.418 38.504 38.487 -0.668 0.000 1.041 2470 N HN 0.205 nan 8.380 nan 0.000 0.506 2471 K N 0.305 120.297 120.400 -0.680 0.000 2.077 2471 K HA -0.273 4.047 4.320 0.001 0.000 0.213 2471 K C 1.437 177.978 176.600 -0.098 0.000 1.051 2471 K CA 1.557 57.401 56.287 -0.737 0.000 0.929 2471 K CB -0.456 31.539 32.500 -0.841 0.000 0.715 2471 K HN 0.313 nan 8.250 nan 0.000 0.451 2472 Y N 1.574 121.723 120.300 -0.251 0.000 2.145 2472 Y HA -0.244 4.306 4.550 0.001 0.000 0.286 2472 Y C 2.149 177.909 175.900 -0.234 0.000 1.145 2472 Y CA 1.827 59.782 58.100 -0.242 0.000 1.148 2472 Y CB -0.169 38.051 38.460 -0.401 0.000 0.981 2472 Y HN 0.170 nan 8.280 nan 0.000 0.507 2473 H N -1.506 117.518 119.070 -0.076 0.000 2.436 2473 H HA -0.094 4.463 4.556 0.001 0.000 0.294 2473 H C 2.372 177.420 175.328 -0.466 0.000 1.048 2473 H CA 1.707 57.637 56.048 -0.198 0.000 1.353 2473 H CB -0.283 29.501 29.762 0.037 0.000 1.414 2473 H HN 0.242 nan 8.280 nan 0.000 0.536 2474 I N -0.144 120.204 120.570 -0.370 0.000 2.179 2474 I HA -0.266 3.904 4.170 0.001 0.000 0.242 2474 I C 2.358 178.486 176.117 0.018 0.000 1.088 2474 I CA 1.104 62.230 61.300 -0.290 0.000 1.357 2474 I CB -0.944 37.062 38.000 0.010 0.000 1.051 2474 I HN 0.668 nan 8.210 nan 0.000 0.409 2475 W N 1.146 122.387 121.300 -0.098 0.000 2.388 2475 W HA -0.147 4.515 4.660 0.004 0.000 0.294 2475 W C 2.402 178.734 176.519 -0.311 0.000 1.212 2475 W CA 1.246 58.429 57.345 -0.271 0.000 1.271 2475 W CB -0.087 29.023 29.460 -0.583 0.000 1.126 2475 W HN 0.244 nan 8.180 nan 0.000 0.535 2476 E N 0.348 120.312 120.200 -0.393 0.000 2.110 2476 E HA -0.148 4.202 4.350 0.001 0.000 0.193 2476 E C 2.194 178.617 176.600 -0.294 0.000 0.988 2476 E CA 1.459 57.604 56.400 -0.424 0.000 0.804 2476 E CB -0.529 28.927 29.700 -0.406 0.000 0.745 2476 E HN 0.193 nan 8.360 nan 0.000 0.458 2477 S N 0.925 116.495 115.700 -0.217 0.000 2.348 2477 S HA -0.126 4.344 4.470 0.001 0.000 0.221 2477 S C 2.059 176.557 174.600 -0.170 0.000 1.033 2477 S CA 1.256 59.382 58.200 -0.123 0.000 1.010 2477 S CB -0.236 62.921 63.200 -0.072 0.000 0.891 2477 S HN 0.270 nan 8.310 nan 0.000 0.442 2478 M N 0.452 119.899 119.600 -0.254 0.000 2.202 2478 M HA -0.114 4.367 4.480 0.001 0.000 0.262 2478 M C 1.760 177.819 176.300 -0.402 0.000 1.063 2478 M CA 1.061 56.176 55.300 -0.308 0.000 1.097 2478 M CB -0.535 31.827 32.600 -0.397 0.000 1.382 2478 M HN 0.204 nan 8.290 nan 0.000 0.413 2479 L N -0.420 120.469 121.223 -0.556 0.000 2.109 2479 L HA -0.082 4.258 4.340 0.001 0.000 0.207 2479 L C 2.563 179.357 176.870 -0.127 0.000 1.086 2479 L CA 1.675 56.267 54.840 -0.413 0.000 0.760 2479 L CB -0.926 40.838 42.059 -0.491 0.000 0.910 2479 L HN 0.169 nan 8.230 nan 0.000 0.437 2480 S N -0.644 114.989 115.700 -0.112 0.000 2.402 2480 S HA -0.076 4.394 4.470 0.001 0.000 0.229 2480 S C 1.993 176.609 174.600 0.028 0.000 1.021 2480 S CA 0.946 59.133 58.200 -0.022 0.000 0.974 2480 S CB -0.510 62.674 63.200 -0.026 0.000 0.800 2480 S HN 0.585 nan 8.310 nan 0.000 0.484 2481 G N -0.190 108.613 108.800 0.004 0.000 2.408 2481 G HA2 -0.227 3.734 3.960 0.001 0.000 0.217 2481 G HA3 -0.227 3.734 3.960 0.001 0.000 0.217 2481 G C 1.226 176.196 174.900 0.117 0.000 1.150 2481 G CA 0.615 45.744 45.100 0.048 0.000 0.776 2481 G HN 0.574 nan 8.290 nan 0.000 0.542 2482 Y N 1.060 121.355 120.300 -0.009 0.000 2.242 2482 Y HA 0.005 4.556 4.550 0.002 0.000 0.291 2482 Y C 2.747 178.723 175.900 0.127 0.000 1.137 2482 Y CA 2.057 60.200 58.100 0.071 0.000 1.181 2482 Y CB 0.003 38.447 38.460 -0.026 0.000 0.989 2482 Y HN 0.144 nan 8.280 nan 0.000 0.527 2483 K N -1.075 119.406 120.400 0.135 0.000 2.097 2483 K HA -0.257 4.064 4.320 0.001 0.000 0.205 2483 K C 1.901 178.513 176.600 0.020 0.000 1.050 2483 K CA 1.653 57.979 56.287 0.066 0.000 0.938 2483 K CB -0.379 32.174 32.500 0.088 0.000 0.718 2483 K HN 0.455 nan 8.250 nan 0.000 0.442 2484 H N -0.526 118.519 119.070 -0.042 0.000 2.524 2484 H HA 0.062 4.618 4.556 0.001 0.000 0.282 2484 H C 1.363 176.620 175.328 -0.118 0.000 1.016 2484 H CA 1.299 57.311 56.048 -0.061 0.000 1.270 2484 H CB 0.271 30.009 29.762 -0.039 0.000 1.394 2484 H HN 0.307 nan 8.280 nan 0.000 0.568 2485 A N -0.864 121.871 122.820 -0.141 0.000 1.956 2485 A HA 0.025 4.345 4.320 0.001 0.000 0.212 2485 A C 1.003 178.231 177.584 -0.594 0.000 1.188 2485 A CA 0.632 52.456 52.037 -0.355 0.000 0.675 2485 A CB -0.140 18.661 19.000 -0.331 0.000 0.845 2485 A HN 0.490 nan 8.150 nan 0.000 0.455 2486 Y N -1.418 118.677 120.300 -0.342 0.000 2.500 2486 Y HA 0.399 4.949 4.550 0.001 0.000 0.246 2486 Y C 1.757 177.532 175.900 -0.209 0.000 1.146 2486 Y CA 0.100 58.012 58.100 -0.313 0.000 1.230 2486 Y CB 0.814 38.978 38.460 -0.494 0.000 1.214 2486 Y HN 0.474 nan 8.280 nan 0.000 0.526 2487 G N 1.284 110.035 108.800 -0.081 0.000 4.933 2487 G HA2 -0.351 3.610 3.960 0.001 0.000 0.285 2487 G HA3 -0.351 3.610 3.960 0.001 0.000 0.285 2487 G C -0.124 174.768 174.900 -0.015 0.000 1.596 2487 G CA 0.125 45.191 45.100 -0.057 0.000 1.081 2487 G HN 0.364 nan 8.290 nan 0.000 0.710 2488 N N -0.034 118.671 118.700 0.009 0.000 2.372 2488 N HA 0.543 5.284 4.740 0.001 0.000 0.291 2488 N C -0.263 175.281 175.510 0.056 0.000 1.024 2488 N CA 0.180 53.246 53.050 0.027 0.000 0.873 2488 N CB 1.609 40.108 38.487 0.020 0.000 1.206 2488 N HN 1.055 nan 8.380 nan 0.000 0.486 2489 I N 3.005 123.621 120.570 0.075 0.000 2.505 2489 I HA 0.293 4.464 4.170 0.001 0.000 0.287 2489 I C 0.001 176.157 176.117 0.065 0.000 1.104 2489 I CA -0.332 61.033 61.300 0.108 0.000 1.387 2489 I CB -0.733 37.326 38.000 0.098 0.000 1.404 2489 I HN 0.669 nan 8.210 