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 1mx9_1_F DATA FIRST_RESID 6022 DATA SEQUENCE SPPVVDTVHG KVLGKFVSLE GFAQPVAIFL GIPFAKPPLG PLRFTPPQPA DATA SEQUENCE EPWSFVKNAT SYPPMcTQDP KAGQLLSELF TNRKENIPLK LSEDcLYLNI DATA SEQUENCE YTPADLTKKN RLPVMVWIHG GGLMVGAAST YDGLALAAHE NVVVVTIQYR DATA SEQUENCE LGIWGFFSTG DEHSRGNWGH LDQVAALRWV QDNIASFGGN PGSVTIFGES DATA SEQUENCE AGGESVSVLV LSPLAKNLFH RAISESGVAL TSVLVKKGDV KPLAEQIAIT DATA SEQUENCE AGcKTTTSAV MVHcLRQKTE EELLETTLKM KFLSLDLQGD PRESQPLLGT DATA SEQUENCE VIDGMLLLKT PEELQAERNF HTVPYMVGIN KQEFGWLIPM XLMSYPLSEG DATA SEQUENCE QLDQKTAMSL LWKSYPLVCI AKELIPEATE KYLGGTDDTV KKKDLFLDLI DATA SEQUENCE ADVMFGVPSV IVARNHRDAG APTYMYEFQY RPSFSSDMKP KTVIGDHGDE DATA SEQUENCE LFSVFGAPFL KEGASEEEIR LSKMVMKFWA NFARNGNPNG EGLPHWPEYN DATA SEQUENCE QKEGYLQIGA NTQAAQKLKD KEVAFWTNLF AK 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 6022 S HA 0.000 nan 4.470 nan 0.000 0.327 6022 S C 0.000 174.680 174.600 0.133 0.000 1.055 6022 S CA 0.000 58.269 58.200 0.115 0.000 1.107 6022 S CB 0.000 63.244 63.200 0.074 0.000 0.593 6023 P HA 0.314 nan 4.420 nan 0.000 0.264 6023 P C -2.613 174.578 177.300 -0.182 0.000 1.179 6023 P CA -0.259 62.771 63.100 -0.117 0.000 0.763 6023 P CB -0.550 31.090 31.700 -0.099 0.000 0.806 6024 P HA 0.170 nan 4.420 nan 0.000 0.280 6024 P C -1.053 176.189 177.300 -0.096 0.000 1.244 6024 P CA 0.051 62.938 63.100 -0.355 0.000 0.784 6024 P CB 0.691 31.948 31.700 -0.738 0.000 0.913 6025 V N 4.519 124.458 119.914 0.042 0.000 2.482 6025 V HA 0.270 4.389 4.120 -0.002 0.000 0.295 6025 V C -0.092 176.053 176.094 0.086 0.000 1.026 6025 V CA -0.620 61.750 62.300 0.117 0.000 0.856 6025 V CB 2.155 34.026 31.823 0.081 0.000 1.001 6025 V HN 0.218 nan 8.190 nan 0.000 0.424 6026 V N 3.060 123.020 119.914 0.077 0.000 2.547 6026 V HA 0.433 4.552 4.120 -0.002 0.000 0.299 6026 V C -0.353 175.681 176.094 -0.100 0.000 1.040 6026 V CA -0.564 61.609 62.300 -0.211 0.000 0.913 6026 V CB 2.156 33.432 31.823 -0.912 0.000 0.992 6026 V HN 0.934 nan 8.190 nan 0.000 0.449 6027 D N 3.055 123.380 120.400 -0.124 0.000 2.428 6027 D HA 0.392 5.031 4.640 -0.002 0.000 0.221 6027 D C 0.393 176.645 176.300 -0.079 0.000 1.123 6027 D CA -0.081 53.884 54.000 -0.059 0.000 0.869 6027 D CB 0.949 41.713 40.800 -0.060 0.000 1.032 6027 D HN 0.774 nan 8.370 nan 0.000 0.506 6028 T N -0.377 114.174 114.554 -0.005 0.000 2.849 6028 T HA 0.221 4.570 4.350 -0.002 0.000 0.276 6028 T C 1.508 176.126 174.700 -0.137 0.000 0.971 6028 T CA -0.706 61.390 62.100 -0.006 0.000 0.949 6028 T CB 0.995 70.002 68.868 0.231 0.000 1.093 6028 T HN 0.040 nan 8.240 nan 0.000 0.545 6029 V N 1.182 120.950 119.914 -0.243 0.000 2.343 6029 V HA -0.135 3.984 4.120 -0.002 0.000 0.247 6029 V C 2.480 178.416 176.094 -0.263 0.000 1.051 6029 V CA 1.736 63.859 62.300 -0.294 0.000 1.036 6029 V CB -1.117 30.455 31.823 -0.419 0.000 0.654 6029 V HN 0.860 nan 8.190 nan 0.000 0.451 6030 H N -0.345 118.530 119.070 -0.325 0.000 2.551 6030 H HA 0.449 5.004 4.556 -0.002 0.000 0.266 6030 H C 0.935 175.503 175.328 -1.267 0.000 0.964 6030 H CA 0.707 56.362 56.048 -0.655 0.000 1.180 6030 H CB 0.309 29.697 29.762 -0.624 0.000 1.408 6030 H HN 0.527 nan 8.280 nan 0.000 0.563 6031 G N -0.217 108.059 108.800 -0.874 0.000 2.356 6031 G HA2 0.082 4.041 3.960 -0.002 0.000 0.300 6031 G HA3 0.082 4.041 3.960 -0.002 0.000 0.300 6031 G C -1.405 173.456 174.900 -0.065 0.000 1.331 6031 G CA -1.151 43.448 45.100 -0.835 0.000 0.905 6031 G HN 0.016 nan 8.290 nan 0.000 0.587 6032 K N 0.124 120.667 120.400 0.239 0.000 2.297 6032 K HA 0.520 4.839 4.320 -0.002 0.000 0.286 6032 K C 0.433 177.358 176.600 0.543 0.000 1.053 6032 K CA -0.500 55.984 56.287 0.328 0.000 0.940 6032 K CB 1.783 34.417 32.500 0.223 0.000 1.019 6032 K HN 0.808 nan 8.250 nan 0.000 0.475 6033 V N 1.497 121.682 119.914 0.452 0.000 2.547 6033 V HA 0.505 4.624 4.120 -0.002 0.000 0.299 6033 V C -0.576 175.773 176.094 0.425 0.000 1.040 6033 V CA -1.076 61.510 62.300 0.477 0.000 0.913 6033 V CB 1.587 33.754 31.823 0.572 0.000 0.992 6033 V HN 0.587 nan 8.190 nan 0.000 0.449 6034 L N 4.506 125.909 121.223 0.300 0.000 2.325 6034 L HA 0.884 5.223 4.340 -0.002 0.000 0.281 6034 L C 0.241 177.072 176.870 -0.066 0.000 1.004 6034 L CA 0.525 55.440 54.840 0.126 0.000 0.823 6034 L CB 1.043 43.130 42.059 0.047 0.000 1.236 6034 L HN 0.988 nan 8.230 nan 0.000 0.415 6035 G N 4.969 113.499 108.800 -0.450 0.000 3.099 6035 G HA2 0.605 4.564 3.960 -0.002 0.000 0.151 6035 G HA3 0.605 4.564 3.960 -0.002 0.000 0.151 6035 G C -1.121 173.423 174.900 -0.594 0.000 1.265 6035 G CA -0.429 44.147 45.100 -0.875 0.000 0.981 6035 G HN 0.709 nan 8.290 nan 0.000 0.601 6036 K N -1.177 118.839 120.400 -0.640 0.000 2.562 6036 K HA 0.468 4.787 4.320 -0.002 0.000 0.267 6036 K C -1.890 174.512 176.600 -0.330 0.000 0.938 6036 K CA -0.786 55.263 56.287 -0.397 0.000 0.840 6036 K CB 1.543 33.907 32.500 -0.227 0.000 1.390 6036 K HN 0.298 nan 8.250 nan 0.000 0.428 6037 F N 1.495 121.396 119.950 -0.082 0.000 2.404 6037 F HA 0.432 4.958 4.527 -0.002 0.000 0.345 6037 F C -0.275 175.524 175.800 -0.001 0.000 1.110 6037 F CA -0.818 57.167 58.000 -0.026 0.000 1.130 6037 F CB 1.889 40.887 39.000 -0.003 0.000 1.129 6037 F HN 0.104 nan 8.300 nan 0.000 0.500 6038 V N 3.350 123.431 119.914 0.278 0.000 2.567 6038 V HA 0.211 4.330 4.120 -0.002 0.000 0.298 6038 V C -0.554 175.632 176.094 0.153 0.000 1.047 6038 V CA -0.850 61.553 62.300 0.171 0.000 0.880 6038 V CB 1.846 33.753 31.823 0.141 0.000 1.009 6038 V HN 0.797 nan 8.190 nan 0.000 0.429 6039 S N 5.226 120.994 115.700 0.114 0.000 2.646 6039 S HA 0.854 5.323 4.470 -0.002 0.000 0.276 6039 S C -0.733 173.931 174.600 0.107 0.000 1.222 6039 S CA -0.636 57.625 58.200 0.101 0.000 1.014 6039 S CB 2.169 65.415 63.200 0.077 0.000 0.991 6039 S HN 0.613 nan 8.310 nan 0.000 0.533 6040 L N 0.913 122.211 121.223 0.125 0.000 2.362 6040 L HA 0.542 4.881 4.340 -0.002 0.000 0.271 6040 L C -0.371 176.641 176.870 0.237 0.000 1.002 6040 L CA -0.447 54.475 54.840 0.138 0.000 0.818 6040 L CB 1.543 43.627 42.059 0.041 0.000 1.298 6040 L HN 0.688 nan 8.230 nan 0.000 0.420 6041 E N 2.961 123.289 120.200 0.212 0.000 2.765 6041 E HA 0.153 4.502 4.350 -0.002 0.000 0.256 6041 E C 0.955 177.714 176.600 0.265 0.000 0.935 6041 E CA 1.448 57.969 56.400 0.202 0.000 0.954 6041 E CB 0.103 29.914 29.700 0.185 0.000 0.908 6041 E HN 0.899 nan 8.360 nan 0.000 0.500 6042 G N 3.093 111.964 108.800 0.118 0.000 2.136 6042 G HA2 -0.282 3.677 3.960 -0.002 0.000 0.242 6042 G HA3 -0.282 3.677 3.960 -0.002 0.000 0.242 6042 G C -0.150 174.536 174.900 -0.357 0.000 0.989 6042 G CA -0.031 45.015 45.100 -0.090 0.000 0.682 6042 G HN 0.337 nan 8.290 nan 0.000 0.522 6043 F N -0.596 119.334 119.950 -0.033 0.000 2.745 6043 F HA 0.655 5.181 4.527 -0.002 0.000 0.343 6043 F C 1.069 176.857 175.800 -0.019 0.000 1.196 6043 F CA -0.197 57.784 58.000 -0.030 0.000 1.021 6043 F CB 1.161 40.151 39.000 -0.016 0.000 1.297 6043 F HN 0.114 nan 8.300 nan 0.000 0.486 6044 A N 1.915 124.775 122.820 0.067 0.000 1.877 6044 A HA -0.167 4.152 4.320 -0.002 0.000 0.216 6044 A C 1.278 178.886 177.584 0.040 0.000 1.186 6044 A CA 1.158 53.213 52.037 0.031 0.000 0.620 6044 A CB -0.478 18.516 19.000 -0.010 0.000 0.822 6044 A HN 0.682 nan 8.150 nan 0.000 0.443 6045 Q N 0.797 120.642 119.800 0.075 0.000 2.311 6045 Q HA 0.334 4.673 4.340 -0.002 0.000 0.272 6045 Q C -2.760 173.275 176.000 0.059 0.000 1.012 6045 Q CA -1.594 54.236 55.803 0.046 0.000 0.891 6045 Q CB 0.478 29.269 28.738 0.089 0.000 1.201 6045 Q HN 0.241 nan 8.270 nan 0.000 0.391 6046 P HA 0.192 nan 4.420 nan 0.000 0.290 6046 P C -1.178 176.213 177.300 0.152 0.000 1.275 6046 P CA -0.604 62.511 63.100 0.024 0.000 0.841 6046 P CB 1.260 32.889 31.700 -0.119 0.000 1.042 6047 V N 1.834 121.871 119.914 0.206 0.000 2.775 6047 V HA 0.425 4.544 4.120 -0.002 0.000 0.299 6047 V C 0.608 176.929 176.094 0.379 0.000 1.062 6047 V CA -0.239 62.218 62.300 0.262 0.000 1.063 6047 V CB 0.790 32.741 31.823 0.214 0.000 0.994 6047 V HN 0.668 nan 8.190 nan 0.000 0.483 6048 A N 6.207 129.258 122.820 0.385 0.000 2.253 6048 A HA 0.682 5.001 4.320 -0.002 0.000 0.316 6048 A C -0.444 177.225 177.584 0.142 0.000 1.327 6048 A CA -0.385 51.792 52.037 0.234 0.000 0.917 6048 A CB -0.044 19.157 19.000 0.335 0.000 1.162 6048 A HN 0.739 nan 8.150 nan 0.000 0.535 6049 I N 2.694 123.196 120.570 -0.114 0.000 2.321 6049 I HA 0.317 4.485 4.170 -0.002 0.000 0.291 6049 I C -1.153 174.706 176.117 -0.430 0.000 0.998 6049 I CA -0.202 60.983 61.300 -0.191 0.000 1.227 6049 I CB 1.079 39.007 38.000 -0.120 0.000 1.368 6049 I HN 0.540 nan 8.210 nan 0.000 0.466 6050 F N 6.978 126.801 119.950 -0.213 0.000 2.382 6050 F HA 0.443 4.969 4.527 -0.002 0.000 0.361 6050 F C -0.151 175.509 175.800 -0.233 0.000 1.109 6050 F CA -0.511 57.405 58.000 -0.140 0.000 1.031 6050 F CB 0.999 40.006 39.000 0.010 0.000 1.234 6050 F HN 0.149 nan 8.300 nan 0.000 0.445 6051 L N 3.113 124.254 121.223 -0.138 0.000 2.275 6051 L HA 0.602 4.940 4.340 -0.002 0.000 0.288 6051 L C 0.835 177.623 176.870 -0.136 0.000 1.046 6051 L CA -0.663 54.058 54.840 -0.198 0.000 0.805 6051 L CB 1.197 43.000 42.059 -0.426 0.000 1.193 6051 L HN 0.900 nan 8.230 nan 0.000 0.426 6052 G N 3.931 112.682 108.800 -0.082 0.000 2.291 6052 G HA2 -0.237 3.722 3.960 -0.002 0.000 0.271 6052 G HA3 -0.237 3.722 3.960 -0.002 0.000 0.271 6052 G C -0.236 174.689 174.900 0.041 0.000 1.099 6052 G CA -0.505 44.532 45.100 -0.105 0.000 0.919 6052 G HN 0.503 nan 8.290 nan 0.000 0.496 6053 I N 2.225 122.843 120.570 0.080 0.000 2.371 6053 I HA 0.272 4.441 4.170 -0.002 0.000 0.290 6053 I C -1.426 174.732 176.117 0.068 0.000 1.028 6053 I CA -2.217 59.117 61.300 0.056 0.000 1.345 6053 I CB 1.457 39.410 38.000 -0.079 0.000 1.407 6053 I HN 0.032 nan 8.210 nan 0.000 0.501 6054 P HA 0.118 nan 4.420 nan 0.000 0.286 6054 P C -0.339 176.834 177.300 -0.212 0.000 1.269 6054 P CA -0.159 62.788 63.100 -0.254 0.000 0.787 6054 P CB 0.805 32.410 31.700 -0.158 0.000 0.920 6055 F N 0.972 120.727 119.950 -0.325 0.000 2.706 6055 F HA 0.714 5.240 4.527 -0.002 0.000 0.308 6055 F C 0.175 176.006 175.800 0.051 0.000 1.095 6055 F CA -0.765 57.103 58.000 -0.220 0.000 1.244 6055 F CB 0.057 38.819 39.000 -0.396 0.000 1.063 6055 F HN 0.321 nan 8.300 nan 0.000 0.582 6056 A N 0.792 123.369 122.820 -0.406 0.000 2.566 6056 A HA 0.544 4.863 4.320 -0.002 0.000 0.292 6056 A C -1.015 176.431 177.584 -0.231 0.000 1.112 6056 A CA -1.106 50.810 52.037 -0.203 0.000 0.707 6056 A CB 1.034 19.890 19.000 -0.240 0.000 1.302 6056 A HN 0.179 nan 8.150 nan 0.000 0.409 6057 K N 1.133 121.465 120.400 -0.114 0.000 2.412 6057 K HA 0.322 4.641 4.320 -0.002 0.000 0.281 6057 K C -2.412 174.091 176.600 -0.161 0.000 1.027 6057 K CA -1.186 55.037 56.287 -0.106 0.000 0.989 6057 K CB 0.124 32.590 32.500 -0.057 0.000 0.935 6057 K HN 0.330 nan 8.250 nan 0.000 0.475 6058 P HA -0.056 nan 4.420 nan 0.000 0.260 6058 P C -2.405 174.812 177.300 -0.138 0.000 1.172 6058 P CA -0.778 62.219 63.100 -0.172 0.000 0.760 6058 P CB 0.177 31.809 31.700 -0.114 0.000 0.773 6059 P HA 0.067 nan 4.420 nan 0.000 0.225 6059 P C -0.641 176.580 177.300 -0.132 0.000 1.768 6059 P CA 0.415 63.432 63.100 -0.138 0.000 0.943 6059 P CB -0.004 31.614 31.700 -0.135 0.000 1.936 6060 L N -0.122 121.033 121.223 -0.112 0.000 2.344 6060 L HA 0.529 4.867 4.340 -0.002 0.000 0.272 6060 L C 1.782 178.593 176.870 -0.099 0.000 1.035 6060 L CA -0.265 54.517 54.840 -0.096 0.000 0.807 6060 L CB 0.654 42.668 42.059 -0.075 0.000 1.237 6060 L HN 0.281 nan 8.230 nan 0.000 0.442 6061 G N 2.103 110.848 108.800 -0.093 0.000 2.692 6061 G HA2 -0.321 3.638 3.960 -0.002 0.000 0.339 6061 G HA3 -0.321 3.638 3.960 -0.002 0.000 0.339 6061 G C -1.020 173.815 174.900 -0.109 0.000 1.226 6061 G CA 0.556 45.602 45.100 -0.091 0.000 0.979 6061 G HN 0.631 nan 8.290 nan 0.000 0.549 6062 P HA 0.033 nan 4.420 nan 0.000 0.220 6062 P C 1.990 179.234 177.300 -0.095 0.000 1.148 6062 P CA 1.411 64.474 63.100 -0.061 0.000 0.803 6062 P CB -0.131 31.552 31.700 -0.028 0.000 0.782 6063 L N -0.884 120.269 121.223 -0.116 0.000 2.610 6063 L HA 0.072 4.411 4.340 -0.002 0.000 0.232 6063 L C 1.723 178.451 176.870 -0.238 0.000 1.149 6063 L CA -0.098 54.655 54.840 -0.145 0.000 0.872 6063 L CB -0.506 41.484 42.059 -0.114 0.000 0.992 6063 L HN -0.030 nan 8.230 nan 0.000 0.447 6064 R N 0.723 121.045 120.500 -0.297 0.000 2.389 6064 R HA 0.033 4.372 4.340 -0.002 0.000 0.295 6064 R C -0.379 175.556 176.300 -0.608 0.000 1.075 6064 R CA -0.249 55.532 56.100 -0.531 0.000 1.005 6064 R CB 0.289 30.203 30.300 -0.644 0.000 0.987 6064 R HN 0.047 nan 8.270 nan 0.000 0.452 6065 F N 0.466 120.053 119.950 -0.605 0.000 3.023 6065 F HA -0.240 4.285 4.527 -0.002 0.000 0.297 6065 F C -0.178 174.631 175.800 -1.651 0.000 0.858 6065 F CA 1.345 58.647 58.000 -1.163 0.000 1.222 6065 F CB -2.504 36.280 39.000 -0.360 0.000 1.263 6065 F HN 0.699 nan 8.300 nan 0.000 0.565 6066 T N -2.436 111.341 114.554 -1.294 0.000 2.868 6066 T HA 0.758 5.107 4.350 -0.002 0.000 0.306 6066 T C -2.976 171.510 174.700 -0.356 0.000 1.224 6066 T CA -2.041 59.575 62.100 -0.807 0.000 1.012 6066 T CB 3.721 72.407 68.868 -0.303 0.000 1.221 6066 T HN -0.111 nan 8.240 nan 0.000 0.499 6067 P HA 0.238 nan 4.420 nan 0.000 0.268 6067 P C -2.464 174.896 177.300 0.100 0.000 1.208 6067 P CA -0.901 62.336 63.100 0.229 0.000 0.777 6067 P CB -0.636 31.209 31.700 0.242 0.000 0.875 6068 P HA 0.150 nan 4.420 nan 0.000 0.271 6068 P C -0.448 176.901 177.300 0.082 0.000 1.218 6068 P CA 0.172 63.322 63.100 0.085 0.000 0.780 6068 P CB 0.900 32.684 31.700 0.140 0.000 0.901 6069 Q N 2.122 121.950 119.800 0.046 0.000 2.348 6069 Q HA 0.418 4.757 4.340 -0.002 0.000 0.271 6069 Q C -2.138 173.906 176.000 0.073 0.000 1.067 6069 Q CA -2.245 53.590 55.803 0.054 0.000 0.839 6069 Q CB 1.784 30.535 28.738 0.022 0.000 1.354 6069 Q HN 0.405 nan 8.270 nan 0.000 0.447 6070 P HA -0.045 nan 4.420 nan 0.000 0.268 6070 P C -1.180 176.165 177.300 0.075 0.000 1.208 6070 P CA 0.167 63.356 63.100 0.148 0.000 0.777 6070 P CB 0.513 32.303 31.700 0.149 0.000 0.875 6071 A N 2.339 125.225 122.820 0.111 0.000 2.340 6071 A HA 0.239 4.558 4.320 -0.002 0.000 0.268 6071 A C 0.336 177.780 177.584 -0.233 0.000 1.100 6071 A CA -0.258 51.781 52.037 0.002 0.000 0.803 6071 A CB -0.218 18.882 19.000 0.168 0.000 1.043 6071 A HN 0.499 nan 8.150 nan 0.000 0.488 6072 E N 1.941 122.078 120.200 -0.105 0.000 2.354 6072 E HA 0.364 4.713 4.350 -0.002 0.000 0.269 6072 E C -2.001 174.547 176.600 -0.086 0.000 1.036 6072 E CA -1.146 55.181 56.400 -0.121 0.000 0.876 6072 E CB 0.574 30.269 29.700 -0.009 0.000 1.009 6072 E HN 0.519 nan 8.360 nan 0.000 0.416 6073 P HA 0.168 nan 4.420 nan 0.000 0.274 6073 P C -1.126 176.249 177.300 0.124 0.000 1.256 6073 P CA -0.430 62.567 63.100 -0.171 0.000 0.795 6073 P CB 0.441 32.019 31.700 -0.203 0.000 1.038 6074 W N -0.987 120.352 121.300 0.065 0.000 2.799 6074 W HA 0.613 5.273 4.660 -0.002 0.000 0.349 6074 W C 0.640 177.184 176.519 0.042 0.000 1.100 6074 W CA -0.667 56.721 57.345 0.072 0.000 1.174 6074 W CB -0.006 29.521 29.460 0.112 0.000 1.427 6074 W HN 0.096 nan 8.180 nan 0.000 0.547 6075 S N 0.418 116.268 115.700 0.249 0.000 2.395 6075 S HA 0.037 4.505 4.470 -0.002 0.000 0.225 6075 S C 0.601 175.044 174.600 -0.263 0.000 1.027 6075 S CA 0.855 59.002 58.200 -0.088 0.000 0.965 6075 S CB -0.275 62.783 63.200 -0.237 0.000 0.812 6075 S HN 0.427 nan 8.310 nan 0.000 0.482 6076 F N 0.247 120.339 119.950 0.237 0.000 3.034 6076 F HA 0.480 5.005 4.527 -0.002 0.000 0.165 6076 F C 0.165 176.133 175.800 0.279 0.000 1.484 6076 F CA -0.922 57.194 58.000 0.193 0.000 0.903 6076 F CB -0.370 38.706 39.000 0.126 0.000 2.041 6076 F HN -0.301 nan 8.300 nan 0.000 0.436 6077 V N 1.157 121.347 119.914 0.460 0.000 2.334 6077 V HA 0.265 4.384 4.120 -0.002 0.000 0.281 6077 V C -0.288 175.938 176.094 0.221 0.000 1.016 6077 V CA -1.199 61.303 62.300 0.338 0.000 0.832 6077 V CB 1.035 32.993 31.823 0.226 0.000 0.999 6077 V HN 0.338 nan 8.190 nan 0.000 0.439 6078 K N 4.183 124.693 120.400 0.183 0.000 2.368 6078 K HA 0.134 4.452 4.320 -0.002 0.000 0.282 6078 K C 0.457 177.042 176.600 -0.026 0.000 1.035 6078 K CA -0.104 56.098 56.287 -0.140 0.000 0.973 6078 K CB 0.334 32.464 32.500 -0.617 0.000 0.957 6078 K HN 0.727 nan 8.250 nan 0.000 0.474 6079 N N 3.343 121.997 118.700 -0.076 0.000 2.663 6079 N HA 0.057 4.796 4.740 -0.002 0.000 0.250 6079 N C -1.018 174.441 175.510 -0.085 0.000 1.129 6079 N CA -0.221 52.792 53.050 -0.061 0.000 0.995 6079 N CB 0.593 39.033 38.487 -0.078 0.000 1.324 6079 N HN 0.514 nan 8.380 nan 0.000 0.512 6080 A N 3.040 125.842 122.820 -0.029 0.000 3.091 6080 A HA 0.150 4.469 4.320 -0.002 0.000 0.264 6080 A C 0.918 178.430 177.584 -0.121 0.000 1.673 6080 A CA -0.329 51.689 52.037 -0.031 0.000 1.362 6080 A CB -0.604 18.489 19.000 0.156 0.000 1.137 6080 A HN 0.621 nan 8.150 nan 0.000 0.617 6081 T N -3.328 111.117 114.554 -0.181 0.000 3.475 6081 T HA 0.392 4.741 4.350 -0.002 0.000 0.310 6081 T C -0.042 174.483 174.700 -0.292 0.000 0.963 6081 T CA -0.047 61.905 62.100 -0.246 0.000 0.985 6081 T CB -0.197 68.545 68.868 -0.210 0.000 1.198 6081 T HN 0.176 nan 8.240 nan 0.000 0.508 6082 S N 0.961 116.486 115.700 -0.292 0.000 2.557 6082 S HA 0.591 5.060 4.470 -0.002 0.000 0.291 6082 S C -1.255 173.165 174.600 -0.300 0.000 1.116 6082 S CA -0.666 57.363 58.200 -0.285 0.000 0.992 6082 S CB 0.728 63.817 63.200 -0.185 0.000 1.028 6082 S HN 0.370 nan 8.310 nan 0.000 0.484 6083 Y N 4.227 124.461 120.300 -0.109 0.000 2.650 6083 Y HA 0.143 4.692 4.550 -0.002 0.000 0.331 6083 Y C -1.330 174.465 175.900 -0.174 0.000 1.165 6083 Y CA -1.205 56.830 58.100 -0.109 0.000 1.473 6083 Y CB -0.254 38.163 38.460 -0.071 0.000 1.224 6083 Y HN 0.413 nan 8.280 nan 0.000 0.533 6084 P HA 0.098 nan 4.420 nan 0.000 0.272 6084 P C -2.594 174.616 177.300 -0.148 0.000 1.240 6084 P CA -1.349 61.563 63.100 -0.313 0.000 0.791 6084 P CB 0.489 31.906 31.700 -0.471 0.000 0.978 6085 P HA 0.168 nan 4.420 nan 0.000 0.274 6085 P C -0.180 177.086 177.300 -0.057 0.000 1.237 6085 P CA -0.116 62.928 63.100 -0.095 0.000 0.793 6085 P CB 0.443 32.084 31.700 -0.098 0.000 0.977 6086 M N 0.281 119.835 119.600 -0.076 0.000 2.277 6086 M HA 0.395 4.874 4.480 -0.002 0.000 0.350 6086 M C -0.490 175.741 176.300 -0.115 0.000 1.180 6086 M CA -0.518 54.732 55.300 -0.084 0.000 1.103 6086 M CB 0.470 33.006 32.600 -0.107 0.000 1.577 6086 M HN 0.092 nan 8.290 nan 0.000 0.459 6087 c N 2.751 121.279 118.600 -0.119 0.000 2.563 6087 c HA 0.053 4.622 4.570 -0.002 0.000 0.411 6087 c C 0.959 174.894 174.090 -0.259 0.000 1.386 6087 c CA 0.033 56.250 56.329 -0.187 0.000 1.703 6087 c CB -0.882 41.540 42.510 -0.146 0.000 2.596 6087 c HN 0.899 nan 8.230 nan 0.000 0.605 6088 T N 4.978 119.255 114.554 -0.462 0.000 2.923 6088 T HA 0.245 4.594 4.350 -0.002 0.000 0.309 6088 T C 0.068 174.564 174.700 -0.340 0.000 1.059 