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 1l0w_1_B DATA FIRST_RESID 1001 DATA SEQUENCE MRRTHYAGSL RETHVGEEVV LEGWVNRRRD LGGLIFLDLR DREGLVQLVA DATA SEQUENCE HPASPAYATA ERVRPEWVVR AKGLVRLRPE PNPRLATGRV EVELSALEVL DATA SEQUENCE AEAKTPPFPV DAGWRGEEEK EASEELRLKY RYLDLRRRRM QENLRLRHRV DATA SEQUENCE IKAIWDFLDR EGFVQVETPF LTKSTPEGAR DFLVPYRHEP GLFYALPQSP DATA SEQUENCE QLFKQMLMVA GLDRYFQIAR CFRDEDLRAD RQPDFTQLDL EMSFVEVEDV DATA SEQUENCE LELNERLMAH VFREALGVEL PLPFPRLSYE EAMERYGSDK PDLRFGLELK DATA SEQUENCE EVGPLFRQSG FRVFQEAESV KALALPKALS RKEVAELEEV AKRHKAQGLA DATA SEQUENCE WARVEEGGFS GGVAKFLEPV REALLQATEA RPGDTLLFVA GPRKVAATAL DATA SEQUENCE GAVRLRAADL LGLKREGFRF LWVVDFPLLE WDEEEEAWTY MHHPFTSPHP DATA SEQUENCE EDLPLLEKDP GRVRALAYDL VLNGVEVGGG SIRIHDPRLQ ARVFRLLGIG DATA SEQUENCE EEEQREKFGF FLEALEYGAP PHGGIAWGLD RLLALMTGSP SIREVIAFPK DATA SEQUENCE NKEGKDPLTG APSPVPEEQL RELGLMVVRP 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 1001 M HA 0.000 nan 4.480 nan 0.000 0.227 1001 M C 0.000 176.267 176.300 -0.055 0.000 1.140 1001 M CA 0.000 55.272 55.300 -0.046 0.000 0.988 1001 M CB 0.000 32.572 32.600 -0.046 0.000 1.302 1002 R N 4.037 124.504 120.500 -0.055 0.000 2.538 1002 R HA 0.022 4.362 4.340 -0.000 0.000 0.273 1002 R C -0.205 176.050 176.300 -0.074 0.000 0.967 1002 R CA 0.683 56.742 56.100 -0.068 0.000 1.101 1002 R CB 0.082 30.344 30.300 -0.063 0.000 0.908 1002 R HN 0.407 nan 8.270 nan 0.000 0.411 1003 R N 0.616 121.056 120.500 -0.099 0.000 2.679 1003 R HA 0.121 4.461 4.340 -0.000 0.000 0.269 1003 R C 1.000 177.232 176.300 -0.113 0.000 1.076 1003 R CA 0.108 56.148 56.100 -0.101 0.000 1.160 1003 R CB 0.224 30.438 30.300 -0.145 0.000 1.054 1003 R HN 0.633 nan 8.270 nan 0.000 0.507 1004 T N -2.898 111.617 114.554 -0.064 0.000 3.034 1004 T HA 0.143 4.493 4.350 -0.000 0.000 0.248 1004 T C -0.011 174.455 174.700 -0.391 0.000 1.040 1004 T CA 0.146 62.163 62.100 -0.138 0.000 1.107 1004 T CB -0.140 68.771 68.868 0.071 0.000 0.932 1004 T HN 0.747 nan 8.240 nan 0.000 0.474 1005 H N -1.399 117.592 119.070 -0.132 0.000 3.008 1005 H HA 0.541 5.097 4.556 -0.000 0.000 0.354 1005 H C -1.679 173.556 175.328 -0.154 0.000 1.252 1005 H CA -1.330 54.640 56.048 -0.131 0.000 1.117 1005 H CB 0.642 30.320 29.762 -0.141 0.000 1.857 1005 H HN 0.105 nan 8.280 nan 0.000 0.547 1006 Y N 0.338 120.692 120.300 0.090 0.000 2.346 1006 Y HA 0.266 4.816 4.550 -0.000 0.000 0.330 1006 Y C 1.570 177.492 175.900 0.036 0.000 1.178 1006 Y CA 0.324 58.455 58.100 0.052 0.000 1.331 1006 Y CB 1.053 39.542 38.460 0.049 0.000 1.253 1006 Y HN 0.879 nan 8.280 nan 0.000 0.529 1007 A N 2.678 125.606 122.820 0.179 0.000 1.883 1007 A HA -0.183 4.137 4.320 -0.000 0.000 0.217 1007 A C 2.212 179.844 177.584 0.080 0.000 1.186 1007 A CA 1.950 54.040 52.037 0.087 0.000 0.624 1007 A CB -1.291 17.748 19.000 0.064 0.000 0.822 1007 A HN 1.016 nan 8.150 nan 0.000 0.444 1008 G N -1.509 107.356 108.800 0.110 0.000 2.956 1008 G HA2 0.186 4.146 3.960 -0.000 0.000 0.207 1008 G HA3 0.186 4.146 3.960 -0.000 0.000 0.207 1008 G C 1.174 176.132 174.900 0.096 0.000 1.162 1008 G CA 0.849 46.005 45.100 0.094 0.000 0.796 1008 G HN 0.458 nan 8.290 nan 0.000 0.527 1009 S N 0.011 115.776 115.700 0.108 0.000 2.524 1009 S HA 0.234 4.704 4.470 -0.000 0.000 0.216 1009 S C 0.699 175.326 174.600 0.045 0.000 0.987 1009 S CA -0.454 57.812 58.200 0.109 0.000 0.909 1009 S CB 0.178 63.486 63.200 0.180 0.000 0.781 1009 S HN 0.070 nan 8.310 nan 0.000 0.521 1010 L N 3.232 124.422 121.223 -0.056 0.000 2.490 1010 L HA 0.252 4.592 4.340 -0.000 0.000 0.274 1010 L C 0.692 177.627 176.870 0.109 0.000 1.201 1010 L CA 1.130 55.888 54.840 -0.138 0.000 0.869 1010 L CB -0.267 41.699 42.059 -0.156 0.000 1.123 1010 L HN 0.163 nan 8.230 nan 0.000 0.484 1011 R N 1.700 122.421 120.500 0.367 0.000 2.869 1011 R HA 0.206 4.546 4.340 -0.000 0.000 0.263 1011 R C 0.740 177.148 176.300 0.179 0.000 1.066 1011 R CA -0.795 55.451 56.100 0.243 0.000 0.960 1011 R CB 0.633 31.052 30.300 0.199 0.000 1.221 1011 R HN 0.557 nan 8.270 nan 0.000 0.474 1012 E N 0.437 120.687 120.200 0.083 0.000 2.267 1012 E HA -0.160 4.190 4.350 -0.000 0.000 0.197 1012 E C 0.784 177.386 176.600 0.003 0.000 0.998 1012 E CA 1.847 58.273 56.400 0.043 0.000 0.830 1012 E CB 0.257 29.974 29.700 0.028 0.000 0.751 1012 E HN 0.643 nan 8.360 nan 0.000 0.491 1013 T N -3.166 111.353 114.554 -0.059 0.000 3.085 1013 T HA -0.072 4.278 4.350 -0.000 0.000 0.263 1013 T C 0.927 175.474 174.700 -0.255 0.000 1.127 1013 T CA 0.884 62.882 62.100 -0.170 0.000 1.103 1013 T CB -0.317 68.403 68.868 -0.246 0.000 0.921 1013 T HN 0.288 nan 8.240 nan 0.000 0.510 1014 H N 0.045 119.112 119.070 -0.006 0.000 2.551 1014 H HA 0.465 5.020 4.556 -0.000 0.000 0.271 1014 H C 0.371 175.679 175.328 -0.032 0.000 0.984 1014 H CA -0.461 55.568 56.048 -0.032 0.000 1.164 1014 H CB 0.095 29.791 29.762 -0.109 0.000 1.437 1014 H HN 0.189 nan 8.280 nan 0.000 0.550 1015 V N 1.136 121.085 119.914 0.059 0.000 2.617 1015 V HA 0.082 4.202 4.120 -0.000 0.000 0.304 1015 V C 1.534 177.645 176.094 0.028 0.000 1.040 1015 V CA 1.655 63.977 62.300 0.037 0.000 1.149 1015 V CB 0.346 32.183 31.823 0.023 0.000 0.914 1015 V HN 0.868 nan 8.190 nan 0.000 0.487 1016 G N 3.666 112.481 108.800 0.025 0.000 2.258 1016 G HA2 -0.189 3.771 3.960 -0.000 0.000 0.233 1016 G HA3 -0.189 3.771 3.960 -0.000 0.000 0.233 1016 G C 0.104 175.020 174.900 0.028 0.000 1.006 1016 G CA 0.112 45.225 45.100 0.022 0.000 0.620 1016 G HN 0.648 nan 8.290 nan 0.000 0.511 1017 E N 1.060 121.283 120.200 0.039 0.000 2.349 1017 E HA 0.448 4.798 4.350 -0.000 0.000 0.265 1017 E C -0.143 176.475 176.600 0.030 0.000 1.064 1017 E CA -0.253 56.176 56.400 0.049 0.000 0.886 1017 E CB 0.729 30.481 29.700 0.086 0.000 1.036 1017 E HN 0.507 nan 8.360 nan 0.000 0.413 1018 E N 1.245 121.469 120.200 0.040 0.000 2.200 1018 E HA 0.311 4.661 4.350 -0.000 0.000 0.283 1018 E C -1.020 175.604 176.600 0.041 0.000 1.015 1018 E CA -0.374 56.043 56.400 0.029 0.000 0.819 1018 E CB 1.984 31.701 29.700 0.028 0.000 1.081 1018 E HN 0.051 nan 8.360 nan 0.000 0.397 1019 V N 3.532 123.456 119.914 0.016 0.000 2.960 1019 V HA 0.476 4.596 4.120 -0.000 0.000 0.315 1019 V C -1.142 174.964 176.094 0.020 0.000 1.087 1019 V CA -0.707 61.611 62.300 0.029 0.000 0.982 1019 V CB 2.299 34.084 31.823 -0.063 0.000 1.039 1019 V HN 0.407 nan 8.190 nan 0.000 0.437 1020 V N 6.296 126.232 119.914 0.037 0.000 2.443 1020 V HA 0.545 4.665 4.120 -0.000 0.000 0.293 1020 V C -0.518 175.573 176.094 -0.006 0.000 1.021 1020 V CA -0.400 61.901 62.300 0.002 0.000 0.848 1020 V CB 1.403 33.220 31.823 -0.010 0.000 0.998 1020 V HN 0.687 nan 8.190 nan 0.000 0.424 1021 L N 4.143 125.352 121.223 -0.024 0.000 2.341 1021 L HA 0.767 5.107 4.340 -0.000 0.000 0.267 1021 L C -0.420 176.418 176.870 -0.054 0.000 1.009 1021 L CA -0.669 54.152 54.840 -0.031 0.000 0.819 1021 L CB 2.439 44.486 42.059 -0.021 0.000 1.323 1021 L HN 0.540 nan 8.230 nan 0.000 0.425 1022 E N 0.295 120.456 120.200 -0.065 0.000 2.275 1022 E HA 0.738 5.088 4.350 -0.000 0.000 0.270 1022 E C -0.537 175.999 176.600 -0.106 0.000 0.882 1022 E CA -0.552 55.782 56.400 -0.109 0.000 0.758 1022 E CB 2.734 32.357 29.700 -0.130 0.000 1.195 1022 E HN 0.806 nan 8.360 nan 0.000 0.419 1023 G N 1.752 110.438 108.800 -0.190 0.000 2.356 1023 G HA2 0.196 4.156 3.960 -0.000 0.000 0.281 1023 G HA3 0.196 4.156 3.960 -0.000 0.000 0.281 1023 G C -1.800 172.957 174.900 -0.238 0.000 1.246 1023 G CA -0.850 44.167 45.100 -0.137 0.000 0.889 1023 G HN 0.317 nan 8.290 nan 0.000 0.486 1024 W N 0.269 121.543 121.300 -0.044 0.000 2.627 1024 W HA 0.551 5.211 4.660 -0.000 0.000 0.339 1024 W C -0.313 176.190 176.519 -0.026 0.000 1.058 1024 W CA -0.659 56.675 57.345 -0.019 0.000 1.223 1024 W CB 2.061 31.498 29.460 -0.038 0.000 1.389 1024 W HN 0.267 nan 8.180 nan 0.000 0.541 1025 V N 3.076 123.114 119.914 0.207 0.000 2.415 1025 V HA -0.120 4.000 4.120 -0.000 0.000 0.267 1025 V C 0.866 177.020 176.094 0.100 0.000 1.042 1025 V CA 0.343 62.707 62.300 0.106 0.000 1.000 1025 V CB 0.561 32.413 31.823 0.048 0.000 1.015 1025 V HN 0.551 nan 8.190 nan 0.000 0.478 1026 N N 4.030 122.766 118.700 0.061 0.000 2.250 1026 N HA 0.021 4.761 4.740 -0.000 0.000 0.181 1026 N C 0.719 176.257 175.510 0.046 0.000 1.017 1026 N CA 0.903 53.981 53.050 0.046 0.000 0.866 1026 N CB 0.271 38.772 38.487 0.024 0.000 0.985 1026 N HN 0.748 nan 8.380 nan 0.000 0.429 1027 R N -0.669 119.851 120.500 0.033 0.000 2.664 1027 R HA 0.270 4.610 4.340 -0.000 0.000 0.266 1027 R C -1.845 174.459 176.300 0.007 0.000 1.046 1027 R CA -0.763 55.348 56.100 0.019 0.000 0.885 1027 R CB 1.072 31.392 30.300 0.033 0.000 1.254 1027 R HN 0.036 nan 8.270 nan 0.000 0.465 1028 R N 3.287 123.778 120.500 -0.015 0.000 2.561 1028 R HA 0.523 4.863 4.340 -0.000 0.000 0.297 1028 R C -1.242 175.059 176.300 0.001 0.000 0.969 1028 R CA -0.697 55.393 56.100 -0.017 0.000 0.879 1028 R CB 1.577 31.828 30.300 -0.081 0.000 1.178 1028 R HN 0.651 nan 8.270 nan 0.000 0.445 1029 R N 2.405 122.933 120.500 0.046 0.000 2.513 1029 R HA 0.180 4.519 4.340 -0.000 0.000 0.301 1029 R C -1.383 174.971 176.300 0.089 0.000 0.968 1029 R CA -0.934 55.191 56.100 0.042 0.000 0.872 1029 R CB 1.820 32.125 30.300 0.009 0.000 1.177 1029 R HN 0.525 nan 8.270 nan 0.000 0.444 1030 D N 4.046 124.477 120.400 0.050 0.000 2.396 1030 D HA 0.118 4.758 4.640 -0.000 0.000 0.225 1030 D C -0.009 176.338 176.300 0.079 0.000 1.121 1030 D CA -0.473 53.571 54.000 0.074 0.000 0.853 1030 D CB 1.238 42.055 40.800 0.028 0.000 1.043 1030 D HN 0.267 nan 8.370 nan 0.000 0.500 1031 L N 2.964 124.270 121.223 0.137 0.000 2.685 1031 L HA 0.358 4.698 4.340 -0.000 0.000 0.233 1031 L C 1.086 178.016 176.870 0.100 0.000 1.173 1031 L CA -0.008 54.885 54.840 0.089 0.000 0.961 1031 L CB -0.187 41.914 42.059 0.070 0.000 1.217 1031 L HN 0.722 nan 8.230 nan 0.000 0.478 1032 G N -0.641 108.224 108.800 0.108 0.000 2.929 1032 G HA2 0.220 4.180 3.960 -0.000 0.000 0.335 1032 G HA3 0.220 4.180 3.960 -0.000 0.000 0.335 1032 G C 0.750 175.721 174.900 0.118 0.000 1.054 1032 G CA -0.029 45.128 45.100 0.095 0.000 1.067 1032 G HN 0.752 nan 8.290 nan 0.000 0.472 1033 G N -0.549 108.341 108.800 0.150 0.000 2.160 1033 G HA2 0.108 4.068 3.960 -0.000 0.000 0.251 1033 G HA3 0.108 4.068 3.960 -0.000 0.000 0.251 1033 G C 0.142 175.148 174.900 0.177 0.000 1.008 1033 G CA 0.729 45.911 45.100 0.138 0.000 0.724 1033 G HN 2.015 nan 8.290 nan 0.000 0.514 1034 L N 0.215 121.602 121.223 0.275 0.000 2.676 1034 L HA 0.504 4.844 4.340 -0.000 0.000 0.262 1034 L C -1.220 175.838 176.870 0.314 0.000 0.932 1034 L CA -0.813 54.202 54.840 0.293 0.000 0.932 1034 L CB 1.543 43.781 42.059 0.298 0.000 1.355 1034 L HN 0.026 nan 8.230 nan 0.000 0.421 1035 I N 4.717 125.411 120.570 0.207 0.000 2.354 1035 I HA 0.417 4.587 4.170 -0.000 0.000 0.292 1035 I C -0.516 175.619 176.117 0.031 0.000 0.989 1035 I CA -0.392 60.979 61.300 0.118 0.000 1.188 1035 I CB 1.426 39.373 38.000 -0.090 0.000 1.342 1035 I HN 0.316 nan 8.210 nan 0.000 0.457 1036 F N 6.342 126.295 119.950 0.005 0.000 2.444 1036 F HA 0.563 5.090 4.527 -0.000 0.000 0.342 1036 F C 0.029 175.820 175.800 -0.015 0.000 1.121 1036 F CA -0.615 57.389 58.000 0.008 0.000 0.997 1036 F CB 1.431 40.441 39.000 0.016 0.000 1.130 1036 F HN 0.120 nan 8.300 nan 0.000 0.454 1037 L N 3.661 124.947 121.223 0.105 0.000 2.362 1037 L HA 0.460 4.799 4.340 -0.000 0.000 0.275 1037 L C -0.917 175.993 176.870 0.066 0.000 0.998 1037 L CA -0.875 53.997 54.840 0.054 0.000 0.820 1037 L CB 1.777 43.832 42.059 -0.006 0.000 1.270 1037 L HN 0.419 nan 8.230 nan 0.000 0.415 1038 D N 4.271 124.709 120.400 0.062 0.000 2.396 1038 D HA 0.211 4.851 4.640 -0.000 0.000 0.225 1038 D C -0.479 175.843 176.300 0.038 0.000 1.121 1038 D CA -0.240 53.796 54.000 0.060 0.000 0.853 1038 D CB 2.194 43.034 40.800 0.066 0.000 1.043 1038 D HN 0.115 nan 8.370 nan 0.000 0.500 1039 L N 2.925 124.166 121.223 0.031 0.000 2.305 1039 L HA 0.344 4.684 4.340 -0.000 0.000 0.281 1039 L C 0.020 176.894 176.870 0.006 0.000 1.085 1039 L CA -0.058 54.797 54.840 0.025 0.000 0.813 1039 L CB 0.927 42.996 42.059 0.016 0.000 1.157 1039 L HN 0.351 nan 8.230 nan 0.000 0.436 1040 R N 3.961 124.463 120.500 0.003 0.000 2.670 1040 R HA 0.542 4.882 4.340 -0.000 0.000 0.289 1040 R C -1.504 174.788 176.300 -0.014 0.000 0.965 1040 R CA -0.365 55.659 56.100 -0.127 0.000 0.899 1040 R CB 1.882 31.966 30.300 -0.360 0.000 1.173 1040 R HN 0.851 nan 8.270 nan 0.000 0.456 1041 D N 1.660 121.987 120.400 -0.122 0.000 2.664 1041 D HA 0.125 4.765 4.640 -0.000 0.000 0.292 1041 D C 0.564 176.766 176.300 -0.165 0.000 1.214 1041 D CA -0.805 53.213 54.000 0.030 0.000 0.932 1041 D CB 0.585 41.529 40.800 0.239 0.000 1.420 1041 D HN 0.582 nan 8.370 nan 0.000 0.471 1042 R N -0.360 120.127 120.500 -0.022 0.000 2.154 1042 R HA -0.132 4.208 4.340 -0.000 0.000 0.248 1042 R C 0.786 177.118 176.300 0.052 0.000 1.155 1042 R CA 1.465 57.567 56.100 0.002 0.000 0.979 1042 R CB -0.533 29.758 30.300 -0.014 0.000 0.869 1042 R HN 0.324 nan 8.270 nan 0.000 0.452 1043 E N 0.584 120.772 120.200 -0.020 0.000 2.442 1043 E HA 0.179 4.529 4.350 -0.000 0.000 0.195 1043 E C 0.860 177.545 176.600 0.141 0.000 1.030 1043 E CA 0.883 57.297 56.400 0.023 0.000 0.869 1043 E CB 0.831 30.503 29.700 -0.047 0.000 0.857 1043 E HN 0.586 nan 8.360 nan 0.000 0.505 1044 G N 0.037 108.907 108.800 0.116 0.000 2.325 1044 G HA2 0.020 3.980 3.960 -0.000 0.000 0.285 1044 G HA3 0.020 3.980 3.960 -0.000 0.000 0.285 1044 G C -1.412 173.512 174.900 0.040 0.000 1.303 1044 G CA -0.920 44.291 45.100 0.184 0.000 0.970 1044 G HN 0.018 nan 8.290 nan 0.000 0.490 1045 L N 0.128 121.412 121.223 0.102 0.000 2.334 1045 L HA 0.805 5.145 4.340 -0.000 0.000 0.275 1045 L C 0.310 177.218 176.870 0.062 0.000 1.036 1045 L CA -1.255 53.620 54.840 0.059 0.000 0.807 1045 L CB 1.677 43.795 42.059 0.099 0.000 1.231 1045 L HN 0.876 nan 8.230 nan 0.000 0.438 1046 V N -0.286 119.656 119.914 0.047 0.000 2.760 1046 V HA 0.421 4.540 4.120 -0.000 0.000 0.309 1046 V C -0.693 175.432 176.094 0.052 0.000 1.077 1046 V CA -0.855 61.472 62.300 0.045 0.000 0.910 1046 V CB 1.556 33.394 31.823 0.024 0.000 1.008 1046 V HN 0.860 nan 8.190 nan 0.000 0.424 1047 Q N 3.130 122.971 119.800 0.069 0.000 2.288 1047 Q HA 0.634 4.973 4.340 -0.000 0.000 0.258 1047 Q C -1.331 174.702 176.000 0.056 0.000 0.957 1047 Q CA -0.442 55.419 55.803 0.097 0.000 0.919 1047 Q CB 1.246 30.078 28.738 0.157 0.000 1.185 1047 Q HN 0.835 nan 8.270 nan 0.000 0.408 1048 L N 3.814 125.056 121.223 0.032 0.000 2.325 1048 L HA 0.604 4.944 4.340 -0.000 0.000 0.278 1048 L C -0.823 175.978 176.870 -0.115 0.000 1.023 1048 L CA -1.157 53.666 54.840 -0.028 0.000 0.811 1048 L CB 1.872 43.913 42.059 -0.029 0.000 1.249 1048 L HN 0.388 nan 8.230 nan 0.000 0.431 1049 V N 1.780 121.591 119.914 -0.173 0.000 2.444 1049 V HA 0.687 4.807 4.120 -0.000 0.000 0.294 1049 V C -0.028 175.965 176.094 -0.168 0.000 1.022 1049 V CA -0.539 61.549 62.300 -0.354 0.000 0.850 1049 V CB 1.575 33.168 31.823 -0.384 0.000 0.992 1049 V HN 0.852 nan 8.190 nan 0.000 0.426 1050 A N 3.944 126.666 122.820 -0.164 0.000 2.304 1050 A HA 0.832 5.152 4.320 -0.000 0.000 0.314 1050 A C -0.527 177.128 177.584 0.119 0.000 1.187 1050 A CA -0.567 51.433 52.037 -0.061 0.000 0.810 1050 A CB 0.388 19.358 19.000 -0.050 0.000 1.183 1050 A HN 1.134 nan 8.150 nan 0.000 0.487 1051 H N 1.059 120.174 119.070 0.075 0.000 2.533 1051 H HA 0.572 5.127 4.556 -0.000 0.000 0.343 1051 H C -2.503 172.682 175.328 -0.238 0.000 1.160 1051 H CA -2.479 53.546 56.048 -0.037 0.000 1.218 1051 H CB 0.668 30.383 29.762 -0.079 0.000 1.566 1051 H HN 0.287 nan 8.280 nan 0.000 0.522 1052 P HA -0.191 nan 4.420 nan 0.000 0.218 1052 P C 1.051 178.152 177.300 -0.332 0.000 1.146 1052 P CA 2.066 64.636 63.100 -0.883 0.000 0.813 1052 P CB 0.022 31.340 31.700 -0.636 0.000 0.778 1053 A N -1.147 121.613 122.820 -0.100 0.000 2.169 1053 A HA 0.055 4.374 4.320 -0.000 0.000 0.212 1053 A C 1.387 178.956 177.584 -0.025 0.000 1.153 1053 A CA 0.376 52.414 52.037 0.002 0.000 0.756 1053 A CB -0.776 18.291 19.000 0.112 0.000 0.813 1053 A HN 0.239 nan 8.150 nan 0.000 0.471 1054 S N -0.202 115.384 115.700 -0.190 0.000 2.565 1054 S HA 0.394 4.864 4.470 -0.000 0.000 0.274 1054 S C -1.694 172.850 174.600 -0.092 0.000 1.309 1054 S CA -1.261 56.790 58.200 -0.248 0.000 1.043 1054 S CB 0.973 63.815 63.200 -0.597 0.000 0.939 1054 S HN 0.102 nan 8.310 nan 0.000 0.504 1055 P HA 0.119 nan 4.420 nan 0.000 0.226 1055 P C 0.719 178.012 177.300 -0.013 0.000 1.153 1055 P CA 0.707 63.794 63.100 -0.021 0.000 0.777 1055 P CB 0.051 31.738 31.700 -0.020 0.000 0.794 1056 A N -2.154 120.644 122.820 -0.037 0.000 2.178 1056 A HA -0.077 4.242 4.320 -0.000 0.000 0.211 1056 A C 1.902 179.474 177.584 -0.020 0.000 1.157 1056 A CA 0.230 52.245 52.037 -0.037 0.000 0.780 1056 A CB -1.385 17.576 19.000 -0.066 0.000 0.828 1056 A HN 0.079 nan 8.150 nan 0.000 0.476 1057 Y N 0.944 121.170 120.300 -0.123 0.000 2.128 1057 Y HA -0.239 4.311 4.550 -0.000 0.000 0.284 1057 Y C 2.615 178.477 175.900 -0.063 0.000 1.154 1057 Y CA 1.480 59.519 58.100 -0.102 0.000 1.149 1057 Y CB -0.417 37.984 38.460 -0.100 0.000 0.976 1057 Y HN 0.344 nan 8.280 nan 0.000 0.505 1058 A N -0.999 121.852 122.820 0.052 0.000 1.883 1058 A HA -0.242 4.078 4.320 -0.000 0.000 0.217 1058 A C 2.246 179.781 177.584 -0.081 0.000 1.186 1058 A CA 2.520 54.552 52.037 -0.008 0.000 0.624 1058 A CB -1.329 17.692 19.000 0.034 0.000 0.822 1058 A HN 0.502 nan 8.150 nan 0.000 0.444 1059 T N -0.003 114.513 114.554 -0.064 0.000 2.857 1059 T HA 0.113 4.463 4.350 -0.000 0.000 0.266 1059 T C 2.156 176.789 174.700 -0.112 0.000 1.048 1059 T CA 1.192 63.261 62.100 -0.052 0.000 1.139 1059 T CB -0.347 68.511 68.868 -0.018 0.000 0.874 1059 T HN 0.590 nan 8.240 nan 0.000 0.455 1060 A N 2.102 124.817 122.820 -0.175 0.000 2.019 1060 A HA -0.136 4.183 4.320 -0.000 0.000 0.219 1060 A C 2.193 179.606 177.584 -0.286 0.000 1.164 1060 A CA 1.675 53.578 52.037 -0.222 0.000 0.644 1060 A CB -0.512 18.336 19.000 -0.253 0.000 0.805 1060 A HN 0.757 nan 8.150 nan 0.000 0.449 1061 E N 0.468 120.464 120.200 -0.340 0.000 2.285 1061 E HA -0.186 4.164 4.350 -0.000 0.000 0.194 1061 E C 1.789 178.260 176.600 -0.215 0.000 0.997 1061 E CA 0.953 57.169 56.400 -0.308 0.000 0.845 1061 E CB -0.223 29.285 29.700 -0.320 0.000 0.782 1061 E HN 0.780 nan 8.360 nan 0.000 0.491 1062 R N 0.573 120.957 120.500 -0.193 0.000 2.334 1062 R HA 0.253 4.593 4.340 -0.000 0.000 0.212 1062 R C 0.357 176.392 176.300 -0.443 0.000 0.897 1062 R CA -0.259 55.726 56.100 -0.192 0.000 1.056 1062 R CB 0.108 30.380 30.300 -0.047 0.000 1.046 1062 R HN -0.081 nan 8.270 nan 0.000 0.513 1063 V N 2.793 122.420 119.914 -0.479 0.000 2.740 1063 V HA 0.122 4.242 4.120 -0.000 0.000 0.303 1063 V C 0.281 175.823 176.094 -0.921 0.000 1.054 1063 V CA 0.152 61.959 62.300 -0.821 0.000 1.106 1063 V CB 0.925 32.532 31.823 -0.359 0.000 0.957 1063 V HN 0.304 nan 8.190 nan 0.000 0.486 1064 R N 3.558 123.176 120.500 -1.470 0.000 2.912 1064 R HA 0.502 4.842 4.340 -0.000 0.000 0.262 1064 R C -2.757 173.237 176.300 -0.511 0.000 1.057 1064 R CA -2.561 53.018 56.100 -0.868 0.000 0.981 1064 R CB 1.071 30.915 30.300 -0.759 0.000 1.201 1064 R HN 0.335 nan 8.270 nan 0.000 0.484 1065 P HA 0.003 nan 4.420 nan 0.000 0.266 1065 P C -0.233 177.159 177.300 0.153 0.000 1.193 1065 P CA 0.617 63.713 63.100 -0.006 0.000 0.770 1065 P CB 0.441 32.146 31.700 0.008 0.000 0.836 1066 E N -1.689 118.647 120.200 0.226 0.000 3.916 1066 E HA -0.189 4.161 4.350 -0.000 0.000 0.331 1066 E C -0.437 176.456 176.600 0.488 0.000 0.729 1066 E CA 0.927 57.548 56.400 0.368 0.000 1.222 1066 E CB -1.960 27.905 29.700 0.275 0.000 1.633 1066 E HN 0.479 nan 8.360 nan 0.000 0.437 1067 W N 0.895 122.246 121.300 0.085 0.000 2.158 1067 W HA 0.331 4.991 4.660 -0.000 0.000 0.339 1067 W C 0.906 177.370 176.519 -0.092 0.000 1.294 1067 W CA -0.375 56.972 57.345 0.003 0.000 1.231 1067 W CB 0.443 29.889 29.460 -0.024 0.000 1.143 1067 W HN -0.242 nan 8.180 nan 0.000 0.571 1068 V N 5.138 125.014 119.914 -0.064 0.000 2.407 1068 V HA 0.522 4.642 4.120 -0.000 0.000 0.278 1068 V C 0.139 176.122 176.094 -0.185 0.000 1.037 1068 V CA -0.848 61.234 62.300 -0.363 0.000 0.900 1068 V CB 0.634 32.128 31.823 -0.548 0.000 0.983 1068 V HN 0.360 nan 8.190 nan 0.000 0.459 1069 V N 2.745 122.552 119.914 -0.178 0.000 3.160 1069 V HA 0.762 4.882 4.120 -0.000 0.000 0.310 1069 V C -0.703 175.321 176.094 -0.117 0.000 1.181 1069 V CA -1.202 61.042 62.300 -0.095 0.000 1.047 1069 V CB 2.243 34.056 31.823 -0.018 0.000 1.068 1069 V HN 0.862 nan 8.190 nan 0.000 0.441 1070 R N 1.363 121.813 120.500 -0.083 0.000 2.439 1070 R HA 0.852 5.192 