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 1fw6_1_B DATA FIRST_RESID 1002 DATA SEQUENCE EGXLKGEGPG PLPPLLQQYV ELRDQYPDYL LLFQVGDFYE CFGEDAERLA DATA SEQUENCE RALGLVLTHK TSKDFTTPXA GIPLRAFEAY AERLLKXGFR LAVADQVEPX DATA SEQUENCE XXXXXXVRRE VTQLLTPGTL LQESLLPREA NYLAAIATGD GWGLAFLDVS DATA SEQUENCE TGEFKGTVLK SKSALYDELF RHRPAEVLLA PELLENGAFL DEFRKRFPVX DATA SEQUENCE LSEAPFEPEG EGPLALRRAR GALLAYAQRT QGGALSLQPF RFYDPGAFXR DATA SEQUENCE LPEATLRALE VFEPLRGQDT LFSVLDETRT APGRRLLQSW LRHPLLDRGP DATA SEQUENCE LEARLDRVEG FVREGALREG VRRLLYRLAD LERLATRLEL GRASPKDLGA DATA SEQUENCE LRRSLQILPE LRALLGEEVG LPDLSPLKEE LEAALVEDPP LKVSEGGLIR DATA SEQUENCE EGYDPDLDAL RAAHREGVAY FLELEERERE RTGIPTLKVG YNAVFGYYLE DATA SEQUENCE VTRPYYERVP KEYRPVQTLK DRQRYTLPEX KEKEREVYRL EALIRRREEE DATA SEQUENCE VFLEVRERAK RQAEALREAA RILAELDVYA ALAEVAVRYG YVRPRFGDRL DATA SEQUENCE QIRAGRHPVV ERRTEFVPND LEXAHELVLI TGPNXAGKST FLRQTALIAL DATA SEQUENCE LAQVGSFVPA EEAHLPLFDG IYTRIGAXXX XXXGKSTFXV EXEEVALILK DATA SEQUENCE EATENSLVLL DEVGRGTSSL DGVAIATAVA EALHERRAYT LFATHYFELT DATA SEQUENCE ALGLPRLKNL HVAAREEAGG LVFYHQVLPG PASKSYGVEV AAXAGLPKEV DATA SEQUENCE VARARALLQA 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 1002 E HA 0.000 nan 4.350 nan 0.000 0.291 1002 E C 0.000 176.580 176.600 -0.034 0.000 1.382 1002 E CA 0.000 56.384 56.400 -0.027 0.000 0.976 1002 E CB 0.000 29.682 29.700 -0.031 0.000 0.812 1006 K N 2.710 123.266 120.400 0.260 0.000 2.228 1006 K HA 0.649 4.969 4.320 -0.000 0.000 0.284 1006 K C -0.236 176.506 176.600 0.236 0.000 1.088 1006 K CA 0.784 57.202 56.287 0.218 0.000 0.941 1006 K CB -0.214 32.374 32.500 0.145 0.000 1.158 1006 K HN 0.870 nan 8.250 nan 0.000 0.438 1007 G N 2.896 111.840 108.800 0.240 0.000 2.619 1007 G HA2 0.380 4.340 3.960 -0.000 0.000 0.305 1007 G HA3 0.380 4.340 3.960 -0.000 0.000 0.305 1007 G C -1.593 173.113 174.900 -0.324 0.000 1.330 1007 G CA -0.668 44.319 45.100 -0.189 0.000 0.789 1007 G HN 0.411 nan 8.290 nan 0.000 0.487 1008 E N -1.005 118.823 120.200 -0.619 0.000 2.222 1008 E HA 0.626 4.976 4.350 -0.000 0.000 0.267 1008 E C -0.038 176.349 176.600 -0.355 0.000 0.884 1008 E CA 0.032 56.237 56.400 -0.325 0.000 0.764 1008 E CB 2.250 31.832 29.700 -0.196 0.000 1.169 1008 E HN 1.503 nan 8.360 nan 0.000 0.413 1009 G N 2.697 111.459 108.800 -0.064 0.000 2.465 1009 G HA2 -0.083 3.877 3.960 -0.000 0.000 0.681 1009 G HA3 -0.083 3.877 3.960 -0.000 0.000 0.681 1009 G C -2.556 172.477 174.900 0.222 0.000 1.340 1009 G CA -0.759 44.376 45.100 0.059 0.000 0.884 1009 G HN 0.406 nan 8.290 nan 0.000 0.650 1010 P HA 0.220 nan 4.420 nan 0.000 0.200 1010 P C 1.522 178.892 177.300 0.116 0.000 1.198 1010 P CA 1.209 64.381 63.100 0.120 0.000 0.892 1010 P CB -0.424 31.315 31.700 0.066 0.000 0.724 1011 G N 2.265 111.111 108.800 0.076 0.000 2.983 1011 G HA2 -0.111 3.849 3.960 -0.000 0.000 0.234 1011 G HA3 -0.111 3.849 3.960 -0.000 0.000 0.234 1011 G C -2.217 172.683 174.900 -0.001 0.000 0.734 1011 G CA -0.258 44.867 45.100 0.041 0.000 1.049 1011 G HN 0.287 nan 8.290 nan 0.000 0.348 1012 P HA 0.049 nan 4.420 nan 0.000 0.271 1012 P C 0.288 177.496 177.300 -0.154 0.000 1.233 1012 P CA -0.619 62.421 63.100 -0.099 0.000 0.795 1012 P CB 0.359 32.020 31.700 -0.065 0.000 0.936 1013 L N 3.092 124.187 121.223 -0.213 0.000 2.462 1013 L HA 0.222 4.562 4.340 -0.000 0.000 0.272 1013 L C -1.868 174.924 176.870 -0.130 0.000 1.166 1013 L CA -1.298 53.394 54.840 -0.246 0.000 0.880 1013 L CB -0.911 41.001 42.059 -0.245 0.000 1.142 1013 L HN 0.323 nan 8.230 nan 0.000 0.473 1014 P HA 0.039 nan 4.420 nan 0.000 0.271 1014 P C -1.846 175.420 177.300 -0.057 0.000 1.233 1014 P CA -0.734 62.332 63.100 -0.057 0.000 0.795 1014 P CB -0.100 31.573 31.700 -0.045 0.000 0.936 1015 P HA -0.211 nan 4.420 nan 0.000 0.214 1015 P C 1.453 178.754 177.300 0.001 0.000 1.163 1015 P CA 1.500 64.593 63.100 -0.013 0.000 0.889 1015 P CB -0.135 31.565 31.700 -0.001 0.000 0.790 1016 L N 0.048 121.273 121.223 0.002 0.000 1.943 1016 L HA -0.150 4.190 4.340 -0.000 0.000 0.215 1016 L C 2.738 179.590 176.870 -0.029 0.000 1.074 1016 L CA 1.828 56.694 54.840 0.043 0.000 0.759 1016 L CB -1.660 40.416 42.059 0.028 0.000 0.888 1016 L HN -0.178 nan 8.230 nan 0.000 0.433 1017 L N -0.607 120.511 121.223 -0.175 0.000 2.263 1017 L HA -0.231 4.109 4.340 -0.000 0.000 0.216 1017 L C 2.679 179.480 176.870 -0.115 0.000 1.111 1017 L CA 0.886 55.566 54.840 -0.266 0.000 0.773 1017 L CB -0.717 41.144 42.059 -0.330 0.000 0.906 1017 L HN 0.510 nan 8.230 nan 0.000 0.439 1018 Q N 0.005 119.753 119.800 -0.087 0.000 2.079 1018 Q HA -0.242 4.098 4.340 -0.000 0.000 0.200 1018 Q C 2.100 178.078 176.000 -0.036 0.000 0.974 1018 Q CA 1.625 57.388 55.803 -0.065 0.000 0.840 1018 Q CB -0.108 28.599 28.738 -0.052 0.000 0.898 1018 Q HN 0.569 nan 8.270 nan 0.000 0.430 1019 Q N -0.779 119.026 119.800 0.009 0.000 2.020 1019 Q HA -0.224 4.116 4.340 -0.000 0.000 0.202 1019 Q C 2.055 178.037 176.000 -0.031 0.000 0.982 1019 Q CA 1.743 57.587 55.803 0.068 0.000 0.838 1019 Q CB -0.361 28.516 28.738 0.233 0.000 0.899 1019 Q HN 0.397 nan 8.270 nan 0.000 0.423 1020 Y N 0.644 120.681 120.300 -0.438 0.000 2.030 1020 Y HA -0.315 4.235 4.550 -0.000 0.000 0.272 1020 Y C 1.973 177.683 175.900 -0.316 0.000 1.185 1020 Y CA 2.118 59.731 58.100 -0.812 0.000 1.120 1020 Y CB -0.612 37.290 38.460 -0.929 0.000 0.955 1020 Y HN 0.003 nan 8.280 nan 0.000 0.495 1021 V N 1.201 120.981 119.914 -0.223 0.000 2.594 1021 V HA -0.265 3.854 4.120 -0.000 0.000 0.253 1021 V C 2.130 178.107 176.094 -0.194 0.000 1.069 1021 V CA 2.144 64.299 62.300 -0.242 0.000 1.082 1021 V CB -0.666 31.113 31.823 -0.074 0.000 0.680 1021 V HN 0.499 nan 8.190 nan 0.000 0.469 1022 E N 0.093 120.213 120.200 -0.134 0.000 2.106 1022 E HA -0.136 4.214 4.350 -0.000 0.000 0.192 1022 E C 2.209 178.763 176.600 -0.076 0.000 0.984 1022 E CA 1.115 57.466 56.400 -0.081 0.000 0.806 1022 E CB -0.101 29.579 29.700 -0.034 0.000 0.750 1022 E HN 0.522 nan 8.360 nan 0.000 0.458 1023 L N 0.554 121.734 121.223 -0.071 0.000 2.084 1023 L HA -0.040 4.300 4.340 -0.000 0.000 0.202 1023 L C 2.722 179.577 176.870 -0.025 0.000 1.074 1023 L CA 0.407 55.257 54.840 0.016 0.000 0.757 1023 L CB -0.491 41.635 42.059 0.111 0.000 0.918 1023 L HN 0.047 nan 8.230 nan 0.000 0.444 1024 R N 0.970 121.339 120.500 -0.218 0.000 2.140 1024 R HA -0.248 4.092 4.340 -0.000 0.000 0.250 1024 R C 1.425 177.667 176.300 -0.095 0.000 1.150 1024 R CA 2.200 58.157 56.100 -0.239 0.000 0.966 1024 R CB -0.652 29.310 30.300 -0.564 0.000 0.869 1024 R HN 0.358 nan 8.270 nan 0.000 0.445 1025 D N 0.145 120.476 120.400 -0.115 0.000 2.317 1025 D HA -0.060 4.580 4.640 -0.000 0.000 0.211 1025 D C 1.852 178.083 176.300 -0.115 0.000 0.966 1025 D CA 0.595 54.542 54.000 -0.087 0.000 0.876 1025 D CB 0.061 40.809 40.800 -0.088 0.000 0.927 1025 D HN 0.453 nan 8.370 nan 0.000 0.519 1026 Q N -0.771 118.930 119.800 -0.165 0.000 2.212 1026 Q HA -0.051 4.289 4.340 -0.000 0.000 0.199 1026 Q C 0.210 175.848 176.000 -0.604 0.000 0.950 1026 Q CA 0.706 56.266 55.803 -0.406 0.000 0.863 1026 Q CB 0.269 28.694 28.738 -0.522 0.000 0.944 1026 Q HN 0.393 nan 8.270 nan 0.000 0.465 1027 Y N 0.487 120.733 120.300 -0.090 0.000 2.602 1027 Y HA 0.196 4.746 4.550 -0.000 0.000 0.373 1027 Y C -1.648 174.293 175.900 0.068 0.000 0.960 1027 Y CA -2.280 55.752 58.100 -0.113 0.000 1.281 1027 Y CB 0.308 38.587 38.460 -0.300 0.000 1.308 1027 Y HN 0.082 nan 8.280 nan 0.000 0.595 1028 P HA -0.289 nan 4.420 nan 0.000 0.219 1028 P C 0.665 178.092 177.300 0.212 0.000 1.161 1028 P CA 1.852 65.037 63.100 0.142 0.000 0.909 1028 P CB 0.529 32.275 31.700 0.077 0.000 0.793 1029 D N -1.960 118.627 120.400 0.312 0.000 2.378 1029 D HA -0.018 4.622 4.640 -0.000 0.000 0.227 1029 D C 0.318 176.671 176.300 0.088 0.000 1.012 1029 D CA 0.705 54.818 54.000 0.188 0.000 0.905 1029 D CB -0.278 40.603 40.800 0.134 0.000 0.895 1029 D HN 0.268 nan 8.370 nan 0.000 0.532 1030 Y N -0.306 120.048 120.300 0.091 0.000 2.528 1030 Y HA 0.385 4.935 4.550 -0.000 0.000 0.335 1030 Y C 0.076 176.038 175.900 0.103 0.000 1.093 1030 Y CA -1.515 56.641 58.100 0.093 0.000 1.134 1030 Y CB 0.958 39.473 38.460 0.091 0.000 1.253 1030 Y HN -0.289 nan 8.280 nan 0.000 0.478 1031 L N 4.119 125.508 121.223 0.276 0.000 2.268 1031 L HA 0.347 4.687 4.340 -0.000 0.000 0.289 1031 L C -0.829 176.166 176.870 0.209 0.000 1.064 1031 L CA -0.353 54.642 54.840 0.259 0.000 0.824 1031 L CB -0.100 42.179 42.059 0.367 0.000 1.202 1031 L HN 0.552 nan 8.230 nan 0.000 0.433 1032 L N 7.018 128.344 121.223 0.172 0.000 2.369 1032 L HA 0.265 4.605 4.340 -0.000 0.000 0.279 1032 L C -0.959 176.028 176.870 0.195 0.000 1.108 1032 L CA 0.005 54.927 54.840 0.136 0.000 0.852 1032 L CB 0.508 42.600 42.059 0.055 0.000 1.169 1032 L HN 0.650 nan 8.230 nan 0.000 0.452 1033 L N 6.681 127.979 121.223 0.126 0.000 2.264 1033 L HA 0.282 4.622 4.340 -0.000 0.000 0.287 1033 L C -0.459 176.574 176.870 0.271 0.000 1.039 1033 L CA -0.377 54.529 54.840 0.111 0.000 0.829 1033 L CB 1.048 43.005 42.059 -0.169 0.000 1.211 1033 L HN 0.475 nan 8.230 nan 0.000 0.427 1034 F N 3.365 123.474 119.950 0.265 0.000 2.404 1034 F HA 0.258 4.785 4.527 -0.000 0.000 0.345 1034 F C 0.547 176.556 175.800 0.349 0.000 1.110 1034 F CA -0.283 57.921 58.000 0.339 0.000 1.130 1034 F CB 1.266 40.564 39.000 0.497 0.000 1.129 1034 F HN 0.429 nan 8.300 nan 0.000 0.500 1035 Q N 4.446 124.218 119.800 -0.047 0.000 2.286 1035 Q HA 0.521 4.861 4.340 -0.000 0.000 0.257 1035 Q C -1.741 174.108 176.000 -0.251 0.000 0.941 1035 Q CA -0.340 55.356 55.803 -0.179 0.000 0.912 1035 Q CB 1.054 29.640 28.738 -0.252 0.000 1.192 1035 Q HN 0.580 nan 8.270 nan 0.000 0.410 1036 V N 5.442 125.303 119.914 -0.088 0.000 2.516 1036 V HA 0.420 4.540 4.120 -0.000 0.000 0.271 1036 V C 0.575 176.682 176.094 0.022 0.000 0.992 1036 V CA 0.338 62.637 62.300 -0.002 0.000 0.857 1036 V CB 0.498 32.404 31.823 0.139 0.000 1.047 1036 V HN 1.152 nan 8.190 nan 0.000 0.455 1037 G N 4.694 113.478 108.800 -0.026 0.000 2.557 1037 G HA2 -0.247 3.713 3.960 -0.000 0.000 0.292 1037 G HA3 -0.247 3.713 3.960 -0.000 0.000 0.292 1037 G C 0.221 175.108 174.900 -0.022 0.000 1.162 1037 G CA 0.584 45.688 45.100 0.008 0.000 0.964 1037 G HN 0.575 nan 8.290 nan 0.000 0.541 1038 D N 1.195 121.652 120.400 0.096 0.000 2.463 1038 D HA 0.502 5.142 4.640 -0.000 0.000 0.224 1038 D C -0.127 175.937 176.300 -0.393 0.000 1.174 1038 D CA 0.398 54.311 54.000 -0.146 0.000 0.829 1038 D CB 0.074 40.761 40.800 -0.188 0.000 0.993 1038 D HN 0.163 nan 8.370 nan 0.000 0.497 1039 F N -0.455 119.358 119.950 -0.229 0.000 2.629 1039 F HA 0.390 4.916 4.527 -0.000 0.000 0.316 1039 F C -0.472 175.152 175.800 -0.294 0.000 1.081 1039 F CA -1.216 56.659 58.000 -0.208 0.000 0.954 1039 F CB 1.258 40.202 39.000 -0.094 0.000 1.337 1039 F HN -0.246 nan 8.300 nan 0.000 0.474 1040 Y N 1.412 121.791 120.300 0.132 0.000 2.331 1040 Y HA 0.423 4.973 4.550 -0.000 0.000 0.338 1040 Y C -0.014 175.910 175.900 0.041 0.000 0.992 1040 Y CA -0.650 57.477 58.100 0.045 0.000 1.121 1040 Y CB 1.228 39.680 38.460 -0.013 0.000 1.184 1040 Y HN 0.379 nan 8.280 nan 0.000 0.469 1041 E N 2.582 122.901 120.200 0.198 0.000 2.221 1041 E HA 0.505 4.855 4.350 -0.000 0.000 0.268 1041 E C -1.234 175.215 176.600 -0.252 0.000 0.933 1041 E CA -0.627 55.697 56.400 -0.126 0.000 0.809 1041 E CB 2.395 31.949 29.700 -0.244 0.000 1.190 1041 E HN 0.524 nan 8.360 nan 0.000 0.406 1042 C N 1.788 120.730 119.300 -0.598 0.000 2.626 1042 C HA 0.665 5.125 4.460 -0.000 0.000 0.310 1042 C C -0.711 173.771 174.990 -0.848 0.000 1.191 1042 C CA -0.655 58.112 59.018 -0.419 0.000 1.517 1042 C CB 0.138 27.805 27.740 -0.120 0.000 2.102 1042 C HN 0.623 nan 8.230 nan 0.000 0.479 1043 F N 0.855 120.711 119.950 -0.158 0.000 2.631 1043 F HA 0.771 5.298 4.527 -0.000 0.000 0.328 1043 F C 1.043 176.866 175.800 0.037 0.000 1.067 1043 F CA 0.758 58.642 58.000 -0.194 0.000 0.969 1043 F CB 1.155 39.828 39.000 -0.545 0.000 1.332 1043 F HN 0.954 nan 8.300 nan 0.000 0.490 1044 G N 0.846 109.796 108.800 0.250 0.000 2.574 1044 G HA2 -0.371 3.589 3.960 -0.000 0.000 0.286 1044 G HA3 -0.371 3.589 3.960 -0.000 0.000 0.286 1044 G C 0.963 175.942 174.900 0.132 0.000 1.212 1044 G CA 0.763 45.986 45.100 0.204 0.000 0.979 1044 G HN 0.825 nan 8.290 nan 0.000 0.557 1045 E N -0.068 120.215 120.200 0.138 0.000 2.110 1045 E HA -0.117 4.233 4.350 -0.000 0.000 0.193 1045 E C 1.968 178.633 176.600 0.107 0.000 0.988 1045 E CA 1.325 57.788 56.400 0.105 0.000 0.804 1045 E CB -0.203 29.559 29.700 0.103 0.000 0.745 1045 E HN 0.534 nan 8.360 nan 0.000 0.458 1046 D N 0.023 120.509 120.400 0.143 0.000 2.144 1046 D HA -0.146 4.494 4.640 -0.000 0.000 0.199 1046 D C 1.801 178.154 176.300 0.088 0.000 0.984 1046 D CA 1.112 55.201 54.000 0.148 0.000 0.834 1046 D CB 0.015 40.939 40.800 0.208 0.000 0.955 1046 D HN 0.262 nan 8.370 nan 0.000 0.465 1047 A N 1.342 124.186 122.820 0.040 0.000 1.969 1047 A HA -0.179 4.141 4.320 -0.000 0.000 0.218 1047 A C 2.016 179.576 177.584 -0.040 0.000 1.169 1047 A CA 1.102 53.106 52.037 -0.055 0.000 0.635 1047 A CB -0.327 18.601 19.000 -0.119 0.000 0.810 1047 A HN 0.187 nan 8.150 nan 0.000 0.445 1048 E N -0.424 119.775 120.200 -0.002 0.000 2.150 1048 E HA -0.150 4.200 4.350 -0.000 0.000 0.193 1048 E C 2.281 178.895 176.600 0.022 0.000 0.985 1048 E CA 0.733 57.133 56.400 0.001 0.000 0.814 1048 E CB -0.157 29.555 29.700 0.020 0.000 0.752 1048 E HN 0.535 nan 8.360 nan 0.000 0.466 1049 R N 0.502 121.038 120.500 0.059 0.000 2.057 1049 R HA -0.091 4.249 4.340 -0.000 0.000 0.229 1049 R C 2.553 178.863 176.300 0.016 0.000 1.136 1049 R CA 0.692 56.852 56.100 0.100 0.000 0.952 1049 R CB -0.633 29.800 30.300 0.221 0.000 0.848 1049 R HN 0.103 nan 8.270 nan 0.000 0.430 1050 L N 1.199 122.408 121.223 -0.024 0.000 2.051 1050 L HA -0.221 4.119 4.340 -0.000 0.000 0.214 1050 L C 2.324 179.122 176.870 -0.119 0.000 1.076 1050 L CA 2.145 56.912 54.840 -0.122 0.000 0.758 1050 L CB -0.576 41.419 42.059 -0.106 0.000 0.890 1050 L HN 0.188 nan 8.230 nan 0.000 0.433 1051 A N -0.873 121.898 122.820 -0.082 0.000 1.902 1051 A HA -0.224 4.096 4.320 -0.000 0.000 0.217 1051 A C 2.489 180.045 177.584 -0.047 0.000 1.181 1051 A CA 1.749 53.742 52.037 -0.073 0.000 0.623 1051 A CB -0.579 18.383 19.000 -0.063 0.000 0.818 1051 A HN 0.505 nan 8.150 nan 0.000 0.443 1052 R N -0.546 119.940 120.500 -0.025 0.000 2.082 1052 R HA -0.083 4.257 4.340 -0.000 0.000 0.228 1052 R C 2.422 178.716 176.300 -0.010 0.000 1.140 1052 R CA 1.457 57.557 56.100 -0.001 0.000 0.920 1052 R CB -0.517 29.802 30.300 0.032 0.000 0.828 1052 R HN 0.415 nan 8.270 nan 0.000 0.430 1053 A N 0.568 123.370 122.820 -0.029 0.000 1.997 1053 A HA -0.151 4.169 4.320 -0.000 0.000 0.221 1053 A C 1.901 179.447 177.584 -0.064 0.000 1.172 1053 A CA 1.533 53.533 52.037 -0.062 0.000 0.645 1053 A CB -0.351 18.516 19.000 -0.222 0.000 0.813 1053 A HN 0.407 nan 8.150 nan 0.000 0.454 1054 L N -2.028 119.152 121.223 -0.071 0.000 2.766 1054 L HA 0.324 4.664 4.340 -0.000 0.000 0.242 1054 L C 1.218 178.088 176.870 -0.002 0.000 1.136 1054 L CA 0.226 55.052 54.840 -0.023 0.000 0.933 1054 L CB -0.062 41.952 42.059 -0.075 0.000 1.241 1054 L HN 0.475 nan 8.230 nan 0.000 0.522 1055 G N 1.994 110.784 108.800 -0.016 0.000 2.370 1055 G HA2 -0.236 3.724 3.960 -0.000 0.000 0.295 1055 G HA3 -0.236 3.724 3.960 -0.000 0.000 0.295 1055 G C -0.133 174.759 174.900 -0.014 0.000 1.045 1055 G CA 0.094 45.191 45.100 -0.005 0.000 1.199 1055 G HN 0.189 nan 8.290 nan 0.000 0.513 1056 L N -0.957 120.241 121.223 -0.041 0.000 2.544 1056 L HA 0.576 4.916 4.340 -0.000 0.000 0.256 1056 L C 1.082 177.928 176.870 -0.040 0.000 1.097 1056 L CA -1.307 53.502 54.840 -0.052 0.000 0.812 1056 L CB 1.227 43.226 42.059 -0.100 0.000 1.440 1056 L HN -0.016 nan 8.230 nan 0.000 0.496 1057 V N 2.399 122.288 119.914 -0.042 0.000 2.338 1057 V HA 0.157 4.277 4.120 -0.000 0.000 0.255 1057 V C 0.387 176.449 176.094 -0.053 0.000 1.082 1057 V CA -0.248 62.031 62.300 -0.034 0.000 0.951 1057 V CB 0.132 31.940 31.823 -0.026 0.000 1.102 1057 V HN 0.382 nan 8.190 nan 0.000 0.489 1058 L N 5.824 127.016 121.223 -0.052 0.000 2.455 1058 L HA 0.337 4.677 4.340 -0.000 0.000 0.272 1058 L C 0.892 177.719 176.870 -0.072 0.000 1.174 1058 L CA 0.668 55.458 54.840 -0.083 0.000 0.869 1058 L CB 0.917 42.930 42.059 -0.075 0.000 1.130 1058 L HN 0.918 nan 8.230 nan 0.000 0.474 1059 T N -0.718 113.760 114.554 -0.127 0.000 2.618 1059 T HA 0.562 4.912 4.350 -0.000 0.000 0.286 1059 T C -0.899 173.676 174.700 -0.208 0.000 1.027 1059 T CA -0.981 61.095 62.100 -0.041 0.000 1.063 1059 T CB 1.632 70.494 68.868 -0.009 0.000 1.440 1059 T HN 0.456 nan 8.240 nan 0.000 0.505 1060 H N -0.727 118.339 119.070 -0.006 0.000 2.865 1060 H HA 0.799 5.355 4.556 -0.000 0.000 0.372 1060 H C -0.985 174.363 175.328 0.034 0.000 1.173 1060 H CA -0.795 55.260 56.048 0.012 0.000 1.147 1060 H CB 1.767 31.517 29.762 -0.021 0.000 1.805 1060 H HN 0.690 nan 8.280 nan 0.000 0.553 1061 K N 0.937 121.442 120.400 0.175 0.000 2.339 1061 K HA 0.458 4.778 4.320 -0.000 0.000 0.264 1061 K C -1.226 175.419 176.600 0.074 0.000 0.986 1061 K CA -0.325 56.031 56.287 0.116 0.000 0.866 1061 K CB 0.843 33.404 32.500 0.102 0.000 1.103 1061 K HN 0.653 nan 8.250 nan 0.000 0.441 1062 T N 2.342 116.923 114.554 0.044 0.000 2.856 1062 T HA 0.624 4.974 4.350 -0.000 0.000 0.283 1062 T C -1.035 173.676 174.700 0.018 0.000 1.008 1062 T CA -0.770 61.343 62.100 0.022 0.000 0.997 1062 T CB 1.315 70.183 68.868 0.000 0.000 0.992 1062 T HN 0.696 nan 8.240 nan 0.000 0.454 1063 S N 1.332 117.050 115.700 0.031 0.000 2.618 1063 S HA 0.507 4.977 4.470 -0.000 0.000 0.277 1063 S C 0.975 175.595 174.600 0.034 0.000 1.138 1063 S CA -1.025 57.194 58.200 0.031 0.000 0.844 1063 S CB 2.106 65.333 63.200 0.045 0.000 1.127 1063 S HN 0.702 nan 8.310 nan 0.000 0.474 1064 K N 0.570 120.985 120.400 0.024 0.000 2.015 1064 K HA -0.223 4.097 4.320 -0.000 0.000 0.220 1064 K C 0.595 177.216 176.600 0.036 0.000 1.055 1064 K CA 2.477 58.776 56.287 0.021 0.000 0.951 1064 K CB -0.433 32.076 32.500 0.015 0.000 0.725 1064 K HN 0.709 nan 8.250 nan 0.000 0.449 1065 D N -1.276 119.163 120.400 0.064 0.000 2.328 1065 D HA 0.079 4.719 4.640 -0.000 0.000 0.221 1065 D C -0.702 175.721 176.300 0.205 0.000 1.072 1065 D CA 0.375 54.433 54.000 0.097 0.000 0.850 1065 D CB 0.279 41.127 40.800 0.080 0.000 0.922 1065 D HN 0.070 nan 8.370 nan 0.000 0.516 1066 F N -0.178 119.762 119.950 -0.017 0.000 2.654 1066 F HA 0.213 4.740 4.527 -0.000 0.000 0.314 1066 F C -1.296 174.499 175.800 -0.009 0.000 1.116 1066 F CA -0.617 57.376 58.000 -0.013 0.000 1.017 1066 F CB 2.077 41.065 39.000 -0.020 0.000 1.285 1066 F HN -0.411 nan 8.300 nan 0.000 0.448 1067 T N 3.847 118.057 114.554 -0.573 0.000 2.879 1067 T HA 0.599 4.949 4.350 -0.000 0.000 0.290 1067 T C -1.388 173.043 174.700 -0.449 0.000 0.993 1067 T CA -0.238 61.684 62.100 -0.298 0.000 0.975 1067 T CB 1.310 70.073 68.868 -0.174 0.000 0.981 1067 T HN 0.822 nan 8.240 nan 0.000 0.439 1068 T N 5.737 120.249 114.554 -0.069 0.000 2.900 1068 T HA 0.724 5.074 4.350 -0.000 0.000 0.295 1068 T C -2.680 172.069 174.700 0.082 0.000 1.044 1068 T CA -1.829 60.299 62.100 0.047 0.000 0.995 1068 T CB 1.738 70.793 68.868 0.311 0.000 1.072 1068 T HN 0.441 nan 8.240 nan 0.000 0.473 1072 G N -0.398 108.321 108.800 -0.134 0.000 2.645 1072 G HA2 0.822 4.782 3.960 -0.000 0.000 0.292 1072 G HA3 0.822 4.782 3.960 -0.000 0.000 0.292 1072 G C -1.060 173.842 174.900 0.003 0.000 1.415 1072 G CA 0.074 45.141 45.100 -0.055 0.000 0.785 1072 G HN 1.925 nan 8.290 nan 0.000 0.483 1073 I N -2.330 118.291 120.570 0.084 0.000 2.647 1073 I HA 0.639 4.809 4.170 -0.000 0.000 0.295 1073 I C -2.964 173.237 176.117 0.140 0.000 1.078 1073 I CA -3.016 58.303 61.300 0.032 0.000 1.048 1073 I CB 2.701 40.599 38.000 -0.170 0.000 1.239 1073 I HN 0.116 nan 8.210 nan 0.000 0.421 1074 P HA 0.004 nan 4.420 nan 0.000 0.263 1074 P C 0.969 178.158 177.300 -0.184 0.000 1.195 1074 P CA -0.212 62.642 63.100 -0.411 0.000 0.762 1074 P CB 0.513 32.028 31.700 -0.309 0.000 0.799 1075 L N 4.576 125.575 121.223 -0.374 0.000 2.103 1075 L HA -0.249 4.091 4.340 -0.000 0.000 0.215 1075 L C 2.281 179.132 176.870 -0.032 0.000 1.080 1075 L CA 2.294 56.936 54.840 -0.330 0.000 0.764 1075 L CB -0.624 41.154 42.059 -0.468 0.000 0.890 1075 L HN 0.506 nan 8.230 nan 0.000 0.435 1076 R N 0.128 120.582 120.500 -0.076 0.000 2.092 1076 R HA -0.093 4.247 4.340 -0.000 0.000 0.226 1076 R C 2.115 178.481 176.300 0.110 0.000 1.140 1076 R CA 1.389 57.492 56.100 0.005 0.000 0.910 1076 R CB -1.222 29.044 30.300 -0.056 0.000 0.822 1076 R HN 0.170 nan 8.270 nan 0.000 0.433 1077 A N 0.993 123.874 122.820 0.102 0.000 2.255 1077 A HA -0.208 4.112 4.320 -0.000 0.000 0.218 1077 A C 1.757 179.485 177.584 0.241 0.000 1.175 1077 A CA 1.316 53.437 52.037 0.140 0.000 0.682 1077 A CB -1.027 18.108 19.000 0.225 0.000 0.784 1077 A HN 0.575 nan 8.150 nan 0.000 0.482 1078 F N 1.108 121.162 119.950 0.175 0.000 2.088 1078 F HA -0.329 4.198 4.527 -0.000 0.000 0.296 1078 F C 1.891 177.755 175.800 0.108 0.000 1.161 1078 F CA 2.556 60.677 58.000 0.202 0.000 1.236 1078 F CB -1.035 38.111 39.000 0.244 0.000 0.936 1078 F HN 0.428 nan 8.300 nan 0.000 0.528 1079 E N -0.293 119.631 120.200 -0.461 0.000 2.393 1079 E HA -0.190 4.160 4.350 -0.000 0.000 0.201 1079 E C 2.038 178.437 176.600 -0.336 0.000 1.025 1079 E CA 0.730 56.778 56.400 -0.586 0.000 0.856 1079 E CB -0.387 29.125 29.700 -0.313 0.000 0.771 1079 E HN 0.548 nan 8.360 nan 0.000 0.526 1080 A N -0.451 122.228 122.820 -0.236 0.000 1.984 1080 A HA -0.054 4.266 4.320 -0.000 0.000 0.214 1080 A C 1.446 178.852 177.584 -0.298 0.000 1.173 1080 A CA 0.520 52.397 52.037 -0.267 0.000 0.673 1080 A CB -0.159 18.654 19.000 -0.312 0.000 0.830 1080 A HN 0.215 nan 8.150 nan 0.000 0.453 1081 Y N -0.175 120.064 120.300 -0.101 0.000 2.420 1081 Y HA 0.156 4.706 4.550 -0.000 0.000 0.292 1081 Y C 2.778 178.611 175.900 -0.112 0.000 1.119 1081 Y CA 0.247 58.303 58.100 -0.072 0.000 1.229 1081 Y CB -0.415 38.042 38.460 -0.005 0.000 1.026 1081 Y HN 0.315 nan 8.280 nan 0.000 0.554 1082 A N 0.116 122.893 122.820 -0.071 0.000 1.883 1082 A HA -0.268 4.052 4.320 -0.000 0.000 0.217 1082 A C 2.182 179.708 177.584 -0.098 0.000 1.186 1082 A CA 2.030 53.975 52.037 -0.153 0.000 0.624 1082 A CB -0.714 17.985 19.000 -0.501 0.000 0.822 1082 A HN 0.495 nan 8.150 nan 0.000 0.444 1083 E N -0.520 119.601 120.200 -0.131 0.000 2.058 1083 E HA -0.226 4.124 4.350 -0.000 0.000 0.194 1083 E C 2.351 178.925 176.600 -0.043 0.000 0.997 1083 E CA 1.232 57.579 56.400 -0.089 0.000 0.801 1083 E CB -0.091 29.543 29.700 -0.110 0.000 0.746 1083 E HN 0.594 nan 8.360 nan 0.000 0.450 1084 R N 0.045 120.521 120.500 -0.040 0.000 2.073 1084 R HA -0.109 4.231 4.340 -0.000 0.000 0.234 1084 R C 2.613 178.915 176.300 0.004 0.000 1.134 1084 R CA 1.232 57.326 56.100 -0.010 0.000 0.952 1084 R CB -0.312 29.993 30.300 0.009 0.000 0.850 1084 R HN 0.251 nan 8.270 nan 0.000 0.433 1085 L N 0.574 121.790 121.223 -0.012 0.000 2.083 1085 L HA -0.198 4.142 4.340 -0.000 0.000 0.209 1085 L C 2.377 179.315 176.870 0.112 0.000 1.083 1085 L CA 1.117 55.924 54.840 -0.056 0.000 0.752 1085 L CB -0.350 41.648 42.059 -0.102 0.000 0.899 1085 L HN 0.244 nan 8.230 nan 0.000 0.433 1086 L N -0.565 120.707 121.223 0.081 0.000 2.044 1086 L HA -0.128 4.212 4.340 -0.000 0.000 0.205 1086 L C 1.538 178.466 176.870 0.097 0.000 1.075 1086 L CA 0.916 55.814 54.840 0.097 0.000 0.747 1086 L CB -0.211 41.872 42.059 0.040 0.000 0.903 1086 L HN 0.175 nan 8.230 nan 0.000 0.435 1090 F N 1.974 121.923 119.950 -0.003 0.000 2.404 1090 F HA 0.612 5.139 4.527 -0.000 0.000 0.345 1090 F C 0.998 176.782 175.800 -0.027 0.000 1.110 1090 F CA -0.540 57.454 58.000 -0.009 0.000 1.130 1090 F CB 1.209 40.218 39.000 0.016 0.000 1.129 1090 F HN -0.210 nan 8.300 nan 0.000 0.500 1091 R N 4.218 124.723 120.500 0.008 0.000 2.312 1091 R HA 0.607 4.947 4.340 -0.000 0.000 0.311 1091 R C -1.148 175.226 176.300 0.124 0.000 1.004 1091 R CA -0.726 55.335 56.100 -0.065 0.000 0.902 1091 R CB 1.167 31.150 30.300 -0.529 0.000 1.073 1091 R HN 0.580 nan 8.270 nan 0.000 0.457 1092 L N 2.014 123.366 121.223 0.214 0.000 2.329 1092 L HA 0.613 4.953 4.340 -0.000 0.000 0.279 1092 L C -0.148 176.846 176.870 0.206 0.000 1.014 1092 L CA -0.896 54.081 54.840 0.229 0.000 0.814 1092 L CB 1.970 44.135 42.059 0.176 0.000 1.257 1092 L HN 0.624 nan 8.230 nan 0.000 0.424 1093 A N 3.437 126.323 122.820 0.111 0.000 2.273 1093 A HA 0.693 5.013 4.320 -0.000 0.000 0.315 1093 A C -0.616 176.900 177.584 -0.114 0.000 1.256 1093 A CA -0.472 51.502 52.037 -0.106 0.000 0.851 1093 A CB 1.126 20.013 19.000 -0.189 0.000 1.172 1093 A HN 0.409 nan 8.150 nan 0.000 0.508 1094 V N 2.150 121.960 119.914 -0.173 0.000 2.407 1094 V HA 0.625 4.745 4.120 -0.000 0.000 0.278 1094 V C 0.532 176.547 176.094 -0.131 0.000 1.037 1094 V CA -0.077 62.086 62.300 -0.228 0.000 0.900 1094 V CB 1.351 32.985 31.823 -0.315 0.000 0.983 1094 V HN 1.077 nan 8.190 nan 0.000 0.459 1095 A N 4.267 127.070 122.820 -0.028 0.000 2.291 1095 A HA 0.673 4.993 4.320 -0.000 0.000 0.311 1095 A C -0.604 177.006 177.584 0.043 0.000 1.224 1095 A CA -0.638 51.438 52.037 0.065 0.000 0.821 1095 A CB 0.434 19.599 19.000 0.275 0.000 1.172 1095 A HN 0.756 nan 8.150 nan 0.000 0.494 1096 D N 1.829 122.227 120.400 -0.003 0.000 2.198 1096 D HA 0.268 4.907 4.640 -0.000 0.000 0.247 1096 D C -0.372 175.874 176.300 -0.091 0.000 1.010 