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 1mx1_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 0.000 174.712 174.600 0.187 0.000 1.055 6022 S CA 0.000 58.287 58.200 0.144 0.000 1.107 6022 S CB 0.000 63.257 63.200 0.094 0.000 0.593 6023 P HA 0.330 nan 4.420 nan 0.000 0.265 6023 P C -2.646 174.554 177.300 -0.167 0.000 1.187 6023 P CA -0.461 62.574 63.100 -0.108 0.000 0.766 6023 P CB -0.659 30.986 31.700 -0.091 0.000 0.820 6024 P HA 0.114 nan 4.420 nan 0.000 0.276 6024 P C -0.955 176.347 177.300 0.003 0.000 1.235 6024 P CA 0.163 63.095 63.100 -0.280 0.000 0.772 6024 P CB 0.553 31.903 31.700 -0.584 0.000 0.871 6025 V N 5.018 124.990 119.914 0.097 0.000 2.407 6025 V HA 0.314 4.436 4.120 0.003 0.000 0.291 6025 V C 0.049 176.198 176.094 0.092 0.000 1.018 6025 V CA -0.590 61.793 62.300 0.137 0.000 0.842 6025 V CB 2.127 34.007 31.823 0.094 0.000 0.996 6025 V HN 0.235 nan 8.190 nan 0.000 0.426 6026 V N 3.189 123.137 119.914 0.057 0.000 2.715 6026 V HA 0.502 4.624 4.120 0.003 0.000 0.310 6026 V C -0.487 175.532 176.094 -0.125 0.000 1.054 6026 V CA -0.660 61.523 62.300 -0.196 0.000 0.928 6026 V CB 2.297 33.679 31.823 -0.736 0.000 1.007 6026 V HN 0.809 nan 8.190 nan 0.000 0.437 6027 D N 2.561 122.863 120.400 -0.163 0.000 2.329 6027 D HA 0.429 5.071 4.640 0.003 0.000 0.232 6027 D C 0.041 176.267 176.300 -0.125 0.000 1.088 6027 D CA 0.045 53.991 54.000 -0.090 0.000 0.835 6027 D CB 1.739 42.489 40.800 -0.083 0.000 1.078 6027 D HN 0.790 nan 8.370 nan 0.000 0.495 6028 T N -0.818 113.715 114.554 -0.034 0.000 2.937 6028 T HA 0.285 4.637 4.350 0.003 0.000 0.283 6028 T C 1.682 176.287 174.700 -0.158 0.000 1.012 6028 T CA -0.724 61.358 62.100 -0.030 0.000 0.997 6028 T CB 1.057 70.077 68.868 0.254 0.000 1.136 6028 T HN 0.023 nan 8.240 nan 0.000 0.551 6029 V N 1.134 120.891 119.914 -0.261 0.000 2.282 6029 V HA -0.185 3.937 4.120 0.003 0.000 0.249 6029 V C 2.428 178.282 176.094 -0.401 0.000 1.057 6029 V CA 1.826 63.904 62.300 -0.370 0.000 1.032 6029 V CB -1.125 30.376 31.823 -0.537 0.000 0.645 6029 V HN 0.873 nan 8.190 nan 0.000 0.447 6030 H N -0.214 118.685 119.070 -0.286 0.000 2.548 6030 H HA 0.454 5.012 4.556 0.003 0.000 0.265 6030 H C 0.961 175.555 175.328 -1.223 0.000 0.969 6030 H CA 0.893 56.574 56.048 -0.612 0.000 1.155 6030 H CB 0.359 29.791 29.762 -0.549 0.000 1.394 6030 H HN 0.551 nan 8.280 nan 0.000 0.570 6031 G N 0.048 108.365 108.800 -0.805 0.000 2.368 6031 G HA2 0.046 4.008 3.960 0.003 0.000 0.302 6031 G HA3 0.046 4.008 3.960 0.003 0.000 0.302 6031 G C -1.335 173.560 174.900 -0.008 0.000 1.329 6031 G CA -1.133 43.512 45.100 -0.759 0.000 0.935 6031 G HN 0.029 nan 8.290 nan 0.000 0.590 6032 K N -0.642 119.913 120.400 0.258 0.000 2.185 6032 K HA 0.622 4.944 4.320 0.003 0.000 0.271 6032 K C 0.193 177.123 176.600 0.549 0.000 1.013 6032 K CA -0.461 56.029 56.287 0.338 0.000 0.943 6032 K CB 1.830 34.469 32.500 0.230 0.000 0.998 6032 K HN 1.053 nan 8.250 nan 0.000 0.468 6033 V N 0.018 120.163 119.914 0.384 0.000 2.789 6033 V HA 0.503 4.625 4.120 0.003 0.000 0.311 6033 V C -1.071 175.230 176.094 0.344 0.000 1.073 6033 V CA -1.119 61.406 62.300 0.374 0.000 0.921 6033 V CB 1.810 33.902 31.823 0.450 0.000 1.009 6033 V HN 0.600 nan 8.190 nan 0.000 0.426 6034 L N 4.215 125.591 121.223 0.255 0.000 2.305 6034 L HA 0.908 5.250 4.340 0.003 0.000 0.284 6034 L C 0.295 177.183 176.870 0.030 0.000 1.013 6034 L CA 0.559 55.487 54.840 0.146 0.000 0.819 6034 L CB 0.992 43.084 42.059 0.054 0.000 1.227 6034 L HN 1.067 nan 8.230 nan 0.000 0.417 6035 G N 4.942 113.603 108.800 -0.231 0.000 2.990 6035 G HA2 0.626 4.587 3.960 0.003 0.000 0.208 6035 G HA3 0.626 4.587 3.960 0.003 0.000 0.208 6035 G C -1.237 173.309 174.900 -0.589 0.000 1.334 6035 G CA -0.521 44.143 45.100 -0.727 0.000 1.024 6035 G HN 0.699 nan 8.290 nan 0.000 0.574 6036 K N -1.306 118.699 120.400 -0.659 0.000 2.508 6036 K HA 0.601 4.923 4.320 0.003 0.000 0.260 6036 K C -1.715 174.626 176.600 -0.432 0.000 0.949 6036 K CA -0.848 55.170 56.287 -0.447 0.000 0.834 6036 K CB 1.985 34.336 32.500 -0.248 0.000 1.365 6036 K HN 0.294 nan 8.250 nan 0.000 0.437 6037 F N 0.982 120.867 119.950 -0.108 0.000 2.385 6037 F HA 0.465 4.992 4.527 0.000 0.000 0.336 6037 F C -0.256 175.526 175.800 -0.030 0.000 1.100 6037 F CA -0.790 57.176 58.000 -0.056 0.000 1.116 6037 F CB 2.016 41.004 39.000 -0.020 0.000 1.166 6037 F HN 0.080 nan 8.300 nan 0.000 0.511 6038 V N 2.423 122.470 119.914 0.221 0.000 2.612 6038 V HA 0.258 4.380 4.120 0.003 0.000 0.301 6038 V C -0.631 175.539 176.094 0.128 0.000 1.059 6038 V CA -0.815 61.569 62.300 0.139 0.000 0.886 6038 V CB 1.781 33.671 31.823 0.112 0.000 1.007 6038 V HN 0.755 nan 8.190 nan 0.000 0.426 6039 S N 4.520 120.281 115.700 0.101 0.000 2.585 6039 S HA 0.752 5.224 4.470 0.003 0.000 0.277 6039 S C -0.593 174.065 174.600 0.097 0.000 1.241 6039 S CA -0.398 57.855 58.200 0.088 0.000 1.041 6039 S CB 1.536 64.778 63.200 0.070 0.000 0.987 6039 S HN 0.562 nan 8.310 nan 0.000 0.512 6040 L N 2.690 123.981 121.223 0.113 0.000 2.362 6040 L HA 0.448 4.790 4.340 0.003 0.000 0.275 6040 L C -0.324 176.689 176.870 0.238 0.000 0.998 6040 L CA -0.389 54.537 54.840 0.144 0.000 0.820 6040 L CB 1.313 43.402 42.059 0.050 0.000 1.270 6040 L HN 0.478 nan 8.230 nan 0.000 0.415 6041 E N 3.893 124.211 120.200 0.197 0.000 2.694 6041 E HA 0.200 4.552 4.350 0.003 0.000 0.250 6041 E C 0.953 177.648 176.600 0.157 0.000 0.963 6041 E CA 1.338 57.833 56.400 0.159 0.000 0.949 6041 E CB 0.197 29.982 29.700 0.143 0.000 0.911 6041 E HN 0.921 nan 8.360 nan 0.000 0.500 6042 G N 3.102 111.905 108.800 0.005 0.000 2.163 6042 G HA2 -0.244 3.718 3.960 0.003 0.000 0.213 6042 G HA3 -0.244 3.718 3.960 0.003 0.000 0.213 6042 G C -0.221 174.266 174.900 -0.687 0.000 0.991 6042 G CA -0.364 44.559 45.100 -0.295 0.000 0.653 6042 G HN 0.349 nan 8.290 nan 0.000 0.518 6043 F N -0.402 119.499 119.950 -0.082 0.000 2.557 6043 F HA 0.704 5.232 4.527 0.002 0.000 0.316 6043 F C 0.995 176.762 175.800 -0.055 0.000 1.141 6043 F CA -0.220 57.728 58.000 -0.087 0.000 0.922 6043 F CB 1.735 40.664 39.000 -0.117 0.000 1.194 6043 F HN 0.084 nan 8.300 nan 0.000 0.443 6044 A N 1.453 124.319 122.820 0.078 0.000 1.970 6044 A HA -0.053 4.269 4.320 0.003 0.000 0.216 6044 A C 1.044 178.646 177.584 0.030 0.000 1.170 6044 A CA 0.813 52.869 52.037 0.032 0.000 0.645 6044 A CB -0.274 18.725 19.000 -0.001 0.000 0.816 6044 A HN 0.635 nan 8.150 nan 0.000 0.447 6045 Q N 1.045 120.883 119.800 0.064 0.000 2.314 6045 Q HA 0.402 4.744 4.340 0.003 0.000 0.257 6045 Q C -2.815 173.202 176.000 0.028 0.000 0.975 6045 Q CA -2.433 53.386 55.803 0.026 0.000 0.933 6045 Q CB 0.514 29.282 28.738 0.050 0.000 1.195 6045 Q HN 0.171 nan 8.270 nan 0.000 0.426 6046 P HA 0.071 nan 4.420 nan 0.000 0.276 6046 P C -1.083 176.302 