nan 0.000 0.528 2490 S N 5.153 120.893 115.700 0.066 0.000 2.576 2490 S HA 0.130 4.601 4.470 0.001 0.000 0.276 2490 S C 1.206 175.819 174.600 0.021 0.000 1.339 2490 S CA -0.243 57.978 58.200 0.035 0.000 1.039 2490 S CB 1.035 64.253 63.200 0.029 0.000 0.902 2490 S HN 0.925 nan 8.310 nan 0.000 0.516 2491 E N 1.622 121.830 120.200 0.014 0.000 2.204 2491 E HA -0.150 4.201 4.350 0.001 0.000 0.194 2491 E C 1.270 177.871 176.600 0.003 0.000 0.989 2491 E CA 0.901 57.306 56.400 0.008 0.000 0.824 2491 E CB 0.054 29.759 29.700 0.008 0.000 0.756 2491 E HN 0.717 nan 8.360 nan 0.000 0.477 2492 N N -0.617 118.084 118.700 0.001 0.000 2.187 2492 N HA -0.061 4.680 4.740 0.001 0.000 0.212 2492 N C 0.728 176.232 175.510 -0.011 0.000 1.152 2492 N CA 0.106 53.154 53.050 -0.004 0.000 0.872 2492 N CB 0.514 38.999 38.487 -0.003 0.000 1.025 2492 N HN -0.015 nan 8.380 nan 0.000 0.514 2493 D N 1.694 122.088 120.400 -0.010 0.000 2.271 2493 D HA 0.015 4.656 4.640 0.001 0.000 0.206 2493 D C 1.739 178.008 176.300 -0.052 0.000 0.967 2493 D CA 0.180 54.165 54.000 -0.024 0.000 0.867 2493 D CB 0.248 41.049 40.800 0.001 0.000 0.960 2493 D HN 0.202 nan 8.370 nan 0.000 0.509 2494 R N 0.406 120.884 120.500 -0.037 0.000 2.241 2494 R HA -0.088 4.253 4.340 0.001 0.000 0.224 2494 R C 1.944 178.220 176.300 -0.039 0.000 1.101 2494 R CA 0.933 57.005 56.100 -0.046 0.000 0.995 2494 R CB 0.114 30.400 30.300 -0.023 0.000 0.870 2494 R HN -0.122 nan 8.270 nan 0.000 0.463 2495 K N -0.063 120.317 120.400 -0.033 0.000 2.147 2495 K HA -0.055 4.266 4.320 0.001 0.000 0.205 2495 K C 1.755 178.331 176.600 -0.040 0.000 1.049 2495 K CA 1.485 57.754 56.287 -0.030 0.000 0.936 2495 K CB 0.046 32.532 32.500 -0.024 0.000 0.722 2495 K HN 0.159 nan 8.250 nan 0.000 0.446 2496 M N -0.456 119.112 119.600 -0.053 0.000 2.175 2496 M HA -0.099 4.382 4.480 0.001 0.000 0.264 2496 M C 0.425 176.690 176.300 -0.057 0.000 1.063 2496 M CA 1.054 56.316 55.300 -0.063 0.000 1.119 2496 M CB 0.079 32.630 32.600 -0.082 0.000 1.377 2496 M HN -0.002 nan 8.290 nan 0.000 0.415 2497 L N 0.549 121.734 121.223 -0.063 0.000 2.968 2497 L HA 0.130 4.471 4.340 0.001 0.000 0.235 2497 L C -0.261 176.693 176.870 0.139 0.000 1.323 2497 L CA 0.139 54.985 54.840 0.009 0.000 1.159 2497 L CB -0.941 41.008 42.059 -0.183 0.000 1.523 2497 L HN -0.002 nan 8.230 nan 0.000 0.468 2498 D N -0.610 119.822 120.400 0.052 0.000 2.344 2498 D HA 0.181 4.822 4.640 0.001 0.000 0.244 2498 D C 0.181 176.402 176.300 -0.131 0.000 1.134 2498 D CA -0.160 53.840 54.000 0.000 0.000 0.930 2498 D CB 1.187 41.946 40.800 -0.069 0.000 1.175 2498 D HN -0.114 nan 8.370 nan 0.000 0.437 2499 I N 3.044 123.491 120.570 -0.206 0.000 2.671 2499 I HA 0.156 4.327 4.170 0.001 0.000 0.285 2499 I C -1.602 174.126 176.117 -0.647 0.000 1.148 2499 I CA -1.405 59.525 61.300 -0.618 0.000 1.386 2499 I CB -0.991 36.857 38.000 -0.255 0.000 1.406 2499 I HN 0.364 nan 8.210 nan 0.000 0.540 2500 P HA 0.247 nan 4.420 nan 0.000 0.281 2500 P C -0.452 176.675 177.300 -0.288 0.000 1.249 2500 P CA -0.692 62.037 63.100 -0.619 0.000 0.810 2500 P CB 0.725 31.940 31.700 -0.807 0.000 1.008 2501 N N 2.115 120.727 118.700 -0.146 0.000 2.817 2501 N HA 0.136 4.877 4.740 0.001 0.000 0.234 2501 N C -0.100 175.427 175.510 0.029 0.000 1.066 2501 N CA -0.282 52.756 53.050 -0.019 0.000 0.926 2501 N CB -0.005 38.470 38.487 -0.019 0.000 1.176 2501 N HN 0.283 nan 8.380 nan 0.000 0.506 2502 N N 1.286 120.047 118.700 0.101 0.000 2.211 2502 N HA -0.067 4.673 4.740 0.001 0.000 0.216 2502 N C 0.518 176.110 175.510 0.137 0.000 1.240 2502 N CA 0.008 53.130 53.050 0.120 0.000 0.895 2502 N CB 0.439 39.001 38.487 0.125 0.000 1.102 2502 N HN 0.577 nan 8.380 nan 0.000 0.498 2503 D N 2.171 122.685 120.400 0.189 0.000 2.149 2503 D HA -0.199 4.442 4.640 0.001 0.000 0.198 2503 D C 1.063 177.425 176.300 0.104 0.000 0.990 2503 D CA 1.365 55.474 54.000 0.182 0.000 0.839 2503 D CB -0.369 40.719 40.800 0.481 0.000 0.948 2503 D HN 0.310 nan 8.370 nan 0.000 0.460 2504 D N 0.279 120.745 120.400 0.110 0.000 2.333 2504 D HA -0.062 4.579 4.640 0.001 0.000 0.208 2504 D C 0.692 177.000 176.300 0.014 0.000 0.984 2504 D CA -0.063 53.972 54.000 0.058 0.000 0.873 2504 D CB -0.679 40.165 40.800 0.073 0.000 0.935 2504 D HN 0.386 nan 8.370 nan 0.000 0.521 2505 E N 0.265 120.501 120.200 0.059 0.000 2.360 2505 E HA 0.006 4.356 4.350 0.001 0.000 0.269 2505 E C -0.573 176.068 176.600 0.068 0.000 1.022 2505 E CA -0.431 56.030 56.400 0.101 0.000 0.887 2505 E CB 0.358 30.149 29.700 0.151 0.000 0.990 2505 E HN 0.163 nan 8.360 nan 0.000 0.426 2506 H N 2.706 121.821 119.070 0.075 0.000 3.140 2506 H HA -0.115 4.440 4.556 -0.002 0.000 0.316 2506 H C 1.066 176.385 175.328 -0.015 0.000 0.986 2506 H CA 0.925 57.001 56.048 0.048 0.000 1.397 2506 H CB 0.698 30.523 29.762 0.105 0.000 1.377 2506 H HN 0.631 nan 8.280 nan 0.000 0.585 2507 Q N 3.249 123.031 119.800 -0.030 0.000 2.050 2507 Q HA -0.194 4.146 4.340 0.001 0.000 0.202 2507 Q C 1.781 177.562 176.000 -0.366 0.000 0.980 2507 Q CA 1.558 57.202 55.803 -0.265 0.000 0.840 2507 Q CB -0.068 28.369 28.738 -0.502 0.000 0.898 2507 Q HN 0.791 nan 8.270 nan 0.000 0.424 2508 F N 0.680 120.368 119.950 -0.436 0.000 2.120 2508 F HA -0.281 4.245 4.527 -0.001 0.000 0.300 2508 F C 1.644 177.437 175.800 -0.011 0.000 1.095 2508 F CA 1.211 59.019 58.000 -0.320 0.000 1.249 2508 F CB -0.175 38.513 39.000 -0.520 0.000 0.995 2508 F HN 0.130 nan 8.300 nan 0.000 0.480 2509 L N 0.584 121.807 121.223 0.001 0.000 2.083 2509 L HA -0.178 4.162 4.340 0.001 0.000 0.209 2509 L C 2.572 179.626 176.870 0.306 0.000 1.083 2509 L CA 