6088 T CA 0.496 62.254 62.100 -0.570 0.000 1.133 6088 T CB -0.030 68.069 68.868 -1.282 0.000 1.053 6088 T HN 0.914 nan 8.240 nan 0.000 0.530 6089 Q N 0.465 120.183 119.800 -0.137 0.000 2.919 6089 Q HA 0.275 4.614 4.340 -0.002 0.000 0.323 6089 Q C -1.706 174.330 176.000 0.061 0.000 0.829 6089 Q CA -1.140 54.686 55.803 0.038 0.000 0.803 6089 Q CB 0.673 29.423 28.738 0.020 0.000 1.423 6089 Q HN 0.428 nan 8.270 nan 0.000 0.478 6090 D N 1.928 122.386 120.400 0.097 0.000 2.434 6090 D HA 0.062 4.701 4.640 -0.002 0.000 0.252 6090 D C -1.286 175.031 176.300 0.029 0.000 1.185 6090 D CA -1.318 52.730 54.000 0.079 0.000 0.886 6090 D CB 1.144 41.996 40.800 0.086 0.000 1.148 6090 D HN 0.298 nan 8.370 nan 0.000 0.483 6091 P HA -0.149 nan 4.420 nan 0.000 0.217 6091 P C 0.864 178.154 177.300 -0.018 0.000 1.150 6091 P CA 1.185 64.277 63.100 -0.012 0.000 0.832 6091 P CB 0.443 32.136 31.700 -0.013 0.000 0.787 6092 K N -0.314 120.082 120.400 -0.008 0.000 2.167 6092 K HA 0.075 4.394 4.320 -0.002 0.000 0.203 6092 K C 2.372 178.959 176.600 -0.022 0.000 1.052 6092 K CA 1.044 57.322 56.287 -0.016 0.000 0.956 6092 K CB -0.367 32.128 32.500 -0.009 0.000 0.735 6092 K HN 0.020 nan 8.250 nan 0.000 0.451 6093 A N 1.471 124.286 122.820 -0.008 0.000 1.873 6093 A HA -0.043 4.276 4.320 -0.002 0.000 0.215 6093 A C 2.418 179.986 177.584 -0.028 0.000 1.186 6093 A CA 1.761 53.790 52.037 -0.012 0.000 0.616 6093 A CB -1.269 17.743 19.000 0.020 0.000 0.823 6093 A HN 0.372 nan 8.150 nan 0.000 0.442 6094 G N -0.628 108.159 108.800 -0.022 0.000 2.514 6094 G HA2 -0.361 3.598 3.960 -0.002 0.000 0.217 6094 G HA3 -0.361 3.598 3.960 -0.002 0.000 0.217 6094 G C 1.654 176.513 174.900 -0.068 0.000 1.198 6094 G CA 1.323 46.398 45.100 -0.041 0.000 0.780 6094 G HN 0.634 nan 8.290 nan 0.000 0.565 6095 Q N -0.541 119.219 119.800 -0.066 0.000 2.061 6095 Q HA -0.125 4.214 4.340 -0.002 0.000 0.204 6095 Q C 2.460 178.408 176.000 -0.087 0.000 0.984 6095 Q CA 1.596 57.353 55.803 -0.078 0.000 0.846 6095 Q CB -0.279 28.421 28.738 -0.063 0.000 0.902 6095 Q HN 0.406 nan 8.270 nan 0.000 0.421 6096 L N 0.402 121.577 121.223 -0.080 0.000 1.989 6096 L HA -0.174 4.165 4.340 -0.002 0.000 0.211 6096 L C 2.199 178.983 176.870 -0.144 0.000 1.071 6096 L CA 1.740 56.525 54.840 -0.092 0.000 0.749 6096 L CB -0.951 41.057 42.059 -0.085 0.000 0.890 6096 L HN 0.464 nan 8.230 nan 0.000 0.431 6097 L N -0.911 120.214 121.223 -0.164 0.000 2.042 6097 L HA -0.206 4.133 4.340 -0.002 0.000 0.210 6097 L C 2.659 179.369 176.870 -0.267 0.000 1.076 6097 L CA 2.285 56.970 54.840 -0.259 0.000 0.749 6097 L CB -1.295 40.674 42.059 -0.150 0.000 0.893 6097 L HN 0.498 nan 8.230 nan 0.000 0.432 6098 S N -0.912 114.687 115.700 -0.168 0.000 2.382 6098 S HA -0.207 4.261 4.470 -0.002 0.000 0.228 6098 S C 1.853 176.345 174.600 -0.180 0.000 1.027 6098 S CA 1.468 59.562 58.200 -0.176 0.000 0.991 6098 S CB -0.351 62.752 63.200 -0.162 0.000 0.823 6098 S HN 0.681 nan 8.310 nan 0.000 0.469 6099 E N 0.650 120.765 120.200 -0.142 0.000 2.077 6099 E HA -0.110 4.239 4.350 -0.002 0.000 0.193 6099 E C 2.152 178.714 176.600 -0.064 0.000 0.989 6099 E CA 1.351 57.693 56.400 -0.097 0.000 0.800 6099 E CB -0.281 29.379 29.700 -0.066 0.000 0.746 6099 E HN 0.501 nan 8.360 nan 0.000 0.452 6100 L N -0.118 121.035 121.223 -0.116 0.000 1.994 6100 L HA -0.166 4.172 4.340 -0.002 0.000 0.208 6100 L C 2.274 179.186 176.870 0.070 0.000 1.071 6100 L CA 1.110 55.910 54.840 -0.066 0.000 0.745 6100 L CB -0.372 41.519 42.059 -0.281 0.000 0.892 6100 L HN 0.116 nan 8.230 nan 0.000 0.431 6101 F N -0.593 119.313 119.950 -0.074 0.000 2.615 6101 F HA 0.030 4.556 4.527 -0.002 0.000 0.297 6101 F C 1.695 177.186 175.800 -0.515 0.000 1.124 6101 F CA -0.313 57.515 58.000 -0.287 0.000 1.451 6101 F CB -1.188 37.648 39.000 -0.273 0.000 1.103 6101 F HN -0.071 nan 8.300 nan 0.000 0.569 6102 T N 2.029 116.434 114.554 -0.249 0.000 2.946 6102 T HA -0.071 4.278 4.350 -0.002 0.000 0.312 6102 T C 1.214 175.760 174.700 -0.256 0.000 1.066 6102 T CA 0.126 62.008 62.100 -0.365 0.000 1.138 6102 T CB 0.219 68.930 68.868 -0.261 0.000 1.014 6102 T HN 0.395 nan 8.240 nan 0.000 0.544 6103 N N 3.511 122.023 118.700 -0.312 0.000 2.214 6103 N HA 0.090 4.829 4.740 -0.002 0.000 0.214 6103 N C 0.253 175.648 175.510 -0.193 0.000 1.132 6103 N CA -0.291 52.632 53.050 -0.211 0.000 0.856 6103 N CB 0.128 38.491 38.487 -0.206 0.000 1.020 6103 N HN 0.460 nan 8.380 nan 0.000 0.509 6104 R N 0.546 120.937 120.500 -0.181 0.000 2.546 6104 R HA 0.230 4.569 4.340 -0.002 0.000 0.266 6104 R C 1.390 177.613 176.300 -0.129 0.000 1.086 6104 R CA -0.585 55.433 56.100 -0.136 0.000 1.160 6104 R CB 1.317 31.543 30.300 -0.124 0.000 1.138 6104 R HN 0.026 nan 8.270 nan 0.000 0.567 6105 K N 0.900 121.247 120.400 -0.088 0.000 2.002 6105 K HA -0.144 4.175 4.320 -0.002 0.000 0.209 6105 K C -0.362 176.202 176.600 -0.060 0.000 1.048 6105 K CA 1.610 57.856 56.287 -0.068 0.000 0.930 6105 K CB 0.241 32.722 32.500 -0.031 0.000 0.714 6105 K HN 0.492 nan 8.250 nan 0.000 0.438 6106 E N 0.313 120.478 120.200 -0.058 0.000 2.293 6106 E HA 0.158 4.507 4.350 -0.002 0.000 0.270 6106 E C -1.443 175.106 176.600 -0.085 0.000 0.879 6106 E CA -0.654 55.712 56.400 -0.057 0.000 0.756 6106 E CB 1.813 31.489 29.700 -0.040 0.000 1.208 6106 E HN 0.212 nan 8.360 nan 0.000 0.428 6107 N N 2.885 121.531 118.700 -0.090 0.000 2.475 6107 N HA 0.100 4.839 4.740 -0.002 0.000 0.267 6107 N C -0.576 174.853 175.510 -0.135 0.000 1.169 6107 N CA -0.256 52.719 53.050 -0.124 0.000 0.947 6107 N CB 0.544 38.963 38.487 -0.114 0.000 1.061 6107 N HN 0.409 nan 8.380 nan 0.000 0.466 6108 I N 5.336 125.789 120.570 -0.195 0.000 2.436 6108 I HA 0.128 4.297 4.170 -0.002 0.000 0.289 6108 I C -1.877 174.123 176.117 -0.194 0.000 1.083 6108 I CA -1.798 59.365 61.300 -0.227 0.000 1.372 6108 I CB 0.967 38.705 38.000 -0.438 0.000 1.408 6108 I HN 0.437 nan 8.210 nan 0.000 0.516 6109 P HA 0.157 nan 4.420 nan 0.000 0.265 6109 P C -0.947 176.290 177.300 -0.105 0.000 1.193 6109 P CA 0.148 63.188 63.100 -0.100 0.000 0.765 6109 P CB 0.481 32.139 31.700 -0.069 0.000 0.823 6110 L N 2.717 123.881 121.223 -0.099 0.000 2.354 6110 L HA 0.527 4.865 4.340 -0.002 0.000 0.269 6110 L C 0.315 177.139 176.870 -0.076 0.000 1.005 6110 L CA -1.142 53.643 54.840 -0.092 0.000 0.819 6110 L CB 1.969 43.963 42.059 -0.108 0.000 1.311 6110 L HN 0.122 nan 8.230 nan 0.000 0.423 6111 K N 1.858 122.215 120.400 -0.072 0.000 2.138 6111 K HA 0.595 4.914 4.320 -0.002 0.000 0.263 6111 K C -0.865 175.682 176.600 -0.087 0.000 0.965 6111 K CA -0.276 55.968 56.287 -0.073 0.000 0.868 6111 K CB 1.211 33.670 32.500 -0.068 0.000 1.083 6111 K HN 0.379 nan 8.250 nan 0.000 0.443 6112 L N 1.465 122.632 121.223 -0.093 0.000 2.350 6112 L HA 0.507 4.846 4.340 -0.002 0.000 0.275 6112 L C 0.193 176.979 176.870 -0.141 0.000 1.099 6112 L CA -0.355 54.410 54.840 -0.125 0.000 0.808 6112 L CB 1.498 43.480 42.059 -0.129 0.000 1.149 6112 L HN 0.543 nan 8.230 nan 0.000 0.442 6113 S N 0.256 115.846 115.700 -0.184 0.000 2.567 6113 S HA 0.220 4.689 4.470 -0.002 0.000 0.270 6113 S C 0.037 174.478 174.600 -0.264 0.000 1.152 6113 S CA -0.599 57.491 58.200 -0.183 0.000 0.835 6113 S CB 1.616 64.751 63.200 -0.109 0.000 1.115 6113 S HN 0.734 nan 8.310 nan 0.000 0.459 6114 E N 0.630 120.669 120.200 -0.267 0.000 2.318 6114 E HA 0.010 4.359 4.350 -0.002 0.000 0.193 6114 E C -0.428 176.057 176.600 -0.192 0.000 0.998 6114 E CA 0.252 56.458 56.400 -0.324 0.000 0.859 6114 E CB 0.156 29.695 29.700 -0.268 0.000 0.812 6114 E HN 0.518 nan 8.360 nan 0.000 0.492 6115 D N 0.664 120.994 120.400 -0.117 0.000 2.483 6115 D HA -0.001 4.638 4.640 -0.002 0.000 0.220 6115 D C -0.051 176.292 176.300 0.072 0.000 1.173 6115 D CA -0.335 53.635 54.000 -0.051 0.000 0.964 6115 D CB -0.052 40.749 40.800 0.002 0.000 1.046 6115 D HN 0.150 nan 8.370 nan 0.000 0.517 6116 c N 2.665 121.245 118.600 -0.033 0.000 3.486 6116 c HA 0.371 4.940 4.570 -0.002 0.000 0.264 6116 c C 0.482 174.530 174.090 -0.069 0.000 1.756 6116 c CA -0.786 55.598 56.329 0.091 0.000 1.764 6116 c CB -1.329 41.172 42.510 -0.016 0.000 3.238 6116 c HN 0.455 nan 8.230 nan 0.000 0.524 6117 L N 2.315 123.224 121.223 -0.524 0.000 2.399 6117 L HA 0.406 4.745 4.340 -0.002 0.000 0.257 6117 L C -0.819 175.324 176.870 -1.212 0.000 1.236 6117 L CA 0.487 54.844 54.840 -0.804 0.000 1.144 6117 L CB -0.730 40.721 42.059 -1.013 0.000 1.379 6117 L HN 0.406 nan 8.230 nan 0.000 0.414 6118 Y N 1.918 122.118 120.300 -0.168 0.000 2.602 6118 Y HA 0.693 5.242 4.550 -0.002 0.000 0.342 6118 Y C -0.098 175.921 175.900 0.198 0.000 1.029 6118 Y CA -1.238 56.835 58.100 -0.045 0.000 1.080 6118 Y CB 2.070 40.489 38.460 -0.068 0.000 1.284 6118 Y HN 0.185 nan 8.280 nan 0.000 0.485 6119 L N -0.167 121.211 121.223 0.257 0.000 2.393 6119 L HA 0.730 5.069 4.340 -0.002 0.000 0.260 6119 L C -1.543 175.356 176.870 0.049 0.000 1.002 6119 L CA -1.227 53.698 54.840 0.141 0.000 0.818 6119 L CB 1.766 43.819 42.059 -0.009 0.000 1.369 6119 L HN 0.399 nan 8.230 nan 0.000 0.412 6120 N N 2.271 121.020 118.700 0.083 0.000 2.372 6120 N HA 0.664 5.403 4.740 -0.002 0.000 0.291 6120 N C -1.047 174.433 175.510 -0.051 0.000 1.024 6120 N CA -0.223 52.829 53.050 0.003 0.000 0.873 6120 N CB 2.425 40.961 38.487 0.082 0.000 1.206 6120 N HN 0.691 nan 8.380 nan 0.000 0.486 6121 I N 2.073 122.539 120.570 -0.173 0.000 2.377 6121 I HA 0.304 4.473 4.170 -0.002 0.000 0.293 6121 I C -0.860 175.164 176.117 -0.155 0.000 0.987 6121 I CA -0.741 60.491 61.300 -0.114 0.000 1.185 6121 I CB 0.806 38.633 38.000 -0.289 0.000 1.341 6121 I HN 0.325 nan 8.210 nan 0.000 0.455 6122 Y N 3.488 123.909 120.300 0.202 0.000 2.376 6122 Y HA 0.357 4.906 4.550 -0.002 0.000 0.326 6122 Y C 0.286 176.316 175.900 0.217 0.000 0.970 6122 Y CA -0.620 57.608 58.100 0.213 0.000 1.248 6122 Y CB 1.980 40.542 38.460 0.170 0.000 1.117 6122 Y HN 0.394 nan 8.280 nan 0.000 0.476 6123 T N 5.038 119.817 114.554 0.375 0.000 2.841 6123 T HA 0.327 4.676 4.350 -0.002 0.000 0.285 6123 T C -2.078 172.795 174.700 0.289 0.000 0.991 6123 T CA -2.325 59.971 62.100 0.325 0.000 0.966 6123 T CB 1.437 70.525 68.868 0.367 0.000 0.962 6123 T HN 0.336 nan 8.240 nan 0.000 0.438 6124 P HA 0.205 nan 4.420 nan 0.000 0.230 6124 P C 0.595 178.001 177.300 0.177 0.000 1.168 6124 P CA 0.012 63.218 63.100 0.176 0.000 0.793 6124 P CB -0.001 31.772 31.700 0.121 0.000 0.851 6125 A N 1.261 124.190 122.820 0.183 0.000 2.583 6125 A HA -0.061 4.258 4.320 -0.002 0.000 0.231 6125 A C 0.080 177.765 177.584 0.168 0.000 1.065 6125 A CA 0.389 52.521 52.037 0.160 0.000 0.760 6125 A CB -0.754 18.342 19.000 0.159 0.000 1.001 6125 A HN 0.097 nan 8.150 nan 0.000 0.509 6126 D N 1.148 121.625 120.400 0.127 0.000 2.380 6126 D HA 0.363 5.002 4.640 -0.002 0.000 0.230 6126 D C 0.850 177.222 176.300 0.120 0.000 1.154 6126 D CA -0.142 53.929 54.000 0.118 0.000 0.859 6126 D CB 0.094 40.940 40.800 0.077 0.000 1.045 6126 D HN 0.396 nan 8.370 nan 0.000 0.495 6127 L N 2.674 123.994 121.223 0.161 0.000 2.362 6127 L HA -0.082 4.257 4.340 -0.002 0.000 0.219 6127 L C 2.337 179.257 176.870 0.083 0.000 1.134 6127 L CA 1.140 56.053 54.840 0.121 0.000 0.807 6127 L CB -0.620 41.535 42.059 0.159 0.000 0.927 6127 L HN 0.557 nan 8.230 nan 0.000 0.447 6128 T N -2.990 111.619 114.554 0.091 0.000 2.732 6128 T HA -0.100 4.249 4.350 -0.002 0.000 0.261 6128 T C 1.398 176.123 174.700 0.042 0.000 1.040 6128 T CA 0.530 62.668 62.100 0.064 0.000 1.145 6128 T CB 0.063 68.969 68.868 0.062 0.000 0.866 6128 T HN 0.167 nan 8.240 nan 0.000 0.427 6129 K N 0.859 121.285 120.400 0.043 0.000 2.948 6129 K HA 0.280 4.599 4.320 -0.002 0.000 0.323 6129 K C -0.083 176.533 176.600 0.027 0.000 1.015 6129 K CA -0.247 56.058 56.287 0.031 0.000 1.117 6129 K CB 0.240 32.760 32.500 0.032 0.000 1.264 6129 K HN 0.025 nan 8.250 nan 0.000 0.486 6130 K N 2.068 122.483 120.400 0.024 0.000 2.701 6130 K HA 0.277 4.596 4.320 -0.002 0.000 0.212 6130 K C -1.223 175.393 176.600 0.026 0.000 1.035 6130 K CA -0.309 55.990 56.287 0.020 0.000 1.048 6130 K CB 0.826 33.331 32.500 0.008 0.000 1.234 6130 K HN 0.477 nan 8.250 nan 0.000 0.540 6131 N N 0.986 119.710 118.700 0.040 0.000 2.448 6131 N HA 0.409 5.148 4.740 -0.002 0.000 0.274 6131 N C -0.188 175.350 175.510 0.045 0.000 1.239 6131 N CA -0.638 52.440 53.050 0.046 0.000 0.982 6131 N CB 0.758 39.283 38.487 0.063 0.000 1.199 6131 N HN 0.089 nan 8.380 nan 0.000 0.576 6132 R N 0.755 121.282 120.500 0.046 0.000 2.734 6132 R HA 0.277 4.616 4.340 -0.002 0.000 0.242 6132 R C -1.286 175.044 176.300 0.050 0.000 1.617 6132 R CA -0.306 55.820 56.100 0.044 0.000 1.572 6132 R CB -0.399 29.915 30.300 0.023 0.000 1.477 6132 R HN 0.518 nan 8.270 nan 0.000 0.707 6133 L N 2.455 123.720 121.223 0.070 0.000 2.436 6133 L HA 0.420 4.758 4.340 -0.002 0.000 0.265 6133 L C -1.572 175.343 176.870 0.074 0.000 1.168 6133 L CA -1.793 53.090 54.840 0.073 0.000 0.815 6133 L CB 0.252 42.366 42.059 0.093 0.000 1.109 6133 L HN -0.026 nan 8.230 nan 0.000 0.462 6134 P HA 0.027 nan 4.420 nan 0.000 0.269 6134 P C -0.829 176.528 177.300 0.095 0.000 1.215 6134 P CA -0.112 63.026 63.100 0.064 0.000 0.780 6134 P CB 1.006 32.728 31.700 0.038 0.000 0.898 6135 V N 4.342 124.324 119.914 0.113 0.000 2.417 6135 V HA 0.347 4.466 4.120 -0.002 0.000 0.291 6135 V C 0.542 176.740 176.094 0.173 0.000 1.024 6135 V CA -0.330 62.058 62.300 0.147 0.000 0.861 6135 V CB 1.110 33.022 31.823 0.148 0.000 0.985 6135 V HN 0.500 nan 8.190 nan 0.000 0.436 6136 M N 5.130 124.867 119.600 0.228 0.000 2.114 6136 M HA 0.484 4.963 4.480 -0.002 0.000 0.332 6136 M C -1.019 175.602 176.300 0.534 0.000 1.014 6136 M CA -0.563 54.955 55.300 0.363 0.000 0.956 6136 M CB 1.880 34.647 32.600 0.278 0.000 1.551 6136 M HN 0.368 nan 8.290 nan 0.000 0.427 6137 V N 3.721 123.926 119.914 0.486 0.000 2.383 6137 V HA 0.303 4.422 4.120 -0.002 0.000 0.275 6137 V C -0.698 175.521 176.094 0.208 0.000 1.036 6137 V CA -0.555 61.931 62.300 0.310 0.000 0.889 6137 V CB 1.193 33.102 31.823 0.143 0.000 0.985 6137 V HN 0.832 nan 8.190 nan 0.000 0.459 6138 W N 7.178 128.373 121.300 -0.174 0.000 2.391 6138 W HA 0.622 5.281 4.660 -0.002 0.000 0.311 6138 W C -1.285 175.077 176.519 -0.262 0.000 1.087 6138 W CA -0.912 56.125 57.345 -0.513 0.000 1.209 6138 W CB 1.415 30.593 29.460 -0.469 0.000 1.273 6138 W HN 0.461 nan 8.180 nan 0.000 0.482 6139 I N 7.746 127.721 120.570 -0.992 0.000 2.359 6139 I HA 0.078 4.247 4.170 -0.002 0.000 0.284 6139 I C 1.064 176.501 176.117 -1.133 0.000 1.018 6139 I CA -0.836 60.013 61.300 -0.752 0.000 1.173 6139 I CB 0.677 38.328 38.000 -0.582 0.000 1.326 6139 I HN 0.384 nan 8.210 nan 0.000 0.462 6140 H N 4.501 123.154 119.070 -0.696 0.000 2.913 6140 H HA 0.291 4.846 4.556 -0.002 0.000 0.365 6140 H C 0.104 175.353 175.328 -0.132 0.000 1.155 6140 H CA -0.223 55.553 56.048 -0.454 0.000 1.417 6140 H CB 0.759 30.549 29.762 0.047 0.000 1.386 6140 H HN 0.632 nan 8.280 nan 0.000 0.614 6141 G N -1.543 107.324 108.800 0.112 0.000 2.568 6141 G HA2 0.461 4.419 3.960 -0.002 0.000 0.293 6141 G HA3 0.461 4.419 3.960 -0.002 0.000 0.293 6141 G C 0.534 175.666 174.900 0.386 0.000 1.347 6141 G CA -0.574 44.624 45.100 0.164 0.000 1.039 6141 G HN 1.152 nan 8.290 nan 0.000 0.523 6142 G N -3.233 105.757 108.800 0.317 0.000 2.559 6142 G HA2 0.393 4.351 3.960 -0.002 0.000 0.202 6142 G HA3 0.393 4.351 3.960 -0.002 0.000 0.202 6142 G C 1.072 176.081 174.900 0.180 0.000 0.992 6142 G CA 0.885 46.159 45.100 0.290 0.000 0.764 6142 G HN 2.407 nan 8.290 nan 0.000 0.525 6143 G N 0.309 109.190 108.800 0.134 0.000 2.132 6143 G HA2 -0.112 3.847 3.960 -0.002 0.000 0.234 6143 G HA3 -0.112 3.847 3.960 -0.002 0.000 0.234 6143 G C 1.004 175.875 174.900 -0.048 0.000 0.989 6143 G CA 0.430 45.552 45.100 0.037 0.000 0.676 6143 G HN 1.686 nan 8.290 nan 0.000 0.522 6144 L N -2.752 118.486 121.223 0.025 0.000 4.232 6144 L HA -0.286 4.053 4.340 -0.002 0.000 0.415 6144 L C 1.869 178.782 176.870 0.072 0.000 1.168 6144 L CA 1.611 56.456 54.840 0.008 0.000 0.966 6144 L CB -1.630 40.012 42.059 -0.696 0.000 2.052 6144 L HN 0.448 nan 8.230 nan 0.000 0.887 6145 M N -1.714 117.935 119.600 0.081 0.000 2.429 6145 M HA 0.309 4.788 4.480 -0.002 0.000 0.230 6145 M C 0.862 177.231 176.300 0.114 0.000 1.469 6145 M CA 1.272 56.626 55.300 0.089 0.000 1.097 6145 M CB 0.453 33.080 32.600 0.046 0.000 1.490 6145 M HN 0.203 nan 8.290 nan 0.000 0.556 6146 V N -2.300 117.684 119.914 0.117 0.000 3.105 6146 V HA 1.057 5.176 4.120 -0.002 0.000 0.311 6146 V C -0.060 176.117 176.094 0.138 0.000 1.282 6146 V CA -0.310 62.046 62.300 0.093 0.000 1.065 6146 V CB 1.010 32.875 31.823 0.069 0.000 1.136 6146 V HN 0.587 nan 8.190 nan 0.000 0.469 6147 G N -1.167 107.657 108.800 0.040 0.000 2.515 6147 G HA2 0.571 4.530 3.960 -0.002 0.000 0.686 6147 G HA3 0.571 4.530 3.960 -0.002 0.000 0.686 6147 G C -0.639 173.963 174.900 -0.496 0.000 1.274 6147 G CA -0.161 44.883 45.100 -0.093 0.000 0.874 6147 G HN 2.635 nan 8.290 nan 0.000 0.631 6148 A N -0.772 121.616 122.820 -0.719 0.000 2.612 6148 A HA 1.053 5.372 4.320 -0.002 0.000 0.293 6148 A C 0.757 178.180 177.584 -0.267 0.000 1.075 6148 A CA 0.686 52.439 52.037 -0.473 0.000 0.680 6148 A CB 0.904 19.781 19.000 -0.205 0.000 1.279 6148 A HN 2.560 nan 8.150 nan 0.000 0.411 6149 A N 0.257 123.067 122.820 -0.016 0.000 1.898 6149 A HA 0.151 4.470 4.320 -0.002 0.000 0.214 6149 A C 1.987 179.730 177.584 0.264 0.000 1.183 6149 A CA 2.176 54.354 52.037 0.236 0.000 0.622 6149 A CB -0.783 18.378 19.000 0.268 0.000 0.824 6149 A HN 1.125 nan 8.150 nan 0.000 0.444 6150 S N 0.105 115.887 115.700 0.137 0.000 2.465 6150 S HA -0.124 4.345 4.470 -0.002 0.000 0.241 6150 S C 1.808 176.362 174.600 -0.076 0.000 1.000 6150 S CA 1.549 59.789 58.200 0.066 0.000 0.964 6150 S CB -0.545 62.610 63.200 -0.074 0.000 0.763 6150 S HN 0.689 nan 8.310 nan 0.000 0.512 6151 T N 0.842 115.338 114.554 -0.096 0.000 2.803 6151 T HA -0.099 4.250 4.350 -0.002 0.000 0.269 6151 T C -0.101 174.265 174.700 -0.557 0.000 1.052 6151 T CA 1.146 63.036 62.100 -0.350 0.000 1.136 6151 T CB -0.270 68.314 68.868 -0.473 0.000 0.864 6151 T HN 0.427 nan 8.240 nan 0.000 0.467 6152 Y N 1.388 121.553 120.300 -0.224 0.000 2.356 6152 Y HA 0.467 5.015 4.550 -0.002 0.000 0.334 6152 Y C -0.134 175.597 175.900 -0.282 0.000 0.958 6152 Y CA -2.482 55.344 58.100 -0.457 0.000 1.196 6152 Y CB 0.567 38.503 38.460 -0.874 0.000 1.137 6152 Y HN -0.109 nan 8.280 nan 0.000 0.485 6153 D N 2.322 122.618 120.400 -0.174 0.000 2.295 6153 D HA 0.208 4.847 4.640 -0.002 0.000 0.248 6153 D C 0.795 176.853 176.300 -0.404 0.000 1.154 6153 D CA -0.196 53.665 54.000 -0.232 0.000 0.857 6153 D CB 1.558 42.290 40.800 -0.114 0.000 1.117 6153 D HN 0.839 nan 8.370 nan 0.000 0.468 6154 G N 3.832 111.943 108.800 -1.149 0.000 3.518 6154 G HA2 0.023 3.982 3.960 -0.002 0.000 0.273 6154 G HA3 0.023 3.982 3.960 -0.002 0.000 0.273 6154 G C 1.280 175.884 174.900 -0.493 0.000 1.199 6154 G CA -0.280 44.403 