177.300 0.143 0.000 1.230 6046 P CA -0.344 62.759 63.100 0.005 0.000 0.776 6046 P CB 0.870 32.461 31.700 -0.183 0.000 0.888 6047 V N 2.798 122.822 119.914 0.184 0.000 2.530 6047 V HA 0.387 4.509 4.120 0.003 0.000 0.282 6047 V C 0.645 176.921 176.094 0.302 0.000 1.048 6047 V CA -0.403 62.031 62.300 0.224 0.000 0.997 6047 V CB 0.688 32.611 31.823 0.166 0.000 0.987 6047 V HN 0.655 nan 8.190 nan 0.000 0.477 6048 A N 6.989 129.992 122.820 0.304 0.000 2.276 6048 A HA 0.733 5.055 4.320 0.003 0.000 0.300 6048 A C -0.426 177.145 177.584 -0.023 0.000 1.235 6048 A CA -0.322 51.764 52.037 0.083 0.000 0.867 6048 A CB -0.029 19.114 19.000 0.240 0.000 1.137 6048 A HN 0.768 nan 8.150 nan 0.000 0.527 6049 I N 2.208 122.562 120.570 -0.360 0.000 2.404 6049 I HA 0.439 4.611 4.170 0.003 0.000 0.293 6049 I C -1.278 174.432 176.117 -0.680 0.000 0.992 6049 I CA -0.302 60.767 61.300 -0.385 0.000 1.149 6049 I CB 1.653 39.481 38.000 -0.285 0.000 1.315 6049 I HN 0.543 nan 8.210 nan 0.000 0.446 6050 F N 6.466 126.271 119.950 -0.243 0.000 2.499 6050 F HA 0.524 5.055 4.527 0.007 0.000 0.333 6050 F C -0.390 175.264 175.800 -0.244 0.000 1.138 6050 F CA -0.537 57.366 58.000 -0.161 0.000 0.945 6050 F CB 1.250 40.249 39.000 -0.001 0.000 1.181 6050 F HN 0.092 nan 8.300 nan 0.000 0.435 6051 L N 2.592 123.732 121.223 -0.139 0.000 2.317 6051 L HA 0.703 5.045 4.340 0.003 0.000 0.281 6051 L C 0.755 177.534 176.870 -0.152 0.000 1.024 6051 L CA -0.995 53.722 54.840 -0.204 0.000 0.810 6051 L CB 1.651 43.454 42.059 -0.427 0.000 1.240 6051 L HN 0.889 nan 8.230 nan 0.000 0.427 6052 G N 3.594 112.328 108.800 -0.109 0.000 2.298 6052 G HA2 -0.242 3.720 3.960 0.003 0.000 0.287 6052 G HA3 -0.242 3.720 3.960 0.003 0.000 0.287 6052 G C -0.281 174.624 174.900 0.009 0.000 1.075 6052 G CA -0.377 44.632 45.100 -0.152 0.000 0.960 6052 G HN 0.491 nan 8.290 nan 0.000 0.502 6053 I N 2.165 122.780 120.570 0.074 0.000 2.325 6053 I HA 0.245 4.417 4.170 0.003 0.000 0.291 6053 I C -1.482 174.672 176.117 0.061 0.000 1.019 6053 I CA -2.299 59.026 61.300 0.042 0.000 1.302 6053 I CB 1.450 39.399 38.000 -0.085 0.000 1.401 6053 I HN 0.025 nan 8.210 nan 0.000 0.485 6054 P HA 0.026 nan 4.420 nan 0.000 0.276 6054 P C -0.190 177.011 177.300 -0.164 0.000 1.243 6054 P CA -0.007 62.955 63.100 -0.230 0.000 0.768 6054 P CB 0.498 32.094 31.700 -0.174 0.000 0.856 6055 F N 1.633 121.402 119.950 -0.302 0.000 2.682 6055 F HA 0.726 5.255 4.527 0.002 0.000 0.308 6055 F C 0.099 175.909 175.800 0.017 0.000 1.093 6055 F CA -0.909 56.947 58.000 -0.240 0.000 1.244 6055 F CB 0.127 38.898 39.000 -0.382 0.000 1.052 6055 F HN 0.376 nan 8.300 nan 0.000 0.573 6056 A N 0.498 123.094 122.820 -0.374 0.000 2.599 6056 A HA 0.516 4.838 4.320 0.003 0.000 0.290 6056 A C -1.313 176.105 177.584 -0.276 0.000 1.101 6056 A CA -1.131 50.767 52.037 -0.231 0.000 0.674 6056 A CB 0.874 19.693 19.000 -0.302 0.000 1.277 6056 A HN 0.173 nan 8.150 nan 0.000 0.419 6057 K N 0.651 120.951 120.400 -0.166 0.000 2.298 6057 K HA 0.445 4.766 4.320 0.003 0.000 0.280 6057 K C -2.471 174.008 176.600 -0.202 0.000 1.032 6057 K CA -1.581 54.614 56.287 -0.154 0.000 0.958 6057 K CB 0.408 32.855 32.500 -0.089 0.000 0.978 6057 K HN 0.325 nan 8.250 nan 0.000 0.472 6058 P HA -0.026 nan 4.420 nan 0.000 0.260 6058 P C -2.394 174.812 177.300 -0.156 0.000 1.185 6058 P CA -0.815 62.166 63.100 -0.198 0.000 0.763 6058 P CB 0.216 31.831 31.700 -0.141 0.000 0.776 6059 P HA 0.040 nan 4.420 nan 0.000 0.232 6059 P C -0.678 176.534 177.300 -0.147 0.000 1.738 6059 P CA 0.482 63.490 63.100 -0.154 0.000 0.948 6059 P CB -0.035 31.571 31.700 -0.157 0.000 1.943 6060 L N -0.202 120.948 121.223 -0.122 0.000 2.344 6060 L HA 0.599 4.940 4.340 0.003 0.000 0.272 6060 L C 1.597 178.409 176.870 -0.097 0.000 1.035 6060 L CA -0.258 54.521 54.840 -0.103 0.000 0.807 6060 L CB 0.950 42.961 42.059 -0.081 0.000 1.237 6060 L HN 0.295 nan 8.230 nan 0.000 0.442 6061 G N 2.111 110.857 108.800 -0.090 0.000 2.596 6061 G HA2 -0.283 3.679 3.960 0.003 0.000 0.304 6061 G HA3 -0.283 3.679 3.960 0.003 0.000 0.304 6061 G C -1.333 173.514 174.900 -0.090 0.000 1.189 6061 G CA 0.279 45.333 45.100 -0.078 0.000 0.986 6061 G HN 0.601 nan 8.290 nan 0.000 0.548 6062 P HA 0.061 nan 4.420 nan 0.000 0.223 6062 P C 2.074 179.326 177.300 -0.080 0.000 1.151 6062 P CA 1.350 64.422 63.100 -0.047 0.000 0.787 6062 P CB -0.105 31.584 31.700 -0.018 0.000 0.788 6063 L N -1.023 120.136 121.223 -0.108 0.000 2.465 6063 L HA 0.035 4.377 4.340 0.003 0.000 0.224 6063 L C 1.836 178.562 176.870 -0.240 0.000 1.145 6063 L CA 0.057 54.811 54.840 -0.144 0.000 0.834 6063 L CB -0.518 41.468 42.059 -0.121 0.000 0.944 6063 L HN -0.039 nan 8.230 nan 0.000 0.451 6064 R N 0.578 120.905 120.500 -0.289 0.000 2.537 6064 R HA -0.029 4.313 4.340 0.003 0.000 0.280 6064 R C -0.227 175.721 176.300 -0.587 0.000 1.058 6064 R CA -0.093 55.685 56.100 -0.536 0.000 1.057 6064 R CB 0.229 30.135 30.300 -0.656 0.000 0.973 6064 R HN 0.059 nan 8.270 nan 0.000 0.438 6065 F N 0.031 119.640 119.950 -0.569 0.000 3.043 6065 F HA -0.259 4.270 4.527 0.004 0.000 0.290 6065 F C 0.009 174.924 175.800 -1.475 0.000 0.844 6065 F CA 1.340 58.705 58.000 -1.059 0.000 1.184 6065 F CB -2.592 36.197 39.000 -0.352 0.000 1.246 6065 F HN 0.658 nan 8.300 nan 0.000 0.536 6066 T N -2.507 111.397 114.554 -1.084 0.000 2.896 6066 T HA 0.782 5.134 4.350 0.003 0.000 0.297 6066 T C -2.863 171.641 174.700 -0.327 0.000 1.108 6066 T CA -2.214 59.478 62.100 -0.681 0.000 1.004 6066 T CB 3.609 72.326 68.868 -0.253 0.000 1.159 6066 T HN -0.145 nan 8.240 nan 0.000 0.499 6067 P HA 0.237 nan 4.420 nan 0.000 0.268 6067 P C -2.473 174.891 177.300 0.107 0.000 1.208 6067 P CA -1.056 62.186 63.100 0.237 0.000 0.777 6067 P CB -0.697 31.157 31.700 0.258 0.000 0.875 6068 P HA 0.095 nan 4.420 nan 0.000 0.271 6068 P C -0.463 176.887 177.300 0.083 0.000 1.216 6068 P CA 0.298 63.451 63.100 0.088 0.000 0.776 6068 P CB 0.801 32.592 31.700 0.152 0.000 0.881 6069 Q N 3.229 123.051 119.800 0.036 0.000 2.257 6069 Q HA 0.412 4.753 4.340 0.003 0.000 0.262 6069 Q C -2.076 173.955 176.000 0.051 0.000 0.997 6069 Q CA -2.196 53.633 55.803 0.043 0.000 0.873 6069 Q CB 1.223 29.967 28.738 0.010 0.000 1.312 6069 Q HN 0.420 nan 8.270 nan 0.000 0.450 6070 P HA -0.005 nan 4.420 nan 0.000 0.269 6070 P C -0.986 176.313 177.300 -0.001 0.000 1.209 6070 P CA 0.112 63.279 63.100 0.112 0.000 0.776 6070 P CB 0.555 32.346 31.700 0.152 0.000 0.876 6071 A N 2.418 125.220 122.820 -0.029 0.000 2.425 6071 A HA 0.132 4.454 4.320 0.003 0.000 0.242 6071 A C 0.457 177.845 177.584 -0.326 0.000 1.077 6071 A CA 0.040 52.001 52.037 -0.127 0.000 0.781 6071 A CB -0.349 18.662 19.000 0.018 0.000 1.020 6071 A HN 0.514 nan 8.150 nan 0.000 0.494 6072 E N 1.518 121.633 120.200 -0.142 0.000 2.301 6072 E HA 0.421 4.773 