1.689 56.644 54.840 0.192 0.000 0.752 2509 L CB -0.788 41.423 42.059 0.254 0.000 0.899 2509 L HN 0.067 nan 8.230 nan 0.000 0.433 2510 R N -2.169 118.493 120.500 0.271 0.000 2.066 2510 R HA -0.184 4.156 4.340 0.001 0.000 0.232 2510 R C 2.148 178.701 176.300 0.422 0.000 1.131 2510 R CA 1.527 57.872 56.100 0.408 0.000 0.955 2510 R CB -0.458 30.098 30.300 0.426 0.000 0.851 2510 R HN 0.314 nan 8.270 nan 0.000 0.432 2511 W N 0.122 121.466 121.300 0.073 0.000 2.338 2511 W HA -0.174 4.488 4.660 0.004 0.000 0.304 2511 W C 2.081 178.668 176.519 0.114 0.000 1.212 2511 W CA 0.335 57.724 57.345 0.073 0.000 1.264 2511 W CB -1.006 28.493 29.460 0.064 0.000 1.142 2511 W HN 0.020 nan 8.180 nan 0.000 0.512 2512 F N 1.154 121.061 119.950 -0.071 0.000 2.146 2512 F HA -0.192 4.335 4.527 0.000 0.000 0.298 2512 F C 2.480 178.136 175.800 -0.240 0.000 1.096 2512 F CA 2.011 59.844 58.000 -0.278 0.000 1.275 2512 F CB -1.198 37.529 39.000 -0.456 0.000 1.008 2512 F HN 0.021 nan 8.300 nan 0.000 0.480 2513 Q N 0.096 119.949 119.800 0.089 0.000 2.096 2513 Q HA -0.263 4.078 4.340 0.001 0.000 0.204 2513 Q C 2.299 178.357 176.000 0.096 0.000 0.982 2513 Q CA 2.074 57.858 55.803 -0.032 0.000 0.850 2513 Q CB -0.342 28.627 28.738 0.385 0.000 0.901 2513 Q HN 0.590 nan 8.270 nan 0.000 0.422 2514 E N -0.542 119.756 120.200 0.164 0.000 2.051 2514 E HA -0.229 4.121 4.350 0.001 0.000 0.192 2514 E C 1.641 178.359 176.600 0.197 0.000 0.991 2514 E CA 1.310 57.756 56.400 0.077 0.000 0.799 2514 E CB -0.390 29.098 29.700 -0.352 0.000 0.748 2514 E HN 0.534 nan 8.360 nan 0.000 0.449 2515 W N 1.435 122.727 121.300 -0.013 0.000 2.317 2515 W HA -0.248 4.412 4.660 0.001 0.000 0.318 2515 W C 2.263 178.691 176.519 -0.153 0.000 1.227 2515 W CA 2.779 59.915 57.345 -0.350 0.000 1.269 2515 W CB -0.604 28.386 29.460 -0.782 0.000 1.155 2515 W HN 0.036 nan 8.180 nan 0.000 0.484 2516 T N 0.505 115.162 114.554 0.172 0.000 2.708 2516 T HA -0.239 4.111 4.350 0.001 0.000 0.266 2516 T C 1.384 176.074 174.700 -0.016 0.000 1.037 2516 T CA 1.905 64.018 62.100 0.023 0.000 1.146 2516 T CB -0.489 68.203 68.868 -0.292 0.000 0.865 2516 T HN 0.306 nan 8.240 nan 0.000 0.435 2517 E N 1.188 121.390 120.200 0.004 0.000 2.038 2517 E HA -0.148 4.203 4.350 0.001 0.000 0.195 2517 E C 2.339 178.941 176.600 0.005 0.000 1.000 2517 E CA 1.142 57.561 56.400 0.031 0.000 0.803 2517 E CB -0.148 29.607 29.700 0.091 0.000 0.750 2517 E HN 0.352 nan 8.360 nan 0.000 0.448 2518 N N 0.305 119.010 118.700 0.008 0.000 2.244 2518 N HA -0.151 4.590 4.740 0.001 0.000 0.183 2518 N C 1.567 177.035 175.510 -0.069 0.000 1.016 2518 N CA 0.752 53.806 53.050 0.006 0.000 0.866 2518 N CB -0.371 38.178 38.487 0.103 0.000 0.980 2518 N HN 0.143 nan 8.380 nan 0.000 0.430 2519 F N 1.321 121.034 119.950 -0.396 0.000 2.075 2519 F HA -0.166 4.362 4.527 0.002 0.000 0.297 2519 F C 2.235 177.954 175.800 -0.135 0.000 1.113 2519 F CA 1.195 58.935 58.000 -0.435 0.000 1.218 2519 F CB -0.439 37.912 39.000 -1.082 0.000 0.984 2519 F HN -0.026 nan 8.300 nan 0.000 0.472 2520 c N 0.325 118.909 118.600 -0.026 0.000 2.435 2520 c HA -0.121 4.450 4.570 0.001 0.000 0.279 2520 c C 2.662 176.689 174.090 -0.104 0.000 1.321 2520 c CA 1.701 58.002 56.329 -0.046 0.000 1.752 2520 c CB -1.388 41.177 42.510 0.092 0.000 1.959 2520 c HN 0.606 nan 8.230 nan 0.000 0.500 2521 T N 0.443 114.944 114.554 -0.089 0.000 2.777 2521 T HA -0.167 4.183 4.350 0.001 0.000 0.266 2521 T C 1.883 176.498 174.700 -0.142 0.000 1.040 2521 T CA 1.462 63.511 62.100 -0.084 0.000 1.141 2521 T CB -0.149 68.688 68.868 -0.053 0.000 0.868 2521 T HN 0.444 nan 8.240 nan 0.000 0.444 2522 K N 1.283 121.553 120.400 -0.216 0.000 2.062 2522 K HA 0.075 4.395 4.320 0.001 0.000 0.205 2522 K C 2.454 178.740 176.600 -0.524 0.000 1.051 2522 K CA 0.702 56.751 56.287 -0.396 0.000 0.941 2522 K CB -0.141 32.047 32.500 -0.520 0.000 0.719 2522 K HN -0.018 nan 8.250 nan 0.000 0.440 2523 R N 1.100 121.339 120.500 -0.435 0.000 2.083 2523 R HA -0.157 4.183 4.340 0.001 0.000 0.237 2523 R C 1.861 178.120 176.300 -0.069 0.000 1.137 2523 R CA 1.997 57.931 56.100 -0.276 0.000 0.951 2523 R CB -0.869 29.168 30.300 -0.439 0.000 0.851 2523 R HN 0.475 nan 8.270 nan 0.000 0.434 2524 N N 0.414 119.059 118.700 -0.092 0.000 2.188 2524 N HA -0.193 4.548 4.740 0.001 0.000 0.184 2524 N C 1.722 177.242 175.510 0.018 0.000 1.018 2524 N CA 1.153 54.203 53.050 -0.001 0.000 0.858 2524 N CB -0.075 38.403 38.487 -0.016 0.000 0.989 2524 N HN 0.402 nan 8.380 nan 0.000 0.426 2525 E N 0.693 120.857 120.200 -0.059 0.000 2.051 2525 E HA -0.141 4.210 4.350 0.001 0.000 0.192 2525 E C 2.211 178.778 176.600 -0.056 0.000 0.991 2525 E CA 0.763 57.122 56.400 -0.067 0.000 0.799 2525 E CB 0.008 29.642 29.700 -0.110 0.000 0.748 2525 E HN 0.418 nan 8.360 nan 0.000 0.449 2526 L N -0.101 121.079 121.223 -0.073 0.000 2.217 2526 L HA -0.131 4.209 4.340 0.001 0.000 0.211 2526 L C 2.381 179.322 176.870 0.119 0.000 1.107 2526 L CA 0.662 55.498 54.840 -0.006 0.000 0.783 2526 L CB -0.297 41.719 42.059 -0.073 0.000 0.919 2526 L HN 0.242 nan 8.230 nan 0.000 0.442 2527 Y N 0.567 120.883 120.300 0.026 0.000 2.439 2527 Y HA -0.169 4.382 4.550 0.002 0.000 0.292 2527 Y C 2.391 178.224 175.900 -0.112 0.000 1.130 2527 Y CA 1.193 59.225 58.100 -0.113 0.000 1.254 2527 Y CB 0.085 38.466 38.460 -0.132 0.000 1.000 2527 Y HN 0.184 nan 8.280 nan 0.000 0.554 2528 E N -0.285 119.864 120.200 -0.084 0.000 2.112 2528 E HA -0.141 4.209 4.350 0.001 0.000 0.190 2528 E C 1.511 178.021 176.600 -0.151 0.000 0.979 2528 E CA 1.114 57.434 56.400 -0.133 0.000 0.814 2528 E CB -0.030 29.639 29.700 -0.051 