45.100 -0.695 0.000 0.899 6154 G HN 0.541 nan 8.290 nan 0.000 0.533 6155 L N 0.250 121.246 121.223 -0.378 0.000 1.993 6155 L HA 0.015 4.354 4.340 -0.002 0.000 0.206 6155 L C 3.120 179.905 176.870 -0.142 0.000 1.074 6155 L CA 1.580 56.359 54.840 -0.101 0.000 0.746 6155 L CB -0.412 41.640 42.059 -0.013 0.000 0.896 6155 L HN 0.329 nan 8.230 nan 0.000 0.435 6156 A N 0.130 122.845 122.820 -0.175 0.000 1.859 6156 A HA -0.330 3.989 4.320 -0.002 0.000 0.218 6156 A C 2.136 179.480 177.584 -0.400 0.000 1.209 6156 A CA 2.360 54.193 52.037 -0.340 0.000 0.639 6156 A CB -1.236 17.622 19.000 -0.236 0.000 0.835 6156 A HN 0.492 nan 8.150 nan 0.000 0.450 6157 L N -0.307 120.752 121.223 -0.275 0.000 2.013 6157 L HA -0.159 4.179 4.340 -0.002 0.000 0.212 6157 L C 2.675 179.465 176.870 -0.134 0.000 1.073 6157 L CA 2.599 57.302 54.840 -0.229 0.000 0.753 6157 L CB -0.956 40.938 42.059 -0.275 0.000 0.890 6157 L HN 0.408 nan 8.230 nan 0.000 0.432 6158 A N -0.563 122.202 122.820 -0.090 0.000 1.877 6158 A HA -0.107 4.212 4.320 -0.002 0.000 0.216 6158 A C 2.447 179.998 177.584 -0.055 0.000 1.186 6158 A CA 2.204 54.238 52.037 -0.006 0.000 0.620 6158 A CB -1.290 17.761 19.000 0.085 0.000 0.822 6158 A HN 0.630 nan 8.150 nan 0.000 0.443 6159 A N -0.737 121.974 122.820 -0.182 0.000 1.835 6159 A HA -0.179 4.140 4.320 -0.002 0.000 0.215 6159 A C 2.008 179.326 177.584 -0.444 0.000 1.199 6159 A CA 1.561 53.336 52.037 -0.437 0.000 0.615 6159 A CB -1.218 17.313 19.000 -0.783 0.000 0.838 6159 A HN 0.733 nan 8.150 nan 0.000 0.444 6160 H N -0.871 117.858 119.070 -0.569 0.000 2.319 6160 H HA -0.093 4.462 4.556 -0.002 0.000 0.299 6160 H C 1.294 176.618 175.328 -0.007 0.000 1.092 6160 H CA 1.285 57.225 56.048 -0.181 0.000 1.302 6160 H CB 0.142 29.771 29.762 -0.221 0.000 1.373 6160 H HN 0.391 nan 8.280 nan 0.000 0.497 6161 E N 0.261 120.515 120.200 0.089 0.000 2.474 6161 E HA -0.024 4.325 4.350 -0.002 0.000 0.195 6161 E C 0.145 176.788 176.600 0.070 0.000 1.039 6161 E CA -0.168 56.276 56.400 0.074 0.000 0.881 6161 E CB -0.089 29.639 29.700 0.047 0.000 0.970 6161 E HN 0.344 nan 8.360 nan 0.000 0.486 6162 N N 0.687 119.429 118.700 0.070 0.000 2.738 6162 N HA -0.156 4.583 4.740 -0.002 0.000 0.249 6162 N C -0.613 174.945 175.510 0.079 0.000 1.047 6162 N CA 0.817 53.916 53.050 0.082 0.000 0.707 6162 N CB -1.108 37.436 38.487 0.096 0.000 0.937 6162 N HN 0.046 nan 8.380 nan 0.000 0.545 6163 V N -3.116 116.843 119.914 0.076 0.000 3.001 6163 V HA 0.716 4.835 4.120 -0.002 0.000 0.314 6163 V C 0.540 176.709 176.094 0.125 0.000 1.099 6163 V CA -0.951 61.403 62.300 0.089 0.000 0.989 6163 V CB 2.286 34.150 31.823 0.069 0.000 1.040 6163 V HN -0.126 nan 8.190 nan 0.000 0.434 6164 V N 3.133 123.136 119.914 0.148 0.000 2.368 6164 V HA 0.337 4.456 4.120 -0.002 0.000 0.266 6164 V C 0.225 176.447 176.094 0.214 0.000 1.045 6164 V CA -0.210 62.205 62.300 0.190 0.000 0.899 6164 V CB 1.039 32.975 31.823 0.188 0.000 1.006 6164 V HN 0.724 nan 8.190 nan 0.000 0.470 6165 V N 6.130 126.199 119.914 0.258 0.000 2.567 6165 V HA 0.461 4.580 4.120 -0.002 0.000 0.289 6165 V C 0.007 176.315 176.094 0.357 0.000 1.049 6165 V CA -0.389 62.098 62.300 0.312 0.000 0.969 6165 V CB 1.762 33.756 31.823 0.285 0.000 0.995 6165 V HN 0.572 nan 8.190 nan 0.000 0.471 6166 V N 3.492 123.612 119.914 0.343 0.000 2.482 6166 V HA 0.407 4.526 4.120 -0.002 0.000 0.295 6166 V C 0.035 176.309 176.094 0.301 0.000 1.026 6166 V CA -0.563 61.903 62.300 0.276 0.000 0.856 6166 V CB 2.147 34.077 31.823 0.178 0.000 1.001 6166 V HN 1.015 nan 8.190 nan 0.000 0.424 6167 T N 3.517 118.271 114.554 0.334 0.000 2.744 6167 T HA 0.810 5.159 4.350 -0.002 0.000 0.291 6167 T C -0.417 174.433 174.700 0.250 0.000 0.957 6167 T CA -0.439 61.872 62.100 0.351 0.000 1.002 6167 T CB 1.070 70.194 68.868 0.426 0.000 0.919 6167 T HN 0.663 nan 8.240 nan 0.000 0.468 6168 I N 0.280 120.977 120.570 0.211 0.000 2.797 6168 I HA 0.693 4.862 4.170 -0.002 0.000 0.307 6168 I C -0.586 175.721 176.117 0.316 0.000 1.033 6168 I CA -1.243 60.167 61.300 0.185 0.000 1.071 6168 I CB 2.005 40.006 38.000 0.001 0.000 1.255 6168 I HN 0.538 nan 8.210 nan 0.000 0.445 6169 Q N 2.636 122.663 119.800 0.377 0.000 2.348 6169 Q HA 0.575 4.914 4.340 -0.002 0.000 0.271 6169 Q C -1.793 174.471 176.000 0.440 0.000 1.067 6169 Q CA -0.817 55.206 55.803 0.366 0.000 0.839 6169 Q CB 2.624 31.504 28.738 0.236 0.000 1.354 6169 Q HN 0.724 nan 8.270 nan 0.000 0.447 6170 Y N -2.350 118.091 120.300 0.235 0.000 2.609 6170 Y HA 0.588 5.137 4.550 -0.002 0.000 0.342 6170 Y C -0.762 175.223 175.900 0.141 0.000 1.058 6170 Y CA -1.553 56.652 58.100 0.175 0.000 1.055 6170 Y CB 0.854 39.377 38.460 0.106 0.000 1.292 6170 Y HN 0.368 nan 8.280 nan 0.000 0.476 6171 R N 1.996 122.620 120.500 0.206 0.000 2.489 6171 R HA 0.405 4.744 4.340 -0.002 0.000 0.287 6171 R C -0.858 175.557 176.300 0.192 0.000 1.053 6171 R CA -0.072 56.099 56.100 0.119 0.000 1.036 6171 R CB 0.210 30.584 30.300 0.123 0.000 0.966 6171 R HN 0.649 nan 8.270 nan 0.000 0.432 6172 L N 1.276 122.625 121.223 0.210 0.000 2.298 6172 L HA 0.534 4.873 4.340 -0.002 0.000 0.268 6172 L C 1.326 178.484 176.870 0.479 0.000 1.010 6172 L CA -0.631 54.425 54.840 0.361 0.000 0.812 6172 L CB 1.019 43.187 42.059 0.182 0.000 1.331 6172 L HN 0.858 nan 8.230 nan 0.000 0.450 6173 G N 0.283 109.347 108.800 0.440 0.000 2.564 6173 G HA2 -0.327 3.632 3.960 -0.002 0.000 0.309 6173 G HA3 -0.327 3.632 3.960 -0.002 0.000 0.309 6173 G C 0.846 175.978 174.900 0.387 0.000 1.320 6173 G CA 0.596 45.891 45.100 0.325 0.000 0.941 6173 G HN 0.714 nan 8.290 nan 0.000 0.543 6174 I N -1.134 119.578 120.570 0.237 0.000 2.143 6174 I HA -0.286 3.883 4.170 -0.002 0.000 0.245 6174 I C 2.762 179.120 176.117 0.401 0.000 1.068 6174 I CA 2.676 64.090 61.300 0.191 0.000 1.326 6174 I CB -0.454 37.463 38.000 -0.138 0.000 1.028 6174 I HN 0.567 nan 8.210 nan 0.000 0.412 6175 W N 0.976 122.479 121.300 0.339 0.000 2.325 6175 W HA -0.157 4.501 4.660 -0.003 0.000 0.299 6175 W C 2.368 179.058 176.519 0.284 0.000 1.215 6175 W CA 1.596 59.074 57.345 0.223 0.000 1.244 6175 W CB -0.861 28.620 29.460 0.034 0.000 1.140 6175 W HN 0.293 nan 8.180 nan 0.000 0.523 6176 G N -2.921 106.145 108.800 0.443 0.000 3.044 6176 G HA2 0.112 4.071 3.960 -0.002 0.000 0.223 6176 G HA3 0.112 4.071 3.960 -0.002 0.000 0.223 6176 G C 0.481 175.056 174.900 -0.542 0.000 1.123 6176 G CA -0.065 45.056 45.100 0.034 0.000 0.765 6176 G HN 0.117 nan 8.290 nan 0.000 0.546 6177 F N -0.650 119.491 119.950 0.318 0.000 2.859 6177 F HA 0.401 4.927 4.527 -0.002 0.000 0.324 6177 F C 0.003 175.838 175.800 0.059 0.000 1.158 6177 F CA -1.570 56.466 58.000 0.059 0.000 1.147 6177 F CB 0.329 39.302 39.000 -0.046 0.000 1.137 6177 F HN 0.012 nan 8.300 nan 0.000 0.516 6178 F N 2.042 122.105 119.950 0.188 0.000 2.506 6178 F HA 0.485 5.011 4.527 -0.001 0.000 0.371 6178 F C 0.345 176.134 175.800 -0.018 0.000 1.078 6178 F CA 0.018 58.023 58.000 0.008 0.000 1.195 6178 F CB 0.538 39.400 39.000 -0.229 0.000 1.099 6178 F HN -0.081 nan 8.300 nan 0.000 0.548 6179 S N 3.341 118.560 115.700 -0.800 0.000 2.542 6179 S HA 0.450 4.919 4.470 -0.002 0.000 0.293 6179 S C 0.354 174.522 174.600 -0.721 0.000 1.089 6179 S CA -0.065 57.764 58.200 -0.618 0.000 0.961 6179 S CB 1.553 64.546 63.200 -0.346 0.000 1.062 6179 S HN 0.786 nan 8.310 nan 0.000 0.483 6180 T N 0.299 114.603 114.554 -0.417 0.000 3.054 6180 T HA 0.412 4.761 4.350 -0.002 0.000 0.255 6180 T C 1.414 176.036 174.700 -0.130 0.000 1.035 6180 T CA 0.457 62.408 62.100 -0.249 0.000 0.941 6180 T CB 0.119 68.946 68.868 -0.068 0.000 1.026 6180 T HN 1.689 nan 8.240 nan 0.000 0.533 6181 G N 2.368 111.085 108.800 -0.138 0.000 2.179 6181 G HA2 -0.203 3.756 3.960 -0.002 0.000 0.260 6181 G HA3 -0.203 3.756 3.960 -0.002 0.000 0.260 6181 G C -0.274 174.590 174.900 -0.059 0.000 0.977 6181 G CA 0.361 45.404 45.100 -0.095 0.000 0.641 6181 G HN 0.888 nan 8.290 nan 0.000 0.533 6182 D N -1.701 118.675 120.400 -0.039 0.000 2.781 6182 D HA 0.466 5.105 4.640 -0.002 0.000 0.295 6182 D C 1.335 177.603 176.300 -0.052 0.000 1.143 6182 D CA -0.062 53.913 54.000 -0.042 0.000 1.076 6182 D CB -0.268 40.522 40.800 -0.018 0.000 1.444 6182 D HN 0.117 nan 8.370 nan 0.000 0.567 6183 E N -0.168 119.948 120.200 -0.140 0.000 2.265 6183 E HA -0.242 4.107 4.350 -0.002 0.000 0.196 6183 E C 0.876 177.439 176.600 -0.062 0.000 0.996 6183 E CA 1.210 57.534 56.400 -0.126 0.000 0.832 6183 E CB -0.618 28.968 29.700 -0.190 0.000 0.756 6183 E HN 0.518 nan 8.360 nan 0.000 0.491 6184 H N 0.426 119.551 119.070 0.091 0.000 2.545 6184 H HA 0.134 4.689 4.556 -0.001 0.000 0.282 6184 H C 0.414 175.853 175.328 0.185 0.000 1.020 6184 H CA 1.180 57.298 56.048 0.117 0.000 1.243 6184 H CB 0.336 30.152 29.762 0.090 0.000 1.377 6184 H HN 0.138 nan 8.280 nan 0.000 0.581 6185 S N -0.370 115.507 115.700 0.296 0.000 2.927 6185 S HA 0.103 4.572 4.470 -0.002 0.000 0.136 6185 S C 0.924 175.650 174.600 0.210 0.000 0.831 6185 S CA -0.566 57.893 58.200 0.431 0.000 0.882 6185 S CB -0.136 63.268 63.200 0.340 0.000 1.612 6185 S HN 0.202 nan 8.310 nan 0.000 0.579 6186 R N 1.259 121.828 120.500 0.115 0.000 2.119 6186 R HA 0.076 4.415 4.340 -0.002 0.000 0.246 6186 R C 1.496 177.537 176.300 -0.431 0.000 1.146 6186 R CA 1.434 57.438 56.100 -0.161 0.000 0.962 6186 R CB -0.352 29.861 30.300 -0.146 0.000 0.863 6186 R HN 0.905 nan 8.270 nan 0.000 0.442 6187 G N -0.377 107.828 108.800 -0.992 0.000 2.466 6187 G HA2 -0.217 3.742 3.960 -0.002 0.000 0.316 6187 G HA3 -0.217 3.742 3.960 -0.002 0.000 0.316 6187 G C -0.701 173.365 174.900 -1.389 0.000 1.270 6187 G CA -0.377 44.005 45.100 -1.197 0.000 0.982 6187 G HN 0.241 nan 8.290 nan 0.000 0.506 6188 N N -0.944 117.288 118.700 -0.780 0.000 2.735 6188 N HA -0.192 4.547 4.740 -0.002 0.000 0.248 6188 N C 1.068 176.298 175.510 -0.467 0.000 1.083 6188 N CA 1.895 54.669 53.050 -0.459 0.000 0.703 6188 N CB -1.513 36.895 38.487 -0.132 0.000 1.005 6188 N HN 0.694 nan 8.380 nan 0.000 0.550 6189 W N 0.167 121.312 121.300 -0.257 0.000 2.363 6189 W HA -0.033 4.626 4.660 -0.002 0.000 0.296 6189 W C 2.448 178.835 176.519 -0.219 0.000 1.212 6189 W CA 0.554 57.807 57.345 -0.153 0.000 1.260 6189 W CB -0.498 28.922 29.460 -0.067 0.000 1.131 6189 W HN 0.310 nan 8.180 nan 0.000 0.530 6190 G N -0.117 108.440 108.800 -0.406 0.000 2.418 6190 G HA2 -0.260 3.699 3.960 -0.002 0.000 0.217 6190 G HA3 -0.260 3.699 3.960 -0.002 0.000 0.217 6190 G C 1.207 176.080 174.900 -0.045 0.000 1.158 6190 G CA 1.272 46.221 45.100 -0.250 0.000 0.771 6190 G HN 0.265 nan 8.290 nan 0.000 0.545 6191 H N 0.417 119.452 119.070 -0.059 0.000 2.357 6191 H HA 0.105 4.660 4.556 -0.002 0.000 0.301 6191 H C 2.726 178.037 175.328 -0.028 0.000 1.082 6191 H CA 0.713 56.729 56.048 -0.053 0.000 1.342 6191 H CB -0.440 29.300 29.762 -0.036 0.000 1.389 6191 H HN 0.264 nan 8.280 nan 0.000 0.511 6192 L N 0.477 121.786 121.223 0.142 0.000 2.265 6192 L HA -0.152 4.187 4.340 -0.002 0.000 0.215 6192 L C 1.903 178.867 176.870 0.156 0.000 1.117 6192 L CA 0.846 55.770 54.840 0.141 0.000 0.782 6192 L CB -0.223 41.951 42.059 0.191 0.000 0.914 6192 L HN 0.139 nan 8.230 nan 0.000 0.441 6193 D N 0.059 120.568 120.400 0.181 0.000 2.097 6193 D HA -0.168 4.471 4.640 -0.002 0.000 0.197 6193 D C 2.277 178.673 176.300 0.161 0.000 0.984 6193 D CA 1.109 55.266 54.000 0.261 0.000 0.826 6193 D CB -0.174 40.816 40.800 0.316 0.000 0.973 6193 D HN 0.410 nan 8.370 nan 0.000 0.460 6194 Q N 0.430 120.267 119.800 0.062 0.000 2.135 6194 Q HA -0.108 4.230 4.340 -0.002 0.000 0.204 6194 Q C 2.413 178.347 176.000 -0.110 0.000 0.981 6194 Q CA 0.906 56.658 55.803 -0.085 0.000 0.856 6194 Q CB -0.053 28.587 28.738 -0.162 0.000 0.902 6194 Q HN 0.146 nan 8.270 nan 0.000 0.425 6195 V N 1.080 120.970 119.914 -0.040 0.000 2.295 6195 V HA -0.287 3.832 4.120 -0.002 0.000 0.246 6195 V C 2.341 178.434 176.094 -0.002 0.000 1.049 6195 V CA 1.812 64.094 62.300 -0.030 0.000 1.024 6195 V CB -1.078 30.755 31.823 0.017 0.000 0.648 6195 V HN 0.427 nan 8.190 nan 0.000 0.447 6196 A N 0.084 122.940 122.820 0.061 0.000 1.917 6196 A HA -0.215 4.104 4.320 -0.002 0.000 0.219 6196 A C 2.439 180.025 177.584 0.004 0.000 1.182 6196 A CA 2.446 54.563 52.037 0.133 0.000 0.633 6196 A CB -0.896 18.284 19.000 0.300 0.000 0.819 6196 A HN 0.601 nan 8.150 nan 0.000 0.448 6197 A N -0.249 122.358 122.820 -0.354 0.000 1.865 6197 A HA -0.108 4.211 4.320 -0.002 0.000 0.217 6197 A C 2.203 179.660 177.584 -0.211 0.000 1.191 6197 A CA 1.616 53.198 52.037 -0.759 0.000 0.623 6197 A CB -0.715 17.759 19.000 -0.878 0.000 0.826 6197 A HN 0.488 nan 8.150 nan 0.000 0.444 6198 L N -1.219 119.924 121.223 -0.134 0.000 2.042 6198 L HA -0.209 4.130 4.340 -0.002 0.000 0.210 6198 L C 2.854 179.738 176.870 0.023 0.000 1.076 6198 L CA 1.899 56.711 54.840 -0.045 0.000 0.749 6198 L CB -0.487 41.526 42.059 -0.076 0.000 0.893 6198 L HN 0.489 nan 8.230 nan 0.000 0.432 6199 R N -0.611 119.911 120.500 0.036 0.000 2.120 6199 R HA -0.241 4.098 4.340 -0.002 0.000 0.234 6199 R C 2.228 178.575 176.300 0.079 0.000 1.123 6199 R CA 1.683 57.816 56.100 0.056 0.000 0.975 6199 R CB -0.346 29.998 30.300 0.075 0.000 0.866 6199 R HN 0.439 nan 8.270 nan 0.000 0.446 6200 W N 0.039 121.320 121.300 -0.032 0.000 2.388 6200 W HA -0.131 4.528 4.660 -0.001 0.000 0.294 6200 W C 1.560 178.064 176.519 -0.025 0.000 1.212 6200 W CA 0.943 58.288 57.345 -0.001 0.000 1.271 6200 W CB -0.009 29.478 29.460 0.045 0.000 1.126 6200 W HN -0.168 nan 8.180 nan 0.000 0.535 6201 V N 0.840 120.917 119.914 0.271 0.000 2.427 6201 V HA -0.286 3.833 4.120 -0.002 0.000 0.248 6201 V C 2.410 178.472 176.094 -0.053 0.000 1.051 6201 V CA 1.790 64.183 62.300 0.154 0.000 1.048 6201 V CB -0.889 31.050 31.823 0.193 0.000 0.666 6201 V HN 0.178 nan 8.190 nan 0.000 0.456 6202 Q N -0.219 119.559 119.800 -0.037 0.000 2.364 6202 Q HA -0.194 4.145 4.340 -0.002 0.000 0.209 6202 Q C 1.479 177.410 176.000 -0.115 0.000 0.977 6202 Q CA 1.439 57.216 55.803 -0.044 0.000 0.885 6202 Q CB -0.113 28.616 28.738 -0.015 0.000 0.941 6202 Q HN 0.718 nan 8.270 nan 0.000 0.464 6203 D N -1.313 118.945 120.400 -0.237 0.000 2.422 6203 D HA 0.033 4.672 4.640 -0.002 0.000 0.218 6203 D C 1.079 177.134 176.300 -0.408 0.000 1.047 6203 D CA 0.325 54.145 54.000 -0.301 0.000 0.885 6203 D CB 0.300 40.896 40.800 -0.340 0.000 1.035 6203 D HN 0.160 nan 8.370 nan 0.000 0.502 6204 N N -0.106 118.223 118.700 -0.618 0.000 2.317 6204 N HA 0.046 4.785 4.740 -0.002 0.000 0.199 6204 N C 1.366 176.749 175.510 -0.212 0.000 1.145 6204 N CA -0.065 52.637 53.050 -0.579 0.000 0.882 6204 N CB 1.068 38.827 38.487 -1.214 0.000 1.113 6204 N HN -0.011 nan 8.380 nan 0.000 0.486 6205 I N 2.860 123.334 120.570 -0.160 0.000 2.300 6205 I HA -0.262 3.907 4.170 -0.002 0.000 0.252 6205 I C 2.285 178.489 176.117 0.145 0.000 1.119 6205 I CA 0.802 62.148 61.300 0.077 0.000 1.384 6205 I CB -0.380 37.664 38.000 0.073 0.000 1.062 6205 I HN 0.104 nan 8.210 nan 0.000 0.426 6206 A N -0.996 121.852 122.820 0.046 0.000 1.917 6206 A HA -0.257 4.062 4.320 -0.002 0.000 0.219 6206 A C 2.438 180.047 177.584 0.041 0.000 1.182 6206 A CA 2.211 54.270 52.037 0.037 0.000 0.633 6206 A CB -1.161 17.831 19.000 -0.012 0.000 0.819 6206 A HN 0.461 nan 8.150 nan 0.000 0.448 6207 S N -1.191 114.520 115.700 0.018 0.000 2.462 6207 S HA -0.125 4.344 4.470 -0.002 0.000 0.243 6207 S C 0.756 175.179 174.600 -0.295 0.000 1.003 6207 S CA 1.308 59.430 58.200 -0.129 0.000 0.970 6207 S CB -0.430 62.657 63.200 -0.188 0.000 0.762 6207 S HN 0.570 nan 8.310 nan 0.000 0.510 6208 F N 0.076 120.004 119.950 -0.037 0.000 2.654 6208 F HA 0.392 4.918 4.527 -0.002 0.000 0.303 6208 F C 1.578 177.411 175.800 0.055 0.000 1.099 6208 F CA -0.096 57.899 58.000 -0.008 0.000 1.270 6208 F CB 0.148 39.124 39.000 -0.040 0.000 1.024 6208 F HN 0.184 nan 8.300 nan 0.000 0.548 6209 G N 0.314 109.208 108.800 0.156 0.000 2.141 6209 G HA2 -0.166 3.793 3.960 -0.002 0.000 0.242 6209 G HA3 -0.166 3.793 3.960 -0.002 0.000 0.242 6209 G C 0.568 175.548 174.900 0.133 0.000 0.982 6209 G CA -0.185 44.992 45.100 0.129 0.000 0.662 6209 G HN 0.751 nan 8.290 nan 0.000 0.527 6210 G N -0.500 108.390 108.800 0.150 0.000 2.412 6210 G HA2 0.515 4.474 3.960 -0.002 0.000 0.318 6210 G HA3 0.515 4.474 3.960 -0.002 0.000 0.318 6210 G C -0.340 174.613 174.900 0.088 0.000 1.146 6210 G CA -0.104 45.072 45.100 0.127 0.000 0.882 6210 G HN 0.558 nan 8.290 nan 0.000 0.501 6211 N N 1.520 120.264 118.700 0.074 0.000 2.462 6211 N HA 0.323 5.062 4.740 -0.002 0.000 0.242 6211 N C -1.014 174.533 175.510 0.061 0.000 1.010 6211 N CA -2.195 50.883 53.050 0.048 0.000 0.939 6211 N CB 1.913 40.416 38.487 0.027 0.000 1.127 6211 N HN 0.109 nan 8.380 nan 0.000 0.509 6212 P HA -0.031 nan 4.420 nan 0.000 0.228 6212 P C 0.866 178.245 177.300 0.133 0.000 1.151 6212 P CA 0.735 63.881 63.100 0.076 0.000 0.770 6212 P CB 0.123 31.840 31.700 0.028 0.000 0.786 6213 G N -1.023 107.801 108.800 0.039 0.000 2.920 6213 G HA2 -0.004 3.955 3.960 -0.002 0.000 0.208 6213 G HA3 -0.004 3.955 3.960 -0.002 0.000 0.208 6213 G C 0.505 175.213 174.900 -0.319 0.000 1.159 6213 G CA 0.144 45.179 45.100 -0.107 0.000 0.784 6213 G HN 0.300 nan 8.290 nan 0.000 0.535 6214 S N -0.074 115.649 115.700 0.038 0.000 2.293 6214 S HA 0.448 4.917 4.470 -0.002 0.000 0.154 6214 S C -0.896 173.866 174.600 0.270 0.000 1.602 6214 S CA -0.383 57.905 58.200 0.147 0.000 1.260 6214 S CB 0.737 63.934 63.200 -0.005 0.000 1.270 6214 S HN -0.044 nan 8.310 nan 0.000 0.416 6215 V N 3.435 123.600 119.914 0.418 0.000 2.398 6215 V HA 0.562 4.681 4.120 -0.002 0.000 0.286 6215 V C 0.079 176.255 176.094 0.136 0.000 1.026 6215 V CA -0.372 62.032 62.300 0.174 0.000 0.868 6215 V CB 1.942 33.820 31.823 0.091 0.000 0.982 6215 V HN 0.674 nan 8.190 nan 0.000 0.443 6216 T N 6.291 120.935 114.554 0.149 0.000 2.779 6216 T HA 0.634 4.982 4.350 -0.002 0.000 0.280 6216 T C -0.217 174.650 174.700 0.278 0.000 0.987 6216 T CA -0.209 61.985 62.100 0.158 0.000 0.966 6216 T CB 1.041 69.941 68.868 0.054 0.000 0.933 6216 T HN 0.616 nan 8.240 nan 0.000 0.442 6217 I N 1.360 122.091 120.570 0.269 0.000 2.392 6217 I HA 0.904 5.073 4.170 -0.002 0.000 0.295 6217 I C -0.953 175.407 176.117 0.405 0.000 0.985 6217 I CA -1.101 60.344 61.300 0.242 0.000 1.221 6217 I CB 1.079 39.017 38.000 -0.103 0.000 1.366 6217 I HN 0.561 nan 8.210 nan 0.000 0.467 6218 F N 2.792 122.797 119.950 0.092 0.000 2.654 6218 F HA 1.002 5.528 4.527 -0.001 0.000 0.308 6218 F C -0.455 175.323 175.800 -0.037 0.000 1.108 6218 F CA -1.024 57.068 58.000 0.153 0.000 0.957 6218 F CB 1.224 40.437 39.000 0.355 0.000 1.309 6218 F HN 0.877 nan 8.300 nan 0.000 0.446 6219 G N 1.058 109.747 108.800 -0.185 0.000 2.506 6219 G HA2 0.545 4.504 3.960 -0.002 0.000 0.292 6219 G HA3 0.545 4.504 3.960 -0.002 0.000 0.292 6219 G C -2.422 172.283 174.900 -0.324 0.000 1.425 6219 G CA -0.717 43.793 45.100 -0.984 0.000 0.788 6219 G HN 1.119 nan 8.290 nan 0.000 0.490 6220 E N -0.642 119.346 