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 2iuk_1_B DATA FIRST_RESID 1008 DATA SEQUENCE GQKIKGTVVL MPKNVLDFNA ITSIXXXXXX XXXXXXXXXX XXXXXXVIDT DATA SEQUENCE ATSFLGRNIS MQLISATQTD GSGNGKVGKE VYLEKHLPTL PTLGARQDAF DATA SEQUENCE SIFFEWDASF GIPGAFYIKN FMTDEFFLVS VKLEDIPNHG TIEFVCNSWV DATA SEQUENCE YNFRSYKKNR IFFVNDTYLP SATPAPLLKY RKEEFEVLRG DGTGKRKDFD DATA SEQUENCE RIYDYDVYND LGNPDGGDPR PILGGCSIYP YPLRVRTGRE RTRTDPNSEK DATA SEQUENCE PGEVYVPRDE NFGHLKSSDF LTYGIKSLSH DVIPLFKSAI FQLRVTSSEF DATA SEQUENCE ESFEDVRSLY EGGIKLPTDI LSQISPLPAL KEIFRTDGEN VLQFPPPHVA DATA SEQUENCE KVSKSGVMTD EEFAREVIAG VNPNVIRRLQ EFPPKSTLDP TLYGDQTSTI DATA SEQUENCE TKEQLEINMG GVTVEEALST QRLFILDYQD AFIPYLTRIN SLPTAKAYAT DATA SEQUENCE RTILFLKDDG TLKPLAIELS KPHPDGDNLG PESIVVLPAT EGVDSTIWLL DATA SEQUENCE AKAHVIVNDS GYHQLVSHWL NTHAVMEPFA IATNRHLSVL HPIYKLLYPH DATA SEQUENCE YRDTININGL ARQSLINADG IIEKSFLPGK YSIEMSSSVY KNWVFTHQAL DATA SEQUENCE PADLVKRGLA IEDPSAPHGL RLVIEDYPYA VDGLEIWDAI KTWVHEYVSL DATA SEQUENCE YYPTDAAVQQ DTELQAWWKE AVEKGHGDLK EKPWWPKKQT TEDLIQSCSI DATA SEQUENCE IVWTASALHA AVNFGQYPYG GLILNRPTLA RRFIPAEGTP EYDEMVKNPQ DATA SEQUENCE KAYLRTITPK FETLIDLSVI EILSRHASDE IYLGERETPN WTTDKKALEA DATA SEQUENCE FKRFGSKLTG IEGKINARNS DPSLRNRTGP VQLPYTLLHR SSEEGLTFKG DATA SEQUENCE IPNSISI 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 1008 G HA2 0.000 nan 3.960 nan 0.000 0.244 1008 G HA3 0.000 3.945 3.960 -0.025 0.000 0.244 1008 G C 0.000 175.039 174.900 0.231 0.000 0.946 1008 G CA 0.000 45.307 45.100 0.345 0.000 0.502 1009 Q N -0.919 118.938 119.800 0.095 0.000 3.093 1009 Q HA 0.744 5.069 4.340 -0.025 0.000 0.330 1009 Q C -1.119 174.853 176.000 -0.046 0.000 0.947 1009 Q CA -1.188 54.616 55.803 0.001 0.000 0.801 1009 Q CB 1.187 29.892 28.738 -0.054 0.000 1.470 1009 Q HN -0.061 nan 8.270 nan 0.000 0.498 1010 K N 2.062 122.452 120.400 -0.015 0.000 2.206 1010 K HA 0.351 4.656 4.320 -0.025 0.000 0.268 1010 K C -0.423 176.219 176.600 0.070 0.000 1.111 1010 K CA -0.337 55.981 56.287 0.051 0.000 0.955 1010 K CB -0.230 32.299 32.500 0.048 0.000 1.406 1010 K HN 0.552 nan 8.250 nan 0.000 0.427 1011 I N 0.597 121.142 120.570 -0.042 0.000 2.648 1011 I HA 0.142 4.297 4.170 -0.025 0.000 0.284 1011 I C 0.174 176.377 176.117 0.144 0.000 1.153 1011 I CA -0.401 60.866 61.300 -0.055 0.000 1.426 1011 I CB 0.573 38.418 38.000 -0.258 0.000 1.381 1011 I HN 0.408 nan 8.210 nan 0.000 0.571 1012 K N 4.925 125.368 120.400 0.072 0.000 2.211 1012 K HA 0.890 5.195 4.320 -0.025 0.000 0.237 1012 K C -0.349 176.251 176.600 -0.000 0.000 1.002 1012 K CA -0.876 55.355 56.287 -0.093 0.000 0.885 1012 K CB 1.829 34.163 32.500 -0.277 0.000 1.136 1012 K HN 0.852 nan 8.250 nan 0.000 0.448 1013 G N 0.073 108.800 108.800 -0.122 0.000 2.620 1013 G HA2 0.459 4.404 3.960 -0.025 0.000 0.301 1013 G HA3 0.459 4.404 3.960 -0.025 0.000 0.301 1013 G C -1.449 173.352 174.900 -0.165 0.000 1.347 1013 G CA -0.753 44.343 45.100 -0.007 0.000 0.971 1013 G HN 0.466 nan 8.290 nan 0.000 0.488 1014 T N 1.138 115.638 114.554 -0.090 0.000 2.788 1014 T HA 0.448 4.783 4.350 -0.025 0.000 0.296 1014 T C -0.384 174.272 174.700 -0.073 0.000 1.009 1014 T CA -0.293 61.753 62.100 -0.091 0.000 0.949 1014 T CB 1.467 70.299 68.868 -0.061 0.000 0.946 1014 T HN 0.312 nan 8.240 nan 0.000 0.453 1015 V N 4.901 124.765 119.914 -0.084 0.000 2.313 1015 V HA 0.307 4.412 4.120 -0.025 0.000 0.278 1015 V C 0.041 176.093 176.094 -0.069 0.000 1.017 1015 V CA -0.702 61.535 62.300 -0.104 0.000 0.823 1015 V CB 1.301 33.029 31.823 -0.157 0.000 1.010 1015 V HN 0.699 nan 8.190 nan 0.000 0.443 1016 V N 7.584 127.455 119.914 -0.072 0.000 2.432 1016 V HA 0.590 4.695 4.120 -0.025 0.000 0.275 1016 V C -0.109 175.929 176.094 -0.094 0.000 1.043 1016 V CA -0.290 61.977 62.300 -0.054 0.000 0.925 1016 V CB 1.105 32.913 31.823 -0.025 0.000 0.985 1016 V HN 0.778 nan 8.190 nan 0.000 0.466 1017 L N 2.937 124.092 121.223 -0.113 0.000 2.479 1017 L HA 0.843 5.168 4.340 -0.025 0.000 0.255 1017 L C -0.835 175.985 176.870 -0.082 0.000 1.026 1017 L CA -0.849 53.901 54.840 -0.150 0.000 0.842 1017 L CB 2.354 44.160 42.059 -0.422 0.000 1.444 1017 L HN 0.433 nan 8.230 nan 0.000 0.409 1018 M N 1.290 120.905 119.600 0.026 0.000 2.327 1018 M HA 0.551 5.016 4.480 -0.025 0.000 0.298 1018 M C -2.642 173.728 176.300 0.117 0.000 1.065 1018 M CA -1.437 53.904 55.300 0.068 0.000 0.916 1018 M CB 2.572 35.239 32.600 0.112 0.000 1.630 1018 M HN 0.396 nan 8.290 nan 0.000 0.442 1019 P HA 0.084 nan 4.420 nan 0.000 0.274 1019 P C 0.038 177.576 177.300 0.398 0.000 1.231 1019 P CA -0.467 62.856 63.100 0.372 0.000 0.790 1019 P CB 0.456 32.431 31.700 0.459 0.000 0.951 1020 K N 2.814 123.529 120.400 0.526 0.000 2.032 1020 K HA -0.272 4.033 4.320 -0.025 0.000 0.218 1020 K C 1.054 177.893 176.600 0.399 0.000 1.054 1020 K CA 2.261 58.894 56.287 0.577 0.000 0.941 1020 K CB -1.966 30.760 32.500 0.376 0.000 0.720 1020 K HN 0.404 nan 8.250 nan 0.000 0.449 1021 N N 0.715 119.583 118.700 0.280 0.000 2.430 1021 N HA -0.090 4.635 4.740 -0.025 0.000 0.186 1021 N C 1.587 177.212 175.510 0.191 0.000 1.032 1021 N CA 0.893 54.063 53.050 0.200 0.000 0.893 1021 N CB -0.013 38.569 38.487 0.159 0.000 0.957 1021 N HN 0.013 nan 8.380 nan 0.000 0.442 1022 V N 0.280 120.324 119.914 0.217 0.000 2.871 1022 V HA -0.030 4.075 4.120 -0.025 0.000 0.256 1022 V C 1.463 177.689 176.094 0.221 0.000 1.082 1022 V CA 1.145 63.554 62.300 0.182 0.000 1.105 1022 V CB -0.129 31.786 31.823 0.154 0.000 0.713 1022 V HN 0.330 nan 8.190 nan 0.000 0.473 1023 L N 0.097 121.502 121.223 0.303 0.000 2.766 1023 L HA 0.294 4.619 4.340 -0.025 0.000 0.242 1023 L C 0.279 177.482 176.870 0.554 0.000 1.136 1023 L CA -0.039 55.033 54.840 0.388 0.000 0.933 1023 L CB 0.317 42.566 42.059 0.318 0.000 1.241 1023 L HN 0.486 nan 8.230 nan 0.000 0.522 1024 D N -2.427 118.203 120.400 0.384 0.000 2.248 1024 D HA 0.108 4.733 4.640 -0.025 0.000 0.246 1024 D C 0.890 177.145 176.300 -0.075 0.000 1.027 1024 D CA -0.708 53.434 54.000 0.236 0.000 0.853 1024 D CB 1.105 41.987 40.800 0.137 0.000 1.243 1024 D HN -0.055 nan 8.370 nan 0.000 0.462 1025 F N 2.635 122.112 119.950 -0.788 0.000 2.091 1025 F HA -0.193 4.320 4.527 -0.022 0.000 0.299 1025 F C 1.848 177.312 175.800 -0.560 0.000 1.103 1025 F CA 1.806 59.106 58.000 -1.166 0.000 1.228 1025 F CB -0.252 37.562 39.000 -1.976 0.000 0.984 1025 F HN 0.480 nan 8.300 nan 0.000 0.477 1026 N N 0.305 118.919 118.700 -0.144 0.000 2.216 1026 N HA -0.067 4.658 4.740 -0.025 0.000 0.183 1026 N C 1.461 176.891 175.510 -0.134 0.000 1.017 1026 N CA 1.150 54.142 53.050 -0.095 0.000 0.861 1026 N CB -0.380 38.136 38.487 0.048 0.000 0.986 1026 N HN 0.271 nan 8.380 nan 0.000 0.428 1027 A N -0.660 122.113 122.820 -0.078 0.000 2.255 1027 A HA 0.130 4.435 4.320 -0.025 0.000 0.206 1027 A C 1.655 179.203 177.584 -0.059 0.000 1.193 1027 A CA 0.413 52.428 52.037 -0.037 0.000 0.794 1027 A CB -0.488 18.531 19.000 0.031 0.000 0.794 1027 A HN 0.388 nan 8.150 nan 0.000 0.481 1028 I N -1.644 118.826 120.570 -0.167 0.000 3.565 1028 I HA -0.046 4.109 4.170 -0.025 0.000 0.287 1028 I C 2.068 178.039 176.117 -0.243 0.000 1.193 1028 I CA 1.212 62.414 61.300 -0.164 0.000 1.402 1028 I CB 0.311 38.212 38.000 -0.163 0.000 1.284 1028 I HN 0.347 nan 8.210 nan 0.000 0.454 1029 T N -1.751 112.550 114.554 -0.421 0.000 3.317 1029 T HA 0.203 4.538 4.350 -0.025 0.000 0.250 1029 T C 0.349 174.934 174.700 -0.191 0.000 1.106 1029 T CA -0.116 61.759 62.100 -0.376 0.000 0.986 1029 T CB -0.341 68.136 68.868 -0.652 0.000 1.010 1029 T HN 0.163 nan 8.240 nan 0.000 0.560 1030 S N 0.591 116.208 115.700 -0.138 0.000 2.964 1030 S HA -0.113 4.342 4.470 -0.025 0.000 0.829 1030 S C 0.485 175.059 174.600 -0.043 0.000 0.843 1030 S CA -0.206 57.953 58.200 -0.068 0.000 1.458 1030 S CB -1.498 61.675 63.200 -0.045 0.000 1.044 1030 S HN 0.707 nan 8.310 nan 0.000 0.490 1055 I N 0.425 120.976 120.570 -0.030 0.000 2.934 1055 I HA 0.598 4.753 4.170 -0.025 0.000 0.315 1055 I C -0.427 175.649 176.117 -0.069 0.000 0.997 1055 I CA 0.188 61.462 61.300 -0.043 0.000 1.184 1055 I CB 1.384 39.356 38.000 -0.047 0.000 1.400 1055 I HN 0.932 nan 8.210 nan 0.000 0.549 1056 D N 3.530 123.877 120.400 -0.088 0.000 3.830 1056 D HA -0.133 4.492 4.640 -0.025 0.000 0.247 1056 D C 0.480 176.757 176.300 -0.039 0.000 1.073 1056 D CA 0.640 54.561 54.000 -0.131 0.000 1.116 1056 D CB -0.486 40.115 40.800 -0.331 0.000 0.909 1056 D HN 0.665 nan 8.370 nan 0.000 0.418 1057 T N -0.250 114.306 114.554 0.004 0.000 2.978 1057 T HA 0.055 4.390 4.350 -0.025 0.000 0.262 1057 T C 1.435 176.178 174.700 0.073 0.000 1.063 1057 T CA 1.182 63.301 62.100 0.031 0.000 1.140 1057 T CB 0.268 69.152 68.868 0.026 0.000 0.886 1057 T HN 0.508 nan 8.240 nan 0.000 0.470 1058 A N 2.062 124.959 122.820 0.128 0.000 3.019 1058 A HA 0.311 4.616 4.320 -0.025 0.000 0.262 1058 A C 1.801 179.669 177.584 0.473 0.000 1.509 1058 A CA -0.055 52.137 52.037 0.258 0.000 1.159 1058 A CB -0.854 18.337 19.000 0.318 0.000 1.042 1058 A HN 0.511 nan 8.150 nan 0.000 0.641 1059 T N -2.498 112.264 114.554 0.348 0.000 2.781 1059 T HA -0.077 4.258 4.350 -0.025 0.000 0.252 1059 T C 1.782 176.785 174.700 0.505 0.000 1.039 1059 T CA 0.999 63.422 62.100 0.539 0.000 1.147 1059 T CB -0.572 68.455 68.868 0.266 0.000 0.865 1059 T HN 0.487 nan 8.240 nan 0.000 0.423 1060 S N 1.716 117.489 115.700 0.122 0.000 2.821 1060 S HA -0.321 4.134 4.470 -0.025 0.000 0.364 1060 S C 1.221 175.649 174.600 -0.286 0.000 1.615 1060 S CA 2.226 60.330 58.200 -0.162 0.000 1.180 1060 S CB -1.694 61.260 63.200 -0.411 0.000 1.129 1060 S HN 0.588 nan 8.310 nan 0.000 0.503 1061 F N 2.382 122.262 119.950 -0.116 0.000 2.373 1061 F HA 0.050 4.556 4.527 -0.035 0.000 0.300 1061 F C 1.446 177.089 175.800 -0.262 0.000 1.080 1061 F CA 0.414 58.188 58.000 -0.377 0.000 1.417 1061 F CB -0.394 37.986 39.000 -1.033 0.000 1.070 1061 F HN 0.310 nan 8.300 nan 0.000 0.546 1062 L N -1.922 119.336 121.223 0.057 0.000 2.416 1062 L HA 0.772 5.097 4.340 -0.025 0.000 0.263 1062 L C 0.842 177.728 176.870 0.027 0.000 1.065 1062 L CA -0.358 54.533 54.840 0.084 0.000 0.798 1062 L CB 0.025 42.194 42.059 0.182 0.000 1.267 1062 L HN 0.188 nan 8.230 nan 0.000 0.467 1063 G N 0.732 109.532 108.800 -0.001 0.000 2.470 1063 G HA2 -0.261 3.684 3.960 -0.025 0.000 0.286 1063 G HA3 -0.261 3.684 3.960 -0.025 0.000 0.286 1063 G C 0.452 175.257 174.900 -0.159 0.000 1.115 1063 G CA 0.326 45.381 45.100 -0.075 0.000 1.122 1063 G HN 0.908 nan 8.290 nan 0.000 0.522 1064 R N -1.565 118.772 120.500 -0.272 0.000 3.422 1064 R HA -0.207 4.118 4.340 -0.025 0.000 0.267 1064 R C 1.006 177.240 176.300 -0.110 0.000 1.074 1064 R CA 1.035 56.788 56.100 -0.578 0.000 0.718 1064 R CB -1.125 28.663 30.300 -0.853 0.000 1.157 1064 R HN 0.509 nan 8.270 nan 0.000 0.440 1065 N N -0.220 118.568 118.700 0.148 0.000 2.273 1065 N HA 0.247 4.972 4.740 -0.025 0.000 0.192 1065 N C -0.039 175.710 175.510 0.397 0.000 1.132 1065 N CA 0.542 53.737 53.050 0.242 0.000 0.887 1065 N CB 0.855 39.384 38.487 0.070 0.000 1.048 1065 N HN 0.257 nan 8.380 nan 0.000 0.490 1066 I N 1.062 121.862 120.570 0.382 0.000 2.563 1066 I HA 0.118 4.273 4.170 -0.025 0.000 0.281 1066 I C -0.449 175.786 176.117 0.196 0.000 1.110 1066 I CA -0.451 61.011 61.300 0.271 0.000 1.073 1066 I CB 1.602 39.615 38.000 0.022 0.000 1.215 1066 I HN -0.121 nan 8.210 nan 0.000 0.460 1067 S N 6.526 122.309 115.700 0.139 0.000 2.672 1067 S HA 0.859 5.314 4.470 -0.025 0.000 0.276 1067 S C -0.475 174.113 174.600 -0.021 0.000 1.207 1067 S CA -0.614 57.491 58.200 -0.158 0.000 1.002 1067 S CB 2.043 65.011 63.200 -0.388 0.000 0.998 1067 S HN 0.554 nan 8.310 nan 0.000 0.542 1068 M N 1.705 121.298 119.600 -0.013 0.000 2.421 1068 M HA 0.379 4.844 4.480 -0.025 0.000 0.287 1068 M C -1.672 174.704 176.300 0.127 0.000 1.183 1068 M CA -0.421 54.925 55.300 0.077 0.000 0.916 1068 M CB 2.638 35.248 32.600 0.017 0.000 1.701 1068 M HN 0.907 nan 8.290 nan 0.000 0.470 1069 Q N 3.560 123.442 119.800 0.138 0.000 2.271 1069 Q HA 0.620 4.945 4.340 -0.025 0.000 0.268 1069 Q C -1.783 174.243 176.000 0.043 0.000 1.021 1069 Q CA -0.870 55.006 55.803 0.121 0.000 0.802 1069 Q CB 2.049 30.900 28.738 0.187 0.000 1.282 1069 Q HN 0.724 nan 8.270 nan 0.000 0.431 1070 L N 2.501 123.695 121.223 -0.048 0.000 2.397 1070 L HA 0.365 4.690 4.340 -0.025 0.000 0.271 1070 L C -0.117 176.811 176.870 0.097 0.000 1.148 1070 L CA -0.614 54.209 54.840 -0.029 0.000 0.825 1070 L CB 0.166 42.183 42.059 -0.069 0.000 1.117 1070 L HN 0.563 nan 8.230 nan 0.000 0.456 1071 I N 1.317 121.805 120.570 -0.136 0.000 2.437 1071 I HA 0.216 4.371 4.170 -0.025 0.000 0.298 1071 I C 0.438 176.402 176.117 -0.256 0.000 0.984 1071 I CA 0.420 61.497 61.300 -0.372 0.000 1.214 1071 I CB 1.862 39.323 38.000 -0.899 0.000 1.365 1071 I HN 0.520 nan 8.210 nan 0.000 0.469 1072 S N 3.126 118.517 115.700 -0.515 0.000 2.616 1072 S HA 0.690 5.145 4.470 -0.025 0.000 0.277 1072 S C 0.690 175.109 174.600 -0.302 0.000 1.234 1072 S CA -0.036 57.832 58.200 -0.555 0.000 1.028 1072 S CB 1.146 63.738 63.200 -1.013 0.000 0.988 1072 S HN 0.708 nan 8.310 nan 0.000 0.522 1073 A N 3.109 125.826 122.820 -0.173 0.000 2.382 1073 A HA 0.263 4.568 4.320 -0.025 0.000 0.228 1073 A C 1.535 179.062 177.584 -0.095 0.000 1.217 1073 A CA 0.251 52.227 52.037 -0.102 0.000 0.923 1073 A CB -0.225 18.755 19.000 -0.033 0.000 0.979 1073 A HN 0.722 nan 8.150 nan 0.000 0.515 1074 T N -0.611 113.872 114.554 -0.117 0.000 3.031 1074 T HA 0.149 4.484 4.350 -0.025 0.000 0.236 1074 T C 0.533 175.165 174.700 -0.112 0.000 1.005 1074 T CA 0.652 62.699 62.100 -0.088 0.000 1.230 1074 T CB -0.085 68.751 68.868 -0.053 0.000 0.913 1074 T HN 0.312 nan 8.240 nan 0.000 0.419 1075 Q N 2.024 121.720 119.800 -0.174 0.000 2.256 1075 Q HA 0.454 4.779 4.340 -0.025 0.000 0.257 1075 Q C 0.227 176.121 176.000 -0.178 0.000 0.936 1075 Q CA -0.362 55.346 55.803 -0.158 0.000 0.903 1075 Q CB 1.481 30.127 28.738 -0.154 0.000 1.263 1075 Q HN 0.569 nan 8.270 nan 0.000 0.440 1076 T N -1.119 113.372 114.554 -0.105 0.000 2.865 1076 T HA 0.513 4.848 4.350 -0.025 0.000 0.302 1076 T C 0.018 174.681 174.700 -0.061 0.000 1.078 1076 T CA -0.421 61.636 62.100 -0.073 0.000 0.942 1076 T CB 0.553 69.398 68.868 -0.038 0.000 1.387 1076 T HN 0.621 nan 8.240 nan 0.000 0.557 1077 D N -1.714 118.671 120.400 -0.026 0.000 2.784 1077 D HA 0.371 4.996 4.640 -0.025 0.000 0.256 1077 D C 1.596 177.894 176.300 -0.003 0.000 1.129 1077 D CA -0.236 53.759 54.000 -0.009 0.000 1.102 1077 D CB 0.183 40.990 40.800 0.013 0.000 1.330 1077 D HN 0.696 nan 8.370 nan 0.000 0.626 1078 G N -0.984 107.818 108.800 0.005 0.000 2.498 1078 G HA2 -0.105 3.840 3.960 -0.025 0.000 0.219 1078 G HA3 -0.105 3.840 3.960 -0.025 0.000 0.219 1078 G C 0.996 175.897 174.900 0.002 0.000 1.119 1078 G CA 0.614 45.717 45.100 0.004 0.000 0.766 1078 G HN 0.344 nan 8.290 nan 0.000 0.552 1079 S N -0.923 114.779 115.700 0.003 0.000 2.578 1079 S HA 0.403 4.858 4.470 -0.025 0.000 0.231 1079 S C 1.571 176.168 174.600 -0.005 0.000 0.994 1079 S CA 0.556 58.755 58.200 -0.002 0.000 0.956 1079 S CB 0.486 63.684 63.200 -0.004 0.000 0.870 1079 S HN 1.056 nan 8.310 nan 0.000 0.494 1080 G N 2.191 110.989 108.800 -0.003 0.000 2.159 1080 G HA2 -0.238 3.707 3.960 -0.025 0.000 0.256 1080 G HA3 -0.238 3.707 3.960 -0.025 0.000 0.256 1080 G C -0.290 174.615 174.900 0.008 0.000 0.977 1080 G CA -0.186 44.912 45.100 -0.004 0.000 0.652 1080 G HN 0.564 nan 8.290 nan 0.000 0.531 1081 N N 0.115 118.829 118.700 0.022 0.000 2.466 1081 N HA 0.535 5.260 4.740 -0.025 0.000 0.294 1081 N C 0.710 176.304 175.510 0.139 0.000 1.129 1081 N CA -0.325 52.776 53.050 0.085 0.000 0.931 1081 N CB 1.066 39.548 38.487 -0.007 0.000 1.193 1081 N HN 0.335 nan 8.380 nan 0.000 0.500 1082 G N 1.249 110.198 108.800 0.248 0.000 2.225 1082 G HA2 -0.107 3.838 3.960 -0.025 0.000 0.245 1082 G HA3 -0.107 3.838 3.960 -0.025 0.000 0.245 1082 G C 0.267 175.104 174.900 -0.104 0.000 1.249 1082 G CA 0.010 45.087 45.100 -0.037 0.000 0.919 1082 G HN 0.369 nan 8.290 nan 0.000 0.486 1083 K N 1.090 121.336 120.400 -0.256 0.000 2.524 1083 K HA 0.028 4.333 4.320 -0.025 0.000 0.279 1083 K C 0.002 176.491 176.600 -0.186 0.000 0.993 1083 K CA 0.143 56.289 56.287 -0.235 0.000 1.030 1083 K CB 0.855 33.133 32.500 -0.370 0.000 0.891 1083 K HN 0.165 nan 8.250 nan 0.000 0.488 1084 V N 3.430 123.392 119.914 0.080 0.000 2.417 1084 V HA 0.282 4.387 4.120 -0.025 0.000 0.291 1084 V C 1.081 177.384 176.094 0.348 0.000 1.024 1084 V CA -0.663 61.766 62.300 0.215 0.000 0.861 1084 V CB 1.506 33.448 31.823 0.199 0.000 0.985 1084 V HN 0.946 nan 8.190 nan 0.000 0.436 1085 G N 3.420 112.489 108.800 0.448 0.000 2.590 1085 G HA2 0.194 4.139 3.960 -0.025 0.000 0.276 1085 G HA3 0.194 4.139 3.960 -0.025 0.000 0.276 1085 G C -0.154 174.840 174.900 0.156 0.000 1.337 1085 G CA -0.340 44.890 45.100 0.215 0.000 1.030 1085 G HN 0.681 nan 8.290 nan 0.000 0.534 1086 K N -0.404 120.063 120.400 0.111 0.000 2.144 1086 K HA 0.182 4.487 4.320 -0.025 0.000 0.270 1086 K C 0.087 176.751 176.600 0.107 0.000 1.005 1086 K CA -0.255 56.097 56.287 0.109 0.000 0.932 1086 K CB 0.732 33.289 32.500 0.095 0.000 1.021 1086 K HN 0.452 nan 8.250 nan 0.000 0.462 1087 E N 2.771 123.013 120.200 0.070 0.000 2.029 1087 E HA 0.083 4.418 4.350 -0.025 0.000 0.276 1087 E C -1.193 175.365 176.600 -0.071 0.000 1.163 1087 E CA -0.343 56.046 56.400 -0.018 0.000 0.909 1087 E CB 0.590 30.259 29.700 -0.051 0.000 1.046 1087 E HN 0.231 nan 8.360 nan 0.000 0.406 1088 V N 5.800 125.681 119.914 -0.056 0.000 2.398 1088 V HA 0.236 4.341 4.120 -0.025 0.000 0.286 1088 V C -0.487 175.527 176.094 -0.134 0.000 1.026 1088 V CA -0.655 61.614 62.300 -0.052 0.000 0.868 1088 V CB 0.513 32.271 31.823 -0.109 0.000 0.982 1088 V HN 0.520 nan 8.190 nan 0.000 0.443 1089 Y N 3.274 123.554 120.300 -0.034 0.000 2.374 1089 Y HA 0.516 5.050 4.550 -0.026 0.000 0.322 1089 Y C 0.618 176.471 175.900 -0.079 0.000 1.275 1089 Y CA -0.955 57.129 58.100 -0.027 0.000 1.307 1089 Y CB 0.818 39.260 38.460 -0.029 0.000 1.282 1089 Y HN 0.402 nan 8.280 nan 0.000 0.509 1090 L N 1.945 123.218 121.223 0.084 0.000 2.540 1090 L HA -0.054 4.271 4.340 -0.025 0.000 0.276 1090 L C 0.846 177.749 176.870 0.056 0.000 1.212 1090 L CA 0.156 54.999 54.840 0.005 0.000 0.893 1090 L CB 0.472 42.524 42.059 -0.013 0.000 1.138 1090 L HN 0.771 nan 8.230 nan 0.000 0.491 1091 E N 2.552 122.771 120.200 0.033 0.000 2.014 1091 E HA -0.029 4.306 4.350 -0.025 0.000 0.190 1091 E C 0.011 176.687 176.600 0.126 0.000 0.980 1091 E CA 1.237 57.694 56.400 0.094 0.000 0.807 1091 E CB 0.287 30.096 29.700 0.181 0.000 0.770 1091 E HN 0.600 nan 8.360 nan 0.000 0.451 1092 K N -1.490 118.996 120.400 0.143 0.000 2.522 1092 K HA 0.355 4.660 4.320 -0.025 0.000 0.275 1092 K C -1.227 175.452 176.600 0.132 0.000 1.006 1092 K CA -0.804 55.577 56.287 0.157 0.000 0.890 1092 K CB 1.114 33.684 32.500 0.117 0.000 1.475 1092 K HN 0.007 nan 8.250 nan 0.000 0.441 1093 H N 0.197 119.244 119.070 -0.038 0.000 2.652 1093 H HA 0.317 4.878 4.556 0.008 0.000 0.349 1093 H C -1.054 174.106 175.328 -0.279 0.000 1.099 1093 H CA -0.265 55.549 56.048 -0.390 0.000 1.417 1093 H CB 0.813 30.362 29.762 -0.356 0.000 1.457 1093 H HN 0.297 nan 8.280 nan 0.000 0.568 1094 L N 8.016 129.029 121.223 -0.350 0.000 2.324 1094 L HA 0.338 4.663 4.340 -0.025 0.000 0.274 1094 L C -2.268 174.590 176.870 -0.019 0.000 1.012 1094 L CA -1.976 52.787 54.840 -0.128 0.000 0.859 1094 L CB 1.005 42.961 42.059 -0.171 0.000 1.224 1094 L HN 0.660 nan 8.230 nan 0.000 0.429 1095 P HA 0.253 nan 4.420 nan 0.000 0.274 1095 P C 0.707 178.014 177.300 0.011 0.000 1.246 1095 P CA -0.042 63.087 63.100 0.048 0.000 0.795 1095 P CB 0.748 32.447 31.700 -0.001 0.000 1.006 1096 T N 0.016 114.577 114.554 0.010 0.000 9.639 1096 T HA -0.246 4.089 4.350 -0.025 0.000 0.362 1096 T C 0.483 175.188 174.700 0.007 0.000 1.812 1096 T CA 1.315 63.419 62.100 0.006 0.000 2.782 1096 T CB -1.864 67.004 68.868 0.001 0.000 2.606 1096 T HN 0.524 nan 8.240 nan 0.000 1.105 1097 L N -1.774 119.449 121.223 -0.002 0.000 3.472 1097 L HA -0.101 4.224 4.340 -0.025 0.000 0.485 1097 L C -2.262 174.592 176.870 -0.027 0.000 1.312 1097 L CA 0.047 54.871 54.840 -0.027 0.000 0.869 1097 L CB -1.493 40.563 42.059 -0.005 0.000 1.687 1097 L HN 0.276 nan 8.230 nan 0.000 0.853 1098 P HA 0.059 nan 4.420 nan 0.000 0.245 1098 P C 1.033 178.331 177.300 -0.003 0.000 1.670 1098 P CA 1.026 64.118 63.100 -0.014 0.000 1.146 1098 P CB 0.478 32.168 31.700 -0.017 0.000 1.954 1099 T N -0.848 113.707 114.554 0.002 0.000 10.235 1099 T HA -0.243 4.092 4.350 -0.025 0.000 0.395 1099 T C 0.473 175.181 174.700 0.013 0.000 1.613 1099 T CA 1.083 63.188 62.100 0.009 0.000 2.565 1099 T CB -1.755 67.118 68.868 0.009 0.000 2.818 1099 T HN 0.269 nan 8.240 nan 0.000 1.101 1100 L N 1.667 122.897 121.223 0.010 0.000 2.536 1100 L HA 0.397 4.722 4.340 -0.025 0.000 0.282 1100 L C 1.688 178.570 176.870 0.021 0.000 1.147 1100 L CA 0.720 55.570 54.840 0.017 0.000 0.936 1100 L CB -0.066 42.001 42.059 0.013 0.000 1.279 1100 L HN 0.589 nan 8.230 nan 0.000 0.461 1101 G N 2.553 111.372 108.800 0.030 0.000 4.165 1101 G HA2 -0.328 3.617 3.960 -0.025 0.000 0.211 1101 G HA3 -0.328 3.617 3.960 -0.025 0.000 0.211 1101 G C 0.851 175.772 174.900 0.035 0.000 1.469 1101 G CA 0.213 45.336 45.100 0.039 0.000 0.964 1101 G HN 1.254 nan 8.290 nan 0.000 0.613 1102 A N -1.119 121.718 122.820 0.028 0.000 3.925 1102 A HA -0.398 3.907 4.320 -0.025 0.000 0.247 1102 A C 1.762 179.372 177.584 0.043 0.000 0.630 1102 A CA 2.839 54.894 52.037 0.030 0.000 1.174 1102 A CB -1.615 17.402 19.000 0.027 0.000 1.222 1102 A HN 1.666 nan 8.150 nan 0.000 0.676 1103 R N 1.248 121.777 120.500 0.049 0.000 2.193 1103 R HA 0.091 4.416 4.340 -0.025 0.000 0.213 1103 R C 1.189 177.529 176.300 0.067 0.000 1.055 1103 R CA 1.206 57.342 56.100 0.060 0.000 0.995 1103 R CB -0.203 30.132 30.300 0.059 0.000 0.893 1103 R HN 0.927 nan 8.270 nan 0.000 0.459 1104 Q N 1.691 121.524 119.800 0.056 0.000 2.267 1104 Q HA 0.210 4.535 4.340 -0.025 0.000 0.255 1104 Q C -1.084 174.933 176.000 0.028 0.000 0.923 1104 Q CA -0.502 55.331 55.803 0.049 0.000 0.925 1104 Q CB 1.347 30.118 28.738 0.056 0.000 1.195 1104 Q HN -0.025 nan 8.270 nan 0.000 0.417 1105 D N 2.095 122.509 120.400 0.023 0.000 2.232 1105 D HA 0.421 5.045 4.640 -0.025 0.000 0.242 1105 D C -0.683 175.541 176.300 -0.127 0.000 1.093 1105 D CA -0.285 53.698 54.000 -0.029 0.000 0.845 1105 D CB 1.612 42.476 40.800 0.107 0.000 1.124 1105 D HN 0.688 nan 8.370 nan 0.000 0.467 1106 A N 2.565 125.218 122.820 -0.279 0.000 2.310 1106 A HA 0.664 4.969 4.320 -0.025 0.000 0.299 1106 A C -0.801 176.441 177.584 -0.570 0.000 1.147 1106 A CA -0.395 51.492 52.037 -0.250 0.000 0.818 1106 A CB 0.318 19.217 19.000 -0.168 0.000 1.096 1106 A HN 0.475 nan 8.150 nan 0.000 0.495 1107 F N 0.305 120.068 119.950 -0.312 0.000 2.588 1107 F HA 0.576 5.091 4.527 -0.018 0.000 0.314 1107 F C 0.667 176.334 175.800 -0.221 0.000 1.069 1107 F CA -0.353 57.479 58.000 -0.280 0.000 0.931 1107 F CB 2.478 41.314 39.000 -0.273 0.000 1.260 1107 F HN 0.529 nan 8.300 nan 0.000 0.465 1108 S N 2.214 117.903 115.700 -0.017 0.000 2.593 1108 S HA 0.826 5.281 4.470 -0.025 0.000 0.297 1108 S C -1.111 173.324 174.600 -0.275 0.000 1.112 1108 S CA -0.497 57.601 58.200 -0.170 0.000 1.043 1108 S CB 0.989 64.115 63.200 -0.124 0.000 1.054 1108 S HN 0.606 nan 8.310 nan 0.000 0.516 1109 I N 3.005 123.209 120.570 -0.609 0.000 2.710 1109 I HA 0.423 4.578 4.170 -0.025 0.000 0.290 1109 I C -2.117 173.278 176.117 -1.203 0.000 1.318 1109 I CA -0.760 60.098 61.300 -0.738 0.000 1.045 1109 I CB 1.099 38.764 38.000 -0.558 0.000 1.307 1109 I HN 0.634 nan 8.210 nan 0.000 0.424 1110 F N 7.312 126.931 119.950 -0.552 0.000 2.449 1110 F HA 0.529 5.039 4.527 -0.028 0.000 0.342 1110 F C -0.569 174.917 175.800 -0.523 0.000 1.127 1110 F CA -0.548 57.194 58.000 -0.430 0.000 0.975 1110 F CB 1.246 40.132 39.000 -0.190 0.000 1.146 1110 F HN 0.113 nan 8.300 nan 0.000 0.444 1111 F N 1.486 121.465 119.950 0.049 0.000 2.399 1111 F HA 0.369 4.882 4.527 -0.024 0.000 0.334 1111 F C 0.876 176.704 175.800 0.047 0.000 1.097 1111 F CA -0.984 57.019 58.000 0.004 0.000 1.076 1111 F CB 0.693 39.646 39.000 -0.080 0.000 1.162 1111 F HN 0.466 nan 8.300 nan 0.000 0.495 1112 E N 1.479 121.805 120.200 0.210 0.000 2.451 1112 E HA -0.017 4.318 4.350 -0.025 0.000 0.256 1112 E C -0.862 175.911 176.600 0.287 0.000 1.294 1112 E CA 0.073 56.586 56.400 0.188 0.000 1.005 1112 E CB 1.002 30.777 29.700 0.125 0.000 0.990 1112 E HN 0.646 nan 8.360 nan 0.000 0.505 1113 W N 0.119 121.407 121.300 -0.019 0.000 3.107 1113 W HA 0.243 4.888 4.660 -0.024 0.000 0.331 1113 W C -1.515 175.001 176.519 -0.005 0.000 1.204 1113 W CA -0.567 56.756 57.345 -0.038 0.000 1.184 1113 W CB 2.262 31.720 29.460 -0.003 0.000 1.421 1113 W HN 0.504 nan 8.180 nan 0.000 0.544 1114 D N 1.162 121.179 120.400 -0.637 0.000 2.661 1114 D HA 0.491 5.116 4.640 -0.025 0.000 0.228 1114 D C 0.066 175.652 176.300 -1.189 0.000 1.210 1114 D CA -0.011 53.609 54.000 -0.632 0.000 0.826 1114 D CB 2.162 42.807 40.800 -0.258 0.000 1.542 1114 D HN 0.340 nan 8.370 nan 0.000 0.447 1115 A N 0.924 123.339 122.820 -0.675 0.000 2.021 1115 A HA 0.086 4.391 4.320 -0.025 0.000 0.216 1115 A C 1.358 178.764 177.584 -0.297 0.000 1.163 1115 A CA 0.612 52.351 52.037 -0.496 0.000 0.676 1115 A CB 0.002 18.875 19.000 -0.211 0.000 0.818 1115 A HN 0.355 nan 8.150 nan 0.000 0.453 1116 S N -0.787 114.786 115.700 -0.210 0.000 2.677 1116 S HA 0.357 4.812 4.470 -0.025 0.000 0.246 1116 S C -0.534 174.030 174.600 -0.060 0.000 1.005 1116 S CA -0.221 57.914 58.200 -0.108 0.000 1.062 1116 S CB -0.756 62.399 63.200 -0.076 0.000 0.778 1116 S HN 0.448 nan 8.310 nan 0.000 0.461 1117 F N 0.678 120.471 119.950 -0.262 0.000 3.034 1117 F HA 0.522 5.034 4.527 -0.024 0.000 0.371 1117 F C 0.715 176.364 175.800 -0.251 0.000 1.233 1117 F CA -0.937 56.947 58.000 -0.194 0.000 1.134 1117 F CB 0.233 39.129 39.000 -0.172 0.000 1.495 1117 F HN 0.184 nan 8.300 nan 0.000 0.563 1118 G N 4.883 113.732 108.800 0.082 0.000 2.830 1118 G HA2 0.104 4.049 3.960 -0.025 0.000 0.172 1118 G HA3 0.104 4.049 3.960 -0.025 0.000 0.172 1118 G C 0.123 175.255 174.900 0.386 0.000 1.782 1118 G CA -0.207 44.984 45.100 0.152 0.000 0.900 1118 G HN 0.379 nan 8.290 nan 0.000 0.389 1119 I N 3.090 123.764 120.570 0.173 0.000 2.304 1119 I HA 0.260 4.415 4.170 -0.025 0.000 0.291 1119 I C -2.006 174.196 176.117 0.142 0.000 1.018 1119 I CA -3.277 58.079 61.300 0.094 0.000 1.260 1119 I CB 0.883 38.782 38.000 -0.170 0.000 1.390 1119 I HN 0.151 nan 8.210 nan 0.000 0.475 1120 P HA 0.017 nan 4.420 nan 0.000 0.258 1120 P C 0.723 178.116 177.300 0.155 0.000 1.187 1120 P CA 0.281 63.541 63.100 0.266 0.000 0.767 1120 P CB 0.577 32.433 31.700 0.260 0.000 0.770 1121 G N 2.177 111.036 108.800 0.098 0.000 3.044 1121 G HA2 0.469 4.414 3.960 -0.025 0.000 0.223 1121 G HA3 0.469 4.414 3.960 -0.025 0.000 0.223 1121 G C 0.236 175.250 174.900 0.191 0.000 1.123 1121 G CA 0.450 45.628 45.100 0.129 0.000 0.765 1121 G HN 0.810 nan 8.290 nan 0.000 0.546 1122 A N -0.480 122.375 122.820 0.057 0.000 2.536 1122 A HA 0.831 5.136 4.320 -0.025 0.000 0.293 1122 A C -1.686 175.700 177.584 -0.330 0.000 1.119 1122 A CA -0.776 51.112 52.037 -0.248 0.000 0.654 1122 A CB 0.800 19.316 19.000 -0.807 0.000 1.291 1122 A HN 0.949 nan 8.150 nan 0.000 0.439 1123 F N -2.454 117.133 119.950 -0.604 0.000 2.693 1123 F HA 0.804 5.316 4.527 -0.024 0.000 0.309 1123 F C -1.929 173.681 175.800 -0.317 0.000 1.129 1123 F CA -1.163 56.527 58.000 -0.517 0.000 0.948 1123 F CB 0.862 39.518 39.000 -0.574 0.000 1.315 1123 F HN 0.483 nan 8.300 nan 0.000 0.447 1124 Y N 2.824 123.201 120.300 0.128 0.000 2.361 1124 Y HA 0.717 5.252 4.550 -0.026 0.000 0.332 1124 Y C -0.243 175.809 175.900 0.254 0.000 1.101 1124 Y CA -1.738 56.419 58.100 0.095 0.000 1.137 1124 Y CB 1.785 40.269 38.460 0.040 0.000 1.207 1124 Y HN 0.790 nan 8.280 nan 0.000 0.463 1125 I N 3.082 123.898 120.570 0.410 0.000 2.569 1125 I HA 0.442 4.597 4.170 -0.025 0.000 0.290 1125 I C -1.560 174.657 176.117 0.166 0.000 1.088 1125 I CA -0.769 60.719 61.300 0.314 0.000 1.047 1125 I CB 1.433 39.706 38.000 0.454 0.000 1.237 1125 I HN 0.531 nan 8.210 nan 0.000 0.421 1126 K N 5.850 126.268 120.400 0.030 0.000 2.323 1126 K HA 0.304 4.609 4.320 -0.025 0.000 0.259 1126 K C -0.730 175.728 176.600 -0.236 0.000 0.947 1126 K CA -0.580 55.582 56.287 -0.209 0.000 0.819 1126 K CB 1.609 33.775 32.500 -0.557 0.000 1.109 1126 K HN 0.534 nan 8.250 nan 0.000 0.429 1127 N N 3.883 122.533 118.700 -0.084 0.000 2.558 1127 N HA 0.118 4.843 4.740 -0.025 0.000 0.233 1127 N C -0.208 175.308 175.510 0.009 0.000 1.038 1127 N CA -0.343 52.786 53.050 0.131 0.000 0.934 1127 N CB 0.348 38.976 38.487 0.235 0.000 1.175 1127 N HN 0.431 nan 8.380 nan 0.000 0.512 1128 F N 1.902 121.921 119.950 0.115 0.000 2.771 1128 F HA 0.100 4.611 4.527 -0.027 0.000 0.299 1128 F C 1.006 176.889 175.800 0.138 0.000 1.177 1128 F CA 0.479 58.521 58.000 0.070 0.000 1.450 1128 F CB -0.072 38.932 39.000 0.007 0.000 1.114 1128 F HN 0.410 nan 8.300 nan 0.000 0.587 1129 M N -1.031 118.745 119.600 0.294 0.000 2.283 1129 M HA 0.106 4.571 4.480 -0.025 0.000 0.314 1129 M C 1.658 178.065 176.300 0.179 0.000 1.153 1129 M CA -0.055 55.365 55.300 0.200 0.000 1.084 1129 M CB 0.720 33.414 32.600 0.157 0.000 1.468 1129 M HN -0.221 nan 8.290 nan 0.000 0.474 1130 T N -0.298 114.333 114.554 0.129 0.000 2.951 1130 T HA -0.016 4.319 4.350 -0.025 0.000 0.268 1130 T C -0.002 174.761 174.700 0.105 0.000 1.073 1130 T CA 0.960 63.127 62.100 0.111 0.000 1.134 1130 T CB -0.090 68.828 68.868 0.085 0.000 0.884 1130 T HN 0.572 nan 8.240 nan 0.000 0.479 1131 D N 1.977 122.443 120.400 0.110 0.000 2.252 1131 D HA 0.205 4.830 4.640 -0.025 0.000 0.245 1131 D C -0.130 