0.000 0.762 2528 E HN 0.638 nan 8.360 nan 0.000 0.460 2529 N N -0.070 118.564 118.700 -0.110 0.000 2.396 2529 N HA -0.088 4.653 4.740 0.001 0.000 0.180 2529 N C 1.644 177.083 175.510 -0.119 0.000 1.028 2529 N CA 0.654 53.648 53.050 -0.093 0.000 0.893 2529 N CB 0.010 38.462 38.487 -0.058 0.000 0.967 2529 N HN 0.115 nan 8.380 nan 0.000 0.440 2530 M N 0.254 119.747 119.600 -0.177 0.000 2.394 2530 M HA -0.042 4.438 4.480 0.001 0.000 0.264 2530 M C 1.067 177.219 176.300 -0.247 0.000 1.073 2530 M CA 0.926 56.102 55.300 -0.207 0.000 1.111 2530 M CB 0.336 32.764 32.600 -0.287 0.000 1.401 2530 M HN 0.031 nan 8.290 nan 0.000 0.448 2531 V N -1.091 118.650 119.914 -0.288 0.000 2.685 2531 V HA -0.094 4.026 4.120 0.001 0.000 0.244 2531 V C 1.969 177.975 176.094 -0.147 0.000 1.054 2531 V CA 1.793 63.948 62.300 -0.241 0.000 1.076 2531 V CB -0.684 30.972 31.823 -0.279 0.000 0.725 2531 V HN 0.568 nan 8.190 nan 0.000 0.467 2532 T N -1.837 112.642 114.554 -0.126 0.000 3.380 2532 T HA 0.423 4.774 4.350 0.001 0.000 0.250 2532 T C 1.008 175.665 174.700 -0.071 0.000 1.082 2532 T CA 0.769 62.817 62.100 -0.085 0.000 0.968 2532 T CB 0.336 69.161 68.868 -0.071 0.000 1.027 2532 T HN 0.387 nan 8.240 nan 0.000 0.575 2533 A N 0.465 123.237 122.820 -0.079 0.000 2.141 2533 A HA 0.549 4.870 4.320 0.001 0.000 0.201 2533 A C 0.947 178.495 177.584 -0.059 0.000 1.344 2533 A CA 0.239 52.240 52.037 -0.061 0.000 0.971 2533 A CB 0.301 19.267 19.000 -0.057 0.000 1.035 2533 A HN 0.902 nan 8.150 nan 0.000 0.480 2534 c N -1.396 117.159 118.600 -0.074 0.000 3.006 2534 c HA 0.696 5.266 4.570 0.001 0.000 0.359 2534 c C 0.064 174.109 174.090 -0.076 0.000 1.103 2534 c CA -0.851 55.438 56.329 -0.067 0.000 1.286 2534 c CB 0.830 43.302 42.510 -0.064 0.000 1.694 2534 c HN 0.282 nan 8.230 nan 0.000 0.511 2535 N N 0.704 119.367 118.700 -0.061 0.000 2.516 2535 N HA 0.173 4.914 4.740 0.001 0.000 0.197 2535 N C -0.104 175.376 175.510 -0.049 0.000 1.064 2535 N CA 0.374 53.390 53.050 -0.058 0.000 0.866 2535 N CB 0.708 39.166 38.487 -0.049 0.000 1.255 2535 N HN 0.753 nan 8.380 nan 0.000 0.447 2536 S N -0.623 115.052 115.700 -0.042 0.000 2.603 2536 S HA 0.665 5.136 4.470 0.001 0.000 0.274 2536 S C -0.998 173.581 174.600 -0.035 0.000 1.168 2536 S CA -0.619 57.559 58.200 -0.037 0.000 0.963 2536 S CB 2.296 65.478 63.200 -0.030 0.000 1.078 2536 S HN 0.307 nan 8.310 nan 0.000 0.477 2537 A N 2.691 125.489 122.820 -0.036 0.000 2.958 2537 A HA 0.343 4.664 4.320 0.001 0.000 0.214 2537 A C -0.040 177.525 177.584 -0.032 0.000 0.902 2537 A CA -0.735 51.282 52.037 -0.033 0.000 1.136 2537 A CB -0.180 18.797 19.000 -0.037 0.000 1.250 2537 A HN 0.708 nan 8.150 nan 0.000 0.497 2538 K N 0.055 120.438 120.400 -0.028 0.000 2.414 2538 K HA 0.395 4.716 4.320 0.001 0.000 0.272 2538 K C 0.203 176.790 176.600 -0.023 0.000 0.993 2538 K CA 0.284 56.556 56.287 -0.026 0.000 0.964 2538 K CB 0.121 32.608 32.500 -0.022 0.000 0.925 2538 K HN 0.557 nan 8.250 nan 0.000 0.487 2548 K N 0.645 121.035 120.400 -0.018 0.000 1.828 2548 K HA 0.469 4.790 4.320 0.001 0.000 0.268 2548 K C 0.797 177.389 176.600 -0.014 0.000 0.973 2548 K CA -0.779 55.498 56.287 -0.017 0.000 1.093 2548 K CB 0.886 33.373 32.500 -0.021 0.000 2.798 2548 K HN 0.013 nan 8.250 nan 0.000 1.015 2549 K N 1.591 121.982 120.400 -0.015 0.000 2.103 2549 K HA -0.037 4.284 4.320 0.001 0.000 0.215 2549 K C 1.682 178.275 176.600 -0.011 0.000 1.027 2549 K CA 1.393 57.672 56.287 -0.012 0.000 0.953 2549 K CB -0.288 32.203 32.500 -0.014 0.000 0.904 2549 K HN 0.587 nan 8.250 nan 0.000 0.454 2550 E N 0.513 120.705 120.200 -0.014 0.000 2.447 2550 E HA -0.003 4.348 4.350 0.001 0.000 0.204 2550 E C 2.122 178.714 176.600 -0.013 0.000 0.977 2550 E CA 0.137 56.530 56.400 -0.011 0.000 0.950 2550 E CB -0.805 28.887 29.700 -0.013 0.000 0.975 2550 E HN 0.231 nan 8.360 nan 0.000 0.496 2551 c N 2.870 121.457 118.600 -0.021 0.000 2.385 2551 c HA -0.202 4.368 4.570 0.001 0.000 0.275 2551 c C 2.990 177.072 174.090 -0.013 0.000 1.207 2551 c CA 2.684 58.996 56.329 -0.028 0.000 1.760 2551 c CB -1.333 41.153 42.510 -0.040 0.000 2.051 2551 c HN 0.670 nan 8.230 nan 0.000 0.467 2552 T N -1.301 113.249 114.554 -0.006 0.000 2.881 2552 T HA -0.210 4.140 4.350 0.001 0.000 0.270 2552 T C 1.729 176.454 174.700 0.041 0.000 1.068 2552 T CA 1.749 63.856 62.100 0.012 0.000 1.131 2552 T CB -0.708 68.165 68.868 0.007 0.000 0.871 2552 T HN 0.816 nan 8.240 nan 0.000 0.479 2553 E N 1.595 121.813 120.200 0.031 0.000 2.085 2553 E HA -0.158 4.192 4.350 0.001 0.000 0.194 2553 E C 2.408 179.042 176.600 0.057 0.000 0.994 2553 E CA 1.259 57.683 56.400 0.040 0.000 0.801 2553 E CB -0.372 29.342 29.700 0.023 0.000 0.743 2553 E HN 0.669 nan 8.360 nan 0.000 0.453 2554 A N 0.307 123.154 122.820 0.045 0.000 1.929 2554 A HA -0.137 4.184 4.320 0.001 0.000 0.216 2554 A C 2.477 180.138 177.584 0.129 0.000 1.176 2554 A CA 1.124 53.197 52.037 0.059 0.000 0.628 2554 A CB -0.692 18.313 19.000 0.009 0.000 0.816 2554 A HN 0.479 nan 8.150 nan 0.000 0.444 2555 c N -0.109 118.568 118.600 0.130 0.000 2.425 2555 c HA -0.052 4.519 4.570 0.001 0.000 0.277 2555 c C 2.666 176.959 174.090 0.338 0.000 1.280 2555 c CA 1.071 57.547 56.329 0.244 0.000 1.744 2555 c CB -0.719 41.877 42.510 0.144 0.000 1.989 2555 c HN 0.501 nan 8.230 nan 0.000 0.491 2556 K N 1.141 121.675 120.400 0.223 0.000 2.097 2556 K HA -0.072 4.248 4.320 0.001 0.000 0.205 2556 K C 1.501 178.208 176.600 0.179 0.000 1.050 2556 K CA 1.259 57.665 56.287 0.199 0.000 0.938 2556 K CB -0.712 31.867 32.500 0.133 0.000 0.718 2556 K HN 0.628 nan 8.250 nan 0.000 0.442 2557 N N 