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 2o7c_1_C DATA FIRST_RESID 1001 DATA SEQUENCE MHGSNKLPGF ATRAIHHGYD PQDHGGALVP PVYQTATFTF PTVEYGAACF DATA SEQUENCE AGEQAGHFYS RISNPTLNLL EARMASLEGG EAGLALASGM GAITSTLWTL DATA SEQUENCE LRPGDEVLLG NTLYGCTFAF LHHGIGEFGV KLRHVDMADL QALEAAMTPA DATA SEQUENCE TRVIYFESPA NPNMHMADIA GVAKIARKHG ATVVVDNTYC TPYLQRPLEL DATA SEQUENCE GADLVVHSAT XYLSGHGDIT AGIVVGSQAL VDRIRLQGLK DMTGAVLSPH DATA SEQUENCE DAALLMRGIK TLNLRMDRHC ANAQVLAEFL ARQPQVELIH YPGLASFPQY DATA SEQUENCE TLARQQMSQP GGMIAFELKG GIGAGRRFMN ALQLFSRAVS LGDAESLAQH DATA SEQUENCE PASMTHSSYT PEERAHYGIS EGLVRLSVGL EDIDDLLADV QQALKASA VARS RESID RESNAME ATOMNAME SS_SHIFT SHIFT RC_SHIFT HM_SHIFT EF_SHIFT SIGMA FORMAT %4d %4s %4s %9.3f %9.3f %9.3f %9.3f %9.3f %9.3f 1001 M HA 0.000 nan 4.480 nan 0.000 0.227 1001 M C 0.000 176.371 176.300 0.118 0.000 1.140 1001 M CA 0.000 55.327 55.300 0.045 0.000 0.988 1001 M CB 0.000 32.601 32.600 0.002 0.000 1.302 1002 H N -0.272 118.738 119.070 -0.099 0.000 3.141 1002 H HA -0.230 4.326 4.556 -0.000 0.000 0.260 1002 H C 0.846 176.219 175.328 0.076 0.000 1.132 1002 H CA 1.761 57.766 56.048 -0.071 0.000 1.171 1002 H CB -0.589 29.130 29.762 -0.072 0.000 1.274 1002 H HN 1.156 nan 8.280 nan 0.000 0.329 1003 G N -1.452 107.470 108.800 0.204 0.000 2.698 1003 G HA2 -0.301 3.659 3.960 -0.000 0.000 0.200 1003 G HA3 -0.301 3.659 3.960 -0.000 0.000 0.200 1003 G C 0.548 175.653 174.900 0.342 0.000 2.083 1003 G CA 0.664 45.973 45.100 0.348 0.000 1.629 1003 G HN 0.428 nan 8.290 nan 0.000 0.565 1004 S N -0.055 115.862 115.700 0.361 0.000 2.582 1004 S HA 0.297 4.767 4.470 -0.000 0.000 0.159 1004 S C 1.492 176.162 174.600 0.118 0.000 0.918 1004 S CA 1.452 59.790 58.200 0.230 0.000 1.287 1004 S CB -0.514 62.846 63.200 0.265 0.000 0.667 1004 S HN 1.209 nan 8.310 nan 0.000 0.462 1005 N N 0.587 119.338 118.700 0.085 0.000 1.405 1005 N HA -0.303 4.437 4.740 -0.000 0.000 0.142 1005 N C 0.913 176.447 175.510 0.040 0.000 0.378 1005 N CA 2.411 55.488 53.050 0.045 0.000 1.141 1005 N CB -0.805 37.698 38.487 0.027 0.000 1.420 1005 N HN 0.419 nan 8.380 nan 0.000 0.427 1006 K N -0.553 119.869 120.400 0.036 0.000 2.916 1006 K HA 0.197 4.517 4.320 -0.000 0.000 0.183 1006 K C -0.198 176.426 176.600 0.040 0.000 1.138 1006 K CA 0.322 56.627 56.287 0.031 0.000 1.346 1006 K CB -0.123 32.391 32.500 0.024 0.000 1.866 1006 K HN 0.358 nan 8.250 nan 0.000 0.503 1007 L N 2.587 123.834 121.223 0.039 0.000 2.574 1007 L HA 0.374 4.714 4.340 -0.000 0.000 0.258 1007 L C -2.443 174.456 176.870 0.049 0.000 1.520 1007 L CA -1.590 53.275 54.840 0.042 0.000 0.775 1007 L CB 0.275 42.355 42.059 0.036 0.000 1.028 1007 L HN 0.294 nan 8.230 nan 0.000 0.516 1008 P HA 0.168 nan 4.420 nan 0.000 0.268 1008 P C 0.534 177.879 177.300 0.074 0.000 1.208 1008 P CA 0.102 63.241 63.100 0.065 0.000 0.777 1008 P CB 0.719 32.463 31.700 0.075 0.000 0.875 1009 G N 0.514 109.368 108.800 0.091 0.000 2.667 1009 G HA2 0.023 3.983 3.960 -0.000 0.000 0.250 1009 G HA3 0.023 3.983 3.960 -0.000 0.000 0.250 1009 G C 0.446 175.446 174.900 0.168 0.000 1.212 1009 G CA -0.477 44.703 45.100 0.132 0.000 0.874 1009 G HN 0.447 nan 8.290 nan 0.000 0.561 1010 F N 1.597 121.592 119.950 0.076 0.000 2.065 1010 F HA -0.167 4.360 4.527 -0.000 0.000 0.298 1010 F C 2.750 178.589 175.800 0.065 0.000 1.112 1010 F CA 2.477 60.528 58.000 0.085 0.000 1.212 1010 F CB -0.253 38.840 39.000 0.155 0.000 0.975 1010 F HN 0.398 nan 8.300 nan 0.000 0.476 1011 A N -0.671 122.357 122.820 0.346 0.000 1.908 1011 A HA -0.207 4.113 4.320 -0.000 0.000 0.218 1011 A C 2.181 179.823 177.584 0.096 0.000 1.181 1011 A CA 2.385 54.539 52.037 0.195 0.000 0.627 1011 A CB -1.459 17.631 19.000 0.150 0.000 0.818 1011 A HN 0.462 nan 8.150 nan 0.000 0.445 1012 T N -0.273 114.350 114.554 0.115 0.000 2.684 1012 T HA -0.161 4.189 4.350 -0.000 0.000 0.267 1012 T C 2.052 176.824 174.700 0.120 0.000 1.036 1012 T CA 1.662 63.847 62.100 0.142 0.000 1.148 1012 T CB -0.245 68.694 68.868 0.118 0.000 0.863 1012 T HN 0.531 nan 8.240 nan 0.000 0.436 1013 R N 0.885 121.401 120.500 0.027 0.000 2.115 1013 R HA 0.152 4.492 4.340 -0.000 0.000 0.226 1013 R C 2.778 179.027 176.300 -0.085 0.000 1.100 1013 R CA 1.003 57.098 56.100 -0.008 0.000 0.980 1013 R CB -0.385 29.841 30.300 -0.123 0.000 0.875 1013 R HN 0.348 nan 8.270 nan 0.000 0.445 1014 A N 1.259 123.956 122.820 -0.206 0.000 2.070 1014 A HA -0.125 4.195 4.320 -0.000 0.000 0.220 1014 A C 2.027 179.543 177.584 -0.112 0.000 1.159 1014 A CA 1.308 53.220 52.037 -0.208 0.000 0.656 1014 A CB -0.368 18.516 19.000 -0.194 0.000 0.800 1014 A HN 0.493 nan 8.150 nan 0.000 0.453 1015 I N -6.749 113.765 120.570 -0.092 0.000 4.139 1015 I HA 0.248 4.418 4.170 -0.000 0.000 0.320 1015 I C 1.606 177.555 176.117 -0.281 0.000 1.290 1015 I CA 0.547 61.735 61.300 -0.186 0.000 1.253 1015 I CB 0.178 38.041 38.000 -0.228 0.000 1.122 1015 I HN 0.165 nan 8.210 nan 0.000 0.421 1016 H N -0.828 118.194 119.070 -0.080 0.000 2.927 1016 H HA 0.210 4.766 4.556 -0.000 0.000 0.255 1016 H C -0.006 175.267 175.328 -0.093 0.000 0.974 1016 H CA -0.149 55.806 56.048 -0.155 0.000 1.199 1016 H CB -0.044 29.550 29.762 -0.280 0.000 1.447 1016 H HN 0.353 nan 8.280 nan 0.000 0.467 1017 H N 0.821 119.916 119.070 0.042 0.000 3.167 1017 H HA 0.089 4.645 4.556 -0.000 0.000 0.306 1017 H C 1.361 176.725 175.328 0.060 0.000 0.965 1017 H CA 1.691 57.761 56.048 0.037 0.000 1.408 1017 H CB 0.005 29.759 29.762 -0.015 0.000 1.406 1017 H HN 0.690 nan 8.280 nan 0.000 0.576 1018 G N 3.197 111.617 108.800 -0.632 0.000 2.199 1018 G HA2 -0.301 3.659 3.960 -0.000 0.000 0.254 1018 G HA3 -0.301 3.659 3.960 -0.000 0.000 0.254 1018 G C -0.327 174.578 174.900 0.008 0.000 0.982 1018 G CA 0.393 45.294 45.100 -0.333 0.000 0.632 1018 G HN 0.749 nan 8.290 nan 0.000 0.529 1019 Y N 1.315 121.564 120.300 -0.084 0.000 2.361 1019 Y HA 0.611 5.161 4.550 -0.000 0.000 0.337 1019 Y C -1.319 174.659 175.900 0.131 0.000 0.965 1019 Y CA -1.560 56.532 58.100 -0.014 0.000 1.091 1019 Y CB 2.103 40.501 38.460 -0.103 0.000 1.182 1019 Y HN 0.057 nan 8.280 nan 0.000 0.450 1020 D N 8.269 128.456 120.400 -0.355 0.000 2.462 1020 D HA 0.364 5.004 4.640 -0.000 0.000 0.245 1020 D C -2.239 173.792 176.300 -0.448 0.000 1.122 1020 D CA -2.591 51.342 54.000 -0.111 0.000 0.864 1020 D CB 2.414 43.199 40.800 -0.026 0.000 1.098 1020 D HN 0.264 nan 8.370 nan 0.000 0.541 1021 P HA -0.199 nan 4.420 nan 0.000 0.217 1021 P C 1.293 178.577 177.300 -0.026 0.000 1.151 1021 P CA 1.118 64.123 63.100 -0.159 0.000 0.849 1021 P CB 0.279 32.031 31.700 0.088 0.000 0.787 1022 Q N -0.597 119.182 119.800 -0.036 0.000 2.234 1022 Q HA -0.196 4.144 4.340 -0.000 0.000 0.206 1022 Q C 0.906 176.867 176.000 -0.066 0.000 0.980 1022 Q CA 1.321 57.103 55.803 -0.034 0.000 0.869 1022 Q CB -0.322 28.386 28.738 -0.050 0.000 0.912 1022 Q HN 0.263 nan 8.270 nan 0.000 0.436 1023 D N -1.055 119.279 120.400 -0.110 0.000 2.349 1023 D HA -0.014 4.626 4.640 -0.000 0.000 0.215 1023 D C -0.197 175.776 176.300 -0.545 0.000 1.016 1023 D CA 0.623 54.445 54.000 -0.296 0.000 0.870 1023 D CB 0.250 40.834 40.800 -0.361 0.000 0.917 1023 D HN 0.348 nan 8.370 nan 0.000 0.524 1024 H N -1.210 117.848 119.070 -0.020 0.000 2.535 1024 H HA 0.423 4.979 4.556 -0.000 0.000 0.232 1024 H C 1.083 176.460 175.328 0.081 0.000 1.405 1024 H CA -0.309 55.789 56.048 0.083 0.000 1.224 1024 H CB 0.696 30.589 29.762 0.218 0.000 1.763 1024 H HN -0.033 nan 8.280 nan 0.000 0.529 1025 G N 0.334 109.192 108.800 0.097 0.000 2.203 1025 G HA2 -0.209 3.751 3.960 -0.000 0.000 0.263 1025 G HA3 -0.209 3.751 3.960 -0.000 0.000 0.263 1025 G C 1.348 176.297 174.900 0.081 0.000 1.012 1025 G CA 0.591 45.736 45.100 0.076 0.000 0.749 1025 G HN 1.334 nan 8.290 nan 0.000 0.512 1026 G N -1.445 107.408 108.800 0.088 0.000 2.168 1026 G HA2 0.120 4.080 3.960 -0.000 0.000 0.263 1026 G HA3 0.120 4.080 3.960 -0.000 0.000 0.263 1026 G C 0.899 175.871 174.900 0.120 0.000 0.977 1026 G CA 1.234 46.384 45.100 0.083 0.000 0.659 1026 G HN 2.365 nan 8.290 nan 0.000 0.533 1027 A N 0.436 123.355 122.820 0.166 0.000 2.522 1027 A HA 0.556 4.876 4.320 -0.000 0.000 0.256 1027 A C 1.518 179.244 177.584 0.236 0.000 1.086 1027 A CA 0.577 52.715 52.037 0.170 0.000 0.763 1027 A CB 0.260 19.364 19.000 0.174 0.000 1.024 1027 A HN 0.856 nan 8.150 nan 0.000 0.502 1028 L N 3.306 124.620 121.223 0.152 0.000 2.017 1028 L HA -0.048 4.292 4.340 -0.000 0.000 0.208 1028 L C 0.547 177.495 176.870 0.129 0.000 1.073 1028 L CA 1.658 56.593 54.840 0.157 0.000 0.745 1028 L CB -0.120 41.983 42.059 0.074 0.000 0.894 1028 L HN 0.498 nan 8.230 nan 0.000 0.432 1029 V N 1.231 121.150 119.914 0.008 0.000 2.439 1029 V HA 0.254 4.374 4.120 -0.000 0.000 0.282 1029 V C -2.136 173.821 176.094 -0.229 0.000 1.039 1029 V CA -1.502 60.710 62.300 -0.148 0.000 0.913 1029 V CB 0.946 32.696 31.823 -0.121 0.000 0.983 1029 V HN 0.179 nan 8.190 nan 0.000 0.460 1030 P HA 0.210 nan 4.420 nan 0.000 0.267 1030 P C -2.464 174.710 177.300 -0.210 0.000 1.205 1030 P CA -1.050 61.703 63.100 -0.577 0.000 0.765 1030 P CB -0.278 30.832 31.700 -0.984 0.000 0.828 1031 P HA -0.002 nan 4.420 nan 0.000 0.268 1031 P C -0.616 176.634 177.300 -0.082 0.000 1.205 1031 P CA 0.165 63.214 63.100 -0.085 0.000 0.771 1031 P CB 0.340 31.981 31.700 -0.098 0.000 0.858 1032 V N 4.070 123.918 119.914 -0.110 0.000 2.408 1032 V HA 0.035 4.155 4.120 -0.000 0.000 0.267 1032 V C 0.191 176.224 176.094 -0.101 0.000 1.047 1032 V CA -0.211 62.060 62.300 -0.048 0.000 0.937 1032 V CB -0.637 31.162 31.823 -0.041 0.000 0.999 1032 V HN 0.385 nan 8.190 nan 0.000 0.472 1033 Y N 3.195 123.478 120.300 -0.028 0.000 2.724 1033 Y HA 0.238 4.788 4.550 -0.000 0.000 0.354 1033 Y C 1.110 176.979 175.900 -0.051 0.000 1.270 1033 Y CA -0.153 57.934 58.100 -0.023 0.000 1.902 1033 Y CB -0.007 38.475 38.460 0.037 0.000 1.981 1033 Y HN 0.638 nan 8.280 nan 0.000 0.428 1034 Q N 1.965 121.757 119.800 -0.014 0.000 2.837 1034 Q HA 0.151 4.491 4.340 -0.000 0.000 0.235 1034 Q C -0.425 175.524 176.000 -0.085 0.000 1.348 1034 Q CA 0.087 55.872 55.803 -0.029 0.000 0.990 1034 Q CB 0.057 28.774 28.738 -0.035 0.000 1.570 1034 Q HN 0.405 nan 8.270 nan 0.000 0.575 1035 T N 0.167 114.652 114.554 -0.114 0.000 2.933 1035 T HA 0.684 5.034 4.350 -0.000 0.000 0.305 1035 T C 0.210 174.756 174.700 -0.256 0.000 1.092 1035 T CA 0.068 62.027 62.100 -0.236 0.000 1.008 1035 T CB 1.276 69.894 68.868 -0.417 0.000 1.102 1035 T HN 0.376 nan 8.240 nan 0.000 0.469 1036 A N 3.136 125.823 122.820 -0.222 0.000 1.903 1036 A HA 0.362 4.682 4.320 -0.000 0.000 0.213 1036 A C 1.299 178.769 177.584 -0.190 0.000 1.185 1036 A CA 0.915 52.818 52.037 -0.224 0.000 0.628 1036 A CB -0.381 18.532 19.000 -0.147 0.000 0.830 1036 A HN 0.696 nan 8.150 nan 0.000 0.446 1037 T N -1.400 113.076 114.554 -0.129 0.000 2.930 1037 T HA 0.631 4.981 4.350 -0.000 0.000 0.290 1037 T C -1.571 172.992 174.700 -0.228 0.000 1.052 1037 T CA -0.502 61.645 62.100 0.078 0.000 1.017 1037 T CB 0.577 69.585 68.868 0.232 0.000 1.137 1037 T HN 0.076 nan 8.240 nan 0.000 0.511 1038 F N 1.135 121.129 119.950 0.074 0.000 2.563 1038 F HA 0.566 5.093 4.527 -0.000 0.000 0.316 1038 F C 0.892 176.539 175.800 -0.255 0.000 1.076 1038 F CA -0.796 57.200 58.000 -0.007 0.000 0.921 1038 F CB 2.124 41.184 39.000 0.100 0.000 1.209 1038 F HN 0.580 nan 8.300 nan 0.000 0.462 1039 T N -1.002 113.478 114.554 -0.124 0.000 2.944 1039 T HA 0.772 5.122 4.350 -0.000 0.000 0.284 1039 T C -0.833 173.642 174.700 -0.375 0.000 1.010 1039 T CA -0.546 61.319 62.100 -0.393 0.000 1.025 1039 T CB 0.941 69.718 68.868 -0.152 0.000 1.079 1039 T HN 0.296 nan 8.240 nan 0.000 0.516 1040 F N 0.798 120.824 119.950 0.126 0.000 2.522 1040 F HA 0.472 4.999 4.527 -0.000 0.000 0.324 1040 F C -1.157 174.627 175.800 -0.026 0.000 1.077 1040 F CA -2.495 55.541 58.000 0.060 0.000 0.944 1040 F CB 1.689 40.812 39.000 0.204 0.000 1.175 1040 F HN 0.414 nan 8.300 nan 0.000 0.468 1041 P HA 0.028 nan 4.420 nan 0.000 0.225 1041 P C -0.028 177.315 177.300 0.071 0.000 1.156 1041 P CA 0.856 63.951 63.100 -0.008 0.000 0.787 1041 P CB 0.231 31.855 31.700 -0.125 0.000 0.802 1042 T N -4.132 110.510 114.554 0.147 0.000 2.843 1042 T HA 0.333 4.683 4.350 -0.000 0.000 0.302 1042 T C 0.933 175.744 174.700 0.184 0.000 1.232 1042 T CA -0.266 61.920 62.100 0.144 0.000 1.009 1042 T CB 1.695 70.629 68.868 0.111 0.000 1.254 1042 T HN -0.185 nan 8.240 nan 0.000 0.504 1043 V N -1.020 118.974 119.914 0.134 0.000 2.515 1043 V HA 0.006 4.126 4.120 -0.000 0.000 0.250 1043 V C 2.156 178.273 176.094 0.039 0.000 1.058 1043 V CA 1.565 63.933 62.300 0.114 0.000 1.064 1043 V CB -1.331 30.548 31.823 0.093 0.000 0.675 1043 V HN 0.858 nan 8.190 nan 0.000 0.461 1044 E N 0.128 120.354 120.200 0.044 0.000 2.077 1044 E HA -0.153 4.197 4.350 -0.000 0.000 0.193 1044 E C 1.972 178.548 176.600 -0.041 0.000 0.989 1044 E CA 1.768 58.172 56.400 0.006 0.000 0.800 1044 E CB -0.574 29.143 29.700 0.029 0.000 0.746 1044 E HN 0.813 nan 8.360 nan 0.000 0.452 1045 Y N 0.550 120.780 120.300 -0.117 0.000 2.242 1045 Y HA -0.105 4.445 4.550 -0.000 0.000 0.291 1045 Y C 2.179 177.802 175.900 -0.461 0.000 1.137 1045 Y CA 1.742 59.741 58.100 -0.169 0.000 1.181 1045 Y CB -0.525 37.912 38.460 -0.038 0.000 0.989 1045 Y HN 0.051 nan 8.280 nan 0.000 0.527 1046 G N -0.125 108.345 108.800 -0.550 0.000 2.433 1046 G HA2 -0.267 3.693 3.960 -0.000 0.000 0.216 1046 G HA3 -0.267 3.693 3.960 -0.000 0.000 0.216 1046 G C 1.854 176.037 174.900 -1.195 0.000 1.186 1046 G CA 1.001 45.098 45.100 -1.673 0.000 0.779 1046 G HN 0.577 nan 8.290 nan 0.000 0.543 1047 A N 1.306 123.903 122.820 -0.371 0.000 1.883 1047 A HA 0.164 4.484 4.320 -0.000 0.000 0.217 1047 A C 2.835 180.300 177.584 -0.199 0.000 1.186 1047 A CA 2.538 54.562 52.037 -0.022 0.000 0.624 1047 A CB -0.925 18.071 19.000 -0.007 0.000 0.822 1047 A HN 0.894 nan 8.150 nan 0.000 0.444 1048 A N -1.265 121.362 122.820 -0.321 0.000 1.940 1048 A HA -0.190 4.130 4.320 -0.000 0.000 0.219 1048 A C 2.298 179.642 177.584 -0.400 0.000 1.176 1048 A CA 1.744 53.591 52.037 -0.316 0.000 0.631 1048 A CB -1.241 17.556 19.000 -0.338 0.000 0.814 1048 A HN 0.610 nan 8.150 nan 0.000 0.446 1049 C N -1.748 117.160 119.300 -0.652 0.000 