176.231 176.300 0.102 0.000 1.009 1131 D CA -0.503 53.556 54.000 0.099 0.000 0.870 1131 D CB 1.266 42.139 40.800 0.122 0.000 1.251 1131 D HN 0.322 nan 8.370 nan 0.000 0.460 1132 E N 1.455 121.610 120.200 -0.075 0.000 2.338 1132 E HA 0.189 4.524 4.350 -0.025 0.000 0.272 1132 E C -0.707 176.020 176.600 0.212 0.000 1.029 1132 E CA -0.329 55.937 56.400 -0.224 0.000 0.872 1132 E CB 0.432 29.566 29.700 -0.942 0.000 1.015 1132 E HN 0.327 nan 8.360 nan 0.000 0.417 1133 F N 0.680 120.802 119.950 0.287 0.000 2.483 1133 F HA 0.599 5.113 4.527 -0.022 0.000 0.329 1133 F C -0.568 175.358 175.800 0.210 0.000 1.064 1133 F CA -1.959 56.221 58.000 0.300 0.000 0.986 1133 F CB 0.706 39.808 39.000 0.170 0.000 1.218 1133 F HN 0.295 nan 8.300 nan 0.000 0.484 1134 F N 4.087 123.937 119.950 -0.168 0.000 2.413 1134 F HA 0.351 4.861 4.527 -0.027 0.000 0.359 1134 F C -0.476 175.250 175.800 -0.123 0.000 1.122 1134 F CA -0.913 56.687 58.000 -0.666 0.000 1.160 1134 F CB 0.479 38.786 39.000 -1.155 0.000 1.146 1134 F HN 0.508 nan 8.300 nan 0.000 0.514 1135 L N 8.100 129.096 121.223 -0.379 0.000 2.313 1135 L HA 0.176 4.501 4.340 -0.025 0.000 0.282 1135 L C 0.324 176.870 176.870 -0.541 0.000 1.092 1135 L CA -0.160 54.546 54.840 -0.223 0.000 0.831 1135 L CB 1.360 43.323 42.059 -0.161 0.000 1.159 1135 L HN 0.638 nan 8.230 nan 0.000 0.442 1136 V N 3.080 122.817 119.914 -0.295 0.000 2.374 1136 V HA 0.061 4.166 4.120 -0.025 0.000 0.241 1136 V C 0.716 176.746 176.094 -0.108 0.000 1.034 1136 V CA 1.093 63.282 62.300 -0.185 0.000 1.037 1136 V CB 0.213 32.044 31.823 0.014 0.000 0.682 1136 V HN 0.914 nan 8.190 nan 0.000 0.463 1137 S N -1.697 113.959 115.700 -0.073 0.000 2.565 1137 S HA 0.649 5.104 4.470 -0.025 0.000 0.274 1137 S C -1.426 173.184 174.600 0.016 0.000 1.144 1137 S CA -0.640 57.562 58.200 0.003 0.000 0.849 1137 S CB 2.116 65.342 63.200 0.044 0.000 1.103 1137 S HN -0.012 nan 8.310 nan 0.000 0.455 1138 V N 2.649 122.644 119.914 0.135 0.000 2.525 1138 V HA 0.619 4.724 4.120 -0.025 0.000 0.299 1138 V C -1.136 175.122 176.094 0.273 0.000 1.034 1138 V CA -0.631 61.751 62.300 0.136 0.000 0.863 1138 V CB 1.896 33.699 31.823 -0.034 0.000 0.999 1138 V HN 0.931 nan 8.190 nan 0.000 0.423 1139 K N 5.362 125.831 120.400 0.115 0.000 2.323 1139 K HA 0.651 4.956 4.320 -0.025 0.000 0.259 1139 K C -1.452 175.177 176.600 0.048 0.000 0.947 1139 K CA -0.876 55.449 56.287 0.063 0.000 0.819 1139 K CB 2.619 35.125 32.500 0.009 0.000 1.109 1139 K HN 0.341 nan 8.250 nan 0.000 0.429 1140 L N 3.056 124.305 121.223 0.043 0.000 2.257 1140 L HA 0.298 4.623 4.340 -0.025 0.000 0.290 1140 L C 0.095 176.959 176.870 -0.011 0.000 1.044 1140 L CA 0.079 54.935 54.840 0.027 0.000 0.810 1140 L CB 0.784 42.870 42.059 0.044 0.000 1.193 1140 L HN 0.612 nan 8.230 nan 0.000 0.425 1141 E N 1.042 121.233 120.200 -0.015 0.000 2.469 1141 E HA 0.345 4.680 4.350 -0.025 0.000 0.246 1141 E C -0.345 176.230 176.600 -0.041 0.000 0.969 1141 E CA -0.557 55.829 56.400 -0.023 0.000 0.881 1141 E CB 0.448 30.138 29.700 -0.017 0.000 1.320 1141 E HN 0.608 nan 8.360 nan 0.000 0.421 1142 D N 0.143 120.518 120.400 -0.041 0.000 2.764 1142 D HA -0.253 4.372 4.640 -0.025 0.000 0.223 1142 D C -0.734 175.474 176.300 -0.152 0.000 1.207 1142 D CA 0.714 54.675 54.000 -0.064 0.000 0.614 1142 D CB -1.728 39.054 40.800 -0.030 0.000 1.007 1142 D HN 0.322 nan 8.370 nan 0.000 0.407 1143 I N -0.629 119.844 120.570 -0.161 0.000 2.371 1143 I HA 0.202 4.357 4.170 -0.025 0.000 0.290 1143 I C -1.714 174.296 176.117 -0.178 0.000 1.028 1143 I CA -2.197 58.925 61.300 -0.298 0.000 1.345 1143 I CB 0.701 38.599 38.000 -0.170 0.000 1.407 1143 I HN -0.233 nan 8.210 nan 0.000 0.501 1144 P HA -0.036 nan 4.420 nan 0.000 0.258 1144 P C 0.074 177.437 177.300 0.105 0.000 1.187 1144 P CA 0.464 63.560 63.100 -0.006 0.000 0.767 1144 P CB 0.051 31.816 31.700 0.108 0.000 0.770 1145 N N 1.334 120.081 118.700 0.078 0.000 2.708 1145 N HA -0.310 4.415 4.740 -0.025 0.000 0.251 1145 N C 0.337 175.912 175.510 0.110 0.000 1.123 1145 N CA 1.661 54.762 53.050 0.085 0.000 0.739 1145 N CB -2.634 35.915 38.487 0.104 0.000 1.113 1145 N HN 0.656 nan 8.380 nan 0.000 0.561 1146 H N -1.977 117.099 119.070 0.009 0.000 2.788 1146 H HA 0.318 4.858 4.556 -0.025 0.000 0.262 1146 H C 1.687 177.006 175.328 -0.016 0.000 0.968 1146 H CA 1.267 57.319 56.048 0.007 0.000 1.218 1146 H CB 0.534 30.307 29.762 0.018 0.000 1.443 1146 H HN 0.532 nan 8.280 nan 0.000 0.478 1147 G N 0.578 109.370 108.800 -0.012 0.000 3.299 1147 G HA2 -0.252 3.692 3.960 -0.025 0.000 0.251 1147 G HA3 -0.252 3.692 3.960 -0.025 0.000 0.251 1147 G C -0.014 174.880 174.900 -0.011 0.000 1.741 1147 G CA 0.267 45.337 45.100 -0.050 0.000 1.151 1147 G HN 0.583 nan 8.290 nan 0.000 0.561 1148 T N 0.038 114.588 114.554 -0.006 0.000 2.982 1148 T HA 0.619 4.954 4.350 -0.025 0.000 0.321 1148 T C -1.427 173.273 174.700 0.000 0.000 1.229 1148 T CA -0.199 61.901 62.100 -0.000 0.000 1.044 1148 T CB 1.175 70.026 68.868 -0.028 0.000 1.184 1148 T HN 0.855 nan 8.240 nan 0.000 0.477 1149 I N 3.272 123.814 120.570 -0.046 0.000 2.474 1149 I HA 0.550 4.705 4.170 -0.025 0.000 0.294 1149 I C -0.572 175.370 176.117 -0.292 0.000 1.005 1149 I CA -0.807 60.387 61.300 -0.177 0.000 1.113 1149 I CB 2.114 39.979 38.000 -0.224 0.000 1.289 1149 I HN 0.600 nan 8.210 nan 0.000 0.436 1150 E N 5.157 125.140 120.200 -0.362 0.000 2.266 1150 E HA 0.553 4.888 4.350 -0.025 0.000 0.268 1150 E C -1.539 174.833 176.600 -0.380 0.000 0.879 1150 E CA -0.456 55.777 56.400 -0.279 0.000 0.762 1150 E CB 2.099 31.741 29.700 -0.097 0.000 1.199 1150 E HN 0.221 nan 8.360 nan 0.000 0.422 1151 F N 1.185 121.184 119.950 0.082 0.000 2.402 1151 F HA 0.340 4.851 4.527 -0.026 0.000 0.355 1151 F C -0.311 175.530 175.800 0.068 0.000 1.123 1151 F CA -1.110 56.956 58.000 0.110 0.000 1.021 1151 F CB 1.262 40.418 39.000 0.260 0.000 1.160 1151 F HN 0.153 nan 8.300 nan 0.000 0.451 1152 V N 3.792 123.834 119.914 0.213 0.000 2.339 1152 V HA 0.049 4.154 4.120 -0.025 0.000 0.261 1152 V C 0.310 176.495 176.094 0.152 0.000 1.058 1152 V CA -0.196 62.199 62.300 0.159 0.000 0.897 1152 V CB 0.040 31.957 31.823 0.157 0.000 1.052 1152 V HN 1.072 nan 8.190 nan 0.000 0.480 1153 C N 2.441 121.780 119.300 0.064 0.000 2.684 1153 C HA 0.083 4.528 4.460 -0.025 0.000 0.283 1153 C C 1.577 176.572 174.990 0.008 0.000 1.346 1153 C CA -0.246 58.764 59.018 -0.014 0.000 1.707 1153 C CB -0.750 26.753 27.740 -0.395 0.000 2.137 1153 C HN 0.925 nan 8.230 nan 0.000 0.544 1154 N N 1.297 119.898 118.700 -0.164 0.000 2.708 1154 N HA -0.162 4.563 4.740 -0.025 0.000 0.251 1154 N C -0.363 174.866 175.510 -0.469 0.000 1.017 1154 N CA 1.286 54.166 53.050 -0.285 0.000 0.742 1154 N CB -0.897 37.687 38.487 0.161 0.000 0.943 1154 N HN 0.635 nan 8.380 nan 0.000 0.539 1155 S N -0.772 114.542 115.700 -0.644 0.000 2.557 1155 S HA 0.514 4.969 4.470 -0.025 0.000 0.291 1155 S C -0.649 173.813 174.600 -0.230 0.000 1.116 1155 S CA -0.779 57.286 58.200 -0.225 0.000 0.992 1155 S CB 0.659 64.004 63.200 0.242 0.000 1.028 1155 S HN 0.281 nan 8.310 nan 0.000 0.484 1156 W N 3.536 124.884 121.300 0.079 0.000 2.308 1156 W HA 0.434 5.078 4.660 -0.026 0.000 0.324 1156 W C -0.174 176.413 176.519 0.113 0.000 1.387 1156 W CA -0.361 57.058 57.345 0.124 0.000 1.250 1156 W CB 0.582 30.205 29.460 0.272 0.000 1.257 1156 W HN 0.333 nan 8.180 nan 0.000 0.554 1157 V N 5.269 125.229 119.914 0.077 0.000 2.448 1157 V HA 0.349 4.454 4.120 -0.025 0.000 0.295 1157 V C -0.419 175.608 176.094 -0.112 0.000 1.025 1157 V CA -1.165 61.129 62.300 -0.010 0.000 0.859 1157 V CB 0.592 32.184 31.823 -0.384 0.000 0.988 1157 V HN 0.397 nan 8.190 nan 0.000 0.431 1158 Y N 1.953 122.405 120.300 0.254 0.000 2.596 1158 Y HA 0.325 4.861 4.550 -0.022 0.000 0.326 1158 Y C 1.092 177.029 175.900 0.063 0.000 1.167 1158 Y CA -0.626 57.502 58.100 0.046 0.000 1.246 1158 Y CB 0.836 39.130 38.460 -0.277 0.000 1.347 1158 Y HN 0.591 nan 8.280 nan 0.000 0.515 1159 N N 2.346 121.133 118.700 0.145 0.000 2.414 1159 N HA -0.119 4.606 4.740 -0.025 0.000 0.268 1159 N C 1.116 176.722 175.510 0.159 0.000 1.286 1159 N CA 0.099 53.250 53.050 0.168 0.000 0.896 1159 N CB 0.218 38.775 38.487 0.116 0.000 1.093 1159 N HN 0.791 nan 8.380 nan 0.000 0.480 1160 F N 3.716 123.622 119.950 -0.073 0.000 2.204 1160 F HA -0.252 4.260 4.527 -0.025 0.000 0.301 1160 F C 1.563 177.331 175.800 -0.053 0.000 1.058 1160 F CA 0.873 58.852 58.000 -0.036 0.000 1.313 1160 F CB -0.222 38.655 39.000 -0.205 0.000 1.051 1160 F HN 0.424 nan 8.300 nan 0.000 0.505 1161 R N 0.407 120.479 120.500 -0.713 0.000 2.313 1161 R HA 0.079 4.404 4.340 -0.025 0.000 0.199 1161 R C 1.551 177.570 176.300 -0.468 0.000 0.958 1161 R CA 0.627 56.323 56.100 -0.675 0.000 1.047 1161 R CB -0.166 29.696 30.300 -0.730 0.000 0.955 1161 R HN 0.264 nan 8.270 nan 0.000 0.481 1162 S N -0.354 114.983 115.700 -0.605 0.000 2.593 1162 S HA 0.101 4.556 4.470 -0.025 0.000 0.217 1162 S C -0.467 173.520 174.600 -1.021 0.000 0.966 1162 S CA 0.303 57.818 58.200 -1.142 0.000 0.914 1162 S CB 0.153 62.270 63.200 -1.806 0.000 0.776 1162 S HN 0.224 nan 8.310 nan 0.000 0.523 1163 Y N 0.918 121.054 120.300 -0.273 0.000 2.373 1163 Y HA 0.321 4.855 4.550 -0.026 0.000 0.336 1163 Y C 0.985 176.823 175.900 -0.104 0.000 0.979 1163 Y CA -1.163 56.859 58.100 -0.129 0.000 1.080 1163 Y CB 1.266 39.675 38.460 -0.085 0.000 1.190 1163 Y HN -0.187 nan 8.280 nan 0.000 0.446 1164 K N 2.715 123.173 120.400 0.098 0.000 2.063 1164 K HA -0.090 4.215 4.320 -0.025 0.000 0.208 1164 K C -0.483 176.131 176.600 0.022 0.000 1.048 1164 K CA 1.553 57.862 56.287 0.037 0.000 0.928 1164 K CB 0.160 32.687 32.500 0.046 0.000 0.713 1164 K HN 0.640 nan 8.250 nan 0.000 0.442 1165 K N 0.880 121.301 120.400 0.035 0.000 2.375 1165 K HA 0.247 4.552 4.320 -0.025 0.000 0.249 1165 K C -1.005 175.558 176.600 -0.061 0.000 0.942 1165 K CA -0.770 55.502 56.287 -0.025 0.000 0.806 1165 K CB 1.777 34.260 32.500 -0.029 0.000 1.227 1165 K HN 0.115 nan 8.250 nan 0.000 0.430 1166 N N 1.533 120.143 118.700 -0.149 0.000 2.395 1166 N HA -0.008 4.717 4.740 -0.025 0.000 0.246 1166 N C -0.457 174.933 175.510 -0.201 0.000 1.246 1166 N CA -0.223 52.717 53.050 -0.183 0.000 0.879 1166 N CB 0.485 38.758 38.487 -0.357 0.000 1.098 1166 N HN 0.064 nan 8.380 nan 0.000 0.444 1167 R N 2.069 122.435 120.500 -0.224 0.000 2.421 1167 R HA 0.197 4.522 4.340 -0.025 0.000 0.305 1167 R C -0.236 175.950 176.300 -0.191 0.000 1.039 1167 R CA 0.044 55.948 56.100 -0.327 0.000 1.003 1167 R CB -0.315 29.795 30.300 -0.318 0.000 0.959 1167 R HN 0.578 nan 8.270 nan 0.000 0.427 1168 I N 3.497 123.853 120.570 -0.356 0.000 2.460 1168 I HA 0.422 4.577 4.170 -0.025 0.000 0.298 1168 I C -1.016 174.573 176.117 -0.880 0.000 0.989 1168 I CA -0.872 60.175 61.300 -0.422 0.000 1.173 1168 I CB 0.934 38.757 38.000 -0.294 0.000 1.338 1168 I HN 0.347 nan 8.210 nan 0.000 0.456 1169 F N 6.111 125.528 119.950 -0.889 0.000 2.557 1169 F HA 0.441 4.954 4.527 -0.023 0.000 0.316 1169 F C -0.451 174.888 175.800 -0.768 0.000 1.141 1169 F CA -0.440 57.061 58.000 -0.831 0.000 0.922 1169 F CB 1.416 39.701 39.000 -1.192 0.000 1.194 1169 F HN 0.191 nan 8.300 nan 0.000 0.443 1170 F N 1.594 121.497 119.950 -0.078 0.000 2.375 1170 F HA 0.589 5.101 4.527 -0.025 0.000 0.317 1170 F C 0.585 176.575 175.800 0.317 0.000 1.124 1170 F CA -0.920 57.126 58.000 0.078 0.000 1.050 1170 F CB 0.588 39.579 39.000 -0.015 0.000 1.314 1170 F HN 0.243 nan 8.300 nan 0.000 0.511 1171 V N 0.228 120.393 119.914 0.420 0.000 3.376 1171 V HA 0.072 4.177 4.120 -0.025 0.000 0.303 1171 V C 0.651 176.765 176.094 0.033 0.000 1.100 1171 V CA -0.779 61.564 62.300 0.071 0.000 1.126 1171 V CB 0.448 32.257 31.823 -0.023 0.000 1.085 1171 V HN 0.863 nan 8.190 nan 0.000 0.480 1172 N N -0.423 118.235 118.700 -0.070 0.000 2.362 1172 N HA 0.006 4.731 4.740 -0.025 0.000 0.204 1172 N C -0.238 175.195 175.510 -0.129 0.000 1.166 1172 N CA -0.166 52.853 53.050 -0.053 0.000 0.831 1172 N CB -0.547 37.917 38.487 -0.039 0.000 1.008 1172 N HN 0.768 nan 8.380 nan 0.000 0.472 1173 D N 0.802 121.074 120.400 -0.213 0.000 2.302 1173 D HA 0.159 4.784 4.640 -0.025 0.000 0.248 1173 D C -0.246 175.691 176.300 -0.605 0.000 1.094 1173 D CA 0.275 54.025 54.000 -0.417 0.000 0.897 1173 D CB 1.404 41.848 40.800 -0.593 0.000 1.200 1173 D HN 0.009 nan 8.370 nan 0.000 0.429 1174 T N 2.414 116.650 114.554 -0.531 0.000 2.749 1174 T HA 0.383 4.718 4.350 -0.025 0.000 0.287 1174 T C -0.699 173.725 174.700 -0.460 0.000 0.970 1174 T CA -0.411 61.448 62.100 -0.403 0.000 0.980 1174 T CB 0.117 68.874 68.868 -0.184 0.000 0.924 1174 T HN 0.129 nan 8.240 nan 0.000 0.456 1175 Y N 1.975 122.194 120.300 -0.134 0.000 2.373 1175 Y HA 0.504 5.039 4.550 -0.025 0.000 0.336 1175 Y C -0.213 175.537 175.900 -0.249 0.000 0.979 1175 Y CA -1.491 56.523 58.100 -0.143 0.000 1.080 1175 Y CB 0.901 39.294 38.460 -0.111 0.000 1.190 1175 Y HN 0.413 nan 8.280 nan 0.000 0.446 1176 L N 6.649 127.806 121.223 -0.110 0.000 2.461 1176 L HA 0.256 4.580 4.340 -0.025 0.000 0.272 1176 L C -1.201 175.628 176.870 -0.069 0.000 1.197 1176 L CA -1.645 53.041 54.840 -0.256 0.000 0.836 1176 L CB 0.611 42.533 42.059 -0.229 0.000 1.105 1176 L HN 0.394 nan 8.230 nan 0.000 0.477 1177 P HA -0.226 nan 4.420 nan 0.000 0.217 1177 P C 1.332 178.647 177.300 0.025 0.000 1.148 1177 P CA 1.853 64.992 63.100 0.065 0.000 0.828 1177 P CB -0.001 31.789 31.700 0.151 0.000 0.783 1178 S N 0.024 115.736 115.700 0.019 0.000 2.402 1178 S HA 0.015 4.470 4.470 -0.025 0.000 0.229 1178 S C 2.123 176.706 174.600 -0.028 0.000 1.021 1178 S CA 0.922 59.123 58.200 0.003 0.000 0.974 1178 S CB -1.213 61.993 63.200 0.010 0.000 0.800 1178 S HN 0.169 nan 8.310 nan 0.000 0.484 1179 A N 1.351 124.150 122.820 -0.035 0.000 2.238 1179 A HA 0.309 4.614 4.320 -0.025 0.000 0.208 1179 A C 1.022 178.498 177.584 -0.180 0.000 1.177 1179 A CA 0.188 52.193 52.037 -0.053 0.000 0.804 1179 A CB -0.861 18.149 19.000 0.018 0.000 0.823 1179 A HN 0.485 nan 8.150 nan 0.000 0.482 1180 T N 2.817 117.247 114.554 -0.207 0.000 2.928 1180 T HA 0.288 4.623 4.350 -0.025 0.000 0.305 1180 T C -2.384 172.085 174.700 -0.385 0.000 1.035 1180 T CA -0.495 61.366 62.100 -0.398 0.000 1.145 1180 T CB 0.144 68.905 68.868 -0.180 0.000 0.963 1180 T HN 0.114 nan 8.240 nan 0.000 0.545 1181 P HA 0.006 nan 4.420 nan 0.000 0.259 1181 P C 0.415 177.637 177.300 -0.130 0.000 1.155 1181 P CA 0.144 63.085 63.100 -0.265 0.000 0.759 1181 P CB 0.222 31.774 31.700 -0.246 0.000 0.753 1182 A N 6.586 129.353 122.820 -0.087 0.000 1.969 1182 A HA -0.065 4.240 4.320 -0.025 0.000 0.218 1182 A C -0.382 177.198 177.584 -0.006 0.000 1.169 1182 A CA 1.397 53.409 52.037 -0.041 0.000 0.635 1182 A CB -1.987 16.991 19.000 -0.038 0.000 0.810 1182 A HN 0.454 nan 8.150 nan 0.000 0.445 1183 P HA -0.098 nan 4.420 nan 0.000 0.219 1183 P C 1.078 178.473 177.300 0.158 0.000 1.146 1183 P CA 0.718 63.839 63.100 0.035 0.000 0.808 1183 P CB 0.090 31.765 31.700 -0.043 0.000 0.779 1184 L N -2.151 119.145 121.223 0.121 0.000 2.298 1184 L HA 0.099 4.424 4.340 -0.025 0.000 0.209 1184 L C 2.154 179.188 176.870 0.273 0.000 1.084 1184 L CA 0.913 55.900 54.840 0.244 0.000 0.816 1184 L CB -1.341 40.810 42.059 0.153 0.000 0.967 1184 L HN -0.113 nan 8.230 nan 0.000 0.460 1185 L N -0.258 121.035 121.223 0.117 0.000 2.064 1185 L HA -0.348 3.977 4.340 -0.025 0.000 0.216 1185 L C 2.686 179.610 176.870 0.090 0.000 1.077 1185 L CA 1.657 56.542 54.840 0.076 0.000 0.766 1185 L CB -0.386 41.692 42.059 0.032 0.000 0.890 1185 L HN 0.287 nan 8.230 nan 0.000 0.435 1186 K N -0.713 119.721 120.400 0.057 0.000 2.009 1186 K HA -0.230 4.075 4.320 -0.025 0.000 0.210 1186 K C 2.194 178.752 176.600 -0.071 0.000 1.049 1186 K CA 1.997 58.244 56.287 -0.067 0.000 0.929 1186 K CB -0.321 32.030 32.500 -0.248 0.000 0.714 1186 K HN 0.241 nan 8.250 nan 0.000 0.440 1187 Y N 0.685 121.042 120.300 0.094 0.000 2.274 1187 Y HA -0.182 4.353 4.550 -0.025 0.000 0.290 1187 Y C 2.631 178.685 175.900 0.258 0.000 1.145 1187 Y CA 1.580 59.761 58.100 0.135 0.000 1.203 1187 Y CB -0.288 38.199 38.460 0.046 0.000 0.984 1187 Y HN 0.151 nan 8.280 nan 0.000 0.533 1188 R N 0.622 121.331 120.500 0.349 0.000 2.070 1188 R HA -0.149 4.176 4.340 -0.025 0.000 0.232 1188 R C 2.132 178.391 176.300 -0.068 0.000 1.138 1188 R CA 1.398 57.510 56.100 0.020 0.000 0.936 1188 R CB -0.075 30.175 30.300 -0.083 0.000 0.839 1188 R HN 0.009 nan 8.270 nan 0.000 0.429 1189 K N 0.743 121.209 120.400 0.110 0.000 2.288 1189 K HA -0.130 4.175 4.320 -0.025 0.000 0.201 1189 K C 1.792 178.542 176.600 0.250 0.000 1.048 1189 K CA 0.979 57.432 56.287 0.276 0.000 0.956 1189 K CB 0.004 32.630 32.500 0.209 0.000 0.746 1189 K HN 0.411 nan 8.250 nan 0.000 0.461 1190 E N 0.796 121.080 120.200 0.139 0.000 2.107 1190 E HA -0.131 4.204 4.350 -0.025 0.000 0.191 1190 E C -0.284 176.394 176.600 0.131 0.000 0.982 1190 E CA 0.780 57.242 56.400 0.104 0.000 0.809 1190 E CB 0.312 30.026 29.700 0.024 0.000 0.756 1190 E HN 0.021 nan 8.360 nan 0.000 0.459 1191 E N -0.526 119.748 120.200 0.123 0.000 2.400 1191 E HA 0.195 4.530 4.350 -0.025 0.000 0.232 1191 E C -1.011 175.632 176.600 0.072 0.000 0.988 1191 E CA -0.201 56.254 56.400 0.091 0.000 0.823 1191 E CB 0.475 30.208 29.700 0.055 0.000 1.246 1191 E HN 0.150 nan 8.360 nan 0.000 0.441 1192 F N -0.168 119.807 119.950 0.042 0.000 1.705 1192 F HA 0.027 4.539 4.527 -0.025 0.000 0.276 1192 F C 1.620 177.434 175.800 0.024 0.000 1.197 1192 F CA 0.211 58.225 58.000 0.024 0.000 1.299 1192 F CB 0.048 39.068 39.000 0.034 0.000 1.873 1192 F HN 0.369 nan 8.300 nan 0.000 0.260 1193 E N 0.820 121.191 120.200 0.285 0.000 2.153 1193 E HA -0.120 4.215 4.350 -0.025 0.000 0.194 1193 E C 1.816 178.488 176.600 0.120 0.000 0.988 1193 E CA 1.728 58.213 56.400 0.141 0.000 0.811 1193 E CB 0.136 29.913 29.700 0.128 0.000 0.746 1193 E HN 0.216 nan 8.360 nan 0.000 0.466 1194 V N 0.980 120.976 119.914 0.137 0.000 2.261 1194 V HA -0.264 3.841 4.120 -0.025 0.000 0.246 1194 V C 2.384 178.562 176.094 0.140 0.000 1.047 1194 V CA 1.328 63.696 62.300 0.113 0.000 1.015 1194 V CB -0.433 31.445 31.823 0.091 0.000 0.642 1194 V HN 0.312 nan 8.190 nan 0.000 0.446 1195 L N -0.394 120.942 121.223 0.189 0.000 2.131 1195 L HA -0.108 4.217 4.340 -0.025 0.000 0.210 1195 L C 2.493 179.496 176.870 0.221 0.000 1.092 1195 L CA 1.776 56.771 54.840 0.258 0.000 0.759 1195 L CB -0.966 41.261 42.059 0.280 0.000 0.903 1195 L HN 0.256 nan 8.230 nan 0.000 0.435 1196 R N -1.209 119.360 120.500 0.116 0.000 2.100 1196 R HA 0.206 4.531 4.340 -0.025 0.000 0.220 1196 R C 1.166 177.493 176.300 0.046 0.000 1.091 1196 R CA 0.603 56.729 56.100 0.044 0.000 0.986 1196 R CB -0.235 30.044 30.300 -0.035 0.000 0.888 1196 R HN 0.442 nan 8.270 nan 0.000 0.444 1197 G N 1.641 110.471 108.800 0.050 0.000 2.697 1197 G HA2 -0.323 3.622 3.960 -0.025 0.000 0.240 1197 G HA3 -0.323 3.622 3.960 -0.025 0.000 0.240 1197 G C -0.563 174.346 174.900 0.014 0.000 1.346 1197 G CA 0.249 45.366 45.100 0.027 0.000 0.887 1197 G HN 0.529 nan 8.290 nan 0.000 0.569 1198 D N -1.550 118.849 120.400 -0.002 0.000 2.538 1198 D HA 0.476 5.101 4.640 -0.025 0.000 0.231 1198 D C 1.514 177.806 176.300 -0.012 0.000 1.229 1198 D CA 0.867 54.865 54.000 -0.003 0.000 0.828 1198 D CB 0.194 40.991 40.800 -0.005 0.000 1.035 1198 D HN 2.093 nan 8.370 nan 0.000 0.495 1199 G N 0.199 108.987 108.800 -0.019 0.000 2.168 1199 G HA2 -0.267 3.677 3.960 -0.025 0.000 0.263 1199 G HA3 -0.267 3.677 3.960 -0.025 0.000 0.263 1199 G C 0.436 175.309 174.900 -0.045 0.000 0.977 1199 G CA 0.791 45.876 45.100 -0.025 0.000 0.659 1199 G HN 0.997 nan 8.290 nan 0.000 0.533 1200 T N -2.933 111.588 114.554 -0.056 0.000 2.896 1200 T HA 0.912 5.247 4.350 -0.025 0.000 0.297 1200 T C 0.346 174.990 174.700 -0.093 0.000 1.108 1200 T CA 0.554 62.613 62.100 -0.068 0.000 1.004 1200 T CB 2.382 71.220 68.868 -0.051 0.000 1.159 1200 T HN 2.390 nan 8.240 nan 0.000 0.499 1201 G N 0.959 109.697 108.800 -0.103 0.000 2.612 1201 G HA2 0.295 4.240 3.960 -0.025 0.000 0.686 1201 G HA3 0.295 4.240 3.960 -0.025 0.000 0.686 1201 G C -1.177 173.621 174.900 -0.170 0.000 1.274 1201 G CA -0.460 44.565 45.100 -0.126 0.000 0.849 1201 G HN 0.991 nan 8.290 nan 0.000 0.595 1202 K N 0.775 121.062 120.400 -0.188 0.000 2.183 1202 K HA 0.631 4.936 4.320 -0.025 0.000 0.274 1202 K C 0.603 177.001 176.600 -0.337 0.000 1.009 1202 K CA -0.863 55.283 56.287 -0.234 0.000 0.888 1202 K CB 0.659 33.046 32.500 -0.188 0.000 1.078 1202 K HN 0.518 nan 8.250 nan 0.000 0.459 1203 R N 3.468 123.670 120.500 -0.497 0.000 2.491 1203 R HA 0.183 4.508 4.340 -0.025 0.000 0.283 1203 R C -0.220 175.684 176.300 -0.659 0.000 1.072 1203 R CA -0.016 55.602 56.100 -0.802 0.000 1.048 1203 R CB 0.362 29.677 30.300 -1.642 0.000 0.983 1203 R HN 0.657 nan 8.270 nan 0.000 0.450 1204 K N 1.561 121.579 120.400 -0.638 0.000 2.156 1204 K HA 0.081 4.386 4.320 -0.025 0.000 0.250 1204 K C 1.077 177.366 176.600 -0.519 0.000 0.955 1204 K CA -0.772 55.123 56.287 -0.655 0.000 0.855 1204 K CB 1.238 33.105 32.500 -1.055 0.000 1.101 1204 K HN 0.575 nan 8.250 nan 0.000 0.434 1205 D N 2.152 122.286 120.400 -0.443 0.000 2.170 1205 D HA -0.256 4.369 4.640 -0.025 0.000 0.193 1205 D C 1.296 177.443 176.300 -0.254 0.000 1.004 1205 D CA 1.974 55.827 54.000 -0.245 0.000 0.860 1205 D CB -0.286 40.405 40.800 -0.182 0.000 0.931 1205 D HN 0.662 nan 8.370 nan 0.000 0.448 1206 F N 0.082 119.792 119.950 -0.399 0.000 2.780 1206 F HA 0.295 4.807 4.527 -0.025 0.000 0.299 1206 F C 0.292 175.914 175.800 -0.297 0.000 1.146 1206 F CA -0.703 56.862 58.000 -0.726 0.000 1.428 1206 F CB -0.252 37.801 39.000 -1.578 0.000 1.115 1206 F HN -0.375 nan 8.300 nan 0.000 0.583 1207 D N 2.113 122.477 120.400 -0.060 0.000 2.389 1207 D HA 0.143 4.768 4.640 -0.025 0.000 0.247 1207 D C 0.240 176.655 176.300 0.192 0.000 1.128 1207 D CA -0.005 54.070 54.000 0.125 0.000 0.884 1207 D CB 0.985 41.749 40.800 -0.060 0.000 1.194 1207 D HN 0.339 nan 8.370 nan 0.000 0.441 1208 R N 1.925 122.544 120.500 0.200 0.000 3.130 1208 R HA 0.346 4.671 4.340 -0.025 0.000 0.348 1208 R C -0.228 176.119 176.300 0.079 0.000 1.241 1208 R CA -0.250 55.928 56.100 0.130 0.000 1.141 1208 R CB 0.192 30.627 30.300 0.224 0.000 1.453 1208 R HN 0.304 nan 8.270 nan 0.000 0.590 1209 I N 1.015 121.601 120.570 0.026 0.000 2.336 1209 I HA 0.251 4.406 4.170 -0.025 0.000 0.292 1209 I C -0.587 175.458 176.117 -0.119 0.000 0.991 1209 I CA -0.883 60.431 61.300 0.025 0.000 1.227 1209 I CB 0.924 38.925 38.000 0.001 0.000 1.366 1209 I HN 0.070 nan 8.210 nan 0.000 0.466 1210 Y N 4.582 124.893 120.300 0.019 0.000 2.331 1210 Y HA 0.531 5.066 4.550 -0.025 0.000 0.338 1210 Y C 0.039 175.841 175.900 -0.163 0.000 0.992 1210 Y CA -0.424 57.633 58.100 -0.072 0.000 1.121 1210 Y CB 1.169 39.575 38.460 -0.092 0.000 1.184 1210 Y HN 0.483 nan 8.280 nan 0.000 0.469 1211 D N 0.633 120.951 120.400 -0.136 0.000 2.713 1211 D HA 0.284 4.909 4.640 -0.025 0.000 0.306 1211 D C -1.743 174.336 176.300 -0.368 0.000 1.299 1211 D CA -0.696 53.174 54.000 -0.216 0.000 0.823 1211 D CB 1.700 42.466 40.800 -0.057 0.000 1.353 1211 D HN 0.329 nan 8.370 nan 0.000 0.447 1212 Y N 0.434 120.711 120.300 -0.039 0.000 2.409 1212 Y HA 0.550 5.085 4.550 -0.025 0.000 0.339 1212 Y C 0.365 176.217 175.900 -0.079 0.000 1.033 1212 Y CA -0.482 57.574 58.100 -0.073 0.000 1.094 1212 Y CB 1.778 40.182 38.460 -0.093 0.000 1.210 1212 Y HN 0.093 nan 8.280 nan 0.000 0.456 1213 D N -0.087 120.347 120.400 0.055 0.000 2.643 1213 D HA 0.419 5.044 4.640 -0.025 0.000 0.283 1213 D C -1.211 175.073 176.300 -0.027 0.000 1.242 1213 D CA -0.400 53.596 54.000 -0.007 0.000 0.863 1213 D CB 2.501 43.265 40.800 -0.061 0.000 1.382 1213 D HN 0.372 nan 8.370 nan 0.000 0.444 1214 V N -0.682 119.223 119.914 -0.015 0.000 3.295 1214 V HA 0.471 4.575 4.120 -0.025 0.000 0.308 1214 V C -0.227 175.865 176.094 -0.003 0.000 1.068 1214 V CA -0.204 62.129 62.300 0.054 0.000 1.062 1214 V CB 0.572 32.431 31.823 0.059 0.000 1.162 1214 V HN 0.506 nan 8.190 nan 0.000 0.456 1215 Y N 2.334 122.626 120.300 -0.013 0.000 2.714 1215 Y HA 0.314 4.849 4.550 -0.025 0.000 0.333 1215 Y C 1.046 176.889 175.900 -0.095 0.000 1.220 1215 Y CA -0.455 57.615 58.100 -0.050 0.000 1.513 1215 Y CB -0.140 38.269 38.460 -0.084 0.000 1.435 1215 Y HN 0.855 nan 8.280 nan 0.000 0.489 1216 N N -1.012 117.685 118.700 -0.005 0.000 2.205 1216 N HA -0.056 4.669 4.740 -0.025 0.000 0.201 1216 N C 0.172 175.646 175.510 -0.061 0.000 1.128 1216 N CA 0.130 53.154 53.050 -0.043 0.000 0.867 1216 N CB -0.024 38.433 38.487 -0.050 0.000 0.996 1216 N HN 0.449 nan 8.380 nan 0.000 0.503 1217 D N -0.520 119.839 120.400 -0.068 0.000 2.340 1217 D HA 0.064 4.689 4.640 -0.025 0.000 0.217 1217 D C 0.880 177.140 176.300 -0.067 0.000 1.081 1217 D CA -0.222 53.731 54.000 -0.077 0.000 0.842 1217 D CB -0.022 40.718 40.800 -0.101 0.000 0.934 1217 D HN 0.072 nan 8.370 nan 0.000 0.511 1218 L N 0.340 121.531 121.223 -0.053 0.000 2.592 1218 L HA 0.404 4.729 4.340 -0.025 0.000 0.227 1218 L C 1.299 178.120 176.870 -0.081 0.000 1.127 1218 L CA 0.059 54.861 54.840 -0.063 0.000 0.884 1218 L CB 0.215 42.242 42.059 -0.054 0.000 1.065 1218 L HN 0.156 nan 8.230 nan 0.000 0.457 1219 G N -1.370 107.382 108.800 -0.079 0.000 2.938 1219 G HA2 0.331 4.276 3.960 -0.025 0.000 0.258 1219 G HA3 0.331 4.276 3.960 -0.025 0.000 0.258 1219 G C -0.731 174.126 174.900 -0.072 0.000 1.356 1219 G CA -0.336 44.716 45.100 -0.081 0.000 1.052 1219 G HN 0.048 nan 8.290 nan 0.000 0.550 1220 N N -0.380 118.279 118.700 -0.068 0.000 2.697 1220 N HA 0.350 5.075 4.740 -0.025 0.000 0.253 1220 N C -2.101 173.376 175.510 -0.056 0.000 1.604 1220 N CA -1.339 51.674 53.050 -0.060 0.000 0.772 1220 N CB 1.894 40.347 38.487 -0.057 0.000 1.267 1220 N HN -0.000 nan 8.380 nan 0.000 0.510 1221 P HA -0.005 nan 4.420 nan 0.000 0.217 1221 P C 0.564 177.838 177.300 -0.043 0.000 1.151 1221 P CA 0.923 63.993 63.100 -0.050 0.000 0.828 1221 P CB 0.427 32.096 31.700 -0.052 0.000 0.788 1222 D N -0.601 119.773 120.400 -0.043 0.000 2.221 1222 D HA -0.089 4.536 4.640 -0.025 0.000 0.204 1222 D C 2.066 178.344 176.300 -0.036 0.000 0.982 1222 D CA 1.570 55.547 54.000 -0.038 0.000 0.857 1222 D CB -0.912 39.864 40.800 -0.039 0.000 0.934 1222 D HN 0.244 nan 8.370 nan 0.000 0.475 1223 G N -0.939 107.838 108.800 -0.039 0.000 2.838 1223 G HA2 0.280 4.225 3.960 -0.025 0.000 0.210 1223 G HA3 0.280 4.225 3.960 -0.025 0.000 0.210 1223 G C 1.172 176.050 174.900 -0.037 0.000 1.153 1223 G CA 0.438 45.515 45.100 -0.038 0.000 0.778 1223 G HN 0.441 nan 8.290 nan 0.000 0.539 1224 G N -0.194 108.583 108.800 -0.039 0.000 2.134 1224 G HA2 -0.200 3.745 3.960 -0.025 0.000 0.209 1224 G HA3 -0.200 3.745 3.960 -0.025 0.000 0.209 1224 G C -0.227 174.648 174.900 -0.043 0.000 0.993 1224 G CA 0.209 45.286 45.100 -0.037 0.000 0.669 1224 G HN 0.440 nan 8.290 nan 0.000 0.519 1225 D N 1.012 121.381 120.400 -0.051 0.000 2.441 1225 D HA 0.419 5.044 4.640 -0.025 0.000 0.287 1225 D C -1.980 174.277 176.300 -0.070 0.000 1.198 1225 D CA -1.413 52.550 54.000 -0.062 0.000 0.894 1225 D CB 1.864 42.627 40.800 -0.062 0.000 1.070 1225 D HN 0.260 nan 8.370 nan 0.000 0.499 1226 P HA 0.419 nan 4.420 nan 0.000 0.282 1226 P C -0.464 176.780 177.300 -0.094 0.000 1.259 1226 P CA -0.706 62.348 63.100 -0.077 0.000 0.826 1226 P CB 1.670 33.331 31.700 -0.066 0.000 1.064 1227 R N 0.747 121.183 120.500 -0.107 0.000 2.837 1227 R HA 0.555 4.880 4.340 -0.025 0.000 0.271 1227 R C -2.399 173.801 176.300 -0.166 0.000 0.993 1227 R CA -2.093 53.931 56.100 -0.126 0.000 0.931 1227 R CB 0.068 30.291 30.300 -0.127 0.000 1.206 1227 R HN 0.386 nan 8.270 nan 0.000 0.474 1228 P HA 0.224 nan 4.420 nan 0.000 0.268 1228 P C -0.141 176.926 177.300 -0.388 0.000 1.204 1228 P CA -0.109 62.726 63.100 -0.443 0.000 0.768 1228 P CB 0.394 31.649 31.700 -0.741 0.000 0.842 1229 I N 3.497 123.862 120.570 -0.342 0.000 2.581 1229 I HA -0.007 4.148 4.170 -0.025 0.000 0.285 1229 I C 0.365 176.396 176.117 -0.143 0.000 1.129 1229 I CA 0.202 61.394 61.300 -0.181 0.000 1.397 1229 I CB -0.061 37.875 38.000 -0.107 0.000 1.399 1229 I HN 0.116 nan 8.210 nan 0.000 0.537 1230 L N 7.800 128.974 121.223 -0.081 0.000 2.287 1230 L HA 0.668 4.993 4.340 -0.025 0.000 0.280 1230 L C 0.440 177.377 176.870 0.112 0.000 1.055 1230 L CA -0.298 54.508 54.840 -0.058 0.000 0.863 1230 L CB 0.384 42.182 42.059 -0.435 0.000 1.245 1230 L HN 0.871 nan 8.230 nan 0.000 0.432 1231 G N 0.601 109.499 108.800 0.163 0.000 2.312 1231 G HA2 0.389 4.334 3.960 -0.025 0.000 0.347 1231 G HA3 0.389 4.334 3.960 -0.025 0.000 0.347 1231 G C 0.093 175.064 174.900 0.120 0.000 1.564 1231 G CA -0.083 45.117 45.100 0.165 0.000 0.981 1231 G HN 0.753 nan 8.290 nan 0.000 0.678 1232 G N -1.037 107.817 108.800 0.090 0.000 3.909 1232 G HA2 -0.211 3.734 3.960 -0.025 0.000 0.218 1232 G HA3 -0.211 3.734 3.960 -0.025 0.000 0.218 1232 G C 1.458 176.408 174.900 0.083 0.000 1.404 1232 G CA 1.025 46.163 45.100 0.064 0.000 0.905 1232 G HN 1.983 nan 8.290 nan 0.000 0.589 1233 C N 1.600 120.977 119.300 0.129 0.000 2.767 1233 C HA 0.530 4.975 4.460 -0.025 0.000 0.353 1233 C C 2.305 177.359 174.990 0.107 0.000 1.376 1233 C CA 1.185 60.284 59.018 0.135 0.000 2.284 1233 C CB 1.101 28.987 27.740 0.243 0.000 2.535 1233 C HN 1.226 nan 8.230 nan 0.000 0.745 1234 S N -1.226 114.513 115.700 0.064 0.000 2.603 1234 S HA 0.234 4.689 4.470 -0.025 0.000 0.232 1234 S C 0.827 175.427 174.600 -0.000 0.000 1.016 1234 S CA -0.034 58.193 58.200 0.045 0.000 0.976 1234 S CB -0.258 62.956 63.200 0.023 0.000 0.921 1234 S HN 0.693 nan 8.310 nan 0.000 0.516 1235 I N -0.500 120.029 120.570 -0.068 0.000 2.731 1235 I HA 0.193 4.348 4.170 -0.025 0.000 0.260 1235 I C -0.066 175.729 176.117 -0.536 0.000 1.138 1235 I CA 0.573 61.695 61.300 -0.296 0.000 1.461 1235 I CB 0.200 38.001 38.000 -0.333 0.000 1.128 1235 I HN 0.226 nan 