4.350 0.003 0.000 0.275 6072 E C -2.117 174.446 176.600 -0.062 0.000 1.030 6072 E CA -1.701 54.629 56.400 -0.117 0.000 0.852 6072 E CB 0.636 30.326 29.700 -0.016 0.000 1.060 6072 E HN 0.483 nan 8.360 nan 0.000 0.401 6073 P HA 0.091 nan 4.420 nan 0.000 0.272 6073 P C -1.011 176.308 177.300 0.032 0.000 1.223 6073 P CA -0.231 62.771 63.100 -0.162 0.000 0.784 6073 P CB 0.303 31.916 31.700 -0.144 0.000 0.923 6074 W N 0.207 121.533 121.300 0.043 0.000 2.706 6074 W HA 0.604 5.268 4.660 0.005 0.000 0.346 6074 W C 0.717 177.209 176.519 -0.044 0.000 1.071 6074 W CA -0.690 56.666 57.345 0.019 0.000 1.206 6074 W CB -0.158 29.340 29.460 0.063 0.000 1.413 6074 W HN 0.132 nan 8.180 nan 0.000 0.542 6075 S N 0.534 116.280 115.700 0.077 0.000 2.362 6075 S HA 0.018 4.489 4.470 0.003 0.000 0.221 6075 S C 0.660 174.971 174.600 -0.481 0.000 1.032 6075 S CA 0.889 58.894 58.200 -0.325 0.000 0.973 6075 S CB -0.313 62.525 63.200 -0.603 0.000 0.849 6075 S HN 0.451 nan 8.310 nan 0.000 0.465 6076 F N 0.326 120.417 119.950 0.234 0.000 3.034 6076 F HA 0.456 4.985 4.527 0.004 0.000 0.165 6076 F C 0.108 176.072 175.800 0.273 0.000 1.484 6076 F CA -0.963 57.151 58.000 0.191 0.000 0.903 6076 F CB -0.335 38.740 39.000 0.125 0.000 2.041 6076 F HN -0.283 nan 8.300 nan 0.000 0.436 6077 V N 1.221 121.403 119.914 0.448 0.000 2.347 6077 V HA 0.254 4.376 4.120 0.003 0.000 0.280 6077 V C -0.279 175.944 176.094 0.214 0.000 1.021 6077 V CA -1.116 61.373 62.300 0.316 0.000 0.847 6077 V CB 0.867 32.815 31.823 0.209 0.000 0.990 6077 V HN 0.373 nan 8.190 nan 0.000 0.444 6078 K N 4.294 124.784 120.400 0.150 0.000 2.297 6078 K HA 0.178 4.500 4.320 0.003 0.000 0.286 6078 K C 0.164 176.740 176.600 -0.040 0.000 1.053 6078 K CA -0.453 55.758 56.287 -0.127 0.000 0.940 6078 K CB 0.462 32.585 32.500 -0.629 0.000 1.019 6078 K HN 0.661 nan 8.250 nan 0.000 0.475 6079 N N 3.235 121.896 118.700 -0.066 0.000 2.405 6079 N HA 0.070 4.812 4.740 0.003 0.000 0.260 6079 N C -1.198 174.260 175.510 -0.086 0.000 1.152 6079 N CA 0.009 53.025 53.050 -0.056 0.000 0.948 6079 N CB 1.059 39.505 38.487 -0.068 0.000 1.111 6079 N HN 0.614 nan 8.380 nan 0.000 0.485 6080 A N 3.029 125.822 122.820 -0.045 0.000 3.232 6080 A HA 0.243 4.565 4.320 0.003 0.000 0.312 6080 A C 0.794 178.295 177.584 -0.139 0.000 1.185 6080 A CA -0.493 51.511 52.037 -0.056 0.000 1.011 6080 A CB -0.536 18.527 19.000 0.106 0.000 1.096 6080 A HN 0.639 nan 8.150 nan 0.000 0.543 6081 T N -2.784 111.660 114.554 -0.184 0.000 3.231 6081 T HA 0.350 4.702 4.350 0.003 0.000 0.292 6081 T C 0.264 174.793 174.700 -0.285 0.000 1.001 6081 T CA 0.402 62.358 62.100 -0.240 0.000 0.920 6081 T CB -0.548 68.205 68.868 -0.192 0.000 1.140 6081 T HN 0.725 nan 8.240 nan 0.000 0.525 6082 S N 0.500 116.025 115.700 -0.292 0.000 2.538 6082 S HA 0.679 5.151 4.470 0.003 0.000 0.288 6082 S C -0.910 173.489 174.600 -0.334 0.000 1.108 6082 S CA -0.921 57.105 58.200 -0.289 0.000 0.971 6082 S CB 0.746 63.844 63.200 -0.169 0.000 1.041 6082 S HN 0.209 nan 8.310 nan 0.000 0.483 6083 Y N 3.151 123.383 120.300 -0.113 0.000 2.712 6083 Y HA 0.243 4.792 4.550 -0.001 0.000 0.333 6083 Y C -1.412 174.380 175.900 -0.180 0.000 1.225 6083 Y CA -0.700 57.330 58.100 -0.117 0.000 1.499 6083 Y CB 0.054 38.465 38.460 -0.082 0.000 1.288 6083 Y HN 0.529 nan 8.280 nan 0.000 0.575 6084 P HA 0.195 nan 4.420 nan 0.000 0.278 6084 P C -2.677 174.545 177.300 -0.129 0.000 1.258 6084 P CA -1.785 61.146 63.100 -0.281 0.000 0.811 6084 P CB 0.818 32.251 31.700 -0.446 0.000 1.063 6085 P HA 0.180 nan 4.420 nan 0.000 0.274 6085 P C -0.122 177.145 177.300 -0.056 0.000 1.237 6085 P CA -0.093 62.954 63.100 -0.088 0.000 0.793 6085 P CB 0.460 32.105 31.700 -0.093 0.000 0.977 6086 M N 0.047 119.600 119.600 -0.079 0.000 2.342 6086 M HA 0.424 4.906 4.480 0.003 0.000 0.332 6086 M C -0.379 175.846 176.300 -0.124 0.000 1.166 6086 M CA -0.548 54.699 55.300 -0.089 0.000 1.086 6086 M CB 0.369 32.899 32.600 -0.117 0.000 1.541 6086 M HN 0.098 nan 8.290 nan 0.000 0.462 6087 c N 1.856 120.373 118.600 -0.137 0.000 2.665 6087 c HA 0.128 4.700 4.570 0.003 0.000 0.416 6087 c C 0.897 174.808 174.090 -0.298 0.000 1.305 6087 c CA -0.222 55.976 56.329 -0.219 0.000 1.903 6087 c CB -0.408 41.989 42.510 -0.187 0.000 2.704 6087 c HN 0.867 nan 8.230 nan 0.000 0.629 6088 T N 4.470 118.706 114.554 -0.530 0.000 2.849 6088 T HA 0.266 4.618 4.350 0.003 0.000 0.289 6088 T C -0.010 174.445 174.700 -0.409 0.000 1.010 6088 T CA 0.479 62.191 62.100 -0.647 0.000 1.161 6088 T CB -0.218 67.813 68.868 -1.395 0.000 0.989 6088 T HN 0.885 nan 8.240 nan 0.000 0.523 6089 Q N 1.083 120.786 119.800 -0.162 0.000 2.756 6089 Q HA 0.290 4.632 4.340 0.003 0.000 0.295 6089 Q C -1.614 174.410 176.000 0.040 0.000 0.903 6089 Q CA -1.164 54.650 55.803 0.018 0.000 0.768 6089 Q CB 0.943 29.681 28.738 -0.000 0.000 1.472 6089 Q HN 0.416 nan 8.270 nan 0.000 0.416 6090 D N 2.286 122.738 120.400 0.086 0.000 2.426 6090 D HA 0.010 4.652 4.640 0.003 0.000 0.261 6090 D C -1.202 175.108 176.300 0.018 0.000 1.245 6090 D CA -1.040 52.999 54.000 0.066 0.000 0.917 6090 D CB 1.054 41.901 40.800 0.077 0.000 1.123 6090 D HN 0.327 nan 8.370 nan 0.000 0.508 6091 P HA -0.163 nan 4.420 nan 0.000 0.218 6091 P C 0.933 178.220 177.300 -0.022 0.000 1.148 6091 P CA 1.124 64.212 63.100 -0.021 0.000 0.822 6091 P CB 0.456 32.144 31.700 -0.021 0.000 0.784 6092 K N -0.033 120.361 120.400 -0.010 0.000 2.044 6092 K HA 0.049 4.371 4.320 0.003 0.000 0.204 6092 K C 2.427 179.015 176.600 -0.020 0.000 1.049 6092 K CA 1.232 57.510 56.287 -0.014 0.000 0.945 6092 K CB -0.536 31.961 32.500 -0.005 0.000 0.724 6092 K HN 0.003 nan 8.250 nan 0.000 0.440 6093 A N 1.328 124.140 122.820 -0.013 0.000 1.969 6093 A HA -0.062 4.260 4.320 0.003 0.000 0.218 6093 A C 2.357 179.914 177.584 -0.046 0.000 1.169 6093 A CA 1.805 53.828 52.037 -0.024 0.000 0.635 6093 A CB -1.020 17.979 19.000 -0.001 0.000 0.810 6093 A HN 0.419 nan 8.150 nan 0.000 0.445 6094 G N -0.872 107.903 108.800 -0.042 0.000 2.402 6094 G HA2 -0.234 3.728 3.960 0.003 0.000 0.216 6094 G HA3 -0.234 3.728 3.960 0.003 0.000 0.216 6094 G C 1.628 176.477 174.900 -0.085 0.000 1.162 6094 G CA 1.019 46.079 45.100 -0.066 0.000 0.777 6094 G HN 0.617 nan 8.290 nan 0.000 0.539 6095 Q N -0.506 119.253 119.800 -0.069 0.000 2.079 6095 Q HA -0.048 4.294 4.340 0.003 0.000 0.200 6095 Q C 2.442 178.404 176.000 -0.063 0.000 0.974 6095 Q CA 1.126 56.887 55.803 -0.070 0.000 0.840 6095 Q CB -0.218 28.489 28.738 -0.053 0.000 0.898 6095 Q HN 0.373 nan 8.270 nan 0.000 0.430 6096 L N 0.703 121.895 121.223 -0.052 0.000 1.989 6096 L HA -0.189 4.153 4.340 0.003 0.000 0.211 6096 L C 2.239 179.070 176.870 -0.065 0.000 1.071 6096 L CA 1.623 56.440 54.840 -0.039 0.000 0.749 6096 L CB -0.883 41.155 42.059 -0.035 0.000 0.890 6096 L HN 0.404 