2.440 1049 C HA -0.015 4.445 4.460 -0.000 0.000 0.278 1049 C C 2.447 177.216 174.990 -0.368 0.000 1.295 1049 C CA 0.749 59.436 59.018 -0.552 0.000 1.738 1049 C CB -1.672 25.686 27.740 -0.638 0.000 1.987 1049 C HN 0.674 nan 8.230 nan 0.000 0.492 1050 F N 1.493 121.256 119.950 -0.311 0.000 2.113 1050 F HA -0.098 4.429 4.527 -0.000 0.000 0.297 1050 F C 2.576 178.282 175.800 -0.157 0.000 1.103 1050 F CA 1.180 58.988 58.000 -0.321 0.000 1.248 1050 F CB -0.659 38.106 39.000 -0.392 0.000 0.999 1050 F HN 0.131 nan 8.300 nan 0.000 0.475 1051 A N -0.015 122.818 122.820 0.021 0.000 2.172 1051 A HA 0.232 4.552 4.320 -0.000 0.000 0.216 1051 A C 2.054 179.624 177.584 -0.023 0.000 1.154 1051 A CA 1.147 53.180 52.037 -0.007 0.000 0.701 1051 A CB -1.273 17.707 19.000 -0.034 0.000 0.789 1051 A HN 0.685 nan 8.150 nan 0.000 0.465 1052 G N -0.968 107.805 108.800 -0.046 0.000 2.159 1052 G HA2 -0.280 3.680 3.960 -0.000 0.000 0.256 1052 G HA3 -0.280 3.680 3.960 -0.000 0.000 0.256 1052 G C 0.387 175.242 174.900 -0.076 0.000 0.977 1052 G CA 0.616 45.688 45.100 -0.046 0.000 0.652 1052 G HN 0.632 nan 8.290 nan 0.000 0.531 1053 E N -0.729 119.409 120.200 -0.102 0.000 2.489 1053 E HA 0.223 4.573 4.350 -0.000 0.000 0.193 1053 E C 0.856 177.373 176.600 -0.139 0.000 1.057 1053 E CA 0.626 56.965 56.400 -0.101 0.000 0.866 1053 E CB 0.313 29.958 29.700 -0.091 0.000 0.916 1053 E HN 0.499 nan 8.360 nan 0.000 0.500 1054 Q N 0.646 120.327 119.800 -0.199 0.000 2.323 1054 Q HA 0.471 4.811 4.340 -0.000 0.000 0.271 1054 Q C -1.563 174.298 176.000 -0.231 0.000 1.048 1054 Q CA -0.676 54.968 55.803 -0.266 0.000 0.792 1054 Q CB 1.725 30.155 28.738 -0.512 0.000 1.280 1054 Q HN 0.053 nan 8.270 nan 0.000 0.441 1055 A N 2.743 125.469 122.820 -0.157 0.000 2.376 1055 A HA 0.734 5.054 4.320 -0.000 0.000 0.298 1055 A C 0.176 177.702 177.584 -0.097 0.000 1.271 1055 A CA 0.705 52.668 52.037 -0.123 0.000 0.926 1055 A CB -0.417 18.544 19.000 -0.066 0.000 1.141 1055 A HN 0.895 nan 8.150 nan 0.000 0.539 1056 G N 1.380 110.075 108.800 -0.175 0.000 2.570 1056 G HA2 0.582 4.542 3.960 -0.000 0.000 0.310 1056 G HA3 0.582 4.542 3.960 -0.000 0.000 0.310 1056 G C -1.275 173.393 174.900 -0.386 0.000 1.266 1056 G CA -0.571 44.481 45.100 -0.079 0.000 0.825 1056 G HN 0.692 nan 8.290 nan 0.000 0.483 1057 H N -1.110 117.888 119.070 -0.120 0.000 2.946 1057 H HA 0.550 5.106 4.556 -0.000 0.000 0.365 1057 H C -0.331 175.012 175.328 0.025 0.000 1.197 1057 H CA -0.078 55.710 56.048 -0.434 0.000 1.131 1057 H CB 2.190 31.127 29.762 -1.376 0.000 1.849 1057 H HN 0.608 nan 8.280 nan 0.000 0.555 1058 F N -1.468 118.625 119.950 0.239 0.000 2.828 1058 F HA 0.321 4.848 4.527 -0.000 0.000 0.368 1058 F C -1.123 175.082 175.800 0.675 0.000 0.877 1058 F CA -0.387 57.924 58.000 0.518 0.000 1.071 1058 F CB 1.069 40.437 39.000 0.613 0.000 1.006 1058 F HN 0.295 nan 8.300 nan 0.000 0.598 1059 Y N 1.344 121.674 120.300 0.050 0.000 2.358 1059 Y HA 0.481 5.031 4.550 -0.000 0.000 0.324 1059 Y C 0.912 176.854 175.900 0.070 0.000 1.123 1059 Y CA -1.390 56.836 58.100 0.209 0.000 1.067 1059 Y CB 1.999 40.670 38.460 0.352 0.000 1.230 1059 Y HN 0.028 nan 8.280 nan 0.000 0.429 1060 S N 3.422 119.059 115.700 -0.104 0.000 2.419 1060 S HA -0.177 4.293 4.470 -0.000 0.000 0.235 1060 S C 2.007 176.537 174.600 -0.116 0.000 1.019 1060 S CA 1.614 59.775 58.200 -0.066 0.000 0.982 1060 S CB -0.101 63.060 63.200 -0.064 0.000 0.789 1060 S HN 0.752 nan 8.310 nan 0.000 0.490 1061 R N 0.355 120.737 120.500 -0.198 0.000 2.092 1061 R HA -0.042 4.298 4.340 -0.000 0.000 0.231 1061 R C 1.722 178.061 176.300 0.066 0.000 1.119 1061 R CA 1.213 57.309 56.100 -0.006 0.000 0.970 1061 R CB -0.185 30.198 30.300 0.139 0.000 0.864 1061 R HN 0.299 nan 8.270 nan 0.000 0.440 1062 I N -0.758 119.864 120.570 0.086 0.000 2.277 1062 I HA -0.003 4.167 4.170 -0.000 0.000 0.243 1062 I C 0.649 176.741 176.117 -0.042 0.000 1.094 1062 I CA 0.926 62.249 61.300 0.039 0.000 1.393 1062 I CB 0.202 38.204 38.000 0.003 0.000 1.078 1062 I HN 0.019 nan 8.210 nan 0.000 0.417 1063 S N -0.016 115.627 115.700 -0.095 0.000 2.560 1063 S HA 0.388 4.858 4.470 -0.000 0.000 0.283 1063 S C -1.393 173.227 174.600 0.033 0.000 1.141 1063 S CA -0.868 57.304 58.200 -0.047 0.000 0.902 1063 S CB 0.740 63.868 63.200 -0.121 0.000 1.104 1063 S HN 0.217 nan 8.310 nan 0.000 0.454 1064 N N 3.454 122.171 118.700 0.029 0.000 2.225 1064 N HA 0.483 5.223 4.740 -0.000 0.000 0.298 1064 N C -2.427 172.970 175.510 -0.188 0.000 1.076 1064 N CA -1.994 51.009 53.050 -0.078 0.000 0.792 1064 N CB 2.337 40.840 38.487 0.027 0.000 1.498 1064 N HN 0.285 nan 8.380 nan 0.000 0.474 1065 P HA -0.044 nan 4.420 nan 0.000 0.218 1065 P C 1.029 178.214 177.300 -0.192 0.000 1.148 1065 P CA 1.482 64.299 63.100 -0.472 0.000 0.822 1065 P CB 0.315 31.429 31.700 -0.977 0.000 0.784 1066 T N -0.549 113.953 114.554 -0.087 0.000 2.812 1066 T HA -0.047 4.303 4.350 -0.000 0.000 0.264 1066 T C 1.628 176.313 174.700 -0.026 0.000 1.042 1066 T CA 0.939 63.035 62.100 -0.006 0.000 1.140 1066 T CB -0.759 68.146 68.868 0.061 0.000 0.870 1066 T HN -0.050 nan 8.240 nan 0.000 0.445 1067 L N 1.868 123.081 121.223 -0.017 0.000 2.083 1067 L HA -0.032 4.308 4.340 -0.000 0.000 0.209 1067 L C 2.257 179.125 176.870 -0.003 0.000 1.083 1067 L CA 1.324 56.160 54.840 -0.008 0.000 0.752 1067 L CB -0.773 41.287 42.059 0.002 0.000 0.899 1067 L HN 0.170 nan 8.230 nan 0.000 0.433 1068 N N -0.640 118.060 118.700 -0.002 0.000 2.166 1068 N HA -0.179 4.561 4.740 -0.000 0.000 0.186 1068 N C 1.788 177.307 175.510 0.016 0.000 1.019 1068 N CA 1.054 54.114 53.050 0.017 0.000 0.856 1068 N CB -0.411 38.099 38.487 0.037 0.000 0.993 1068 N HN 0.199 nan 8.380 nan 0.000 0.426 1069 L N 0.767 121.989 121.223 -0.001 0.000 2.056 1069 L HA 0.000 4.340 4.340 -0.000 0.000 0.207 1069 L C 1.988 178.858 176.870 0.000 0.000 1.078 1069 L CA 1.192 56.032 54.840 -0.001 0.000 0.749 1069 L CB -0.890 41.145 42.059 -0.040 0.000 0.901 1069 L HN 0.138 nan 8.230 nan 0.000 0.433 1070 L N -0.364 120.848 121.223 -0.018 0.000 2.046 1070 L HA -0.178 4.162 4.340 -0.000 0.000 0.208 1070 L C 2.268 179.140 176.870 0.003 0.000 1.077 1070 L CA 1.822 56.650 54.840 -0.020 0.000 0.747 1070 L CB -0.792 41.249 42.059 -0.029 0.000 0.896 1070 L HN 0.395 nan 8.230 nan 0.000 0.432 1071 E N 0.033 120.241 120.200 0.014 0.000 2.058 1071 E HA -0.221 4.129 4.350 -0.000 0.000 0.194 1071 E C 2.213 178.838 176.600 0.043 0.000 0.997 1071 E CA 1.376 57.791 56.400 0.026 0.000 0.801 1071 E CB -0.412 29.305 29.700 0.028 0.000 0.746 1071 E HN 0.689 nan 8.360 nan 0.000 0.450 1072 A N 1.148 124.007 122.820 0.066 0.000 1.930 1072 A HA -0.191 4.129 4.320 -0.000 0.000 0.217 1072 A C 2.083 179.774 177.584 0.179 0.000 1.175 1072 A CA 1.519 53.629 52.037 0.122 0.000 0.627 1072 A CB -0.395 18.687 19.000 0.136 0.000 0.815 1072 A HN 0.066 nan 8.150 nan 0.000 0.443 1073 R N -1.445 119.151 120.500 0.160 0.000 2.066 1073 R HA -0.078 4.262 4.340 -0.000 0.000 0.232 1073 R C 2.092 178.371 176.300 -0.034 0.000 1.131 1073 R CA 1.646 57.823 56.100 0.128 0.000 0.955 1073 R CB -0.247 30.086 30.300 0.055 0.000 0.851 1073 R HN 0.360 nan 8.270 nan 0.000 0.432 1074 M N 0.093 119.678 119.600 -0.025 0.000 2.213 1074 M HA -0.066 4.414 4.480 -0.000 0.000 0.263 1074 M C 2.263 178.545 176.300 -0.029 0.000 1.062 1074 M CA 1.577 56.851 55.300 -0.044 0.000 1.105 1074 M CB -0.907 31.678 32.600 -0.026 0.000 1.385 1074 M HN 0.307 nan 8.290 nan 0.000 0.417 1075 A N -1.047 121.765 122.820 -0.013 0.000 1.898 1075 A HA -0.139 4.181 4.320 -0.000 0.000 0.216 1075 A C 2.467 180.010 177.584 -0.069 0.000 1.181 1075 A CA 2.134 54.165 52.037 -0.009 0.000 0.620 1075 A CB -0.891 18.119 19.000 0.016 0.000 0.819 1075 A HN 0.481 nan 8.150 nan 0.000 0.442 1076 S N -0.364 115.229 115.700 -0.178 0.000 2.356 1076 S HA -0.095 4.375 4.470 -0.000 0.000 0.223 1076 S C 1.932 176.396 174.600 -0.226 0.000 1.032 1076 S CA 1.451 59.447 58.200 -0.340 0.000 1.005 1076 S CB -0.480 62.198 63.200 -0.870 0.000 0.867 1076 S HN 0.491 nan 8.310 nan 0.000 0.449 1077 L N 0.807 121.901 121.223 -0.214 0.000 2.141 1077 L HA 0.012 4.352 4.340 -0.000 0.000 0.209 1077 L C 2.466 179.375 176.870 0.065 0.000 1.094 1077 L CA 1.100 55.838 54.840 -0.170 0.000 0.763 1077 L CB -0.424 41.495 42.059 -0.233 0.000 0.908 1077 L HN 0.305 nan 8.230 nan 0.000 0.437 1078 E N -0.038 120.192 120.200 0.050 0.000 2.474 1078 E HA 0.041 4.391 4.350 -0.000 0.000 0.194 1078 E C 1.380 178.017 176.600 0.061 0.000 1.041 1078 E CA 0.696 57.155 56.400 0.098 0.000 0.874 1078 E CB 0.449 30.219 29.700 0.117 0.000 0.914 1078 E HN 0.478 nan 8.360 nan 0.000 0.498 1079 G N 1.176 109.991 108.800 0.024 0.000 2.147 1079 G HA2 -0.242 3.718 3.960 -0.000 0.000 0.244 1079 G HA3 -0.242 3.718 3.960 -0.000 0.000 0.244 1079 G C 0.549 175.457 174.900 0.013 0.000 1.005 1079 G CA 0.283 45.392 45.100 0.014 0.000 0.713 1079 G HN 0.479 nan 8.290 nan 0.000 0.515 1080 G N -1.460 107.348 108.800 0.013 0.000 2.552 1080 G HA2 0.640 4.600 3.960 -0.000 0.000 0.318 1080 G HA3 0.640 4.600 3.960 -0.000 0.000 0.318 1080 G C 0.512 175.421 174.900 0.015 0.000 1.240 1080 G CA 0.291 45.402 45.100 0.018 0.000 1.002 1080 G HN 0.246 nan 8.290 nan 0.000 0.493 1081 E N -0.779 119.434 120.200 0.021 0.000 2.122 1081 E HA 0.297 4.647 4.350 -0.000 0.000 0.190 1081 E C 0.979 177.596 176.600 0.030 0.000 0.977 1081 E CA 0.857 57.272 56.400 0.024 0.000 0.820 1081 E CB 0.321 30.035 29.700 0.024 0.000 0.770 1081 E HN 0.505 nan 8.360 nan 0.000 0.462 1082 A N 0.058 122.896 122.820 0.031 0.000 2.587 1082 A HA 0.718 5.038 4.320 -0.000 0.000 0.293 1082 A C -0.515 177.091 177.584 0.037 0.000 1.087 1082 A CA -0.220 51.838 52.037 0.034 0.000 0.692 1082 A CB 1.865 20.883 19.000 0.030 0.000 1.291 1082 A HN 0.143 nan 8.150 nan 0.000 0.407 1083 G N -0.923 107.901 108.800 0.039 0.000 2.605 1083 G HA2 0.717 4.677 3.960 -0.000 0.000 0.296 1083 G HA3 0.717 4.677 3.960 -0.000 0.000 0.296 1083 G C -1.922 173.002 174.900 0.039 0.000 1.304 1083 G CA -0.552 44.573 45.100 0.042 0.000 0.941 1083 G HN 1.406 nan 8.290 nan 0.000 0.475 1084 L N 0.299 121.548 121.223 0.044 0.000 2.455 1084 L HA 0.837 5.177 4.340 -0.000 0.000 0.264 1084 L C -0.231 176.663 176.870 0.040 0.000 0.968 1084 L CA -0.642 54.221 54.840 0.039 0.000 0.827 1084 L CB 1.939 44.023 42.059 0.042 0.000 1.317 1084 L HN 0.921 nan 8.230 nan 0.000 0.407 1085 A N 4.967 127.806 122.820 0.031 0.000 2.317 1085 A HA 0.876 5.196 4.320 -0.000 0.000 0.327 1085 A C -1.291 176.311 177.584 0.030 0.000 1.178 1085 A CA -0.352 51.702 52.037 0.028 0.000 0.817 1085 A CB 0.737 19.747 19.000 0.016 0.000 1.189 1085 A HN 0.641 nan 8.150 nan 0.000 0.489 1086 L N 0.807 122.050 121.223 0.032 0.000 2.303 1086 L HA 0.648 4.988 4.340 -0.000 0.000 0.256 1086 L C 1.485 178.373 176.870 0.029 0.000 1.034 1086 L CA -0.119 54.740 54.840 0.032 0.000 0.832 1086 L CB 1.530 43.611 42.059 0.036 0.000 1.403 1086 L HN 0.745 nan 8.230 nan 0.000 0.419 1087 A N -0.045 122.792 122.820 0.029 0.000 2.125 1087 A HA 0.162 4.482 4.320 -0.000 0.000 0.219 1087 A C 0.745 178.347 177.584 0.029 0.000 1.156 1087 A CA 1.602 53.656 52.037 0.028 0.000 0.671 1087 A CB -0.575 18.443 19.000 0.029 0.000 0.794 1087 A HN 0.779 nan 8.150 nan 0.000 0.459 1088 S N -5.198 110.519 115.700 0.029 0.000 2.636 1088 S HA 0.491 4.961 4.470 -0.000 0.000 0.266 1088 S C 0.895 175.510 174.600 0.025 0.000 1.147 1088 S CA 0.108 58.325 58.200 0.028 0.000 0.815 1088 S CB 0.636 63.855 63.200 0.032 0.000 1.119 1088 S HN 0.778 nan 8.310 nan 0.000 0.470 1089 G N 0.476 109.287 108.800 0.018 0.000 2.408 1089 G HA2 -0.056 3.904 3.960 -0.000 0.000 0.217 1089 G HA3 -0.056 3.904 3.960 -0.000 0.000 0.217 1089 G C 1.119 176.022 174.900 0.005 0.000 1.150 1089 G CA 0.969 46.075 45.100 0.010 0.000 0.776 1089 G HN 0.509 nan 8.290 nan 0.000 0.542 1090 M N 1.233 120.839 119.600 0.009 0.000 2.229 1090 M HA 0.060 4.540 4.480 -0.000 0.000 0.264 1090 M C 2.731 178.990 176.300 -0.069 0.000 1.063 1090 M CA 0.935 56.226 55.300 -0.014 0.000 1.114 1090 M CB -1.443 31.175 32.600 0.029 0.000 1.387 1090 M HN 0.261 nan 8.290 nan 0.000 0.420 1091 G N -0.516 108.271 108.800 -0.021 0.000 2.422 1091 G HA2 -0.003 3.957 3.960 -0.000 0.000 0.218 1091 G HA3 -0.003 3.957 3.960 -0.000 0.000 0.218 1091 G C 1.641 176.538 174.900 -0.004 0.000 1.140 1091 G CA 0.983 46.076 45.100 -0.011 0.000 0.775 1091 G HN 0.530 nan 8.290 nan 0.000 0.545 1092 A N 1.099 123.923 122.820 0.007 0.000 1.897 1092 A HA 0.102 4.422 4.320 -0.000 0.000 0.215 1092 A C 2.375 179.965 177.584 0.010 0.000 1.181 1092 A CA 1.493 53.545 52.037 0.025 0.000 0.620 1092 A CB -0.364 18.664 19.000 0.048 0.000 0.821 1092 A HN 0.704 nan 8.150 nan 0.000 0.443 1093 I N -0.782 119.778 120.570 -0.017 0.000 2.233 1093 I HA -0.144 4.026 4.170 -0.000 0.000 0.243 1093 I C 2.350 178.367 176.117 -0.166 0.000 1.093 1093 I CA 2.466 63.740 61.300 -0.044 0.000 1.380 1093 I CB -0.933 37.061 38.000 -0.010 0.000 1.067 1093 I HN 0.306 nan 8.210 nan 0.000 0.413 1094 T N -1.617 112.740 114.554 -0.329 0.000 2.788 1094 T HA -0.102 4.248 4.350 -0.000 0.000 0.268 1094 T C 1.996 176.658 174.700 -0.064 0.000 1.044 1094 T CA 1.655 63.431 62.100 -0.541 0.000 1.139 1094 T CB -0.991 67.474 68.868 -0.672 0.000 0.867 1094 T HN 0.414 nan 8.240 nan 0.000 0.454 1095 S N 1.237 116.961 115.700 0.041 0.000 2.368 1095 S HA -0.099 4.371 4.470 -0.000 0.000 0.225 1095 S C 2.330 177.003 174.600 0.121 0.000 1.030 1095 S CA 1.689 59.970 58.200 0.135 0.000 0.999 1095 S CB -0.880 62.371 63.200 0.084 0.000 0.844 1095 S HN 0.706 nan 8.310 nan 0.000 0.459 1096 T N 2.882 117.472 114.554 0.060 0.000 2.701 1096 T HA 0.046 4.396 4.350 -0.000 0.000 0.263 1096 T C 1.785 176.518 174.700 0.055 0.000 1.040 1096 T CA 1.019 63.154 62.100 0.059 0.000 1.147 1096 T CB -0.446 68.452 68.868 0.050 0.000 0.865 1096 T HN 0.249 nan 8.240 nan 0.000 0.426 1097 L N -1.071 120.154 121.223 0.003 0.000 2.083 1097 L HA -0.055 4.285 4.340 -0.000 0.000 0.209 1097 L C 2.456 179.337 176.870 0.018 0.000 1.083 1097 L CA 1.332 56.148 54.840 -0.040 0.000 0.752 1097 L CB -0.555 41.441 42.059 -0.106 0.000 0.899 1097 L HN 0.394 nan 8.230 nan 0.000 0.433 1098 W N 0.192 121.549 121.300 0.094 0.000 2.374 1098 W HA -0.209 4.451 4.660 -0.000 0.000 