8.210 nan 0.000 0.438 1236 Y N 2.270 122.621 120.300 0.085 0.000 2.638 1236 Y HA 0.361 4.896 4.550 -0.025 0.000 0.367 1236 Y C -2.473 173.503 175.900 0.127 0.000 1.001 1236 Y CA -3.416 54.736 58.100 0.086 0.000 1.133 1236 Y CB -0.250 38.235 38.460 0.042 0.000 1.199 1236 Y HN -0.033 nan 8.280 nan 0.000 0.642 1237 P HA 0.288 nan 4.420 nan 0.000 0.281 1237 P C -0.958 176.573 177.300 0.384 0.000 1.249 1237 P CA -0.207 63.109 63.100 0.359 0.000 0.810 1237 P CB 2.051 34.010 31.700 0.431 0.000 1.008 1238 Y N 0.433 120.656 120.300 -0.127 0.000 2.677 1238 Y HA 0.350 4.885 4.550 -0.025 0.000 0.334 1238 Y C -2.505 172.983 175.900 -0.688 0.000 1.196 1238 Y CA -2.464 55.256 58.100 -0.633 0.000 1.059 1238 Y CB 2.298 40.537 38.460 -0.368 0.000 1.315 1238 Y HN 0.245 nan 8.280 nan 0.000 0.455 1239 P HA 0.156 nan 4.420 nan 0.000 0.272 1239 P C -1.168 175.996 177.300 -0.226 0.000 1.240 1239 P CA -0.047 62.590 63.100 -0.771 0.000 0.791 1239 P CB 0.659 31.794 31.700 -0.942 0.000 0.978 1240 L N 1.558 122.657 121.223 -0.208 0.000 2.440 1240 L HA 0.602 4.927 4.340 -0.025 0.000 0.262 1240 L C 0.866 177.758 176.870 0.037 0.000 1.072 1240 L CA 0.101 54.949 54.840 0.013 0.000 0.798 1240 L CB 0.588 42.630 42.059 -0.029 0.000 1.307 1240 L HN 0.485 nan 8.230 nan 0.000 0.475 1241 R N -1.169 119.310 120.500 -0.034 0.000 2.846 1241 R HA 0.651 4.976 4.340 -0.025 0.000 0.263 1241 R C -1.387 174.833 176.300 -0.132 0.000 1.080 1241 R CA -0.820 55.204 56.100 -0.127 0.000 0.961 1241 R CB 0.388 30.474 30.300 -0.358 0.000 1.231 1241 R HN 0.155 nan 8.270 nan 0.000 0.465 1242 V N 1.799 121.629 119.914 -0.141 0.000 2.521 1242 V HA 0.192 4.297 4.120 -0.025 0.000 0.286 1242 V C 0.246 176.292 176.094 -0.079 0.000 1.034 1242 V CA -0.132 62.092 62.300 -0.126 0.000 1.045 1242 V CB 0.547 32.300 31.823 -0.117 0.000 0.974 1242 V HN 0.586 nan 8.190 nan 0.000 0.480 1243 R N 3.828 124.287 120.500 -0.070 0.000 2.421 1243 R HA 0.091 4.416 4.340 -0.025 0.000 0.305 1243 R C 1.171 177.435 176.300 -0.060 0.000 1.039 1243 R CA 0.657 56.716 56.100 -0.068 0.000 1.003 1243 R CB 0.746 31.001 30.300 -0.074 0.000 0.959 1243 R HN 0.997 nan 8.270 nan 0.000 0.427 1244 T N 0.273 114.778 114.554 -0.082 0.000 3.021 1244 T HA 0.138 4.473 4.350 -0.025 0.000 0.245 1244 T C 1.326 175.895 174.700 -0.217 0.000 1.028 1244 T CA 0.474 62.507 62.100 -0.112 0.000 1.139 1244 T CB 0.192 69.031 68.868 -0.048 0.000 0.884 1244 T HN 0.721 nan 8.240 nan 0.000 0.457 1245 G N 2.295 110.999 108.800 -0.160 0.000 2.147 1245 G HA2 -0.256 3.689 3.960 -0.025 0.000 0.244 1245 G HA3 -0.256 3.689 3.960 -0.025 0.000 0.244 1245 G C 0.122 174.935 174.900 -0.144 0.000 1.005 1245 G CA -0.050 44.957 45.100 -0.156 0.000 0.713 1245 G HN 0.670 nan 8.290 nan 0.000 0.515 1246 R N 0.685 121.109 120.500 -0.127 0.000 2.774 1246 R HA 0.358 4.683 4.340 -0.025 0.000 0.269 1246 R C 0.925 177.169 176.300 -0.093 0.000 1.068 1246 R CA -0.002 56.032 56.100 -0.111 0.000 1.180 1246 R CB 0.375 30.616 30.300 -0.098 0.000 1.077 1246 R HN 0.555 nan 8.270 nan 0.000 0.513 1247 E N 2.713 122.862 120.200 -0.084 0.000 2.415 1247 E HA -0.002 4.333 4.350 -0.025 0.000 0.262 1247 E C -0.279 176.282 176.600 -0.066 0.000 1.038 1247 E CA -0.028 56.329 56.400 -0.072 0.000 0.921 1247 E CB 0.472 30.133 29.700 -0.065 0.000 0.950 1247 E HN 0.254 nan 8.360 nan 0.000 0.438 1248 R N 1.301 121.766 120.500 -0.059 0.000 2.641 1248 R HA 0.197 4.522 4.340 -0.025 0.000 0.269 1248 R C 0.346 176.616 176.300 -0.051 0.000 1.074 1248 R CA -0.238 55.829 56.100 -0.055 0.000 1.133 1248 R CB 0.028 30.299 30.300 -0.049 0.000 1.029 1248 R HN 0.532 nan 8.270 nan 0.000 0.488 1249 T N 1.569 116.093 114.554 -0.050 0.000 2.795 1249 T HA 0.007 4.342 4.350 -0.025 0.000 0.314 1249 T C 1.592 176.267 174.700 -0.041 0.000 1.069 1249 T CA -0.008 62.063 62.100 -0.047 0.000 1.071 1249 T CB 0.737 69.575 68.868 -0.050 0.000 0.988 1249 T HN 0.468 nan 8.240 nan 0.000 0.543 1250 R N 0.342 120.818 120.500 -0.039 0.000 2.066 1250 R HA -0.032 4.293 4.340 -0.025 0.000 0.224 1250 R C 2.346 178.627 176.300 -0.032 0.000 1.122 1250 R CA 1.262 57.341 56.100 -0.034 0.000 0.974 1250 R CB -0.468 29.813 30.300 -0.032 0.000 0.871 1250 R HN 0.610 nan 8.270 nan 0.000 0.435 1251 T N 0.001 114.535 114.554 -0.034 0.000 2.812 1251 T HA -0.090 4.245 4.350 -0.025 0.000 0.264 1251 T C 0.029 174.709 174.700 -0.034 0.000 1.042 1251 T CA 1.220 63.300 62.100 -0.032 0.000 1.140 1251 T CB -0.022 68.826 68.868 -0.034 0.000 0.870 1251 T HN 0.177 nan 8.240 nan 0.000 0.445 1252 D N 0.680 121.057 120.400 -0.038 0.000 2.421 1252 D HA 0.239 4.864 4.640 -0.025 0.000 0.254 1252 D C -2.223 174.053 176.300 -0.041 0.000 1.238 1252 D CA -2.344 51.632 54.000 -0.040 0.000 0.919 1252 D CB 1.913 42.684 40.800 -0.047 0.000 1.152 1252 D HN 0.029 nan 8.370 nan 0.000 0.552 1253 P HA 0.070 nan 4.420 nan 0.000 0.249 1253 P C 0.342 177.619 177.300 -0.039 0.000 1.241 1253 P CA 0.071 63.148 63.100 -0.038 0.000 0.781 1253 P CB 0.438 32.118 31.700 -0.034 0.000 1.088 1254 N N -0.531 118.146 118.700 -0.039 0.000 2.412 1254 N HA 0.045 4.770 4.740 -0.025 0.000 0.184 1254 N C 0.333 175.815 175.510 -0.047 0.000 1.101 1254 N CA 0.418 53.445 53.050 -0.039 0.000 0.881 1254 N CB 0.240 38.706 38.487 -0.035 0.000 0.969 1254 N HN 0.099 nan 8.380 nan 0.000 0.459 1255 S N 0.183 115.851 115.700 -0.052 0.000 2.593 1255 S HA 0.246 4.701 4.470 -0.025 0.000 0.297 1255 S C -0.145 174.419 174.600 -0.060 0.000 1.112 1255 S CA -0.712 57.453 58.200 -0.058 0.000 1.043 1255 S CB 2.637 65.800 63.200 -0.062 0.000 1.054 1255 S HN 0.110 nan 8.310 nan 0.000 0.516 1256 E N 1.609 121.769 120.200 -0.066 0.000 2.175 1256 E HA 0.185 4.520 4.350 -0.025 0.000 0.278 1256 E C -0.743 175.815 176.600 -0.069 0.000 0.969 1256 E CA -0.728 55.630 56.400 -0.070 0.000 0.796 1256 E CB 0.589 30.242 29.700 -0.078 0.000 1.104 1256 E HN 0.337 nan 8.360 nan 0.000 0.395 1257 K N 5.603 125.962 120.400 -0.067 0.000 2.447 1257 K HA 0.117 4.422 4.320 -0.025 0.000 0.281 1257 K C -2.048 174.510 176.600 -0.069 0.000 1.031 1257 K CA -1.191 55.057 56.287 -0.065 0.000 1.019 1257 K CB 0.381 32.843 32.500 -0.062 0.000 0.918 1257 K HN 0.480 nan 8.250 nan 0.000 0.476 1258 P HA -0.090 nan 4.420 nan 0.000 0.271 1258 P C 0.544 177.800 177.300 -0.072 0.000 1.228 1258 P CA 0.299 63.356 63.100 -0.071 0.000 0.797 1258 P CB 0.559 32.218 31.700 -0.069 0.000 0.914 1259 G N -0.111 108.644 108.800 -0.075 0.000 2.217 1259 G HA2 -0.080 3.865 3.960 -0.025 0.000 0.173 1259 G HA3 -0.080 3.865 3.960 -0.025 0.000 0.173 1259 G C -0.849 174.006 174.900 -0.075 0.000 1.324 1259 G CA -0.385 44.669 45.100 -0.076 0.000 1.225 1259 G HN 0.649 nan 8.290 nan 0.000 0.494 1260 E N 1.482 121.637 120.200 -0.074 0.000 2.351 1260 E HA 0.089 4.424 4.350 -0.025 0.000 0.241 1260 E C 1.333 177.903 176.600 -0.051 0.000 1.243 1260 E CA 0.453 56.812 56.400 -0.068 0.000 0.963 1260 E CB 1.187 30.841 29.700 -0.077 0.000 1.042 1260 E HN 0.779 nan 8.360 nan 0.000 0.468 1261 V N 4.236 124.122 119.914 -0.048 0.000 2.515 1261 V HA -0.187 3.918 4.120 -0.025 0.000 0.250 1261 V C 0.403 176.517 176.094 0.034 0.000 1.058 1261 V CA 1.560 63.842 62.300 -0.031 0.000 1.064 1261 V CB -1.127 30.663 31.823 -0.055 0.000 0.675 1261 V HN 0.813 nan 8.190 nan 0.000 0.461 1262 Y N -0.373 119.848 120.300 -0.133 0.000 2.538 1262 Y HA -0.179 4.356 4.550 -0.025 0.000 0.028 1262 Y C -0.675 175.144 175.900 -0.136 0.000 1.731 1262 Y CA 0.217 58.226 58.100 -0.152 0.000 1.396 1262 Y CB -0.610 37.741 38.460 -0.181 0.000 2.043 1262 Y HN 0.270 nan 8.280 nan 0.000 0.259 1263 V N 4.006 123.379 119.914 -0.902 0.000 2.888 1263 V HA 0.573 4.678 4.120 -0.025 0.000 0.309 1263 V C -2.540 172.818 176.094 -1.228 0.000 1.114 1263 V CA -2.287 59.469 62.300 -0.907 0.000 0.940 1263 V CB 2.120 33.726 31.823 -0.362 0.000 1.021 1263 V HN 0.585 nan 8.190 nan 0.000 0.426 1264 P HA -0.041 nan 4.420 nan 0.000 0.191 1264 P C 0.885 178.030 177.300 -0.257 0.000 1.337 1264 P CA 0.758 63.458 63.100 -0.668 0.000 0.945 1264 P CB -0.291 30.814 31.700 -0.992 0.000 1.664 1265 R N 1.871 122.245 120.500 -0.210 0.000 1.249 1265 R HA -0.312 4.013 4.340 -0.025 0.000 0.032 1265 R C 1.069 177.396 176.300 0.043 0.000 0.960 1265 R CA 2.738 58.819 56.100 -0.031 0.000 1.296 1265 R CB -2.200 28.172 30.300 0.119 0.000 0.453 1265 R HN 0.213 nan 8.270 nan 0.000 0.505 1266 D N 0.738 121.218 120.400 0.133 0.000 2.348 1266 D HA -0.037 4.587 4.640 -0.025 0.000 0.216 1266 D C 1.312 177.571 176.300 -0.068 0.000 0.970 1266 D CA 0.850 54.925 54.000 0.125 0.000 0.889 1266 D CB -0.164 40.770 40.800 0.225 0.000 0.912 1266 D HN 0.472 nan 8.370 nan 0.000 0.524 1267 E N 0.583 120.787 120.200 0.006 0.000 2.333 1267 E HA -0.093 4.242 4.350 -0.025 0.000 0.198 1267 E C 0.731 177.369 176.600 0.064 0.000 1.007 1267 E CA 0.219 56.665 56.400 0.076 0.000 0.845 1267 E CB -0.292 29.437 29.700 0.049 0.000 0.766 1267 E HN 0.395 nan 8.360 nan 0.000 0.507 1268 N N 0.490 119.153 118.700 -0.061 0.000 2.462 1268 N HA 0.044 4.769 4.740 -0.025 0.000 0.242 1268 N C -1.192 174.269 175.510 -0.081 0.000 1.010 1268 N CA -0.181 52.869 53.050 0.000 0.000 0.939 1268 N CB 0.233 38.709 38.487 -0.019 0.000 1.127 1268 N HN -0.244 nan 8.380 nan 0.000 0.509 1269 F N 1.658 121.655 119.950 0.079 0.000 2.424 1269 F HA 0.321 4.833 4.527 -0.026 0.000 0.356 1269 F C 1.498 177.145 175.800 -0.255 0.000 1.110 1269 F CA -0.419 57.571 58.000 -0.016 0.000 1.161 1269 F CB 1.157 40.128 39.000 -0.048 0.000 1.115 1269 F HN 0.350 nan 8.300 nan 0.000 0.507 1270 G N 2.940 111.761 108.800 0.035 0.000 2.444 1270 G HA2 0.414 4.359 3.960 -0.025 0.000 0.268 1270 G HA3 0.414 4.359 3.960 -0.025 0.000 0.268 1270 G C -0.780 173.957 174.900 -0.272 0.000 1.203 1270 G CA -0.249 44.891 45.100 0.066 0.000 0.835 1270 G HN 0.595 nan 8.290 nan 0.000 0.543 1271 H N 0.696 119.492 119.070 -0.456 0.000 2.869 1271 H HA 0.393 4.933 4.556 -0.026 0.000 0.342 1271 H C 0.399 175.674 175.328 -0.088 0.000 1.250 1271 H CA -0.861 54.894 56.048 -0.488 0.000 1.217 1271 H CB 1.882 31.068 29.762 -0.961 0.000 1.917 1271 H HN 0.226 nan 8.280 nan 0.000 0.586 1272 L N 0.121 121.410 121.223 0.111 0.000 2.286 1272 L HA 0.093 4.418 4.340 -0.025 0.000 0.203 1272 L C 0.431 177.411 176.870 0.182 0.000 1.068 1272 L CA 1.199 56.126 54.840 0.145 0.000 0.811 1272 L CB -0.265 41.841 42.059 0.078 0.000 0.989 1272 L HN 0.429 nan 8.230 nan 0.000 0.467 1273 K N 0.231 120.722 120.400 0.151 0.000 2.240 1273 K HA 0.221 4.526 4.320 -0.025 0.000 0.271 1273 K C 1.181 177.968 176.600 0.311 0.000 1.018 1273 K CA 0.082 56.465 56.287 0.161 0.000 0.874 1273 K CB 1.296 33.849 32.500 0.089 0.000 1.098 1273 K HN 0.030 nan 8.250 nan 0.000 0.458 1274 S N 1.204 117.073 115.700 0.282 0.000 2.462 1274 S HA -0.216 4.239 4.470 -0.025 0.000 0.243 1274 S C 1.580 176.478 174.600 0.498 0.000 1.003 1274 S CA 1.549 59.942 58.200 0.321 0.000 0.970 1274 S CB -0.441 62.603 63.200 -0.259 0.000 0.762 1274 S HN 0.671 nan 8.310 nan 0.000 0.510 1275 S N 1.080 116.972 115.700 0.320 0.000 2.489 1275 S HA 0.024 4.479 4.470 -0.025 0.000 0.228 1275 S C 1.131 175.886 174.600 0.259 0.000 0.995 1275 S CA 0.516 58.877 58.200 0.268 0.000 0.934 1275 S CB -0.272 63.021 63.200 0.155 0.000 0.771 1275 S HN 0.464 nan 8.310 nan 0.000 0.522 1276 D N 0.978 121.522 120.400 0.240 0.000 2.323 1276 D HA 0.121 4.746 4.640 -0.025 0.000 0.209 1276 D C -0.312 176.149 176.300 0.270 0.000 0.973 1276 D CA 0.351 54.400 54.000 0.082 0.000 0.874 1276 D CB -0.277 40.352 40.800 -0.286 0.000 0.930 1276 D HN 0.456 nan 8.370 nan 0.000 0.521 1277 F N 1.501 121.694 119.950 0.406 0.000 2.659 1277 F HA 0.049 4.559 4.527 -0.027 0.000 0.360 1277 F C 1.474 177.471 175.800 0.327 0.000 1.218 1277 F CA -0.451 57.832 58.000 0.471 0.000 1.317 1277 F CB 0.094 39.352 39.000 0.431 0.000 1.697 1277 F HN -0.215 nan 8.300 nan 0.000 0.637 1278 L N 0.954 122.418 121.223 0.402 0.000 2.081 1278 L HA -0.238 4.087 4.340 -0.025 0.000 0.212 1278 L C 2.707 179.705 176.870 0.214 0.000 1.080 1278 L CA 2.266 57.263 54.840 0.260 0.000 0.754 1278 L CB -1.646 40.540 42.059 0.211 0.000 0.893 1278 L HN 0.538 nan 8.230 nan 0.000 0.433 1279 T N -3.939 110.753 114.554 0.230 0.000 2.737 1279 T HA -0.297 4.038 4.350 -0.025 0.000 0.269 1279 T C 1.875 176.565 174.700 -0.017 0.000 1.040 1279 T CA 1.465 63.624 62.100 0.099 0.000 1.142 1279 T CB -0.911 67.995 68.868 0.063 0.000 0.861 1279 T HN 0.307 nan 8.240 nan 0.000 0.456 1280 Y N 1.762 122.021 120.300 -0.069 0.000 2.616 1280 Y HA 0.264 4.800 4.550 -0.023 0.000 0.296 1280 Y C 2.654 178.448 175.900 -0.176 0.000 1.154 1280 Y CA 0.351 58.276 58.100 -0.291 0.000 1.325 1280 Y CB -0.324 37.595 38.460 -0.902 0.000 1.007 1280 Y HN 0.417 nan 8.280 nan 0.000 0.542 1281 G N -0.616 108.243 108.800 0.097 0.000 2.510 1281 G HA2 -0.068 3.877 3.960 -0.025 0.000 0.212 1281 G HA3 -0.068 3.877 3.960 -0.025 0.000 0.212 1281 G C 1.551 176.496 174.900 0.075 0.000 1.151 1281 G CA 0.232 45.392 45.100 0.100 0.000 0.817 1281 G HN 0.336 nan 8.290 nan 0.000 0.534 1282 I N 1.371 121.975 120.570 0.056 0.000 2.252 1282 I HA -0.121 4.034 4.170 -0.025 0.000 0.245 1282 I C 2.644 178.777 176.117 0.027 0.000 1.102 1282 I CA 1.392 62.720 61.300 0.046 0.000 1.385 1282 I CB -0.007 38.016 38.000 0.039 0.000 1.064 1282 I HN 0.248 nan 8.210 nan 0.000 0.414 1283 K N -0.282 120.111 120.400 -0.012 0.000 2.444 1283 K HA 0.065 4.370 4.320 -0.025 0.000 0.193 1283 K C 1.791 178.420 176.600 0.048 0.000 1.024 1283 K CA 0.675 56.957 56.287 -0.009 0.000 1.077 1283 K CB 0.130 32.575 32.500 -0.091 0.000 0.833 1283 K HN 0.022 nan 8.250 nan 0.000 0.517 1284 S N 0.482 116.212 115.700 0.050 0.000 2.503 1284 S HA 0.058 4.513 4.470 -0.025 0.000 0.217 1284 S C 1.491 176.130 174.600 0.066 0.000 0.999 1284 S CA -0.217 58.020 58.200 0.062 0.000 0.914 1284 S CB -0.040 63.209 63.200 0.083 0.000 0.782 1284 S HN 0.360 nan 8.310 nan 0.000 0.520 1285 L N 1.004 122.278 121.223 0.085 0.000 2.202 1285 L HA 0.336 4.660 4.340 -0.025 0.000 0.205 1285 L C 2.335 179.250 176.870 0.074 0.000 1.083 1285 L CA 1.735 56.638 54.840 0.105 0.000 0.790 1285 L CB -0.921 41.223 42.059 0.141 0.000 0.942 1285 L HN 0.321 nan 8.230 nan 0.000 0.452 1286 S N -1.359 114.384 115.700 0.072 0.000 2.357 1286 S HA -0.234 4.221 4.470 -0.025 0.000 0.221 1286 S C 2.093 176.759 174.600 0.110 0.000 1.031 1286 S CA 1.275 59.518 58.200 0.072 0.000 0.982 1286 S CB -0.419 62.808 63.200 0.046 0.000 0.853 1286 S HN 0.739 nan 8.310 nan 0.000 0.458 1287 H N 0.142 119.211 119.070 -0.003 0.000 2.539 1287 H HA 0.349 4.890 4.556 -0.025 0.000 0.269 1287 H C 0.975 176.299 175.328 -0.007 0.000 0.980 1287 H CA 0.779 56.824 56.048 -0.005 0.000 1.152 1287 H CB 0.074 29.829 29.762 -0.012 0.000 1.407 1287 H HN 0.396 nan 8.280 nan 0.000 0.564 1288 D N -1.532 118.822 120.400 -0.076 0.000 3.050 1288 D HA 0.030 4.654 4.640 -0.025 0.000 0.281 1288 D C 1.772 177.972 176.300 -0.167 0.000 1.246 1288 D CA 0.769 54.673 54.000 -0.159 0.000 1.073 1288 D CB 0.463 41.175 40.800 -0.147 0.000 1.382 1288 D HN 0.193 nan 8.370 nan 0.000 0.433 1289 V N 1.723 121.517 119.914 -0.201 0.000 2.725 1289 V HA 0.014 4.119 4.120 -0.025 0.000 0.247 1289 V C 2.462 178.124 176.094 -0.719 0.000 1.058 1289 V CA 0.669 62.668 62.300 -0.501 0.000 1.080 1289 V CB -0.010 31.526 31.823 -0.478 0.000 0.713 1289 V HN 0.113 nan 8.190 nan 0.000 0.465 1290 I N 1.153 121.567 120.570 -0.260 0.000 2.315 1290 I HA -0.084 4.071 4.170 -0.025 0.000 0.248 1290 I C 0.050 176.289 176.117 0.205 0.000 1.117 1290 I CA 1.333 62.666 61.300 0.056 0.000 1.404 1290 I CB -1.058 37.020 38.000 0.129 0.000 1.071 1290 I HN 0.361 nan 8.210 nan 0.000 0.419 1291 P HA -0.114 nan 4.420 nan 0.000 0.223 1291 P C 1.884 179.214 177.300 0.049 0.000 1.151 1291 P CA 1.294 64.456 63.100 0.103 0.000 0.787 1291 P CB 0.075 31.812 31.700 0.062 0.000 0.788 1292 L N -1.713 119.475 121.223 -0.057 0.000 2.109 1292 L HA -0.055 4.270 4.340 -0.025 0.000 0.207 1292 L C 2.723 179.639 176.870 0.077 0.000 1.086 1292 L CA 1.300 56.101 54.840 -0.065 0.000 0.760 1292 L CB -0.836 41.107 42.059 -0.192 0.000 0.910 1292 L HN -0.135 nan 8.230 nan 0.000 0.437 1293 F N -0.078 119.970 119.950 0.164 0.000 2.234 1293 F HA -0.214 4.298 4.527 -0.025 0.000 0.299 1293 F C 2.701 178.578 175.800 0.129 0.000 1.087 1293 F CA 0.694 58.828 58.000 0.222 0.000 1.340 1293 F CB -0.122 39.136 39.000 0.430 0.000 1.031 1293 F HN 0.014 nan 8.300 nan 0.000 0.500 1294 K N 0.495 121.060 120.400 0.275 0.000 1.984 1294 K HA -0.141 4.164 4.320 -0.025 0.000 0.209 1294 K C 2.220 178.822 176.600 0.003 0.000 1.046 1294 K CA 1.527 57.763 56.287 -0.085 0.000 0.934 1294 K CB -0.343 32.154 32.500 -0.004 0.000 0.717 1294 K HN 0.017 nan 8.250 nan 0.000 0.438 1295 S N 0.485 116.208 115.700 0.038 0.000 2.420 1295 S HA -0.181 4.274 4.470 -0.025 0.000 0.237 1295 S C 1.760 176.367 174.600 0.011 0.000 1.023 1295 S CA 1.299 59.513 58.200 0.023 0.000 0.991 1295 S CB -0.170 63.040 63.200 0.016 0.000 0.792 1295 S HN 0.494 nan 8.310 nan 0.000 0.488 1296 A N 0.261 123.097 122.820 0.026 0.000 2.021 1296 A HA 0.228 4.533 4.320 -0.025 0.000 0.216 1296 A C 1.899 179.432 177.584 -0.084 0.000 1.163 1296 A CA 0.592 52.631 52.037 0.003 0.000 0.676 1296 A CB -0.200 18.843 19.000 0.071 0.000 0.818 1296 A HN 0.508 nan 8.150 nan 0.000 0.453 1297 I N -2.965 117.499 120.570 -0.176 0.000 3.039 1297 I HA 0.089 4.244 4.170 -0.025 0.000 0.270 1297 I C 1.332 177.135 176.117 -0.523 0.000 1.150 1297 I CA 0.732 61.776 61.300 -0.426 0.000 1.448 1297 I CB 0.143 37.772 38.000 -0.619 0.000 1.197 1297 I HN 0.234 nan 8.210 nan 0.000 0.450 1298 F N -0.094 119.753 119.950 -0.172 0.000 2.704 1298 F HA 0.213 4.725 4.527 -0.025 0.000 0.304 1298 F C 2.106 177.845 175.800 -0.102 0.000 1.094 1298 F CA 0.068 57.979 58.000 -0.148 0.000 1.275 1298 F CB 0.082 38.961 39.000 -0.202 0.000 1.073 1298 F HN -0.026 nan 8.300 nan 0.000 0.586 1299 Q N 0.453 120.289 119.800 0.060 0.000 2.490 1299 Q HA 0.130 4.455 4.340 -0.025 0.000 0.190 1299 Q C 1.977 177.978 176.000 0.003 0.000 0.969 1299 Q CA 0.264 56.085 55.803 0.030 0.000 0.844 1299 Q CB -0.230 28.520 28.738 0.020 0.000 1.050 1299 Q HN 0.270 nan 8.270 nan 0.000 0.601 1300 L N 0.809 122.027 121.223 -0.009 0.000 2.261 1300 L HA -0.068 4.257 4.340 -0.025 0.000 0.216 1300 L C 0.418 177.269 176.870 -0.032 0.000 1.114 1300 L CA 0.845 55.675 54.840 -0.017 0.000 0.777 1300 L CB -0.527 41.523 42.059 -0.016 0.000 0.910 1300 L HN 0.420 nan 8.230 nan 0.000 0.440 1301 R N -0.554 119.913 120.500 -0.055 0.000 3.251 1301 R HA -0.143 4.182 4.340 -0.025 0.000 0.249 1301 R C 0.682 176.940 176.300 -0.070 0.000 0.949 1301 R CA 0.468 56.519 56.100 -0.082 0.000 0.645 1301 R CB -1.654 28.609 30.300 -0.060 0.000 1.065 1301 R HN 0.426 nan 8.270 nan 0.000 0.452 1302 V N -3.878 115.996 119.914 -0.066 0.000 3.542 1302 V HA 0.256 4.361 4.120 -0.025 0.000 0.296 1302 V C 0.417 176.476 176.094 -0.058 0.000 1.364 1302 V CA 0.612 62.882 62.300 -0.049 0.000 1.118 1302 V CB 0.984 32.789 31.823 -0.030 0.000 0.972 1302 V HN 0.261 nan 8.190 nan 0.000 0.430 1303 T N -0.190 114.308 114.554 -0.093 0.000 3.012 1303 T HA 0.429 4.764 4.350 -0.025 0.000 0.330 1303 T C -0.233 174.365 174.700 -0.170 0.000 1.321 1303 T CA -0.349 61.687 62.100 -0.107 0.000 1.067 1303 T CB 1.759 70.570 68.868 -0.095 0.000 1.235 1303 T HN 0.241 nan 8.240 nan 0.000 0.479 1304 S N 1.470 117.073 115.700 -0.161 0.000 2.584 1304 S HA 0.175 4.630 4.470 -0.025 0.000 0.270 1304 S C 1.623 176.050 174.600 -0.289 0.000 1.346 1304 S CA -0.325 57.760 58.200 -0.192 0.000 1.018 1304 S CB 0.747 63.863 63.200 -0.140 0.000 0.899 1304 S HN 0.926 nan 8.310 nan 0.000 0.542 1305 S N -0.047 115.464 115.700 -0.315 0.000 2.527 1305 S HA 0.090 4.545 4.470 -0.025 0.000 0.222 1305 S C 0.296 174.722 174.600 -0.290 0.000 0.985 1305 S CA 0.107 58.082 58.200 -0.375 0.000 0.921 1305 S CB -0.050 62.928 63.200 -0.370 0.000 0.772 1305 S HN 0.630 nan 8.310 nan 0.000 0.529 1306 E N 0.504 120.551 120.200 -0.255 0.000 2.263 1306 E HA 0.527 4.862 4.350 -0.025 0.000 0.264 1306 E C -1.362 175.077 176.600 -0.269 0.000 0.923 1306 E CA -0.828 55.437 56.400 -0.226 0.000 0.802 1306 E CB 1.048 30.703 29.700 -0.076 0.000 1.228 1306 E HN 0.279 nan 8.360 nan 0.000 0.417 1307 F N 1.067 121.023 119.950 0.011 0.000 2.404 1307 F HA 0.199 4.711 4.527 -0.025 0.000 0.339 1307 F C 1.737 177.554 175.800 0.029 0.000 1.105 1307 F CA -0.410 57.604 58.000 0.024 0.000 1.087 1307 F CB 0.968 40.000 39.000 0.054 0.000 1.143 1307 F HN 0.277 nan 8.300 nan 0.000 0.491 1308 E N 0.584 120.908 120.200 0.206 0.000 2.276 1308 E HA 0.047 4.382 4.350 -0.025 0.000 0.193 1308 E C 0.173 176.824 176.600 0.085 0.000 0.983 1308 E CA 0.474 56.940 56.400 0.109 0.000 0.861 1308 E CB 0.308 30.039 29.700 0.052 0.000 0.817 1308 E HN 0.602 nan 8.360 nan 0.000 0.485 1309 S N -1.356 114.408 115.700 0.108 0.000 2.671 1309 S HA 0.364 4.819 4.470 -0.025 0.000 0.277 1309 S C 0.408 175.098 174.600 0.151 0.000 1.165 1309 S CA -0.706 57.517 58.200 0.038 0.000 0.822 1309 S CB 0.323 63.507 63.200 -0.026 0.000 1.150 1309 S HN -0.165 nan 8.310 nan 0.000 0.479 1310 F N 1.291 121.199 119.950 -0.070 0.000 2.234 1310 F HA 0.112 4.624 4.527 -0.025 0.000 0.299 1310 F C 2.478 178.195 175.800 -0.137 0.000 1.087 1310 F CA 1.327 59.254 58.000 -0.123 0.000 1.340 1310 F CB -1.010 37.918 39.000 -0.121 0.000 1.031 1310 F HN 0.784 nan 8.300 nan 0.000 0.500 1311 E N 0.518 120.771 120.200 0.088 0.000 2.274 1311 E HA -0.162 4.173 4.350 -0.025 0.000 0.194 1311 E C 1.793 178.373 176.600 -0.033 0.000 0.996 1311 E CA 1.014 57.413 56.400 -0.002 0.000 0.840 1311 E CB -0.367 29.330 29.700 -0.005 0.000 0.772 1311 E HN 0.182 nan 8.360 nan 0.000 0.491 1312 D N -0.616 119.790 120.400 0.010 0.000 2.097 1312 D HA -0.103 4.522 4.640 -0.025 0.000 0.197 1312 D C 1.852 178.122 176.300 -0.049 0.000 0.984 1312 D CA 1.274 55.307 54.000 0.054 0.000 0.826 1312 D CB -0.009 40.900 40.800 0.182 0.000 0.973 1312 D HN 0.148 nan 8.370 nan 0.000 0.460 1313 V N 1.045 120.774 119.914 -0.310 0.000 2.295 1313 V HA -0.214 3.891 4.120 -0.025 0.000 0.246 1313 V C 2.718 178.611 176.094 -0.335 0.000 1.049 1313 V CA 1.768 63.669 62.300 -0.665 0.000 1.024 1313 V CB -0.464 30.917 31.823 -0.737 0.000 0.648 1313 V HN 0.176 nan 8.190 nan 0.000 0.447 1314 R N 0.806 121.141 120.500 -0.275 0.000 2.081 1314 R HA -0.149 4.176 4.340 -0.025 0.000 0.235 1314 R C 2.536 178.396 176.300 -0.733 0.000 1.131 1314 R CA 1.675 57.492 56.100 -0.472 0.000 0.960 1314 R CB -0.634 29.455 30.300 -0.351 0.000 0.856 1314 R HN 0.689 nan 8.270 nan 0.000 0.436 1315 S N 1.065 116.552 115.700 -0.355 0.000 2.493 1315 S HA -0.082 4.373 4.470 -0.025 0.000 0.243 1315 S C 1.881 176.419 174.600 -0.103 0.000 0.991 1315 S CA 0.861 58.924 58.200 -0.229 0.000 0.957 1315 S CB -0.448 62.702 63.200 -0.084 0.000 0.756 1315 S HN 0.278 nan 8.310 nan 0.000 0.521 1316 L N -0.214 121.005 121.223 -0.007 0.000 2.291 1316 L HA 0.037 4.362 4.340 -0.025 0.000 0.214 1316 L C 2.516 179.620 176.870 0.391 0.000 1.120 1316 L CA 1.201 56.198 54.840 0.261 0.000 0.799 1316 L CB -0.842 41.448 42.059 0.386 0.000 0.925 1316 L HN 0.601 nan 8.230 nan 0.000 0.446 1317 Y N -1.628 118.811 120.300 0.232 0.000 2.498 1317 Y HA 0.299 4.834 4.550 -0.025 0.000 0.259 1317 Y C 1.846 177.821 175.900 0.125 0.000 1.086 1317 Y CA -0.592 57.640 58.100 0.219 0.000 1.287 1317 Y CB -0.383 38.183 38.460 0.176 0.000 1.146 1317 Y HN 0.007 nan 8.280 nan 0.000 0.523 1318 E N 1.111 121.195 120.200 -0.194 0.000 2.040 1318 E HA 0.099 4.434 4.350 -0.025 0.000 0.205 1318 E C 2.283 178.880 176.600 -0.006 0.000 0.936 1318 E CA 0.627 56.971 56.400 -0.094 0.000 0.900 1318 E CB -0.577 28.976 29.700 -0.246 0.000 0.889 1318 E HN 0.431 nan 8.360 nan 0.000 0.503 1319 G N -0.125 108.659 108.800 -0.027 0.000 2.394 1319 G HA2 0.250 4.195 3.960 -0.025 0.000 0.215 1319 G HA3 0.250 4.195 3.960 -0.025 0.000 0.215 1319 G C 0.522 175.439 174.900 0.027 0.000 1.165 1319 G CA 0.655 45.758 45.100 0.005 0.000 0.784 1319 G HN 0.598 nan 8.290 nan 0.000 0.535 1320 G N -1.228 107.597 108.800 0.041 0.000 2.340 1320 G HA2 0.247 4.192 3.960 -0.025 0.000 0.527 1320 G HA3 0.247 4.192 3.960 -0.025 0.000 0.527 1320 G C -1.377 173.565 174.900 0.070 0.000 1.381 1320 G CA -0.375 44.764 45.100 0.064 0.000 1.001 1320 G HN 0.696 nan 8.290 nan 0.000 0.626 1321 I N 0.967 121.586 120.570 0.081 0.000 2.342 1321 I HA 0.457 4.612 4.170 -0.025 0.000 0.291 1321 I C 1.050 177.185 176.117 0.030 0.000 1.010 1321 I CA -1.408 59.937 61.300 0.075 0.000 1.308 1321 I CB 0.993 39.063 38.000 0.116 0.000 1.400 1321 I HN 0.433 nan 8.210 nan 0.000 0.488 1322 K N 8.370 128.787 120.400 0.027 0.000 2.081 1322 K HA 0.162 4.467 4.320 -0.025 0.000 0.230 1322 K C -1.081 175.524 176.600 0.009 0.000 1.199 1322 K CA 0.187 56.481 56.287 0.013 0.000 1.130 1322 K CB -0.774 31.733 32.500 0.010 0.000 1.386 1322 K HN 0.548 nan 8.250 nan 0.000 0.280 1323 L N 3.778 125.007 121.223 0.011 0.000 2.325 1323 L HA 0.422 4.747 4.340 -0.025 0.000 0.278 1323 L C -1.772 175.101 176.870 0.005 0.000 1.023 1323 L CA -2.355 52.495 54.840 0.016 0.000 0.811 1323 L CB 1.682 43.765 42.059 0.040 0.000 1.249 1323 L HN 0.327 nan 8.230 nan 0.000 0.431 1324 P HA 0.069 nan 4.420 nan 0.000 0.286 1324 P C 0.624 177.921 177.300 -0.006 0.000 1.293 1324 P CA -0.299 62.800 63.100 -0.003 0.000 0.770 1324 P CB 0.366 32.064 31.700 -0.004 0.000 1.206 1325 T N -0.825 113.725 114.554 -0.007 0.000 2.493 1325 T HA -0.302 4.033 4.350 -0.025 0.000 0.256 1325 T C 1.166 175.860 174.700 -0.010 0.000 1.195 1325 T CA 2.407 64.502 62.100 -0.008 0.000 1.183 1325 T CB -1.923 66.941 68.868 -0.006 0.000 0.863 1325 T HN 0.537 nan 8.240 nan 0.000 0.418 1326 D N 0.793 121.187 120.400 -0.010 0.000 2.349 1326 D HA 0.060 4.685 4.640 -0.025 0.000 0.224 1326 D C 1.806 178.095 176.300 -0.018 0.000 1.029 1326 D CA 0.081 54.073 54.000 -0.013 0.000 0.879 1326 D CB -0.254 40.540 40.800 -0.011 0.000 0.906 1326 D HN 0.429 nan 8.370 nan 0.000 0.528 1327 I N 0.505 121.065 120.570 -0.017 0.000 2.368 1327 I HA -0.003 4.152 4.170 -0.025 0.000 0.238 1327 I C 2.224 178.317 176.117 -0.039 0.000 1.076 1327 I CA 0.356 61.642 61.300 -0.024 0.000 1.397 1327 I CB -0.983 37.015 38.000 -0.003 0.000 1.141 1327 I HN 0.056 nan 8.210 nan 0.000 0.430 1328 L N 1.429 122.632 121.223 -0.032 0.000 2.721 1328 L HA -0.114 4.211 4.340 -0.025 0.000 0.241 1328 L C 2.028 178.877 176.870 -0.036 0.000 1.168 1328 L CA 0.740 55.554 54.840 -0.043 0.000 0.866 1328 L CB -0.732 41.307 42.059 -0.033 0.000 0.996 1328 L HN 0.350 nan 8.230 nan 0.000 0.451 1329 S N -2.686 112.996 115.700 -0.030 0.000 2.505 1329 S HA 0.018 4.473 4.470 -0.025 0.000 0.216 1329 S C 1.636 176.221 174.600 -0.025 0.000 1.018 1329 S CA -0.382 57.805 58.200 -0.021 0.000 0.911 1329 S CB 0.341 63.532 63.200 -0.015 0.000 0.818 1329 S HN 0.426 nan 8.310 nan 0.000 0.497 1330 Q N 0.565 120.342 119.800 -0.038 0.000 2.297 1330 Q HA 0.352 4.677 4.340 -0.025 0.000 0.203 1330 Q C 1.838 177.803 176.000 -0.059 0.000 0.931 1330 Q CA 0.504 56.280 55.803 -0.045 0.000 0.885 1330 Q CB -0.129 28.575 28.738 -0.056 0.000 0.991 1330 Q HN 0.532 nan 8.270 nan 0.000 0.498 1331 I N 0.018 120.538 120.570 -0.083 0.000 2.226 1331 I HA -0.155 4.000 4.170 -0.025 0.000 0.245 1331 I C 1.093 177.184 176.117 -0.044 0.000 1.100 1331 I CA 0.676 61.908 61.300 -0.114 0.000 1.374 1331 I CB 0.128 38.014 38.000 -0.192 0.000 1.057 1331 I HN -0.066 nan 8.210 nan 0.000 0.413 1332 S N 1.268 116.954 115.700 -0.024 0.000 2.659 1332 S HA 0.437 4.892 4.470 -0.025 0.000 0.312 1332 S C -2.442 172.162 174.600 0.006 0.000 1.114 1332 S CA -1.208 57.000 58.200 0.013 0.000 1.063 1332 S CB 1.406 64.618 63.200 0.019 0.000 0.996 1332 S HN -0.053 nan 8.310 nan 0.000 0.478 1333 P HA 0.368 nan 4.420 nan 0.000 0.226 1333 P C -0.916 176.412 177.300 0.047 0.000 1.845 1333 P CA -0.335 62.783 63.100 0.029 0.000 1.092 1333 P CB 0.008 31.719 31.700 0.018 0.000 1.851 1334 L N 2.150 123.414 121.223 0.068 0.000 2.319 1334 L HA 0.264 4.589 4.340 -0.025 0.000 0.280 1334 L C -1.179 175.778 176.870 0.145 0.000 1.099 1334 L CA -1.745 53.158 54.840 0.105 0.000 0.828 1334 L CB 1.130 43.254 42.059 0.108 0.000 1.150 1334 L HN -0.046 nan 8.230 nan 0.000 0.442 1335 P HA 0.000 nan 4.420 nan 0.000 0.241 1335 P C 0.714 178.221 177.300 0.345 0.000 1.191 1335 P CA 0.352 63.560 63.100 0.181 0.000 0.771 1335 P CB 0.463 32.189 31.700 0.043 0.000 0.929 1336 A N -1.206 121.848 122.820 0.391 0.000 2.431 1336 A HA 0.284 4.589 4.320 -0.025 0.000 0.239 1336 A C 0.814 178.527 177.584 0.215 0.000 1.230 1336 A CA 0.146 52.390 52.037 0.346 0.000 0.928 1336 A CB -0.278 18.872 19.000 0.249 0.000 1.006 1336 A HN 0.115 nan 8.150 nan 0.000 0.520 1337 L N 0.063 121.405 121.223 0.199 0.000 2.732 1337 L HA 0.330 4.655 4.340 -0.025 0.000 0.246 1337 L C 0.417 177.401 176.870 0.190 0.000 1.407 1337 L CA -0.211 54.738 54.840 0.182 0.000 0.861 1337 L CB 0.883 43.128 42.059 0.311 0.000 1.161 1337 L HN 0.154 nan 8.230 nan 0.000 0.510 1338 K N -0.851 119.628 120.400 0.132 0.000 2.286 1338 K HA 0.090 4.395 4.320 -0.025 0.000 0.203 1338 K C 1.784 178.431 176.600 0.077 0.000 1.078 1338 K CA -0.088 56.266 56.287 0.113 0.000 0.957 1338 K CB 0.242 32.799 32.500 0.095 0.000 1.018 1338 K HN 0.066 nan 8.250 nan 0.000 0.484 1339 E N 1.401 121.631 120.200 0.050 0.000 2.208 1339 E HA -0.098 4.237 4.350 -0.025 0.000 0.193 1339 E C 1.653 178.229 176.600 -0.041 0.000 0.988 1339 E CA 0.843 57.255 56.400 0.020 0.000 0.828 1339 E CB 0.194 29.911 29.700 0.028 0.000 0.763 1339 E HN 0.139 nan 8.360 nan 0.000 0.478 1340 I N 0.361 120.861 120.570 -0.116 0.000 2.162 1340 I HA -0.109 4.046 4.170 -0.025 0.000 0.238 1340 I C 1.060 176.952 176.117 -0.376 0.000 1.076 1340 I CA 1.166 62.244 61.300 -0.370 0.000 1.353 1340 I CB -0.842 36.794 38.000 -0.606 0.000 1.063 1340 I HN -0.030 nan 8.210 nan 0.000 0.408 1341 F N 0.071 120.011 119.950 -0.015 0.000 2.651 1341 F HA 0.569 5.081 