1096 D CA -0.139 53.843 54.000 -0.029 0.000 0.880 1096 D CB 1.510 42.300 40.800 -0.015 0.000 1.209 1096 D HN 0.591 nan 8.370 nan 0.000 0.451 1097 Q N 0.876 120.596 119.800 -0.133 0.000 2.348 1097 Q HA 0.198 4.538 4.340 -0.000 0.000 0.251 1097 Q C -0.164 175.791 176.000 -0.076 0.000 1.113 1097 Q CA -0.356 55.371 55.803 -0.126 0.000 0.902 1097 Q CB 0.794 29.447 28.738 -0.143 0.000 1.333 1097 Q HN 0.203 nan 8.270 nan 0.000 0.457 1098 V N 4.149 124.033 119.914 -0.051 0.000 2.611 1098 V HA -0.165 3.955 4.120 -0.000 0.000 0.296 1098 V C 0.644 176.716 176.094 -0.036 0.000 1.006 1098 V CA 0.632 62.913 62.300 -0.032 0.000 1.194 1098 V CB -0.711 31.102 31.823 -0.017 0.000 0.871 1098 V HN 0.756 nan 8.190 nan 0.000 0.470 1099 E N 7.113 127.291 120.200 -0.036 0.000 3.434 1099 E HA -0.105 4.245 4.350 -0.000 0.000 0.248 1099 E C -1.218 175.364 176.600 -0.031 0.000 0.895 1099 E CA -0.576 55.802 56.400 -0.037 0.000 0.953 1099 E CB -0.274 29.407 29.700 -0.032 0.000 0.893 1099 E HN 0.641 nan 8.360 nan 0.000 0.570 1109 R N 2.317 122.819 120.500 0.002 0.000 2.868 1109 R HA 0.617 4.957 4.340 -0.000 0.000 0.262 1109 R C -1.534 174.763 176.300 -0.005 0.000 1.163 1109 R CA -0.544 55.565 56.100 0.015 0.000 1.105 1109 R CB 1.492 31.797 30.300 0.007 0.000 1.270 1109 R HN 0.536 nan 8.270 nan 0.000 0.437 1110 R N 2.697 123.216 120.500 0.032 0.000 2.725 1110 R HA 0.442 4.782 4.340 -0.000 0.000 0.277 1110 R C -1.115 175.235 176.300 0.085 0.000 0.987 1110 R CA -1.059 55.046 56.100 0.008 0.000 0.901 1110 R CB 2.636 32.869 30.300 -0.111 0.000 1.207 1110 R HN 0.775 nan 8.270 nan 0.000 0.463 1111 E N 0.039 120.274 120.200 0.057 0.000 2.433 1111 E HA 0.292 4.641 4.350 -0.000 0.000 0.278 1111 E C -1.131 175.499 176.600 0.049 0.000 0.976 1111 E CA -1.069 55.375 56.400 0.074 0.000 0.793 1111 E CB 1.557 31.284 29.700 0.046 0.000 1.311 1111 E HN 0.120 nan 8.360 nan 0.000 0.460 1112 V N 2.862 122.803 119.914 0.044 0.000 2.381 1112 V HA -0.003 4.117 4.120 -0.000 0.000 0.257 1112 V C 1.369 177.413 176.094 -0.082 0.000 1.057 1112 V CA 0.802 63.067 62.300 -0.058 0.000 1.013 1112 V CB -0.373 31.343 31.823 -0.177 0.000 1.069 1112 V HN 0.950 nan 8.190 nan 0.000 0.484 1113 T N 2.701 117.209 114.554 -0.077 0.000 2.623 1113 T HA -0.035 4.315 4.350 -0.000 0.000 0.254 1113 T C 0.737 175.387 174.700 -0.084 0.000 1.075 1113 T CA 0.686 62.749 62.100 -0.062 0.000 1.177 1113 T CB 0.003 68.844 68.868 -0.044 0.000 0.869 1113 T HN 0.590 nan 8.240 nan 0.000 0.403 1114 Q N 0.045 119.787 119.800 -0.095 0.000 2.286 1114 Q HA 0.724 5.064 4.340 -0.000 0.000 0.250 1114 Q C -1.043 174.871 176.000 -0.143 0.000 1.021 1114 Q CA -0.876 54.877 55.803 -0.083 0.000 0.930 1114 Q CB 1.732 30.463 28.738 -0.011 0.000 1.266 1114 Q HN 0.289 nan 8.270 nan 0.000 0.491 1115 L N 2.369 123.536 121.223 -0.094 0.000 2.563 1115 L HA 0.291 4.631 4.340 -0.000 0.000 0.259 1115 L C -1.569 175.328 176.870 0.044 0.000 1.034 1115 L CA -0.541 54.252 54.840 -0.079 0.000 0.899 1115 L CB 1.204 43.156 42.059 -0.178 0.000 1.159 1115 L HN 0.428 nan 8.230 nan 0.000 0.456 1116 L N 2.733 124.013 121.223 0.095 0.000 2.361 1116 L HA 0.391 4.730 4.340 -0.000 0.000 0.278 1116 L C 0.513 177.458 176.870 0.124 0.000 1.113 1116 L CA 0.948 55.848 54.840 0.100 0.000 0.849 1116 L CB 1.178 43.297 42.059 0.099 0.000 1.155 1116 L HN 0.401 nan 8.230 nan 0.000 0.452 1117 T N 4.781 119.399 114.554 0.106 0.000 2.952 1117 T HA 0.317 4.666 4.350 -0.000 0.000 0.305 1117 T C -1.930 172.830 174.700 0.100 0.000 1.064 1117 T CA -1.001 61.173 62.100 0.124 0.000 1.008 1117 T CB 2.171 71.156 68.868 0.195 0.000 1.078 1117 T HN 0.241 nan 8.240 nan 0.000 0.459 1118 P HA -0.122 nan 4.420 nan 0.000 0.219 1118 P C 1.124 178.468 177.300 0.073 0.000 1.158 1118 P CA 1.221 64.361 63.100 0.067 0.000 0.895 1118 P CB 0.162 31.901 31.700 0.065 0.000 0.792 1119 G N -2.656 106.211 108.800 0.112 0.000 3.523 1119 G HA2 0.153 4.113 3.960 -0.000 0.000 0.270 1119 G HA3 0.153 4.113 3.960 -0.000 0.000 0.270 1119 G C 0.486 175.465 174.900 0.131 0.000 1.134 1119 G CA 0.509 45.681 45.100 0.120 0.000 0.825 1119 G HN 0.367 nan 8.290 nan 0.000 0.534 1120 T N -2.262 112.359 114.554 0.112 0.000 3.192 1120 T HA 0.334 4.684 4.350 -0.000 0.000 0.295 1120 T C 0.625 175.349 174.700 0.041 0.000 0.947 1120 T CA -0.454 61.699 62.100 0.087 0.000 0.916 1120 T CB -0.233 68.698 68.868 0.105 0.000 1.169 1120 T HN 0.017 nan 8.240 nan 0.000 0.540 1121 L N 1.902 123.143 121.223 0.030 0.000 2.525 1121 L HA 0.149 4.489 4.340 -0.000 0.000 0.278 1121 L C 1.052 177.917 176.870 -0.007 0.000 1.218 1121 L CA -0.371 54.473 54.840 0.007 0.000 0.878 1121 L CB 0.562 42.617 42.059 -0.007 0.000 1.127 1121 L HN 0.159 nan 8.230 nan 0.000 0.492 1122 L N 2.051 123.270 121.223 -0.007 0.000 2.717 1122 L HA 0.102 4.442 4.340 -0.000 0.000 0.239 1122 L C 0.688 177.550 176.870 -0.014 0.000 1.086 1122 L CA 0.746 55.579 54.840 -0.011 0.000 0.897 1122 L CB -0.018 42.039 42.059 -0.004 0.000 1.214 1122 L HN 0.607 nan 8.230 nan 0.000 0.508 1123 Q N 0.503 120.296 119.800 -0.013 0.000 2.296 1123 Q HA 0.035 4.375 4.340 -0.000 0.000 0.263 1123 Q C 0.482 176.460 176.000 -0.037 0.000 1.026 1123 Q CA -0.011 55.781 55.803 -0.018 0.000 0.912 1123 Q CB 0.683 29.410 28.738 -0.018 0.000 1.198 1123 Q HN 0.300 nan 8.270 nan 0.000 0.407 1124 E N 2.179 122.358 120.200 -0.036 0.000 2.086 1124 E HA -0.221 4.129 4.350 -0.000 0.000 0.200 1124 E C 1.670 178.237 176.600 -0.056 0.000 1.012 1124 E CA 2.080 58.452 56.400 -0.046 0.000 0.812 1124 E CB 0.015 29.690 29.700 -0.043 0.000 0.743 1124 E HN 0.836 nan 8.360 nan 0.000 0.453 1125 S N 0.277 115.942 115.700 -0.059 0.000 2.500 1125 S HA -0.078 4.392 4.470 -0.000 0.000 0.239 1125 S C 1.832 176.383 174.600 -0.082 0.000 0.989 1125 S CA 0.652 58.809 58.200 -0.071 0.000 0.951 1125 S CB -0.206 62.948 63.200 -0.076 0.000 0.759 1125 S HN 0.195 nan 8.310 nan 0.000 0.523 1126 L N 0.034 121.209 121.223 -0.080 0.000 2.693 1126 L HA 0.479 4.818 4.340 -0.000 0.000 0.235 1126 L C 0.115 176.946 176.870 -0.065 0.000 1.127 1126 L CA -0.057 54.734 54.840 -0.082 0.000 0.914 1126 L CB 0.152 42.157 42.059 -0.090 0.000 1.193 1126 L HN 0.253 nan 8.230 nan 0.000 0.502 1127 L N 0.521 121.706 121.223 -0.064 0.000 2.322 1127 L HA 0.525 4.865 4.340 -0.000 0.000 0.269 1127 L C -2.103 174.727 176.870 -0.068 0.000 1.012 1127 L CA -1.686 53.115 54.840 -0.065 0.000 0.815 1127 L CB 1.839 43.857 42.059 -0.068 0.000 1.295 1127 L HN -0.160 nan 8.230 nan 0.000 0.438 1128 P HA 0.363 nan 4.420 nan 0.000 0.283 1128 P C -0.179 177.076 177.300 -0.075 0.000 1.278 1128 P CA -0.676 62.384 63.100 -0.067 0.000 0.834 1128 P CB 1.479 33.138 31.700 -0.068 0.000 1.150 1129 R N -0.435 120.027 120.500 -0.063 0.000 2.096 1129 R HA -0.081 4.259 4.340 -0.000 0.000 0.235 1129 R C 0.649 176.901 176.300 -0.081 0.000 1.127 1129 R CA 1.309 57.369 56.100 -0.067 0.000 0.968 1129 R CB -0.431 29.839 30.300 -0.051 0.000 0.861 1129 R HN 0.621 nan 8.270 nan 0.000 0.440 1130 E N 0.077 120.230 120.200 -0.079 0.000 2.428 1130 E HA 0.177 4.527 4.350 -0.000 0.000 0.257 1130 E C -0.265 176.217 176.600 -0.196 0.000 1.197 1130 E CA 0.187 56.514 56.400 -0.123 0.000 0.974 1130 E CB 0.290 29.914 29.700 -0.127 0.000 0.976 1130 E HN 0.279 nan 8.360 nan 0.000 0.463 1131 A N 1.257 123.905 122.820 -0.286 0.000 2.386 1131 A HA 0.267 4.586 4.320 -0.000 0.000 0.248 1131 A C -0.134 177.149 177.584 -0.502 0.000 1.082 1131 A CA -0.171 51.591 52.037 -0.460 0.000 0.789 1131 A CB 0.061 18.639 19.000 -0.704 0.000 1.025 1131 A HN 0.566 nan 8.150 nan 0.000 0.490 1132 N N 0.047 118.440 118.700 -0.513 0.000 2.531 1132 N HA 0.494 5.234 4.740 -0.000 0.000 0.268 1132 N C -1.699 173.639 175.510 -0.286 0.000 1.023 1132 N CA -0.222 52.644 53.050 -0.306 0.000 0.896 1132 N CB 0.470 38.864 38.487 -0.155 0.000 1.233 1132 N HN 0.535 nan 8.380 nan 0.000 0.512 1133 Y N 1.675 121.991 120.300 0.026 0.000 2.419 1133 Y HA 0.515 5.065 4.550 -0.000 0.000 0.328 1133 Y C -0.253 175.730 175.900 0.139 0.000 1.162 1133 Y CA -1.178 56.984 58.100 0.103 0.000 1.174 1133 Y CB 1.421 39.965 38.460 0.141 0.000 1.228 1133 Y HN 0.333 nan 8.280 nan 0.000 0.473 1134 L N 2.523 123.966 121.223 0.366 0.000 2.325 1134 L HA 0.854 5.194 4.340 -0.000 0.000 0.281 1134 L C -0.791 176.220 176.870 0.235 0.000 1.004 1134 L CA -0.471 54.514 54.840 0.241 0.000 0.823 1134 L CB 0.782 42.967 42.059 0.210 0.000 1.236 1134 L HN 0.669 nan 8.230 nan 0.000 0.415 1135 A N 4.209 127.115 122.820 0.143 0.000 2.337 1135 A HA 0.992 5.312 4.320 -0.000 0.000 0.331 1135 A C -0.839 176.702 177.584 -0.070 0.000 1.137 1135 A CA -0.086 51.940 52.037 -0.017 0.000 0.807 1135 A CB 1.452 20.431 19.000 -0.034 0.000 1.250 1135 A HN 1.186 nan 8.150 nan 0.000 0.468 1136 A N 1.331 124.073 122.820 -0.130 0.000 2.422 1136 A HA 0.746 5.066 4.320 -0.000 0.000 0.302 1136 A C -0.969 176.610 177.584 -0.007 0.000 1.041 1136 A CA -0.346 51.672 52.037 -0.033 0.000 0.708 1136 A CB 0.812 19.759 19.000 -0.088 0.000 1.257 1136 A HN 0.748 nan 8.150 nan 0.000 0.414 1137 I N 1.465 122.093 120.570 0.096 0.000 2.465 1137 I HA 0.701 4.871 4.170 -0.000 0.000 0.291 1137 I C 0.345 176.520 176.117 0.095 0.000 1.014 1137 I CA -0.467 60.875 61.300 0.070 0.000 1.093 1137 I CB 2.055 40.071 38.000 0.027 0.000 1.267 1137 I HN 0.801 nan 8.210 nan 0.000 0.431 1138 A N 3.606 126.471 122.820 0.074 0.000 2.483 1138 A HA 0.972 5.292 4.320 -0.000 0.000 0.286 1138 A C -0.469 177.042 177.584 -0.121 0.000 1.207 1138 A CA -0.547 51.460 52.037 -0.049 0.000 0.764 1138 A CB 1.971 21.027 19.000 0.093 0.000 1.341 1138 A HN 0.681 nan 8.150 nan 0.000 0.428 1139 T N -2.879 111.548 114.554 -0.211 0.000 2.916 1139 T HA 0.884 5.234 4.350 -0.000 0.000 0.292 1139 T C 0.135 174.692 174.700 -0.239 0.000 1.055 1139 T CA 0.143 62.054 62.100 -0.315 0.000 1.009 1139 T CB 1.684 70.310 68.868 -0.404 0.000 1.118 1139 T HN 2.359 nan 8.240 nan 0.000 0.497 1140 G N 0.486 109.121 108.800 -0.276 0.000 2.552 1140 G HA2 0.235 4.195 3.960 -0.000 0.000 0.137 1140 G HA3 0.235 4.195 3.960 -0.000 0.000 0.137 1140 G C -1.594 173.178 174.900 -0.213 0.000 1.135 1140 G CA -0.424 44.561 45.100 -0.192 0.000 1.047 1140 G HN 0.876 nan 8.290 nan 0.000 0.501 1141 D N 1.627 121.942 120.400 -0.141 0.000 2.383 1141 D HA 0.477 5.117 4.640 -0.000 0.000 0.245 1141 D C 0.827 177.056 176.300 -0.118 0.000 1.263 1141 D CA 1.571 55.497 54.000 -0.124 0.000 0.936 1141 D CB -0.264 40.495 40.800 -0.069 0.000 1.053 1141 D HN 1.638 nan 8.370 nan 0.000 0.507 1142 G N 3.454 112.125 108.800 -0.215 0.000 2.746 1142 G HA2 -0.237 3.723 3.960 -0.000 0.000 0.685 1142 G HA3 -0.237 3.723 3.960 -0.000 0.000 0.685 1142 G C -0.401 174.381 174.900 -0.197 0.000 1.350 1142 G CA -0.685 44.332 45.100 -0.138 0.000 0.837 1142 G HN 0.467 nan 8.290 nan 0.000 0.564 1143 W N 0.184 121.483 121.300 -0.002 0.000 2.261 1143 W HA 0.518 5.178 4.660 -0.000 0.000 0.323 1143 W C 0.876 177.388 176.519 -0.012 0.000 1.243 1143 W CA 0.519 57.855 57.345 -0.016 0.000 1.210 1143 W CB 1.694 31.160 29.460 0.010 0.000 1.149 1143 W HN 0.973 nan 8.180 nan 0.000 0.562 1144 G N 3.871 112.770 108.800 0.165 0.000 2.384 1144 G HA2 0.553 4.513 3.960 -0.000 0.000 0.316 1144 G HA3 0.553 4.513 3.960 -0.000 0.000 0.316 1144 G C -1.579 173.356 174.900 0.058 0.000 1.160 1144 G CA -0.683 44.473 45.100 0.093 0.000 0.936 1144 G HN 0.423 nan 8.290 nan 0.000 0.455 1145 L N 2.219 123.433 121.223 -0.015 0.000 2.362 1145 L HA 0.804 5.144 4.340 -0.000 0.000 0.275 1145 L C -0.294 176.424 176.870 -0.253 0.000 0.998 1145 L CA -0.839 53.894 54.840 -0.178 0.000 0.820 1145 L CB 1.921 43.867 42.059 -0.188 0.000 1.270 1145 L HN 0.609 nan 8.230 nan 0.000 0.415 1146 A N 4.436 127.026 122.820 -0.383 0.000 2.427 1146 A HA 0.765 5.085 4.320 -0.000 0.000 0.298 1146 A C -1.662 175.688 177.584 -0.390 0.000 1.036 1146 A CA -0.361 51.547 52.037 -0.216 0.000 0.701 1146 A CB 1.129 20.134 19.000 0.008 0.000 1.250 1146 A HN 0.546 nan 8.150 nan 0.000 0.412 1147 F N 2.004 121.978 119.950 0.041 0.000 2.522 1147 F HA 0.733 5.260 4.527 -0.000 0.000 0.324 1147 F C -0.013 175.949 175.800 0.271 0.000 1.077 1147 F CA -0.935 57.072 58.000 0.012 0.000 0.944 1147 F CB 2.030 40.777 39.000 -0.422 0.000 1.175 1147 F HN 0.461 nan 8.300 nan 0.000 0.468 1148 L N 2.572 124.114 121.223 0.531 0.000 2.431 1148 L HA 0.469 4.809 4.340 -0.000 0.000 0.266 1148 L C -1.830 175.266 176.870 0.376 0.000 0.978 1148 L CA -0.324 54.783 54.840 0.445 0.000 0.822 1148 L CB 2.130 44.370 42.059 0.302 0.000 1.310 1148 L HN 0.650 nan 8.230 nan 0.000 0.409 1149 D N 3.630 124.175 120.400 0.242 0.000 2.404 1149 D HA 0.151 4.790 4.640 -0.000 0.000 0.267 1149 D C 1.166 177.481 176.300 0.025 0.000 1.194 1149 D CA -0.334 53.707 54.000 0.069 0.000 0.910 1149 D CB 1.182 41.930 40.800 -0.086 0.000 1.090 1149 D HN 0.403 nan 8.370 nan 0.000 0.511 1150 V N 1.944 121.872 119.914 0.024 0.000 2.636 1150 V HA -0.239 3.881 4.120 -0.000 0.000 0.258 1150 V C 1.855 177.937 176.094 -0.019 0.000 1.092 1150 V CA 2.257 64.554 62.300 -0.005 0.000 1.110 1150 V CB -1.251 30.571 31.823 -0.001 0.000 0.685 1150 V HN 0.490 nan 8.190 nan 0.000 0.481 1151 S N -1.464 114.218 115.700 -0.029 0.000 2.496 1151 S HA -0.028 4.442 4.470 -0.000 0.000 0.224 1151 S C 1.680 176.256 174.600 -0.040 0.000 0.996 1151 S CA 1.106 59.283 58.200 -0.038 0.000 0.927 1151 S CB -0.022 63.147 63.200 -0.053 0.000 0.774 1151 S HN 0.622 nan 8.310 nan 0.000 0.524 1152 T N -0.188 114.344 114.554 -0.036 0.000 2.987 1152 T HA 0.499 4.849 4.350 -0.000 0.000 0.248 1152 T C 1.339 176.039 174.700 0.000 0.000 0.997 1152 T CA 0.647 62.731 62.100 -0.026 0.000 1.013 1152 T CB 0.280 69.123 68.868 -0.042 0.000 1.077 1152 T HN 0.738 nan 8.240 nan 0.000 0.483 1153 G N 1.780 110.587 108.800 0.012 0.000 2.195 1153 G HA2 -0.192 3.768 3.960 -0.000 0.000 0.224 1153 G HA3 -0.192 3.768 3.960 -0.000 0.000 0.224 1153 G C -0.031 174.922 174.900 0.088 0.000 0.990 1153 G CA -0.001 45.114 45.100 0.024 0.000 0.639 1153 G HN 0.512 nan 8.290 nan 0.000 0.514 1154 E N 0.132 120.400 120.200 0.112 0.000 2.480 1154 E HA 0.320 4.670 4.350 -0.000 0.000 0.258 1154 E C -1.051 175.748 176.600 0.332 0.000 0.984 1154 E CA -0.131 56.383 56.400 0.191 0.000 0.930 1154 E CB 0.040 29.855 29.700 0.192 0.000 0.936 1154 E HN 0.159 nan 8.360 nan 0.000 0.466 1155 F N 5.862 125.883 119.950 0.118 0.000 2.716 1155 F HA 0.299 4.826 4.527 -0.000 0.000 0.354 1155 F C -0.958 174.829 175.800 -0.023 0.000 1.168 1155 F CA -0.934 57.170 58.000 0.173 0.000 1.045 1155 F CB 0.537 39.688 39.000 0.251 0.000 1.311 1155 F HN 0.306 nan 8.300 nan 0.000 0.477 1156 K N 3.395 123.793 120.400 -0.003 0.000 2.433 1156 K HA 1.033 5.353 4.320 -0.000 0.000 0.252 1156 K C -0.861 175.611 176.600 -0.213 0.000 1.015 1156 K CA -1.274 54.760 56.287 -0.422 0.000 0.860 1156 K CB 2.619 35.014 32.500 -0.176 0.000 1.359 1156 K HN 0.641 nan 8.250 nan 0.000 0.452 1157 G N -0.470 108.157 108.800 -0.288 0.000 2.559 1157 G HA2 0.550 4.510 3.960 -0.000 0.000 0.291 1157 G HA3 0.550 4.510 3.960 -0.000 0.000 0.291 1157 G C -1.639 172.995 174.900 -0.443 0.000 1.424 1157 G CA -0.314 44.788 45.100 0.004 0.000 0.786 1157 G HN 0.687 nan 8.290 nan 0.000 0.485 1158 T N -2.039 112.230 114.554 -0.475 0.000 2.739 1158 T HA 0.591 4.941 4.350 -0.000 0.000 0.303 1158 T C -1.824 172.770 174.700 -0.176 0.000 1.389 1158 T CA -0.274 61.343 62.100 -0.804 0.000 1.001 1158 T CB 1.750 69.851 68.868 -1.280 0.000 1.436 1158 T HN 0.982 nan 8.240 nan 0.000 0.500 1159 V N 3.071 122.982 119.914 -0.004 0.000 2.407 1159 V HA 0.584 4.704 4.120 -0.000 0.000 0.291 1159 V C -0.853 175.322 176.094 0.135 0.000 1.018 1159 V CA -0.671 61.716 62.300 0.144 0.000 0.842 1159 V CB 1.074 33.039 31.823 0.237 0.000 0.996 1159 V HN 0.702 nan 8.190 nan 0.000 0.426 1160 L N 4.816 126.153 121.223 0.189 0.000 2.322 1160 L HA 0.556 4.896 4.340 -0.000 0.000 0.279 1160 L C 1.030 178.121 176.870 0.369 0.000 1.036 1160 L CA -0.239 54.734 54.840 0.223 0.000 0.807 1160 L CB 1.373 43.536 42.059 0.174 0.000 1.226 1160 L HN 0.416 nan 8.230 nan 0.000 0.433 1161 K N 0.035 120.612 120.400 0.295 0.000 2.137 1161 K HA 0.092 4.412 4.320 -0.000 0.000 0.202 1161 K C 0.416 177.323 176.600 0.512 0.000 1.052 1161 K CA 0.518 57.009 56.287 0.340 0.000 0.961 1161 K CB 0.077 32.697 32.500 0.200 0.000 0.741 1161 K HN 0.673 nan 8.250 nan 0.000 0.452 1162 S N -0.175 115.673 115.700 0.247 0.000 2.501 1162 S HA 0.300 4.770 4.470 -0.000 0.000 0.301 1162 S C 0.714 174.921 174.600 -0.654 0.000 1.096 1162 S CA -0.967 57.240 58.200 0.012 0.000 1.063 1162 S CB 2.206 65.412 63.200 0.010 0.000 1.042 1162 S HN 0.161 nan 8.310 nan 0.000 0.494 1163 K N 1.575 121.290 120.400 -1.142 0.000 2.211 1163 K HA -0.113 4.207 4.320 -0.000 0.000 0.204 1163 K C 1.946 178.257 176.600 -0.482 0.000 1.047 1163 K CA 1.648 57.211 56.287 -1.207 0.000 0.935 1163 K CB -0.440 31.716 32.500 -0.573 0.000 0.728 1163 K HN 0.563 nan 8.250 nan 0.000 0.452 1164 S N -0.195 115.308 115.700 -0.327 0.000 2.368 1164 S HA -0.076 4.394 4.470 -0.000 0.000 0.224 1164 S C 1.939 176.510 174.600 -0.048 0.000 1.029 1164 S CA 1.119 59.205 58.200 -0.190 0.000 0.988 1164 S CB -0.293 62.836 63.200 -0.119 0.000 0.838 1164 S HN 0.525 nan 8.310 nan 0.000 0.462 1165 A N 1.082 123.876 122.820 -0.044 0.000 1.968 1165 A HA 0.094 4.414 4.320 -0.000 0.000 0.217 1165 A C 2.065 179.700 177.584 0.085 0.000 1.169 1165 A CA 1.316 53.383 52.037 0.050 0.000 0.638 1165 A CB -0.732 18.307 19.000 0.065 0.000 0.812 1165 A HN 0.551 nan 8.150 nan 0.000 0.446 1166 L N -1.160 120.054 121.223 -0.015 0.000 1.943 1166 L HA -0.203 4.137 4.340 -0.000 0.000 0.215 1166 L C 2.330 179.332 176.870 0.221 0.000 1.074 1166 L CA 2.245 57.102 54.840 0.028 0.000 0.759 1166 L CB -0.907 41.020 42.059 -0.221 0.000 0.888 1166 L HN 0.440 nan 8.230 nan 0.000 0.433 1167 Y N 0.470 120.807 120.300 0.061 0.000 2.139 1167 Y HA -0.320 4.230 4.550 -0.000 0.000 0.282 1167 Y C 2.569 178.678 175.900 0.349 0.000 1.179 1167 Y CA 1.641 59.910 58.100 0.281 0.000 1.161 1167 Y CB -1.122 37.533 38.460 0.325 0.000 0.970 1167 Y HN 0.369 nan 8.280 nan 0.000 0.511 1168 D N -0.145 120.481 120.400 0.376 0.000 2.087 1168 D HA -0.159 4.481 4.640 -0.000 0.000 0.192 1168 D C 2.113 178.621 176.300 0.346 0.000 0.993 1168 D CA 1.438 55.619 54.000 0.302 0.000 0.828 1168 D CB -0.166 40.746 40.800 0.186 0.000 0.968 1168 D HN 0.303 nan 8.370 nan 0.000 0.448 1169 E N 0.501 120.901 120.200 0.333 0.000 2.118 1169 E HA -0.123 4.227 4.350 -0.000 0.000 0.195 1169 E C 2.207 179.137 176.600 0.550 0.000 0.992 1169 E CA 0.046 56.712 56.400 0.443 0.000 0.804 1169 E CB -0.325 29.643 29.700 0.447 0.000 0.741 1169 E HN 0.271 nan 8.360 nan 0.000 0.458 1170 L N -0.270 121.196 121.223 0.404 0.000 2.083 1170 L HA -0.148 4.192 4.340 -0.000 0.000 0.209 1170 L C 2.185 179.268 176.870 0.356 0.000 1.083 1170 L CA 1.304 56.322 54.840 0.297 0.000 0.752 1170 L CB -0.499 41.451 42.059 -0.182 0.000 0.899 1170 L HN 0.099 nan 8.230 nan 0.000 0.433 1171 F N 0.488 120.645 119.950 0.344 0.000 2.293 1171 F HA -0.073 4.454 4.527 -0.000 0.000 0.297 1171 F C 2.656 178.523 175.800 0.112 0.000 1.089 1171 F CA 0.813 59.004 58.000 0.318 0.000 1.377 1171 F CB -0.095 39.080 39.000 0.290 0.000 1.051 1171 F HN -0.055 nan 8.300 nan 0.000 0.511 1172 R N -0.667 119.942 120.500 0.181 0.000 2.105 1172 R HA -0.171 4.169 4.340 -0.000 0.000 0.239 1172 R C 1.784 177.797 176.300 -0.479 0.000 1.135 1172 R CA 1.552 57.569 56.100 -0.138 0.000 0.967 1172 R CB -0.709 29.399 30.300 -0.321 0.000 0.861 1172 R HN 0.466 nan 8.270 nan 0.000 0.442 1173 H N -0.379 118.531 119.070 -0.266 0.000 2.544 1173 H HA 0.165 4.721 4.556 -0.000 0.000 0.269 1173 H C 0.224 175.406 175.328 -0.245 0.000 0.970 1173 H CA 0.008 55.799 56.048 -0.428 0.000 1.219 1173 H CB 0.406 29.543 29.762 -1.041 0.000 1.421 1173 H HN -0.099 nan 8.280 nan 0.000 0.555 1174 R N 0.473 120.879 120.500 -0.156 0.000 3.188 1174 R HA -0.107 4.233 4.340 -0.000 0.000 0.247 1174 R C -2.566 173.750 176.300 0.028 0.000 0.918 1174 R CA -0.147 55.861 56.100 -0.153 0.000 0.629 1174 R CB -2.446 27.684 30.300 -0.283 0.000 1.087 1174 R HN 0.410 nan 8.270 nan 0.000 0.462 1175 P HA -0.004 nan 4.420 nan 0.000 0.269 1175 P C 0.482 177.863 177.300 0.135 0.000 1.211 1175 P CA 0.718 63.950 63.100 0.221 0.000 0.781 1175 P CB 0.606 32.461 31.700 0.258 0.000 0.877 1176 A N 0.821 123.723 122.820 0.137 0.000 2.063 1176 A HA 0.118 4.438 4.320 -0.000 0.000 0.211 1176 A C 0.624 178.265 177.584 0.094 0.000 1.177 1176 A CA 0.842 52.931 52.037 0.088 0.000 0.759 1176 A CB -0.183 18.856 19.000 0.065 0.000 0.857 1176 A HN 0.615 nan 8.150 nan 0.000 0.468 1177 E N -0.771 119.496 120.200 0.113 0.000 2.335 1177 E HA 0.531 4.881 4.350 -0.000 0.000 0.280 1177 E C -1.984 174.660 176.600 0.073 0.000 0.918 1177 E CA -0.491 55.960 56.400 0.085 0.000 0.765 1177 E CB 2.259 32.008 29.700 0.082 0.000 1.218 1177 E HN -0.011 nan 8.360 nan 0.000 0.425 1178 V N 4.321 124.263 119.914 0.048 0.000 2.769 1178 V HA 0.500 4.620 4.120 -0.000 0.000 0.312 1178 V C -0.480 175.577 176.094 -0.063 0.000 1.061 1178 V CA -0.791 61.522 62.300 0.021 0.000 0.931 1178 V CB 1.735 33.623 31.823 0.107 0.000 1.010 1178 V HN 0.617 nan 8.190 nan 0.000 0.433 1179 L N 4.974 126.158 121.223 -0.066 0.000 2.345 1179 L HA 0.548 4.888 4.340 -0.000 0.000 0.274 1179 L C -0.868 176.072 176.870 0.117 0.000 0.999 1179 L CA -0.289 54.537 54.840 -0.023 0.000 0.849 1179 L CB 1.424 43.432 42.059 -0.084 0.000 1.220 1179 L HN 0.411 nan 8.230 nan 0.000 0.422 1180 L N 2.968 124.188 121.223 -0.004 0.000 2.292 1180 L HA 0.607 4.947 4.340 -0.000 0.000 0.284 1180 L C 0.874 177.580 176.870 -0.273 0.000 1.065 1180 L CA -0.409 54.365 54.840 -0.110 0.000 0.806 1180 L CB 1.501 43.447 42.059 -0.188 0.000 1.175 1180 L HN 0.654 nan 8.230 nan 0.000 0.431 1181 A N 5.670 128.050 122.820 -0.735 0.000 2.455 1181 A HA 0.223 4.543 4.320 -0.000 0.000 0.244 1181 A C -1.259 175.955 177.584 -0.618 0.000 1.099 1181 A CA -0.737 50.431 52.037 -1.449 0.000 0.786 1181 A CB -0.378 17.876 19.000 -1.244 0.000 1.051 1181 A HN 0.696 nan 8.150 nan 0.000 0.508 1182 P HA -0.180 nan 4.420 nan 0.000 0.217 1182 P C 0.610 177.800 177.300 -0.183 0.000 1.150 1182 P CA 1.715 64.678 63.100 -0.228 0.000 0.832 1182 P CB -0.012 31.594 31.700 -0.157 0.000 0.787 1183 E N 0.284 120.352 120.200 -0.221 0.000 2.160 1183 E HA -0.130 4.220 4.350 -0.000 0.000 0.195 1183 E C 2.252 178.761 176.600 -0.152 0.000 0.991 1183 E CA 0.984 57.280 56.400 -0.173 0.000 0.810 1183 E CB -1.208 28.370 29.700 -0.204 0.000 0.742 1183 E HN 0.295 nan 8.360 nan 0.000 0.466 1184 L N -0.118 120.991 121.223 -0.190 0.000 2.131 1184 L HA -0.014 4.326 4.340 -0.000 0.000 0.206 1184 L C 2.226 179.145 176.870 0.082 0.000 1.087 1184 L CA 0.576 55.356 54.840 -0.099 0.000 0.767 1184 L CB -0.257 41.699 42.059 -0.172 0.000 0.917 1184 L HN 0.137 nan 8.230 nan 0.000 0.441 1185 L N -0.353 120.861 121.223 -0.015 0.000 2.201 1185 L HA -0.166 4.174 4.340 -0.000 0.000 0.212 1185 L C 2.223 179.107 176.870 0.024 0.000 1.105 1185 L CA 1.179 56.023 54.840 0.008 0.000 0.775 1185 L CB -0.300 41.738 42.059 -0.035 0.000 0.913 1185 L HN 0.326 nan 8.230 nan 0.000 0.440 1186 E N -0.694 119.509 120.200 0.005 0.000 2.318 1186 E HA -0.076 4.274 4.350 -0.000 0.000 0.193 1186 E C 0.760 177.381 176.600 0.036 0.000 0.998 1186 E CA -0.131 56.275 56.400 0.010 0.000 0.859 1186 E CB 0.023 29.714 29.700 -0.015 0.000 0.812 1186 E HN 0.241 nan 8.360 nan 0.000 0.492 1187 N N 1.485 120.221 118.700 0.061 0.000 2.498 1187 N HA -0.024 4.716 4.740 -0.000 0.000 0.277 1187 N C 0.893 176.489 175.510 0.142 0.000 1.208 1187 N CA 0.156 53.265 53.050 0.098 0.000 1.029 1187 N CB 0.717 39.274 38.487 0.117 0.000 1.403 1187 N HN 0.127 nan 8.380 nan 0.000 0.500 1188 G N 2.653 111.510 108.800 0.095 0.000 2.517 1188 G HA2 -0.303 3.657 3.960 -0.000 0.000 0.222 1188 G HA3 -0.303 3.657 3.960 -0.000 0.000 0.222 1188 G C 1.296 176.261 174.900 0.108 0.000 1.109 1188 G CA 1.075 46.228 45.100 0.088 0.000 0.746 1188 G HN 0.663 nan 8.290 nan 0.000 0.576 1189 A N 0.119 123.020 122.820 0.135 0.000 1.898 1189 A HA 0.256 4.576 4.320 -0.000 0.000 0.214 1189 A C 2.093 179.798 177.584 0.201 0.000 1.183 1189 A CA 1.316 53.439 52.037 0.144 0.000 0.622 1189 A CB -0.432 18.650 19.000 0.137 0.000 0.824 1189 A HN 0.371 nan 8.150 nan 0.000 0.444 1190 F N 0.520 120.545 119.950 0.125 0.000 2.051 1190 F HA -0.159 4.368 4.527 -0.000 0.000 0.296 1190 F C 1.851 177.779 175.800 0.213 0.000 1.122 1190 F CA 1.840 59.952 58.000 0.186 0.000 1.201 1190 F CB -0.547 38.554 39.000 0.168 0.000 0.978 1190 F HN 0.184 nan 8.300 nan 0.000 0.472 1191 L N 0.979 122.234 121.223 0.053 0.000 2.042 1191 L HA -0.241 4.099 4.340 -0.000 0.000 0.210 1191 L C 1.708 178.577 176.870 -0.002 0.000 1.076 1191 L CA 2.242 57.057 54.840 -0.041 0.000 0.749 1191 L CB -1.211 40.884 42.059 0.060 0.000 0.893 1191 L HN 0.128 nan 8.230 nan 0.000 0.432 1192 D N -1.081 119.342 120.400 0.038 0.000 2.219 1192 D HA -0.183 4.457 4.640 -0.000 0.000 0.205 1192 D C 2.086 178.408 176.300 0.036 0.000 0.970 1192 D CA 1.175 55.200 54.000 0.042 0.000 0.851 1192 D CB 0.142 40.973 40.800 0.051 0.000 0.943 1192 D HN 0.596 nan 8.370 nan 0.000 0.488 1193 E N -0.784 119.434 120.200 0.031 0.000 2.075 1193 E HA -0.103 4.247 4.350 -0.000 0.000 0.190 1193 E C 1.775 178.406 176.600 0.053 0.000 0.969 1193 E CA 0.067 56.499 56.400 0.054 0.000 0.815 1193 E CB -0.171 29.595 29.700 0.110 0.000 0.776 1193 E HN 0.210 nan 8.360 nan 0.000 0.457 1194 F N 2.168 121.975 119.950 -0.238 0.000 2.091 1194 F HA -0.201 4.326 4.527 -0.000 