0.021 118.820 118.700 0.164 0.000 2.142 2557 N HA -0.176 4.565 4.740 0.001 0.000 0.186 2557 N C 1.868 177.495 175.510 0.194 0.000 1.023 2557 N CA 0.911 54.048 53.050 0.144 0.000 0.852 2557 N CB -0.210 38.334 38.487 0.095 0.000 0.998 2557 N HN 0.162 nan 8.380 nan 0.000 0.424 2558 Y N 1.245 121.615 120.300 0.117 0.000 2.145 2558 Y HA -0.184 4.367 4.550 0.001 0.000 0.286 2558 Y C 2.754 178.746 175.900 0.155 0.000 1.145 2558 Y CA 1.531 59.720 58.100 0.148 0.000 1.148 2558 Y CB -0.536 38.016 38.460 0.153 0.000 0.981 2558 Y HN -0.037 nan 8.280 nan 0.000 0.507 2559 S N 0.043 115.880 115.700 0.229 0.000 2.359 2559 S HA -0.272 4.199 4.470 0.001 0.000 0.224 2559 S C 1.986 176.588 174.600 0.005 0.000 1.035 2559 S CA 1.891 60.089 58.200 -0.005 0.000 1.018 2559 S CB -0.792 62.361 63.200 -0.080 0.000 0.876 2559 S HN 0.692 nan 8.310 nan 0.000 0.448 2560 N N 0.233 118.981 118.700 0.080 0.000 2.043 2560 N HA -0.148 4.593 4.740 0.001 0.000 0.193 2560 N C 1.537 177.096 175.510 0.083 0.000 1.037 2560 N CA 1.999 55.098 53.050 0.082 0.000 0.851 2560 N CB -0.724 37.826 38.487 0.105 0.000 1.027 2560 N HN 0.486 nan 8.380 nan 0.000 0.422 2561 F N 0.992 120.910 119.950 -0.053 0.000 2.065 2561 F HA -0.207 4.320 4.527 0.001 0.000 0.298 2561 F C 2.414 178.177 175.800 -0.062 0.000 1.112 2561 F CA 1.510 59.460 58.000 -0.083 0.000 1.212 2561 F CB -0.825 38.077 39.000 -0.164 0.000 0.975 2561 F HN -0.017 nan 8.300 nan 0.000 0.476 2562 I N 0.401 120.824 120.570 -0.245 0.000 2.248 2562 I HA -0.293 3.877 4.170 0.001 0.000 0.248 2562 I C 2.492 178.606 176.117 -0.004 0.000 1.107 2562 I CA 1.419 62.614 61.300 -0.176 0.000 1.373 2562 I CB -1.478 36.446 38.000 -0.127 0.000 1.055 2562 I HN 0.342 nan 8.210 nan 0.000 0.418 2563 L N -0.483 120.728 121.223 -0.020 0.000 2.341 2563 L HA -0.066 4.274 4.340 0.001 0.000 0.214 2563 L C 2.683 179.542 176.870 -0.018 0.000 1.115 2563 L CA 0.614 55.464 54.840 0.016 0.000 0.820 2563 L CB -0.485 41.587 42.059 0.021 0.000 0.944 2563 L HN 0.272 nan 8.230 nan 0.000 0.452 2564 I N -1.237 119.304 120.570 -0.048 0.000 2.233 2564 I HA -0.140 4.031 4.170 0.001 0.000 0.243 2564 I C 2.492 178.572 176.117 -0.062 0.000 1.093 2564 I CA 1.016 62.294 61.300 -0.037 0.000 1.380 2564 I CB -1.052 36.944 38.000 -0.008 0.000 1.067 2564 I HN 0.278 nan 8.210 nan 0.000 0.413 2565 K N 1.008 121.328 120.400 -0.132 0.000 2.217 2565 K HA -0.084 4.236 4.320 0.001 0.000 0.202 2565 K C 1.991 178.519 176.600 -0.121 0.000 1.051 2565 K CA 0.893 57.165 56.287 -0.024 0.000 0.952 2565 K CB -0.540 31.939 32.500 -0.036 0.000 0.736 2565 K HN 0.532 nan 8.250 nan 0.000 0.453 2566 K N 2.119 122.421 120.400 -0.164 0.000 2.001 2566 K HA -0.200 4.121 4.320 0.001 0.000 0.214 2566 K C 1.873 178.215 176.600 -0.429 0.000 1.050 2566 K CA 1.792 57.823 56.287 -0.426 0.000 0.934 2566 K CB 0.025 32.492 32.500 -0.054 0.000 0.718 2566 K HN 0.004 nan 8.250 nan 0.000 0.443 2567 K N 0.368 120.636 120.400 -0.221 0.000 2.057 2567 K HA -0.162 4.159 4.320 0.001 0.000 0.207 2567 K C 2.188 178.650 176.600 -0.230 0.000 1.049 2567 K CA 1.847 58.022 56.287 -0.187 0.000 0.931 2567 K CB -0.089 32.353 32.500 -0.098 0.000 0.714 2567 K HN 0.353 nan 8.250 nan 0.000 0.440 2568 E N -0.001 120.077 120.200 -0.203 0.000 2.051 2568 E HA -0.218 4.133 4.350 0.001 0.000 0.192 2568 E C 1.953 178.209 176.600 -0.573 0.000 0.991 2568 E CA 1.218 57.465 56.400 -0.256 0.000 0.799 2568 E CB -0.194 29.481 29.700 -0.042 0.000 0.748 2568 E HN 0.303 nan 8.360 nan 0.000 0.449 2569 Y N 1.985 121.791 120.300 -0.824 0.000 2.145 2569 Y HA -0.264 4.286 4.550 0.001 0.000 0.286 2569 Y C 2.241 177.701 175.900 -0.733 0.000 1.145 2569 Y CA 1.888 59.335 58.100 -1.088 0.000 1.148 2569 Y CB -0.149 37.602 38.460 -1.181 0.000 0.981 2569 Y HN -0.005 nan 8.280 nan 0.000 0.507 2570 Q N -0.904 118.548 119.800 -0.579 0.000 2.197 2570 Q HA -0.239 4.101 4.340 0.001 0.000 0.207 2570 Q C 2.554 178.311 176.000 -0.406 0.000 0.984 2570 Q CA 1.895 57.431 55.803 -0.446 0.000 0.869 2570 Q CB -0.329 28.224 28.738 -0.309 0.000 0.906 2570 Q HN 0.396 nan 8.270 nan 0.000 0.426 2571 S N -0.071 115.387 115.700 -0.404 0.000 2.362 2571 S HA -0.000 4.470 4.470 0.001 0.000 0.221 2571 S C 1.795 176.164 174.600 -0.385 0.000 1.032 2571 S CA 0.526 58.536 58.200 -0.317 0.000 0.973 2571 S CB -0.036 63.019 63.200 -0.242 0.000 0.849 2571 S HN 0.266 nan 8.310 nan 0.000 0.465 2572 L N 1.424 122.270 121.223 -0.628 0.000 2.046 2572 L HA -0.084 4.257 4.340 0.001 0.000 0.208 2572 L C 2.345 178.814 176.870 -0.668 0.000 1.077 2572 L CA 1.302 55.665 54.840 -0.795 0.000 0.747 2572 L CB -0.532 40.598 42.059 -1.549 0.000 0.896 2572 L HN 0.438 nan 8.230 nan 0.000 0.432 2573 N N -1.034 117.214 118.700 -0.754 0.000 2.396 2573 N HA -0.178 4.562 4.740 0.001 0.000 0.180 2573 N C 2.069 177.494 175.510 -0.142 0.000 1.028 2573 N CA 0.743 53.552 53.050 -0.401 0.000 0.893 2573 N CB 0.209 38.232 38.487 -0.774 0.000 0.967 2573 N HN 0.142 nan 8.380 nan 0.000 0.440 2574 S N 0.562 116.134 115.700 -0.214 0.000 2.368 2574 S HA -0.203 4.268 4.470 0.001 0.000 0.225 2574 S C 1.904 176.442 174.600 -0.104 0.000 1.030 2574 S CA 1.368 59.488 58.200 -0.134 0.000 0.999 2574 S CB -0.203 62.905 63.200 -0.153 0.000 0.844 2574 S HN 0.381 nan 8.310 nan 0.000 0.459 2575 Q N -0.280 119.443 119.800 -0.128 0.000 2.083 2575 Q HA -0.072 4.269 4.340 0.001 0.000 0.198 2575 Q C 1.833 177.745 176.000 -0.148 0.000 0.969 2575 Q CA 1.861 57.539 55.803 -0.207 0.000 0.838 2575 Q CB -0.819 27.701 28.738 -0.364 0.000 0.900 2575 Q HN 0.748 nan 8.270 nan 0.000 0.436 2576 Y N 0.994 121.272 120.300 -0.037 0.000 2.070 2576 Y HA -0.274 