0.288 1098 W C 2.867 179.398 176.519 0.020 0.000 1.218 1098 W CA 1.267 58.647 57.345 0.057 0.000 1.245 1098 W CB -0.102 29.382 29.460 0.039 0.000 1.126 1098 W HN 0.219 nan 8.180 nan 0.000 0.545 1099 T N -1.801 112.902 114.554 0.248 0.000 3.054 1099 T HA 0.012 4.362 4.350 -0.000 0.000 0.259 1099 T C 1.518 176.281 174.700 0.105 0.000 1.092 1099 T CA 0.658 62.849 62.100 0.152 0.000 1.121 1099 T CB -0.220 68.716 68.868 0.113 0.000 0.912 1099 T HN 0.097 nan 8.240 nan 0.000 0.489 1100 L N -0.032 121.245 121.223 0.089 0.000 2.477 1100 L HA 0.467 4.807 4.340 -0.000 0.000 0.220 1100 L C 0.331 177.228 176.870 0.045 0.000 1.106 1100 L CA 0.169 55.043 54.840 0.057 0.000 0.851 1100 L CB 0.080 42.164 42.059 0.042 0.000 0.994 1100 L HN 0.245 nan 8.230 nan 0.000 0.462 1101 L N -0.146 121.108 121.223 0.052 0.000 2.342 1101 L HA 0.574 4.914 4.340 -0.000 0.000 0.271 1101 L C -0.408 176.505 176.870 0.072 0.000 1.008 1101 L CA -0.708 54.151 54.840 0.032 0.000 0.818 1101 L CB 1.770 43.811 42.059 -0.030 0.000 1.296 1101 L HN -0.083 nan 8.230 nan 0.000 0.427 1102 R N 1.222 121.755 120.500 0.055 0.000 2.808 1102 R HA 0.508 4.848 4.340 -0.000 0.000 0.272 1102 R C -2.721 173.613 176.300 0.055 0.000 0.995 1102 R CA -2.549 53.593 56.100 0.071 0.000 0.917 1102 R CB 1.894 32.228 30.300 0.058 0.000 1.217 1102 R HN 0.198 nan 8.270 nan 0.000 0.471 1103 P HA 0.037 nan 4.420 nan 0.000 0.264 1103 P C 0.689 178.007 177.300 0.030 0.000 1.179 1103 P CA 1.309 64.442 63.100 0.055 0.000 0.763 1103 P CB 0.482 32.225 31.700 0.072 0.000 0.806 1104 G N 1.897 110.705 108.800 0.013 0.000 2.345 1104 G HA2 -0.186 3.774 3.960 -0.000 0.000 0.218 1104 G HA3 -0.186 3.774 3.960 -0.000 0.000 0.218 1104 G C -0.024 174.875 174.900 -0.002 0.000 1.058 1104 G CA -0.233 44.871 45.100 0.006 0.000 0.632 1104 G HN 0.524 nan 8.290 nan 0.000 0.508 1105 D N 1.472 121.872 120.400 -0.001 0.000 2.400 1105 D HA 0.483 5.123 4.640 -0.000 0.000 0.238 1105 D C 0.438 176.720 176.300 -0.030 0.000 1.157 1105 D CA 0.472 54.466 54.000 -0.009 0.000 0.889 1105 D CB 1.093 41.890 40.800 -0.005 0.000 1.199 1105 D HN 0.598 nan 8.370 nan 0.000 0.436 1106 E N 0.198 120.380 120.200 -0.031 0.000 2.238 1106 E HA 0.518 4.868 4.350 -0.000 0.000 0.267 1106 E C -1.696 174.871 176.600 -0.054 0.000 0.887 1106 E CA -0.869 55.501 56.400 -0.050 0.000 0.769 1106 E CB 2.132 31.810 29.700 -0.038 0.000 1.187 1106 E HN 0.135 nan 8.360 nan 0.000 0.416 1107 V N 5.551 125.413 119.914 -0.087 0.000 2.531 1107 V HA 0.363 4.483 4.120 -0.000 0.000 0.301 1107 V C -1.452 174.596 176.094 -0.076 0.000 1.034 1107 V CA -0.780 61.475 62.300 -0.074 0.000 0.865 1107 V CB 1.475 33.228 31.823 -0.117 0.000 0.995 1107 V HN 0.603 nan 8.190 nan 0.000 0.424 1108 L N 7.585 128.798 121.223 -0.015 0.000 2.265 1108 L HA 0.567 4.907 4.340 -0.000 0.000 0.288 1108 L C -0.152 176.750 176.870 0.054 0.000 1.058 1108 L CA 0.267 55.105 54.840 -0.003 0.000 0.809 1108 L CB 1.012 43.083 42.059 0.021 0.000 1.179 1108 L HN 0.552 nan 8.230 nan 0.000 0.429 1109 L N 2.360 123.583 121.223 0.000 0.000 2.334 1109 L HA 0.677 5.017 4.340 -0.000 0.000 0.273 1109 L C 0.989 178.008 176.870 0.248 0.000 1.013 1109 L CA -0.848 54.058 54.840 0.110 0.000 0.816 1109 L CB 1.471 43.459 42.059 -0.118 0.000 1.278 1109 L HN 0.669 nan 8.230 nan 0.000 0.431 1110 G N 0.358 109.362 108.800 0.342 0.000 2.630 1110 G HA2 -0.061 3.899 3.960 -0.000 0.000 0.236 1110 G HA3 -0.061 3.899 3.960 -0.000 0.000 0.236 1110 G C 0.648 175.759 174.900 0.351 0.000 1.248 1110 G CA -0.276 44.998 45.100 0.289 0.000 0.844 1110 G HN 0.756 nan 8.290 nan 0.000 0.588 1111 N N -0.761 118.050 118.700 0.186 0.000 2.149 1111 N HA -0.083 4.657 4.740 -0.000 0.000 0.188 1111 N C 1.417 176.890 175.510 -0.063 0.000 1.019 1111 N CA 1.612 54.695 53.050 0.055 0.000 0.857 1111 N CB -0.108 38.345 38.487 -0.057 0.000 0.997 1111 N HN 0.725 nan 8.380 nan 0.000 0.426 1112 T N -1.621 112.943 114.554 0.016 0.000 2.887 1112 T HA 0.746 5.096 4.350 -0.000 0.000 0.288 1112 T C -0.242 174.545 174.700 0.146 0.000 1.021 1112 T CA -0.839 61.245 62.100 -0.028 0.000 1.000 1112 T CB 2.213 71.040 68.868 -0.068 0.000 1.034 1112 T HN -0.078 nan 8.240 nan 0.000 0.467 1113 L N 1.185 122.527 121.223 0.197 0.000 2.415 1113 L HA 0.494 4.834 4.340 -0.000 0.000 0.256 1113 L C -0.899 176.171 176.870 0.332 0.000 1.010 1113 L CA -1.653 53.392 54.840 0.340 0.000 0.826 1113 L CB 1.914 44.292 42.059 0.531 0.000 1.405 1113 L HN 0.775 nan 8.230 nan 0.000 0.410 1114 Y N 0.789 121.233 120.300 0.239 0.000 2.811 1114 Y HA 0.049 4.599 4.550 -0.000 0.000 0.334 1114 Y C 1.301 177.366 175.900 0.275 0.000 1.247 1114 Y CA 0.719 58.946 58.100 0.212 0.000 1.526 1114 Y CB 1.311 39.886 38.460 0.193 0.000 1.284 1114 Y HN 0.710 nan 8.280 nan 0.000 0.586 1115 G N 3.436 112.012 108.800 -0.374 0.000 2.547 1115 G HA2 -0.334 3.626 3.960 -0.000 0.000 0.221 1115 G HA3 -0.334 3.626 3.960 -0.000 0.000 0.221 1115 G C 1.409 176.245 174.900 -0.107 0.000 1.140 1115 G CA 1.296 46.259 45.100 -0.229 0.000 0.760 1115 G HN 0.804 nan 8.290 nan 0.000 0.583 1116 C N 0.072 119.144 119.300 -0.381 0.000 2.464 1116 C HA 0.105 4.565 4.460 -0.000 0.000 0.278 1116 C C 3.287 178.455 174.990 0.297 0.000 1.375 1116 C CA 1.304 60.352 59.018 0.051 0.000 1.761 1116 C CB -0.701 27.131 27.740 0.153 0.000 1.944 1116 C HN 0.617 nan 8.230 nan 0.000 0.509 1117 T N -0.725 114.075 114.554 0.411 0.000 2.942 1117 T HA -0.122 4.228 4.350 -0.000 0.000 0.265 1117 T C 1.586 176.536 174.700 0.417 0.000 1.062 1117 T CA 1.090 63.445 62.100 0.425 0.000 1.139 1117 T CB -0.473 68.653 68.868 0.429 0.000 0.883 1117 T HN 0.489 nan 8.240 nan 0.000 0.468 1118 F N 2.079 122.214 119.950 0.307 0.000 2.102 1118 F HA 0.168 4.695 4.527 -0.000 0.000 0.298 1118 F C 2.539 178.578 175.800 0.398 0.000 1.105 1118 F CA 1.240 59.465 58.000 0.375 0.000 1.239 1118 F CB -0.680 38.532 39.000 0.353 0.000 0.991 1118 F HN 0.268 nan 8.300 nan 0.000 0.474 1119 A N 0.031 123.188 122.820 0.562 0.000 1.930 1119 A HA -0.191 4.129 4.320 -0.000 0.000 0.217 1119 A C 2.075 179.881 177.584 0.369 0.000 1.175 1119 A CA 1.479 53.818 52.037 0.503 0.000 0.627 1119 A CB -1.536 17.692 19.000 0.381 0.000 0.815 1119 A HN 0.571 nan 8.150 nan 0.000 0.443 1120 F N 0.692 120.730 119.950 0.146 0.000 2.102 1120 F HA -0.119 4.408 4.527 -0.000 0.000 0.298 1120 F C 1.784 177.539 175.800 -0.074 0.000 1.105 1120 F CA 1.591 59.616 58.000 0.041 0.000 1.239 1120 F CB -0.563 38.424 39.000 -0.022 0.000 0.991 1120 F HN 0.143 nan 8.300 nan 0.000 0.474 1121 L N -0.367 120.626 121.223 -0.383 0.000 1.976 1121 L HA -0.243 4.097 4.340 -0.000 0.000 0.209 1121 L C 2.776 179.268 176.870 -0.629 0.000 1.071 1121 L CA 1.640 56.068 54.840 -0.687 0.000 0.746 1121 L CB -1.129 40.581 42.059 -0.583 0.000 0.890 1121 L HN 0.184 nan 8.230 nan 0.000 0.432 1122 H N -1.331 117.461 119.070 -0.462 0.000 2.462 1122 H HA -0.016 4.540 4.556 -0.000 0.000 0.292 1122 H C 1.305 176.309 175.328 -0.540 0.000 1.049 1122 H CA 1.121 56.847 56.048 -0.536 0.000 1.334 1122 H CB 0.251 29.568 29.762 -0.741 0.000 1.404 1122 H HN 0.484 nan 8.280 nan 0.000 0.544 1123 H N -1.204 117.870 119.070 0.006 0.000 2.893 1123 H HA 0.227 4.783 4.556 -0.000 0.000 0.270 1123 H C 1.459 176.840 175.328 0.088 0.000 1.095 1123 H CA 0.474 56.557 56.048 0.059 0.000 1.186 1123 H CB 1.163 30.994 29.762 0.115 0.000 1.562 1123 H HN 0.304 nan 8.280 nan 0.000 0.536 1124 G N 0.987 109.836 108.800 0.081 0.000 2.887 1124 G HA2 0.118 4.078 3.960 -0.000 0.000 0.210 1124 G HA3 0.118 4.078 3.960 -0.000 0.000 0.210 1124 G C 1.307 176.277 174.900 0.117 0.000 1.964 1124 G CA -0.025 45.173 45.100 0.164 0.000 0.738 1124 G HN 0.073 nan 8.290 nan 0.000 0.790 1125 I N 1.559 121.844 120.570 -0.476 0.000 2.194 1125 I HA -0.058 4.112 4.170 -0.000 0.000 0.246 1125 I C 2.823 178.875 176.117 -0.107 0.000 1.093 1125 I CA 1.669 62.742 61.300 -0.379 0.000 1.355 1125 I CB -0.950 36.495 38.000 -0.926 0.000 1.046 1125 I HN 0.297 nan 8.210 nan 0.000 0.413 1126 G N 0.345 108.969 108.800 -0.294 0.000 2.479 1126 G HA2 -0.207 3.753 3.960 -0.000 0.000 0.220 1126 G HA3 -0.207 3.753 3.960 -0.000 0.000 0.220 1126 G C 1.507 176.335 174.900 -0.120 0.000 1.115 1126 G CA 0.743 45.699 45.100 -0.240 0.000 0.757 1126 G HN 0.567 nan 8.290 nan 0.000 0.560 1127 E N -0.788 119.378 120.200 -0.058 0.000 2.489 1127 E HA 0.120 4.470 4.350 -0.000 0.000 0.193 1127 E C 0.161 176.599 176.600 -0.270 0.000 1.057 1127 E CA -0.208 56.105 56.400 -0.145 0.000 0.866 1127 E CB 0.098 29.700 29.700 -0.163 0.000 0.916 1127 E HN 0.529 nan 8.360 nan 0.000 0.500 1128 F N 0.232 120.185 119.950 0.004 0.000 2.850 1128 F HA 0.283 4.810 4.527 -0.000 0.000 0.306 1128 F C 1.297 177.110 175.800 0.021 0.000 1.162 1128 F CA -0.092 57.939 58.000 0.052 0.000 1.327 1128 F CB 1.092 40.188 39.000 0.160 0.000 0.953 1128 F HN 0.008 nan 8.300 nan 0.000 0.507 1129 G N 0.156 108.996 108.800 0.068 0.000 2.159 1129 G HA2 -0.256 3.704 3.960 -0.000 0.000 0.256 1129 G HA3 -0.256 3.704 3.960 -0.000 0.000 0.256 1129 G C -0.057 174.851 174.900 0.012 0.000 0.977 1129 G CA 0.087 45.207 45.100 0.034 0.000 0.652 1129 G HN 0.181 nan 8.290 nan 0.000 0.531 1130 V N 1.039 120.946 119.914 -0.011 0.000 2.465 1130 V HA 0.429 4.549 4.120 -0.000 0.000 0.279 1130 V C 0.852 176.879 176.094 -0.112 0.000 1.045 1130 V CA -0.572 61.690 62.300 -0.063 0.000 0.938 1130 V CB 1.731 33.489 31.823 -0.109 0.000 0.986 1130 V HN 0.354 nan 8.190 nan 0.000 0.467 1131 K N 4.156 124.496 120.400 -0.099 0.000 2.276 1131 K HA 0.434 4.754 4.320 -0.000 0.000 0.283 1131 K C -1.404 175.100 176.600 -0.160 0.000 1.044 1131 K CA -0.587 55.633 56.287 -0.111 0.000 0.944 1131 K CB 0.587 33.044 32.500 -0.071 0.000 1.012 1131 K HN 0.340 nan 8.250 nan 0.000 0.472 1132 L N 4.471 125.574 121.223 -0.201 0.000 2.341 1132 L HA 0.521 4.861 4.340 -0.000 0.000 0.278 1132 L C -0.225 176.521 176.870 -0.207 0.000 1.005 1132 L CA -0.276 54.394 54.840 -0.282 0.000 0.818 1132 L CB 1.445 43.215 42.059 -0.482 0.000 1.259 1132 L HN 0.639 nan 8.230 nan 0.000 0.418 1133 R N 1.988 122.360 120.500 -0.214 0.000 2.510 1133 R HA 0.339 4.679 4.340 -0.000 0.000 0.287 1133 R C -1.296 174.920 176.300 -0.140 0.000 1.084 1133 R CA -0.670 55.358 56.100 -0.121 0.000 0.934 1133 R CB 1.342 31.609 30.300 -0.055 0.000 1.201 1133 R HN 0.645 nan 8.270 nan 0.000 0.431 1134 H N 3.204 122.306 119.070 0.053 0.000 2.620 1134 H HA 0.302 4.858 4.556 -0.000 0.000 0.313 1134 H C 0.030 175.377 175.328 0.031 0.000 1.075 1134 H CA -0.018 56.072 56.048 0.069 0.000 1.397 1134 H CB 1.599 31.420 29.762 0.098 0.000 1.446 1134 H HN 0.410 nan 8.280 nan 0.000 0.493 1135 V N 0.711 120.707 119.914 0.138 0.000 3.007 1135 V HA 0.241 4.361 4.120 -0.000 0.000 0.311 1135 V C -0.118 176.001 176.094 0.042 0.000 1.120 1135 V CA -1.196 61.140 62.300 0.060 0.000 0.980 1135 V CB 2.602 34.434 31.823 0.016 0.000 1.033 1135 V HN 0.566 nan 8.190 nan 0.000 0.429 1136 D N 4.150 124.555 120.400 0.008 0.000 2.359 1136 D HA 0.183 4.823 4.640 -0.000 0.000 0.250 1136 D C 1.067 177.354 176.300 -0.021 0.000 1.264 1136 D CA -0.247 53.760 54.000 0.011 0.000 0.911 1136 D CB 1.174 41.971 40.800 -0.006 0.000 1.056 1136 D HN 0.560 nan 8.370 nan 0.000 0.499 1137 M N 2.913 122.469 119.600 -0.074 0.000 2.700 1137 M HA -0.045 4.435 4.480 -0.000 0.000 0.249 1137 M C 1.548 177.703 176.300 -0.240 0.000 1.082 1137 M CA 0.340 55.482 55.300 -0.264 0.000 1.077 1137 M CB -0.877 31.348 32.600 -0.625 0.000 1.477 1137 M HN 0.461 nan 8.290 nan 0.000 0.529 1138 A N -0.717 122.049 122.820 -0.090 0.000 2.095 1138 A HA -0.007 4.313 4.320 -0.000 0.000 0.212 1138 A C 0.862 178.412 177.584 -0.058 0.000 1.162 1138 A CA 0.321 52.297 52.037 -0.100 0.000 0.753 1138 A CB -0.063 18.918 19.000 -0.032 0.000 0.840 1138 A HN 0.317 nan 8.150 nan 0.000 0.468 1139 D N 0.650 121.027 120.400 -0.038 0.000 2.500 1139 D HA 0.280 4.920 4.640 -0.000 0.000 0.219 1139 D C 0.683 176.950 176.300 -0.056 0.000 1.137 1139 D CA -0.415 53.563 54.000 -0.038 0.000 0.946 1139 D CB 0.446 41.230 40.800 -0.026 0.000 1.022 1139 D HN -0.012 nan 8.370 nan 0.000 0.518 1140 L N 2.830 124.018 121.223 -0.060 0.000 2.261 1140 L HA -0.146 4.194 4.340 -0.000 0.000 0.216 1140 L C 2.171 179.009 176.870 -0.052 0.000 1.114 1140 L CA 1.567 56.371 54.840 -0.061 0.000 0.777 1140 L CB -0.502 41.527 42.059 -0.050 0.000 0.910 1140 L HN 0.503 nan 8.230 nan 0.000 0.440 1141 Q N -1.705 118.069 119.800 -0.042 0.000 2.062 1141 Q HA -0.036 4.304 4.340 -0.000 0.000 0.196 1141 Q C 2.324 178.298 176.000 -0.043 0.000 0.967 1141 Q CA 1.246 57.027 55.803 -0.037 0.000 0.832 1141 Q CB -0.169 28.552 28.738 -0.027 0.000 0.899 1141 Q HN 0.526 nan 8.270 nan 0.000 0.442 1142 A N 1.215 124.011 122.820 -0.041 0.000 1.972 1142 A HA -0.143 4.177 4.320 -0.000 0.000 0.219 1142 A C 1.982 179.537 177.584 -0.049 0.000 1.169 1142 A CA 0.773 52.787 52.037 -0.039 0.000 0.635 1142 A CB -0.578 18.403 19.000 -0.032 0.000 0.810 1142 A HN 0.360 nan 8.150 nan 0.000 0.446 1143 L N -0.362 120.825 121.223 -0.061 0.000 2.027 1143 L HA -0.160 4.180 4.340 -0.000 0.000 0.206 1143 L C 2.336 179.143 176.870 -0.106 0.000 1.074 1143 L CA 2.596 57.392 54.840 -0.074 0.000 0.745 1143 L CB -0.711 41.298 42.059 -0.084 0.000 0.898 1143 L HN 0.640 nan 8.230 nan 0.000 0.433 1144 E N -0.291 119.836 120.200 -0.121 0.000 2.106 1144 E HA -0.184 4.166 4.350 -0.000 0.000 0.192 1144 E C 2.009 178.511 176.600 -0.162 0.000 0.984 1144 E CA 1.123 57.405 56.400 -0.196 0.000 0.806 1144 E CB 0.017 29.631 29.700 -0.143 0.000 0.750 1144 E HN 0.567 nan 8.360 nan 0.000 0.458 1145 A N 0.330 123.096 122.820 -0.089 0.000 2.121 1145 A HA 0.055 4.375 4.320 -0.000 0.000 0.218 1145 A C 2.074 179.626 177.584 -0.053 0.000 1.154 1145 A CA 1.293 53.296 52.037 -0.057 0.000 0.679 1145 A CB -0.239 18.739 19.000 -0.036 0.000 0.795 1145 A HN 0.347 nan 8.150 nan 0.000 0.458 1146 A N -1.529 121.252 122.820 -0.065 0.000 2.220 1146 A HA 0.414 4.734 4.320 -0.000 0.000 0.211 1146 A C 0.862 178.412 177.584 -0.056 0.000 1.176 1146 A CA -0.127 51.881 52.037 -0.048 0.000 0.834 1146 A CB -0.166 18.811 19.000 -0.038 0.000 0.868 1146 A HN 0.344 nan 8.150 nan 0.000 0.488 1147 M N 1.906 121.446 119.600 -0.101 0.000 2.252 1147 M HA 0.204 4.684 4.480 -0.000 0.000 0.348 1147 M C 0.508 176.792 176.300 -0.027 0.000 1.334 1147 M CA 0.617 55.856 55.300 -0.103 0.000 1.071 1147 M CB -0.146 32.273 32.600 -0.302 0.000 1.763 1147 M HN 0.498 nan 8.290 nan 0.000 0.452 1148 T N 1.011 115.570 114.554 0.009 0.000 2.865 1148 T HA 0.616 4.966 4.350 -0.000 0.000 0.294 1148 T C -2.340 172.386 174.700 0.044 0.000 1.119 1148 T CA -1.504 60.613 62.100 0.027 0.000 1.007 1148 T CB 1.841 70.714 68.868 0.009 0.000 1.225 1148 T HN 0.313 nan 8.240 nan 0.000 0.515 1149 P HA 0.110 nan 4.420 nan 0.000 0.222 1149 P C 1.376 178.692 177.300 0.027 0.000 1.147 1149 P CA 0.981 64.103 63.100 0.037 0.000 0.790 1149 P CB -0.211 31.506 31.700 0.027 0.000 0.780 1150 A N -1.164 121.666 122.820 0.018 0.000 2.067 1150 A HA 0.006 4.326 4.320 -0.000 0.000 0.217 1150 A C 1.042 178.631 177.584 0.008 0.000 1.156 1150 A CA 0.705 52.748 52.037 0.010 0.000 0.683 1150 A CB -1.473 17.527 19.000 0.001 0.000 0.808 1150 A HN 0.130 nan 8.150 nan 0.000 0.455 1151 T N 1.044 115.605 114.554 0.012 0.000 2.758 1151 T HA 0.076 4.426 4.350 -0.000 0.000 0.281 1151 T C 1.154 175.867 174.700 0.022 0.000 0.963 1151 T CA 0.060 62.166 62.100 0.011 0.000 1.201 1151 T CB 0.626 69.503 68.868 0.015 0.000 0.906 1151 T HN 0.254 nan 8.240 nan 0.000 0.528 1152 R N 2.203 122.712 120.500 0.014 0.000 2.191 1152 R HA 0.258 4.598 4.340 -0.000 0.000 0.196 1152 R C 0.105 176.423 176.300 0.030 0.000 0.991 1152 R CA 0.462 56.575 56.100 0.021 0.000 1.075 1152 R CB 0.552 30.860 30.300 0.013 0.000 1.040 1152 R HN 0.460 nan 8.270 nan 0.000 0.526 1153 V N 1.301 121.231 119.914 0.026 0.000 2.925 1153 V HA 0.461 4.581 4.120 -0.000 0.000 0.311 1153 V C -0.571 175.567 176.094 0.073 0.000 1.104 1153 V CA -0.790 61.539 62.300 0.048 0.000 0.954 1153 V CB 2.823 34.668 31.823 0.037 0.000 1.022 1153 V HN -0.034 nan 8.190 nan 0.000 0.427 1154 I N 3.772 124.411 120.570 0.115 0.000 2.410 1154 I HA 0.467 4.637 4.170 -0.000 0.000 0.286 1154 I C -1.463 174.791 176.117 0.229 0.000 1.009 1154 I CA -0.510 60.895 61.300 0.175 0.000 1.111 1154 I CB 1.479 39.593 38.000 0.190 0.000 1.262 1154 I HN 0.671 nan 8.210 nan 0.000 0.443 1155 Y N 8.940 129.312 120.300 0.120 0.000 2.391 1155 Y HA 0.731 5.281 4.550 -0.000 0.000 0.341 1155 Y C -1.288 174.718 175.900 0.177 0.000 0.965 1155 Y CA -0.952 57.168 58.100 0.033 0.000 1.067 1155 Y CB 1.350 39.807 38.460 -0.005 0.000 1.199 1155 Y HN 0.466 nan 8.280 nan 0.000 0.450 1156 F N 1.435 121.078 119.950 -0.511 0.000 2.773 1156 F HA 0.655 5.182 4.527 -0.000 0.000 0.314 1156 F C -1.833 173.721 175.800 -0.409 0.000 1.160 1156 F CA -1.342 56.471 58.000 -0.310 0.000 0.920 1156 F CB 1.205 40.145 39.000 -0.099 0.000 1.323 1156 F HN 0.353 nan 8.300 nan 0.000 0.457 1157 E N 0.491 120.688 120.200 -0.005 0.000 2.191 1157 E HA 0.613 4.963 4.350 -0.000 0.000 0.274 1157 E C -1.350 175.315 176.600 0.108 0.000 0.948 1157 E CA -1.165 55.187 56.400 -0.079 0.000 0.802 1157 E CB 1.995 31.648 29.700 -0.077 0.000 1.137 1157 E HN 0.645 nan 8.360 nan 0.000 0.397 1158 S N 2.702 118.425 115.700 0.039 0.000 2.706 1158 S HA 0.392 4.862 4.470 -0.000 0.000 0.270 1158 S C -2.769 171.848 174.600 0.028 0.000 1.163 1158 S CA -1.516 56.731 58.200 0.079 0.000 1.042 1158 S CB 0.686 63.999 63.200 0.188 0.000 1.079 1158 S HN 0.190 nan 8.310 nan 0.000 0.474 1159 P HA 0.501 nan 4.420 nan 0.000 0.274 1159 P C -1.206 176.060 177.300 -0.057 0.000 1.246 1159 P CA -0.433 62.685 63.100 0.030 0.000 0.795 1159 P CB 0.619 32.373 31.700 0.089 0.000 1.006 1160 A N 1.289 124.112 122.820 0.006 0.000 2.355 1160 A HA 0.439 4.759 4.320 -0.000 0.000 0.324 1160 A C -0.189 177.405 177.584 0.017 0.000 1.117 1160 A CA -0.789 51.234 52.037 -0.022 0.000 0.785 1160 A CB 0.451 19.495 19.000 0.074 0.000 1.254 1160 A HN 0.581 nan 8.150 nan 0.000 0.453 1161 N N 1.316 120.013 118.700 -0.004 0.000 2.399 1161 N HA 0.317 5.057 4.740 -0.000 0.000 0.250 1161 N C -1.763 173.765 175.510 0.030 0.000 1.272 1161 N CA -1.346 51.741 53.050 0.062 0.000 0.928 1161 N CB 0.934 39.489 38.487 0.112 0.000 1.158 1161 N HN 0.475 nan 8.380 nan 0.000 0.463 1162 P HA 0.168 nan 4.420 nan 0.000 0.267 1162 P C -0.432 176.840 177.300 -0.046 0.000 1.289 1162 P CA 0.524 63.634 63.100 0.017 0.000 0.866 1162 P CB 0.433 32.127 31.700 -0.011 0.000 1.309 1163 N N 0.220 118.856 118.700 -0.108 0.000 2.230 1163 N HA 0.156 4.896 4.740 -0.000 0.000 0.202 1163 N C 0.456 176.059 175.510 0.154 0.000 1.119 1163 N CA -0.035 52.882 53.050 -0.222 0.000 0.851 1163 N CB -0.274 38.006 38.487 -0.345 0.000 0.990 1163 N HN -0.178 nan 8.380 nan 0.000 0.497 1164 M N -0.317 119.397 119.600 0.190 0.000 2.751 1164 M HA -0.221 4.259 4.480 -0.000 0.000 0.199 1164 M C -0.000 176.493 176.300 0.322 0.000 0.550 1164 M CA 0.575 56.026 55.300 0.251 0.000 0.640 1164 M CB -2.963 29.791 32.600 0.257 0.000 2.351 1164 M HN 0.400 nan 8.290 nan 0.000 0.613 1165 H N 1.225 120.374 119.070 0.133 0.000 3.034 1165 H HA 0.248 4.804 4.556 -0.000 0.000 0.324 1165 H C 0.291 175.668 175.328 0.082 0.000 1.015 1165 H CA 0.619 56.716 56.048 0.082 0.000 1.429 1165 H CB 0.546 30.305 29.762 -0.005 0.000 1.429 1165 H HN 0.378 nan 8.280 nan 0.000 0.585 1166 M N 2.838 122.210 119.600 -0.379 0.000 2.513 1166 M HA 0.526 5.006 4.480 -0.000 0.000 0.291 1166 M C -0.035 175.997 176.300 -0.448 0.000 1.190 1166 M CA -0.934 54.205 55.300 -0.267 0.000 0.960 1166 M CB 1.589 34.131 32.600 -0.097 0.000 1.517 1166 M HN 0.591 nan 8.290 nan 0.000 0.499 1167 A N 0.503 123.170 122.820 -0.255 0.000 2.435 1167 A HA 0.471 4.791 4.320 -0.000 0.000 0.304 1167 A C -1.205 176.257 177.584 -0.203 0.000 1.064 1167 A CA -0.602 51.235 52.037 -0.334 0.000 0.727 1167 A CB 1.252 19.879 19.000 -0.623 0.000 1.284 1167 A HN 0.766 nan 8.150 nan 0.000 0.415 1168 D N 2.506 122.788 120.400 -0.197 0.000 2.483 1168 D HA 0.256 4.896 4.640 -0.000 0.000 0.220 1168 D C 1.100 177.359 176.300 -0.068 0.000 1.173 1168 D CA -0.156 53.781 54.000 -0.105 0.000 0.964 1168 D CB -0.028 40.718 40.800 -0.091 0.000 1.046 1168 D HN 0.433 nan 8.370 nan 0.000 0.517 1169 I N 2.326 122.902 120.570 0.010 0.000 2.118 1169 I HA -0.336 3.834 4.170 -0.000 0.000 0.241 1169 I C 2.394 178.552 176.117 0.068 0.000 1.070 1169 I CA 1.364 62.730 61.300 0.111 0.000 1.327 1169 I CB -0.188 37.893 38.000 0.135 0.000 1.034 1169 I HN 0.381 nan 8.210 nan 0.000 0.405 1170 A N 0.846 123.685 122.820 0.032 0.000 1.978 1170 A HA -0.124 4.196 4.320 -0.000 0.000 0.220 1170 A C 2.401 179.995 177.584 0.017 0.000 1.170 1170 A CA 1.947 53.998 52.037 0.023 0.000 0.636 1170 A CB -1.374 17.632 19.000 0.010 0.000 0.810 1170 A HN 0.507 nan 8.150 nan 0.000 0.448 1171 G N -0.394 108.406 108.800 -0.001 0.000 2.414 1171 G HA2 -0.103 3.857 3.960 -0.000 0.000 0.215 1171 G HA3 -0.103 3.857 3.960 -0.000 0.000 0.215 1171 G C 1.673 176.568 174.900 -0.008 0.000 1.188 1171 G CA 1.659 46.751 45.100 -0.013 0.000 0.783 1171 G HN 1.020 nan 8.290 nan 0.000 0.537 1172 V N 0.291 120.193 119.914 -0.021 0.000 2.594 1172 V HA 0.092 4.212 4.120 -0.000 0.000 0.253 1172 V C 2.828 178.952 176.094 0.050 0.000 1.069 1172 V CA 2.180 64.476 62.300 -0.008 0.000 1.082 1172 V CB -0.683 31.111 31.823 -0.047 0.000 0.680 1172 V HN 0.417 nan 8.190 nan 0.000 0.469 1173 A N 0.132 122.993 122.820 0.067 0.000 1.930 1173 A HA -0.126 4.194 4.320 -0.000 0.000 0.217 1173 A C 2.145 179.763 177.584 0.058 0.000 1.175 1173 A CA 1.976 54.056 52.037 0.071 0.000 0.627 1173 A CB -0.606 18.432 19.000 0.064 0.000 0.815 1173 A HN 0.524 nan 8.150 nan 0.000 0.443 1174 K N -0.016 120.412 120.400 0.046 0.000 2.148 1174 K HA 0.107 4.427 4.320 -0.000 0.000 0.204 1174 K C 1.571 178.216 176.600 0.074 0.000 1.050 1174 K CA 0.975 57.291 56.287 0.048 0.000 0.942 1174 K CB -0.460 32.060 32.500 0.035 0.000 0.724 1174 K HN 0.594 nan 8.250 nan 0.000 0.446 1175 I N -0.062 120.551 120.570 0.071 0.000 2.353 1175 I HA -0.226 3.944 4.170 -0.000 0.000 0.248 1175 I C 2.075 178.286 176.117 0.156 0.000 1.119 1175 I CA 1.023 62.387 61.300 0.106 0.000 1.417 1175 I CB -0.251 37.750 38.000 0.001 0.000 1.078 1175 I HN 0.073 nan 8.210 nan 0.000 0.421 1176 A N 0.677 123.556 122.820 0.098 0.000 1.902 1176 A HA -0.213 4.107 4.320 -0.000 0.000 0.217 1176 A C 2.288 179.935 177.584 0.104 0.000 1.181 1176 A CA 1.528 53.626 52.037 0.101 0.000 0.623 1176 A CB -0.452 18.598 19.000 0.084 0.000 0.818 1176 A HN 0.214 nan 8.150 nan 0.000 0.443 1177 R N -0.207 120.343 120.500 0.084 0.000 2.152 1177 R HA -0.009 4.331 4.340 -0.000 0.000 0.232 1177 R C 1.927 178.256 176.300 0.049 0.000 1.117 1177 R CA 1.638 57.773 56.100 0.058 0.000 0.981 1177 R CB -0.219 30.107 30.300 0.044 0.000 0.870 1177 R HN 0.583 nan 8.270 nan 0.000 0.451 1178 K N -1.382 119.067 120.400 0.081 0.000 2.262 1178 K HA 0.061 4.381 4.320 -0.000 0.000 0.200 1178 K C 0.750 177.265 176.600 -0.141 0.000 1.049 1178 K CA 0.788 57.072 56.287 -0.005 0.000 0.979 1178 K CB 0.299 32.824 32.500 0.041 0.000 0.773 1178 K HN 0.355 nan 8.250 nan 0.000 0.474 1179 H N -1.249 117.828 119.070 0.012 0.000 2.528 1179 H HA 0.213 4.769 4.556 -0.000 0.000 0.282 1179 H C 0.885 176.221 175.328 0.014 0.000 1.097 1179 H CA 0.338 56.393 56.048 0.012 0.000 1.121 1179 H CB 1.349 31.118 29.762 0.011 0.000 1.590 1179 H HN 0.404 nan 8.280 nan 0.000 0.553 1180 G N 1.854 110.712 108.800 0.096 0.000 5.064 1180 G HA2 -0.353 3.607 3.960 -0.000 0.000 0.277 1180 G HA3 -0.353 3.607 3.960 -0.000 0.000 0.277 1180 G C 0.549 175.489 174.900 0.067 0.000 1.580 1180 G CA 0.124 45.263 45.100 0.066 0.000 1.109 1180 G HN 0.695 nan 8.290 nan 0.000 0.695 1181 A N 0.275 123.138 122.820 0.072 0.000 2.512 1181 A HA 0.292 4.612 4.320 -0.000 0.000 0.247 1181 A C 0.731 178.351 177.584 0.060 0.000 1.210 1181 A CA 2.079 54.153 52.037 0.062 0.000 1.164 1181 A CB -0.372 18.668 19.000 0.066 0.000 0.909 1181 A HN 1.727 nan 8.150 nan 0.000 0.429 1182 T N 2.686 117.273 114.554 0.054 0.000 2.799 1182 T HA 0.472 4.822 4.350 -0.000 0.000 0.286 1182 T C 0.004 174.739 174.700 0.058 0.000 0.973 1182 T CA -0.368 61.762 62.100 0.050 0.000 1.035 1182 T CB 0.997 69.891 68.868 0.044 0.000 0.932 1182 T HN 0.629 nan 8.240 nan 0.000 0.469 1183 V N 4.713 124.656 119.914 0.049 0.000 2.364 1183 V HA 0.354 4.474 4.120 -0.000 0.000 0.272 1183 V C -0.023 176.048 176.094 -0.038 0.000 1.036 1183 V CA -0.642 61.679 62.300 0.036 0.000 0.880 1183 V CB 1.190 33.052 31.823 0.064 0.000 0.991 1183 V HN 0.665 nan 8.190 nan 0.000 0.460 1184 V N 6.034 125.896 119.914 -0.085 0.000 2.378 1184 V HA 0.454 4.574 4.120 -0.000 0.000 0.288 1184 V C -0.145 175.639 176.094 -0.516 0.000 1.016 1184 V CA -0.564 61.652 62.300 -0.139 0.000 0.840 1184 V CB 1.803 33.700 31.823 0.123 0.000 0.994 1184 V HN 0.594 nan 8.190 nan 0.000 0.431 1185 V N 3.509 123.100 119.914 -0.538 0.000 2.417 1185 V HA 0.370 4.490 4.120 -0.000 0.000 0.291 1185 V C -0.164 175.598 176.094 -0.553 0.000 1.024 1185 V CA -0.555 61.273 62.300 -0.785 0.000 0.861 1185 V CB 1.967 33.434 31.823 -0.593 0.000 0.985 1185 V HN 0.891 nan 8.190 nan 0.000 0.436 1186 D N 4.125 124.165 120.400 -0.600 0.000 2.374 1186 D HA 0.040 4.680 4.640 -0.000 0.000 0.240 1186 D C 0.590 176.717 176.300 -0.287 0.000 1.229 1186 D CA 0.322 54.102 54.000 -0.367 0.000 0.895 1186 D CB 0.353 40.987 40.800 -0.277 0.000 1.046 1186 D HN 0.627 nan 8.370 nan 0.000 0.498 1187 N N 2.682 121.176 118.700 -0.344 0.000 2.295 1187 N HA -0.018 4.722 4.740 -0.000 0.000 0.221 1187 N C 0.687 176.192 175.510 -0.007 0.000 1.129 1187 N CA -0.151 52.767 53.050 -0.221 0.000 0.836 1187 N CB 0.467 38.783 38.487 -0.285 0.000 1.040 1187 N HN 0.296 nan 8.380 nan 0.000 0.494 1188 T N 0.214 114.808 114.554 0.066 0.000 2.635 1188 T HA -0.180 4.170 4.350 -0.000 0.000 0.267 1188 T C 1.236 176.219 174.700 0.472 0.000 1.040 1188 T CA 1.357 63.647 62.100 0.317 0.000 1.156 1188 T CB -0.322 68.700 68.868 0.255 0.000 0.863 1188 T HN 0.325 nan 8.240 nan 0.000 0.430 1189 Y N 0.711 121.112 120.300 0.168 0.000 2.128 1189 Y HA -0.135 4.415 4.550 0.000 0.000 0.284 1189 Y C 2.942 178.897 175.900 0.092 0.000 1.154 1189 Y CA -0.199 58.031 58.100 0.217 0.000 1.149 1189 Y CB -1.136 37.413 38.460 0.147 0.000 0.976 1189 Y HN 0.302 nan 8.280 nan 0.000 0.505 1190 C N -1.094 118.330 119.300 0.208 0.000 2.492 1190 C HA 0.105 4.565 4.460 -0.000 0.000 0.279 1190 C C 1.056 176.076 174.990 0.050 0.000 1.335 1190 C CA 0.959 60.010 59.018 0.055 0.000 1.734 1190 C CB -1.340 26.425 27.740 0.043 0.000 2.027 1190 C HN 0.792 nan 8.230 nan 0.000 0.496 1191 T N -1.638 113.033 114.554 0.195 0.000 0.541 1191 T HA -0.139 4.211 4.350 -0.000 0.000 0.774 1191 T C -1.919 172.913 174.700 0.221 0.000 0.992 1191 T CA 0.177 62.419 62.100 0.237 0.000 4.077 1191 T CB -1.516 67.431 68.868 0.131 0.000 2.303 1191 T HN 0.176 nan 8.240 nan 0.000 0.398 1192 P HA -0.054 nan 4.420 nan 0.000 0.228 1192 P C 1.210 178.655 177.300 0.240 0.000 1.151 1192 P CA 1.380 64.648 63.100 0.280 0.000 0.770 1192 P CB -0.255 31.638 31.700 0.322 0.000 0.786 1193 Y N 0.704 120.973 120.300 -0.053 0.000 2.337 1193 Y HA 0.011 4.561 4.550 -0.000 0.000 0.293 1193 Y C 2.078 177.775 175.900 -0.339 0.000 1.123 1193 Y CA 1.216 58.983 58.100 -0.555 0.000 1.201 1193 Y CB -0.534 37.582 38.460 -0.573 0.000 1.011 1193 Y HN -0.209 nan 8.280 nan 0.000 0.545 1194 L N -0.521 120.559 121.223 -0.238 0.000 2.515 1194 L HA 0.187 4.527 4.340 -0.000 0.000 0.223 1194 L C 0.125 176.897 176.870 -0.163 0.000 1.079 1194 L CA 0.272 54.947 54.840 -0.275 0.000 0.857 1194 L CB 0.358 42.310 42.059 -0.177 0.000 1.050 1194 L HN 0.053 nan 8.230 nan 0.000 0.476 1195 Q N 0.397 120.153 119.800 -0.072 0.000 2.327 1195 Q HA 0.328 4.668 4.340 -0.000 0.000 0.265 1195 Q C -1.196 174.817 176.000 0.022 0.000 0.993 1195 Q CA -0.524 55.260 55.803 -0.032 0.000 0.885 1195 Q CB 1.965 30.693 28.738 -0.017 0.000 1.379 1195 Q HN 0.101 nan 8.270 nan 0.000 0.408 1196 R N 4.573 125.083 120.500 0.018 0.000 2.477 1196 R HA 0.252 4.592 4.340 -0.000 0.000 0.285 1196 R C -2.116 174.198 176.300 0.024 0.000 1.415 1196 R CA -1.697 54.430 56.100 0.045 0.000 1.446 1196 R CB 1.162 31.496 30.300 0.058 0.000 1.110 1196 R HN 0.427 nan 8.270 nan 0.000 0.590 1197 P HA -0.216 nan 4.420 nan 0.000 0.217 1197 P C 1.107 178.410 177.300 0.004 0.000 1.151 1197 P CA 1.264 64.362 63.100 -0.003 0.000 0.849 1197 P CB 0.255 31.924 31.700 -0.052 0.000 0.787 1198 L N -0.470 