120.200 -0.353 0.000 2.288 6220 E HA 0.786 5.135 4.350 -0.002 0.000 0.268 6220 E C 0.520 177.098 176.600 -0.037 0.000 0.885 6220 E CA 0.021 56.394 56.400 -0.045 0.000 0.767 6220 E CB 1.927 31.655 29.700 0.046 0.000 1.220 6220 E HN 1.259 nan 8.360 nan 0.000 0.427 6221 S N 1.289 117.051 115.700 0.103 0.000 3.790 6221 S HA -0.368 4.101 4.470 -0.002 0.000 0.628 6221 S C 1.524 176.194 174.600 0.115 0.000 2.348 6221 S CA 1.780 60.140 58.200 0.267 0.000 3.927 6221 S CB -1.736 61.684 63.200 0.367 0.000 0.236 6221 S HN 1.563 nan 8.310 nan 0.000 0.953 6222 A N 0.674 123.553 122.820 0.098 0.000 1.997 6222 A HA -0.051 4.268 4.320 -0.002 0.000 0.221 6222 A C 2.434 179.957 177.584 -0.102 0.000 1.172 6222 A CA 2.946 54.984 52.037 0.003 0.000 0.645 6222 A CB -1.650 17.374 19.000 0.039 0.000 0.813 6222 A HN 1.666 nan 8.150 nan 0.000 0.454 6223 G N -0.934 107.763 108.800 -0.171 0.000 2.402 6223 G HA2 0.058 4.017 3.960 -0.002 0.000 0.216 6223 G HA3 0.058 4.017 3.960 -0.002 0.000 0.216 6223 G C 1.519 176.241 174.900 -0.296 0.000 1.162 6223 G CA 1.216 46.093 45.100 -0.371 0.000 0.777 6223 G HN 0.729 nan 8.290 nan 0.000 0.539 6224 G N 0.382 109.082 108.800 -0.166 0.000 2.402 6224 G HA2 -0.172 3.786 3.960 -0.002 0.000 0.216 6224 G HA3 -0.172 3.786 3.960 -0.002 0.000 0.216 6224 G C 1.586 176.448 174.900 -0.062 0.000 1.162 6224 G CA 1.165 46.225 45.100 -0.067 0.000 0.777 6224 G HN 0.409 nan 8.290 nan 0.000 0.539 6225 E N 1.132 121.296 120.200 -0.061 0.000 2.085 6225 E HA -0.128 4.221 4.350 -0.002 0.000 0.194 6225 E C 2.578 179.093 176.600 -0.142 0.000 0.994 6225 E CA 1.425 57.776 56.400 -0.081 0.000 0.801 6225 E CB -0.355 29.303 29.700 -0.070 0.000 0.743 6225 E HN 0.345 nan 8.360 nan 0.000 0.453 6226 S N 0.115 115.710 115.700 -0.174 0.000 2.355 6226 S HA -0.108 4.361 4.470 -0.002 0.000 0.222 6226 S C 2.178 176.590 174.600 -0.314 0.000 1.031 6226 S CA 1.084 59.128 58.200 -0.260 0.000 0.993 6226 S CB -0.294 62.736 63.200 -0.283 0.000 0.859 6226 S HN 0.136 nan 8.310 nan 0.000 0.453 6227 V N 1.487 121.241 119.914 -0.266 0.000 2.332 6227 V HA -0.191 3.928 4.120 -0.002 0.000 0.248 6227 V C 2.627 178.564 176.094 -0.261 0.000 1.055 6227 V CA 2.081 64.222 62.300 -0.264 0.000 1.038 6227 V CB -0.769 30.973 31.823 -0.135 0.000 0.651 6227 V HN 0.573 nan 8.190 nan 0.000 0.450 6228 S N -0.852 114.751 115.700 -0.162 0.000 2.382 6228 S HA -0.145 4.324 4.470 -0.002 0.000 0.228 6228 S C 1.923 176.389 174.600 -0.223 0.000 1.027 6228 S CA 1.725 59.842 58.200 -0.138 0.000 0.991 6228 S CB -0.110 63.075 63.200 -0.026 0.000 0.823 6228 S HN 0.342 nan 8.310 nan 0.000 0.469 6229 V N 1.896 121.653 119.914 -0.263 0.000 2.453 6229 V HA -0.046 4.073 4.120 -0.002 0.000 0.247 6229 V C 2.276 178.195 176.094 -0.291 0.000 1.048 6229 V CA 1.464 63.582 62.300 -0.304 0.000 1.049 6229 V CB -0.564 30.983 31.823 -0.460 0.000 0.672 6229 V HN 0.487 nan 8.190 nan 0.000 0.457 6230 L N -0.440 120.589 121.223 -0.324 0.000 2.275 6230 L HA -0.099 4.239 4.340 -0.002 0.000 0.215 6230 L C 2.294 179.136 176.870 -0.046 0.000 1.119 6230 L CA 0.735 55.411 54.840 -0.273 0.000 0.790 6230 L CB -0.487 41.272 42.059 -0.500 0.000 0.919 6230 L HN 0.227 nan 8.230 nan 0.000 0.443 6231 V N -0.146 119.716 119.914 -0.088 0.000 2.667 6231 V HA -0.200 3.919 4.120 -0.002 0.000 0.252 6231 V C 2.065 177.998 176.094 -0.269 0.000 1.065 6231 V CA 1.237 63.578 62.300 0.069 0.000 1.083 6231 V CB -0.177 31.474 31.823 -0.287 0.000 0.692 6231 V HN 0.397 nan 8.190 nan 0.000 0.468 6232 L N -0.972 120.095 121.223 -0.260 0.000 2.529 6232 L HA 0.162 4.501 4.340 -0.002 0.000 0.223 6232 L C 0.858 177.609 176.870 -0.197 0.000 1.113 6232 L CA 0.168 54.874 54.840 -0.224 0.000 0.861 6232 L CB 0.077 42.036 42.059 -0.166 0.000 1.012 6232 L HN 0.182 nan 8.230 nan 0.000 0.461 6233 S N 0.637 116.238 115.700 -0.166 0.000 2.541 6233 S HA 0.246 4.715 4.470 -0.002 0.000 0.283 6233 S C -1.492 173.144 174.600 0.060 0.000 1.196 6233 S CA -1.041 57.126 58.200 -0.055 0.000 1.062 6233 S CB 1.507 64.683 63.200 -0.040 0.000 1.009 6233 S HN -0.019 nan 8.310 nan 0.000 0.502 6234 P HA 0.002 nan 4.420 nan 0.000 0.222 6234 P C 1.010 178.399 177.300 0.148 0.000 1.153 6234 P CA 0.786 63.971 63.100 0.142 0.000 0.798 6234 P CB 0.027 31.771 31.700 0.073 0.000 0.796 6235 L N -0.849 120.435 121.223 0.102 0.000 2.456 6235 L HA -0.009 4.330 4.340 -0.002 0.000 0.224 6235 L C 2.329 179.259 176.870 0.099 0.000 1.148 6235 L CA 1.100 55.990 54.840 0.082 0.000 0.825 6235 L CB -0.806 41.286 42.059 0.055 0.000 0.937 6235 L HN -0.031 nan 8.230 nan 0.000 0.450 6236 A N 0.085 123.010 122.820 0.175 0.000 2.343 6236 A HA 0.076 4.395 4.320 -0.002 0.000 0.223 6236 A C 0.864 178.565 177.584 0.194 0.000 1.214 6236 A CA -0.369 51.791 52.037 0.205 0.000 0.900 6236 A CB -0.064 19.070 19.000 0.223 0.000 0.942 6236 A HN 0.349 nan 8.150 nan 0.000 0.507 6237 K N 0.734 121.193 120.400 0.097 0.000 2.448 6237 K HA 0.107 4.426 4.320 -0.002 0.000 0.278 6237 K C -0.274 176.250 176.600 -0.126 0.000 1.009 6237 K CA 0.276 56.437 56.287 -0.210 0.000 0.995 6237 K CB 0.148 32.648 32.500 0.000 0.000 0.917 6237 K HN 0.147 nan 8.250 nan 0.000 0.481 6238 N N 1.052 119.617 118.700 -0.226 0.000 2.948 6238 N HA -0.178 4.560 4.740 -0.002 0.000 0.239 6238 N C 0.185 175.645 175.510 -0.082 0.000 0.954 6238 N CA 1.356 54.337 53.050 -0.116 0.000 0.941 6238 N CB -1.291 37.173 38.487 -0.038 0.000 1.101 6238 N HN 0.683 nan 8.380 nan 0.000 0.579 6239 L N -0.695 120.506 121.223 -0.037 0.000 2.616 6239 L HA 0.274 4.613 4.340 -0.002 0.000 0.229 6239 L C 0.129 177.020 176.870 0.035 0.000 1.110 6239 L CA 0.159 55.019 54.840 0.033 0.000 0.884 6239 L CB -0.029 42.081 42.059 0.085 0.000 1.115 6239 L HN 0.179 nan 8.230 nan 0.000 0.481 6240 F N -3.890 115.743 119.950 -0.528 0.000 2.719 6240 F HA 0.431 4.957 4.527 -0.002 0.000 0.309 6240 F C 0.041 175.356 175.800 -0.808 0.000 1.138 6240 F CA -1.207 56.417 58.000 -0.627 0.000 0.943 6240 F CB 0.685 39.513 39.000 -0.287 0.000 1.304 6240 F HN -0.100 nan 8.300 nan 0.000 0.445 6241 H N 0.142 119.121 119.070 -0.151 0.000 3.233 6241 H HA 0.450 5.005 4.556 -0.002 0.000 0.263 6241 H C -0.520 174.674 175.328 -0.223 0.000 1.168 6241 H CA -0.178 55.708 56.048 -0.270 0.000 1.159 6241 H CB 0.801 30.460 29.762 -0.171 0.000 1.593 6241 H HN 0.570 nan 8.280 nan 0.000 0.580 6242 R N 0.459 120.929 120.500 -0.050 0.000 2.629 6242 R HA 0.713 5.051 4.340 -0.002 0.000 0.266 6242 R C -1.438 174.964 176.300 0.169 0.000 1.051 6242 R CA -0.747 55.310 56.100 -0.071 0.000 0.895 6242 R CB 2.394 32.484 30.300 -0.351 0.000 1.246 6242 R HN 0.102 nan 8.270 nan 0.000 0.459 6243 A N 2.922 125.898 122.820 0.259 0.000 2.422 6243 A HA 0.751 5.070 4.320 -0.002 0.000 0.302 6243 A C -0.961 176.903 177.584 0.465 0.000 1.041 6243 A CA -0.686 51.519 52.037 0.280 0.000 0.708 6243 A CB 1.205 20.196 19.000 -0.014 0.000 1.257 6243 A HN 0.615 nan 8.150 nan 0.000 0.414 6244 I N 1.239 122.033 120.570 0.373 0.000 2.465 6244 I HA 0.410 4.579 4.170 -0.002 0.000 0.291 6244 I C -0.115 176.182 176.117 0.299 0.000 1.014 6244 I CA -0.429 61.016 61.300 0.243 0.000 1.093 6244 I CB 2.394 40.420 38.000 0.043 0.000 1.267 6244 I HN 0.509 nan 8.210 nan 0.000 0.431 6245 S N 4.762 120.583 115.700 0.202 0.000 2.669 6245 S HA 0.283 4.752 4.470 -0.002 0.000 0.315 6245 S C -0.490 174.172 174.600 0.104 0.000 1.106 6245 S CA -0.610 57.682 58.200 0.154 0.000 1.107 6245 S CB 0.643 63.916 63.200 0.121 0.000 0.990 6245 S HN 0.482 nan 8.310 nan 0.000 0.471 6246 E N 2.029 122.357 120.200 0.214 0.000 1.963 6246 E HA 0.285 4.634 4.350 -0.002 0.000 0.274 6246 E C -0.304 176.387 176.600 0.151 0.000 1.061 6246 E CA -0.384 56.184 56.400 0.280 0.000 0.847 6246 E CB 0.479 30.455 29.700 0.459 0.000 1.083 6246 E HN 0.630 nan 8.360 nan 0.000 0.402 6247 S N 1.825 117.585 115.700 0.099 0.000 3.791 6247 S HA -0.111 4.358 4.470 -0.002 0.000 0.393 6247 S C 0.023 174.823 174.600 0.333 0.000 0.936 6247 S CA 0.391 58.670 58.200 0.131 0.000 1.234 6247 S CB -1.174 62.021 63.200 -0.009 0.000 0.891 6247 S HN 0.914 nan 8.310 nan 0.000 0.519 6248 G N -0.838 108.119 108.800 0.262 0.000 2.270 6248 G HA2 0.514 4.472 3.960 -0.002 0.000 0.295 6248 G HA3 0.514 4.472 3.960 -0.002 0.000 0.295 6248 G C -0.902 174.036 174.900 0.062 0.000 1.732 6248 G CA 0.062 45.298 45.100 0.226 0.000 0.909 6248 G HN 1.317 nan 8.290 nan 0.000 0.730 6249 V N -0.662 119.250 119.914 -0.004 0.000 3.103 6249 V HA 0.915 5.034 4.120 -0.002 0.000 0.311 6249 V C 1.306 177.353 176.094 -0.080 0.000 1.322 6249 V CA -0.258 62.019 62.300 -0.037 0.000 1.063 6249 V CB 1.105 32.897 31.823 -0.052 0.000 1.090 6249 V HN 1.938 nan 8.190 nan 0.000 0.462 6250 A N -0.723 122.045 122.820 -0.085 0.000 2.235 6250 A HA 0.330 4.648 4.320 -0.002 0.000 0.208 6250 A C 1.320 178.838 177.584 -0.110 0.000 1.172 6250 A CA 0.886 52.858 52.037 -0.108 0.000 0.786 6250 A CB -0.667 18.262 19.000 -0.117 0.000 0.804 6250 A HN 0.741 nan 8.150 nan 0.000 0.479 6251 L N -0.773 120.384 121.223 -0.110 0.000 2.693 6251 L HA 0.084 4.423 4.340 -0.002 0.000 0.235 6251 L C 0.206 176.977 176.870 -0.165 0.000 1.127 6251 L CA 0.009 54.778 54.840 -0.118 0.000 0.914 6251 L CB 0.333 42.341 42.059 -0.086 0.000 1.193 6251 L HN 0.090 nan 8.230 nan 0.000 0.502 6252 T N 0.536 114.972 114.554 -0.197 0.000 3.842 6252 T HA 0.001 4.350 4.350 -0.002 0.000 0.267 6252 T C 1.559 176.102 174.700 -0.263 0.000 1.173 6252 T CA 0.460 62.382 62.100 -0.296 0.000 1.142 6252 T CB 0.259 68.908 68.868 -0.365 0.000 1.191 6252 T HN 0.418 nan 8.240 nan 0.000 0.895 6253 S N 2.249 117.800 115.700 -0.248 0.000 2.434 6253 S HA -0.239 4.230 4.470 -0.002 0.000 0.250 6253 S C 2.138 176.606 174.600 -0.219 0.000 1.102 6253 S CA 1.736 59.796 58.200 -0.233 0.000 1.104 6253 S CB -0.998 62.038 63.200 -0.274 0.000 0.957 6253 S HN 0.505 nan 8.310 nan 0.000 0.456 6254 V N 1.633 121.404 119.914 -0.238 0.000 2.380 6254 V HA -0.120 3.999 4.120 -0.002 0.000 0.251 6254 V C 2.211 178.207 176.094 -0.164 0.000 1.063 6254 V CA 2.267 64.451 62.300 -0.193 0.000 1.055 6254 V CB -0.537 31.175 31.823 -0.186 0.000 0.657 6254 V HN 0.673 nan 8.190 nan 0.000 0.455 6255 L N -0.460 120.659 121.223 -0.175 0.000 2.418 6255 L HA 0.141 4.480 4.340 -0.002 0.000 0.218 6255 L C 0.525 177.297 176.870 -0.162 0.000 1.125 6255 L CA 0.033 54.771 54.840 -0.170 0.000 0.835 6255 L CB 0.182 42.147 42.059 -0.157 0.000 0.953 6255 L HN 0.134 nan 8.230 nan 0.000 0.454 6256 V N 0.990 120.816 119.914 -0.145 0.000 2.370 6256 V HA 0.235 4.354 4.120 -0.002 0.000 0.283 6256 V C 0.047 176.072 176.094 -0.115 0.000 1.023 6256 V CA -0.867 61.361 62.300 -0.120 0.000 0.857 6256 V CB 1.538 33.292 31.823 -0.114 0.000 0.985 6256 V HN 0.029 nan 8.190 nan 0.000 0.443 6257 K N 5.840 126.181 120.400 -0.098 0.000 2.263 6257 K HA 0.311 4.630 4.320 -0.002 0.000 0.282 6257 K C 0.092 176.645 176.600 -0.079 0.000 1.089 6257 K CA -0.516 55.718 56.287 -0.087 0.000 0.907 6257 K CB 1.242 33.693 32.500 -0.081 0.000 1.148 6257 K HN 0.677 nan 8.250 nan 0.000 0.470 6258 K N 0.901 121.254 120.400 -0.078 0.000 2.106 6258 K HA 0.536 4.855 4.320 -0.002 0.000 0.246 6258 K C 0.305 176.872 176.600 -0.055 0.000 0.987 6258 K CA -0.220 56.026 56.287 -0.069 0.000 0.904 6258 K CB 0.583 33.037 32.500 -0.077 0.000 1.071 6258 K HN 0.537 nan 8.250 nan 0.000 0.453 6259 G N 1.080 109.851 108.800 -0.047 0.000 2.955 6259 G HA2 -0.293 3.666 3.960 -0.002 0.000 0.604 6259 G HA3 -0.293 3.666 3.960 -0.002 0.000 0.604 6259 G C -0.736 174.141 174.900 -0.039 0.000 1.572 6259 G CA 0.189 45.267 45.100 -0.037 0.000 1.016 6259 G HN 1.079 nan 8.290 nan 0.000 0.569 6260 D N -0.644 119.737 120.400 -0.032 0.000 2.982 6260 D HA 0.123 4.762 4.640 -0.002 0.000 0.222 6260 D C 1.738 178.014 176.300 -0.040 0.000 1.124 6260 D CA 1.247 55.227 54.000 -0.034 0.000 0.810 6260 D CB 0.485 41.272 40.800 -0.023 0.000 1.152 6260 D HN 1.391 nan 8.370 nan 0.000 0.538 6261 V N 1.383 121.262 119.914 -0.058 0.000 3.590 6261 V HA 0.123 4.242 4.120 -0.002 0.000 0.265 6261 V C 2.139 178.187 176.094 -0.075 0.000 1.239 6261 V CA 0.175 62.432 62.300 -0.072 0.000 1.117 6261 V CB -0.225 31.534 31.823 -0.108 0.000 0.818 6261 V HN 0.313 nan 8.190 nan 0.000 0.451 6262 K N 2.020 122.382 120.400 -0.063 0.000 2.077 6262 K HA -0.135 4.183 4.320 -0.002 0.000 0.213 6262 K C -0.161 176.422 176.600 -0.029 0.000 1.051 6262 K CA 2.705 58.961 56.287 -0.051 0.000 0.929 6262 K CB -1.745 30.738 32.500 -0.027 0.000 0.715 6262 K HN 0.450 nan 8.250 nan 0.000 0.451 6263 P HA -0.195 nan 4.420 nan 0.000 0.216 6263 P C 1.342 178.650 177.300 0.014 0.000 1.153 6263 P CA 1.016 64.117 63.100 0.001 0.000 0.858 6263 P CB 0.020 31.721 31.700 0.000 0.000 0.789 6264 L N -1.097 120.130 121.223 0.007 0.000 2.141 6264 L HA -0.096 4.243 4.340 -0.002 0.000 0.209 6264 L C 2.043 178.952 176.870 0.065 0.000 1.094 6264 L CA 1.866 56.730 54.840 0.039 0.000 0.763 6264 L CB -0.993 41.085 42.059 0.031 0.000 0.908 6264 L HN -0.040 nan 8.230 nan 0.000 0.437 6265 A N -0.051 122.769 122.820 0.000 0.000 1.898 6265 A HA -0.219 4.100 4.320 -0.002 0.000 0.216 6265 A C 1.998 179.688 177.584 0.175 0.000 1.181 6265 A CA 1.536 53.604 52.037 0.051 0.000 0.620 6265 A CB -0.407 18.482 19.000 -0.186 0.000 0.819 6265 A HN 0.560 nan 8.150 nan 0.000 0.442 6266 E N -0.754 119.496 120.200 0.084 0.000 2.106 6266 E HA -0.229 4.120 4.350 -0.002 0.000 0.192 6266 E C 2.218 178.858 176.600 0.066 0.000 0.984 6266 E CA 1.161 57.604 56.400 0.072 0.000 0.806 6266 E CB -0.167 29.556 29.700 0.038 0.000 0.750 6266 E HN 0.771 nan 8.360 nan 0.000 0.458 6267 Q N 0.585 120.424 119.800 0.065 0.000 2.084 6267 Q HA -0.155 4.184 4.340 -0.002 0.000 0.202 6267 Q C 2.161 178.198 176.000 0.062 0.000 0.978 6267 Q CA 1.071 56.904 55.803 0.050 0.000 0.844 6267 Q CB 0.077 28.843 28.738 0.046 0.000 0.898 6267 Q HN 0.304 nan 8.270 nan 0.000 0.426 6268 I N 0.077 120.716 120.570 0.115 0.000 2.193 6268 I HA -0.220 3.949 4.170 -0.002 0.000 0.240 6268 I C 2.455 178.602 176.117 0.048 0.000 1.084 6268 I CA 0.773 62.141 61.300 0.113 0.000 1.365 6268 I CB -0.536 37.595 38.000 0.218 0.000 1.064 6268 I HN 0.202 nan 8.210 nan 0.000 0.410 6269 A N 1.589 124.453 122.820 0.074 0.000 1.869 6269 A HA -0.253 4.066 4.320 -0.002 0.000 0.218 6269 A C 2.344 179.927 177.584 -0.001 0.000 1.203 6269 A CA 1.949 53.993 52.037 0.013 0.000 0.638 6269 A CB -1.098 17.938 19.000 0.060 0.000 0.831 6269 A HN 0.386 nan 8.150 nan 0.000 0.450 6270 I N -0.609 119.971 120.570 0.016 0.000 2.151 6270 I HA -0.275 3.894 4.170 -0.002 0.000 0.243 6270 I C 2.620 178.733 176.117 -0.006 0.000 1.080 6270 I CA 2.002 63.305 61.300 0.004 0.000 1.339 6270 I CB -0.767 37.238 38.000 0.008 0.000 1.039 6270 I HN 0.323 nan 8.210 nan 0.000 0.409 6271 T N 0.741 115.292 114.554 -0.006 0.000 2.788 6271 T HA -0.131 4.218 4.350 -0.002 0.000 0.268 6271 T C 1.822 176.508 174.700 -0.024 0.000 1.044 6271 T CA 1.377 63.467 62.100 -0.016 0.000 1.139 6271 T CB -0.273 68.583 68.868 -0.020 0.000 0.867 6271 T HN 0.494 nan 8.240 nan 0.000 0.454 6272 A N 0.562 123.363 122.820 -0.032 0.000 2.239 6272 A HA 0.451 4.770 4.320 -0.002 0.000 0.209 6272 A C 1.616 179.176 177.584 -0.041 0.000 1.171 6272 A CA 0.732 52.740 52.037 -0.048 0.000 0.768 6272 A CB -0.930 18.019 19.000 -0.086 0.000 0.790 6272 A HN 0.831 nan 8.150 nan 0.000 0.478 6273 G N -1.599 107.184 108.800 -0.029 0.000 2.368 6273 G HA2 -0.164 3.795 3.960 -0.002 0.000 0.290 6273 G HA3 -0.164 3.795 3.960 -0.002 0.000 0.290 6273 G C -0.220 174.664 174.900 -0.026 0.000 1.098 6273 G CA 0.006 45.092 45.100 -0.023 0.000 1.073 6273 G HN 0.689 nan 8.290 nan 0.000 0.511 6274 c N 0.572 119.158 118.600 -0.024 0.000 2.712 6274 c HA 0.654 5.223 4.570 -0.002 0.000 0.308 6274 c C 0.791 174.878 174.090 -0.006 0.000 1.201 6274 c CA -1.162 55.154 56.329 -0.022 0.000 1.554 6274 c CB 1.796 44.284 42.510 -0.037 0.000 2.117 6274 c HN 0.668 nan 8.230 nan 0.000 0.480 6275 K N 0.612 121.013 120.400 0.001 0.000 2.180 6275 K HA 0.340 4.659 4.320 -0.002 0.000 0.251 6275 K C 0.770 177.378 176.600 0.014 0.000 1.014 6275 K CA 0.226 56.518 56.287 0.008 0.000 0.913 6275 K CB 0.435 32.941 32.500 0.010 0.000 1.008 6275 K HN 0.852 nan 8.250 nan 0.000 0.490 6276 T N -2.734 111.829 114.554 0.015 0.000 3.339 6276 T HA 0.075 4.424 4.350 -0.002 0.000 0.292 6276 T C 0.942 175.651 174.700 0.015 0.000 1.012 6276 T CA -0.439 61.674 62.100 0.021 0.000 0.937 6276 T CB -0.033 68.849 68.868 0.024 0.000 1.164 6276 T HN 0.477 nan 8.240 nan 0.000 0.509 6277 T N 2.363 116.923 114.554 0.010 0.000 2.665 6277 T HA -0.013 4.336 4.350 -0.002 0.000 0.268 6277 T C 1.159 175.859 174.700 0.000 0.000 1.035 6277 T CA 1.886 63.988 62.100 0.004 0.000 1.151 6277 T CB -0.531 68.338 68.868 0.001 0.000 0.862 6277 T HN 0.863 nan 8.240 nan 0.000 0.438 6278 T N -2.526 112.023 114.554 -0.007 0.000 2.821 6278 T HA 0.517 4.866 4.350 -0.002 0.000 0.306 6278 T C 0.878 175.558 174.700 -0.034 0.000 1.313 6278 T CA -0.435 61.652 62.100 -0.022 0.000 1.012 6278 T CB 1.733 70.569 68.868 -0.054 0.000 1.298 6278 T HN -0.180 nan 8.240 nan 0.000 0.502 6279 S N 0.384 116.060 115.700 -0.039 0.000 2.359 6279 S HA -0.085 4.383 4.470 -0.002 0.000 0.224 6279 S C 2.479 177.002 174.600 -0.128 0.000 1.035 6279 S CA 1.672 59.863 58.200 -0.016 0.000 1.018 6279 S CB -0.997 62.282 63.200 0.132 0.000 0.876 6279 S HN 0.960 nan 8.310 nan 0.000 0.448 6280 A N 0.707 123.250 122.820 -0.463 0.000 1.940 6280 A HA -0.076 4.243 4.320 -0.002 0.000 0.219 6280 A C 2.296 179.825 177.584 -0.091 0.000 1.176 6280 A CA 1.569 53.361 52.037 -0.408 0.000 0.631 6280 A CB -0.780 17.896 19.000 -0.540 0.000 0.814 6280 A HN 0.371 nan 8.150 nan 0.000 0.446 6281 V N -0.312 119.565 119.914 -0.061 0.000 2.453 6281 V HA -0.264 3.855 4.120 -0.002 0.000 0.247 6281 V C 2.604 178.737 176.094 0.064 0.000 1.048 6281 V CA 2.033 64.349 62.300 0.027 0.000 1.049 6281 V CB -0.587 31.240 31.823 0.007 0.000 0.672 6281 V HN 0.572 nan 8.190 nan 0.000 0.457 6282 M N -0.649 118.981 119.600 0.050 0.000 2.077 6282 M HA -0.135 4.344 4.480 -0.002 0.000 0.261 6282 M C 2.225 178.550 176.300 0.043 0.000 1.070 6282 M CA 1.635 56.970 55.300 0.059 0.000 1.125 6282 M CB -0.490 32.181 32.600 0.118 0.000 1.339 6282 M HN 0.231 nan 8.290 nan 0.000 0.409 6283 V N -0.559 119.418 119.914 0.105 0.000 2.490 6283 V HA -0.276 3.843 4.120 -0.002 0.000 0.250 6283 V C 2.222 178.387 176.094 0.117 0.000 1.061 6283 V CA 2.201 64.567 62.300 0.109 0.000 1.064 6283 V CB -1.163 30.784 31.823 0.206 0.000 0.670 6283 V HN 0.492 nan 8.190 nan 0.000 0.461 6284 H N -0.843 118.245 119.070 0.031 0.000 2.428 6284 H HA -0.142 4.413 4.556 -0.002 0.000 0.296 6284 H C 2.234 177.566 175.328 0.006 0.000 1.062 6284 H CA 1.906 57.967 56.048 0.020 0.000 1.350 6284 H CB -0.397 29.365 29.762 0.000 0.000 1.403 6284 H HN 0.457 nan 8.280 nan 0.000 0.533 6285 c N -0.425 118.125 118.600 -0.082 0.000 2.464 6285 c HA 0.101 4.670 4.570 -0.002 0.000 0.278 6285 c C 2.571 176.577 174.090 -0.140 0.000 1.375 6285 c CA 0.284 56.530 56.329 -0.138 