4.278 4.550 0.003 0.000 0.280 2576 Y C 1.672 177.634 175.900 0.104 0.000 1.148 2576 Y CA 2.414 60.658 58.100 0.240 0.000 1.125 2576 Y CB -0.349 38.450 38.460 0.567 0.000 0.975 2576 Y HN 0.217 nan 8.280 nan 0.000 0.492 2577 D N -0.046 120.448 120.400 0.157 0.000 2.123 2577 D HA -0.245 4.396 4.640 0.001 0.000 0.196 2577 D C 2.318 178.552 176.300 -0.110 0.000 0.992 2577 D CA 1.684 55.695 54.000 0.017 0.000 0.833 2577 D CB -0.450 40.399 40.800 0.082 0.000 0.954 2577 D HN 0.487 nan 8.370 nan 0.000 0.455 2578 M N 0.026 119.554 119.600 -0.120 0.000 2.132 2578 M HA -0.166 4.314 4.480 0.001 0.000 0.263 2578 M C 1.066 177.217 176.300 -0.248 0.000 1.065 2578 M CA 1.429 56.632 55.300 -0.163 0.000 1.122 2578 M CB 0.256 32.762 32.600 -0.157 0.000 1.365 2578 M HN -0.082 nan 8.290 nan 0.000 0.411 2579 N N -1.420 117.071 118.700 -0.347 0.000 2.724 2579 N HA 0.049 4.790 4.740 0.001 0.000 0.226 2579 N C 1.327 176.468 175.510 -0.615 0.000 1.030 2579 N CA 0.970 53.683 53.050 -0.561 0.000 1.038 2579 N CB -0.371 37.582 38.487 -0.890 0.000 1.475 2579 N HN 0.325 nan 8.380 nan 0.000 0.472 2580 Y N 1.663 121.698 120.300 -0.443 0.000 2.420 2580 Y HA 0.196 4.746 4.550 -0.001 0.000 0.292 2580 Y C 2.359 177.896 175.900 -0.604 0.000 1.119 2580 Y CA 0.713 58.526 58.100 -0.478 0.000 1.229 2580 Y CB 0.171 38.426 38.460 -0.341 0.000 1.026 2580 Y HN -0.019 nan 8.280 nan 0.000 0.554 2581 K N 0.831 120.824 120.400 -0.679 0.000 2.155 2581 K HA -0.192 4.128 4.320 0.001 0.000 0.203 2581 K C 1.827 178.249 176.600 -0.296 0.000 1.052 2581 K CA 1.278 57.221 56.287 -0.573 0.000 0.948 2581 K CB 0.050 32.234 32.500 -0.526 0.000 0.728 2581 K HN 0.353 nan 8.250 nan 0.000 0.448 2582 E N -0.457 119.578 120.200 -0.274 0.000 2.072 2582 E HA -0.098 4.253 4.350 0.001 0.000 0.190 2582 E C 1.246 177.742 176.600 -0.174 0.000 0.982 2582 E CA 1.480 57.764 56.400 -0.194 0.000 0.803 2582 E CB 0.244 29.830 29.700 -0.190 0.000 0.755 2582 E HN 0.269 nan 8.360 nan 0.000 0.453 2583 T N 0.802 115.231 114.554 -0.209 0.000 2.754 2583 T HA -0.045 4.306 4.350 0.001 0.000 0.238 2583 T C 0.326 174.944 174.700 -0.137 0.000 1.091 2583 T CA 0.953 62.952 62.100 -0.168 0.000 1.358 2583 T CB -0.060 68.691 68.868 -0.194 0.000 1.006 2583 T HN 0.095 nan 8.240 nan 0.000 0.411 2584 K N 0.739 121.051 120.400 -0.147 0.000 2.675 2584 K HA 0.739 5.059 4.320 0.001 0.000 0.224 2584 K C -0.875 175.633 176.600 -0.154 0.000 1.003 2584 K CA -0.720 55.499 56.287 -0.114 0.000 1.034 2584 K CB 1.466 33.932 32.500 -0.056 0.000 1.218 2584 K HN 0.263 nan 8.250 nan 0.000 0.507 2585 A N 2.937 125.627 122.820 -0.216 0.000 2.701 2585 A HA 0.247 4.568 4.320 0.001 0.000 0.297 2585 A C -0.085 177.344 177.584 -0.259 0.000 1.197 2585 A CA -0.385 51.430 52.037 -0.369 0.000 0.963 2585 A CB -0.450 18.258 19.000 -0.486 0.000 1.175 2585 A HN 0.922 nan 8.150 nan 0.000 0.531 2586 E N -0.615 119.526 120.200 -0.098 0.000 3.286 2586 E HA -0.295 4.056 4.350 0.001 0.000 0.292 2586 E C 0.599 177.195 176.600 -0.008 0.000 0.928 2586 E CA 0.884 57.279 56.400 -0.008 0.000 0.982 2586 E CB -1.683 28.064 29.700 0.079 0.000 1.500 2586 E HN 0.688 nan 8.360 nan 0.000 0.441 2587 K N -0.384 119.986 120.400 -0.050 0.000 3.274 2587 K HA -0.289 4.031 4.320 0.001 0.000 0.305 2587 K C -0.320 176.291 176.600 0.018 0.000 1.225 2587 K CA 1.701 57.968 56.287 -0.032 0.000 0.904 2587 K CB -0.464 32.022 32.500 -0.023 0.000 1.227 2587 K HN 0.241 nan 8.250 nan 0.000 0.453 2588 K N 1.232 121.661 120.400 0.049 0.000 2.219 2588 K HA 0.075 4.395 4.320 0.001 0.000 0.258 2588 K C 0.471 177.165 176.600 0.157 0.000 1.008 2588 K CA -0.341 56.012 56.287 0.110 0.000 0.928 2588 K CB 0.533 33.137 32.500 0.173 0.000 0.983 2588 K HN 0.091 nan 8.250 nan 0.000 0.484 2589 E N 0.555 120.853 120.200 0.164 0.000 2.391 2589 E HA -0.051 4.299 4.350 0.001 0.000 0.255 2589 E C 1.014 177.740 176.600 0.210 0.000 1.187 2589 E CA 0.185 56.711 56.400 0.209 0.000 0.941 2589 E CB 1.428 31.225 29.700 0.161 0.000 1.010 2589 E HN 0.575 nan 8.360 nan 0.000 0.458 2590 S N 1.623 117.437 115.700 0.190 0.000 2.359 2590 S HA -0.125 4.346 4.470 0.001 0.000 0.222 2590 S C -1.052 173.566 174.600 0.031 0.000 1.038 2590 S CA 1.716 59.828 58.200 -0.148 0.000 1.051 2590 S CB -0.802 62.381 63.200 -0.029 0.000 0.944 2590 S HN 0.312 nan 8.310 nan 0.000 0.433 2591 P HA 0.045 nan 4.420 nan 0.000 0.223 2591 P C 1.240 178.631 177.300 0.152 0.000 1.151 2591 P CA 0.725 63.949 63.100 0.206 0.000 0.787 2591 P CB -0.062 31.762 31.700 0.206 0.000 0.788 2592 E N -1.364 118.910 120.200 0.124 0.000 2.107 2592 E HA -0.177 4.173 4.350 0.001 0.000 0.191 2592 E C 1.858 178.508 176.600 0.083 0.000 0.982 2592 E CA 1.044 57.505 56.400 0.101 0.000 0.809 2592 E CB -0.683 29.081 29.700 0.107 0.000 0.756 2592 E HN 0.342 nan 8.360 nan 0.000 0.459 2593 Y N 0.297 120.539 120.300 -0.096 0.000 2.220 2593 Y HA -0.171 4.380 4.550 0.001 0.000 0.291 2593 Y C 1.832 177.591 175.900 -0.236 0.000 1.129 2593 Y CA 1.288 59.263 58.100 -0.209 0.000 1.161 2593 Y CB -0.415 37.840 38.460 -0.340 0.000 0.997 2593 Y HN -0.113 nan 8.280 nan 0.000 0.522 2594 F N 0.641 120.496 119.950 -0.157 0.000 2.604 2594 F HA 0.028 4.558 4.527 0.005 0.000 0.298 2594 F C 2.311 178.032 175.800 -0.132 0.000 1.131 2594 F CA 1.005 58.871 58.000 -0.223 0.000 1.457 2594 F CB -0.517 38.394 39.000 -0.147 0.000 1.095 2594 F HN -0.013 nan 8.300 nan 0.000 0.574 2595 K N 0.069 120.505 120.400 0.060 0.000 2.283 2595 K HA -0.133 4.188 4.320 0.001 0.000 0.202 2595 K C 0.446 177.045 176.600 -0.002 0.000 1.048 2595 K CA 1.429 57.743 56.287 0.045 0.000 0.948 2595 K CB 0.034 32.562 32.500 