120.758 121.223 0.009 0.000 2.127 1198 L HA -0.178 4.162 4.340 -0.000 0.000 0.211 1198 L C 2.140 179.021 176.870 0.018 0.000 1.089 1198 L CA 1.559 56.407 54.840 0.014 0.000 0.757 1198 L CB -0.930 41.142 42.059 0.022 0.000 0.899 1198 L HN 0.107 nan 8.230 nan 0.000 0.434 1199 E N -0.023 120.189 120.200 0.021 0.000 2.427 1199 E HA -0.078 4.272 4.350 -0.000 0.000 0.196 1199 E C 1.880 178.489 176.600 0.016 0.000 1.028 1199 E CA 0.541 56.952 56.400 0.019 0.000 0.864 1199 E CB 0.154 29.866 29.700 0.020 0.000 0.813 1199 E HN 0.542 nan 8.360 nan 0.000 0.514 1200 L N -0.853 120.381 121.223 0.017 0.000 2.640 1200 L HA 0.240 4.580 4.340 -0.000 0.000 0.230 1200 L C 1.377 178.263 176.870 0.027 0.000 1.123 1200 L CA 0.342 55.194 54.840 0.019 0.000 0.900 1200 L CB 0.604 42.676 42.059 0.022 0.000 1.146 1200 L HN 0.259 nan 8.230 nan 0.000 0.484 1201 G N -0.326 108.489 108.800 0.026 0.000 2.255 1201 G HA2 -0.187 3.773 3.960 -0.000 0.000 0.196 1201 G HA3 -0.187 3.773 3.960 -0.000 0.000 0.196 1201 G C 0.469 175.388 174.900 0.032 0.000 0.998 1201 G CA -0.189 44.929 45.100 0.031 0.000 0.656 1201 G HN 0.369 nan 8.290 nan 0.000 0.490 1202 A N 0.450 123.286 122.820 0.026 0.000 2.492 1202 A HA 0.501 4.821 4.320 -0.000 0.000 0.236 1202 A C 1.123 178.709 177.584 0.004 0.000 1.078 1202 A CA 1.125 53.166 52.037 0.008 0.000 0.773 1202 A CB 0.238 19.215 19.000 -0.038 0.000 1.023 1202 A HN 0.227 nan 8.150 nan 0.000 0.504 1203 D N -0.285 120.116 120.400 0.001 0.000 2.277 1203 D HA 0.210 4.850 4.640 -0.000 0.000 0.209 1203 D C -0.035 176.267 176.300 0.003 0.000 0.970 1203 D CA 1.051 55.057 54.000 0.010 0.000 0.874 1203 D CB 0.192 41.003 40.800 0.020 0.000 0.982 1203 D HN 0.421 nan 8.370 nan 0.000 0.504 1204 L N 0.447 121.660 121.223 -0.017 0.000 2.466 1204 L HA 0.367 4.707 4.340 -0.000 0.000 0.258 1204 L C -0.918 175.912 176.870 -0.067 0.000 0.973 1204 L CA -1.051 53.779 54.840 -0.018 0.000 0.826 1204 L CB 2.924 44.987 42.059 0.007 0.000 1.372 1204 L HN -0.269 nan 8.230 nan 0.000 0.409 1205 V N -0.006 119.872 119.914 -0.060 0.000 2.656 1205 V HA 0.868 4.988 4.120 -0.000 0.000 0.307 1205 V C -0.376 175.644 176.094 -0.123 0.000 1.051 1205 V CA -0.822 61.391 62.300 -0.145 0.000 0.893 1205 V CB 1.714 33.449 31.823 -0.146 0.000 0.999 1205 V HN 0.519 nan 8.190 nan 0.000 0.426 1206 V N 1.053 120.851 119.914 -0.193 0.000 2.715 1206 V HA 0.743 4.863 4.120 -0.000 0.000 0.310 1206 V C -0.683 175.275 176.094 -0.228 0.000 1.054 1206 V CA -0.328 61.919 62.300 -0.090 0.000 0.928 1206 V CB 1.868 33.706 31.823 0.025 0.000 1.007 1206 V HN 1.066 nan 8.190 nan 0.000 0.437 1207 H N 1.775 120.862 119.070 0.029 0.000 2.717 1207 H HA 0.491 5.047 4.556 -0.000 0.000 0.366 1207 H C -0.718 174.623 175.328 0.021 0.000 1.132 1207 H CA -0.380 55.688 56.048 0.034 0.000 1.180 1207 H CB 2.296 32.087 29.762 0.047 0.000 1.678 1207 H HN 0.820 nan 8.280 nan 0.000 0.537 1208 S N 1.892 117.680 115.700 0.147 0.000 2.835 1208 S HA 0.298 4.768 4.470 -0.000 0.000 0.286 1208 S C 1.174 175.825 174.600 0.086 0.000 1.194 1208 S CA -0.211 58.025 58.200 0.059 0.000 1.031 1208 S CB -0.282 62.900 63.200 -0.029 0.000 1.216 1208 S HN 0.719 nan 8.310 nan 0.000 0.502 1209 A N 4.174 127.043 122.820 0.083 0.000 2.225 1209 A HA 0.092 4.412 4.320 -0.000 0.000 0.215 1209 A C 1.397 178.998 177.584 0.029 0.000 1.164 1209 A CA 0.909 52.976 52.037 0.049 0.000 0.710 1209 A CB -0.925 18.090 19.000 0.024 0.000 0.780 1209 A HN 0.699 nan 8.150 nan 0.000 0.473 1213 L N 0.064 121.378 121.223 0.151 0.000 1.989 1213 L HA -0.238 4.102 4.340 -0.000 0.000 0.211 1213 L C 2.534 179.450 176.870 0.077 0.000 1.071 1213 L CA 2.248 57.134 54.840 0.077 0.000 0.749 1213 L CB -0.521 41.537 42.059 -0.001 0.000 0.890 1213 L HN 0.357 nan 8.230 nan 0.000 0.431 1214 S N -0.616 115.125 115.700 0.069 0.000 2.345 1214 S HA -0.111 4.359 4.470 -0.000 0.000 0.220 1214 S C 1.781 176.508 174.600 0.213 0.000 1.031 1214 S CA 1.712 59.967 58.200 0.092 0.000 0.996 1214 S CB -0.294 62.940 63.200 0.058 0.000 0.882 1214 S HN 0.648 nan 8.310 nan 0.000 0.445 1215 G N 0.021 108.894 108.800 0.122 0.000 2.234 1215 G HA2 -0.259 3.701 3.960 -0.000 0.000 0.260 1215 G HA3 -0.259 3.701 3.960 -0.000 0.000 0.260 1215 G C 0.443 175.228 174.900 -0.192 0.000 0.987 1215 G CA 0.858 45.967 45.100 0.015 0.000 0.625 1215 G HN 0.730 nan 8.290 nan 0.000 0.532 1216 H N -0.442 118.626 119.070 -0.005 0.000 2.785 1216 H HA 0.471 5.027 4.556 -0.000 0.000 0.268 1216 H C 1.818 177.134 175.328 -0.020 0.000 1.153 1216 H CA 0.167 56.208 56.048 -0.012 0.000 1.111 1216 H CB 0.420 30.172 29.762 -0.017 0.000 1.633 1216 H HN 1.173 nan 8.280 nan 0.000 0.576 1217 G N 2.060 110.898 108.800 0.064 0.000 2.296 1217 G HA2 -0.344 3.616 3.960 -0.000 0.000 0.282 1217 G HA3 -0.344 3.616 3.960 -0.000 0.000 0.282 1217 G C 0.291 175.214 174.900 0.037 0.000 1.014 1217 G CA 0.977 46.093 45.100 0.027 0.000 0.812 1217 G HN 0.624 nan 8.290 nan 0.000 0.508 1218 D N -1.264 119.165 120.400 0.048 0.000 2.462 1218 D HA 0.477 5.117 4.640 -0.000 0.000 0.221 1218 D C 0.521 176.841 176.300 0.033 0.000 1.173 1218 D CA -0.394 53.629 54.000 0.037 0.000 0.831 1218 D CB 0.451 41.270 40.800 0.031 0.000 1.001 1218 D HN 0.451 nan 8.370 nan 0.000 0.499 1219 I N -0.735 119.852 120.570 0.028 0.000 2.842 1219 I HA 0.249 4.419 4.170 -0.000 0.000 0.297 1219 I C -1.294 174.837 176.117 0.024 0.000 1.380 1219 I CA -0.306 61.009 61.300 0.026 0.000 1.018 1219 I CB 2.652 40.655 38.000 0.005 0.000 1.311 1219 I HN -0.282 nan 8.210 nan 0.000 0.439 1220 T N 4.716 119.287 114.554 0.028 0.000 2.791 1220 T HA 0.861 5.211 4.350 -0.000 0.000 0.288 1220 T C -0.723 173.993 174.700 0.026 0.000 0.999 1220 T CA -0.485 61.632 62.100 0.028 0.000 0.952 1220 T CB 1.311 70.199 68.868 0.034 0.000 0.938 1220 T HN 0.679 nan 8.240 nan 0.000 0.444 1221 A N 2.400 125.235 122.820 0.024 0.000 2.609 1221 A HA 0.992 5.312 4.320 -0.000 0.000 0.291 1221 A C -0.457 177.147 177.584 0.033 0.000 1.096 1221 A CA -0.792 51.260 52.037 0.025 0.000 0.684 1221 A CB 1.687 20.697 19.000 0.016 0.000 1.282 1221 A HN 1.014 nan 8.150 nan 0.000 0.412 1222 G N -0.220 108.603 108.800 0.039 0.000 2.619 1222 G HA2 0.651 4.611 3.960 -0.000 0.000 0.296 1222 G HA3 0.651 4.611 3.960 -0.000 0.000 0.296 1222 G C -1.358 173.582 174.900 0.068 0.000 1.334 1222 G CA -0.453 44.681 45.100 0.057 0.000 0.934 1222 G HN 0.592 nan 8.290 nan 0.000 0.476 1223 I N 0.323 120.958 120.570 0.109 0.000 2.769 1223 I HA 0.516 4.686 4.170 -0.000 0.000 0.298 1223 I C -0.816 175.386 176.117 0.141 0.000 1.128 1223 I CA -0.903 60.467 61.300 0.117 0.000 1.031 1223 I CB 2.067 40.137 38.000 0.117 0.000 1.235 1223 I HN 0.208 nan 8.210 nan 0.000 0.423 1224 V N 5.387 125.365 119.914 0.108 0.000 2.638 1224 V HA 0.608 4.728 4.120 -0.000 0.000 0.306 1224 V C -0.462 175.684 176.094 0.087 0.000 1.052 1224 V CA -0.639 61.714 62.300 0.088 0.000 0.885 1224 V CB 2.784 34.645 31.823 0.063 0.000 0.999 1224 V HN 0.465 nan 8.190 nan 0.000 0.424 1225 V N 3.112 123.076 119.914 0.083 0.000 2.789 1225 V HA 1.049 5.169 4.120 -0.000 0.000 0.311 1225 V C 0.410 176.531 176.094 0.045 0.000 1.073 1225 V CA 0.431 62.772 62.300 0.069 0.000 0.921 1225 V CB 1.676 33.553 31.823 0.091 0.000 1.009 1225 V HN 1.187 nan 8.190 nan 0.000 0.426 1226 G N 2.173 110.996 108.800 0.037 0.000 2.356 1226 G HA2 0.442 4.402 3.960 -0.000 0.000 0.281 1226 G HA3 0.442 4.402 3.960 -0.000 0.000 0.281 1226 G C -0.485 174.432 174.900 0.028 0.000 1.246 1226 G CA 0.070 45.187 45.100 0.029 0.000 0.889 1226 G HN 1.069 nan 8.290 nan 0.000 0.486 1227 S N -0.305 115.411 115.700 0.025 0.000 2.579 1227 S HA 0.272 4.742 4.470 -0.000 0.000 0.275 1227 S C 1.277 175.892 174.600 0.025 0.000 1.345 1227 S CA 0.771 58.986 58.200 0.024 0.000 1.031 1227 S CB 1.756 64.970 63.200 0.023 0.000 0.892 1227 S HN 0.843 nan 8.310 nan 0.000 0.529 1228 Q N 2.514 122.328 119.800 0.023 0.000 2.061 1228 Q HA -0.111 4.229 4.340 -0.000 0.000 0.204 1228 Q C 2.257 178.271 176.000 0.023 0.000 0.984 1228 Q CA 2.389 58.206 55.803 0.022 0.000 0.846 1228 Q CB -1.108 27.642 28.738 0.019 0.000 0.902 1228 Q HN 0.983 nan 8.270 nan 0.000 0.421 1229 A N -0.001 122.832 122.820 0.022 0.000 1.892 1229 A HA -0.196 4.124 4.320 -0.000 0.000 0.218 1229 A C 2.122 179.723 177.584 0.027 0.000 1.188 1229 A CA 1.763 53.813 52.037 0.023 0.000 0.631 1229 A CB -0.878 18.135 19.000 0.021 0.000 0.822 1229 A HN 0.462 nan 8.150 nan 0.000 0.447 1230 L N -0.859 120.382 121.223 0.029 0.000 2.109 1230 L HA -0.106 4.234 4.340 -0.000 0.000 0.207 1230 L C 2.508 179.400 176.870 0.037 0.000 1.086 1230 L CA 0.775 55.635 54.840 0.034 0.000 0.760 1230 L CB -0.414 41.665 42.059 0.033 0.000 0.910 1230 L HN 0.247 nan 8.230 nan 0.000 0.437 1231 V N -0.394 119.541 119.914 0.035 0.000 2.358 1231 V HA -0.261 3.859 4.120 -0.000 0.000 0.246 1231 V C 2.078 178.194 176.094 0.036 0.000 1.047 1231 V CA 1.722 64.044 62.300 0.037 0.000 1.035 1231 V CB -0.482 31.362 31.823 0.035 0.000 0.658 1231 V HN 0.398 nan 8.190 nan 0.000 0.452 1232 D N -0.179 120.240 120.400 0.032 0.000 2.123 1232 D HA -0.161 4.479 4.640 -0.000 0.000 0.196 1232 D C 2.406 178.729 176.300 0.038 0.000 0.992 1232 D CA 1.198 55.216 54.000 0.031 0.000 0.833 1232 D CB -0.241 40.575 40.800 0.026 0.000 0.954 1232 D HN 0.295 nan 8.370 nan 0.000 0.455 1233 R N -0.040 120.483 120.500 0.039 0.000 2.075 1233 R HA -0.005 4.335 4.340 -0.000 0.000 0.232 1233 R C 2.509 178.840 176.300 0.053 0.000 1.126 1233 R CA 0.605 56.732 56.100 0.044 0.000 0.963 1233 R CB -0.281 30.045 30.300 0.043 0.000 0.858 1233 R HN 0.252 nan 8.270 nan 0.000 0.435 1234 I N 0.103 120.706 120.570 0.055 0.000 2.394 1234 I HA -0.250 3.920 4.170 -0.000 0.000 0.251 1234 I C 2.758 178.912 176.117 0.062 0.000 1.136 1234 I CA 0.941 62.279 61.300 0.064 0.000 1.425 1234 I CB -0.252 37.785 38.000 0.062 0.000 1.079 1234 I HN 0.148 nan 8.210 nan 0.000 0.425 1235 R N 1.606 122.138 120.500 0.053 0.000 2.062 1235 R HA -0.113 4.227 4.340 -0.000 0.000 0.231 1235 R C 2.137 178.473 176.300 0.060 0.000 1.136 1235 R CA 1.488 57.618 56.100 0.052 0.000 0.948 1235 R CB -0.213 30.111 30.300 0.041 0.000 0.845 1235 R HN 0.307 nan 8.270 nan 0.000 0.430 1236 L N 0.228 121.488 121.223 0.060 0.000 2.610 1236 L HA -0.015 4.325 4.340 -0.000 0.000 0.232 1236 L C 1.751 178.658 176.870 0.061 0.000 1.149 1236 L CA 0.588 55.469 54.840 0.069 0.000 0.872 1236 L CB 0.009 42.109 42.059 0.067 0.000 0.992 1236 L HN 0.335 nan 8.230 nan 0.000 0.447 1237 Q N -1.154 118.680 119.800 0.056 0.000 2.474 1237 Q HA 0.159 4.499 4.340 -0.000 0.000 0.191 1237 Q C 2.202 178.231 176.000 0.049 0.000 0.700 1237 Q CA 0.550 56.381 55.803 0.047 0.000 0.849 1237 Q CB -0.384 28.384 28.738 0.050 0.000 1.232 1237 Q HN 0.278 nan 8.270 nan 0.000 0.563 1238 G N 2.006 110.852 108.800 0.076 0.000 2.446 1238 G HA2 -0.225 3.735 3.960 -0.000 0.000 0.217 1238 G HA3 -0.225 3.735 3.960 -0.000 0.000 0.217 1238 G C 1.352 176.297 174.900 0.076 0.000 1.168 1238 G CA 0.595 45.757 45.100 0.104 0.000 0.771 1238 G HN 0.144 nan 8.290 nan 0.000 0.551 1239 L N 0.112 121.376 121.223 0.069 0.000 2.022 1239 L HA 0.079 4.419 4.340 -0.000 0.000 0.204 1239 L C 2.812 179.717 176.870 0.058 0.000 1.076 1239 L CA 2.014 56.891 54.840 0.061 0.000 0.749 1239 L CB -0.535 41.560 42.059 0.059 0.000 0.903 1239 L HN 0.277 nan 8.230 nan 0.000 0.439 1240 K N -0.393 120.048 120.400 0.067 0.000 2.020 1240 K HA -0.239 4.081 4.320 -0.000 0.000 0.212 1240 K C 1.439 178.074 176.600 0.058 0.000 1.050 1240 K CA 2.388 58.724 56.287 0.082 0.000 0.929 1240 K CB 0.028 32.585 32.500 0.095 0.000 0.714 1240 K HN 0.442 nan 8.250 nan 0.000 0.443 1241 D N -0.973 119.443 120.400 0.026 0.000 2.431 1241 D HA 0.041 4.681 4.640 -0.000 0.000 0.227 1241 D C 1.687 177.948 176.300 -0.066 0.000 1.030 1241 D CA 0.733 54.726 54.000 -0.012 0.000 0.897 1241 D CB 0.222 41.010 40.800 -0.021 0.000 1.058 1241 D HN 0.277 nan 8.370 nan 0.000 0.500 1242 M N -0.475 119.072 119.600 -0.088 0.000 2.441 1242 M HA 0.113 4.593 4.480 -0.000 0.000 0.244 1242 M C 1.348 177.540 176.300 -0.181 0.000 1.122 1242 M CA 0.608 55.778 55.300 -0.217 0.000 1.041 1242 M CB 1.015 33.413 32.600 -0.336 0.000 1.438 1242 M HN -0.171 nan 8.290 nan 0.000 0.484 1243 T N -1.181 113.344 114.554 -0.048 0.000 3.177 1243 T HA 0.210 4.560 4.350 -0.000 0.000 0.262 1243 T C 1.075 175.786 174.700 0.018 0.000 0.959 1243 T CA 0.873 62.976 62.100 0.005 0.000 0.996 1243 T CB 0.388 69.297 68.868 0.068 0.000 1.185 1243 T HN 0.461 nan 8.240 nan 0.000 0.486 1244 G N 2.098 110.915 108.800 0.029 0.000 2.258 1244 G HA2 -0.176 3.784 3.960 -0.000 0.000 0.274 1244 G HA3 -0.176 3.784 3.960 -0.000 0.000 0.274 1244 G C 0.291 175.215 174.900 0.041 0.000 1.021 1244 G CA 0.360 45.486 45.100 0.043 0.000 0.798 1244 G HN 0.942 nan 8.290 nan 0.000 0.507 1245 A N 0.137 122.981 122.820 0.039 0.000 3.063 1245 A HA 0.613 4.933 4.320 -0.000 0.000 0.263 1245 A C 0.784 178.388 177.584 0.033 0.000 1.736 1245 A CA 0.028 52.086 52.037 0.035 0.000 1.408 1245 A CB 0.152 19.172 19.000 0.033 0.000 1.108 1245 A HN 0.982 nan 8.150 nan 0.000 0.621 1246 V N 2.154 122.086 119.914 0.030 0.000 2.530 1246 V HA 0.149 4.269 4.120 -0.000 0.000 0.282 1246 V C 0.295 176.399 176.094 0.018 0.000 1.048 1246 V CA -0.416 61.897 62.300 0.021 0.000 0.997 1246 V CB 1.045 32.874 31.823 0.010 0.000 0.987 1246 V HN 0.673 nan 8.190 nan 0.000 0.477 1247 L N 4.903 126.136 121.223 0.017 0.000 2.305 1247 L HA 0.431 4.771 4.340 -0.000 0.000 0.281 1247 L C 0.621 177.502 176.870 0.018 0.000 1.085 1247 L CA 0.676 55.528 54.840 0.019 0.000 0.813 1247 L CB 1.562 43.632 42.059 0.018 0.000 1.157 1247 L HN 0.763 nan 8.230 nan 0.000 0.436 1248 S N 5.776 121.494 115.700 0.029 0.000 2.533 1248 S HA 0.281 4.751 4.470 -0.000 0.000 0.282 1248 S C -1.626 173.004 174.600 0.049 0.000 1.304 1248 S CA -0.826 57.398 58.200 0.040 0.000 1.063 1248 S CB 0.761 64.001 63.200 0.066 0.000 0.881 1248 S HN 0.647 nan 8.310 nan 0.000 0.493 1249 P HA -0.134 nan 4.420 nan 0.000 0.218 1249 P C 1.047 178.374 177.300 0.045 0.000 1.146 1249 P CA 1.382 64.508 63.100 0.043 0.000 0.813 1249 P CB -0.055 31.680 31.700 0.058 0.000 0.778 1250 H N 0.117 119.170 119.070 -0.027 0.000 2.293 1250 H HA -0.138 4.418 4.556 -0.000 0.000 0.300 1250 H C 1.411 176.717 175.328 -0.037 