4.340 -0.000 0.000 0.310 1070 R C -0.746 175.522 176.300 -0.053 0.000 0.955 1070 R CA -0.030 56.023 56.100 -0.077 0.000 0.853 1070 R CB 1.668 31.922 30.300 -0.077 0.000 1.171 1070 R HN 1.358 nan 8.270 nan 0.000 0.449 1071 A N 4.234 127.026 122.820 -0.048 0.000 2.355 1071 A HA 0.616 4.936 4.320 -0.000 0.000 0.324 1071 A C -1.150 176.415 177.584 -0.032 0.000 1.117 1071 A CA -0.849 51.166 52.037 -0.038 0.000 0.785 1071 A CB 1.400 20.378 19.000 -0.036 0.000 1.254 1071 A HN 0.747 nan 8.150 nan 0.000 0.453 1072 K N 0.653 121.036 120.400 -0.028 0.000 2.378 1072 K HA 0.723 5.043 4.320 -0.000 0.000 0.252 1072 K C -0.189 176.400 176.600 -0.018 0.000 0.931 1072 K CA -0.475 55.800 56.287 -0.020 0.000 0.794 1072 K CB 2.608 35.097 32.500 -0.018 0.000 1.181 1072 K HN 1.120 nan 8.250 nan 0.000 0.425 1073 G N 1.307 110.101 108.800 -0.011 0.000 2.430 1073 G HA2 0.345 4.305 3.960 -0.000 0.000 0.300 1073 G HA3 0.345 4.305 3.960 -0.000 0.000 0.300 1073 G C -2.133 172.767 174.900 -0.000 0.000 1.330 1073 G CA -0.863 44.234 45.100 -0.005 0.000 0.813 1073 G HN 0.411 nan 8.290 nan 0.000 0.487 1074 L N 0.923 122.151 121.223 0.008 0.000 2.307 1074 L HA 0.638 4.978 4.340 -0.000 0.000 0.284 1074 L C -0.022 176.849 176.870 0.002 0.000 1.023 1074 L CA -0.992 53.852 54.840 0.008 0.000 0.810 1074 L CB 1.669 43.738 42.059 0.016 0.000 1.231 1074 L HN 0.335 nan 8.230 nan 0.000 0.423 1075 V N 5.386 125.298 119.914 -0.004 0.000 2.555 1075 V HA 0.382 4.502 4.120 -0.000 0.000 0.286 1075 V C 0.165 176.266 176.094 0.011 0.000 1.044 1075 V CA -0.207 62.091 62.300 -0.002 0.000 1.026 1075 V CB 1.038 32.857 31.823 -0.006 0.000 0.981 1075 V HN 0.861 nan 8.190 nan 0.000 0.480 1076 R N 4.120 124.629 120.500 0.014 0.000 2.774 1076 R HA 0.673 5.013 4.340 -0.000 0.000 0.272 1076 R C -1.457 174.857 176.300 0.024 0.000 1.000 1076 R CA -1.077 55.032 56.100 0.016 0.000 0.906 1076 R CB 1.357 31.662 30.300 0.008 0.000 1.227 1076 R HN 0.475 nan 8.270 nan 0.000 0.468 1077 L N 2.338 123.575 121.223 0.023 0.000 2.456 1077 L HA 0.265 4.605 4.340 -0.000 0.000 0.272 1077 L C 0.721 177.612 176.870 0.035 0.000 1.189 1077 L CA -0.190 54.668 54.840 0.029 0.000 0.846 1077 L CB 0.402 42.475 42.059 0.024 0.000 1.111 1077 L HN 0.494 nan 8.230 nan 0.000 0.475 1078 R N 3.363 123.889 120.500 0.044 0.000 2.490 1078 R HA 0.127 4.467 4.340 -0.000 0.000 0.280 1078 R C -1.494 174.835 176.300 0.048 0.000 1.077 1078 R CA -1.460 54.674 56.100 0.057 0.000 1.065 1078 R CB 0.614 30.953 30.300 0.065 0.000 1.003 1078 R HN 0.390 nan 8.270 nan 0.000 0.470 1079 P HA -0.095 nan 4.420 nan 0.000 0.222 1079 P C -0.830 176.491 177.300 0.035 0.000 1.147 1079 P CA 1.278 64.402 63.100 0.041 0.000 0.790 1079 P CB 0.400 32.129 31.700 0.048 0.000 0.780 1080 E N -0.150 120.074 120.200 0.040 0.000 2.281 1080 E HA 0.231 4.581 4.350 -0.000 0.000 0.266 1080 E C -2.636 173.984 176.600 0.033 0.000 0.893 1080 E CA -2.117 54.300 56.400 0.029 0.000 0.798 1080 E CB 1.700 31.412 29.700 0.020 0.000 1.245 1080 E HN 0.082 nan 8.360 nan 0.000 0.410 1081 P HA 0.028 nan 4.420 nan 0.000 0.275 1081 P C -0.735 176.582 177.300 0.028 0.000 1.228 1081 P CA -0.391 62.728 63.100 0.032 0.000 0.786 1081 P CB 0.780 32.497 31.700 0.028 0.000 0.927 1082 N N 3.203 121.923 118.700 0.034 0.000 2.609 1082 N HA 0.226 4.966 4.740 -0.000 0.000 0.234 1082 N C -2.347 173.181 175.510 0.031 0.000 1.001 1082 N CA -2.076 50.992 53.050 0.030 0.000 0.926 1082 N CB 0.556 39.065 38.487 0.036 0.000 1.130 1082 N HN 0.107 nan 8.380 nan 0.000 0.510 1083 P HA 0.168 nan 4.420 nan 0.000 0.235 1083 P C -0.255 177.059 177.300 0.023 0.000 1.765 1083 P CA 0.177 63.291 63.100 0.023 0.000 1.034 1083 P CB -0.222 31.488 31.700 0.017 0.000 1.984 1084 R N -0.617 119.901 120.500 0.029 0.000 2.399 1084 R HA 0.164 4.504 4.340 -0.000 0.000 0.084 1084 R C -0.930 175.395 176.300 0.041 0.000 0.516 1084 R CA -0.265 55.852 56.100 0.029 0.000 0.771 1084 R CB -0.480 29.834 30.300 0.022 0.000 1.035 1084 R HN 0.085 nan 8.270 nan 0.000 0.539 1085 L N 1.029 122.282 121.223 0.049 0.000 2.385 1085 L HA 0.698 5.038 4.340 -0.000 0.000 0.273 1085 L C 1.111 178.019 176.870 0.063 0.000 0.990 1085 L CA -0.769 54.111 54.840 0.065 0.000 0.821 1085 L CB 2.033 44.135 42.059 0.071 0.000 1.279 1085 L HN 0.209 nan 8.230 nan 0.000 0.412 1086 A N 1.214 124.077 122.820 0.070 0.000 2.019 1086 A HA -0.136 4.184 4.320 -0.000 0.000 0.219 1086 A C 1.728 179.354 177.584 0.070 0.000 1.164 1086 A CA 2.165 54.243 52.037 0.068 0.000 0.644 1086 A CB -0.558 18.486 19.000 0.074 0.000 0.805 1086 A HN 0.828 nan 8.150 nan 0.000 0.449 1087 T N -3.949 110.648 114.554 0.072 0.000 3.122 1087 T HA 0.305 4.655 4.350 -0.000 0.000 0.250 1087 T C 1.558 176.296 174.700 0.063 0.000 1.067 1087 T CA 0.793 62.934 62.100 0.067 0.000 0.966 1087 T CB 0.088 68.992 68.868 0.061 0.000 1.002 1087 T HN 0.349 nan 8.240 nan 0.000 0.542 1088 G N 2.217 111.054 108.800 0.061 0.000 2.549 1088 G HA2 -0.222 3.738 3.960 -0.000 0.000 0.222 1088 G HA3 -0.222 3.738 3.960 -0.000 0.000 0.222 1088 G C 1.728 176.660 174.900 0.052 0.000 1.100 1088 G CA 0.209 45.343 45.100 0.056 0.000 0.739 1088 G HN 0.551 nan 8.290 nan 0.000 0.577 1089 R N -0.538 119.993 120.500 0.051 0.000 2.276 1089 R HA 0.220 4.560 4.340 -0.000 0.000 0.196 1089 R C 0.749 177.079 176.300 0.049 0.000 0.961 1089 R CA 0.510 56.638 56.100 0.047 0.000 1.024 1089 R CB 0.165 30.490 30.300 0.042 0.000 0.940 1089 R HN 0.433 nan 8.270 nan 0.000 0.480 1090 V N -1.391 118.555 119.914 0.053 0.000 3.155 1090 V HA 0.589 4.709 4.120 -0.000 0.000 0.313 1090 V C -0.893 175.232 176.094 0.052 0.000 1.162 1090 V CA -1.088 61.242 62.300 0.049 0.000 1.048 1090 V CB 2.188 34.039 31.823 0.047 0.000 1.092 1090 V HN 0.260 nan 8.190 nan 0.000 0.447 1091 E N -0.114 120.111 120.200 0.042 0.000 2.437 1091 E HA 0.716 5.066 4.350 -0.000 0.000 0.280 1091 E C -2.004 174.605 176.600 0.014 0.000 1.044 1091 E CA -1.063 55.361 56.400 0.040 0.000 0.826 1091 E CB 2.406 32.145 29.700 0.064 0.000 1.358 1091 E HN 0.511 nan 8.360 nan 0.000 0.459 1092 V N 1.023 120.937 119.914 0.000 0.000 2.378 1092 V HA 0.246 4.366 4.120 -0.000 0.000 0.288 1092 V C -0.326 175.761 176.094 -0.012 0.000 1.016 1092 V CA -0.649 61.645 62.300 -0.011 0.000 0.840 1092 V CB 1.174 32.984 31.823 -0.021 0.000 0.994 1092 V HN 0.723 nan 8.190 nan 0.000 0.431 1093 E N 5.008 125.214 120.200 0.009 0.000 2.217 1093 E HA 0.309 4.659 4.350 -0.000 0.000 0.279 1093 E C -0.672 175.954 176.600 0.044 0.000 1.068 1093 E CA -0.423 56.010 56.400 0.054 0.000 0.882 1093 E CB 0.639 30.389 29.700 0.083 0.000 1.039 1093 E HN 0.588 nan 8.360 nan 0.000 0.418 1094 L N 3.839 125.062 121.223 0.000 0.000 2.416 1094 L HA 0.037 4.377 4.340 -0.000 0.000 0.272 1094 L C 1.373 178.208 176.870 -0.058 0.000 1.161 1094 L CA 0.022 54.835 54.840 -0.044 0.000 0.845 1094 L CB 1.064 43.074 42.059 -0.081 0.000 1.119 1094 L HN 0.660 nan 8.230 nan 0.000 0.464 1095 S N 0.635 116.313 115.700 -0.037 0.000 2.554 1095 S HA 0.476 4.945 4.470 -0.000 0.000 0.227 1095 S C 0.329 174.906 174.600 -0.039 0.000 1.050 1095 S CA 0.159 58.339 58.200 -0.032 0.000 0.927 1095 S CB 0.758 63.954 63.200 -0.006 0.000 0.859 1095 S HN 0.683 nan 8.310 nan 0.000 0.494 1096 A N 0.567 123.365 122.820 -0.038 0.000 2.594 1096 A HA 0.803 5.123 4.320 -0.000 0.000 0.295 1096 A C -2.038 175.524 177.584 -0.037 0.000 1.071 1096 A CA -0.627 51.389 52.037 -0.034 0.000 0.685 1096 A CB 1.630 20.614 19.000 -0.026 0.000 1.285 1096 A HN 0.680 nan 8.150 nan 0.000 0.405 1097 L N 0.481 121.684 121.223 -0.033 0.000 2.543 1097 L HA 0.698 5.038 4.340 -0.000 0.000 0.265 1097 L C -0.859 175.998 176.870 -0.021 0.000 0.945 1097 L CA 0.103 54.924 54.840 -0.032 0.000 0.869 1097 L CB 1.935 43.971 42.059 -0.039 0.000 1.294 1097 L HN 0.897 nan 8.230 nan 0.000 0.405 1098 E N 3.416 123.603 120.200 -0.022 0.000 2.266 1098 E HA 0.646 4.996 4.350 -0.000 0.000 0.268 1098 E C -1.649 174.943 176.600 -0.014 0.000 0.879 1098 E CA -0.857 55.533 56.400 -0.018 0.000 0.762 1098 E CB 2.275 31.955 29.700 -0.032 0.000 1.199 1098 E HN 0.470 nan 8.360 nan 0.000 0.422 1099 V N 6.306 126.222 119.914 0.003 0.000 2.432 1099 V HA 0.112 4.232 4.120 -0.000 0.000 0.271 1099 V C 1.031 177.077 176.094 -0.079 0.000 1.046 1099 V CA -0.016 62.284 62.300 0.000 0.000 0.945 1099 V CB 0.950 32.802 31.823 0.048 0.000 0.992 1099 V HN 0.787 nan 8.190 nan 0.000 0.471 1100 L N 3.832 124.986 121.223 -0.115 0.000 2.354 1100 L HA 0.531 4.871 4.340 -0.000 0.000 0.212 1100 L C 0.866 177.629 176.870 -0.178 0.000 1.091 1100 L CA 0.681 55.435 54.840 -0.143 0.000 0.828 1100 L CB 0.124 42.086 42.059 -0.162 0.000 0.973 1100 L HN 0.741 nan 8.230 nan 0.000 0.461 1101 A N -0.043 122.641 122.820 -0.226 0.000 2.555 1101 A HA 0.508 4.828 4.320 -0.000 0.000 0.297 1101 A C -0.961 176.351 177.584 -0.454 0.000 1.060 1101 A CA -0.679 51.190 52.037 -0.279 0.000 0.710 1101 A CB 1.047 19.924 19.000 -0.204 0.000 1.282 1101 A HN 0.061 nan 8.150 nan 0.000 0.399 1102 E N 0.299 120.105 120.200 -0.657 0.000 2.280 1102 E HA 0.713 5.063 4.350 -0.000 0.000 0.261 1102 E C -0.058 176.170 176.600 -0.620 0.000 1.088 1102 E CA -0.578 55.074 56.400 -1.246 0.000 0.915 1102 E CB 1.883 30.836 29.700 -1.244 0.000 1.141 1102 E HN 1.025 nan 8.360 nan 0.000 0.433 1103 A N 1.415 123.959 122.820 -0.459 0.000 2.520 1103 A HA 0.388 4.708 4.320 -0.000 0.000 0.298 1103 A C -0.755 176.911 177.584 0.136 0.000 1.051 1103 A CA -0.970 51.062 52.037 -0.008 0.000 0.690 1103 A CB 1.085 20.185 19.000 0.168 0.000 1.281 1103 A HN 0.605 nan 8.150 nan 0.000 0.402 1104 K N 0.573 121.022 120.400 0.082 0.000 2.117 1104 K HA 0.557 4.877 4.320 -0.000 0.000 0.240 1104 K C -0.446 176.200 176.600 0.077 0.000 1.031 1104 K CA -0.329 56.011 56.287 0.088 0.000 0.909 1104 K CB 0.179 32.707 32.500 0.046 0.000 1.097 1104 K HN 0.414 nan 8.250 nan 0.000 0.492 1105 T N 3.032 117.614 114.554 0.047 0.000 2.853 1105 T HA 0.125 4.475 4.350 -0.000 0.000 0.298 1105 T C -2.163 172.493 174.700 -0.074 0.000 0.978 1105 T CA -0.862 61.240 62.100 0.005 0.000 1.152 1105 T CB 0.185 69.052 68.868 -0.002 0.000 0.914 1105 T HN 0.466 nan 8.240 nan 0.000 0.539 1106 P HA 0.228 nan 4.420 nan 0.000 0.271 1106 P C -1.846 175.242 177.300 -0.353 0.000 1.218 1106 P CA -1.437 61.490 63.100 -0.289 0.000 0.780 1106 P CB 0.089 31.622 31.700 -0.278 0.000 0.901 1107 P HA 0.021 nan 4.420 nan 0.000 0.226 1107 P C -0.435 176.759 177.300 -0.177 0.000 1.153 1107 P CA 0.972 63.825 63.100 -0.411 0.000 0.777 1107 P CB -0.071 31.253 31.700 -0.627 0.000 0.794 1108 F N -3.431 116.453 119.950 -0.111 0.000 2.654 1108 F HA 0.649 5.176 4.527 -0.000 0.000 0.308 1108 F C -3.179 172.600 175.800 -0.036 0.000 1.108 1108 F CA -3.615 54.351 58.000 -0.057 0.000 0.957 1108 F CB -0.232 38.740 39.000 -0.047 0.000 1.309 1108 F HN -0.388 nan 8.300 nan 0.000 0.446 1109 P HA 0.272 nan 4.420 nan 0.000 0.275 1109 P C 0.153 177.594 177.300 0.235 0.000 1.227 1109 P CA -0.250 62.950 63.100 0.167 0.000 0.781 1109 P CB 2.009 33.776 31.700 0.112 0.000 0.906 1110 V N -1.517 118.503 119.914 0.177 0.000 3.330 1110 V HA 0.102 4.222 4.120 -0.000 0.000 0.309 1110 V C 1.189 177.430 176.094 0.244 0.000 1.481 1110 V CA 0.440 62.865 62.300 0.209 0.000 1.068 1110 V CB -0.116 31.822 31.823 0.191 0.000 0.935 1110 V HN 0.471 nan 8.190 nan 0.000 0.453 1111 D N 2.013 122.530 120.400 0.194 0.000 2.240 1111 D HA 0.051 4.691 4.640 -0.000 0.000 0.206 1111 D C 1.875 178.308 176.300 0.222 0.000 0.963 1111 D CA 1.364 55.502 54.000 0.230 0.000 0.863 1111 D CB 0.432 41.314 40.800 0.137 0.000 0.973 1111 D HN 0.487 nan 8.370 nan 0.000 0.501 1112 A N 1.531 124.429 122.820 0.129 0.000 1.883 1112 A HA -0.016 4.304 4.320 -0.000 0.000 0.217 1112 A C 2.492 180.097 177.584 0.035 0.000 1.186 1112 A CA 2.202 54.283 52.037 0.073 0.000 0.624 1112 A CB -1.495 17.527 19.000 0.036 0.000 0.822 1112 A HN 0.376 nan 8.150 nan 0.000 0.444 1113 G N -1.618 107.161 108.800 -0.035 0.000 2.442 1113 G HA2 -0.267 3.693 3.960 -0.000 0.000 0.219 1113 G HA3 -0.267 3.693 3.960 -0.000 0.000 0.219 1113 G C 1.301 176.060 174.900 -0.234 0.000 1.141 1113 G CA 0.945 45.930 45.100 -0.192 0.000 0.763 1113 G HN 0.696 nan 8.290 nan 0.000 0.554 1114 W N -0.074 121.226 121.300 0.000 0.000 2.525 1114 W HA 0.222 4.882 4.660 -0.000 0.000 0.259 1114 W C 2.597 179.122 176.519 0.011 0.000 1.253 1114 W CA 0.182 57.530 57.345 0.005 0.000 1.262 1114 W CB 0.155 29.622 29.460 0.012 0.000 1.122 1114 W HN 0.061 nan 8.180 nan 0.000 0.607 1115 R N -0.216 120.384 120.500 0.166 0.000 2.312 1115 R HA 0.163 4.503 4.340 -0.000 0.000 0.205 1115 R C 1.573 177.904 176.300 0.050 0.000 0.904 1115 R CA 0.702 56.867 56.100 0.107 0.000 1.052 1115 R CB 0.007 30.359 30.300 0.087 0.000 1.014 1115 R HN 0.146 nan 8.270 nan 0.000 0.503 1116 G N 0.882 109.690 108.800 0.013 0.000 2.176 1116 G HA2 -0.269 3.691 3.960 -0.000 0.000 0.253 1116 G HA3 -0.269 3.691 3.960 -0.000 0.000 0.253 1116 G C -0.278 174.609 174.900 -0.022 0.000 0.979 1116 G CA 0.125 45.215 45.100 -0.017 0.000 0.641 1116 G HN 0.419 nan 8.290 nan 0.000 0.530 1117 E N 0.576 120.768 120.200 -0.012 0.000 2.314 1117 E HA 0.472 4.822 4.350 -0.000 0.000 0.262 1117 E C -0.052 176.531 176.600 -0.030 0.000 1.093 1117 E CA -0.751 55.641 56.400 -0.013 0.000 0.908 1117 E CB 0.821 30.523 29.700 0.003 0.000 1.091 1117 E HN 0.235 nan 8.360 nan 0.000 0.425 1118 E N 1.796 121.979 120.200 -0.028 0.000 2.354 1118 E HA 0.081 4.431 4.350 -0.000 0.000 0.269 1118 E C -0.414 176.167 176.600 -0.032 0.000 1.036 1118 E CA 0.203 56.581 56.400 -0.036 0.000 0.876 1118 E CB 0.770 30.451 29.700 -0.032 0.000 1.009 1118 E HN 0.380 nan 8.360 nan 0.000 0.416 1119 E N 1.251 121.425 120.200 -0.043 0.000 2.222 1119 E HA 0.300 4.650 4.350 -0.000 0.000 0.267 1119 E C -0.407 176.170 176.600 -0.039 0.000 0.963 1119 E CA -0.965 55.414 56.400 -0.035 0.000 0.837 1119 E CB 1.276 30.948 29.700 -0.046 0.000 1.183 1119 E HN -0.029 nan 8.360 nan 0.000 0.403 1120 K N 2.202 122.584 120.400 -0.029 0.000 2.354 1120 K HA 0.129 4.449 4.320 -0.000 0.000 0.257 1120 K C -0.913 175.651 176.600 -0.060 0.000 1.062 1120 K CA -0.119 56.146 56.287 -0.035 0.000 0.971 1120 K CB 0.240 32.731 32.500 -0.016 0.000 1.305 1120 K HN 0.315 nan 8.250 nan 0.000 0.449 1121 E N 2.222 122.367 120.200 -0.091 0.000 2.384 1121 E HA 0.194 4.544 4.350 -0.000 0.000 0.266 1121 E C -0.186 176.317 176.600 -0.161 0.000 1.012 1121 E CA -0.276 56.031 56.400 -0.155 0.000 0.901 1121 E CB 0.882 30.493 29.700 -0.148 0.000 0.967 1121 E HN 0.693 nan 8.360 nan 0.000 0.435 1122 A N 2.817 125.478 122.820 -0.265 0.000 2.296 1122 A HA 0.258 4.578 4.320 -0.000 0.000 0.264 1122 A C 0.288 177.775 177.584 -0.161 0.000 1.097 1122 A CA -0.538 51.381 52.037 -0.196 0.000 0.811 1122 A CB 0.377 19.223 19.000 -0.257 0.000 1.072 1122 A HN 0.700 nan 8.150 nan 0.000 0.495 1123 S N -0.585 115.068 115.700 -0.078 0.000 2.559 1123 S HA -0.013 4.457 4.470 -0.000 0.000 0.282 1123 S C 0.753 175.315 174.600 -0.064 0.000 1.336 1123 S CA 0.668 58.838 58.200 -0.050 0.000 1.037 1123 S CB 0.534 63.730 63.200 -0.007 0.000 0.853 1123 S HN 0.807 nan 8.310 nan 0.000 0.523 1124 E N 0.716 120.886 120.200 -0.050 0.000 2.153 1124 E HA -0.163 4.187 4.350 -0.000 0.000 0.194 1124 E C 1.528 178.121 176.600 -0.012 0.000 0.988 1124 E CA 1.058 57.431 56.400 -0.046 0.000 0.811 1124 E CB 0.006 29.686 29.700 -0.034 0.000 0.746 1124 E HN 0.708 nan 8.360 nan 0.000 0.466 1125 E N 0.407 120.612 120.200 0.009 0.000 2.153 1125 E HA -0.163 4.187 4.350 -0.000 0.000 0.194 1125 E C 2.133 178.768 176.600 0.059 0.000 0.988 1125 E CA 0.573 56.990 56.400 0.029 0.000 0.811 1125 E CB -0.139 29.581 29.700 0.033 0.000 0.746 1125 E HN 0.393 nan 8.360 nan 0.000 0.466 1126 L N 0.278 121.555 121.223 0.088 0.000 2.072 1126 L HA -0.115 4.225 4.340 -0.000 0.000 0.205 1126 L C 2.593 179.622 176.870 0.264 0.000 1.079 1126 L CA 0.942 55.914 54.840 0.220 0.000 0.752 1126 L CB -0.117 42.083 42.059 0.235 0.000 0.906 1126 L HN 0.064 nan 8.230 nan 0.000 0.436 1127 R N -0.672 119.853 120.500 0.042 0.000 2.091 1127 R HA -0.202 4.138 4.340 -0.000 0.000 0.238 1127 R C 2.081 178.425 176.300 0.073 0.000 1.136 1127 R CA 1.146 57.228 56.100 -0.029 0.000 0.959 1127 R CB -0.339 29.851 30.300 -0.184 0.000 0.856 1127 R HN 0.182 nan 8.270 nan 0.000 0.437 1128 L N 1.175 122.425 121.223 0.045 0.000 2.072 1128 L HA -0.106 4.234 4.340 -0.000 0.000 0.205 1128 L C 2.283 179.172 176.870 0.032 0.000 1.079 1128 L CA 1.675 56.543 54.840 0.047 0.000 0.752 1128 L CB -0.549 41.533 42.059 0.038 0.000 0.906 1128 L HN 0.059 nan 8.230 nan 0.000 0.436 1129 K N -1.203 119.190 120.400 -0.013 0.000 2.147 1129 K HA -0.168 4.152 4.320 -0.000 0.000 0.205 1129 K C 0.186 176.552 176.600 -0.391 0.000 1.049 1129 K CA 1.337 57.509 56.287 -0.193 0.000 0.936 1129 K CB 0.010 32.348 32.500 -0.271 0.000 0.722 1129 K HN 0.299 nan 8.250 nan 0.000 0.446 1130 Y N -0.003 120.288 120.300 -0.015 0.000 2.617 1130 Y HA 0.269 4.819 4.550 -0.000 0.000 0.328 1130 Y C 0.881 176.588 175.900 -0.323 0.000 0.946 1130 Y CA -0.827 57.087 58.100 -0.310 0.000 1.241 1130 Y CB 0.700 39.008 38.460 -0.253 0.000 1.226 1130 Y HN -0.112 nan 8.280 nan 0.000 0.582 1131 R N 0.549 121.022 120.500 -0.044 0.000 2.139 1131 R HA -0.225 4.115 4.340 -0.000 0.000 0.243 1131 R C 1.455 177.771 176.300 0.027 0.000 1.145 1131 R CA 1.712 57.840 56.100 0.046 0.000 0.976 1131 R CB -0.739 29.667 30.300 0.175 0.000 0.866 1131 R HN 0.735 nan 8.270 nan 0.000 0.449 1132 Y N -1.795 118.657 120.300 0.254 0.000 2.497 1132 Y HA 0.031 4.581 4.550 -0.000 0.000 0.292 1132 Y C 1.827 177.808 175.900 0.135 0.000 1.137 1132 Y CA 0.505 58.725 58.100 0.200 0.000 1.285 1132 Y CB -0.643 37.948 38.460 0.218 0.000 0.991 1132 Y HN -0.090 nan 8.280 nan 0.000 0.556 1133 L N -0.278 120.879 121.223 -0.110 0.000 2.298 1133 L HA 0.038 4.378 4.340 -0.000 0.000 0.209 1133 L C 1.834 178.804 176.870 0.167 0.000 1.084 1133 L CA 1.003 55.841 54.840 -0.002 0.000 0.816 1133 L CB -0.315 41.604 42.059 -0.234 0.000 0.967 1133 L HN 0.142 nan 8.230 nan 0.000 0.460 1134 D N 0.883 121.427 120.400 0.240 0.000 2.144 1134 D HA -0.155 4.485 4.640 -0.000 0.000 0.200 1134 D C 2.139 178.482 176.300 0.073 0.000 0.978 1134 D CA 1.119 55.240 54.000 0.201 0.000 0.833 1134 D CB 0.047 40.894 40.800 0.077 0.000 0.961 1134 D HN 0.178 nan 8.370 nan 0.000 0.470 1135 L N -0.175 121.067 121.223 0.032 0.000 2.633 1135 L HA 0.054 4.394 4.340 -0.000 0.000 0.235 1135 L C 2.121 179.011 176.870 0.033 0.000 1.163 1135 L CA 0.349 55.185 54.840 -0.006 0.000 0.859 1135 L CB -0.181 41.844 42.059 -0.056 0.000 0.973 1135 L HN 0.017 nan 8.230 nan 0.000 0.451 1136 R N -0.251 120.286 120.500 0.061 0.000 2.275 1136 R HA 0.072 4.412 4.340 -0.000 0.000 0.199 1136 R C 0.526 176.996 176.300 0.283 0.000 0.989 1136 R CA -0.022 56.120 56.100 0.069 0.000 1.016 1136 R CB 0.137 30.419 30.300 -0.031 0.000 0.918 1136 R HN 0.322 nan 8.270 nan 0.000 0.473 1137 R N 1.019 121.623 120.500 0.173 0.000 2.543 1137 R HA 0.053 4.393 4.340 -0.000 0.000 0.277 1137 R C 1.103 177.307 176.300 -0.160 0.000 1.074 1137 R CA -0.098 56.045 56.100 0.071 0.000 1.076 1137 R CB 0.633 30.924 30.300 -0.016 0.000 0.993 1137 R HN 0.098 nan 8.270 nan 0.000 0.459 1138 R N 2.513 122.577 120.500 -0.727 0.000 2.094 1138 R HA -0.255 4.085 4.340 -0.000 0.000 0.239 1138 R C 2.149 178.151 176.300 -0.497 0.000 1.137 1138 R CA 2.104 57.535 56.100 -1.115 0.000 0.943 1138 R CB -0.103 29.275 30.300 -1.537 0.000 0.850 1138 R HN 0.540 nan 8.270 nan 0.000 0.433 1139 R N -0.332 119.957 120.500 -0.352 0.000 2.105 1139 R HA -0.144 4.196 4.340 -0.000 0.000 0.239 1139 R C 2.109 178.318 176.300 -0.152 0.000 1.135 1139 R CA 1.756 57.726 56.100 -0.216 0.000 0.967 1139 R CB -0.067 30.130 30.300 -0.171 0.000 0.861 1139 R HN 0.233 nan 8.270 nan 0.000 0.442 1140 M N 0.453 119.973 119.600 -0.132 0.000 2.132 1140 M HA -0.123 4.357 4.480 -0.000 0.000 0.263 1140 M C 2.073 178.329 176.300 -0.074 0.000 1.065 1140 M CA 1.619 56.864 55.300 -0.092 0.000 1.122 1140 M CB -0.924 31.631 32.600 -0.075 0.000 1.365 1140 M HN 0.230 nan 8.290 nan 0.000 0.411 1141 Q N -0.117 119.646 119.800 -0.062 0.000 2.119 1141 Q HA -0.157 4.183 4.340 -0.000 0.000 0.201 1141 Q C 1.935 177.910 176.000 -0.043 0.000 0.972 1141 Q CA 1.159 56.949 55.803 -0.022 0.000 0.847 1141 Q CB -0.091 28.687 28.738 0.066 0.000 0.903 1141 Q HN 0.595 nan 8.270 nan 0.000 0.433 1142 E N 0.670 120.818 120.200 -0.086 0.000 2.077 1142 E HA -0.173 4.177 4.350 -0.000 0.000 0.193 1142 E C 1.624 178.191 176.600 -0.054 0.000 0.989 1142 E CA 0.976 57.331 56.400 -0.076 0.000 0.800 1142 E CB -0.099 29.536 29.700 -0.108 0.000 0.746 1142 E HN 0.416 nan 8.360 nan 0.000 0.452 1143 N N 0.478 119.142 118.700 -0.059 0.000 2.084 1143 N HA -0.130 4.610 4.740 -0.000 0.000 0.190 1143 N C 1.953 177.449 