0.000 0.299 1194 F C 2.371 178.142 175.800 -0.049 0.000 1.103 1194 F CA 1.825 59.674 58.000 -0.253 0.000 1.228 1194 F CB 0.017 38.610 39.000 -0.678 0.000 0.984 1194 F HN -0.070 nan 8.300 nan 0.000 0.477 1195 R N 0.339 120.910 120.500 0.118 0.000 2.070 1195 R HA -0.155 4.185 4.340 -0.000 0.000 0.233 1195 R C 2.240 178.535 176.300 -0.009 0.000 1.137 1195 R CA 1.775 57.922 56.100 0.078 0.000 0.945 1195 R CB -0.531 29.818 30.300 0.082 0.000 0.845 1195 R HN 0.297 nan 8.270 nan 0.000 0.430 1196 K N 0.320 120.715 120.400 -0.008 0.000 2.044 1196 K HA -0.220 4.100 4.320 -0.000 0.000 0.210 1196 K C 2.250 178.802 176.600 -0.080 0.000 1.049 1196 K CA 1.611 57.881 56.287 -0.028 0.000 0.927 1196 K CB -0.203 32.290 32.500 -0.011 0.000 0.713 1196 K HN 0.098 nan 8.250 nan 0.000 0.443 1197 R N -0.287 120.149 120.500 -0.107 0.000 2.161 1197 R HA 0.018 4.358 4.340 -0.000 0.000 0.213 1197 R C -0.059 175.927 176.300 -0.522 0.000 1.055 1197 R CA 0.629 56.586 56.100 -0.239 0.000 0.996 1197 R CB 0.335 30.578 30.300 -0.096 0.000 0.901 1197 R HN -0.006 nan 8.270 nan 0.000 0.456 1198 F N 2.441 122.168 119.950 -0.372 0.000 2.550 1198 F HA 0.356 4.883 4.527 -0.000 0.000 0.348 1198 F C -2.103 173.546 175.800 -0.252 0.000 1.219 1198 F CA -2.492 55.252 58.000 -0.428 0.000 1.203 1198 F CB 1.795 40.196 39.000 -0.999 0.000 1.436 1198 F HN -0.079 nan 8.300 nan 0.000 0.541 1199 P HA 0.113 nan 4.420 nan 0.000 0.267 1199 P C -0.363 176.978 177.300 0.069 0.000 1.328 1199 P CA 0.582 63.699 63.100 0.029 0.000 0.990 1199 P CB 1.614 33.318 31.700 0.006 0.000 1.168 1203 S N 0.829 116.480 115.700 -0.082 0.000 2.607 1203 S HA 0.681 5.151 4.470 -0.000 0.000 0.303 1203 S C -0.631 173.920 174.600 -0.081 0.000 1.086 1203 S CA -0.847 57.293 58.200 -0.100 0.000 0.995 1203 S CB 2.395 65.468 63.200 -0.213 0.000 1.084 1203 S HN 0.504 nan 8.310 nan 0.000 0.507 1204 E N 0.480 120.682 120.200 0.002 0.000 2.313 1204 E HA 0.662 5.012 4.350 -0.000 0.000 0.272 1204 E C -0.653 176.007 176.600 0.100 0.000 1.038 1204 E CA -0.461 55.978 56.400 0.065 0.000 0.863 1204 E CB 1.324 31.079 29.700 0.091 0.000 1.060 1204 E HN 0.672 nan 8.360 nan 0.000 0.402 1205 A N 3.433 126.350 122.820 0.161 0.000 2.583 1205 A HA 0.375 4.695 4.320 -0.000 0.000 0.298 1205 A C -2.750 174.964 177.584 0.217 0.000 1.055 1205 A CA -1.220 50.913 52.037 0.161 0.000 0.714 1205 A CB 1.120 20.122 19.000 0.003 0.000 1.277 1205 A HN 0.389 nan 8.150 nan 0.000 0.406 1206 P HA 0.367 nan 4.420 nan 0.000 0.271 1206 P C -0.659 176.705 177.300 0.105 0.000 1.216 1206 P CA 0.276 63.473 63.100 0.162 0.000 0.776 1206 P CB 0.241 31.993 31.700 0.087 0.000 0.881 1207 F N 0.472 120.421 119.950 -0.001 0.000 2.908 1207 F HA 0.144 4.671 4.527 -0.000 0.000 0.328 1207 F C 0.829 176.619 175.800 -0.017 0.000 1.211 1207 F CA -0.379 57.614 58.000 -0.013 0.000 1.291 1207 F CB 0.196 39.176 39.000 -0.032 0.000 0.962 1207 F HN 0.079 nan 8.300 nan 0.000 0.505 1208 E N 3.235 123.489 120.200 0.090 0.000 2.351 1208 E HA 0.098 4.448 4.350 -0.000 0.000 0.266 1208 E C -2.119 174.494 176.600 0.021 0.000 1.031 1208 E CA -1.976 54.454 56.400 0.050 0.000 0.911 1208 E CB -0.167 29.550 29.700 0.028 0.000 0.986 1208 E HN 0.139 nan 8.360 nan 0.000 0.446 1209 P HA -0.120 nan 4.420 nan 0.000 0.269 1209 P C 0.028 177.314 177.300 -0.024 0.000 1.200 1209 P CA 0.594 63.690 63.100 -0.007 0.000 0.779 1209 P CB 0.801 32.493 31.700 -0.012 0.000 0.841 1210 E N 0.522 120.694 120.200 -0.046 0.000 2.308 1210 E HA 0.456 4.806 4.350 -0.000 0.000 0.275 1210 E C 0.359 176.913 176.600 -0.077 0.000 0.890 1210 E CA 0.138 56.511 56.400 -0.046 0.000 0.754 1210 E CB 1.925 31.604 29.700 -0.034 0.000 1.207 1210 E HN 0.761 nan 8.360 nan 0.000 0.426 1211 G N 4.184 112.951 108.800 -0.054 0.000 2.552 1211 G HA2 -0.276 3.684 3.960 -0.000 0.000 0.265 1211 G HA3 -0.276 3.684 3.960 -0.000 0.000 0.265 1211 G C -0.165 174.693 174.900 -0.069 0.000 1.234 1211 G CA 0.495 45.556 45.100 -0.064 0.000 0.944 1211 G HN 0.581 nan 8.290 nan 0.000 0.568 1212 E N -0.435 119.716 120.200 -0.082 0.000 2.412 1212 E HA 0.603 4.953 4.350 -0.000 0.000 0.255 1212 E C 0.508 177.051 176.600 -0.095 0.000 0.933 1212 E CA -0.347 56.009 56.400 -0.073 0.000 0.823 1212 E CB 1.487 31.157 29.700 -0.051 0.000 1.352 1212 E HN 2.216 nan 8.360 nan 0.000 0.406 1213 G N 0.397 109.143 108.800 -0.091 0.000 2.698 1213 G HA2 -0.163 3.797 3.960 -0.000 0.000 0.225 1213 G HA3 -0.163 3.797 3.960 -0.000 0.000 0.225 1213 G C -2.605 172.241 174.900 -0.089 0.000 1.345 1213 G CA -1.098 43.933 45.100 -0.115 0.000 0.871 1213 G HN 0.396 nan 8.290 nan 0.000 0.540 1214 P HA 0.070 nan 4.420 nan 0.000 0.268 1214 P C 1.452 178.725 177.300 -0.045 0.000 1.189 1214 P CA -0.319 62.750 63.100 -0.052 0.000 0.771 1214 P CB 0.336 32.023 31.700 -0.021 0.000 0.822 1215 L N 2.572 123.769 121.223 -0.044 0.000 2.056 1215 L HA -0.177 4.163 4.340 -0.000 0.000 0.207 1215 L C 1.856 178.708 176.870 -0.030 0.000 1.078 1215 L CA 2.560 57.376 54.840 -0.041 0.000 0.749 1215 L CB -1.390 40.641 42.059 -0.046 0.000 0.901 1215 L HN 0.427 nan 8.230 nan 0.000 0.433 1216 A N -0.212 122.589 122.820 -0.032 0.000 1.972 1216 A HA -0.184 4.135 4.320 -0.000 0.000 0.219 1216 A C 2.303 179.895 177.584 0.013 0.000 1.169 1216 A CA 1.361 53.387 52.037 -0.017 0.000 0.635 1216 A CB -0.494 18.481 19.000 -0.042 0.000 0.810 1216 A HN 0.501 nan 8.150 nan 0.000 0.446 1217 L N -1.078 120.148 121.223 0.006 0.000 2.007 1217 L HA -0.155 4.185 4.340 -0.000 0.000 0.205 1217 L C 2.862 179.681 176.870 -0.085 0.000 1.073 1217 L CA 1.452 56.288 54.840 -0.007 0.000 0.744 1217 L CB -0.408 41.675 42.059 0.039 0.000 0.898 1217 L HN 0.358 nan 8.230 nan 0.000 0.435 1218 R N -0.512 119.927 120.500 -0.101 0.000 2.140 1218 R HA -0.231 4.109 4.340 -0.000 0.000 0.250 1218 R C 2.316 178.575 176.300 -0.070 0.000 1.150 1218 R CA 1.730 57.758 56.100 -0.120 0.000 0.966 1218 R CB -0.386 29.863 30.300 -0.084 0.000 0.869 1218 R HN 0.376 nan 8.270 nan 0.000 0.445 1219 R N -0.071 120.427 120.500 -0.004 0.000 2.075 1219 R HA -0.051 4.289 4.340 -0.000 0.000 0.232 1219 R C 2.372 178.714 176.300 0.071 0.000 1.126 1219 R CA 1.371 57.520 56.100 0.081 0.000 0.963 1219 R CB -0.377 30.020 30.300 0.161 0.000 0.858 1219 R HN 0.258 nan 8.270 nan 0.000 0.435 1220 A N 1.206 124.069 122.820 0.071 0.000 1.898 1220 A HA -0.156 4.164 4.320 -0.000 0.000 0.216 1220 A C 2.174 179.683 177.584 -0.125 0.000 1.181 1220 A CA 1.077 53.116 52.037 0.003 0.000 0.620 1220 A CB -0.444 18.586 19.000 0.051 0.000 0.819 1220 A HN 0.195 nan 8.150 nan 0.000 0.442 1221 R N -0.547 119.887 120.500 -0.109 0.000 2.091 1221 R HA -0.137 4.203 4.340 -0.000 0.000 0.238 1221 R C 2.260 178.558 176.300 -0.003 0.000 1.136 1221 R CA 1.607 57.655 56.100 -0.085 0.000 0.959 1221 R CB -0.657 29.441 30.300 -0.337 0.000 0.856 1221 R HN 0.483 nan 8.270 nan 0.000 0.437 1222 G N -0.117 108.633 108.800 -0.084 0.000 2.418 1222 G HA2 -0.265 3.695 3.960 -0.000 0.000 0.217 1222 G HA3 -0.265 3.695 3.960 -0.000 0.000 0.217 1222 G C 1.512 176.315 174.900 -0.161 0.000 1.158 1222 G CA 0.770 45.820 45.100 -0.082 0.000 0.771 1222 G HN 0.480 nan 8.290 nan 0.000 0.545 1223 A N 0.673 123.254 122.820 -0.398 0.000 1.883 1223 A HA 0.021 4.341 4.320 -0.000 0.000 0.217 1223 A C 2.457 179.902 177.584 -0.232 0.000 1.186 1223 A CA 1.440 53.119 52.037 -0.596 0.000 0.624 1223 A CB -0.469 17.584 19.000 -1.579 0.000 0.822 1223 A HN 0.363 nan 8.150 nan 0.000 0.444 1224 L N -0.686 120.459 121.223 -0.128 0.000 1.970 1224 L HA -0.221 4.119 4.340 -0.000 0.000 0.212 1224 L C 2.688 179.592 176.870 0.057 0.000 1.071 1224 L CA 1.465 56.330 54.840 0.041 0.000 0.751 1224 L CB -0.763 41.403 42.059 0.177 0.000 0.889 1224 L HN 0.387 nan 8.230 nan 0.000 0.432 1225 L N -0.288 120.956 121.223 0.035 0.000 1.990 1225 L HA -0.292 4.048 4.340 -0.000 0.000 0.213 1225 L C 2.913 179.780 176.870 -0.004 0.000 1.072 1225 L CA 1.594 56.424 54.840 -0.017 0.000 0.755 1225 L CB -0.869 41.191 42.059 0.003 0.000 0.889 1225 L HN 0.328 nan 8.230 nan 0.000 0.432 1226 A N -0.998 121.824 122.820 0.003 0.000 1.883 1226 A HA -0.295 4.024 4.320 -0.000 0.000 0.217 1226 A C 2.167 179.785 177.584 0.056 0.000 1.186 1226 A CA 1.834 53.880 52.037 0.016 0.000 0.624 1226 A CB -0.941 18.063 19.000 0.007 0.000 0.822 1226 A HN 0.481 nan 8.150 nan 0.000 0.444 1227 Y N 0.364 120.639 120.300 -0.041 0.000 2.163 1227 Y HA -0.020 4.530 4.550 -0.000 0.000 0.288 1227 Y C 2.706 178.615 175.900 0.015 0.000 1.136 1227 Y CA 1.300 59.400 58.100 0.000 0.000 1.147 1227 Y CB -0.548 37.909 38.460 -0.004 0.000 0.987 1227 Y HN 0.297 nan 8.280 nan 0.000 0.509 1228 A N 0.062 122.927 122.820 0.076 0.000 1.972 1228 A HA -0.238 4.082 4.320 -0.000 0.000 0.219 1228 A C 2.072 179.610 177.584 -0.077 0.000 1.169 1228 A CA 1.882 53.912 52.037 -0.012 0.000 0.635 1228 A CB -0.672 18.344 19.000 0.027 0.000 0.810 1228 A HN 0.686 nan 8.150 nan 0.000 0.446 1229 Q N -0.920 118.842 119.800 -0.064 0.000 2.079 1229 Q HA -0.127 4.213 4.340 -0.000 0.000 0.200 1229 Q C 2.286 178.239 176.000 -0.079 0.000 0.974 1229 Q CA 0.970 56.736 55.803 -0.062 0.000 0.840 1229 Q CB -0.194 28.517 28.738 -0.044 0.000 0.898 1229 Q HN 0.468 nan 8.270 nan 0.000 0.430 1230 R N 0.059 120.495 120.500 -0.106 0.000 2.117 1230 R HA -0.117 4.223 4.340 -0.000 0.000 0.243 1230 R C 2.164 178.375 176.300 -0.149 0.000 1.143 1230 R CA 1.549 57.580 56.100 -0.115 0.000 0.968 1230 R CB -0.786 29.419 30.300 -0.158 0.000 0.863 1230 R HN 0.309 nan 8.270 nan 0.000 0.444 1231 T N 0.823 115.259 114.554 -0.198 0.000 2.639 1231 T HA -0.162 4.188 4.350 -0.000 0.000 0.261 1231 T C 1.188 175.828 174.700 -0.100 0.000 1.053 1231 T CA 1.170 63.175 62.100 -0.160 0.000 1.158 1231 T CB -0.194 68.586 68.868 -0.146 0.000 0.863 1231 T HN 0.110 nan 8.240 nan 0.000 0.413 1232 Q N 2.151 121.906 119.800 -0.076 0.000 3.179 1232 Q HA 0.298 4.638 4.340 -0.000 0.000 0.328 1232 Q C 0.770 176.741 176.000 -0.048 0.000 1.336 1232 Q CA -0.452 55.321 55.803 -0.051 0.000 0.939 1232 Q CB -1.091 27.622 28.738 -0.041 0.000 1.658 1232 Q HN 0.410 nan 8.270 nan 0.000 0.486 1233 G N 1.419 110.186 108.800 -0.055 0.000 1.967 1233 G HA2 0.105 4.064 3.960 -0.000 0.000 0.244 1233 G HA3 0.105 4.064 3.960 -0.000 0.000 0.244 1233 G C 0.457 175.342 174.900 -0.026 0.000 0.709 1233 G CA 0.751 45.827 45.100 -0.039 0.000 0.899 1233 G HN 0.996 nan 8.290 nan 0.000 0.392 1234 G N -1.301 107.482 108.800 -0.029 0.000 2.362 1234 G HA2 0.575 4.535 3.960 -0.000 0.000 0.288 1234 G HA3 0.575 4.535 3.960 -0.000 0.000 0.288 1234 G C 0.022 174.906 174.900 -0.027 0.000 1.305 1234 G CA -0.002 45.084 45.100 -0.022 0.000 0.910 1234 G HN 1.690 nan 8.290 nan 0.000 0.518 1235 A N -0.630 122.176 122.820 -0.023 0.000 2.587 1235 A HA 0.482 4.802 4.320 -0.000 0.000 0.233 1235 A C 0.621 178.184 177.584 -0.035 0.000 1.049 1235 A CA 0.573 52.594 52.037 -0.027 0.000 0.754 1235 A CB -0.265 18.724 19.000 -0.018 0.000 0.977 1235 A HN 1.117 nan 8.150 nan 0.000 0.509 1236 L N 1.594 122.788 121.223 -0.049 0.000 2.360 1236 L HA 0.442 4.782 4.340 -0.000 0.000 0.271 1236 L C 0.834 177.671 176.870 -0.055 0.000 1.057 1236 L CA -0.363 54.440 54.840 -0.062 0.000 0.803 1236 L CB 1.715 43.712 42.059 -0.103 0.000 1.207 1236 L HN 0.677 nan 8.230 nan 0.000 0.445 1237 S N 2.468 118.139 115.700 -0.049 0.000 2.420 1237 S HA 0.727 5.197 4.470 -0.000 0.000 0.313 1237 S C -0.808 173.766 174.600 -0.043 0.000 1.079 1237 S CA -0.530 57.650 58.200 -0.033 0.000 1.104 1237 S CB -0.182 63.006 63.200 -0.021 0.000 0.969 1237 S HN 0.340 nan 8.310 nan 0.000 0.471 1238 L N 4.713 125.915 121.223 -0.035 0.000 2.445 1238 L HA 0.526 4.866 4.340 -0.000 0.000 0.262 1238 L C -0.150 176.753 176.870 0.055 0.000 0.974 1238 L CA -0.848 53.975 54.840 -0.027 0.000 0.822 1238 L CB 1.853 43.819 42.059 -0.154 0.000 1.339 1238 L HN 0.586 nan 8.230 nan 0.000 0.409 1239 Q N 0.211 120.072 119.800 0.102 0.000 2.260 1239 Q HA 0.579 4.919 4.340 -0.000 0.000 0.238 1239 Q C -2.462 173.670 176.000 0.220 0.000 0.948 1239 Q CA -1.983 53.897 55.803 0.129 0.000 0.895 1239 Q CB 0.145 28.947 28.738 0.106 0.000 1.218 1239 Q HN 0.301 nan 8.270 nan 0.000 0.470 1240 P HA -0.164 nan 4.420 nan 0.000 0.261 1240 P C -0.913 176.568 177.300 0.302 0.000 1.158 1240 P CA 0.285 63.530 63.100 0.242 0.000 0.758 1240 P CB 0.048 31.844 31.700 0.160 0.000 0.763 1241 F N 4.080 124.164 119.950 0.223 0.000 2.608 1241 F HA 0.054 4.581 4.527 -0.000 0.000 0.380 1241 F C 0.978 176.808 175.800 0.049 0.000 1.083 1241 F CA 0.168 58.187 58.000 0.030 0.000 1.266 1241 F CB 0.317 39.167 39.000 -0.250 0.000 1.076 1241 F HN 0.172 nan 8.300 nan 0.000 0.574 1242 R N 7.926 128.020 120.500 -0.676 0.000 2.310 1242 R HA 0.237 4.577 4.340 -0.000 0.000 0.324 1242 R C -1.602 174.342 176.300 -0.593 0.000 0.955 1242 R CA -0.673 55.195 56.100 -0.386 0.000 0.830 1242 R CB 0.581 30.771 30.300 -0.183 0.000 1.154 1242 R HN 0.704 nan 8.270 nan 0.000 0.458 1243 F N 6.504 126.278 119.950 -0.294 0.000 2.404 1243 F HA 0.317 4.844 4.527 -0.000 0.000 0.345 1243 F C -1.136 174.697 175.800 0.055 0.000 1.110 1243 F CA -0.395 57.546 58.000 -0.097 0.000 1.130 1243 F CB 0.524 39.587 39.000 0.106 0.000 1.129 1243 F HN 0.521 nan 8.300 nan 0.000 0.500 1244 Y N 2.458 122.244 120.300 -0.855 0.000 2.633 1244 Y HA 0.625 5.175 4.550 -0.000 0.000 0.339 1244 Y C -1.765 173.830 175.900 -0.508 0.000 1.045 1244 Y CA -1.588 56.257 58.100 -0.425 0.000 1.098 1244 Y CB 1.155 39.494 38.460 -0.203 0.000 1.296 1244 Y HN 0.518 nan 8.280 nan 0.000 0.494 1245 D N 1.414 121.847 120.400 0.054 0.000 2.481 1245 D HA 0.444 5.084 4.640 -0.000 0.000 0.246 1245 D C -2.320 174.172 176.300 0.320 0.000 1.109 1245 D CA -2.824 51.211 54.000 0.060 0.000 0.845 1245 D CB 2.190 43.068 40.800 0.130 0.000 1.160 1245 D HN 0.310 nan 8.370 nan 0.000 0.534 1246 P HA 0.076 nan 4.420 nan 0.000 0.225 1246 P C 1.182 178.707 177.300 0.375 0.000 1.148 1246 P CA 0.548 63.924 63.100 0.460 0.000 0.779 1246 P CB 0.377 32.269 31.700 0.321 0.000 0.780 1247 G N -0.212 108.723 108.800 0.225 0.000 2.712 1247 G HA2 0.001 3.961 3.960 -0.000 0.000 0.212 1247 G HA3 0.001 3.961 3.960 -0.000 0.000 0.212 1247 G C 1.344 176.278 174.900 0.057 0.000 1.142 1247 G CA 0.525 45.712 45.100 0.145 0.000 0.789 1247 G HN 0.315 nan 8.290 nan 0.000 0.535 1248 A N -0.481 122.310 122.820 -0.048 0.000 2.251 1248 A HA 0.615 4.935 4.320 -0.000 0.000 0.209 1248 A C 0.249 177.456 177.584 -0.628 0.000 1.187 1248 A CA 0.004 51.818 52.037 -0.371 0.000 0.823 1248 A CB -0.085 18.583 19.000 -0.554 0.000 0.846 1248 A HN 0.202 nan 8.150 nan 0.000 0.486 1252 L N 4.244 125.390 121.223 -0.128 0.000 2.481 1252 L HA 0.353 4.693 4.340 -0.000 0.000 0.255 1252 L C -2.133 174.681 176.870 -0.094 0.000 1.192 1252 L CA -1.516 53.230 54.840 -0.157 0.000 0.924 1252 L CB 2.214 44.187 42.059 -0.144 0.000 1.179 1252 L HN 0.271 nan 8.230 nan 0.000 0.491 1253 P HA 0.030 nan 4.420 nan 0.000 0.274 1253 P C 0.476 177.737 177.300 -0.064 0.000 1.237 1253 P CA -0.219 62.858 63.100 -0.038 0.000 0.793 1253 P CB 1.241 32.931 31.700 -0.016 0.000 0.977 1254 E N 1.759 121.904 120.200 -0.091 0.000 2.147 1254 E HA -0.269 4.081 4.350 -0.000 0.000 0.199 1254 E C 1.801 178.219 176.600 -0.302 0.000 1.005 1254 E CA 1.898 58.105 56.400 -0.321 0.000 0.810 1254 E CB -0.523 28.831 29.700 -0.576 0.000 0.736 1254 E HN 0.494 nan 8.360 nan 0.000 0.460 1255 A N -0.036 122.666 122.820 -0.197 0.000 1.902 1255 A HA -0.167 4.153 4.320 -0.000 0.000 0.217 1255 A C 2.399 179.908 177.584 -0.126 0.000 1.181 1255 A CA 1.999 53.941 52.037 -0.157 0.000 0.623 1255 A CB -0.852 18.083 19.000 -0.107 0.000 0.818 1255 A HN 0.371 nan 8.150 nan 0.000 0.443 1256 T N 0.253 114.737 114.554 -0.116 0.000 2.857 1256 T HA 0.009 4.359 4.350 -0.000 0.000 0.266 1256 T C 1.809 176.447 174.700 -0.104 0.000 1.048 1256 T CA 1.175 63.204 62.100 -0.118 0.000 1.139 1256 T CB -0.310 68.464 68.868 -0.157 0.000 0.874 1256 T HN 0.332 nan 8.240 nan 0.000 0.455 1257 L N 0.341 121.518 121.223 -0.076 0.000 2.083 1257 L HA -0.093 4.246 4.340 -0.000 0.000 0.209 1257 L C 2.867 179.741 176.870 0.008 0.000 1.083 1257 L CA 1.427 56.257 54.840 -0.016 0.000 0.752 1257 L CB -0.340 41.809 42.059 0.151 0.000 0.899 1257 L HN 0.186 nan 8.230 nan 0.000 0.433 1258 R N -0.526 119.959 120.500 -0.024 0.000 2.062 1258 R HA -0.022 4.317 4.340 -0.000 0.000 0.226 1258 R C 2.460 178.741 176.300 -0.032 0.000 1.125 1258 R CA 1.106 57.197 56.100 -0.015 0.000 0.966 1258 R CB -0.489 29.758 30.300 -0.089 0.000 0.861 1258 R HN 0.280 nan 8.270 nan 0.000 0.433 1259 A N 0.983 123.767 122.820 -0.060 0.000 1.940 1259 A HA -0.151 4.169 4.320 -0.000 0.000 0.219 1259 A C 1.795 179.357 177.584 -0.036 0.000 1.176 1259 A CA 1.419 53.425 52.037 -0.051 0.000 0.631 1259 A CB -0.262 18.698 19.000 -0.066 0.000 0.814 1259 A HN 0.111 nan 8.150 nan 0.000 0.446 1260 L N -0.618 120.572 121.223 -0.055 0.000 2.567 1260 L HA 0.135 4.475 4.340 -0.000 0.000 0.225 1260 L C 0.389 177.232 176.870 -0.045 0.000 1.119 1260 L CA 0.688 55.492 54.840 -0.060 0.000 0.871 1260 L CB -0.923 41.067 42.059 -0.115 0.000 1.036 1260 L HN 0.523 nan 8.230 nan 0.000 0.459 1261 E N -1.372 118.811 120.200 -0.029 0.000 2.297 1261 E HA -0.224 4.126 4.350 -0.000 0.000 0.228 1261 E C 1.337 177.900 176.600 -0.060 0.000 1.213 1261 E CA 0.280 56.676 56.400 -0.007 0.000 0.712 1261 E CB -1.587 28.126 29.700 0.021 0.000 1.202 1261 E HN 0.209 nan 8.360 nan 0.000 0.376 1262 V N -1.123 118.690 119.914 -0.170 0.000 2.261 1262 V HA -0.247 3.873 4.120 -0.000 0.000 0.246 1262 V C 1.672 177.486 176.094 -0.467 0.000 1.047 1262 V CA 2.496 64.549 62.300 -0.413 0.000 1.015 1262 V CB -0.349 31.055 31.823 -0.699 0.000 0.642 1262 V HN 0.412 nan 8.190 nan 0.000 0.446 1263 F N -1.255 118.690 119.950 -0.009 0.000 2.553 1263 F HA 0.312 4.839 4.527 -0.000 0.000 0.282 1263 F C 1.083 176.897 175.800 0.024 0.000 1.089 1263 F CA -0.103 57.878 58.000 -0.032 0.000 1.411 1263 F CB 0.616 39.524 39.000 -0.153 0.000 1.125 1263 F HN 0.069 nan 8.300 nan 0.000 0.610 1264 E N 1.549 121.866 120.200 0.196 0.000 2.248 1264 E HA 0.266 4.616 4.350 -0.000 0.000 0.267 1264 E C -2.496 174.160 176.600 0.093 0.000 0.877 1264 E CA -2.335 54.145 56.400 0.133 0.000 0.759 1264 E CB 2.202 31.973 29.700 0.119 0.000 1.182 1264 E HN -0.193 nan 8.360 nan 0.000 0.418 1265 P HA 0.120 nan 4.420 nan 0.000 0.276 1265 P C 0.082 177.404 177.300 0.036 0.000 1.244 1265 P CA -0.295 62.832 63.100 0.046 0.000 0.801 1265 P CB 1.016 32.739 31.700 0.037 0.000 1.006 1266 L N 0.933 122.170 121.223 0.022 0.000 2.777 1266 L HA 0.161 4.501 4.340 -0.000 0.000 0.244 1266 L C 0.506 177.381 176.870 0.008 0.000 1.235 1266 L CA -0.003 54.845 54.840 0.012 0.000 1.062 1266 L CB -1.042 41.017 42.059 0.001 0.000 1.340 1266 L HN 0.521 nan 8.230 nan 0.000 0.439 1267 R N 0.918 121.426 120.500 0.013 0.000 1.108 1267 R HA -0.027 4.313 4.340 -0.000 0.000 0.425 1267 R C -0.039 176.263 176.300 0.004 0.000 1.347 1267 R CA 0.539 56.645 56.100 0.009 0.000 1.080 1267 R CB -1.180 29.123 30.300 0.006 0.000 3.248 1267 R HN 0.577 nan 8.270 nan 0.000 0.507 1268 G N 2.976 111.779 108.800 0.004 0.000 3.035 1268 G HA2 0.041 4.001 3.960 -0.000 0.000 0.214 1268 G HA3 0.041 4.001 3.960 -0.000 0.000 0.214 1268 G C -0.307 174.594 174.900 0.001 0.000 1.063 1268 G CA 0.043 45.142 45.100 -0.002 0.000 1.109 1268 G HN 0.854 nan 8.290 nan 0.000 0.563 1269 Q N 0.136 119.939 119.800 0.005 0.000 2.523 1269 Q HA 0.185 4.525 4.340 -0.000 0.000 0.366 1269 Q C 0.608 176.613 176.000 0.009 0.000 1.485 1269 Q CA 2.423 58.232 55.803 0.010 0.000 1.034 1269 Q CB 0.097 28.839 28.738 0.007 0.000 1.296 1269 Q HN 1.127 nan 8.270 nan 0.000 0.486 1270 D N -0.945 119.465 120.400 0.016 0.000 7.320 1270 D HA -0.069 4.571 4.640 -0.000 0.000 0.246 1270 D C -1.028 175.292 176.300 0.033 0.000 2.057 1270 D CA 1.220 55.229 54.000 0.015 0.000 1.893 1270 D CB -0.891 39.907 40.800 -0.004 0.000 0.755 1270 D HN 0.721 nan 8.370 nan 0.000 0.463 1271 T N -0.899 113.687 114.554 0.053 0.000 2.940 1271 T HA 0.590 4.940 4.350 -0.000 0.000 0.288 1271 T C 1.076 175.816 174.700 0.066 0.000 1.045 1271 T CA -1.075 61.069 62.100 0.073 0.000 1.018 1271 T CB 1.648 70.597 68.868 0.135 0.000 1.151 1271 T HN 0.233 nan 8.240 nan 0.000 0.529 1272 L N 0.252 121.500 121.223 0.041 0.000 2.042 1272 L HA 0.092 4.432 4.340 -0.000 0.000 0.210 1272 L C 2.041 178.972 176.870 0.103 0.000 1.076 1272 L CA 1.769 56.624 54.840 0.024 0.000 0.749 1272 L CB -1.345 40.681 42.059 -0.056 0.000 0.893 1272 L HN 0.761 nan 8.230 nan 0.000 0.432 1273 F N 0.248 120.166 119.950 -0.054 0.000 2.102 1273 F HA -0.230 4.297 4.527 -0.000 0.000 0.298 1273 F C 2.828 178.651 175.800 0.038 0.000 1.105 1273 F CA 1.573 59.582 58.000 0.014 0.000 1.239 1273 F CB -0.884 38.184 39.000 0.114 0.000 0.991 1273 F HN 0.380 nan 8.300 nan 0.000 0.474 1274 S N -0.437 115.258 115.700 -0.008 0.000 2.356 1274 S HA -0.171 4.298 4.470 -0.000 0.000 0.223 1274 S C 2.164 176.701 174.600 -0.105 0.000 1.032 1274 S CA 1.529 59.655 58.200 -0.124 0.000 1.005 1274 S CB -1.319 61.866 63.200 -0.025 0.000 0.867 1274 S HN 0.177 nan 8.310 nan 0.000 0.449 1275 V N 2.104 121.999 119.914 -0.031 0.000 2.255 1275 V HA -0.135 3.985 4.120 -0.000 0.000 0.247 1275 V C 2.596 178.714 176.094 0.039 0.000 1.051 1275 V CA 2.063 64.362 62.300 -0.002 0.000 1.018 1275 V CB -0.804 31.021 31.823 0.003 0.000 0.641 1275 V HN 0.506 nan 8.190 nan 0.000 0.445 1276 L N -0.021 121.221 121.223 0.032 0.000 2.056 1276 L HA -0.057 4.283 4.340 -0.000 0.000 0.207 1276 L C 1.070 177.902 176.870 -0.062 0.000 1.078 1276 L CA 1.257 56.133 54.840 0.060 0.000 0.749 1276 L CB -0.356 41.772 42.059 0.116 0.000 0.901 1276 L HN 0.445 nan 8.230 nan 0.000 0.433 1277 D N 0.481 120.718 120.400 -0.271 0.000 2.434 1277 D HA -0.056 4.584 4.640 -0.000 0.000 0.252 1277 D C 0.173 176.333 176.300 -0.233 0.000 1.185 1277 D CA 0.680 54.438 54.000 -0.403 0.000 0.886 1277 D CB 0.915 41.160 40.800 -0.924 0.000 1.148 1277 D HN 0.060 nan 8.370 nan 0.000 0.483 1278 E N 1.510 121.605 120.200 -0.175 0.000 2.945 1278 E HA 0.098 4.448 4.350 -0.000 0.000 0.196 1278 E C -0.510 176.012 176.600 -0.130 0.000 0.965 1278 E CA -0.225 56.097 56.400 -0.130 0.000 1.270 1278 E CB 0.259 29.891 29.700 -0.113 0.000 1.045 1278 E HN 0.547 nan 8.360 nan 0.000 0.474 1279 T N -1.654 112.812 114.554 -0.148 0.000 2.813 1279 T HA 0.264 4.614 4.350 -0.000 0.000 0.297 1279 T C 1.038 175.677 174.700 -0.100 0.000 1.036 1279 T CA -0.477 61.541 62.100 -0.137 0.000 1.044 1279 T CB 1.388 70.166 68.868 -0.149 0.000 0.993 1279 T HN -0.095 nan 8.240 nan 0.000 0.535 1280 R N -0.015 120.432 120.500 -0.089 0.000 2.335 1280 R HA 0.204 4.544 4.340 -0.000 0.000 0.210 1280 R C 1.104 177.357 176.300 -0.079 0.000 0.892 1280 R CA 0.368 56.437 56.100 -0.052 0.000 1.048 1280 R CB 0.102 30.393 30.300 -0.015 0.000 1.067 1280 R HN 0.948 nan 8.270 nan 0.000 0.524 1281 T N -4.232 110.265 114.554 -0.094 0.000 2.916 1281 T HA 0.628 4.978 4.350 -0.000 0.000 0.292 1281 T C 1.062 175.704 174.700 -0.097 0.000 1.064 1281 T CA -0.209 61.833 62.100 -0.097 0.000 1.011 1281 T CB 2.372 71.185 68.868 -0.091 0.000 1.152 1281 T HN -0.065 nan 8.240 nan 0.000 0.510 1282 A N 1.007 123.772 122.820 -0.091 0.000 1.855 1282 A HA 0.234 4.554 4.320 -0.000 0.000 0.215 1282 A C -0.385 177.143 177.584 -0.094 0.000 1.191 1282 A CA 1.064 53.049 52.037 -0.086 0.000 0.613 1282 A CB -1.969 16.981 19.000 -0.083 0.000 0.829 1282 A HN 0.721 nan 8.150 nan 0.000 0.442 1283 P HA -0.156 nan 4.420 nan 0.000 0.217 1283 P C 1.714 178.933 177.300 -0.135 0.000 1.151 1283 P CA 1.884 64.922 63.100 -0.102 0.000 0.849 1283 P CB -0.309 31.339 31.700 -0.086 0.000 0.787 1284 G N -0.317 108.397 108.800 -0.143 0.000 2.433 1284 G HA2 -0.273 3.687 3.960 -0.000 0.000 0.216 1284 G HA3 -0.273 3.687 3.960 -0.000 0.000 0.216 1284 G C 1.742 176.535 174.900 -0.179 0.000 1.186 1284 G CA 0.528 45.514 45.100 -0.191 0.000 0.779 1284 G HN 0.173 nan 8.290 nan 0.000 0.543 1285 R N 0.117 120.551 120.500 -0.110 0.000 2.103 1285 R HA -0.074 4.266 4.340 -0.000 0.000 0.242 1285 R C 2.738 179.041 176.300 0.004 0.000 1.142 1285 R CA 1.578 57.666 56.100 -0.021 0.000 0.960 1285 R CB -0.216 30.080 30.300 -0.006 0.000 0.858 1285 R HN 0.256 nan 8.270 nan 0.000 0.439 1286 R N 0.006 120.459 120.500 -0.079 0.000 2.075 1286 R HA -0.128 4.212 4.340 -0.000 0.000 0.232 1286 R C 2.300 178.502 176.300 -0.163 0.000 1.126 1286 R CA 1.195 57.227 56.100 -0.114 0.000 0.963 1286 R CB -0.393 29.834 30.300 -0.121 0.000 0.858 1286 R HN 0.134 nan 8.270 nan 0.000 0.435 1287 L N 0.497 121.577 121.223 -0.238 0.000 1.989 1287 L HA -0.170 4.170 4.340 -0.000 0.000 0.211 1287 L C 1.976 178.465 176.870 -0.635 0.000 1.071 1287 L CA 1.634 56.224 54.840 -0.417 0.000 0.749 1287 L CB -0.710 41.036 42.059 -0.522 0.000 0.890 1287 L HN 0.207 nan 8.230 nan 0.000 0.431 1288 L N -0.635 120.274 121.223 -0.523 0.000 2.042 1288 L HA -0.257 4.083 4.340 -0.000 0.000 0.210 1288 L C 2.517 179.381 176.870 -0.010 0.000 1.076 1288 L CA 1.927 56.565 54.840 -0.338 0.000 0.749 1288 L CB -0.872 41.139 42.059 -0.079 0.000 0.893 1288 L HN 0.511 nan 8.230 nan 0.000 0.432 1289 Q N -1.298 118.500 119.800 -0.002 0.000 2.084 1289 Q HA -0.228 4.112 4.340 -0.000 0.000 0.202 1289 Q C 2.409 178.368 176.000 -0.068 0.000 0.978 1289 Q CA 1.861 57.573 55.803 -0.152 0.000 0.844 1289 Q CB -0.165 28.357 28.738 -0.360 0.000 0.898 1289 Q HN 0.654 nan 8.270 nan 0.000 0.426 1290 S N -0.513 115.142 115.700 -0.075 0.000 2.387 1290 S HA -0.170 4.300 4.470 -0.000 0.000 0.230 1290 S C 1.388 176.117 174.600 0.214 0.000 1.035 1290 S