0.000 1.761 6285 c CB -1.401 41.080 42.510 -0.048 0.000 1.944 6285 c HN 0.630 nan 8.230 nan 0.000 0.509 6286 L N 0.357 121.514 121.223 -0.110 0.000 2.217 6286 L HA 0.028 4.367 4.340 -0.002 0.000 0.211 6286 L C 2.840 179.692 176.870 -0.030 0.000 1.107 6286 L CA 1.077 55.856 54.840 -0.101 0.000 0.783 6286 L CB -0.469 41.451 42.059 -0.231 0.000 0.919 6286 L HN 0.294 nan 8.230 nan 0.000 0.442 6287 R N -0.722 119.758 120.500 -0.034 0.000 2.276 6287 R HA -0.074 4.265 4.340 -0.002 0.000 0.203 6287 R C 1.943 178.160 176.300 -0.139 0.000 1.017 6287 R CA 0.431 56.473 56.100 -0.096 0.000 1.010 6287 R CB 0.006 30.264 30.300 -0.070 0.000 0.900 6287 R HN 0.382 nan 8.270 nan 0.000 0.469 6288 Q N 0.662 120.361 119.800 -0.167 0.000 2.269 6288 Q HA 0.033 4.372 4.340 -0.002 0.000 0.201 6288 Q C 0.274 176.216 176.000 -0.095 0.000 0.946 6288 Q CA 0.792 56.507 55.803 -0.148 0.000 0.877 6288 Q CB 0.202 28.830 28.738 -0.183 0.000 0.963 6288 Q HN 0.063 nan 8.270 nan 0.000 0.472 6289 K N 2.074 122.418 120.400 -0.092 0.000 2.380 6289 K HA 0.056 4.375 4.320 -0.002 0.000 0.267 6289 K C 0.629 177.208 176.600 -0.035 0.000 0.990 6289 K CA 0.125 56.373 56.287 -0.065 0.000 0.946 6289 K CB 0.102 32.553 32.500 -0.082 0.000 0.937 6289 K HN 0.198 nan 8.250 nan 0.000 0.491 6290 T N -2.606 111.945 114.554 -0.005 0.000 2.849 6290 T HA 0.060 4.409 4.350 -0.002 0.000 0.284 6290 T C 1.315 176.073 174.700 0.096 0.000 1.004 6290 T CA -0.585 61.532 62.100 0.028 0.000 1.021 6290 T CB 1.194 70.076 68.868 0.023 0.000 1.013 6290 T HN 0.624 nan 8.240 nan 0.000 0.527 6291 E N 0.456 120.739 120.200 0.138 0.000 2.070 6291 E HA -0.287 4.062 4.350 -0.002 0.000 0.197 6291 E C 1.883 178.645 176.600 0.270 0.000 1.004 6291 E CA 1.745 58.314 56.400 0.281 0.000 0.805 6291 E CB -0.146 29.623 29.700 0.115 0.000 0.744 6291 E HN 0.892 nan 8.360 nan 0.000 0.451 6292 E N 0.269 120.548 120.200 0.132 0.000 2.070 6292 E HA -0.267 4.082 4.350 -0.002 0.000 0.197 6292 E C 2.036 178.700 176.600 0.108 0.000 1.004 6292 E CA 1.637 58.099 56.400 0.104 0.000 0.805 6292 E CB -0.014 29.717 29.700 0.052 0.000 0.744 6292 E HN 0.347 nan 8.360 nan 0.000 0.451 6293 E N 0.306 120.551 120.200 0.074 0.000 2.033 6293 E HA -0.217 4.132 4.350 -0.002 0.000 0.199 6293 E C 2.309 178.929 176.600 0.034 0.000 1.011 6293 E CA 1.395 57.817 56.400 0.038 0.000 0.815 6293 E CB -0.139 29.563 29.700 0.004 0.000 0.755 6293 E HN 0.314 nan 8.360 nan 0.000 0.451 6294 L N 0.515 121.751 121.223 0.022 0.000 2.079 6294 L HA -0.211 4.128 4.340 -0.002 0.000 0.210 6294 L C 2.588 179.473 176.870 0.025 0.000 1.081 6294 L CA 0.456 55.228 54.840 -0.114 0.000 0.752 6294 L CB -0.392 41.395 42.059 -0.454 0.000 0.896 6294 L HN 0.244 nan 8.230 nan 0.000 0.433 6295 L N 0.213 121.611 121.223 0.292 0.000 2.046 6295 L HA -0.211 4.128 4.340 -0.002 0.000 0.208 6295 L C 2.301 179.278 176.870 0.179 0.000 1.077 6295 L CA 1.791 56.844 54.840 0.355 0.000 0.747 6295 L CB -0.524 41.718 42.059 0.305 0.000 0.896 6295 L HN 0.197 nan 8.230 nan 0.000 0.432 6296 E N -1.430 118.837 120.200 0.111 0.000 2.265 6296 E HA -0.162 4.187 4.350 -0.002 0.000 0.196 6296 E C 1.807 178.432 176.600 0.041 0.000 0.996 6296 E CA 1.471 57.909 56.400 0.062 0.000 0.832 6296 E CB -0.048 29.675 29.700 0.038 0.000 0.756 6296 E HN 0.571 nan 8.360 nan 0.000 0.491 6297 T N -0.076 114.500 114.554 0.037 0.000 2.809 6297 T HA -0.089 4.260 4.350 -0.002 0.000 0.260 6297 T C 1.988 176.717 174.700 0.048 0.000 1.039 6297 T CA 1.393 63.502 62.100 0.015 0.000 1.141 6297 T CB -0.379 68.482 68.868 -0.012 0.000 0.869 6297 T HN 0.145 nan 8.240 nan 0.000 0.437 6298 T N 2.607 117.244 114.554 0.138 0.000 2.737 6298 T HA -0.061 4.288 4.350 -0.002 0.000 0.269 6298 T C 1.798 176.594 174.700 0.160 0.000 1.040 6298 T CA 0.827 63.105 62.100 0.297 0.000 1.142 6298 T CB -0.384 68.704 68.868 0.366 0.000 0.861 6298 T HN 0.047 nan 8.240 nan 0.000 0.456 6299 L N 0.746 122.027 121.223 0.097 0.000 2.072 6299 L HA 0.080 4.419 4.340 -0.002 0.000 0.205 6299 L C 2.355 179.207 176.870 -0.031 0.000 1.079 6299 L CA 1.627 56.493 54.840 0.044 0.000 0.752 6299 L CB -0.542 41.547 42.059 0.049 0.000 0.906 6299 L HN 0.163 nan 8.230 nan 0.000 0.436 6300 K N -1.325 119.047 120.400 -0.047 0.000 2.148 6300 K HA -0.108 4.211 4.320 -0.002 0.000 0.204 6300 K C 1.955 178.459 176.600 -0.160 0.000 1.050 6300 K CA 0.991 57.230 56.287 -0.079 0.000 0.942 6300 K CB -0.147 32.319 32.500 -0.057 0.000 0.724 6300 K HN 0.203 nan 8.250 nan 0.000 0.446 6301 M N 0.872 120.308 119.600 -0.273 0.000 2.374 6301 M HA -0.065 4.414 4.480 -0.002 0.000 0.264 6301 M C 0.144 176.085 176.300 -0.599 0.000 1.067 6301 M CA 0.989 55.958 55.300 -0.552 0.000 1.103 6301 M CB -0.467 31.488 32.600 -1.076 0.000 1.402 6301 M HN 0.019 nan 8.290 nan 0.000 0.444 6302 K N 0.977 121.145 120.400 -0.387 0.000 3.393 6302 K HA -0.167 4.152 4.320 -0.002 0.000 0.272 6302 K C -0.536 175.951 176.600 -0.188 0.000 1.004 6302 K CA 0.461 56.622 56.287 -0.210 0.000 0.764 6302 K CB -2.134 30.283 32.500 -0.138 0.000 1.373 6302 K HN 0.234 nan 8.250 nan 0.000 0.458 6303 F N 0.471 120.440 119.950 0.031 0.000 2.299 6303 F HA 0.196 4.722 4.527 -0.001 0.000 0.293 6303 F C 2.268 178.084 175.800 0.027 0.000 1.252 6303 F CA -0.383 57.636 58.000 0.031 0.000 1.160 6303 F CB 0.260 39.288 39.000 0.047 0.000 1.405 6303 F HN 0.151 nan 8.300 nan 0.000 0.517 6304 L N 0.555 121.931 121.223 0.255 0.000 3.781 6304 L HA -0.279 4.060 4.340 -0.002 0.000 0.426 6304 L C -0.312 176.614 176.870 0.094 0.000 1.197 6304 L CA 0.397 55.320 54.840 0.138 0.000 0.907 6304 L CB -1.934 40.196 42.059 0.118 0.000 1.812 6304 L HN 0.554 nan 8.230 nan 0.000 0.956 6305 S N -0.244 115.509 115.700 0.088 0.000 2.543 6305 S HA 0.541 5.010 4.470 -0.002 0.000 0.273 6305 S C -0.580 174.050 174.600 0.048 0.000 1.152 6305 S CA -0.693 57.540 58.200 0.055 0.000 0.910 6305 S CB 2.019 65.235 63.200 0.027 0.000 1.105 6305 S HN 0.288 nan 8.310 nan 0.000 0.465 6306 L N 3.651 124.903 121.223 0.048 0.000 2.315 6306 L HA 0.390 4.729 4.340 -0.002 0.000 0.283 6306 L C -0.339 176.517 176.870 -0.023 0.000 1.089 6306 L CA -0.381 54.473 54.840 0.024 0.000 0.833 6306 L CB 0.508 42.584 42.059 0.030 0.000 1.170 6306 L HN 0.667 nan 8.230 nan 0.000 0.442 6307 D N 4.242 124.623 120.400 -0.031 0.000 2.383 6307 D HA 0.096 4.735 4.640 -0.002 0.000 0.252 6307 D C 0.710 176.974 176.300 -0.061 0.000 1.166 6307 D CA 0.140 54.112 54.000 -0.046 0.000 0.879 6307 D CB 1.095 41.866 40.800 -0.049 0.000 1.164 6307 D HN 0.453 nan 8.370 nan 0.000 0.462 6308 L N 2.792 123.982 121.223 -0.054 0.000 2.640 6308 L HA 0.154 4.493 4.340 -0.002 0.000 0.230 6308 L C 0.905 177.753 176.870 -0.036 0.000 1.123 6308 L CA -0.151 54.658 54.840 -0.053 0.000 0.900 6308 L CB -0.367 41.662 42.059 -0.049 0.000 1.146 6308 L HN 0.459 nan 8.230 nan 0.000 0.484 6309 Q N 0.045 119.824 119.800 -0.037 0.000 2.433 6309 Q HA 0.682 5.021 4.340 -0.002 0.000 0.279 6309 Q C 0.081 176.063 176.000 -0.031 0.000 1.105 6309 Q CA -0.125 55.663 55.803 -0.024 0.000 0.815 6309 Q CB 2.708 31.434 28.738 -0.020 0.000 1.403 6309 Q HN 0.045 nan 8.270 nan 0.000 0.435 6310 G N 1.399 110.190 108.800 -0.016 0.000 2.681 6310 G HA2 -0.230 3.729 3.960 -0.002 0.000 0.220 6310 G HA3 -0.230 3.729 3.960 -0.002 0.000 0.220 6310 G C -1.251 173.630 174.900 -0.031 0.000 1.353 6310 G CA -0.135 44.954 45.100 -0.020 0.000 0.872 6310 G HN 0.889 nan 8.290 nan 0.000 0.557 6311 D N 0.826 121.198 120.400 -0.047 0.000 2.280 6311 D HA 0.442 5.081 4.640 -0.002 0.000 0.243 6311 D C -0.960 175.218 176.300 -0.204 0.000 1.129 6311 D CA -1.601 52.347 54.000 -0.087 0.000 0.848 6311 D CB 1.484 42.256 40.800 -0.046 0.000 1.107 6311 D HN -0.000 nan 8.370 nan 0.000 0.471 6312 P HA -0.081 nan 4.420 nan 0.000 0.219 6312 P C 1.122 178.230 177.300 -0.319 0.000 1.146 6312 P CA 0.940 63.785 63.100 -0.425 0.000 0.808 6312 P CB 0.308 31.529 31.700 -0.798 0.000 0.779 6313 R N -0.252 119.944 120.500 -0.507 0.000 2.115 6313 R HA -0.075 4.264 4.340 -0.002 0.000 0.230 6313 R C 1.865 178.106 176.300 -0.097 0.000 1.111 6313 R CA 1.075 56.938 56.100 -0.395 0.000 0.976 6313 R CB -0.437 29.557 30.300 -0.510 0.000 0.870 6313 R HN 0.299 nan 8.270 nan 0.000 0.445 6314 E N 0.287 120.425 120.200 -0.104 0.000 2.502 6314 E HA 0.025 4.374 4.350 -0.002 0.000 0.194 6314 E C -0.057 176.527 176.600 -0.027 0.000 1.062 6314 E CA -0.105 56.268 56.400 -0.046 0.000 0.867 6314 E CB 0.491 30.164 29.700 -0.044 0.000 0.888 6314 E HN 0.009 nan 8.360 nan 0.000 0.510 6315 S N 0.606 116.287 115.700 -0.032 0.000 2.586 6315 S HA 0.223 4.692 4.470 -0.002 0.000 0.274 6315 S C -0.431 174.185 174.600 0.027 0.000 1.281 6315 S CA -0.509 57.683 58.200 -0.013 0.000 1.035 6315 S CB 1.036 64.215 63.200 -0.035 0.000 0.962 6315 S HN 0.035 nan 8.310 nan 0.000 0.512 6316 Q N 3.978 123.809 119.800 0.052 0.000 2.878 6316 Q HA 0.395 4.734 4.340 -0.002 0.000 0.232 6316 Q C -1.950 174.160 176.000 0.182 0.000 0.893 6316 Q CA -1.407 54.454 55.803 0.097 0.000 0.742 6316 Q CB 1.559 30.367 28.738 0.117 0.000 1.354 6316 Q HN 0.451 nan 8.270 nan 0.000 0.466 6317 P HA -0.082 nan 4.420 nan 0.000 0.219 6317 P C -0.364 177.098 177.300 0.270 0.000 1.146 6317 P CA 0.883 64.096 63.100 0.188 0.000 0.808 6317 P CB 0.250 32.008 31.700 0.096 0.000 0.779 6318 L N -4.755 116.545 121.223 0.128 0.000 2.710 6318 L HA 0.460 4.799 4.340 -0.002 0.000 0.260 6318 L C -1.048 175.701 176.870 -0.201 0.000 0.993 6318 L CA -1.437 53.338 54.840 -0.107 0.000 0.877 6318 L CB 0.365 42.356 42.059 -0.113 0.000 1.461 6318 L HN -0.373 nan 8.230 nan 0.000 0.413 6319 L N 1.728 122.728 121.223 -0.370 0.000 2.278 6319 L HA 0.840 5.178 4.340 -0.002 0.000 0.287 6319 L C 0.851 177.535 176.870 -0.309 0.000 1.072 6319 L CA 0.431 55.132 54.840 -0.232 0.000 0.819 6319 L CB 0.680 42.643 42.059 -0.161 0.000 1.176 6319 L HN 0.986 nan 8.230 nan 0.000 0.435 6320 G N 1.393 110.028 108.800 -0.274 0.000 3.251 6320 G HA2 0.494 4.453 3.960 -0.002 0.000 0.248 6320 G HA3 0.494 4.453 3.960 -0.002 0.000 0.248 6320 G C -0.669 174.096 174.900 -0.224 0.000 1.320 6320 G CA -0.528 44.307 45.100 -0.441 0.000 0.982 6320 G HN 0.361 nan 8.290 nan 0.000 0.575 6321 T N 0.146 114.609 114.554 -0.153 0.000 2.937 6321 T HA 0.400 4.749 4.350 -0.002 0.000 0.316 6321 T C 0.500 175.200 174.700 -0.001 0.000 1.079 6321 T CA 0.515 62.660 62.100 0.076 0.000 1.131 6321 T CB 0.936 69.904 68.868 0.168 0.000 1.000 6321 T HN 1.261 nan 8.240 nan 0.000 0.549 6322 V N -0.623 119.291 119.914 -0.000 0.000 3.167 6322 V HA 0.604 4.723 4.120 -0.002 0.000 0.310 6322 V C -0.717 175.342 176.094 -0.060 0.000 1.207 6322 V CA -1.369 60.897 62.300 -0.056 0.000 1.059 6322 V CB 1.976 33.744 31.823 -0.092 0.000 1.079 6322 V HN 0.671 nan 8.190 nan 0.000 0.446 6323 I N 2.166 122.694 120.570 -0.069 0.000 2.224 6323 I HA 0.268 4.437 4.170 -0.002 0.000 0.293 6323 I C 0.942 177.014 176.117 -0.075 0.000 1.155 6323 I CA 0.129 61.390 61.300 -0.065 0.000 1.297 6323 I CB -0.832 37.134 38.000 -0.056 0.000 1.487 6323 I HN 1.019 nan 8.210 nan 0.000 0.564 6324 D N 3.329 123.674 120.400 -0.090 0.000 2.178 6324 D HA -0.053 4.586 4.640 -0.002 0.000 0.202 6324 D C 1.569 177.826 176.300 -0.072 0.000 0.974 6324 D CA 1.278 55.213 54.000 -0.109 0.000 0.841 6324 D CB 0.132 40.837 40.800 -0.157 0.000 0.953 6324 D HN 0.661 nan 8.370 nan 0.000 0.478 6325 G N -1.141 107.626 108.800 -0.054 0.000 2.163 6325 G HA2 -0.224 3.735 3.960 -0.002 0.000 0.213 6325 G HA3 -0.224 3.735 3.960 -0.002 0.000 0.213 6325 G C 0.826 175.712 174.900 -0.023 0.000 0.991 6325 G CA 0.482 45.560 45.100 -0.036 0.000 0.653 6325 G HN 0.232 nan 8.290 nan 0.000 0.518 6326 M N -1.558 118.027 119.600 -0.026 0.000 2.583 6326 M HA 0.412 4.891 4.480 -0.002 0.000 0.217 6326 M C 2.111 178.407 176.300 -0.006 0.000 1.655 6326 M CA 0.740 56.036 55.300 -0.006 0.000 1.114 6326 M CB -0.770 31.832 32.600 0.003 0.000 1.384 6326 M HN 0.188 nan 8.290 nan 0.000 0.562 6327 L N 1.005 122.215 121.223 -0.022 0.000 2.062 6327 L HA 0.208 4.547 4.340 -0.002 0.000 0.202 6327 L C 0.451 177.296 176.870 -0.041 0.000 1.079 6327 L CA 1.294 56.119 54.840 -0.026 0.000 0.755 6327 L CB 0.171 42.211 42.059 -0.032 0.000 0.913 6327 L HN 0.096 nan 8.230 nan 0.000 0.445 6328 L N 0.736 121.929 121.223 -0.050 0.000 2.287 6328 L HA 0.230 4.569 4.340 -0.002 0.000 0.287 6328 L C 0.342 177.187 176.870 -0.041 0.000 1.022 6328 L CA -0.321 54.487 54.840 -0.053 0.000 0.814 6328 L CB 1.637 43.657 42.059 -0.065 0.000 1.217 6328 L HN 0.234 nan 8.230 nan 0.000 0.420 6329 L N 3.443 124.648 121.223 -0.031 0.000 2.558 6329 L HA 0.130 4.469 4.340 -0.002 0.000 0.225 6329 L C 0.294 177.150 176.870 -0.024 0.000 1.128 6329 L CA 0.447 55.273 54.840 -0.024 0.000 0.868 6329 L CB -0.328 41.722 42.059 -0.014 0.000 1.006 6329 L HN 0.643 nan 8.230 nan 0.000 0.454 6330 K N -1.922 118.461 120.400 -0.027 0.000 2.736 6330 K HA 0.216 4.535 4.320 -0.002 0.000 0.290 6330 K C -0.475 176.107 176.600 -0.031 0.000 1.033 6330 K CA -0.764 55.507 56.287 -0.026 0.000 0.852 6330 K CB 0.267 32.758 32.500 -0.016 0.000 1.494 6330 K HN -0.128 nan 8.250 nan 0.000 0.378 6331 T N -1.094 113.440 114.554 -0.033 0.000 2.923 6331 T HA 0.020 4.369 4.350 -0.002 0.000 0.304 6331 T C -1.721 172.959 174.700 -0.033 0.000 1.044 6331 T CA -0.353 61.722 62.100 -0.041 0.000 1.141 6331 T CB 0.089 68.932 68.868 -0.042 0.000 1.023 6331 T HN 0.352 nan 8.240 nan 0.000 0.533 6332 P HA -0.165 nan 4.420 nan 0.000 0.216 6332 P C 1.408 178.701 177.300 -0.011 0.000 1.157 6332 P CA 1.490 64.564 63.100 -0.042 0.000 0.880 6332 P CB 0.032 31.689 31.700 -0.070 0.000 0.791 6333 E N -0.065 120.125 120.200 -0.016 0.000 2.049 6333 E HA -0.230 4.119 4.350 -0.002 0.000 0.198 6333 E C 1.916 178.531 176.600 0.024 0.000 1.007 6333 E CA 1.539 57.941 56.400 0.004 0.000 0.809 6333 E CB -0.984 28.709 29.700 -0.011 0.000 0.749 6333 E HN 0.457 nan 8.360 nan 0.000 0.450 6334 E N 0.209 120.416 120.200 0.011 0.000 2.204 6334 E HA -0.152 4.197 4.350 -0.002 0.000 0.195 6334 E C 2.081 178.701 176.600 0.034 0.000 0.990 6334 E CA 0.698 57.107 56.400 0.016 0.000 0.821 6334 E CB -0.114 29.587 29.700 0.002 0.000 0.750 6334 E HN 0.256 nan 8.360 nan 0.000 0.477 6335 L N 0.623 121.875 121.223 0.047 0.000 2.068 6335 L HA -0.170 4.169 4.340 -0.002 0.000 0.204 6335 L C 2.560 179.539 176.870 0.183 0.000 1.076 6335 L CA 1.046 55.938 54.840 0.088 0.000 0.753 6335 L CB -0.379 41.725 42.059 0.076 0.000 0.910 6335 L HN 0.117 nan 8.230 nan 0.000 0.439 6336 Q N 0.054 119.982 119.800 0.214 0.000 2.112 6336 Q HA -0.242 4.097 4.340 -0.002 0.000 0.206 6336 Q C 2.382 178.521 176.000 0.232 0.000 0.987 6336 Q CA 1.747 57.769 55.803 0.365 0.000 0.858 6336 Q CB -0.376 28.494 28.738 0.220 0.000 0.905 6336 Q HN 0.552 nan 8.270 nan 0.000 0.420 6337 A N 1.611 124.505 122.820 0.123 0.000 1.940 6337 A HA -0.238 4.081 4.320 -0.002 0.000 0.219 6337 A C 1.757 179.360 177.584 0.031 0.000 1.176 6337 A CA 1.583 53.660 52.037 0.068 0.000 0.631 6337 A CB -0.442 18.585 19.000 0.045 0.000 0.814 6337 A HN 0.372 nan 8.150 nan 0.000 0.446 6338 E N -1.683 118.532 120.200 0.025 0.000 2.478 6338 E HA -0.075 4.274 4.350 -0.002 0.000 0.198 6338 E C 0.393 176.938 176.600 -0.092 0.000 1.046 6338 E CA 0.229 56.617 56.400 -0.021 0.000 0.870 6338 E CB -0.001 29.693 29.700 -0.011 0.000 0.818 6338 E HN 0.338 nan 8.360 nan 0.000 0.527 6339 R N 0.144 120.566 120.500 -0.130 0.000 3.946 6339 R HA -0.196 4.143 4.340 -0.002 0.000 0.329 6339 R C -0.568 175.384 176.300 -0.580 0.000 1.209 6339 R CA 0.819 56.675 56.100 -0.406 0.000 0.909 6339 R CB -2.522 27.619 30.300 -0.266 0.000 1.355 6339 R HN 0.112 nan 8.270 nan 0.000 0.539 6340 N N 0.807 119.311 118.700 -0.326 0.000 2.645 6340 N HA 0.434 5.173 4.740 -0.002 0.000 0.233 6340 N C -0.919 174.538 175.510 -0.088 0.000 1.058 6340 N CA -0.329 52.596 53.050 -0.209 0.000 0.942 6340 N CB 0.197 38.641 38.487 -0.072 0.000 1.210 6340 N HN 0.185 nan 8.380 nan 0.000 0.512 6341 F N -1.395 118.524 119.950 -0.052 0.000 3.194 6341 F HA 0.331 4.857 4.527 -0.002 0.000 0.327 6341 F C -1.093 174.693 175.800 -0.023 0.000 1.141 6341 F CA -1.387 56.534 58.000 -0.132 0.000 0.862 6341 F CB 0.423 39.349 39.000 -0.123 0.000 1.447 6341 F HN 0.103 nan 8.300 nan 0.000 0.479 6342 H N 0.415 119.770 119.070 0.474 0.000 3.086 6342 H HA 0.356 4.911 4.556 -0.002 0.000 0.265 6342 H C 0.340 175.912 175.328 0.406 0.000 1.092 6342 H CA 0.235 56.434 56.048 0.251 0.000 1.487 6342 H CB 0.506 30.305 29.762 0.062 0.000 1.514 6342 H HN 0.709 nan 8.280 nan 0.000 0.497 6343 T N 0.945 115.697 114.554 0.330 0.000 3.607 6343 T HA 0.191 4.540 4.350 -0.002 0.000 0.225 6343 T C 0.603 175.425 174.700 0.204 0.000 0.904 6343 T CA -0.742 61.487 62.100 0.215 0.000 0.962 6343 T CB -1.324 67.545 68.868 0.001 0.000 1.221 6343 T HN 0.345 nan 8.240 nan 0.000 0.641 6344 V N -1.996 118.079 119.914 0.268 0.000 2.863 6344 V HA 0.656 4.775 4.120 -0.002 0.000 0.307 6344 V C -2.811 173.463 176.094 0.301 0.000 1.061 6344 V CA -3.183 59.195 62.300 0.131 0.000 1.024 6344 V CB 0.738 32.500 31.823 -0.102 0.000 1.049 6344 V HN 0.092 nan 8.190 nan 0.000 0.471 6345 P HA 0.108 nan 4.420 nan 0.000 0.262 6345 P C -1.359 176.243 177.300 0.503 0.000 1.182 6345 P CA 0.744 64.048 63.100 0.341 0.000 0.761 6345 P CB -0.189 31.536 31.700 0.041 0.000 0.795 6346 Y N 3.567 124.079 120.300 0.353 0.000 2.406 6346 Y HA 0.539 5.087 4.550 -0.002 0.000 0.340 6346 Y C -0.658 175.245 175.900 0.005 0.000 0.975 6346 Y CA -1.518 56.635 58.100 0.087 0.000 1.056 6346 Y CB 1.590 39.767 38.460 -0.470 0.000 1.210 6346 Y HN 0.204 nan 8.280 nan 0.000 0.448 6347 M N 7.858 127.462 119.600 0.008 0.000 2.125 6347 M HA 0.515 4.994 4.480 -0.002 0.000 0.321 6347 M C -2.202 173.828 176.300 -0.449 0.000 0.983 6347 M CA -0.665 54.364 55.300 -0.453 0.000 0.934 6347 M CB 0.870 32.863 32.600 -1.013 0.000 1.542 6347 M HN 0.411 nan 8.290 nan 0.000 0.424 6348 V N 4.208 123.792 119.914 -0.550 0.000 2.513 6348 V HA 0.958 5.077 4.120 -0.002 0.000 0.299 6348 V C 0.339 176.095 176.094 -0.563 0.000 1.035 6348 V CA -0.491 61.471 62.300 -0.564 0.000 0.889 6348 V CB 1.684 33.098 31.823 -0.681 0.000 0.988 6348 V HN 0.996 nan 8.190 nan 0.000 0.440 6349 G N 3.232 111.621 108.800 -0.684 0.000 2.682 6349 G HA2 0.877 4.836 3.960 -0.002 0.000 0.290 6349 G HA3 0.877 4.836 3.960 -0.002 0.000 0.290 6349 G C -1.345 173.154 174.900 -0.668 0.000 1.425 6349 G CA -0.478 43.810 45.100 -1.354 0.000 0.807 6349 G HN 0.966 nan 8.290 nan 0.000 0.482 6350 I N -3.124 117.167 120.570 -0.465 0.000 3.352 6350 I HA 0.610 4.779 4.170 -0.002 0.000 0.316 6350 I C -1.422 174.809 176.117 0.190 0.000 1.214 6350 I CA -1.424 59.845 61.300 -0.052 0.000 0.934 6350 I CB 2.329 40.306 38.000 -0.038 0.000 1.310 6350 I HN 0.454 nan 8.210 nan 0.000 0.475 6351 N N 1.085 119.896 118.700 0.184 0.000 2.314 6351 N HA 0.245 4.984 4.740 -0.002 0.000 0.304 6351 N C -0.115 175.516 175.510 0.201 0.000 1.073 6351 N CA -0.810 52.414 53.050 0.290 0.000 0.822 6351 N CB 2.396 41.054 38.487 0.284 0.000 1.280 6351 N