4.527 -0.025 0.000 0.329 1341 F C -0.073 175.694 175.800 -0.056 0.000 1.186 1341 F CA -1.271 56.675 58.000 -0.090 0.000 1.046 1341 F CB 0.913 39.758 39.000 -0.259 0.000 1.296 1341 F HN -0.273 nan 8.300 nan 0.000 0.497 1342 R N 1.686 122.280 120.500 0.157 0.000 2.428 1342 R HA 0.565 4.890 4.340 -0.025 0.000 0.294 1342 R C -0.572 175.755 176.300 0.046 0.000 1.000 1342 R CA -0.601 55.555 56.100 0.094 0.000 0.960 1342 R CB 2.002 32.344 30.300 0.070 0.000 1.076 1342 R HN 0.840 nan 8.270 nan 0.000 0.475 1343 T N -0.666 113.905 114.554 0.029 0.000 2.842 1343 T HA 0.281 4.616 4.350 -0.025 0.000 0.308 1343 T C 0.120 174.827 174.700 0.012 0.000 1.041 1343 T CA -1.009 61.093 62.100 0.003 0.000 0.964 1343 T CB 1.045 69.903 68.868 -0.017 0.000 0.972 1343 T HN 0.438 nan 8.240 nan 0.000 0.460 1344 D N 3.515 123.923 120.400 0.013 0.000 2.399 1344 D HA 0.430 5.054 4.640 -0.025 0.000 0.288 1344 D C 1.269 177.573 176.300 0.007 0.000 1.197 1344 D CA -0.435 53.573 54.000 0.013 0.000 1.081 1344 D CB -0.431 40.380 40.800 0.017 0.000 1.139 1344 D HN 0.557 nan 8.370 nan 0.000 0.554 1345 G N -1.602 107.203 108.800 0.007 0.000 3.152 1345 G HA2 0.058 4.003 3.960 -0.025 0.000 0.157 1345 G HA3 0.058 4.003 3.960 -0.025 0.000 0.157 1345 G C 0.387 175.289 174.900 0.004 0.000 1.786 1345 G CA 0.427 45.529 45.100 0.004 0.000 1.055 1345 G HN 0.670 nan 8.290 nan 0.000 0.528 1346 E N -0.820 119.383 120.200 0.004 0.000 3.649 1346 E HA -0.334 4.001 4.350 -0.025 0.000 0.305 1346 E C 0.203 176.804 176.600 0.002 0.000 0.760 1346 E CA 1.144 57.547 56.400 0.004 0.000 1.038 1346 E CB -0.925 28.779 29.700 0.006 0.000 1.531 1346 E HN 0.614 nan 8.360 nan 0.000 0.459 1347 N N -1.451 117.249 118.700 0.000 0.000 2.783 1347 N HA -0.195 4.530 4.740 -0.025 0.000 0.247 1347 N C -0.603 174.906 175.510 -0.002 0.000 1.089 1347 N CA 0.901 53.949 53.050 -0.002 0.000 0.690 1347 N CB -1.176 37.310 38.487 -0.002 0.000 0.991 1347 N HN 0.282 nan 8.380 nan 0.000 0.552 1348 V N -2.986 116.925 119.914 -0.004 0.000 3.046 1348 V HA 0.879 4.984 4.120 -0.025 0.000 0.316 1348 V C -0.160 175.919 176.094 -0.025 0.000 1.104 1348 V CA -1.163 61.135 62.300 -0.005 0.000 1.006 1348 V CB 2.369 34.196 31.823 0.007 0.000 1.058 1348 V HN 0.073 nan 8.190 nan 0.000 0.440 1349 L N 2.209 123.406 121.223 -0.044 0.000 2.372 1349 L HA 0.615 4.940 4.340 -0.025 0.000 0.274 1349 L C -0.376 176.413 176.870 -0.136 0.000 0.988 1349 L CA 0.068 54.836 54.840 -0.121 0.000 0.833 1349 L CB 1.647 43.593 42.059 -0.188 0.000 1.236 1349 L HN 0.915 nan 8.230 nan 0.000 0.410 1350 Q N 3.924 123.670 119.800 -0.091 0.000 2.266 1350 Q HA 0.546 4.871 4.340 -0.025 0.000 0.261 1350 Q C -1.362 174.618 176.000 -0.033 0.000 0.985 1350 Q CA -0.486 55.314 55.803 -0.005 0.000 0.873 1350 Q CB 2.353 31.137 28.738 0.077 0.000 1.306 1350 Q HN 0.529 nan 8.270 nan 0.000 0.447 1351 F N 1.107 121.215 119.950 0.263 0.000 2.470 1351 F HA 0.420 4.932 4.527 -0.025 0.000 0.329 1351 F C -1.918 174.039 175.800 0.262 0.000 1.072 1351 F CA -2.434 55.739 58.000 0.289 0.000 0.989 1351 F CB 1.179 40.394 39.000 0.358 0.000 1.193 1351 F HN 0.323 nan 8.300 nan 0.000 0.481 1352 P HA 0.027 nan 4.420 nan 0.000 0.267 1352 P C -2.517 174.933 177.300 0.249 0.000 1.200 1352 P CA -0.818 62.441 63.100 0.265 0.000 0.772 1352 P CB -0.177 31.627 31.700 0.174 0.000 0.855 1353 P HA 0.020 nan 4.420 nan 0.000 0.266 1353 P C -1.855 175.225 177.300 -0.366 0.000 1.215 1353 P CA -1.162 61.759 63.100 -0.299 0.000 0.763 1353 P CB 0.088 31.702 31.700 -0.143 0.000 0.806 1354 P HA -0.211 nan 4.420 nan 0.000 0.211 1354 P C 0.782 177.940 177.300 -0.237 0.000 1.181 1354 P CA 1.861 64.674 63.100 -0.478 0.000 0.929 1354 P CB 0.027 31.354 31.700 -0.622 0.000 0.789 1355 H N -4.449 114.386 119.070 -0.392 0.000 1.803 1355 H HA -0.077 4.463 4.556 -0.025 0.000 0.115 1355 H C 1.234 176.305 175.328 -0.428 0.000 0.638 1355 H CA 0.640 56.454 56.048 -0.391 0.000 0.412 1355 H CB -0.583 28.855 29.762 -0.539 0.000 0.313 1355 H HN -0.067 nan 8.280 nan 0.000 0.208 1356 V N 2.038 121.759 119.914 -0.322 0.000 3.510 1356 V HA 0.343 4.448 4.120 -0.025 0.000 0.270 1356 V C 1.101 177.088 176.094 -0.178 0.000 1.201 1356 V CA 1.470 63.601 62.300 -0.280 0.000 1.166 1356 V CB -0.430 31.243 31.823 -0.250 0.000 0.825 1356 V HN 0.444 nan 8.190 nan 0.000 0.484 1357 A N -0.131 122.569 122.820 -0.200 0.000 3.290 1357 A HA 0.471 4.776 4.320 -0.025 0.000 0.297 1357 A C 1.089 178.626 177.584 -0.078 0.000 1.285 1357 A CA -0.326 51.633 52.037 -0.129 0.000 1.060 1357 A CB -0.054 18.854 19.000 -0.152 0.000 1.114 1357 A HN 0.308 nan 8.150 nan 0.000 0.601 1358 K N -0.689 119.673 120.400 -0.065 0.000 2.367 1358 K HA 0.253 4.558 4.320 -0.025 0.000 0.194 1358 K C -0.181 176.412 176.600 -0.012 0.000 1.027 1358 K CA 0.621 56.887 56.287 -0.035 0.000 1.075 1358 K CB 0.569 33.046 32.500 -0.039 0.000 0.845 1358 K HN 0.288 nan 8.250 nan 0.000 0.529 1359 V N 1.057 120.965 119.914 -0.010 0.000 2.340 1359 V HA 0.137 4.242 4.120 -0.025 0.000 0.277 1359 V C 0.610 176.703 176.094 -0.002 0.000 1.017 1359 V CA -0.328 61.973 62.300 0.002 0.000 0.820 1359 V CB 1.387 33.215 31.823 0.008 0.000 1.028 1359 V HN 0.071 nan 8.190 nan 0.000 0.436 1360 S N 2.666 118.371 115.700 0.009 0.000 2.419 1360 S HA -0.140 4.315 4.470 -0.025 0.000 0.235 1360 S C 1.968 176.568 174.600 -0.000 0.000 1.019 1360 S CA 1.200 59.411 58.200 0.017 0.000 0.982 1360 S CB -0.051 63.176 63.200 0.045 0.000 0.789 1360 S HN 0.688 nan 8.310 nan 0.000 0.490 1361 K N 0.606 121.010 120.400 0.007 0.000 2.361 1361 K HA 0.157 4.462 4.320 -0.025 0.000 0.196 1361 K C 2.126 178.725 176.600 -0.002 0.000 1.039 1361 K CA 0.488 56.780 56.287 0.008 0.000 1.001 1361 K CB -0.079 32.433 32.500 0.020 0.000 0.795 1361 K HN 0.295 nan 8.250 nan 0.000 0.495 1362 S N -0.483 115.217 115.700 0.000 0.000 2.456 1362 S HA 0.017 4.472 4.470 -0.025 0.000 0.224 1362 S C 1.877 176.482 174.600 0.007 0.000 1.035 1362 S CA 1.029 59.236 58.200 0.012 0.000 0.940 1362 S CB -0.209 63.005 63.200 0.024 0.000 0.799 1362 S HN 0.444 nan 8.310 nan 0.000 0.508 1363 G N 1.747 110.537 108.800 -0.017 0.000 2.808 1363 G HA2 -0.311 3.634 3.960 -0.025 0.000 0.225 1363 G HA3 -0.311 3.634 3.960 -0.025 0.000 0.225 1363 G C 1.470 176.354 174.900 -0.025 0.000 1.210 1363 G CA 1.781 46.861 45.100 -0.032 0.000 0.777 1363 G HN 0.640 nan 8.290 nan 0.000 0.640 1364 V N 0.264 120.128 119.914 -0.084 0.000 2.450 1364 V HA 0.173 4.278 4.120 -0.025 0.000 0.222 1364 V C 2.662 178.722 176.094 -0.056 0.000 1.102 1364 V CA 1.866 64.099 62.300 -0.111 0.000 1.102 1364 V CB -0.278 31.362 31.823 -0.305 0.000 0.715 1364 V HN 0.395 nan 8.190 nan 0.000 0.491 1365 M N 1.522 121.076 119.600 -0.077 0.000 2.413 1365 M HA -0.105 4.360 4.480 -0.025 0.000 0.258 1365 M C 0.682 177.001 176.300 0.030 0.000 1.081 1365 M CA 1.768 57.052 55.300 -0.026 0.000 1.047 1365 M CB -0.939 31.655 32.600 -0.010 0.000 1.390 1365 M HN 0.761 nan 8.290 nan 0.000 0.438 1366 T N -2.375 112.215 114.554 0.060 0.000 2.780 1366 T HA 0.149 4.484 4.350 -0.025 0.000 0.294 1366 T C 0.411 175.214 174.700 0.171 0.000 0.949 1366 T CA -0.943 61.214 62.100 0.095 0.000 1.074 1366 T CB 1.091 70.007 68.868 0.081 0.000 0.910 1366 T HN 0.052 nan 8.240 nan 0.000 0.501 1367 D N 2.081 122.597 120.400 0.194 0.000 2.221 1367 D HA -0.091 4.534 4.640 -0.025 0.000 0.204 1367 D C 1.716 178.198 176.300 0.303 0.000 0.982 1367 D CA 1.153 55.349 54.000 0.327 0.000 0.857 1367 D CB 0.036 40.976 40.800 0.233 0.000 0.934 1367 D HN 0.687 nan 8.370 nan 0.000 0.475 1368 E N 0.430 120.738 120.200 0.181 0.000 2.017 1368 E HA -0.172 4.163 4.350 -0.025 0.000 0.193 1368 E C 1.969 178.647 176.600 0.131 0.000 0.997 1368 E CA 1.156 57.631 56.400 0.126 0.000 0.804 1368 E CB -0.239 29.515 29.700 0.090 0.000 0.757 1368 E HN 0.210 nan 8.360 nan 0.000 0.448 1369 E N -0.361 119.926 120.200 0.146 0.000 2.216 1369 E HA -0.079 4.256 4.350 -0.025 0.000 0.192 1369 E C 1.615 178.320 176.600 0.174 0.000 0.988 1369 E CA 0.288 56.771 56.400 0.139 0.000 0.834 1369 E CB -0.268 29.508 29.700 0.126 0.000 0.772 1369 E HN 0.234 nan 8.360 nan 0.000 0.479 1370 F N 0.976 120.962 119.950 0.060 0.000 2.051 1370 F HA -0.104 4.408 4.527 -0.025 0.000 0.296 1370 F C 2.031 177.854 175.800 0.037 0.000 1.122 1370 F CA 2.070 60.103 58.000 0.055 0.000 1.201 1370 F CB -0.925 38.138 39.000 0.106 0.000 0.978 1370 F HN 0.077 nan 8.300 nan 0.000 0.472 1371 A N 0.753 123.563 122.820 -0.017 0.000 2.015 1371 A HA -0.140 4.165 4.320 -0.025 0.000 0.219 1371 A C 2.442 179.938 177.584 -0.148 0.000 1.163 1371 A CA 1.383 53.312 52.037 -0.180 0.000 0.646 1371 A CB -0.894 18.103 19.000 -0.005 0.000 0.806 1371 A HN 0.526 nan 8.150 nan 0.000 0.448 1372 R N 0.263 120.729 120.500 -0.058 0.000 2.081 1372 R HA -0.120 4.205 4.340 -0.025 0.000 0.235 1372 R C 1.387 177.633 176.300 -0.089 0.000 1.131 1372 R CA 1.676 57.742 56.100 -0.056 0.000 0.960 1372 R CB -0.307 30.006 30.300 0.023 0.000 0.856 1372 R HN 0.610 nan 8.270 nan 0.000 0.436 1373 E N 0.272 120.415 120.200 -0.095 0.000 2.515 1373 E HA -0.067 4.268 4.350 -0.025 0.000 0.201 1373 E C 1.528 178.005 176.600 -0.206 0.000 1.071 1373 E CA 0.353 56.656 56.400 -0.163 0.000 0.880 1373 E CB 0.335 29.923 29.700 -0.188 0.000 0.828 1373 E HN 0.221 nan 8.360 nan 0.000 0.540 1374 V N 1.003 120.783 119.914 -0.223 0.000 2.951 1374 V HA -0.133 3.972 4.120 -0.025 0.000 0.255 1374 V C 2.008 177.976 176.094 -0.210 0.000 1.088 1374 V CA 1.185 63.350 62.300 -0.225 0.000 1.109 1374 V CB -0.280 31.373 31.823 -0.283 0.000 0.724 1374 V HN 0.378 nan 8.190 nan 0.000 0.471 1375 I N -2.443 117.991 120.570 -0.228 0.000 3.939 1375 I HA 0.504 4.659 4.170 -0.025 0.000 0.313 1375 I C 1.415 177.546 176.117 0.024 0.000 1.274 1375 I CA 0.837 62.020 61.300 -0.196 0.000 1.301 1375 I CB 0.265 37.966 38.000 -0.499 0.000 1.105 1375 I HN 0.054 nan 8.210 nan 0.000 0.427 1376 A N 1.356 124.146 122.820 -0.049 0.000 2.610 1376 A HA 0.733 5.038 4.320 -0.025 0.000 0.290 1376 A C 0.663 178.336 177.584 0.148 0.000 1.001 1376 A CA 0.006 52.022 52.037 -0.034 0.000 1.004 1376 A CB -0.499 18.494 19.000 -0.011 0.000 1.220 1376 A HN 0.416 nan 8.150 nan 0.000 0.507 1377 G N -1.164 107.590 108.800 -0.076 0.000 2.695 1377 G HA2 0.387 4.332 3.960 -0.025 0.000 0.213 1377 G HA3 0.387 4.332 3.960 -0.025 0.000 0.213 1377 G C 0.906 175.622 174.900 -0.306 0.000 1.406 1377 G CA 0.568 45.381 45.100 -0.478 0.000 1.049 1377 G HN 0.494 nan 8.290 nan 0.000 0.573 1378 V N -0.302 119.351 119.914 -0.435 0.000 2.878 1378 V HA 0.172 4.276 4.120 -0.025 0.000 0.250 1378 V C 0.558 176.519 176.094 -0.223 0.000 1.075 1378 V CA 1.386 63.546 62.300 -0.234 0.000 1.096 1378 V CB -0.218 31.417 31.823 -0.314 0.000 0.724 1378 V HN 0.512 nan 8.190 nan 0.000 0.467 1379 N N 0.657 119.254 118.700 -0.171 0.000 2.746 1379 N HA 0.397 5.122 4.740 -0.025 0.000 0.250 1379 N C -2.112 173.382 175.510 -0.028 0.000 1.146 1379 N CA -1.690 51.374 53.050 0.023 0.000 0.828 1379 N CB 1.795 40.376 38.487 0.156 0.000 1.158 1379 N HN 0.209 nan 8.380 nan 0.000 0.519 1380 P HA 0.130 nan 4.420 nan 0.000 0.267 1380 P C -0.497 176.809 177.300 0.010 0.000 1.289 1380 P CA 0.339 63.381 63.100 -0.097 0.000 0.866 1380 P CB 0.030 31.623 31.700 -0.179 0.000 1.309 1381 N N -0.438 118.260 118.700 -0.004 0.000 2.238 1381 N HA 0.089 4.814 4.740 -0.025 0.000 0.222 1381 N C 0.695 176.282 175.510 0.128 0.000 1.133 1381 N CA -0.287 52.857 53.050 0.157 0.000 0.854 1381 N CB 0.364 38.972 38.487 0.202 0.000 1.041 1381 N HN -0.143 nan 8.380 nan 0.000 0.510 1382 V N 0.885 120.826 119.914 0.046 0.000 2.685 1382 V HA 0.074 4.179 4.120 -0.025 0.000 0.244 1382 V C 1.370 177.397 176.094 -0.112 0.000 1.054 1382 V CA 0.088 62.349 62.300 -0.065 0.000 1.076 1382 V CB 0.002 31.709 31.823 -0.193 0.000 0.725 1382 V HN 0.409 nan 8.190 nan 0.000 0.467 1383 I N 2.162 122.671 120.570 -0.102 0.000 2.906 1383 I HA -0.088 4.067 4.170 -0.025 0.000 0.302 1383 I C 0.439 176.547 176.117 -0.015 0.000 1.220 1383 I CA 0.810 62.048 61.300 -0.103 0.000 1.441 1383 I CB 0.087 37.972 38.000 -0.192 0.000 1.336 1383 I HN 0.277 nan 8.210 nan 0.000 0.565 1384 R N 6.906 127.420 120.500 0.024 0.000 2.778 1384 R HA 0.462 4.787 4.340 -0.025 0.000 0.277 1384 R C -0.539 175.879 176.300 0.197 0.000 0.977 1384 R CA -1.065 55.081 56.100 0.077 0.000 0.950 1384 R CB 1.551 31.860 30.300 0.015 0.000 1.165 1384 R HN 0.625 nan 8.270 nan 0.000 0.474 1385 R N 1.819 122.426 120.500 0.179 0.000 2.543 1385 R HA 0.120 4.445 4.340 -0.025 0.000 0.277 1385 R C -0.707 175.546 176.300 -0.079 0.000 1.074 1385 R CA -0.428 55.669 56.100 -0.005 0.000 1.076 1385 R CB 0.558 30.782 30.300 -0.127 0.000 0.993 1385 R HN 0.301 nan 8.270 nan 0.000 0.459 1386 L N 3.844 124.973 121.223 -0.156 0.000 2.276 1386 L HA 0.160 4.485 4.340 -0.025 0.000 0.286 1386 L C 0.344 177.170 176.870 -0.073 0.000 1.061 1386 L CA 0.683 55.492 54.840 -0.051 0.000 0.807 1386 L CB 1.457 43.536 42.059 0.033 0.000 1.177 1386 L HN 0.718 nan 8.230 nan 0.000 0.429 1387 Q N 2.938 122.722 119.800 -0.028 0.000 2.189 1387 Q HA 0.194 4.519 4.340 -0.025 0.000 0.223 1387 Q C -0.731 175.277 176.000 0.013 0.000 0.828 1387 Q CA -0.049 55.741 55.803 -0.022 0.000 0.967 1387 Q CB 0.942 29.663 28.738 -0.028 0.000 1.139 1387 Q HN 0.649 nan 8.270 nan 0.000 0.497 1388 E N 0.079 120.302 120.200 0.038 0.000 2.314 1388 E HA 0.347 4.682 4.350 -0.025 0.000 0.272 1388 E C -1.534 175.128 176.600 0.103 0.000 0.884 1388 E CA -0.838 55.588 56.400 0.044 0.000 0.753 1388 E CB 1.677 31.372 29.700 -0.007 0.000 1.213 1388 E HN -0.035 nan 8.360 nan 0.000 0.432 1389 F N 2.319 122.266 119.950 -0.004 0.000 2.539 1389 F HA 0.469 4.981 4.527 -0.025 0.000 0.318 1389 F C -2.415 173.388 175.800 0.005 0.000 1.135 1389 F CA -1.570 56.431 58.000 0.002 0.000 0.915 1389 F CB 1.721 40.723 39.000 0.003 0.000 1.176 1389 F HN 0.335 nan 8.300 nan 0.000 0.440 1390 P HA 0.320 nan 4.420 nan 0.000 0.276 1390 P C -2.812 174.109 177.300 -0.631 0.000 1.252 1390 P CA -1.436 60.807 63.100 -1.427 0.000 0.802 1390 P CB -0.023 31.151 31.700 -0.877 0.000 1.035 1391 P HA 0.075 nan 4.420 nan 0.000 0.266 1391 P C -0.444 176.776 177.300 -0.132 0.000 1.215 1391 P CA 0.265 63.258 63.100 -0.178 0.000 0.763 1391 P CB 0.514 32.164 31.700 -0.084 0.000 0.806 1392 K N 1.466 121.814 120.400 -0.088 0.000 2.102 1392 K HA 0.442 4.747 4.320 -0.025 0.000 0.244 1392 K C 0.501 177.084 176.600 -0.028 0.000 1.021 1392 K CA -0.442 55.812 56.287 -0.055 0.000 0.913 1392 K CB 0.477 32.954 32.500 -0.039 0.000 1.062 1392 K HN 0.271 nan 8.250 nan 0.000 0.485 1393 S N -0.235 115.458 115.700 -0.011 0.000 2.500 1393 S HA 0.126 4.581 4.470 -0.025 0.000 0.301 1393 S C 0.855 175.465 174.600 0.017 0.000 1.092 1393 S CA -0.745 57.458 58.200 0.004 0.000 1.030 1393 S CB 1.255 64.461 63.200 0.011 0.000 1.031 1393 S HN 0.736 nan 8.310 nan 0.000 0.483 1394 T N 2.346 116.913 114.554 0.022 0.000 2.867 1394 T HA 0.095 4.430 4.350 -0.025 0.000 0.268 1394 T C 0.957 175.687 174.700 0.050 0.000 1.057 1394 T CA 0.503 62.623 62.100 0.034 0.000 1.136 1394 T CB -0.571 68.319 68.868 0.036 0.000 0.874 1394 T HN 0.527 nan 8.240 nan 0.000 0.466 1395 L N 2.663 123.915 121.223 0.049 0.000 2.615 1395 L HA 0.072 4.397 4.340 -0.025 0.000 0.284 1395 L C 0.496 177.458 176.870 0.152 0.000 1.237 1395 L CA -0.129 54.765 54.840 0.090 0.000 0.905 1395 L CB -0.150 41.915 42.059 0.010 0.000 1.149 1395 L HN 0.313 nan 8.230 nan 0.000 0.499 1396 D N 5.166 125.692 120.400 0.210 0.000 2.412 1396 D HA 0.042 4.667 4.640 -0.025 0.000 0.257 1396 D C -1.570 174.807 176.300 0.128 0.000 1.217 1396 D CA -1.114 52.974 54.000 0.148 0.000 0.897 1396 D CB 1.132 42.003 40.800 0.119 0.000 1.132 1396 D HN 0.209 nan 8.370 nan 0.000 0.493 1397 P HA -0.123 nan 4.420 nan 0.000 0.219 1397 P C 0.973 178.268 177.300 -0.008 0.000 1.146 1397 P CA 1.082 64.207 63.100 0.041 0.000 0.808 1397 P CB 0.230 31.946 31.700 0.026 0.000 0.779 1398 T N -1.036 113.499 114.554 -0.031 0.000 2.904 1398 T HA 0.008 4.343 4.350 -0.025 0.000 0.267 1398 T C 1.554 176.167 174.700 -0.145 0.000 1.059 1398 T CA 0.963 63.021 62.100 -0.069 0.000 1.137 1398 T CB -0.480 68.355 68.868 -0.055 0.000 0.879 1398 T HN 0.110 nan 8.240 nan 0.000 0.467 1399 L N -1.500 119.590 121.223 -0.222 0.000 2.463 1399 L HA 0.230 4.555 4.340 -0.025 0.000 0.219 1399 L C 1.247 177.583 176.870 -0.889 0.000 1.088 1399 L CA 0.781 55.300 54.840 -0.534 0.000 0.849 1399 L CB 0.158 41.835 42.059 -0.636 0.000 1.012 1399 L HN 0.237 nan 8.230 nan 0.000 0.468 1400 Y N -0.781 119.515 120.300 -0.007 0.000 2.540 1400 Y HA 0.440 4.975 4.550 -0.025 0.000 0.257 1400 Y C 1.274 177.175 175.900 0.002 0.000 1.090 1400 Y CA 0.030 58.131 58.100 0.001 0.000 1.242 1400 Y CB 0.537 39.005 38.460 0.014 0.000 1.325 1400 Y HN 0.104 nan 8.280 nan 0.000 0.544 1401 G N 0.798 109.647 108.800 0.081 0.000 2.584 1401 G HA2 -0.355 3.590 3.960 -0.025 0.000 0.229 1401 G HA3 -0.355 3.590 3.960 -0.025 0.000 0.229 1401 G C 0.334 175.274 174.900 0.068 0.000 1.320 1401 G CA 0.284 45.415 45.100 0.052 0.000 0.891 1401 G HN 0.201 nan 8.290 nan 0.000 0.573 1402 D N -0.877 119.552 120.400 0.048 0.000 2.081 1402 D HA -0.019 4.606 4.640 -0.025 0.000 0.194 1402 D C 2.010 178.337 176.300 0.045 0.000 0.986 1402 D CA 2.373 56.395 54.000 0.037 0.000 0.837 1402 D CB -0.084 40.729 40.800 0.023 0.000 0.985 1402 D HN 0.672 nan 8.370 nan 0.000 0.448 1403 Q N -1.748 118.080 119.800 0.047 0.000 2.311 1403 Q HA -0.151 4.174 4.340 -0.025 0.000 0.178 1403 Q C -0.062 175.947 176.000 0.014 0.000 0.596 1403 Q CA 1.170 56.998 55.803 0.041 0.000 1.377 1403 Q CB -2.751 26.017 28.738 0.051 0.000 1.372 1403 Q HN 0.380 nan 8.270 nan 0.000 0.896 1404 T N 1.137 115.689 114.554 -0.002 0.000 2.906 1404 T HA 0.178 4.513 4.350 -0.025 0.000 0.320 1404 T C 0.575 175.249 174.700 -0.045 0.000 1.088 1404 T CA 0.525 62.605 62.100 -0.033 0.000 1.120 1404 T CB 1.052 69.894 68.868 -0.043 0.000 1.000 1404 T HN 0.275 nan 8.240 nan 0.000 0.550 1405 S N 0.716 116.365 115.700 -0.084 0.000 2.568 1405 S HA 0.143 4.598 4.470 -0.025 0.000 0.282 1405 S C 1.435 175.990 174.600 -0.075 0.000 1.338 1405 S CA -0.147 58.002 58.200 -0.084 0.000 1.045 1405 S CB 0.293 63.409 63.200 -0.140 0.000 0.873 1405 S HN 0.895 nan 8.310 nan 0.000 0.516 1406 T N 2.320 116.856 114.554 -0.029 0.000 3.145 1406 T HA 0.362 4.697 4.350 -0.025 0.000 0.255 1406 T C 0.458 175.174 174.700 0.027 0.000 1.039 1406 T CA -0.262 61.836 62.100 -0.004 0.000 0.928 1406 T CB -0.546 68.326 68.868 0.007 0.000 1.029 1406 T HN 0.464 nan 8.240 nan 0.000 0.554 1407 I N 2.896 123.487 120.570 0.036 0.000 2.612 1407 I HA 0.416 4.571 4.170 -0.025 0.000 0.295 1407 I C 0.671 176.919 176.117 0.218 0.000 1.011 1407 I CA -0.732 60.654 61.300 0.143 0.000 1.326 1407 I CB 1.443 39.580 38.000 0.228 0.000 1.427 1407 I HN 0.264 nan 8.210 nan 0.000 0.537 1408 T N 0.271 115.008 114.554 0.305 0.000 2.916 1408 T HA 0.395 4.730 4.350 -0.025 0.000 0.292 1408 T C 0.547 175.412 174.700 0.275 0.000 1.055 1408 T CA -1.003 61.318 62.100 0.368 0.000 1.009 1408 T CB 2.057 71.025 68.868 0.167 0.000 1.118 1408 T HN 0.461 nan 8.240 nan 0.000 0.497 1409 K N 0.770 121.268 120.400 0.163 0.000 2.032 1409 K HA -0.209 4.096 4.320 -0.025 0.000 0.218 1409 K C 2.252 178.757 176.600 -0.160 0.000 1.054 1409 K CA 2.328 58.484 56.287 -0.218 0.000 0.941 1409 K CB -0.164 32.281 32.500 -0.091 0.000 0.720 1409 K HN 0.803 nan 8.250 nan 0.000 0.449 1410 E N 0.832 121.003 120.200 -0.049 0.000 2.333 1410 E HA -0.243 4.092 4.350 -0.025 0.000 0.198 1410 E C 1.612 178.189 176.600 -0.039 0.000 1.007 1410 E CA 1.220 57.594 56.400 -0.044 0.000 0.845 1410 E CB -0.186 29.508 29.700 -0.011 0.000 0.766 1410 E HN 0.538 nan 8.360 nan 0.000 0.507 1411 Q N 0.208 120.000 119.800 -0.013 0.000 2.354 1411 Q HA 0.147 4.472 4.340 -0.025 0.000 0.203 1411 Q C 2.339 178.314 176.000 -0.040 0.000 0.933 1411 Q CA 0.339 56.140 55.803 -0.003 0.000 0.901 1411 Q CB 0.223 28.991 28.738 0.050 0.000 1.007 1411 Q HN 0.286 nan 8.270 nan 0.000 0.495 1412 L N 0.309 121.479 121.223 -0.089 0.000 2.071 1412 L HA -0.065 4.260 4.340 -0.025 0.000 0.201 1412 L C 2.048 178.783 176.870 -0.226 0.000 1.076 1412 L CA 0.932 55.678 54.840 -0.157 0.000 0.755 1412 L CB -0.406 41.499 42.059 -0.257 0.000 0.915 1412 L HN 0.169 nan 8.230 nan 0.000 0.445 1413 E N 0.377 120.437 120.200 -0.234 0.000 2.187 1413 E HA -0.271 4.064 4.350 -0.025 0.000 0.199 1413 E C 2.015 178.502 176.600 -0.187 0.000 1.004 1413 E CA 1.229 57.491 56.400 -0.230 0.000 0.813 1413 E CB -0.142 29.454 29.700 -0.174 0.000 0.736 1413 E HN 0.321 nan 8.360 nan 0.000 0.468 1414 I N 1.141 121.625 120.570 -0.144 0.000 2.916 1414 I HA -0.167 3.988 4.170 -0.025 0.000 0.267 1414 I C 1.304 177.347 176.117 -0.124 0.000 1.263 1414 I CA 0.970 62.203 61.300 -0.111 0.000 1.471 1414 I CB 0.090 38.041 38.000 -0.081 0.000 1.089 1414 I HN 0.016 nan 8.210 nan 0.000 0.468 1415 N N -0.995 117.607 118.700 -0.163 0.000 2.194 1415 N HA 0.241 4.966 4.740 -0.025 0.000 0.231 1415 N C 0.688 176.065 175.510 -0.223 0.000 1.247 1415 N CA 0.156 53.108 53.050 -0.163 0.000 0.884 1415 N CB 0.610 39.007 38.487 -0.149 0.000 1.146 1415 N HN 0.253 nan 8.380 nan 0.000 0.516 1416 M N -0.577 118.823 119.600 -0.333 0.000 2.475 1416 M HA 0.234 4.699 4.480 -0.025 0.000 0.261 1416 M C 1.236 177.384 176.300 -0.253 0.000 1.177 1416 M CA -0.158 54.808 55.300 -0.558 0.000 0.979 1416 M CB 0.576 32.589 32.600 -0.979 0.000 1.482 1416 M HN 0.095 nan 8.290 nan 0.000 0.484 1417 G N 1.705 110.423 108.800 -0.138 0.000 3.879 1417 G HA2 -0.306 3.639 3.960 -0.025 0.000 0.318 1417 G HA3 -0.306 3.639 3.960 -0.025 0.000 0.318 1417 G C 0.642 175.497 174.900 -0.076 0.000 1.344 1417 G CA 0.166 45.226 45.100 -0.066 0.000 1.024 1417 G HN 0.600 nan 8.290 nan 0.000 0.681 1418 G N -0.804 107.961 108.800 -0.059 0.000 4.908 1418 G HA2 0.577 4.522 3.960 -0.025 0.000 0.267 1418 G HA3 0.577 4.522 3.960 -0.025 0.000 0.267 1418 G C -0.205 174.668 174.900 -0.045 0.000 0.958 1418 G CA 0.873 45.941 45.100 -0.054 0.000 0.743 1418 G HN 1.157 nan 8.290 nan 0.000 0.410 1419 V N 2.024 121.903 119.914 -0.057 0.000 2.686 1419 V HA 0.546 4.651 4.120 -0.025 0.000 0.295 1419 V C 0.970 177.015 176.094 -0.080 0.000 1.057 1419 V CA -0.159 62.135 62.300 -0.011 0.000 1.012 1419 V CB 1.476 33.383 31.823 0.140 0.000 1.006 1419 V HN 0.438 nan 8.190 nan 0.000 0.477 1420 T N 1.113 115.638 114.554 -0.049 0.000 2.922 1420 T HA 0.375 4.710 4.350 -0.025 0.000 0.285 1420 T C 1.088 175.738 174.700 -0.084 0.000 1.005 1420 T CA -0.590 61.462 62.100 -0.081 0.000 1.061 1420 T CB 1.553 70.388 68.868 -0.054 0.000 1.007 1420 T HN 0.193 nan 8.240 nan 0.000 0.502 1421 V N 1.542 121.363 119.914 -0.155 0.000 2.324 1421 V HA -0.184 3.921 4.120 -0.025 0.000 0.250 1421 V C 2.813 178.857 176.094 -0.084 0.000 1.060 1421 V CA 2.413 64.597 62.300 -0.194 0.000 1.042 1421 V CB -0.955 30.616 31.823 -0.421 0.000 0.650 1421 V HN 1.093 nan 8.190 nan 0.000 0.450 1422 E N -0.007 120.161 120.200 -0.052 0.000 2.051 1422 E HA -0.298 4.037 4.350 -0.025 0.000 0.192 1422 E C 2.313 178.911 176.600 -0.004 0.000 0.991 1422 E CA 1.708 58.101 56.400 -0.012 0.000 0.799 1422 E CB -0.143 29.554 29.700 -0.005 0.000 0.748 1422 E HN 0.733 nan 8.360 nan 0.000 0.449 1423 E N -0.229 119.969 120.200 -0.002 0.000 2.110 1423 E HA -0.187 4.148 4.350 -0.025 0.000 0.193 1423 E C 1.889 178.504 176.600 0.025 0.000 0.988 1423 E CA 0.917 57.324 56.400 0.011 0.000 0.804 1423 E CB -0.093 29.617 29.700 0.017 0.000 0.745 1423 E HN 0.328 nan 8.360 nan 0.000 0.458 1424 A N 0.694 123.545 122.820 0.052 0.000 1.930 1424 A HA -0.121 4.184 4.320 -0.025 0.000 0.217 1424 A C 2.033 179.618 177.584 0.001 0.000 1.175 1424 A CA 0.768 52.862 52.037 0.096 0.000 0.627 1424 A CB -0.386 18.771 19.000 0.262 0.000 0.815 1424 A HN 0.253 nan 8.150 nan 0.000 0.443 1425 L N -0.293 120.924 121.223 -0.011 0.000 2.046 1425 L HA -0.109 4.216 4.340 -0.025 0.000 0.208 1425 L C 2.797 179.636 176.870 -0.051 0.000 1.077 1425 L CA 2.181 56.998 54.840 -0.039 0.000 0.747 1425 L CB -1.034 41.024 42.059 -0.002 0.000 0.896 1425 L HN 0.422 nan 8.230 nan 0.000 0.432 1426 S N -1.378 114.305 115.700 -0.028 0.000 2.402 1426 S HA -0.127 4.328 4.470 -0.025 0.000 0.229 1426 S C 1.814 176.393 174.600 -0.034 0.000 1.021 1426 S CA 1.566 59.751 58.200 -0.025 0.000 0.974 1426 S CB -0.173 63.020 63.200 -0.011 0.000 0.800 1426 S HN 0.667 nan 8.310 nan 0.000 0.484 1427 T N -1.146 113.386 114.554 -0.038 0.000 3.086 1427 T HA 0.271 4.606 4.350 -0.025 0.000 0.250 1427 T C 0.204 174.856 174.700 -0.080 0.000 1.074 1427 T CA 0.086 62.160 62.100 -0.044 0.000 0.988 1427 T CB -0.366 68.486 68.868 -0.026 0.000 0.988 1427 T HN 0.489 nan 8.240 nan 0.000 0.530 1428 Q N 0.601 120.324 119.800 -0.129 0.000 2.460 1428 Q HA -0.159 4.166 4.340 -0.025 0.000 0.311 1428 Q C 0.699 176.495 176.000 -0.341 0.000 1.396 1428 Q CA 0.229 55.884 55.803 -0.246 0.000 0.838 1428 Q CB -1.148 27.484 28.738 -0.175 0.000 1.140 1428 Q HN 0.458 nan 8.270 nan 0.000 0.415 1429 R N -0.300 120.019 120.500 -0.302 0.000 2.397 1429 R HA 0.273 4.598 4.340 -0.025 0.000 0.241 1429 R C 0.061 176.220 176.300 -0.236 0.000 0.914 1429 R CA 0.200 56.127 56.100 -0.288 0.000 1.071 1429 R CB 0.776 30.865 30.300 -0.352 0.000 1.116 1429 R HN 0.284 nan 8.270 nan 0.000 0.524 1430 L N 1.192 122.236 121.223 -0.298 0.000 2.341 1430 L HA 0.512 4.837 4.340 -0.025 0.000 0.278 1430 L C -1.006 175.665 176.870 -0.332 0.000 1.005 1430 L CA -0.606 54.199 54.840 -0.057 0.000 0.818 1430 L CB 1.397 43.495 42.059 0.065 0.000 1.259 1430 L HN -0.181 nan 8.230 nan 0.000 0.418 1431 F N 3.180 123.158 119.950 0.047 0.000 2.650 1431 F HA 0.663 5.175 4.527 -0.025 0.000 0.320 1431 F C -0.342 175.470 175.800 0.020 0.000 1.091 1431 F CA -0.739 57.264 58.000 0.006 0.000 0.962 1431 F CB 2.117 41.087 39.000 -0.050 0.000 1.363 1431 F HN 0.174 nan 8.300 nan 0.000 0.482 1432 I N 1.518 122.208 120.570 0.201 0.000 2.752 1432 I HA 0.415 4.570 4.170 -0.025 0.000 0.295 1432 I C -1.894 174.214 176.117 -0.015 0.000 1.219 1432 I CA -0.988 60.364 61.300 0.088 0.000 1.030 1432 I CB 2.136 40.181 38.000 0.074 0.000 1.259 1432 I HN 0.531 nan 8.210 nan 0.000 0.423 1433 L N 6.605 127.796 121.223 -0.055 0.000 2.407 1433 L HA 0.448 4.773 4.340 -0.025 0.000 0.261 1433 L C -0.727 176.038 176.870 -0.174 0.000 1.108 1433 L CA 0.050 54.788 54.840 -0.170 0.000 0.995 1433 L CB 0.052 42.042 42.059 -0.115 0.000 1.349 1433 L HN 0.390 nan 8.230 nan 0.000 0.423 1434 D N 2.372 122.626 120.400 -0.243 0.000 2.313 1434 D HA 0.120 4.745 4.640 -0.025 0.000 0.239 1434 D C -0.304 175.840 176.300 -0.261 0.000 1.142 1434 D CA 0.222 54.130 54.000 -0.154 0.000 0.847 1434 D CB 0.600 41.349 40.800 -0.087 0.000 1.082 1434 D HN 0.486 nan 8.370 nan 0.000 0.480 1435 Y N 2.071 122.385 120.300 0.024 0.000 2.682 1435 Y HA 0.046 4.580 4.550 -0.025 0.000 0.251 1435 Y C 1.792 177.812 175.900 0.199 0.000 1.172 1435 Y CA -0.374 57.787 58.100 0.103 0.000 1.186 1435 Y CB 0.864 39.349 38.460 0.042 0.000 1.216 1435 Y HN 0.359 nan 8.280 nan 0.000 0.540 1436 Q N 1.036 120.973 119.800 0.228 0.000 2.050 1436 Q HA -0.190 4.135 4.340 -0.025 0.000 0.202 1436 Q C 1.414 177.504 176.000 0.150 0.000 0.980 1436 Q CA 2.441 58.346 55.803 0.169 0.000 0.840 1436 Q CB 0.048 28.837 28.738 0.085 0.000 0.898 1436 Q HN 0.392 nan 8.270 nan 0.000 0.424 1437 D N -0.591 119.881 120.400 0.119 0.000 2.144 1437 D HA -0.111 4.514 4.640 -0.025 0.000 0.200 1437 D C 1.588 177.948 176.300 0.100 0.000 0.978 1437 D CA 1.303 55.342 54.000 0.065 0.000 0.833 1437 D CB -0.135 40.701 40.800 0.059 0.000 0.961 1437 D HN 0.404 nan 8.370 nan 0.000 0.470 1438 A N 0.226 123.172 122.820 0.211 0.000 1.897 1438 A HA -0.061 4.244 4.320 -0.025 0.000 0.215 1438 A C 1.941 179.517 177.584 -0.014 0.000 1.181 1438 A CA 0.815 52.949 52.037 0.163 0.000 0.620 1438 A CB -0.646 18.547 19.000 0.322 0.000 0.821 1438 A HN 0.082 nan 8.150 nan 0.000 0.443 1439 F N -0.495 119.571 119.950 0.194 0.000 2.220 1439 F HA 0.080 4.592 4.527 -0.025 0.000 0.290 1439 F C 2.162 178.051 175.800 0.147 0.000 1.080 1439 F CA 0.522 58.625 58.000 0.172 0.000 1.318 1439 F CB -0.117 38.966 39.000 0.139 0.000 1.063 1439 F HN 0.045 nan 8.300 nan 0.000 0.498 1440 I N 0.922 121.623 120.570 0.219 0.000 2.236 1440 I HA -0.238 3.917 4.170 -0.025 0.000 0.249 1440 I C -0.675 175.426 176.117 -0.027 0.000 1.102 1440 I CA 1.836 63.182 61.300 0.077 0.000 1.365 1440 I CB -2.109 35.882 38.000 -0.016 0.000 1.051 1440 I HN 0.043 nan 8.210 nan 0.000 0.420 1441 P HA -0.144 nan 4.420 nan 0.000 0.228 1441 P C 0.795 177.971 177.300 -0.207 0.000 1.151 1441 P CA 1.474 64.487 63.100 -0.145 0.000 0.770 1441 P CB -0.062 31.549 31.700 -0.149 0.000 0.786 1442 Y N -3.122 117.158 120.300 -0.034 0.000 2.425 1442 Y HA 0.220 4.755 4.550 -0.025 0.000 0.261 1442 Y C 1.859 177.742 175.900 -0.027 0.000 1.084 1442 Y CA -0.157 57.900 58.100 -0.073 0.000 1.248 1442 Y CB -0.118 38.276 38.460 -0.110 0.000 1.270 1442 Y HN -0.234 nan 8.280 nan 0.000 0.524 1443 L N -0.497 120.838 121.223 0.187 0.000 2.131 1443 L HA -0.194 4.131 4.340 -0.025 0.000 0.210 1443 L C 1.948 178.881 176.870 0.105 0.000 1.092 1443 L CA 1.660 56.604 54.840 0.173 0.000 0.759 1443 L CB -0.497 41.671 42.059 0.182 0.000 0.903 1443 L HN 0.222 nan 8.230 nan 0.000 0.435 1444 T N -1.183 113.410 114.554 0.066 0.000 2.821 1444 T HA -0.107 4.228 4.350 -0.025 0.000 0.267 1444 T C 2.060 176.755 174.700 -0.009 0.000 1.046 1444 T CA 0.758 62.883 62.100 0.042 0.000 1.139 1444 T CB -0.039 68.851 68.868 0.037 0.000 0.871 1444 T HN 0.162 nan 8.240 nan 0.000 0.454 1445 R N 1.441 121.871 120.500 -0.116 0.000 2.062 1445 R HA 0.036 4.360 4.340 -0.025 0.000 0.231 1445 R C 2.590 178.796 176.300 -0.156 0.000 1.136 1445 R CA 1.184 57.100 56.100 -0.307 0.000 0.948 1445 R CB -1.118 28.719 30.300 -0.773 0.000 0.845 1445 R HN 0.617 nan 8.270 nan 0.000 0.430 1446 I N -1.394 119.175 120.570 -0.002 0.000 2.439 1446 I HA -0.072 4.083 4.170 -0.025 0.000 0.251 1446 I C 0.774 176.985 176.117 0.157 0.000 1.139 1446 I CA 1.485 62.899 61.300 0.191 0.000 1.438 1446 I CB -0.337 37.803 38.000 0.233 0.000 1.085 1446 I HN -0.123 nan 8.210 nan 0.000 0.427 1447 N N 1.494 120.267 118.700 0.121 0.000 2.383 1447 N HA 0.006 4.731 4.740 -0.025 0.000 0.192 1447 N C 0.897 176.470 175.510 0.106 0.000 1.141 1447 N CA 0.796 53.913 53.050 0.112 0.000 0.851 1447 N CB 0.023 38.601 38.487 0.152 0.000 0.976 1447 N HN 0.532 nan 8.380 nan 0.000 0.465 1448 S N 0.124 115.888 115.700 0.105 0.000 2.849 1448 S HA 0.251 4.706 4.470 -0.025 0.000 0.244 1448 S C 0.845 175.510 174.600 0.108 0.000 1.297 1448 S CA -0.513 57.746 58.200 0.100 0.000 1.241 1448 S CB -0.615 62.641 63.200 0.094 0.000 0.958 1448 S HN 0.148 nan 8.310 nan 0.000 0.489 1449 L N -0.354 120.922 121.223 0.089 0.000 6.255 1449 L HA -0.277 4.048 4.340 -0.025 0.000 0.053 1449 L C -0.481 176.430 176.870 0.068 0.000 1.736 1449 L CA 1.541 56.417 54.840 0.061 0.000 1.818 1449 L CB -1.545 40.537 42.059 0.038 0.000 2.566 1449 L HN 0.273 nan 8.230 nan 0.000 0.975 1450 P HA -0.045 nan 4.420 nan 0.000 0.221 1450 P C 1.275 178.578 177.300 0.005 0.000 1.155 1450 P CA 1.937 65.050 63.100 0.021 0.000 0.812 1450 P CB 0.088 31.795 31.700 0.011 0.000 0.801 1451 T N 0.509 115.065 114.554 0.003 0.000 2.735 1451 T HA 0.161 4.496 4.350 -0.025 0.000 0.256 1451 T C 1.153 175.827 174.700 -0.043 0.000 1.042 1451 T CA 0.755 62.847 62.100 -0.012 0.000 1.147 1451 T CB -0.877 67.992 68.868 0.003 0.000 0.865 1451 T HN 0.165 nan 8.240 nan 0.000 0.421 1452 A N 2.106 124.910 122.820 -0.027 0.000 2.567 1452 A HA 0.249 4.554 4.320 -0.025 0.000 0.240 1452 A C 0.153 177.637 177.584 -0.168 0.000 1.053 1452 A CA 0.649 52.653 52.037 -0.054 0.000 0.755 1452 A CB -0.106 18.908 19.000 0.022 0.000 0.978 1452 A HN 0.441 nan 8.150 nan 0.000 0.507 1453 K N 1.587 121.801 120.400 -0.309 0.000 2.740 1453 K HA 0.523 4.828 4.320 -0.025 0.000 0.246 1453 K C -0.690 175.554 176.600 -0.594 0.000 1.021 1453 K CA -0.018 55.799 56.287 -0.784 0.000 1.021 1453 K CB 1.743 33.467 32.500 -1.294 0.000 1.233 1453 K HN 0.915 nan 8.250 nan 0.000 0.497 1454 A N 2.188 124.821 122.820 -0.311 0.000 2.475 1454 A HA 0.880 5.185 4.320 -0.025 0.000 0.281 1454 A C -1.615 175.745 177.584 -0.373 0.000 1.263 1454 A CA -0.504 51.366 52.037 -0.279 0.000 0.776 1454 A CB 0.887 19.871 19.000 -0.026 0.000 1.347 1454 A HN 0.468 nan 8.150 nan 0.000 0.443 1455 Y N -1.978 118.261 120.300 -0.102 0.000 2.790 1455 Y HA 0.703 5.238 4.550 -0.025 0.000 0.323 1455 Y C 0.373 176.252 175.900 -0.034 0.000 1.230 1455 Y CA -0.347 57.720 58.100 -0.056 0.000 1.121 1455 Y CB 1.683 40.058 38.460 -0.141 0.000 1.328 1455 Y HN 0.884 nan 8.280 nan 0.000 0.514 1456 A N 0.717 123.661 122.820 0.206 0.000 2.304 1456 A HA 0.627 4.932 4.320 -0.025 0.000 0.314 1456 A C -0.797 176.850 177.584 0.105 0.000 1.187 1456 A CA -0.554 51.571 52.037 0.147 0.000 0.810 1456 A CB 0.053 19.185 19.000 0.220 0.000 1.183 1456 A HN 0.666 nan 8.150 nan 0.000 0.487 1457 T N 0.757 115.357 114.554 0.077 0.000 2.788 1457 T HA 0.563 4.898 4.350 -0.025 0.000 0.296 1457 T C -0.243 174.536 174.700 0.131 0.000 1.009 1457 T CA -0.681 61.469 62.100 0.084 0.000 0.949 1457 T CB 0.580 69.479 68.868 0.052 0.000 0.946 1457 T HN 0.616 nan 8.240 nan 0.000 0.453 1458 R N 2.549 123.102 120.500 0.089 0.000 2.308 1458 R HA 0.519 4.844 4.340 -0.025 0.000 0.305 1458 R C -0.359 176.001 176.300 0.101 0.000 1.053 1458 R CA -0.507 55.641 56.100 0.081 0.000 0.957 1458 R CB 1.093 31.430 30.300 0.062 0.000 1.022 1458 R HN 0.634 nan 8.270 nan 0.000 0.461 1459 T N 4.239 118.858 114.554 0.108 0.000 2.809 1459 T HA 0.363 4.698 4.350 -0.025 0.000 0.284 1459 T C 0.042 174.834 174.700 0.154 0.000 0.992 1459 T CA -0.656 61.538 62.100 0.156 0.000 0.957 1459 T CB 1.042 70.002 68.868 0.153 0.000 0.942 1459 T HN 0.256 nan 8.240 nan 0.000 0.439 1460 I N 4.421 125.115 120.570 0.206 0.000 2.371 1460 I HA 0.326 4.481 4.170 -0.025 0.000 0.290 1460 I C -0.134 176.120 176.117 0.229 0.000 1.028 1460 I CA -0.571 60.857 61.300 0.214 0.000 1.345 1460 I CB 0.615 38.755 38.000 0.234 0.000 1.407 1460 I HN 0.509 nan 8.210 nan 0.000 0.501 1461 L N 6.748 128.108 121.223 0.228 0.000 2.298 1461 L HA 0.411 4.736 4.340 -0.025 0.000 0.284 1461 L C -0.530 176.539 176.870 0.332 0.000 1.013 1461 L CA -0.510 54.462 54.840 0.220 0.000 0.824 1461 L CB 1.492 43.600 42.059 0.082 0.000 1.221 1461 L HN 0.333 nan 8.230 nan 0.000 0.418 1462 F N 4.092 124.119 119.950 0.127 0.000 2.410 1462 F HA 0.413 4.925 4.527 -0.025 0.000 0.349 1462 F C -0.206 175.660 175.800 0.110 0.000 1.117 1462 F CA -0.824 57.251 58.000 0.124 0.000 1.104 1462 F CB 1.416 40.453 39.000 0.062 0.000 1.122 1462 F HN 0.260 nan 8.300 nan 0.000 0.483 1463 L N 7.629 128.655 121.223 -0.327 0.000 2.342 1463 L HA 0.273 4.598 4.340 -0.025 0.000 0.285 1463 L C -0.116 176.474 176.870 -0.466 0.000 1.095 1463 L CA 0.030 54.703 54.840 -0.278 0.000 0.843 1463 L CB -0.519 41.486 42.059 -0.091 0.000 1.201 1463 L HN 0.426 nan 8.230 nan 0.000 0.445 1464 K N 2.883 123.178 120.400 -0.174 0.000 2.140 1464 K HA 0.114 4.419 4.320 -0.025 0.000 0.237 1464 K C 0.782 177.343 176.600 -0.065 0.000 1.045 1464 K CA -0.231 56.019 56.287 -0.062 0.000 0.896 1464 K CB 0.405 32.941 32.500 0.061 0.000 1.122 1464 K HN 0.579 nan 8.250 nan 0.000 0.503 1465 D N 0.960 121.355 120.400 -0.009 0.000 2.310 1465 D HA -0.136 4.489 4.640 -0.025 0.000 0.212 1465 D C 0.565 176.861 176.300 -0.007 0.000 0.965 1465 D CA 0.973 54.968 54.000 -0.008 0.000 0.879 1465 D CB 0.204 41.014 40.800 0.016 0.000 0.921 1465 D HN 0.496 nan 8.370 nan 0.000 0.510 1466 D N -0.381 120.018 120.400 -0.002 0.000 2.328 1466 D HA 0.086 4.711 4.640 -0.025 0.000 0.221 1466 D C 1.333 177.628 176.300 -0.008 0.000 1.072 1466 D CA 0.252 54.252 54.000 0.000 0.000 0.850 1466 D CB 0.233 41.039 40.800 0.010 0.000 0.922 1466 D HN 0.143 nan 8.370 nan 0.000 0.516 1467 G N 0.198 108.983 108.800 -0.026 0.000 2.171 1467 G HA2 -0.230 3.715 3.960 -0.025 0.000 0.238 1467 G HA3 -0.230 3.715 3.960 -0.025 0.000 0.238 1467 G C 0.048 174.918 174.900 -0.050 0.000 1.039 1467 G CA 0.283 45.360 45.100 -0.038 0.000 0.759 1467 G HN 0.448 nan 8.290 nan 0.000 0.501 1468 T N 0.132 114.660 114.554 -0.044 0.000 2.855 1468 T HA 0.671 5.006 4.350 -0.025 0.000 0.281 1468 T C 0.415 175.084 174.700 -0.052 0.000 1.007 1468 T CA -0.478 61.600 62.100 -0.037 0.000 1.009 1468 T CB 1.208 70.077 68.868 0.001 0.000 0.983 1468 T HN 0.346 nan 8.240 nan 0.000 0.455 1469 L N 3.760 124.943 121.223 -0.066 0.000 2.325 1469 L HA 0.643 4.968 4.340 -0.025 0.000 0.279 1469 L C -0.016 176.876 176.870 0.036 0.000 1.054 1469 L CA -0.804 54.006 54.840 -0.051 0.000 0.804 1469 L CB 1.230 43.203 42.059 -0.143 0.000 1.200 1469 L HN 0.587 nan 8.230 nan 0.000 0.436 1470 K N 2.430 122.896 120.400 0.110 0.000 2.427 1470 K HA 0.596 4.901 4.320 -0.025 0.000 0.252 1470 K C -2.917 173.811 176.600 0.213 0.000 0.931 1470 K CA -1.850 54.531 56.287 0.157 0.000 0.793 1470 K CB 2.160 34.747 32.500 0.144 0.000 1.211 1470 K HN 0.128 nan 8.250 nan 0.000 0.426 1471 P HA 0.082 nan 4.420 nan 0.000 0.276 1471 P C -0.141 177.319 177.300 0.266 0.000 1.243 1471 P CA -0.406 62.942 63.100 0.414 0.000 0.768 1471 P CB 0.985 33.198 31.700 0.856 0.000 0.856 1472 L N 2.022 123.391 121.223 0.242 0.000 2.515 1472 L HA 0.413 4.738 4.340 -0.025 0.000 0.223 1472 L C 0.995 177.973 176.870 0.180 0.000 1.079 1472 L CA 0.398 55.308 54.840 0.117 0.000 0.857 1472 L CB 0.112 42.207 42.059 0.061 0.000 1.050 1472 L HN 0.463 nan 8.230 nan 0.000 0.476 1473 A N 0.299 123.330 122.820 0.352 0.000 2.585 1473 A HA 0.589 4.894 4.320 -0.025 0.000 0.299 1473 A C -1.441 176.356 177.584 0.355 0.000 1.047 1473 A CA -0.454 51.806 52.037 0.372 0.000 0.723 1473 A CB 0.781 19.921 19.000 0.232 0.000 1.275 1473 A HN -0.004 nan 8.150 nan 0.000 0.408 1474 I N 1.360 122.105 120.570 0.291 0.000 2.433 1474 I HA 0.472 4.627 4.170 -0.025 0.000 0.292 1474 I C -0.002 176.146 176.117 0.052 0.000 1.001 1474 I CA -0.332 61.036 61.300 0.113 0.000 1.119 1474 I CB 2.060 40.006 38.000 -0.089 0.000 1.289 1474 I HN 0.815 nan 8.210 nan 0.000 0.438 1475 E N 7.122 127.339 120.200 0.028 0.000 2.176 1475 E HA 0.522 4.857 4.350 -0.025 0.000 0.267 1475 E C -1.623 174.930 176.600 -0.078 0.000 0.893 1475 E CA -0.680 55.712 56.400 -0.013 0.000 0.761 1475 E CB 1.539 31.252 29.700 0.022 0.000 1.133 1475 E HN 0.502 nan 8.360 nan 0.000 0.409 1476 L N 3.738 124.846 121.223 -0.191 0.000 2.324 1476 L HA 0.367 4.692 4.340 -0.025 0.000 0.274 1476 L C -0.633 176.111 176.870 -0.210 0.000 1.012 1476 L CA -0.556 54.056 54.840 -0.379 0.000 0.859 1476 L CB 1.530 43.025 42.059 -0.941 0.000 1.224 1476 L HN 0.379 nan 8.230 nan 0.000 0.429 1477 S N 3.042 118.747 115.700 0.007 0.000 2.489 1477 S HA 0.659 5.114 4.470 -0.025 0.000 0.291 1477 S C -0.401 174.322 174.600 0.205 0.000 1.151 1477 S CA -0.899 57.354 58.200 0.088 0.000 1.082 1477 S CB 1.697 64.944 63.200 0.077 0.000 1.019 1477 S HN 0.591 nan 8.310 nan 0.000 0.492 1478 K N 0.586 121.085 120.400 0.165 0.000 2.444 1478 K HA 0.689 4.993 4.320 -0.025 0.000 0.252 1478 K C -3.536 173.118 176.600 0.089 0.000 0.993 1478 K CA -2.550 53.813 56.287 0.127 0.000 0.847 1478 K CB 0.816 33.335 32.500 0.031 0.000 1.340 1478 K HN 0.163 nan 8.250 nan 0.000 0.446 1479 P HA 0.027 nan 4.420 nan 0.000 0.274 1479 P C -0.899 176.460 177.300 0.097 0.000 1.231 1479 P CA -0.164 63.005 63.100 0.116 0.000 0.790 1479 P CB 0.377 32.154 31.700 0.129 0.000 0.951 1480 H N 3.257 122.345 119.070 0.030 0.000 2.679 1480 H HA 0.155 4.696 4.556 -0.025 0.000 0.369 1480 H C -2.014 173.321 175.328 0.012 0.000 1.178 1480 H CA -1.683 54.373 56.048 0.013 0.000 1.419 1480 H CB 0.026 29.798 29.762 0.017 0.000 1.458 1480 H HN 0.175 nan 8.280 nan 0.000 0.605 1481 P HA 0.105 nan 4.420 nan 0.000 0.267 1481 P C -1.114 176.352 177.300 0.277 0.000 1.328 1481 P CA 0.546 63.778 63.100 0.220 0.000 0.990 1481 P CB -0.050 31.704 31.700 0.091 0.000 1.168 1482 D N 2.672 123.150 120.400 0.131 0.000 3.273 1482 D HA -0.034 4.591 4.640 -0.025 0.000 0.209 1482 D C -0.305 175.997 176.300 0.003 0.000 1.184 1482 D CA 0.478 54.495 54.000 0.030 0.000 0.687 1482 D CB -1.184 39.605 40.800 -0.017 0.000 0.501 1482 D HN 0.367 nan 8.370 nan 0.000 0.234 1483 G N 2.851 111.667 108.800 0.027 0.000 3.205 1483 G HA2 0.517 4.462 3.960 -0.025 0.000 0.343 1483 G HA3 0.517 4.462 3.960 -0.025 0.000 0.343 1483 G C 0.344 175.256 174.900 0.020 0.000 1.305 1483 G CA 0.018 45.150 45.100 0.054 0.000 1.120 1483 G HN 0.415 nan 8.290 nan 0.000 0.472 1484 D N 0.789 121.167 120.400 -0.036 0.000 2.424 1484 D HA -0.091 4.534 4.640 -0.025 0.000 0.428 1484 D C -0.180 176.079 176.300 -0.068 0.000 1.148 1484 D CA -0.254 53.690 54.000 -0.094 0.000 0.986 1484 D CB -0.592 40.105 40.800 -0.172 0.000 1.461 1484 D HN 0.516 nan 8.370 nan 0.000 0.447 1485 N N 1.087 119.733 118.700 -0.090 0.000 2.432 1485 N HA 0.414 5.139 4.740 -0.025 0.000 0.292 1485 N C 1.179 176.631 175.510 -0.096 0.000 1.193 1485 N CA -0.402 52.578 53.050 -0.117 0.000 0.878 1485 N CB 2.794 41.163 38.487 -0.197 0.000 1.252 1485 N HN -0.029 nan 8.380 nan 0.000 0.520 1486 L N -0.735 120.452 121.223 -0.059 0.000 5.339 1486 L HA -0.380 3.945 4.340 -0.025 0.000 0.414 1486 L C 0.637 177.532 176.870 0.042 0.000 0.847 1486 L CA 3.202 58.047 54.840 0.008 0.000 1.836 1486 L CB -1.731 40.372 42.059 0.072 0.000 1.169 1486 L HN 1.323 nan 8.230 nan 0.000 0.616 1487 G N -2.143 106.690 108.800 0.055 0.000 2.826 1487 G HA2 -0.116 3.829 3.960 -0.025 0.000 0.233 1487 G HA3 -0.116 3.829 3.960 -0.025 0.000 0.233 1487 G C -2.573 172.396 174.900 0.115 0.000 1.296 1487 G CA 0.321 45.475 45.100 0.089 0.000 1.001 1487 G HN 0.883 nan 8.290 nan 0.000 0.576 1488 P HA 0.467 nan 4.420 nan 0.000 0.297 1488 P C -0.976 176.377 177.300 0.089 0.000 1.307 1488 P CA -0.193 62.968 63.100 0.101 0.000 0.773 1488 P CB 1.094 32.843 31.700 0.081 0.000 1.265 1489 E N -0.247 119.988 120.200 0.059 0.000 2.141 1489 E HA 0.395 4.730 4.350 -0.025 0.000 0.259 1489 E C -0.774 175.833 176.600 0.012 0.000 0.883 1489 E CA -0.370 56.041 56.400 0.017 0.000 0.744 1489 E CB 1.154 30.831 29.700 -0.038 0.000 1.150 1489 E HN 0.270 nan 8.360 nan 0.000 0.420 1490 S N 2.679 118.380 115.700 0.002 0.000 2.568 1490 S HA 0.653 5.108 4.470 -0.025 0.000 0.302 1490 S C -0.273 174.303 174.600 -0.041 0.000 1.082 1490 S CA -0.760 57.427 58.200 -0.023 0.000 1.009 1490 S CB 1.013 64.209 63.200 -0.008 0.000 1.069 1490 S HN 0.475 nan 8.310 nan 0.000 0.500 1491 I N -0.906 119.614 120.570 -0.085 0.000 2.569 1491 I HA 0.697 4.852 4.170 -0.025 0.000 0.290 1491 I C -1.245 174.837 176.117 -0.058 0.000 1.088 1491 I CA -1.161 60.099 61.300 -0.066 0.000 1.047 1491 I CB 1.727 39.679 38.000 -0.081 0.000 1.237 1491 I HN 0.206 nan 8.210 nan 0.000 0.421 1492 V N 6.009 125.924 119.914 0.001 0.000 2.370 1492 V HA 0.441 4.546 4.120 -0.025 0.000 0.279 1492 V C 0.246 176.389 176.094 0.083 0.000 1.029 1492 V CA -0.660 61.666 62.300 0.043 0.000 0.870 1492 V CB 1.480 33.344 31.823 0.070 0.000 0.984 1492 V HN 0.639 nan 8.190 nan 0.000 0.451 1493 V N 5.172 125.161 119.914 0.125 0.000 2.417 1493 V HA 0.651 4.756 4.120 -0.025 0.000 0.291 1493 V C -0.432 175.936 176.094 0.458 0.000 1.024 1493 V CA -0.572 61.869 62.300 0.234 0.000 0.861 1493 V CB 1.446 33.381 31.823 0.187 0.000 0.985 1493 V HN 0.650 nan 8.190 nan 0.000 0.436 1494 L N 5.215 126.625 121.223 0.312 0.000 2.399 1494 L HA 0.558 4.883 4.340 -0.025 0.000 0.265 1494 L C -2.145 174.554 176.870 -0.285 0.000 1.089 1494 L CA -1.918 53.004 54.840 0.137 0.000 0.802 1494 L CB 1.653 43.724 42.059 0.021 0.000 1.180 1494 L HN 0.421 nan 8.230 nan 0.000 0.454 1495 P HA 0.094 nan 4.420 nan 0.000 0.265 1495 P C -1.189 175.728 177.300 -0.638 0.000 1.187 1495 P CA 0.152 62.458 63.100 -1.325 0.000 0.766 1495 P CB 0.623 31.772 31.700 -0.919 0.000 0.820 1496 A N 1.650 124.152 122.820 -0.530 0.000 2.512 1496 A HA 0.447 4.752 4.320 -0.025 0.000 0.294 1496 A C 0.824 178.350 177.584 -0.096 0.000 1.054 1496 A CA -0.172 51.746 52.037 -0.198 0.000 0.756 1496 A CB 0.406 19.364 19.000 -0.071 0.000 1.293 1496 A HN 0.500 nan 8.150 nan 0.000 0.395 1497 T N -0.893 113.613 114.554 -0.080 0.000 2.978 1497 T HA 0.231 4.566 4.350 -0.025 0.000 0.262 1497 T C 0.452 175.142 174.700 -0.017 0.000 1.063 1497 T CA 1.200 63.274 62.100 -0.043 0.000 1.140 1497 T CB -0.030 68.809 68.868 -0.048 0.000 0.886 1497 T HN 0.639 nan 8.240 nan 0.000 0.470 1498 E N 0.304 120.494 120.200 -0.016 0.000 2.293 1498 E HA 0.517 4.852 4.350 -0.025 0.000 0.270 1498 E C -0.314 176.286 176.600 0.000 0.000 0.879 1498 E CA -0.972 55.423 56.400 -0.008 0.000 0.756 1498 E CB 1.962 31.655 29.700 -0.012 0.000 1.208 1498 E HN 0.469 nan 8.360 nan 0.000 0.428 1499 G N 1.397 110.196 108.800 -0.002 0.000 2.793 1499 G HA2 -0.247 3.698 3.960 -0.025 0.000 0.335 1499 G HA3 -0.247 3.698 3.960 -0.025 0.000 0.335 1499 G C 0.802 175.703 174.900 0.002 0.000 0.098 1499 G CA 0.518 45.615 45.100 -0.005 0.000 1.221 1499 G HN 0.914 nan 8.290 nan 0.000 0.582 1500 V N 1.880 121.783 119.914 -0.019 0.000 0.555 1500 V HA -0.485 3.620 4.120 -0.025 0.000 0.092 1500 V C 2.197 178.302 176.094 0.018 0.000 2.037 1500 V CA 3.722 65.998 62.300 -0.040 0.000 3.484 1500 V CB -1.347 30.439 31.823 -0.062 0.000 0.777 1500 V HN 1.132 nan 8.190 nan 0.000 0.808 1501 D N 0.238 120.671 120.400 0.054 0.000 2.351 1501 D HA -0.026 4.599 4.640 -0.025 0.000 0.216 1501 D C 2.081 178.448 176.300 0.111 0.000 0.968 1501 D CA 1.308 55.365 54.000 0.095 0.000 0.899 1501 D CB -0.068 40.780 40.800 0.081 0.000 0.907 1501 D HN 0.945 nan 8.370 nan 0.000 0.514 1502 S N -0.989 114.754 115.700 0.073 0.000 2.362 1502 S HA -0.161 4.294 4.470 -0.025 0.000 0.221 1502 S C 2.078 176.746 174.600 0.114 0.000 1.032 1502 S CA 1.250 59.501 58.200 0.084 0.000 0.973 1502 S CB -0.618 62.604 63.200 0.037 0.000 0.849 1502 S HN 0.229 nan 8.310 nan 0.000 0.465 1503 T N 0.972 115.570 114.554 0.074 0.000 3.023 1503 T HA 0.156 4.491 4.350 -0.025 0.000 0.266 1503 T C 1.628 176.394 174.700 0.109 0.000 1.093 1503 T CA 0.555 62.703 62.100 0.080 0.000 1.129 1503 T CB -0.501 68.385 68.868 0.031 0.000 0.899 1503 T HN 0.293 nan 8.240 nan 0.000 0.491 1504 I N -0.456 120.185 120.570 0.119 0.000 2.439 1504 I HA 0.021 4.176 4.170 -0.025 0.000 0.251 1504 I C 1.918 178.121 176.117 0.144 0.000 1.139 1504 I CA 0.734 62.116 61.300 0.137 0.000 1.438 1504 I CB -0.984 37.110 38.000 0.157 0.000 1.085 1504 I HN 0.456 nan 8.210 nan 0.000 0.427 1505 W N 0.957 122.268 121.300 0.017 0.000 2.453 1505 W HA -0.133 4.512 4.660 -0.025 0.000 0.289 1505 W C 2.326 178.821 176.519 -0.042 0.000 1.215 1505 W CA 0.673 58.009 57.345 -0.016 0.000 1.297 1505 W CB -0.332 29.106 29.460 -0.037 0.000 1.113 1505 W HN 0.016 nan 8.180 nan 0.000 0.551 1506 L N -0.089 121.191 121.223 0.095 0.000 2.275 1506 L HA -0.131 4.194 4.340 -0.025 0.000 0.215 1506 L C 1.923 178.847 176.870 0.090 0.000 1.119 1506 L CA 1.585 56.457 54.840 0.053 0.000 0.790 1506 L CB -0.765 41.359 42.059 0.107 0.000 0.919 1506 L HN -0.073 nan 8.230 nan 0.000 0.443 1507 L N -0.693 120.562 121.223 0.054 0.000 2.102 1507 L HA 0.109 4.434 4.340 -0.025 0.000 0.202 1507 L C 2.625 179.458 176.870 -0.061 0.000 1.076 1507 L CA 1.771 56.622 54.840 0.019 0.000 0.761 1507 L CB -1.413 40.692 42.059 0.075 0.000 0.921 1507 L HN 0.275 nan 8.230 nan 0.000 0.444 1508 A N -0.498 122.240 122.820 -0.135 0.000 1.908 1508 A HA -0.260 4.045 4.320 -0.025 0.000 0.218 1508 A C 2.295 179.716 177.584 -0.271 0.000 1.181 1508 A CA 1.946 53.855 52.037 -0.212 0.000 0.627 1508 A CB -0.452 18.269 19.000 -0.464 0.000 0.818 1508 A HN 0.418 nan 8.150 nan 0.000 0.445 1509 K N -0.268 119.840 120.400 -0.487 0.000 2.057 1509 K HA -0.040 4.265 4.320 -0.025 0.000 0.207 1509 K C 2.331 178.842 176.600 -0.147 0.000 1.049 1509 K CA 1.082 57.065 56.287 -0.506 0.000 0.931 1509 K CB -0.364 31.643 32.500 -0.821 0.000 0.714 1509 K HN 0.447 nan 8.250 nan 0.000 0.440 1510 A N 1.611 124.359 122.820 -0.119 0.000 1.865 1510 A HA -0.217 4.088 4.320 -0.025 0.000 0.217 1510 A C 1.907 179.430 177.584 -0.102 0.000 1.191 1510 A CA 1.541 53.501 52.037 -0.128 0.000 0.623 1510 A CB -0.822 17.976 19.000 -0.336 0.000 0.826 1510 A HN 0.274 nan 8.150 nan 0.000 0.444 1511 H N -0.629 118.410 119.070 -0.051 0.000 2.422 1511 H HA -0.087 4.454 4.556 -0.025 0.000 0.298 1511 H C 2.283 177.583 175.328 -0.046 0.000 1.098 1511 H CA 1.640 57.683 56.048 -0.008 0.000 1.315 1511 H CB -0.459 29.381 29.762 0.130 0.000 1.382 1511 H HN 0.279 nan 8.280 nan 0.000 0.523 1512 V N 1.030 120.997 119.914 0.087 0.000 2.307 1512 V HA -0.190 3.915 4.120 -0.025 0.000 0.245 1512 V C 2.428 178.546 176.094 0.040 0.000 1.045 1512 V CA 1.176 63.520 62.300 0.074 0.000 1.024 1512 V CB -0.238 31.709 31.823 0.206 0.000 0.651 1512 V HN 0.293 nan 8.190 nan 0.000 0.449 1513 I N -0.222 120.395 120.570 0.078 0.000 2.928 1513 I HA -0.072 4.083 4.170 -0.025 0.000 0.266 1513 I C 2.309 178.426 176.117 -0.000 0.000 1.234 1513 I CA 0.969 62.301 61.300 0.055 0.000 1.483 1513 I CB -1.019 37.040 38.000 0.098 0.000 1.097 1513 I HN 0.168 nan 8.210 nan 0.000 0.455 1514 V N 1.175 121.072 119.914 -0.029 0.000 2.515 1514 V HA -0.222 3.883 4.120 -0.025 0.000 0.250 1514 V C 2.169 178.199 176.094 -0.106 0.000 1.058 1514 V CA 1.567 63.851 62.300 -0.028 0.000 1.064 1514 V CB -0.796 31.021 31.823 -0.010 0.000 0.675 1514 V HN 0.485 nan 8.190 nan 0.000 0.461 1515 N N -0.252 118.259 118.700 -0.315 0.000 2.106 1515 N HA -0.201 4.524 4.740 -0.025 0.000 0.188 1515 N C 1.765 176.898 175.510 -0.628 0.000 1.029 1515 N CA 1.390 53.967 53.050 -0.789 0.000 0.848 1515 N CB -0.127 37.749 38.487 -1.018 0.000 1.007 1515 N HN 0.472 nan 8.380 nan 0.000 0.423 1516 D N 0.283 120.454 120.400 -0.381 0.000 2.144 1516 D HA -0.056 4.569 4.640 -0.025 0.000 0.200 1516 D C 1.688 178.062 176.300 0.123 0.000 0.978 1516 D CA 0.772 54.710 54.000 -0.104 0.000 0.833 1516 D CB 0.175 41.013 40.800 0.064 0.000 0.961 1516 D HN 0.023 nan 8.370 nan 0.000 0.470 1517 S N -0.856 114.927 115.700 0.138 0.000 2.436 1517 S HA 0.020 4.475 4.470 -0.025 0.000 0.228 1517 S C 1.775 176.573 174.600 0.330 0.000 1.014 1517 S CA 0.945 59.314 58.200 0.282 0.000 0.950 1517 S CB -0.003 63.367 63.200 0.284 0.000 0.784 1517 S HN 0.410 nan 8.310 nan 0.000 0.504 1518 G N -0.266 108.708 108.800 0.291 0.000 2.484 1518 G HA2 -0.232 3.713 3.960 -0.025 0.000 0.215 1518 G HA3 -0.232 3.713 3.960 -0.025 0.000 0.215 1518 G C 1.245 176.282 174.900 0.229 0.000 1.219 1518 G CA 0.857 46.134 45.100 0.295 0.000 0.791 1518 G HN 0.555 nan 8.290 nan 0.000 0.550 1519 Y N 0.972 121.390 120.300 0.196 0.000 2.224 1519 Y HA -0.151 4.384 4.550 -0.025 0.000 0.289 1519 Y C 2.606 178.608 175.900 0.169 0.000 1.146 1519 Y CA 2.031 60.254 58.100 0.205 0.000 1.182 1519 Y CB -0.411 38.268 38.460 0.365 0.000 0.983 1519 Y HN 0.461 nan 8.280 nan 0.000 0.524 1520 H N -0.249 119.028 119.070 0.346 0.000 2.253 1520 H HA -0.251 4.290 4.556 -0.025 0.000 0.296 1520 H C 2.120 177.507 175.328 0.099 0.000 1.074 1520 H CA 2.203 58.388 56.048 0.228 0.000 1.263 1520 H CB -0.295 29.563 29.762 0.160 0.000 1.363 1520 H HN 0.374 nan 8.280 nan 0.000 0.489 1521 Q N 0.357 120.011 119.800 -0.243 0.000 2.002 1521 Q HA -0.124 4.201 4.340 -0.025 0.000 0.204 1521 Q C 2.537 178.392 176.000 -0.241 0.000 0.988 1521 Q CA 1.725 57.313 55.803 -0.358 0.000 0.843 1521 Q CB -0.480 27.827 28.738 -0.718 0.000 0.908 1521 Q HN 0.401 nan 8.270 nan 0.000 0.420 1522 L N -1.065 120.013 121.223 -0.242 0.000 2.017 1522 L HA -0.106 4.219 4.340 -0.025 0.000 0.208 1522 L C 2.160 178.959 176.870 -0.118 0.000 1.073 1522 L CA 1.378 56.126 54.840 -0.152 0.000 0.745 1522 L CB -0.837 41.120 42.059 -0.171 0.000 0.894 1522 L HN 0.190 nan 8.230 nan 0.000 0.432 1523 V N -2.755 116.996 119.914 -0.272 0.000 2.735 1523 V HA 0.017 4.122 4.120 -0.025 0.000 0.234 1523 V C 2.216 178.191 176.094 -0.199 0.000 1.121 1523 V CA 0.996 63.088 62.300 -0.346 0.000 1.160 1523 V CB -0.143 31.152 31.823 -0.880 0.000 0.908 1523 V HN 0.239 nan 8.190 nan 0.000 0.495 1524 S N -0.527 115.096 115.700 -0.129 0.000 2.387 1524 S HA -0.272 4.183 4.470 -0.025 0.000 0.230 1524 S C 1.795 176.407 174.600 0.020 0.000 1.035 1524 S CA 2.333 60.569 58.200 0.059 0.000 1.014 1524 S CB -0.401 62.932 63.200 0.222 0.000 0.836 1524 S HN 0.741 nan 8.310 nan 0.000 0.466 1525 H N -1.492 117.439 119.070 -0.230 0.000 2.315 1525 H HA 0.009 4.549 4.556 -0.025 0.000 0.318 1525 H C 2.154 177.489 175.328 0.011 0.000 1.068 1525 H CA 0.557 56.523 56.048 -0.136 0.000 1.465 1525 H CB -0.469 29.105 29.762 -0.313 0.000 1.475 1525 H HN 0.522 nan 8.280 nan 0.000 0.597 1526 W N 1.872 122.939 121.300 -0.388 0.000 2.388 1526 W HA -0.133 4.511 4.660 -0.026 0.000 0.294 1526 W C 1.821 178.221 176.519 -0.198 0.000 1.212 1526 W CA 0.704 57.828 57.345 -0.368 0.000 1.271 1526 W CB -0.266 28.996 29.460 -0.330 0.000 1.126 1526 W HN 0.269 nan 8.180 nan 0.000 0.535 1527 L N 1.070 122.073 121.223 -0.367 0.000 2.084 1527 L HA -0.102 4.223 4.340 -0.025 0.000 0.202 1527 L C 1.381 178.023 176.870 -0.380 0.000 1.074 1527 L CA 1.622 56.190 54.840 -0.453 0.000 0.757 1527 L CB -0.787 41.133 42.059 -0.232 0.000 0.918 1527 L HN -0.055 nan 8.230 nan 0.000 0.444 1528 N N -1.639 116.981 118.700 -0.133 0.000 2.449 1528 N HA -0.056 4.669 4.740 -0.025 0.000 0.191 1528 N C 0.589 176.165 175.510 0.110 0.000 1.161 1528 N CA 0.316 53.422 53.050 0.093 0.000 0.863 1528 N CB 0.544 39.185 38.487 0.255 0.000 0.980 1528 N HN 0.279 nan 8.380 nan 0.000 0.458 1529 T N -1.456 113.068 114.554 -0.050 0.000 3.422 1529 T HA 0.090 4.425 4.350 -0.025 0.000 0.179 1529 T C 1.203 175.777 174.700 -0.210 0.000 0.946 1529 T CA -0.225 61.860 62.100 -0.025 0.000 1.025 1529 T CB -0.114 68.812 68.868 0.098 0.000 1.298 1529 T HN 0.096 nan 8.240 nan 0.000 0.312 1530 H N 1.269 120.069 119.070 -0.450 0.000 2.267 1530 H HA -0.004 4.537 4.556 -0.025 0.000 0.297 1530 H C 2.388 177.286 175.328 -0.716 0.000 1.080 1530 H CA 1.778 57.456 56.048 -0.617 0.000 1.278 1530 H CB -0.357 28.831 29.762 -0.958 0.000 1.365 1530 H HN 0.385 nan 8.280 nan 0.000 0.489 1531 A N 0.726 122.966 122.820 -0.968 0.000 1.835 1531 A HA -0.126 4.179 4.320 -0.025 0.000 0.215 1531 A C 2.788 180.049 177.584 -0.538 0.000 1.199 1531 A CA 1.627 53.190 52.037 -0.789 0.000 0.615 1531 A CB -1.146 17.243 19.000 -1.018 0.000 0.838 1531 A HN 0.216 nan 8.150 nan 0.000 0.444 1532 V N -0.532 119.046 119.914 -0.561 0.000 2.428 1532 V HA -0.330 3.775 4.120 -0.025 0.000 0.255 1532 V C 2.593 178.665 176.094 -0.037 0.000 1.080 1532 V CA 2.716 64.779 62.300 -0.393 0.000 1.083 1532 V CB -0.569 30.980 31.823 -0.455 0.000 0.665 1532 V HN 0.713 nan 8.190 nan 0.000 0.461 1533 M N -0.581 119.030 119.600 0.019 0.000 2.388 1533 M HA -0.015 4.450 4.480 -0.025 0.000 0.265 1533 M C 1.862 178.213 176.300 0.086 0.000 1.088 1533 M CA 1.646 57.097 55.300 0.252 0.000 1.134 1533 M CB -0.487 32.219 32.600 0.176 0.000 1.384 1533 M HN 0.361 nan 8.290 nan 0.000 0.447 1534 E N 0.009 120.151 120.200 -0.097 0.000 2.058 1534 E HA -0.175 4.160 4.350 -0.025 0.000 0.194 1534 E C -0.901 175.586 176.600 -0.187 0.000 0.997 1534 E CA 1.491 57.819 56.400 -0.120 0.000 0.801 1534 E CB -0.953 28.689 29.700 -0.097 0.000 0.746 1534 E HN 0.338 nan 8.360 nan 0.000 0.450 1535 P HA -0.206 nan 4.420 nan 0.000 0.218 1535 P C 0.724 177.842 177.300 -0.303 0.000 1.154 1535 P CA 1.470 64.348 63.100 -0.370 0.000 0.872 1535 P CB -0.110 31.053 31.700 -0.894 0.000 0.790 1536 F N -0.634 119.311 119.950 -0.009 0.000 2.146 1536 F HA -0.037 4.475 4.527 -0.025 0.000 0.298 1536 F C 2.475 178.159 175.800 -0.193 0.000 1.096 1536 F CA 1.087 59.097 58.000 0.016 0.000 1.275 1536 F CB -1.653 37.461 39.000 0.189 0.000 1.008 1536 F HN -0.116 nan 8.300 nan 0.000 0.480 1537 A N 0.252 122.843 122.820 -0.382 0.000 1.930 1537 A HA -0.083 4.221 4.320 -0.025 0.000 0.217 1537 A C 2.251 179.688 177.584 -0.245 0.000 1.175 1537 A CA 1.395 52.992 52.037 -0.733 0.000 0.627 1537 A CB -1.020 17.645 19.000 -0.559 0.000 0.815 1537 A HN 0.369 nan 8.150 nan 0.000 0.443 1538 I N -0.303 120.183 120.570 -0.140 0.000 2.202 1538 I HA -0.229 3.926 4.170 -0.025 0.000 0.242 1538 I C 2.989 179.062 176.117 -0.074 0.000 1.091 1538 I CA 0.978 62.193 61.300 -0.141 0.000 1.368 1538 I CB -0.403 37.321 38.000 -0.459 0.000 1.058 1538 I HN 0.329 nan 8.210 nan 0.000 0.410 1539 A N 0.655 123.544 122.820 0.114 0.000 1.908 1539 A HA -0.236 4.069 4.320 -0.025 0.000 0.218 1539 A C 2.390 180.263 177.584 0.482 0.000 1.181 1539 A CA 2.668 54.890 52.037 0.309 0.000 0.627 1539 A CB -1.235 17.897 19.000 0.219 0.000 0.818 1539 A HN 0.427 nan 8.150 nan 0.000 0.445 1540 T N 0.305 115.174 114.554 0.524 0.000 2.746 1540 T HA -0.147 4.188 4.350 -0.025 0.000 0.267 1540 T C 1.734 176.629 174.700 0.325 0.000 1.039 1540 T CA 1.837 64.264 62.100 0.545 0.000 1.142 1540 T CB -0.496 68.681 68.868 0.515 0.000 0.866 1540 T HN 0.674 nan 8.240 nan 0.000 0.444 1541 N N 0.525 119.264 118.700 0.065 0.000 2.171 1541 N HA 0.040 4.765 4.740 -0.025 0.000 0.184 1541 N C 2.025 177.489 175.510 -0.076 0.000 1.021 1541 N CA 0.614 53.590 53.050 -0.123 0.000 0.854 1541 N CB -0.088 37.840 38.487 -0.932 0.000 0.994 1541 N HN 0.270 nan 8.380 nan 0.000 0.426 1542 R N -0.585 119.819 120.500 -0.160 0.000 2.152 1542 R HA -0.047 4.278 4.340 -0.025 0.000 0.232 1542 R C 0.663 176.589 176.300 -0.624 0.000 1.117 1542 R CA 1.059 56.985 56.100 -0.290 0.000 0.981 1542 R CB -0.041 30.052 30.300 -0.345 0.000 0.870 1542 R HN 0.471 nan 8.270 nan 0.000 0.451 1543 H N -2.040 116.943 119.070 -0.145 0.000 3.771 1543 H HA 0.252 4.793 4.556 -0.025 0.000 0.260 1543 H C -0.288 175.038 175.328 -0.002 0.000 1.158 1543 H CA -0.055 55.792 56.048 -0.335 0.000 1.170 1543 H CB 0.852 30.621 29.762 0.011 0.000 1.539 1543 H HN -0.039 nan 8.280 nan 0.000 0.634 1544 L N 1.656 123.111 121.223 0.387 0.000 2.305 1544 L HA 0.327 4.652 4.340 -0.025 0.000 0.284 1544 L C 0.650 177.767 176.870 0.412 0.000 1.013 1544 L CA -0.527 54.495 54.840 0.304 0.000 0.819 1544 L CB 2.102 44.150 42.059 -0.018 0.000 1.227 1544 L HN -0.049 nan 8.230 nan 0.000 0.417 1545 S N 1.434 117.279 115.700 0.242 0.000 2.573 1545 S HA 0.024 4.479 4.470 -0.025 0.000 0.277 1545 S C 1.117 175.348 174.600 -0.614 0.000 1.346 1545 S CA -0.381 57.531 58.200 -0.481 0.000 1.034 1545 S CB 1.386 64.258 63.200 -0.546 0.000 0.879 1545 S HN 0.478 nan 8.310 nan 0.000 0.528 1546 V N 5.093 124.452 119.914 -0.925 0.000 2.867 1546 V HA -0.073 4.032 4.120 -0.025 0.000 0.260 1546 V C 1.591 177.375 176.094 -0.518 0.000 1.099 1546 V CA 1.828 63.453 62.300 -1.124 0.000 1.122 1546 V CB -0.605 30.781 31.823 -0.729 0.000 0.708 1546 V HN 0.804 nan 8.190 nan 0.000 0.490 1547 L N -0.658 120.301 121.223 -0.441 0.000 2.554 1547 L HA 0.118 4.443 4.340 -0.025 0.000 0.226 1547 L C 1.208 177.998 176.870 -0.134 0.000 1.137 1547 L CA 0.088 54.766 54.840 -0.270 0.000 0.863 1547 L CB -0.424 41.465 42.059 -0.284 0.000 0.985 1547 L HN 0.339 nan 8.230 nan 0.000 0.451 1548 H N 2.319 121.314 119.070 -0.125 0.000 2.646 1548 H HA 0.101 4.642 4.556 -0.025 0.000 0.325 1548 H C -1.590 173.735 175.328 -0.004 0.000 1.075 1548 H CA -1.958 54.069 56.048 -0.035 0.000 1.421 1548 H CB 1.773 31.555 29.762 0.032 0.000 1.461 1548 H HN -0.135 nan 8.280 nan 0.000 0.525 1549 P HA -0.191 nan 4.420 nan 0.000 0.216 1549 P C 1.410 178.863 177.300 0.256 0.000 1.150 1549 P CA 1.032 64.046 63.100 -0.143 0.000 0.843 1549 P CB 0.537 31.666 31.700 -0.952 0.000 0.787 1550 I N -2.300 118.501 120.570 0.385 0.000 2.876 1550 I HA -0.117 4.038 4.170 -0.025 0.000 0.264 1550 I C 2.551 178.686 176.117 0.029 0.000 1.204 1550 I CA 0.337 61.702 61.300 0.109 0.000 1.485 1550 I CB -1.645 36.321 38.000 -0.057 0.000 1.103 1550 I HN -0.078 nan 8.210 nan 0.000 0.446 1551 Y N 2.538 122.866 120.300 0.047 0.000 2.084 1551 Y HA -0.239 