175.510 -0.023 0.000 1.030 1143 N CA 0.698 53.722 53.050 -0.044 0.000 0.849 1143 N CB -0.035 38.422 38.487 -0.050 0.000 1.012 1143 N HN 0.069 nan 8.380 nan 0.000 0.423 1144 L N 0.840 122.050 121.223 -0.022 0.000 2.093 1144 L HA -0.085 4.255 4.340 -0.000 0.000 0.208 1144 L C 2.440 179.329 176.870 0.030 0.000 1.085 1144 L CA 0.918 55.759 54.840 0.001 0.000 0.755 1144 L CB -0.294 41.758 42.059 -0.013 0.000 0.904 1144 L HN 0.165 nan 8.230 nan 0.000 0.435 1145 R N -0.203 120.304 120.500 0.012 0.000 2.115 1145 R HA -0.134 4.206 4.340 -0.000 0.000 0.230 1145 R C 2.210 178.550 176.300 0.067 0.000 1.111 1145 R CA 1.028 57.145 56.100 0.028 0.000 0.976 1145 R CB -0.434 29.859 30.300 -0.011 0.000 0.870 1145 R HN 0.224 nan 8.270 nan 0.000 0.445 1146 L N 1.329 122.565 121.223 0.023 0.000 2.046 1146 L HA -0.139 4.201 4.340 -0.000 0.000 0.208 1146 L C 2.458 179.341 176.870 0.022 0.000 1.077 1146 L CA 1.687 56.530 54.840 0.004 0.000 0.747 1146 L CB -0.421 41.616 42.059 -0.036 0.000 0.896 1146 L HN -0.033 nan 8.230 nan 0.000 0.432 1147 R N -1.627 118.896 120.500 0.038 0.000 2.096 1147 R HA -0.263 4.077 4.340 -0.000 0.000 0.235 1147 R C 2.446 178.798 176.300 0.086 0.000 1.127 1147 R CA 1.752 57.884 56.100 0.052 0.000 0.968 1147 R CB -0.476 29.858 30.300 0.056 0.000 0.861 1147 R HN 0.690 nan 8.270 nan 0.000 0.440 1148 H N 0.161 119.244 119.070 0.021 0.000 2.290 1148 H HA -0.061 4.495 4.556 -0.000 0.000 0.298 1148 H C 2.042 177.390 175.328 0.034 0.000 1.087 1148 H CA 2.215 58.282 56.048 0.031 0.000 1.291 1148 H CB 0.060 29.833 29.762 0.019 0.000 1.369 1148 H HN 0.132 nan 8.280 nan 0.000 0.492 1149 R N -0.226 120.320 120.500 0.076 0.000 2.091 1149 R HA -0.113 4.227 4.340 -0.000 0.000 0.238 1149 R C 2.496 178.770 176.300 -0.043 0.000 1.136 1149 R CA 1.425 57.531 56.100 0.008 0.000 0.959 1149 R CB -0.408 29.922 30.300 0.051 0.000 0.856 1149 R HN 0.240 nan 8.270 nan 0.000 0.437 1150 V N 1.353 121.251 119.914 -0.026 0.000 2.295 1150 V HA -0.246 3.874 4.120 -0.000 0.000 0.246 1150 V C 2.233 178.342 176.094 0.025 0.000 1.049 1150 V CA 1.802 64.094 62.300 -0.013 0.000 1.024 1150 V CB -0.322 31.495 31.823 -0.009 0.000 0.648 1150 V HN 0.275 nan 8.190 nan 0.000 0.447 1151 I N -0.205 120.383 120.570 0.028 0.000 2.315 1151 I HA -0.214 3.955 4.170 -0.000 0.000 0.248 1151 I C 2.531 178.744 176.117 0.160 0.000 1.117 1151 I CA 1.435 62.798 61.300 0.105 0.000 1.404 1151 I CB -0.355 37.721 38.000 0.126 0.000 1.071 1151 I HN 0.240 nan 8.210 nan 0.000 0.419 1152 K N 1.795 122.181 120.400 -0.023 0.000 2.057 1152 K HA -0.113 4.207 4.320 -0.000 0.000 0.207 1152 K C 2.046 178.721 176.600 0.124 0.000 1.049 1152 K CA 1.762 58.039 56.287 -0.016 0.000 0.931 1152 K CB -0.423 31.951 32.500 -0.209 0.000 0.714 1152 K HN 0.257 nan 8.250 nan 0.000 0.440 1153 A N 0.678 123.557 122.820 0.098 0.000 1.902 1153 A HA -0.107 4.213 4.320 -0.000 0.000 0.217 1153 A C 2.272 179.999 177.584 0.238 0.000 1.181 1153 A CA 1.732 53.885 52.037 0.193 0.000 0.623 1153 A CB -0.674 18.357 19.000 0.052 0.000 0.818 1153 A HN 0.357 nan 8.150 nan 0.000 0.443 1154 I N -2.555 118.082 120.570 0.112 0.000 2.179 1154 I HA -0.305 3.865 4.170 -0.000 0.000 0.242 1154 I C 2.457 178.490 176.117 -0.139 0.000 1.088 1154 I CA 1.468 62.728 61.300 -0.066 0.000 1.357 1154 I CB -0.362 37.538 38.000 -0.167 0.000 1.051 1154 I HN 0.530 nan 8.210 nan 0.000 0.409 1155 W N 1.447 122.680 121.300 -0.112 0.000 2.358 1155 W HA -0.209 4.450 4.660 -0.000 0.000 0.303 1155 W C 2.383 178.868 176.519 -0.057 0.000 1.208 1155 W CA 1.331 58.636 57.345 -0.067 0.000 1.274 1155 W CB -0.458 29.047 29.460 0.074 0.000 1.138 1155 W HN 0.139 nan 8.180 nan 0.000 0.515 1156 D N -0.798 119.747 120.400 0.242 0.000 2.097 1156 D HA -0.222 4.418 4.640 -0.000 0.000 0.195 1156 D C 1.877 178.185 176.300 0.014 0.000 0.989 1156 D CA 1.438 55.528 54.000 0.149 0.000 0.827 1156 D CB -1.034 39.880 40.800 0.190 0.000 0.966 1156 D HN 0.096 nan 8.370 nan 0.000 0.456 1157 F N 1.115 120.924 119.950 -0.235 0.000 2.075 1157 F HA -0.099 4.428 4.527 0.000 0.000 0.297 1157 F C 2.233 177.839 175.800 -0.323 0.000 1.113 1157 F CA 1.162 58.922 58.000 -0.400 0.000 1.218 1157 F CB -0.206 38.484 39.000 -0.516 0.000 0.984 1157 F HN -0.127 nan 8.300 nan 0.000 0.472 1158 L N -0.092 120.977 121.223 -0.258 0.000 2.141 1158 L HA -0.171 4.169 4.340 -0.000 0.000 0.209 1158 L C 2.046 178.809 176.870 -0.179 0.000 1.094 1158 L CA 1.586 56.140 54.840 -0.476 0.000 0.763 1158 L CB -0.791 40.581 42.059 -1.145 0.000 0.908 1158 L HN 0.196 nan 8.230 nan 0.000 0.437 1159 D N 0.367 120.714 120.400 -0.089 0.000 2.117 1159 D HA -0.244 4.396 4.640 -0.000 0.000 0.197 1159 D C 2.318 178.623 176.300 0.008 0.000 0.987 1159 D CA 1.150 55.197 54.000 0.079 0.000 0.829 1159 D CB 0.076 40.982 40.800 0.177 0.000 0.961 1159 D HN 0.040 nan 8.370 nan 0.000 0.460 1160 R N 0.003 120.443 120.500 -0.101 0.000 2.120 1160 R HA -0.064 4.276 4.340 -0.000 0.000 0.234 1160 R C 1.164 177.358 176.300 -0.177 0.000 1.123 1160 R CA 1.085 57.094 56.100 -0.153 0.000 0.975 1160 R CB 0.046 30.196 30.300 -0.249 0.000 0.866 1160 R HN 0.133 nan 8.270 nan 0.000 0.446 1161 E N -0.626 119.446 120.200 -0.213 0.000 2.476 1161 E HA 0.060 4.410 4.350 -0.000 0.000 0.191 1161 E C 0.664 177.310 176.600 0.076 0.000 1.064 1161 E CA 0.696 57.037 56.400 -0.098 0.000 0.866 1161 E CB 0.821 30.457 29.700 -0.108 0.000 0.952 1161 E HN 0.622 nan 8.360 nan 0.000 0.492 1162 G N 1.209 110.050 108.800 0.068 0.000 2.141 1162 G HA2 -0.274 3.686 3.960 -0.000 0.000 0.242 1162 G HA3 -0.274 3.686 3.960 -0.000 0.000 0.242 1162 G C -0.022 174.898 174.900 0.033 0.000 0.982 1162 G CA -0.225 44.894 45.100 0.032 0.000 0.662 1162 G HN 0.170 nan 8.290 nan 0.000 0.527 1163 F N 0.091 120.041 119.950 -0.000 0.000 2.399 1163 F HA 0.553 5.080 4.527 -0.000 0.000 0.342 1163 F C 0.875 176.760 175.800 0.142 0.000 1.106 1163 F CA -0.616 57.430 58.000 0.077 0.000 1.196 1163 F CB 1.626 40.669 39.000 0.071 0.000 1.163 1163 F HN -0.024 nan 8.300 nan 0.000 0.547 1164 V N 3.648 123.712 119.914 0.250 0.000 2.370 1164 V HA 0.229 4.349 4.120 -0.000 0.000 0.283 1164 V C -0.065 175.994 176.094 -0.057 0.000 1.023 1164 V CA -0.981 61.394 62.300 0.125 0.000 0.857 1164 V CB 1.223 33.095 31.823 0.081 0.000 0.985 1164 V HN 0.555 nan 8.190 nan 0.000 0.443 1165 Q N 3.554 123.162 119.800 -0.320 0.000 2.293 1165 Q HA 0.360 4.700 4.340 -0.000 0.000 0.263 1165 Q C -1.110 174.712 176.000 -0.298 0.000 1.002 1165 Q CA 0.137 55.432 55.803 -0.847 0.000 0.910 1165 Q CB 1.478 29.603 28.738 -1.023 0.000 1.185 1165 Q HN 0.608 nan 8.270 nan 0.000 0.401 1166 V N 4.471 124.274 119.914 -0.185 0.000 2.531 1166 V HA 0.275 4.395 4.120 -0.000 0.000 0.301 1166 V C -0.560 175.570 176.094 0.060 0.000 1.034 1166 V CA -0.852 61.478 62.300 0.050 0.000 0.865 1166 V CB 2.003 33.950 31.823 0.207 0.000 0.995 1166 V HN 0.719 nan 8.190 nan 0.000 0.424 1167 E N 2.190 122.405 120.200 0.025 0.000 2.229 1167 E HA 0.434 4.784 4.350 -0.000 0.000 0.283 1167 E C -0.204 176.381 176.600 -0.026 0.000 1.030 1167 E CA -0.095 56.322 56.400 0.028 0.000 0.836 1167 E CB 1.156 30.887 29.700 0.051 0.000 1.068 1167 E HN 0.668 nan 8.360 nan 0.000 0.401 1168 T N 4.028 118.534 114.554 -0.079 0.000 2.928 1168 T HA 0.336 4.686 4.350 -0.000 0.000 0.284 1168 T C -2.140 172.347 174.700 -0.355 0.000 1.008 1168 T CA -1.558 60.362 62.100 -0.299 0.000 1.057 1168 T CB 0.884 69.579 68.868 -0.288 0.000 1.018 1168 T HN 0.261 nan 8.240 nan 0.000 0.493 1169 P HA 0.184 nan 4.420 nan 0.000 0.267 1169 P C -0.215 176.934 177.300 -0.252 0.000 1.200 1169 P CA 0.001 62.894 63.100 -0.345 0.000 0.772 1169 P CB 0.377 31.811 31.700 -0.443 0.000 0.855 1170 F N 0.087 119.954 119.950 -0.139 0.000 2.678 1170 F HA 0.237 4.764 4.527 -0.000 0.000 0.291 1170 F C 0.849 176.578 175.800 -0.118 0.000 1.123 1170 F CA 0.339 58.285 58.000 -0.089 0.000 1.395 1170 F CB 0.318 39.263 39.000 -0.091 0.000 1.121 1170 F HN 0.078 nan 8.300 nan 0.000 0.592 1171 L N 1.126 122.347 121.223 -0.002 0.000 2.283 1171 L HA 0.390 4.730 4.340 -0.000 0.000 0.281 1171 L C -0.261 176.627 176.870 0.031 0.000 1.033 1171 L CA -0.187 54.589 54.840 -0.106 0.000 0.848 1171 L CB 0.678 42.421 42.059 -0.528 0.000 1.226 1171 L HN -0.006 nan 8.230 nan 0.000 0.429 1172 T N 0.497 115.144 114.554 0.155 0.000 2.676 1172 T HA 0.339 4.689 4.350 -0.000 0.000 0.269 1172 T C -0.497 174.337 174.700 0.223 0.000 0.952 1172 T CA -0.849 61.382 62.100 0.218 0.000 1.040 1172 T CB 1.847 70.885 68.868 0.284 0.000 1.352 1172 T HN 0.280 nan 8.240 nan 0.000 0.554 1173 K N 1.119 121.623 120.400 0.173 0.000 2.143 1173 K HA 0.486 4.806 4.320 -0.000 0.000 0.272 1173 K C -0.114 176.569 176.600 0.138 0.000 1.001 1173 K CA -0.315 56.054 56.287 0.135 0.000 0.915 1173 K CB 1.100 33.659 32.500 0.098 0.000 1.047 1173 K HN 0.522 nan 8.250 nan 0.000 0.458 1174 S N 1.638 117.406 115.700 0.114 0.000 2.584 1174 S HA 0.233 4.702 4.470 -0.000 0.000 0.273 1174 S C -0.758 173.877 174.600 0.058 0.000 1.311 1174 S CA -0.321 57.932 58.200 0.088 0.000 1.034 1174 S CB 0.781 64.021 63.200 0.066 0.000 0.939 1174 S HN 0.590 nan 8.310 nan 0.000 0.513 1175 T N 5.749 120.327 114.554 0.040 0.000 2.824 1175 T HA 0.415 4.765 4.350 -0.000 0.000 0.282 1175 T C -1.436 173.248 174.700 -0.026 0.000 0.993 1175 T CA -1.077 61.019 62.100 -0.005 0.000 0.967 1175 T CB 1.689 70.559 68.868 0.003 0.000 0.960 1175 T HN 0.567 nan 8.240 nan 0.000 0.441 1176 P HA -0.072 nan 4.420 nan 0.000 0.217 1176 P C 0.033 177.309 177.300 -0.041 0.000 1.148 1176 P CA 1.195 64.263 63.100 -0.055 0.000 0.828 1176 P CB 0.687 32.341 31.700 -0.077 0.000 0.783 1177 E N -1.905 118.273 120.200 -0.036 0.000 2.367 1177 E HA 0.517 4.867 4.350 -0.000 0.000 0.273 1177 E C 0.041 176.667 176.600 0.044 0.000 0.903 1177 E CA -0.406 55.995 56.400 0.002 0.000 0.764 1177 E CB 2.339 32.043 29.700 0.007 0.000 1.252 1177 E HN 0.088 nan 8.360 nan 0.000 0.446 1178 G N 0.935 109.772 108.800 0.062 0.000 1.894 1178 G HA2 0.234 4.194 3.960 -0.000 0.000 0.076 1178 G HA3 0.234 4.194 3.960 -0.000 0.000 0.076 1178 G C -1.146 173.793 174.900 0.065 0.000 0.954 1178 G CA -0.083 45.073 45.100 0.093 0.000 1.214 1178 G HN 0.752 nan 8.290 nan 0.000 0.409 1179 A N -0.092 122.767 122.820 0.065 0.000 2.346 1179 A HA 0.876 5.196 4.320 -0.000 0.000 0.313 1179 A C 0.303 177.896 177.584 0.015 0.000 1.140 1179 A CA 0.211 52.274 52.037 0.044 0.000 0.826 1179 A CB 1.286 20.331 19.000 0.075 0.000 1.332 1179 A HN 0.991 nan 8.150 nan 0.000 0.457 1180 R N 0.601 121.085 120.500 -0.027 0.000 2.491 1180 R HA 0.222 4.562 4.340 -0.000 0.000 0.283 1180 R C -1.195 175.043 176.300 -0.102 0.000 1.072 1180 R CA -0.262 55.791 56.100 -0.078 0.000 1.048 1180 R CB 0.261 30.484 30.300 -0.128 0.000 0.983 1180 R HN 0.702 nan 8.270 nan 0.000 0.450 1181 D N 3.346 123.701 120.400 -0.076 0.000 2.253 1181 D HA 0.145 4.785 4.640 -0.000 0.000 0.249 1181 D C -0.547 175.695 176.300 -0.098 0.000 1.049 1181 D CA 0.006 53.994 54.000 -0.022 0.000 0.929 1181 D CB 0.724 41.551 40.800 0.044 0.000 1.176 1181 D HN 0.331 nan 8.370 nan 0.000 0.437 1182 F N 0.716 120.712 119.950 0.076 0.000 2.394 1182 F HA 0.310 4.837 4.527 -0.000 0.000 0.340 1182 F C 0.513 176.336 175.800 0.038 0.000 1.105 1182 F CA -0.523 57.511 58.000 0.056 0.000 1.124 1182 F CB 0.783 39.821 39.000 0.065 0.000 1.145 1182 F HN -0.066 nan 8.300 nan 0.000 0.505 1183 L N 3.594 124.943 121.223 0.211 0.000 2.322 1183 L HA 0.741 5.081 4.340 -0.000 0.000 0.269 1183 L C -1.007 176.014 176.870 0.252 0.000 1.012 1183 L CA -1.201 53.741 54.840 0.170 0.000 0.815 1183 L CB 1.964 44.010 42.059 -0.022 0.000 1.295 1183 L HN 0.189 nan 8.230 nan 0.000 0.438 1184 V N 1.609 121.737 119.914 0.357 0.000 2.482 1184 V HA 0.309 4.429 4.120 -0.000 0.000 0.295 1184 V C -2.394 173.986 176.094 0.477 0.000 1.026 1184 V CA -1.700 60.824 62.300 0.372 0.000 0.856 1184 V CB 1.729 33.750 31.823 0.330 0.000 1.001 1184 V HN 0.568 nan 8.190 nan 0.000 0.424 1185 P HA 0.039 nan 4.420 nan 0.000 0.268 1185 P C -1.095 176.236 177.300 0.051 0.000 1.204 1185 P CA 0.082 63.228 63.100 0.076 0.000 0.768 1185 P CB 0.150 31.900 31.700 0.084 0.000 0.842 1186 Y N 3.943 124.057 120.300 -0.311 0.000 2.454 1186 Y HA 0.251 4.801 4.550 -0.000 0.000 0.345 1186 Y C 1.629 177.450 175.900 -0.132 0.000 0.970 1186 Y CA -0.629 57.354 58.100 -0.196 0.000 1.204 1186 Y CB 0.285 38.512 38.460 -0.389 0.000 1.122 1186 Y HN 0.325 nan 8.280 nan 0.000 0.514 1187 R N 2.484 122.778 120.500 -0.343 0.000 2.094 1187 R HA -0.232 4.108 4.340 -0.000 0.000 0.239 1187 R C 1.055 176.989 176.300 -0.610 0.000 1.137 1187 R CA 2.448 58.289 56.100 -0.432 0.000 0.943 1187 R CB -0.221 29.837 30.300 -0.404 0.000 0.850 1187 R HN 0.914 nan 8.270 nan 0.000 0.433 1188 H N -0.579 117.985 119.070 -0.843 0.000 2.560 1188 H HA 0.101 4.657 4.556 -0.000 0.000 0.283 1188 H C -0.217 174.880 175.328 -0.385 0.000 1.028 1188 H CA 1.059 56.746 56.048 -0.601 0.000 1.221 1188 H CB 0.077 29.492 29.762 -0.578 0.000 1.363 1188 H HN 0.321 nan 8.280 nan 0.000 0.594 1189 E N -0.195 119.835 120.200 -0.283 0.000 2.466 1189 E HA 0.190 4.540 4.350 -0.000 0.000 0.308 1189 E C -2.837 173.715 176.600 -0.080 0.000 0.933 1189 E CA -1.887 54.485 56.400 -0.047 0.000 0.800 1189 E CB 2.056 31.845 29.700 0.148 0.000 1.434 1189 E HN 0.039 nan 8.360 nan 0.000 0.389 1190 P HA -0.016 nan 4.420 nan 0.000 0.265 1190 P C 0.892 178.127 177.300 -0.108 0.000 1.187 1190 P CA 1.160 64.181 63.100 -0.133 0.000 0.766 1190 P CB 0.603 32.259 31.700 -0.075 0.000 0.820 1191 G N 0.799 109.502 108.800 -0.163 0.000 2.217 1191 G HA2 -0.219 3.740 3.960 -0.000 0.000 0.246 1191 G HA3 -0.219 3.740 3.960 -0.000 0.000 0.246 1191 G C -0.313 174.558 174.900 -0.048 0.000 0.990 1191 G CA -0.378 44.722 45.100 -0.000 0.000 0.627 1191 G HN 0.445 nan 8.290 nan 0.000 0.522 1192 L N 0.731 121.797 121.223 -0.263 0.000 2.289 1192 L HA 0.860 5.200 4.340 -0.000 0.000 0.285 1192 L C -0.203 176.377 176.870 -0.484 0.000 1.049 1192 L CA -0.682 54.043 54.840 -0.192 0.000 0.804 1192 L CB 1.072 43.094 42.059 -0.062 0.000 1.195 1192 L HN 0.097 nan 8.230 nan 0.000 0.428 1193 F N 1.628 121.530 119.950 -0.079 0.000 2.599 1193 F HA 0.534 5.060 4.527 -0.000 0.000 0.311 1193 F C -0.490 175.231 175.800 -0.132 0.000 1.076 1193 F CA -0.755 57.208 58.000 -0.063 0.000 0.937 1193 F CB 1.543 40.557 39.000 0.023 0.000 1.282 1193 F HN 0.196 nan 8.300 nan 0.000 0.460 1194 Y N 0.884 121.333 120.300 0.249 0.000 2.432 1194 Y HA 0.743 5.293 4.550 -0.000 0.000 0.322 1194 Y C 0.158 176.154 175.900 0.161 0.000 1.246 1194 Y CA -1.067 57.119 58.100 0.144 0.000 1.268 1194 Y CB 1.424 39.948 38.460 0.106 0.000 1.276 1194 Y HN 0.634 nan 8.280 nan 0.000 0.499 1195 A N 2.168 125.168 122.820 0.299 0.000 2.401 1195 A HA 0.682 5.002 4.320 -0.000 0.000 0.310 1195 A C -1.493 176.187 177.584 0.160 0.000 1.075 1195 A CA -0.731 51.429 52.037 0.206 0.000 0.746 1195 A CB 0.901 20.000 19.000 0.164 0.000 1.277 1195 A HN 0.570 nan 8.150 nan 0.000 0.425 1196 L N 2.602 123.892 121.223 0.113 0.000 2.395 1196 L HA 0.380 4.720 4.340 -0.000 0.000 0.269 1196 L C -1.902 175.047 176.870 0.131 0.000 1.133 1196 L CA -1.425 53.406 54.840 -0.015 0.000 0.812 1196 L CB 0.444 42.318 42.059 -0.308 0.000 1.125 1196 L HN 0.506 nan 8.230 nan 0.000 0.452 1197 P HA 0.125 nan 4.420 nan 0.000 0.276 1197 P C -0.248 177.193 177.300 0.235 0.000 1.235 1197 P CA -0.282 62.925 63.100 0.179 0.000 0.772 1197 P CB 0.933 32.673 31.700 0.068 0.000 0.871 1198 Q N 1.165 121.083 119.800 0.195 0.000 2.331 1198 Q HA 0.058 4.398 4.340 -0.000 0.000 0.203 1198 Q C 0.669 176.737 176.000 0.114 0.000 0.944 1198 Q CA 0.816 56.729 55.803 0.183 0.000 0.892 1198 Q CB 0.251 29.100 28.738 0.186 0.000 0.983 1198 Q HN 0.697 nan 8.270 nan 0.000 0.482 1199 S N -1.280 114.482 115.700 0.104 0.000 2.597 1199 S HA 0.254 4.724 4.470 -0.000 0.000 0.274 1199 S C -2.848 171.816 174.600 0.107 0.000 1.132 1199 S CA -1.099 57.145 58.200 0.074 0.000 0.835 1199 S CB 1.083 64.338 63.200 0.092 0.000 1.092 1199 S HN -0.200 nan 8.310 nan 0.000 0.457 1200 P HA 0.188 nan 4.420 nan 0.000 0.255 1200 P C 1.266 178.659 177.300 0.155 0.000 1.301 1200 P CA 0.079 63.297 63.100 0.197 0.000 0.817 1200 P CB 0.194 31.982 31.700 0.147 0.000 1.259 1201 Q N 1.265 121.102 119.800 0.062 0.000 2.045 1201 Q HA -0.237 4.103 4.340 -0.000 0.000 0.215 1201 Q C 1.730 177.660 176.000 -0.117 0.000 1.026 1201 Q CA 2.136 57.914 55.803 -0.041 0.000 0.885 1201 Q CB -1.317 27.353 28.738 -0.114 0.000 0.984 1201 Q HN 0.229 nan 8.270 nan 0.000 0.414 1202 L N -0.988 120.126 121.223 -0.183 0.000 2.083 1202 L HA -0.113 4.227 4.340 -0.000 0.000 0.209 1202 L C 2.362 179.071 176.870 -0.270 0.000 1.083 1202 L CA 1.078 55.702 54.840 -0.360 0.000 0.752 1202 L CB -0.496 41.362 42.059 -0.336 0.000 0.899 1202 L HN 0.252 nan 8.230 nan 0.000 0.433 1203 F N 0.920 120.852 119.950 -0.031 0.000 2.146 1203 F HA -0.212 4.315 4.527 -0.000 0.000 0.298 1203 F C 2.649 178.333 175.800 -0.192 0.000 1.096 1203 F CA 1.465 59.426 58.000 -0.065 0.000 1.275 1203 F CB -0.334 38.619 39.000 -0.078 0.000 1.008 1203 F HN 0.082 nan 8.300 nan 0.000 0.480 1204 K N 0.380 120.707 120.400 -0.121 0.000 2.148 1204 K HA -0.164 4.156 4.320 -0.000 0.000 0.204 1204 K C 1.723 178.196 176.600 -0.213 0.000 1.050 1204 K CA 1.426 57.459 56.287 -0.423 0.000 0.942 1204 K CB -0.584 31.619 32.500 -0.496 0.000 0.724 1204 K HN 0.327 nan 8.250 nan 0.000 0.446 1205 Q N 0.485 120.233 119.800 -0.086 0.000 2.119 1205 Q HA 0.005 4.345 4.340 -0.000 0.000 0.201 1205 Q C 2.173 178.153 176.000 -0.035 0.000 0.972 1205 Q CA 1.496 57.284 55.803 -0.024 0.000 0.847 1205 Q CB -0.121 28.695 28.738 0.131 0.000 0.903 1205 Q HN 0.424 nan 8.270 nan 0.000 0.433 1206 M N -0.106 119.534 119.600 0.067 0.000 2.296 1206 M HA -0.136 4.344 4.480 -0.000 0.000 0.265 1206 M C 1.548 177.828 176.300 -0.034 0.000 1.064 1206 M CA 0.744 56.090 55.300 0.077 0.000 1.109 1206 M CB 0.023 32.717 32.600 0.156 0.000 1.396 1206 M HN 0.179 nan 8.290 nan 0.000 0.430 1207 L N -0.176 120.993 121.223 -0.090 0.000 2.217 1207 L HA -0.108 4.232 4.340 -0.000 0.000 0.211 1207 L C 2.234 179.023 176.870 -0.134 0.000 1.107 1207 L CA 1.461 56.233 54.840 -0.115 0.000 0.783 1207 L CB -0.627 41.309 42.059 -0.205 0.000 0.919 1207 L HN 0.319 nan 8.230 nan 0.000 0.442 1208 M N -1.952 117.524 119.600 -0.207 0.000 2.236 1208 M HA -0.032 4.448 4.480 -0.000 0.000 0.266 1208 M C 2.302 178.443 176.300 -0.266 0.000 1.070 1208 M CA 0.966 56.097 55.300 -0.281 0.000 1.137 1208 M CB -0.966 31.325 32.600 -0.516 0.000 1.378 1208 M HN 0.008 nan 8.290 nan 0.000 0.426 1209 V N 0.800 120.570 119.914 -0.240 0.000 2.490 1209 V HA -0.177 3.943 4.120 -0.000 0.000 0.250 1209 V C 2.552 178.590 176.094 -0.093 0.000 1.061 1209 V CA 1.685 63.889 62.300 -0.161 0.000 1.064 1209 V CB -1.218 30.532 31.823 -0.120 0.000 0.670 1209 V HN 0.480 nan 8.190 nan 0.000 0.461 1210 A N -0.587 122.186 122.820 -0.079 0.000 2.209 1210 A HA 0.312 4.631 4.320 -0.000 0.000 0.212 1210 A C 1.977 179.536 177.584 -0.041 0.000 1.158 1210 A CA 1.158 53.166 52.037 -0.049 0.000 0.742 1210 A CB -0.535 18.443 19.000 -0.036 0.000 0.790 1210 A HN 1.252 nan 8.150 nan 0.000 0.472 1211 G N -1.724 107.044 108.800 -0.054 0.000 2.131 1211 G HA2 -0.150 3.810 3.960 -0.000 0.000 0.223 1211 G HA3 -0.150 3.810 3.960 -0.000 0.000 0.223 1211 G C -0.098 174.793 174.900 -0.016 0.000 0.990 1211 G CA 0.048 45.133 45.100 -0.024 0.000 0.671 1211 G HN 0.302 nan 8.290 nan 0.000 0.521 1212 L N 1.635 122.839 121.223 -0.032 0.000 2.312 1212 L HA 0.239 4.579 4.340 -0.000 0.000 0.287 1212 L C 1.564 178.413 176.870 -0.034 0.000 1.091 1212 L CA 0.608 55.438 54.840 -0.017 0.000 0.846 1212 L CB 0.636 42.696 42.059 0.001 0.000 1.219 1212 L HN 0.285 nan 8.230 nan 0.000 0.439 1213 D N 3.493 123.873 120.400 -0.033 0.000 2.170 1213 D HA -0.183 4.457 4.640 -0.000 0.000 0.193 1213 D C 0.589 176.814 176.300 -0.125 0.000 1.004 1213 D CA 1.703 55.673 54.000 -0.049 0.000 0.860 1213 D CB 0.490 41.268 40.800 -0.038 0.000 0.931 1213 D HN 0.604 nan 8.370 nan 0.000 0.448 1214 R N -1.418 118.971 120.500 -0.185 0.000 2.535 1214 R HA 0.396 4.736 4.340 -0.000 0.000 0.274 1214 R C -1.522 174.746 176.300 -0.054 0.000 1.090 1214 R CA -1.068 54.831 56.100 -0.335 0.000 0.930 1214 R CB 0.670 30.294 30.300 -1.128 0.000 1.223 1214 R HN 0.155 nan 8.270 nan 0.000 0.441 1215 Y N 3.480 123.824 120.300 0.074 0.000 2.576 1215 Y HA 0.809 5.359 4.550 -0.000 0.000 0.346 1215 Y C -1.672 174.473 175.900 0.409 0.000 1.018 1215 Y CA -1.287 56.931 58.100 0.197 0.000 1.050 1215 Y CB 2.136 40.631 38.460 0.057 0.000 1.280 1215 Y HN 0.735 nan 8.280 nan 0.000 0.474 1216 F N 1.473 120.844 119.950 -0.965 0.000 2.713 1216 F HA 0.694 5.221 4.527 -0.000 0.000 0.311 1216 F C -1.996 173.138 175.800 -1.111 0.000 1.141 1216 