HN 0.523 nan 8.380 nan 0.000 0.489 6352 K N 1.038 121.565 120.400 0.212 0.000 2.127 6352 K HA -0.217 4.102 4.320 -0.002 0.000 0.212 6352 K C 0.009 176.693 176.600 0.139 0.000 1.050 6352 K CA 1.937 58.316 56.287 0.153 0.000 0.929 6352 K CB 0.065 32.646 32.500 0.135 0.000 0.715 6352 K HN 0.584 nan 8.250 nan 0.000 0.457 6353 Q N -0.130 119.762 119.800 0.152 0.000 3.122 6353 Q HA 0.121 4.460 4.340 -0.002 0.000 0.282 6353 Q C -0.323 175.765 176.000 0.147 0.000 0.947 6353 Q CA -0.303 55.588 55.803 0.147 0.000 0.812 6353 Q CB 1.457 30.283 28.738 0.147 0.000 1.333 6353 Q HN 0.115 nan 8.270 nan 0.000 0.430 6354 E N 0.171 120.432 120.200 0.102 0.000 2.273 6354 E HA -0.165 4.184 4.350 -0.002 0.000 0.198 6354 E C 0.384 177.024 176.600 0.066 0.000 1.002 6354 E CA 1.201 57.600 56.400 -0.001 0.000 0.828 6354 E CB 0.180 29.730 29.700 -0.251 0.000 0.747 6354 E HN 0.485 nan 8.360 nan 0.000 0.491 6355 F N -0.056 119.869 119.950 -0.042 0.000 2.708 6355 F HA 0.262 4.788 4.527 -0.002 0.000 0.300 6355 F C 1.808 177.610 175.800 0.004 0.000 1.118 6355 F CA -0.241 57.722 58.000 -0.063 0.000 1.307 6355 F CB 0.560 39.491 39.000 -0.115 0.000 0.986 6355 F HN -0.056 nan 8.300 nan 0.000 0.522 6356 G N 0.573 109.449 108.800 0.128 0.000 2.513 6356 G HA2 -0.340 3.619 3.960 -0.002 0.000 0.219 6356 G HA3 -0.340 3.619 3.960 -0.002 0.000 0.219 6356 G C 1.130 176.164 174.900 0.222 0.000 1.160 6356 G CA 1.877 47.078 45.100 0.168 0.000 0.767 6356 G HN 0.675 nan 8.290 nan 0.000 0.571 6357 W N -2.049 119.199 121.300 -0.086 0.000 2.999 6357 W HA 0.193 4.852 4.660 -0.002 0.000 0.148 6357 W C 1.533 177.979 176.519 -0.122 0.000 0.732 6357 W CA 0.359 57.648 57.345 -0.092 0.000 1.240 6357 W CB -0.625 28.821 29.460 -0.023 0.000 0.547 6357 W HN 0.055 nan 8.180 nan 0.000 0.839 6358 L N 2.432 123.533 121.223 -0.203 0.000 1.933 6358 L HA -0.152 4.187 4.340 -0.002 0.000 0.220 6358 L C 2.228 178.795 176.870 -0.506 0.000 1.078 6358 L CA 3.264 57.821 54.840 -0.471 0.000 0.773 6358 L CB -1.294 40.772 42.059 0.012 0.000 0.890 6358 L HN 0.210 nan 8.230 nan 0.000 0.434 6359 I N -0.364 119.968 120.570 -0.397 0.000 2.087 6359 I HA -0.295 3.874 4.170 -0.002 0.000 0.240 6359 I C -0.171 175.634 176.117 -0.519 0.000 1.054 6359 I CA 1.971 63.010 61.300 -0.435 0.000 1.311 6359 I CB -2.058 35.631 38.000 -0.517 0.000 1.024 6359 I HN 0.318 nan 8.210 nan 0.000 0.402 6360 P HA -0.165 nan 4.420 nan 0.000 0.215 6360 P C 1.116 178.249 177.300 -0.279 0.000 1.153 6360 P CA 1.218 63.994 63.100 -0.540 0.000 0.853 6360 P CB -0.049 31.271 31.700 -0.634 0.000 0.788 6364 M N -1.192 118.367 119.600 -0.068 0.000 2.414 6364 M HA 0.256 4.735 4.480 -0.002 0.000 0.357 6364 M C 0.716 177.052 176.300 0.061 0.000 1.059 6364 M CA 0.051 55.366 55.300 0.025 0.000 0.959 6364 M CB 1.206 33.856 32.600 0.084 0.000 1.522 6364 M HN 0.089 nan 8.290 nan 0.000 0.551 6365 S N 0.697 116.413 115.700 0.026 0.000 3.581 6365 S HA -0.211 4.258 4.470 -0.002 0.000 0.354 6365 S C -0.142 174.506 174.600 0.080 0.000 1.059 6365 S CA 0.544 58.765 58.200 0.036 0.000 1.060 6365 S CB -1.985 61.223 63.200 0.013 0.000 0.908 6365 S HN 0.599 nan 8.310 nan 0.000 0.475 6366 Y N 1.986 122.288 120.300 0.005 0.000 2.717 6366 Y HA 0.228 4.777 4.550 -0.002 0.000 0.330 6366 Y C -1.886 174.059 175.900 0.074 0.000 1.217 6366 Y CA -1.155 56.984 58.100 0.065 0.000 1.506 6366 Y CB 0.424 38.941 38.460 0.094 0.000 1.268 6366 Y HN 0.052 nan 8.280 nan 0.000 0.561 6367 P HA 0.211 nan 4.420 nan 0.000 0.263 6367 P C -1.303 176.065 177.300 0.113 0.000 1.601 6367 P CA 0.506 63.590 63.100 -0.027 0.000 1.161 6367 P CB -0.146 31.480 31.700 -0.123 0.000 1.730 6368 L N 1.864 123.199 121.223 0.186 0.000 2.611 6368 L HA 0.205 4.544 4.340 -0.002 0.000 0.263 6368 L C 0.735 177.696 176.870 0.152 0.000 0.969 6368 L CA -0.036 54.930 54.840 0.211 0.000 0.894 6368 L CB 1.927 44.189 42.059 0.337 0.000 1.229 6368 L HN 0.192 nan 8.230 nan 0.000 0.416 6369 S N 0.111 115.877 115.700 0.110 0.000 3.148 6369 S HA 0.272 4.741 4.470 -0.002 0.000 0.246 6369 S C 0.351 175.000 174.600 0.082 0.000 1.041 6369 S CA -0.487 57.767 58.200 0.091 0.000 0.813 6369 S CB 0.334 63.574 63.200 0.067 0.000 0.813 6369 S HN 0.429 nan 8.310 nan 0.000 0.546 6370 E N 2.098 122.339 120.200 0.068 0.000 2.324 6370 E HA 0.333 4.682 4.350 -0.002 0.000 0.271 6370 E C 0.814 177.456 176.600 0.070 0.000 1.028 6370 E CA 0.250 56.685 56.400 0.059 0.000 0.890 6370 E CB 0.801 30.527 29.700 0.044 0.000 1.004 6370 E HN 0.564 nan 8.360 nan 0.000 0.431 6371 G N 3.167 112.008 108.800 0.069 0.000 2.776 6371 G HA2 -0.147 3.812 3.960 -0.002 0.000 0.209 6371 G HA3 -0.147 3.812 3.960 -0.002 0.000 0.209 6371 G C 0.469 175.409 174.900 0.067 0.000 1.145 6371 G CA 0.036 45.183 45.100 0.078 0.000 0.791 6371 G HN 0.294 nan 8.290 nan 0.000 0.530 6372 Q N 0.059 119.891 119.800 0.052 0.000 2.296 6372 Q HA 0.446 4.785 4.340 -0.002 0.000 0.257 6372 Q C -1.399 174.620 176.000 0.031 0.000 0.942 6372 Q CA -0.499 55.328 55.803 0.040 0.000 0.939 6372 Q CB 2.322 31.078 28.738 0.030 0.000 1.198 6372 Q HN 0.139 nan 8.270 nan 0.000 0.429 6373 L N 4.539 125.777 121.223 0.025 0.000 2.446 6373 L HA 0.288 4.626 4.340 -0.002 0.000 0.268 6373 L C -1.011 175.849 176.870 -0.017 0.000 0.975 6373 L CA -0.488 54.348 54.840 -0.007 0.000 0.848 6373 L CB 1.413 43.460 42.059 -0.020 0.000 1.225 6373 L HN 0.506 nan 8.230 nan 0.000 0.410 6374 D N 2.855 123.241 120.400 -0.024 0.000 2.264 6374 D HA 0.047 4.686 4.640 -0.002 0.000 0.249 6374 D C 0.351 176.631 176.300 -0.034 0.000 1.070 6374 D CA -0.460 53.530 54.000 -0.016 0.000 0.912 6374 D CB 1.405 42.200 40.800 -0.008 0.000 1.193 6374 D HN 0.683 nan 8.370 nan 0.000 0.427 6375 Q N 0.556 120.349 119.800 -0.011 0.000 2.248 6375 Q HA -0.231 4.108 4.340 -0.002 0.000 0.208 6375 Q C 1.909 177.902 176.000 -0.012 0.000 0.984 6375 Q CA 1.527 57.327 55.803 -0.005 0.000 0.875 6375 Q CB 0.126 28.878 28.738 0.022 0.000 0.910 6375 Q HN 0.511 nan 8.270 nan 0.000 0.433 6376 K N -0.862 119.531 120.400 -0.012 0.000 1.973 6376 K HA -0.115 4.204 4.320 -0.002 0.000 0.210 6376 K C 1.924 178.512 176.600 -0.019 0.000 1.045 6376 K CA 1.786 58.068 56.287 -0.008 0.000 0.937 6376 K CB -0.141 32.356 32.500 -0.004 0.000 0.721 6376 K HN 0.107 nan 8.250 nan 0.000 0.438 6377 T N 0.969 115.502 114.554 -0.035 0.000 2.803 6377 T HA -0.144 4.205 4.350 -0.002 0.000 0.269 6377 T C 1.766 176.400 174.700 -0.110 0.000 1.052 6377 T CA 1.257 63.327 62.100 -0.050 0.000 1.136 6377 T CB -0.282 68.557 68.868 -0.049 0.000 0.864 6377 T HN 0.437 nan 8.240 nan 0.000 0.467 6378 A N 1.195 123.912 122.820 -0.172 0.000 1.930 6378 A HA 0.006 4.325 4.320 -0.002 0.000 0.217 6378 A C 2.294 179.776 177.584 -0.171 0.000 1.175 6378 A CA 1.290 53.102 52.037 -0.375 0.000 0.627 6378 A CB -0.585 18.218 19.000 -0.329 0.000 0.815 6378 A HN 0.458 nan 8.150 nan 0.000 0.443 6379 M N -0.493 119.101 119.600 -0.010 0.000 2.296 6379 M HA -0.099 4.380 4.480 -0.002 0.000 0.265 6379 M C 2.302 178.695 176.300 0.155 0.000 1.064 6379 M CA 1.326 56.686 55.300 0.100 0.000 1.109 6379 M CB -0.222 32.420 32.600 0.070 0.000 1.396 6379 M HN 0.416 nan 8.290 nan 0.000 0.430 6380 S N 0.771 116.532 115.700 0.102 0.000 2.355 6380 S HA -0.027 4.441 4.470 -0.002 0.000 0.222 6380 S C 1.837 176.555 174.600 0.198 0.000 1.031 6380 S CA 1.003 59.296 58.200 0.155 0.000 0.993 6380 S CB -0.243 63.006 63.200 0.081 0.000 0.859 6380 S HN 0.409 nan 8.310 nan 0.000 0.453 6381 L N 0.733 122.036 121.223 0.133 0.000 2.056 6381 L HA -0.045 4.294 4.340 -0.002 0.000 0.207 6381 L C 2.352 179.435 176.870 0.355 0.000 1.078 6381 L CA 0.723 55.673 54.840 0.183 0.000 0.749 6381 L CB -0.601 41.581 42.059 0.204 0.000 0.901 6381 L HN 0.291 nan 8.230 nan 0.000 0.433 6382 L N -0.381 121.131 121.223 0.483 0.000 2.129 6382 L HA -0.267 4.072 4.340 -0.002 0.000 0.212 6382 L C 2.147 179.275 176.870 0.429 0.000 1.087 6382 L CA 1.818 56.953 54.840 0.493 0.000 0.757 6382 L CB -0.691 41.674 42.059 0.510 0.000 0.896 6382 L HN 0.360 nan 8.230 nan 0.000 0.434 6383 W N -0.002 121.413 121.300 0.192 0.000 2.452 6383 W HA -0.165 4.494 4.660 -0.002 0.000 0.313 6383 W C 2.029 178.646 176.519 0.163 0.000 1.176 6383 W CA 0.413 57.859 57.345 0.169 0.000 1.350 6383 W CB 0.070 29.593 29.460 0.106 0.000 1.148 6383 W HN -0.053 nan 8.180 nan 0.000 0.498 6384 K N 0.873 121.288 120.400 0.026 0.000 2.360 6384 K HA -0.095 4.224 4.320 -0.002 0.000 0.201 6384 K C 1.653 178.210 176.600 -0.072 0.000 1.046 6384 K CA 1.147 57.354 56.287 -0.133 0.000 0.940 6384 K CB -0.556 31.909 32.500 -0.059 0.000 0.748 6384 K HN 0.064 nan 8.250 nan 0.000 0.465 6385 S N 0.387 116.118 115.700 0.052 0.000 2.593 6385 S HA -0.010 4.459 4.470 -0.002 0.000 0.217 6385 S C 1.209 175.825 174.600 0.026 0.000 0.966 6385 S CA -0.354 57.902 58.200 0.093 0.000 0.914 6385 S CB -0.257 63.056 63.200 0.189 0.000 0.776 6385 S HN 0.287 nan 8.310 nan 0.000 0.523 6386 Y N 4.040 124.242 120.300 -0.163 0.000 2.062 6386 Y HA -0.234 4.315 4.550 -0.002 0.000 0.273 6386 Y C -0.764 175.054 175.900 -0.138 0.000 1.206 6386 Y CA 2.256 60.239 58.100 -0.194 0.000 1.125 6386 Y CB -1.270 36.919 38.460 -0.451 0.000 0.951 6386 Y HN 0.256 nan 8.280 nan 0.000 0.501 6387 P HA -0.178 nan 4.420 nan 0.000 0.221 6387 P C 1.259 178.475 177.300 -0.140 0.000 1.145 6387 P CA 1.861 64.912 63.100 -0.081 0.000 0.795 6387 P CB -0.128 31.572 31.700 0.001 0.000 0.775 6388 L N -0.748 120.400 121.223 -0.124 0.000 2.189 6388 L HA 0.007 4.345 4.340 -0.002 0.000 0.199 6388 L C 2.686 179.415 176.870 -0.235 0.000 1.074 6388 L CA 0.794 55.552 54.840 -0.136 0.000 0.783 6388 L CB -0.897 41.133 42.059 -0.049 0.000 0.955 6388 L HN -0.171 nan 8.230 nan 0.000 0.460 6389 V N -4.656 115.114 119.914 -0.241 0.000 3.125 6389 V HA 0.101 4.220 4.120 -0.002 0.000 0.249 6389 V C 0.888 176.811 176.094 -0.285 0.000 1.113 6389 V CA -0.784 61.359 62.300 -0.262 0.000 1.106 6389 V CB -0.510 31.183 31.823 -0.218 0.000 0.768 6389 V HN 0.546 nan 8.190 nan 0.000 0.468 6390 C N 1.673 120.683 119.300 -0.484 0.000 2.877 6390 C HA -0.139 4.319 4.460 -0.002 0.000 0.269 6390 C C 0.152 174.956 174.990 -0.310 0.000 1.132 6390 C CA 0.142 58.665 59.018 -0.825 0.000 2.588 6390 C CB -2.964 24.360 27.740 -0.695 0.000 1.574 6390 C HN 0.654 nan 8.230 nan 0.000 0.439 6391 I N 1.390 121.982 120.570 0.037 0.000 2.493 6391 I HA 0.471 4.640 4.170 -0.002 0.000 0.279 6391 I C 0.889 177.363 176.117 0.595 0.000 1.045 6391 I CA -0.160 61.394 61.300 0.422 0.000 1.106 6391 I CB 1.073 39.333 38.000 0.432 0.000 1.216 6391 I HN 0.692 nan 8.210 nan 0.000 0.459 6392 A N 5.507 128.655 122.820 0.547 0.000 2.608 6392 A HA -0.092 4.226 4.320 -0.002 0.000 0.239 6392 A C 1.644 179.436 177.584 0.347 0.000 1.018 6392 A CA 0.535 52.867 52.037 0.492 0.000 0.766 6392 A CB 0.160 19.341 19.000 0.301 0.000 0.928 6392 A HN 0.937 nan 8.150 nan 0.000 0.512 6393 K N 1.292 121.777 120.400 0.142 0.000 2.089 6393 K HA -0.227 4.092 4.320 -0.002 0.000 0.210 6393 K C 1.741 178.260 176.600 -0.135 0.000 1.048 6393 K CA 2.019 58.107 56.287 -0.331 0.000 0.926 6393 K CB -0.022 31.850 32.500 -1.047 0.000 0.714 6393 K HN 0.912 nan 8.250 nan 0.000 0.448 6394 E N 0.937 121.101 120.200 -0.060 0.000 2.516 6394 E HA -0.160 4.189 4.350 -0.002 0.000 0.199 6394 E C 1.271 177.895 176.600 0.041 0.000 1.069 6394 E CA 0.805 57.191 56.400 -0.023 0.000 0.876 6394 E CB -0.078 29.614 29.700 -0.013 0.000 0.843 6394 E HN 0.475 nan 8.360 nan 0.000 0.530 6395 L N 0.057 121.340 121.223 0.100 0.000 2.664 6395 L HA 0.140 4.479 4.340 -0.002 0.000 0.233 6395 L C 1.932 178.907 176.870 0.175 0.000 1.113 6395 L CA -0.326 54.598 54.840 0.140 0.000 0.896 6395 L CB 0.069 42.248 42.059 0.199 0.000 1.163 6395 L HN -0.012 nan 8.230 nan 0.000 0.497 6396 I N 0.981 121.652 120.570 0.168 0.000 2.226 6396 I HA -0.140 4.029 4.170 -0.002 0.000 0.245 6396 I C -0.130 176.087 176.117 0.168 0.000 1.100 6396 I CA 1.582 63.004 61.300 0.202 0.000 1.374 6396 I CB -2.090 36.016 38.000 0.177 0.000 1.057 6396 I HN 0.142 nan 8.210 nan 0.000 0.413 6397 P HA -0.173 nan 4.420 nan 0.000 0.216 6397 P C 1.723 179.089 177.300 0.109 0.000 1.153 6397 P CA 1.363 64.518 63.100 0.090 0.000 0.848 6397 P CB 0.019 31.750 31.700 0.050 0.000 0.787 6398 E N -0.407 119.863 120.200 0.116 0.000 2.106 6398 E HA -0.164 4.185 4.350 -0.002 0.000 0.192 6398 E C 1.861 178.590 176.600 0.215 0.000 0.984 6398 E CA 1.102 57.583 56.400 0.134 0.000 0.806 6398 E CB -0.423 29.342 29.700 0.108 0.000 0.750 6398 E HN 0.051 nan 8.360 nan 0.000 0.458 6399 A N 0.295 123.268 122.820 0.254 0.000 1.872 6399 A HA -0.124 4.195 4.320 -0.002 0.000 0.214 6399 A C 2.382 180.153 177.584 0.312 0.000 1.187 6399 A CA 1.862 54.105 52.037 0.343 0.000 0.614 6399 A CB -0.915 18.342 19.000 0.429 0.000 0.826 6399 A HN 0.328 nan 8.150 nan 0.000 0.442 6400 T N -0.239 114.474 114.554 0.265 0.000 2.788 6400 T HA -0.143 4.206 4.350 -0.002 0.000 0.268 6400 T C 1.849 176.667 174.700 0.196 0.000 1.044 6400 T CA 1.723 63.974 62.100 0.252 0.000 1.139 6400 T CB -0.209 68.775 68.868 0.193 0.000 0.867 6400 T HN 0.618 nan 8.240 nan 0.000 0.454 6401 E N 1.733 122.013 120.200 0.134 0.000 2.007 6401 E HA -0.135 4.214 4.350 -0.002 0.000 0.194 6401 E C 2.061 178.666 176.600 0.008 0.000 0.999 6401 E CA 1.351 57.791 56.400 0.067 0.000 0.811 6401 E CB -0.299 29.429 29.700 0.047 0.000 0.762 6401 E HN 0.223 nan 8.360 nan 0.000 0.450 6402 K N -1.187 119.173 120.400 -0.067 0.000 2.366 6402 K HA -0.186 4.132 4.320 -0.002 0.000 0.202 6402 K C 1.193 177.559 176.600 -0.389 0.000 1.045 6402 K CA 1.474 57.552 56.287 -0.348 0.000 0.934 6402 K CB -0.328 31.645 32.500 -0.878 0.000 0.746 6402 K HN 0.324 nan 8.250 nan 0.000 0.470 6403 Y N -1.317 118.896 120.300 -0.144 0.000 2.569 6403 Y HA 0.238 4.787 4.550 -0.002 0.000 0.278 6403 Y C 1.420 177.327 175.900 0.012 0.000 1.130 6403 Y CA 0.355 58.423 58.100 -0.053 0.000 1.280 6403 Y CB 0.290 38.776 38.460 0.043 0.000 1.379 6403 Y HN -0.171 nan 8.280 nan 0.000 0.508 6404 L N -0.441 120.916 121.223 0.223 0.000 2.599 6404 L HA 0.154 4.492 4.340 -0.002 0.000 0.230 6404 L C 2.037 178.953 176.870 0.076 0.000 1.141 6404 L CA 0.718 55.648 54.840 0.151 0.000 0.877 6404 L CB -0.667 41.488 42.059 0.159 0.000 1.009 6404 L HN 0.310 nan 8.230 nan 0.000 0.447 6405 G N 0.272 109.097 108.800 0.042 0.000 2.679 6405 G HA2 -0.033 3.925 3.960 -0.002 0.000 0.212 6405 G HA3 -0.033 3.925 3.960 -0.002 0.000 0.212 6405 G C 1.350 176.249 174.900 -0.002 0.000 1.137 6405 G CA 0.538 45.645 45.100 0.012 0.000 0.787 6405 G HN 0.434 nan 8.290 nan 0.000 0.534 6406 G N 0.635 109.434 108.800 -0.002 0.000 2.942 6406 G HA2 0.090 4.049 3.960 -0.002 0.000 0.199 6406 G HA3 0.090 4.049 3.960 -0.002 0.000 0.199 6406 G C 1.057 175.960 174.900 0.004 0.000 1.440 6406 G CA 1.589 46.685 45.100 -0.007 0.000 0.815 6406 G HN 0.714 nan 8.290 nan 0.000 0.675 6407 T N -2.315 112.249 114.554 0.016 0.000 2.927 6407 T HA 0.401 4.750 4.350 -0.002 0.000 0.281 6407 T C 0.343 175.056 174.700 0.021 0.000 0.998 6407 T CA -0.114 61.996 62.100 0.016 0.000 1.019 6407 T CB 1.765 70.644 68.868 0.019 0.000 1.061 6407 T HN 0.234 nan 8.240 nan 0.000 0.518 6408 D N 0.103 120.514 120.400 0.018 0.000 2.336 6408 D HA 0.026 4.665 4.640 -0.002 0.000 0.229 6408 D C -0.097 176.216 176.300 0.022 0.000 1.061 6408 D CA 0.257 54.268 54.000 0.018 0.000 0.875 6408 D CB -0.050 40.758 40.800 0.013 0.000 0.904 6408 D HN 0.649 nan 8.370 nan 0.000 0.525 6409 D N 1.201 121.617 120.400 0.026 0.000 2.359 6409 D HA -0.025 4.614 4.640 -0.002 0.000 0.250 6409 D C 1.651 177.973 176.300 0.037 0.000 1.264 6409 D CA 0.056 54.074 54.000 0.029 0.000 0.911 6409 D CB 0.823 41.642 40.800 0.031 0.000 1.056 6409 D HN -0.055 nan 8.370 nan 0.000 0.499 6410 T N 0.077 114.651 114.554 0.033 0.000 2.977 6410 T HA -0.117 4.232 4.350 -0.002 0.000 0.271 6410 T C 1.627 176.355 174.700 0.046 0.000 1.105 6410 T CA 0.681 62.802 62.100 0.035 0.000 1.116 6410 T CB -0.097 68.787 68.868 0.026 0.000 0.878 6410 T HN 0.210 nan 8.240 nan 0.000 0.509 6411 V N 0.638 120.580 119.914 0.047 0.000 3.052 6411 V HA 0.179 4.297 4.120 -0.002 0.000 0.254 6411 V C 2.586 178.721 176.094 0.068 0.000 1.100 6411 V CA 1.190 63.523 62.300 0.054 0.000 1.112 6411 V CB -0.332 31.518 31.823 0.044 0.000 0.738 6411 V HN 0.473 nan 8.190 nan 0.000 0.469 6412 K N 0.067 120.506 120.400 0.065 0.000 2.323 6412 K HA 0.018 4.337 4.320 -0.002 0.000 0.197 6412 K C 2.051 178.711 176.600 0.100 0.000 1.043 6412 K CA 0.422 56.754 56.287 0.075 0.000 0.997 6412 K CB 0.157 32.693 32.500 0.058 0.000 0.807 6412 K HN 0.351 nan 8.250 nan 0.000 0.497 6413 K N 0.953 121.412 120.400 0.098 0.000 2.025 6413 K HA -0.159 4.160 4.320 -0.002 0.000 0.207 6413 K C 1.964 178.671 176.600 0.180 0.000 1.049 6413 K CA 1.746 58.107 56.287 0.125 0.000 0.933 6413 K CB -0.001 32.550 32.500 0.085 0.000 0.714 6413 K HN 0.069 nan 8.250 nan 0.000 0.438 6414 K N 1.170 121.663 120.400 0.156 0.000 2.097 6414 K HA -0.139 4.180 4.320 -0.002 0.000 0.206 6414 K C 1.506 178.264 176.600 0.263 0.000 1.049 6414 K CA 1.881 58.298 56.287 0.218 0.000 0.933 6414 K CB -0.271 32.328 32.500 0.164 0.000 0.717 6414 K HN -0.057 nan 8.250 nan 0.000 0.442 6415 D N 0.405 120.920 120.400 0.192 0.000 2.144 6415 D HA -0.039 4.600 4.640 -0.002 0.000 0.200 6415 D C 1.803 178.216 176.300 0.189 0.000 0.978 6415 D CA 0.905 55.009 54.000 0.174 0.000 0.833 6415 D CB -0.026 40.851 40.800 0.129 0.000 0.961 6415 D HN 0.214 nan 8.370 nan 0.000 0.470 6416 L N -0.462 120.886 121.223 0.209 0.000 2.240 6416 L HA -0.064 4.275 4.340 -0.002 0.000 0.211 6416 L C 2.106 179.146 176.870 0.283 0.000 1.106 6416 L CA 0.252 55.238 54.840 0.243 0.000 0.793 6416 L CB -0.158 42.040 42.059 0.232 0.000 0.927 6416 L HN -0.031 nan 8.230 nan 0.000 0.446 6417 F N 0.511 120.532 119.950 0.118 0.000 2.146 6417 F HA -0.197 4.329 4.527 -0.002 0.000 0.298 6417 F C 2.081 177.884 175.800 0.005 0.000 1.096 6417 F CA 1.479 59.516 58.000 0.063 0.000 1.275 6417 F CB -0.206 38.848 39.000 0.090 0.000 1.008 6417 F HN -0.114 nan 8.300 nan 0.000 0.480 6418 L N -0.239 121.018 121.223 0.057 0.000 2.131 6418 L HA -0.226 4.113 4.340 -0.002 0.000 0.210 6418 L C 2.129 178.947 176.870 -0.086 0.000 1.092 6418 L CA 1.391 56.214 54.840 -0.028 0.000 0.759 6418 L CB -0.825 41.344 42.059 0.183 0.000 0.903 6418 L HN 0.117 nan 8.230 nan 0.000 0.435 6419 D N 0.079 120.487 120.400 0.013 0.000 2.144 6419 D HA -0.152 4.487 4.640 -0.002 0.000 0.200 6419 D C 2.103 178.368 176.300 -0.058 0.000 0.978 6419 D CA 0.960 55.002 54.000 0.069 0.000 0.833 6419 D CB 0.037 40.964 40.800 0.212 0.000 0.961 6419 D HN 0.173 nan 8.370 nan 0.000 0.470 6420 L N 1.491 122.522 121.223 -0.320 0.000 1.971 6420 L HA -0.211 4.128 4.340 -0.002 0.000 0.215 6420 L C 2.074 178.601 176.870 -0.571 0.000 1.072 6420 L CA 1.658 56.020 54.840 -0.797 0.000 0.758 6420 L CB -0.814 40.707 42.059 -0.897 0.000 0.889 6420 L HN -0.063 nan 8.230 nan 0.000 0.433 6421 I N 0.463 120.626 120.570 -0.679 0.000 2.127 6421 I HA -0.308 3.861 4.170 -0.002 0.000 0.241 