4.296 4.550 -0.026 0.000 0.279 1551 Y C 2.642 178.664 175.900 0.203 0.000 1.119 1551 Y CA 1.916 60.065 58.100 0.082 0.000 1.101 1551 Y CB -0.233 38.270 38.460 0.072 0.000 0.989 1551 Y HN -0.088 nan 8.280 nan 0.000 0.484 1552 K N -0.074 120.593 120.400 0.444 0.000 2.144 1552 K HA -0.267 4.038 4.320 -0.025 0.000 0.209 1552 K C 1.923 178.646 176.600 0.205 0.000 1.047 1552 K CA 1.834 58.412 56.287 0.485 0.000 0.927 1552 K CB -0.529 32.256 32.500 0.474 0.000 0.716 1552 K HN 0.365 nan 8.250 nan 0.000 0.454 1553 L N 0.638 121.819 121.223 -0.069 0.000 1.988 1553 L HA -0.138 4.187 4.340 -0.025 0.000 0.207 1553 L C 1.710 178.453 176.870 -0.212 0.000 1.071 1553 L CA 1.745 56.367 54.840 -0.363 0.000 0.744 1553 L CB -0.161 41.567 42.059 -0.551 0.000 0.893 1553 L HN 0.127 nan 8.230 nan 0.000 0.433 1554 L N -1.239 119.886 121.223 -0.164 0.000 2.529 1554 L HA -0.057 4.268 4.340 -0.025 0.000 0.223 1554 L C 2.315 178.937 176.870 -0.413 0.000 1.113 1554 L CA 0.375 55.098 54.840 -0.195 0.000 0.861 1554 L CB -0.615 41.372 42.059 -0.121 0.000 1.012 1554 L HN 0.487 nan 8.230 nan 0.000 0.461 1555 Y N 0.173 120.196 120.300 -0.461 0.000 2.384 1555 Y HA -0.065 4.470 4.550 -0.026 0.000 0.289 1555 Y C -0.835 174.861 175.900 -0.340 0.000 1.152 1555 Y CA 0.339 58.175 58.100 -0.441 0.000 1.258 1555 Y CB -2.048 36.002 38.460 -0.684 0.000 0.979 1555 Y HN 0.170 nan 8.280 nan 0.000 0.549 1556 P HA -0.005 nan 4.420 nan 0.000 0.227 1556 P C 0.288 177.190 177.300 -0.664 0.000 1.161 1556 P CA 1.643 64.210 63.100 -0.888 0.000 0.788 1556 P CB -0.002 31.031 31.700 -1.111 0.000 0.822 1557 H N -3.184 115.621 119.070 -0.442 0.000 2.539 1557 H HA 0.119 4.661 4.556 -0.024 0.000 0.267 1557 H C 0.362 175.571 175.328 -0.198 0.000 0.982 1557 H CA 0.560 56.409 56.048 -0.331 0.000 1.146 1557 H CB -0.200 29.349 29.762 -0.354 0.000 1.382 1557 H HN 0.185 nan 8.280 nan 0.000 0.577 1558 Y N -0.224 120.099 120.300 0.039 0.000 2.481 1558 Y HA 0.177 4.711 4.550 -0.025 0.000 0.247 1558 Y C 0.980 176.923 175.900 0.073 0.000 1.151 1558 Y CA -0.983 57.163 58.100 0.077 0.000 1.238 1558 Y CB 0.017 38.556 38.460 0.130 0.000 1.179 1558 Y HN -0.023 nan 8.280 nan 0.000 0.524 1559 R N 2.146 122.702 120.500 0.093 0.000 2.513 1559 R HA -0.085 4.240 4.340 -0.025 0.000 0.333 1559 R C -0.255 176.034 176.300 -0.018 0.000 0.925 1559 R CA 0.827 56.908 56.100 -0.032 0.000 1.072 1559 R CB -0.417 29.688 30.300 -0.324 0.000 0.914 1559 R HN 0.245 nan 8.270 nan 0.000 0.408 1560 D N 2.149 122.667 120.400 0.196 0.000 3.012 1560 D HA -0.166 4.459 4.640 -0.025 0.000 0.222 1560 D C 0.303 176.711 176.300 0.179 0.000 1.167 1560 D CA 1.912 56.066 54.000 0.257 0.000 0.854 1560 D CB -0.761 40.142 40.800 0.173 0.000 1.107 1560 D HN 0.750 nan 8.370 nan 0.000 0.421 1561 T N -0.825 113.825 114.554 0.160 0.000 2.896 1561 T HA 0.070 4.405 4.350 -0.025 0.000 0.263 1561 T C 2.203 176.980 174.700 0.127 0.000 1.050 1561 T CA 0.684 62.848 62.100 0.107 0.000 1.140 1561 T CB 0.177 69.103 68.868 0.096 0.000 0.877 1561 T HN 0.324 nan 8.240 nan 0.000 0.457 1562 I N 1.481 122.129 120.570 0.129 0.000 2.546 1562 I HA -0.088 4.066 4.170 -0.025 0.000 0.255 1562 I C 2.470 178.629 176.117 0.071 0.000 1.163 1562 I CA 0.718 62.067 61.300 0.081 0.000 1.457 1562 I CB -0.200 37.838 38.000 0.064 0.000 1.092 1562 I HN 0.189 nan 8.210 nan 0.000 0.434 1563 N N 1.597 120.360 118.700 0.106 0.000 2.173 1563 N HA -0.127 4.598 4.740 -0.025 0.000 0.184 1563 N C 1.624 177.207 175.510 0.122 0.000 1.025 1563 N CA 1.415 54.522 53.050 0.095 0.000 0.852 1563 N CB -0.116 38.460 38.487 0.148 0.000 0.998 1563 N HN 0.250 nan 8.380 nan 0.000 0.427 1564 I N -0.851 119.827 120.570 0.180 0.000 3.001 1564 I HA 0.047 4.202 4.170 -0.025 0.000 0.268 1564 I C 1.378 177.648 176.117 0.256 0.000 1.267 1564 I CA 0.881 62.307 61.300 0.211 0.000 1.472 1564 I CB -0.761 37.412 38.000 0.289 0.000 1.089 1564 I HN 0.122 nan 8.210 nan 0.000 0.468 1565 N N 1.498 120.369 118.700 0.285 0.000 2.250 1565 N HA -0.035 4.690 4.740 -0.025 0.000 0.181 1565 N C 2.100 177.742 175.510 0.220 0.000 1.017 1565 N CA 0.852 54.134 53.050 0.386 0.000 0.866 1565 N CB -0.278 38.418 38.487 0.348 0.000 0.985 1565 N HN 0.531 nan 8.380 nan 0.000 0.429 1566 G N 2.369 111.231 108.800 0.104 0.000 2.433 1566 G HA2 -0.212 3.733 3.960 -0.025 0.000 0.216 1566 G HA3 -0.212 3.733 3.960 -0.025 0.000 0.216 1566 G C 1.357 176.257 174.900 0.000 0.000 1.186 1566 G CA 0.196 45.308 45.100 0.020 0.000 0.779 1566 G HN 0.146 nan 8.290 nan 0.000 0.543 1567 L N 1.192 122.419 121.223 0.007 0.000 2.127 1567 L HA -0.024 4.301 4.340 -0.025 0.000 0.211 1567 L C 2.876 179.730 176.870 -0.026 0.000 1.089 1567 L CA 2.366 57.194 54.840 -0.021 0.000 0.757 1567 L CB -0.950 41.104 42.059 -0.008 0.000 0.899 1567 L HN 0.310 nan 8.230 nan 0.000 0.434 1568 A N -0.186 122.629 122.820 -0.008 0.000 1.968 1568 A HA -0.143 4.162 4.320 -0.025 0.000 0.217 1568 A C 2.235 179.717 177.584 -0.170 0.000 1.169 1568 A CA 0.801 52.768 52.037 -0.118 0.000 0.638 1568 A CB -0.376 18.497 19.000 -0.212 0.000 0.812 1568 A HN 0.461 nan 8.150 nan 0.000 0.446 1569 R N -1.238 119.211 120.500 -0.085 0.000 2.189 1569 R HA -0.038 4.287 4.340 -0.025 0.000 0.218 1569 R C 1.855 178.103 176.300 -0.086 0.000 1.074 1569 R CA 1.136 57.189 56.100 -0.077 0.000 0.991 1569 R CB -0.052 30.233 30.300 -0.025 0.000 0.883 1569 R HN 0.399 nan 8.270 nan 0.000 0.457 1570 Q N -0.929 118.824 119.800 -0.079 0.000 2.376 1570 Q HA 0.151 4.476 4.340 -0.025 0.000 0.206 1570 Q C 1.065 177.019 176.000 -0.078 0.000 0.921 1570 Q CA 0.969 56.725 55.803 -0.078 0.000 0.911 1570 Q CB 0.936 29.628 28.738 -0.076 0.000 1.032 1570 Q HN 0.075 nan 8.270 nan 0.000 0.510 1571 S N -1.727 113.925 115.700 -0.079 0.000 2.727 1571 S HA 0.263 4.718 4.470 -0.025 0.000 0.249 1571 S C 1.318 175.877 174.600 -0.068 0.000 1.079 1571 S CA -0.206 57.956 58.200 -0.064 0.000 0.912 1571 S CB 0.583 63.754 63.200 -0.048 0.000 0.861 1571 S HN 0.145 nan 8.310 nan 0.000 0.484 1572 L N 1.472 122.632 121.223 -0.105 0.000 2.189 1572 L HA 0.357 4.682 4.340 -0.025 0.000 0.199 1572 L C 1.975 178.740 176.870 -0.175 0.000 1.074 1572 L CA 0.894 55.661 54.840 -0.122 0.000 0.783 1572 L CB -0.396 41.569 42.059 -0.157 0.000 0.955 1572 L HN 0.299 nan 8.230 nan 0.000 0.460 1573 I N -1.735 118.671 120.570 -0.274 0.000 3.956 1573 I HA 0.128 4.282 4.170 -0.025 0.000 0.333 1573 I C 0.867 176.854 176.117 -0.218 0.000 1.302 1573 I CA -0.548 60.557 61.300 -0.324 0.000 1.122 1573 I CB -0.399 37.235 38.000 -0.610 0.000 1.013 1573 I HN 0.217 nan 8.210 nan 0.000 0.405 1574 N N 2.978 121.582 118.700 -0.160 0.000 2.288 1574 N HA 0.049 4.774 4.740 -0.025 0.000 0.237 1574 N C 0.102 175.549 175.510 -0.105 0.000 1.311 1574 N CA 0.198 53.178 53.050 -0.116 0.000 0.909 1574 N CB 0.625 39.054 38.487 -0.096 0.000 1.167 1574 N HN 0.205 nan 8.380 nan 0.000 0.476 1575 A N -0.147 122.617 122.820 -0.093 0.000 2.438 1575 A HA 0.173 4.478 4.320 -0.025 0.000 0.280 1575 A C 0.471 178.012 177.584 -0.072 0.000 1.160 1575 A CA -0.022 51.962 52.037 -0.089 0.000 0.821 1575 A CB -0.907 18.042 19.000 -0.086 0.000 1.101 1575 A HN 0.832 nan 8.150 nan 0.000 0.515 1576 D N 1.050 121.408 120.400 -0.069 0.000 3.110 1576 D HA -0.138 4.487 4.640 -0.025 0.000 0.214 1576 D C 0.699 176.979 176.300 -0.033 0.000 1.112 1576 D CA 1.170 55.142 54.000 -0.048 0.000 0.927 1576 D CB -1.067 39.710 40.800 -0.038 0.000 1.095 1576 D HN 0.896 nan 8.370 nan 0.000 0.429 1577 G N 0.215 108.988 108.800 -0.045 0.000 2.494 1577 G HA2 0.455 4.400 3.960 -0.025 0.000 0.270 1577 G HA3 0.455 4.400 3.960 -0.025 0.000 0.270 1577 G C 1.577 176.467 174.900 -0.016 0.000 1.423 1577 G CA -0.113 44.967 45.100 -0.034 0.000 1.055 1577 G HN 0.165 nan 8.290 nan 0.000 0.536 1578 I N -0.054 120.512 120.570 -0.007 0.000 2.127 1578 I HA -0.174 3.981 4.170 -0.025 0.000 0.241 1578 I C 2.555 178.713 176.117 0.068 0.000 1.075 1578 I CA 0.912 62.224 61.300 0.020 0.000 1.334 1578 I CB -0.217 37.804 38.000 0.034 0.000 1.040 1578 I HN 0.236 nan 8.210 nan 0.000 0.405 1579 I N 0.666 121.284 120.570 0.079 0.000 2.286 1579 I HA -0.226 3.929 4.170 -0.025 0.000 0.248 1579 I C 2.457 178.710 176.117 0.226 0.000 1.115 1579 I CA 1.586 63.014 61.300 0.213 0.000 1.392 1579 I CB -1.350 36.629 38.000 -0.035 0.000 1.065 1579 I HN 0.358 nan 8.210 nan 0.000 0.418 1580 E N 0.676 120.914 120.200 0.064 0.000 2.072 1580 E HA -0.170 4.165 4.350 -0.025 0.000 0.191 1580 E C 2.151 178.776 176.600 0.042 0.000 0.985 1580 E CA 0.779 57.202 56.400 0.038 0.000 0.801 1580 E CB 0.014 29.696 29.700 -0.030 0.000 0.750 1580 E HN 0.458 nan 8.360 nan 0.000 0.452 1581 K N 0.462 120.873 120.400 0.018 0.000 2.057 1581 K HA -0.024 4.281 4.320 -0.025 0.000 0.206 1581 K C 2.315 178.885 176.600 -0.050 0.000 1.050 1581 K CA 0.996 57.277 56.287 -0.010 0.000 0.935 1581 K CB -0.005 32.479 32.500 -0.027 0.000 0.715 1581 K HN -0.042 nan 8.250 nan 0.000 0.439 1582 S N 0.146 115.798 115.700 -0.081 0.000 2.414 1582 S HA 0.039 4.494 4.470 -0.025 0.000 0.227 1582 S C 0.461 174.750 174.600 -0.518 0.000 1.022 1582 S CA 0.764 58.783 58.200 -0.302 0.000 0.958 1582 S CB 0.003 62.998 63.200 -0.342 0.000 0.797 1582 S HN 0.059 nan 8.310 nan 0.000 0.493 1583 F N -0.053 119.901 119.950 0.006 0.000 2.538 1583 F HA 0.433 4.945 4.527 -0.025 0.000 0.325 1583 F C 0.768 176.593 175.800 0.042 0.000 1.066 1583 F CA -1.134 56.882 58.000 0.028 0.000 0.946 1583 F CB 0.967 39.988 39.000 0.035 0.000 1.199 1583 F HN -0.174 nan 8.300 nan 0.000 0.473 1584 L N 3.784 125.153 121.223 0.242 0.000 2.021 1584 L HA -0.127 4.198 4.340 -0.025 0.000 0.215 1584 L C -1.016 175.976 176.870 0.202 0.000 1.074 1584 L CA 2.408 57.360 54.840 0.188 0.000 0.760 1584 L CB -1.373 40.808 42.059 0.203 0.000 0.889 1584 L HN 0.460 nan 8.230 nan 0.000 0.433 1585 P HA -0.012 nan 4.420 nan 0.000 0.215 1585 P C 0.932 178.354 177.300 0.202 0.000 1.153 1585 P CA 1.780 64.990 63.100 0.182 0.000 0.853 1585 P CB -0.187 31.543 31.700 0.050 0.000 0.788 1586 G N -0.215 108.658 108.800 0.122 0.000 2.554 1586 G HA2 -0.308 3.637 3.960 -0.025 0.000 0.253 1586 G HA3 -0.308 3.637 3.960 -0.025 0.000 0.253 1586 G C 0.909 175.780 174.900 -0.048 0.000 1.172 1586 G CA 0.385 45.515 45.100 0.050 0.000 0.950 1586 G HN 0.330 nan 8.290 nan 0.000 0.557 1587 K N 0.231 120.512 120.400 -0.198 0.000 2.283 1587 K HA 0.028 4.333 4.320 -0.025 0.000 0.202 1587 K C 1.911 178.319 176.600 -0.319 0.000 1.048 1587 K CA 1.933 58.030 56.287 -0.316 0.000 0.948 1587 K CB -0.155 32.077 32.500 -0.448 0.000 0.742 1587 K HN 0.609 nan 8.250 nan 0.000 0.458 1588 Y N 1.978 122.295 120.300 0.028 0.000 2.553 1588 Y HA 0.070 4.605 4.550 -0.025 0.000 0.303 1588 Y C 2.214 178.064 175.900 -0.083 0.000 1.194 1588 Y CA -0.185 57.942 58.100 0.045 0.000 1.305 1588 Y CB 0.189 38.742 38.460 0.155 0.000 1.045 1588 Y HN 0.075 nan 8.280 nan 0.000 0.514 1589 S N 0.376 116.071 115.700 -0.009 0.000 2.343 1589 S HA -0.145 4.310 4.470 -0.025 0.000 0.219 1589 S C 1.895 176.410 174.600 -0.141 0.000 1.033 1589 S CA 1.237 59.386 58.200 -0.084 0.000 1.014 1589 S CB -0.139 63.017 63.200 -0.073 0.000 0.915 1589 S HN 0.340 nan 8.310 nan 0.000 0.435 1590 I N 1.651 122.126 120.570 -0.158 0.000 2.406 1590 I HA -0.015 4.140 4.170 -0.025 0.000 0.249 1590 I C 2.441 178.447 176.117 -0.185 0.000 1.122 1590 I CA 0.910 62.085 61.300 -0.209 0.000 1.431 1590 I CB -1.469 36.354 38.000 -0.295 0.000 1.087 1590 I HN 0.375 nan 8.210 nan 0.000 0.424 1591 E N 0.849 120.997 120.200 -0.086 0.000 2.130 1591 E HA -0.282 4.053 4.350 -0.025 0.000 0.196 1591 E C 2.275 178.939 176.600 0.107 0.000 0.998 1591 E CA 1.439 57.879 56.400 0.068 0.000 0.806 1591 E CB -0.061 29.783 29.700 0.241 0.000 0.738 1591 E HN 0.385 nan 8.360 nan 0.000 0.459 1592 M N 0.390 119.921 119.600 -0.115 0.000 2.159 1592 M HA -0.172 4.293 4.480 -0.025 0.000 0.263 1592 M C 2.323 178.557 176.300 -0.110 0.000 1.063 1592 M CA 1.920 57.003 55.300 -0.362 0.000 1.110 1592 M CB -0.022 32.136 32.600 -0.736 0.000 1.374 1592 M HN 0.107 nan 8.290 nan 0.000 0.411 1593 S N -1.291 114.383 115.700 -0.044 0.000 2.402 1593 S HA -0.127 4.328 4.470 -0.025 0.000 0.229 1593 S C 1.957 176.711 174.600 0.258 0.000 1.021 1593 S CA 1.424 59.672 58.200 0.080 0.000 0.974 1593 S CB -0.716 62.582 63.200 0.162 0.000 0.800 1593 S HN 0.587 nan 8.310 nan 0.000 0.484 1594 S N 1.666 117.520 115.700 0.256 0.000 2.368 1594 S HA -0.098 4.357 4.470 -0.025 0.000 0.225 1594 S C 2.025 176.820 174.600 0.326 0.000 1.030 1594 S CA 1.549 59.961 58.200 0.353 0.000 0.999 1594 S CB -0.872 62.428 63.200 0.166 0.000 0.844 1594 S HN 0.633 nan 8.310 nan 0.000 0.459 1595 S N 0.796 116.647 115.700 0.252 0.000 2.356 1595 S HA -0.050 4.405 4.470 -0.025 0.000 0.223 1595 S C 1.862 176.597 174.600 0.225 0.000 1.032 1595 S CA 1.416 59.758 58.200 0.236 0.000 1.005 1595 S CB -0.548 62.828 63.200 0.294 0.000 0.867 1595 S HN 0.425 nan 8.310 nan 0.000 0.449 1596 V N 0.698 120.733 119.914 0.202 0.000 2.626 1596 V HA -0.121 3.984 4.120 -0.025 0.000 0.252 1596 V C 1.894 178.146 176.094 0.264 0.000 1.067 1596 V CA 1.295 63.715 62.300 0.199 0.000 1.081 1596 V CB -0.758 31.131 31.823 0.111 0.000 0.686 1596 V HN 0.548 nan 8.190 nan 0.000 0.468 1597 Y N 1.543 121.927 120.300 0.140 0.000 2.274 1597 Y HA -0.221 4.314 4.550 -0.025 0.000 0.290 1597 Y C 2.319 178.361 175.900 0.236 0.000 1.145 1597 Y CA 1.491 59.677 58.100 0.143 0.000 1.203 1597 Y CB -0.243 38.248 38.460 0.052 0.000 0.984 1597 Y HN 0.213 nan 8.280 nan 0.000 0.533 1598 K N 0.007 120.517 120.400 0.183 0.000 2.160 1598 K HA -0.220 4.085 4.320 -0.025 0.000 0.206 1598 K C 0.965 177.640 176.600 0.126 0.000 1.047 1598 K CA 1.901 58.251 56.287 0.105 0.000 0.930 1598 K CB -0.339 32.243 32.500 0.137 0.000 0.720 1598 K HN 0.536 nan 8.250 nan 0.000 0.450 1599 N N -0.872 117.924 118.700 0.161 0.000 2.230 1599 N HA 0.001 4.726 4.740 -0.025 0.000 0.202 1599 N C -0.589 175.013 175.510 0.154 0.000 1.119 1599 N CA -0.444 52.701 53.050 0.159 0.000 0.851 1599 N CB 0.223 38.803 38.487 0.154 0.000 0.990 1599 N HN 0.179 nan 8.380 nan 0.000 0.497 1600 W N 1.864 123.141 121.300 -0.037 0.000 2.266 1600 W HA 0.334 4.979 4.660 -0.025 0.000 0.317 1600 W C -0.746 175.664 176.519 -0.183 0.000 1.310 1600 W CA -0.302 57.013 57.345 -0.050 0.000 1.207 1600 W CB 0.577 30.060 29.460 0.038 0.000 1.199 1600 W HN -0.328 nan 8.180 nan 0.000 0.544 1601 V N 9.766 129.145 119.914 -0.890 0.000 2.378 1601 V HA 0.089 4.194 4.120 -0.025 0.000 0.288 1601 V C 0.761 175.976 176.094 -1.465 0.000 1.016 1601 V CA -0.789 60.557 62.300 -1.589 0.000 0.840 1601 V CB 0.650 31.455 31.823 -1.696 0.000 0.994 1601 V HN 0.588 nan 8.190 nan 0.000 0.431 1602 F N 2.527 121.685 119.950 -1.319 0.000 2.120 1602 F HA -0.193 4.319 4.527 -0.025 0.000 0.300 1602 F C 2.628 178.123 175.800 -0.510 0.000 1.095 1602 F CA 1.917 59.391 58.000 -0.877 0.000 1.249 1602 F CB -1.960 37.062 39.000 0.037 0.000 0.995 1602 F HN 0.621 nan 8.300 nan 0.000 0.480 1603 T N -2.914 111.404 114.554 -0.394 0.000 2.904 1603 T HA -0.141 4.194 4.350 -0.025 0.000 0.267 1603 T C 1.491 176.071 174.700 -0.200 0.000 1.059 1603 T CA 1.379 63.335 62.100 -0.240 0.000 1.137 1603 T CB -0.683 68.037 68.868 -0.247 0.000 0.879 1603 T HN 0.219 nan 8.240 nan 0.000 0.467 1604 H N 1.138 119.960 119.070 -0.414 0.000 2.553 1604 H HA 0.282 4.823 4.556 -0.025 0.000 0.269 1604 H C 2.065 177.231 175.328 -0.269 0.000 1.011 1604 H CA 0.075 55.919 56.048 -0.340 0.000 1.150 1604 H CB -0.090 29.450 29.762 -0.370 0.000 1.339 1604 H HN 0.356 nan 8.280 nan 0.000 0.604 1605 Q N 0.341 120.069 119.800 -0.119 0.000 2.172 1605 Q HA 0.117 4.442 4.340 -0.025 0.000 0.200 1605 Q C 1.037 177.007 176.000 -0.050 0.000 0.964 1605 Q CA 0.449 56.255 55.803 0.004 0.000 0.855 1605 Q CB -0.280 28.524 28.738 0.111 0.000 0.918 1605 Q HN 0.373 nan 8.270 nan 0.000 0.444 1606 A N 1.460 124.115 122.820 -0.274 0.000 2.567 1606 A HA -0.060 4.245 4.320 -0.025 0.000 0.240 1606 A C 1.312 178.176 177.584 -1.201 0.000 1.053 1606 A CA 0.089 51.576 52.037 -0.917 0.000 0.755 1606 A CB -0.078 18.591 19.000 -0.552 0.000 0.978 1606 A HN 0.389 nan 8.150 nan 0.000 0.507 1607 L N 3.149 123.202 121.223 -1.951 0.000 2.012 1607 L HA -0.118 4.207 4.340 -0.025 0.000 0.210 1607 L C -0.402 175.941 176.870 -0.878 0.000 1.073 1607 L CA 2.144 56.227 54.840 -1.261 0.000 0.748 1607 L CB -1.260 39.953 42.059 -1.409 0.000 0.891 1607 L HN 0.529 nan 8.230 nan 0.000 0.431 1608 P HA -0.174 nan 4.420 nan 0.000 0.215 1608 P C 1.371 178.467 177.300 -0.339 0.000 1.153 1608 P CA 1.839 64.655 63.100 -0.473 0.000 0.853 1608 P CB -0.035 31.460 31.700 -0.341 0.000 0.788 1609 A N -0.355 122.249 122.820 -0.360 0.000 1.930 1609 A HA -0.234 4.071 4.320 -0.025 0.000 0.217 1609 A C 2.188 179.578 177.584 -0.324 0.000 1.175 1609 A CA 2.156 54.028 52.037 -0.274 0.000 0.627 1609 A CB -1.609 17.272 19.000 -0.200 0.000 0.815 1609 A HN 0.181 nan 8.150 nan 0.000 0.443 1610 D N -0.479 119.730 120.400 -0.318 0.000 2.084 1610 D HA -0.144 4.481 4.640 -0.025 0.000 0.194 1610 D C 1.706 177.903 176.300 -0.172 0.000 0.990 1610 D CA 1.116 54.981 54.000 -0.225 0.000 0.826 1610 D CB -0.119 40.600 40.800 -0.134 0.000 0.971 1610 D HN 0.168 nan 8.370 nan 0.000 0.453 1611 L N 0.310 121.423 121.223 -0.184 0.000 2.131 1611 L HA -0.065 4.260 4.340 -0.025 0.000 0.210 1611 L C 2.473 179.295 176.870 -0.081 0.000 1.092 1611 L CA 0.802 55.580 54.840 -0.103 0.000 0.759 1611 L CB -1.068 40.903 42.059 -0.147 0.000 0.903 1611 L HN 0.142 nan 8.230 nan 0.000 0.435 1612 V N -0.675 119.161 119.914 -0.130 0.000 2.488 1612 V HA -0.169 3.936 4.120 -0.025 0.000 0.246 1612 V C 2.556 178.578 176.094 -0.119 0.000 1.046 1612 V CA 1.046 63.282 62.300 -0.106 0.000 1.053 1612 V CB -0.385 31.369 31.823 -0.115 0.000 0.679 1612 V HN 0.418 nan 8.190 nan 0.000 0.458 1613 K N 0.463 120.746 120.400 -0.195 0.000 2.147 1613 K HA -0.136 4.169 4.320 -0.025 0.000 0.205 1613 K C 2.081 178.613 176.600 -0.113 0.000 1.049 1613 K CA 1.320 57.479 56.287 -0.214 0.000 0.936 1613 K CB -0.019 32.238 32.500 -0.406 0.000 0.722 1613 K HN 0.365 nan 8.250 nan 0.000 0.446 1614 R N -1.013 119.444 120.500 -0.071 0.000 2.310 1614 R HA 0.053 4.378 4.340 -0.025 0.000 0.202 1614 R C 0.932 177.249 176.300 0.029 0.000 0.933 1614 R CA 0.544 56.639 56.100 -0.009 0.000 1.054 1614 R CB 0.443 30.760 30.300 0.029 0.000 0.985 1614 R HN 0.448 nan 8.270 nan 0.000 0.489 1615 G N 0.935 109.743 108.800 0.013 0.000 2.162 1615 G HA2 -0.259 3.686 3.960 -0.025 0.000 0.260 1615 G HA3 -0.259 3.686 3.960 -0.025 0.000 0.260 1615 G C 0.449 175.405 174.900 0.093 0.000 0.976 1615 G CA -0.059 45.057 45.100 0.028 0.000 0.655 1615 G HN 0.248 nan 8.290 nan 0.000 0.533 1616 L N 0.462 121.765 121.223 0.132 0.000 2.628 1616 L HA 0.711 5.036 4.340 -0.025 0.000 0.229 1616 L C 1.211 178.160 176.870 0.131 0.000 1.137 1616 L CA 1.188 56.150 54.840 0.203 0.000 0.909 1616 L CB 0.470 42.694 42.059 0.275 0.000 1.137 1616 L HN 0.669 nan 8.230 nan 0.000 0.470 1617 A N 0.019 122.873 122.820 0.057 0.000 2.459 1617 A HA 0.737 5.042 4.320 -0.025 0.000 0.296 1617 A C -0.967 176.617 177.584 -0.001 0.000 1.039 1617 A CA -0.325 51.721 52.037 0.015 0.000 0.698 1617 A CB 1.102 20.081 19.000 -0.035 0.000 1.261 1617 A HN 0.023 nan 8.150 nan 0.000 0.405 1618 I N 1.618 122.189 120.570 0.003 0.000 2.441 1618 I HA 0.283 4.438 4.170 -0.025 0.000 0.295 1618 I C 0.088 176.200 176.117 -0.008 0.000 0.994 1618 I CA -0.465 60.833 61.300 -0.005 0.000 1.144 1618 I CB 1.949 39.950 38.000 0.001 0.000 1.314 1618 I HN 0.648 nan 8.210 nan 0.000 0.445 1619 E N 4.929 125.121 120.200 -0.014 0.000 2.166 1619 E HA 0.187 4.522 4.350 -0.025 0.000 0.279 1619 E C -1.223 175.374 176.600 -0.005 0.000 1.095 1619 E CA 0.092 56.486 56.400 -0.011 0.000 0.888 1619 E CB 0.959 30.649 29.700 -0.015 0.000 1.041 1619 E HN 0.420 nan 8.360 nan 0.000 0.414 1620 D N 2.324 122.724 120.400 -0.001 0.000 2.559 1620 D HA 0.246 4.871 4.640 -0.025 0.000 0.250 1620 D C -1.784 174.516 176.300 0.000 0.000 1.135 1620 D CA -1.413 52.587 54.000 -0.000 0.000 0.955 1620 D CB 2.072 42.873 40.800 0.002 0.000 1.442 1620 D HN 0.114 nan 8.370 nan 0.000 0.471 1621 P HA 0.003 nan 4.420 nan 0.000 0.200 1621 P C 0.137 177.432 177.300 -0.008 0.000 1.198 1621 P CA 0.447 63.544 63.100 -0.004 0.000 0.892 1621 P CB 0.014 31.710 31.700 -0.006 0.000 0.724 1622 S N -0.802 114.890 115.700 -0.013 0.000 3.170 1622 S HA 0.506 4.961 4.470 -0.025 0.000 0.257 1622 S C 0.937 175.523 174.600 -0.024 0.000 1.284 1622 S CA -0.214 57.973 58.200 -0.022 0.000 0.973 1622 S CB -1.055 62.131 63.200 -0.022 0.000 1.330 1622 S HN 0.293 nan 8.310 nan 0.000 0.493 1623 A N 5.769 128.576 122.820 -0.022 0.000 1.911 1623 A HA 0.315 4.620 4.320 -0.025 0.000 0.212 1623 A C -0.531 177.038 177.584 -0.025 0.000 1.189 1623 A CA 0.390 52.419 52.037 -0.013 0.000 0.639 1623 A CB -1.132 17.871 19.000 0.005 0.000 0.839 1623 A HN 0.646 nan 8.150 nan 0.000 0.449 1624 P HA 0.007 nan 4.420 nan 0.000 0.213 1624 P C 0.685 177.910 177.300 -0.126 0.000 1.156 1624 P CA 0.620 63.634 63.100 -0.144 0.000 0.884 1624 P CB -0.266 31.272 31.700 -0.270 0.000 0.774 1625 H N -0.163 118.904 119.070 -0.006 0.000 2.568 1625 H HA 0.078 4.619 4.556 -0.025 0.000 0.285 1625 H C 1.133 176.459 175.328 -0.002 0.000 1.048 1625 H CA 1.374 57.422 56.048 0.001 0.000 1.197 1625 H CB -0.828 28.933 29.762 -0.003 0.000 1.343 1625 H HN 0.304 nan 8.280 nan 0.000 0.614 1626 G N 0.375 109.216 108.800 0.069 0.000 2.132 1626 G HA2 -0.237 3.708 3.960 -0.025 0.000 0.234 1626 G HA3 -0.237 3.708 3.960 -0.025 0.000 0.234 1626 G C -0.006 174.913 174.900 0.032 0.000 0.989 1626 G CA -0.045 45.079 45.100 0.040 0.000 0.676 1626 G HN 0.370 nan 8.290 nan 0.000 0.522 1627 L N 0.104 121.356 121.223 0.047 0.000 2.518 1627 L HA 0.471 4.796 4.340 -0.025 0.000 0.262 1627 L C 0.186 177.077 176.870 0.034 0.000 0.982 1627 L CA -1.138 53.719 54.840 0.029 0.000 0.873 1627 L CB 1.731 43.798 42.059 0.014 0.000 1.198 1627 L HN 0.131 nan 8.230 nan 0.000 0.427 1628 R N 3.373 123.885 120.500 0.020 0.000 2.248 1628 R HA 0.432 4.757 4.340 -0.025 0.000 0.328 1628 R C -0.831 175.488 176.300 0.032 0.000 1.067 1628 R CA -0.079 56.036 56.100 0.025 0.000 0.924 1628 R CB 0.355 30.666 30.300 0.017 0.000 1.013 1628 R HN 0.530 nan 8.270 nan 0.000 0.454 1629 L N 5.161 126.410 121.223 0.043 0.000 2.455 1629 L HA 0.000 4.325 4.340 -0.025 0.000 0.272 1629 L C 1.324 178.241 176.870 0.078 0.000 1.174 1629 L CA -0.173 54.705 54.840 0.063 0.000 0.869 1629 L CB 1.027 43.126 42.059 0.067 0.000 1.130 1629 L HN 0.597 nan 8.230 nan 0.000 0.474 1630 V N 5.170 125.151 119.914 0.111 0.000 2.515 1630 V HA -0.110 3.995 4.120 -0.025 0.000 0.250 1630 V C 0.689 176.884 176.094 0.170 0.000 1.058 1630 V CA 1.379 63.764 62.300 0.141 0.000 1.064 1630 V CB 0.097 32.027 31.823 0.179 0.000 0.675 1630 V HN 0.588 nan 8.190 nan 0.000 0.461 1631 I N -0.768 119.885 120.570 0.138 0.000 2.411 1631 I HA 0.336 4.491 4.170 -0.025 0.000 0.284 1631 I C 1.114 177.274 176.117 0.073 0.000 1.012 1631 I CA -0.360 60.964 61.300 0.040 0.000 1.119 1631 I CB 1.291 39.177 38.000 -0.189 0.000 1.261 1631 I HN -0.037 nan 8.210 nan 0.000 0.448 1632 E N 3.830 124.060 120.200 0.049 0.000 2.152 1632 E HA -0.133 4.202 4.350 -0.025 0.000 0.192 1632 E C -0.021 176.612 176.600 0.056 0.000 0.983 1632 E CA 0.961 57.393 56.400 0.053 0.000 0.818 1632 E CB 0.214 29.934 29.700 0.034 0.000 0.758 1632 E HN 0.660 nan 8.360 nan 0.000 0.467 1633 D N -0.079 120.344 120.400 0.039 0.000 2.639 1633 D HA -0.028 4.597 4.640 -0.025 0.000 0.233 1633 D C -1.334 175.005 176.300 0.066 0.000 1.161 1633 D CA -0.240 53.783 54.000 0.039 0.000 1.003 1633 D CB -0.902 39.906 40.800 0.014 0.000 1.034 1633 D HN 0.126 nan 8.370 nan 0.000 0.514 1634 Y N 2.688 122.938 120.300 -0.082 0.000 2.805 1634 Y HA 0.313 4.848 4.550 -0.025 0.000 0.339 1634 Y C -2.000 173.829 175.900 -0.119 0.000 1.012 1634 Y CA -2.649 55.387 58.100 -0.106 0.000 1.262 1634 Y CB 1.751 40.154 38.460 -0.094 0.000 1.100 1634 Y HN 0.127 nan 8.280 nan 0.000 0.559 1635 P HA -0.231 nan 4.420 nan 0.000 0.218 1635 P C 1.066 178.199 177.300 -0.280 0.000 1.148 1635 P CA 1.335 64.327 63.100 -0.181 0.000 0.822 1635 P CB -0.026 31.458 31.700 -0.360 0.000 0.784 1636 Y N 0.825 120.874 120.300 -0.418 0.000 2.163 1636 Y HA -0.098 4.437 4.550 -0.025 0.000 0.288 1636 Y C 2.312 178.056 175.900 -0.259 0.000 1.136 1636 Y CA 1.374 59.345 58.100 -0.215 0.000 1.147 1636 Y CB -1.129 37.285 38.460 -0.076 0.000 0.987 1636 Y HN -0.127 nan 8.280 nan 0.000 0.509 1637 A N -0.193 122.067 122.820 -0.933 0.000 1.858 1637 A HA -0.146 4.159 4.320 -0.025 0.000 0.216 1637 A C 2.394 179.673 177.584 -0.508 0.000 1.190 1637 A CA 2.259 53.728 52.037 -0.947 0.000 0.617 1637 A CB -1.415 16.916 19.000 -1.115 0.000 0.827 1637 A HN 0.329 nan 8.150 nan 0.000 0.443 1638 V N 0.880 120.613 119.914 -0.301 0.000 2.252 1638 V HA -0.287 3.818 4.120 -0.025 0.000 0.249 1638 V C 2.151 178.208 176.094 -0.061 0.000 1.056 1638 V CA 2.549 64.779 62.300 -0.116 0.000 1.022 1638 V CB -0.893 30.910 31.823 -0.033 0.000 0.641 1638 V HN 0.550 nan 8.190 nan 0.000 0.445 1639 D N 0.154 120.541 120.400 -0.022 0.000 2.224 1639 D HA -0.028 4.597 4.640 -0.025 0.000 0.205 1639 D C 2.114 178.450 176.300 0.059 0.000 0.965 1639 D CA 1.292 55.334 54.000 0.070 0.000 0.852 1639 D CB -0.504 40.412 40.800 0.193 0.000 0.947 1639 D HN 0.470 nan 8.370 nan 0.000 0.494 1640 G N 0.525 109.297 108.800 -0.046 0.000 2.394 1640 G HA2 -0.156 3.789 3.960 -0.025 0.000 0.215 1640 G HA3 -0.156 3.789 3.960 -0.025 0.000 0.215 1640 G C 1.508 176.355 174.900 -0.089 0.000 1.165 1640 G CA 0.094 45.220 45.100 0.042 0.000 0.784 1640 G HN 0.123 nan 8.290 nan 0.000 0.535 1641 L N 1.069 122.109 121.223 -0.304 0.000 2.013 1641 L HA -0.074 4.251 4.340 -0.025 0.000 0.212 1641 L C 2.742 179.468 176.870 -0.240 0.000 1.073 1641 L CA 1.681 56.256 54.840 -0.440 0.000 0.753 1641 L CB -0.966 40.649 42.059 -0.740 0.000 0.890 1641 L HN 0.359 nan 8.230 nan 0.000 0.432 1642 E N -0.860 119.305 120.200 -0.058 0.000 2.110 1642 E HA -0.219 4.116 4.350 -0.025 0.000 0.193 1642 E C 2.256 178.941 176.600 0.142 0.000 0.988 1642 E CA 1.281 57.752 56.400 0.118 0.000 0.804 1642 E CB -0.144 29.633 29.700 0.128 0.000 0.745 1642 E HN 0.495 nan 8.360 nan 0.000 0.458 1643 I N 0.347 121.031 120.570 0.190 0.000 2.353 1643 I HA -0.204 3.951 4.170 -0.025 0.000 0.248 1643 I C 2.343 178.660 176.117 0.335 0.000 1.119 1643 I CA 0.616 62.082 61.300 0.276 0.000 1.417 1643 I CB -0.300 37.916 38.000 0.361 0.000 1.078 1643 I HN 0.327 nan 8.210 nan 0.000 0.421 1644 W N 2.631 123.978 121.300 0.077 0.000 2.335 1644 W HA -0.277 4.368 4.660 -0.025 0.000 0.311 1644 W C 1.891 178.410 176.519 -0.000 0.000 1.213 1644 W CA 1.974 59.277 57.345 -0.070 0.000 1.274 1644 W CB -0.201 29.000 29.460 -0.432 0.000 1.148 1644 W HN 0.184 nan 8.180 nan 0.000 0.498 1645 D N 0.261 120.677 120.400 0.026 0.000 2.104 1645 D HA -0.155 4.470 4.640 -0.025 0.000 0.194 1645 D C 2.406 178.715 176.300 0.014 0.000 0.994 1645 D CA 2.247 56.248 54.000 0.000 0.000 0.830 1645 D CB -0.838 40.048 40.800 0.143 0.000 0.959 1645 D HN 0.138 nan 8.370 nan 0.000 0.452 1646 A N 0.470 123.365 122.820 0.124 0.000 1.892 1646 A HA -0.203 4.102 4.320 -0.025 0.000 0.218 1646 A C 2.352 180.114 177.584 0.296 0.000 1.188 1646 A CA 1.308 53.503 52.037 0.263 0.000 0.631 1646 A CB -0.824 18.370 19.000 0.323 0.000 0.822 1646 A HN 0.239 nan 8.150 nan 0.000 0.447 1647 I N -0.981 119.705 120.570 0.194 0.000 2.163 1647 I HA -0.237 3.918 4.170 -0.025 0.000 0.240 1647 I C 2.582 178.576 176.117 -0.205 0.000 1.081 1647 I CA 1.802 63.108 61.300 0.009 0.000 1.353 1647 I CB -0.314 37.697 38.000 0.017 0.000 1.054 1647 I HN 0.313 nan 8.210 nan 0.000 0.407 1648 K N 0.304 120.473 120.400 -0.385 0.000 2.147 1648 K HA -0.158 4.147 4.320 -0.025 0.000 0.205 1648 K C 2.056 178.558 176.600 -0.163 0.000 1.049 1648 K CA 1.650 57.696 56.287 -0.402 0.000 0.936 1648 K CB 0.001 32.141 32.500 -0.600 0.000 0.722 1648 K HN 0.276 nan 8.250 nan 0.000 0.446 1649 T N 0.411 114.919 114.554 -0.076 0.000 2.812 1649 T HA -0.148 4.187 4.350 -0.025 0.000 0.264 1649 T C 1.164 175.906 174.700 0.071 0.000 1.042 1649 T CA 1.032 63.141 62.100 0.015 0.000 1.140 1649 T CB -0.238 68.658 68.868 0.047 0.000 0.870 1649 T HN 0.517 nan 8.240 nan 0.000 0.445 1650 W N 1.937 123.128 121.300 -0.182 0.000 2.355 1650 W HA -0.182 4.463 4.660 -0.025 0.000 0.309 1650 W C 1.600 178.054 176.519 -0.109 0.000 1.206 1650 W CA 0.693 57.890 57.345 -0.246 0.000 1.284 1650 W CB -0.548 28.386 29.460 -0.877 0.000 1.145 1650 W HN 0.028 nan 8.180 nan 0.000 0.502 1651 V N 1.057 120.613 119.914 -0.597 0.000 2.343 1651 V HA -0.352 3.753 4.120 -0.025 0.000 0.247 1651 V C 2.685 178.611 176.094 -0.281 0.000 1.051 1651 V CA 2.414 64.331 62.300 -0.639 0.000 1.036 1651 V CB -1.592 29.964 31.823 -0.445 0.000 0.654 1651 V HN 0.336 nan 8.190 nan 0.000 0.451 1652 H N 0.730 119.677 119.070 -0.204 0.000 2.352 1652 H HA -0.173 4.368 4.556 -0.025 0.000 0.299 1652 H C 2.323 177.617 175.328 -0.057 0.000 1.097 1652 H CA 2.269 58.254 56.048 -0.106 0.000 1.311 1652 H CB 0.103 29.820 29.762 -0.075 0.000 1.377 1652 H HN 0.577 nan 8.280 nan 0.000 0.504 1653 E N -1.007 119.295 120.200 0.170 0.000 2.107 1653 E HA -0.165 4.170 4.350 -0.025 0.000 0.191 1653 E C 2.018 178.673 176.600 0.091 0.000 0.982 1653 E CA 0.790 57.286 56.400 0.160 0.000 0.809 1653 E CB -0.169 29.646 29.700 0.191 0.000 0.756 1653 E HN 0.459 nan 8.360 nan 0.000 0.459 1654 Y N 1.295 121.501 120.300 -0.157 0.000 2.109 1654 Y HA -0.229 4.305 4.550 -0.025 0.000 0.285 1654 Y C 2.348 178.277 175.900 0.048 0.000 1.131 1654 Y CA 1.668 59.674 58.100 -0.157 0.000 1.121 1654 Y CB -0.258 37.821 38.460 -0.636 0.000 0.987 1654 Y HN -0.047 nan 8.280 nan 0.000 0.495 1655 V N -2.707 117.325 119.914 0.196 0.000 2.515 1655 V HA -0.163 3.942 4.120 -0.025 0.000 0.250 1655 V C 1.963 178.173 176.094 0.193 