F CA -0.729 56.611 58.000 -1.100 0.000 0.939 1216 F CB 1.948 40.580 39.000 -0.614 0.000 1.325 1216 F HN 0.749 nan 8.300 nan 0.000 0.453 1217 Q N 2.530 121.841 119.800 -0.815 0.000 2.438 1217 Q HA 0.482 4.822 4.340 -0.000 0.000 0.272 1217 Q C -1.765 174.116 176.000 -0.198 0.000 0.994 1217 Q CA -0.899 54.568 55.803 -0.559 0.000 0.887 1217 Q CB 2.715 31.285 28.738 -0.280 0.000 1.432 1217 Q HN 0.967 nan 8.270 nan 0.000 0.392 1218 I N 0.786 121.301 120.570 -0.092 0.000 2.276 1218 I HA 0.752 4.922 4.170 -0.000 0.000 0.290 1218 I C -0.367 175.768 176.117 0.029 0.000 1.109 1218 I CA -0.463 60.848 61.300 0.019 0.000 1.229 1218 I CB 0.859 38.930 38.000 0.119 0.000 1.452 1218 I HN 0.497 nan 8.210 nan 0.000 0.497 1219 A N 5.558 128.378 122.820 0.001 0.000 2.301 1219 A HA 0.711 5.031 4.320 -0.000 0.000 0.312 1219 A C -0.054 177.487 177.584 -0.073 0.000 1.182 1219 A CA -0.782 51.242 52.037 -0.022 0.000 0.826 1219 A CB 0.976 19.951 19.000 -0.041 0.000 1.134 1219 A HN 0.798 nan 8.150 nan 0.000 0.501 1220 R N 1.149 121.607 120.500 -0.071 0.000 2.308 1220 R HA 0.533 4.873 4.340 -0.000 0.000 0.305 1220 R C -1.206 174.813 176.300 -0.469 0.000 1.053 1220 R CA 0.096 56.069 56.100 -0.212 0.000 0.957 1220 R CB 0.166 30.506 30.300 0.067 0.000 1.022 1220 R HN 0.718 nan 8.270 nan 0.000 0.461 1221 C N 4.559 123.358 119.300 -0.835 0.000 2.529 1221 C HA 0.656 5.116 4.460 -0.000 0.000 0.329 1221 C C -1.213 173.173 174.990 -1.007 0.000 1.194 1221 C CA -0.706 57.819 59.018 -0.821 0.000 1.779 1221 C CB 0.775 27.921 27.740 -0.990 0.000 2.322 1221 C HN 0.729 nan 8.230 nan 0.000 0.500 1222 F N 1.558 121.439 119.950 -0.114 0.000 2.539 1222 F HA 0.653 5.179 4.527 -0.000 0.000 0.318 1222 F C 0.172 176.189 175.800 0.362 0.000 1.135 1222 F CA -0.612 57.497 58.000 0.181 0.000 0.915 1222 F CB 1.083 40.223 39.000 0.233 0.000 1.176 1222 F HN 0.405 nan 8.300 nan 0.000 0.440 1223 R N 1.872 122.757 120.500 0.643 0.000 2.502 1223 R HA 0.240 4.580 4.340 -0.000 0.000 0.298 1223 R C -1.551 174.894 176.300 0.243 0.000 1.018 1223 R CA -0.549 55.791 56.100 0.400 0.000 0.899 1223 R CB 1.198 31.733 30.300 0.391 0.000 1.181 1223 R HN 0.607 nan 8.270 nan 0.000 0.444 1224 D N 4.529 124.755 120.400 -0.291 0.000 2.558 1224 D HA 0.029 4.669 4.640 -0.000 0.000 0.221 1224 D C -0.522 175.665 176.300 -0.189 0.000 1.143 1224 D CA 0.003 53.636 54.000 -0.611 0.000 1.010 1224 D CB 0.378 40.459 40.800 -1.199 0.000 1.068 1224 D HN 0.548 nan 8.370 nan 0.000 0.511 1225 E N 0.535 120.724 120.200 -0.018 0.000 2.222 1225 E HA 0.302 4.652 4.350 -0.000 0.000 0.267 1225 E C -0.597 176.015 176.600 0.019 0.000 0.963 1225 E CA -0.893 55.510 56.400 0.005 0.000 0.837 1225 E CB 1.185 30.908 29.700 0.038 0.000 1.183 1225 E HN 0.020 nan 8.360 nan 0.000 0.403 1226 D N 2.247 122.651 120.400 0.008 0.000 2.934 1226 D HA 0.100 4.740 4.640 -0.000 0.000 0.237 1226 D C -0.369 175.943 176.300 0.020 0.000 1.158 1226 D CA 0.124 54.133 54.000 0.014 0.000 0.971 1226 D CB 0.102 40.904 40.800 0.003 0.000 1.123 1226 D HN 0.210 nan 8.370 nan 0.000 0.467 1227 L N 1.952 123.195 121.223 0.033 0.000 2.305 1227 L HA 0.219 4.559 4.340 -0.000 0.000 0.281 1227 L C 1.595 178.483 176.870 0.030 0.000 1.085 1227 L CA 0.233 55.090 54.840 0.027 0.000 0.813 1227 L CB 1.445 43.522 42.059 0.030 0.000 1.157 1227 L HN 0.250 nan 8.230 nan 0.000 0.436 1228 R N 2.565 123.076 120.500 0.017 0.000 2.582 1228 R HA 0.187 4.527 4.340 -0.000 0.000 0.285 1228 R C 0.451 176.756 176.300 0.007 0.000 0.940 1228 R CA 0.152 56.261 56.100 0.016 0.000 1.072 1228 R CB 0.066 30.375 30.300 0.014 0.000 1.527 1228 R HN 0.433 nan 8.270 nan 0.000 0.538 1229 A N 3.194 126.014 122.820 0.000 0.000 2.900 1229 A HA 0.038 4.358 4.320 -0.000 0.000 0.246 1229 A C 0.146 177.723 177.584 -0.013 0.000 1.725 1229 A CA 0.521 52.553 52.037 -0.008 0.000 1.400 1229 A CB -0.938 18.054 19.000 -0.013 0.000 0.973 1229 A HN 0.458 nan 8.150 nan 0.000 0.635 1230 D N -0.110 120.287 120.400 -0.005 0.000 2.737 1230 D HA -0.132 4.508 4.640 -0.000 0.000 0.238 1230 D C -0.628 175.664 176.300 -0.014 0.000 1.157 1230 D CA 0.716 54.713 54.000 -0.006 0.000 0.694 1230 D CB -0.309 40.484 40.800 -0.011 0.000 1.021 1230 D HN 0.471 nan 8.370 nan 0.000 0.420 1231 R N 1.079 121.577 120.500 -0.004 0.000 2.750 1231 R HA 0.453 4.793 4.340 -0.000 0.000 0.281 1231 R C 0.274 176.601 176.300 0.044 0.000 0.972 1231 R CA -0.666 55.425 56.100 -0.014 0.000 0.912 1231 R CB 1.522 31.796 30.300 -0.044 0.000 1.187 1231 R HN 0.211 nan 8.270 nan 0.000 0.464 1232 Q N 1.863 121.709 119.800 0.076 0.000 2.248 1232 Q HA 0.354 4.694 4.340 -0.000 0.000 0.263 1232 Q C -1.540 174.595 176.000 0.226 0.000 1.007 1232 Q CA -1.834 54.053 55.803 0.139 0.000 0.877 1232 Q CB 1.549 30.372 28.738 0.141 0.000 1.315 1232 Q HN 0.235 nan 8.270 nan 0.000 0.454 1233 P HA -0.154 nan 4.420 nan 0.000 0.218 1233 P C -0.468 177.050 177.300 0.363 0.000 1.149 1233 P CA 1.328 64.646 63.100 0.364 0.000 0.817 1233 P CB 0.316 32.191 31.700 0.292 0.000 0.785 1234 D N -0.787 119.724 120.400 0.186 0.000 2.732 1234 D HA 0.519 5.159 4.640 -0.000 0.000 0.229 1234 D C -0.565 175.763 176.300 0.047 0.000 1.152 1234 D CA -0.952 52.982 54.000 -0.110 0.000 0.854 1234 D CB 1.212 41.678 40.800 -0.556 0.000 1.590 1234 D HN 0.025 nan 8.370 nan 0.000 0.468 1235 F N -1.883 117.956 119.950 -0.185 0.000 2.664 1235 F HA 0.792 5.319 4.527 -0.000 0.000 0.317 1235 F C -0.930 174.823 175.800 -0.079 0.000 1.108 1235 F CA -1.096 56.856 58.000 -0.079 0.000 0.957 1235 F CB 1.361 40.351 39.000 -0.016 0.000 1.365 1235 F HN 0.228 nan 8.300 nan 0.000 0.475 1236 T N 1.310 115.946 114.554 0.136 0.000 2.824 1236 T HA 0.553 4.903 4.350 -0.000 0.000 0.280 1236 T C -0.885 173.912 174.700 0.161 0.000 0.995 1236 T CA -0.616 61.521 62.100 0.062 0.000 1.009 1236 T CB 1.458 70.377 68.868 0.086 0.000 0.955 1236 T HN 0.590 nan 8.240 nan 0.000 0.452 1237 Q N 1.250 121.105 119.800 0.092 0.000 2.397 1237 Q HA 0.545 4.885 4.340 -0.000 0.000 0.275 1237 Q C -1.350 174.692 176.000 0.070 0.000 1.090 1237 Q CA -1.150 54.740 55.803 0.146 0.000 0.809 1237 Q CB 2.692 31.524 28.738 0.157 0.000 1.362 1237 Q HN 0.439 nan 8.270 nan 0.000 0.431 1238 L N 1.822 123.072 121.223 0.044 0.000 2.260 1238 L HA 0.383 4.723 4.340 -0.000 0.000 0.289 1238 L C -1.067 175.723 176.870 -0.134 0.000 1.057 1238 L CA 0.253 55.008 54.840 -0.142 0.000 0.811 1238 L CB 0.714 42.495 42.059 -0.464 0.000 1.184 1238 L HN 0.480 nan 8.230 nan 0.000 0.429 1239 D N 4.499 124.844 120.400 -0.092 0.000 2.256 1239 D HA 0.607 5.247 4.640 -0.000 0.000 0.246 1239 D C -1.427 174.843 176.300 -0.050 0.000 1.042 1239 D CA -0.142 53.863 54.000 0.007 0.000 0.841 1239 D CB 1.452 42.320 40.800 0.114 0.000 1.223 1239 D HN 0.687 nan 8.370 nan 0.000 0.470 1240 L N 2.038 123.314 121.223 0.088 0.000 2.472 1240 L HA 0.695 5.035 4.340 -0.000 0.000 0.260 1240 L C -1.727 175.345 176.870 0.337 0.000 0.963 1240 L CA -0.552 54.374 54.840 0.143 0.000 0.829 1240 L CB 2.097 44.147 42.059 -0.015 0.000 1.348 1240 L HN 0.297 nan 8.230 nan 0.000 0.408 1241 E N 3.599 124.086 120.200 0.478 0.000 2.331 1241 E HA 0.718 5.068 4.350 -0.000 0.000 0.275 1241 E C -1.701 175.073 176.600 0.288 0.000 0.895 1241 E CA -0.335 56.282 56.400 0.362 0.000 0.753 1241 E CB 2.127 32.011 29.700 0.307 0.000 1.216 1241 E HN 0.634 nan 8.360 nan 0.000 0.434 1242 M N 1.068 120.778 119.600 0.183 0.000 2.550 1242 M HA 0.553 5.033 4.480 -0.000 0.000 0.292 1242 M C -0.797 175.517 176.300 0.023 0.000 1.221 1242 M CA -0.951 54.391 55.300 0.069 0.000 0.873 1242 M CB 2.478 35.131 32.600 0.089 0.000 1.727 1242 M HN 0.322 nan 8.290 nan 0.000 0.459 1243 S N 0.239 115.908 115.700 -0.052 0.000 2.593 1243 S HA 0.704 5.174 4.470 -0.000 0.000 0.297 1243 S C -0.409 174.141 174.600 -0.083 0.000 1.112 1243 S CA -0.556 57.529 58.200 -0.192 0.000 1.043 1243 S CB 0.583 63.565 63.200 -0.364 0.000 1.054 1243 S HN 0.748 nan 8.310 nan 0.000 0.516 1244 F N -0.156 119.767 119.950 -0.046 0.000 3.074 1244 F HA -0.190 4.337 4.527 -0.000 0.000 0.287 1244 F C 0.354 176.121 175.800 -0.055 0.000 0.932 1244 F CA 0.013 57.973 58.000 -0.067 0.000 0.995 1244 F CB -1.952 37.010 39.000 -0.064 0.000 0.966 1244 F HN 0.345 nan 8.300 nan 0.000 0.721 1245 V N -3.155 116.785 119.914 0.043 0.000 2.919 1245 V HA 0.809 4.929 4.120 -0.000 0.000 0.316 1245 V C 0.092 176.179 176.094 -0.012 0.000 1.077 1245 V CA -1.227 61.086 62.300 0.022 0.000 0.977 1245 V CB 2.305 34.138 31.823 0.016 0.000 1.039 1245 V HN 0.176 nan 8.190 nan 0.000 0.441 1246 E N 0.920 121.104 120.200 -0.027 0.000 2.264 1246 E HA 0.512 4.862 4.350 -0.000 0.000 0.260 1246 E C 0.649 177.201 176.600 -0.081 0.000 0.961 1246 E CA -0.906 55.466 56.400 -0.047 0.000 0.834 1246 E CB 2.189 31.861 29.700 -0.046 0.000 1.230 1246 E HN 0.403 nan 8.360 nan 0.000 0.412 1247 V N 1.358 121.216 119.914 -0.093 0.000 2.278 1247 V HA -0.296 3.824 4.120 -0.000 0.000 0.251 1247 V C 1.954 177.871 176.094 -0.296 0.000 1.062 1247 V CA 1.892 64.084 62.300 -0.179 0.000 1.038 1247 V CB -0.478 31.277 31.823 -0.114 0.000 0.646 1247 V HN 0.636 nan 8.190 nan 0.000 0.447 1248 E N -0.136 119.940 120.200 -0.206 0.000 2.160 1248 E HA -0.213 4.137 4.350 -0.000 0.000 0.195 1248 E C 1.978 178.466 176.600 -0.187 0.000 0.991 1248 E CA 1.306 57.580 56.400 -0.210 0.000 0.810 1248 E CB -0.411 29.212 29.700 -0.128 0.000 0.742 1248 E HN 0.685 nan 8.360 nan 0.000 0.466 1249 D N 0.155 120.475 120.400 -0.133 0.000 2.144 1249 D HA -0.095 4.545 4.640 -0.000 0.000 0.200 1249 D C 2.106 178.349 176.300 -0.095 0.000 0.978 1249 D CA 0.679 54.631 54.000 -0.080 0.000 0.833 1249 D CB 0.078 40.859 40.800 -0.032 0.000 0.961 1249 D HN 0.057 nan 8.370 nan 0.000 0.470 1250 V N 1.758 121.570 119.914 -0.169 0.000 2.307 1250 V HA -0.199 3.921 4.120 -0.000 0.000 0.245 1250 V C 2.699 178.621 176.094 -0.286 0.000 1.045 1250 V CA 1.051 63.240 62.300 -0.184 0.000 1.024 1250 V CB -0.488 31.168 31.823 -0.278 0.000 0.651 1250 V HN 0.177 nan 8.190 nan 0.000 0.449 1251 L N -0.251 120.642 121.223 -0.549 0.000 2.017 1251 L HA -0.206 4.134 4.340 -0.000 0.000 0.208 1251 L C 2.581 179.317 176.870 -0.222 0.000 1.073 1251 L CA 1.894 56.308 54.840 -0.710 0.000 0.745 1251 L CB -0.844 40.598 42.059 -1.029 0.000 0.894 1251 L HN 0.385 nan 8.230 nan 0.000 0.432 1252 E N 0.319 120.415 120.200 -0.175 0.000 2.077 1252 E HA -0.257 4.093 4.350 -0.000 0.000 0.193 1252 E C 2.177 178.771 176.600 -0.009 0.000 0.989 1252 E CA 1.170 57.522 56.400 -0.080 0.000 0.800 1252 E CB -0.191 29.468 29.700 -0.068 0.000 0.746 1252 E HN 0.309 nan 8.360 nan 0.000 0.452 1253 L N 1.454 122.695 121.223 0.030 0.000 2.046 1253 L HA -0.166 4.174 4.340 -0.000 0.000 0.208 1253 L C 1.789 178.726 176.870 0.111 0.000 1.077 1253 L CA 1.565 56.476 54.840 0.119 0.000 0.747 1253 L CB -0.216 41.939 42.059 0.159 0.000 0.896 1253 L HN 0.064 nan 8.230 nan 0.000 0.432 1254 N N -0.353 118.435 118.700 0.147 0.000 2.188 1254 N HA -0.177 4.563 4.740 -0.000 0.000 0.184 1254 N C 1.632 177.231 175.510 0.149 0.000 1.018 1254 N CA 1.587 54.808 53.050 0.285 0.000 0.858 1254 N CB -0.036 38.792 38.487 0.568 0.000 0.989 1254 N HN 0.572 nan 8.380 nan 0.000 0.426 1255 E N 0.879 121.098 120.200 0.032 0.000 2.077 1255 E HA -0.132 4.218 4.350 -0.000 0.000 0.193 1255 E C 2.013 178.411 176.600 -0.337 0.000 0.989 1255 E CA 0.883 57.052 56.400 -0.384 0.000 0.800 1255 E CB -0.039 29.328 29.700 -0.554 0.000 0.746 1255 E HN 0.308 nan 8.360 nan 0.000 0.452 1256 R N 0.545 120.933 120.500 -0.188 0.000 2.092 1256 R HA -0.027 4.313 4.340 -0.000 0.000 0.231 1256 R C 2.514 178.526 176.300 -0.480 0.000 1.119 1256 R CA 0.601 56.602 56.100 -0.164 0.000 0.970 1256 R CB -0.242 30.113 30.300 0.092 0.000 0.864 1256 R HN 0.185 nan 8.270 nan 0.000 0.440 1257 L N 0.219 121.063 121.223 -0.632 0.000 2.027 1257 L HA -0.172 4.168 4.340 -0.000 0.000 0.206 1257 L C 2.343 179.033 176.870 -0.301 0.000 1.074 1257 L CA 1.288 55.556 54.840 -0.953 0.000 0.745 1257 L CB -0.089 41.682 42.059 -0.480 0.000 0.898 1257 L HN 0.234 nan 8.230 nan 0.000 0.433 1258 M N -0.168 119.387 119.600 -0.075 0.000 2.159 1258 M HA -0.149 4.331 4.480 -0.000 0.000 0.263 1258 M C 2.126 178.406 176.300 -0.034 0.000 1.063 1258 M CA 2.064 57.341 55.300 -0.037 0.000 1.110 1258 M CB -0.446 31.961 32.600 -0.323 0.000 1.374 1258 M HN 0.262 nan 8.290 nan 0.000 0.411 1259 A N -1.692 121.059 122.820 -0.116 0.000 1.930 1259 A HA -0.194 4.126 4.320 -0.000 0.000 0.217 1259 A C 2.036 179.637 177.584 0.028 0.000 1.175 1259 A CA 1.989 53.998 52.037 -0.047 0.000 0.627 1259 A CB -1.145 17.806 19.000 -0.080 0.000 0.815 1259 A HN 0.741 nan 8.150 nan 0.000 0.443 1260 H N -0.429 118.567 119.070 -0.123 0.000 2.326 1260 H HA -0.063 4.493 4.556 -0.000 0.000 0.301 1260 H C 1.833 177.155 175.328 -0.009 0.000 1.081 1260 H CA 2.007 58.009 56.048 -0.076 0.000 1.334 1260 H CB -0.221 29.420 29.762 -0.201 0.000 1.385 1260 H HN 0.097 nan 8.280 nan 0.000 0.504 1261 V N 0.074 119.976 119.914 -0.021 0.000 2.287 1261 V HA -0.253 3.867 4.120 -0.000 0.000 0.248 1261 V C 2.179 178.241 176.094 -0.053 0.000 1.053 1261 V CA 2.033 64.319 62.300 -0.024 0.000 1.027 1261 V CB -0.741 31.155 31.823 0.122 0.000 0.646 1261 V HN 0.360 nan 8.190 nan 0.000 0.447 1262 F N 0.072 119.949 119.950 -0.121 0.000 2.234 1262 F HA -0.098 4.429 4.527 -0.000 0.000 0.299 1262 F C 2.559 178.301 175.800 -0.096 0.000 1.087 1262 F CA 1.848 59.778 58.000 -0.117 0.000 1.340 1262 F CB -0.421 38.515 39.000 -0.107 0.000 1.031 1262 F HN -0.011 nan 8.300 nan 0.000 0.500 1263 R N 0.374 120.910 120.500 0.060 0.000 2.066 1263 R HA -0.125 4.214 4.340 -0.000 0.000 0.232 1263 R C 2.127 178.388 176.300 -0.065 0.000 1.131 1263 R CA 1.488 57.591 56.100 0.004 0.000 0.955 1263 R CB -0.137 30.159 30.300 -0.006 0.000 0.851 1263 R HN 0.118 nan 8.270 nan 0.000 0.432 1264 E N 0.119 120.217 120.200 -0.169 0.000 2.107 1264 E HA -0.117 4.233 4.350 -0.000 0.000 0.191 1264 E C 1.765 178.301 176.600 -0.106 0.000 0.982 1264 E CA 1.287 57.588 56.400 -0.164 0.000 0.809 1264 E CB -0.064 29.465 29.700 -0.286 0.000 0.756 1264 E HN 0.455 nan 8.360 nan 0.000 0.459 1265 A N 0.421 123.162 122.820 -0.131 0.000 1.878 1265 A HA 0.057 4.377 4.320 -0.000 0.000 0.213 1265 A C 2.142 179.654 177.584 -0.120 0.000 1.192 1265 A CA 0.659 52.618 52.037 -0.130 0.000 0.619 1265 A CB -0.175 18.709 19.000 -0.193 0.000 0.837 1265 A HN 0.150 nan 8.150 nan 0.000 0.446 1266 L N -1.846 119.295 121.223 -0.136 0.000 2.701 1266 L HA 0.297 4.637 4.340 -0.000 0.000 0.238 1266 L C 1.414 178.284 176.870 -0.001 0.000 1.106 1266 L CA 0.487 55.280 54.840 -0.080 0.000 0.898 1266 L CB 0.323 42.307 42.059 -0.124 0.000 1.188 1266 L HN 0.542 nan 8.230 nan 0.000 0.508 1267 G N 1.390 110.193 108.800 0.006 0.000 2.198 1267 G HA2 -0.224 3.736 3.960 -0.000 0.000 0.257 1267 G HA3 -0.224 3.736 3.960 -0.000 0.000 0.257 1267 G C -0.123 174.822 174.900 0.076 0.000 1.042 1267 G CA 0.141 45.261 45.100 0.033 0.000 0.791 1267 G HN 0.108 nan 8.290 nan 0.000 0.502 1268 V N -0.218 119.769 119.914 0.120 0.000 2.459 1268 V HA 0.610 4.730 4.120 -0.000 0.000 0.295 1268 V C 0.184 176.379 176.094 0.168 0.000 1.029 1268 V CA -0.842 61.569 62.300 0.185 0.000 0.874 1268 V CB 1.919 33.938 31.823 0.328 0.000 0.985 1268 V HN 0.360 nan 8.190 nan 0.000 0.438 1269 E N 4.038 124.315 120.200 0.129 0.000 2.115 1269 E HA 0.482 4.832 4.350 -0.000 0.000 0.282 1269 E C -1.019 175.636 176.600 0.091 0.000 0.987 1269 E CA -0.132 56.325 56.400 0.095 0.000 0.797 1269 E CB 0.823 30.567 29.700 0.073 0.000 1.086 1269 E HN 0.546 nan 8.360 nan 0.000 0.397 1270 L N 6.666 127.930 121.223 0.068 0.000 2.312 1270 L HA 0.485 4.825 4.340 -0.000 0.000 0.281 1270 L C -1.767 175.152 176.870 0.082 0.000 1.070 1270 L CA -2.029 52.852 54.840 0.068 0.000 0.805 1270 L CB 1.098 43.171 42.059 0.022 0.000 1.174 1270 L HN 0.484 nan 8.230 nan 0.000 0.434 1271 P HA 0.315 nan 4.420 nan 0.000 0.281 1271 P C -1.112 176.247 177.300 0.098 0.000 1.252 1271 P CA -0.454 62.699 63.100 0.088 0.000 0.778 1271 P CB 1.623 33.374 31.700 0.085 0.000 0.895 1272 L N 5.228 126.459 121.223 0.013 0.000 2.333 1272 L HA 0.590 4.930 4.340 -0.000 0.000 0.269 1272 L C -1.760 175.098 176.870 -0.019 0.000 1.010 1272 L CA -1.748 53.050 54.840 -0.071 0.000 0.818 1272 L CB 0.332 42.293 42.059 -0.163 0.000 1.306 1272 L HN 0.366 nan 8.230 nan 0.000 0.430 1273 P HA 0.433 nan 4.420 nan 0.000 0.279 1273 P C -1.024 176.331 177.300 0.092 0.000 1.276 1273 P CA -0.524 62.540 63.100 -0.059 0.000 0.801 1273 P CB 0.380 32.078 31.700 -0.003 0.000 1.127 1274 F N -0.414 119.590 119.950 0.091 0.000 2.382 1274 F HA 0.333 4.860 4.527 -0.000 0.000 0.331 1274 F C -1.729 174.143 175.800 0.121 0.000 1.121 1274 F CA -2.545 55.487 58.000 0.054 0.000 1.183 1274 F CB -1.114 37.846 39.000 -0.067 0.000 1.207 1274 F HN 0.130 nan 8.300 nan 0.000 0.555 1275 P HA 0.281 nan 4.420 nan 0.000 0.272 1275 P C -1.029 176.425 177.300 0.258 0.000 1.223 1275 P CA -0.296 62.921 63.100 0.195 0.000 0.784 1275 P CB 0.558 32.321 31.700 0.105 0.000 0.923 1276 R N 1.644 122.277 120.500 0.222 0.000 2.476 1276 R HA 0.584 4.923 4.340 -0.000 0.000 0.305 1276 R C -0.825 175.568 176.300 0.155 0.000 0.965 1276 R CA -0.538 55.708 56.100 0.244 0.000 0.867 1276 R CB 1.141 31.563 30.300 0.203 0.000 1.176 1276 R HN 0.411 nan 8.270 nan 0.000 0.447 1277 L N 1.820 123.131 121.223 0.146 0.000 2.362 1277 L HA 0.493 4.832 4.340 -0.000 0.000 0.271 1277 L C 0.310 177.216 176.870 0.059 0.000 1.002 1277 L CA -0.917 53.979 54.840 0.094 0.000 0.818 1277 L CB 2.264 44.380 42.059 0.094 0.000 1.298 1277 L HN 0.689 nan 8.230 nan 0.000 0.420 1278 S N 0.584 116.303 115.700 0.033 0.000 2.603 1278 S HA 0.074 4.544 4.470 -0.000 0.000 0.268 1278 S C 0.929 175.512 174.600 -0.030 0.000 1.317 1278 S CA -0.329 57.873 58.200 0.003 0.000 1.012 1278 S CB 0.790 64.005 63.200 0.025 0.000 0.926 1278 S HN 0.601 nan 8.310 nan 0.000 0.539 1279 Y N 1.332 121.484 120.300 -0.246 0.000 2.102 1279 Y HA -0.226 4.324 4.550 -0.000 0.000 0.280 1279 Y C 2.396 178.263 175.900 -0.056 0.000 1.178 1279 Y CA 2.469 60.416 58.100 -0.256 0.000 1.146 1279 Y CB -0.527 37.736 38.460 -0.328 0.000 0.968 1279 Y HN 0.979 nan 8.280 nan 0.000 0.504 1280 E N -0.172 119.966 120.200 -0.103 0.000 2.051 1280 E HA -0.269 4.081 4.350 -0.000 0.000 0.192 1280 E C 2.293 178.817 176.600 -0.126 0.000 0.991 1280 E CA 1.360 57.675 56.400 -0.142 0.000 0.799 1280 E CB -0.312 29.384 29.700 -0.007 0.000 0.748 1280 E HN 0.688 nan 8.360 nan 0.000 0.449 1281 E N -0.370 119.791 120.200 -0.064 0.000 2.110 1281 E HA -0.215 4.135 4.350 -0.000 0.000 0.193 1281 E C 1.858 178.439 176.600 -0.031 0.000 0.988 1281 E CA 0.963 57.339 56.400 -0.040 0.000 0.804 1281 E CB -0.095 29.605 29.700 -0.001 0.000 0.745 1281 E HN 0.345 nan 8.360 nan 0.000 0.458 1282 A N 0.618 123.424 122.820 -0.023 0.000 1.897 1282 A HA -0.142 4.178 4.320 -0.000 0.000 0.215 1282 A C 2.109 179.698 177.584 0.008 0.000 1.181 1282 A CA 1.150 53.225 52.037 0.062 0.000 0.620 1282 A CB -0.265 18.758 19.000 0.038 0.000 0.821 1282 A HN 0.229 nan 8.150 nan 0.000 0.443 1283 M N -0.329 119.181 119.600 -0.150 0.000 2.132 1283 M HA -0.069 4.411 4.480 -0.000 0.000 0.263 1283 M C 1.871 178.112 176.300 -0.099 0.000 1.065 1283 M CA 1.189 56.396 55.300 -0.155 0.000 1.122 1283 M CB -1.238 31.177 32.600 -0.308 0.000 1.365 1283 M HN 0.396 nan 8.290 nan 0.000 0.411 1284 E N -0.106 120.027 120.200 -0.111 0.000 2.107 1284 E HA -0.083 4.267 4.350 -0.000 0.000 0.191 1284 E C 2.181 178.688 176.600 -0.154 0.000 0.982 1284 E CA 0.827 57.163 56.400 -0.106 0.000 0.809 1284 E CB -0.061 29.584 29.700 -0.092 0.000 0.756 1284 E HN 0.512 nan 8.360 nan 0.000 0.459 1285 R N -0.779 119.588 120.500 -0.223 0.000 2.140 1285 R HA 0.019 4.359 4.340 -0.000 0.000 0.213 1285 R C 1.128 177.011 176.300 -0.696 0.000 1.059 1285 R CA 0.716 56.523 56.100 -0.487 0.000 1.000 1285 R CB 0.216 30.124 30.300 -0.653 0.000 0.910 1285 R HN 0.254 nan 8.270 nan 0.000 0.455 1286 Y N -1.480 118.771 120.300 -0.082 0.000 2.563 1286 Y HA 0.289 4.839 4.550 -0.000 0.000 0.250 1286 Y C 1.185 177.043 175.900 -0.070 0.000 1.126 1286 Y CA 0.111 58.157 58.100 -0.089 0.000 1.231 1286 Y CB 1.223 39.615 38.460 -0.113 0.000 1.288 1286 Y HN 0.169 nan 8.280 nan 0.000 0.537 1287 G N 1.311 110.138 108.800 0.044 0.000 2.179 1287 G HA2 -0.240 3.719 3.960 -0.000 0.000 0.257 1287 G HA3 -0.240 3.719 3.960 -0.000 0.000 0.257 1287 G C 0.054 174.978 174.900 0.040 0.000 1.010 1287 G CA 0.732 45.843 45.100 0.018 0.000 0.736 1287 G HN 0.470 nan 8.290 nan 0.000 0.513 1288 S N -1.072 114.665 115.700 0.062 0.000 2.537 1288 S HA 0.524 4.994 4.470 -0.000 0.000 0.271 1288 S C 0.302 174.956 174.600 0.089 0.000 1.148 1288 S CA 0.461 58.705 58.200 0.073 0.000 0.868 1288 S CB 1.278 64.512 63.200 0.057 0.000 1.115 1288 S HN 0.441 nan 8.310 