6421 I C 2.786 178.630 176.117 -0.455 0.000 1.075 6421 I CA 1.696 62.549 61.300 -0.745 0.000 1.334 6421 I CB -2.125 35.071 38.000 -1.340 0.000 1.040 6421 I HN 0.435 nan 8.210 nan 0.000 0.405 6422 A N 0.777 123.445 122.820 -0.253 0.000 1.917 6422 A HA -0.248 4.071 4.320 -0.002 0.000 0.219 6422 A C 2.021 179.638 177.584 0.054 0.000 1.182 6422 A CA 2.201 54.267 52.037 0.048 0.000 0.633 6422 A CB -0.714 18.345 19.000 0.098 0.000 0.819 6422 A HN 0.414 nan 8.150 nan 0.000 0.448 6423 D N -0.402 119.986 120.400 -0.020 0.000 2.117 6423 D HA -0.095 4.544 4.640 -0.002 0.000 0.197 6423 D C 2.142 178.327 176.300 -0.192 0.000 0.987 6423 D CA 1.549 55.561 54.000 0.020 0.000 0.829 6423 D CB -0.388 40.560 40.800 0.247 0.000 0.961 6423 D HN 0.267 nan 8.370 nan 0.000 0.460 6424 V N 0.949 120.591 119.914 -0.454 0.000 2.239 6424 V HA -0.224 3.895 4.120 -0.002 0.000 0.242 6424 V C 2.628 178.496 176.094 -0.378 0.000 1.038 6424 V CA 1.349 63.272 62.300 -0.628 0.000 1.002 6424 V CB -0.511 30.836 31.823 -0.794 0.000 0.641 6424 V HN 0.134 nan 8.190 nan 0.000 0.449 6425 M N -1.193 118.188 119.600 -0.366 0.000 2.082 6425 M HA -0.194 4.285 4.480 -0.002 0.000 0.258 6425 M C 1.981 177.883 176.300 -0.664 0.000 1.069 6425 M CA 2.409 57.395 55.300 -0.523 0.000 1.102 6425 M CB -0.287 31.987 32.600 -0.543 0.000 1.336 6425 M HN 0.372 nan 8.290 nan 0.000 0.404 6426 F N -2.412 117.477 119.950 -0.103 0.000 2.522 6426 F HA 0.320 4.846 4.527 -0.002 0.000 0.275 6426 F C 2.367 178.127 175.800 -0.067 0.000 0.890 6426 F CA 0.307 58.272 58.000 -0.058 0.000 1.157 6426 F CB -1.487 37.516 39.000 0.004 0.000 1.117 6426 F HN 0.060 nan 8.300 nan 0.000 0.787 6427 G N 1.217 110.124 108.800 0.177 0.000 2.764 6427 G HA2 -0.286 3.673 3.960 -0.002 0.000 0.219 6427 G HA3 -0.286 3.673 3.960 -0.002 0.000 0.219 6427 G C 1.751 176.670 174.900 0.033 0.000 1.259 6427 G CA 2.201 47.348 45.100 0.078 0.000 0.793 6427 G HN 0.191 nan 8.290 nan 0.000 0.633 6428 V N 2.432 122.367 119.914 0.034 0.000 2.287 6428 V HA -0.138 3.981 4.120 -0.002 0.000 0.248 6428 V C 0.513 176.615 176.094 0.014 0.000 1.053 6428 V CA 2.495 64.828 62.300 0.055 0.000 1.027 6428 V CB -1.213 30.660 31.823 0.083 0.000 0.646 6428 V HN 0.322 nan 8.190 nan 0.000 0.447 6429 P HA -0.127 nan 4.420 nan 0.000 0.215 6429 P C 2.029 179.294 177.300 -0.058 0.000 1.157 6429 P CA 1.974 65.044 63.100 -0.050 0.000 0.874 6429 P CB -0.126 31.513 31.700 -0.101 0.000 0.790 6430 S N -0.478 115.181 115.700 -0.068 0.000 2.359 6430 S HA -0.157 4.312 4.470 -0.002 0.000 0.222 6430 S C 2.040 176.542 174.600 -0.164 0.000 1.038 6430 S CA 1.720 59.842 58.200 -0.129 0.000 1.051 6430 S CB -1.524 61.593 63.200 -0.138 0.000 0.944 6430 S HN -0.052 nan 8.310 nan 0.000 0.433 6431 V N 2.281 122.122 119.914 -0.122 0.000 2.332 6431 V HA -0.204 3.915 4.120 -0.002 0.000 0.248 6431 V C 2.114 178.191 176.094 -0.029 0.000 1.055 6431 V CA 1.672 63.909 62.300 -0.105 0.000 1.038 6431 V CB -0.813 31.004 31.823 -0.011 0.000 0.651 6431 V HN 0.446 nan 8.190 nan 0.000 0.450 6432 I N -0.384 120.189 120.570 0.006 0.000 2.208 6432 I HA -0.239 3.930 4.170 -0.002 0.000 0.245 6432 I C 2.389 178.524 176.117 0.030 0.000 1.097 6432 I CA 1.381 62.705 61.300 0.041 0.000 1.363 6432 I CB -0.466 37.560 38.000 0.043 0.000 1.051 6432 I HN 0.172 nan 8.210 nan 0.000 0.413 6433 V N 1.083 120.982 119.914 -0.025 0.000 2.237 6433 V HA -0.313 3.806 4.120 -0.002 0.000 0.245 6433 V C 2.787 178.870 176.094 -0.017 0.000 1.046 6433 V CA 2.040 64.321 62.300 -0.031 0.000 1.007 6433 V CB -1.131 30.637 31.823 -0.092 0.000 0.638 6433 V HN 0.508 nan 8.190 nan 0.000 0.445 6434 A N -0.082 122.653 122.820 -0.142 0.000 1.903 6434 A HA -0.322 3.997 4.320 -0.002 0.000 0.219 6434 A C 2.356 180.002 177.584 0.103 0.000 1.191 6434 A CA 2.495 54.415 52.037 -0.196 0.000 0.638 6434 A CB -0.591 18.073 19.000 -0.561 0.000 0.823 6434 A HN 0.544 nan 8.150 nan 0.000 0.451 6435 R N -0.751 119.856 120.500 0.177 0.000 2.070 6435 R HA -0.139 4.200 4.340 -0.002 0.000 0.232 6435 R C 2.135 178.570 176.300 0.225 0.000 1.138 6435 R CA 1.789 58.057 56.100 0.281 0.000 0.936 6435 R CB -0.516 29.915 30.300 0.218 0.000 0.839 6435 R HN 0.652 nan 8.270 nan 0.000 0.429 6436 N N -0.377 118.441 118.700 0.196 0.000 2.104 6436 N HA -0.210 4.529 4.740 -0.002 0.000 0.190 6436 N C 1.672 177.390 175.510 0.345 0.000 1.024 6436 N CA 1.517 54.706 53.050 0.232 0.000 0.853 6436 N CB -0.302 38.320 38.487 0.225 0.000 1.008 6436 N HN 0.299 nan 8.380 nan 0.000 0.424 6437 H N 0.872 120.103 119.070 0.268 0.000 2.352 6437 H HA -0.004 4.551 4.556 -0.002 0.000 0.299 6437 H C 2.227 177.735 175.328 0.300 0.000 1.097 6437 H CA 1.701 57.974 56.048 0.375 0.000 1.311 6437 H CB 0.049 29.968 29.762 0.261 0.000 1.377 6437 H HN 0.081 nan 8.280 nan 0.000 0.504 6438 R N 0.370 121.051 120.500 0.300 0.000 2.097 6438 R HA -0.162 4.177 4.340 -0.002 0.000 0.236 6438 R C 1.386 177.743 176.300 0.095 0.000 1.135 6438 R CA 2.222 58.442 56.100 0.200 0.000 0.934 6438 R CB -0.341 30.110 30.300 0.253 0.000 0.846 6438 R HN 0.446 nan 8.270 nan 0.000 0.431 6439 D N 0.217 120.680 120.400 0.106 0.000 2.309 6439 D HA -0.122 4.517 4.640 -0.002 0.000 0.212 6439 D C 1.236 177.544 176.300 0.012 0.000 0.968 6439 D CA 1.171 55.204 54.000 0.055 0.000 0.882 6439 D CB -0.062 40.779 40.800 0.068 0.000 0.918 6439 D HN 0.442 nan 8.370 nan 0.000 0.503 6440 A N 0.131 122.955 122.820 0.007 0.000 2.261 6440 A HA 0.369 4.688 4.320 -0.002 0.000 0.208 6440 A C 1.700 179.206 177.584 -0.129 0.000 1.223 6440 A CA 0.784 52.755 52.037 -0.110 0.000 0.833 6440 A CB -0.446 18.450 19.000 -0.173 0.000 0.830 6440 A HN 0.221 nan 8.150 nan 0.000 0.483 6441 G N -2.176 106.581 108.800 -0.070 0.000 2.176 6441 G HA2 0.127 4.086 3.960 -0.002 0.000 0.252 6441 G HA3 0.127 4.086 3.960 -0.002 0.000 0.252 6441 G C 0.236 175.106 174.900 -0.050 0.000 1.024 6441 G CA 0.445 45.513 45.100 -0.054 0.000 0.755 6441 G HN 1.680 nan 8.290 nan 0.000 0.507 6442 A N -0.595 122.183 122.820 -0.070 0.000 2.386 6442 A HA 0.953 5.272 4.320 -0.002 0.000 0.308 6442 A C -2.669 174.976 177.584 0.102 0.000 1.128 6442 A CA -1.723 50.304 52.037 -0.016 0.000 0.789 6442 A CB 1.453 20.382 19.000 -0.118 0.000 1.325 6442 A HN 0.082 nan 8.150 nan 0.000 0.437 6443 P HA 0.298 nan 4.420 nan 0.000 0.267 6443 P C -0.538 176.951 177.300 0.315 0.000 1.209 6443 P CA 0.631 63.857 63.100 0.210 0.000 0.763 6443 P CB 0.736 32.608 31.700 0.286 0.000 0.816 6444 T N 3.124 117.748 114.554 0.117 0.000 2.907 6444 T HA 0.599 4.948 4.350 -0.002 0.000 0.292 6444 T C -1.047 173.511 174.700 -0.236 0.000 1.043 6444 T CA -0.240 61.946 62.100 0.145 0.000 1.003 6444 T CB 0.840 69.859 68.868 0.253 0.000 1.084 6444 T HN 0.135 nan 8.240 nan 0.000 0.483 6445 Y N 0.655 120.888 120.300 -0.111 0.000 2.534 6445 Y HA 0.680 5.229 4.550 -0.002 0.000 0.345 6445 Y C -0.157 175.612 175.900 -0.219 0.000 1.031 6445 Y CA -1.071 56.885 58.100 -0.241 0.000 1.022 6445 Y CB 2.092 40.120 38.460 -0.720 0.000 1.292 6445 Y HN 0.350 nan 8.280 nan 0.000 0.459 6446 M N 2.743 122.486 119.600 0.238 0.000 2.631 6446 M HA 0.555 5.033 4.480 -0.002 0.000 0.288 6446 M C -1.655 175.014 176.300 0.616 0.000 1.260 6446 M CA -0.973 54.415 55.300 0.147 0.000 0.842 6446 M CB 3.603 36.095 32.600 -0.181 0.000 1.743 6446 M HN 0.791 nan 8.290 nan 0.000 0.461 6447 Y N -1.519 118.961 120.300 0.300 0.000 2.656 6447 Y HA 0.702 5.251 4.550 -0.002 0.000 0.334 6447 Y C -1.807 174.185 175.900 0.153 0.000 1.179 6447 Y CA -0.970 57.302 58.100 0.287 0.000 1.050 6447 Y CB 1.590 40.231 38.460 0.302 0.000 1.308 6447 Y HN 0.698 nan 8.280 nan 0.000 0.456 6448 E N 2.253 122.785 120.200 0.552 0.000 2.283 6448 E HA 0.320 4.668 4.350 -0.002 0.000 0.258 6448 E C -2.238 174.659 176.600 0.496 0.000 0.893 6448 E CA -0.819 55.818 56.400 0.396 0.000 0.798 6448 E CB 1.276 31.093 29.700 0.195 0.000 1.242 6448 E HN 0.607 nan 8.360 nan 0.000 0.414 6449 F N 3.858 124.069 119.950 0.435 0.000 2.421 6449 F HA 0.218 4.744 4.527 -0.002 0.000 0.358 6449 F C -0.098 175.831 175.800 0.216 0.000 1.115 6449 F CA 0.032 58.197 58.000 0.275 0.000 1.160 6449 F CB 0.941 40.107 39.000 0.278 0.000 1.123 6449 F HN 0.451 nan 8.300 nan 0.000 0.508 6450 Q N 6.780 126.419 119.800 -0.269 0.000 2.907 6450 Q HA 0.237 4.576 4.340 -0.002 0.000 0.262 6450 Q C -2.109 173.765 176.000 -0.210 0.000 0.997 6450 Q CA -0.491 55.242 55.803 -0.117 0.000 0.797 6450 Q CB 0.576 29.308 28.738 -0.011 0.000 1.228 6450 Q HN 0.773 nan 8.270 nan 0.000 0.466 6451 Y N 0.450 120.493 120.300 -0.429 0.000 2.597 6451 Y HA 0.536 5.085 4.550 -0.002 0.000 0.340 6451 Y C -1.650 174.259 175.900 0.017 0.000 1.097 6451 Y CA -1.149 56.781 58.100 -0.283 0.000 1.037 6451 Y CB 1.632 39.790 38.460 -0.504 0.000 1.305 6451 Y HN 0.295 nan 8.280 nan 0.000 0.463 6452 R N 5.485 125.519 120.500 -0.778 0.000 2.415 6452 R HA 0.373 4.712 4.340 -0.002 0.000 0.292 6452 R C -3.053 172.856 176.300 -0.651 0.000 1.295 6452 R CA -2.034 53.781 56.100 -0.475 0.000 1.137 6452 R CB 1.065 31.151 30.300 -0.358 0.000 1.135 6452 R HN 0.502 nan 8.270 nan 0.000 0.560 6453 P HA 0.022 nan 4.420 nan 0.000 0.269 6453 P C 0.347 177.322 177.300 -0.541 0.000 1.209 6453 P CA 0.058 62.928 63.100 -0.383 0.000 0.776 6453 P CB 0.896 32.423 31.700 -0.288 0.000 0.876 6454 S N 0.387 115.636 115.700 -0.752 0.000 2.650 6454 S HA 0.085 4.554 4.470 -0.002 0.000 0.219 6454 S C 0.921 175.168 174.600 -0.587 0.000 0.960 6454 S CA -0.116 57.712 58.200 -0.621 0.000 0.925 6454 S CB -1.098 61.771 63.200 -0.551 0.000 0.775 6454 S HN 0.422 nan 8.310 nan 0.000 0.525 6455 F N 1.654 121.356 119.950 -0.414 0.000 2.727 6455 F HA 0.315 4.840 4.527 -0.002 0.000 0.302 6455 F C 1.030 176.636 175.800 -0.323 0.000 1.097 6455 F CA -0.768 56.974 58.000 -0.430 0.000 1.330 6455 F CB 0.090 38.627 39.000 -0.771 0.000 1.084 6455 F HN 0.075 nan 8.300 nan 0.000 0.578 6456 S N 0.460 116.048 115.700 -0.187 0.000 2.568 6456 S HA 0.008 4.477 4.470 -0.002 0.000 0.282 6456 S C 0.496 175.054 174.600 -0.069 0.000 1.338 6456 S CA -0.489 57.665 58.200 -0.076 0.000 1.045 6456 S CB 1.044 64.155 63.200 -0.148 0.000 0.873 6456 S HN 0.222 nan 8.310 nan 0.000 0.516 6457 S N 0.779 116.468 115.700 -0.019 0.000 2.563 6457 S HA -0.022 4.447 4.470 -0.002 0.000 0.284 6457 S C 0.732 175.231 174.600 -0.167 0.000 1.331 6457 S CA -0.503 57.683 58.200 -0.024 0.000 1.047 6457 S CB 0.143 63.444 63.200 0.169 0.000 0.859 6457 S HN 0.623 nan 8.310 nan 0.000 0.514 6458 D N 3.227 123.571 120.400 -0.095 0.000 2.144 6458 D HA -0.109 4.530 4.640 -0.002 0.000 0.199 6458 D C 1.571 177.772 176.300 -0.166 0.000 0.984 6458 D CA 1.565 55.495 54.000 -0.117 0.000 0.834 6458 D CB -0.214 40.551 40.800 -0.058 0.000 0.955 6458 D HN 0.654 nan 8.370 nan 0.000 0.465 6459 M N -0.011 119.515 119.600 -0.122 0.000 2.748 6459 M HA -0.042 4.437 4.480 -0.002 0.000 0.241 6459 M C 0.699 176.727 176.300 -0.453 0.000 1.080 6459 M CA 0.514 55.758 55.300 -0.093 0.000 1.068 6459 M CB -0.212 32.496 32.600 0.180 0.000 1.536 6459 M HN -0.191 nan 8.290 nan 0.000 0.540 6460 K N 2.055 121.977 120.400 -0.797 0.000 2.240 6460 K HA 0.345 4.664 4.320 -0.002 0.000 0.271 6460 K C -2.529 173.693 176.600 -0.630 0.000 1.018 6460 K CA -1.875 53.640 56.287 -1.287 0.000 0.874 6460 K CB 1.221 32.887 32.500 -1.389 0.000 1.098 6460 K HN -0.171 nan 8.250 nan 0.000 0.458 6461 P HA -0.032 nan 4.420 nan 0.000 0.266 6461 P C -0.071 177.103 177.300 -0.210 0.000 1.195 6461 P CA -0.148 62.803 63.100 -0.249 0.000 0.768 6461 P CB 0.598 32.206 31.700 -0.152 0.000 0.838 6462 K N 1.317 121.623 120.400 -0.157 0.000 2.280 6462 K HA -0.090 4.229 4.320 -0.002 0.000 0.202 6462 K C 1.726 178.261 176.600 -0.108 0.000 1.047 6462 K CA 1.743 57.947 56.287 -0.138 0.000 0.942 6462 K CB -1.114 31.318 32.500 -0.114 0.000 0.739 6462 K HN 0.621 nan 8.250 nan 0.000 0.457 6463 T N -1.455 113.051 114.554 -0.079 0.000 2.942 6463 T HA -0.011 4.338 4.350 -0.002 0.000 0.265 6463 T C 1.086 175.768 174.700 -0.030 0.000 1.062 6463 T CA 0.050 62.123 62.100 -0.045 0.000 1.139 6463 T CB -0.337 68.521 68.868 -0.017 0.000 0.883 6463 T HN -0.151 nan 8.240 nan 0.000 0.468 6464 V N 2.837 122.730 119.914 -0.035 0.000 2.420 6464 V HA 0.250 4.368 4.120 -0.002 0.000 0.274 6464 V C 0.173 176.265 176.094 -0.003 0.000 1.003 6464 V CA 0.237 62.542 62.300 0.008 0.000 1.092 6464 V CB -0.731 31.105 31.823 0.022 0.000 1.002 6464 V HN 0.482 nan 8.190 nan 0.000 0.473 6465 I N 4.238 124.822 120.570 0.024 0.000 2.410 6465 I HA 0.595 4.764 4.170 -0.002 0.000 0.286 6465 I C 0.854 177.023 176.117 0.087 0.000 1.009 6465 I CA -0.175 61.131 61.300 0.011 0.000 1.111 6465 I CB 1.666 39.648 38.000 -0.031 0.000 1.262 6465 I HN 0.786 nan 8.210 nan 0.000 0.443 6466 G N 3.845 112.739 108.800 0.156 0.000 2.140 6466 G HA2 -0.222 3.737 3.960 -0.002 0.000 0.211 6466 G HA3 -0.222 3.737 3.960 -0.002 0.000 0.211 6466 G C -0.079 174.985 174.900 0.274 0.000 1.013 6466 G CA -0.137 45.128 45.100 0.276 0.000 0.705 6466 G HN 0.657 nan 8.290 nan 0.000 0.508 6467 D N -0.416 120.135 120.400 0.251 0.000 2.335 6467 D HA 0.273 4.912 4.640 -0.002 0.000 0.236 6467 D C 0.905 177.379 176.300 0.289 0.000 1.297 6467 D CA -0.119 54.039 54.000 0.264 0.000 0.906 6467 D CB 0.246 41.226 40.800 0.301 0.000 1.164 6467 D HN 0.345 nan 8.370 nan 0.000 0.469 6468 H N -0.762 118.399 119.070 0.153 0.000 2.964 6468 H HA 0.328 4.883 4.556 -0.002 0.000 0.328 6468 H C 1.283 176.751 175.328 0.233 0.000 1.030 6468 H CA 1.594 57.705 56.048 0.104 0.000 1.445 6468 H CB 0.203 29.996 29.762 0.053 0.000 1.449 6468 H HN 0.576 nan 8.280 nan 0.000 0.581 6469 G N 4.323 112.970 108.800 -0.255 0.000 2.162 6469 G HA2 -0.302 3.657 3.960 -0.002 0.000 0.260 6469 G HA3 -0.302 3.657 3.960 -0.002 0.000 0.260 6469 G C 1.019 175.898 174.900 -0.034 0.000 0.976 6469 G CA 0.477 45.384 45.100 -0.322 0.000 0.655 6469 G HN 0.682 nan 8.290 nan 0.000 0.533 6470 D N 0.661 121.134 120.400 0.121 0.000 2.269 6470 D HA -0.021 4.618 4.640 -0.002 0.000 0.208 6470 D C 2.387 178.633 176.300 -0.089 0.000 0.963 6470 D CA 1.150 55.327 54.000 0.294 0.000 0.864 6470 D CB -0.002 41.075 40.800 0.462 0.000 0.936 6470 D HN 0.756 nan 8.370 nan 0.000 0.505 6471 E N 1.052 120.870 120.200 -0.637 0.000 2.427 6471 E HA -0.091 4.258 4.350 -0.002 0.000 0.196 6471 E C 2.126 178.434 176.600 -0.486 0.000 1.028 6471 E CA 0.088 55.790 56.400 -1.164 0.000 0.864 6471 E CB -0.454 28.702 29.700 -0.906 0.000 0.813 6471 E HN 0.306 nan 8.360 nan 0.000 0.514 6472 L N -0.080 120.946 121.223 -0.329 0.000 1.994 6472 L HA -0.138 4.201 4.340 -0.002 0.000 0.208 6472 L C 2.545 179.268 176.870 -0.246 0.000 1.071 6472 L CA 1.580 56.231 54.840 -0.315 0.000 0.745 6472 L CB -0.677 41.061 42.059 -0.535 0.000 0.892 6472 L HN 0.010 nan 8.230 nan 0.000 0.431 6473 F N -0.174 119.795 119.950 0.031 0.000 2.161 6473 F HA -0.237 4.289 4.527 -0.002 0.000 0.300 6473 F C 2.705 178.545 175.800 0.066 0.000 1.089 6473 F CA 1.401 59.465 58.000 0.105 0.000 1.282 6473 F CB -0.958 38.231 39.000 0.315 0.000 1.010 6473 F HN -0.009 nan 8.300 nan 0.000 0.485 6474 S N 0.237 116.042 115.700 0.175 0.000 2.338 6474 S HA -0.137 4.332 4.470 -0.002 0.000 0.218 6474 S C 2.336 176.844 174.600 -0.152 0.000 1.032 6474 S CA 1.287 59.507 58.200 0.032 0.000 0.999 6474 S CB -0.753 62.457 63.200 0.017 0.000 0.905 6474 S HN 0.132 nan 8.310 nan 0.000 0.439 6475 V N 0.741 120.443 119.914 -0.354 0.000 2.317 6475 V HA -0.187 3.932 4.120 -0.002 0.000 0.251 6475 V C 1.426 177.249 176.094 -0.452 0.000 1.065 6475 V CA 1.698 63.645 62.300 -0.588 0.000 1.049 6475 V CB -0.712 30.746 31.823 -0.607 0.000 0.651 6475 V HN 0.439 nan 8.190 nan 0.000 0.450 6476 F N 0.360 120.149 119.950 -0.268 0.000 2.713 6476 F HA 0.476 5.003 4.527 -0.001 0.000 0.294 6476 F C 1.597 177.317 175.800 -0.133 0.000 1.152 6476 F CA 0.273 58.139 58.000 -0.223 0.000 1.385 6476 F CB -0.284 38.547 39.000 -0.282 0.000 0.981 6476 F HN 0.221 nan 8.300 nan 0.000 0.514 6477 G N 0.957 109.784 108.800 0.044 0.000 2.421 6477 G HA2 -0.308 3.651 3.960 -0.002 0.000 0.300 6477 G HA3 -0.308 3.651 3.960 -0.002 0.000 0.300 6477 G C 1.295 176.278 174.900 0.138 0.000 0.974 6477 G CA 0.393 45.593 45.100 0.167 0.000 1.062 6477 G HN 0.606 nan 8.290 nan 0.000 0.514 6478 A N 0.570 123.448 122.820 0.097 0.000 1.883 6478 A HA 0.061 4.380 4.320 -0.002 0.000 0.217 6478 A C 0.565 178.077 177.584 -0.121 0.000 1.186 6478 A CA 1.967 53.985 52.037 -0.032 0.000 0.624 6478 A CB -0.887 18.127 19.000 0.023 0.000 0.822 6478 A HN 0.467 nan 8.150 nan 0.000 0.444 6479 P HA -0.106 nan 4.420 nan 0.000 0.231 6479 P C 0.121 177.076 177.300 -0.574 0.000 1.154 6479 P CA 1.032 63.982 63.100 -0.249 0.000 0.762 6479 P CB -0.261 31.217 31.700 -0.371 0.000 0.790 6480 F N -3.586 116.390 119.950 0.043 0.000 2.767 6480 F HA 0.258 4.784 4.527 -0.002 0.000 0.323 6480 F C 1.553 177.362 175.800 0.015 0.000 1.091 6480 F CA -0.005 58.025 58.000 0.050 0.000 1.192 6480 F CB 0.076 39.095 39.000 0.031 0.000 1.056 6480 F HN -0.220 nan 8.300 nan 0.000 0.571 6481 L N -1.025 120.243 121.223 0.076 0.000 2.642 6481 L HA 0.268 4.606 4.340 -0.002 0.000 0.233 6481 L C 0.522 177.366 176.870 -0.043 0.000 1.077 6481 L CA 0.337 55.189 54.840 0.020 0.000 0.879 6481 L CB 0.347 42.395 42.059 -0.018 0.000 1.151 6481 L HN -0.180 nan 8.230 nan 0.000 0.495 6482 K N 0.791 121.125 120.400 -0.110 0.000 2.208 6482 K HA 0.316 4.635 4.320 -0.002 0.000 0.247 6482 K C -0.572 176.025 176.600 -0.005 0.000 0.953 6482 K CA -0.538 55.668 56.287 -0.136 0.000 0.837 6482 K CB 2.076 34.310 32.500 -0.444 0.000 1.131 6482 K HN -0.136 nan 8.250 nan 0.000 0.431 6483 E N 0.215 120.436 120.200 0.034 0.000 2.249 6483 E HA 0.283 4.632 4.350 -0.002 0.000 0.280 6483 E C 0.158 176.825 176.600 0.113 0.000 1.016 6483 E CA 0.192 56.631 56.400 0.065 0.000 0.830 6483 E CB 0.879 30.604 29.700 0.043 0.000 1.081 6483 E HN 0.781 nan 8.360 nan 0.000 0.395 6484 G N 2.514 111.368 108.800 0.089 0.000 2.184 6484 G HA2 -0.231 3.728 3.960 -0.002 0.000 0.206 6484 G HA3 -0.231 3.728 3.960 -0.002 0.000 0.206 6484 G C 0.326 175.244 174.900 0.029 0.000 0.995 6484 G CA -0.125 45.014 45.100 0.066 0.000 0.651 6484 G HN 0.830 nan 8.290 nan 0.000 0.511 6485 A N 0.353 123.213 122.820 0.066 0.000 2.475 6485 A HA 0.673 4.992 4.320 -0.002 0.000 0.239 6485 A C 1.149 178.698 177.584 -0.059 0.000 1.087 6485 A CA 1.196 53.209 52.037 -0.040 0.000 0.779 6485 A CB 0.236 19.257 19.000 0.035 0.000 1.036 6485 A HN 2.032 nan 8.150 nan 0.000 0.506 6486 S N -0.384 115.265 115.700 -0.084 0.000 2.713 6486 S HA 0.359 4.828 4.470 -0.002 0.000 0.283 6486 S C 0.642 175.224 174.600 -0.031 0.000 1.161 6486 S CA -0.339 57.831 58.200 -0.049 0.000 0.999 6486 S CB 1.040 64.212 63.200 -0.047 0.000 1.039 6486 S HN 0.628 nan 8.310 nan 0.000 0.548 6487 E N 0.890 121.081 120.200 -0.016 0.000 2.118 6487 E HA -0.171 4.178 4.350 -0.002 0.000 0.195 6487 E C 1.788 178.380 176.600 -0.012 0.000 0.992 6487 E CA 1.481 57.877 56.400 -0.008 0.000 0.804 6487 E CB -0.410 29.290 29.700 -0.000 0.000 0.741 6487 E HN 0.909 