CA 1.301 59.512 58.200 0.019 0.000 1.014 1290 S CB -0.267 62.944 63.200 0.018 0.000 0.836 1290 S HN 0.514 nan 8.310 nan 0.000 0.466 1291 W N 1.400 122.698 121.300 -0.004 0.000 2.378 1291 W HA 0.185 4.845 4.660 -0.000 0.000 0.313 1291 W C 2.296 178.827 176.519 0.018 0.000 1.197 1291 W CA -0.105 57.253 57.345 0.022 0.000 1.304 1291 W CB -1.431 28.058 29.460 0.049 0.000 1.148 1291 W HN 0.290 nan 8.180 nan 0.000 0.494 1292 L N 0.032 121.425 121.223 0.284 0.000 2.079 1292 L HA -0.245 4.095 4.340 -0.000 0.000 0.210 1292 L C 2.733 179.639 176.870 0.060 0.000 1.081 1292 L CA 1.511 56.428 54.840 0.128 0.000 0.752 1292 L CB -0.599 41.498 42.059 0.064 0.000 0.896 1292 L HN -0.021 nan 8.230 nan 0.000 0.433 1293 R N -0.800 119.762 120.500 0.103 0.000 2.096 1293 R HA -0.119 4.221 4.340 -0.000 0.000 0.235 1293 R C -0.006 175.999 176.300 -0.492 0.000 1.127 1293 R CA 1.167 57.184 56.100 -0.138 0.000 0.968 1293 R CB 0.091 30.244 30.300 -0.245 0.000 0.861 1293 R HN 0.387 nan 8.270 nan 0.000 0.440 1294 H N -0.615 118.353 119.070 -0.170 0.000 2.569 1294 H HA 0.333 4.889 4.556 -0.000 0.000 0.247 1294 H C -2.459 172.830 175.328 -0.065 0.000 1.346 1294 H CA -2.027 53.849 56.048 -0.288 0.000 1.502 1294 H CB 1.353 30.554 29.762 -0.935 0.000 1.512 1294 H HN 0.126 nan 8.280 nan 0.000 0.502 1295 P HA -0.009 nan 4.420 nan 0.000 0.269 1295 P C -0.063 177.356 177.300 0.197 0.000 1.215 1295 P CA -0.059 63.109 63.100 0.113 0.000 0.780 1295 P CB 1.014 32.753 31.700 0.065 0.000 0.898 1296 L N 2.261 123.544 121.223 0.101 0.000 2.421 1296 L HA 0.276 4.616 4.340 -0.000 0.000 0.263 1296 L C 1.557 178.411 176.870 -0.026 0.000 1.122 1296 L CA -0.428 54.445 54.840 0.054 0.000 0.804 1296 L CB 0.348 42.379 42.059 -0.048 0.000 1.150 1296 L HN 0.383 nan 8.230 nan 0.000 0.457 1297 L N -0.656 120.524 121.223 -0.071 0.000 2.349 1297 L HA 0.132 4.472 4.340 -0.000 0.000 0.200 1297 L C 0.210 176.974 176.870 -0.177 0.000 1.064 1297 L CA 0.003 54.781 54.840 -0.104 0.000 0.821 1297 L CB 0.032 42.041 42.059 -0.082 0.000 1.027 1297 L HN 0.597 nan 8.230 nan 0.000 0.476 1298 D N 1.664 121.964 120.400 -0.167 0.000 2.450 1298 D HA -0.039 4.601 4.640 -0.000 0.000 0.247 1298 D C 1.004 177.157 176.300 -0.245 0.000 1.162 1298 D CA 0.186 54.080 54.000 -0.176 0.000 0.879 1298 D CB 1.340 42.060 40.800 -0.133 0.000 1.163 1298 D HN 0.163 nan 8.370 nan 0.000 0.472 1299 R N 2.570 122.905 120.500 -0.274 0.000 2.115 1299 R HA -0.093 4.247 4.340 -0.000 0.000 0.230 1299 R C 1.824 178.022 176.300 -0.171 0.000 1.111 1299 R CA 1.362 57.257 56.100 -0.341 0.000 0.976 1299 R CB -0.427 29.716 30.300 -0.262 0.000 0.870 1299 R HN 0.476 nan 8.270 nan 0.000 0.445 1300 G N 1.670 110.403 108.800 -0.112 0.000 2.587 1300 G HA2 -0.229 3.731 3.960 -0.000 0.000 0.217 1300 G HA3 -0.229 3.731 3.960 -0.000 0.000 0.217 1300 G C -0.876 173.991 174.900 -0.055 0.000 1.240 1300 G CA 0.828 45.891 45.100 -0.062 0.000 0.794 1300 G HN 0.366 nan 8.290 nan 0.000 0.580 1301 P HA -0.051 nan 4.420 nan 0.000 0.215 1301 P C 2.164 179.424 177.300 -0.066 0.000 1.157 1301 P CA 0.727 63.788 63.100 -0.065 0.000 0.868 1301 P CB -0.149 31.501 31.700 -0.084 0.000 0.788 1302 L N -0.819 120.344 121.223 -0.100 0.000 2.042 1302 L HA -0.227 4.113 4.340 -0.000 0.000 0.210 1302 L C 2.486 179.410 176.870 0.090 0.000 1.076 1302 L CA 1.608 56.421 54.840 -0.046 0.000 0.749 1302 L CB -0.747 41.202 42.059 -0.184 0.000 0.893 1302 L HN -0.046 nan 8.230 nan 0.000 0.432 1303 E N -0.277 119.975 120.200 0.087 0.000 2.150 1303 E HA -0.158 4.192 4.350 -0.000 0.000 0.193 1303 E C 2.084 178.727 176.600 0.072 0.000 0.985 1303 E CA 1.146 57.628 56.400 0.136 0.000 0.814 1303 E CB -0.035 29.730 29.700 0.108 0.000 0.752 1303 E HN 0.430 nan 8.360 nan 0.000 0.466 1304 A N 0.488 123.326 122.820 0.031 0.000 1.873 1304 A HA -0.154 4.166 4.320 -0.000 0.000 0.215 1304 A C 2.096 179.678 177.584 -0.002 0.000 1.186 1304 A CA 1.448 53.489 52.037 0.007 0.000 0.616 1304 A CB -0.339 18.664 19.000 0.005 0.000 0.823 1304 A HN 0.127 nan 8.150 nan 0.000 0.442 1305 R N -0.541 119.980 120.500 0.036 0.000 2.081 1305 R HA -0.039 4.301 4.340 -0.000 0.000 0.235 1305 R C 2.020 178.382 176.300 0.102 0.000 1.131 1305 R CA 1.456 57.617 56.100 0.102 0.000 0.960 1305 R CB -0.540 29.827 30.300 0.111 0.000 0.856 1305 R HN 0.492 nan 8.270 nan 0.000 0.436 1306 L N 0.624 121.941 121.223 0.156 0.000 2.131 1306 L HA -0.196 4.144 4.340 -0.000 0.000 0.210 1306 L C 1.795 178.758 176.870 0.155 0.000 1.092 1306 L CA 1.024 56.009 54.840 0.242 0.000 0.759 1306 L CB -0.398 41.822 42.059 0.268 0.000 0.903 1306 L HN 0.141 nan 8.230 nan 0.000 0.435 1307 D N -0.224 120.209 120.400 0.055 0.000 2.097 1307 D HA -0.143 4.497 4.640 -0.000 0.000 0.195 1307 D C 2.373 178.620 176.300 -0.089 0.000 0.989 1307 D CA 0.916 54.915 54.000 -0.002 0.000 0.827 1307 D CB -0.080 40.704 40.800 -0.027 0.000 0.966 1307 D HN 0.085 nan 8.370 nan 0.000 0.456 1308 R N 0.599 120.961 120.500 -0.231 0.000 2.091 1308 R HA -0.064 4.276 4.340 -0.000 0.000 0.238 1308 R C 2.459 178.623 176.300 -0.225 0.000 1.136 1308 R CA 0.320 56.153 56.100 -0.445 0.000 0.959 1308 R CB -1.193 28.344 30.300 -1.271 0.000 0.856 1308 R HN 0.182 nan 8.270 nan 0.000 0.437 1309 V N 1.093 120.949 119.914 -0.096 0.000 2.295 1309 V HA -0.231 3.889 4.120 -0.000 0.000 0.246 1309 V C 2.421 178.483 176.094 -0.054 0.000 1.049 1309 V CA 2.013 64.322 62.300 0.015 0.000 1.024 1309 V CB -0.468 31.302 31.823 -0.090 0.000 0.648 1309 V HN 0.385 nan 8.190 nan 0.000 0.447 1310 E N 0.128 120.330 120.200 0.003 0.000 2.110 1310 E HA -0.165 4.185 4.350 -0.000 0.000 0.193 1310 E C 2.280 178.879 176.600 -0.000 0.000 0.988 1310 E CA 1.210 57.660 56.400 0.084 0.000 0.804 1310 E CB -0.492 29.318 29.700 0.183 0.000 0.745 1310 E HN 0.578 nan 8.360 nan 0.000 0.458 1311 G N 0.481 109.228 108.800 -0.088 0.000 2.553 1311 G HA2 -0.302 3.658 3.960 -0.000 0.000 0.218 1311 G HA3 -0.302 3.658 3.960 -0.000 0.000 0.218 1311 G C 1.250 176.011 174.900 -0.233 0.000 1.195 1311 G CA 1.141 46.108 45.100 -0.220 0.000 0.779 1311 G HN 0.319 nan 8.290 nan 0.000 0.577 1312 F N 0.132 120.056 119.950 -0.044 0.000 2.407 1312 F HA 0.030 4.557 4.527 -0.000 0.000 0.299 1312 F C 2.719 178.488 175.800 -0.050 0.000 1.097 1312 F CA 0.233 58.210 58.000 -0.038 0.000 1.422 1312 F CB 0.009 38.992 39.000 -0.028 0.000 1.067 1312 F HN -0.017 nan 8.300 nan 0.000 0.539 1313 V N -0.030 119.937 119.914 0.088 0.000 2.515 1313 V HA -0.204 3.916 4.120 -0.000 0.000 0.250 1313 V C 2.353 178.476 176.094 0.048 0.000 1.058 1313 V CA 1.525 63.852 62.300 0.045 0.000 1.064 1313 V CB -0.455 31.395 31.823 0.046 0.000 0.675 1313 V HN 0.243 nan 8.190 nan 0.000 0.461 1314 R N 0.221 120.740 120.500 0.031 0.000 2.052 1314 R HA -0.026 4.314 4.340 -0.000 0.000 0.224 1314 R C 1.264 177.568 176.300 0.008 0.000 1.165 1314 R CA 0.670 56.778 56.100 0.013 0.000 0.939 1314 R CB -0.448 29.846 30.300 -0.010 0.000 0.834 1314 R HN 0.294 nan 8.270 nan 0.000 0.435 1315 E N 1.293 121.485 120.200 -0.014 0.000 2.950 1315 E HA 0.001 4.351 4.350 -0.000 0.000 0.312 1315 E C 1.029 177.663 176.600 0.056 0.000 1.258 1315 E CA -0.054 56.345 56.400 -0.003 0.000 1.363 1315 E CB -0.523 29.139 29.700 -0.063 0.000 1.109 1315 E HN 0.437 nan 8.360 nan 0.000 0.484 1316 G N 1.311 110.137 108.800 0.043 0.000 2.476 1316 G HA2 -0.356 3.604 3.960 -0.000 0.000 0.218 1316 G HA3 -0.356 3.604 3.960 -0.000 0.000 0.218 1316 G C 1.545 176.471 174.900 0.045 0.000 1.164 1316 G CA 0.789 45.915 45.100 0.044 0.000 0.768 1316 G HN 0.549 nan 8.290 nan 0.000 0.560 1317 A N 0.091 122.931 122.820 0.033 0.000 1.908 1317 A HA 0.017 4.337 4.320 -0.000 0.000 0.218 1317 A C 2.380 179.995 177.584 0.051 0.000 1.181 1317 A CA 1.786 53.840 52.037 0.029 0.000 0.627 1317 A CB -0.417 18.594 19.000 0.018 0.000 0.818 1317 A HN 0.393 nan 8.150 nan 0.000 0.445 1318 L N -0.492 120.777 121.223 0.077 0.000 2.023 1318 L HA -0.049 4.290 4.340 -0.000 0.000 0.205 1318 L C 2.489 179.484 176.870 0.207 0.000 1.073 1318 L CA 2.198 57.115 54.840 0.128 0.000 0.745 1318 L CB -0.714 41.411 42.059 0.109 0.000 0.900 1318 L HN 0.482 nan 8.230 nan 0.000 0.435 1319 R N -0.231 120.432 120.500 0.271 0.000 2.094 1319 R HA -0.222 4.118 4.340 -0.000 0.000 0.239 1319 R C 2.096 178.415 176.300 0.031 0.000 1.137 1319 R CA 2.257 58.478 56.100 0.201 0.000 0.943 1319 R CB -0.295 30.108 30.300 0.171 0.000 0.850 1319 R HN 0.523 nan 8.270 nan 0.000 0.433 1320 E N -1.209 119.006 120.200 0.025 0.000 2.153 1320 E HA -0.134 4.216 4.350 -0.000 0.000 0.194 1320 E C 1.880 178.476 176.600 -0.007 0.000 0.988 1320 E CA 1.039 57.432 56.400 -0.012 0.000 0.811 1320 E CB -0.155 29.536 29.700 -0.014 0.000 0.746 1320 E HN 0.615 nan 8.360 nan 0.000 0.466 1321 G N 0.878 109.691 108.800 0.021 0.000 2.448 1321 G HA2 -0.144 3.816 3.960 -0.000 0.000 0.218 1321 G HA3 -0.144 3.816 3.960 -0.000 0.000 0.218 1321 G C 1.699 176.613 174.900 0.023 0.000 1.135 1321 G CA 0.324 45.438 45.100 0.022 0.000 0.784 1321 G HN 0.107 nan 8.290 nan 0.000 0.543 1322 V N 0.283 120.213 119.914 0.027 0.000 2.535 1322 V HA -0.001 4.119 4.120 -0.000 0.000 0.246 1322 V C 2.741 178.815 176.094 -0.033 0.000 1.045 1322 V CA 1.224 63.529 62.300 0.008 0.000 1.058 1322 V CB -0.351 31.480 31.823 0.013 0.000 0.689 1322 V HN 0.240 nan 8.190 nan 0.000 0.461 1323 R N -0.285 120.179 120.500 -0.060 0.000 2.148 1323 R HA -0.026 4.314 4.340 -0.000 0.000 0.227 1323 R C 2.518 178.807 176.300 -0.018 0.000 1.103 1323 R CA 0.923 56.985 56.100 -0.063 0.000 0.983 1323 R CB -0.201 30.043 30.300 -0.094 0.000 0.874 1323 R HN 0.445 nan 8.270 nan 0.000 0.451 1324 R N 0.414 120.905 120.500 -0.015 0.000 2.057 1324 R HA -0.024 4.316 4.340 -0.000 0.000 0.229 1324 R C 2.265 178.593 176.300 0.046 0.000 1.136 1324 R CA 1.104 57.203 56.100 -0.002 0.000 0.952 1324 R CB -0.284 30.006 30.300 -0.017 0.000 0.848 1324 R HN 0.184 nan 8.270 nan 0.000 0.430 1325 L N 0.793 122.035 121.223 0.031 0.000 2.083 1325 L HA -0.173 4.167 4.340 -0.000 0.000 0.209 1325 L C 2.212 179.105 176.870 0.038 0.000 1.083 1325 L CA 1.105 55.965 54.840 0.034 0.000 0.752 1325 L CB -0.287 41.785 42.059 0.022 0.000 0.899 1325 L HN 0.215 nan 8.230 nan 0.000 0.433 1326 L N -1.562 119.678 121.223 0.028 0.000 2.478 1326 L HA -0.109 4.231 4.340 -0.000 0.000 0.223 1326 L C 0.699 177.587 176.870 0.031 0.000 1.140 1326 L CA -0.287 54.558 54.840 0.008 0.000 0.842 1326 L CB -0.430 41.615 42.059 -0.024 0.000 0.953 1326 L HN 0.148 nan 8.230 nan 0.000 0.452 1327 Y N 2.335 122.604 120.300 -0.053 0.000 2.804 1327 Y HA -0.109 4.441 4.550 -0.000 0.000 0.338 1327 Y C 1.171 177.044 175.900 -0.045 0.000 1.252 1327 Y CA -0.037 58.032 58.100 -0.052 0.000 1.576 1327 Y CB -0.251 38.182 38.460 -0.046 0.000 1.223 1327 Y HN 0.135 nan 8.280 nan 0.000 0.536 1328 R N 2.226 122.385 120.500 -0.568 0.000 3.977 1328 R HA -0.240 4.100 4.340 -0.000 0.000 0.428 1328 R C 0.033 176.188 176.300 -0.242 0.000 1.079 1328 R CA 0.733 56.530 56.100 -0.505 0.000 1.269 1328 R CB -1.577 28.304 30.300 -0.699 0.000 1.856 1328 R HN 0.614 nan 8.270 nan 0.000 0.551 1329 L N 1.901 123.031 121.223 -0.154 0.000 2.593 1329 L HA 0.117 4.457 4.340 -0.000 0.000 0.287 1329 L C 0.993 177.805 176.870 -0.097 0.000 1.243 1329 L CA 1.259 56.043 54.840 -0.094 0.000 0.890 1329 L CB 0.081 42.103 42.059 -0.061 0.000 1.134 1329 L HN 0.261 nan 8.230 nan 0.000 0.502 1330 A N 4.612 127.385 122.820 -0.078 0.000 2.387 1330 A HA 0.010 4.330 4.320 -0.000 0.000 0.251 1330 A C 0.288 177.832 177.584 -0.066 0.000 1.113 1330 A CA -0.250 51.744 52.037 -0.072 0.000 0.794 1330 A CB -0.031 18.935 19.000 -0.057 0.000 1.069 1330 A HN 0.808 nan 8.150 nan 0.000 0.506 1331 D N 0.962 121.324 120.400 -0.063 0.000 2.517 1331 D HA 0.190 4.829 4.640 -0.000 0.000 0.220 1331 D C 0.829 177.100 176.300 -0.047 0.000 1.158 1331 D CA -0.369 53.595 54.000 -0.060 0.000 0.992 1331 D CB -0.003 40.760 40.800 -0.063 0.000 1.058 1331 D HN 0.251 nan 8.370 nan 0.000 0.516 1332 L N 2.746 123.944 121.223 -0.042 0.000 2.129 1332 L HA -0.169 4.171 4.340 -0.000 0.000 0.212 1332 L C 2.214 179.067 176.870 -0.029 0.000 1.087 1332 L CA 1.483 56.304 54.840 -0.032 0.000 0.757 1332 L CB -0.850 41.193 42.059 -0.027 0.000 0.896 1332 L HN 0.511 nan 8.230 nan 0.000 0.434 1333 E N -0.466 119.714 120.200 -0.033 0.000 2.051 1333 E HA -0.222 4.128 4.350 -0.000 0.000 0.192 1333 E C 2.387 178.969 176.600 -0.030 0.000 0.991 1333 E CA 1.095 57.477 56.400 -0.029 0.000 0.799 1333 E CB 0.029 29.709 29.700 -0.034 0.000 0.748 1333 E HN 0.368 nan 8.360 nan 0.000 0.449 1334 R N 0.179 120.656 120.500 -0.038 0.000 2.081 1334 R HA -0.090 4.250 4.340 -0.000 0.000 0.235 1334 R C 2.643 178.926 176.300 -0.028 0.000 1.131 1334 R CA 1.165 57.242 56.100 -0.037 0.000 0.960 1334 R CB -0.369 29.903 30.300 -0.046 0.000 0.856 1334 R HN 0.269 nan 8.270 nan 0.000 0.436 1335 L N 0.360 121.566 121.223 -0.028 0.000 2.012 1335 L HA -0.239 4.101 4.340 -0.000 0.000 0.210 1335 L C 2.424 179.283 176.870 -0.019 0.000 1.073 1335 L CA 1.642 56.468 54.840 -0.023 0.000 0.748 1335 L CB -0.386 41.659 42.059 -0.024 0.000 0.891 1335 L HN 0.240 nan 8.230 nan 0.000 0.431 1336 A N -1.049 121.759 122.820 -0.019 0.000 1.892 1336 A HA -0.268 4.052 4.320 -0.000 0.000 0.218 1336 A C 2.254 179.829 177.584 -0.014 0.000 1.188 1336 A CA 2.574 54.601 52.037 -0.016 0.000 0.631 1336 A CB -1.217 17.775 19.000 -0.013 0.000 0.822 1336 A HN 0.502 nan 8.150 nan 0.000 0.447 1337 T N -0.334 114.211 114.554 -0.015 0.000 2.720 1337 T HA -0.163 4.187 4.350 -0.000 0.000 0.268 1337 T C 2.025 176.716 174.700 -0.014 0.000 1.037 1337 T CA 1.563 63.655 62.100 -0.015 0.000 1.144 1337 T CB -0.270 68.588 68.868 -0.018 0.000 0.864 1337 T HN 0.506 nan 8.240 nan 0.000 0.444 1338 R N 0.397 120.890 120.500 -0.012 0.000 2.096 1338 R HA 0.057 4.397 4.340 -0.000 0.000 0.235 1338 R C 2.478 178.775 176.300 -0.004 0.000 1.127 1338 R CA 0.934 57.030 56.100 -0.006 0.000 0.968 1338 R CB -0.536 29.762 30.300 -0.002 0.000 0.861 1338 R HN 0.376 nan 8.270 nan 0.000 0.440 1339 L N 0.650 121.867 121.223 -0.010 0.000 2.027 1339 L HA -0.176 4.164 4.340 -0.000 0.000 0.206 1339 L C 2.197 179.057 176.870 -0.016 0.000 1.074 1339 L CA 1.492 56.322 54.840 -0.017 0.000 0.745 1339 L CB -0.375 41.669 42.059 -0.026 0.000 0.898 1339 L HN 0.217 nan 8.230 nan 0.000 0.433 1340 E N 0.144 120.335 120.200 -0.014 0.000 2.118 1340 E HA -0.217 4.133 4.350 -0.000 0.000 0.195 1340 E C 2.148 178.742 176.600 -0.011 0.000 0.992 1340 E CA 1.037 57.430 56.400 -0.012 0.000 0.804 1340 E CB -0.131 29.563 29.700 -0.010 0.000 0.741 1340 E HN 0.470 nan 8.360 nan 0.000 0.458 1341 L N -0.201 121.015 121.223 -0.010 0.000 2.552 1341 L HA 0.074 4.414 4.340 -0.000 0.000 0.227 1341 L C 1.211 178.079 176.870 -0.003 0.000 1.146 1341 L CA 0.349 55.183 54.840 -0.009 0.000 0.858 1341 L CB -0.255 41.798 42.059 -0.010 0.000 0.969 1341 L HN 0.295 nan 8.230 nan 0.000 0.451 1342 G N 0.851 109.651 108.800 -0.001 0.000 2.225 1342 G HA2 -0.298 3.662 3.960 -0.000 0.000 0.264 1342 G HA3 -0.298 3.662 3.960 -0.000 0.000 0.264 1342 G C 0.768 175.682 174.900 0.023 0.000 1.060 1342 G CA 0.145 45.249 45.100 0.007 0.000 0.833 1342 G HN 0.444 nan 8.290 nan 0.000 0.498 1343 R N -0.527 119.987 120.500 0.023 0.000 2.476 1343 R HA 0.455 4.794 4.340 -0.000 0.000 0.276 1343 R C 1.398 177.729 176.300 0.051 0.000 0.941 1343 R CA 0.336 56.458 56.100 0.035 0.000 1.088 1343 R CB 0.667 30.980 30.300 0.022 0.000 1.216 1343 R HN 0.642 nan 8.270 nan 0.000 0.533 1344 A N 2.188 125.038 122.820 0.050 0.000 2.548 1344 A HA 0.124 4.444 4.320 -0.000 0.000 0.247 1344 A C 0.676 178.348 177.584 0.147 0.000 1.067 1344 A CA 0.128 52.205 52.037 0.066 0.000 0.757 1344 A CB 0.156 19.175 19.000 0.032 0.000 0.996 1344 A HN 0.317 nan 8.150 nan 0.000 0.504 1345 S N 2.765 118.539 115.700 0.122 0.000 2.652 1345 S HA 0.492 4.962 4.470 -0.000 0.000 0.270 1345 S C -1.982 172.741 174.600 0.205 0.000 1.243 1345 S CA -1.040 57.239 58.200 0.133 0.000 0.999 1345 S CB 0.920 64.150 63.200 0.050 0.000 0.973 1345 S HN 0.399 nan 8.310 nan 0.000 0.544 1346 P HA -0.069 nan 4.420 nan 0.000 0.217 1346 P C 1.412 178.778 177.300 0.110 0.000 1.150 1346 P CA 1.055 64.293 63.100 0.230 0.000 0.832 1346 P CB 0.054 31.707 31.700 -0.078 0.000 0.787 1347 K N -0.099 120.325 120.400 0.040 0.000 2.152 1347 K HA -0.202 4.118 4.320 -0.000 0.000 0.206 1347 K C 1.545 178.160 176.600 0.024 0.000 1.048 1347 K CA 1.582 57.880 56.287 0.018 0.000 0.933 1347 K CB -0.499 32.001 32.500 -0.001 0.000 0.721 1347 K HN 0.062 nan 8.250 nan 0.000 0.447 1348 D N 0.918 121.342 120.400 0.041 0.000 2.084 1348 D HA -0.160 4.480 4.640 -0.000 0.000 0.194 1348 D C 2.043 178.356 176.300 0.022 0.000 0.990 1348 D CA 1.037 55.053 54.000 0.027 0.000 0.826 1348 D CB -0.147 40.674 40.800 0.034 0.000 0.971 1348 D HN 0.227 nan 8.370 nan 0.000 0.453 1349 L N 0.671 121.921 121.223 0.044 0.000 2.129 1349 L HA -0.145 4.195 4.340 -0.000 0.000 0.212 1349 L C 2.554 179.427 176.870 0.006 0.000 1.087 1349 L CA 1.331 56.181 54.840 0.016 0.000 0.757 1349 L CB -0.679 41.393 42.059 0.022 0.000 0.896 1349 L HN 0.091 nan 8.230 nan 0.000 0.434 1350 G N -0.608 108.202 108.800 0.017 0.000 2.402 1350 G HA2 -0.176 3.784 3.960 -0.000 0.000 0.216 1350 G HA3 -0.176 3.784 3.960 -0.000 0.000 0.216 1350 G C 1.783 176.677 174.900 -0.009 0.000 1.162 1350 G CA 0.696 45.797 45.100 0.002 0.000 0.777 1350 G HN 0.459 nan 8.290 nan 0.000 0.539 1351 A N 0.489 123.303 122.820 -0.010 0.000 1.933 1351 A HA 0.076 4.396 4.320 -0.000 0.000 0.218 1351 A C 2.332 179.903 177.584 -0.022 0.000 1.175 1351 A CA 1.642 53.666 52.037 -0.021 0.000 0.628 1351 A CB -0.420 18.566 19.000 -0.025 0.000 0.814 1351 A HN 0.451 nan 8.150 nan 0.000 0.444 1352 L N 0.944 122.156 121.223 -0.018 0.000 2.012 1352 L HA -0.205 4.135 4.340 -0.000 0.000 0.210 1352 L C 2.582 179.441 176.870 -0.019 0.000 1.073 1352 L CA 2.738 57.566 54.840 -0.020 0.000 0.748 1352 L CB -0.709 41.337 42.059 -0.021 0.000 0.891 1352 L HN 0.584 nan 8.230 nan 0.000 0.431 1353 R N -0.883 119.606 120.500 -0.017 0.000 2.096 1353 R HA -0.171 4.169 4.340 -0.000 0.000 0.235 1353 R C 2.408 178.700 176.300 -0.013 0.000 1.127 1353 R CA 1.381 57.472 56.100 -0.015 0.000 0.968 1353 R CB -0.849 29.442 30.300 -0.016 0.000 0.861 1353 R HN 0.257 nan 8.270 nan 0.000 0.440 1354 R N 1.045 121.537 120.500 -0.015 0.000 2.083 1354 R HA -0.061 4.279 4.340 -0.000 0.000 0.237 1354 R C 1.937 178.228 176.300 -0.015 0.000 1.137 1354 R CA 2.219 58.310 56.100 -0.015 0.000 0.951 1354 R CB -0.548 29.739 30.300 -0.020 0.000 0.851 1354 R HN 0.396 nan 8.270 nan 0.000 0.434 1355 S N 1.326 117.014 115.700 -0.020 0.000 2.368 1355 S HA -0.097 4.373 4.470 -0.000 0.000 0.225 1355 S C 2.049 176.641 174.600 -0.013 0.000 1.030 1355 S CA 1.199 59.387 58.200 -0.021 0.000 0.999 1355 S CB -0.229 62.955 63.200 -0.026 0.000 0.844 1355 S HN 0.304 nan 8.310 nan 0.000 0.459 1356 L N 1.302 122.518 121.223 -0.011 0.000 2.131 1356 L HA -0.173 4.167 4.340 -0.000 0.000 0.210 1356 L C 2.686 179.555 176.870 -0.002 0.000 1.092 1356 L CA 1.140 55.977 54.840 -0.006 0.000 0.759 1356 L CB -0.549 41.506 42.059 -0.007 0.000 0.903 1356 L HN 0.401 nan 8.230 nan 0.000 0.435 1357 Q N -0.271 119.528 119.800 -0.003 0.000 2.119 1357 Q HA -0.179 4.161 4.340 -0.000 0.000 0.201 1357 Q C 2.272 178.274 176.000 0.003 0.000 0.972 1357 Q CA 1.300 57.103 55.803 0.001 0.000 0.847 1357 Q CB -0.003 28.736 28.738 0.001 0.000 0.903 1357 Q HN 0.542 nan 8.270 nan 0.000 0.433 1358 I N 0.197 120.768 120.570 0.001 0.000 2.617 1358 I HA -0.208 3.962 4.170 -0.000 0.000 0.256 1358 I C 1.996 178.117 176.117 0.007 0.000 1.167 1358 I CA 0.147 61.450 61.300 0.005 0.000 1.469 1358 I CB 0.099 38.100 38.000 0.002 0.000 1.098 1358 I HN 0.200 nan 8.210 nan 0.000 0.436 1359 L N 1.881 123.106 121.223 0.004 0.000 2.013 1359 L HA -0.177 4.163 4.340 -0.000 0.000 0.212 1359 L C -0.548 176.329 176.870 0.012 0.000 1.073 1359 L CA 2.494 57.339 54.840 0.007 0.000 0.753 1359 L CB -1.553 40.510 42.059 0.005 0.000 0.890 1359 L HN 0.098 nan 8.230 nan 0.000 0.432 1360 P HA -0.190 nan 4.420 nan 0.000 0.216 1360 P C 1.290 178.599 177.300 0.015 0.000 1.150 1360 P CA 1.574 64.681 63.100 0.013 0.000 0.843 1360 P CB -0.003 31.703 31.700 0.011 0.000 0.787 1361 E N -0.806 119.403 120.200 0.015 0.000 2.072 1361 E HA -0.120 4.230 4.350 -0.000 0.000 0.191 1361 E C 2.011 178.624 176.600 0.022 0.000 0.985 1361 E CA 0.798 57.208 56.400 0.017 0.000 0.801 1361 E CB -0.605 29.105 29.700 0.016 0.000 0.750 1361 E HN 0.222 nan 8.360 nan 0.000 0.452 1362 L N 0.639 121.876 121.223 0.023 0.000 2.083 1362 L HA -0.176 4.164 4.340 -0.000 0.000 0.209 1362 L C 2.737 179.629 176.870 0.036 0.000 1.083 1362 L CA 1.024 55.883 54.840 0.032 0.000 0.752 1362 L CB -0.279 41.798 42.059 0.029 0.000 0.899 1362 L HN 0.072 nan 8.230 nan 0.000 0.433 1363 R N 0.059 120.577 120.500 0.029 0.000 2.115 1363 R HA -0.141 4.199 4.340 -0.000 0.000 0.230 1363 R C 2.229 178.545 176.300 0.027 0.000 1.111 1363 R CA 1.160 57.278 56.100 0.029 0.000 0.976 1363 R CB -0.114 30.200 30.300 0.024 0.000 0.870 1363 R HN 0.355 nan 8.270 nan 0.000 0.445 1364 A N 1.413 124.247 122.820 0.023 0.000 1.845 1364 A HA -0.171 4.149 4.320 -0.000 0.000 0.215 1364 A C 2.206 179.804 177.584 0.023 0.000 1.195 1364 A CA 1.098 53.147 52.037 0.020 0.000 0.616 1364 A CB -0.730 18.281 19.000 0.018 0.000 0.832 1364 A HN 0.338 nan 8.150 nan 0.000 0.443 1365 L N -0.647 120.594 121.223 0.030 0.000 1.990 1365 L HA -0.239 4.101 4.340 -0.000 0.000 0.213 1365 L C 2.649 179.543 176.870 0.040 0.000 1.072 1365 L CA 1.696 56.558 54.840 0.037 0.000 0.755 1365 L CB -0.419 41.670 42.059 0.049 0.000 0.889 1365 L HN 0.452 nan 8.230 nan 0.000 0.432 1366 L N -1.434 119.819 121.223 0.049 0.000 2.013 1366 L HA 0.190 4.530 4.340 -0.000 0.000 0.204 1366 L C 1.037 177.924 176.870 0.029 0.000 1.081 1366 L CA 0.701 55.570 54.840 0.049 0.000 0.751 1366 L CB -0.923 41.178 42.059 0.071 0.000 0.901 1366 L HN 0.410 nan 8.230 nan 0.000 0.440 1367 G N -0.525 108.292 108.800 0.029 0.000 2.497 1367 G HA2 -0.182 3.778 3.960 -0.000 0.000 0.686 1367 G HA3 -0.182 3.778 3.960 -0.000 0.000 0.686 1367 G C 0.145 175.059 174.900 0.023 0.000 1.288 1367 G CA -0.010 45.103 45.100 0.021 0.000 0.899 1367 G HN 0.317 nan 8.290 nan 0.000 0.608 1368 E N -0.138 120.073 120.200 0.018 0.000 2.253 1368 E HA -0.253 4.097 4.350 -0.000 0.000 0.202 1368 E C 1.924 178.537 176.600 0.022 0.000 1.014 1368 E CA 2.391 58.803 56.400 0.019 0.000 0.823 1368 E CB -0.121 29.587 29.700 0.015 0.000 0.736 1368 E HN 0.689 nan 8.360 nan 0.000 0.478 1369 E N -0.163 120.048 120.200 0.019 0.000 2.065 1369 E HA -0.252 4.098 4.350 -0.000 0.000 0.201 1369 E C 2.206 178.826 176.600 0.033 0.000 1.016 1369 E CA 1.837 58.250 56.400 0.020 0.000 0.818 1369 E CB -0.196 29.511 29.700 0.011 0.000 0.749 1369 E HN 0.192 nan 8.360 nan 0.000 0.453 1370 V N -0.134 119.805 119.914 0.041 0.000 2.252 1370 V HA -0.246 3.874 4.120 -0.000 0.000 0.249 1370 V C 1.816 177.942 176.094 0.053 0.000 1.056 1370 V CA 1.986 64.320 62.300 0.058 0.000 1.022 1370 V CB -0.960 30.902 31.823 0.066 0.000 0.641 1370 V HN 0.706 nan 8.190 nan 0.000 0.445 1371 G N -1.001 107.824 108.800 0.042 0.000 2.134 1371 G HA2 -0.202 3.758 3.960 -0.000 0.000 0.209 1371 G HA3 -0.202 3.758 3.960 -0.000 0.000 0.209 1371 G C -0.015 174.906 174.900 0.035 0.000 0.993 1371 G CA 0.070 45.192 45.100 0.037 0.000 0.669 1371 G HN 0.428 nan 8.290 nan 0.000 0.519 1372 L N 0.860 122.104 121.223 0.035 0.000 2.483 1372 L HA 0.329 4.669 4.340 -0.000 0.000 0.276 1372 L C -1.395 175.488 176.870 0.023 0.000 1.213 1372 L CA -1.324 53.534 54.840 0.029 0.000 0.843 1372 L CB 0.217 42.293 42.059 0.028 0.000 1.107 1372 L HN 0.009 nan 8.230 nan 0.000 0.487 1373 P HA 0.130 nan 4.420 nan 0.000 0.282 1373 P C -1.220 176.088 177.300 0.013 0.000 1.249 1373 P CA -0.525 62.585 63.100 0.016 0.000 0.806 1373 P CB 0.685 32.393 31.700 0.014 0.000 0.984 1374 D N 2.141 122.548 120.400 0.012 0.000 2.352 1374 D HA 0.100 4.740 4.640 -0.000 0.000 0.245 1374 D C 0.043 176.348 176.300 0.009 0.000 1.224 1374 D CA 0.146 54.152 54.000 0.011 0.000 0.879 1374 D CB 0.028 40.835 40.800 0.011 0.000 1.057 1374 D HN 0.232 nan 8.370 nan 0.000 0.491 1375 L N 2.963 124.190 121.223 0.007 0.000 2.910 1375 L HA 0.061 4.401 4.340 -0.000 0.000 0.252 1375 L C 2.112 178.985 176.870 0.005 0.000 1.195 1375 L CA -0.126 54.717 54.840 0.005 0.000 1.003 1375 L CB -0.010 42.050 42.059 0.002 0.000 1.328 1375 L HN 0.374 nan 8.230 nan 0.000 0.540 1376 S N 0.233 115.937 115.700 0.007 0.000 2.380 1376 S HA -0.141 4.329 4.470 -0.000 0.000 0.229 1376 S C -0.590 174.016 174.600 0.010 0.000 1.043 1376 S CA 1.159 59.364 58.200 0.008 0.000 1.038 1376 S CB -1.501 61.704 63.200 0.009 0.000 0.872 1376 S HN 0.241 nan 8.310 nan 0.000 0.456 1377 P HA -0.038 nan 4.420 nan 0.000 0.215 1377 P C 1.853 179.161 177.300 0.013 0.000 1.157 1377 P CA 0.772 63.879 63.100 0.012 0.000 0.868 1377 P CB -0.146 31.560 31.700 0.010 0.000 0.788 1378 L N -0.041 121.186 121.223 0.006 0.000 2.046 1378 L HA -0.185 4.155 4.340 -0.000 0.000 0.208 1378 L C 2.367 179.237 176.870 0.000 0.000 1.077 1378 L CA 1.834 56.675 54.840 0.000 0.000 0.747 1378 L CB -0.498 41.557 42.059 -0.007 0.000 0.896 1378 L HN -0.026 nan 8.230 nan 0.000 0.432 1379 K N 0.067 120.469 120.400 0.002 0.000 2.148 1379 K HA -0.211 4.109 4.320 -0.000 0.000 0.204 1379 K C 1.667 178.272 176.600 0.009 0.000 1.050 1379 K CA 1.530 57.818 56.287 0.002 0.000 0.942 1379 K CB 0.032 32.534 32.500 0.003 0.000 0.724 1379 K HN 0.428 nan 8.250 nan 0.000 0.446 1380 