nan 0.000 0.461 1289 D N 1.806 122.305 120.400 0.164 0.000 2.340 1289 D HA 0.113 4.753 4.640 -0.000 0.000 0.220 1289 D C 0.456 176.885 176.300 0.215 0.000 1.039 1289 D CA 0.119 54.282 54.000 0.271 0.000 0.866 1289 D CB -0.158 40.975 40.800 0.555 0.000 0.913 1289 D HN 0.623 nan 8.370 nan 0.000 0.523 1290 K N -0.309 120.156 120.400 0.108 0.000 3.146 1290 K HA 0.381 4.701 4.320 -0.000 0.000 0.168 1290 K C -3.050 173.520 176.600 -0.050 0.000 1.075 1290 K CA -1.622 54.691 56.287 0.042 0.000 0.843 1290 K CB 0.981 33.508 32.500 0.045 0.000 1.002 1290 K HN -0.175 nan 8.250 nan 0.000 0.597 1291 P HA -0.060 nan 4.420 nan 0.000 0.266 1291 P C -0.792 176.296 177.300 -0.352 0.000 1.195 1291 P CA 0.139 63.061 63.100 -0.297 0.000 0.768 1291 P CB 0.521 31.907 31.700 -0.524 0.000 0.838 1292 D N 2.797 122.973 120.400 -0.374 0.000 2.373 1292 D HA 0.131 4.771 4.640 -0.000 0.000 0.227 1292 D C 0.362 176.339 176.300 -0.539 0.000 1.091 1292 D CA -0.173 53.631 54.000 -0.327 0.000 0.840 1292 D CB 0.318 41.043 40.800 -0.126 0.000 1.060 1292 D HN 0.234 nan 8.370 nan 0.000 0.502 1293 L N 3.628 124.582 121.223 -0.450 0.000 2.653 1293 L HA 0.230 4.570 4.340 -0.000 0.000 0.231 1293 L C 1.708 178.422 176.870 -0.259 0.000 1.153 1293 L CA -0.087 54.495 54.840 -0.429 0.000 0.933 1293 L CB 0.063 41.918 42.059 -0.340 0.000 1.175 1293 L HN 0.164 nan 8.230 nan 0.000 0.473 1294 R N 0.618 121.015 120.500 -0.171 0.000 2.316 1294 R HA 0.041 4.381 4.340 -0.000 0.000 0.202 1294 R C -0.135 176.250 176.300 0.142 0.000 1.029 1294 R CA 0.692 56.785 56.100 -0.011 0.000 1.018 1294 R CB -0.067 30.254 30.300 0.035 0.000 0.888 1294 R HN 0.312 nan 8.270 nan 0.000 0.471 1295 F N -5.130 114.784 119.950 -0.061 0.000 2.662 1295 F HA 0.670 5.197 4.527 -0.000 0.000 0.312 1295 F C 0.748 176.560 175.800 0.020 0.000 1.113 1295 F CA -1.388 56.597 58.000 -0.025 0.000 0.951 1295 F CB 0.518 39.501 39.000 -0.028 0.000 1.344 1295 F HN -0.160 nan 8.300 nan 0.000 0.462 1296 G N 0.697 109.586 108.800 0.149 0.000 2.535 1296 G HA2 0.230 4.190 3.960 -0.000 0.000 0.210 1296 G HA3 0.230 4.190 3.960 -0.000 0.000 0.210 1296 G C 0.412 175.368 174.900 0.093 0.000 1.593 1296 G CA -0.001 45.144 45.100 0.075 0.000 0.948 1296 G HN 0.964 nan 8.290 nan 0.000 0.476 1297 L N 0.630 121.938 121.223 0.142 0.000 3.854 1297 L HA -0.161 4.179 4.340 -0.000 0.000 0.460 1297 L C -0.040 176.852 176.870 0.037 0.000 1.228 1297 L CA -0.185 54.731 54.840 0.126 0.000 0.760 1297 L CB -1.801 40.416 42.059 0.264 0.000 1.597 1297 L HN 0.430 nan 8.230 nan 0.000 0.852 1298 E N 0.666 120.840 120.200 -0.044 0.000 2.398 1298 E HA 0.357 4.707 4.350 -0.000 0.000 0.263 1298 E C 0.282 176.792 176.600 -0.151 0.000 1.046 1298 E CA -0.515 55.770 56.400 -0.192 0.000 0.908 1298 E CB 0.891 30.442 29.700 -0.248 0.000 0.963 1298 E HN 0.294 nan 8.360 nan 0.000 0.431 1299 L N 2.622 123.725 121.223 -0.200 0.000 2.395 1299 L HA 0.263 4.603 4.340 -0.000 0.000 0.269 1299 L C -0.027 176.773 176.870 -0.118 0.000 1.133 1299 L CA -0.193 54.569 54.840 -0.130 0.000 0.812 1299 L CB 0.320 42.307 42.059 -0.120 0.000 1.125 1299 L HN 0.272 nan 8.230 nan 0.000 0.452 1300 K N 1.328 121.684 120.400 -0.073 0.000 2.324 1300 K HA 0.340 4.660 4.320 -0.000 0.000 0.253 1300 K C -0.785 175.806 176.600 -0.015 0.000 0.932 1300 K CA -0.703 55.558 56.287 -0.043 0.000 0.799 1300 K CB 1.818 34.308 32.500 -0.017 0.000 1.154 1300 K HN 0.297 nan 8.250 nan 0.000 0.425 1301 E N 1.953 122.147 120.200 -0.009 0.000 2.194 1301 E HA 0.189 4.539 4.350 -0.000 0.000 0.284 1301 E C -0.637 175.994 176.600 0.051 0.000 1.035 1301 E CA -0.111 56.294 56.400 0.008 0.000 0.836 1301 E CB 1.149 30.845 29.700 -0.006 0.000 1.070 1301 E HN 0.269 nan 8.360 nan 0.000 0.401 1302 V N 4.581 124.556 119.914 0.100 0.000 3.330 1302 V HA 0.310 4.430 4.120 -0.000 0.000 0.309 1302 V C 1.283 177.533 176.094 0.261 0.000 1.481 1302 V CA 0.873 63.287 62.300 0.190 0.000 1.068 1302 V CB 0.234 32.258 31.823 0.336 0.000 0.935 1302 V HN 0.803 nan 8.190 nan 0.000 0.453 1303 G N 1.596 110.482 108.800 0.144 0.000 2.469 1303 G HA2 -0.171 3.789 3.960 -0.000 0.000 0.219 1303 G HA3 -0.171 3.789 3.960 -0.000 0.000 0.219 1303 G C -0.257 174.752 174.900 0.180 0.000 1.150 1303 G CA 1.396 46.579 45.100 0.138 0.000 0.763 1303 G HN 0.558 nan 8.290 nan 0.000 0.561 1304 P HA -0.046 nan 4.420 nan 0.000 0.216 1304 P C 1.884 179.207 177.300 0.038 0.000 1.150 1304 P CA 0.612 63.749 63.100 0.061 0.000 0.837 1304 P CB -0.136 31.582 31.700 0.031 0.000 0.786 1305 L N -2.904 118.315 121.223 -0.007 0.000 2.549 1305 L HA -0.098 4.242 4.340 -0.000 0.000 0.230 1305 L C 1.418 178.067 176.870 -0.369 0.000 1.162 1305 L CA 1.034 55.751 54.840 -0.205 0.000 0.834 1305 L CB -0.610 41.246 42.059 -0.337 0.000 0.947 1305 L HN -0.019 nan 8.230 nan 0.000 0.452 1306 F N -1.441 118.540 119.950 0.053 0.000 2.704 1306 F HA 0.156 4.683 4.527 -0.000 0.000 0.304 1306 F C 1.318 177.149 175.800 0.053 0.000 1.094 1306 F CA -0.338 57.708 58.000 0.077 0.000 1.275 1306 F CB 0.303 39.388 39.000 0.142 0.000 1.073 1306 F HN -0.161 nan 8.300 nan 0.000 0.586 1307 R N 1.203 121.795 120.500 0.152 0.000 2.666 1307 R HA 0.306 4.646 4.340 -0.000 0.000 0.275 1307 R C 0.171 176.503 176.300 0.054 0.000 1.266 1307 R CA 0.137 56.296 56.100 0.098 0.000 1.401 1307 R CB -0.037 30.305 30.300 0.071 0.000 1.145 1307 R HN 0.195 nan 8.270 nan 0.000 0.581 1308 Q N -0.332 119.498 119.800 0.051 0.000 1.647 1308 Q HA 0.097 4.437 4.340 -0.000 0.000 0.172 1308 Q C 0.124 176.146 176.000 0.037 0.000 0.646 1308 Q CA 0.820 56.641 55.803 0.029 0.000 0.718 1308 Q CB 0.218 28.962 28.738 0.010 0.000 1.190 1308 Q HN 0.443 nan 8.270 nan 0.000 0.379 1309 S N -1.323 114.412 115.700 0.059 0.000 4.041 1309 S HA 0.837 5.307 4.470 -0.000 0.000 0.194 1309 S C 0.566 175.225 174.600 0.099 0.000 0.942 1309 S CA 0.019 58.265 58.200 0.077 0.000 1.642 1309 S CB 0.724 63.981 63.200 0.095 0.000 0.665 1309 S HN 0.708 nan 8.310 nan 0.000 0.698 1310 G N 0.729 109.616 108.800 0.144 0.000 2.509 1310 G HA2 0.350 4.310 3.960 -0.000 0.000 0.216 1310 G HA3 0.350 4.310 3.960 -0.000 0.000 0.216 1310 G C -1.471 173.496 174.900 0.111 0.000 3.092 1310 G CA -0.726 44.442 45.100 0.113 0.000 0.700 1310 G HN 0.695 nan 8.290 nan 0.000 0.451 1311 F N 5.181 125.033 119.950 -0.163 0.000 2.430 1311 F HA 0.598 5.125 4.527 -0.000 0.000 0.362 1311 F C 1.323 176.883 175.800 -0.399 0.000 1.103 1311 F CA -1.883 55.807 58.000 -0.517 0.000 1.045 1311 F CB 0.820 39.287 39.000 -0.889 0.000 1.276 1311 F HN 0.384 nan 8.300 nan 0.000 0.444 1312 R N 2.757 122.959 120.500 -0.496 0.000 2.402 1312 R HA -0.267 4.073 4.340 -0.000 0.000 0.201 1312 R C 1.973 177.909 176.300 -0.607 0.000 1.053 1312 R CA 2.488 58.295 56.100 -0.489 0.000 0.698 1312 R CB -1.566 28.491 30.300 -0.405 0.000 0.892 1312 R HN 0.553 nan 8.270 nan 0.000 0.355 1313 V N 0.694 120.081 119.914 -0.879 0.000 2.277 1313 V HA -0.267 3.853 4.120 -0.000 0.000 0.253 1313 V C 2.183 178.085 176.094 -0.320 0.000 1.067 1313 V CA 2.236 64.186 62.300 -0.583 0.000 1.047 1313 V CB -0.666 30.790 31.823 -0.613 0.000 0.649 1313 V HN 0.202 nan 8.190 nan 0.000 0.447 1314 F N -0.269 119.182 119.950 -0.831 0.000 2.805 1314 F HA 0.051 4.578 4.527 -0.000 0.000 0.301 1314 F C 2.076 177.695 175.800 -0.302 0.000 1.196 1314 F CA 1.071 58.743 58.000 -0.547 0.000 1.439 1314 F CB -0.512 38.073 39.000 -0.692 0.000 1.117 1314 F HN 0.275 nan 8.300 nan 0.000 0.581 1315 Q N -0.664 119.079 119.800 -0.094 0.000 2.313 1315 Q HA 0.035 4.375 4.340 -0.000 0.000 0.263 1315 Q C 1.800 177.762 176.000 -0.064 0.000 0.820 1315 Q CA 0.400 56.177 55.803 -0.045 0.000 0.974 1315 Q CB 0.032 28.761 28.738 -0.015 0.000 1.156 1315 Q HN 0.133 nan 8.270 nan 0.000 0.517 1316 E N 0.375 120.518 120.200 -0.096 0.000 2.268 1316 E HA 0.118 4.468 4.350 -0.000 0.000 0.195 1316 E C -0.313 176.243 176.600 -0.073 0.000 0.995 1316 E CA 0.709 57.060 56.400 -0.081 0.000 0.836 1316 E CB -0.068 29.574 29.700 -0.096 0.000 0.763 1316 E HN 0.340 nan 8.360 nan 0.000 0.491 1317 A N 0.871 123.638 122.820 -0.087 0.000 2.331 1317 A HA 0.236 4.556 4.320 -0.000 0.000 0.283 1317 A C 0.776 178.318 177.584 -0.069 0.000 1.142 1317 A CA 0.018 52.005 52.037 -0.085 0.000 0.812 1317 A CB 0.349 19.279 19.000 -0.116 0.000 1.074 1317 A HN 0.374 nan 8.150 nan 0.000 0.497 1318 E N 1.509 121.676 120.200 -0.055 0.000 2.274 1318 E HA 0.041 4.391 4.350 -0.000 0.000 0.194 1318 E C 0.576 177.150 176.600 -0.042 0.000 0.996 1318 E CA 0.981 57.357 56.400 -0.040 0.000 0.840 1318 E CB 0.084 29.764 29.700 -0.033 0.000 0.772 1318 E HN 0.360 nan 8.360 nan 0.000 0.491 1319 S N -0.052 115.610 115.700 -0.063 0.000 2.541 1319 S HA 0.487 4.957 4.470 -0.000 0.000 0.280 1319 S C -1.422 173.103 174.600 -0.124 0.000 1.112 1319 S CA -0.823 57.336 58.200 -0.069 0.000 0.925 1319 S CB 2.071 65.240 63.200 -0.050 0.000 1.067 1319 S HN 0.047 nan 8.310 nan 0.000 0.479 1320 V N 5.594 125.427 119.914 -0.134 0.000 2.419 1320 V HA 0.511 4.631 4.120 -0.000 0.000 0.287 1320 V C -0.764 175.276 176.094 -0.090 0.000 1.017 1320 V CA -0.863 61.294 62.300 -0.238 0.000 0.844 1320 V CB 1.703 33.249 31.823 -0.462 0.000 1.011 1320 V HN 0.730 nan 8.190 nan 0.000 0.429 1321 K N 3.284 123.646 120.400 -0.062 0.000 2.130 1321 K HA 0.881 5.201 4.320 -0.000 0.000 0.268 1321 K C -0.126 176.471 176.600 -0.005 0.000 0.983 1321 K CA -0.213 56.059 56.287 -0.024 0.000 0.893 1321 K CB 2.507 34.984 32.500 -0.037 0.000 1.066 1321 K HN 0.761 nan 8.250 nan 0.000 0.450 1322 A N 2.427 125.224 122.820 -0.037 0.000 2.413 1322 A HA 0.765 5.085 4.320 -0.000 0.000 0.307 1322 A C -1.545 175.942 177.584 -0.162 0.000 1.087 1322 A CA -0.702 51.225 52.037 -0.183 0.000 0.750 1322 A CB 1.254 20.160 19.000 -0.157 0.000 1.296 1322 A HN 0.508 nan 8.150 nan 0.000 0.423 1323 L N 1.078 122.169 121.223 -0.221 0.000 2.438 1323 L HA 0.770 5.110 4.340 -0.000 0.000 0.270 1323 L C -0.255 176.548 176.870 -0.111 0.000 0.972 1323 L CA -0.147 54.622 54.840 -0.117 0.000 0.831 1323 L CB 1.800 43.816 42.059 -0.071 0.000 1.273 1323 L HN 0.992 nan 8.230 nan 0.000 0.405 1324 A N 6.312 129.102 122.820 -0.050 0.000 2.280 1324 A HA 0.671 4.991 4.320 -0.000 0.000 0.320 1324 A C -0.901 176.689 177.584 0.010 0.000 1.366 1324 A CA -0.426 51.602 52.037 -0.014 0.000 0.938 1324 A CB -0.035 18.970 19.000 0.009 0.000 1.157 1324 A HN 0.702 nan 8.150 nan 0.000 0.536 1325 L N 4.717 125.949 121.223 0.014 0.000 2.292 1325 L HA 0.362 4.702 4.340 -0.000 0.000 0.284 1325 L C -1.545 175.337 176.870 0.020 0.000 1.065 1325 L CA -1.817 53.033 54.840 0.016 0.000 0.806 1325 L CB 1.804 43.867 42.059 0.006 0.000 1.175 1325 L HN 0.531 nan 8.230 nan 0.000 0.431 1326 P HA 0.030 nan 4.420 nan 0.000 0.246 1326 P C -0.629 176.675 177.300 0.005 0.000 1.686 1326 P CA 0.283 63.391 63.100 0.013 0.000 0.867 1326 P CB 0.015 31.722 31.700 0.012 0.000 1.733 1327 K N -0.127 120.277 120.400 0.008 0.000 2.578 1327 K HA 0.544 4.864 4.320 -0.000 0.000 0.269 1327 K C -1.533 175.073 176.600 0.010 0.000 0.941 1327 K CA -0.795 55.493 56.287 0.001 0.000 0.847 1327 K CB 1.766 34.257 32.500 -0.016 0.000 1.397 1327 K HN -0.126 nan 8.250 nan 0.000 0.422 1328 A N 5.126 127.953 122.820 0.011 0.000 2.376 1328 A HA 0.357 4.677 4.320 -0.000 0.000 0.298 1328 A C -0.069 177.508 177.584 -0.012 0.000 1.271 1328 A CA -0.541 51.510 52.037 0.022 0.000 0.926 1328 A CB -0.383 18.635 19.000 0.030 0.000 1.141 1328 A HN 0.615 nan 8.150 nan 0.000 0.539 1329 L N 2.378 123.578 121.223 -0.037 0.000 2.464 1329 L HA 0.271 4.611 4.340 -0.000 0.000 0.264 1329 L C 1.229 178.014 176.870 -0.143 0.000 1.199 1329 L CA -0.269 54.510 54.840 -0.103 0.000 0.818 1329 L CB 0.929 42.894 42.059 -0.156 0.000 1.102 1329 L HN 0.848 nan 8.230 nan 0.000 0.473 1330 S N 0.875 116.488 115.700 -0.146 0.000 2.713 1330 S HA 0.359 4.829 4.470 -0.000 0.000 0.283 1330 S C 0.743 175.212 174.600 -0.220 0.000 1.161 1330 S CA -0.812 57.304 58.200 -0.140 0.000 0.999 1330 S CB 1.664 64.810 63.200 -0.089 0.000 1.039 1330 S HN 0.508 nan 8.310 nan 0.000 0.548 1331 R N 0.586 120.976 120.500 -0.183 0.000 2.120 1331 R HA 0.085 4.425 4.340 -0.000 0.000 0.234 1331 R C 2.108 178.313 176.300 -0.159 0.000 1.123 1331 R CA 1.131 57.109 56.100 -0.202 0.000 0.975 1331 R CB -0.367 29.880 30.300 -0.089 0.000 0.866 1331 R HN 0.547 nan 8.270 nan 0.000 0.446 1332 K N 0.955 121.288 120.400 -0.111 0.000 2.103 1332 K HA -0.085 4.235 4.320 -0.000 0.000 0.204 1332 K C 1.552 178.094 176.600 -0.097 0.000 1.052 1332 K CA 1.444 57.682 56.287 -0.083 0.000 0.945 1332 K CB 0.127 32.592 32.500 -0.059 0.000 0.722 1332 K HN 0.289 nan 8.250 nan 0.000 0.443 1333 E N 0.048 120.177 120.200 -0.119 0.000 2.110 1333 E HA -0.123 4.226 4.350 -0.000 0.000 0.193 1333 E C 1.988 178.502 176.600 -0.143 0.000 0.988 1333 E CA 1.034 57.364 56.400 -0.116 0.000 0.804 1333 E CB 0.051 29.681 29.700 -0.117 0.000 0.745 1333 E HN -0.011 nan 8.360 nan 0.000 0.458 1334 V N 1.409 121.185 119.914 -0.229 0.000 2.358 1334 V HA -0.257 3.863 4.120 -0.000 0.000 0.246 1334 V C 2.337 178.338 176.094 -0.155 0.000 1.047 1334 V CA 1.844 63.973 62.300 -0.284 0.000 1.035 1334 V CB -0.634 30.810 31.823 -0.632 0.000 0.658 1334 V HN 0.316 nan 8.190 nan 0.000 0.452 1335 A N -0.512 122.234 122.820 -0.123 0.000 1.933 1335 A HA -0.279 4.041 4.320 -0.000 0.000 0.218 1335 A C 2.268 179.834 177.584 -0.029 0.000 1.175 1335 A CA 2.039 54.046 52.037 -0.051 0.000 0.628 1335 A CB -0.487 18.490 19.000 -0.038 0.000 0.814 1335 A HN 0.644 nan 8.150 nan 0.000 0.444 1336 E N -0.069 120.105 120.200 -0.042 0.000 2.072 1336 E HA -0.141 4.209 4.350 -0.000 0.000 0.191 1336 E C 1.876 178.469 176.600 -0.013 0.000 0.985 1336 E CA 1.056 57.441 56.400 -0.025 0.000 0.801 1336 E CB -0.207 29.473 29.700 -0.035 0.000 0.750 1336 E HN 0.632 nan 8.360 nan 0.000 0.452 1337 L N 0.653 121.861 121.223 -0.025 0.000 2.141 1337 L HA -0.127 4.213 4.340 -0.000 0.000 0.209 1337 L C 2.619 179.501 176.870 0.020 0.000 1.094 1337 L CA 1.138 55.973 54.840 -0.007 0.000 0.763 1337 L CB -0.406 41.641 42.059 -0.021 0.000 0.908 1337 L HN 0.274 nan 8.230 nan 0.000 0.437 1338 E N 0.134 120.347 120.200 0.023 0.000 2.150 1338 E HA -0.232 4.118 4.350 -0.000 0.000 0.193 1338 E C 2.096 178.729 176.600 0.056 0.000 0.985 1338 E CA 0.607 57.040 56.400 0.054 0.000 0.814 1338 E CB 0.211 29.948 29.700 0.063 0.000 0.752 1338 E HN 0.303 nan 8.360 nan 0.000 0.466 1339 E N 0.384 120.609 120.200 0.041 0.000 2.047 1339 E HA -0.133 4.217 4.350 -0.000 0.000 0.191 1339 E C 2.137 178.777 176.600 0.067 0.000 0.987 1339 E CA 0.933 57.360 56.400 0.045 0.000 0.799 1339 E CB -0.026 29.692 29.700 0.030 0.000 0.752 1339 E HN 0.168 nan 8.360 nan 0.000 0.449 1340 V N 1.560 121.516 119.914 0.070 0.000 2.332 1340 V HA -0.278 3.842 4.120 -0.000 0.000 0.248 1340 V C 2.621 178.811 176.094 0.160 0.000 1.055 1340 V CA 1.887 64.254 62.300 0.112 0.000 1.038 1340 V CB -1.031 30.832 31.823 0.067 0.000 0.651 1340 V HN 0.321 nan 8.190 nan 0.000 0.450 1341 A N -0.184 122.696 122.820 0.101 0.000 1.902 1341 A HA -0.245 4.075 4.320 -0.000 0.000 0.217 1341 A C 2.299 179.960 177.584 0.129 0.000 1.181 1341 A CA 2.024 54.121 52.037 0.101 0.000 0.623 1341 A CB -0.430 18.617 19.000 0.078 0.000 0.818 1341 A HN 0.561 nan 8.150 nan 0.000 0.443 1342 K N -0.967 119.495 120.400 0.104 0.000 2.217 1342 K HA -0.077 4.243 4.320 -0.000 0.000 0.202 1342 K C 2.281 178.927 176.600 0.078 0.000 1.051 1342 K CA 1.075 57.411 56.287 0.082 0.000 0.952 1342 K CB -0.118 32.418 32.500 0.061 0.000 0.736 1342 K HN 0.457 nan 8.250 nan 0.000 0.453 1343 R N 0.811 121.369 120.500 0.097 0.000 2.091 1343 R HA -0.131 4.209 4.340 -0.000 0.000 0.238 1343 R C 0.555 176.820 176.300 -0.059 0.000 1.136 1343 R CA 1.476 57.590 56.100 0.023 0.000 0.959 1343 R CB -0.078 30.245 30.300 0.039 0.000 0.856 1343 R HN 0.259 nan 8.270 nan 0.000 0.437 1344 H N 0.944 120.035 119.070 0.034 0.000 2.820 1344 H HA 0.195 4.751 4.556 -0.000 0.000 0.291 1344 H C -0.536 174.814 175.328 0.038 0.000 1.412 1344 H CA -0.066 56.007 56.048 0.040 0.000 1.176 1344 H CB -0.225 29.564 29.762 0.045 0.000 1.467 1344 H HN 0.071 nan 8.280 nan 0.000 0.517 1345 K N 0.681 121.128 120.400 0.080 0.000 4.462 1345 K HA -0.180 4.140 4.320 -0.000 0.000 0.278 1345 K C -0.422 176.217 176.600 0.065 0.000 0.789 1345 K CA 0.478 56.800 56.287 0.058 0.000 0.765 1345 K CB -0.962 31.559 32.500 0.035 0.000 1.839 1345 K HN 0.512 nan 8.250 nan 0.000 0.418 1346 A N 1.222 124.085 122.820 0.071 0.000 2.365 1346 A HA 0.311 4.631 4.320 -0.000 0.000 0.318 1346 A C 0.811 178.425 177.584 0.050 0.000 1.091 1346 A CA -0.734 51.338 52.037 0.058 0.000 0.763 1346 A CB 1.608 20.650 19.000 0.070 0.000 1.248 1346 A HN 0.358 nan 8.150 nan 0.000 0.442 1347 Q N 0.978 120.800 119.800 0.037 0.000 2.226 1347 Q HA 0.219 4.559 4.340 -0.000 0.000 0.204 1347 Q C 0.719 176.750 176.000 0.053 0.000 0.975 1347 Q CA 2.018 57.841 55.803 0.034 0.000 0.866 1347 Q CB 0.006 28.753 28.738 0.015 0.000 0.915 1347 Q HN 1.355 nan 8.270 nan 0.000 0.440 1348 G N -1.618 107.226 108.800 0.072 0.000 2.349 1348 G HA2 0.381 4.341 3.960 -0.000 0.000 0.294 1348 G HA3 0.381 4.341 3.960 -0.000 0.000 0.294 1348 G C -2.369 172.612 174.900 0.135 0.000 1.380 1348 G CA -0.608 44.553 45.100 0.100 0.000 0.811 1348 G HN 0.105 nan 8.290 nan 0.000 0.519 1349 L N 0.875 122.201 121.223 0.171 0.000 2.325 1349 L HA 0.870 5.210 4.340 -0.000 0.000 0.281 1349 L C 0.409 177.477 176.870 0.331 0.000 1.004 1349 L CA -0.412 54.561 54.840 0.222 0.000 0.823 1349 L CB 1.195 43.362 42.059 0.179 0.000 1.236 1349 L HN 1.205 nan 8.230 nan 0.000 0.415 1350 A N 5.560 128.622 122.820 0.403 0.000 2.303 1350 A HA 0.888 5.208 4.320 -0.000 0.000 0.317 1350 A C -1.220 176.735 177.584 0.619 0.000 1.149 1350 A CA -0.483 51.826 52.037 0.453 0.000 0.822 1350 A CB 0.688 19.963 19.000 0.458 0.000 1.131 1350 A HN 0.844 nan 8.150 nan 0.000 0.493 1351 W N -1.064 120.428 121.300 0.320 0.000 3.042 1351 W HA 0.773 5.433 4.660 -0.000 0.000 0.342 1351 W C -1.004 175.674 176.519 0.265 0.000 1.240 1351 W CA -0.726 56.797 57.345 0.296 0.000 1.166 1351 W CB 1.193 30.752 29.460 0.164 0.000 1.469 1351 W HN 1.487 nan 8.180 nan 0.000 0.579 1352 A N 1.896 124.955 122.820 0.397 0.000 2.565 1352 A HA 0.624 4.944 4.320 -0.000 0.000 0.298 1352 A C -1.178 176.658 177.584 0.419 0.000 1.062 1352 A CA -1.013 51.131 52.037 0.178 0.000 0.723 1352 A CB 1.521 20.602 19.000 0.134 0.000 1.282 1352 A HN 0.594 nan 8.150 nan 0.000 0.400 1353 R N 0.691 121.420 120.500 0.383 0.000 2.459 1353 R HA 0.513 4.853 4.340 -0.000 0.000 0.281 1353 R C -0.788 175.676 176.300 0.273 0.000 1.050 1353 R CA -0.550 55.749 56.100 0.331 0.000 1.055 1353 R CB 1.494 31.965 30.300 0.286 0.000 1.045 1353 R HN 0.420 nan 8.270 nan 0.000 0.495 1354 V N 4.241 124.264 119.914 0.181 0.000 2.304 1354 V HA 0.134 4.254 4.120 -0.000 0.000 0.269 1354 V C 0.235 176.301 176.094 -0.048 0.000 1.036 1354 V CA -0.304 62.015 62.300 0.031 0.000 0.840 1354 V CB 0.833 32.688 31.823 0.054 0.000 1.036 1354 V HN 0.646 nan 8.190 nan 0.000 0.466 1355 E N 2.374 122.503 120.200 -0.119 0.000 2.284 1355 E HA 0.367 4.717 4.350 -0.000 0.000 0.255 1355 E C -0.231 176.290 176.600 -0.133 0.000 1.052 1355 E CA -1.029 55.320 56.400 -0.086 0.000 0.904 1355 E CB 1.127 30.795 29.700 -0.052 0.000 1.217 1355 E HN 0.604 nan 8.360 nan 0.000 0.438 1356 E N -0.001 120.147 120.200 -0.087 0.000 2.292 1356 E HA 0.259 4.609 4.350 -0.000 0.000 0.265 1356 E C 0.253 176.791 176.600 -0.104 0.000 1.093 1356 E CA 0.734 57.083 56.400 -0.085 0.000 0.922 1356 E CB -0.457 29.212 29.700 -0.052 0.000 1.001 1356 E HN 0.671 nan 8.360 nan 0.000 0.444 1357 G N 3.085 111.805 108.800 -0.133 0.000 2.272 1357 G HA2 0.007 3.967 3.960 -0.000 0.000 0.280 1357 G HA3 0.007 3.967 3.960 -0.000 0.000 0.280 1357 G C 0.399 175.202 174.900 -0.161 0.000 1.067 1357 G CA 0.308 45.331 45.100 -0.127 0.000 0.902 1357 G HN 1.150 nan 8.290 nan 0.000 0.500 1358 G N -2.052 106.562 108.800 -0.311 0.000 2.337 1358 G HA2 0.583 4.543 3.960 -0.000 0.000 0.298 1358 G HA3 0.583 4.543 3.960 -0.000 0.000 0.298 1358 G C -0.886 173.696 174.900 -0.530 0.000 1.335 1358 G CA -0.451 44.457 45.100 -0.320 0.000 0.875 1358 G HN 0.842 nan 8.290 nan 0.000 0.579 1359 F N -0.048 119.902 119.950 -0.001 0.000 2.598 1359 F HA 0.876 5.402 4.527 -0.000 0.000 0.327 1359 F C 0.632 176.418 175.800 -0.023 0.000 1.057 1359 F CA -0.790 57.214 58.000 0.007 0.000 0.957 1359 F CB 2.660 41.668 39.000 0.012 0.000 1.278 1359 F HN 0.465 nan 8.300 nan 0.000 0.484 1360 S N -0.273 115.532 115.700 0.175 0.000 2.546 1360 S HA 0.733 5.203 4.470 -0.000 0.000 0.274 1360 S C -0.356 174.238 174.600 -0.010 0.000 1.121 1360 S CA -0.417 57.824 58.200 0.067 0.000 0.887 1360 S CB 1.796 65.043 63.200 0.078 0.000 1.094 1360 S HN 1.251 nan 8.310 nan 0.000 0.474 1361 G N 0.976 109.710 