0.047 0.000 0.742 2595 K HN 0.147 nan 8.250 nan 0.000 0.458 2596 D N -0.692 119.667 120.400 -0.068 0.000 2.503 2596 D HA 0.017 4.658 4.640 0.001 0.000 0.218 2596 D C 1.107 177.332 176.300 -0.126 0.000 1.183 2596 D CA 0.034 53.990 54.000 -0.074 0.000 0.827 2596 D CB 0.773 41.542 40.800 -0.052 0.000 1.034 2596 D HN 0.001 nan 8.370 nan 0.000 0.510 2597 K N 0.602 120.885 120.400 -0.195 0.000 2.214 2597 K HA 0.081 4.402 4.320 0.001 0.000 0.210 2597 K C 0.801 177.380 176.600 -0.035 0.000 1.036 2597 K CA 0.552 56.714 56.287 -0.208 0.000 0.958 2597 K CB 0.259 32.456 32.500 -0.506 0.000 0.973 2597 K HN 0.126 nan 8.250 nan 0.000 0.466 2598 c N 2.296 120.920 118.600 0.040 0.000 2.582 2598 c HA 0.485 5.056 4.570 0.001 0.000 0.477 2598 c C 0.240 174.376 174.090 0.076 0.000 1.221 2598 c CA -1.462 54.927 56.329 0.099 0.000 1.572 2598 c CB -2.288 40.325 42.510 0.172 0.000 1.866 2598 c HN 0.551 nan 8.230 nan 0.000 0.594 2599 N N 0.907 119.634 118.700 0.045 0.000 1.202 2599 N HA -0.205 4.536 4.740 0.001 0.000 0.108 2599 N C 1.035 176.569 175.510 0.039 0.000 0.816 2599 N CA 1.444 54.515 53.050 0.036 0.000 0.848 2599 N CB -1.191 37.320 38.487 0.040 0.000 0.972 2599 N HN 0.685 nan 8.380 nan 0.000 0.645 2600 G N -0.166 108.656 108.800 0.037 0.000 3.088 2600 G HA2 0.071 4.032 3.960 0.001 0.000 0.217 2600 G HA3 0.071 4.032 3.960 0.001 0.000 0.217 2600 G C 0.189 175.120 174.900 0.051 0.000 1.159 2600 G CA 0.239 45.363 45.100 0.041 0.000 0.760 2600 G HN 0.605 nan 8.290 nan 0.000 0.550 2601 E N -0.329 119.900 120.200 0.049 0.000 2.423 2601 E HA 0.182 4.533 4.350 0.001 0.000 0.198 2601 E C 0.341 176.980 176.600 0.065 0.000 1.038 2601 E CA -0.261 56.168 56.400 0.048 0.000 1.011 2601 E CB -0.006 29.704 29.700 0.017 0.000 1.118 2601 E HN 0.296 nan 8.360 nan 0.000 0.451 2602 c N 0.201 118.851 118.600 0.083 0.000 3.785 2602 c HA 0.112 4.683 4.570 0.001 0.000 0.312 2602 c C 2.406 176.575 174.090 0.132 0.000 1.566 2602 c CA 0.233 56.620 56.329 0.096 0.000 1.837 2602 c CB -0.332 42.234 42.510 0.093 0.000 2.826 2602 c HN 0.545 nan 8.230 nan 0.000 0.667 2603 S N 0.994 116.765 115.700 0.118 0.000 2.428 2603 S HA -0.190 4.281 4.470 0.001 0.000 0.230 2603 S C 1.834 176.528 174.600 0.156 0.000 1.014 2603 S CA 1.427 59.694 58.200 0.112 0.000 0.957 2603 S CB -1.063 62.182 63.200 0.074 0.000 0.784 2603 S HN 0.810 nan 8.310 nan 0.000 0.499 2604 c N 1.092 119.823 118.600 0.219 0.000 2.409 2604 c HA 0.135 4.706 4.570 0.001 0.000 0.284 2604 c C 2.353 176.716 174.090 0.455 0.000 1.354 2604 c CA 0.070 56.623 56.329 0.372 0.000 1.787 2604 c CB -1.833 40.863 42.510 0.309 0.000 1.900 2604 c HN 0.543 nan 8.230 nan 0.000 0.520 2605 L N 1.260 122.683 121.223 0.334 0.000 2.056 2605 L HA -0.033 4.308 4.340 0.001 0.000 0.207 2605 L C 2.779 179.805 176.870 0.260 0.000 1.078 2605 L CA 2.381 57.396 54.840 0.292 0.000 0.749 2605 L CB -1.158 40.999 42.059 0.163 0.000 0.901 2605 L HN 0.594 nan 8.230 nan 0.000 0.433 2606 S N -0.979 114.828 115.700 0.179 0.000 2.421 2606 S HA -0.140 4.330 4.470 0.001 0.000 0.224 2606 S C 1.792 176.397 174.600 0.009 0.000 1.035 2606 S CA 0.726 58.989 58.200 0.106 0.000 0.953 2606 S CB 0.036 63.287 63.200 0.084 0.000 0.810 2606 S HN 0.438 nan 8.310 nan 0.000 0.497 2607 E N -1.272 118.909 120.200 -0.031 0.000 2.265 2607 E HA -0.110 4.240 4.350 0.001 0.000 0.196 2607 E C 0.486 176.721 176.600 -0.609 0.000 0.996 2607 E CA 1.106 57.329 56.400 -0.295 0.000 0.832 2607 E CB 0.076 29.591 29.700 -0.308 0.000 0.756 2607 E HN 0.743 nan 8.360 nan 0.000 0.491 2608 Y N -3.238 116.927 120.300 -0.224 0.000 2.476 2608 Y HA 0.199 4.750 4.550 0.001 0.000 0.261 2608 Y C 0.363 175.680 175.900 -0.972 0.000 1.077 2608 Y CA -0.373 57.362 58.100 -0.608 0.000 1.240 2608 Y CB 0.898 38.877 38.460 -0.802 0.000 1.317 2608 Y HN -0.022 nan 8.280 nan 0.000 0.540 2609 F N -1.572 118.300 119.950 -0.130 0.000 2.915 2609 F HA 0.290 4.817 4.527 0.000 0.000 0.347 2609 F C 1.691 177.462 175.800 -0.047 0.000 1.104 2609 F CA -0.381 57.456 58.000 -0.272 0.000 1.126 2609 F CB 0.514 39.121 39.000 -0.654 0.000 1.145 2609 F HN -0.262 nan 8.300 nan 0.000 0.541 2610 K N 1.291 121.760 120.400 0.115 0.000 2.005 2610 K HA -0.047 4.274 4.320 0.001 0.000 0.206 2610 K C 1.413 178.081 176.600 0.112 0.000 1.044 2610 K CA 2.049 58.418 56.287 0.136 0.000 0.942 2610 K CB -0.488 32.070 32.500 0.096 0.000 0.727 2610 K HN -0.035 nan 8.250 nan 0.000 0.439 2611 D N 0.068 120.498 120.400 0.050 0.000 2.126 2611 D HA -0.114 4.527 4.640 0.001 0.000 0.190 2611 D C -0.049 176.294 176.300 0.071 0.000 1.001 2611 D CA 1.542 55.567 54.000 0.043 0.000 0.841 2611 D CB 0.066 40.867 40.800 0.002 0.000 0.949 2611 D HN 0.335 nan 8.370 nan 0.000 0.446 2612 E N -2.324 117.925 120.200 0.081 0.000 2.416 2612 E HA 0.316 4.666 4.350 0.001 0.000 0.273 2612 E C -0.660 176.058 176.600 0.197 0.000 0.935 2612 E CA -0.513 55.959 56.400 0.121 0.000 0.784 2612 E CB 1.641 31.395 29.700 0.090 0.000 1.301 2612 E HN -0.091 nan 8.360 nan 0.000 0.454 2613 T N -0.702 114.013 114.554 0.269 0.000 4.647 2613 T HA 0.073 4.424 4.350 0.001 0.000 0.224 2613 T C 0.463 175.408 174.700 0.409 0.000 0.928 2613 T CA -0.376 62.005 62.100 0.467 0.000 0.969 2613 T CB -0.798 68.308 68.868 0.397 0.000 1.425 2613 T HN 0.461 nan 8.240 nan 0.000 1.045 2614 R N -0.739 119.904 120.500 0.238 0.000 2.535 2614 R HA 0.161 4.502 4.340 0.001 0.000 0.233 2614 R C 0.389 176.794 176.300 0.174 0.000 1.202 2614 R CA -0.414 55.768 56.100 0.137 0.000 1.205 2614 R CB -0.709 29.595 30.300 0.007 0.000 1.153 2614 R HN 0.523 nan 8.270 nan 0.000 0.512 2615 W N 1.768 123.211 121.300 0.239 0.000 