E N 0.298 120.509 120.200 0.017 0.000 2.072 1380 E HA -0.129 4.221 4.350 -0.000 0.000 0.190 1380 E C 1.996 178.623 176.600 0.045 0.000 0.982 1380 E CA 0.632 57.049 56.400 0.029 0.000 0.803 1380 E CB 0.114 29.831 29.700 0.029 0.000 0.755 1380 E HN 0.279 nan 8.360 nan 0.000 0.453 1381 E N 0.978 121.205 120.200 0.045 0.000 2.023 1381 E HA -0.171 4.179 4.350 -0.000 0.000 0.196 1381 E C 2.247 178.859 176.600 0.020 0.000 1.003 1381 E CA 0.917 57.360 56.400 0.072 0.000 0.809 1381 E CB -0.251 29.481 29.700 0.053 0.000 0.755 1381 E HN 0.271 nan 8.360 nan 0.000 0.449 1382 L N 0.826 122.039 121.223 -0.017 0.000 2.187 1382 L HA -0.193 4.146 4.340 -0.000 0.000 0.213 1382 L C 2.220 179.065 176.870 -0.041 0.000 1.100 1382 L CA 1.139 55.949 54.840 -0.051 0.000 0.765 1382 L CB -0.353 41.684 42.059 -0.038 0.000 0.904 1382 L HN 0.126 nan 8.230 nan 0.000 0.437 1383 E N -0.131 120.065 120.200 -0.007 0.000 2.285 1383 E HA -0.083 4.267 4.350 -0.000 0.000 0.194 1383 E C 2.207 178.819 176.600 0.020 0.000 0.997 1383 E CA 0.803 57.206 56.400 0.004 0.000 0.845 1383 E CB 0.016 29.726 29.700 0.016 0.000 0.782 1383 E HN 0.499 nan 8.360 nan 0.000 0.491 1384 A N 0.877 123.728 122.820 0.051 0.000 2.030 1384 A HA 0.215 4.535 4.320 -0.000 0.000 0.215 1384 A C 2.143 179.775 177.584 0.081 0.000 1.164 1384 A CA 1.081 53.212 52.037 0.156 0.000 0.697 1384 A CB 0.069 19.247 19.000 0.296 0.000 0.827 1384 A HN 0.239 nan 8.150 nan 0.000 0.457 1385 A N -0.896 121.731 122.820 -0.321 0.000 2.035 1385 A HA 0.510 4.830 4.320 -0.000 0.000 0.208 1385 A C 0.801 178.172 177.584 -0.354 0.000 1.206 1385 A CA -0.023 51.511 52.037 -0.839 0.000 0.773 1385 A CB -0.060 18.123 19.000 -1.363 0.000 0.878 1385 A HN 0.345 nan 8.150 nan 0.000 0.469 1386 L N 1.113 122.226 121.223 -0.183 0.000 2.357 1386 L HA 0.375 4.715 4.340 -0.000 0.000 0.273 1386 L C -0.169 176.676 176.870 -0.042 0.000 1.080 1386 L CA -0.903 53.888 54.840 -0.082 0.000 0.803 1386 L CB 1.586 43.617 42.059 -0.045 0.000 1.174 1386 L HN -0.014 nan 8.230 nan 0.000 0.443 1387 V N 1.445 121.345 119.914 -0.022 0.000 3.051 1387 V HA -0.041 4.079 4.120 -0.000 0.000 0.306 1387 V C 0.999 177.088 176.094 -0.008 0.000 1.083 1387 V CA -0.259 62.035 62.300 -0.010 0.000 1.104 1387 V CB 0.643 32.461 31.823 -0.007 0.000 1.027 1387 V HN 0.782 nan 8.190 nan 0.000 0.483 1388 E N 1.899 122.097 120.200 -0.003 0.000 2.352 1388 E HA 0.000 4.350 4.350 -0.000 0.000 0.197 1388 E C 0.007 176.604 176.600 -0.005 0.000 1.224 1388 E CA 0.372 56.770 56.400 -0.003 0.000 1.118 1388 E CB -0.136 29.564 29.700 0.001 0.000 1.198 1388 E HN 0.658 nan 8.360 nan 0.000 0.454 1389 D N 0.293 120.688 120.400 -0.007 0.000 4.100 1389 D HA -0.007 4.633 4.640 -0.000 0.000 0.215 1389 D C -2.720 173.573 176.300 -0.012 0.000 1.464 1389 D CA -0.739 53.255 54.000 -0.009 0.000 1.161 1389 D CB 0.271 41.066 40.800 -0.009 0.000 1.250 1389 D HN -0.030 nan 8.370 nan 0.000 0.864 1390 P HA 0.149 nan 4.420 nan 0.000 0.266 1390 P C -2.653 174.632 177.300 -0.026 0.000 1.186 1390 P CA -0.557 62.535 63.100 -0.013 0.000 0.767 1390 P CB 0.146 31.854 31.700 0.012 0.000 0.820 1391 P HA 0.157 nan 4.420 nan 0.000 0.253 1391 P C 0.409 177.658 177.300 -0.083 0.000 1.599 1391 P CA -0.698 62.370 63.100 -0.054 0.000 1.189 1391 P CB 1.228 32.898 31.700 -0.050 0.000 1.347 1392 L N 4.643 125.823 121.223 -0.072 0.000 2.131 1392 L HA -0.142 4.198 4.340 -0.000 0.000 0.210 1392 L C 1.844 178.662 176.870 -0.087 0.000 1.092 1392 L CA 2.078 56.863 54.840 -0.092 0.000 0.759 1392 L CB -0.614 41.417 42.059 -0.047 0.000 0.903 1392 L HN 0.114 nan 8.230 nan 0.000 0.435 1393 K N -0.738 119.626 120.400 -0.061 0.000 2.044 1393 K HA 0.106 4.426 4.320 -0.000 0.000 0.204 1393 K C 0.860 177.424 176.600 -0.061 0.000 1.049 1393 K CA 0.871 57.126 56.287 -0.053 0.000 0.945 1393 K CB -0.255 32.223 32.500 -0.036 0.000 0.724 1393 K HN 0.150 nan 8.250 nan 0.000 0.440 1394 V N 2.887 122.766 119.914 -0.060 0.000 2.220 1394 V HA -0.098 4.022 4.120 -0.000 0.000 0.236 1394 V C 1.029 177.084 176.094 -0.066 0.000 1.314 1394 V CA 0.792 63.059 62.300 -0.055 0.000 1.349 1394 V CB -1.331 30.466 31.823 -0.044 0.000 1.428 1394 V HN 0.572 nan 8.190 nan 0.000 0.495 1395 S N 2.752 118.411 115.700 -0.068 0.000 4.112 1395 S HA -0.376 4.094 4.470 -0.000 0.000 0.265 1395 S C 1.096 175.634 174.600 -0.104 0.000 1.845 1395 S CA 2.443 60.600 58.200 -0.072 0.000 4.199 1395 S CB -0.826 62.341 63.200 -0.055 0.000 0.291 1395 S HN 1.028 nan 8.310 nan 0.000 0.455 1396 E N -0.180 119.946 120.200 -0.123 0.000 2.570 1396 E HA 0.148 4.498 4.350 -0.000 0.000 0.249 1396 E C -0.117 176.395 176.600 -0.147 0.000 0.562 1396 E CA 1.171 57.456 56.400 -0.191 0.000 1.134 1396 E CB -1.037 28.539 29.700 -0.206 0.000 3.854 1396 E HN 1.008 nan 8.360 nan 0.000 0.490 1397 G N -0.803 107.941 108.800 -0.094 0.000 2.511 1397 G HA2 0.509 4.469 3.960 -0.000 0.000 0.316 1397 G HA3 0.509 4.469 3.960 -0.000 0.000 0.316 1397 G C 0.849 175.717 174.900 -0.052 0.000 1.210 1397 G CA 0.035 45.097 45.100 -0.064 0.000 0.969 1397 G HN 0.857 nan 8.290 nan 0.000 0.492 1398 G N -1.343 107.437 108.800 -0.033 0.000 2.249 1398 G HA2 -0.161 3.799 3.960 -0.000 0.000 0.273 1398 G HA3 -0.161 3.799 3.960 -0.000 0.000 0.273 1398 G C 0.744 175.628 174.900 -0.027 0.000 1.036 1398 G CA 0.925 46.012 45.100 -0.021 0.000 0.824 1398 G HN 1.109 nan 8.290 nan 0.000 0.504 1399 L N -0.675 120.528 121.223 -0.032 0.000 2.347 1399 L HA 0.530 4.870 4.340 -0.000 0.000 0.196 1399 L C 1.176 178.042 176.870 -0.006 0.000 1.072 1399 L CA 0.606 55.426 54.840 -0.032 0.000 0.817 1399 L CB 0.124 42.138 42.059 -0.075 0.000 1.029 1399 L HN 0.169 nan 8.230 nan 0.000 0.478 1400 I N 2.346 122.919 120.570 0.004 0.000 2.365 1400 I HA 0.239 4.409 4.170 -0.000 0.000 0.291 1400 I C 0.439 176.566 176.117 0.017 0.000 1.004 1400 I CA -0.285 61.013 61.300 -0.004 0.000 1.311 1400 I CB 0.925 38.946 38.000 0.035 0.000 1.401 1400 I HN 0.383 nan 8.210 nan 0.000 0.491 1401 R N 4.415 124.922 120.500 0.012 0.000 2.637 1401 R HA 0.339 4.679 4.340 -0.000 0.000 0.269 1401 R C -0.162 176.190 176.300 0.086 0.000 1.089 1401 R CA -0.726 55.400 56.100 0.042 0.000 1.177 1401 R CB 0.843 31.164 30.300 0.035 0.000 1.091 1401 R HN 0.369 nan 8.270 nan 0.000 0.540 1402 E N 0.173 120.415 120.200 0.070 0.000 2.415 1402 E HA 0.072 4.422 4.350 -0.000 0.000 0.262 1402 E C 0.933 177.586 176.600 0.088 0.000 1.038 1402 E CA 1.249 57.693 56.400 0.072 0.000 0.921 1402 E CB 0.814 30.544 29.700 0.051 0.000 0.950 1402 E HN 0.893 nan 8.360 nan 0.000 0.438 1403 G N 2.170 111.016 108.800 0.076 0.000 2.168 1403 G HA2 -0.375 3.585 3.960 -0.000 0.000 0.263 1403 G HA3 -0.375 3.585 3.960 -0.000 0.000 0.263 1403 G C 0.630 175.572 174.900 0.069 0.000 0.977 1403 G CA 0.907 46.042 45.100 0.058 0.000 0.659 1403 G HN 0.613 nan 8.290 nan 0.000 0.533 1404 Y N 0.867 121.175 120.300 0.013 0.000 2.301 1404 Y HA 0.404 4.954 4.550 -0.000 0.000 0.295 1404 Y C 1.047 176.954 175.900 0.011 0.000 1.126 1404 Y CA 1.149 59.256 58.100 0.012 0.000 1.154 1404 Y CB 0.570 39.040 38.460 0.017 0.000 1.075 1404 Y HN 0.258 nan 8.280 nan 0.000 0.534 1405 D N 0.788 121.200 120.400 0.020 0.000 2.549 1405 D HA 0.234 4.874 4.640 -0.000 0.000 0.251 1405 D C -1.953 174.345 176.300 -0.002 0.000 1.153 1405 D CA -2.502 51.477 54.000 -0.036 0.000 0.861 1405 D CB 1.775 42.651 40.800 0.127 0.000 1.207 1405 D HN -0.024 nan 8.370 nan 0.000 0.543 1406 P HA -0.165 nan 4.420 nan 0.000 0.215 1406 P C 0.591 177.893 177.300 0.003 0.000 1.157 1406 P CA 1.064 64.155 63.100 -0.015 0.000 0.868 1406 P CB 0.422 32.104 31.700 -0.030 0.000 0.788 1407 D N 0.052 120.454 120.400 0.005 0.000 2.106 1407 D HA -0.164 4.476 4.640 -0.000 0.000 0.191 1407 D C 2.130 178.445 176.300 0.025 0.000 0.997 1407 D CA 1.062 55.071 54.000 0.014 0.000 0.834 1407 D CB -0.682 40.127 40.800 0.016 0.000 0.956 1407 D HN 0.083 nan 8.370 nan 0.000 0.448 1408 L N 1.577 122.823 121.223 0.039 0.000 2.046 1408 L HA -0.168 4.171 4.340 -0.000 0.000 0.208 1408 L C 1.521 178.416 176.870 0.040 0.000 1.077 1408 L CA 1.880 56.747 54.840 0.045 0.000 0.747 1408 L CB -0.724 41.377 42.059 0.069 0.000 0.896 1408 L HN -0.193 nan 8.230 nan 0.000 0.432 1409 D N -0.113 120.312 120.400 0.042 0.000 2.104 1409 D HA -0.182 4.458 4.640 -0.000 0.000 0.194 1409 D C 2.219 178.538 176.300 0.031 0.000 0.994 1409 D CA 1.701 55.724 54.000 0.037 0.000 0.830 1409 D CB -0.225 40.593 40.800 0.031 0.000 0.959 1409 D HN 0.521 nan 8.370 nan 0.000 0.452 1410 A N 0.060 122.894 122.820 0.024 0.000 1.902 1410 A HA -0.121 4.199 4.320 -0.000 0.000 0.217 1410 A C 2.302 179.903 177.584 0.028 0.000 1.181 1410 A CA 0.977 53.026 52.037 0.020 0.000 0.623 1410 A CB -0.730 18.278 19.000 0.013 0.000 0.818 1410 A HN 0.230 nan 8.150 nan 0.000 0.443 1411 L N -1.214 120.028 121.223 0.031 0.000 2.017 1411 L HA -0.178 4.162 4.340 -0.000 0.000 0.208 1411 L C 2.882 179.788 176.870 0.061 0.000 1.073 1411 L CA 1.422 56.286 54.840 0.039 0.000 0.745 1411 L CB -0.575 41.502 42.059 0.030 0.000 0.894 1411 L HN 0.334 nan 8.230 nan 0.000 0.432 1412 R N 0.016 120.545 120.500 0.049 0.000 2.091 1412 R HA -0.185 4.155 4.340 -0.000 0.000 0.238 1412 R C 2.374 178.737 176.300 0.104 0.000 1.136 1412 R CA 1.496 57.634 56.100 0.064 0.000 0.959 1412 R CB -0.519 29.806 30.300 0.041 0.000 0.856 1412 R HN 0.400 nan 8.270 nan 0.000 0.437 1413 A N 1.154 124.015 122.820 0.068 0.000 1.858 1413 A HA -0.129 4.191 4.320 -0.000 0.000 0.216 1413 A C 2.397 180.010 177.584 0.050 0.000 1.190 1413 A CA 1.768 53.837 52.037 0.054 0.000 0.617 1413 A CB -0.692 18.327 19.000 0.032 0.000 0.827 1413 A HN 0.403 nan 8.150 nan 0.000 0.443 1414 A N -0.629 122.218 122.820 0.045 0.000 1.865 1414 A HA -0.222 4.098 4.320 -0.000 0.000 0.217 1414 A C 1.995 179.596 177.584 0.029 0.000 1.191 1414 A CA 2.354 54.404 52.037 0.022 0.000 0.623 1414 A CB -1.184 17.828 19.000 0.019 0.000 0.826 1414 A HN 0.827 nan 8.150 nan 0.000 0.444 1415 H N -0.158 118.903 119.070 -0.015 0.000 2.261 1415 H HA -0.212 4.344 4.556 -0.000 0.000 0.290 1415 H C 2.220 177.543 175.328 -0.007 0.000 1.081 1415 H CA 2.600 58.640 56.048 -0.012 0.000 1.196 1415 H CB -0.239 29.529 29.762 0.009 0.000 1.350 1415 H HN 0.420 nan 8.280 nan 0.000 0.498 1416 R N 0.168 120.705 120.500 0.062 0.000 2.140 1416 R HA -0.229 4.111 4.340 -0.000 0.000 0.250 1416 R C 2.497 178.758 176.300 -0.065 0.000 1.150 1416 R CA 2.008 58.111 56.100 0.004 0.000 0.966 1416 R CB -0.414 29.932 30.300 0.076 0.000 0.869 1416 R HN 0.632 nan 8.270 nan 0.000 0.445 1417 E N -0.527 119.639 120.200 -0.056 0.000 2.038 1417 E HA -0.167 4.183 4.350 -0.000 0.000 0.195 1417 E C 2.140 178.674 176.600 -0.110 0.000 1.000 1417 E CA 1.196 57.557 56.400 -0.066 0.000 0.803 1417 E CB -0.321 29.344 29.700 -0.060 0.000 0.750 1417 E HN 0.512 nan 8.360 nan 0.000 0.448 1418 G N 0.847 109.540 108.800 -0.179 0.000 2.529 1418 G HA2 -0.327 3.633 3.960 -0.000 0.000 0.219 1418 G HA3 -0.327 3.633 3.960 -0.000 0.000 0.219 1418 G C 1.713 176.510 174.900 -0.173 0.000 1.177 1418 G CA 1.285 46.231 45.100 -0.255 0.000 0.773 1418 G HN 0.195 nan 8.290 nan 0.000 0.573 1419 V N 1.621 121.436 119.914 -0.166 0.000 2.380 1419 V HA -0.204 3.916 4.120 -0.000 0.000 0.251 1419 V C 3.330 179.440 176.094 0.027 0.000 1.063 1419 V CA 2.209 64.500 62.300 -0.016 0.000 1.055 1419 V CB -0.956 30.843 31.823 -0.041 0.000 0.657 1419 V HN 0.550 nan 8.190 nan 0.000 0.455 1420 A N -0.745 122.061 122.820 -0.025 0.000 1.877 1420 A HA -0.287 4.033 4.320 -0.000 0.000 0.216 1420 A C 2.152 179.699 177.584 -0.061 0.000 1.186 1420 A CA 2.146 54.167 52.037 -0.027 0.000 0.620 1420 A CB -0.863 18.118 19.000 -0.032 0.000 0.822 1420 A HN 0.677 nan 8.150 nan 0.000 0.443 1421 Y N -0.292 119.876 120.300 -0.220 0.000 2.081 1421 Y HA -0.231 4.319 4.550 -0.000 0.000 0.280 1421 Y C 1.468 177.192 175.900 -0.293 0.000 1.163 1421 Y CA 1.908 59.812 58.100 -0.326 0.000 1.135 1421 Y CB -0.518 37.609 38.460 -0.556 0.000 0.970 1421 Y HN 0.251 nan 8.280 nan 0.000 0.498 1422 F N 0.275 120.186 119.950 -0.065 0.000 2.703 1422 F HA 0.069 4.596 4.527 -0.000 0.000 0.299 1422 F C 1.106 176.846 175.800 -0.100 0.000 1.229 1422 F CA 0.135 58.066 58.000 -0.116 0.000 1.430 1422 F CB -0.049 38.915 39.000 -0.059 0.000 1.053 1422 F HN 0.163 nan 8.300 nan 0.000 0.513 1423 L N -1.567 119.642 121.223 -0.023 0.000 3.128 1423 L HA 0.119 4.459 4.340 -0.000 0.000 0.277 1423 L C 1.626 178.444 176.870 -0.086 0.000 1.171 1423 L CA 0.300 55.131 54.840 -0.015 0.000 1.008 1423 L CB 0.364 42.427 42.059 0.006 0.000 1.442 1423 L HN 0.023 nan 8.230 nan 0.000 0.584 1424 E N 0.002 120.085 120.200 -0.196 0.000 2.127 1424 E HA -0.096 4.254 4.350 -0.000 0.000 0.191 1424 E C 1.818 178.273 176.600 -0.241 0.000 0.964 1424 E CA 0.467 56.737 56.400 -0.216 0.000 0.832 1424 E CB 0.281 29.817 29.700 -0.274 0.000 0.790 1424 E HN 0.170 nan 8.360 nan 0.000 0.465 1425 L N 1.997 122.988 121.223 -0.386 0.000 2.129 1425 L HA -0.224 4.116 4.340 -0.000 0.000 0.212 1425 L C 2.172 178.982 176.870 -0.100 0.000 1.087 1425 L CA 1.713 56.385 54.840 -0.281 0.000 0.757 1425 L CB -0.077 41.806 42.059 -0.293 0.000 0.896 1425 L HN 0.108 nan 8.230 nan 0.000 0.434 1426 E N -0.663 119.497 120.200 -0.067 0.000 2.016 1426 E HA -0.218 4.132 4.350 -0.000 0.000 0.190 1426 E C 2.024 178.607 176.600 -0.029 0.000 0.985 1426 E CA 1.355 57.745 56.400 -0.016 0.000 0.802 1426 E CB -0.080 29.623 29.700 0.004 0.000 0.762 1426 E HN 0.591 nan 8.360 nan 0.000 0.448 1427 E N 0.299 120.473 120.200 -0.044 0.000 2.110 1427 E HA -0.213 4.137 4.350 -0.000 0.000 0.193 1427 E C 2.249 178.826 176.600 -0.040 0.000 0.988 1427 E CA 0.643 57.019 56.400 -0.039 0.000 0.804 1427 E CB -0.102 29.572 29.700 -0.044 0.000 0.745 1427 E HN 0.088 nan 8.360 nan 0.000 0.458 1428 R N 1.153 121.619 120.500 -0.056 0.000 2.062 1428 R HA -0.138 4.202 4.340 -0.000 0.000 0.229 1428 R C 1.827 178.114 176.300 -0.022 0.000 1.128 1428 R CA 1.207 57.279 56.100 -0.047 0.000 0.960 1428 R CB -0.006 30.250 30.300 -0.073 0.000 0.855 1428 R HN 0.089 nan 8.270 nan 0.000 0.432 1429 E N 1.396 121.588 120.200 -0.012 0.000 2.007 1429 E HA -0.190 4.160 4.350 -0.000 0.000 0.194 1429 E C 1.953 178.561 176.600 0.014 0.000 0.999 1429 E CA 1.603 58.018 56.400 0.025 0.000 0.811 1429 E CB -0.453 29.288 29.700 0.068 0.000 0.762 1429 E HN 0.478 nan 8.360 nan 0.000 0.450 1430 R N 1.079 121.578 120.500 -0.002 0.000 2.316 1430 R HA -0.088 4.252 4.340 -0.000 0.000 0.232 1430 R C 0.985 177.277 176.300 -0.014 0.000 1.137 1430 R CA 0.891 56.977 56.100 -0.023 0.000 1.012 1430 R CB -0.239 30.033 30.300 -0.047 0.000 0.859 1430 R HN 0.013 nan 8.270 nan 0.000 0.474 1431 E N 0.887 121.081 120.200 -0.009 0.000 2.370 1431 E HA 0.056 4.406 4.350 -0.000 0.000 0.194 1431 E C 0.857 177.456 176.600 -0.001 0.000 1.057 1431 E CA 0.005 56.401 56.400 -0.007 0.000 1.011 1431 E CB 0.472 30.165 29.700 -0.012 0.000 1.132 1431 E HN 0.432 nan 8.360 nan 0.000 0.450 1432 R N -1.441 119.061 120.500 0.003 0.000 2.771 1432 R HA 0.072 4.412 4.340 -0.000 0.000 0.177 1432 R C 0.829 177.132 176.300 0.005 0.000 0.937 1432 R CA 0.425 56.529 56.100 0.007 0.000 1.536 1432 R CB 0.394 30.703 30.300 0.015 0.000 1.696 1432 R HN -0.082 nan 8.270 nan 0.000 0.550 1433 T N -0.517 114.038 114.554 0.002 0.000 3.040 1433 T HA 0.205 4.554 4.350 -0.000 0.000 0.250 1433 T C 1.028 175.740 174.700 0.020 0.000 1.058 1433 T CA 0.713 62.808 62.100 -0.008 0.000 0.988 1433 T CB 0.896 69.740 68.868 -0.040 0.000 0.993 1433 T HN 0.516 nan 8.240 nan 0.000 0.519 1434 G N 2.236 111.049 108.800 0.021 0.000 2.189 1434 G HA2 -0.259 3.701 3.960 -0.000 0.000 0.267 1434 G HA3 -0.259 3.701 3.960 -0.000 0.000 0.267 1434 G C 0.288 175.235 174.900 0.079 0.000 0.975 1434 G CA -0.012 45.117 45.100 0.049 0.000 0.644 1434 G HN 0.612 nan 8.290 nan 0.000 0.537 1435 I N 2.295 122.864 120.570 -0.001 0.000 2.206 1435 I HA 0.159 4.329 4.170 -0.000 0.000 0.292 1435 I C -0.879 175.091 176.117 -0.246 0.000 1.156 1435 I CA -1.784 59.382 61.300 -0.223 0.000 1.356 1435 I CB 0.751 38.554 38.000 -0.328 0.000 1.494 1435 I HN -0.053 nan 8.210 nan 0.000 0.601 1436 P HA -0.067 nan 4.420 nan 0.000 0.242 1436 P C 0.898 178.107 177.300 -0.151 0.000 1.198 1436 P CA 0.877 63.912 63.100 -0.109 0.000 0.756 1436 P CB 0.119 31.791 31.700 -0.046 0.000 0.911 1437 T N -0.129 114.250 114.554 -0.292 0.000 2.988 1437 T HA 0.033 4.383 4.350 -0.000 0.000 0.240 1437 T C 0.733 175.326 174.700 -0.177 0.000 1.014 1437 T CA -0.368 61.573 62.100 -0.266 0.000 1.155 1437 T CB -0.802 67.793 68.868 -0.456 0.000 0.872 1437 T HN 0.030 nan 8.240 nan 0.000 0.440 1438 L N 3.010 124.107 121.223 -0.210 0.000 3.187 1438 L HA -0.134 4.206 4.340 -0.000 0.000 0.348 1438 L C -0.036 176.837 176.870 0.004 0.000 1.142 1438 L CA 0.630 55.427 54.840 -0.072 0.000 0.826 1438 L CB -0.335 41.697 42.059 -0.047 0.000 1.209 1438 L HN 0.104 nan 8.230 nan 0.000 0.589 1439 K N 3.566 124.006 120.400 0.066 0.000 2.185 1439 K HA 0.702 5.022 4.320 -0.000 0.000 0.240 1439 K C -0.981 175.705 176.600 0.144 0.000 0.983 1439 K CA -0.972 55.372 56.287 0.094 0.000 0.873 1439 K CB 1.920 34.485 32.500 0.110 0.000 1.118 1439 K HN 0.386 nan 8.250 nan 0.000 0.441 1440 V N 1.887 121.861 119.914 0.099 0.000 2.383 1440 V HA 0.298 4.418 4.120 -0.000 0.000 0.261 1440 V C 0.018 176.071 176.094 -0.068 0.000 0.987 1440 V CA -0.796 61.543 62.300 0.066 0.000 0.853 1440 V CB 0.919 32.806 31.823 0.107 0.000 1.095 1440 V HN 0.919 nan 8.190 nan 0.000 0.461 1441 G N 1.737 110.372 108.800 -0.276 0.000 2.509 1441 G HA2 0.709 4.668 3.960 -0.000 0.000 0.328 1441 G HA3 0.709 4.668 3.960 -0.000 0.000 0.328 1441 G C -1.290 172.825 174.900 -1.307 0.000 1.194 1441 G CA -0.650 44.143 45.100 -0.512 0.000 0.967 1441 G HN 0.612 nan 8.290 nan 0.000 0.488 1442 Y N -0.341 119.360 120.300 -0.998 0.000 2.570 1442 Y HA 0.765 5.314 4.550 -0.000 0.000 0.345 1442 Y C -0.912 174.800 175.900 -0.314 0.000 1.014 1442 Y CA -1.823 55.665 58.100 -1.019 0.000 1.063 1442 Y CB 2.200 39.688 38.460 -1.620 0.000 1.272 1442 Y HN 0.536 nan 8.280 nan 0.000 0.477 1443 N N 1.441 120.252 118.700 0.185 0.000 2.324 1443 N HA 0.355 5.095 4.740 -0.000 0.000 0.285 1443 N C 0.157 175.833 175.510 0.276 0.000 1.076 1443 N CA 0.221 53.405 53.050 0.224 0.000 0.864 1443 N CB 2.499 41.213 38.487 0.377 0.000 1.632 1443 N HN 1.079 nan 8.380 nan 0.000 0.478 1444 A N 2.671 125.586 122.820 0.159 0.000 1.896 1444 A HA -0.178 4.142 4.320 -0.000 0.000 0.220 1444 A C 1.988 179.549 177.584 -0.038 0.000 1.206 1444 A CA 2.588 54.659 52.037 0.058 0.000 0.647 1444 A CB -0.972 18.020 19.000 -0.013 0.000 0.828 1444 A HN 0.539 nan 8.150 nan 0.000 0.455 1445 V N -1.821 118.005 119.914 -0.147 0.000 2.277 1445 V HA -0.326 3.794 4.120 -0.000 0.000 0.253 1445 V C 2.026 177.742 176.094 -0.629 0.000 1.067 1445 V CA 2.602 64.594 62.300 -0.515 0.000 1.047 1445 V CB -0.970 30.317 31.823 -0.893 0.000 0.649 1445 V HN 0.647 nan 8.190 nan 0.000 0.447 1446 F N -1.381 118.642 119.950 0.122 0.000 2.817 1446 F HA 0.627 5.154 4.527 -0.000 0.000 0.333 1446 F C 1.426 177.345 175.800 0.199 0.000 1.085 1446 F CA 0.481 58.566 58.000 0.142 0.000 1.170 1446 F CB 0.274 39.361 39.000 0.145 0.000 1.066 1446 F HN 0.277 nan 8.300 nan 0.000 0.564 1447 G N 0.445 109.487 108.800 0.403 0.000 2.848 1447 G HA2 -0.257 3.703 3.960 -0.000 0.000 0.246 1447 G HA3 -0.257 3.703 3.960 -0.000 0.000 0.246 1447 G C -0.609 174.405 174.900 0.190 0.000 1.374 1447 G CA -0.400 44.958 45.100 0.429 0.000 0.982 1447 G HN 0.105 nan 8.290 nan 0.000 0.563 1448 Y N 1.031 121.336 120.300 0.008 0.000 2.458 1448 Y HA 0.717 5.266 4.550 -0.000 0.000 0.322 1448 Y C 0.734 176.586 175.900 -0.081 0.000 1.259 1448 Y CA 0.630 58.549 58.100 -0.303 0.000 1.302 1448 Y CB 1.543 39.521 38.460 -0.804 0.000 1.314 1448 Y HN 1.017 nan 8.280 nan 0.000 0.509 1449 Y N -2.353 117.990 120.300 0.072 0.000 2.925 1449 Y HA 0.648 5.198 4.550 -0.000 0.000 0.349 1449 Y C -2.536 173.409 175.900 0.075 0.000 1.342 1449 Y CA -2.286 55.851 58.100 0.061 0.000 1.093 1449 Y CB 0.410 38.883 38.460 0.022 0.000 1.571 1449 Y HN 0.362 nan 8.280 nan 0.000 0.438 1450 L N 1.666 123.191 121.223 0.503 0.000 2.346 1450 L HA 0.614 4.954 4.340 -0.000 0.000 0.276 1450 L C -0.702 176.445 176.870 0.462 0.000 1.006 1450 L CA -0.723 54.357 54.840 0.400 0.000 0.817 1450 L CB 2.134 44.349 42.059 0.259 0.000 1.272 1450 L HN 0.741 nan 8.230 nan 0.000 0.421 1451 E N 2.330 122.753 120.200 0.371 0.000 2.185 1451 E HA 0.528 4.878 4.350 -0.000 0.000 0.261 1451 E C -1.682 175.037 176.600 0.198 0.000 0.879 1451 E CA -0.540 56.014 56.400 0.256 0.000 0.756 1451 E CB 2.137 31.978 29.700 0.236 0.000 1.152 1451 E HN 0.284 nan 8.360 nan 0.000 0.416 1452 V N 3.579 123.637 119.914 0.241 0.000 2.555 1452 V HA 0.293 4.413 4.120 -0.000 0.000 0.302 1452 V C 0.549 176.667 176.094 0.039 0.000 1.038 1452 V CA -0.758 61.626 62.300 0.141 0.000 0.887 1452 V CB 1.770 33.739 31.823 0.243 0.000 0.991 1452 V HN 0.870 nan 8.190 nan 0.000 0.434 1453 T N 1.835 116.349 114.554 -0.068 0.000 2.828 1453 T HA 0.207 4.556 4.350 -0.000 0.000 0.290 1453 T C 1.258 175.727 174.700 -0.384 0.000 1.019 1453 T CA -0.317 61.716 62.100 -0.111 0.000 1.031 1453 T CB 0.877 69.723 68.868 -0.036 0.000 1.001 1453 T HN 0.494 nan 8.240 nan 0.000 0.531 1454 R N 1.302 121.583 120.500 -0.365 0.000 2.096 1454 R HA -0.060 4.280 4.340 -0.000 0.000 0.240 1454 R C -0.753 175.221 176.300 -0.543 0.000 1.139 1454 R CA 1.691 57.442 56.100 -0.582 0.000 0.952 1454 R CB -2.181 28.076 30.300 -0.072 0.000 0.854 1454 R HN 0.585 nan 8.270 nan 0.000 0.436 1455 P HA -0.145 nan 4.420 nan 0.000 0.215 1455 P C 0.555 177.715 177.300 -0.233 0.000 1.157 1455 P CA 1.379 64.382 63.100 -0.162 0.000 0.874 1455 P CB -0.264 31.380 31.700 -0.094 0.000 0.790 1456 Y N -3.025 117.128 120.300 -0.245 0.000 2.465 1456 Y HA 0.006 4.556 4.550 -0.000 0.000 0.311 1456 Y C 1.565 177.410 175.900 -0.092 0.000 1.204 1456 Y CA 0.077 58.083 58.100 -0.156 0.000 1.272 1456 Y CB -1.291 37.090 38.460 -0.132 0.000 1.083 1456 Y HN 0.018 nan 8.280 nan 0.000 0.508 1457 Y N -0.148 120.216 120.300 0.107 0.000 2.333 1457 Y HA -0.185 4.365 4.550 -0.000 0.000 0.290 1457 Y C 1.995 177.910 175.900 0.025 0.000 1.144 1457 Y CA 0.856 59.007 58.100 0.084 0.000 1.228 1457 Y CB -0.392 38.116 38.460 0.080 0.000 0.985 1457 Y HN 0.133 nan 8.280 nan 0.000 0.542 1458 E N -0.269 120.010 120.200 0.133 0.000 2.216 1458 E HA -0.032 4.318 4.350 -0.000 0.000 0.192 1458 E C 1.628 178.237 176.600 0.015 0.000 0.988 1458 E CA 0.669 57.100 56.400 0.052 0.000 0.834 1458 E CB -0.045 29.658 29.700 0.005 0.000 0.772 1458 E HN 0.322 nan 8.360 nan 0.000 0.479 1459 R N -0.138 120.373 120.500 0.019 0.000 2.359 1459 R HA 0.177 4.517 4.340 -0.000 0.000 0.231 1459 R C -0.370 175.897 176.300 -0.056 0.000 0.913 1459 R CA -0.082 56.022 56.100 0.007 0.000 1.075 1459 R CB 0.746 31.094 30.300 0.080 0.000 1.087 1459 R HN -0.065 nan 8.270 nan 0.000 0.515 1460 V N 4.810 124.671 119.914 -0.088 0.000 2.389 1460 V HA 0.134 4.254 4.120 -0.000 0.000 0.264 1460 V C -1.400 174.491 176.094 -0.338 0.000 1.049 1460 V CA -1.558 60.552 62.300 -0.317 0.000 0.932 1460 V CB 0.765 32.408 31.823 -0.299 0.000 1.011 1460 V HN 0.121 nan 8.190 nan 0.000 0.475 1461 P HA 0.191 nan 4.420 nan 0.000 0.272 1461 P C 0.165 177.351 177.300 -0.189 0.000 1.254 1461 P CA -0.330 62.617 63.100 -0.255 0.000 0.795 1461 P CB 1.261 32.846 31.700 -0.192 0.000 1.022 1462 K N -0.228 120.156 120.400 -0.027 0.000 2.356 1462 K HA -0.001 4.319 4.320 -0.000 0.000 0.195 1462 K C 1.583 178.269 176.600 0.143 0.000 1.037 1462 K CA 0.541 56.862 56.287 0.056 0.000 1.014 1462 K CB -0.009 32.518 32.500 0.045 0.000 0.815 1462 K HN 0.300 nan 8.250 nan 0.000 0.507 1463 E N 0.368 120.677 120.200 0.182 0.000 2.333 1463 E HA -0.122 4.228 4.350 -0.000 0.000 0.200 1463 E C 0.006 176.774 176.600 0.281 0.000 1.010 1463 E CA 1.043 57.570 56.400 0.212 0.000 0.841 1463 E CB -0.133 29.694 29.700 0.211 0.000 0.757 1463 E HN 0.186 nan 8.360 nan 0.000 0.508 1464 Y N -0.006 120.310 120.300 0.027 0.000 2.286 1464 Y HA 0.359 4.909 4.550 -0.000 0.000 0.347 1464 Y C 0.799 176.788 175.900 0.148 0.000 1.351 1464 Y CA -0.552 57.594 58.100 0.076 0.000 1.640 1464 Y CB 0.558 38.999 38.460 -0.032 0.000 1.560 1464 Y HN -0.237 nan 8.280 nan 0.000 0.574 1465 R N 1.956 122.693 120.500 0.395 0.000 3.130 1465 R HA 0.238 4.578 4.340 -0.000 0.000 0.261 1465 R C -3.319 173.100 176.300 0.199 0.000 1.683 1465 R CA -1.559 54.688 56.100 0.245 0.000 1.095 1465 R CB 0.969 31.349 30.300 0.133 0.000 1.421 1465 R HN 0.326 nan 8.270 nan 0.000 0.454 1466 P HA -0.068 nan 4.420 nan 0.000 0.266 1466 P C 0.097 177.285 177.300 -0.186 0.000 1.186 1466 P CA 0.040 62.999 63.100 -0.234 0.000 0.767 1466 P CB 1.338 32.817 31.700 -0.368 0.000 0.820 1467 V N 0.886 120.616 119.914 -0.307 0.000 3.408 1467 V HA 0.208 4.328 4.120 -0.000 0.000 0.263 1467 V C 0.665 176.467 176.094 -0.485 0.000 1.503 1467 V CA 0.544 62.621 62.300 -0.373 0.000 1.046 1467 V CB 0.053 31.556 31.823 -0.534 0.000 0.851 1467 V HN 0.667 nan 8.190 nan 0.000 0.435 1468 Q N 0.335 119.861 119.800 -0.456 0.000 2.443 1468 Q HA 0.358 4.698 4.340 -0.000 0.000 0.258 1468 Q C -1.719 174.109 176.000 -0.286 0.000 0.967 1468 Q CA -0.156 55.437 55.803 -0.350 0.000 0.951 1468 Q CB 2.277 30.743 28.738 -0.453 0.000 1.459 1468 Q HN 0.303 nan 8.270 nan 0.000 0.415 1469 T N 3.795 118.237 114.554 -0.186 0.000 2.823 1469 T HA 0.649 4.999 4.350 -0.000 0.000 0.279 1469 T C -0.654 174.002 174.700 -0.074 0.000 0.998 1469 T CA -0.438 61.578 62.100 -0.140 0.000 0.994 1469 T CB 0.858 69.644 