0.000 1.058 1655 V CA 2.077 64.550 62.300 0.289 0.000 1.064 1655 V CB -1.164 30.737 31.823 0.130 0.000 0.675 1655 V HN 0.358 nan 8.190 nan 0.000 0.461 1656 S N 0.614 116.331 115.700 0.029 0.000 2.500 1656 S HA 0.124 4.578 4.470 -0.025 0.000 0.239 1656 S C 1.612 176.169 174.600 -0.072 0.000 0.989 1656 S CA 1.532 59.731 58.200 -0.001 0.000 0.951 1656 S CB -0.516 62.712 63.200 0.046 0.000 0.759 1656 S HN 0.665 nan 8.310 nan 0.000 0.523 1657 L N -1.184 119.922 121.223 -0.194 0.000 2.446 1657 L HA 0.109 4.434 4.340 -0.025 0.000 0.219 1657 L C 1.303 177.717 176.870 -0.761 0.000 1.116 1657 L CA 0.819 55.367 54.840 -0.487 0.000 0.844 1657 L CB -0.166 41.456 42.059 -0.729 0.000 0.970 1657 L HN 0.352 nan 8.230 nan 0.000 0.457 1658 Y N -2.818 117.333 120.300 -0.248 0.000 2.535 1658 Y HA 0.146 4.681 4.550 -0.025 0.000 0.264 1658 Y C 0.114 175.676 175.900 -0.564 0.000 1.087 1658 Y CA -0.514 57.328 58.100 -0.431 0.000 1.285 1658 Y CB 0.427 38.542 38.460 -0.575 0.000 1.200 1658 Y HN -0.092 nan 8.280 nan 0.000 0.514 1659 Y N 1.155 121.474 120.300 0.031 0.000 2.721 1659 Y HA 0.339 4.873 4.550 -0.025 0.000 0.328 1659 Y C -1.998 173.882 175.900 -0.034 0.000 1.003 1659 Y CA -2.909 55.195 58.100 0.006 0.000 1.275 1659 Y CB 0.642 39.108 38.460 0.010 0.000 1.097 1659 Y HN -0.014 nan 8.280 nan 0.000 0.514 1660 P HA -0.070 nan 4.420 nan 0.000 0.217 1660 P C 0.568 177.883 177.300 0.024 0.000 1.151 1660 P CA 1.153 64.254 63.100 0.000 0.000 0.828 1660 P CB 0.520 32.202 31.700 -0.029 0.000 0.788 1661 T N -2.527 112.055 114.554 0.046 0.000 2.887 1661 T HA 0.219 4.554 4.350 -0.025 0.000 0.292 1661 T C 0.209 174.946 174.700 0.061 0.000 1.087 1661 T CA -0.678 61.447 62.100 0.041 0.000 1.009 1661 T CB 0.832 69.716 68.868 0.026 0.000 1.203 1661 T HN -0.309 nan 8.240 nan 0.000 0.518 1662 D N 1.374 121.794 120.400 0.033 0.000 2.149 1662 D HA -0.041 4.584 4.640 -0.025 0.000 0.198 1662 D C 2.086 178.413 176.300 0.044 0.000 0.990 1662 D CA 1.579 55.593 54.000 0.024 0.000 0.839 1662 D CB -0.429 40.372 40.800 0.001 0.000 0.948 1662 D HN 0.624 nan 8.370 nan 0.000 0.460 1663 A N 0.872 123.719 122.820 0.045 0.000 1.933 1663 A HA -0.034 4.271 4.320 -0.025 0.000 0.218 1663 A C 2.246 179.876 177.584 0.078 0.000 1.175 1663 A CA 1.940 54.007 52.037 0.049 0.000 0.628 1663 A CB -0.529 18.492 19.000 0.035 0.000 0.814 1663 A HN 0.241 nan 8.150 nan 0.000 0.444 1664 A N -0.950 121.933 122.820 0.105 0.000 2.167 1664 A HA 0.254 4.559 4.320 -0.025 0.000 0.214 1664 A C 2.023 179.778 177.584 0.286 0.000 1.151 1664 A CA 1.215 53.339 52.037 0.146 0.000 0.735 1664 A CB -0.392 18.669 19.000 0.102 0.000 0.802 1664 A HN 0.293 nan 8.150 nan 0.000 0.467 1665 V N -0.173 119.899 119.914 0.263 0.000 2.331 1665 V HA -0.253 3.852 4.120 -0.025 0.000 0.242 1665 V C 2.549 178.728 176.094 0.141 0.000 1.034 1665 V CA 2.045 64.461 62.300 0.194 0.000 1.027 1665 V CB -0.837 30.974 31.823 -0.019 0.000 0.667 1665 V HN 0.651 nan 8.190 nan 0.000 0.457 1666 Q N -0.059 119.796 119.800 0.092 0.000 2.152 1666 Q HA -0.293 4.032 4.340 -0.025 0.000 0.206 1666 Q C 2.005 178.062 176.000 0.096 0.000 0.985 1666 Q CA 1.797 57.646 55.803 0.076 0.000 0.863 1666 Q CB -0.250 28.518 28.738 0.049 0.000 0.904 1666 Q HN 0.666 nan 8.270 nan 0.000 0.422 1667 Q N 0.448 120.312 119.800 0.106 0.000 2.444 1667 Q HA -0.008 4.317 4.340 -0.025 0.000 0.206 1667 Q C -0.325 175.757 176.000 0.136 0.000 0.948 1667 Q CA -0.102 55.763 55.803 0.103 0.000 0.946 1667 Q CB 0.330 29.117 28.738 0.081 0.000 1.027 1667 Q HN 0.145 nan 8.270 nan 0.000 0.513 1668 D N -0.033 120.482 120.400 0.192 0.000 2.365 1668 D HA 0.029 4.654 4.640 -0.025 0.000 0.237 1668 D C 0.572 177.006 176.300 0.223 0.000 1.190 1668 D CA 0.189 54.339 54.000 0.249 0.000 0.867 1668 D CB 1.243 42.281 40.800 0.396 0.000 1.050 1668 D HN -0.092 nan 8.370 nan 0.000 0.491 1669 T N 3.102 117.771 114.554 0.192 0.000 2.684 1669 T HA -0.165 4.170 4.350 -0.025 0.000 0.267 1669 T C 1.466 176.270 174.700 0.174 0.000 1.036 1669 T CA 1.345 63.542 62.100 0.162 0.000 1.148 1669 T CB 0.150 69.102 68.868 0.141 0.000 0.863 1669 T HN 0.492 nan 8.240 nan 0.000 0.436 1670 E N 0.156 120.491 120.200 0.225 0.000 2.072 1670 E HA -0.052 4.283 4.350 -0.025 0.000 0.190 1670 E C 2.190 178.922 176.600 0.219 0.000 0.982 1670 E CA 0.728 57.254 56.400 0.209 0.000 0.803 1670 E CB -0.220 29.638 29.700 0.263 0.000 0.755 1670 E HN 0.254 nan 8.360 nan 0.000 0.453 1671 L N 1.213 122.579 121.223 0.239 0.000 2.083 1671 L HA -0.228 4.097 4.340 -0.025 0.000 0.209 1671 L C 2.307 179.451 176.870 0.455 0.000 1.083 1671 L CA 1.630 56.675 54.840 0.343 0.000 0.752 1671 L CB -0.120 42.106 42.059 0.279 0.000 0.899 1671 L HN 0.001 nan 8.230 nan 0.000 0.433 1672 Q N -0.603 119.373 119.800 0.294 0.000 2.046 1672 Q HA -0.082 4.243 4.340 -0.025 0.000 0.200 1672 Q C 2.233 178.350 176.000 0.195 0.000 0.975 1672 Q CA 2.027 57.976 55.803 0.243 0.000 0.836 1672 Q CB -0.467 28.372 28.738 0.169 0.000 0.896 1672 Q HN 0.625 nan 8.270 nan 0.000 0.428 1673 A N -1.025 121.847 122.820 0.086 0.000 1.929 1673 A HA -0.142 4.163 4.320 -0.025 0.000 0.216 1673 A C 1.842 179.325 177.584 -0.168 0.000 1.176 1673 A CA 1.104 53.057 52.037 -0.140 0.000 0.628 1673 A CB -1.119 17.648 19.000 -0.389 0.000 0.816 1673 A HN 0.655 nan 8.150 nan 0.000 0.444 1674 W N -0.265 120.991 121.300 -0.073 0.000 2.315 1674 W HA -0.236 4.409 4.660 -0.025 0.000 0.323 1674 W C 2.194 178.866 176.519 0.255 0.000 1.233 1674 W CA 1.958 59.390 57.345 0.144 0.000 1.267 1674 W CB -0.626 28.959 29.460 0.208 0.000 1.160 1674 W HN 0.487 nan 8.180 nan 0.000 0.474 1675 W N 1.859 123.055 121.300 -0.174 0.000 2.436 1675 W HA -0.144 4.501 4.660 -0.025 0.000 0.284 1675 W C 2.216 178.692 176.519 -0.071 0.000 1.225 1675 W CA 1.706 58.851 57.345 -0.333 0.000 1.271 1675 W CB -0.362 29.069 29.460 -0.049 0.000 1.114 1675 W HN -0.035 nan 8.180 nan 0.000 0.559 1676 K N 0.964 121.374 120.400 0.017 0.000 2.062 1676 K HA -0.227 4.078 4.320 -0.025 0.000 0.205 1676 K C 1.946 178.425 176.600 -0.203 0.000 1.051 1676 K CA 1.588 57.863 56.287 -0.021 0.000 0.941 1676 K CB -0.452 32.088 32.500 0.067 0.000 0.719 1676 K HN 0.089 nan 8.250 nan 0.000 0.440 1677 E N -0.078 120.007 120.200 -0.191 0.000 2.106 1677 E HA -0.153 4.181 4.350 -0.025 0.000 0.192 1677 E C 1.760 178.151 176.600 -0.348 0.000 0.984 1677 E CA 0.875 57.158 56.400 -0.195 0.000 0.806 1677 E CB -0.056 29.671 29.700 0.046 0.000 0.750 1677 E HN 0.408 nan 8.360 nan 0.000 0.458 1678 A N 0.378 122.950 122.820 -0.412 0.000 1.933 1678 A HA -0.145 4.160 4.320 -0.025 0.000 0.218 1678 A C 2.312 179.514 177.584 -0.638 0.000 1.175 1678 A CA 1.519 53.243 52.037 -0.522 0.000 0.628 1678 A CB -0.448 18.203 19.000 -0.583 0.000 0.814 1678 A HN 0.217 nan 8.150 nan 0.000 0.444 1679 V N -0.256 119.233 119.914 -0.709 0.000 2.379 1679 V HA -0.160 3.945 4.120 -0.025 0.000 0.243 1679 V C 2.330 178.122 176.094 -0.504 0.000 1.035 1679 V CA 1.946 63.871 62.300 -0.625 0.000 1.035 1679 V CB -0.768 30.671 31.823 -0.640 0.000 0.673 1679 V HN 0.608 nan 8.190 nan 0.000 0.457 1680 E N 0.170 120.086 120.200 -0.472 0.000 2.086 1680 E HA -0.129 4.206 4.350 -0.025 0.000 0.190 1680 E C 2.116 178.498 176.600 -0.364 0.000 0.975 1680 E CA 0.911 57.080 56.400 -0.385 0.000 0.813 1680 E CB 0.033 29.553 29.700 -0.299 0.000 0.768 1680 E HN 0.454 nan 8.360 nan 0.000 0.457 1681 K N 0.442 120.564 120.400 -0.464 0.000 2.102 1681 K HA 0.073 4.378 4.320 -0.025 0.000 0.206 1681 K C 2.064 178.176 176.600 -0.813 0.000 1.031 1681 K CA 0.944 56.871 56.287 -0.599 0.000 0.962 1681 K CB -0.942 31.154 32.500 -0.674 0.000 0.811 1681 K HN 0.123 nan 8.250 nan 0.000 0.453 1682 G N 0.419 108.572 108.800 -1.077 0.000 2.556 1682 G HA2 -0.274 3.671 3.960 -0.025 0.000 0.220 1682 G HA3 -0.274 3.671 3.960 -0.025 0.000 0.220 1682 G C 0.521 175.025 174.900 -0.659 0.000 1.156 1682 G CA 1.439 46.032 45.100 -0.844 0.000 0.766 1682 G HN 0.426 nan 8.290 nan 0.000 0.583 1683 H N -0.558 118.208 119.070 -0.508 0.000 2.502 1683 H HA 0.378 4.919 4.556 -0.025 0.000 0.268 1683 H C 1.980 177.178 175.328 -0.216 0.000 1.177 1683 H CA -0.060 55.783 56.048 -0.341 0.000 0.961 1683 H CB 0.462 29.952 29.762 -0.453 0.000 1.737 1683 H HN 0.255 nan 8.280 nan 0.000 0.569 1684 G N 0.400 109.094 108.800 -0.177 0.000 2.556 1684 G HA2 -0.332 3.613 3.960 -0.025 0.000 0.220 1684 G HA3 -0.332 3.613 3.960 -0.025 0.000 0.220 1684 G C 1.234 176.092 174.900 -0.071 0.000 1.156 1684 G CA 1.261 46.270 45.100 -0.152 0.000 0.766 1684 G HN 0.421 nan 8.290 nan 0.000 0.583 1685 D N 0.078 120.496 120.400 0.030 0.000 2.378 1685 D HA 0.045 4.670 4.640 -0.025 0.000 0.227 1685 D C 1.744 178.075 176.300 0.050 0.000 1.012 1685 D CA 0.396 54.439 54.000 0.071 0.000 0.905 1685 D CB 0.223 41.128 40.800 0.176 0.000 0.895 1685 D HN 0.363 nan 8.370 nan 0.000 0.532 1686 L N 0.135 121.376 121.223 0.029 0.000 3.184 1686 L HA 0.135 4.460 4.340 -0.025 0.000 0.283 1686 L C 1.832 178.584 176.870 -0.197 0.000 1.218 1686 L CA -0.133 54.684 54.840 -0.038 0.000 1.028 1686 L CB 0.419 42.559 42.059 0.136 0.000 1.400 1686 L HN -0.087 nan 8.230 nan 0.000 0.591 1687 K N 0.146 120.389 120.400 -0.263 0.000 2.519 1687 K HA -0.113 4.192 4.320 -0.025 0.000 0.196 1687 K C 0.928 177.096 176.600 -0.721 0.000 1.041 1687 K CA 1.266 57.238 56.287 -0.524 0.000 0.954 1687 K CB 0.088 32.312 32.500 -0.460 0.000 0.774 1687 K HN 0.394 nan 8.250 nan 0.000 0.480 1688 E N 0.677 120.613 120.200 -0.439 0.000 2.476 1688 E HA 0.075 4.410 4.350 -0.025 0.000 0.199 1688 E C -0.356 176.080 176.600 -0.273 0.000 1.021 1688 E CA -0.284 55.955 56.400 -0.270 0.000 0.907 1688 E CB 0.455 30.062 29.700 -0.157 0.000 0.974 1688 E HN 0.114 nan 8.360 nan 0.000 0.489 1689 K N 1.925 122.009 120.400 -0.527 0.000 2.472 1689 K HA 0.003 4.308 4.320 -0.025 0.000 0.280 1689 K C -1.829 174.428 176.600 -0.571 0.000 1.028 1689 K CA -1.182 54.626 56.287 -0.799 0.000 1.045 1689 K CB 0.342 31.814 32.500 -1.713 0.000 0.902 1689 K HN -0.095 nan 8.250 nan 0.000 0.478 1690 P HA -0.169 nan 4.420 nan 0.000 0.216 1690 P C 1.006 178.291 177.300 -0.025 0.000 1.150 1690 P CA 1.209 64.267 63.100 -0.070 0.000 0.843 1690 P CB -0.147 31.543 31.700 -0.018 0.000 0.787 1691 W N 1.180 122.432 121.300 -0.080 0.000 2.424 1691 W HA -0.088 4.557 4.660 -0.025 0.000 0.264 1691 W C 0.541 176.938 176.519 -0.203 0.000 1.229 1691 W CA -0.734 56.499 57.345 -0.186 0.000 1.208 1691 W CB -2.029 27.239 29.460 -0.319 0.000 1.127 1691 W HN 0.000 nan 8.180 nan 0.000 0.588 1692 W N 4.395 125.435 121.300 -0.432 0.000 2.322 1692 W HA 0.342 4.987 4.660 -0.025 0.000 0.328 1692 W C -2.020 174.536 176.519 0.061 0.000 1.395 1692 W CA -2.749 54.409 57.345 -0.312 0.000 1.267 1692 W CB -0.993 28.272 29.460 -0.325 0.000 1.259 1692 W HN -0.092 nan 8.180 nan 0.000 0.560 1693 P HA 0.127 nan 4.420 nan 0.000 0.271 1693 P C -0.793 176.587 177.300 0.134 0.000 1.238 1693 P CA 0.263 63.444 63.100 0.135 0.000 0.794 1693 P CB 1.162 32.908 31.700 0.077 0.000 0.959 1694 K N 0.069 120.398 120.400 -0.120 0.000 2.316 1694 K HA 0.517 4.822 4.320 -0.025 0.000 0.234 1694 K C -0.148 176.323 176.600 -0.215 0.000 1.054 1694 K CA -0.775 55.425 56.287 -0.145 0.000 0.879 1694 K CB 0.756 33.139 32.500 -0.195 0.000 1.252 1694 K HN 0.033 nan 8.250 nan 0.000 0.471 1695 K N 1.233 121.560 120.400 -0.123 0.000 3.122 1695 K HA 0.168 4.473 4.320 -0.025 0.000 0.193 1695 K C -0.169 176.391 176.600 -0.066 0.000 1.141 1695 K CA 0.067 56.276 56.287 -0.130 0.000 0.975 1695 K CB 0.837 33.318 32.500 -0.032 0.000 1.173 1695 K HN 0.357 nan 8.250 nan 0.000 0.546 1696 Q N -0.644 119.106 119.800 -0.084 0.000 2.373 1696 Q HA 0.121 4.446 4.340 -0.025 0.000 0.210 1696 Q C 0.372 176.341 176.000 -0.051 0.000 0.913 1696 Q CA 0.730 56.500 55.803 -0.054 0.000 0.911 1696 Q CB 0.879 29.579 28.738 -0.064 0.000 1.040 1696 Q HN 0.502 nan 8.270 nan 0.000 0.521 1697 T N -5.503 109.004 114.554 -0.078 0.000 2.858 1697 T HA 0.309 4.644 4.350 -0.025 0.000 0.285 1697 T C 0.857 175.494 174.700 -0.106 0.000 1.052 1697 T CA -0.041 62.017 62.100 -0.071 0.000 1.009 1697 T CB 0.844 69.672 68.868 -0.065 0.000 1.241 1697 T HN -0.152 nan 8.240 nan 0.000 0.542 1698 T N -0.864 113.636 114.554 -0.091 0.000 2.857 1698 T HA -0.013 4.322 4.350 -0.025 0.000 0.266 1698 T C 1.553 176.149 174.700 -0.174 0.000 1.048 1698 T CA 1.566 63.589 62.100 -0.127 0.000 1.139 1698 T CB -0.493 68.325 68.868 -0.083 0.000 0.874 1698 T HN 0.669 nan 8.240 nan 0.000 0.455 1699 E N 0.470 120.589 120.200 -0.135 0.000 2.385 1699 E HA 0.047 4.382 4.350 -0.025 0.000 0.194 1699 E C 1.847 178.372 176.600 -0.126 0.000 1.013 1699 E CA 0.276 56.600 56.400 -0.128 0.000 0.866 1699 E CB -0.091 29.567 29.700 -0.069 0.000 0.832 1699 E HN 0.391 nan 8.360 nan 0.000 0.500 1700 D N -0.024 120.294 120.400 -0.137 0.000 2.104 1700 D HA -0.178 4.447 4.640 -0.025 0.000 0.194 1700 D C 1.843 178.007 176.300 -0.226 0.000 0.994 1700 D CA 0.814 54.714 54.000 -0.167 0.000 0.830 1700 D CB -0.109 40.582 40.800 -0.181 0.000 0.959 1700 D HN 0.182 nan 8.370 nan 0.000 0.452 1701 L N 0.871 121.948 121.223 -0.243 0.000 2.027 1701 L HA -0.078 4.247 4.340 -0.025 0.000 0.206 1701 L C 2.248 178.990 176.870 -0.214 0.000 1.074 1701 L CA 1.298 55.983 54.840 -0.260 0.000 0.745 1701 L CB -0.522 41.333 42.059 -0.339 0.000 0.898 1701 L HN 0.011 nan 8.230 nan 0.000 0.433 1702 I N -0.782 119.663 120.570 -0.209 0.000 2.163 1702 I HA -0.318 3.837 4.170 -0.025 0.000 0.243 1702 I C 2.522 178.550 176.117 -0.148 0.000 1.085 1702 I CA 1.548 62.731 61.300 -0.195 0.000 1.347 1702 I CB -0.331 37.534 38.000 -0.224 0.000 1.044 1702 I HN 0.399 nan 8.210 nan 0.000 0.408 1703 Q N 0.711 120.449 119.800 -0.104 0.000 2.119 1703 Q HA -0.123 4.202 4.340 -0.025 0.000 0.201 1703 Q C 2.244 178.244 176.000 -0.001 0.000 0.972 1703 Q CA 1.773 57.559 55.803 -0.029 0.000 0.847 1703 Q CB -0.015 28.731 28.738 0.012 0.000 0.903 1703 Q HN 0.330 nan 8.270 nan 0.000 0.433 1704 S N -1.104 114.553 115.700 -0.071 0.000 2.383 1704 S HA -0.125 4.330 4.470 -0.025 0.000 0.227 1704 S C 1.920 176.523 174.600 0.004 0.000 1.026 1704 S CA 1.058 59.223 58.200 -0.059 0.000 0.981 1704 S CB -0.417 62.575 63.200 -0.347 0.000 0.818 1704 S HN 0.530 nan 8.310 nan 0.000 0.472 1705 C N 1.223 120.504 119.300 -0.033 0.000 2.448 1705 C HA 0.083 4.528 4.460 -0.025 0.000 0.280 1705 C C 2.952 177.890 174.990 -0.087 0.000 1.398 1705 C CA 0.435 59.427 59.018 -0.042 0.000 1.774 1705 C CB -1.280 26.392 27.740 -0.113 0.000 1.888 1705 C HN 0.517 nan 8.230 nan 0.000 0.519 1706 S N 0.763 116.403 115.700 -0.099 0.000 2.395 1706 S HA 0.045 4.500 4.470 -0.025 0.000 0.225 1706 S C 1.655 176.300 174.600 0.075 0.000 1.027 1706 S CA 0.919 59.001 58.200 -0.195 0.000 0.965 1706 S CB -0.184 62.765 63.200 -0.418 0.000 0.812 1706 S HN 0.568 nan 8.310 nan 0.000 0.482 1707 I N 1.368 122.097 120.570 0.265 0.000 2.179 1707 I HA -0.175 3.980 4.170 -0.025 0.000 0.242 1707 I C 2.002 178.314 176.117 0.326 0.000 1.088 1707 I CA 1.263 62.816 61.300 0.422 0.000 1.357 1707 I CB -0.389 37.786 38.000 0.292 0.000 1.051 1707 I HN 0.259 nan 8.210 nan 0.000 0.409 1708 I N 0.161 120.818 120.570 0.145 0.000 2.226 1708 I HA -0.236 3.919 4.170 -0.025 0.000 0.245 1708 I C 2.490 178.636 176.117 0.048 0.000 1.100 1708 I CA 1.170 62.522 61.300 0.086 0.000 1.374 1708 I CB -0.241 37.776 38.000 0.028 0.000 1.057 1708 I HN 0.035 nan 8.210 nan 0.000 0.413 1709 V N 0.521 120.400 119.914 -0.058 0.000 2.358 1709 V HA -0.277 3.828 4.120 -0.025 0.000 0.246 1709 V C 2.117 178.257 176.094 0.077 0.000 1.047 1709 V CA 1.718 63.873 62.300 -0.241 0.000 1.035 1709 V CB -0.768 30.849 31.823 -0.343 0.000 0.658 1709 V HN 0.641 nan 8.190 nan 0.000 0.452 1710 W N 1.937 123.313 121.300 0.126 0.000 2.333 1710 W HA -0.284 4.361 4.660 -0.025 0.000 0.316 1710 W C 2.567 179.234 176.519 0.247 0.000 1.215 1710 W CA 2.875 60.387 57.345 0.278 0.000 1.278 1710 W CB -0.648 29.152 29.460 0.566 0.000 1.154 1710 W HN 0.511 nan 8.180 nan 0.000 0.486 1711 T N -0.586 114.078 114.554 0.183 0.000 2.803 1711 T HA -0.117 4.218 4.350 -0.025 0.000 0.269 1711 T C 1.999 176.729 174.700 0.051 0.000 1.052 1711 T CA 1.924 64.072 62.100 0.080 0.000 1.136 1711 T CB -0.792 68.240 68.868 0.273 0.000 0.864 1711 T HN 0.141 nan 8.240 nan 0.000 0.467 1712 A N 1.747 124.608 122.820 0.069 0.000 1.898 1712 A HA 0.124 4.429 4.320 -0.025 0.000 0.214 1712 A C 2.649 180.267 177.584 0.055 0.000 1.183 1712 A CA 1.747 53.816 52.037 0.054 0.000 0.622 1712 A CB -0.746 18.302 19.000 0.079 0.000 0.824 1712 A HN 0.727 nan 8.150 nan 0.000 0.444 1713 S N -0.626 115.109 115.700 0.058 0.000 2.338 1713 S HA 0.392 4.847 4.470 -0.025 0.000 0.197 1713 S C 2.107 176.724 174.600 0.028 0.000 0.990 1713 S CA 0.864 59.119 58.200 0.092 0.000 0.920 1713 S CB -0.792 62.495 63.200 0.145 0.000 0.903 1713 S HN 0.825 nan 8.310 nan 0.000 0.542 1714 A N 0.821 123.555 122.820 -0.142 0.000 2.072 1714 A HA 0.408 4.713 4.320 -0.025 0.000 0.216 1714 A C 2.245 179.476 177.584 -0.589 0.000 1.156 1714 A CA 0.394 52.233 52.037 -0.329 0.000 0.701 1714 A CB -0.757 18.024 19.000 -0.366 0.000 0.816 1714 A HN 0.541 nan 8.150 nan 0.000 0.458 1715 L N -1.115 119.596 121.223 -0.854 0.000 2.027 1715 L HA -0.180 4.145 4.340 -0.025 0.000 0.206 1715 L C 2.703 179.537 176.870 -0.060 0.000 1.074 1715 L CA 1.944 56.520 54.840 -0.441 0.000 0.745 1715 L CB -0.551 41.363 42.059 -0.241 0.000 0.898 1715 L HN 0.664 nan 8.230 nan 0.000 0.433 1716 H N -0.001 119.028 119.070 -0.067 0.000 2.256 1716 H HA -0.196 4.345 4.556 -0.025 0.000 0.299 1716 H C 2.024 177.421 175.328 0.115 0.000 1.071 1716 H CA 1.849 57.935 56.048 0.064 0.000 1.280 1716 H CB 0.139 29.938 29.762 0.061 0.000 1.370 1716 H HN 0.392 nan 8.280 nan 0.000 0.490 1717 A N 1.279 124.252 122.820 0.255 0.000 1.958 1717 A HA -0.192 4.113 4.320 -0.025 0.000 0.221 1717 A C 2.657 180.386 177.584 0.242 0.000 1.178 1717 A CA 2.274 54.558 52.037 0.412 0.000 0.642 1717 A CB -1.153 18.069 19.000 0.370 0.000 0.816 1717 A HN 0.630 nan 8.150 nan 0.000 0.453 1718 A N -0.623 122.268 122.820 0.119 0.000 2.066 1718 A HA 0.154 4.459 4.320 -0.025 0.000 0.218 1718 A C 1.954 179.566 177.584 0.046 0.000 1.157 1718 A CA 1.742 53.845 52.037 0.110 0.000 0.670 1718 A CB -0.612 18.527 19.000 0.231 0.000 0.804 1718 A HN 1.201 nan 8.150 nan 0.000 0.453 1719 V N -3.442 116.476 119.914 0.006 0.000 3.605 1719 V HA 0.218 4.323 4.120 -0.025 0.000 0.284 1719 V C 1.174 177.253 176.094 -0.024 0.000 1.386 1719 V CA 1.212 63.565 62.300 0.087 0.000 1.053 1719 V CB -0.632 31.300 31.823 0.183 0.000 0.857 1719 V HN 0.483 nan 8.190 nan 0.000 0.436 1720 N N -0.039 118.457 118.700 -0.340 0.000 2.516 1720 N HA 0.232 4.957 4.740 -0.025 0.000 0.197 1720 N C 1.158 176.281 175.510 -0.646 0.000 1.064 1720 N CA 0.269 52.923 53.050 -0.661 0.000 0.866 1720 N CB 0.055 37.866 38.487 -1.127 0.000 1.255 1720 N HN 0.362 nan 8.380 nan 0.000 0.447 1721 F N -0.129 119.792 119.950 -0.048 0.000 2.802 1721 F HA 0.330 4.842 4.527 -0.025 0.000 0.300 1721 F C 1.931 177.804 175.800 0.122 0.000 1.168 1721 F CA 0.333 58.342 58.000 0.014 0.000 1.433 1721 F CB 0.382 39.396 39.000 0.023 0.000 1.115 1721 F HN 0.170 nan 8.300 nan 0.000 0.582 1722 G N -1.176 107.758 108.800 0.225 0.000 3.126 1722 G HA2 -0.017 3.928 3.960 -0.025 0.000 0.224 1722 G HA3 -0.017 3.928 3.960 -0.025 0.000 0.224 1722 G C 1.212 176.287 174.900 0.291 0.000 1.142 1722 G CA -0.051 45.310 45.100 0.435 0.000 0.759 1722 G HN 0.250 nan 8.290 nan 0.000 0.550 1723 Q N 0.089 119.959 119.800 0.115 0.000 1.858 1723 Q HA -0.258 4.067 4.340 -0.025 0.000 0.240 1723 Q C 2.032 178.112 176.000 0.133 0.000 1.014 1723 Q CA 2.095 57.946 55.803 0.080 0.000 0.884 1723 Q CB -0.498 28.250 28.738 0.018 0.000 0.957 1723 Q HN 0.410 nan 8.270 nan 0.000 0.419 1724 Y N 0.557 120.881 120.300 0.039 0.000 2.145 1724 Y HA -0.083 4.452 4.550 -0.024 0.000 0.286 1724 Y C -1.034 174.866 175.900 0.001 0.000 1.145 1724 Y CA 1.782 59.898 58.100 0.027 0.000 1.148 1724 Y CB -1.061 37.422 38.460 0.037 0.000 0.981 1724 Y HN 0.299 nan 8.280 nan 0.000 0.507 1725 P HA -0.286 nan 4.420 nan 0.000 0.222 1725 P C 0.895 177.950 177.300 -0.408 0.000 1.157 1725 P CA 2.470 65.421 63.100 -0.248 0.000 0.905 1725 P CB -0.265 31.100 31.700 -0.558 0.000 0.792 1726 Y N -2.632 117.546 120.300 -0.204 0.000 2.476 1726 Y HA 0.305 4.840 4.550 -0.025 0.000 0.283 1726 Y C 2.271 178.057 175.900 -0.189 0.000 1.109 1726 Y CA 1.119 59.114 58.100 -0.175 0.000 1.246 1726 Y CB -0.403 38.004 38.460 -0.087 0.000 1.068 1726 Y HN -0.089 nan 8.280 nan 0.000 0.552 1727 G N -1.131 107.634 108.800 -0.058 0.000 4.144 1727 G HA2 0.270 4.215 3.960 -0.025 0.000 0.297 1727 G HA3 0.270 4.215 3.960 -0.025 0.000 0.297 1727 G C 1.348 176.071 174.900 -0.295 0.000 1.090 1727 G CA 0.304 45.335 45.100 -0.115 0.000 0.870 1727 G HN 0.388 nan 8.290 nan 0.000 0.532 1728 G N 0.264 108.692 108.800 -0.621 0.000 2.623 1728 G HA2 0.139 4.083 3.960 -0.025 0.000 0.214 1728 G HA3 0.139 4.083 3.960 -0.025 0.000 0.214 1728 G C 0.486 175.086 174.900 -0.500 0.000 1.138 1728 G CA 0.139 44.597 45.100 -1.071 0.000 0.794 1728 G HN 0.371 nan 8.290 nan 0.000 0.535 1729 L N 1.162 122.176 121.223 -0.349 0.000 2.255 1729 L HA 0.486 4.811 4.340 -0.025 0.000 0.289 1729 L C 1.123 177.885 176.870 -0.179 0.000 1.046 1729 L CA -0.661 54.056 54.840 -0.205 0.000 0.816 1729 L CB 1.348 43.300 42.059 -0.179 0.000 1.197 1729 L HN 0.008 nan 8.230 nan 0.000 0.427 1730 I N 3.836 124.304 120.570 -0.169 0.000 2.916 1730 I HA -0.153 4.002 4.170 -0.025 0.000 0.267 1730 I C 1.473 177.531 176.117 -0.098 0.000 1.263 1730 I CA 1.397 62.622 61.300 -0.124 0.000 1.471 1730 I CB -0.031 37.909 38.000 -0.100 0.000 1.089 1730 I HN 0.719 nan 8.210 nan 0.000 0.468 1731 L N -0.177 120.960 121.223 -0.143 0.000 2.131 1731 L HA -0.106 4.219 4.340 -0.025 0.000 0.206 1731 L C 2.213 179.042 176.870 -0.068 0.000 1.087 1731 L CA 1.180 55.944 54.840 -0.127 0.000 0.767 1731 L CB -0.750 41.051 42.059 -0.430 0.000 0.917 1731 L HN 0.307 nan 8.230 nan 0.000 0.441 1732 N N 0.401 119.046 118.700 -0.093 0.000 2.173 1732 N HA -0.084 4.641 4.740 -0.025 0.000 0.184 1732 N C 0.692 176.206 175.510 0.007 0.000 1.025 1732 N CA 1.062 54.092 53.050 -0.032 0.000 0.852 1732 N CB 0.342 38.811 38.487 -0.030 0.000 0.998 1732 N HN -0.002 nan 8.380 nan 0.000 0.427 1733 R N 0.893 121.382 120.500 -0.018 0.000 2.587 1733 R HA 0.319 4.644 4.340 -0.025 0.000 0.283 1733 R C -2.528 173.762 176.300 -0.018 0.000 1.472 1733 R CA -1.532 54.568 56.100 -0.001 0.000 1.578 1733 R CB 1.382 31.685 30.300 0.005 0.000 1.130 1733 R HN 0.339 nan 8.270 nan 0.000 0.602 1734 P HA 0.027 nan 4.420 nan 0.000 0.276 1734 P C 0.781 178.053 177.300 -0.047 0.000 1.235 1734 P CA 0.136 63.200 63.100 -0.061 0.000 0.772 1734 P CB 1.298 32.938 31.700 -0.100 0.000 0.871 1735 T N 0.868 115.360 114.554 -0.103 0.000 3.044 1735 T HA 0.132 4.467 4.350 -0.025 0.000 0.255 1735 T C 0.722 175.378 174.700 -0.074 0.000 1.073 1735 T CA 0.382 62.399 62.100 -0.139 0.000 1.125 1735 T CB -0.037 68.524 68.868 -0.513 0.000 0.908 1735 T HN 0.106 nan 8.240 nan 0.000 0.480 1736 L N 1.546 122.716 121.223 -0.088 0.000 2.342 1736 L HA 0.816 5.141 4.340 -0.025 0.000 0.271 1736 L C -0.327 176.507 176.870 -0.060 0.000 1.008 1736 L CA -1.527 53.282 54.840 -0.053 0.000 0.818 1736 L CB 1.555 43.577 42.059 -0.063 0.000 1.296 1736 L HN 0.330 nan 8.230 nan 0.000 0.427 1737 A N 2.960 125.763 122.820 -0.029 0.000 2.332 1737 A HA 0.697 5.002 4.320 -0.025 0.000 0.300 1737 A C 0.306 177.849 177.584 -0.068 0.000 1.153 1737 A CA -0.523 51.492 52.037 -0.036 0.000 0.764 1737 A CB 0.656 19.741 19.000 0.142 0.000 1.174 1737 A HN 0.772 nan 8.150 nan 0.000 0.467 1738 R N 1.023 121.457 120.500 -0.111 0.000 2.509 1738 R HA 0.305 4.630 4.340 -0.025 0.000 0.300 1738 R C -0.202 175.987 176.300 -0.185 0.000 0.985 1738 R CA 0.202 56.223 56.100 -0.132 0.000 1.092 1738 R CB 0.635 30.884 30.300 -0.086 0.000 1.237 1738 R HN 0.697 nan 8.270 nan 0.000 0.546 1739 R N -0.381 119.991 120.500 -0.214 0.000 2.664 1739 R HA 0.221 4.546 4.340 -0.025 0.000 0.260 1739 R C -1.180 175.046 176.300 -0.124 0.000 1.062 1739 R CA -0.613 55.354 56.100 -0.223 0.000 0.902 1739 R CB 1.055 31.319 30.300 -0.061 0.000 1.258 1739 R HN -0.156 nan 8.270 nan 0.000 0.465 1740 F N 1.514 121.519 119.950 0.091 0.000 2.173 1740 F HA 0.340 4.853 4.527 -0.025 0.000 0.280 1740 F C 1.315 177.312 175.800 0.327 0.000 1.175 1740 F CA -0.414 57.670 58.000 0.139 0.000 1.166 1740 F CB 0.347 39.372 39.000 0.043 0.000 1.589 1740 F HN 0.171 nan 8.300 nan 0.000 0.513 1741 I N 3.334 124.287 120.570 0.637 0.000 2.452 1741 I HA 0.108 4.263 4.170 -0.025 0.000 0.287 1741 I C -1.945 174.366 176.117 0.324 0.000 1.079 1741 I CA -1.850 59.689 61.300 0.399 0.000 1.387 1741 I CB -0.109 38.070 38.000 0.298 0.000 1.404 1741 I HN 0.161 nan 8.210 nan 0.000 0.522 1742 P HA -0.037 nan 4.420 nan 0.000 0.259 1742 P C -0.449 177.042 177.300 0.318 0.000 1.163 1742 P CA -0.052 63.223 63.100 0.291 0.000 0.760 1742 P CB 0.376 32.248 31.700 0.286 0.000 0.762 1743 A N 3.301 126.237 122.820 0.193 0.000 2.320 1743 A HA 0.162 4.467 4.320 -0.025 0.000 0.287 1743 A C 0.535 178.008 177.584 -0.185 0.000 1.181 1743 A CA -0.640 51.419 52.037 0.037 0.000 0.831 1743 A CB -0.131 18.883 19.000 0.023 0.000 1.102 1743 A HN 0.618 nan 8.150 nan 0.000 0.513 1744 E N 1.651 121.517 120.200 -0.557 0.000 2.694 1744 E HA 0.216 4.551 4.350 -0.025 0.000 0.250 1744 E C 1.312 177.569 176.600 -0.572 0.000 0.963 1744 E CA 1.456 57.121 56.400 -1.225 0.000 0.949 1744 E CB -0.034 29.179 29.700 -0.811 0.000 0.911 1744 E HN 1.282 nan 8.360 nan 0.000 0.500 1745 G N 2.974 111.499 108.800 -0.460 0.000 2.307 1745 G HA2 -0.276 3.669 3.960 -0.025 0.000 0.210 1745 G HA3 -0.276 3.669 3.960 -0.025 0.000 0.210 1745 G C 0.406 175.311 174.900 0.009 0.000 1.005 1745 G CA 0.071 45.099 45.100 -0.119 0.000 0.634 1745 G HN 0.804 nan 8.290 nan 0.000 0.496 1746 T N 0.005 114.586 114.554 0.045 0.000 2.813 1746 T HA 0.555 4.890 4.350 -0.025 0.000 0.297 1746 T C -0.579 174.202 174.700 0.134 0.000 1.036 1746 T CA -0.450 61.707 62.100 0.094 0.000 1.044 1746 T CB 1.887 70.815 68.868 0.101 0.000 0.993 1746 T HN 0.056 nan 8.240 nan 0.000 0.535 1747 P HA -0.099 nan 4.420 nan 0.000 0.221 1747 P C 1.091 178.446 177.300 0.092 0.000 1.145 1747 P CA 0.986 64.137 63.100 0.086 0.000 0.795 1747 P CB 0.153 31.889 31.700 0.060 0.000 0.775 1748 E N -0.819 119.450 120.200 0.115 0.000 2.112 1748 E HA -0.170 4.165 4.350 -0.025 0.000 0.190 1748 E C 2.142 178.822 176.600 0.132 0.000 0.979 1748 E CA 0.891 57.358 56.400 0.111 0.000 0.814 1748 E CB -1.165 28.610 29.700 0.125 0.000 0.762 1748 E HN 0.343 nan 8.360 nan 0.000 0.460 1749 Y N 2.515 122.845 120.300 0.051 0.000 2.263 1749 Y HA -0.121 4.414 4.550 -0.025 0.000 0.292 1749 Y C 1.815 177.739 175.900 0.039 0.000 1.130 1749 Y CA 1.573 59.703 58.100 0.050 0.000 1.179 1749 Y CB 0.126 38.616 38.460 0.049 0.000 0.998 1749 Y HN -0.093 nan 8.280 nan 0.000 0.532 1750 D N -0.082 120.411 120.400 0.155 0.000 2.123 1750 D HA -0.193 4.432 4.640 -0.025 0.000 0.200 1750 D C 1.888 178.185 176.300 -0.006 0.000 0.976 1750 D CA 1.359 55.396 54.000 0.062 0.000 0.831 1750 D CB -0.251 40.606 40.800 0.095 0.000 0.974 1750 D HN 0.550 nan 8.370 nan 0.000 0.469 1751 E N 0.419 120.625 120.200 0.011 0.000 2.265 1751 E HA -0.161 4.174 4.350 -0.025 0.000 0.196 1751 E C 1.982 178.562 176.600 -0.033 0.000 0.996 1751 E CA 0.445 56.843 56.400 -0.004 0.000 0.832 1751 E CB -0.025 29.684 29.700 0.015 0.000 0.756 1751 E HN 0.213 nan 8.360 nan 0.000 0.491 1752 M N -0.143 119.417 119.600 -0.066 0.000 2.236 1752 M HA -0.072 4.392 4.480 -0.025 0.000 0.266 1752 M C 2.123 178.342 176.300 -0.135 0.000 1.070 1752 M CA 0.751 55.994 55.300 -0.094 0.000 1.137 1752 M CB 0.244 32.769 32.600 -0.125 0.000 1.378 1752 M HN 0.102 nan 8.290 nan 0.000 0.426 1753 V N 0.533 120.337 119.914 -0.182 0.000 2.407 1753 V HA -0.182 3.922 4.120 -0.025 0.000 0.245 1753 V C 1.902 177.945 176.094 -0.087 0.000 1.041 1753 V CA 1.713 63.921 62.300 -0.153 0.000 1.040 1753 V CB -0.236 31.477 31.823 -0.184 0.000 0.671 1753 V HN 0.416 nan 8.190 nan 0.000 0.455 1754 K N 0.692 121.052 120.400 -0.066 0.000 2.148 1754 K HA -0.003 4.302 4.320 -0.025 0.000 0.204 1754 K C 0.795 177.364 176.600 -0.053 0.000 1.050 1754 K CA 0.996 57.255 56.287 -0.046 0.000 0.942 1754 K CB -0.087 32.396 32.500 -0.028 0.000 0.724 1754 K HN 0.436 nan 8.250 nan 0.000 0.446 1755 N N -1.076 117.589 118.700 -0.058 0.000 2.732 1755 N HA 0.181 4.906 4.740 -0.025 0.000 0.247 1755 N C -2.672 172.797 175.510 -0.068 0.000 1.305 1755 N CA -1.694 51.316 53.050 -0.067 0.000 0.762 1755 N CB 1.231 39.688 38.487 -0.050 0.000 1.361 1755 N HN -0.241 nan 8.380 nan 0.000 0.545 1756 P HA -0.087 nan 4.420 nan 0.000 0.219 1756 P C 0.748 178.005 177.300 -0.072 0.000 1.146 1756 P CA 1.284 64.344 63.100 -0.067 0.000 0.808 1756 P CB 0.460 32.110 31.700 -0.083 0.000 0.779 1757 Q N -1.161 118.520 119.800 -0.198 0.000 2.389 1757 Q HA -0.055 4.270 4.340 -0.025 0.000 0.204 1757 Q C 1.921 177.905 176.000 -0.026 0.000 0.944 1757 Q CA 0.729 56.361 55.803 -0.285 0.000 0.908 1757 Q CB -0.087 28.270 28.738 -0.635 0.000 1.002 1757 Q HN 0.066 nan 8.270 nan 0.000 0.493 1758 K N 1.057 121.452 120.400 -0.009 0.000 2.128 1758 K HA 0.083 4.388 4.320 -0.025 0.000 0.202 1758 K C 1.814 178.455 176.600 0.068 0.000 1.050 1758 K CA 1.007 57.318 56.287 0.040 0.000 0.966 1758 K CB -0.349 32.159 32.500 0.014 0.000 0.759 1758 K HN 0.107 nan 8.250 nan 0.000 0.454 1759 A N 0.135 122.988 122.820 0.054 0.000 1.896 1759 A HA -0.269 4.036 4.320 -0.025 0.000 0.220 1759 A C 2.240 179.883 177.584 0.100 0.000 1.206 1759 A CA 2.066 54.142 52.037 0.065 0.000 0.647 1759 A CB -1.234 17.799 19.000 0.055 0.000 0.828 1759 A HN 0.498 nan 8.150 nan 0.000 0.455 1760 Y N 0.112 120.436 120.300 0.040 0.000 2.049 1760 Y HA -0.192 4.343 4.550 -0.025 0.000 0.277 1760 Y C 2.198 