0.000 1.082 1250 H CA 2.238 58.264 56.048 -0.036 0.000 1.308 1250 H CB -0.668 29.072 29.762 -0.036 0.000 1.375 1250 H HN -0.037 nan 8.280 nan 0.000 0.495 1251 D N 0.185 120.573 120.400 -0.020 0.000 2.144 1251 D HA -0.093 4.547 4.640 -0.000 0.000 0.199 1251 D C 2.204 178.444 176.300 -0.100 0.000 0.984 1251 D CA 1.375 55.325 54.000 -0.084 0.000 0.834 1251 D CB -0.574 40.248 40.800 0.037 0.000 0.955 1251 D HN 0.588 nan 8.370 nan 0.000 0.465 1252 A N 0.669 123.453 122.820 -0.060 0.000 1.930 1252 A HA 0.022 4.342 4.320 -0.000 0.000 0.217 1252 A C 2.249 179.776 177.584 -0.095 0.000 1.175 1252 A CA 1.888 53.891 52.037 -0.058 0.000 0.627 1252 A CB -0.664 18.319 19.000 -0.030 0.000 0.815 1252 A HN 0.232 nan 8.150 nan 0.000 0.443 1253 A N -0.729 122.016 122.820 -0.125 0.000 1.898 1253 A HA 0.038 4.358 4.320 -0.000 0.000 0.216 1253 A C 2.023 179.496 177.584 -0.185 0.000 1.181 1253 A CA 1.578 53.523 52.037 -0.153 0.000 0.620 1253 A CB -0.524 18.383 19.000 -0.154 0.000 0.819 1253 A HN 0.409 nan 8.150 nan 0.000 0.442 1254 L N -0.748 120.331 121.223 -0.240 0.000 2.083 1254 L HA -0.115 4.225 4.340 -0.000 0.000 0.209 1254 L C 2.326 179.102 176.870 -0.158 0.000 1.083 1254 L CA 1.648 56.346 54.840 -0.236 0.000 0.752 1254 L CB -0.931 40.950 42.059 -0.297 0.000 0.899 1254 L HN 0.437 nan 8.230 nan 0.000 0.433 1255 L N -1.050 120.102 121.223 -0.119 0.000 2.017 1255 L HA -0.191 4.149 4.340 -0.000 0.000 0.208 1255 L C 2.364 179.190 176.870 -0.073 0.000 1.073 1255 L CA 1.811 56.609 54.840 -0.071 0.000 0.745 1255 L CB -0.490 41.538 42.059 -0.051 0.000 0.894 1255 L HN 0.251 nan 8.230 nan 0.000 0.432 1256 M N -1.200 118.343 119.600 -0.095 0.000 2.279 1256 M HA -0.198 4.282 4.480 -0.000 0.000 0.264 1256 M C 2.403 178.636 176.300 -0.111 0.000 1.062 1256 M CA 1.345 56.584 55.300 -0.101 0.000 1.099 1256 M CB -0.292 32.234 32.600 -0.124 0.000 1.394 1256 M HN 0.272 nan 8.290 nan 0.000 0.426 1257 R N 0.167 120.590 120.500 -0.129 0.000 2.066 1257 R HA -0.110 4.230 4.340 -0.000 0.000 0.232 1257 R C 2.219 178.455 176.300 -0.108 0.000 1.131 1257 R CA 1.690 57.706 56.100 -0.140 0.000 0.955 1257 R CB -0.501 29.691 30.300 -0.179 0.000 0.851 1257 R HN 0.436 nan 8.270 nan 0.000 0.432 1258 G N 0.902 109.652 108.800 -0.084 0.000 2.422 1258 G HA2 -0.222 3.738 3.960 -0.000 0.000 0.218 1258 G HA3 -0.222 3.738 3.960 -0.000 0.000 0.218 1258 G C 1.443 176.375 174.900 0.054 0.000 1.146 1258 G CA 0.650 45.771 45.100 0.035 0.000 0.769 1258 G HN 0.278 nan 8.290 nan 0.000 0.547 1259 I N 0.250 120.822 120.570 0.002 0.000 2.567 1259 I HA -0.115 4.055 4.170 -0.000 0.000 0.257 1259 I C 2.583 178.690 176.117 -0.017 0.000 1.184 1259 I CA 0.813 62.111 61.300 -0.003 0.000 1.451 1259 I CB -0.025 37.953 38.000 -0.036 0.000 1.089 1259 I HN 0.115 nan 8.210 nan 0.000 0.441 1260 K N 0.149 120.525 120.400 -0.040 0.000 2.360 1260 K HA -0.114 4.206 4.320 -0.000 0.000 0.201 1260 K C 1.422 178.005 176.600 -0.028 0.000 1.046 1260 K CA 1.712 57.965 56.287 -0.056 0.000 0.945 1260 K CB -0.107 32.341 32.500 -0.086 0.000 0.750 1260 K HN 0.454 nan 8.250 nan 0.000 0.464 1261 T N -2.088 112.466 114.554 -0.001 0.000 3.182 1261 T HA 0.190 4.540 4.350 -0.000 0.000 0.277 1261 T C 1.356 176.042 174.700 -0.023 0.000 1.013 1261 T CA -0.431 61.667 62.100 -0.003 0.000 0.900 1261 T CB 0.131 69.017 68.868 0.030 0.000 1.098 1261 T HN 0.005 nan 8.240 nan 0.000 0.543 1262 L N 2.679 123.894 121.223 -0.013 0.000 1.978 1262 L HA -0.247 4.093 4.340 -0.000 0.000 0.218 1262 L C 2.728 179.428 176.870 -0.283 0.000 1.075 1262 L CA 2.623 57.437 54.840 -0.044 0.000 0.767 1262 L CB -0.571 41.527 42.059 0.066 0.000 0.890 1262 L HN 0.518 nan 8.230 nan 0.000 0.434 1263 N N 0.150 118.566 118.700 -0.473 0.000 2.069 1263 N HA -0.251 4.489 4.740 -0.000 0.000 0.191 1263 N C 1.787 177.002 175.510 -0.493 0.000 1.031 1263 N CA 1.487 53.887 53.050 -1.082 0.000 0.852 1263 N CB -0.921 37.136 38.487 -0.716 0.000 1.018 1263 N HN 0.212 nan 8.380 nan 0.000 0.423 1264 L N 1.163 122.253 121.223 -0.221 0.000 2.017 1264 L HA -0.030 4.310 4.340 -0.000 0.000 0.208 1264 L C 2.807 179.622 176.870 -0.091 0.000 1.073 1264 L CA 1.451 56.226 54.840 -0.108 0.000 0.745 1264 L CB -0.859 41.161 42.059 -0.064 0.000 0.894 1264 L HN 0.200 nan 8.230 nan 0.000 0.432 1265 R N -1.834 118.617 120.500 -0.081 0.000 2.066 1265 R HA -0.130 4.210 4.340 -0.000 0.000 0.232 1265 R C 2.125 178.457 176.300 0.053 0.000 1.131 1265 R CA 1.166 57.236 56.100 -0.050 0.000 0.955 1265 R CB -0.348 29.964 30.300 0.021 0.000 0.851 1265 R HN 0.241 nan 8.270 nan 0.000 0.432 1266 M N 0.952 120.585 119.600 0.057 0.000 2.117 1266 M HA -0.140 4.340 4.480 -0.000 0.000 0.262 1266 M C 1.410 177.790 176.300 0.132 0.000 1.065 1266 M CA 1.537 56.904 55.300 0.113 0.000 1.114 1266 M CB -0.859 31.797 32.600 0.094 0.000 1.361 1266 M HN 0.001 nan 8.290 nan 0.000 0.408 1267 D N -0.248 120.210 120.400 0.097 0.000 2.104 1267 D HA -0.187 4.453 4.640 -0.000 0.000 0.194 1267 D C 2.153 178.482 176.300 0.049 0.000 0.994 1267 D CA 1.288 55.348 54.000 0.099 0.000 0.830 1267 D CB -0.219 40.620 40.800 0.065 0.000 0.959 1267 D HN 0.172 nan 8.370 nan 0.000 0.452 1268 R N -0.022 120.473 120.500 -0.008 0.000 2.090 1268 R HA -0.066 4.274 4.340 -0.000 0.000 0.228 1268 R C 2.144 178.419 176.300 -0.042 0.000 1.110 1268 R CA 1.286 57.352 56.100 -0.058 0.000 0.973 1268 R CB -0.552 29.665 30.300 -0.139 0.000 0.869 1268 R HN 0.310 nan 8.270 nan 0.000 0.440 1269 H N -0.759 118.322 119.070 0.019 0.000 2.321 1269 H HA -0.120 4.436 4.556 0.000 0.000 0.300 1269 H C 2.080 177.442 175.328 0.056 0.000 1.087 1269 H CA 1.905 57.980 56.048 0.046 0.000 1.319 1269 H CB -0.383 29.424 29.762 0.075 0.000 1.379 1269 H HN 0.269 nan 8.280 nan 0.000 0.501 1270 C N 0.595 120.006 119.300 0.185 0.000 2.453 1270 C HA -0.043 4.417 4.460 -0.000 0.000 0.277 1270 C C 3.162 178.232 174.990 0.132 0.000 1.262 1270 C CA 0.812 59.926 59.018 0.160 0.000 1.718 1270 C CB -1.067 26.739 27.740 0.111 0.000 2.031 1270 C HN 0.627 nan 8.230 nan 0.000 0.480 1271 A N 1.276 124.147 122.820 0.085 0.000 1.908 1271 A HA -0.200 4.120 4.320 -0.000 0.000 0.218 1271 A C 1.883 179.491 177.584 0.040 0.000 1.181 1271 A CA 2.121 54.192 52.037 0.057 0.000 0.627 1271 A CB -0.636 18.383 19.000 0.032 0.000 0.818 1271 A HN 0.631 nan 8.150 nan 0.000 0.445 1272 N N 0.236 118.955 118.700 0.032 0.000 2.188 1272 N HA -0.052 4.688 4.740 -0.000 0.000 0.184 1272 N C 1.830 177.345 175.510 0.007 0.000 1.018 1272 N CA 1.508 54.567 53.050 0.015 0.000 0.858 1272 N CB -0.541 37.952 38.487 0.010 0.000 0.989 1272 N HN 0.461 nan 8.380 nan 0.000 0.426 1273 A N 0.492 123.321 122.820 0.016 0.000 1.898 1273 A HA -0.172 4.148 4.320 -0.000 0.000 0.216 1273 A C 2.214 179.593 177.584 -0.342 0.000 1.181 1273 A CA 1.458 53.418 52.037 -0.128 0.000 0.620 1273 A CB -0.606 18.371 19.000 -0.038 0.000 0.819 1273 A HN 0.232 nan 8.150 nan 0.000 0.442 1274 Q N -0.035 119.699 119.800 -0.110 0.000 2.030 1274 Q HA -0.125 4.215 4.340 -0.000 0.000 0.204 1274 Q C 1.939 177.919 176.000 -0.034 0.000 0.986 1274 Q CA 2.312 58.109 55.803 -0.010 0.000 0.843 1274 Q CB -0.665 28.157 28.738 0.140 0.000 0.904 1274 Q HN 0.332 nan 8.270 nan 0.000 0.420 1275 V N 0.277 120.186 119.914 -0.009 0.000 2.332 1275 V HA -0.236 3.884 4.120 -0.000 0.000 0.248 1275 V C 2.218 178.324 176.094 0.019 0.000 1.055 1275 V CA 1.609 63.916 62.300 0.012 0.000 1.038 1275 V CB -0.634 31.190 31.823 0.001 0.000 0.651 1275 V HN 0.357 nan 8.190 nan 0.000 0.450 1276 L N 0.372 121.582 121.223 -0.023 0.000 2.056 1276 L HA -0.056 4.284 4.340 -0.000 0.000 0.207 1276 L C 2.473 179.347 176.870 0.006 0.000 1.078 1276 L CA 2.224 57.073 54.840 0.014 0.000 0.749 1276 L CB -1.073 40.995 42.059 0.013 0.000 0.901 1276 L HN 0.261 nan 8.230 nan 0.000 0.433 1277 A N -0.982 121.747 122.820 -0.153 0.000 1.877 1277 A HA -0.226 4.094 4.320 -0.000 0.000 0.216 1277 A C 2.193 179.753 177.584 -0.039 0.000 1.186 1277 A CA 1.738 53.676 52.037 -0.166 0.000 0.620 1277 A CB -0.598 18.170 19.000 -0.387 0.000 0.822 1277 A HN 0.526 nan 8.150 nan 0.000 0.443 1278 E N -1.467 118.738 120.200 0.007 0.000 2.153 1278 E HA -0.170 4.180 4.350 -0.000 0.000 0.194 1278 E C 1.689 178.306 176.600 0.028 0.000 0.988 1278 E CA 1.268 57.687 56.400 0.031 0.000 0.811 1278 E CB -0.244 29.488 29.700 0.053 0.000 0.746 1278 E HN 0.749 nan 8.360 nan 0.000 0.466 1279 F N 0.927 120.830 119.950 -0.078 0.000 2.163 1279 F HA -0.166 4.361 4.527 -0.000 0.000 0.297 1279 F C 1.816 177.542 175.800 -0.124 0.000 1.094 1279 F CA 0.847 58.797 58.000 -0.083 0.000 1.290 1279 F CB 0.070 39.026 39.000 -0.073 0.000 1.017 1279 F HN -0.048 nan 8.300 nan 0.000 0.483 1280 L N 0.658 121.754 121.223 -0.212 0.000 2.131 1280 L HA -0.142 4.198 4.340 -0.000 0.000 0.210 1280 L C 2.756 179.400 176.870 -0.376 0.000 1.092 1280 L CA 1.706 56.293 54.840 -0.421 0.000 0.759 1280 L CB -2.217 39.580 42.059 -0.436 0.000 0.903 1280 L HN 0.356 nan 8.230 nan 0.000 0.435 1281 A N -0.116 122.561 122.820 -0.238 0.000 2.019 1281 A HA -0.187 4.133 4.320 -0.000 0.000 0.219 1281 A C 2.231 179.703 177.584 -0.186 0.000 1.164 1281 A CA 1.204 53.142 52.037 -0.166 0.000 0.644 1281 A CB -0.368 18.581 19.000 -0.085 0.000 0.805 1281 A HN 0.414 nan 8.150 nan 0.000 0.449 1282 R N -0.568 119.779 120.500 -0.254 0.000 2.334 1282 R HA 0.120 4.460 4.340 -0.000 0.000 0.216 1282 R C -0.388 175.745 176.300 -0.277 0.000 0.905 1282 R CA -0.077 55.887 56.100 -0.228 0.000 1.064 1282 R CB 0.241 30.422 30.300 -0.198 0.000 1.046 1282 R HN 0.408 nan 8.270 nan 0.000 0.508 1283 Q N 1.178 120.763 119.800 -0.358 0.000 2.256 1283 Q HA 0.153 4.493 4.340 -0.000 0.000 0.254 1283 Q C -1.715 174.169 176.000 -0.195 0.000 0.916 1283 Q CA -2.418 53.191 55.803 -0.323 0.000 0.932 1283 Q CB 1.148 29.625 28.738 -0.434 0.000 1.207 1283 Q HN -0.039 nan 8.270 nan 0.000 0.426 1284 P HA -0.130 nan 4.420 nan 0.000 0.225 1284 P C 0.351 177.611 177.300 -0.067 0.000 1.148 1284 P CA 1.086 64.135 63.100 -0.085 0.000 0.779 1284 P CB 0.621 32.284 31.700 -0.061 0.000 0.780 1285 Q N -0.588 119.168 119.800 -0.073 0.000 2.331 1285 Q HA 0.056 4.396 4.340 -0.000 0.000 0.203 1285 Q C 0.658 176.636 176.000 -0.038 0.000 0.944 1285 Q CA 0.432 56.211 55.803 -0.040 0.000 0.892 1285 Q CB -0.258 28.469 28.738 -0.017 0.000 0.983 1285 Q HN 0.098 nan 8.270 nan 0.000 0.482 1286 V N 1.774 121.637 119.914 -0.084 0.000 2.432 1286 V HA 0.027 4.147 4.120 -0.000 0.000 0.271 1286 V C 1.067 177.140 176.094 -0.035 0.000 1.046 1286 V CA 0.043 62.309 62.300 -0.057 0.000 0.945 1286 V CB 1.362 33.073 31.823 -0.187 0.000 0.992 1286 V HN 0.285 nan 8.190 nan 0.000 0.471 1287 E N 3.814 124.018 120.200 0.007 0.000 2.216 1287 E HA 0.095 4.445 4.350 -0.000 0.000 0.192 1287 E C -0.028 176.561 176.600 -0.018 0.000 0.973 1287 E CA 0.268 56.665 56.400 -0.006 0.000 0.851 1287 E CB 0.547 30.252 29.700 0.008 0.000 0.804 1287 E HN 0.471 nan 8.360 nan 0.000 0.477 1288 L N 0.686 121.897 121.223 -0.020 0.000 2.545 1288 L HA 0.454 4.794 4.340 -0.000 0.000 0.258 1288 L C -1.923 174.862 176.870 -0.142 0.000 0.942 1288 L CA -0.564 54.222 54.840 -0.089 0.000 0.855 1288 L CB 1.998 43.993 42.059 -0.106 0.000 1.374 1288 L HN -0.068 nan 8.230 nan 0.000 0.411 1289 I N 3.075 123.536 120.570 -0.181 0.000 2.498 1289 I HA 0.372 4.542 4.170 -0.000 0.000 0.290 1289 I C -1.047 174.992 176.117 -0.130 0.000 1.032 1289 I CA -0.600 60.638 61.300 -0.104 0.000 1.073 1289 I CB 1.917 39.927 38.000 0.017 0.000 1.251 1289 I HN 0.653 nan 8.210 nan 0.000 0.426 1290 H N 5.581 124.827 119.070 0.292 0.000 2.643 1290 H HA 0.362 4.918 4.556 -0.000 0.000 0.259 1290 H C -1.453 174.078 175.328 0.339 0.000 1.298 1290 H CA -0.412 55.848 56.048 0.352 0.000 1.301 1290 H CB 0.438 30.384 29.762 0.308 0.000 1.422 1290 H HN 0.415 nan 8.280 nan 0.000 0.521 1291 Y N 3.152 123.558 120.300 0.177 0.000 2.354 1291 Y HA 0.274 4.824 4.550 -0.000 0.000 0.330 1291 Y C -2.405 173.267 175.900 -0.380 0.000 1.011 1291 Y CA -3.214 54.860 58.100 -0.043 0.000 1.099 1291 Y CB 1.996 40.479 38.460 0.037 0.000 1.179 1291 Y HN 0.275 nan 8.280 nan 0.000 0.442 1292 P HA -0.086 nan 4.420 nan 0.000 0.222 1292 P C 1.237 178.133 177.300 -0.673 0.000 1.142 1292 P CA 1.968 64.180 63.100 -1.480 0.000 0.788 1292 P CB 0.304 31.377 31.700 -1.045 0.000 0.767 1293 G N -1.224 107.092 108.800 -0.807 0.000 2.623 1293 G HA2 -0.002 3.958 3.960 -0.000 0.000 0.214 1293 G HA3 -0.002 3.958 3.960 -0.000 0.000 0.214 1293 G C 0.422 175.472 174.900 0.250 0.000 1.138 1293 G CA -0.093 44.930 45.100 -0.129 0.000 0.794 1293 G HN 0.214 nan 8.290 nan 0.000 0.535 1294 L N 1.327 122.697 121.223 0.245 0.000 2.319 1294 L HA 0.307 4.647 4.340 -0.000 0.000 0.280 1294 L C 1.898 178.800 176.870 0.054 0.000 1.099 1294 L CA -0.577 54.377 54.840 0.191 0.000 0.828 1294 L CB 1.486 43.669 42.059 0.206 0.000 1.150 1294 L HN 0.140 nan 8.230 nan 0.000 0.442 1295 A N 2.334 125.004 122.820 -0.251 0.000 2.032 1295 A HA -0.185 4.135 4.320 -0.000 0.000 0.221 1295 A C 2.142 179.469 177.584 -0.428 0.000 1.165 1295 A CA 2.011 53.547 52.037 -0.834 0.000 0.645 1295 A CB -0.438 18.225 19.000 -0.561 0.000 0.807 1295 A HN 0.854 nan 8.150 nan 0.000 0.453 1296 S N -1.605 114.023 115.700 -0.120 0.000 2.603 1296 S HA 0.136 4.606 4.470 -0.000 0.000 0.220 1296 S C 0.383 175.037 174.600 0.090 0.000 0.967 1296 S CA -0.412 57.775 58.200 -0.023 0.000 0.920 1296 S CB -0.617 62.582 63.200 -0.001 0.000 0.773 1296 S HN 0.370 nan 8.310 nan 0.000 0.529 1297 F N 4.364 124.330 119.950 0.026 0.000 2.602 1297 F HA 0.281 4.808 4.527 -0.000 0.000 0.385 1297 F C -1.595 174.276 175.800 0.118 0.000 1.063 1297 F CA -2.448 55.622 58.000 0.117 0.000 1.233 1297 F CB 0.399 39.513 39.000 0.188 0.000 1.067 1297 F HN -0.017 nan 8.300 nan 0.000 0.564 1298 P HA -0.241 nan 4.420 nan 0.000 0.217 1298 P C 0.084 177.191 177.300 -0.321 0.000 1.158 1298 P CA 1.972 64.865 63.100 -0.346 0.000 0.887 1298 P CB 0.056 31.554 31.700 -0.337 0.000 0.792 1299 Q N -2.645 116.787 119.800 -0.613 0.000 2.286 1299 Q HA 0.085 4.425 4.340 -0.000 0.000 0.281 1299 Q C 0.817 176.928 176.000 0.185 0.000 0.897 1299 Q CA -0.417 55.277 55.803 -0.183 0.000 1.023 1299 Q CB -0.321 28.315 28.738 -0.171 0.000 1.151 1299 Q HN 0.228 nan 8.270 nan 0.000 0.445 1300 Y N 1.052 121.448 120.300 0.160 0.000 