nan 8.230 nan 0.000 0.431 6097 L N -0.963 120.187 121.223 -0.123 0.000 2.043 6097 L HA -0.224 4.118 4.340 0.003 0.000 0.212 6097 L C 2.707 179.449 176.870 -0.213 0.000 1.075 6097 L CA 2.199 56.895 54.840 -0.240 0.000 0.752 6097 L CB -1.052 40.840 42.059 -0.280 0.000 0.891 6097 L HN 0.489 nan 8.230 nan 0.000 0.432 6098 S N -1.049 114.559 115.700 -0.153 0.000 2.368 6098 S HA -0.222 4.250 4.470 0.003 0.000 0.225 6098 S C 1.933 176.474 174.600 -0.098 0.000 1.030 6098 S CA 1.549 59.655 58.200 -0.156 0.000 0.999 6098 S CB -0.280 62.821 63.200 -0.166 0.000 0.844 6098 S HN 0.619 nan 8.310 nan 0.000 0.459 6099 E N 0.218 120.388 120.200 -0.050 0.000 2.077 6099 E HA -0.087 4.265 4.350 0.003 0.000 0.193 6099 E C 2.001 178.661 176.600 0.099 0.000 0.989 6099 E CA 1.280 57.685 56.400 0.007 0.000 0.800 6099 E CB -0.158 29.553 29.700 0.018 0.000 0.746 6099 E HN 0.502 nan 8.360 nan 0.000 0.452 6100 L N -0.532 120.780 121.223 0.148 0.000 2.240 6100 L HA -0.070 4.272 4.340 0.003 0.000 0.211 6100 L C 1.757 178.957 176.870 0.549 0.000 1.106 6100 L CA 0.418 55.462 54.840 0.340 0.000 0.793 6100 L CB -0.006 42.254 42.059 0.336 0.000 0.927 6100 L HN 0.115 nan 8.230 nan 0.000 0.446 6101 F N -0.831 119.093 119.950 -0.043 0.000 2.678 6101 F HA 0.118 4.646 4.527 0.002 0.000 0.291 6101 F C 1.680 177.193 175.800 -0.478 0.000 1.123 6101 F CA -0.427 57.430 58.000 -0.238 0.000 1.395 6101 F CB -0.497 38.403 39.000 -0.167 0.000 1.121 6101 F HN -0.188 nan 8.300 nan 0.000 0.592 6102 T N 1.840 116.260 114.554 -0.224 0.000 2.932 6102 T HA -0.036 4.315 4.350 0.003 0.000 0.312 6102 T C 1.279 175.816 174.700 -0.271 0.000 1.071 6102 T CA -0.008 61.866 62.100 -0.376 0.000 1.128 6102 T CB 0.310 69.016 68.868 -0.271 0.000 0.984 6102 T HN 0.359 nan 8.240 nan 0.000 0.549 6103 N N 3.730 122.230 118.700 -0.333 0.000 2.236 6103 N HA 0.019 4.761 4.740 0.003 0.000 0.196 6103 N C 0.390 175.804 175.510 -0.159 0.000 1.114 6103 N CA -0.324 52.588 53.050 -0.230 0.000 0.859 6103 N CB 0.030 38.381 38.487 -0.226 0.000 0.982 6103 N HN 0.695 nan 8.380 nan 0.000 0.493 6104 R N 0.109 120.523 120.500 -0.143 0.000 2.532 6104 R HA 0.341 4.683 4.340 0.003 0.000 0.272 6104 R C 0.947 177.221 176.300 -0.044 0.000 1.032 6104 R CA -0.833 55.218 56.100 -0.082 0.000 1.089 6104 R CB 1.587 31.836 30.300 -0.085 0.000 1.098 6104 R HN -0.205 nan 8.270 nan 0.000 0.526 6105 K N 0.543 120.938 120.400 -0.010 0.000 2.034 6105 K HA -0.206 4.116 4.320 0.003 0.000 0.214 6105 K C -0.304 176.301 176.600 0.008 0.000 1.051 6105 K CA 1.844 58.140 56.287 0.015 0.000 0.931 6105 K CB 0.116 32.632 32.500 0.027 0.000 0.715 6105 K HN 0.690 nan 8.250 nan 0.000 0.446 6106 E N 0.678 120.870 120.200 -0.013 0.000 2.234 6106 E HA 0.134 4.486 4.350 0.003 0.000 0.266 6106 E C -1.288 175.277 176.600 -0.059 0.000 0.877 6106 E CA -0.630 55.756 56.400 -0.022 0.000 0.758 6106 E CB 1.540 31.231 29.700 -0.015 0.000 1.170 6106 E HN 0.213 nan 8.360 nan 0.000 0.415 6107 N N 3.481 122.144 118.700 -0.063 0.000 2.458 6107 N HA 0.025 4.767 4.740 0.003 0.000 0.258 6107 N C -0.616 174.817 175.510 -0.127 0.000 1.219 6107 N CA 0.259 53.246 53.050 -0.105 0.000 0.902 6107 N CB 0.583 39.019 38.487 -0.084 0.000 1.076 6107 N HN 0.451 nan 8.380 nan 0.000 0.455 6108 I N 4.594 125.046 120.570 -0.198 0.000 2.325 6108 I HA 0.223 4.395 4.170 0.003 0.000 0.291 6108 I C -1.998 174.004 176.117 -0.191 0.000 1.019 6108 I CA -1.989 59.173 61.300 -0.229 0.000 1.302 6108 I CB 1.419 39.156 38.000 -0.439 0.000 1.401 6108 I HN 0.369 nan 8.210 nan 0.000 0.485 6109 P HA 0.275 nan 4.420 nan 0.000 0.271 6109 P C -0.942 176.295 177.300 -0.105 0.000 1.220 6109 P CA 0.013 63.053 63.100 -0.100 0.000 0.768 6109 P CB 0.581 32.240 31.700 -0.068 0.000 0.848 6110 L N 2.472 123.634 121.223 -0.102 0.000 2.333 6110 L HA 0.549 4.891 4.340 0.003 0.000 0.269 6110 L C 0.437 177.260 176.870 -0.078 0.000 1.010 6110 L CA -1.206 53.579 54.840 -0.092 0.000 0.818 6110 L CB 1.773 43.766 42.059 -0.110 0.000 1.306 6110 L HN 0.129 nan 8.230 nan 0.000 0.430 6111 K N 1.101 121.457 120.400 -0.072 0.000 2.087 6111 K HA 0.641 4.963 4.320 0.003 0.000 0.255 6111 K C -0.893 175.654 176.600 -0.088 0.000 0.988 6111 K CA -0.226 56.017 56.287 -0.073 0.000 0.915 6111 K CB 1.016 33.474 32.500 -0.070 0.000 1.043 6111 K HN 0.361 nan 8.250 nan 0.000 0.457 6112 L N 0.690 121.856 121.223 -0.095 0.000 2.344 6112 L HA 0.624 4.965 4.340 0.003 0.000 0.272 6112 L C -0.122 176.665 176.870 -0.139 0.000 1.035 6112 L CA -0.596 54.168 54.840 -0.127 0.000 0.807 6112 L CB 1.805 43.787 42.059 -0.129 0.000 1.237 6112 L HN 0.583 nan 8.230 nan 0.000 0.442 6113 S N -0.161 115.427 115.700 -0.187 0.000 2.614 6113 S HA 0.142 4.614 4.470 0.003 0.000 0.280 6113 S C -0.114 174.327 174.600 -0.264 0.000 1.111 6113 S CA -0.600 57.489 58.200 -0.186 0.000 0.847 6113 S CB 1.297 64.431 63.200 -0.110 0.000 1.079 6113 S HN 0.754 nan 8.310 nan 0.000 0.452 6114 E N 0.821 120.857 120.200 -0.273 0.000 2.358 6114 E HA -0.013 4.338 4.350 0.003 0.000 0.195 6114 E C -0.310 176.171 176.600 -0.200 0.000 1.010 6114 E CA 0.332 56.537 56.400 -0.324 0.000 0.856 6114 E CB 0.130 29.678 29.700 -0.254 0.000 0.795 6114 E HN 0.471 nan 8.360 nan 0.000 0.504 6115 D N 0.497 120.823 120.400 -0.124 0.000 2.517 6115 D HA 0.009 4.651 4.640 0.003 0.000 0.220 6115 D C 0.045 176.385 176.300 0.067 0.000 1.158 6115 D CA -0.318 53.649 54.000 -0.054 0.000 0.992 6115 D CB -0.033 40.771 40.800 0.008 0.000 1.058 6115 D HN 0.170 nan 8.370 nan 0.000 0.516 6116 c N 1.953 120.527 118.600 -0.043 0.000 3.657 6116 c HA 0.380 4.952 4.570 0.003 0.000 0.291 6116 c C 0.858 174.920 174.090 -0.047 0.000 1.572 6116 c CA -0.658 55.714 56.329 0.072 0.000 1.818 6116 c CB -1.240 41.250 42.510 -0.033 0.000 2.903 6116 c HN 0.409 nan 8.230 nan 0.000 0.632 6117 L N 2.411 123.362 121.223 -0.453 0.000 2.376 6117 L HA 0.338 4.679 4.340 0.003 0.000 0.250 6117 L C -0.766 175.440 176.870 -1.107 0.000 1.335 6117 L CA 0.646 55.032 54.840 -0.756 0.000 1.214 6117 L CB -0.926 40.552 42.059 -0.968 0.000 1.395 6117 L HN 0.413 nan 8.230 nan 0.000 0.424 6118 Y N 1.723 121.932 120.300 -0.152 0.000 2.633 6118 Y HA 0.704 5.258 4.550 0.006 0.000 0.339 6118 Y C -0.109 175.920 175.900 0.214 0.000 1.045 6118 Y CA -1.259 56.829 58.100 -0.021 0.000 1.098 6118 Y CB 1.951 40.375 38.460 -0.060 0.000 1.296 6118 Y HN 0.150 nan 8.280 nan 0.000 0.494 6119 L N -0.290 121.095 121.223 0.270 0.000 2.424 6119 L HA 0.723 5.065 4.340 0.003 0.000 0.258 6119 L C -1.508 175.400 176.870 0.063 0.000 0.995 6119 L CA -1.215 53.717 54.840 0.153 0.000 0.821 6119 L CB 1.716 43.776 42.059 0.003 0.000 1.383 6119 L HN 0.408 nan 8.230 nan 0.000 0.410 6120 N N 1.893 120.656 118.700 0.105 0.000 2.361 6120 N HA 0.741 5.482 4.740 0.003 0.000 0.302 6120 N C -1.146 174.376 175.510 0.020 0.000 1.074 6120 N CA -0.232 52.842 53.050 0.039 0.000 0.850 6120 N CB 2.549 41.113 38.487 0.128 0.000 1.228 6120 N HN 0.691 nan 8.380 nan 0.000 0.491 6121 I N 1.661 122.154 120.570 -0.128 0.000 2.509 6121 I HA 0.326 4.498 4.170 0.003 0.000 0.293 6121 I C -1.135 174.886 176.117 -0.161 0.000 1.020 6121 I CA -0.791 60.482 61.300 -0.046 0.000 1.088 6121 I CB 1.339 39.241 38.000 -0.162 0.000 1.267 6121 I HN 0.331 nan 8.210 nan 0.000 0.430 6122 Y N 3.185 123.612 120.300 0.211 0.000 2.447 6122 Y HA 0.361 4.912 4.550 0.001 0.000 0.325 6122 Y C 0.314 176.344 175.900 0.216 0.000 0.976 6122 Y CA -0.746 57.478 58.100 0.208 0.000 1.280 6122 Y CB 1.863 40.424 38.460 0.168 0.000 1.104 6122 Y HN 0.379 nan 8.280 nan 0.000 0.486 6123 T N 4.989 119.757 114.554 0.358 0.000 2.779 6123 T HA 0.345 4.697 4.350 0.003 0.000 0.280 6123 T C -2.088 172.775 174.700 0.271 0.000 0.987 6123 T CA -2.345 59.946 62.100 0.319 0.000 0.966 6123 T CB 1.283 70.377 68.868 0.377 0.000 0.933 6123 T HN 0.354 nan 8.240 nan 0.000 0.442 6124 P HA 0.275 nan 4.420 nan 0.000 0.255 6124 P C 0.221 177.607 177.300 0.143 0.000 1.248 6124 P CA -0.168 63.017 63.100 0.142 0.000 0.807 6124 P CB 0.094 31.838 31.700 0.073 0.000 1.150 6125 A N 1.046 123.968 122.820 0.170 0.000 2.407 6125 A HA 0.180 4.502 4.320 0.003 0.000 0.248 6125 A C -0.064 177.617 177.584 0.162 0.000 1.082 6125 A CA -0.160 51.966 52.037 0.147 0.000 0.785 6125 A CB -0.342 18.746 19.000 0.146 0.000 1.020 6125 A HN 0.008 nan 8.150 nan 0.000 0.489 6126 D N 2.123 122.594 120.400 0.119 0.000 2.374 6126 D HA 0.247 4.889 4.640 0.003 0.000 0.240 6126 D C 0.798 177.170 176.300 0.121 0.000 1.229 6126 D CA -0.105 53.963 54.000 0.113 0.000 0.895 6126 D CB -0.074 40.765 40.800 0.066 0.000 1.046 6126 D HN 0.405 nan 8.370 nan 0.000 0.498 6127 L N 2.752 124.076 121.223 0.170 0.000 2.353 6127 L HA -0.113 4.229 4.340 0.003 0.000 0.220 6127 L C 2.408 179.332 176.870 0.090 0.000 1.133 6127 L CA 1.316 56.236 54.840 0.133 0.000 0.798 6127 L CB -0.762 41.400 42.059 0.171 0.000 0.922 6127 L HN 0.569 nan 8.230 nan 0.000 0.445 6128 T N -3.528 111.083 114.554 0.095 0.000 2.995 6128 T HA -0.042 4.309 4.350 0.003 0.000 0.269 6128 T C 1.092 175.817 174.700 0.042 0.000 1.091 6128 T CA 0.543 62.682 62.100 0.065 0.000 1.128 6128 T CB 0.130 69.035 68.868 0.062 0.000 0.891 6128 T HN 0.262 nan 8.240 nan 0.000 0.492 6129 K N 0.564 120.990 120.400 0.044 0.000 2.531 6129 K HA 0.566 4.888 4.320 0.003 0.000 0.265 6129 K C -0.668 175.948 176.600 0.026 0.000 1.045 6129 K CA -0.957 55.349 56.287 0.031 0.000 1.040 6129 K CB 0.829 33.348 32.500 0.031 0.000 1.436 6129 K HN 0.061 nan 8.250 nan 0.000 0.571 6130 K N 1.362 121.775 120.400 0.021 0.000 2.358 6130 K HA 0.352 4.674 4.320 0.003 0.000 0.260 6130 K C -1.196 175.418 176.600 0.024 0.000 0.956 6130 K CA -0.557 55.740 56.287 0.016 0.000 0.834 6130 K CB 1.349 33.853 32.500 0.006 0.000 1.102 6130 K HN 0.396 nan 8.250 nan 0.000 0.431 6131 N N 0.976 119.695 118.700 0.031 0.000 2.321 6131 N HA 0.441 5.183 4.740 0.003 0.000 0.290 6131 N C -1.034 174.498 175.510 0.038 0.000 1.212 6131 N CA -1.068 52.005 53.050 0.039 0.000 0.767 6131 N CB 1.686 40.208 38.487 0.060 0.000 1.494 6131 N HN 0.274 nan 8.380 nan 0.000 0.479 6132 R N 1.311 121.832 120.500 0.035 0.000 2.638 6132 R HA 0.300 4.642 4.340 0.003 0.000 0.261 6132 R C -1.008 175.312 176.300 0.033 0.000 1.515 6132 R CA -0.335 55.783 56.100 0.030 0.000 1.623 6132 R CB 0.248 30.554 30.300 0.009 0.000 1.347 6132 R HN 0.456 nan 8.270 nan 0.000 0.705 6133 L N 2.500 123.755 121.223 0.054 0.000 2.436 6133 L HA 0.352 4.694 4.340 0.003 0.000 0.265 6133 L C -1.699 175.205 176.870 0.057 0.000 1.168 6133 L CA -1.813 53.060 54.840 0.056 0.000 0.815 6133 L CB 0.266 42.371 42.059 0.077 0.000 1.109 6133 L HN -0.023 nan 8.230 nan 0.000 0.462 6134 P HA 0.061 nan 4.420 nan 0.000 0.269 6134 P C -0.853 176.494 177.300 0.079 0.000 1.209 6134 P CA -0.129 62.997 63.100 0.043 0.000 0.776 6134 P CB 0.996 32.705 31.700 0.016 0.000 0.876 6135 V N 4.126 124.102 119.914 0.103 0.000 2.483 6135 V HA 0.414 4.536 4.120 0.003 0.000 0.295 6135 V C 0.555 176.746 176.094 0.161 0.000 1.035 6135 V CA -0.442 61.947 62.300 0.147 0.000 0.896 6135 V CB 1.343 33.267 31.823 0.169 0.000 0.986 6135 V HN 0.482 nan 8.190 nan 0.000 0.447 6136 M N 4.440 124.163 119.600 0.204 0.000 2.085 6136 M HA 0.470 4.952 4.480 0.003 0.000 0.309 6136 M C -1.222 175.392 176.300 0.524 0.000 0.947 6136 M CA -0.560 54.897 55.300 0.262 0.000 0.918 6136 M CB 1.956 34.583 32.600 0.045 0.000 1.504 6136 M HN 0.367 nan 8.290 nan 0.000 0.420 6137 V N 3.518 123.749 119.914 0.528 0.000 2.350 6137 V HA 0.270 4.392 4.120 0.003 0.000 0.276 6137 V C -0.575 175.785 176.094 0.445 0.000 1.028 6137 V CA -0.532 62.026 62.300 0.431 0.000 0.860 6137 V CB 1.059 33.021 31.823 0.232 0.000 0.990 6137 V HN 0.840 nan 8.190 nan 0.000 0.453 6138 W N 7.180 128.525 121.300 0.075 0.000 2.338 6138 W HA 0.580 5.242 4.660 0.004 0.000 0.307 6138 W C -1.162 175.246 176.519 -0.184 0.000 1.167 6138 W CA -0.806 56.326 57.345 -0.356 0.000 1.208 6138 W CB 1.174 30.432 29.460 -0.337 0.000 1.228 6138 W HN 0.446 nan 8.180 nan 0.000 0.499 6139 I N 8.016 127.963 120.570 -1.039 0.000 2.359 6139 I HA 0.057 4.228 4.170 0.003 0.000 0.284 6139 I C 1.025 176.431 176.117 -1.186 0.000 1.018 6139 I CA -0.791 60.027 61.300 -0.803 0.000 1.173 6139 I CB 0.746 38.401 38.000 -0.575 0.000 1.326 6139 I HN 0.389 nan 8.210 nan 0.000 0.462 6140 H N 4.767 123.426 119.070 -0.685 0.000 2.757 6140 H HA 0.357 4.916 4.556 0.004 0.000 0.370 6140 H C 0.050 175.340 175.328 -0.063 0.000 1.172 6140 H CA -0.330 55.498 56.048 -0.366 0.000 1.426 6140 H CB 0.978 30.813 29.762 0.122 0.000 1.438 6140 H HN 0.616 nan 8.280 nan 0.000 0.612 6141 G N -1.315 107.614 108.800 0.215 0.000 2.583 6141 G HA2 0.459 4.421 3.960 0.003 0.000 0.280 6141 G HA3 0.459 4.421 3.960 0.003 0.000 0.280 6141 G C 0.353 175.461 174.900 0.346 0.000 1.376 6141 G CA -0.703 44.534 45.100 0.227 0.000 1.043 6141 G HN 1.205 nan 8.290 nan 0.000 0.538 6142 G N -2.854 106.082 108.800 0.227 0.000 2.207 6142 G HA2 0.401 4.363 3.960 0.003 0.000 0.193 6142 G HA3 0.401 4.363 3.960 0.003 0.000 0.193 6142 G C 1.063 176.024 174.900 0.102 0.000 1.050 6142 G CA 0.720 45.908 45.100 0.147 0.000 0.780 6142 G HN 2.320 nan 8.290 nan 0.000 0.504 6143 G N -0.032 108.824 108.800 0.095 0.000 2.212 6143 G HA2 -0.203 3.759 3.960 0.003 0.000 0.267 6143 G HA3 -0.203 3.759 3.960 0.003 0.000 0.267 6143 G C 1.169 176.050 174.900 -0.032 0.000 1.002 6143 G CA 0.863 45.980 45.100 0.030 0.000 0.729 6143 G HN 1.785 nan 8.290 nan 0.000 0.517 6144 L N -3.472 117.764 121.223 0.022 0.000 4.696 6144 L HA -0.271 4.071 4.340 0.003 0.000 0.425 6144 L C 2.000 178.919 176.870 0.083 0.000 1.115 6144 L CA 1.622 56.474 54.840 0.019 0.000 0.996 6144 L CB -1.411 40.409 