178.150 175.900 0.086 0.000 1.143 1760 Y CA 2.201 60.350 58.100 0.083 0.000 1.115 1760 Y CB -0.296 38.295 38.460 0.219 0.000 0.975 1760 Y HN 0.227 nan 8.280 nan 0.000 0.487 1761 L N -0.266 121.129 121.223 0.287 0.000 2.191 1761 L HA -0.206 4.119 4.340 -0.025 0.000 0.212 1761 L C 2.467 179.388 176.870 0.085 0.000 1.103 1761 L CA 1.163 56.131 54.840 0.213 0.000 0.769 1761 L CB -0.452 41.798 42.059 0.318 0.000 0.908 1761 L HN 0.189 nan 8.230 nan 0.000 0.438 1762 R N -0.464 120.068 120.500 0.053 0.000 2.189 1762 R HA -0.081 4.244 4.340 -0.025 0.000 0.218 1762 R C 2.099 178.371 176.300 -0.047 0.000 1.074 1762 R CA 1.608 57.715 56.100 0.012 0.000 0.991 1762 R CB -0.223 30.089 30.300 0.020 0.000 0.883 1762 R HN 0.449 nan 8.270 nan 0.000 0.457 1763 T N -1.693 112.792 114.554 -0.114 0.000 3.107 1763 T HA 0.171 4.506 4.350 -0.025 0.000 0.249 1763 T C 1.024 175.578 174.700 -0.244 0.000 1.096 1763 T CA -0.220 61.768 62.100 -0.187 0.000 1.012 1763 T CB -0.282 68.431 68.868 -0.258 0.000 0.977 1763 T HN 0.190 nan 8.240 nan 0.000 0.527 1764 I N -2.653 117.791 120.570 -0.210 0.000 3.595 1764 I HA 0.559 4.714 4.170 -0.025 0.000 0.289 1764 I C -0.583 175.494 176.117 -0.068 0.000 1.145 1764 I CA -1.570 59.618 61.300 -0.186 0.000 1.071 1764 I CB 0.557 38.393 38.000 -0.275 0.000 1.364 1764 I HN -0.324 nan 8.210 nan 0.000 0.486 1765 T N 3.004 117.528 114.554 -0.049 0.000 2.656 1765 T HA 0.056 4.391 4.350 -0.025 0.000 0.258 1765 T C -2.235 172.512 174.700 0.078 0.000 1.020 1765 T CA -0.111 61.987 62.100 -0.004 0.000 1.191 1765 T CB -0.945 67.908 68.868 -0.024 0.000 1.004 1765 T HN 0.401 nan 8.240 nan 0.000 0.498 1766 P HA 0.057 nan 4.420 nan 0.000 0.271 1766 P C 1.035 178.284 177.300 -0.086 0.000 1.233 1766 P CA -0.477 62.622 63.100 -0.002 0.000 0.795 1766 P CB 0.633 32.363 31.700 0.051 0.000 0.936 1767 K N 0.595 120.767 120.400 -0.381 0.000 2.097 1767 K HA -0.158 4.147 4.320 -0.025 0.000 0.206 1767 K C 1.866 178.395 176.600 -0.119 0.000 1.049 1767 K CA 1.391 57.324 56.287 -0.591 0.000 0.933 1767 K CB -0.486 31.576 32.500 -0.730 0.000 0.717 1767 K HN 0.385 nan 8.250 nan 0.000 0.442 1768 F N 1.480 121.342 119.950 -0.148 0.000 2.084 1768 F HA -0.187 4.325 4.527 -0.025 0.000 0.296 1768 F C 1.843 177.664 175.800 0.036 0.000 1.111 1768 F CA 1.435 59.432 58.000 -0.005 0.000 1.224 1768 F CB 0.122 39.228 39.000 0.176 0.000 0.991 1768 F HN 0.059 nan 8.300 nan 0.000 0.471 1769 E N -0.063 120.102 120.200 -0.059 0.000 2.153 1769 E HA -0.155 4.180 4.350 -0.025 0.000 0.194 1769 E C 2.062 178.573 176.600 -0.148 0.000 0.988 1769 E CA 1.822 58.108 56.400 -0.190 0.000 0.811 1769 E CB -0.553 29.091 29.700 -0.092 0.000 0.746 1769 E HN 0.350 nan 8.360 nan 0.000 0.466 1770 T N 0.707 115.229 114.554 -0.053 0.000 2.674 1770 T HA -0.139 4.196 4.350 -0.025 0.000 0.265 1770 T C 1.612 176.262 174.700 -0.083 0.000 1.039 1770 T CA 0.913 63.003 62.100 -0.015 0.000 1.150 1770 T CB -0.264 68.725 68.868 0.202 0.000 0.864 1770 T HN 0.006 nan 8.240 nan 0.000 0.427 1771 L N 0.578 121.735 121.223 -0.110 0.000 2.083 1771 L HA 0.018 4.343 4.340 -0.025 0.000 0.209 1771 L C 2.276 179.161 176.870 0.024 0.000 1.083 1771 L CA 1.280 56.025 54.840 -0.158 0.000 0.752 1771 L CB -0.819 40.953 42.059 -0.479 0.000 0.899 1771 L HN 0.317 nan 8.230 nan 0.000 0.433 1772 I N -0.773 119.761 120.570 -0.061 0.000 2.127 1772 I HA -0.327 3.828 4.170 -0.025 0.000 0.241 1772 I C 2.239 178.371 176.117 0.025 0.000 1.075 1772 I CA 1.658 62.942 61.300 -0.027 0.000 1.334 1772 I CB -0.322 37.528 38.000 -0.250 0.000 1.040 1772 I HN 0.313 nan 8.210 nan 0.000 0.405 1773 D N 1.094 121.462 120.400 -0.053 0.000 2.081 1773 D HA -0.163 4.462 4.640 -0.025 0.000 0.194 1773 D C 2.265 178.593 176.300 0.047 0.000 0.986 1773 D CA 1.544 55.518 54.000 -0.043 0.000 0.837 1773 D CB -0.219 40.489 40.800 -0.154 0.000 0.985 1773 D HN 0.159 nan 8.370 nan 0.000 0.448 1774 L N 0.150 121.380 121.223 0.011 0.000 2.081 1774 L HA -0.197 4.128 4.340 -0.025 0.000 0.212 1774 L C 2.571 179.537 176.870 0.159 0.000 1.080 1774 L CA 1.290 56.180 54.840 0.083 0.000 0.754 1774 L CB -0.635 41.303 42.059 -0.201 0.000 0.893 1774 L HN 0.099 nan 8.230 nan 0.000 0.433 1775 S N -0.624 115.209 115.700 0.221 0.000 2.357 1775 S HA -0.142 4.313 4.470 -0.025 0.000 0.221 1775 S C 1.918 176.599 174.600 0.134 0.000 1.031 1775 S CA 1.191 59.569 58.200 0.297 0.000 0.982 1775 S CB -0.208 63.344 63.200 0.586 0.000 0.853 1775 S HN 0.280 nan 8.310 nan 0.000 0.458 1776 V N 1.992 121.992 119.914 0.143 0.000 2.379 1776 V HA 0.021 4.126 4.120 -0.025 0.000 0.245 1776 V C 1.842 178.000 176.094 0.107 0.000 1.044 1776 V CA 1.198 63.564 62.300 0.110 0.000 1.036 1776 V CB -0.351 31.542 31.823 0.117 0.000 0.664 1776 V HN 0.477 nan 8.190 nan 0.000 0.453 1777 I N 0.014 120.673 120.570 0.148 0.000 2.530 1777 I HA -0.211 3.944 4.170 -0.025 0.000 0.257 1777 I C 2.462 178.676 176.117 0.161 0.000 1.179 1777 I CA 1.886 63.296 61.300 0.183 0.000 1.440 1777 I CB -0.109 38.032 38.000 0.234 0.000 1.087 1777 I HN 0.523 nan 8.210 nan 0.000 0.440 1778 E N 1.014 121.231 120.200 0.028 0.000 2.102 1778 E HA -0.105 4.230 4.350 -0.025 0.000 0.190 1778 E C 2.253 178.782 176.600 -0.117 0.000 0.971 1778 E CA 0.581 56.835 56.400 -0.244 0.000 0.821 1778 E CB 0.168 29.516 29.700 -0.587 0.000 0.777 1778 E HN 0.448 nan 8.360 nan 0.000 0.460 1779 I N 1.418 121.953 120.570 -0.058 0.000 2.756 1779 I HA -0.212 3.943 4.170 -0.025 0.000 0.262 1779 I C 2.086 178.228 176.117 0.041 0.000 1.225 1779 I CA 0.551 61.846 61.300 -0.008 0.000 1.472 1779 I CB -0.090 37.922 38.000 0.020 0.000 1.094 1779 I HN 0.177 nan 8.210 nan 0.000 0.454 1780 L N -0.173 121.073 121.223 0.040 0.000 2.209 1780 L HA -0.022 4.303 4.340 -0.025 0.000 0.207 1780 L C 1.758 178.596 176.870 -0.054 0.000 1.094 1780 L CA 0.790 55.648 54.840 0.029 0.000 0.790 1780 L CB -0.233 41.843 42.059 0.029 0.000 0.932 1780 L HN 0.132 nan 8.230 nan 0.000 0.447 1781 S N -0.040 115.649 115.700 -0.018 0.000 2.618 1781 S HA 0.220 4.675 4.470 -0.025 0.000 0.242 1781 S C 0.241 174.979 174.600 0.230 0.000 0.972 1781 S CA -0.293 57.917 58.200 0.017 0.000 1.004 1781 S CB -0.227 63.040 63.200 0.112 0.000 0.778 1781 S HN 0.173 nan 8.310 nan 0.000 0.459 1782 R N 1.380 121.973 120.500 0.155 0.000 2.637 1782 R HA 0.430 4.755 4.340 -0.025 0.000 0.291 1782 R C -1.026 175.288 176.300 0.023 0.000 0.963 1782 R CA -0.519 55.629 56.100 0.080 0.000 0.901 1782 R CB 0.635 30.972 30.300 0.062 0.000 1.160 1782 R HN 0.360 nan 8.270 nan 0.000 0.457 1783 H N 0.167 119.340 119.070 0.172 0.000 2.527 1783 H HA 0.405 4.946 4.556 -0.025 0.000 0.321 1783 H C 0.226 175.591 175.328 0.062 0.000 1.087 1783 H CA -0.257 55.848 56.048 0.095 0.000 1.337 1783 H CB 1.386 31.176 29.762 0.046 0.000 1.440 1783 H HN 0.715 nan 8.280 nan 0.000 0.490 1784 A N 1.909 124.805 122.820 0.128 0.000 2.445 1784 A HA 0.084 4.389 4.320 -0.025 0.000 0.242 1784 A C 1.561 179.150 177.584 0.010 0.000 1.075 1784 A CA 0.125 52.169 52.037 0.012 0.000 0.777 1784 A CB 0.050 18.980 19.000 -0.116 0.000 1.013 1784 A HN 0.944 nan 8.150 nan 0.000 0.493 1785 S N 0.686 116.378 115.700 -0.013 0.000 2.399 1785 S HA -0.175 4.280 4.470 -0.025 0.000 0.231 1785 S C 0.876 175.466 174.600 -0.017 0.000 1.022 1785 S CA 1.399 59.606 58.200 0.011 0.000 0.983 1785 S CB -0.432 62.772 63.200 0.007 0.000 0.803 1785 S HN 0.847 nan 8.310 nan 0.000 0.480 1786 D N 0.675 121.016 120.400 -0.097 0.000 2.319 1786 D HA 0.179 4.804 4.640 -0.025 0.000 0.230 1786 D C 0.309 176.520 176.300 -0.148 0.000 1.094 1786 D CA -0.284 53.651 54.000 -0.109 0.000 0.856 1786 D CB -0.445 40.268 40.800 -0.145 0.000 0.915 1786 D HN 0.446 nan 8.370 nan 0.000 0.517 1787 E N 0.584 120.671 120.200 -0.189 0.000 2.398 1787 E HA 0.190 4.525 4.350 -0.025 0.000 0.263 1787 E C -0.446 175.866 176.600 -0.481 0.000 1.046 1787 E CA -0.131 56.044 56.400 -0.376 0.000 0.908 1787 E CB 0.547 29.941 29.700 -0.510 0.000 0.963 1787 E HN 0.238 nan 8.360 nan 0.000 0.431 1788 I N 5.272 125.542 120.570 -0.500 0.000 2.355 1788 I HA 0.205 4.360 4.170 -0.025 0.000 0.288 1788 I C -0.582 175.267 176.117 -0.446 0.000 0.999 1788 I CA -0.782 60.309 61.300 -0.349 0.000 1.163 1788 I CB 0.503 38.355 38.000 -0.245 0.000 1.316 1788 I HN 0.529 nan 8.210 nan 0.000 0.454 1789 Y N 4.364 124.576 120.300 -0.146 0.000 2.334 1789 Y HA 0.215 4.750 4.550 -0.026 0.000 0.325 1789 Y C 1.303 177.120 175.900 -0.139 0.000 1.308 1789 Y CA -0.409 57.597 58.100 -0.157 0.000 1.389 1789 Y CB 0.749 39.089 38.460 -0.199 0.000 1.328 1789 Y HN 0.453 nan 8.280 nan 0.000 0.532 1790 L N 0.683 121.928 121.223 0.036 0.000 2.030 1790 L HA -0.278 4.047 4.340 -0.025 0.000 0.222 1790 L C 1.935 178.765 176.870 -0.067 0.000 1.082 1790 L CA 2.147 56.996 54.840 0.014 0.000 0.785 1790 L CB -0.740 41.310 42.059 -0.015 0.000 0.895 1790 L HN 0.993 nan 8.230 nan 0.000 0.439 1791 G N -1.264 107.332 108.800 -0.340 0.000 3.088 1791 G HA2 0.019 3.964 3.960 -0.025 0.000 0.212 1791 G HA3 0.019 3.964 3.960 -0.025 0.000 0.212 1791 G C 0.306 174.983 174.900 -0.372 0.000 1.173 1791 G CA -0.231 44.501 45.100 -0.615 0.000 0.779 1791 G HN 0.388 nan 8.290 nan 0.000 0.540 1792 E N -0.505 119.657 120.200 -0.063 0.000 2.250 1792 E HA 0.681 5.016 4.350 -0.025 0.000 0.269 1792 E C -0.511 176.129 176.600 0.066 0.000 1.018 1792 E CA -0.736 55.691 56.400 0.046 0.000 0.873 1792 E CB 1.300 30.995 29.700 -0.009 0.000 1.134 1792 E HN -0.081 nan 8.360 nan 0.000 0.403 1793 R N 0.763 121.251 120.500 -0.020 0.000 2.744 1793 R HA 0.130 4.455 4.340 -0.025 0.000 0.279 1793 R C 0.395 176.610 176.300 -0.141 0.000 0.977 1793 R CA -0.449 55.444 56.100 -0.346 0.000 0.906 1793 R CB 1.145 30.890 30.300 -0.924 0.000 1.197 1793 R HN 0.643 nan 8.270 nan 0.000 0.463 1794 E N 0.644 120.765 120.200 -0.132 0.000 2.023 1794 E HA -0.103 4.232 4.350 -0.025 0.000 0.196 1794 E C -0.318 176.348 176.600 0.110 0.000 1.003 1794 E CA 1.678 58.087 56.400 0.015 0.000 0.809 1794 E CB 0.162 29.908 29.700 0.077 0.000 0.755 1794 E HN 0.691 nan 8.360 nan 0.000 0.449 1795 T N -0.549 114.116 114.554 0.185 0.000 2.867 1795 T HA 0.252 4.587 4.350 -0.025 0.000 0.282 1795 T C -1.835 173.065 174.700 0.334 0.000 1.000 1795 T CA -1.643 60.598 62.100 0.235 0.000 1.042 1795 T CB 1.600 70.618 68.868 0.250 0.000 0.973 1795 T HN -0.006 nan 8.240 nan 0.000 0.465 1796 P HA -0.082 nan 4.420 nan 0.000 0.219 1796 P C 0.387 177.827 177.300 0.234 0.000 1.150 1796 P CA 0.971 64.250 63.100 0.299 0.000 0.814 1796 P CB -0.216 31.588 31.700 0.175 0.000 0.787 1797 N N -0.775 118.024 118.700 0.164 0.000 2.758 1797 N HA 0.077 4.802 4.740 -0.025 0.000 0.293 1797 N C 1.120 176.682 175.510 0.087 0.000 1.273 1797 N CA -0.973 52.097 53.050 0.035 0.000 1.022 1797 N CB -0.834 37.666 38.487 0.021 0.000 1.334 1797 N HN 0.247 nan 8.380 nan 0.000 0.519 1798 W N -0.224 121.124 121.300 0.080 0.000 2.425 1798 W HA 0.139 4.783 4.660 -0.026 0.000 0.277 1798 W C 0.044 176.616 176.519 0.088 0.000 1.231 1798 W CA 0.204 57.616 57.345 0.112 0.000 1.248 1798 W CB -0.117 29.445 29.460 0.169 0.000 1.117 1798 W HN 0.055 nan 8.180 nan 0.000 0.568 1799 T N -0.237 114.047 114.554 -0.449 0.000 2.933 1799 T HA 0.248 4.583 4.350 -0.025 0.000 0.305 1799 T C 0.972 175.480 174.700 -0.321 0.000 1.092 1799 T CA 0.050 61.951 62.100 -0.332 0.000 1.008 1799 T CB 1.375 70.045 68.868 -0.330 0.000 1.102 1799 T HN 0.105 nan 8.240 nan 0.000 0.469 1800 T N 0.749 115.185 114.554 -0.197 0.000 3.035 1800 T HA 0.067 4.402 4.350 -0.025 0.000 0.268 1800 T C 0.542 175.155 174.700 -0.145 0.000 1.109 1800 T CA 0.432 62.437 62.100 -0.159 0.000 1.119 1800 T CB -0.529 68.265 68.868 -0.123 0.000 0.900 1800 T HN 0.615 nan 8.240 nan 0.000 0.503 1801 D N 2.406 122.723 120.400 -0.138 0.000 2.356 1801 D HA 0.175 4.800 4.640 -0.025 0.000 0.272 1801 D C 1.245 177.493 176.300 -0.087 0.000 1.337 1801 D CA -0.061 53.888 54.000 -0.085 0.000 0.970 1801 D CB 0.846 41.644 40.800 -0.003 0.000 1.092 1801 D HN 0.514 nan 8.370 nan 0.000 0.516 1802 K N 3.348 123.705 120.400 -0.071 0.000 2.057 1802 K HA -0.245 4.060 4.320 -0.025 0.000 0.207 1802 K C 1.385 177.982 176.600 -0.006 0.000 1.049 1802 K CA 1.192 57.451 56.287 -0.047 0.000 0.931 1802 K CB -0.117 32.358 32.500 -0.041 0.000 0.714 1802 K HN 0.304 nan 8.250 nan 0.000 0.440 1803 K N 0.145 120.538 120.400 -0.012 0.000 2.439 1803 K HA 0.149 4.454 4.320 -0.025 0.000 0.197 1803 K C 1.910 178.569 176.600 0.098 0.000 1.041 1803 K CA 0.955 57.252 56.287 0.018 0.000 0.970 1803 K CB 0.059 32.530 32.500 -0.048 0.000 0.773 1803 K HN 0.237 nan 8.250 nan 0.000 0.479 1804 A N 1.697 124.593 122.820 0.126 0.000 1.924 1804 A HA 0.159 4.464 4.320 -0.025 0.000 0.211 1804 A C 2.101 179.929 177.584 0.407 0.000 1.198 1804 A CA 0.075 52.317 52.037 0.341 0.000 0.657 1804 A CB -0.337 18.873 19.000 0.351 0.000 0.852 1804 A HN 0.171 nan 8.150 nan 0.000 0.454 1805 L N -0.175 121.117 121.223 0.116 0.000 1.989 1805 L HA -0.229 4.096 4.340 -0.025 0.000 0.211 1805 L C 2.676 179.708 176.870 0.270 0.000 1.071 1805 L CA 2.047 56.929 54.840 0.070 0.000 0.749 1805 L CB -0.550 41.435 42.059 -0.122 0.000 0.890 1805 L HN 0.615 nan 8.230 nan 0.000 0.431 1806 E N 0.646 120.958 120.200 0.188 0.000 2.058 1806 E HA -0.274 4.061 4.350 -0.025 0.000 0.194 1806 E C 2.137 178.873 176.600 0.227 0.000 0.997 1806 E CA 1.488 57.989 56.400 0.168 0.000 0.801 1806 E CB -0.040 29.724 29.700 0.107 0.000 0.746 1806 E HN 0.456 nan 8.360 nan 0.000 0.450 1807 A N 0.151 123.160 122.820 0.314 0.000 2.066 1807 A HA -0.104 4.200 4.320 -0.025 0.000 0.218 1807 A C 1.859 179.755 177.584 0.519 0.000 1.157 1807 A CA 0.751 53.029 52.037 0.400 0.000 0.670 1807 A CB -0.655 18.625 19.000 0.467 0.000 0.804 1807 A HN 0.477 nan 8.150 nan 0.000 0.453 1808 F N 0.627 120.780 119.950 0.339 0.000 2.146 1808 F HA -0.015 4.497 4.527 -0.025 0.000 0.298 1808 F C 1.902 177.724 175.800 0.037 0.000 1.096 1808 F CA 1.503 59.497 58.000 -0.010 0.000 1.275 1808 F CB 0.012 39.141 39.000 0.216 0.000 1.008 1808 F HN -0.002 nan 8.300 nan 0.000 0.480 1809 K N 0.361 120.820 120.400 0.098 0.000 2.504 1809 K HA -0.086 4.219 4.320 -0.025 0.000 0.195 1809 K C 2.108 178.664 176.600 -0.074 0.000 1.036 1809 K CA 0.463 56.714 56.287 -0.061 0.000 0.984 1809 K CB -0.307 32.225 32.500 0.054 0.000 0.788 1809 K HN 0.322 nan 8.250 nan 0.000 0.488 1810 R N -0.688 119.818 120.500 0.009 0.000 2.210 1810 R HA -0.005 4.320 4.340 -0.025 0.000 0.203 1810 R C 1.858 178.184 176.300 0.045 0.000 1.010 1810 R CA 0.234 56.355 56.100 0.036 0.000 1.008 1810 R CB -0.007 30.354 30.300 0.101 0.000 0.923 1810 R HN 0.026 nan 8.270 nan 0.000 0.469 1811 F N 0.360 120.190 119.950 -0.200 0.000 2.187 1811 F HA 0.160 4.672 4.527 -0.025 0.000 0.295 1811 F C 1.852 177.438 175.800 -0.356 0.000 1.091 1811 F CA 1.509 59.345 58.000 -0.272 0.000 1.308 1811 F CB -0.713 38.002 39.000 -0.476 0.000 1.030 1811 F HN -0.006 nan 8.300 nan 0.000 0.487 1812 G N -0.992 107.478 108.800 -0.550 0.000 2.421 1812 G HA2 -0.296 3.649 3.960 -0.025 0.000 0.216 1812 G HA3 -0.296 3.649 3.960 -0.025 0.000 0.216 1812 G C 1.853 176.540 174.900 -0.356 0.000 1.171 1812 G CA 1.011 45.774 45.100 -0.562 0.000 0.775 1812 G HN 0.440 nan 8.290 nan 0.000 0.543 1813 S N 0.032 115.593 115.700 -0.231 0.000 2.406 1813 S HA -0.072 4.383 4.470 -0.025 0.000 0.228 1813 S C 2.273 176.794 174.600 -0.132 0.000 1.020 1813 S CA 1.876 59.986 58.200 -0.150 0.000 0.965 1813 S CB -0.194 62.952 63.200 -0.089 0.000 0.798 1813 S HN 0.326 nan 8.310 nan 0.000 0.488 1814 K N 1.217 121.544 120.400 -0.122 0.000 2.155 1814 K HA 0.181 4.486 4.320 -0.025 0.000 0.203 1814 K C 1.750 178.274 176.600 -0.128 0.000 1.052 1814 K CA 1.142 57.384 56.287 -0.076 0.000 0.948 1814 K CB -0.516 31.989 32.500 0.009 0.000 0.728 1814 K HN 0.425 nan 8.250 nan 0.000 0.448 1815 L N 0.010 121.085 121.223 -0.248 0.000 2.179 1815 L HA -0.059 4.266 4.340 -0.025 0.000 0.208 1815 L C 1.995 178.714 176.870 -0.251 0.000 1.096 1815 L CA 1.243 55.910 54.840 -0.287 0.000 0.779 1815 L CB -0.480 41.300 42.059 -0.466 0.000 0.922 1815 L HN 0.143 nan 8.230 nan 0.000 0.443 1816 T N -0.359 114.057 114.554 -0.230 0.000 2.833 1816 T HA -0.110 4.225 4.350 -0.025 0.000 0.269 1816 T C 1.847 176.462 174.700 -0.142 0.000 1.054 1816 T CA 1.323 63.307 62.100 -0.194 0.000 1.135 1816 T CB -0.356 68.415 68.868 -0.162 0.000 0.869 1816 T HN 0.559 nan 8.240 nan 0.000 0.466 1817 G N 1.197 109.931 108.800 -0.109 0.000 2.394 1817 G HA2 -0.075 3.870 3.960 -0.025 0.000 0.215 1817 G HA3 -0.075 3.870 3.960 -0.025 0.000 0.215 1817 G C 1.499 176.365 174.900 -0.056 0.000 1.165 1817 G CA 0.300 45.359 45.100 -0.067 0.000 0.784 1817 G HN 0.488 nan 8.290 nan 0.000 0.535 1818 I N 0.723 121.254 120.570 -0.066 0.000 2.286 1818 I HA -0.133 4.022 4.170 -0.025 0.000 0.248 1818 I C 2.700 178.778 176.117 -0.063 0.000 1.115 1818 I CA 1.064 62.340 61.300 -0.040 0.000 1.392 1818 I CB -0.235 37.746 38.000 -0.032 0.000 1.065 1818 I HN 0.254 nan 8.210 nan 0.000 0.418 1819 E N 0.961 121.068 120.200 -0.155 0.000 2.085 1819 E HA -0.181 4.154 4.350 -0.025 0.000 0.194 1819 E C 2.359 178.935 176.600 -0.040 0.000 0.994 1819 E CA 1.274 57.542 56.400 -0.220 0.000 0.801 1819 E CB -0.416 28.994 29.700 -0.484 0.000 0.743 1819 E HN 0.612 nan 8.360 nan 0.000 0.453 1820 G N 1.717 110.491 108.800 -0.044 0.000 2.491 1820 G HA2 -0.322 3.623 3.960 -0.025 0.000 0.218 1820 G HA3 -0.322 3.623 3.960 -0.025 0.000 0.218 1820 G C 1.495 176.407 174.900 0.020 0.000 1.180 1820 G CA 1.014 46.112 45.100 -0.003 0.000 0.774 1820 G HN 0.120 nan 8.290 nan 0.000 0.562 1821 K N -0.266 120.143 120.400 0.016 0.000 2.152 1821 K HA 0.029 4.334 4.320 -0.025 0.000 0.206 1821 K C 2.437 179.070 176.600 0.055 0.000 1.048 1821 K CA 0.817 57.124 56.287 0.032 0.000 0.933 1821 K CB -0.215 32.304 32.500 0.031 0.000 0.721 1821 K HN 0.358 nan 8.250 nan 0.000 0.447 1822 I N 1.057 121.670 120.570 0.071 0.000 2.179 1822 I HA -0.327 3.828 4.170 -0.025 0.000 0.242 1822 I C 1.674 177.854 176.117 0.105 0.000 1.088 1822 I CA 1.439 62.804 61.300 0.108 0.000 1.357 1822 I CB -0.332 37.750 38.000 0.137 0.000 1.051 1822 I HN 0.289 nan 8.210 nan 0.000 0.409 1823 N N 0.837 119.597 118.700 0.099 0.000 2.025 1823 N HA -0.211 4.514 4.740 -0.025 0.000 0.194 1823 N C 1.920 177.465 175.510 0.059 0.000 1.044 1823 N CA 1.393 54.488 53.050 0.075 0.000 0.851 1823 N CB -0.284 38.244 38.487 0.067 0.000 1.036 1823 N HN 0.327 nan 8.380 nan 0.000 0.422 1824 A N 1.120 123.970 122.820 0.050 0.000 2.070 1824 A HA -0.088 4.217 4.320 -0.025 0.000 0.220 1824 A C 2.104 179.716 177.584 0.046 0.000 1.159 1824 A CA 1.145 53.207 52.037 0.040 0.000 0.656 1824 A CB -0.249 18.770 19.000 0.031 0.000 0.800 1824 A HN 0.238 nan 8.150 nan 0.000 0.453 1825 R N -0.872 119.663 120.500 0.058 0.000 2.080 1825 R HA 0.012 4.337 4.340 -0.025 0.000 0.222 1825 R C 1.509 177.854 176.300 0.074 0.000 1.107 1825 R CA 0.857 56.995 56.100 0.064 0.000 0.980 1825 R CB -0.250 30.095 30.300 0.074 0.000 0.879 1825 R HN 0.399 nan 8.270 nan 0.000 0.439 1826 N N 0.408 119.160 118.700 0.088 0.000 2.430 1826 N HA -0.083 4.642 4.740 -0.025 0.000 0.186 1826 N C 1.036 176.589 175.510 0.073 0.000 1.032 1826 N CA 1.194 54.301 53.050 0.095 0.000 0.893 1826 N CB 0.061 38.606 38.487 0.097 0.000 0.957 1826 N HN 0.070 nan 8.380 nan 0.000 0.442 1827 S N -0.450 115.285 115.700 0.057 0.000 2.517 1827 S HA -0.000 4.455 4.470 -0.025 0.000 0.214 1827 S C 0.263 174.888 174.600 0.041 0.000 0.991 1827 S CA -0.385 57.841 58.200 0.045 0.000 0.906 1827 S CB 0.404 63.626 63.200 0.036 0.000 0.789 1827 S HN 0.244 nan 8.310 nan 0.000 0.513 1828 D N 2.933 123.359 120.400 0.044 0.000 2.325 1828 D HA 0.148 4.773 4.640 -0.025 0.000 0.251 1828 D C -1.491 174.832 176.300 0.038 0.000 1.196 1828 D CA -2.111 51.911 54.000 0.037 0.000 0.866 1828 D CB 1.310 42.132 40.800 0.037 0.000 1.101 1828 D HN 0.034 nan 8.370 nan 0.000 0.476 1829 P HA -0.124 nan 4.420 nan 0.000 0.228 1829 P C 1.066 178.384 177.300 0.029 0.000 1.151 1829 P CA 0.505 63.623 63.100 0.031 0.000 0.770 1829 P CB 0.359 32.074 31.700 0.026 0.000 0.786 1830 S N -0.909 114.807 115.700 0.027 0.000 2.470 1830 S HA 0.003 4.458 4.470 -0.025 0.000 0.225 1830 S C 0.992 175.608 174.600 0.026 0.000 1.006 1830 S CA 0.011 58.225 58.200 0.024 0.000 0.934 1830 S CB -0.537 62.676 63.200 0.021 0.000 0.778 1830 S HN -0.079 nan 8.310 nan 0.000 0.517 1831 L N 3.558 124.801 121.223 0.034 0.000 2.512 1831 L HA 0.483 4.808 4.340 -0.025 0.000 0.247 1831 L C 1.276 178.174 176.870 0.046 0.000 1.204 1831 L CA -0.071 54.793 54.840 0.039 0.000 1.153 1831 L CB 0.334 42.422 42.059 0.048 0.000 1.415 1831 L HN 0.136 nan 8.230 nan 0.000 0.406 1832 R N 0.503 121.025 120.500 0.036 0.000 2.120 1832 R HA -0.020 4.305 4.340 -0.025 0.000 0.234 1832 R C 0.885 177.214 176.300 0.048 0.000 1.123 1832 R CA 0.684 56.808 56.100 0.040 0.000 0.975 1832 R CB -0.038 30.279 30.300 0.029 0.000 0.866 1832 R HN 0.496 nan 8.270 nan 0.000 0.446 1833 N N 0.690 119.412 118.700 0.037 0.000 2.521 1833 N HA -0.017 4.708 4.740 -0.025 0.000 0.188 1833 N C 1.103 176.656 175.510 0.071 0.000 1.146 1833 N CA 0.423 53.494 53.050 0.035 0.000 0.893 1833 N CB 0.081 38.564 38.487 -0.005 0.000 0.975 1833 N HN 0.249 nan 8.380 nan 0.000 0.451 1834 R N -0.959 119.601 120.500 0.100 0.000 2.308 1834 R HA 0.128 4.453 4.340 -0.025 0.000 0.202 1834 R C 1.215 177.641 176.300 0.210 0.000 0.898 1834 R CA 1.000 57.198 56.100 0.164 0.000 1.046 1834 R CB 0.400 30.788 30.300 0.148 0.000 1.026 1834 R HN 0.305 nan 8.270 nan 0.000 0.512 1835 T N -3.410 111.237 114.554 0.155 0.000 3.176 1835 T HA 0.296 4.631 4.350 -0.025 0.000 0.259 1835 T C 1.058 175.834 174.700 0.125 0.000 0.978 1835 T CA 0.361 62.544 62.100 0.138 0.000 1.050 1835 T CB 0.361 69.287 68.868 0.097 0.000 1.136 1835 T HN 0.289 nan 8.240 nan 0.000 0.465 1836 G N 2.602 111.464 108.800 0.104 0.000 2.915 1836 G HA2 -0.091 3.854 3.960 -0.025 0.000 0.337 1836 G HA3 -0.091 3.854 3.960 -0.025 0.000 0.337 1836 G C -1.980 172.964 174.900 0.074 0.000 1.477 1836 G CA -0.321 44.835 45.100 0.093 0.000 0.916 1836 G HN 0.313 nan 8.290 nan 0.000 0.550 1837 P HA -0.055 nan 4.420 nan 0.000 0.220 1837 P C 1.865 179.189 177.300 0.041 0.000 1.144 1837 P CA 1.959 65.090 63.100 0.051 0.000 0.800 1837 P CB -0.078 31.654 31.700 0.054 0.000 0.772 1838 V N -4.730 115.210 119.914 0.044 0.000 3.623 1838 V HA 0.048 4.153 4.120 -0.025 0.000 0.271 1838 V C 0.243 176.337 176.094 -0.001 0.000 1.248 1838 V CA -0.047 62.261 62.300 0.013 0.000 1.156 1838 V CB -1.368 30.456 31.823 0.002 0.000 0.870 1838 V HN 0.063 nan 8.190 nan 0.000 0.453 1839 Q N 0.233 120.050 119.800 0.028 0.000 2.439 1839 Q HA -0.211 4.114 4.340 -0.025 0.000 0.361 1839 Q C -0.599 175.418 176.000 0.028 0.000 1.408 1839 Q CA 0.883 56.707 55.803 0.035 0.000 1.052 1839 Q CB -1.405 27.347 28.738 0.024 0.000 1.233 1839 Q HN 0.679 nan 8.270 nan 0.000 0.347 1840 L N 1.440 122.693 121.223 0.051 0.000 2.442 1840 L HA 0.447 4.772 4.340 -0.025 0.000 0.261 1840 L C -2.473 174.510 176.870 0.188 0.000 1.000 1840 L CA -1.649 53.209 54.840 0.031 0.000 0.882 1840 L CB 1.669 43.624 42.059 -0.172 0.000 1.207 1840 L HN -0.085 nan 8.230 nan 0.000 0.443 1841 P HA -0.097 nan 4.420 nan 0.000 0.261 1841 P C -1.246 176.244 177.300 0.316 0.000 1.173 1841 P CA 0.359 63.593 63.100 0.224 0.000 0.760 1841 P CB 0.017 31.799 31.700 0.137 0.000 0.783 1842 Y N 3.650 124.061 120.300 0.185 0.000 2.576 1842 Y HA 0.054 4.589 4.550 -0.025 0.000 0.348 1842 Y C 1.095 176.985 175.900 -0.016 0.000 1.212 1842 Y CA 0.501 58.670 58.100 0.115 0.000 1.683 1842 Y CB -0.518 38.027 38.460 0.141 0.000 1.484 1842 Y HN 0.322 nan 8.280 nan 0.000 0.477 1843 T N 1.117 115.379 114.554 -0.488 0.000 3.145 1843 T HA 0.119 4.454 4.350 -0.025 0.000 0.255 1843 T C 1.599 175.915 174.700 -0.639 0.000 1.039 1843 T CA -0.064 61.766 62.100 -0.449 0.000 0.928 1843 T CB -0.119 68.538 68.868 -0.351 0.000 1.029 1843 T HN 0.607 nan 8.240 nan 0.000 0.554 1844 L N 0.146 120.731 121.223 -1.063 0.000 2.056 1844 L HA 0.175 4.500 4.340 -0.025 0.000 0.207 1844 L C 1.737 178.455 176.870 -0.254 0.000 1.078 1844 L CA 1.202 55.621 54.840 -0.701 0.000 0.749 1844 L CB -0.289 41.321 42.059 -0.749 0.000 0.901 1844 L HN 0.331 nan 8.230 nan 0.000 0.433 1845 L N -0.378 120.753 121.223 -0.153 0.000 2.851 1845 L HA 0.098 4.423 4.340 -0.025 0.000 0.237 1845 L C 0.237 177.142 176.870 0.057 0.000 1.257 1845 L CA -0.241 54.633 54.840 0.057 0.000 1.061 1845 L CB -0.415 41.780 42.059 0.227 0.000 1.372 1845 L HN 0.212 nan 8.230 nan 0.000 0.493 1846 H N 1.679 120.683 119.070 -0.110 0.000 2.556 1846 H HA 0.202 4.742 4.556 -0.025 0.000 0.310 1846 H C 0.776 176.010 175.328 -0.157 0.000 1.057 1846 H CA -0.583 55.394 56.048 -0.118 0.000 1.264 1846 H CB 1.093 30.770 29.762 -0.141 0.000 1.404 1846 H HN 0.277 nan 8.280 nan 0.000 0.462 1847 R N 2.915 123.258 120.500 -0.261 0.000 2.093 1847 R HA 0.033 4.358 4.340 -0.025 0.000 0.224 1847 R C 0.255 176.350 176.300 -0.342 0.000 1.101 1847 R CA -0.031 55.939 56.100 -0.217 0.000 0.979 1847 R CB -0.362 29.814 30.300 -0.207 0.000 0.877 1847 R HN 0.244 nan 8.270 nan 0.000 0.441 1848 S N 0.543 116.000 115.700 -0.405 0.000 2.586 1848 S HA 0.417 4.872 4.470 -0.025 0.000 0.274 1848 S C -0.514 173.807 174.600 -0.464 0.000 1.281 1848 S CA -0.391 57.471 58.200 -0.563 0.000 1.035 1848 S CB 1.366 64.329 63.200 -0.395 0.000 0.962 1848 S HN 0.422 nan 8.310 nan 0.000 0.512 1849 S N 1.194 116.370 115.700 -0.872 0.000 2.596 1849 S HA 0.459 4.914 4.470 -0.025 0.000 0.270 1849 S C -1.492 172.843 174.600 -0.442 0.000 1.155 1849 S CA -0.844 57.010 58.200 -0.577 0.000 0.827 1849 S CB 0.962 63.790 63.200 -0.619 0.000 1.130 1849 S HN 0.746 nan 8.310 nan 0.000 0.467 1850 E N 1.587 121.680 120.200 -0.179 0.000 2.302 1850 E HA 0.348 4.682 4.350 -0.025 0.000 0.255 1850 E C -0.196 176.440 176.600 0.061 0.000 1.099 1850 E CA -0.674 55.698 56.400 -0.046 0.000 0.929 1850 E CB 0.054 29.742 29.700 -0.021 0.000 1.203 1850 E HN 0.810 nan 8.360 nan 0.000 0.459 1851 E N -0.278 119.979 120.200 0.096 0.000 2.408 1851 E HA 0.345 4.680 4.350 -0.025 0.000 0.259 1851 E C 0.776 177.463 176.600 0.145 0.000 1.110 1851 E CA -0.154 56.331 56.400 0.142 0.000 0.929 1851 E CB 0.128 29.884 29.700 0.093 0.000 0.971 1851 E HN 0.836 nan 8.360 nan 0.000 0.438 1852 G N 1.489 110.379 108.800 0.151 0.000 2.539 1852 G HA2 -0.331 3.614 3.960 -0.025 0.000 0.256 1852 G HA3 -0.331 3.614 3.960 -0.025 0.000 0.256 1852 G C 0.471 175.455 174.900 0.140 0.000 1.233 1852 G CA 0.103 45.273 45.100 0.116 0.000 0.936 1852 G HN 0.840 nan 8.290 nan 0.000 0.571 1853 L N 1.506 122.812 121.223 0.137 0.000 2.772 1853 L HA 0.177 4.502 4.340 -0.025 0.000 0.243 1853 L C 2.048 179.097 176.870 0.298 0.000 1.187 1853 L CA 1.606 56.572 54.840 0.209 0.000 0.844 1853 L CB -2.580 39.585 42.059 0.176 0.000 0.985 1853 L HN 1.103 nan 8.230 nan 0.000 0.459 1854 T N -3.183 111.503 114.554 0.221 0.000 2.934 1854 T HA 0.026 4.361 4.350 -0.025 0.000 0.306 1854 T C 0.302 175.109 174.700 0.179 0.000 1.042 1854 T CA -0.329 61.881 62.100 0.184 0.000 1.145 1854 T CB 0.244 69.190 68.868 0.130 0.000 0.982 1854 T HN 0.198 nan 8.240 nan 0.000 0.544 1855 F N 3.515 123.393 119.950 -0.119 0.000 2.701 1855 F HA 0.319 4.831 4.527 -0.025 0.000 0.295 1855 F C 0.602 176.328 175.800 -0.124 0.000 1.165 1855 F CA -1.268 56.589 58.000 -0.239 0.000 1.399 1855 F CB -0.632 38.066 39.000 -0.503 0.000 0.996 1855 F HN 0.788 nan 8.300 nan 0.000 0.513 1856 K N -0.677 119.667 120.400 -0.093 0.000 2.318 1856 K HA 0.808 5.113 4.320 -0.025 0.000 0.265 1856 K C -0.404 176.108 176.600 -0.146 0.000 1.055 1856 K CA -0.806 55.364 56.287 -0.195 0.000 0.896 1856 K CB 1.441 33.789 32.500 -0.254 0.000 1.479 1856 K HN 0.122 nan 8.250 nan 0.000 0.449 1857 G N 0.421 109.120 108.800 -0.168 0.000 3.225 1857 G HA2 0.025 3.970 3.960 -0.025 0.000 0.686 1857 G HA3 0.025 3.970 3.960 -0.025 0.000 0.686 1857 G C -1.019 173.814 174.900 -0.111 0.000 1.105 1857 G CA -0.734 44.192 45.100 -0.290 0.000 0.831 1857 G HN 0.490 nan 8.290 nan 0.000 0.578 1858 I N 4.213 124.798 120.570 0.026 0.000 2.428 1858 I HA 0.239 4.394 4.170 -0.025 0.000 0.279 1858 I C -2.126 174.092 176.117 0.168 0.000 1.040 1858 I CA -2.147 59.219 61.300 0.110 0.000 1.171 1858 I CB 2.106 40.142 38.000 0.060 0.000 1.312 1858 I HN 0.191 nan 8.210 nan 0.000 0.470 1859 P HA 0.150 nan 4.420 nan 0.000 0.272 1859 P C 0.339 177.643 177.300 0.005 0.000 1.240 1859 P CA -0.231 62.837 63.100 -0.052 0.000 0.791 1859 P CB 0.811 32.523 31.700 0.021 0.000 0.978 1860 N N -0.710 117.942 118.700 -0.081 0.000 2.106 1860 N HA -0.068 4.657 4.740 -0.025 0.000 0.188 1860 N C 0.950 176.492 175.510 0.053 0.000 1.029 1860 N CA 1.284 54.323 53.050 -0.018 0.000 0.848 1860 N CB -0.388 37.961 38.487 -0.232 0.000 1.007 1860 N HN 0.546 nan 8.380 nan 0.000 0.423 1861 S N -0.174 115.496 115.700 -0.049 0.000 2.713 1861 S HA 0.483 4.938 4.470 -0.025 0.000 0.296 1861 S C 0.170 174.690 174.600 -0.133 0.000 1.114 1861 S CA -0.767 57.403 58.200 -0.050 0.000 0.997 1861 S CB 1.172 64.329 63.200 -0.072 0.000 1.249 1861 S HN 0.006 nan 8.310 nan 0.000 0.534 1862 I N 2.800 123.226 120.570 -0.239 0.000 2.268 1862 I HA 0.216 4.371 4.170 -0.025 0.000 0.290 1862 I C 0.905 176.867 176.117 -0.258 0.000 1.125 1862 I CA -0.196 60.754 61.300 -0.583 0.000 1.236 1862 I CB -0.191 37.475 38.000 -0.558 0.000 1.469 1862 I HN 0.853 nan 8.210 nan 0.000 0.512 1863 S N 4.088 119.706 115.700 -0.137 0.000 2.503 1863 S HA 0.245 4.700 4.470 -0.025 0.000 0.215 1863 S C 0.403 175.098 174.600 0.159 0.000 1.003 1863 S CA -0.040 58.180 58.200 0.033 0.000 0.910 1863 S CB 0.513 63.738 63.200 0.042 0.000 0.790 1863 S HN 0.489 nan 8.310 nan 0.000 0.514 1864 I N 0.000 120.713 120.570 0.238 0.000 2.984 1864 I HA 0.000 4.155 4.170 -0.025 0.000 0.288 1864 I CA 0.000 61.508 61.300 0.347 0.000 1.566 1864 I CB 0.000 38.173 38.000 0.289 0.000 1.214 1864 I HN 0.000 nan 8.210 nan 0.000 0.494