108.800 -0.110 0.000 2.880 1361 G HA2 0.307 4.266 3.960 -0.000 0.000 0.617 1361 G HA3 0.307 4.266 3.960 -0.000 0.000 0.617 1361 G C 0.738 175.143 174.900 -0.826 0.000 1.493 1361 G CA -0.087 44.804 45.100 -0.347 0.000 0.916 1361 G HN 1.984 nan 8.290 nan 0.000 0.553 1362 G N -1.397 106.684 108.800 -1.199 0.000 2.622 1362 G HA2 -0.001 3.959 3.960 -0.000 0.000 0.307 1362 G HA3 -0.001 3.959 3.960 -0.000 0.000 0.307 1362 G C 1.524 176.068 174.900 -0.595 0.000 1.226 1362 G CA 2.663 47.032 45.100 -1.219 0.000 0.997 1362 G HN 2.569 nan 8.290 nan 0.000 0.551 1363 V N -1.561 118.053 119.914 -0.500 0.000 3.337 1363 V HA 0.680 4.800 4.120 -0.000 0.000 0.343 1363 V C 2.381 178.243 176.094 -0.387 0.000 1.302 1363 V CA 0.969 63.035 62.300 -0.389 0.000 1.268 1363 V CB -0.526 31.021 31.823 -0.460 0.000 1.185 1363 V HN 2.005 nan 8.190 nan 0.000 0.447 1364 A N 2.594 125.208 122.820 -0.343 0.000 1.927 1364 A HA -0.265 4.055 4.320 -0.000 0.000 0.220 1364 A C 2.255 179.668 177.584 -0.285 0.000 1.185 1364 A CA 2.601 54.499 52.037 -0.232 0.000 0.639 1364 A CB -0.511 18.439 19.000 -0.083 0.000 0.820 1364 A HN 0.844 nan 8.150 nan 0.000 0.451 1365 K N -1.457 118.688 120.400 -0.425 0.000 2.209 1365 K HA -0.100 4.220 4.320 -0.000 0.000 0.204 1365 K C 1.355 177.613 176.600 -0.570 0.000 1.048 1365 K CA 1.734 57.715 56.287 -0.510 0.000 0.940 1365 K CB -0.485 31.615 32.500 -0.666 0.000 0.729 1365 K HN 0.462 nan 8.250 nan 0.000 0.451 1366 F N 1.161 120.863 119.950 -0.413 0.000 2.743 1366 F HA 0.178 4.705 4.527 -0.000 0.000 0.297 1366 F C 1.759 177.401 175.800 -0.262 0.000 1.131 1366 F CA 0.003 57.754 58.000 -0.416 0.000 1.426 1366 F CB 0.140 38.631 39.000 -0.849 0.000 1.116 1366 F HN -0.128 nan 8.300 nan 0.000 0.583 1367 L N -0.694 120.408 121.223 -0.201 0.000 2.298 1367 L HA -0.001 4.339 4.340 -0.000 0.000 0.209 1367 L C 2.233 178.980 176.870 -0.205 0.000 1.084 1367 L CA 0.392 55.041 54.840 -0.318 0.000 0.816 1367 L CB -0.454 41.062 42.059 -0.904 0.000 0.967 1367 L HN -0.009 nan 8.230 nan 0.000 0.460 1368 E N 0.821 120.985 120.200 -0.060 0.000 2.114 1368 E HA -0.212 4.138 4.350 -0.000 0.000 0.199 1368 E C -0.420 176.222 176.600 0.070 0.000 1.008 1368 E CA 1.481 57.953 56.400 0.121 0.000 0.810 1368 E CB -1.514 28.229 29.700 0.072 0.000 0.739 1368 E HN 0.441 nan 8.360 nan 0.000 0.456 1369 P HA -0.070 nan 4.420 nan 0.000 0.234 1369 P C 0.949 178.242 177.300 -0.012 0.000 1.167 1369 P CA 0.849 63.954 63.100 0.008 0.000 0.763 1369 P CB 0.104 31.811 31.700 0.012 0.000 0.835 1370 V N -5.576 114.323 119.914 -0.025 0.000 3.329 1370 V HA 0.329 4.449 4.120 -0.000 0.000 0.317 1370 V C 1.915 178.022 176.094 0.022 0.000 1.495 1370 V CA -0.414 61.846 62.300 -0.067 0.000 1.105 1370 V CB -0.530 31.145 31.823 -0.246 0.000 0.985 1370 V HN -0.155 nan 8.190 nan 0.000 0.475 1371 R N 1.351 121.937 120.500 0.142 0.000 2.162 1371 R HA -0.315 4.025 4.340 -0.000 0.000 0.245 1371 R C 2.111 178.538 176.300 0.211 0.000 1.129 1371 R CA 2.952 59.252 56.100 0.334 0.000 0.940 1371 R CB -0.237 30.277 30.300 0.356 0.000 0.875 1371 R HN 0.632 nan 8.270 nan 0.000 0.437 1372 E N -0.445 119.820 120.200 0.109 0.000 2.038 1372 E HA -0.174 4.176 4.350 -0.000 0.000 0.195 1372 E C 1.835 178.470 176.600 0.057 0.000 1.000 1372 E CA 1.921 58.361 56.400 0.066 0.000 0.803 1372 E CB -0.287 29.435 29.700 0.036 0.000 0.750 1372 E HN 0.529 nan 8.360 nan 0.000 0.448 1373 A N 0.295 123.134 122.820 0.032 0.000 1.933 1373 A HA -0.140 4.180 4.320 -0.000 0.000 0.218 1373 A C 2.262 179.865 177.584 0.033 0.000 1.175 1373 A CA 1.104 53.148 52.037 0.012 0.000 0.628 1373 A CB -0.600 18.381 19.000 -0.031 0.000 0.814 1373 A HN 0.342 nan 8.150 nan 0.000 0.444 1374 L N -0.577 120.685 121.223 0.063 0.000 2.027 1374 L HA -0.098 4.242 4.340 -0.000 0.000 0.206 1374 L C 2.399 179.365 176.870 0.161 0.000 1.074 1374 L CA 1.148 56.062 54.840 0.124 0.000 0.745 1374 L CB -0.282 41.884 42.059 0.178 0.000 0.898 1374 L HN 0.409 nan 8.230 nan 0.000 0.433 1375 L N -0.877 120.451 121.223 0.176 0.000 2.191 1375 L HA -0.245 4.095 4.340 -0.000 0.000 0.212 1375 L C 2.547 179.468 176.870 0.085 0.000 1.103 1375 L CA 1.095 56.020 54.840 0.141 0.000 0.769 1375 L CB -0.417 41.709 42.059 0.112 0.000 0.908 1375 L HN 0.412 nan 8.230 nan 0.000 0.438 1376 Q N -0.332 119.508 119.800 0.066 0.000 2.033 1376 Q HA -0.101 4.239 4.340 -0.000 0.000 0.196 1376 Q C 2.532 178.556 176.000 0.040 0.000 0.970 1376 Q CA 1.324 57.153 55.803 0.043 0.000 0.828 1376 Q CB -0.180 28.576 28.738 0.030 0.000 0.895 1376 Q HN 0.527 nan 8.270 nan 0.000 0.440 1377 A N 0.925 123.773 122.820 0.046 0.000 1.940 1377 A HA -0.203 4.117 4.320 -0.000 0.000 0.219 1377 A C 2.209 179.818 177.584 0.042 0.000 1.176 1377 A CA 2.177 54.238 52.037 0.041 0.000 0.631 1377 A CB -0.817 18.214 19.000 0.051 0.000 0.814 1377 A HN 0.546 nan 8.150 nan 0.000 0.446 1378 T N -4.124 110.467 114.554 0.062 0.000 3.037 1378 T HA 0.194 4.544 4.350 -0.000 0.000 0.251 1378 T C 0.500 175.225 174.700 0.040 0.000 1.079 1378 T CA 0.764 62.894 62.100 0.050 0.000 1.067 1378 T CB -0.262 68.650 68.868 0.072 0.000 0.948 1378 T HN 0.617 nan 8.240 nan 0.000 0.496 1379 E N 0.438 120.666 120.200 0.046 0.000 2.971 1379 E HA -0.184 4.166 4.350 -0.000 0.000 0.278 1379 E C 0.335 176.959 176.600 0.039 0.000 1.009 1379 E CA 0.088 56.509 56.400 0.035 0.000 0.862 1379 E CB -2.227 27.486 29.700 0.022 0.000 1.436 1379 E HN 0.842 nan 8.360 nan 0.000 0.434 1380 A N 0.932 123.787 122.820 0.058 0.000 2.386 1380 A HA 0.497 4.816 4.320 -0.000 0.000 0.248 1380 A C 0.518 178.128 177.584 0.043 0.000 1.082 1380 A CA -0.029 52.044 52.037 0.060 0.000 0.789 1380 A CB 0.592 19.651 19.000 0.099 0.000 1.025 1380 A HN 0.139 nan 8.150 nan 0.000 0.490 1381 R N 0.506 121.024 120.500 0.030 0.000 2.919 1381 R HA 0.533 4.872 4.340 -0.000 0.000 0.260 1381 R C -3.071 173.229 176.300 0.000 0.000 1.067 1381 R CA -2.582 53.523 56.100 0.009 0.000 1.003 1381 R CB -0.290 30.014 30.300 0.007 0.000 1.192 1381 R HN 0.368 nan 8.270 nan 0.000 0.488 1382 P HA 0.073 nan 4.420 nan 0.000 0.265 1382 P C 0.628 177.926 177.300 -0.003 0.000 1.193 1382 P CA 1.231 64.315 63.100 -0.027 0.000 0.765 1382 P CB 0.399 32.077 31.700 -0.036 0.000 0.823 1383 G N 1.789 110.594 108.800 0.008 0.000 2.254 1383 G HA2 -0.168 3.792 3.960 -0.000 0.000 0.225 1383 G HA3 -0.168 3.792 3.960 -0.000 0.000 0.225 1383 G C 0.062 174.983 174.900 0.036 0.000 1.003 1383 G CA -0.309 44.803 45.100 0.020 0.000 0.622 1383 G HN 0.498 nan 8.290 nan 0.000 0.507 1384 D N 0.899 121.325 120.400 0.043 0.000 2.383 1384 D HA 0.580 5.220 4.640 -0.000 0.000 0.248 1384 D C 0.241 176.599 176.300 0.097 0.000 1.170 1384 D CA 0.633 54.667 54.000 0.057 0.000 0.977 1384 D CB 0.976 41.809 40.800 0.055 0.000 1.120 1384 D HN 0.110 nan 8.370 nan 0.000 0.481 1385 T N 0.706 115.318 114.554 0.097 0.000 2.824 1385 T HA 0.460 4.810 4.350 -0.000 0.000 0.282 1385 T C 0.023 174.795 174.700 0.119 0.000 0.993 1385 T CA -0.617 61.573 62.100 0.150 0.000 0.967 1385 T CB 0.881 69.823 68.868 0.123 0.000 0.960 1385 T HN 0.066 nan 8.240 nan 0.000 0.441 1386 L N 3.586 124.908 121.223 0.164 0.000 2.307 1386 L HA 0.589 4.929 4.340 -0.000 0.000 0.282 1386 L C -1.008 175.826 176.870 -0.061 0.000 1.051 1386 L CA -0.987 53.843 54.840 -0.016 0.000 0.804 1386 L CB 1.046 43.112 42.059 0.012 0.000 1.197 1386 L HN 0.300 nan 8.230 nan 0.000 0.431 1387 L N 3.495 124.547 121.223 -0.285 0.000 2.362 1387 L HA 0.618 4.958 4.340 -0.000 0.000 0.271 1387 L C -0.790 175.835 176.870 -0.409 0.000 1.002 1387 L CA -0.088 54.679 54.840 -0.121 0.000 0.818 1387 L CB 1.770 43.825 42.059 -0.006 0.000 1.298 1387 L HN 0.214 nan 8.230 nan 0.000 0.420 1388 F N 1.310 121.350 119.950 0.150 0.000 2.576 1388 F HA 0.785 5.312 4.527 -0.000 0.000 0.313 1388 F C -0.394 175.428 175.800 0.036 0.000 1.078 1388 F CA -1.052 56.984 58.000 0.060 0.000 0.921 1388 F CB 2.153 41.199 39.000 0.076 0.000 1.232 1388 F HN -0.034 nan 8.300 nan 0.000 0.459 1389 V N 1.914 121.908 119.914 0.134 0.000 2.569 1389 V HA 0.794 4.914 4.120 -0.000 0.000 0.301 1389 V C -0.781 175.282 176.094 -0.053 0.000 1.044 1389 V CA -0.818 61.517 62.300 0.059 0.000 0.874 1389 V CB 1.577 33.424 31.823 0.039 0.000 1.002 1389 V HN 0.956 nan 8.190 nan 0.000 0.424 1390 A N 3.368 126.141 122.820 -0.077 0.000 2.330 1390 A HA 1.061 5.381 4.320 -0.000 0.000 0.327 1390 A C 0.330 177.864 177.584 -0.083 0.000 1.155 1390 A CA 0.209 52.149 52.037 -0.161 0.000 0.803 1390 A CB 1.687 20.540 19.000 -0.244 0.000 1.208 1390 A HN 1.777 nan 8.150 nan 0.000 0.477 1391 G N 0.920 109.668 108.800 -0.086 0.000 2.368 1391 G HA2 0.409 4.369 3.960 -0.000 0.000 0.269 1391 G HA3 0.409 4.369 3.960 -0.000 0.000 0.269 1391 G C -3.461 171.409 174.900 -0.050 0.000 1.291 1391 G CA -0.613 44.453 45.100 -0.057 0.000 0.903 1391 G HN 0.559 nan 8.290 nan 0.000 0.483 1392 P HA 0.233 nan 4.420 nan 0.000 0.265 1392 P C 0.921 178.205 177.300 -0.027 0.000 1.193 1392 P CA -0.092 62.988 63.100 -0.034 0.000 0.765 1392 P CB 0.819 32.499 31.700 -0.033 0.000 0.823 1393 R N 3.412 123.895 120.500 -0.028 0.000 2.153 1393 R HA -0.252 4.088 4.340 -0.000 0.000 0.252 1393 R C 1.379 177.674 176.300 -0.008 0.000 1.158 1393 R CA 1.985 58.072 56.100 -0.022 0.000 0.975 1393 R CB -0.067 30.222 30.300 -0.019 0.000 0.871 1393 R HN 0.452 nan 8.270 nan 0.000 0.450 1394 K N -0.754 119.648 120.400 0.004 0.000 2.103 1394 K HA -0.037 4.283 4.320 -0.000 0.000 0.204 1394 K C 2.016 178.645 176.600 0.049 0.000 1.052 1394 K CA 1.267 57.576 56.287 0.037 0.000 0.945 1394 K CB 0.068 32.598 32.500 0.050 0.000 0.722 1394 K HN 0.017 nan 8.250 nan 0.000 0.443 1395 V N 1.685 121.618 119.914 0.032 0.000 2.358 1395 V HA -0.216 3.904 4.120 -0.000 0.000 0.246 1395 V C 2.414 178.528 176.094 0.033 0.000 1.047 1395 V CA 2.006 64.333 62.300 0.044 0.000 1.035 1395 V CB -0.690 31.149 31.823 0.028 0.000 0.658 1395 V HN 0.345 nan 8.190 nan 0.000 0.452 1396 A N 0.169 122.993 122.820 0.007 0.000 1.877 1396 A HA -0.140 4.180 4.320 -0.000 0.000 0.216 1396 A C 2.429 180.009 177.584 -0.007 0.000 1.186 1396 A CA 2.284 54.317 52.037 -0.006 0.000 0.620 1396 A CB -0.856 18.126 19.000 -0.030 0.000 0.822 1396 A HN 0.559 nan 8.150 nan 0.000 0.443 1397 A N -1.129 121.686 122.820 -0.008 0.000 1.858 1397 A HA -0.078 4.242 4.320 -0.000 0.000 0.216 1397 A C 2.335 179.915 177.584 -0.007 0.000 1.190 1397 A CA 2.337 54.364 52.037 -0.015 0.000 0.617 1397 A CB -1.385 17.603 19.000 -0.021 0.000 0.827 1397 A HN 0.426 nan 8.150 nan 0.000 0.443 1398 T N 0.394 114.960 114.554 0.019 0.000 2.684 1398 T HA -0.059 4.291 4.350 -0.000 0.000 0.267 1398 T C 2.228 176.894 174.700 -0.056 0.000 1.036 1398 T CA 1.797 63.911 62.100 0.024 0.000 1.148 1398 T CB -0.527 68.405 68.868 0.107 0.000 0.863 1398 T HN 0.603 nan 8.240 nan 0.000 0.436 1399 A N 1.106 123.917 122.820 -0.016 0.000 1.858 1399 A HA 0.028 4.348 4.320 -0.000 0.000 0.216 1399 A C 2.310 179.847 177.584 -0.078 0.000 1.190 1399 A CA 1.209 53.219 52.037 -0.045 0.000 0.617 1399 A CB -0.953 18.072 19.000 0.040 0.000 0.827 1399 A HN 0.464 nan 8.150 nan 0.000 0.443 1400 L N -0.646 120.555 121.223 -0.036 0.000 2.275 1400 L HA -0.105 4.235 4.340 -0.000 0.000 0.215 1400 L C 2.605 179.454 176.870 -0.035 0.000 1.119 1400 L CA 0.831 55.654 54.840 -0.028 0.000 0.790 1400 L CB -0.535 41.511 42.059 -0.022 0.000 0.919 1400 L HN 0.543 nan 8.230 nan 0.000 0.443 1401 G N -0.719 108.052 108.800 -0.050 0.000 2.418 1401 G HA2 -0.261 3.699 3.960 -0.000 0.000 0.217 1401 G HA3 -0.261 3.699 3.960 -0.000 0.000 0.217 1401 G C 1.696 176.566 174.900 -0.051 0.000 1.158 1401 G CA 0.705 45.789 45.100 -0.027 0.000 0.771 1401 G HN 0.485 nan 8.290 nan 0.000 0.545 1402 A N 0.053 122.772 122.820 -0.170 0.000 1.930 1402 A HA 0.134 4.454 4.320 -0.000 0.000 0.217 1402 A C 2.576 180.111 177.584 -0.082 0.000 1.175 1402 A CA 1.654 53.563 52.037 -0.212 0.000 0.627 1402 A CB -0.495 18.133 19.000 -0.620 0.000 0.815 1402 A HN 0.241 nan 8.150 nan 0.000 0.443 1403 V N 0.291 120.169 119.914 -0.060 0.000 2.343 1403 V HA -0.260 3.860 4.120 -0.000 0.000 0.247 1403 V C 2.644 178.749 176.094 0.017 0.000 1.051 1403 V CA 2.225 64.517 62.300 -0.013 0.000 1.036 1403 V CB -0.822 30.999 31.823 -0.004 0.000 0.654 1403 V HN 0.728 nan 8.190 nan 0.000 0.451 1404 R N -0.027 120.501 120.500 0.047 0.000 2.103 1404 R HA -0.181 4.159 4.340 -0.000 0.000 0.242 1404 R C 2.263 178.675 176.300 0.187 0.000 1.142 1404 R CA 1.844 58.024 56.100 0.133 0.000 0.960 1404 R CB -0.329 30.069 30.300 0.164 0.000 0.858 1404 R HN 0.452 nan 8.270 nan 0.000 0.439 1405 L N 0.092 121.409 121.223 0.156 0.000 2.005 1405 L HA -0.133 4.207 4.340 -0.000 0.000 0.207 1405 L C 2.848 179.723 176.870 0.008 0.000 1.072 1405 L CA 1.425 56.352 54.840 0.144 0.000 0.744 1405 L CB -0.454 41.668 42.059 0.104 0.000 0.895 1405 L HN 0.174 nan 8.230 nan 0.000 0.433 1406 R N 0.658 121.157 120.500 -0.001 0.000 2.120 1406 R HA -0.131 4.209 4.340 -0.000 0.000 0.234 1406 R C 2.119 178.382 176.300 -0.061 0.000 1.123 1406 R CA 1.585 57.667 56.100 -0.029 0.000 0.975 1406 R CB -0.620 29.673 30.300 -0.012 0.000 0.866 1406 R HN 0.351 nan 8.270 nan 0.000 0.446 1407 A N 0.051 122.839 122.820 -0.054 0.000 1.972 1407 A HA -0.015 4.305 4.320 -0.000 0.000 0.219 1407 A C 2.330 179.821 177.584 -0.154 0.000 1.169 1407 A CA 1.574 53.565 52.037 -0.076 0.000 0.635 1407 A CB -0.909 18.070 19.000 -0.035 0.000 0.810 1407 A HN 0.455 nan 8.150 nan 0.000 0.446 1408 A N 0.039 122.701 122.820 -0.263 0.000 1.972 1408 A HA -0.184 4.136 4.320 -0.000 0.000 0.219 1408 A C 1.759 179.157 177.584 -0.311 0.000 1.169 1408 A CA 1.821 53.563 52.037 -0.493 0.000 0.635 1408 A CB -0.440 17.952 19.000 -1.014 0.000 0.810 1408 A HN 0.511 nan 8.150 nan 0.000 0.446 1409 D N 0.206 120.483 120.400 -0.206 0.000 2.085 1409 D HA -0.082 4.558 4.640 -0.000 0.000 0.199 1409 D C 2.069 178.299 176.300 -0.117 0.000 0.981 1409 D CA 1.126 55.040 54.000 -0.144 0.000 0.834 1409 D CB -0.483 40.258 40.800 -0.100 0.000 0.992 1409 D HN 0.427 nan 8.370 nan 0.000 0.457 1410 L N 0.685 121.848 121.223 -0.101 0.000 2.043 1410 L HA -0.178 4.162 4.340 -0.000 0.000 0.212 1410 L C 2.497 179.316 176.870 -0.086 0.000 1.075 1410 L CA 0.930 55.720 54.840 -0.083 0.000 0.752 1410 L CB -0.491 41.523 42.059 -0.074 0.000 0.891 1410 L HN 0.037 nan 8.230 nan 0.000 0.432 1411 L N -0.331 120.830 121.223 -0.103 0.000 2.478 1411 L HA 0.071 4.410 4.340 -0.000 0.000 0.223 1411 L C 1.438 178.249 176.870 -0.099 0.000 1.140 1411 L CA 0.492 55.275 54.840 -0.095 0.000 0.842 1411 L CB -0.818 41.180 42.059 -0.101 0.000 0.953 1411 L HN 0.518 nan 8.230 nan 0.000 0.452 1412 G N 1.303 110.034 108.800 -0.115 0.000 2.273 1412 G HA2 -0.283 3.677 3.960 -0.000 0.000 0.280 1412 G HA3 -0.283 3.677 3.960 -0.000 0.000 0.280 1412 G C 0.240 175.069 174.900 -0.119 0.000 1.047 1412 G CA -0.081 44.954 45.100 -0.108 0.000 0.869 1412 G HN 0.252 nan 8.290 nan 0.000 0.502 1413 L N -1.068 120.056 121.223 -0.165 0.000 2.483 1413 L HA 0.249 4.589 4.340 -0.000 0.000 0.275 1413 L C 0.959 177.745 176.870 -0.140 0.000 1.220 1413 L CA 0.083 54.825 54.840 -0.162 0.000 0.833 1413 L CB 0.353 42.257 42.059 -0.259 0.000 1.102 1413 L HN 0.115 nan 8.230 nan 0.000 0.490 1414 K N 2.418 122.764 120.400 -0.091 0.000 2.284 1414 K HA 0.286 4.606 4.320 -0.000 0.000 0.287 1414 K C -0.654 175.911 176.600 -0.058 0.000 1.081 1414 K CA 0.029 56.272 56.287 -0.072 0.000 0.910 1414 K CB 0.512 32.982 32.500 -0.050 0.000 1.088 1414 K HN 0.323 nan 8.250 nan 0.000 0.478 1415 R N 3.231 123.686 120.500 -0.075 0.000 2.423 1415 R HA 0.116 4.456 4.340 -0.000 0.000 0.293 1415 R C -0.599 175.645 176.300 -0.093 0.000 1.196 1415 R CA -0.473 55.598 56.100 -0.048 0.000 1.262 1415 R CB 0.534 30.808 30.300 -0.043 0.000 1.116 1415 R HN 0.710 nan 8.270 nan 0.000 0.566 1416 E N 1.051 121.185 120.200 -0.109 0.000 2.359 1416 E HA 0.788 5.138 4.350 -0.000 0.000 0.266 1416 E C -0.105 176.355 176.600 -0.233 0.000 0.920 1416 E CA -1.154 55.139 56.400 -0.177 0.000 0.788 1416 E CB 1.868 31.484 29.700 -0.141 0.000 1.279 1416 E HN 0.375 nan 8.360 nan 0.000 0.438 1417 G N 0.133 108.696 108.800 -0.396 0.000 2.631 1417 G HA2 -0.114 3.845 3.960 -0.000 0.000 0.504 1417 G HA3 -0.114 3.845 3.960 -0.000 0.000 0.504 1417 G C -1.202 173.291 174.900 -0.679 0.000 1.306 1417 G CA -0.573 44.252 45.100 -0.458 0.000 0.897 1417 G HN 0.409 nan 8.290 nan 0.000 0.520 1418 F N 0.992 120.874 119.950 -0.113 0.000 2.434 1418 F HA 0.595 5.122 4.527 -0.000 0.000 0.355 1418 F C 0.700 176.301 175.800 -0.331 0.000 1.115 1418 F CA -0.888 56.961 58.000 -0.252 0.000 1.010 1418 F CB 1.867 40.732 39.000 -0.225 0.000 1.234 1418 F HN 0.149 nan 8.300 nan 0.000 0.439 1419 R N 3.985 124.327 120.500 -0.263 0.000 2.239 1419 R HA 0.377 4.716 4.340 -0.000 0.000 0.332 1419 R C -1.091 174.925 176.300 -0.475 0.000 0.988 1419 R CA -0.604 55.325 56.100 -0.285 0.000 0.859 1419 R CB 0.658 30.821 30.300 -0.227 0.000 1.148 1419 R HN 0.468 nan 8.270 nan 0.000 0.482 1420 F N 3.391 122.982 119.950 -0.598 0.000 2.378 1420 F HA 0.572 5.099 4.527 -0.000 0.000 0.325 1420 F C 0.719 176.080 175.800 -0.732 0.000 1.097 1420 F CA -0.648 56.811 58.000 -0.901 0.000 1.079 1420 F CB 1.143 39.022 39.000 -1.869 0.000 1.240 1420 F HN 0.310 nan 8.300 nan 0.000 0.519 1421 L N -0.954 120.026 121.223 -0.405 0.000 2.724 1421 L HA 0.572 4.912 4.340 -0.000 0.000 0.258 1421 L C -2.327 174.423 176.870 -0.199 0.000 0.967 1421 L CA -1.086 53.624 54.840 -0.216 0.000 0.891 1421 L CB 1.440 43.433 42.059 -0.111 0.000 1.456 1421 L HN 0.581 nan 8.230 nan 0.000 0.416 1422 W N 1.508 122.881 121.300 0.122 0.000 2.469 1422 W HA 0.751 5.411 4.660 -0.000 0.000 0.320 1422 W C -0.678 175.917 176.519 0.126 0.000 1.086 1422 W CA -0.830 56.606 57.345 0.153 0.000 1.211 1422 W CB 2.110 31.665 29.460 0.158 0.000 1.298 1422 W HN 0.256 nan 8.180 nan 0.000 0.525 1423 V N 4.811 124.981 119.914 0.426 0.000 2.384 1423 V HA 0.508 4.628 4.120 -0.000 0.000 0.287 1423 V C -0.063 176.160 176.094 0.215 0.000 1.020 1423 V CA -0.771 61.665 62.300 0.227 0.000 0.850 1423 V CB 0.950 32.902 31.823 0.216 0.000 0.987 1423 V HN 0.418 nan 8.190 nan 0.000 0.436 1424 V N 2.616 122.555 119.914 0.041 0.000 3.181 1424 V HA 0.606 4.726 4.120 -0.000 0.000 0.314 1424 V C -0.077 175.966 176.094 -0.084 0.000 1.173 1424 V CA -0.786 61.560 62.300 0.078 0.000 1.052 1424 V CB 1.872 33.781 31.823 0.143 0.000 1.123 1424 V HN 0.836 nan 8.190 nan 0.000 0.454 1425 D N 0.187 120.634 120.400 0.078 0.000 2.723 1425 D HA -0.173 4.467 4.640 -0.000 0.000 0.236 1425 D C -0.521 175.832 176.300 0.087 0.000 1.138 1425 D CA 0.796 54.858 54.000 0.102 0.000 0.676 1425 D CB -0.970 39.880 40.800 0.083 0.000 1.069 1425 D HN 0.316 nan 8.370 nan 0.000 0.430 1426 F N -0.235 119.792 119.950 0.128 0.000 2.440 1426 F HA 0.343 4.870 4.527 -0.000 0.000 0.323 1426 F C -1.242 174.601 175.800 0.071 0.000 1.192 1426 F CA -1.488 56.534 58.000 0.036 0.000 1.252 1426 F CB 0.143 39.209 39.000 0.109 0.000 1.214 1426 F HN -0.186 nan 8.300 nan 0.000 0.578 1427 P HA 0.060 nan 4.420 nan 0.000 0.276 1427 P C 0.245 177.644 177.300 0.165 0.000 1.244 1427 P CA -0.335 62.856 63.100 0.151 0.000 0.801 1427 P CB 0.815 32.595 31.700 0.133 0.000 1.006 1428 L N 2.110 123.400 121.223 0.112 0.000 2.095 1428 L HA 0.120 4.460 4.340 -0.000 0.000 0.204 1428 L C 0.308 177.209 176.870 0.053 0.000 1.080 1428 L CA 1.710 56.617 54.840 0.111 0.000 0.759 1428 L CB -0.504 41.581 42.059 0.044 0.000 0.914 1428 L HN 0.216 nan 8.230 nan 0.000 0.439 1429 L N -0.317 120.918 121.223 0.019 0.000 2.334 1429 L HA 0.382 4.722 4.340 -0.000 0.000 0.272 1429 L C 0.260 177.232 176.870 0.171 0.000 1.020 1429 L CA -0.548 54.342 54.840 0.084 0.000 0.812 1429 L CB 1.646 43.733 42.059 0.047 0.000 1.264 1429 L HN 0.044 nan 8.230 nan 0.000 0.439 1430 E N 1.068 121.360 120.200 0.152 0.000 2.790 1430 E HA 0.182 4.532 4.350 -0.000 0.000 0.256 1430 E C -1.035 175.828 176.600 0.438 0.000 1.246 1430 E CA -0.718 55.747 56.400 0.107 0.000 1.041 1430 E CB 0.706 30.330 29.700 -0.127 0.000 1.272 1430 E HN 0.447 nan 8.360 nan 0.000 0.603 1431 W N 2.520 123.851 121.300 0.052 0.000 2.429 1431 W HA 0.047 4.707 4.660 -0.000 0.000 0.431 1431 W C 0.383 176.886 176.519 -0.027 0.000 1.038 1431 W CA -0.704 56.655 57.345 0.022 0.000 1.635 1431 W CB 0.202 29.666 29.460 0.006 0.000 1.721 1431 W HN 0.511 nan 8.180 nan 0.000 0.366 1432 D N 2.126 122.619 120.400 0.155 0.000 2.328 1432 D HA -0.068 4.572 4.640 -0.000 0.000 0.221 1432 D C 0.567 176.822 176.300 -0.074 0.000 1.072 1432 D CA 0.391 54.397 54.000 0.010 0.000 0.850 1432 D CB 0.270 41.041 40.800 -0.048 0.000 0.922 1432 D HN 0.212 nan 8.370 nan 0.000 0.516 1433 E N 0.414 120.575 120.200 -0.065 0.000 4.014 1433 E HA -0.216 4.134 4.350 -0.000 0.000 0.209 1433 E C 0.538 177.030 176.600 -0.181 0.000 