2.425 2615 W HA 0.001 4.660 4.660 -0.000 0.000 0.277 2615 W C 1.458 178.046 176.519 0.115 0.000 1.231 2615 W CA 0.667 58.146 57.345 0.224 0.000 1.248 2615 W CB 0.029 29.555 29.460 0.110 0.000 1.117 2615 W HN 0.122 nan 8.180 nan 0.000 0.568 2616 K N 0.004 120.590 120.400 0.310 0.000 2.147 2616 K HA -0.132 4.189 4.320 0.001 0.000 0.205 2616 K C -0.130 176.549 176.600 0.133 0.000 1.049 2616 K CA 1.011 57.410 56.287 0.187 0.000 0.936 2616 K CB -0.515 32.077 32.500 0.153 0.000 0.722 2616 K HN 0.132 nan 8.250 nan 0.000 0.446 2617 N N 0.849 119.624 118.700 0.126 0.000 2.626 2617 N HA 0.125 4.865 4.740 0.001 0.000 0.242 2617 N C -2.381 173.161 175.510 0.054 0.000 1.005 2617 N CA -1.519 51.584 53.050 0.089 0.000 0.905 2617 N CB 1.748 40.300 38.487 0.108 0.000 1.128 2617 N HN -0.178 nan 8.380 nan 0.000 0.512 2618 P HA -0.075 nan 4.420 nan 0.000 0.223 2618 P C 0.305 177.609 177.300 0.008 0.000 1.151 2618 P CA 0.962 64.026 63.100 -0.059 0.000 0.787 2618 P CB 0.129 31.695 31.700 -0.224 0.000 0.788 2619 Y N -0.222 120.185 120.300 0.177 0.000 2.519 2619 Y HA 0.027 4.578 4.550 0.001 0.000 0.287 2619 Y C 2.177 178.119 175.900 0.070 0.000 1.128 2619 Y CA 0.363 58.542 58.100 0.132 0.000 1.282 2619 Y CB -0.791 37.729 38.460 0.099 0.000 1.027 2619 Y HN -0.026 nan 8.280 nan 0.000 0.551 2620 E N -0.166 120.133 120.200 0.166 0.000 2.347 2620 E HA -0.087 4.264 4.350 0.001 0.000 0.196 2620 E C 1.598 178.204 176.600 0.011 0.000 1.008 2620 E CA 1.326 57.773 56.400 0.078 0.000 0.852 2620 E CB -0.378 29.352 29.700 0.050 0.000 0.783 2620 E HN 0.511 nan 8.360 nan 0.000 0.505 2621 T N -0.932 113.609 114.554 -0.022 0.000 3.317 2621 T HA 0.148 4.498 4.350 0.001 0.000 0.250 2621 T C 0.426 175.054 174.700 -0.120 0.000 1.106 2621 T CA -0.210 61.814 62.100 -0.127 0.000 0.986 2621 T CB -0.252 68.409 68.868 -0.346 0.000 1.010 2621 T HN -0.202 nan 8.240 nan 0.000 0.560 2622 L N 3.583 124.786 121.223 -0.034 0.000 2.265 2622 L HA 0.348 4.688 4.340 0.001 0.000 0.289 2622 L C 1.327 178.224 176.870 0.045 0.000 1.033 2622 L CA -0.611 54.204 54.840 -0.042 0.000 0.814 2622 L CB 1.342 43.457 42.059 0.094 0.000 1.203 2622 L HN 0.252 nan 8.230 nan 0.000 0.423 2623 D N 0.881 121.321 120.400 0.067 0.000 2.144 2623 D HA -0.149 4.491 4.640 0.001 0.000 0.200 2623 D C 0.317 176.676 176.300 0.097 0.000 0.978 2623 D CA 0.431 54.494 54.000 0.105 0.000 0.833 2623 D CB 0.093 40.976 40.800 0.138 0.000 0.961 2623 D HN 0.533 nan 8.370 nan 0.000 0.470 2624 D N 0.595 121.084 120.400 0.148 0.000 2.348 2624 D HA 0.059 4.700 4.640 0.001 0.000 0.253 2624 D C 1.190 177.526 176.300 0.061 0.000 1.161 2624 D CA 0.100 54.157 54.000 0.095 0.000 0.876 2624 D CB 1.418 42.270 40.800 0.087 0.000 1.160 2624 D HN 0.023 nan 8.370 nan 0.000 0.459 2625 T N 0.448 115.022 114.554 0.032 0.000 3.081 2625 T HA 0.023 4.374 4.350 0.001 0.000 0.255 2625 T C 1.367 176.069 174.700 0.003 0.000 1.113 2625 T CA 0.209 62.320 62.100 0.019 0.000 1.082 2625 T CB 0.030 68.905 68.868 0.012 0.000 0.939 2625 T HN 0.274 nan 8.240 nan 0.000 0.506 2626 E N 1.208 121.406 120.200 -0.004 0.000 2.028 2626 E HA 0.033 4.383 4.350 0.001 0.000 0.190 2626 E C 2.178 178.758 176.600 -0.033 0.000 0.984 2626 E CA 0.685 57.074 56.400 -0.020 0.000 0.800 2626 E CB -0.724 28.962 29.700 -0.025 0.000 0.758 2626 E HN 0.278 nan 8.360 nan 0.000 0.448 2627 V N 0.739 120.629 119.914 -0.041 0.000 2.970 2627 V HA -0.168 3.952 4.120 0.001 0.000 0.260 2627 V C 2.037 178.096 176.094 -0.059 0.000 1.100 2627 V CA 1.455 63.716 62.300 -0.065 0.000 1.122 2627 V CB -0.230 31.528 31.823 -0.107 0.000 0.721 2627 V HN 0.197 nan 8.190 nan 0.000 0.483 2628 K N 0.138 120.521 120.400 -0.029 0.000 2.152 2628 K HA -0.221 4.100 4.320 0.001 0.000 0.206 2628 K C 1.705 178.254 176.600 -0.084 0.000 1.048 2628 K CA 2.236 58.507 56.287 -0.027 0.000 0.933 2628 K CB -0.161 32.348 32.500 0.015 0.000 0.721 2628 K HN 0.659 nan 8.250 nan 0.000 0.447 2629 N N -0.172 118.486 118.700 -0.070 0.000 2.376 2629 N HA -0.051 4.690 4.740 0.001 0.000 0.177 2629 N C 1.082 176.531 175.510 -0.102 0.000 1.024 2629 N CA 0.946 53.949 53.050 -0.079 0.000 0.893 2629 N CB 0.057 38.515 38.487 -0.049 0.000 0.980 2629 N HN 0.285 nan 8.380 nan 0.000 0.439 2630 N N -0.027 118.613 118.700 -0.100 0.000 2.244 2630 N HA -0.061 4.679 4.740 0.001 0.000 0.183 2630 N C 1.057 176.485 175.510 -0.138 0.000 1.016 2630 N CA 0.883 53.875 53.050 -0.097 0.000 0.866 2630 N CB 0.003 38.443 38.487 -0.079 0.000 0.980 2630 N HN 0.269 nan 8.380 nan 0.000 0.430 2631 c N -0.160 118.309 118.600 -0.218 0.000 2.485 2631 c HA 0.191 4.761 4.570 0.001 0.000 0.277 2631 c C 1.908 175.669 174.090 -0.549 0.000 1.376 2631 c CA 0.028 56.129 56.329 -0.380 0.000 1.759 2631 c CB -0.662 41.539 42.510 -0.516 0.000 1.970 2631 c HN 0.461 nan 8.230 nan 0.000 0.509 2632 M N -0.234 119.111 119.600 -0.426 0.000 2.549 2632 M HA 0.137 4.618 4.480 0.001 0.000 0.273 2632 M C 1.485 177.701 176.300 -0.139 0.000 1.213 2632 M CA -0.120 54.995 55.300 -0.307 0.000 0.976 2632 M CB -0.160 32.307 32.600 -0.222 0.000 1.457 2632 M HN 0.559 nan 8.290 nan 0.000 0.485 2633 c N 1.454 119.981 118.600 -0.121 0.000 2.508 2633 c HA 0.294 4.865 4.570 0.001 0.000 0.280 2633 c C 1.241 175.307 174.090 -0.040 0.000 1.262 2633 c CA 1.735 58.024 56.329 -0.067 0.000 1.706 2633 c CB -0.306 42.169 42.510 -0.059 0.000 2.078 2633 c HN 0.577 nan 8.230 nan 0.000 0.480 2634 K N 0.000 120.380 120.400 -0.033 0.000 2.780 2634 K HA 0.000 4.321 4.320 0.001 0.000 0.191 2634 K CA 0.000 nan 56.287 nan 0.000 0.838 2634 K CB 0.000 nan 32.500 nan 0.000 1.064 2634 K HN 0.000 nan 8.250 nan 0.000 0.543