68.868 -0.136 0.000 0.960 1469 T HN 0.388 nan 8.240 nan 0.000 0.448 1470 L N 1.825 123.026 121.223 -0.037 0.000 2.260 1470 L HA 0.573 4.913 4.340 -0.000 0.000 0.265 1470 L C 1.884 178.766 176.870 0.021 0.000 1.015 1470 L CA -0.795 54.037 54.840 -0.012 0.000 0.826 1470 L CB 0.702 42.749 42.059 -0.019 0.000 1.373 1470 L HN 0.545 nan 8.230 nan 0.000 0.450 1471 K N 0.529 120.941 120.400 0.018 0.000 2.015 1471 K HA -0.198 4.122 4.320 -0.000 0.000 0.216 1471 K C 0.635 177.264 176.600 0.048 0.000 1.052 1471 K CA 2.427 58.731 56.287 0.028 0.000 0.937 1471 K CB -0.041 32.470 32.500 0.019 0.000 0.719 1471 K HN 0.866 nan 8.250 nan 0.000 0.446 1472 D N -0.479 119.946 120.400 0.042 0.000 2.433 1472 D HA -0.005 4.635 4.640 -0.000 0.000 0.211 1472 D C 0.287 176.612 176.300 0.043 0.000 1.114 1472 D CA -0.174 53.852 54.000 0.043 0.000 0.837 1472 D CB 0.379 41.193 40.800 0.023 0.000 0.984 1472 D HN 0.140 nan 8.370 nan 0.000 0.505 1473 R N -0.025 120.515 120.500 0.068 0.000 2.733 1473 R HA 0.478 4.818 4.340 -0.000 0.000 0.272 1473 R C -1.795 174.573 176.300 0.113 0.000 1.029 1473 R CA -0.698 55.450 56.100 0.081 0.000 0.888 1473 R CB 1.333 31.652 30.300 0.032 0.000 1.251 1473 R HN 0.031 nan 8.270 nan 0.000 0.464 1474 Q N 0.966 120.862 119.800 0.161 0.000 2.347 1474 Q HA 0.510 4.850 4.340 -0.000 0.000 0.271 1474 Q C -1.182 174.781 176.000 -0.062 0.000 1.064 1474 Q CA -0.763 55.043 55.803 0.007 0.000 0.800 1474 Q CB 2.284 31.020 28.738 -0.003 0.000 1.304 1474 Q HN 0.606 nan 8.270 nan 0.000 0.438 1475 R N 2.599 122.944 120.500 -0.259 0.000 2.229 1475 R HA 0.383 4.723 4.340 -0.000 0.000 0.328 1475 R C -1.063 175.104 176.300 -0.220 0.000 1.009 1475 R CA -0.230 55.714 56.100 -0.260 0.000 0.864 1475 R CB 0.781 30.631 30.300 -0.749 0.000 1.085 1475 R HN 0.471 nan 8.270 nan 0.000 0.453 1476 Y N 0.058 120.379 120.300 0.035 0.000 2.618 1476 Y HA 0.485 5.035 4.550 -0.000 0.000 0.326 1476 Y C 0.988 176.902 175.900 0.023 0.000 1.168 1476 Y CA -0.703 57.446 58.100 0.082 0.000 1.269 1476 Y CB 1.470 40.142 38.460 0.352 0.000 1.388 1476 Y HN 0.393 nan 8.280 nan 0.000 0.528 1477 T N 0.880 115.537 114.554 0.172 0.000 2.888 1477 T HA 0.694 5.044 4.350 -0.000 0.000 0.288 1477 T C -1.787 172.877 174.700 -0.061 0.000 1.063 1477 T CA -0.522 61.616 62.100 0.062 0.000 1.010 1477 T CB 1.761 70.673 68.868 0.074 0.000 1.214 1477 T HN 0.368 nan 8.240 nan 0.000 0.533 1478 L N 0.909 122.112 121.223 -0.034 0.000 2.479 1478 L HA 0.556 4.896 4.340 -0.000 0.000 0.255 1478 L C -1.969 174.912 176.870 0.019 0.000 1.026 1478 L CA -1.572 53.230 54.840 -0.063 0.000 0.842 1478 L CB 1.660 43.641 42.059 -0.131 0.000 1.444 1478 L HN 0.386 nan 8.230 nan 0.000 0.409 1479 P HA 0.046 nan 4.420 nan 0.000 0.215 1479 P C -0.120 177.200 177.300 0.032 0.000 1.157 1479 P CA 0.615 63.735 63.100 0.033 0.000 0.856 1479 P CB 0.278 31.997 31.700 0.031 0.000 0.786 1483 E N 1.076 121.267 120.200 -0.015 0.000 2.033 1483 E HA -0.214 4.136 4.350 -0.000 0.000 0.199 1483 E C 0.896 177.426 176.600 -0.117 0.000 1.011 1483 E CA 1.688 58.051 56.400 -0.062 0.000 0.815 1483 E CB -0.085 29.557 29.700 -0.097 0.000 0.755 1483 E HN 0.042 nan 8.360 nan 0.000 0.451 1484 K N 0.543 120.801 120.400 -0.236 0.000 2.585 1484 K HA -0.142 4.178 4.320 -0.000 0.000 0.194 1484 K C 1.636 178.144 176.600 -0.153 0.000 1.037 1484 K CA 0.677 56.711 56.287 -0.421 0.000 0.964 1484 K CB 0.078 31.931 32.500 -1.078 0.000 0.787 1484 K HN 0.194 nan 8.250 nan 0.000 0.488 1485 E N -0.255 119.947 120.200 0.003 0.000 2.207 1485 E HA 0.010 4.360 4.350 -0.000 0.000 0.197 1485 E C 1.459 178.075 176.600 0.027 0.000 0.914 1485 E CA -0.050 56.350 56.400 0.001 0.000 0.914 1485 E CB 0.118 29.904 29.700 0.142 0.000 0.893 1485 E HN 0.047 nan 8.360 nan 0.000 0.479 1486 R N 0.365 120.922 120.500 0.095 0.000 2.377 1486 R HA -0.122 4.218 4.340 -0.000 0.000 0.207 1486 R C 1.440 177.784 176.300 0.074 0.000 1.075 1486 R CA 0.984 57.162 56.100 0.130 0.000 1.035 1486 R CB 0.149 30.501 30.300 0.086 0.000 0.857 1486 R HN 0.131 nan 8.270 nan 0.000 0.475 1487 E N -0.807 119.392 120.200 -0.002 0.000 2.207 1487 E HA -0.012 4.338 4.350 -0.000 0.000 0.197 1487 E C 1.671 178.254 176.600 -0.029 0.000 0.914 1487 E CA 0.510 56.891 56.400 -0.032 0.000 0.914 1487 E CB -0.150 29.486 29.700 -0.105 0.000 0.893 1487 E HN -0.062 nan 8.360 nan 0.000 0.479 1488 V N 1.206 121.050 119.914 -0.117 0.000 2.324 1488 V HA -0.289 3.831 4.120 -0.000 0.000 0.250 1488 V C 2.067 178.170 176.094 0.015 0.000 1.060 1488 V CA 2.064 64.288 62.300 -0.127 0.000 1.042 1488 V CB -0.671 30.968 31.823 -0.308 0.000 0.650 1488 V HN 0.299 nan 8.190 nan 0.000 0.450 1489 Y N 0.101 120.439 120.300 0.064 0.000 2.133 1489 Y HA -0.138 4.412 4.550 -0.000 0.000 0.287 1489 Y C 2.652 178.579 175.900 0.045 0.000 1.134 1489 Y CA 1.527 59.659 58.100 0.053 0.000 1.133 1489 Y CB -0.805 37.677 38.460 0.035 0.000 0.987 1489 Y HN 0.089 nan 8.280 nan 0.000 0.502 1490 R N 0.328 120.949 120.500 0.201 0.000 2.185 1490 R HA -0.199 4.141 4.340 -0.000 0.000 0.247 1490 R C 1.807 178.165 176.300 0.095 0.000 1.159 1490 R CA 1.461 57.629 56.100 0.114 0.000 0.988 1490 R CB -0.404 29.940 30.300 0.072 0.000 0.871 1490 R HN 0.376 nan 8.270 nan 0.000 0.458 1491 L N -0.372 120.919 121.223 0.113 0.000 2.084 1491 L HA -0.053 4.287 4.340 -0.000 0.000 0.202 1491 L C 2.200 179.120 176.870 0.084 0.000 1.074 1491 L CA 1.069 55.971 54.840 0.102 0.000 0.757 1491 L CB -0.510 41.635 42.059 0.144 0.000 0.918 1491 L HN 0.194 nan 8.230 nan 0.000 0.444 1492 E N 0.647 120.925 120.200 0.130 0.000 2.171 1492 E HA -0.259 4.091 4.350 -0.000 0.000 0.197 1492 E C 2.164 178.789 176.600 0.041 0.000 0.997 1492 E CA 1.258 57.687 56.400 0.049 0.000 0.810 1492 E CB -0.137 29.667 29.700 0.173 0.000 0.738 1492 E HN 0.518 nan 8.360 nan 0.000 0.467 1493 A N 1.436 124.299 122.820 0.072 0.000 1.832 1493 A HA -0.119 4.201 4.320 -0.000 0.000 0.214 1493 A C 2.218 179.816 177.584 0.024 0.000 1.204 1493 A CA 0.805 52.867 52.037 0.041 0.000 0.606 1493 A CB -0.764 18.263 19.000 0.044 0.000 0.849 1493 A HN 0.120 nan 8.150 nan 0.000 0.445 1494 L N -0.184 121.058 121.223 0.031 0.000 2.089 1494 L HA -0.248 4.092 4.340 -0.000 0.000 0.213 1494 L C 2.484 179.362 176.870 0.013 0.000 1.079 1494 L CA 1.419 56.273 54.840 0.023 0.000 0.758 1494 L CB -0.659 41.416 42.059 0.028 0.000 0.891 1494 L HN 0.427 nan 8.230 nan 0.000 0.433 1495 I N -0.762 119.808 120.570 -0.001 0.000 2.361 1495 I HA -0.288 3.882 4.170 -0.000 0.000 0.251 1495 I C 2.726 178.835 176.117 -0.014 0.000 1.133 1495 I CA 1.172 62.460 61.300 -0.020 0.000 1.413 1495 I CB -0.302 37.652 38.000 -0.077 0.000 1.073 1495 I HN 0.279 nan 8.210 nan 0.000 0.424 1496 R N 0.268 120.761 120.500 -0.012 0.000 2.057 1496 R HA -0.102 4.238 4.340 -0.000 0.000 0.229 1496 R C 2.478 178.780 176.300 0.003 0.000 1.136 1496 R CA 0.958 57.051 56.100 -0.011 0.000 0.952 1496 R CB -0.349 29.944 30.300 -0.011 0.000 0.848 1496 R HN 0.246 nan 8.270 nan 0.000 0.430 1497 R N 0.799 121.304 120.500 0.010 0.000 2.094 1497 R HA -0.225 4.115 4.340 -0.000 0.000 0.239 1497 R C 2.308 178.625 176.300 0.028 0.000 1.137 1497 R CA 1.965 58.075 56.100 0.018 0.000 0.943 1497 R CB -0.123 30.188 30.300 0.017 0.000 0.850 1497 R HN -0.055 nan 8.270 nan 0.000 0.433 1498 R N 0.944 121.461 120.500 0.029 0.000 2.057 1498 R HA -0.113 4.226 4.340 -0.000 0.000 0.229 1498 R C 2.063 178.397 176.300 0.056 0.000 1.136 1498 R CA 2.202 58.326 56.100 0.040 0.000 0.952 1498 R CB -0.555 29.766 30.300 0.036 0.000 0.848 1498 R HN 0.407 nan 8.270 nan 0.000 0.430 1499 E N 0.143 120.371 120.200 0.047 0.000 2.130 1499 E HA -0.270 4.080 4.350 -0.000 0.000 0.196 1499 E C 1.741 178.396 176.600 0.093 0.000 0.998 1499 E CA 1.691 58.127 56.400 0.061 0.000 0.806 1499 E CB -0.118 29.596 29.700 0.025 0.000 0.738 1499 E HN 0.551 nan 8.360 nan 0.000 0.459 1500 E N 0.099 120.342 120.200 0.072 0.000 2.106 1500 E HA -0.217 4.133 4.350 -0.000 0.000 0.192 1500 E C 1.830 178.524 176.600 0.156 0.000 0.984 1500 E CA 1.147 57.614 56.400 0.112 0.000 0.806 1500 E CB 0.093 29.828 29.700 0.059 0.000 0.750 1500 E HN 0.355 nan 8.360 nan 0.000 0.458 1501 E N -0.049 120.212 120.200 0.103 0.000 2.023 1501 E HA -0.205 4.145 4.350 -0.000 0.000 0.196 1501 E C 2.222 178.880 176.600 0.097 0.000 1.003 1501 E CA 1.695 58.147 56.400 0.086 0.000 0.809 1501 E CB -0.064 29.674 29.700 0.062 0.000 0.755 1501 E HN 0.139 nan 8.360 nan 0.000 0.449 1502 V N 1.342 121.325 119.914 0.114 0.000 2.282 1502 V HA -0.285 3.835 4.120 -0.000 0.000 0.249 1502 V C 2.110 178.260 176.094 0.093 0.000 1.057 1502 V CA 2.051 64.428 62.300 0.129 0.000 1.032 1502 V CB -0.636 31.293 31.823 0.176 0.000 0.645 1502 V HN 0.257 nan 8.190 nan 0.000 0.447 1503 F N 0.257 120.206 119.950 -0.003 0.000 2.126 1503 F HA -0.212 4.315 4.527 -0.000 0.000 0.299 1503 F C 1.986 177.777 175.800 -0.016 0.000 1.096 1503 F CA 1.694 59.678 58.000 -0.028 0.000 1.255 1503 F CB -0.315 38.669 39.000 -0.028 0.000 0.997 1503 F HN 0.057 nan 8.300 nan 0.000 0.479 1504 L N 0.648 121.844 121.223 -0.045 0.000 2.056 1504 L HA -0.168 4.172 4.340 -0.000 0.000 0.207 1504 L C 2.395 179.172 176.870 -0.154 0.000 1.078 1504 L CA 1.789 56.553 54.840 -0.127 0.000 0.749 1504 L CB -1.190 40.890 42.059 0.036 0.000 0.901 1504 L HN 0.181 nan 8.230 nan 0.000 0.433 1505 E N -1.168 118.989 120.200 -0.072 0.000 2.058 1505 E HA -0.201 4.149 4.350 -0.000 0.000 0.194 1505 E C 2.220 178.769 176.600 -0.084 0.000 0.997 1505 E CA 1.568 57.943 56.400 -0.042 0.000 0.801 1505 E CB -0.039 29.675 29.700 0.023 0.000 0.746 1505 E HN 0.244 nan 8.360 nan 0.000 0.450 1506 V N 0.880 120.713 119.914 -0.135 0.000 2.358 1506 V HA -0.250 3.869 4.120 -0.000 0.000 0.246 1506 V C 2.428 178.371 176.094 -0.252 0.000 1.047 1506 V CA 1.941 64.136 62.300 -0.175 0.000 1.035 1506 V CB -0.542 31.143 31.823 -0.232 0.000 0.658 1506 V HN 0.254 nan 8.190 nan 0.000 0.452 1507 R N 0.229 120.467 120.500 -0.436 0.000 2.105 1507 R HA -0.249 4.091 4.340 -0.000 0.000 0.239 1507 R C 2.280 178.453 176.300 -0.211 0.000 1.135 1507 R CA 2.091 57.945 56.100 -0.410 0.000 0.967 1507 R CB -0.172 29.759 30.300 -0.615 0.000 0.861 1507 R HN 0.572 nan 8.270 nan 0.000 0.442 1508 E N 0.609 120.709 120.200 -0.166 0.000 2.110 1508 E HA -0.158 4.192 4.350 -0.000 0.000 0.193 1508 E C 1.951 178.510 176.600 -0.068 0.000 0.988 1508 E CA 1.450 57.795 56.400 -0.093 0.000 0.804 1508 E CB 0.039 29.700 29.700 -0.066 0.000 0.745 1508 E HN 0.334 nan 8.360 nan 0.000 0.458 1509 R N -0.182 120.277 120.500 -0.068 0.000 2.096 1509 R HA -0.019 4.321 4.340 -0.000 0.000 0.235 1509 R C 2.389 178.662 176.300 -0.045 0.000 1.127 1509 R CA 1.169 57.244 56.100 -0.042 0.000 0.968 1509 R CB -0.398 29.885 30.300 -0.029 0.000 0.861 1509 R HN 0.208 nan 8.270 nan 0.000 0.440 1510 A N 1.534 124.314 122.820 -0.067 0.000 1.930 1510 A HA -0.182 4.138 4.320 -0.000 0.000 0.217 1510 A C 2.058 179.614 177.584 -0.047 0.000 1.175 1510 A CA 1.336 53.338 52.037 -0.058 0.000 0.627 1510 A CB -0.320 18.633 19.000 -0.078 0.000 0.815 1510 A HN 0.212 nan 8.150 nan 0.000 0.443 1511 K N -0.224 120.144 120.400 -0.054 0.000 2.211 1511 K HA -0.077 4.243 4.320 -0.000 0.000 0.203 1511 K C 1.791 178.376 176.600 -0.026 0.000 1.050 1511 K CA 0.947 57.211 56.287 -0.039 0.000 0.945 1511 K CB -0.106 32.368 32.500 -0.044 0.000 0.732 1511 K HN 0.438 nan 8.250 nan 0.000 0.451 1512 R N -0.085 120.400 120.500 -0.025 0.000 2.323 1512 R HA 0.006 4.346 4.340 -0.000 0.000 0.198 1512 R C 0.725 177.019 176.300 -0.011 0.000 0.988 1512 R CA 0.404 56.495 56.100 -0.015 0.000 1.041 1512 R CB 0.253 30.545 30.300 -0.014 0.000 0.926 1512 R HN 0.138 nan 8.270 nan 0.000 0.476 1513 Q N -0.707 119.085 119.800 -0.013 0.000 2.175 1513 Q HA 0.278 4.618 4.340 -0.000 0.000 0.225 1513 Q C 1.095 177.091 176.000 -0.007 0.000 0.837 1513 Q CA -0.031 55.767 55.803 -0.008 0.000 1.032 1513 Q CB 1.232 29.964 28.738 -0.010 0.000 1.137 1513 Q HN 0.224 nan 8.270 nan 0.000 0.483 1514 A N 0.948 123.763 122.820 -0.008 0.000 1.892 1514 A HA -0.222 4.098 4.320 -0.000 0.000 0.218 1514 A C 1.912 179.496 177.584 -0.000 0.000 1.188 1514 A CA 1.499 53.532 52.037 -0.006 0.000 0.631 1514 A CB -0.039 18.958 19.000 -0.006 0.000 0.822 1514 A HN 0.164 nan 8.150 nan 0.000 0.447 1515 E N -0.259 119.944 120.200 0.005 0.000 2.072 1515 E HA -0.078 4.272 4.350 -0.000 0.000 0.191 1515 E C 2.348 178.954 176.600 0.010 0.000 0.985 1515 E CA 1.253 57.659 56.400 0.010 0.000 0.801 1515 E CB -0.746 28.963 29.700 0.014 0.000 0.750 1515 E HN 0.567 nan 8.360 nan 0.000 0.452 1516 A N 0.870 123.695 122.820 0.007 0.000 1.933 1516 A HA -0.132 4.188 4.320 -0.000 0.000 0.218 1516 A C 2.371 179.958 177.584 0.005 0.000 1.175 1516 A CA 1.038 53.079 52.037 0.008 0.000 0.628 1516 A CB -0.617 18.387 19.000 0.005 0.000 0.814 1516 A HN 0.200 nan 8.150 nan 0.000 0.444 1517 L N -1.343 119.880 121.223 0.000 0.000 2.056 1517 L HA -0.146 4.194 4.340 -0.000 0.000 0.207 1517 L C 2.883 179.752 176.870 -0.003 0.000 1.078 1517 L CA 1.284 56.121 54.840 -0.004 0.000 0.749 1517 L CB -0.392 41.662 42.059 -0.010 0.000 0.901 1517 L HN 0.347 nan 8.230 nan 0.000 0.433 1518 R N -0.362 120.138 120.500 0.001 0.000 2.075 1518 R HA -0.191 4.149 4.340 -0.000 0.000 0.232 1518 R C 2.215 178.520 176.300 0.009 0.000 1.126 1518 R CA 1.310 57.412 56.100 0.003 0.000 0.963 1518 R CB -0.169 30.137 30.300 0.009 0.000 0.858 1518 R HN 0.200 nan 8.270 nan 0.000 0.435 1519 E N 1.073 121.281 120.200 0.014 0.000 2.051 1519 E HA -0.135 4.215 4.350 -0.000 0.000 0.192 1519 E C 1.795 178.405 176.600 0.018 0.000 0.991 1519 E CA 1.682 58.094 56.400 0.020 0.000 0.799 1519 E CB -0.198 29.515 29.700 0.023 0.000 0.748 1519 E HN 0.285 nan 8.360 nan 0.000 0.449 1520 A N 1.182 124.009 122.820 0.012 0.000 1.865 1520 A HA -0.115 4.205 4.320 -0.000 0.000 0.217 1520 A C 2.532 180.118 177.584 0.003 0.000 1.191 1520 A CA 2.659 54.702 52.037 0.010 0.000 0.623 1520 A CB -1.407 17.595 19.000 0.005 0.000 0.826 1520 A HN 0.421 nan 8.150 nan 0.000 0.444 1521 A N -0.285 122.531 122.820 -0.006 0.000 1.884 1521 A HA -0.292 4.028 4.320 -0.000 0.000 0.219 1521 A C 2.295 179.867 177.584 -0.021 0.000 1.197 1521 A CA 2.328 54.353 52.037 -0.019 0.000 0.637 1521 A CB -0.645 18.341 19.000 -0.023 0.000 0.827 1521 A HN 0.607 nan 8.150 nan 0.000 0.450 1522 R N -0.341 120.154 120.500 -0.008 0.000 2.073 1522 R HA -0.113 4.227 4.340 -0.000 0.000 0.234 1522 R C 2.058 178.362 176.300 0.006 0.000 1.134 1522 R CA 1.886 57.985 56.100 -0.003 0.000 0.952 1522 R CB -0.429 29.882 30.300 0.018 0.000 0.850 1522 R HN 0.580 nan 8.270 nan 0.000 0.433 1523 I N 1.001 121.585 120.570 0.024 0.000 2.179 1523 I HA -0.317 3.853 4.170 -0.000 0.000 0.242 1523 I C 2.305 178.441 176.117 0.033 0.000 1.088 1523 I CA 1.254 62.581 61.300 0.046 0.000 1.357 1523 I CB -0.291 37.740 38.000 0.053 0.000 1.051 1523 I HN 0.248 nan 8.210 nan 0.000 0.409 1524 L N 0.564 121.793 121.223 0.009 0.000 2.131 1524 L HA -0.212 4.128 4.340 -0.000 0.000 0.210 1524 L C 2.876 179.714 176.870 -0.053 0.000 1.092 1524 L CA 1.225 56.059 54.840 -0.010 0.000 0.759 1524 L CB -0.822 41.226 42.059 -0.019 0.000 0.903 1524 L HN 0.270 nan 8.230 nan 0.000 0.435 1525 A N 0.118 122.895 122.820 -0.070 0.000 1.902 1525 A HA -0.214 4.106 4.320 -0.000 0.000 0.217 1525 A C 2.186 179.652 177.584 -0.197 0.000 1.181 1525 A CA 1.650 53.608 52.037 -0.132 0.000 0.623 1525 A CB -0.362 18.563 19.000 -0.125 0.000 0.818 1525 A HN 0.470 nan 8.150 nan 0.000 0.443 1526 E N -0.118 119.997 120.200 -0.142 0.000 2.028 1526 E HA -0.144 4.206 4.350 -0.000 0.000 0.191 1526 E C 2.046 178.534 176.600 -0.187 0.000 0.988 1526 E CA 1.168 57.433 56.400 -0.224 0.000 0.799 1526 E CB -0.386 29.318 29.700 0.007 0.000 0.755 1526 E HN 0.610 nan 8.360 nan 0.000 0.447 1527 L N 1.344 122.584 121.223 0.028 0.000 2.013 1527 L HA -0.248 4.092 4.340 -0.000 0.000 0.212 1527 L C 2.514 179.304 176.870 -0.134 0.000 1.073 1527 L CA 1.382 56.279 54.840 0.094 0.000 0.753 1527 L CB -0.490 41.638 42.059 0.116 0.000 0.890 1527 L HN 0.153 nan 8.230 nan 0.000 0.432 1528 D N -0.186 120.120 120.400 -0.157 0.000 2.104 1528 D HA -0.155 4.485 4.640 -0.000 0.000 0.194 1528 D C 2.082 178.229 176.300 -0.254 0.000 0.994 1528 D CA 1.333 55.212 54.000 -0.201 0.000 0.830 1528 D CB 0.057 40.758 40.800 -0.164 0.000 0.959 1528 D HN 0.069 nan 8.370 nan 0.000 0.452 1529 V N -0.167 119.557 119.914 -0.316 0.000 2.270 1529 V HA -0.247 3.873 4.120 -0.000 0.000 0.245 1529 V C 2.257 178.213 176.094 -0.230 0.000 1.043 1529 V CA 1.745 63.822 62.300 -0.371 0.000 1.014 1529 V CB -1.003 30.416 31.823 -0.673 0.000 0.645 1529 V HN 0.292 nan 8.190 nan 0.000 0.447 1530 Y N 0.644 120.906 120.300 -0.062 0.000 2.128 1530 Y HA -0.265 4.285 4.550 -0.000 0.000 0.284 1530 Y C 2.640 178.424 175.900 -0.195 0.000 1.154 1530 Y CA 1.179 59.299 58.100 0.033 0.000 1.149 1530 Y CB -0.560 38.059 38.460 0.264 0.000 0.976 1530 Y HN 0.230 nan 8.280 nan 0.000 0.505 1531 A N 0.022 122.561 122.820 -0.468 0.000 2.024 1531 A HA -0.166 4.154 4.320 -0.000 0.000 0.220 1531 A C 2.296 179.671 177.584 -0.349 0.000 1.164 1531 A CA 1.746 53.295 52.037 -0.813 0.000 0.643 1531 A CB -0.964 17.416 19.000 -1.034 0.000 0.806 1531 A HN 0.458 nan 8.150 nan 0.000 0.451 1532 A N -0.674 122.001 122.820 -0.241 0.000 1.935 1532 A HA 0.217 4.537 4.320 -0.000 0.000 0.214 1532 A C 2.032 179.542 177.584 -0.124 0.000 1.178 1532 A CA 0.908 52.840 52.037 -0.174 0.000 0.640 1532 A CB -0.395 18.508 19.000 -0.162 0.000 0.825 1532 A HN 0.419 nan 8.150 nan 0.000 0.447 1533 L N -0.602 120.580 121.223 -0.070 0.000 2.201 1533 L HA -0.158 4.182 4.340 -0.000 0.000 0.212 1533 L C 2.986 179.786 176.870 -0.116 0.000 1.105 1533 L CA 0.819 55.646 54.840 -0.022 0.000 0.775 1533 L CB -0.420 41.692 42.059 0.089 0.000 0.913 1533 L HN 0.463 nan 8.230 nan 0.000 0.440 1534 A N 0.024 122.766 122.820 -0.130 0.000 1.855 1534 A HA -0.231 4.088 4.320 -0.000 0.000 0.215 1534 A C 2.174 179.659 177.584 -0.166 0.000 1.191 1534 A CA 1.631 53.570 52.037 -0.163 0.000 0.613 1534 A CB -0.446 18.533 19.000 -0.035 0.000 0.829 1534 A HN 0.335 nan 8.150 nan 0.000 0.442 1535 E N 0.145 120.246 120.200 -0.165 0.000 2.097 1535 E HA -0.154 4.196 4.350 -0.000 0.000 0.196 1535 E C 1.815 178.248 176.600 -0.278 0.000 1.000 1535 E CA 1.806 58.090 56.400 -0.194 0.000 0.804 1535 E CB -0.541 29.049 29.700 -0.183 0.000 0.740 1535 E HN 0.239 nan 8.360 nan 0.000 0.454 1536 V N 0.603 120.356 119.914 -0.269 0.000 2.307 1536 V HA -0.245 3.875 4.120 -0.000 0.000 0.245 1536 V C 2.384 178.165 176.094 -0.521 0.000 1.045 1536 V CA 1.816 63.886 62.300 -0.382 0.000 1.024 1536 V CB -1.000 30.721 31.823 -0.171 0.000 0.651 1536 V HN 0.467 nan 8.190 nan 0.000 0.449 1537 A N -0.263 122.372 122.820 -0.307 0.000 1.908 1537 A HA -0.187 4.133 4.320 -0.000 0.000 0.218 1537 A C 2.352 179.848 177.584 -0.148 0.000 1.181 1537 A CA 2.242 54.187 52.037 -0.155 0.000 0.627 1537 A CB -0.709 18.293 19.000 0.002 0.000 0.818 1537 A HN 0.358 nan 8.150 nan 0.000 0.445 1538 V N -0.442 119.369 119.914 -0.171 0.000 2.548 1538 V HA -0.177 3.943 4.120 -0.000 0.000 0.249 1538 V C 2.586 178.556 176.094 -0.207 0.000 1.055 1538 V CA 2.123 64.344 62.300 -0.131 0.000 1.065 1538 V CB -0.747 31.010 31.823 -0.110 0.000 0.681 1538 V HN 0.640 nan 8.190 nan 0.000 0.462 1539 R N -0.797 119.464 120.500 -0.398 0.000 2.057 1539 R HA -0.074 4.266 4.340 -0.000 0.000 0.224 1539 R C 1.919 177.945 176.300 -0.456 0.000 1.136 1539 R CA 1.407 57.186 56.100 -0.535 0.000 0.968 1539 R CB -0.054 29.694 30.300 -0.920 0.000 0.863 1539 R HN 0.513 nan 8.270 nan 0.000 0.433 1540 Y N -0.311 119.838 120.300 -0.253 0.000 2.468 1540 Y HA 0.368 4.918 4.550 -0.000 0.000 0.268 1540 Y C 0.674 176.556 175.900 -0.030 0.000 1.177 1540 Y CA -0.152 57.840 58.100 -0.179 0.000 1.265 1540 Y CB 0.438 38.732 38.460 -0.275 0.000 1.103 1540 Y HN 0.333 nan 8.280 nan 0.000 0.522 1541 G N 0.549 109.382 108.800 0.055 0.000 2.422 1541 G HA2 -0.266 3.693 3.960 -0.000 0.000 0.290 1541 G HA3 -0.266 3.693 3.960 -0.000 0.000 0.290 1541 G C -0.795 174.370 174.900 0.443 0.000 1.059 1541 G CA -0.467 44.750 45.100 0.194 0.000 1.242 1541 G HN 0.135 nan 8.290 nan 0.000 0.520 1542 Y N -1.097 119.307 120.300 0.172 0.000 2.419 1542 Y HA 0.700 5.250 4.550 -0.000 0.000 0.328 1542 Y C 0.815 176.834 175.900 0.198 0.000 1.162 1542 Y CA -1.871 56.345 58.100 0.193 0.000 1.174 1542 Y CB 1.837 40.454 38.460 0.261 0.000 1.228 1542 Y HN 0.197 nan 8.280 nan 0.000 0.473 1543 V N 2.438 122.453 119.914 0.169 0.000 2.881 1543 V HA 0.473 4.593 4.120 -0.000 0.000 0.316 1543 V C -0.086 175.621 176.094 -0.646 0.000 1.070 1543 V CA -1.471 60.737 62.300 -0.154 0.000 0.976 1543 V CB 2.081 33.840 31.823 -0.107 0.000 1.038 1543 V HN 0.671 nan 8.190 nan 0.000 0.446 1544 R N 4.349 124.162 120.500 -1.145 0.000 2.389 1544 R HA 0.321 4.661 4.340 -0.000 0.000 0.295 1544 R C -2.381 173.565 176.300 -0.590 0.000 1.075 1544 R CA -0.954 54.385 56.100 -1.269 0.000 1.005 1544 R CB 0.971 30.642 30.300 -1.048 0.000 0.987 1544 R HN 0.517 nan 8.270 nan 0.000 0.452 1545 P HA 0.287 nan 4.420 nan 0.000 0.280 1545 P C -1.186 175.707 177.300 -0.678 0.000 1.272 1545 P CA -0.526 62.281 63.100 -0.489 0.000 0.819 1545 P CB 1.164 32.600 31.700 -0.439 0.000 1.122 1546 R N 0.679 120.749 120.500 -0.715 0.000 2.621 1546 R HA 0.514 4.854 4.340 -0.000 0.000 0.292 1546 R C -0.602 175.312 176.300 -0.644 0.000 0.969 1546 R CA -0.624 55.061 56.100 -0.692 0.000 0.887 1546 R CB 1.097 30.987 30.300 -0.683 0.000 1.180 1546 R HN 0.453 nan 8.270 nan 0.000 0.450 1547 F N 0.098 119.975 119.950 -0.122 0.000 2.421 1547 F HA 0.731 5.258 4.527 -0.000 0.000 0.337 1547 F C 1.043 176.797 175.800 -0.076 0.000 1.105 1547 F CA -0.478 57.460 58.000 -0.104 0.000 1.049 1547 F CB 2.264 41.203 39.000 -0.101 0.000 1.139 1547 F HN 0.602 nan 8.300 nan 0.000 0.479 1548 G N 1.537 110.400 108.800 0.106 0.000 2.519 1548 G HA2 0.162 4.122 3.960 -0.000 0.000 0.292 1548 G HA3 0.162 4.122 3.960 -0.000 0.000 0.292 1548 G C -0.797 174.128 174.900 0.041 0.000 1.507 1548 G CA -0.773 44.368 45.100 0.069 0.000 0.806 1548 G HN 0.513 nan 8.290 nan 0.000 0.523 1549 D N -0.673 119.770 120.400 0.071 0.000 2.393 1549 D HA -0.050 4.590 4.640 -0.000 0.000 0.220 1549 D C 1.017 177.410 176.300 0.155 0.000 0.974 1549 D CA 0.999 55.071 54.000 0.120 0.000 0.931 1549 D CB 0.175 41.077 40.800 0.170 0.000 0.889 1549 D HN 0.334 nan 8.370 nan 0.000 0.512 1550 R N -0.239 120.329 120.500 0.113 0.000 2.664 1550 R HA 0.487 4.827 4.340 -0.000 0.000 0.286 1550 R C -0.909 175.451 176.300 0.099 0.000 0.967 1550 R CA -0.974 55.208 56.100 0.138 0.000 0.933 1550 R CB 2.028 32.392 30.300 0.107 0.000 1.146 1550 R HN 0.071 nan 8.270 nan 0.000 0.468 1551 L N 2.622 123.933 121.223 0.146 0.000 2.272 1551 L HA 0.334 4.674 4.340 -0.000 0.000 0.289 1551 L C -1.036 175.888 176.870 0.090 0.000 1.032 1551 L CA -0.122 54.782 54.840 0.107 0.000 0.810 1551 L CB 0.783 42.948 42.059 0.176 0.000 1.205 1551 L HN 0.561 nan 8.230 nan 0.000 0.422 1552 Q N 6.735 126.566 119.800 0.051 0.000 2.294 1552 Q HA 0.490 4.830 4.340 -0.000 0.000 0.264 1552 Q C -1.430 174.574 176.000 0.007 0.000 0.992 1552 Q CA -0.372 55.429 55.803 -0.003 0.000 0.747 1552 Q CB 2.803 31.461 28.738 -0.134 0.000 1.262 1552 Q HN 0.635 nan 8.270 nan 0.000 0.452 1553 I N 2.159 122.751 120.570 0.037 0.000 2.418 1553 I HA 0.402 4.572 4.170 -0.000 0.000 0.287 1553 I C -0.486 175.665 176.117 0.057 0.000 1.008 1553 I CA -0.668 60.661 61.300 0.048 0.000 1.104 1553 I CB 1.778 39.812 38.000 0.056 0.000 1.264 1553 I HN 0.312 nan 8.210 nan 0.000 0.438 1554 R N 6.068 126.594 120.500 0.042 0.000 2.215 1554 R HA 0.683 5.023 4.340 -0.000 0.000 0.336 1554 R C 0.061 176.398 176.300 0.063 0.000 0.996 1554 R CA 0.042 56.169 56.100 0.045 0.000 0.847 1554 R CB 0.937 31.251 30.300 0.023 0.000 1.127 1554 R HN 0.809 nan 8.270 nan 0.000 0.465 1555 A N 2.977 125.848 122.820 0.084 0.000 2.475 1555 A HA -0.103 4.217 4.320 -0.000 0.000 0.295 1555 A C 0.381 178.034 177.584 0.115 0.000 1.457 1555 A CA 0.760 52.859 52.037 0.103 0.000 0.734 1555 A CB -1.976 17.075 19.000 0.084 0.000 1.118 1555 A HN 0.936 nan 8.150 nan 0.000 0.400 1556 G N -0.240 108.644 108.800 0.140 0.000 2.420 1556 G HA2 0.635 4.595 3.960 -0.000 0.000 0.284 1556 G HA3 0.635 4.595 3.960 -0.000 0.000 0.284 1556 G C -0.123 174.879 174.900 0.170 0.000 1.177 1556 G CA -0.606 44.559 45.100 0.108 0.000 0.841 1556 G HN 0.802 nan 8.290 nan 0.000 0.527 1557 R N -0.809 119.700 120.500 0.014 0.000 2.807 1557 R HA 0.359 4.699 4.340 -0.000 0.000 0.276 1557 R C -0.680 175.362 176.300 -0.429 0.000 0.979 1557 R CA -1.030 54.952 56.100 -0.197 0.000 0.928 1557 R CB 1.349 31.482 30.300 -0.279 0.000 1.191 1557 R HN 0.772 nan 8.270 nan 0.000 0.471 1558 H N 4.113 122.595 119.070 -0.980 0.000 2.955 1558 H HA 0.101 4.657 4.556 -0.000 0.000 0.290 1558 H C -1.357 173.656 175.328 -0.526 0.000 1.047 1558 H CA -1.563 54.152 56.048 -0.555 0.000 1.484 1558 H CB 1.107 30.637 29.762 -0.387 0.000 1.501 1558 H HN 0.355 nan 8.280 nan 0.000 0.521 1559 P HA -0.227 nan 4.420 nan 0.000 0.216 1559 P C 1.119 178.393 177.300 -0.044 0.000 1.150 1559 P CA 1.127 64.125 63.100 -0.171 0.000 0.843 1559 P CB 0.428 32.004 31.700 -0.207 0.000 0.787 1560 V N -0.100 119.879 119.914 0.110 0.000 2.374 1560 V HA -0.117 4.002 4.120 -0.000 0.000 0.241 1560 V C 2.888 178.980 176.094 -0.003 0.000 1.034 1560 V CA 1.159 63.503 62.300 0.074 0.000 1.037 1560 V CB -1.183 30.715 31.823 0.126 0.000 0.682 1560 V HN -0.107 nan 8.190 nan 0.000 0.463 1561 V N 1.804 121.696 119.914 -0.037 0.000 