1.457 1433 E CA 0.676 57.011 56.400 -0.109 0.000 2.314 1433 E CB -0.918 28.745 29.700 -0.062 0.000 2.109 1433 E HN 0.213 nan 8.360 nan 0.000 0.486 1434 E N 0.521 120.635 120.200 -0.143 0.000 2.476 1434 E HA 0.041 4.391 4.350 -0.000 0.000 0.199 1434 E C 1.522 178.046 176.600 -0.125 0.000 1.021 1434 E CA 0.386 56.698 56.400 -0.148 0.000 0.907 1434 E CB 0.171 29.802 29.700 -0.115 0.000 0.974 1434 E HN 0.282 nan 8.360 nan 0.000 0.489 1435 E N 1.086 121.222 120.200 -0.106 0.000 2.006 1435 E HA -0.061 4.289 4.350 -0.000 0.000 0.192 1435 E C 1.158 177.702 176.600 -0.092 0.000 0.993 1435 E CA 1.226 57.576 56.400 -0.083 0.000 0.808 1435 E CB 0.272 29.934 29.700 -0.062 0.000 0.764 1435 E HN 0.187 nan 8.360 nan 0.000 0.449 1436 E N -1.083 119.053 120.200 -0.107 0.000 4.448 1436 E HA 0.592 4.942 4.350 -0.000 0.000 0.159 1436 E C -0.728 175.780 176.600 -0.153 0.000 1.117 1436 E CA -0.443 55.896 56.400 -0.102 0.000 0.873 1436 E CB 0.315 29.985 29.700 -0.049 0.000 1.896 1436 E HN 0.096 nan 8.360 nan 0.000 0.412 1437 A N 0.638 123.419 122.820 -0.065 0.000 2.406 1437 A HA 0.252 4.571 4.320 -0.000 0.000 0.243 1437 A C -0.812 176.778 177.584 0.010 0.000 1.082 1437 A CA -0.065 51.976 52.037 0.006 0.000 0.786 1437 A CB -0.284 18.790 19.000 0.122 0.000 1.029 1437 A HN 0.332 nan 8.150 nan 0.000 0.495 1438 W N -0.248 121.072 121.300 0.033 0.000 1.777 1438 W HA 0.535 5.195 4.660 -0.000 0.000 0.376 1438 W C 0.951 177.474 176.519 0.007 0.000 1.628 1438 W CA 0.550 57.915 57.345 0.034 0.000 1.760 1438 W CB 0.020 29.513 29.460 0.056 0.000 1.367 1438 W HN 0.722 nan 8.180 nan 0.000 0.722 1439 T N -0.744 113.964 114.554 0.257 0.000 2.841 1439 T HA 0.489 4.839 4.350 -0.000 0.000 0.296 1439 T C -1.434 173.275 174.700 0.015 0.000 1.166 1439 T CA -0.880 61.232 62.100 0.021 0.000 1.007 1439 T CB 0.425 69.199 68.868 -0.157 0.000 1.253 1439 T HN 0.242 nan 8.240 nan 0.000 0.511 1440 Y N 1.548 121.866 120.300 0.030 0.000 2.304 1440 Y HA 0.575 5.125 4.550 -0.000 0.000 0.327 1440 Y C 1.223 177.054 175.900 -0.116 0.000 1.209 1440 Y CA -1.069 57.013 58.100 -0.030 0.000 1.299 1440 Y CB 0.582 39.016 38.460 -0.043 0.000 1.249 1440 Y HN 0.634 nan 8.280 nan 0.000 0.519 1441 M N 1.474 121.060 119.600 -0.024 0.000 2.461 1441 M HA 0.055 4.535 4.480 -0.000 0.000 0.255 1441 M C 0.222 176.245 176.300 -0.463 0.000 1.137 1441 M CA 0.768 55.866 55.300 -0.337 0.000 1.086 1441 M CB 0.201 32.462 32.600 -0.566 0.000 1.356 1441 M HN 0.905 nan 8.290 nan 0.000 0.487 1442 H N -1.985 117.126 119.070 0.069 0.000 2.772 1442 H HA 0.344 4.900 4.556 -0.000 0.000 0.222 1442 H C -0.070 175.264 175.328 0.010 0.000 1.135 1442 H CA 0.261 56.300 56.048 -0.016 0.000 1.513 1442 H CB 0.297 30.005 29.762 -0.091 0.000 1.377 1442 H HN 0.205 nan 8.280 nan 0.000 0.524 1443 H N 0.083 119.088 119.070 -0.108 0.000 3.112 1443 H HA 0.135 4.691 4.556 -0.000 0.000 0.347 1443 H C -2.488 172.527 175.328 -0.521 0.000 1.188 1443 H CA -1.423 54.322 56.048 -0.505 0.000 1.240 1443 H CB 2.150 31.711 29.762 -0.334 0.000 1.920 1443 H HN -0.085 nan 8.280 nan 0.000 0.535 1444 P HA -0.123 nan 4.420 nan 0.000 0.218 1444 P C 0.901 178.045 177.300 -0.259 0.000 1.147 1444 P CA 1.615 64.298 63.100 -0.695 0.000 0.827 1444 P CB -0.114 31.008 31.700 -0.963 0.000 0.778 1445 F N -2.402 117.579 119.950 0.052 0.000 2.732 1445 F HA 0.081 4.608 4.527 -0.000 0.000 0.303 1445 F C 0.803 176.558 175.800 -0.076 0.000 1.110 1445 F CA -0.503 57.475 58.000 -0.036 0.000 1.355 1445 F CB -0.254 38.723 39.000 -0.039 0.000 1.081 1445 F HN -0.284 nan 8.300 nan 0.000 0.565 1446 T N 0.597 115.217 114.554 0.109 0.000 2.814 1446 T HA -0.006 4.344 4.350 -0.000 0.000 0.297 1446 T C 0.316 175.005 174.700 -0.019 0.000 0.956 1446 T CA -0.016 62.084 62.100 0.001 0.000 1.123 1446 T CB 1.209 70.074 68.868 -0.005 0.000 0.902 1446 T HN 0.022 nan 8.240 nan 0.000 0.528 1447 S N 5.203 120.872 115.700 -0.053 0.000 2.505 1447 S HA 0.277 4.747 4.470 -0.000 0.000 0.276 1447 S C -2.037 172.545 174.600 -0.030 0.000 1.274 1447 S CA -1.505 56.664 58.200 -0.051 0.000 1.053 1447 S CB 0.238 63.401 63.200 -0.062 0.000 0.919 1447 S HN 0.436 nan 8.310 nan 0.000 0.490 1448 P HA 0.105 nan 4.420 nan 0.000 0.276 1448 P C -0.469 176.856 177.300 0.041 0.000 1.252 1448 P CA -0.513 62.601 63.100 0.023 0.000 0.802 1448 P CB 0.367 32.072 31.700 0.008 0.000 1.035 1449 H N 3.291 122.364 119.070 0.005 0.000 3.001 1449 H HA 0.004 4.559 4.556 -0.000 0.000 0.334 1449 H C -1.209 174.120 175.328 0.001 0.000 1.034 1449 H CA -0.867 55.188 56.048 0.011 0.000 1.420 1449 H CB 0.516 30.290 29.762 0.020 0.000 1.405 1449 H HN 0.272 nan 8.280 nan 0.000 0.593 1450 P HA -0.191 nan 4.420 nan 0.000 0.215 1450 P C 0.986 178.395 177.300 0.181 0.000 1.157 1450 P CA 1.816 64.978 63.100 0.104 0.000 0.868 1450 P CB 0.063 31.776 31.700 0.022 0.000 0.788 1451 E N 0.034 120.434 120.200 0.333 0.000 2.333 1451 E HA -0.178 4.172 4.350 -0.000 0.000 0.198 1451 E C 0.635 177.268 176.600 0.056 0.000 1.007 1451 E CA 1.130 57.614 56.400 0.139 0.000 0.845 1451 E CB -0.808 28.933 29.700 0.069 0.000 0.766 1451 E HN 0.170 nan 8.360 nan 0.000 0.507 1452 D N 0.348 120.796 120.400 0.080 0.000 2.349 1452 D HA 0.137 4.777 4.640 -0.000 0.000 0.214 1452 D C 1.615 177.928 176.300 0.023 0.000 1.063 1452 D CA -0.050 53.963 54.000 0.022 0.000 0.847 1452 D CB 0.162 40.973 40.800 0.019 0.000 0.933 1452 D HN 0.152 nan 8.370 nan 0.000 0.513 1453 L N 1.559 122.804 121.223 0.037 0.000 1.997 1453 L HA -0.174 4.166 4.340 -0.000 0.000 0.216 1453 L C -0.317 176.551 176.870 -0.002 0.000 1.074 1453 L CA 1.697 56.545 54.840 0.012 0.000 0.763 1453 L CB -1.498 40.568 42.059 0.012 0.000 0.890 1453 L HN 0.174 nan 8.230 nan 0.000 0.434 1454 P HA -0.203 nan 4.420 nan 0.000 0.215 1454 P C 1.801 179.098 177.300 -0.006 0.000 1.153 1454 P CA 1.599 64.698 63.100 -0.001 0.000 0.853 1454 P CB -0.097 31.605 31.700 0.003 0.000 0.788 1455 L N -1.349 119.869 121.223 -0.009 0.000 2.447 1455 L HA -0.130 4.210 4.340 -0.000 0.000 0.225 1455 L C 2.550 179.398 176.870 -0.037 0.000 1.148 1455 L CA 0.305 55.136 54.840 -0.016 0.000 0.808 1455 L CB -1.006 41.042 42.059 -0.018 0.000 0.928 1455 L HN -0.040 nan 8.230 nan 0.000 0.448 1456 L N -0.117 121.081 121.223 -0.042 0.000 2.261 1456 L HA -0.208 4.132 4.340 -0.000 0.000 0.216 1456 L C 2.196 179.032 176.870 -0.057 0.000 1.114 1456 L CA 1.797 56.595 54.840 -0.070 0.000 0.777 1456 L CB -0.243 41.785 42.059 -0.052 0.000 0.910 1456 L HN 0.299 nan 8.230 nan 0.000 0.440 1457 E N -1.021 119.168 120.200 -0.019 0.000 2.110 1457 E HA -0.092 4.258 4.350 -0.000 0.000 0.193 1457 E C 1.936 178.555 176.600 0.032 0.000 0.950 1457 E CA 0.767 57.173 56.400 0.009 0.000 0.840 1457 E CB -0.096 29.613 29.700 0.015 0.000 0.809 1457 E HN 0.524 nan 8.360 nan 0.000 0.465 1458 K N 0.382 120.799 120.400 0.027 0.000 2.186 1458 K HA -0.019 4.301 4.320 -0.000 0.000 0.202 1458 K C 0.453 177.090 176.600 0.062 0.000 1.052 1458 K CA 1.194 57.507 56.287 0.044 0.000 0.965 1458 K CB 0.316 32.835 32.500 0.032 0.000 0.746 1458 K HN -0.092 nan 8.250 nan 0.000 0.457 1459 D N 0.556 120.979 120.400 0.039 0.000 2.846 1459 D HA 0.227 4.867 4.640 -0.000 0.000 0.279 1459 D C -2.455 173.830 176.300 -0.025 0.000 1.222 1459 D CA -2.125 51.909 54.000 0.056 0.000 0.769 1459 D CB 1.383 42.215 40.800 0.052 0.000 1.299 1459 D HN -0.145 nan 8.370 nan 0.000 0.537 1460 P HA 0.100 nan 4.420 nan 0.000 0.239 1460 P C 1.365 178.304 177.300 -0.602 0.000 1.184 1460 P CA 0.435 63.278 63.100 -0.428 0.000 0.760 1460 P CB 0.393 31.666 31.700 -0.713 0.000 0.884 1461 G N 1.567 110.236 108.800 -0.219 0.000 2.404 1461 G HA2 -0.210 3.750 3.960 -0.000 0.000 0.215 1461 G HA3 -0.210 3.750 3.960 -0.000 0.000 0.215 1461 G C 0.954 175.877 174.900 0.039 0.000 1.174 1461 G CA 0.319 45.448 45.100 0.049 0.000 0.780 1461 G HN 0.296 nan 8.290 nan 0.000 0.537 1462 R N 0.132 120.648 120.500 0.027 0.000 3.039 1462 R HA 0.500 4.840 4.340 -0.000 0.000 0.336 1462 R C -0.832 175.473 176.300 0.008 0.000 1.258 1462 R CA -0.523 55.602 56.100 0.042 0.000 1.125 1462 R CB -0.314 30.018 30.300 0.053 0.000 1.427 1462 R HN 0.071 nan 8.270 nan 0.000 0.588 1463 V N 1.768 121.665 119.914 -0.029 0.000 2.364 1463 V HA 0.355 4.475 4.120 -0.000 0.000 0.272 1463 V C 0.447 176.557 176.094 0.028 0.000 1.036 1463 V CA -0.677 61.611 62.300 -0.021 0.000 0.880 1463 V CB 0.916 32.698 31.823 -0.069 0.000 0.991 1463 V HN 0.396 nan 8.190 nan 0.000 0.460 1464 R N 2.857 123.397 120.500 0.067 0.000 2.560 1464 R HA 0.756 5.096 4.340 -0.000 0.000 0.270 1464 R C 0.041 176.433 176.300 0.153 0.000 1.074 1464 R CA -0.228 55.946 56.100 0.125 0.000 1.140 1464 R CB 0.956 31.334 30.300 0.130 0.000 1.073 1464 R HN 0.791 nan 8.270 nan 0.000 0.527 1465 A N 1.713 124.632 122.820 0.165 0.000 2.311 1465 A HA 0.451 4.771 4.320 -0.000 0.000 0.334 1465 A C -0.201 177.428 177.584 0.074 0.000 1.139 1465 A CA -0.777 51.323 52.037 0.105 0.000 0.830 1465 A CB 0.717 19.780 19.000 0.105 0.000 1.234 1465 A HN 0.657 nan 8.150 nan 0.000 0.483 1466 L N 1.651 122.871 121.223 -0.004 0.000 2.648 1466 L HA 0.431 4.771 4.340 -0.000 0.000 0.238 1466 L C 0.556 177.381 176.870 -0.076 0.000 1.316 1466 L CA -0.009 54.831 54.840 0.001 0.000 1.241 1466 L CB -0.534 41.504 42.059 -0.036 0.000 1.499 1466 L HN 0.736 nan 8.230 nan 0.000 0.411 1467 A N 1.000 123.741 122.820 -0.132 0.000 2.354 1467 A HA 0.890 5.210 4.320 -0.000 0.000 0.321 1467 A C -1.286 176.254 177.584 -0.073 0.000 1.125 1467 A CA -0.409 51.358 52.037 -0.450 0.000 0.799 1467 A CB 1.273 19.732 19.000 -0.902 0.000 1.293 1467 A HN 0.383 nan 8.150 nan 0.000 0.452 1468 Y N -0.974 119.409 120.300 0.138 0.000 2.544 1468 Y HA 0.726 5.276 4.550 -0.000 0.000 0.342 1468 Y C -1.392 174.749 175.900 0.403 0.000 1.062 1468 Y CA -1.616 56.686 58.100 0.336 0.000 1.023 1468 Y CB 1.213 39.771 38.460 0.163 0.000 1.308 1468 Y HN 0.445 nan 8.280 nan 0.000 0.457 1469 D N 1.947 122.769 120.400 0.704 0.000 2.481 1469 D HA 0.459 5.099 4.640 -0.000 0.000 0.244 1469 D C -1.589 175.015 176.300 0.507 0.000 1.057 1469 D CA -0.431 53.870 54.000 0.501 0.000 0.848 1469 D CB 2.733 43.789 40.800 0.427 0.000 1.388 1469 D HN 0.615 nan 8.370 nan 0.000 0.475 1470 L N 2.708 124.092 121.223 0.268 0.000 2.287 1470 L HA 0.597 4.936 4.340 -0.000 0.000 0.287 1470 L C -1.213 175.594 176.870 -0.104 0.000 1.022 1470 L CA -0.685 54.085 54.840 -0.117 0.000 0.814 1470 L CB 1.415 43.291 42.059 -0.305 0.000 1.217 1470 L HN 0.175 nan 8.230 nan 0.000 0.420 1471 V N 6.702 126.519 119.914 -0.161 0.000 2.769 1471 V HA 0.725 4.845 4.120 -0.000 0.000 0.312 1471 V C -1.652 174.248 176.094 -0.323 0.000 1.061 1471 V CA -0.691 61.508 62.300 -0.168 0.000 0.931 1471 V CB 2.058 33.822 31.823 -0.098 0.000 1.010 1471 V HN 0.806 nan 8.190 nan 0.000 0.433 1472 L N 6.139 127.132 121.223 -0.384 0.000 2.404 1472 L HA 0.680 5.020 4.340 -0.000 0.000 0.272 1472 L C -0.086 176.554 176.870 -0.383 0.000 0.980 1472 L CA 0.157 54.615 54.840 -0.637 0.000 0.836 1472 L CB 1.288 42.839 42.059 -0.846 0.000 1.238 1472 L HN 0.845 nan 8.230 nan 0.000 0.408 1473 N N 4.183 122.671 118.700 -0.353 0.000 2.727 1473 N HA -0.194 4.546 4.740 -0.000 0.000 0.249 1473 N C 0.938 176.352 175.510 -0.159 0.000 1.048 1473 N CA 1.536 54.451 53.050 -0.225 0.000 0.714 1473 N CB -1.335 37.045 38.487 -0.177 0.000 0.959 1473 N HN 1.342 nan 8.380 nan 0.000 0.544 1474 G N -3.168 105.529 108.800 -0.172 0.000 2.143 1474 G HA2 -0.260 3.700 3.960 -0.000 0.000 0.249 1474 G HA3 -0.260 3.700 3.960 -0.000 0.000 0.249 1474 G C -0.128 174.723 174.900 -0.081 0.000 0.981 1474 G CA 0.332 45.364 45.100 -0.114 0.000 0.665 1474 G HN 0.590 nan 8.290 nan 0.000 0.528 1475 V N 0.232 120.083 119.914 -0.105 0.000 2.656 1475 V HA 0.515 4.635 4.120 -0.000 0.000 0.307 1475 V C 0.310 176.358 176.094 -0.076 0.000 1.051 1475 V CA -0.812 61.443 62.300 -0.075 0.000 0.893 1475 V CB 2.002 33.779 31.823 -0.076 0.000 0.999 1475 V HN 0.409 nan 8.190 nan 0.000 0.426 1476 E N 2.833 123.012 120.200 -0.035 0.000 2.166 1476 E HA 0.214 4.564 4.350 -0.000 0.000 0.279 1476 E C 0.493 177.081 176.600 -0.020 0.000 1.095 1476 E CA -0.235 56.157 56.400 -0.014 0.000 0.888 1476 E CB 1.291 31.002 29.700 0.018 0.000 1.041 1476 E HN 0.671 nan 8.360 nan 0.000 0.414 1477 V N 1.484 121.373 119.914 -0.041 0.000 3.660 1477 V HA 0.502 4.622 4.120 -0.000 0.000 0.276 1477 V C 0.616 176.721 176.094 0.017 0.000 1.317 1477 V CA 0.413 62.693 62.300 -0.034 0.000 1.097 1477 V CB 0.254 32.018 31.823 -0.098 0.000 0.863 1477 V HN 0.562 nan 8.190 nan 0.000 0.438 1478 G N -1.593 107.237 108.800 0.051 0.000 2.547 1478 G HA2 0.666 4.626 3.960 -0.000 0.000 0.291 1478 G HA3 0.666 4.626 3.960 -0.000 0.000 0.291 1478 G C -0.847 174.191 174.900 0.229 0.000 1.471 1478 G CA -0.082 45.126 45.100 0.180 0.000 0.798 1478 G HN 0.933 nan 8.290 nan 0.000 0.504 1479 G N -1.650 107.321 108.800 0.284 0.000 2.667 1479 G HA2 0.943 4.903 3.960 -0.000 0.000 0.294 1479 G HA3 0.943 4.903 3.960 -0.000 0.000 0.294 1479 G C -0.332 174.659 174.900 0.151 0.000 1.467 1479 G CA 0.449 45.681 45.100 0.219 0.000 0.852 1479 G HN 1.877 nan 8.290 nan 0.000 0.521 1480 G N -0.916 107.835 108.800 -0.082 0.000 2.561 1480 G HA2 1.013 4.973 3.960 -0.000 0.000 0.310 1480 G HA3 1.013 4.973 3.960 -0.000 0.000 0.310 1480 G C -0.597 173.750 174.900 -0.922 0.000 1.292 1480 G CA 0.769 45.722 45.100 -0.245 0.000 0.811 1480 G HN 2.150 nan 8.290 nan 0.000 0.482 1481 S N -1.465 113.858 115.700 -0.630 0.000 2.627 1481 S HA 0.558 5.028 4.470 -0.000 0.000 0.268 1481 S C -1.338 173.196 174.600 -0.110 0.000 1.130 1481 S CA -0.902 56.951 58.200 -0.579 0.000 0.819 1481 S CB 1.079 64.004 63.200 -0.459 0.000 1.100 1481 S HN 0.807 nan 8.310 nan 0.000 0.465 1482 I N 1.938 122.486 120.570 -0.036 0.000 2.474 1482 I HA 0.455 4.625 4.170 -0.000 0.000 0.287 1482 I C 0.579 176.617 176.117 -0.132 0.000 1.048 1482 I CA -0.145 61.127 61.300 -0.047 0.000 1.383 1482 I CB 0.583 38.569 38.000 -0.024 0.000 1.412 1482 I HN 0.614 nan 8.210 nan 0.000 0.531 1483 R N 5.353 125.706 120.500 -0.244 0.000 2.553 1483 R HA 0.548 4.888 4.340 -0.000 0.000 0.263 1483 R C -0.305 175.868 176.300 -0.212 0.000 1.066 1483 R CA -1.115 54.823 56.100 -0.270 0.000 1.135 1483 R CB 0.499 30.500 30.300 -0.498 0.000 1.148 1483 R HN 0.432 nan 8.270 nan 0.000 0.558 1484 I N 3.701 124.184 120.570 -0.145 0.000 2.352 1484 I HA 0.082 4.252 4.170 -0.000 0.000 0.290 1484 I C 1.382 177.426 176.117 -0.123 0.000 1.036 1484 I CA -0.092 61.129 61.300 -0.130 0.000 1.336 1484 I CB 0.657 38.569 38.000 -0.146 0.000 1.407 1484 I HN 0.652 nan 8.210 nan 0.000 0.497 1485 H N 3.159 122.134 119.070 -0.158 0.000 2.652 1485 H HA 0.186 4.742 4.556 -0.000 0.000 0.274 1485 H C -0.190 175.064 175.328 -0.123 0.000 1.021 1485 H CA -0.390 55.598 56.048 -0.100 0.000 1.187 1485 H CB 0.161 29.905 29.762 -0.030 0.000 1.505 1485 H HN 0.436 nan 8.280 nan 0.000 0.530 1486 D N 2.618 122.711 120.400 -0.513 0.000 2.317 1486 D HA 0.164 4.804 4.640 -0.000 0.000 0.234 1486 D C -1.777 174.372 176.300 -0.253 0.000 1.112 1486 D CA -2.466 51.310 54.000 -0.373 0.000 0.840 1486 D CB 2.219 42.782 40.800 -0.394 0.000 1.078 1486 D HN -0.005 nan 8.370 nan 0.000 0.486 1487 P HA -0.121 nan 4.420 nan 0.000 0.218 1487 P C 1.155 178.377 177.300 -0.130 0.000 1.148 1487 P CA 0.881 63.875 63.100 -0.176 0.000 0.822 1487 P CB 0.393 31.996 31.700 -0.163 0.000 0.784 1488 R N -0.681 119.746 120.500 -0.122 0.000 2.075 1488 R HA 0.054 4.394 4.340 -0.000 0.000 0.226 1488 R C 2.338 178.584 176.300 -0.090 0.000 1.114 1488 R CA 0.761 56.810 56.100 -0.085 0.000 0.972 1488 R CB -1.866 28.388 30.300 -0.076 0.000 0.869 1488 R HN 0.290 nan 8.270 nan 0.000 0.437 1489 L N 1.097 122.244 121.223 -0.127 0.000 2.046 1489 L HA -0.194 4.146 4.340 -0.000 0.000 0.208 1489 L C 2.517 179.301 176.870 -0.143 0.000 1.077 1489 L CA 1.462 56.225 54.840 -0.127 0.000 0.747 1489 L CB -0.185 41.779 42.059 -0.159 0.000 0.896 1489 L HN 0.115 nan 8.230 nan 0.000 0.432 1490 Q N 0.277 119.964 119.800 -0.188 0.000 2.077 1490 Q HA -0.249 4.091 4.340 -0.000 0.000 0.206 1490 Q C 2.155 177.994 176.000 -0.268 0.000 0.989 1490 Q CA 2.338 57.975 55.803 -0.278 0.000 0.853 1490 Q CB -0.496 28.073 28.738 -0.281 0.000 0.907 1490 Q HN 0.662 nan 8.270 nan 0.000 0.418 1491 A N 0.704 123.473 122.820 -0.086 0.000 1.858 1491 A HA -0.218 4.102 4.320 -0.000 0.000 0.216 1491 A C 2.234 179.859 177.584 0.068 0.000 1.190 1491 A CA 1.862 53.940 52.037 0.069 0.000 0.617 1491 A CB -0.751 18.288 19.000 0.065 0.000 0.827 1491 A HN 0.442 nan 8.150 nan 0.000 0.443 1492 R N -0.494 120.010 120.500 0.007 0.000 2.133 1492 R HA -0.161 4.179 4.340 -0.000 0.000 0.247 1492 R C 1.934 178.247 176.300 0.021 0.000 1.151 1492 R CA 2.013 58.120 56.100 0.012 0.000 0.971 1492 R CB -0.471 29.817 30.300 -0.020 0.000 0.866 1492 R HN 0.339 nan 8.270 nan 0.000 0.447 1493 V N 0.183 120.081 119.914 -0.025 0.000 2.307 1493 V HA -0.215 3.905 4.120 -0.000 0.000 0.245 1493 V C 2.033 178.193 176.094 0.109 0.000 1.045 1493 V CA 1.867 64.153 62.300 -0.023 0.000 1.024 1493 V CB -0.553 31.192 31.823 -0.130 0.000 0.651 1493 V HN 0.345 nan 8.190 nan 0.000 0.449 1494 F N 0.015 119.996 119.950 0.053 0.000 2.307 1494 F HA -0.201 4.326 4.527 -0.000 0.000 0.301 1494 F C 2.623 178.463 175.800 0.066 0.000 1.076 1494 F CA 0.853 58.896 58.000 0.071 0.000 1.383 1494 F CB -0.101 38.949 39.000 0.084 0.000 1.055 1494 F HN 0.107 nan 8.300 nan 0.000 0.526 1495 R N 0.234 120.874 120.500 0.234 0.000 2.075 1495 R HA -0.142 4.198 4.340 -0.000 0.000 0.232 1495 R C 2.140 178.526 176.300 0.142 0.000 1.126 1495 R CA 1.144 57.334 56.100 0.150 0.000 0.963 1495 R CB -0.419 29.941 30.300 0.101 0.000 0.858 1495 R HN 0.338 nan 8.270 nan 0.000 0.435 1496 L N 0.566 121.870 121.223 0.135 0.000 2.027 1496 L HA -0.142 4.198 4.340 -0.000 0.000 0.206 1496 L C 2.286 179.275 176.870 0.197 0.000 1.074 1496 L CA 1.126 56.049 54.840 0.137 0.000 0.745 1496 L CB -0.411 41.675 42.059 0.045 0.000 0.898 1496 L HN 0.210 nan 8.230 nan 0.000 0.433 1497 L N -0.043 121.307 121.223 0.213 0.000 2.353 1497 L HA -0.091 4.249 4.340 -0.000 0.000 0.220 1497 L C 1.492 178.467 176.870 0.176 0.000 1.133 1497 L CA 0.823 55.803 54.840 0.232 0.000 0.798 1497 L CB -0.954 41.295 42.059 0.317 0.000 0.922 1497 L HN 0.596 nan 8.230 nan 0.000 0.445 1498 G N 0.741 109.633 108.800 0.153 0.000 2.147 1498 G HA2 -0.287 3.673 3.960 -0.000 0.000 0.244 1498 G HA3 -0.287 3.673 3.960 -0.000 0.000 0.244 1498 G C 0.156 175.080 174.900 0.040 0.000 1.005 1498 G CA -0.147 45.010 45.100 0.094 0.000 0.713 1498 G HN 0.328 nan 8.290 nan 0.000 0.515 1499 I N 1.745 122.322 120.570 0.012 0.000 2.352 1499 I HA 0.425 4.595 4.170 -0.000 0.000 0.290 1499 I C 1.496 177.535 176.117 -0.131 0.000 1.036 1499 I CA -0.158 61.068 61.300 -0.122 0.000 1.336 1499 I CB 0.983 38.770 38.000 -0.355 0.000 1.407 1499 I HN 0.166 nan 8.210 nan 0.000 0.497 1500 G N 4.391 113.133 108.800 -0.097 0.000 2.559 1500 G HA2 0.011 3.971 3.960 -0.000 0.000 0.235 1500 G HA3 0.011 3.971 3.960 -0.000 0.000 0.235 1500 G C 0.510 175.362 174.900 -0.080 0.000 1.266 1500 G CA -0.359 44.703 45.100 -0.064 0.000 0.847 1500 G HN 0.795 nan 8.290 nan 0.000 0.583 1501 E N 0.422 120.604 120.200 -0.029 0.000 2.516 1501 E HA -0.039 4.311 4.350 -0.000 0.000 0.199 1501 E C 1.394 177.987 176.600 -0.012 0.000 1.069 1501 E CA 0.532 56.929 56.400 -0.006 0.000 0.876 1501 E CB 0.335 30.049 29.700 0.024 0.000 0.843 1501 E HN 0.739 nan 8.360 nan 0.000 0.530 1502 E N 0.191 120.372 120.200 -0.032 0.000 2.372 1502 E HA -0.036 4.314 4.350 -0.000 0.000 0.201 1502 E C 1.671 178.240 176.600 -0.052 0.000 0.938 1502 E CA 0.048 56.431 56.400 -0.028 0.000 0.944 1502 E CB 0.324 30.011 29.700 -0.022 0.000 0.937 1502 E HN 0.145 nan 8.360 nan 0.000 0.495 1503 E N 1.753 121.901 120.200 -0.086 0.000 2.170 1503 E HA -0.171 4.179 4.350 -0.000 0.000 0.191 1503 E C 2.180 178.676 176.600 -0.174 0.000 0.981 1503 E CA 0.741 57.065 56.400 -0.128 0.000 0.830 1503 E CB 0.214 29.829 29.700 -0.142 0.000 0.775 1503 E HN 0.262 nan 8.360 nan 0.000 0.470 1504 Q N 0.325 120.029 119.800 -0.160 0.000 2.119 1504 Q HA -0.132 4.208 4.340 -0.000 0.000 0.201 1504 Q C 1.812 177.818 176.000 0.011 0.000 0.972 1504 Q CA 0.927 56.673 55.803 -0.095 0.000 0.847 1504 Q CB -0.312 28.381 28.738 -0.075 0.000 0.903 1504 Q HN 0.109 nan 8.270 nan 0.000 0.433 1505 R N 0.466 120.969 120.500 0.005 0.000 2.339 1505 R HA -0.000 4.340 4.340 -0.000 0.000 0.199 1505 R C 1.236 177.543 176.300 0.011 0.000 1.018 1505 R CA 0.996 57.114 56.100 0.031 0.000 1.036 1505 R CB 0.147 30.464 30.300 0.029 0.000 0.899 1505 R HN 0.514 nan 8.270 nan 0.000 0.473 1506 E N 0.247 120.418 120.200 -0.049 0.000 2.332 1506 E HA -0.032 4.318 4.350 -0.000 0.000 0.202 1506 E C 1.379 177.907 176.600 -0.120 0.000 0.877 1506 E CA 0.299 