42.059 -0.398 0.000 2.077 6144 L HN 0.435 nan 8.230 nan 0.000 0.792 6145 M N -1.371 118.269 119.600 0.067 0.000 2.638 6145 M HA 0.316 4.798 4.480 0.003 0.000 0.256 6145 M C 0.791 177.154 176.300 0.105 0.000 1.282 6145 M CA 1.138 56.490 55.300 0.086 0.000 1.155 6145 M CB 0.651 33.276 32.600 0.041 0.000 1.345 6145 M HN 0.220 nan 8.290 nan 0.000 0.523 6146 V N -2.836 117.129 119.914 0.086 0.000 3.165 6146 V HA 1.050 5.172 4.120 0.003 0.000 0.309 6146 V C -0.212 175.930 176.094 0.079 0.000 1.267 6146 V CA -0.324 62.008 62.300 0.052 0.000 1.067 6146 V CB 1.174 33.007 31.823 0.016 0.000 1.082 6146 V HN 0.491 nan 8.190 nan 0.000 0.451 6147 G N -0.897 107.891 108.800 -0.020 0.000 2.459 6147 G HA2 0.601 4.563 3.960 0.003 0.000 0.685 6147 G HA3 0.601 4.563 3.960 0.003 0.000 0.685 6147 G C -0.681 173.920 174.900 -0.498 0.000 1.303 6147 G CA -0.134 44.882 45.100 -0.141 0.000 0.907 6147 G HN 2.651 nan 8.290 nan 0.000 0.632 6148 A N -0.873 121.475 122.820 -0.787 0.000 2.604 6148 A HA 1.045 5.367 4.320 0.003 0.000 0.295 6148 A C 0.757 178.164 177.584 -0.294 0.000 1.067 6148 A CA 0.678 52.389 52.037 -0.543 0.000 0.683 6148 A CB 0.929 19.788 19.000 -0.236 0.000 1.281 6148 A HN 2.552 nan 8.150 nan 0.000 0.407 6149 A N 0.403 123.225 122.820 0.004 0.000 1.897 6149 A HA 0.124 4.446 4.320 0.003 0.000 0.215 6149 A C 2.003 179.745 177.584 0.264 0.000 1.181 6149 A CA 2.230 54.442 52.037 0.291 0.000 0.620 6149 A CB -0.842 18.352 19.000 0.322 0.000 0.821 6149 A HN 1.180 nan 8.150 nan 0.000 0.443 6150 S N -0.010 115.772 115.700 0.137 0.000 2.465 6150 S HA -0.123 4.348 4.470 0.003 0.000 0.241 6150 S C 1.781 176.303 174.600 -0.130 0.000 1.000 6150 S CA 1.528 59.775 58.200 0.077 0.000 0.964 6150 S CB -0.525 62.687 63.200 0.020 0.000 0.763 6150 S HN 0.689 nan 8.310 nan 0.000 0.512 6151 T N 0.719 115.155 114.554 -0.195 0.000 2.833 6151 T HA -0.054 4.297 4.350 0.003 0.000 0.269 6151 T C -0.051 174.227 174.700 -0.704 0.000 1.054 6151 T CA 1.000 62.809 62.100 -0.485 0.000 1.135 6151 T CB -0.217 68.256 68.868 -0.658 0.000 0.869 6151 T HN 0.416 nan 8.240 nan 0.000 0.466 6152 Y N 1.692 121.815 120.300 -0.295 0.000 2.385 6152 Y HA 0.428 4.981 4.550 0.004 0.000 0.341 6152 Y C 0.026 175.653 175.900 -0.455 0.000 0.965 6152 Y CA -2.062 55.671 58.100 -0.612 0.000 1.180 6152 Y CB 0.450 38.249 38.460 -1.101 0.000 1.139 6152 Y HN -0.105 nan 8.280 nan 0.000 0.502 6153 D N 2.467 122.674 120.400 -0.322 0.000 2.316 6153 D HA 0.172 4.813 4.640 0.003 0.000 0.245 6153 D C 0.944 176.990 176.300 -0.425 0.000 1.171 6153 D CA -0.057 53.777 54.000 -0.278 0.000 0.856 6153 D CB 1.537 42.266 40.800 -0.118 0.000 1.090 6153 D HN 0.860 nan 8.370 nan 0.000 0.476 6154 G N 3.594 111.731 108.800 -1.106 0.000 3.088 6154 G HA2 -0.057 3.905 3.960 0.003 0.000 0.212 6154 G HA3 -0.057 3.905 3.960 0.003 0.000 0.212 6154 G C 1.499 176.157 174.900 -0.404 0.000 1.173 6154 G CA -0.228 44.449 45.100 -0.705 0.000 0.779 6154 G HN 0.555 nan 8.290 nan 0.000 0.540 6155 L N 0.422 121.474 121.223 -0.287 0.000 1.990 6155 L HA -0.156 4.186 4.340 0.003 0.000 0.213 6155 L C 3.130 179.976 176.870 -0.039 0.000 1.072 6155 L CA 1.847 56.686 54.840 -0.003 0.000 0.755 6155 L CB -0.219 41.883 42.059 0.073 0.000 0.889 6155 L HN 0.332 nan 8.230 nan 0.000 0.432 6156 A N -0.593 122.217 122.820 -0.017 0.000 1.898 6156 A HA -0.238 4.084 4.320 0.003 0.000 0.216 6156 A C 2.083 179.646 177.584 -0.034 0.000 1.181 6156 A CA 1.725 53.768 52.037 0.009 0.000 0.620 6156 A CB -0.761 18.291 19.000 0.088 0.000 0.819 6156 A HN 0.457 nan 8.150 nan 0.000 0.442 6157 L N -0.239 120.949 121.223 -0.058 0.000 2.046 6157 L HA -0.025 4.317 4.340 0.003 0.000 0.208 6157 L C 2.637 179.476 176.870 -0.051 0.000 1.077 6157 L CA 2.174 56.962 54.840 -0.085 0.000 0.747 6157 L CB -0.864 41.113 42.059 -0.137 0.000 0.896 6157 L HN 0.339 nan 8.230 nan 0.000 0.432 6158 A N -0.363 122.441 122.820 -0.027 0.000 1.858 6158 A HA -0.098 4.223 4.320 0.003 0.000 0.216 6158 A C 2.454 179.983 177.584 -0.091 0.000 1.190 6158 A CA 2.008 54.049 52.037 0.008 0.000 0.617 6158 A CB -1.310 17.754 19.000 0.106 0.000 0.827 6158 A HN 0.569 nan 8.150 nan 0.000 0.443 6159 A N -1.461 121.213 122.820 -0.243 0.000 1.902 6159 A HA -0.181 4.141 4.320 0.003 0.000 0.217 6159 A C 2.104 179.206 177.584 -0.803 0.000 1.181 6159 A CA 1.587 53.257 52.037 -0.611 0.000 0.623 6159 A CB -0.899 17.517 19.000 -0.973 0.000 0.818 6159 A HN 0.696 nan 8.150 nan 0.000 0.443 6160 H N -0.870 117.852 119.070 -0.580 0.000 2.363 6160 H HA 0.002 4.559 4.556 0.002 0.000 0.301 6160 H C 1.176 176.471 175.328 -0.055 0.000 1.074 6160 H CA 1.476 57.386 56.048 -0.230 0.000 1.354 6160 H CB 0.231 29.849 29.762 -0.241 0.000 1.397 6160 H HN 0.427 nan 8.280 nan 0.000 0.516 6161 E N 0.383 120.607 120.200 0.041 0.000 2.481 6161 E HA -0.025 4.327 4.350 0.003 0.000 0.198 6161 E C 0.045 176.666 176.600 0.035 0.000 1.027 6161 E CA -0.198 56.227 56.400 0.042 0.000 0.900 6161 E CB -0.147 29.567 29.700 0.023 0.000 0.993 6161 E HN 0.421 nan 8.360 nan 0.000 0.482 6162 N N 0.574 119.287 118.700 0.021 0.000 2.727 6162 N HA -0.176 4.566 4.740 0.003 0.000 0.251 6162 N C -0.659 174.881 175.510 0.050 0.000 1.040 6162 N CA 0.392 53.465 53.050 0.038 0.000 0.712 6162 N CB -0.838 37.679 38.487 0.050 0.000 0.912 6162 N HN 0.028 nan 8.380 nan 0.000 0.545 6163 V N -2.805 117.143 119.914 0.056 0.000 3.040 6163 V HA 0.728 4.849 4.120 0.003 0.000 0.312 6163 V C 0.389 176.553 176.094 0.117 0.000 1.115 6163 V CA -0.926 61.419 62.300 0.075 0.000 0.998 6163 V CB 2.088 33.943 31.823 0.053 0.000 1.042 6163 V HN -0.104 nan 8.190 nan 0.000 0.433 6164 V N 2.997 122.998 119.914 0.144 0.000 2.432 6164 V HA 0.396 4.518 4.120 0.003 0.000 0.271 6164 V C 0.132 176.364 176.094 0.229 0.000 1.046 6164 V CA -0.209 62.209 62.300 0.197 0.000 0.945 6164 V CB 1.201 33.142 31.823 0.197 0.000 0.992 6164 V HN 0.726 nan 8.190 nan 0.000 0.471 6165 V N 6.292 126.382 119.914 0.294 0.000 2.370 6165 V HA 0.445 4.566 4.120 0.003 0.000 0.283 6165 V C -0.122 176.238 176.094 0.442 0.000 1.023 6165 V CA -0.463 62.055 62.300 0.364 0.000 0.857 6165 V CB 1.794 33.812 31.823 0.325 0.000 0.985 6165 V HN 0.611 nan 8.190 nan 0.000 0.443 6166 V N 4.169 124.328 119.914 0.408 0.000 2.409 6166 V HA 0.541 4.663 4.120 0.003 0.000 0.291 6166 V C 0.204 176.530 176.094 0.387 0.000 1.020 6166 V CA -0.513 61.994 62.300 0.345 0.000 0.848 6166 V CB 2.112 34.079 31.823 0.239 0.000 0.990 6166 V HN 0.980 nan 8.190 nan 0.000 0.430 6167 T N 3.593 118.382 114.554 0.392 0.000 2.770 6167 T HA 0.785 5.136 4.350 0.003 0.000 0.283 6167 T C -0.423 174.462 174.700 0.309 0.000 0.988 6167 T CA -0.495 61.851 62.100 0.409 0.000 0.957 6167 T CB 1.176 70.321 68.868 0.462 0.000 0.930 6167 T HN 0.660 nan 8.240 nan 0.000 0.443 6168 I N 0.373 121.104 120.570 0.268 0.000 2.822 