2.324 1561 V HA -0.351 3.769 4.120 -0.000 0.000 0.250 1561 V C 2.643 178.697 176.094 -0.067 0.000 1.060 1561 V CA 2.620 64.823 62.300 -0.162 0.000 1.042 1561 V CB -1.005 30.654 31.823 -0.274 0.000 0.650 1561 V HN 0.891 nan 8.190 nan 0.000 0.450 1562 E N 0.397 120.503 120.200 -0.158 0.000 2.153 1562 E HA -0.237 4.113 4.350 -0.000 0.000 0.194 1562 E C 2.046 178.607 176.600 -0.065 0.000 0.988 1562 E CA 1.013 57.364 56.400 -0.081 0.000 0.811 1562 E CB -0.396 29.187 29.700 -0.194 0.000 0.746 1562 E HN 0.471 nan 8.360 nan 0.000 0.466 1563 R N 0.760 121.178 120.500 -0.136 0.000 2.341 1563 R HA -0.032 4.308 4.340 -0.000 0.000 0.213 1563 R C 1.463 177.719 176.300 -0.074 0.000 1.082 1563 R CA 0.938 56.939 56.100 -0.165 0.000 1.017 1563 R CB -0.239 29.925 30.300 -0.227 0.000 0.860 1563 R HN 0.389 nan 8.270 nan 0.000 0.473 1564 R N -0.390 120.088 120.500 -0.037 0.000 2.344 1564 R HA 0.090 4.430 4.340 -0.000 0.000 0.209 1564 R C 0.501 176.809 176.300 0.014 0.000 0.886 1564 R CA 0.648 56.740 56.100 -0.013 0.000 1.040 1564 R CB 0.831 31.119 30.300 -0.019 0.000 1.114 1564 R HN 0.179 nan 8.270 nan 0.000 0.547 1565 T N -2.455 112.125 114.554 0.043 0.000 2.739 1565 T HA 0.240 4.590 4.350 -0.000 0.000 0.303 1565 T C -1.065 173.696 174.700 0.102 0.000 1.389 1565 T CA -1.024 61.113 62.100 0.061 0.000 1.001 1565 T CB 1.761 70.660 68.868 0.051 0.000 1.436 1565 T HN -0.097 nan 8.240 nan 0.000 0.500 1566 E N 0.531 120.783 120.200 0.087 0.000 2.220 1566 E HA 0.308 4.658 4.350 -0.000 0.000 0.272 1566 E C -1.237 175.443 176.600 0.133 0.000 1.099 1566 E CA -0.194 56.267 56.400 0.103 0.000 0.907 1566 E CB 0.310 30.050 29.700 0.067 0.000 1.022 1566 E HN 0.415 nan 8.360 nan 0.000 0.428 1567 F N 3.060 123.024 119.950 0.023 0.000 2.385 1567 F HA 0.208 4.735 4.527 -0.000 0.000 0.336 1567 F C -0.207 175.621 175.800 0.046 0.000 1.100 1567 F CA -0.765 57.248 58.000 0.023 0.000 1.116 1567 F CB 0.979 39.995 39.000 0.026 0.000 1.166 1567 F HN 0.071 nan 8.300 nan 0.000 0.511 1568 V N 7.675 127.381 119.914 -0.346 0.000 2.348 1568 V HA 0.290 4.410 4.120 -0.000 0.000 0.270 1568 V C -1.926 174.177 176.094 0.015 0.000 1.037 1568 V CA -1.622 60.608 62.300 -0.117 0.000 0.872 1568 V CB 0.609 32.352 31.823 -0.134 0.000 1.002 1568 V HN 0.599 nan 8.190 nan 0.000 0.464 1569 P HA 0.256 nan 4.420 nan 0.000 0.273 1569 P C -0.721 176.674 177.300 0.158 0.000 1.250 1569 P CA -0.331 62.932 63.100 0.271 0.000 0.793 1569 P CB 1.145 32.968 31.700 0.204 0.000 1.011 1570 N N -0.117 118.700 118.700 0.196 0.000 2.732 1570 N HA 0.271 5.011 4.740 -0.000 0.000 0.259 1570 N C -1.303 174.313 175.510 0.176 0.000 1.402 1570 N CA -0.365 52.760 53.050 0.125 0.000 0.829 1570 N CB 1.923 40.439 38.487 0.047 0.000 1.495 1570 N HN 0.357 nan 8.380 nan 0.000 0.511 1571 D N 0.757 121.235 120.400 0.129 0.000 2.326 1571 D HA 0.627 5.267 4.640 -0.000 0.000 0.248 1571 D C -0.617 175.825 176.300 0.236 0.000 1.001 1571 D CA -0.227 53.862 54.000 0.148 0.000 0.961 1571 D CB 2.186 43.035 40.800 0.082 0.000 1.183 1571 D HN 0.244 nan 8.370 nan 0.000 0.502 1572 L N 0.165 121.512 121.223 0.205 0.000 2.549 1572 L HA 0.335 4.675 4.340 -0.000 0.000 0.259 1572 L C -1.225 175.731 176.870 0.144 0.000 0.934 1572 L CA -0.208 54.775 54.840 0.237 0.000 0.865 1572 L CB 1.987 44.213 42.059 0.278 0.000 1.352 1572 L HN 0.344 nan 8.230 nan 0.000 0.410 1576 H N -0.305 118.305 119.070 -0.767 0.000 2.820 1576 H HA -0.147 4.409 4.556 -0.000 0.000 0.295 1576 H C 0.123 175.278 175.328 -0.289 0.000 1.187 1576 H CA 1.920 57.588 56.048 -0.633 0.000 1.144 1576 H CB -1.183 28.342 29.762 -0.396 0.000 1.354 1576 H HN 0.896 nan 8.280 nan 0.000 0.395 1577 E N 0.214 120.346 120.200 -0.113 0.000 2.249 1577 E HA 0.488 4.838 4.350 -0.000 0.000 0.263 1577 E C 0.001 176.645 176.600 0.074 0.000 0.950 1577 E CA -1.286 55.125 56.400 0.019 0.000 0.827 1577 E CB 1.988 31.725 29.700 0.061 0.000 1.220 1577 E HN -0.006 nan 8.360 nan 0.000 0.411 1578 L N 2.051 123.363 121.223 0.149 0.000 2.255 1578 L HA 0.222 4.562 4.340 -0.000 0.000 0.289 1578 L C -1.272 175.689 176.870 0.150 0.000 1.046 1578 L CA -0.400 54.546 54.840 0.177 0.000 0.816 1578 L CB 0.927 43.127 42.059 0.235 0.000 1.197 1578 L HN 0.267 nan 8.230 nan 0.000 0.427 1579 V N 7.034 127.043 119.914 0.158 0.000 2.294 1579 V HA 0.313 4.433 4.120 -0.000 0.000 0.272 1579 V C 0.361 176.556 176.094 0.167 0.000 1.027 1579 V CA -0.588 61.806 62.300 0.156 0.000 0.823 1579 V CB 0.800 32.726 31.823 0.172 0.000 1.030 1579 V HN 0.590 nan 8.190 nan 0.000 0.457 1580 L N 5.639 126.931 121.223 0.115 0.000 2.417 1580 L HA 0.524 4.864 4.340 -0.000 0.000 0.268 1580 L C -0.285 176.650 176.870 0.109 0.000 1.158 1580 L CA -0.071 54.814 54.840 0.075 0.000 0.819 1580 L CB 0.940 42.979 42.059 -0.033 0.000 1.112 1580 L HN 0.454 nan 8.230 nan 0.000 0.458 1581 I N 1.926 122.566 120.570 0.117 0.000 2.468 1581 I HA 0.270 4.440 4.170 -0.000 0.000 0.284 1581 I C 0.145 176.297 176.117 0.058 0.000 1.038 1581 I CA -0.310 61.069 61.300 0.131 0.000 1.083 1581 I CB 1.916 40.041 38.000 0.208 0.000 1.223 1581 I HN 0.667 nan 8.210 nan 0.000 0.443 1582 T N 1.809 116.385 114.554 0.037 0.000 2.889 1582 T HA 0.976 5.326 4.350 -0.000 0.000 0.278 1582 T C 0.155 174.883 174.700 0.047 0.000 0.995 1582 T CA -0.674 61.380 62.100 -0.076 0.000 0.966 1582 T CB 2.231 71.002 68.868 -0.162 0.000 1.237 1582 T HN 1.043 nan 8.240 nan 0.000 0.591 1583 G N 0.396 109.206 108.800 0.016 0.000 2.334 1583 G HA2 0.312 4.272 3.960 -0.000 0.000 0.566 1583 G HA3 0.312 4.272 3.960 -0.000 0.000 0.566 1583 G C -3.420 171.524 174.900 0.074 0.000 1.413 1583 G CA -0.783 44.398 45.100 0.135 0.000 0.993 1583 G HN 0.757 nan 8.290 nan 0.000 0.642 1584 P HA 0.168 nan 4.420 nan 0.000 0.276 1584 P C 0.431 177.782 177.300 0.085 0.000 1.230 1584 P CA -0.167 63.059 63.100 0.209 0.000 0.776 1584 P CB 0.783 32.641 31.700 0.263 0.000 0.888 1588 G N -0.098 108.735 108.800 0.054 0.000 2.507 1588 G HA2 -0.088 3.872 3.960 -0.000 0.000 0.205 1588 G HA3 -0.088 3.872 3.960 -0.000 0.000 0.205 1588 G C 0.715 175.673 174.900 0.096 0.000 0.996 1588 G CA 0.727 45.855 45.100 0.046 0.000 0.776 1588 G HN 0.378 nan 8.290 nan 0.000 0.532 1589 K N 0.920 121.378 120.400 0.097 0.000 2.015 1589 K HA -0.102 4.218 4.320 -0.000 0.000 0.216 1589 K C 2.627 179.339 176.600 0.187 0.000 1.052 1589 K CA 2.026 58.407 56.287 0.156 0.000 0.937 1589 K CB -0.278 32.297 32.500 0.124 0.000 0.719 1589 K HN 0.259 nan 8.250 nan 0.000 0.446 1590 S N 0.222 115.993 115.700 0.119 0.000 2.383 1590 S HA -0.141 4.329 4.470 -0.000 0.000 0.229 1590 S C 2.036 176.712 174.600 0.126 0.000 1.030 1590 S CA 1.725 59.983 58.200 0.097 0.000 1.002 1590 S CB -0.366 62.864 63.200 0.050 0.000 0.829 1590 S HN 0.357 nan 8.310 nan 0.000 0.467 1591 T N 1.749 116.388 114.554 0.141 0.000 2.746 1591 T HA -0.048 4.302 4.350 -0.000 0.000 0.267 1591 T C 1.408 176.309 174.700 0.335 0.000 1.039 1591 T CA 1.070 63.296 62.100 0.210 0.000 1.142 1591 T CB -0.399 68.564 68.868 0.158 0.000 0.866 1591 T HN 0.385 nan 8.240 nan 0.000 0.444 1592 F N 2.105 122.140 119.950 0.142 0.000 2.069 1592 F HA -0.064 4.463 4.527 -0.000 0.000 0.298 1592 F C 1.948 177.808 175.800 0.101 0.000 1.113 1592 F CA 1.083 59.165 58.000 0.136 0.000 1.214 1592 F CB -0.754 38.304 39.000 0.097 0.000 0.978 1592 F HN 0.066 nan 8.300 nan 0.000 0.474 1593 L N -0.168 121.053 121.223 -0.005 0.000 2.042 1593 L HA -0.258 4.081 4.340 -0.000 0.000 0.210 1593 L C 2.701 179.486 176.870 -0.141 0.000 1.076 1593 L CA 1.669 56.422 54.840 -0.145 0.000 0.749 1593 L CB -0.829 41.216 42.059 -0.024 0.000 0.893 1593 L HN 0.109 nan 8.230 nan 0.000 0.432 1594 R N 0.150 120.639 120.500 -0.019 0.000 2.092 1594 R HA -0.194 4.146 4.340 -0.000 0.000 0.231 1594 R C 2.420 178.614 176.300 -0.177 0.000 1.119 1594 R CA 1.685 57.767 56.100 -0.030 0.000 0.970 1594 R CB -0.275 30.120 30.300 0.158 0.000 0.864 1594 R HN 0.605 nan 8.270 nan 0.000 0.440 1595 Q N -0.187 119.547 119.800 -0.109 0.000 2.079 1595 Q HA -0.081 4.259 4.340 -0.000 0.000 0.200 1595 Q C 1.553 177.408 176.000 -0.242 0.000 0.974 1595 Q CA 1.815 57.474 55.803 -0.240 0.000 0.840 1595 Q CB -0.442 28.297 28.738 0.001 0.000 0.898 1595 Q HN 0.010 nan 8.270 nan 0.000 0.430 1596 T N 1.221 115.610 114.554 -0.275 0.000 2.720 1596 T HA -0.168 4.181 4.350 -0.000 0.000 0.268 1596 T C 1.977 176.535 174.700 -0.236 0.000 1.037 1596 T CA 1.645 63.571 62.100 -0.289 0.000 1.144 1596 T CB -0.440 68.179 68.868 -0.415 0.000 0.864 1596 T HN 0.548 nan 8.240 nan 0.000 0.444 1597 A N 0.936 123.609 122.820 -0.245 0.000 1.897 1597 A HA 0.098 4.418 4.320 -0.000 0.000 0.215 1597 A C 2.289 179.746 177.584 -0.211 0.000 1.181 1597 A CA 1.010 52.906 52.037 -0.235 0.000 0.620 1597 A CB -0.719 18.154 19.000 -0.213 0.000 0.821 1597 A HN 0.475 nan 8.150 nan 0.000 0.443 1598 L N -0.496 120.579 121.223 -0.245 0.000 2.141 1598 L HA -0.135 4.205 4.340 -0.000 0.000 0.209 1598 L C 2.411 179.169 176.870 -0.187 0.000 1.094 1598 L CA 0.895 55.590 54.840 -0.243 0.000 0.763 1598 L CB -0.471 41.368 42.059 -0.367 0.000 0.908 1598 L HN 0.369 nan 8.230 nan 0.000 0.437 1599 I N -0.016 120.443 120.570 -0.184 0.000 2.179 1599 I HA -0.282 3.888 4.170 -0.000 0.000 0.242 1599 I C 2.817 178.903 176.117 -0.053 0.000 1.088 1599 I CA 1.189 62.410 61.300 -0.132 0.000 1.357 1599 I CB -0.432 37.495 38.000 -0.122 0.000 1.051 1599 I HN 0.207 nan 8.210 nan 0.000 0.409 1600 A N 0.627 123.430 122.820 -0.029 0.000 1.940 1600 A HA -0.234 4.086 4.320 -0.000 0.000 0.219 1600 A C 2.223 179.849 177.584 0.070 0.000 1.176 1600 A CA 1.600 53.689 52.037 0.086 0.000 0.631 1600 A CB -0.719 18.322 19.000 0.068 0.000 0.814 1600 A HN 0.395 nan 8.150 nan 0.000 0.446 1601 L N -0.317 120.897 121.223 -0.016 0.000 2.005 1601 L HA -0.040 4.300 4.340 -0.000 0.000 0.207 1601 L C 2.295 179.182 176.870 0.029 0.000 1.072 1601 L CA 1.643 56.474 54.840 -0.015 0.000 0.744 1601 L CB -0.720 41.289 42.059 -0.084 0.000 0.895 1601 L HN 0.391 nan 8.230 nan 0.000 0.433 1602 L N -0.399 120.831 121.223 0.013 0.000 2.012 1602 L HA -0.245 4.095 4.340 -0.000 0.000 0.210 1602 L C 2.695 179.639 176.870 0.123 0.000 1.073 1602 L CA 1.386 56.266 54.840 0.066 0.000 0.748 1602 L CB -1.021 41.051 42.059 0.022 0.000 0.891 1602 L HN 0.415 nan 8.230 nan 0.000 0.431 1603 A N -0.382 122.503 122.820 0.108 0.000 1.873 1603 A HA -0.271 4.049 4.320 -0.000 0.000 0.218 1603 A C 2.028 179.771 177.584 0.264 0.000 1.193 1603 A CA 1.675 53.817 52.037 0.175 0.000 0.629 1603 A CB -0.607 18.481 19.000 0.147 0.000 0.826 1603 A HN 0.527 nan 8.150 nan 0.000 0.447 1604 Q N -0.909 119.013 119.800 0.202 0.000 2.387 1604 Q HA 0.164 4.504 4.340 -0.000 0.000 0.211 1604 Q C 1.018 177.069 176.000 0.085 0.000 0.952 1604 Q CA 0.195 56.077 55.803 0.132 0.000 0.957 1604 Q CB 0.153 28.947 28.738 0.094 0.000 1.002 1604 Q HN 0.437 nan 8.270 nan 0.000 0.502 1605 V N -1.345 118.641 119.914 0.120 0.000 3.635 1605 V HA 0.216 4.336 4.120 -0.000 0.000 0.266 1605 V C 0.916 177.080 176.094 0.116 0.000 1.316 1605 V CA 1.049 63.424 62.300 0.124 0.000 1.060 1605 V CB 0.982 32.926 31.823 0.201 0.000 0.820 1605 V HN 0.495 nan 8.190 nan 0.000 0.447 1606 G N 0.900 109.801 108.800 0.168 0.000 2.140 1606 G HA2 -0.199 3.761 3.960 -0.000 0.000 0.211 1606 G HA3 -0.199 3.761 3.960 -0.000 0.000 0.211 1606 G C 0.241 175.334 174.900 0.322 0.000 1.013 1606 G CA 0.566 45.792 45.100 0.210 0.000 0.705 1606 G HN 0.897 nan 8.290 nan 0.000 0.508 1607 S N -1.003 114.890 115.700 0.321 0.000 2.681 1607 S HA 0.863 5.333 4.470 -0.000 0.000 0.299 1607 S C 0.301 175.182 174.600 0.468 0.000 1.113 1607 S CA -0.734 57.680 58.200 0.357 0.000 1.013 1607 S CB 1.007 64.387 63.200 0.301 0.000 1.076 1607 S HN 0.360 nan 8.310 nan 0.000 0.534 1608 F N 1.330 121.397 119.950 0.194 0.000 2.399 1608 F HA 0.495 5.022 4.527 -0.000 0.000 0.313 1608 F C 0.744 176.605 175.800 0.101 0.000 1.202 1608 F CA -1.098 56.998 58.000 0.160 0.000 1.192 1608 F CB 1.002 40.137 39.000 0.224 0.000 1.256 1608 F HN 0.500 nan 8.300 nan 0.000 0.558 1609 V N -0.547 119.437 119.914 0.115 0.000 2.960 1609 V HA 0.609 4.729 4.120 -0.000 0.000 0.315 1609 V C -2.726 173.150 176.094 -0.362 0.000 1.087 1609 V CA -2.516 59.674 62.300 -0.184 0.000 0.982 1609 V CB 1.883 33.624 31.823 -0.138 0.000 1.039 1609 V HN 0.572 nan 8.190 nan 0.000 0.437 1610 P HA 0.501 nan 4.420 nan 0.000 0.244 1610 P C -0.283 176.931 177.300 -0.143 0.000 1.769 1610 P CA 0.580 63.391 63.100 -0.482 0.000 1.102 1610 P CB 0.337 31.694 31.700 -0.572 0.000 1.937 1611 A N 2.587 125.388 122.820 -0.032 0.000 2.483 1611 A HA 0.411 4.731 4.320 -0.000 0.000 0.306 1611 A C 0.477 178.087 177.584 0.043 0.000 1.137 1611 A CA -0.447 51.600 52.037 0.015 0.000 0.626 1611 A CB 0.565 19.561 19.000 -0.007 0.000 1.352 1611 A HN 0.173 nan 8.150 nan 0.000 0.508 1612 E N -0.481 119.744 120.200 0.042 0.000 2.175 1612 E HA 0.173 4.523 4.350 -0.000 0.000 0.195 1612 E C -0.140 176.474 176.600 0.023 0.000 0.934 1612 E CA 0.385 56.809 56.400 0.040 0.000 0.870 1612 E CB 0.691 30.419 29.700 0.046 0.000 0.838 1612 E HN 0.551 nan 8.360 nan 0.000 0.474 1613 E N -0.107 120.114 120.200 0.035 0.000 2.263 1613 E HA 0.531 4.881 4.350 -0.000 0.000 0.268 1613 E C -1.848 174.808 176.600 0.093 0.000 0.884 1613 E CA -0.519 55.924 56.400 0.071 0.000 0.766 1613 E CB 2.009 31.762 29.700 0.087 0.000 1.196 1613 E HN 0.106 nan 8.360 nan 0.000 0.416 1614 A N 4.800 127.691 122.820 0.119 0.000 2.651 1614 A HA 0.343 4.663 4.320 -0.000 0.000 0.290 1614 A C -1.448 176.186 177.584 0.083 0.000 1.185 1614 A CA -0.555 51.530 52.037 0.080 0.000 0.746 1614 A CB 0.331 19.303 19.000 -0.046 0.000 1.213 1614 A HN 0.698 nan 8.150 nan 0.000 0.429 1615 H N 2.669 121.673 119.070 -0.110 0.000 2.556 1615 H HA 0.562 5.117 4.556 -0.000 0.000 0.310 1615 H C -0.999 174.267 175.328 -0.103 0.000 1.057 1615 H CA -0.419 55.554 56.048 -0.125 0.000 1.264 1615 H CB 1.365 31.084 29.762 -0.072 0.000 1.404 1615 H HN 0.491 nan 8.280 nan 0.000 0.462 1616 L N 5.577 126.771 121.223 -0.050 0.000 2.370 1616 L HA 0.415 4.755 4.340 -0.000 0.000 0.266 1616 L C -2.401 174.397 176.870 -0.120 0.000 1.002 1616 L CA -2.221 52.575 54.840 -0.072 0.000 0.818 1616 L CB 2.700 44.738 42.059 -0.035 0.000 1.325 1616 L HN 0.458 nan 8.230 nan 0.000 0.418 1617 P HA 0.203 nan 4.420 nan 0.000 0.281 1617 P C -0.920 175.942 177.300 -0.730 0.000 1.249 1617 P CA -0.440 62.318 63.100 -0.570 0.000 0.810 1617 P CB 1.146 32.340 31.700 -0.843 0.000 1.008 1618 L N 3.134 124.113 121.223 -0.407 0.000 2.401 1618 L HA 0.224 4.564 4.340 -0.000 0.000 0.283 1618 L C 0.616 177.310 176.870 -0.292 0.000 1.151 1618 L CA -0.435 54.217 54.840 -0.314 0.000 0.942 1618 L CB -1.094 40.809 42.059 -0.260 0.000 1.283 1618 L HN 0.253 nan 8.230 nan 0.000 0.442 1619 F N 1.535 121.431 119.950 -0.090 0.000 2.496 1619 F HA -0.035 4.492 4.527 -0.000 0.000 0.344 1619 F C 1.554 177.345 175.800 -0.015 0.000 1.155 1619 F CA -0.310 57.647 58.000 -0.073 0.000 1.302 1619 F CB 0.533 39.467 39.000 -0.109 0.000 1.159 1619 F HN 0.542 nan 8.300 nan 0.000 0.595 1620 D N -0.525 120.022 120.400 0.244 0.000 2.354 1620 D HA 0.267 4.907 4.640 -0.000 0.000 0.209 1620 D C 0.453 176.842 176.300 0.149 0.000 1.015 1620 D CA 0.387 54.490 54.000 0.171 0.000 0.867 1620 D CB 0.362 41.270 40.800 0.178 0.000 0.933 1620 D HN 0.589 nan 8.370 nan 0.000 0.520 1621 G N -0.447 108.427 108.800 0.122 0.000 2.442 1621 G HA2 0.442 4.402 3.960 -0.000 0.000 0.296 1621 G HA3 0.442 4.402 3.960 -0.000 0.000 0.296 1621 G C -1.781 172.923 174.900 -0.327 0.000 1.564 1621 G CA -0.980 44.018 45.100 -0.171 0.000 0.828 1621 G HN 0.093 nan 8.290 nan 0.000 0.571 1622 I N 1.409 121.658 120.570 -0.535 0.000 2.382 1622 I HA 0.328 4.497 4.170 -0.000 0.000 0.285 1622 I C -1.068 174.735 176.117 -0.525 0.000 1.007 1622 I CA -0.735 60.313 61.300 -0.420 0.000 1.142 1622 I CB 1.306 39.118 38.000 -0.312 0.000 1.289 1622 I HN 0.385 nan 8.210 nan 0.000 0.453 1623 Y N 4.178 124.413 120.300 -0.109 0.000 2.342 1623 Y HA 0.412 4.962 4.550 -0.000 0.000 0.338 1623 Y C 0.825 176.660 175.900 -0.110 0.000 0.965 1623 Y CA -0.912 57.133 58.100 -0.091 0.000 1.159 1623 Y CB 1.507 39.927 38.460 -0.066 0.000 1.157 1623 Y HN 0.477 nan 8.280 nan 0.000 0.486 1624 T N -0.076 114.476 114.554 -0.004 0.000 2.945 1624 T HA 0.724 5.074 4.350 -0.000 0.000 0.286 1624 T C -0.380 174.287 174.700 -0.055 0.000 1.025 1624 T CA -1.105 60.965 62.100 -0.050 0.000 1.039 1624 T CB 2.075 70.896 68.868 -0.079 0.000 1.068 1624 T HN 0.564 nan 8.240 nan 0.000 0.497 1625 R N 1.408 121.860 120.500 -0.080 0.000 2.754 1625 R HA 0.524 4.864 4.340 -0.000 0.000 0.255 1625 R C -1.797 174.449 176.300 -0.090 0.000 1.723 1625 R CA -0.414 55.629 56.100 -0.095 0.000 1.596 1625 R CB -0.575 29.648 30.300 -0.128 0.000 1.424 1625 R HN 0.818 nan 8.270 nan 0.000 0.662 1626 I N 1.755 122.282 120.570 -0.071 0.000 2.647 1626 I HA 0.825 4.995 4.170 -0.000 0.000 0.295 1626 I C 0.529 176.618 176.117 -0.048 0.000 1.078 1626 I CA -0.468 60.800 61.300 -0.053 0.000 1.048 1626 I CB 2.274 40.250 38.000 -0.041 0.000 1.239 1626 I HN 0.678 nan 8.210 nan 0.000 0.421 1627 G N 3.476 112.254 108.800 -0.038 0.000 2.725 1627 G HA2 0.143 4.103 3.960 -0.000 0.000 0.220 1627 G HA3 0.143 4.103 3.960 -0.000 0.000 0.220 1627 G C -0.658 174.218 174.900 -0.039 0.000 1.357 1627 G CA -0.219 44.860 45.100 -0.036 0.000 0.866 1627 G HN 1.067 nan 8.290 nan 0.000 0.548 1636 K N 1.942 122.348 120.400 0.009 0.000 2.221 1636 K HA 0.577 4.897 4.320 -0.000 0.000 0.258 1636 K C 0.104 176.719 176.600 0.025 0.000 0.944 1636 K CA -0.317 55.978 56.287 0.015 0.000 0.823 1636 K CB 2.310 34.810 32.500 -0.000 0.000 1.113 1636 K HN 0.326 nan 8.250 nan 0.000 0.431 1637 S N 0.905 116.634 115.700 0.049 0.000 2.584 1637 S HA 0.004 4.474 4.470 -0.000 0.000 0.270 1637 S C 1.086 175.729 174.600 0.072 0.000 1.346 1637 S CA -0.234 58.009 58.200 0.072 0.000 1.018 1637 S CB 0.997 64.267 63.200 0.116 0.000 0.899 1637 S HN 0.565 nan 8.310 nan 0.000 0.542 1638 T N 1.523 116.123 114.554 0.076 0.000 2.788 1638 T HA -0.027 4.323 4.350 -0.000 0.000 0.268 1638 T C 0.603 175.349 174.700 0.078 0.000 1.044 1638 T CA 1.066 63.199 62.100 0.056 0.000 1.139 1638 T CB -0.610 68.290 68.868 0.053 0.000 0.867 1638 T HN 0.559 nan 8.240 nan 0.000 0.454 1645 E N 1.399 121.526 120.200 -0.121 0.000 2.051 1645 E HA -0.138 4.212 4.350 -0.000 0.000 0.192 1645 E C 2.058 178.599 176.600 -0.099 0.000 0.991 1645 E CA 1.635 57.972 56.400 -0.104 0.000 0.799 1645 E CB 0.184 29.820 29.700 -0.107 0.000 0.748 1645 E HN -0.017 nan 8.360 nan 0.000 0.449 1646 V N 1.239 121.082 119.914 -0.119 0.000 2.287 1646 V HA -0.313 3.807 4.120 -0.000 0.000 0.248 1646 V C 2.340 178.376 176.094 -0.096 0.000 1.053 1646 V CA 1.907 64.139 62.300 -0.113 0.000 1.027 1646 V CB -0.755 30.995 31.823 -0.121 0.000 0.646 1646 V HN 0.352 nan 8.190 nan 0.000 0.447 1647 A N -0.431 122.334 122.820 -0.092 0.000 1.948 1647 A HA -0.198 4.122 4.320 -0.000 0.000 0.220 1647 A C 2.233 179.773 177.584 -0.074 0.000 1.177 1647 A CA 1.760 53.752 52.037 -0.075 0.000 0.636 1647 A CB -0.548 18.410 19.000 -0.069 0.000 0.815 1647 A HN 0.397 nan 8.150 nan 0.000 0.449 1648 L N -0.096 121.082 121.223 -0.075 0.000 1.970 1648 L HA -0.203 4.137 4.340 -0.000 0.000 0.212 1648 L C 2.556 179.366 176.870 -0.101 0.000 1.071 1648 L CA 2.177 56.978 54.840 -0.064 0.000 0.751 1648 L CB -1.145 40.889 42.059 -0.043 0.000 0.889 1648 L HN 0.475 nan 8.230 nan 0.000 0.432 1649 I N -0.447 120.053 120.570 -0.117 0.000 2.151 1649 I HA -0.376 3.793 4.170 -0.000 0.000 0.243 1649 I C 2.514 178.493 176.117 -0.230 0.000 1.080 1649 I CA 1.211 62.380 61.300 -0.219 0.000 1.339 1649 I CB -0.392 37.522 38.000 -0.142 0.000 1.039 1649 I HN 0.249 nan 8.210 nan 0.000 0.409 1650 L N 0.374 121.515 121.223 -0.137 0.000 2.191 1650 L HA -0.182 4.158 4.340 -0.000 0.000 0.212 1650 L C 2.182 178.993 176.870 -0.098 0.000 1.103 1650 L CA 1.375 56.154 54.840 -0.102 0.000 0.769 1650 L CB -0.457 41.566 42.059 -0.060 0.000 0.908 1650 L HN 0.235 nan 8.230 nan 0.000 0.438 1651 K N -1.030 119.310 120.400 -0.100 0.000 2.393 1651 K HA 0.001 4.321 4.320 -0.000 0.000 0.193 1651 K C 1.538 178.083 176.600 -0.093 0.000 1.026 1651 K CA 0.226 56.469 56.287 -0.073 0.000 1.064 1651 K CB 0.411 32.884 32.500 -0.046 0.000 0.833 1651 K HN 0.183 nan 8.250 nan 0.000 0.521 1652 E N 0.507 120.594 120.200 -0.189 0.000 2.279 1652 E HA 0.135 4.485 4.350 -0.000 0.000 0.199 1652 E C 0.351 176.737 176.600 -0.357 0.000 0.893 1652 E CA 0.121 56.368 56.400 -0.254 0.000 0.978 1652 E CB -0.074 29.404 29.700 -0.371 0.000 0.964 1652 E HN 0.125 nan 8.360 nan 0.000 0.486 1653 A N 2.326 124.805 122.820 -0.569 0.000 2.587 1653 A HA 0.150 4.470 4.320 -0.000 0.000 0.235 1653 A C 0.768 178.288 177.584 -0.106 0.000 1.044 1653 A CA 1.155 52.956 52.037 -0.394 0.000 0.754 1653 A CB -0.322 18.497 19.000 -0.303 0.000 0.968 1653 A HN 0.263 nan 8.150 nan 0.000 0.509 1654 T N -1.082 113.485 114.554 0.021 0.000 2.773 1654 T HA 0.522 4.872 4.350 -0.000 0.000 0.278 1654 T C 0.963 175.749 174.700 0.144 0.000 1.011 1654 T CA 0.122 62.267 62.100 0.075 0.000 1.014 1654 T CB 1.067 69.997 68.868 0.102 0.000 1.293 1654 T HN 0.729 nan 8.240 nan 0.000 0.554 1655 E N 0.765 121.058 120.200 0.154 0.000 2.409 1655 E HA -0.115 4.235 4.350 -0.000 0.000 0.198 1655 E C 0.337 177.197 176.600 0.433 0.000 1.024 1655 E CA 0.849 57.392 56.400 0.238 0.000 0.861 1655 E CB -0.411 29.368 29.700 0.132 0.000 0.788 1655 E HN 0.603 nan 8.360 nan 0.000 0.521 1656 N N 0.843 119.769 118.700 0.376 0.000 2.273 1656 N HA 0.107 4.847 4.740 -0.000 0.000 0.231 1656 N C -0.641 175.153 175.510 0.474 0.000 1.134 1656 N CA -0.010 53.302 53.050 0.438 0.000 0.856 1656 N CB 1.029 39.678 38.487 0.269 0.000 1.068 1656 N HN -0.034 nan 8.380 nan 0.000 0.510 1657 S N 0.924 116.899 115.700 0.457 0.000 2.565 1657 S HA 0.413 4.882 4.470 -0.000 0.000 0.290 1657 S C -0.339 174.441 174.600 0.299 0.000 1.150 1657 S CA -0.657 57.785 58.200 0.404 0.000 1.058 1657 S CB 2.068 65.501 63.200 0.388 0.000 1.032 1657 S HN 0.148 nan 8.310 nan 0.000 0.510 1658 L N 3.815 125.005 121.223 -0.055 0.000 2.262 1658 L HA 0.574 4.914 4.340 -0.000 0.000 0.288 1658 L C -1.099 175.720 176.870 -0.083 0.000 1.035 1658 L CA -0.277 54.345 54.840 -0.363 0.000 0.820 1658 L CB 0.499 41.842 42.059 -1.194 0.000 1.204 1658 L HN 0.425 nan 8.230 nan 0.000 0.424 1659 V N 6.623 126.547 119.914 0.016 0.000 2.435 1659 V HA 0.456 4.576 4.120 -0.000 0.000 0.290 1659 V C -0.044 176.035 176.094 -0.025 0.000 1.030 1659 V CA -0.542 61.779 62.300 0.036 0.000 0.881 1659 V CB 1.691 33.538 31.823 0.039 0.000 0.983 1659 V HN 0.580 nan 8.190 nan 0.000 0.445 1660 L N 6.267 127.459 121.223 -0.052 0.000 2.353 1660 L HA 0.539 4.879 4.340 -0.000 0.000 0.270 1660 L C -0.776 176.025 176.870 -0.114 0.000 1.003 1660 L CA -0.260 54.535 54.840 -0.075 0.000 0.862 1660 L CB 1.232 43.237 42.059 -0.090 0.000 1.221 1660 L HN 0.404 nan 8.230 nan 0.000 0.430 1661 L N 3.018 124.133 121.223 -0.180 0.000 2.265 1661 L HA 0.391 4.731 4.340 -0.000 0.000 0.289 1661 L C -0.393 176.319 176.870 -0.263 0.000 1.033 1661 L CA -0.303 54.310 54.840 -0.379 0.000 0.814 1661 L CB 1.508 43.014 42.059 -0.922 0.000 1.203 1661 L HN 0.463 nan 8.230 nan 0.000 0.423 1662 D N 3.758 124.062 120.400 -0.161 0.000 2.454 1662 D HA 0.160 4.800 4.640 -0.000 0.000 0.225 1662 D C 0.331 176.623 176.300 -0.013 0.000 1.081 1662 D CA -0.295 53.684 54.000 -0.035 0.000 0.864 1662 D CB 0.759 41.548 40.800 -0.019 0.000 1.040 1662 D HN 0.531 nan 8.370 nan 0.000 0.517 1663 E N 0.893 121.152 120.200 0.098 0.000 2.539 1663 E HA -0.165 4.185 4.350 -0.000 0.000 0.253 1663 E C -0.411 176.263 176.600 0.123 0.000 1.145 1663 E CA 0.239 56.717 56.400 0.129 0.000 0.738 1663 E CB -0.823 28.891 29.700 0.023 0.000 1.308 1663 E HN 0.268 nan 8.360 nan 0.000 0.409 1664 V N -0.333 119.623 119.914 0.071 0.000 2.617 1664 V HA 0.266 4.386 4.120 -0.000 0.000 0.304 1664 V C 1.833 178.129 176.094 0.338 0.000 1.040 1664 V CA 1.695 64.036 62.300 0.069 0.000 1.149 1664 V CB 0.921 32.642 31.823 -0.171 0.000 0.914 1664 V HN 0.680 nan 8.190 nan 0.000 0.487 1665 G N 4.129 113.125 108.800 0.327 0.000 2.428 1665 G HA2 -0.164 3.796 3.960 -0.000 0.000 0.199 1665 G HA3 -0.164 3.796 3.960 -0.000 0.000 0.199 1665 G C 0.318 175.503 174.900 0.476 0.000 1.005 1665 G CA -0.036 45.360 45.100 0.493 0.000 0.671 1665 G HN 0.896 nan 8.290 nan 0.000 0.485 1666 R N 0.479 121.171 120.500 0.321 0.000 2.863 1666 R HA 0.484 4.824 4.340 -0.000 0.000 0.273 1666 R C 1.297 177.763 176.300 0.277 0.000 1.057 1666 R CA 0.790 57.019 56.100 0.215 0.000 1.191 1666 R CB 0.223 30.566 30.300 0.072 0.000 1.104 1666 R HN 1.636 nan 8.270 nan 0.000 0.519 1667 G N -0.939 107.949 108.800 0.146 0.000 2.141 1667 G HA2 -0.264 3.696 3.960 -0.000 0.000 0.231 1667 G HA3 -0.264 3.696 3.960 -0.000 0.000 0.231 1667 G C 0.100 174.941 174.900 -0.097 0.000 0.984 1667 G CA 0.443 45.619 45.100 0.127 0.000 0.660 1667 G HN 0.979 nan 8.290 nan 0.000 0.525 1668 T N -1.649 112.786 114.554 -0.197 0.000 2.627 1668 T HA 0.650 5.000 4.350 -0.000 0.000 0.294 1668 T C 0.552 175.144 174.700 -0.179 0.000 1.230 1668 T CA 1.182 63.060 62.100 -0.370 0.000 1.084 1668 T CB 0.869 69.192 68.868 -0.909 0.000 1.693 1668 T HN 1.248 nan 8.240 nan 0.000 0.465 1669 S N 0.361 115.949 115.700 -0.186 0.000 2.576 1669 S HA 0.237 4.707 4.470 -0.000 0.000 0.272 1669 S C 1.419 175.993 174.600 -0.044 0.000 1.352 1669 S CA 0.520 58.665 58.200 -0.092 0.000 1.021 1669 S CB 0.254 63.399 63.200 -0.092 0.000 0.887 1669 S HN 0.620 nan 8.310 nan 0.000 