56.664 56.400 -0.058 0.000 0.979 1506 E CB 0.460 30.116 29.700 -0.074 0.000 0.969 1506 E HN 0.278 nan 8.360 nan 0.000 0.495 1507 K N -0.462 119.756 120.400 -0.303 0.000 2.354 1507 K HA 0.135 4.455 4.320 -0.000 0.000 0.194 1507 K C 0.416 176.557 176.600 -0.766 0.000 1.045 1507 K CA 0.446 56.369 56.287 -0.607 0.000 1.026 1507 K CB 0.492 32.408 32.500 -0.973 0.000 0.866 1507 K HN -0.009 nan 8.250 nan 0.000 0.530 1508 F N 0.331 120.263 119.950 -0.031 0.000 2.960 1508 F HA 0.344 4.871 4.527 -0.000 0.000 0.345 1508 F C 1.750 177.454 175.800 -0.161 0.000 1.147 1508 F CA -0.715 57.227 58.000 -0.096 0.000 1.099 1508 F CB 0.271 39.393 39.000 0.203 0.000 1.219 1508 F HN 0.041 nan 8.300 nan 0.000 0.525 1509 G N 1.940 110.772 108.800 0.053 0.000 2.574 1509 G HA2 -0.399 3.560 3.960 -0.000 0.000 0.220 1509 G HA3 -0.399 3.560 3.960 -0.000 0.000 0.220 1509 G C 1.659 176.601 174.900 0.071 0.000 1.173 1509 G CA 1.859 47.009 45.100 0.083 0.000 0.772 1509 G HN 0.429 nan 8.290 nan 0.000 0.585 1510 F N -0.435 119.625 119.950 0.183 0.000 2.216 1510 F HA 0.163 4.690 4.527 -0.000 0.000 0.300 1510 F C 2.090 178.007 175.800 0.194 0.000 1.085 1510 F CA 0.907 59.002 58.000 0.158 0.000 1.326 1510 F CB -0.783 38.295 39.000 0.130 0.000 1.027 1510 F HN 0.100 nan 8.300 nan 0.000 0.497 1511 F N 1.274 120.870 119.950 -0.590 0.000 2.187 1511 F HA 0.085 4.612 4.527 -0.000 0.000 0.295 1511 F C 1.941 177.660 175.800 -0.135 0.000 1.091 1511 F CA 1.042 58.870 58.000 -0.286 0.000 1.308 1511 F CB -0.468 38.307 39.000 -0.375 0.000 1.030 1511 F HN -0.036 nan 8.300 nan 0.000 0.487 1512 L N -0.021 121.131 121.223 -0.119 0.000 2.079 1512 L HA -0.205 4.134 4.340 -0.000 0.000 0.210 1512 L C 2.498 179.257 176.870 -0.185 0.000 1.081 1512 L CA 1.480 56.223 54.840 -0.162 0.000 0.752 1512 L CB -0.733 41.359 42.059 0.055 0.000 0.896 1512 L HN 0.176 nan 8.230 nan 0.000 0.433 1513 E N 0.189 120.344 120.200 -0.075 0.000 2.106 1513 E HA -0.196 4.154 4.350 -0.000 0.000 0.192 1513 E C 2.230 178.825 176.600 -0.009 0.000 0.984 1513 E CA 1.173 57.559 56.400 -0.023 0.000 0.806 1513 E CB 0.083 29.846 29.700 0.105 0.000 0.750 1513 E HN 0.469 nan 8.360 nan 0.000 0.458 1514 A N 1.087 123.879 122.820 -0.046 0.000 1.972 1514 A HA -0.137 4.183 4.320 -0.000 0.000 0.219 1514 A C 2.204 179.703 177.584 -0.143 0.000 1.169 1514 A CA 0.842 52.871 52.037 -0.013 0.000 0.635 1514 A CB -0.572 18.351 19.000 -0.127 0.000 0.810 1514 A HN 0.206 nan 8.150 nan 0.000 0.446 1515 L N -0.387 120.611 121.223 -0.375 0.000 2.275 1515 L HA -0.147 4.193 4.340 -0.000 0.000 0.215 1515 L C 1.993 178.731 176.870 -0.220 0.000 1.119 1515 L CA 1.034 55.669 54.840 -0.342 0.000 0.790 1515 L CB -0.504 41.288 42.059 -0.445 0.000 0.919 1515 L HN 0.508 nan 8.230 nan 0.000 0.443 1516 E N -0.882 119.165 120.200 -0.254 0.000 2.481 1516 E HA -0.109 4.241 4.350 -0.000 0.000 0.195 1516 E C 0.668 177.023 176.600 -0.407 0.000 1.047 1516 E CA 0.519 56.717 56.400 -0.337 0.000 0.867 1516 E CB 0.156 29.600 29.700 -0.426 0.000 0.858 1516 E HN 0.565 nan 8.360 nan 0.000 0.513 1517 Y N 0.586 120.836 120.300 -0.084 0.000 2.571 1517 Y HA 0.270 4.820 4.550 -0.000 0.000 0.275 1517 Y C 0.895 176.764 175.900 -0.052 0.000 1.179 1517 Y CA -0.051 58.014 58.100 -0.059 0.000 1.242 1517 Y CB 1.066 39.494 38.460 -0.054 0.000 1.126 1517 Y HN -0.003 nan 8.280 nan 0.000 0.524 1518 G N 0.923 109.740 108.800 0.029 0.000 2.963 1518 G HA2 0.053 4.013 3.960 -0.000 0.000 0.262 1518 G HA3 0.053 4.013 3.960 -0.000 0.000 0.262 1518 G C -0.436 174.467 174.900 0.005 0.000 1.043 1518 G CA -0.376 44.740 45.100 0.027 0.000 1.223 1518 G HN 0.549 nan 8.290 nan 0.000 0.574 1519 A N 3.295 126.108 122.820 -0.012 0.000 2.290 1519 A HA 0.930 5.250 4.320 -0.000 0.000 0.310 1519 A C -1.023 176.546 177.584 -0.025 0.000 1.202 1519 A CA -1.152 50.859 52.037 -0.044 0.000 0.837 1519 A CB 1.110 20.087 19.000 -0.038 0.000 1.139 1519 A HN 0.529 nan 8.150 nan 0.000 0.509 1520 P HA 0.424 nan 4.420 nan 0.000 0.278 1520 P C -2.930 174.090 177.300 -0.466 0.000 1.266 1520 P CA -1.903 60.960 63.100 -0.396 0.000 0.807 1520 P CB 0.193 31.423 31.700 -0.784 0.000 1.094 1521 P HA 0.138 nan 4.420 nan 0.000 0.271 1521 P C -0.424 176.669 177.300 -0.344 0.000 1.216 1521 P CA 0.804 63.437 63.100 -0.778 0.000 0.776 1521 P CB 0.123 31.481 31.700 -0.571 0.000 0.881 1522 H N 0.085 118.973 119.070 -0.302 0.000 3.014 1522 H HA 0.813 5.369 4.556 -0.000 0.000 0.337 1522 H C -1.000 174.285 175.328 -0.072 0.000 1.320 1522 H CA -1.133 54.801 56.048 -0.191 0.000 1.128 1522 H CB 1.230 30.879 29.762 -0.188 0.000 1.862 1522 H HN 0.621 nan 8.280 nan 0.000 0.536 1523 G N -1.354 107.459 108.800 0.021 0.000 2.523 1523 G HA2 0.582 4.542 3.960 -0.000 0.000 0.291 1523 G HA3 0.582 4.542 3.960 -0.000 0.000 0.291 1523 G C -1.138 173.852 174.900 0.149 0.000 1.450 1523 G CA -0.099 45.020 45.100 0.033 0.000 0.790 1523 G HN 1.015 nan 8.290 nan 0.000 0.496 1524 G N -1.338 107.578 108.800 0.194 0.000 2.588 1524 G HA2 0.756 4.716 3.960 -0.000 0.000 0.281 1524 G HA3 0.756 4.716 3.960 -0.000 0.000 0.281 1524 G C -1.716 173.369 174.900 0.309 0.000 1.223 1524 G CA 0.097 45.344 45.100 0.246 0.000 0.871 1524 G HN 1.436 nan 8.290 nan 0.000 0.492 1525 I N -1.125 119.614 120.570 0.282 0.000 3.021 1525 I HA 0.651 4.821 4.170 -0.000 0.000 0.305 1525 I C -1.504 174.770 176.117 0.262 0.000 1.434 1525 I CA -0.987 60.514 61.300 0.335 0.000 0.969 1525 I CB 2.116 40.425 38.000 0.514 0.000 1.328 1525 I HN 1.188 nan 8.210 nan 0.000 0.486 1526 A N 3.796 126.801 122.820 0.309 0.000 2.422 1526 A HA 0.770 5.090 4.320 -0.000 0.000 0.302 1526 A C -2.264 175.604 177.584 0.472 0.000 1.041 1526 A CA -0.336 51.865 52.037 0.272 0.000 0.708 1526 A CB 1.077 20.200 19.000 0.205 0.000 1.257 1526 A HN 0.534 nan 8.150 nan 0.000 0.414 1527 W N 0.924 122.305 121.300 0.134 0.000 2.551 1527 W HA 0.595 5.255 4.660 0.000 0.000 0.330 1527 W C 0.630 177.226 176.519 0.129 0.000 1.063 1527 W CA -1.292 56.128 57.345 0.126 0.000 1.222 1527 W CB 1.628 31.151 29.460 0.104 0.000 1.349 1527 W HN 0.967 nan 8.180 nan 0.000 0.536 1528 G N 2.911 111.913 108.800 0.336 0.000 2.519 1528 G HA2 0.267 4.227 3.960 -0.000 0.000 0.306 1528 G HA3 0.267 4.227 3.960 -0.000 0.000 0.306 1528 G C 0.583 175.629 174.900 0.243 0.000 0.965 1528 G CA -0.373 44.877 45.100 0.250 0.000 1.291 1528 G HN 0.532 nan 8.290 nan 0.000 0.450 1529 L N 2.115 123.498 121.223 0.266 0.000 2.083 1529 L HA -0.053 4.287 4.340 -0.000 0.000 0.209 1529 L C 2.190 179.153 176.870 0.156 0.000 1.083 1529 L CA 1.813 56.791 54.840 0.230 0.000 0.752 1529 L CB -0.097 42.082 42.059 0.199 0.000 0.899 1529 L HN 0.479 nan 8.230 nan 0.000 0.433 1530 D N -0.890 119.597 120.400 0.145 0.000 2.097 1530 D HA -0.238 4.402 4.640 -0.000 0.000 0.195 1530 D C 2.197 178.537 176.300 0.066 0.000 0.989 1530 D CA 1.214 55.274 54.000 0.100 0.000 0.827 1530 D CB -0.043 40.822 40.800 0.109 0.000 0.966 1530 D HN 0.176 nan 8.370 nan 0.000 0.456 1531 R N 1.233 121.770 120.500 0.062 0.000 2.081 1531 R HA -0.035 4.305 4.340 -0.000 0.000 0.235 1531 R C 2.358 178.675 176.300 0.029 0.000 1.131 1531 R CA 0.640 56.758 56.100 0.029 0.000 0.960 1531 R CB -0.917 29.390 30.300 0.012 0.000 0.856 1531 R HN 0.163 nan 8.270 nan 0.000 0.436 1532 L N -0.199 121.056 121.223 0.055 0.000 2.042 1532 L HA -0.173 4.167 4.340 -0.000 0.000 0.210 1532 L C 1.725 178.608 176.870 0.020 0.000 1.076 1532 L CA 1.484 56.352 54.840 0.046 0.000 0.749 1532 L CB -0.348 41.771 42.059 0.099 0.000 0.893 1532 L HN 0.310 nan 8.230 nan 0.000 0.432 1533 L N -0.239 121.001 121.223 0.028 0.000 2.083 1533 L HA -0.165 4.175 4.340 -0.000 0.000 0.209 1533 L C 2.880 179.746 176.870 -0.008 0.000 1.083 1533 L CA 1.771 56.608 54.840 -0.005 0.000 0.752 1533 L CB -1.655 40.414 42.059 0.016 0.000 0.899 1533 L HN 0.291 nan 8.230 nan 0.000 0.433 1534 A N -0.525 122.299 122.820 0.006 0.000 1.902 1534 A HA -0.159 4.161 4.320 -0.000 0.000 0.217 1534 A C 2.171 179.763 177.584 0.012 0.000 1.181 1534 A CA 1.072 53.111 52.037 0.003 0.000 0.623 1534 A CB -0.397 18.604 19.000 0.002 0.000 0.818 1534 A HN 0.277 nan 8.150 nan 0.000 0.443 1535 L N -0.975 120.261 121.223 0.022 0.000 2.093 1535 L HA -0.075 4.265 4.340 -0.000 0.000 0.208 1535 L C 2.616 179.576 176.870 0.150 0.000 1.085 1535 L CA 1.674 56.553 54.840 0.065 0.000 0.755 1535 L CB -1.248 40.839 42.059 0.046 0.000 0.904 1535 L HN 0.465 nan 8.230 nan 0.000 0.435 1536 M N -1.234 118.396 119.600 0.050 0.000 2.279 1536 M HA -0.155 4.325 4.480 -0.000 0.000 0.264 1536 M C 1.704 178.036 176.300 0.054 0.000 1.062 1536 M CA 1.508 56.790 55.300 -0.030 0.000 1.099 1536 M CB -0.342 32.089 32.600 -0.282 0.000 1.394 1536 M HN 0.115 nan 8.290 nan 0.000 0.426 1537 T N -0.887 113.681 114.554 0.024 0.000 3.060 1537 T HA 0.199 4.549 4.350 -0.000 0.000 0.249 1537 T C 1.057 175.767 174.700 0.016 0.000 1.079 1537 T CA 0.739 62.844 62.100 0.008 0.000 1.013 1537 T CB 0.194 69.049 68.868 -0.022 0.000 0.975 1537 T HN 0.659 nan 8.240 nan 0.000 0.518 1538 G N 2.004 110.826 108.800 0.036 0.000 2.198 1538 G HA2 -0.257 3.703 3.960 -0.000 0.000 0.260 1538 G HA3 -0.257 3.703 3.960 -0.000 0.000 0.260 1538 G C 0.216 175.109 174.900 -0.013 0.000 1.025 1538 G CA 0.242 45.348 45.100 0.010 0.000 0.769 1538 G HN 0.514 nan 8.290 nan 0.000 0.507 1539 S N 0.234 115.927 115.700 -0.012 0.000 2.580 1539 S HA 0.455 4.925 4.470 -0.000 0.000 0.274 1539 S C -0.516 174.071 174.600 -0.023 0.000 1.329 1539 S CA -0.413 57.773 58.200 -0.023 0.000 1.036 1539 S CB 1.467 64.653 63.200 -0.023 0.000 0.919 1539 S HN 0.204 nan 8.310 nan 0.000 0.515 1540 P HA 0.113 nan 4.420 nan 0.000 0.236 1540 P C -0.019 177.268 177.300 -0.022 0.000 1.177 1540 P CA 0.375 63.459 63.100 -0.027 0.000 0.773 1540 P CB 0.321 32.002 31.700 -0.032 0.000 0.878 1541 S N -0.881 114.807 115.700 -0.020 0.000 2.550 1541 S HA 0.310 4.780 4.470 -0.000 0.000 0.270 1541 S C 0.561 175.155 174.600 -0.010 0.000 1.145 1541 S CA -0.828 57.363 58.200 -0.015 0.000 0.852 1541 S CB 0.505 63.696 63.200 -0.015 0.000 1.119 1541 S HN -0.005 nan 8.310 nan 0.000 0.465 1542 I N 0.954 121.523 120.570 -0.002 0.000 3.176 1542 I HA 0.149 4.319 4.170 -0.000 0.000 0.275 1542 I C 1.910 178.033 176.117 0.010 0.000 1.298 1542 I CA 0.390 61.694 61.300 0.008 0.000 1.445 1542 I CB -0.293 37.718 38.000 0.019 0.000 1.075 1542 I HN 0.493 nan 8.210 nan 0.000 0.482 1543 R N 1.167 121.669 120.500 0.003 0.000 2.235 1543 R HA -0.025 4.315 4.340 -0.000 0.000 0.213 1543 R C 1.514 177.803 176.300 -0.018 0.000 1.059 1543 R CA 0.686 56.787 56.100 0.001 0.000 0.997 1543 R CB -0.141 30.159 30.300 0.000 0.000 0.884 1543 R HN 0.461 nan 8.270 nan 0.000 0.462 1544 E N 0.415 120.600 120.200 -0.025 0.000 2.427 1544 E HA -0.063 4.287 4.350 -0.000 0.000 0.196 1544 E C 1.489 178.066 176.600 -0.038 0.000 1.028 1544 E CA 0.826 57.202 56.400 -0.040 0.000 0.864 1544 E CB 0.421 30.096 29.700 -0.043 0.000 0.813 1544 E HN 0.269 nan 8.360 nan 0.000 0.514 1545 V N -1.984 117.918 119.914 -0.020 0.000 3.176 1545 V HA 0.409 4.529 4.120 -0.000 0.000 0.332 1545 V C 0.469 176.563 176.094 0.000 0.000 1.414 1545 V CA -0.308 61.985 62.300 -0.012 0.000 1.133 1545 V CB -0.266 31.557 31.823 0.000 0.000 1.088 1545 V HN -0.097 nan 8.190 nan 0.000 0.473 1546 I N 0.927 121.492 120.570 -0.008 0.000 2.466 1546 I HA 0.680 4.850 4.170 -0.000 0.000 0.289 1546 I C 1.506 177.593 176.117 -0.050 0.000 1.026 1546 I CA -0.294 61.011 61.300 0.008 0.000 1.078 1546 I CB 2.049 40.073 38.000 0.039 0.000 1.249 1546 I HN 0.090 nan 8.210 nan 0.000 0.429 1547 A N 6.309 129.081 122.820 -0.081 0.000 1.873 1547 A HA -0.081 4.239 4.320 -0.000 0.000 0.218 1547 A C 0.716 177.976 177.584 -0.541 0.000 1.193 1547 A CA 1.747 53.593 52.037 -0.319 0.000 0.629 1547 A CB -0.236 18.591 19.000 -0.289 0.000 0.826 1547 A HN 0.589 nan 8.150 nan 0.000 0.447 1548 F N 0.798 120.779 119.950 0.052 0.000 2.564 1548 F HA 0.357 4.884 4.527 -0.000 0.000 0.361 1548 F C -2.192 173.636 175.800 0.046 0.000 1.161 1548 F CA -2.105 55.926 58.000 0.052 0.000 1.198 1548 F CB 1.254 40.288 39.000 0.057 0.000 1.424 1548 F HN 0.125 nan 8.300 nan 0.000 0.517 1549 P HA 0.332 nan 4.420 nan 0.000 0.281 1549 P C -0.639 176.727 177.300 0.109 0.000 1.281 1549 P CA -0.614 62.553 63.100 0.112 0.000 0.811 1549 P CB 1.477 33.216 31.700 0.066 0.000 1.154 1550 K N 0.769 121.224 120.400 0.093 0.000 2.106 1550 K HA 0.276 4.596 4.320 -0.000 0.000 0.246 1550 K C 0.708 177.349 176.600 0.067 0.000 0.987 1550 K CA -0.504 55.833 56.287 0.083 0.000 0.904 1550 K CB 0.580 33.132 32.500 0.088 0.000 1.071 1550 K HN 0.570 nan 8.250 nan 0.000 0.453 1551 N N 0.092 118.827 118.700 0.059 0.000 2.381 1551 N HA 0.056 4.796 4.740 -0.000 0.000 0.289 1551 N C 0.528 176.067 175.510 0.049 0.000 1.288 1551 N CA -0.015 53.063 53.050 0.046 0.000 0.960 1551 N CB 0.262 38.773 38.487 0.039 0.000 1.116 1551 N HN 0.303 nan 8.380 nan 0.000 0.557 1552 K N -0.690 119.734 120.400 0.040 0.000 2.283 1552 K HA -0.056 4.264 4.320 -0.000 0.000 0.202 1552 K C 0.747 177.376 176.600 0.048 0.000 1.048 1552 K CA 1.193 57.504 56.287 0.040 0.000 0.948 1552 K CB -0.111 32.406 32.500 0.028 0.000 0.742 1552 K HN 0.590 nan 8.250 nan 0.000 0.458 1553 E N -0.271 119.959 120.200 0.050 0.000 2.479 1553 E HA 0.048 4.397 4.350 -0.000 0.000 0.193 1553 E C 0.621 177.266 176.600 0.075 0.000 1.049 1553 E CA 0.174 56.608 56.400 0.056 0.000 0.870 1553 E CB 0.514 30.242 29.700 0.048 0.000 0.944 1553 E HN 0.432 nan 8.360 nan 0.000 0.492 1554 G N 2.013 110.863 108.800 0.083 0.000 2.143 1554 G HA2 -0.310 3.650 3.960 -0.000 0.000 0.248 1554 G HA3 -0.310 3.650 3.960 -0.000 0.000 0.248 1554 G C 0.084 175.038 174.900 0.091 0.000 0.991 1554 G CA 0.329 45.493 45.100 0.106 0.000 0.689 1554 G HN 0.168 nan 8.290 nan 0.000 0.522 1555 K N -0.244 120.198 120.400 0.071 0.000 2.139 1555 K HA 0.539 4.859 4.320 -0.000 0.000 0.243 1555 K C -1.069 175.564 176.600 0.056 0.000 0.983 1555 K CA -0.812 55.511 56.287 0.060 0.000 0.890 1555 K CB 1.128 33.657 32.500 0.049 0.000 1.090 1555 K HN 0.048 nan 8.250 nan 0.000 0.445 1556 D N 1.585 122.013 120.400 0.048 0.000 2.464 1556 D HA 0.247 4.887 4.640 -0.000 0.000 0.243 1556 D C -2.142 174.178 176.300 0.034 0.000 1.104 1556 D CA -2.458 51.572 54.000 0.049 0.000 0.883 1556 D CB 1.536 42.365 40.800 0.048 0.000 1.050 1556 D HN 0.052 nan 8.370 nan 0.000 0.524 1557 P HA -0.103 nan 4.420 nan 0.000 0.218 1557 P C 1.538 178.830 177.300 -0.015 0.000 1.149 1557 P CA 0.313 63.415 63.100 0.004 0.000 0.817 1557 P CB 0.363 32.064 31.700 0.001 0.000 0.785 1558 L N -0.925 120.307 121.223 0.015 0.000 1.994 1558 L HA -0.102 4.238 4.340 -0.000 0.000 0.208 1558 L C 1.864 178.744 176.870 0.017 0.000 1.071 1558 L CA 2.295 57.150 54.840 0.026 0.000 0.745 1558 L CB -1.428 40.699 42.059 0.114 0.000 0.892 1558 L HN -0.099 nan 8.230 nan 0.000 0.431 1559 T N -0.796 113.765 114.554 0.013 0.000 3.037 1559 T HA 0.270 4.620 4.350 -0.000 0.000 0.252 1559 T C 1.083 175.783 174.700 -0.001 0.000 1.073 1559 T CA 0.567 62.665 62.100 -0.003 0.000 1.091 1559 T CB -0.008 68.849 68.868 -0.019 0.000 0.935 1559 T HN 0.642 nan 8.240 nan 0.000 0.488 1560 G N 1.756 110.559 108.800 0.005 0.000 2.182 1560 G HA2 -0.036 3.924 3.960 -0.000 0.000 0.248 1560 G HA3 -0.036 3.924 3.960 -0.000 0.000 0.248 1560 G C 0.052 174.960 174.900 0.012 0.000 1.042 1560 G CA -0.122 44.983 45.100 0.008 0.000 0.775 1560 G HN 0.854 nan 8.290 nan 0.000 0.501 1561 A N 1.102 123.931 122.820 0.015 0.000 2.260 1561 A HA 0.986 5.306 4.320 -0.000 0.000 0.314 1561 A C -2.161 175.440 177.584 0.029 0.000 1.257 1561 A CA -0.679 51.368 52.037 0.017 0.000 0.871 1561 A CB 1.661 20.665 19.000 0.007 0.000 1.166 1561 A HN 1.069 nan 8.150 nan 0.000 0.522 1562 P HA 0.061 nan 4.420 nan 0.000 0.365 1562 P C -1.157 176.164 177.300 0.034 0.000 1.908 1562 P CA -0.199 62.926 63.100 0.042 0.000 1.433 1562 P CB -0.440 31.293 31.700 0.055 0.000 2.198 1563 S N 2.643 118.360 115.700 0.029 0.000 2.599 1563 S HA 0.981 5.450 4.470 -0.000 0.000 0.294 1563 S C -2.580 172.035 174.600 0.025 0.000 1.094 1563 S CA -1.499 56.715 58.200 0.023 0.000 0.931 1563 S CB 0.836 64.046 63.200 0.016 0.000 1.093 1563 S HN 0.145 nan 8.310 nan 0.000 0.488 1564 P HA 0.504 nan 4.420 nan 0.000 0.274 1564 P C -0.869 176.442 177.300 0.018 0.000 1.231 1564 P CA -0.691 62.422 63.100 0.022 0.000 0.790 1564 P CB 0.704 32.416 31.700 0.019 0.000 0.951 1565 V N -1.031 118.894 119.914 0.019 0.000 2.864 1565 V HA 0.662 4.781 4.120 -0.000 0.000 0.314 1565 V C -2.466 173.635 176.094 0.011 0.000 1.073 1565 V CA -2.525 59.784 62.300 0.014 0.000 0.956 1565 V CB 1.171 33.005 31.823 0.018 0.000 1.023 1565 V HN 0.476 nan 8.190 nan 0.000 0.435 1566 P HA 0.025 nan 4.420 nan 0.000 0.264 1566 P C 0.594 177.896 177.300 0.004 0.000 1.183 1566 P CA 0.264 63.366 63.100 0.003 0.000 0.763 1566 P CB 0.870 32.570 31.700 -0.001 0.000 0.807 1567 E N 2.847 123.050 120.200 0.004 0.000 2.219 1567 E HA -0.221 4.129 4.350 -0.000 0.000 0.198 1567 E C 1.367 177.967 176.600 -0.000 0.000 0.998 1567 E CA 1.444 57.847 56.400 0.004 0.000 0.818 1567 E CB 0.167 29.870 29.700 0.004 0.000 0.741 1567 E HN 0.608 nan 8.360 nan 0.000 0.477 1568 E N 0.220 120.417 120.200 -0.004 0.000 2.299 1568 E HA -0.181 4.169 4.350 -0.000 0.000 0.193 1568 E C 1.959 178.551 176.600 -0.015 0.000 0.998 1568 E CA 0.557 56.951 56.400 -0.010 0.000 0.851 1568 E CB -0.478 29.214 29.700 -0.012 0.000 0.795 1568 E HN 0.352 nan 8.360 nan 0.000 0.492 1569 Q N 0.730 120.523 119.800 -0.011 0.000 2.123 1569 Q HA -0.029 4.311 4.340 -0.000 0.000 0.199 1569 Q C 2.385 178.378 176.000 -0.012 0.000 0.966 1569 Q CA 0.737 56.532 55.803 -0.014 0.000 0.845 1569 Q CB 0.062 28.796 28.738 -0.007 0.000 0.907 1569 Q HN 0.323 nan 8.270 nan 0.000 0.439 1570 L N 0.057 121.279 121.223 -0.002 0.000 2.072 1570 L HA -0.128 4.212 4.340 -0.000 0.000 0.205 1570 L C 2.762 179.628 176.870 -0.006 0.000 1.079 1570 L CA 1.073 55.916 54.840 0.006 0.000 0.752 1570 L CB -0.364 41.707 42.059 0.019 0.000 0.906 1570 L HN 0.238 nan 8.230 nan 0.000 0.436 1571 R N 0.387 120.881 120.500 -0.011 0.000 2.105 1571 R HA -0.248 4.091 4.340 -0.000 0.000 0.239 1571 R C 2.147 178.425 176.300 -0.037 0.000 1.135 1571 R CA 1.780 57.869 56.100 -0.018 0.000 0.967 1571 R CB -0.113 30.177 30.300 -0.016 0.000 0.861 1571 R HN 0.362 nan 8.270 nan 0.000 0.442 1572 E N 0.276 120.449 120.200 -0.044 0.000 2.153 1572 E HA -0.178 4.172 4.350 -0.000 0.000 0.194 1572 E C 1.592 178.135 176.600 -0.095 0.000 0.988 1572 E CA 1.048 57.406 56.400 -0.070 0.000 0.811 1572 E CB 0.019 29.678 29.700 -0.069 0.000 0.746 1572 E HN 0.422 nan 8.360 nan 0.000 0.466 1573 L N -0.602 120.576 121.223 -0.075 0.000 2.554 1573 L HA 0.178 4.518 4.340 -0.000 0.000 0.226 1573 L C 1.248 178.066 176.870 -0.086 0.000 1.137 1573 L CA 0.342 55.127 54.840 -0.092 0.000 0.863 1573 L CB 0.102 42.132 42.059 -0.048 0.000 0.985 1573 L HN 0.337 nan 8.230 nan 0.000 0.451 1574 G N 1.157 109.922 108.800 -0.058 0.000 2.225 1574 G HA2 -0.257 3.703 3.960 -0.000 0.000 0.264 1574 G HA3 -0.257 3.703 3.960 -0.000 0.000 0.264 1574 G C -0.280 174.615 174.900 -0.008 0.000 1.060 1574 G CA -0.001 45.074 45.100 -0.041 0.000 0.833 1574 G HN 0.240 nan 8.290 nan 0.000 0.498 1575 L N -0.710 120.520 121.223 0.011 0.000 2.371 1575 L HA 0.921 5.261 4.340 -0.000 0.000 0.262 1575 L C 0.389 177.282 176.870 0.038 0.000 1.006 1575 L CA -1.335 53.533 54.840 0.047 0.000 0.818 1575 L CB 2.233 44.343 42.059 0.085 0.000 1.354 1575 L HN 0.409 nan 8.230 nan 0.000 0.415 1576 M N 0.414 120.041 119.600 0.044 0.000 2.501 1576 M HA 0.668 5.148 4.480 -0.000 0.000 0.293 1576 M C -1.410 174.913 176.300 0.037 0.000 1.192 1576 M CA -0.870 54.450 55.300 0.033 0.000 0.886 1576 M CB 2.115 34.730 32.600 0.024 0.000 1.710 1576 M HN 0.124 nan 8.290 nan 0.000 0.457 1577 V N 2.629 122.562 119.914 0.031 0.000 2.649 1577 V HA 0.350 4.469 4.120 -0.000 0.000 0.292 1577 V C 0.454 176.562 176.094 0.024 0.000 1.055 1577 V CA -0.265 62.053 62.300 0.030 0.000 1.023 1577 V CB 1.199 33.039 31.823 0.028 0.000 0.992 1577 V HN 0.898 nan 8.190 nan 0.000 0.480 1578 V N 3.667 123.595 119.914 0.023 0.000 5.043 1578 V HA 0.487 4.607 4.120 -0.000 0.000 0.147 1578 V C -0.110 175.993 176.094 0.015 0.000 0.943 1578 V CA -0.347 61.964 62.300 0.017 0.000 1.408 1578 V CB 0.641 32.474 31.823 0.016 0.000 2.221 1578 V HN 0.838 nan 8.190 nan 0.000 0.440 1579 R N 1.274 121.782 120.500 0.013 0.000 2.522 1579 R HA 0.689 5.029 4.340 -0.000 0.000 0.273 1579 R C -2.824 173.481 176.300 0.008 0.000 1.133 1579 R CA -0.659 55.447 56.100 0.011 0.000 0.969 1579 R CB 2.026 32.331 30.300 0.008 0.000 1.235 1579 R HN 0.733 nan 8.270 nan 0.000 0.433 1580 P HA 0.000 nan 4.420 nan 0.000 0.216 1580 P CA 0.000 63.103 63.100 0.006 0.000 0.800 1580 P CB 0.000 31.701 31.700 0.002 0.000 0.726