2.114 1300 Y HA -0.341 4.209 4.550 -0.000 0.000 0.282 1300 Y C 2.065 178.037 175.900 0.119 0.000 1.165 1300 Y CA 2.396 60.646 58.100 0.250 0.000 1.148 1300 Y CB -0.067 38.490 38.460 0.162 0.000 0.972 1300 Y HN 0.162 nan 8.280 nan 0.000 0.504 1301 T N 0.784 115.409 114.554 0.118 0.000 2.708 1301 T HA -0.209 4.141 4.350 -0.000 0.000 0.266 1301 T C 1.816 176.485 174.700 -0.052 0.000 1.037 1301 T CA 1.479 63.577 62.100 -0.005 0.000 1.146 1301 T CB -0.794 68.102 68.868 0.047 0.000 0.865 1301 T HN 0.318 nan 8.240 nan 0.000 0.435 1302 L N 1.581 122.795 121.223 -0.015 0.000 2.046 1302 L HA 0.074 4.414 4.340 -0.000 0.000 0.208 1302 L C 2.611 179.456 176.870 -0.041 0.000 1.077 1302 L CA 1.885 56.707 54.840 -0.030 0.000 0.747 1302 L CB -1.156 40.884 42.059 -0.031 0.000 0.896 1302 L HN 0.228 nan 8.230 nan 0.000 0.432 1303 A N -0.293 122.520 122.820 -0.011 0.000 1.865 1303 A HA -0.247 4.073 4.320 -0.000 0.000 0.217 1303 A C 2.447 179.942 177.584 -0.148 0.000 1.191 1303 A CA 1.955 53.963 52.037 -0.048 0.000 0.623 1303 A CB -0.669 18.329 19.000 -0.003 0.000 0.826 1303 A HN 0.500 nan 8.150 nan 0.000 0.444 1304 R N -0.948 119.409 120.500 -0.239 0.000 2.241 1304 R HA -0.116 4.224 4.340 -0.000 0.000 0.224 1304 R C 2.316 178.519 176.300 -0.162 0.000 1.101 1304 R CA 1.274 57.215 56.100 -0.265 0.000 0.995 1304 R CB -0.155 29.907 30.300 -0.397 0.000 0.870 1304 R HN 0.766 nan 8.270 nan 0.000 0.463 1305 Q N -0.095 119.633 119.800 -0.121 0.000 2.163 1305 Q HA -0.097 4.243 4.340 -0.000 0.000 0.198 1305 Q C 1.608 177.565 176.000 -0.071 0.000 0.954 1305 Q CA 1.012 56.767 55.803 -0.082 0.000 0.851 1305 Q CB 0.412 29.114 28.738 -0.060 0.000 0.928 1305 Q HN 0.324 nan 8.270 nan 0.000 0.459 1306 Q N -0.988 118.769 119.800 -0.072 0.000 2.394 1306 Q HA 0.190 4.530 4.340 -0.000 0.000 0.218 1306 Q C -0.180 175.775 176.000 -0.076 0.000 0.907 1306 Q CA 0.179 55.947 55.803 -0.058 0.000 0.919 1306 Q CB 0.709 29.425 28.738 -0.037 0.000 1.051 1306 Q HN 0.256 nan 8.270 nan 0.000 0.538 1307 M N -0.140 119.399 119.600 -0.103 0.000 2.268 1307 M HA 0.187 4.667 4.480 -0.000 0.000 0.344 1307 M C 0.897 177.101 176.300 -0.161 0.000 1.106 1307 M CA -0.370 54.853 55.300 -0.128 0.000 1.010 1307 M CB 1.888 34.409 32.600 -0.132 0.000 1.649 1307 M HN -0.006 nan 8.290 nan 0.000 0.443 1308 S N 1.757 117.339 115.700 -0.196 0.000 2.428 1308 S HA 0.000 4.470 4.470 -0.000 0.000 0.230 1308 S C 0.483 174.960 174.600 -0.205 0.000 1.014 1308 S CA 0.615 58.682 58.200 -0.222 0.000 0.957 1308 S CB 0.014 63.017 63.200 -0.329 0.000 0.784 1308 S HN 0.805 nan 8.310 nan 0.000 0.499 1309 Q N 0.109 119.790 119.800 -0.199 0.000 2.456 1309 Q HA 0.353 4.693 4.340 -0.000 0.000 0.284 1309 Q C -2.581 173.327 176.000 -0.153 0.000 1.061 1309 Q CA -2.287 53.428 55.803 -0.147 0.000 0.799 1309 Q CB 2.116 30.785 28.738 -0.114 0.000 1.445 1309 Q HN 0.008 nan 8.270 nan 0.000 0.411 1310 P HA -0.060 nan 4.420 nan 0.000 0.239 1310 P C 0.366 177.529 177.300 -0.229 0.000 1.184 1310 P CA 1.360 64.282 63.100 -0.296 0.000 0.760 1310 P CB 0.189 31.617 31.700 -0.455 0.000 0.884 1311 G N -0.667 108.097 108.800 -0.059 0.000 2.756 1311 G HA2 0.004 3.964 3.960 -0.000 0.000 0.678 1311 G HA3 0.004 3.964 3.960 -0.000 0.000 0.678 1311 G C 0.508 175.515 174.900 0.178 0.000 1.349 1311 G CA -0.546 44.555 45.100 0.001 0.000 0.847 1311 G HN 0.296 nan 8.290 nan 0.000 0.548 1312 G N -0.780 108.091 108.800 0.118 0.000 3.393 1312 G HA2 0.482 4.442 3.960 -0.000 0.000 0.255 1312 G HA3 0.482 4.442 3.960 -0.000 0.000 0.255 1312 G C 0.578 175.624 174.900 0.244 0.000 1.097 1312 G CA 0.256 45.486 45.100 0.217 0.000 0.780 1312 G HN 0.520 nan 8.290 nan 0.000 0.540 1313 M N 1.092 120.848 119.600 0.260 0.000 2.300 1313 M HA 0.570 5.050 4.480 -0.000 0.000 0.348 1313 M C -0.743 175.772 176.300 0.358 0.000 1.151 1313 M CA -0.852 54.592 55.300 0.240 0.000 1.046 1313 M CB 1.498 34.194 32.600 0.160 0.000 1.647 1313 M HN -0.136 nan 8.290 nan 0.000 0.451 1314 I N 1.590 122.345 120.570 0.308 0.000 2.686 1314 I HA 0.746 4.916 4.170 -0.000 0.000 0.295 1314 I C -0.577 175.740 176.117 0.333 0.000 1.114 1314 I CA -0.826 60.676 61.300 0.336 0.000 1.038 1314 I CB 2.365 40.483 38.000 0.197 0.000 1.238 1314 I HN 0.762 nan 8.210 nan 0.000 0.420 1315 A N 5.700 128.745 122.820 0.376 0.000 2.386 1315 A HA 0.971 5.291 4.320 -0.000 0.000 0.311 1315 A C -1.183 176.641 177.584 0.399 0.000 1.068 1315 A CA -0.420 51.815 52.037 0.331 0.000 0.743 1315 A CB 1.391 20.601 19.000 0.349 0.000 1.258 1315 A HN 0.687 nan 8.150 nan 0.000 0.429 1316 F N -0.346 119.676 119.950 0.121 0.000 2.678 1316 F HA 0.714 5.241 4.527 -0.000 0.000 0.308 1316 F C -0.778 175.010 175.800 -0.021 0.000 1.118 1316 F CA -0.837 57.159 58.000 -0.007 0.000 0.959 1316 F CB 1.294 40.248 39.000 -0.078 0.000 1.305 1316 F HN 0.515 nan 8.300 nan 0.000 0.443 1317 E N 3.296 123.556 120.200 0.101 0.000 2.191 1317 E HA 0.520 4.870 4.350 -0.000 0.000 0.274 1317 E C -1.238 175.413 176.600 0.084 0.000 0.948 1317 E CA -0.843 55.563 56.400 0.010 0.000 0.802 1317 E CB 2.930 32.657 29.700 0.047 0.000 1.137 1317 E HN 0.660 nan 8.360 nan 0.000 0.397 1318 L N 2.641 123.859 121.223 -0.009 0.000 2.295 1318 L HA 0.258 4.598 4.340 -0.000 0.000 0.285 1318 L C 1.446 178.321 176.870 0.008 0.000 1.035 1318 L CA -0.508 54.340 54.840 0.014 0.000 0.806 1318 L CB 1.120 43.143 42.059 -0.060 0.000 1.214 1318 L HN 0.417 nan 8.230 nan 0.000 0.426 1319 K N 2.377 122.784 120.400 0.012 0.000 2.218 1319 K HA -0.139 4.181 4.320 -0.000 0.000 0.205 1319 K C 1.750 178.355 176.600 0.009 0.000 1.046 1319 K CA 1.421 57.713 56.287 0.008 0.000 0.933 1319 K CB -0.113 32.388 32.500 0.002 0.000 0.728 1319 K HN 0.932 nan 8.250 nan 0.000 0.454 1320 G N 0.701 109.505 108.800 0.008 0.000 2.679 1320 G HA2 0.140 4.100 3.960 -0.000 0.000 0.212 1320 G HA3 0.140 4.100 3.960 -0.000 0.000 0.212 1320 G C 0.732 175.642 174.900 0.017 0.000 1.137 1320 G CA 0.408 45.515 45.100 0.012 0.000 0.787 1320 G HN 0.509 nan 8.290 nan 0.000 0.534 1321 G N 0.307 109.118 108.800 0.018 0.000 2.553 1321 G HA2 -0.286 3.674 3.960 -0.000 0.000 0.242 1321 G HA3 -0.286 3.674 3.960 -0.000 0.000 0.242 1321 G C 1.086 176.028 174.900 0.070 0.000 1.277 1321 G CA 0.340 45.466 45.100 0.044 0.000 0.910 1321 G HN 0.804 nan 8.290 nan 0.000 0.576 1322 I N -0.432 120.211 120.570 0.120 0.000 2.163 1322 I HA 0.116 4.286 4.170 -0.000 0.000 0.243 1322 I C 2.887 179.083 176.117 0.131 0.000 1.085 1322 I CA 2.423 63.855 61.300 0.220 0.000 1.347 1322 I CB -1.130 36.971 38.000 0.169 0.000 1.044 1322 I HN 0.816 nan 8.210 nan 0.000 0.408 1323 G N 0.712 109.556 108.800 0.074 0.000 2.446 1323 G HA2 -0.202 3.758 3.960 -0.000 0.000 0.217 1323 G HA3 -0.202 3.758 3.960 -0.000 0.000 0.217 1323 G C 1.837 176.752 174.900 0.024 0.000 1.168 1323 G CA 1.063 46.192 45.100 0.050 0.000 0.771 1323 G HN 0.591 nan 8.290 nan 0.000 0.551 1324 A N 0.686 123.511 122.820 0.008 0.000 1.969 1324 A HA 0.212 4.532 4.320 -0.000 0.000 0.218 1324 A C 2.664 180.214 177.584 -0.057 0.000 1.169 1324 A CA 1.968 54.005 52.037 0.000 0.000 0.635 1324 A CB -0.869 18.130 19.000 -0.001 0.000 0.810 1324 A HN 0.510 nan 8.150 nan 0.000 0.445 1325 G N -0.650 108.019 108.800 -0.218 0.000 2.402 1325 G HA2 -0.185 3.775 3.960 -0.000 0.000 0.216 1325 G HA3 -0.185 3.775 3.960 -0.000 0.000 0.216 1325 G C 1.786 176.439 174.900 -0.413 0.000 1.162 1325 G CA 0.754 45.453 45.100 -0.668 0.000 0.777 1325 G HN 0.513 nan 8.290 nan 0.000 0.539 1326 R N -0.004 120.409 120.500 -0.146 0.000 2.070 1326 R HA 0.016 4.356 4.340 -0.000 0.000 0.233 1326 R C 2.836 179.161 176.300 0.042 0.000 1.137 1326 R CA 1.128 57.248 56.100 0.034 0.000 0.945 1326 R CB -0.293 30.057 30.300 0.084 0.000 0.845 1326 R HN 0.253 nan 8.270 nan 0.000 0.430 1327 R N -0.367 120.159 120.500 0.043 0.000 2.105 1327 R HA -0.163 4.177 4.340 -0.000 0.000 0.239 1327 R C 2.166 178.505 176.300 0.064 0.000 1.135 1327 R CA 1.587 57.717 56.100 0.049 0.000 0.967 1327 R CB -0.400 29.930 30.300 0.051 0.000 0.861 1327 R HN 0.215 nan 8.270 nan 0.000 0.442 1328 F N 1.110 121.029 119.950 -0.052 0.000 2.113 1328 F HA -0.204 4.323 4.527 -0.000 0.000 0.297 1328 F C 2.235 178.015 175.800 -0.033 0.000 1.103 1328 F CA 1.379 59.358 58.000 -0.035 0.000 1.248 1328 F CB -0.029 38.948 39.000 -0.039 0.000 0.999 1328 F HN -0.133 nan 8.300 nan 0.000 0.475 1329 M N 0.641 120.314 119.600 0.122 0.000 2.080 1329 M HA -0.224 4.256 4.480 -0.000 0.000 0.260 1329 M C 1.814 178.088 176.300 -0.044 0.000 1.068 1329 M CA 1.461 56.789 55.300 0.047 0.000 1.109 1329 M CB -1.601 31.073 32.600 0.125 0.000 1.342 1329 M HN 0.200 nan 8.290 nan 0.000 0.405 1330 N N 0.551 119.240 118.700 -0.018 0.000 2.381 1330 N HA -0.025 4.715 4.740 -0.000 0.000 0.182 1330 N C 1.548 177.025 175.510 -0.056 0.000 1.025 1330 N CA 1.340 54.378 53.050 -0.019 0.000 0.888 1330 N CB -0.258 38.231 38.487 0.003 0.000 0.965 1330 N HN 0.370 nan 8.380 nan 0.000 0.438 1331 A N 0.342 123.096 122.820 -0.111 0.000 2.123 1331 A HA 0.144 4.464 4.320 -0.000 0.000 0.214 1331 A C 0.889 178.376 177.584 -0.161 0.000 1.152 1331 A CA -0.096 51.864 52.037 -0.127 0.000 0.728 1331 A CB -0.221 18.695 19.000 -0.140 0.000 0.814 1331 A HN 0.159 nan 8.150 nan 0.000 0.464 1332 L N 0.345 121.437 121.223 -0.219 0.000 2.514 1332 L HA -0.001 4.339 4.340 -0.000 0.000 0.280 1332 L C 1.329 178.170 176.870 -0.048 0.000 1.223 1332 L CA -0.229 54.513 54.840 -0.165 0.000 0.864 1332 L CB 0.453 42.425 42.059 -0.145 0.000 1.118 1332 L HN 0.355 nan 8.230 nan 0.000 0.494 1333 Q N 1.880 121.673 119.800 -0.011 0.000 2.422 1333 Q HA 0.088 4.428 4.340 -0.000 0.000 0.255 1333 Q C 1.272 177.289 176.000 0.029 0.000 0.864 1333 Q CA 0.249 56.055 55.803 0.005 0.000 0.968 1333 Q CB 0.365 29.099 28.738 -0.007 0.000 1.130 1333 Q HN 0.634 nan 8.270 nan 0.000 0.556 1334 L N -0.723 120.540 121.223 0.066 0.000 2.349 1334 L HA 0.332 4.672 4.340 -0.000 0.000 0.200 1334 L C 0.209 177.112 176.870 0.054 0.000 1.064 1334 L CA 0.702 55.568 54.840 0.044 0.000 0.821 1334 L CB -0.054 42.028 42.059 0.037 0.000 1.027 1334 L HN -0.102 nan 8.230 nan 0.000 0.476 1335 F N 0.658 120.597 119.950 -0.020 0.000 2.518 1335 F HA 0.231 4.758 4.527 -0.000 0.000 0.359 1335 F C 1.043 176.843 175.800 0.000 0.000 1.118 1335 F CA 0.278 58.281 58.000 0.005 0.000 1.287 1335 F CB 0.570 39.584 39.000 0.025 0.000 1.132 1335 F HN -0.094 nan 8.300 nan 0.000 0.587 1336 S N 3.132 118.930 115.700 0.163 0.000 2.565 1336 S HA 0.521 4.991 4.470 -0.000 0.000 0.290 1336 S C -0.296 174.383 174.600 0.132 0.000 1.150 1336 S CA -0.958 57.305 58.200 0.105 0.000 1.058 1336 S CB 1.272 64.502 63.200 0.049 0.000 1.032 1336 S HN 0.423 nan 8.310 nan 0.000 0.510 1337 R N 1.631 122.188 120.500 0.096 0.000 2.220 1337 R HA 0.635 4.975 4.340 -0.000 0.000 0.340 1337 R C -0.257 176.090 176.300 0.077 0.000 1.076 1337 R CA -0.060 56.097 56.100 0.095 0.000 0.920 1337 R CB 0.425 30.769 30.300 0.073 0.000 1.062 1337 R HN 0.691 nan 8.270 nan 0.000 0.469 1338 A N 1.834 124.705 122.820 0.086 0.000 2.586 1338 A HA 0.446 4.766 4.320 -0.000 0.000 0.291 1338 A C -0.611 177.016 177.584 0.071 0.000 1.062 1338 A CA -0.870 51.206 52.037 0.064 0.000 0.666 1338 A CB 0.720 19.750 19.000 0.051 0.000 1.281 1338 A HN 0.413 nan 8.150 nan 0.000 0.421 1339 V N -0.646 119.304 119.914 0.060 0.000 3.403 1339 V HA 0.895 5.015 4.120 -0.000 0.000 0.305 1339 V C 0.561 176.696 176.094 0.069 0.000 1.060 1339 V CA 0.550 62.894 62.300 0.073 0.000 1.053 1339 V CB 0.832 32.697 31.823 0.070 0.000 1.198 1339 V HN 2.923 nan 8.190 nan 0.000 0.447 1340 S N 0.206 115.959 115.700 0.088 0.000 4.024 1340 S HA 0.078 4.548 4.470 -0.000 0.000 0.651 1340 S C -1.085 173.506 174.600 -0.015 0.000 1.390 1340 S CA 0.408 58.637 58.200 0.048 0.000 1.539 1340 S CB -0.856 62.357 63.200 0.022 0.000 0.334 1340 S HN 2.679 nan 8.310 nan 0.000 1.574 1341 L N -1.050 120.103 121.223 -0.117 0.000 2.933 1341 L HA 0.827 5.167 4.340 -0.000 0.000 0.271 1341 L C 1.019 177.599 176.870 -0.484 0.000 1.071 1341 L CA 0.328 55.013 54.840 -0.259 0.000 0.938 1341 L CB 0.169 42.043 42.059 -0.309 0.000 1.534 1341 L HN 2.408 nan 8.230 nan 0.000 0.396 1342 G N 0.140 108.459 108.800 -0.801 0.000 2.147 1342 G HA2 -0.175 3.785 3.960 -0.000 0.000 0.244 1342 G HA3 -0.175 3.785 3.960 -0.000 0.000 0.244 1342 G C -0.208 174.402 174.900 -0.484 0.000 1.005 1342 G CA 0.527 44.880 45.100 -1.245 0.000 0.713 1342 G HN 0.843 nan 8.290 nan 0.000 0.515 1343 D N -0.850 119.403 120.400 -0.245 0.000 2.387 1343 D HA 0.647 5.287 4.640 -0.000 0.000 0.255 1343 D C 1.507 177.802 176.300 -0.008 0.000 1.081 1343 D CA 0.142 54.077 54.000 -0.108 0.000 0.994 1343 D CB 1.153 41.900 40.800 -0.088 0.000 1.127 1343 D HN 0.251 nan 8.370 nan 0.000 0.513 1344 A N 0.673 123.440 122.820 -0.089 0.000 2.015 1344 A HA -0.120 4.200 4.320 -0.000 0.000 0.219 1344 A C 0.684 178.210 177.584 -0.095 0.000 1.163 1344 A CA 1.169 53.138 52.037 -0.113 0.000 0.646 1344 A CB -0.265 18.630 19.000 -0.175 0.000 0.806 1344 A HN 0.488 nan 8.150 nan 0.000 0.448 1345 E N 0.752 120.899 120.200 -0.088 0.000 2.259 1345 E HA 0.401 4.751 4.350 -0.000 0.000 0.281 1345 E C -0.378 176.129 176.600 -0.155 0.000 1.027 1345 E CA -0.075 56.255 56.400 -0.116 0.000 0.838 1345 E CB 1.090 30.741 29.700 -0.081 0.000 1.066 1345 E HN 0.204 nan 8.360 nan 0.000 0.401 1346 S N 2.916 118.433 115.700 -0.304 0.000 2.531 1346 S HA 0.244 4.714 4.470 -0.000 0.000 0.279 1346 S C -0.155 174.268 174.600 -0.295 0.000 1.305 1346 S CA -0.341 57.548 58.200 -0.519 0.000 1.058 1346 S CB 0.103 62.453 63.200 -1.415 0.000 0.899 1346 S HN 0.295 nan 8.310 nan 0.000 0.493 1347 L N 2.127 123.342 121.223 -0.015 0.000 2.341 1347 L HA 0.917 5.257 4.340 -0.000 0.000 0.267 1347 L C -0.103 177.016 176.870 0.414 0.000 1.009 1347 L CA -0.880 54.066 54.840 0.177 0.000 0.819 1347 L CB 1.830 43.937 42.059 0.080 0.000 1.323 1347 L HN 0.672 nan 8.230 nan 0.000 0.425 1348 A N 1.992 125.024 122.820 0.353 0.000 2.515 1348 A HA 0.789 5.109 4.320 -0.000 0.000 0.298 1348 A C -1.499 176.205 177.584 0.200 0.000 1.059 1348 A CA -0.481 51.737 52.037 0.301 0.000 0.698 1348 A CB 2.201 21.371 19.000 0.284 0.000 1.289 1348 A HN 0.727 nan 8.150 nan 0.000 0.404 1349 Q N 0.857 120.759 119.800 0.170 0.000 2.435 1349 Q HA 0.526 4.866 4.340 -0.000 0.000 