0.542 1670 S N 2.663 118.361 115.700 -0.003 0.000 2.406 1670 S HA -0.001 4.469 4.470 -0.000 0.000 0.228 1670 S C 1.709 176.284 174.600 -0.043 0.000 1.020 1670 S CA 0.941 59.165 58.200 0.041 0.000 0.965 1670 S CB -0.466 62.775 63.200 0.069 0.000 0.798 1670 S HN 0.626 nan 8.310 nan 0.000 0.488 1671 L N 1.288 122.478 121.223 -0.054 0.000 1.961 1671 L HA -0.117 4.223 4.340 -0.000 0.000 0.209 1671 L C 2.090 178.901 176.870 -0.099 0.000 1.075 1671 L CA 1.425 56.220 54.840 -0.075 0.000 0.749 1671 L CB -0.925 41.104 42.059 -0.050 0.000 0.890 1671 L HN 0.138 nan 8.230 nan 0.000 0.433 1672 D N 0.446 120.799 120.400 -0.079 0.000 2.158 1672 D HA -0.165 4.475 4.640 -0.000 0.000 0.197 1672 D C 2.085 178.352 176.300 -0.054 0.000 0.995 1672 D CA 1.387 55.351 54.000 -0.061 0.000 0.846 1672 D CB -0.439 40.310 40.800 -0.084 0.000 0.941 1672 D HN 0.404 nan 8.370 nan 0.000 0.456 1673 G N 0.501 109.251 108.800 -0.083 0.000 2.511 1673 G HA2 -0.263 3.697 3.960 -0.000 0.000 0.216 1673 G HA3 -0.263 3.697 3.960 -0.000 0.000 0.216 1673 G C 1.779 176.450 174.900 -0.382 0.000 1.218 1673 G CA 1.123 46.194 45.100 -0.050 0.000 0.788 1673 G HN 0.256 nan 8.290 nan 0.000 0.560 1674 V N 1.689 121.170 119.914 -0.722 0.000 2.407 1674 V HA -0.114 4.006 4.120 -0.000 0.000 0.248 1674 V C 3.318 179.220 176.094 -0.320 0.000 1.055 1674 V CA 2.006 63.805 62.300 -0.834 0.000 1.049 1674 V CB -0.984 30.492 31.823 -0.578 0.000 0.662 1674 V HN 0.519 nan 8.190 nan 0.000 0.455 1675 A N 0.177 122.888 122.820 -0.182 0.000 1.858 1675 A HA -0.193 4.127 4.320 -0.000 0.000 0.216 1675 A C 2.217 179.788 177.584 -0.022 0.000 1.190 1675 A CA 2.078 54.069 52.037 -0.078 0.000 0.617 1675 A CB -0.580 18.392 19.000 -0.047 0.000 0.827 1675 A HN 0.466 nan 8.150 nan 0.000 0.443 1676 I N -0.257 120.323 120.570 0.016 0.000 2.163 1676 I HA -0.324 3.846 4.170 -0.000 0.000 0.243 1676 I C 2.994 179.175 176.117 0.107 0.000 1.085 1676 I CA 1.212 62.562 61.300 0.084 0.000 1.347 1676 I CB -0.388 37.712 38.000 0.168 0.000 1.044 1676 I HN 0.383 nan 8.210 nan 0.000 0.408 1677 A N -0.139 122.753 122.820 0.120 0.000 1.978 1677 A HA -0.219 4.101 4.320 -0.000 0.000 0.220 1677 A C 2.346 180.035 177.584 0.174 0.000 1.170 1677 A CA 2.489 54.675 52.037 0.248 0.000 0.636 1677 A CB -0.951 18.238 19.000 0.315 0.000 0.810 1677 A HN 0.407 nan 8.150 nan 0.000 0.448 1678 T N -0.344 114.237 114.554 0.046 0.000 2.851 1678 T HA 0.131 4.481 4.350 -0.000 0.000 0.262 1678 T C 2.260 176.993 174.700 0.056 0.000 1.043 1678 T CA 1.199 63.313 62.100 0.023 0.000 1.140 1678 T CB -0.341 68.511 68.868 -0.026 0.000 0.872 1678 T HN 0.579 nan 8.240 nan 0.000 0.446 1679 A N 0.931 123.784 122.820 0.055 0.000 1.940 1679 A HA -0.062 4.258 4.320 -0.000 0.000 0.219 1679 A C 2.499 180.132 177.584 0.082 0.000 1.176 1679 A CA 1.359 53.429 52.037 0.056 0.000 0.631 1679 A CB -0.921 18.106 19.000 0.044 0.000 0.814 1679 A HN 0.367 nan 8.150 nan 0.000 0.446 1680 V N -0.437 119.547 119.914 0.118 0.000 2.379 1680 V HA -0.165 3.955 4.120 -0.000 0.000 0.245 1680 V C 3.033 179.238 176.094 0.184 0.000 1.044 1680 V CA 1.702 64.081 62.300 0.132 0.000 1.036 1680 V CB -1.131 30.779 31.823 0.144 0.000 0.664 1680 V HN 0.601 nan 8.190 nan 0.000 0.453 1681 A N -0.237 122.739 122.820 0.261 0.000 1.933 1681 A HA -0.240 4.080 4.320 -0.000 0.000 0.218 1681 A C 2.163 179.854 177.584 0.179 0.000 1.175 1681 A CA 1.915 54.114 52.037 0.270 0.000 0.628 1681 A CB -0.400 18.694 19.000 0.156 0.000 0.814 1681 A HN 0.646 nan 8.150 nan 0.000 0.444 1682 E N -0.265 120.010 120.200 0.124 0.000 2.047 1682 E HA -0.074 4.276 4.350 -0.000 0.000 0.191 1682 E C 2.390 179.074 176.600 0.140 0.000 0.987 1682 E CA 0.844 57.311 56.400 0.112 0.000 0.799 1682 E CB -0.339 29.395 29.700 0.057 0.000 0.752 1682 E HN 0.592 nan 8.360 nan 0.000 0.449 1683 A N 1.490 124.371 122.820 0.102 0.000 1.948 1683 A HA -0.181 4.139 4.320 -0.000 0.000 0.220 1683 A C 2.192 179.822 177.584 0.077 0.000 1.177 1683 A CA 1.230 53.312 52.037 0.075 0.000 0.636 1683 A CB -0.643 18.387 19.000 0.050 0.000 0.815 1683 A HN 0.147 nan 8.150 nan 0.000 0.449 1684 L N -1.955 119.328 121.223 0.100 0.000 2.313 1684 L HA -0.091 4.249 4.340 -0.000 0.000 0.214 1684 L C 2.465 179.392 176.870 0.095 0.000 1.119 1684 L CA 1.247 56.138 54.840 0.086 0.000 0.809 1684 L CB -0.448 41.672 42.059 0.102 0.000 0.933 1684 L HN 0.674 nan 8.230 nan 0.000 0.449 1685 H N 0.265 119.368 119.070 0.056 0.000 2.333 1685 H HA -0.126 4.430 4.556 -0.000 0.000 0.302 1685 H C 2.093 177.439 175.328 0.030 0.000 1.075 1685 H CA 1.519 57.594 56.048 0.045 0.000 1.348 1685 H CB 0.347 30.134 29.762 0.042 0.000 1.393 1685 H HN 0.087 nan 8.280 nan 0.000 0.509 1686 E N 0.369 120.608 120.200 0.065 0.000 2.150 1686 E HA -0.144 4.206 4.350 -0.000 0.000 0.193 1686 E C 2.312 178.886 176.600 -0.044 0.000 0.985 1686 E CA 0.637 57.039 56.400 0.003 0.000 0.814 1686 E CB -0.189 29.549 29.700 0.063 0.000 0.752 1686 E HN 0.317 nan 8.360 nan 0.000 0.466 1687 R N 1.046 121.535 120.500 -0.019 0.000 2.115 1687 R HA -0.013 4.327 4.340 -0.000 0.000 0.230 1687 R C 0.534 176.821 176.300 -0.022 0.000 1.111 1687 R CA 0.902 56.995 56.100 -0.012 0.000 0.976 1687 R CB 0.019 30.322 30.300 0.005 0.000 0.870 1687 R HN 0.033 nan 8.270 nan 0.000 0.445 1688 R N -2.362 118.100 120.500 -0.063 0.000 3.854 1688 R HA -0.158 4.181 4.340 -0.000 0.000 0.352 1688 R C -0.486 175.858 176.300 0.073 0.000 1.156 1688 R CA 0.554 56.620 56.100 -0.058 0.000 0.917 1688 R CB -2.533 27.706 30.300 -0.101 0.000 1.471 1688 R HN 0.331 nan 8.270 nan 0.000 0.521 1689 A N 0.268 123.126 122.820 0.064 0.000 2.287 1689 A HA 0.499 4.819 4.320 -0.000 0.000 0.273 1689 A C -0.191 177.422 177.584 0.047 0.000 1.091 1689 A CA -0.246 51.872 52.037 0.135 0.000 0.817 1689 A CB 0.101 19.186 19.000 0.143 0.000 1.069 1689 A HN 0.225 nan 8.150 nan 0.000 0.492 1690 Y N 0.956 121.307 120.300 0.086 0.000 2.624 1690 Y HA 0.298 4.848 4.550 -0.000 0.000 0.354 1690 Y C 0.613 176.526 175.900 0.022 0.000 1.051 1690 Y CA 0.357 58.490 58.100 0.056 0.000 1.377 1690 Y CB 0.115 38.643 38.460 0.114 0.000 1.168 1690 Y HN 0.449 nan 8.280 nan 0.000 0.525 1691 T N 5.563 120.201 114.554 0.140 0.000 2.770 1691 T HA 0.486 4.836 4.350 -0.000 0.000 0.283 1691 T C -0.334 174.451 174.700 0.140 0.000 0.988 1691 T CA -0.645 61.528 62.100 0.123 0.000 0.957 1691 T CB 0.625 69.577 68.868 0.139 0.000 0.930 1691 T HN 0.397 nan 8.240 nan 0.000 0.443 1692 L N 3.999 125.286 121.223 0.107 0.000 2.305 1692 L HA 0.570 4.910 4.340 -0.000 0.000 0.284 1692 L C -1.070 175.912 176.870 0.187 0.000 1.013 1692 L CA -0.817 54.102 54.840 0.133 0.000 0.819 1692 L CB 1.161 43.245 42.059 0.043 0.000 1.227 1692 L HN 0.693 nan 8.230 nan 0.000 0.417 1693 F N 4.226 124.218 119.950 0.069 0.000 2.513 1693 F HA 0.579 5.106 4.527 -0.000 0.000 0.358 1693 F C 0.170 176.009 175.800 0.066 0.000 1.118 1693 F CA -0.957 57.081 58.000 0.063 0.000 1.037 1693 F CB 1.104 40.144 39.000 0.067 0.000 1.276 1693 F HN 0.513 nan 8.300 nan 0.000 0.446 1694 A N 4.619 127.721 122.820 0.471 0.000 2.362 1694 A HA 0.581 4.901 4.320 -0.000 0.000 0.276 1694 A C -0.125 177.694 177.584 0.392 0.000 1.153 1694 A CA 0.026 52.251 52.037 0.313 0.000 0.813 1694 A CB 1.050 20.173 19.000 0.205 0.000 1.081 1694 A HN 0.693 nan 8.150 nan 0.000 0.507 1695 T N 0.067 114.725 114.554 0.173 0.000 2.812 1695 T HA 0.529 4.878 4.350 -0.000 0.000 0.294 1695 T C -0.092 174.542 174.700 -0.109 0.000 1.159 1695 T CA -0.267 61.880 62.100 0.077 0.000 1.008 1695 T CB 1.148 69.925 68.868 -0.152 0.000 1.289 1695 T HN 0.670 nan 8.240 nan 0.000 0.514 1696 H N -0.631 118.175 119.070 -0.440 0.000 2.986 1696 H HA 0.401 4.957 4.556 -0.000 0.000 0.267 1696 H C -0.681 174.291 175.328 -0.593 0.000 1.072 1696 H CA 0.018 55.742 56.048 -0.540 0.000 1.202 1696 H CB 0.275 29.780 29.762 -0.428 0.000 1.535 1696 H HN 0.430 nan 8.280 nan 0.000 0.522 1697 Y N 0.502 120.710 120.300 -0.154 0.000 2.613 1697 Y HA 0.044 4.594 4.550 -0.000 0.000 0.354 1697 Y C 0.343 176.130 175.900 -0.187 0.000 1.063 1697 Y CA -0.610 57.427 58.100 -0.105 0.000 1.384 1697 Y CB -0.074 38.356 38.460 -0.049 0.000 1.199 1697 Y HN 0.120 nan 8.280 nan 0.000 0.517 1698 F N 0.623 120.627 119.950 0.090 0.000 2.408 1698 F HA -0.183 4.344 4.527 -0.000 0.000 0.300 1698 F C 1.767 177.571 175.800 0.007 0.000 1.090 1698 F CA 0.882 58.890 58.000 0.013 0.000 1.427 1698 F CB -0.173 38.820 39.000 -0.011 0.000 1.070 1698 F HN 0.486 nan 8.300 nan 0.000 0.549 1699 E N 0.699 121.008 120.200 0.182 0.000 2.070 1699 E HA -0.213 4.137 4.350 -0.000 0.000 0.197 1699 E C 2.297 178.911 176.600 0.023 0.000 1.004 1699 E CA 1.208 57.658 56.400 0.083 0.000 0.805 1699 E CB -0.573 29.152 29.700 0.041 0.000 0.744 1699 E HN 0.354 nan 8.360 nan 0.000 0.451 1700 L N 0.340 121.553 121.223 -0.015 0.000 2.081 1700 L HA -0.226 4.114 4.340 -0.000 0.000 0.212 1700 L C 2.279 179.105 176.870 -0.072 0.000 1.080 1700 L CA 1.476 56.259 54.840 -0.095 0.000 0.754 1700 L CB -0.825 41.086 42.059 -0.247 0.000 0.893 1700 L HN 0.214 nan 8.230 nan 0.000 0.433 1701 T N -0.427 114.106 114.554 -0.034 0.000 2.897 1701 T HA -0.093 4.257 4.350 -0.000 0.000 0.271 1701 T C 1.180 175.884 174.700 0.007 0.000 1.084 1701 T CA 1.332 63.431 62.100 -0.001 0.000 1.123 1701 T CB -0.081 68.826 68.868 0.066 0.000 0.865 1701 T HN 0.454 nan 8.240 nan 0.000 0.496 1702 A N 0.062 122.885 122.820 0.006 0.000 2.643 1702 A HA 0.492 4.812 4.320 -0.000 0.000 0.295 1702 A C 1.582 179.154 177.584 -0.020 0.000 1.065 1702 A CA -0.339 51.696 52.037 -0.003 0.000 0.986 1702 A CB -0.118 18.886 19.000 0.006 0.000 1.212 1702 A HN 0.378 nan 8.150 nan 0.000 0.516 1703 L N -0.542 120.659 121.223 -0.037 0.000 2.201 1703 L HA -0.026 4.314 4.340 -0.000 0.000 0.212 1703 L C 1.891 178.724 176.870 -0.061 0.000 1.105 1703 L CA 1.459 56.267 54.840 -0.053 0.000 0.775 1703 L CB -0.540 41.474 42.059 -0.075 0.000 0.913 1703 L HN 0.735 nan 8.230 nan 0.000 0.440 1704 G N 0.679 109.445 108.800 -0.057 0.000 2.160 1704 G HA2 -0.277 3.683 3.960 -0.000 0.000 0.244 1704 G HA3 -0.277 3.683 3.960 -0.000 0.000 0.244 1704 G C 0.124 174.974 174.900 -0.082 0.000 1.022 1704 G CA -0.093 44.976 45.100 -0.052 0.000 0.741 1704 G HN 0.240 nan 8.290 nan 0.000 0.508 1705 L N 0.435 121.567 121.223 -0.151 0.000 2.417 1705 L HA 0.284 4.624 4.340 -0.000 0.000 0.268 1705 L C 0.317 177.111 176.870 -0.126 0.000 1.158 1705 L CA -1.555 53.117 54.840 -0.280 0.000 0.819 1705 L CB 0.629 42.260 42.059 -0.714 0.000 1.112 1705 L HN -0.012 nan 8.230 nan 0.000 0.458 1706 P HA -0.190 nan 4.420 nan 0.000 0.216 1706 P C 0.708 178.108 177.300 0.167 0.000 1.153 1706 P CA 1.560 64.717 63.100 0.095 0.000 0.858 1706 P CB 0.146 31.923 31.700 0.128 0.000 0.789 1707 R N -1.078 119.660 120.500 0.396 0.000 2.466 1707 R HA 0.236 4.576 4.340 -0.000 0.000 0.279 1707 R C 0.526 176.969 176.300 0.237 0.000 0.976 1707 R CA -0.663 55.608 56.100 0.285 0.000 1.081 1707 R CB -0.161 30.241 30.300 0.171 0.000 1.215 1707 R HN 0.162 nan 8.270 nan 0.000 0.546 1708 L N 1.395 122.716 121.223 0.163 0.000 2.418 1708 L HA 0.312 4.652 4.340 -0.000 0.000 0.265 1708 L C -0.323 176.595 176.870 0.080 0.000 1.143 1708 L CA 0.308 55.207 54.840 0.100 0.000 0.809 1708 L CB 0.721 42.785 42.059 0.008 0.000 1.124 1708 L HN -0.048 nan 8.230 nan 0.000 0.456 1709 K N 2.622 123.070 120.400 0.080 0.000 2.562 1709 K HA 0.439 4.759 4.320 -0.000 0.000 0.267 1709 K C -1.596 175.051 176.600 0.079 0.000 0.938 1709 K CA -0.706 55.628 56.287 0.078 0.000 0.840 1709 K CB 1.314 33.871 32.500 0.094 0.000 1.390 1709 K HN 0.750 nan 8.250 nan 0.000 0.428 1710 N N 2.956 121.702 118.700 0.075 0.000 2.384 1710 N HA 0.624 5.364 4.740 -0.000 0.000 0.301 1710 N C -1.171 174.408 175.510 0.116 0.000 1.133 1710 N CA -0.421 52.677 53.050 0.081 0.000 0.853 1710 N CB 1.454 39.973 38.487 0.053 0.000 1.241 1710 N HN 0.442 nan 8.380 nan 0.000 0.502 1711 L N 1.183 122.492 121.223 0.144 0.000 2.582 1711 L HA 0.421 4.761 4.340 -0.000 0.000 0.257 1711 L C -1.067 175.942 176.870 0.231 0.000 0.974 1711 L CA -0.841 54.104 54.840 0.175 0.000 0.851 1711 L CB 2.570 44.709 42.059 0.133 0.000 1.424 1711 L HN 0.690 nan 8.230 nan 0.000 0.412 1712 H N 0.243 119.316 119.070 0.006 0.000 2.981 1712 H HA 0.713 5.269 4.556 -0.000 0.000 0.327 1712 H C -1.648 173.672 175.328 -0.014 0.000 1.342 1712 H CA -0.750 55.303 56.048 0.009 0.000 1.123 1712 H CB 1.390 31.178 29.762 0.044 0.000 1.851 1712 H HN 0.396 nan 8.280 nan 0.000 0.531 1713 V N -1.345 118.475 119.914 -0.156 0.000 3.019 1713 V HA 1.027 5.147 4.120 -0.000 0.000 0.317 1713 V C 0.063 176.095 176.094 -0.103 0.000 1.094 1713 V CA -0.283 61.900 62.300 -0.194 0.000 1.000 1713 V CB 0.958 32.743 31.823 -0.062 0.000 1.060 1713 V HN 1.314 nan 8.190 nan 0.000 0.443 1714 A N 1.001 123.768 122.820 -0.089 0.000 2.552 1714 A HA 1.084 5.404 4.320 -0.000 0.000 0.288 1714 A C -0.446 177.044 177.584 -0.158 0.000 1.193 1714 A CA -0.476 51.543 52.037 -0.029 0.000 0.713 1714 A CB 1.560 20.556 19.000 -0.006 0.000 1.305 1714 A HN 2.489 nan 8.150 nan 0.000 0.424 1715 A N 0.244 122.875 122.820 -0.315 0.000 2.486 1715 A HA 0.765 5.085 4.320 -0.000 0.000 0.300 1715 A C -0.460 176.750 177.584 -0.622 0.000 1.048 1715 A CA -0.664 50.994 52.037 -0.631 0.000 0.696 1715 A CB 1.208 19.670 19.000 -0.897 0.000 1.278 1715 A HN 0.677 nan 8.150 nan 0.000 0.405 1716 R N 0.681 120.709 120.500 -0.787 0.000 2.606 1716 R HA 0.481 4.821 4.340 -0.000 0.000 0.249 1716 R C -0.678 175.375 176.300 -0.411 0.000 1.127 1716 R CA -0.454 55.328 56.100 -0.530 0.000 1.133 1716 R CB 0.688 30.637 30.300 -0.586 0.000 1.243 1716 R HN 0.803 nan 8.270 nan 0.000 0.558 1717 E N 1.848 121.907 120.200 -0.235 0.000 3.170 1717 E HA 0.162 4.512 4.350 -0.000 0.000 0.212 1717 E C -0.607 175.919 176.600 -0.124 0.000 1.143 1717 E CA -0.126 56.171 56.400 -0.171 0.000 1.139 1717 E CB 0.863 30.508 29.700 -0.091 0.000 1.346 1717 E HN 0.354 nan 8.360 nan 0.000 0.432 1718 E N 0.481 120.597 120.200 -0.141 0.000 2.349 1718 E HA 0.396 4.746 4.350 -0.000 0.000 0.262 1718 E C 0.930 177.492 176.600 -0.062 0.000 1.088 1718 E CA 0.004 56.360 56.400 -0.075 0.000 0.899 1718 E CB 1.269 30.943 29.700 -0.044 0.000 1.044 1718 E HN 0.324 nan 8.360 nan 0.000 0.420 1719 A N 2.136 124.934 122.820 -0.036 0.000 5.159 1719 A HA -0.375 3.945 4.320 -0.000 0.000 0.362 1719 A C 1.668 179.234 177.584 -0.031 0.000 1.583 1719 A CA 2.363 54.383 52.037 -0.027 0.000 0.689 1719 A CB -2.165 16.822 19.000 -0.021 0.000 1.532 1719 A HN 0.858 nan 8.150 nan 0.000 0.417 1720 G N -2.595 106.185 108.800 -0.032 0.000 2.499 1720 G HA2 0.387 4.347 3.960 -0.000 0.000 0.213 1720 G HA3 0.387 4.347 3.960 -0.000 0.000 0.213 1720 G C 1.313 176.189 174.900 -0.039 0.000 1.230 1720 G CA 1.855 46.938 45.100 -0.029 0.000 0.813 1720 G HN 1.755 nan 8.290 nan 0.000 0.542 1721 G N -0.762 108.002 108.800 -0.059 0.000 2.667 1721 G HA2 0.504 4.464 3.960 -0.000 0.000 0.209 1721 G HA3 0.504 4.464 3.960 -0.000 0.000 0.209 1721 G C -0.567 174.241 174.900 -0.153 0.000 1.963 1721 G CA -0.424 44.630 45.100 -0.076 0.000 0.728 1721 G HN 0.256 nan 8.290 nan 0.000 0.807 1722 L N 1.189 122.270 121.223 -0.238 0.000 2.381 1722 L HA 0.609 4.949 4.340 -0.000 0.000 0.274 1722 L C -1.103 175.369 176.870 -0.664 0.000 0.988 1722 L CA -0.811 53.735 54.840 -0.490 0.000 0.824 1722 L CB 2.498 44.167 42.059 -0.651 0.000 1.263 1722 L HN 0.025 nan 8.230 nan 0.000 0.410 1723 V N 3.258 122.777 119.914 -0.658 0.000 2.384 1723 V HA 0.388 4.507 4.120 -0.000 0.000 0.287 1723 V C -0.466 175.183 176.094 -0.742 0.000 1.020 1723 V CA -0.392 61.595 62.300 -0.522 0.000 0.850 1723 V CB 1.488 33.187 31.823 -0.207 0.000 0.987 1723 V HN 0.362 nan 8.190 nan 0.000 0.436 1724 F N 4.750 124.541 119.950 -0.266 0.000 2.390 1724 F HA 0.459 4.986 4.527 -0.000 0.000 0.361 1724 F C 0.334 175.907 175.800 -0.379 0.000 1.124 1724 F CA -0.497 57.302 58.000 -0.335 0.000 1.149 1724 F CB 0.109 38.976 39.000 -0.221 0.000 1.160 1724 F HN 0.375 nan 8.300 nan 0.000 0.501 1725 Y N 2.586 122.713 120.300 -0.289 0.000 2.309 1725 Y HA 0.154 4.704 4.550 -0.000 0.000 0.327 1725 Y C 0.855 176.522 175.900 -0.388 0.000 1.172 1725 Y CA -0.953 56.932 58.100 -0.359 0.000 1.280 1725 Y CB 0.826 39.163 38.460 -0.205 0.000 1.234 1725 Y HN 0.448 nan 8.280 nan 0.000 0.512 1726 H N 2.927 122.032 119.070 0.059 0.000 2.638 1726 H HA 0.157 4.713 4.556 -0.000 0.000 0.293 1726 H C -0.815 174.442 175.328 -0.119 0.000 1.316 1726 H CA -0.254 55.753 56.048 -0.069 0.000 1.099 1726 H CB -0.173 29.486 29.762 -0.171 0.000 1.515 1726 H HN 0.626 nan 8.280 nan 0.000 0.505 1727 Q N 0.499 120.284 119.800 -0.024 0.000 2.307 1727 Q HA 0.328 4.668 4.340 -0.000 0.000 0.262 1727 Q C -0.196 175.705 176.000 -0.165 0.000 0.961 1727 Q CA -0.564 55.188 55.803 -0.085 0.000 0.882 1727 Q CB 2.768 31.469 28.738 -0.062 0.000 1.264 1727 Q HN 0.091 nan 8.270 nan 0.000 0.446 1728 V N 5.048 124.815 119.914 -0.245 0.000 2.338 1728 V HA 0.203 4.323 4.120 -0.000 0.000 0.255 1728 V C -0.152 175.794 176.094 -0.246 0.000 1.082 1728 V CA -0.289 61.800 62.300 -0.352 0.000 0.951 1728 V CB -0.694 30.700 31.823 -0.715 0.000 1.102 1728 V HN 0.612 nan 8.190 nan 0.000 0.489 1729 L N 7.334 128.406 121.223 -0.252 0.000 2.421 1729 L HA 0.540 4.880 4.340 -0.000 0.000 0.263 1729 L C -2.019 174.839 176.870 -0.020 0.000 1.122 1729 L CA -1.900 52.847 54.840 -0.154 0.000 0.804 1729 L CB 0.784 42.714 42.059 -0.216 0.000 1.150 1729 L HN 0.327 nan 8.230 nan 0.000 0.457 1730 P HA 0.290 nan 4.420 nan 0.000 0.278 1730 P C 0.001 177.419 177.300 0.197 0.000 1.238 1730 P CA 0.254 63.425 63.100 0.120 0.000 0.794 1730 P CB 1.389 33.136 31.700 0.078 0.000 0.955 1731 G N 2.423 111.317 108.800 0.157 0.000 2.746 1731 G HA2 -0.090 3.870 3.960 -0.000 0.000 0.685 1731 G HA3 -0.090 3.870 3.960 -0.000 0.000 0.685 1731 G C -3.133 171.790 174.900 0.038 0.000 1.350 1731 G CA -0.806 44.346 45.100 0.088 0.000 0.837 1731 G HN 0.576 nan 8.290 nan 0.000 0.564 1732 P HA 0.559 nan 4.420 nan 0.000 0.278 1732 P C 0.205 177.159 177.300 -0.577 0.000 1.258 1732 P CA 0.462 63.454 63.100 -0.180 0.000 0.811 1732 P CB 1.328 33.017 31.700 -0.019 0.000 1.063 1733 A N 1.333 123.957 122.820 -0.326 0.000 2.287 1733 A HA 0.433 4.753 4.320 -0.000 0.000 0.273 1733 A C 1.161 178.730 177.584 -0.025 0.000 1.091 1733 A CA 0.110 52.036 52.037 -0.186 0.000 0.817 1733 A CB -0.069 19.090 19.000 0.265 0.000 1.069 1733 A HN 0.592 nan 8.150 nan 0.000 0.492 1734 S N -0.944 114.698 115.700 -0.096 0.000 2.632 1734 S HA 0.300 4.770 4.470 -0.000 0.000 0.237 1734 S C 0.390 174.764 174.600 -0.376 0.000 1.037 1734 S CA -0.181 57.860 58.200 -0.264 0.000 1.009 1734 S CB 0.045 63.131 63.200 -0.190 0.000 0.974 1734 S HN 0.624 nan 8.310 nan 0.000 0.544 1735 K N 0.757 121.020 120.400 -0.228 0.000 2.378 1735 K HA 0.683 5.003 4.320 -0.000 0.000 0.244 1735 K C -1.270 175.245 176.600 -0.142 0.000 1.039 1735 K CA -0.639 55.460 56.287 -0.313 0.000 0.863 1735 K CB 2.059 34.263 32.500 -0.493 0.000 1.326 1735 K HN 0.100 nan 8.250 nan 0.000 0.460 1736 S N 0.554 116.112 115.700 -0.237 0.000 2.557 1736 S HA 0.400 4.870 4.470 -0.000 0.000 0.291 1736 S C -1.102 173.379 174.600 -0.198 0.000 1.116 1736 S CA -0.558 57.634 58.200 -0.012 0.000 0.992 1736 S CB 0.456 63.731 63.200 0.124 0.000 1.028 1736 S HN 0.554 nan 8.310 nan 0.000 0.484 1737 Y N 3.466 123.834 120.300 0.113 0.000 2.683 1737 Y HA 0.299 4.849 4.550 -0.000 0.000 0.297 1737 Y C 1.924 177.883 175.900 0.100 0.000 1.147 1737 Y CA -0.206 57.950 58.100 0.093 0.000 1.274 1737 Y CB -0.170 38.356 38.460 0.109 0.000 1.143 1737 Y HN 0.832 nan 8.280 nan 0.000 0.527 1738 G N 0.502 109.414 108.800 0.187 0.000 2.679 1738 G HA2 -0.294 3.666 3.960 -0.000 0.000 0.217 1738 G HA3 -0.294 3.666 3.960 -0.000 0.000 0.217 1738 G C 1.732 176.702 174.900 0.116 0.000 1.267 1738 G CA 1.797 46.985 45.100 0.147 0.000 0.799 1738 G HN 0.247 nan 8.290 nan 0.000 0.606 1739 V N 0.845 120.807 119.914 0.079 0.000 2.324 1739 V HA -0.206 3.914 4.120 -0.000 0.000 0.250 1739 V C 2.772 178.912 176.094 0.075 0.000 1.060 1739 V CA 2.474 64.809 62.300 0.059 0.000 1.042 1739 V CB -0.648 31.194 31.823 0.031 0.000 0.650 1739 V HN 0.339 nan 8.190 nan 0.000 0.450 1740 E N -0.050 120.214 120.200 0.107 0.000 2.153 1740 E HA -0.146 4.204 4.350 -0.000 0.000 0.194 1740 E C 2.059 178.733 176.600 0.123 0.000 0.988 1740 E CA 1.180 57.656 56.400 0.127 0.000 0.811 1740 E CB -0.358 29.479 29.700 0.229 0.000 0.746 1740 E HN 0.491 nan 8.360 nan 0.000 0.466 1741 V N 0.132 120.138 119.914 0.153 0.000 2.535 1741 V HA -0.085 4.034 4.120 -0.000 0.000 0.246 1741 V C 2.107 178.258 176.094 0.095 0.000 1.045 1741 V CA 1.362 63.747 62.300 0.142 0.000 1.058 1741 V CB -0.554 31.375 31.823 0.177 0.000 0.689 1741 V HN 0.301 nan 8.190 nan 0.000 0.461 1742 A N 0.326 123.194 122.820 0.080 0.000 1.972 1742 A HA 0.156 4.476 4.320 -0.000 0.000 0.219 1742 A C 1.698 179.310 177.584 0.047 0.000 1.169 1742 A CA 1.167 53.238 52.037 0.056 0.000 0.635 1742 A CB -0.518 18.510 19.000 0.048 0.000 0.810 1742 A HN 0.569 nan 8.150 nan 0.000 0.446 1746 G N -0.782 108.034 108.800 0.026 0.000 2.164 1746 G HA2 0.019 3.979 3.960 -0.000 0.000 0.154 1746 G HA3 0.019 3.979 3.960 -0.000 0.000 0.154 1746 G C -0.160 174.750 174.900 0.018 0.000 1.014 1746 G CA 0.022 45.134 45.100 0.020 0.000 0.683 1746 G HN 0.913 nan 8.290 nan 0.000 0.500 1747 L N 1.709 122.944 121.223 0.021 0.000 2.499 1747 L HA 0.332 4.672 4.340 -0.000 0.000 0.273 1747 L C -1.472 175.407 176.870 0.015 0.000 1.195 1747 L CA -1.263 53.589 54.840 0.018 0.000 0.882 1747 L CB 0.117 42.189 42.059 0.022 0.000 1.133 1747 L HN -0.036 nan 8.230 nan 0.000 0.483 1748 P HA -0.039 nan 4.420 nan 0.000 0.260 1748 P C 0.514 177.820 177.300 0.010 0.000 1.172 1748 P CA 0.277 63.383 63.100 0.010 0.000 0.760 1748 P CB 0.368 32.073 31.700 0.009 0.000 0.773 1749 K N 2.519 122.924 120.400 0.009 0.000 2.144 1749 K HA -0.278 4.042 4.320 -0.000 0.000 0.209 1749 K C 1.483 178.087 176.600 0.006 0.000 1.047 1749 K CA 1.925 58.216 56.287 0.007 0.000 0.927 1749 K CB -0.149 32.354 32.500 0.006 0.000 0.716 1749 K HN 0.512 nan 8.250 nan 0.000 0.454 1750 E N 0.330 120.533 120.200 0.006 0.000 2.047 1750 E HA -0.137 4.213 4.350 -0.000 0.000 0.191 1750 E C 2.044 178.648 176.600 0.006 0.000 0.987 1750 E CA 1.214 57.617 56.400 0.005 0.000 0.799 1750 E CB -0.334 29.369 29.700 0.004 0.000 0.752 1750 E HN 0.034 nan 8.360 nan 0.000 0.449 1751 V N 0.770 120.689 119.914 0.007 0.000 2.343 1751 V HA -0.241 3.879 4.120 -0.000 0.000 0.247 1751 V C 2.262 178.362 176.094 0.010 0.000 1.051 1751 V CA 1.426 63.731 62.300 0.009 0.000 1.036 1751 V CB -0.624 31.205 31.823 0.010 0.000 0.654 1751 V HN 0.129 nan 8.190 nan 0.000 0.451 1752 V N 0.518 120.439 119.914 0.011 0.000 2.295 1752 V HA -0.266 3.854 4.120 -0.000 0.000 0.246 1752 V C 2.777 178.876 176.094 0.009 0.000 1.049 1752 V CA 2.122 64.430 62.300 0.013 0.000 1.024 1752 V CB -1.249 30.583 31.823 0.015 0.000 0.648 1752 V HN 0.556 nan 8.190 nan 0.000 0.447 1753 A N 0.462 123.285 122.820 0.006 0.000 1.908 1753 A HA -0.279 4.041 4.320 -0.000 0.000 0.218 1753 A C 2.305 179.890 177.584 0.001 0.000 1.181 1753 A CA 2.272 54.310 52.037 0.002 0.000 0.627 1753 A CB -0.569 18.432 19.000 0.001 0.000 0.818 1753 A HN 0.471 nan 8.150 nan 0.000 0.445 1754 R N 0.345 120.847 120.500 0.003 0.000 2.096 1754 R HA -0.035 4.305 4.340 -0.000 0.000 0.235 1754 R C 2.082 178.383 176.300 0.002 0.000 1.127 1754 R CA 2.026 58.127 56.100 0.002 0.000 0.968 1754 R CB -0.984 29.318 30.300 0.003 0.000 0.861 1754 R HN 0.390 nan 8.270 nan 0.000 0.440 1755 A N 0.771 123.594 122.820 0.005 0.000 1.877 1755 A HA -0.120 4.200 4.320 -0.000 0.000 0.216 1755 A C 2.218 179.803 177.584 0.002 0.000 1.186 1755 A CA 1.515 53.556 52.037 0.007 0.000 0.620 1755 A CB -0.481 18.527 19.000 0.012 0.000 0.822 1755 A HN 0.348 nan 8.150 nan 0.000 0.443 1756 R N -0.589 119.910 120.500 -0.001 0.000 2.091 1756 R HA -0.134 4.206 4.340 -0.000 0.000 0.238 1756 R C 2.507 178.800 176.300 -0.011 0.000 1.136 1756 R CA 1.280 57.375 56.100 -0.008 0.000 0.959 1756 R CB -0.590 29.705 30.300 -0.009 0.000 0.856 1756 R HN 0.533 nan 8.270 nan 0.000 0.437 1757 A N 1.468 124.283 122.820 -0.008 0.000 1.883 1757 A HA -0.156 4.163 4.320 -0.000 0.000 0.217 1757 A C 2.271 179.850 177.584 -0.009 0.000 1.186 1757 A CA 1.225 53.257 52.037 -0.009 0.000 0.624 1757 A CB -0.606 18.390 19.000 -0.006 0.000 0.822 1757 A HN 0.173 nan 8.150 nan 0.000 0.444 1758 L N -0.715 120.504 121.223 -0.005 0.000 1.994 1758 L HA -0.209 4.131 4.340 -0.000 0.000 0.208 1758 L C 2.655 179.521 176.870 -0.007 0.000 1.071 1758 L CA 1.264 56.101 54.840 -0.004 0.000 0.745 1758 L CB -0.730 41.330 42.059 0.001 0.000 0.892 1758 L HN 0.401 nan 8.230 nan 0.000 0.431 1759 L N -0.662 120.556 121.223 -0.008 0.000 1.976 1759 L HA -0.335 4.004 4.340 -0.000 0.000 0.223 1759 L C 2.821 179.677 176.870 -0.023 0.000 1.081 1759 L CA 1.567 56.399 54.840 -0.015 0.000 0.784 1759 L CB -0.587 41.459 42.059 -0.021 0.000 0.896 1759 L HN 0.319 nan 8.230 nan 0.000 0.438 1760 Q N -0.143 119.641 119.800 -0.026 0.000 2.050 1760 Q HA 0.003 4.343 4.340 -0.000 0.000 0.202 1760 Q C 1.166 177.152 176.000 -0.024 0.000 0.980 1760 Q CA 1.167 56.952 55.803 -0.030 0.000 0.840 1760 Q CB -0.698 28.022 28.738 -0.029 0.000 0.898 1760 Q HN 0.548 nan 8.270 nan 0.000 0.424 1761 A N 0.000 122.809 122.820 -0.018 0.000 2.254 1761 A HA 0.000 4.320 4.320 -0.000 0.000 0.244 1761 A CA 0.000 52.029 52.037 -0.014 0.000 0.836 1761 A CB 0.000 18.994 19.000 -0.010 0.000 0.831 1761 A HN 0.000 nan 8.150 nan 0.000 0.486