nan 8.360 nan 0.000 0.458 6488 E N 0.849 121.044 120.200 -0.008 0.000 2.023 6488 E HA -0.228 4.121 4.350 -0.002 0.000 0.196 6488 E C 2.039 178.606 176.600 -0.057 0.000 1.003 6488 E CA 1.401 57.792 56.400 -0.015 0.000 0.809 6488 E CB -0.035 29.688 29.700 0.038 0.000 0.755 6488 E HN 0.205 nan 8.360 nan 0.000 0.449 6489 E N 0.180 120.376 120.200 -0.007 0.000 2.049 6489 E HA -0.232 4.117 4.350 -0.002 0.000 0.198 6489 E C 2.178 178.737 176.600 -0.067 0.000 1.007 6489 E CA 1.825 58.210 56.400 -0.025 0.000 0.809 6489 E CB -0.164 29.536 29.700 -0.001 0.000 0.749 6489 E HN 0.371 nan 8.360 nan 0.000 0.450 6490 I N 0.235 120.762 120.570 -0.072 0.000 2.194 6490 I HA -0.329 3.840 4.170 -0.002 0.000 0.246 6490 I C 2.750 178.870 176.117 0.004 0.000 1.093 6490 I CA 1.284 62.524 61.300 -0.100 0.000 1.355 6490 I CB -0.345 37.612 38.000 -0.072 0.000 1.046 6490 I HN 0.120 nan 8.210 nan 0.000 0.413 6491 R N 0.874 121.370 120.500 -0.008 0.000 2.073 6491 R HA -0.218 4.121 4.340 -0.002 0.000 0.234 6491 R C 2.380 178.661 176.300 -0.030 0.000 1.134 6491 R CA 1.540 57.639 56.100 -0.000 0.000 0.952 6491 R CB -0.290 29.995 30.300 -0.026 0.000 0.850 6491 R HN 0.202 nan 8.270 nan 0.000 0.433 6492 L N 0.501 121.661 121.223 -0.105 0.000 1.989 6492 L HA -0.174 4.165 4.340 -0.002 0.000 0.211 6492 L C 2.348 179.185 176.870 -0.054 0.000 1.071 6492 L CA 2.347 57.097 54.840 -0.151 0.000 0.749 6492 L CB -1.062 40.774 42.059 -0.372 0.000 0.890 6492 L HN 0.220 nan 8.230 nan 0.000 0.431 6493 S N -0.803 114.891 115.700 -0.009 0.000 2.359 6493 S HA -0.291 4.178 4.470 -0.002 0.000 0.223 6493 S C 2.116 176.769 174.600 0.089 0.000 1.039 6493 S CA 1.912 60.142 58.200 0.050 0.000 1.042 6493 S CB -0.277 62.980 63.200 0.095 0.000 0.915 6493 S HN 0.534 nan 8.310 nan 0.000 0.439 6494 K N 0.300 120.807 120.400 0.177 0.000 2.020 6494 K HA -0.174 4.145 4.320 -0.002 0.000 0.212 6494 K C 2.377 178.997 176.600 0.033 0.000 1.050 6494 K CA 1.955 58.347 56.287 0.176 0.000 0.929 6494 K CB -0.357 32.260 32.500 0.196 0.000 0.714 6494 K HN 0.485 nan 8.250 nan 0.000 0.443 6495 M N 0.884 120.469 119.600 -0.026 0.000 2.065 6495 M HA -0.198 4.281 4.480 -0.002 0.000 0.259 6495 M C 2.043 178.281 176.300 -0.103 0.000 1.069 6495 M CA 1.708 56.925 55.300 -0.139 0.000 1.110 6495 M CB -0.059 32.467 32.600 -0.124 0.000 1.328 6495 M HN -0.023 nan 8.290 nan 0.000 0.405 6496 V N 0.977 120.883 119.914 -0.014 0.000 2.287 6496 V HA -0.340 3.779 4.120 -0.002 0.000 0.248 6496 V C 2.470 178.510 176.094 -0.090 0.000 1.053 6496 V CA 2.134 64.413 62.300 -0.035 0.000 1.027 6496 V CB -0.759 30.900 31.823 -0.273 0.000 0.646 6496 V HN 0.574 nan 8.190 nan 0.000 0.447 6497 M N -1.031 118.502 119.600 -0.111 0.000 2.213 6497 M HA -0.155 4.324 4.480 -0.002 0.000 0.263 6497 M C 2.378 178.715 176.300 0.060 0.000 1.062 6497 M CA 1.492 56.743 55.300 -0.082 0.000 1.105 6497 M CB -0.466 32.093 32.600 -0.068 0.000 1.385 6497 M HN 0.193 nan 8.290 nan 0.000 0.417 6498 K N 0.424 120.850 120.400 0.044 0.000 2.026 6498 K HA -0.079 4.240 4.320 -0.002 0.000 0.208 6498 K C 1.779 178.478 176.600 0.166 0.000 1.048 6498 K CA 1.653 57.960 56.287 0.033 0.000 0.929 6498 K CB -0.594 31.836 32.500 -0.116 0.000 0.713 6498 K HN 0.320 nan 8.250 nan 0.000 0.439 6499 F N -0.537 119.569 119.950 0.261 0.000 2.046 6499 F HA -0.260 4.266 4.527 -0.002 0.000 0.297 6499 F C 2.584 178.599 175.800 0.358 0.000 1.123 6499 F CA 0.766 58.981 58.000 0.359 0.000 1.199 6499 F CB -0.339 39.023 39.000 0.603 0.000 0.972 6499 F HN 0.225 nan 8.300 nan 0.000 0.474 6500 W N 0.257 121.685 121.300 0.214 0.000 2.321 6500 W HA -0.298 4.361 4.660 -0.002 0.000 0.306 6500 W C 2.579 179.106 176.519 0.012 0.000 1.217 6500 W CA 0.973 58.340 57.345 0.037 0.000 1.257 6500 W CB -0.558 28.846 29.460 -0.093 0.000 1.145 6500 W HN 0.054 nan 8.180 nan 0.000 0.509 6501 A N 0.676 123.649 122.820 0.255 0.000 1.873 6501 A HA -0.219 4.100 4.320 -0.002 0.000 0.215 6501 A C 1.771 179.420 177.584 0.108 0.000 1.186 6501 A CA 1.763 53.873 52.037 0.122 0.000 0.616 6501 A CB -1.112 17.942 19.000 0.090 0.000 0.823 6501 A HN 0.248 nan 8.150 nan 0.000 0.442 6502 N N -0.545 118.244 118.700 0.149 0.000 2.036 6502 N HA -0.207 4.532 4.740 -0.002 0.000 0.195 6502 N C 1.500 177.055 175.510 0.075 0.000 1.037 6502 N CA 1.827 54.947 53.050 0.117 0.000 0.855 6502 N CB -0.802 37.788 38.487 0.172 0.000 1.033 6502 N HN 0.516 nan 8.380 nan 0.000 0.423 6503 F N 1.826 121.720 119.950 -0.094 0.000 2.161 6503 F HA -0.124 4.402 4.527 -0.002 0.000 0.300 6503 F C 2.258 177.971 175.800 -0.146 0.000 1.089 6503 F CA 1.280 59.149 58.000 -0.219 0.000 1.282 6503 F CB -0.439 38.324 39.000 -0.394 0.000 1.010 6503 F HN 0.063 nan 8.300 nan 0.000 0.485 6504 A N 1.022 123.800 122.820 -0.070 0.000 1.978 6504 A HA -0.197 4.122 4.320 -0.002 0.000 0.220 6504 A C 2.282 179.787 177.584 -0.131 0.000 1.170 6504 A CA 1.895 53.855 52.037 -0.129 0.000 0.636 6504 A CB -0.659 18.315 19.000 -0.044 0.000 0.810 6504 A HN 0.626 nan 8.150 nan 0.000 0.448 6505 R N -2.542 117.902 120.500 -0.093 0.000 2.250 6505 R HA 0.201 4.540 4.340 -0.002 0.000 0.194 6505 R C 0.617 176.860 176.300 -0.095 0.000 0.927 6505 R CA 0.712 56.769 56.100 -0.071 0.000 1.052 6505 R CB -0.112 30.176 30.300 -0.020 0.000 1.055 6505 R HN 0.311 nan 8.270 nan 0.000 0.537 6506 N N 0.419 119.051 118.700 -0.114 0.000 2.332 6506 N HA 0.099 4.838 4.740 -0.002 0.000 0.190 6506 N C 0.800 176.213 175.510 -0.161 0.000 1.117 6506 N CA 1.091 54.084 53.050 -0.095 0.000 0.883 6506 N CB 1.239 39.710 38.487 -0.026 0.000 1.089 6506 N HN 0.442 nan 8.380 nan 0.000 0.480 6507 G N 1.256 109.843 108.800 -0.354 0.000 2.137 6507 G HA2 -0.245 3.714 3.960 -0.002 0.000 0.237 6507 G HA3 -0.245 3.714 3.960 -0.002 0.000 0.237 6507 G C -0.228 174.594 174.900 -0.130 0.000 1.002 6507 G CA 0.115 44.895 45.100 -0.533 0.000 0.702 6507 G HN 0.438 nan 8.290 nan 0.000 0.515 6508 N N -0.345 118.317 118.700 -0.063 0.000 2.572 6508 N HA 0.322 5.061 4.740 -0.002 0.000 0.287 6508 N C -1.478 173.976 175.510 -0.093 0.000 1.136 6508 N CA -1.017 51.978 53.050 -0.091 0.000 0.900 6508 N CB 2.170 40.696 38.487 0.065 0.000 1.484 6508 N HN -0.038 nan 8.380 nan 0.000 0.526 6509 P HA -0.105 nan 4.420 nan 0.000 0.222 6509 P C -0.114 177.375 177.300 0.315 0.000 1.147 6509 P CA 0.627 63.685 63.100 -0.071 0.000 0.790 6509 P CB 0.292 31.621 31.700 -0.619 0.000 0.780 6510 N N 0.783 119.607 118.700 0.206 0.000 2.407 6510 N HA 0.199 4.938 4.740 -0.002 0.000 0.250 6510 N C 0.946 176.628 175.510 0.286 0.000 1.236 6510 N CA 1.226 54.477 53.050 0.335 0.000 0.879 6510 N CB 0.463 39.102 38.487 0.253 0.000 1.088 6510 N HN 0.190 nan 8.380 nan 0.000 0.450 6511 G N 0.582 109.553 108.800 0.285 0.000 2.606 6511 G HA2 0.351 4.310 3.960 -0.002 0.000 0.300 6511 G HA3 0.351 4.310 3.960 -0.002 0.000 0.300 6511 G C -1.534 173.450 174.900 0.139 0.000 1.360 6511 G CA -0.584 44.618 45.100 0.171 0.000 0.783 6511 G HN 0.358 nan 8.290 nan 0.000 0.484 6512 E N -0.275 119.977 120.200 0.086 0.000 2.313 6512 E HA 0.480 4.829 4.350 -0.002 0.000 0.276 6512 E C 0.925 177.547 176.600 0.036 0.000 1.031 6512 E CA 0.568 57.008 56.400 0.066 0.000 0.857 6512 E CB 1.146 30.875 29.700 0.048 0.000 1.040 6512 E HN 1.740 nan 8.360 nan 0.000 0.408 6513 G N 2.131 110.955 108.800 0.040 0.000 2.160 6513 G HA2 -0.273 3.686 3.960 -0.002 0.000 0.251 6513 G HA3 -0.273 3.686 3.960 -0.002 0.000 0.251 6513 G C -0.319 174.574 174.900 -0.011 0.000 1.008 6513 G CA 0.094 45.203 45.100 0.015 0.000 0.724 6513 G HN 0.330 nan 8.290 nan 0.000 0.514 6514 L N 1.014 122.251 121.223 0.022 0.000 2.381 6514 L HA 0.451 4.790 4.340 -0.002 0.000 0.274 6514 L C -1.835 175.160 176.870 0.209 0.000 0.988 6514 L CA -2.361 52.472 54.840 -0.011 0.000 0.824 6514 L CB 2.324 44.268 42.059 -0.192 0.000 1.263 6514 L HN -0.086 nan 8.230 nan 0.000 0.410 6515 P HA -0.098 nan 4.420 nan 0.000 0.262 6515 P C -0.560 176.975 177.300 0.392 0.000 1.182 6515 P CA 0.045 63.308 63.100 0.272 0.000 0.761 6515 P CB 0.318 32.139 31.700 0.201 0.000 0.795 6516 H N 3.421 122.629 119.070 0.231 0.000 3.094 6516 H HA 0.017 4.572 4.556 -0.002 0.000 0.320 6516 H C -0.792 174.696 175.328 0.267 0.000 1.000 6516 H CA 0.520 56.720 56.048 0.255 0.000 1.413 6516 H CB 0.150 30.016 29.762 0.174 0.000 1.405 6516 H HN 0.417 nan 8.280 nan 0.000 0.586 6517 W N 9.180 130.215 121.300 -0.443 0.000 2.329 6517 W HA 0.307 4.965 4.660 -0.002 0.000 0.312 6517 W C -2.747 173.538 176.519 -0.390 0.000 1.054 6517 W CA -3.206 53.950 57.345 -0.315 0.000 1.245 6517 W CB 1.167 30.446 29.460 -0.302 0.000 1.255 6517 W HN 0.570 nan 8.180 nan 0.000 0.436 6518 P HA 0.035 nan 4.420 nan 0.000 0.276 6518 P C -0.152 177.249 177.300 0.168 0.000 1.235 6518 P CA 0.172 63.394 63.100 0.204 0.000 0.772 6518 P CB 1.297 33.123 31.700 0.209 0.000 0.871 6519 E N 2.837 123.027 120.200 -0.017 0.000 2.415 6519 E HA -0.097 4.252 4.350 -0.002 0.000 0.262 6519 E C -0.997 175.505 176.600 -0.162 0.000 1.038 6519 E CA -0.310 55.854 56.400 -0.394 0.000 0.921 6519 E CB 0.213 29.753 29.700 -0.265 0.000 0.950 6519 E HN 0.390 nan 8.360 nan 0.000 0.438 6520 Y N 6.369 126.465 120.300 -0.340 0.000 2.600 6520 Y HA 0.087 4.636 4.550 -0.002 0.000 0.351 6520 Y C 0.014 175.873 175.900 -0.068 0.000 1.042 6520 Y CA -0.295 57.743 58.100 -0.103 0.000 1.333 6520 Y CB -0.335 38.085 38.460 -0.067 0.000 1.172 6520 Y HN 0.501 nan 8.280 nan 0.000 0.517 6521 N N 1.948 120.480 118.700 -0.281 0.000 3.084 6521 N HA 0.090 4.829 4.740 -0.002 0.000 0.336 6521 N C 0.553 175.879 175.510 -0.307 0.000 1.391 6521 N CA -0.302 52.618 53.050 -0.216 0.000 0.712 6521 N CB 0.245 38.670 38.487 -0.105 0.000 1.248 6521 N HN 0.383 nan 8.380 nan 0.000 0.545 6522 Q N 0.082 119.781 119.800 -0.168 0.000 2.364 6522 Q HA 0.059 4.398 4.340 -0.002 0.000 0.207 6522 Q C 1.317 177.232 176.000 -0.142 0.000 0.970 6522 Q CA 1.039 56.757 55.803 -0.142 0.000 0.888 6522 Q CB -0.226 28.470 28.738 -0.070 0.000 0.951 6522 Q HN 0.589 nan 8.270 nan 0.000 0.469 6523 K N 0.584 120.903 120.400 -0.134 0.000 2.288 6523 K HA -0.055 4.263 4.320 -0.002 0.000 0.201 6523 K C 0.004 176.540 176.600 -0.106 0.000 1.048 6523 K CA 0.128 56.365 56.287 -0.084 0.000 0.956 6523 K CB 0.198 32.672 32.500 -0.043 0.000 0.746 6523 K HN 0.187 nan 8.250 nan 0.000 0.461 6524 E N -0.024 120.006 120.200 -0.282 0.000 2.271 6524 E HA -0.148 4.200 4.350 -0.002 0.000 0.223 6524 E C -0.298 176.355 176.600 0.087 0.000 1.223 6524 E CA 0.104 56.280 56.400 -0.373 0.000 0.704 6524 E CB -1.535 28.085 29.700 -0.134 0.000 1.194 6524 E HN 0.493 nan 8.360 nan 0.000 0.375 6525 G N 0.935 109.790 108.800 0.092 0.000 2.348 6525 G HA2 0.525 4.483 3.960 -0.002 0.000 0.312 6525 G HA3 0.525 4.483 3.960 -0.002 0.000 0.312 6525 G C -0.452 174.688 174.900 0.400 0.000 1.126 6525 G CA -0.374 44.835 45.100 0.181 0.000 0.865 6525 G HN 0.264 nan 8.290 nan 0.000 0.474 6526 Y N 0.435 120.884 120.300 0.249 0.000 2.705 6526 Y HA 0.776 5.325 4.550 -0.002 0.000 0.332 6526 Y C -1.225 174.680 175.900 0.010 0.000 1.157 6526 Y CA -1.983 56.286 58.100 0.282 0.000 1.091 6526 Y CB 1.821 40.426 38.460 0.242 0.000 1.301 6526 Y HN 0.494 nan 8.280 nan 0.000 0.488 6527 L N 2.320 123.438 121.223 -0.174 0.000 2.298 6527 L HA 0.435 4.774 4.340 -0.002 0.000 0.284 6527 L C -0.886 175.860 176.870 -0.208 0.000 1.013 6527 L CA -0.550 53.920 54.840 -0.616 0.000 0.824 6527 L CB 1.580 42.616 42.059 -1.704 0.000 1.221 6527 L HN 0.722 nan 8.230 nan 0.000 0.418 6528 Q N 6.342 126.062 119.800 -0.133 0.000 2.324 6528 Q HA 0.313 4.652 4.340 -0.002 0.000 0.257 6528 Q C -0.763 175.202 176.000 -0.059 0.000 1.080 6528 Q CA 0.197 56.026 55.803 0.043 0.000 0.907 6528 Q CB 0.707 29.464 28.738 0.033 0.000 1.274 6528 Q HN 0.608 nan 8.270 nan 0.000 0.434 6529 I N 2.394 122.944 120.570 -0.034 0.000 2.325 6529 I HA 0.487 4.656 4.170 -0.002 0.000 0.291 6529 I C 0.716 176.683 176.117 -0.250 0.000 1.019 6529 I CA -0.078 61.161 61.300 -0.102 0.000 1.302 6529 I CB 0.968 38.966 38.000 -0.003 0.000 1.401 6529 I HN 0.684 nan 8.210 nan 0.000 0.485 6530 G N 3.301 111.956 108.800 -0.243 0.000 2.490 6530 G HA2 0.440 4.399 3.960 -0.002 0.000 0.308 6530 G HA3 0.440 4.399 3.960 -0.002 0.000 0.308 6530 G C 0.324 175.092 174.900 -0.220 0.000 1.286 6530 G CA 0.052 44.980 45.100 -0.286 0.000 0.825 6530 G HN 0.521 nan 8.290 nan 0.000 0.479 6531 A N -0.516 122.243 122.820 -0.103 0.000 1.927 6531 A HA -0.011 4.308 4.320 -0.002 0.000 0.220 6531 A C 1.036 178.580 177.584 -0.067 0.000 1.185 6531 A CA 1.679 53.674 52.037 -0.070 0.000 0.639 6531 A CB -0.704 18.340 19.000 0.074 0.000 0.820 6531 A HN 0.585 nan 8.150 nan 0.000 0.451 6532 N N -0.522 118.151 118.700 -0.046 0.000 2.417 6532 N HA 0.417 5.156 4.740 -0.002 0.000 0.274 6532 N C -1.473 174.009 175.510 -0.047 0.000 0.987 6532 N CA -0.192 52.837 53.050 -0.035 0.000 0.912 6532 N CB 1.443 39.919 38.487 -0.018 0.000 1.177 6532 N HN 0.041 nan 8.380 nan 0.000 0.490 6533 T N 2.484 117.015 114.554 -0.039 0.000 3.053 6533 T HA 0.252 4.601 4.350 -0.002 0.000 0.363 6533 T C -0.548 174.130 174.700 -0.036 0.000 1.239 6533 T CA -0.725 61.349 62.100 -0.044 0.000 1.071 6533 T CB 0.418 69.277 68.868 -0.015 0.000 1.089 6533 T HN 0.428 nan 8.240 nan 0.000 0.527 6534 Q N 1.365 121.130 119.800 -0.059 0.000 2.418 6534 Q HA 0.870 5.209 4.340 -0.002 0.000 0.276 6534 Q C -0.338 175.584 176.000 -0.131 0.000 1.081 6534 Q CA -1.069 54.698 55.803 -0.060 0.000 0.864 6534 Q CB 0.754 29.468 28.738 -0.040 0.000 1.384 6534 Q HN 0.563 nan 8.270 nan 0.000 0.467 6535 A N -0.021 122.726 122.820 -0.122 0.000 2.286 6535 A HA 0.879 5.198 4.320 -0.002 0.000 0.286 6535 A C -0.562 176.866 177.584 -0.260 0.000 1.097 6535 A CA 0.324 52.237 52.037 -0.207 0.000 0.821 6535 A CB 0.435 19.385 19.000 -0.084 0.000 1.076 6535 A HN 0.851 nan 8.150 nan 0.000 0.490 6536 A N 0.140 122.671 122.820 -0.481 0.000 2.535 6536 A HA 0.817 5.136 4.320 -0.002 0.000 0.296 6536 A C -1.011 176.330 177.584 -0.404 0.000 1.248 6536 A CA -0.578 51.192 52.037 -0.445 0.000 0.686 6536 A CB 1.055 19.739 19.000 -0.527 0.000 1.315 6536 A HN 0.847 nan 8.150 nan 0.000 0.460 6537 Q N -0.668 119.058 119.800 -0.123 0.000 2.435 6537 Q HA 0.543 4.882 4.340 -0.002 0.000 0.282 6537 Q C -1.570 174.588 176.000 0.264 0.000 1.020 6537 Q CA -0.902 54.964 55.803 0.104 0.000 0.820 6537 Q CB 2.137 30.903 28.738 0.046 0.000 1.436 6537 Q HN 0.665 nan 8.270 nan 0.000 0.395 6538 K N 0.742 121.318 120.400 0.293 0.000 3.200 6538 K HA -0.170 4.148 4.320 -0.002 0.000 0.272 6538 K C -0.666 176.083 176.600 0.249 0.000 1.150 6538 K CA -0.058 56.367 56.287 0.229 0.000 0.801 6538 K CB -1.173 31.413 32.500 0.143 0.000 1.269 6538 K HN 0.529 nan 8.250 nan 0.000 0.500 6539 L N 2.051 123.441 121.223 0.278 0.000 2.601 6539 L HA -0.057 4.282 4.340 -0.002 0.000 0.277 6539 L C 0.648 177.538 176.870 0.033 0.000 1.219 6539 L CA 1.021 55.851 54.840 -0.016 0.000 0.915 6539 L CB 0.226 41.998 42.059 -0.478 0.000 1.160 6539 L HN 0.226 nan 8.230 nan 0.000 0.494 6540 K N 2.968 123.393 120.400 0.041 0.000 2.948 6540 K HA -0.320 3.999 4.320 -0.002 0.000 0.253 6540 K C 1.002 177.666 176.600 0.105 0.000 0.970 6540 K CA 1.181 57.516 56.287 0.080 0.000 0.716 6540 K CB -1.326 31.222 32.500 0.079 0.000 1.249 6540 K HN 0.876 nan 8.250 nan 0.000 0.483 6541 D N 0.905 121.367 120.400 0.103 0.000 2.133 6541 D HA -0.181 4.458 4.640 -0.002 0.000 0.195 6541 D C 1.509 177.864 176.300 0.091 0.000 0.997 6541 D CA 1.238 55.298 54.000 0.101 0.000 0.840 6541 D CB 0.435 41.290 40.800 0.091 0.000 0.947 6541 D HN 0.263 nan 8.370 nan 0.000 0.452 6542 K N 0.606 121.050 120.400 0.074 0.000 2.076 6542 K HA -0.071 4.248 4.320 -0.002 0.000 0.204 6542 K C 2.123 178.781 176.600 0.097 0.000 1.051 6542 K CA 0.670 56.990 56.287 0.055 0.000 0.949 6542 K CB -0.367 32.131 32.500 -0.003 0.000 0.726 6542 K HN 0.135 nan 8.250 nan 0.000 0.443 6543 E N 0.862 121.146 120.200 0.139 0.000 2.110 6543 E HA -0.115 4.234 4.350 -0.002 0.000 0.193 6543 E C 2.083 178.915 176.600 0.386 0.000 0.988 6543 E CA 0.752 57.324 56.400 0.287 0.000 0.804 6543 E CB -0.503 29.441 29.700 0.408 0.000 0.745 6543 E HN -0.067 nan 8.360 nan 0.000 0.458 6544 V N 1.255 121.331 119.914 0.270 0.000 2.233 6544 V HA -0.334 3.785 4.120 -0.002 0.000 0.247 6544 V C 2.274 178.479 176.094 0.185 0.000 1.050 6544 V CA 2.069 64.510 62.300 0.235 0.000 1.010 6544 V CB -1.033 30.885 31.823 0.158 0.000 0.637 6544 V HN 0.399 nan 8.190 nan 0.000 0.444 6545 A N -0.479 122.419 122.820 0.129 0.000 1.892 6545 A HA -0.288 4.031 4.320 -0.002 0.000 0.218 6545 A C 2.133 179.736 177.584 0.031 0.000 1.188 6545 A CA 2.351 54.434 52.037 0.076 0.000 0.631 6545 A CB -0.827 18.212 19.000 0.065 0.000 0.822 6545 A HN 0.552 nan 8.150 nan 0.000 0.447 6546 F N -0.860 119.021 119.950 -0.116 0.000 2.069 6546 F HA -0.200 4.326 4.527 -0.002 0.000 0.298 6546 F C 2.029 177.616 175.800 -0.356 0.000 1.113 6546 F CA 1.850 59.678 58.000 -0.288 0.000 1.214 6546 F CB -0.631 38.086 39.000 -0.470 0.000 0.978 6546 F HN 0.401 nan 8.300 nan 0.000 0.474 6547 W N 0.421 121.603 121.300 -0.196 0.000 2.379 6547 W HA -0.140 4.519 4.660 -0.002 0.000 0.307 6547 W C 2.618 178.938 176.519 -0.332 0.000 1.200 6547 W CA 1.675 58.768 57.345 -0.421 0.000 1.297 6547 W CB -1.137 28.207 29.460 -0.193 0.000 1.140 6547 W HN -0.173 nan 8.180 nan 0.000 0.507 6548 T N 0.180 114.794 114.554 0.099 0.000 2.778 6548 T HA -0.286 4.062 4.350 -0.002 0.000 0.269 6548 T C 1.296 176.005 174.700 0.015 0.000 1.050 6548 T CA 1.876 64.035 62.100 0.099 0.000 1.137 6548 T CB -0.493 68.430 68.868 0.091 0.000 0.860 6548 T HN 0.156 nan 8.240 nan 0.000 0.468 6549 N N 0.493 119.123 118.700 -0.116 0.000 2.132 6549 N HA 0.103 4.842 4.740 -0.002 0.000 0.187 6549 N C 1.735 177.138 175.510 -0.178 0.000 1.038 6549 N CA 0.655 53.617 53.050 -0.146 0.000 0.846 6549 N CB -0.416 37.952 38.487 -0.199 0.000 1.012 6549 N HN 0.245 nan 8.380 nan 0.000 0.429 6550 L N -0.373 120.608 121.223 -0.402 0.000 2.013 6550 L HA -0.161 4.178 4.340 -0.002 0.000 0.212 6550 L C 1.712 178.564 176.870 -0.030 0.000 1.073 6550 L CA 1.491 56.127 54.840 -0.340 0.000 0.753 6550 L CB -0.353 41.297 42.059 -0.682 0.000 0.890 6550 L HN 0.299 nan 8.230 nan 0.000 0.432 6551 F N -0.991 118.964 119.950 0.008 0.000 2.451 6551 F HA -0.107 4.419 4.527 -0.002 0.000 0.299 6551 F C 2.222 178.033 175.800 0.017 0.000 1.101 6551 F CA 0.121 58.148 58.000 0.045 0.000 1.436 6551 F CB -0.167 38.872 39.000 0.064 0.000 1.074 6551 F HN 0.198 nan 8.300 nan 0.000 0.553 6552 A N -0.197 122.725 122.820 0.170 0.000 2.278 6552 A HA 0.065 4.384 4.320 -0.002 0.000 0.212 6552 A C 0.939 178.560 177.584 0.062 0.000 1.213 6552 A CA 0.069 52.162 52.037 0.094 0.000 0.840 6552 A CB -0.273 18.760 19.000 0.055 0.000 0.866 6552 A HN 0.124 nan 8.150 nan 0.000 0.489 6553 K N 0.000 120.443 120.400 0.072 0.000 2.780 6553 K HA 0.000 4.319 4.320 -0.002 0.000 0.191 6553 K CA 0.000 56.317 56.287 0.050 0.000 0.838 6553 K CB 0.000 32.519 32.500 0.032 0.000 1.064 6553 K HN 0.000 nan 8.250 nan 0.000 0.543