0.282 1349 Q C -1.674 174.422 176.000 0.161 0.000 1.020 1349 Q CA -0.749 55.142 55.803 0.147 0.000 0.820 1349 Q CB 1.667 30.473 28.738 0.114 0.000 1.436 1349 Q HN 0.845 nan 8.270 nan 0.000 0.395 1350 H N 2.558 121.646 119.070 0.030 0.000 2.675 1350 H HA 0.233 4.789 4.556 -0.000 0.000 0.258 1350 H C -2.172 173.160 175.328 0.008 0.000 1.271 1350 H CA -2.193 53.853 56.048 -0.003 0.000 1.462 1350 H CB 1.521 31.289 29.762 0.010 0.000 1.467 1350 H HN 0.517 nan 8.280 nan 0.000 0.501 1351 P HA -0.253 nan 4.420 nan 0.000 0.219 1351 P C 1.428 178.609 177.300 -0.198 0.000 1.158 1351 P CA 2.348 65.387 63.100 -0.101 0.000 0.895 1351 P CB 0.148 31.827 31.700 -0.034 0.000 0.792 1352 A N -0.500 122.050 122.820 -0.450 0.000 1.978 1352 A HA -0.184 4.136 4.320 -0.000 0.000 0.220 1352 A C 2.227 179.640 177.584 -0.284 0.000 1.170 1352 A CA 2.406 54.217 52.037 -0.377 0.000 0.636 1352 A CB -1.306 17.450 19.000 -0.407 0.000 0.810 1352 A HN 0.398 nan 8.150 nan 0.000 0.448 1353 S N -2.777 112.706 115.700 -0.362 0.000 2.512 1353 S HA 0.337 4.807 4.470 -0.000 0.000 0.216 1353 S C 1.478 176.073 174.600 -0.009 0.000 1.006 1353 S CA 0.493 58.675 58.200 -0.030 0.000 0.915 1353 S CB -0.037 63.321 63.200 0.262 0.000 0.824 1353 S HN 0.437 nan 8.310 nan 0.000 0.497 1354 M N 1.607 121.172 119.600 -0.057 0.000 2.886 1354 M HA 0.130 4.610 4.480 -0.000 0.000 0.199 1354 M C 2.557 178.794 176.300 -0.105 0.000 1.435 1354 M CA 1.346 56.621 55.300 -0.041 0.000 1.387 1354 M CB -0.440 32.156 32.600 -0.007 0.000 0.981 1354 M HN 0.393 nan 8.290 nan 0.000 0.533 1355 T N -1.400 113.055 114.554 -0.166 0.000 2.674 1355 T HA -0.169 4.181 4.350 -0.000 0.000 0.265 1355 T C 1.060 175.444 174.700 -0.527 0.000 1.039 1355 T CA 1.626 63.514 62.100 -0.353 0.000 1.150 1355 T CB -0.881 67.702 68.868 -0.475 0.000 0.864 1355 T HN 0.414 nan 8.240 nan 0.000 0.427 1356 H N 0.593 119.472 119.070 -0.318 0.000 2.568 1356 H HA 0.549 5.105 4.556 -0.000 0.000 0.302 1356 H C 2.054 177.271 175.328 -0.186 0.000 1.065 1356 H CA 0.183 55.973 56.048 -0.430 0.000 1.140 1356 H CB 0.044 29.360 29.762 -0.742 0.000 1.474 1356 H HN 0.376 nan 8.280 nan 0.000 0.545 1357 S N 0.541 116.211 115.700 -0.050 0.000 2.400 1357 S HA -0.226 4.244 4.470 -0.000 0.000 0.232 1357 S C 2.351 176.982 174.600 0.051 0.000 1.025 1357 S CA 1.636 59.835 58.200 -0.002 0.000 0.993 1357 S CB -0.183 63.011 63.200 -0.009 0.000 0.808 1357 S HN 0.577 nan 8.310 nan 0.000 0.478 1358 S N -0.954 114.789 115.700 0.072 0.000 2.522 1358 S HA 0.147 4.617 4.470 -0.000 0.000 0.227 1358 S C 0.706 175.412 174.600 0.176 0.000 0.986 1358 S CA -0.577 57.682 58.200 0.100 0.000 0.929 1358 S CB -0.592 62.653 63.200 0.075 0.000 0.769 1358 S HN 0.642 nan 8.310 nan 0.000 0.529 1359 Y N 2.679 122.979 120.300 0.000 0.000 2.279 1359 Y HA 0.234 4.784 4.550 -0.000 0.000 0.350 1359 Y C 1.506 177.406 175.900 -0.000 0.000 1.288 1359 Y CA 0.166 58.269 58.100 0.005 0.000 1.547 1359 Y CB 0.539 39.014 38.460 0.026 0.000 1.381 1359 Y HN 0.262 nan 8.280 nan 0.000 0.630 1360 T N -1.582 113.037 114.554 0.110 0.000 2.943 1360 T HA 0.241 4.591 4.350 -0.000 0.000 0.284 1360 T C -2.202 172.552 174.700 0.090 0.000 1.015 1360 T CA -2.140 59.996 62.100 0.059 0.000 1.042 1360 T CB 1.565 70.432 68.868 -0.002 0.000 1.055 1360 T HN 0.281 nan 8.240 nan 0.000 0.500 1361 P HA -0.168 nan 4.420 nan 0.000 0.216 1361 P C 1.653 178.991 177.300 0.063 0.000 1.150 1361 P CA 1.112 64.247 63.100 0.058 0.000 0.843 1361 P CB 0.084 31.808 31.700 0.040 0.000 0.787 1362 E N 0.466 120.697 120.200 0.052 0.000 2.072 1362 E HA -0.190 4.160 4.350 -0.000 0.000 0.190 1362 E C 1.793 178.446 176.600 0.088 0.000 0.982 1362 E CA 1.228 57.662 56.400 0.056 0.000 0.803 1362 E CB -1.011 28.708 29.700 0.031 0.000 0.755 1362 E HN 0.312 nan 8.360 nan 0.000 0.453 1363 E N 0.858 121.092 120.200 0.057 0.000 2.077 1363 E HA -0.115 4.235 4.350 -0.000 0.000 0.193 1363 E C 2.364 179.145 176.600 0.301 0.000 0.989 1363 E CA 0.947 57.366 56.400 0.031 0.000 0.800 1363 E CB -0.043 29.506 29.700 -0.252 0.000 0.746 1363 E HN 0.152 nan 8.360 nan 0.000 0.452 1364 R N 0.047 120.757 120.500 0.350 0.000 2.066 1364 R HA -0.086 4.254 4.340 -0.000 0.000 0.232 1364 R C 2.313 178.681 176.300 0.113 0.000 1.131 1364 R CA 1.105 57.339 56.100 0.224 0.000 0.955 1364 R CB -0.206 30.138 30.300 0.074 0.000 0.851 1364 R HN 0.121 nan 8.270 nan 0.000 0.432 1365 A N 0.513 123.393 122.820 0.099 0.000 1.978 1365 A HA -0.232 4.088 4.320 -0.000 0.000 0.220 1365 A C 2.015 179.642 177.584 0.072 0.000 1.170 1365 A CA 1.578 53.649 52.037 0.057 0.000 0.636 1365 A CB -0.832 18.194 19.000 0.044 0.000 0.810 1365 A HN 0.444 nan 8.150 nan 0.000 0.448 1366 H N -1.935 117.157 119.070 0.037 0.000 2.321 1366 H HA -0.195 4.361 4.556 -0.000 0.000 0.300 1366 H C 1.870 177.205 175.328 0.011 0.000 1.087 1366 H CA 2.134 58.196 56.048 0.023 0.000 1.319 1366 H CB -0.534 29.253 29.762 0.041 0.000 1.379 1366 H HN 0.566 nan 8.280 nan 0.000 0.501 1367 Y N 0.550 120.959 120.300 0.181 0.000 2.497 1367 Y HA -0.002 4.548 4.550 -0.000 0.000 0.292 1367 Y C 1.491 177.301 175.900 -0.150 0.000 1.137 1367 Y CA 1.513 59.620 58.100 0.011 0.000 1.285 1367 Y CB -0.086 38.331 38.460 -0.072 0.000 0.991 1367 Y HN 0.532 nan 8.280 nan 0.000 0.556 1368 G N 0.192 108.967 108.800 -0.042 0.000 2.131 1368 G HA2 -0.192 3.768 3.960 -0.000 0.000 0.201 1368 G HA3 -0.192 3.768 3.960 -0.000 0.000 0.201 1368 G C -0.383 174.477 174.900 -0.066 0.000 1.000 1368 G CA -0.009 45.023 45.100 -0.113 0.000 0.680 1368 G HN 0.141 nan 8.290 nan 0.000 0.514 1369 I N 1.846 122.384 120.570 -0.053 0.000 2.304 1369 I HA 0.452 4.622 4.170 -0.000 0.000 0.291 1369 I C 0.937 177.000 176.117 -0.089 0.000 1.018 1369 I CA -0.541 60.678 61.300 -0.134 0.000 1.260 1369 I CB 0.844 38.628 38.000 -0.360 0.000 1.390 1369 I HN 0.121 nan 8.210 nan 0.000 0.475 1370 S N 4.487 120.148 115.700 -0.065 0.000 2.603 1370 S HA 0.168 4.638 4.470 -0.000 0.000 0.268 1370 S C 1.287 175.868 174.600 -0.031 0.000 1.317 1370 S CA -0.389 57.795 58.200 -0.027 0.000 1.012 1370 S CB 0.965 64.168 63.200 0.005 0.000 0.926 1370 S HN 0.507 nan 8.310 nan 0.000 0.539 1371 E N 2.493 122.698 120.200 0.008 0.000 2.158 1371 E HA 0.016 4.366 4.350 -0.000 0.000 0.191 1371 E C 1.445 178.139 176.600 0.156 0.000 0.982 1371 E CA 0.795 57.218 56.400 0.040 0.000 0.823 1371 E CB -0.357 29.371 29.700 0.048 0.000 0.766 1371 E HN 0.751 nan 8.360 nan 0.000 0.468 1372 G N 0.741 109.609 108.800 0.114 0.000 3.575 1372 G HA2 0.145 4.105 3.960 -0.000 0.000 0.273 1372 G HA3 0.145 4.105 3.960 -0.000 0.000 0.273 1372 G C 0.213 175.120 174.900 0.011 0.000 1.053 1372 G CA -0.359 44.803 45.100 0.104 0.000 0.803 1372 G HN 0.026 nan 8.290 nan 0.000 0.528 1373 L N 2.250 123.502 121.223 0.048 0.000 2.305 1373 L HA 0.639 4.979 4.340 -0.000 0.000 0.281 1373 L C -0.337 176.515 176.870 -0.030 0.000 1.085 1373 L CA -0.294 54.523 54.840 -0.039 0.000 0.813 1373 L CB 1.328 43.391 42.059 0.006 0.000 1.157 1373 L HN -0.007 nan 8.230 nan 0.000 0.436 1374 V N 5.612 125.332 119.914 -0.323 0.000 2.709 1374 V HA 0.601 4.721 4.120 -0.000 0.000 0.308 1374 V C -0.674 175.285 176.094 -0.226 0.000 1.062 1374 V CA -0.950 61.182 62.300 -0.279 0.000 0.901 1374 V CB 2.092 33.592 31.823 -0.538 0.000 1.003 1374 V HN 0.955 nan 8.190 nan 0.000 0.425 1375 R N 4.059 124.555 120.500 -0.007 0.000 2.346 1375 R HA 0.710 5.050 4.340 -0.000 0.000 0.311 1375 R C -1.775 174.621 176.300 0.159 0.000 0.983 1375 R CA -0.776 55.384 56.100 0.099 0.000 0.880 1375 R CB 1.591 31.977 30.300 0.144 0.000 1.100 1375 R HN 0.736 nan 8.270 nan 0.000 0.453 1376 L N 2.233 123.590 121.223 0.223 0.000 2.333 1376 L HA 0.306 4.646 4.340 -0.000 0.000 0.280 1376 L C -0.255 176.791 176.870 0.293 0.000 1.004 1376 L CA 0.100 55.127 54.840 0.311 0.000 0.820 1376 L CB 1.865 44.126 42.059 0.336 0.000 1.247 1376 L HN 0.523 nan 8.230 nan 0.000 0.416 1377 S N 3.334 119.207 115.700 0.289 0.000 2.466 1377 S HA 0.437 4.907 4.470 -0.000 0.000 0.313 1377 S C -0.380 174.330 174.600 0.184 0.000 1.078 1377 S CA -0.604 57.682 58.200 0.144 0.000 1.115 1377 S CB 0.147 63.348 63.200 0.002 0.000 1.006 1377 S HN 0.303 nan 8.310 nan 0.000 0.487 1378 V N 6.007 126.058 119.914 0.228 0.000 2.450 1378 V HA 0.302 4.422 4.120 -0.000 0.000 0.281 1378 V C 1.559 177.777 176.094 0.208 0.000 1.019 1378 V CA 0.233 62.652 62.300 0.199 0.000 1.062 1378 V CB 0.042 31.992 31.823 0.212 0.000 0.979 1378 V HN 0.887 nan 8.190 nan 0.000 0.477 1379 G N 3.858 112.649 108.800 -0.016 0.000 2.489 1379 G HA2 0.354 4.314 3.960 -0.000 0.000 0.271 1379 G HA3 0.354 4.314 3.960 -0.000 0.000 0.271 1379 G C 0.602 175.419 174.900 -0.139 0.000 1.427 1379 G CA -0.695 44.399 45.100 -0.009 0.000 1.057 1379 G HN 0.640 nan 8.290 nan 0.000 0.532 1380 L N -0.321 120.766 121.223 -0.227 0.000 2.607 1380 L HA 0.205 4.545 4.340 -0.000 0.000 0.228 1380 L C 0.751 177.520 176.870 -0.167 0.000 1.123 1380 L CA -0.044 54.636 54.840 -0.266 0.000 0.890 1380 L CB -0.241 41.643 42.059 -0.291 0.000 1.103 1380 L HN 0.405 nan 8.230 nan 0.000 0.468 1381 E N 0.513 120.623 120.200 -0.151 0.000 2.455 1381 E HA -0.081 4.269 4.350 -0.000 0.000 0.259 1381 E C 0.201 176.745 176.600 -0.095 0.000 1.245 1381 E CA 0.122 56.451 56.400 -0.119 0.000 1.013 1381 E CB 0.299 29.920 29.700 -0.132 0.000 0.978 1381 E HN -0.018 nan 8.360 nan 0.000 0.479 1382 D N 0.659 121.015 120.400 -0.074 0.000 2.417 1382 D HA -0.066 4.574 4.640 -0.000 0.000 0.250 1382 D C 0.915 177.181 176.300 -0.058 0.000 1.166 1382 D CA -0.155 53.809 54.000 -0.060 0.000 0.881 1382 D CB 0.683 41.453 40.800 -0.050 0.000 1.164 1382 D HN 0.331 nan 8.370 nan 0.000 0.467 1383 I N 4.373 124.911 120.570 -0.054 0.000 2.248 1383 I HA -0.288 3.882 4.170 -0.000 0.000 0.248 1383 I C 1.411 177.485 176.117 -0.070 0.000 1.107 1383 I CA 1.523 62.790 61.300 -0.054 0.000 1.373 1383 I CB -0.120 37.852 38.000 -0.048 0.000 1.055 1383 I HN 0.394 nan 8.210 nan 0.000 0.418 1384 D N 0.736 121.097 120.400 -0.065 0.000 2.123 1384 D HA -0.187 4.453 4.640 -0.000 0.000 0.196 1384 D C 1.843 178.099 176.300 -0.072 0.000 0.992 1384 D CA 1.587 55.544 54.000 -0.073 0.000 0.833 1384 D CB -0.390 40.379 40.800 -0.053 0.000 0.954 1384 D HN 0.438 nan 8.370 nan 0.000 0.455 1385 D N 0.087 120.455 120.400 -0.053 0.000 2.144 1385 D HA -0.074 4.566 4.640 -0.000 0.000 0.200 1385 D C 2.395 178.683 176.300 -0.020 0.000 0.978 1385 D CA 0.357 54.333 54.000 -0.039 0.000 0.833 1385 D CB -0.166 40.612 40.800 -0.036 0.000 0.961 1385 D HN 0.252 nan 8.370 nan 0.000 0.470 1386 L N 0.320 121.537 121.223 -0.010 0.000 2.056 1386 L HA -0.119 4.221 4.340 -0.000 0.000 0.207 1386 L C 2.605 179.486 176.870 0.019 0.000 1.078 1386 L CA 0.586 55.478 54.840 0.086 0.000 0.749 1386 L CB -0.357 41.761 42.059 0.099 0.000 0.901 1386 L HN -0.004 nan 8.230 nan 0.000 0.433 1387 L N -0.386 120.751 121.223 -0.144 0.000 2.046 1387 L HA -0.198 4.142 4.340 -0.000 0.000 0.208 1387 L C 2.872 179.553 176.870 -0.315 0.000 1.077 1387 L CA 1.198 55.792 54.840 -0.411 0.000 0.747 1387 L CB -0.694 41.054 42.059 -0.518 0.000 0.896 1387 L HN 0.235 nan 8.230 nan 0.000 0.432 1388 A N -0.210 122.514 122.820 -0.160 0.000 1.877 1388 A HA -0.287 4.033 4.320 -0.000 0.000 0.216 1388 A C 2.016 179.572 177.584 -0.046 0.000 1.186 1388 A CA 2.123 54.108 52.037 -0.088 0.000 0.620 1388 A CB -0.670 18.298 19.000 -0.055 0.000 0.822 1388 A HN 0.417 nan 8.150 nan 0.000 0.443 1389 D N -0.500 119.890 120.400 -0.017 0.000 2.117 1389 D HA -0.114 4.526 4.640 -0.000 0.000 0.197 1389 D C 1.846 178.120 176.300 -0.043 0.000 0.987 1389 D CA 1.514 55.515 54.000 0.001 0.000 0.829 1389 D CB -0.122 40.737 40.800 0.097 0.000 0.961 1389 D HN 0.147 nan 8.370 nan 0.000 0.460 1390 V N 0.223 120.125 119.914 -0.020 0.000 2.358 1390 V HA -0.212 3.908 4.120 -0.000 0.000 0.246 1390 V C 2.590 178.778 176.094 0.156 0.000 1.047 1390 V CA 1.782 64.106 62.300 0.040 0.000 1.035 1390 V CB -0.631 31.239 31.823 0.079 0.000 0.658 1390 V HN 0.281 nan 8.190 nan 0.000 0.452 1391 Q N 0.318 120.192 119.800 0.123 0.000 2.002 1391 Q HA -0.340 4.000 4.340 -0.000 0.000 0.204 1391 Q C 2.378 178.452 176.000 0.123 0.000 0.988 1391 Q CA 2.590 58.525 55.803 0.220 0.000 0.843 1391 Q CB -0.116 28.715 28.738 0.156 0.000 0.908 1391 Q HN 0.871 nan 8.270 nan 0.000 0.420 1392 Q N -0.477 119.350 119.800 0.045 0.000 2.170 1392 Q HA -0.080 4.260 4.340 -0.000 0.000 0.203 1392 Q C 1.725 177.718 176.000 -0.013 0.000 0.976 1392 Q CA 1.697 57.508 55.803 0.014 0.000 0.858 1392 Q CB -0.564 28.166 28.738 -0.012 0.000 0.907 1392 Q HN 0.358 nan 8.270 nan 0.000 0.433 1393 A N 0.895 123.666 122.820 -0.081 0.000 1.930 1393 A HA 0.007 4.327 4.320 -0.000 0.000 0.217 1393 A C 2.145 179.774 177.584 0.074 0.000 1.175 1393 A CA 1.076 52.971 52.037 -0.236 0.000 0.627 1393 A CB -0.637 17.862 19.000 -0.835 0.000 0.815 1393 A HN 0.402 nan 8.150 nan 0.000 0.443 1394 L N -1.031 120.352 121.223 0.267 0.000 2.056 1394 L HA -0.169 4.171 4.340 -0.000 0.000 0.207 1394 L C 2.477 179.447 176.870 0.167 0.000 1.078 1394 L CA 1.293 56.331 54.840 0.331 0.000 0.749 1394 L CB -0.270 41.927 42.059 0.229 0.000 0.901 1394 L HN 0.171 nan 8.230 nan 0.000 0.433 1395 K N 0.251 120.715 120.400 0.107 0.000 2.097 1395 K HA -0.058 4.262 4.320 -0.000 0.000 0.205 1395 K C 2.021 178.655 176.600 0.056 0.000 1.050 1395 K CA 1.348 57.674 56.287 0.065 0.000 0.938 1395 K CB -0.711 31.818 32.500 0.048 0.000 0.718 1395 K HN 0.231 nan 8.250 nan 0.000 0.442 1396 A N 0.725 123.575 122.820 0.051 0.000 2.172 1396 A HA -0.101 4.219 4.320 -0.000 0.000 0.216 1396 A C 1.980 179.598 177.584 0.058 0.000 1.154 1396 A CA 1.626 53.684 52.037 0.035 0.000 0.701 1396 A CB -0.686 18.314 19.000 -0.000 0.000 0.789 1396 A HN 0.373 nan 8.150 nan 0.000 0.465 1397 S N -0.251 115.511 115.700 0.104 0.000 2.522 1397 S HA 0.401 4.871 4.470 -0.000 0.000 0.227 1397 S C 1.131 175.770 174.600 0.065 0.000 0.986 1397 S CA 0.434 58.701 58.200 0.111 0.000 0.929 1397 S CB -0.656 62.650 63.200 0.176 0.000 0.769 1397 S HN 0.818 nan 8.310 nan 0.000 0.529 1398 A N 0.000 122.851 122.820 0.052 0.000 2.254 1398 A HA 0.000 4.320 4.320 -0.000 0.000 0.244 1398 A CA 0.000 52.058 52.037 0.034 0.000 0.836 1398 A CB 0.000 19.017 19.000 0.028 0.000 0.831 1398 A HN 0.000 nan 8.150 nan 0.000 0.486