6168 I HA 0.680 4.852 4.170 0.003 0.000 0.312 6168 I C -0.585 175.757 176.117 0.375 0.000 1.011 6168 I CA -1.248 60.194 61.300 0.237 0.000 1.105 6168 I CB 1.920 39.951 38.000 0.052 0.000 1.291 6168 I HN 0.557 nan 8.210 nan 0.000 0.474 6169 Q N 2.089 122.146 119.800 0.428 0.000 2.399 6169 Q HA 0.606 4.947 4.340 0.003 0.000 0.276 6169 Q C -1.869 174.421 176.000 0.483 0.000 1.098 6169 Q CA -0.785 55.260 55.803 0.404 0.000 0.827 6169 Q CB 2.779 31.677 28.738 0.268 0.000 1.386 6169 Q HN 0.720 nan 8.270 nan 0.000 0.443 6170 Y N -2.776 117.666 120.300 0.238 0.000 2.609 6170 Y HA 0.520 5.073 4.550 0.004 0.000 0.336 6170 Y C -1.064 174.909 175.900 0.122 0.000 1.129 6170 Y CA -1.473 56.732 58.100 0.175 0.000 1.040 6170 Y CB 0.775 39.301 38.460 0.111 0.000 1.310 6170 Y HN 0.401 nan 8.280 nan 0.000 0.460 6171 R N 1.971 122.563 120.500 0.153 0.000 2.522 6171 R HA 0.415 4.757 4.340 0.003 0.000 0.284 6171 R C -0.858 175.519 176.300 0.128 0.000 1.032 6171 R CA 0.050 56.195 56.100 0.074 0.000 1.049 6171 R CB 0.219 30.577 30.300 0.096 0.000 0.956 6171 R HN 0.653 nan 8.270 nan 0.000 0.422 6172 L N 1.406 122.728 121.223 0.164 0.000 2.304 6172 L HA 0.513 4.855 4.340 0.003 0.000 0.268 6172 L C 1.342 178.495 176.870 0.472 0.000 1.010 6172 L CA -0.488 54.545 54.840 0.322 0.000 0.813 6172 L CB 1.361 43.514 42.059 0.156 0.000 1.315 6172 L HN 0.882 nan 8.230 nan 0.000 0.445 6173 G N 0.453 109.526 108.800 0.455 0.000 2.627 6173 G HA2 -0.342 3.620 3.960 0.003 0.000 0.312 6173 G HA3 -0.342 3.620 3.960 0.003 0.000 0.312 6173 G C 0.826 175.967 174.900 0.401 0.000 1.299 6173 G CA 0.666 45.984 45.100 0.362 0.000 0.989 6173 G HN 0.659 nan 8.290 nan 0.000 0.547 6174 I N -0.450 120.277 120.570 0.262 0.000 2.208 6174 I HA -0.196 3.976 4.170 0.003 0.000 0.245 6174 I C 2.802 179.116 176.117 0.328 0.000 1.097 6174 I CA 2.241 63.646 61.300 0.174 0.000 1.363 6174 I CB -0.322 37.550 38.000 -0.213 0.000 1.051 6174 I HN 0.540 nan 8.210 nan 0.000 0.413 6175 W N 0.646 122.102 121.300 0.259 0.000 2.363 6175 W HA -0.092 4.571 4.660 0.005 0.000 0.296 6175 W C 2.370 178.990 176.519 0.169 0.000 1.212 6175 W CA 1.338 58.740 57.345 0.095 0.000 1.260 6175 W CB -0.846 28.590 29.460 -0.040 0.000 1.131 6175 W HN 0.236 nan 8.180 nan 0.000 0.530 6176 G N -2.276 106.735 108.800 0.351 0.000 2.887 6176 G HA2 0.032 3.994 3.960 0.003 0.000 0.211 6176 G HA3 0.032 3.994 3.960 0.003 0.000 0.211 6176 G C 0.664 175.156 174.900 -0.680 0.000 1.152 6176 G CA 0.111 45.143 45.100 -0.112 0.000 0.769 6176 G HN 0.131 nan 8.290 nan 0.000 0.541 6177 F N -0.987 119.180 119.950 0.363 0.000 2.899 6177 F HA 0.404 4.933 4.527 0.003 0.000 0.337 6177 F C 0.214 176.099 175.800 0.141 0.000 1.129 6177 F CA -1.734 56.340 58.000 0.123 0.000 1.128 6177 F CB 0.192 39.192 39.000 0.000 0.000 1.154 6177 F HN -0.005 nan 8.300 nan 0.000 0.531 6178 F N 2.236 122.381 119.950 0.325 0.000 2.578 6178 F HA 0.343 4.871 4.527 0.003 0.000 0.381 6178 F C 0.449 176.325 175.800 0.127 0.000 1.069 6178 F CA 0.347 58.443 58.000 0.160 0.000 1.231 6178 F CB 0.454 39.449 39.000 -0.009 0.000 1.086 6178 F HN -0.080 nan 8.300 nan 0.000 0.564 6179 S N 3.658 118.872 115.700 -0.811 0.000 2.571 6179 S HA 0.332 4.804 4.470 0.003 0.000 0.284 6179 S C 0.336 174.513 174.600 -0.704 0.000 1.128 6179 S CA -0.079 57.762 58.200 -0.597 0.000 0.970 6179 S CB 1.383 64.401 63.200 -0.304 0.000 1.039 6179 S HN 0.823 nan 8.310 nan 0.000 0.485 6180 T N 0.814 115.097 114.554 -0.452 0.000 3.086 6180 T HA 0.389 4.741 4.350 0.003 0.000 0.250 6180 T C 1.471 176.095 174.700 -0.127 0.000 1.074 6180 T CA 0.596 62.543 62.100 -0.254 0.000 0.988 6180 T CB -0.121 68.709 68.868 -0.065 0.000 0.988 6180 T HN 1.786 nan 8.240 nan 0.000 0.530 6181 G N 2.095 110.813 108.800 -0.136 0.000 2.184 6181 G HA2 -0.210 3.751 3.960 0.003 0.000 0.264 6181 G HA3 -0.210 3.751 3.960 0.003 0.000 0.264 6181 G C -0.260 174.609 174.900 -0.053 0.000 0.975 6181 G CA 0.433 45.480 45.100 -0.089 0.000 0.642 6181 G HN 0.956 nan 8.290 nan 0.000 0.536 6182 D N -2.088 118.293 120.400 -0.031 0.000 2.798 6182 D HA 0.460 5.101 4.640 0.003 0.000 0.308 6182 D C 1.264 177.544 176.300 -0.034 0.000 1.187 6182 D CA -0.063 53.923 54.000 -0.024 0.000 1.033 6182 D CB -0.247 40.557 40.800 0.008 0.000 1.445 6182 D HN 0.093 nan 8.370 nan 0.000 0.550 6183 E N -0.281 119.852 120.200 -0.112 0.000 2.401 6183 E HA -0.236 4.115 4.350 0.003 0.000 0.199 6183 E C 0.666 177.184 176.600 -0.137 0.000 1.023 6183 E CA 1.177 57.493 56.400 -0.140 0.000 0.859 6183 E CB -0.568 29.010 29.700 -0.204 0.000 0.780 6183 E HN 0.522 nan 8.360 nan 0.000 0.523 6184 H N 0.280 119.407 119.070 0.095 0.000 2.535 6184 H HA 0.182 4.740 4.556 0.003 0.000 0.273 6184 H C 0.323 175.762 175.328 0.185 0.000 0.983 6184 H CA 1.014 57.133 56.048 0.118 0.000 1.238 6184 H CB 0.571 30.387 29.762 0.089 0.000 1.412 6184 H HN 0.117 nan 8.280 nan 0.000 0.562 6185 S N -0.157 115.718 115.700 0.291 0.000 2.828 6185 S HA 0.176 4.647 4.470 0.003 0.000 0.149 6185 S C 0.790 175.539 174.600 0.248 0.000 0.924 6185 S CA -0.580 57.883 58.200 0.438 0.000 1.044 6185 S CB 0.177 63.588 63.200 0.352 0.000 1.595 6185 S HN 0.170 nan 8.310 nan 0.000 0.454 6186 R N 1.574 122.186 120.500 0.186 0.000 2.091 6186 R HA 0.158 4.500 4.340 0.003 0.000 0.238 6186 R C 1.436 177.518 176.300 -0.363 0.000 1.136 6186 R CA 1.418 57.449 56.100 -0.114 0.000 0.959 6186 R CB -0.266 29.957 30.300 -0.127 0.000 0.856 6186 R HN 0.889 nan 8.270 nan 0.000 0.437 6187 G N -0.719 107.553 108.800 -0.880 0.000 2.483 6187 G HA2 -0.201 3.761 3.960 0.003 0.000 0.521 6187 G HA3 -0.201 3.761 3.960 0.003 0.000 0.521 6187 G C -0.692 173.419 174.900 -1.315 0.000 1.278 6187 G CA -0.396 44.074 45.100 -1.051 0.000 0.965 6187 G HN 0.254 nan 8.290 nan 0.000 0.504 6188 N N -1.144 117.137 118.700 -0.698 0.000 2.714 6188 N HA -0.206 4.536 4.740 0.003 0.000 0.250 6188 N C 1.203 176.449 175.510 -0.439 0.000 1.117 6188 N CA 2.001 54.849 53.050 -0.337 0.000 0.719 6188 N CB -1.589 36.862 38.487 -0.060 0.000 1.081 6188 N HN 0.718 nan 8.380 nan 0.000 0.557 6189 W N 0.551 121.727 121.300 -0.207 0.000 2.338 6189 W HA -0.116 4.546 4.660 0.003 0.000 0.304 6189 W C 2.510 178.905 176.519 -0.207 0.000 1.212 6189 W CA 0.790 58.049 57.345 -0.144 0.000 1.264 6189 W CB -0.742 28.662 29.460 -0.094 0.000 1.142 6189 W HN 0.288 nan 8.180 nan 0.000 0.512 6190 G N 0.036 108.603 108.800 -0.389 0.000 2.440 6190 G HA2 -0.286 3.676 3.960 0.003 0.000 0.218 6190 G HA3 -0.286 3.676 3.960 0.003 0.000 0.218 6190 G C 1.222 176.089 174.900 -0.055 0.000 1.154 6190 G CA 1.448 46.430 45.100 -0.197 0.000 0.767 6190 G HN 0.296 nan 8.290 nan 0.000 0.552 6191 H N 0.301 119.383 119.070 0.020 0.000 2.389 6191 H HA 0.083 4.641 4.556 0.003 0.000 0.299 6191 H C 2.717 178.049 175.328 0.007 0.000 1.081 6191 H CA 0.793 56.837 56.048 -0.007 0.000 1.345 6191 H CB -0.304 29.467 29.762 0.015 0.000 1.393 6191 H HN 0.278 nan 8.280 nan 0.000 0.520 6192 L N 0.429 121.748 121.223 0.160 0.000 2.201 6192 L HA -0.142 4.200 4.340 0.003 0.000 0.212 6192 L C 1.954 178.935 176.870 0.185 0.000 1.105 6192 L CA 0.831 55.771 54.840 0.167 0.000 0.775 6192 L CB -0.167 42.019 42.059 0.211 0.000 0.913 6192 L HN 0.113 nan 8.230 nan 0.000 0.440 6193 D N -0.121 120.405 120.400 0.210 0.000 2.117 6193 D HA -0.170 4.472 4.640 0.003 0.000 0.198 6193 D C 2.267 178.685 176.300 0.196 0.000 0.982 6193 D CA 1.050 55.235 54.000 0.309 0.000 0.828 6193 D CB -0.092 40.930 40.800 0.371 0.000 0.967 6193 D HN 0.415 nan 8.370 nan 0.000 0.464 6194 Q N 0.321 120.163 119.800 0.070 0.000 2.084 6194 Q HA -0.087 4.255 4.340 0.003 0.000 0.202 6194 Q C 2.415 178.378 176.000 -0.062 0.000 0.978 6194 Q CA 0.838 56.597 55.803 -0.072 0.000 0.844 6194 Q CB -0.037 28.604 28.738 -0.161 0.000 0.898 6194 Q HN 0.127 nan 8.270 nan 0.000 0.426 6195 V N 1.127 121.051 119.914 0.018 0.000 2.343 6195 V HA -0.293 3.829 4.120 0.003 0.000 0.247 6195 V C 2.291 178.425 176.094 0.066 0.000 1.051 6195 V CA 1.828 64.157 62.300 0.048 0.000 1.036 6195 V CB -0.990 30.882 31.823 0.083 0.000 0.654 6195 V HN 0.428 nan 8.190 nan 0.000 0.451 6196 A N -0.100 122.786 122.820 0.110 0.000 1.940 6196 A HA -0.134 4.188 4.320 0.003 0.000 0.219 6196 A C 2.405 180.029 177.584 0.067 0.000 1.176 6196 A CA 2.117 54.265 52.037 0.184 0.000 0.631 6196 A CB -0.703 18.514 19.000 0.361 0.000 0.814 6196 A HN 0.580 nan 8.150 nan 0.000 0.446 6197 A N -0.323 122.298 122.820 -0.332 0.000 1.898 6197 A HA 0.013 4.335 4.320 0.003 0.000 0.216 6197 A C 2.142 179.673 177.584 -0.088 0.000 1.181 6197 A CA 1.372 53.025 52.037 -0.639 0.000 0.620 6197 A CB -0.538 17.859 19.000 -1.005 0.000 0.819 6197 A HN 0.468 nan 8.150 nan 0.000 0.442 6198 L N -1.295 119.911 121.223 -0.029 0.000 2.083 6198 L HA -0.143 4.199 4.340 0.003 0.000 0.209 6198 L C 2.802 179.742 176.870 0.118 0.000 1.083 6198 L CA 1.523 56.405 54.840 0.069 0.000 0.752 6198 L CB -0.432 41.671 42.059 0.073 0.000 0.899 6198 L HN 0.417 nan 8.230 nan 0.000 0.433 6199 R N -0.649 119.924 120.500 0.122 0.000 2.092 6199 R HA -0.224 4.117 4.340 0.003 0.000 0.231 6199 R C 2.223 178.611 176.300 0.147 0.000 1.119 6199 R CA 1.636 57.810 56.100 0.123 0.000 0.970 6199 R CB -0.324 30.055 30.300 0.132 0.000 0.864 6199 R HN 0.382 nan 8.270 nan 0.000 0.440 6200 W N 0.305 121.633 121.300 0.046 0.000 2.355 6200 W HA -0.207 4.455 4.660 0.004 0.000 0.309 6200 W C 1.718 178.269 176.519 0.054 0.000 1.206 6200 W CA 1.327 58.718 57.345 0.077 0.000 1.284 6200 W CB -0.298 29.232 29.460 0.116 0.000 1.145 6200 W HN -0.177 nan 8.180 nan 0.000 0.502 6201 V N 1.078 121.202 119.914 0.350 0.000 2.332 6201 V HA -0.364 3.758 4.120 0.003 0.000 0.248 6201 V C 2.554 178.649 176.094 0.002 0.000 1.055 6201 V CA 2.112 64.539 62.300 0.211 0.000 1.038 6201 V CB -1.012 30.958 31.823 0.244 0.000 0.651 6201 V HN 0.240 nan 8.190 nan 0.000 0.450 6202 Q N -0.192 119.619 119.800 0.018 0.000 2.084 6202 Q HA -0.201 4.141 4.340 0.003 0.000 0.202 6202 Q C 1.969 177.913 176.000 -0.093 0.000 0.978 6202 Q CA 1.710 57.509 55.803 -0.006 0.000 0.844 6202 Q CB -0.486 28.264 28.738 0.020 0.000 0.898 6202 Q HN 0.680 nan 8.270 nan 0.000 0.426 6203 D N -0.513 119.777 120.400 -0.184 0.000 2.323 6203 D HA -0.010 4.632 4.640 0.003 0.000 0.209 6203 D C 1.026 177.102 176.300 -0.374 0.000 0.973 6203 D CA 0.485 54.333 54.000 -0.254 0.000 0.874 6203 D CB 0.124 40.764 40.800 -0.267 0.000 0.930 6203 D HN 0.298 nan 8.370 nan 0.000 0.521 6204 N N -0.117 118.252 118.700 -0.552 0.000 2.239 6204 N HA 0.024 4.766 4.740 0.003 0.000 0.208 6204 N C 1.511 176.899 175.510 -0.204 0.000 1.200 6204 N CA -0.187 52.511 53.050 -0.586 0.000 0.895 6204 N CB 0.979 38.624 38.487 -1.402 0.000 1.085 6204 N HN -0.007 nan 8.380 nan 0.000 0.500 6205 I N 2.576 123.079 120.570 -0.113 0.000 2.567 6205 I HA -0.106 4.066 4.170 0.003 0.000 0.257 6205 I C 2.178 178.399 176.117 0.173 0.000 1.184 6205 I CA 0.568 61.952 61.300 0.141 0.000 1.451 6205 I CB -0.242 37.833 38.000 0.125 0.000 1.089 6205 I HN 0.057 nan 8.210 nan 0.000 0.441 6206 A N -1.003 121.847 122.820 0.050 0.000 1.972 6206 A HA -0.177 4.145 4.320 0.003 0.000 0.219 6206 A C 2.410 179.994 177.584 0.000 0.000 1.169 6206 A CA 1.958 54.009 52.037 0.023 0.000 0.635 6206 A CB -0.831 18.155 19.000 -0.024 0.000 0.810 6206 A HN 0.442 nan 8.150 nan 0.000 0.446 6207 S N -1.123 114.546 115.700 -0.051 0.000 2.481 6207 S HA 0.033 4.505 4.470 0.003 0.000 0.231 6207 S C 0.678 175.047 174.600 -0.385 0.000 0.996 6207 S CA 0.679 58.734 58.200 -0.241 0.000 0.942 6207 S CB -0.355 62.612 63.200 -0.388 0.000 0.768 6207 S HN 0.580 nan 8.310 nan 0.000 0.520 6208 F N 0.725 120.651 119.950 -0.040 0.000 2.641 6208 F HA 0.376 4.904 4.527 0.002 0.000 0.302 6208 F C 1.612 177.443 175.800 0.052 0.000 1.098 6208 F CA -0.141 57.850 58.000 -0.015 0.000 1.318 6208 F CB 0.024 39.008 39.000 -0.026 0.000 1.035 6208 F HN 0.214 nan 8.300 nan 0.000 0.551 6209 G N 0.512 109.399 108.800 0.145 0.000 2.136 6209 G HA2 -0.154 3.808 3.960 0.003 0.000 0.242 6209 G HA3 -0.154 3.808 3.960 0.003 0.000 0.242 6209 G C 0.500 175.476 174.900 0.127 0.000 0.989 6209 G CA -0.152 45.021 45.100 0.121 0.000 0.682 6209 G HN 0.753 nan 8.290 nan 0.000 0.522 6210 G N -0.750 108.136 108.800 0.144 0.000 2.434 6210 G HA2 0.524 4.485 3.960 0.003 0.000 0.330 6210 G HA3 0.524 4.485 3.960 0.003 0.000 0.330 6210 G C -0.406 174.542 174.900 0.081 0.000 1.155 6210 G CA -0.350 44.824 45.100 0.124 0.000 0.917 6210 G HN 0.438 nan 8.290 nan 0.000 0.493 6211 N N 1.332 120.070 118.700 0.063 0.000 2.500 6211 N HA 0.293 5.035 4.740 0.003 0.000 0.236 6211 N C -1.094 174.439 175.510 0.038 0.000 1.022 6211 N CA -2.484 50.583 53.050 0.029 0.000 0.935 6211 N CB 1.927 40.413 38.487 -0.002 0.000 1.147 6211 N HN 0.096 nan 8.380 nan 0.000 0.512 6212 P HA -0.056 nan 4.420 nan 0.000 0.223 6212 P C 0.927 178.288 177.300 0.101 0.000 1.144 6212 P CA 0.798 63.942 63.100 0.073 0.000 0.783 6212 P CB 0.150 31.872 31.700 0.035 0.000 0.771 6213 G N -0.837 107.944 108.800 -0.031 0.000 2.920 6213 G HA2 -0.023 3.939 3.960 0.003 0.000 0.208 6213 G HA3 -0.023 3.939 3.960 0.003 0.000 0.208 6213 G C 0.579 175.068 174.900 -0.684 0.000 1.159 6213 G CA 0.171 45.127 45.100 -0.241 0.000 0.784 6213 G HN 0.381 nan 8.290 nan 0.000 0.535 6214 S N 0.125 115.669 115.700 -0.261 0.000 2.293 6214 S HA 0.469 4.941 4.470 0.003 0.000 0.154 6214 S C -0.927 173.768 174.600 0.158 0.000 1.602 6214 S CA -0.445 57.664 58.200 -0.152 0.000 1.260 6214 S CB 0.437 63.566 63.200 -0.119 0.000 1.270 6214 S HN -0.063 nan 8.310 nan 0.000 0.416 6215 V N 3.529 123.734 119.914 0.485 0.000 2.370 6215 V HA 0.517 4.639 4.120 0.003 0.000 0.283 6215 V C 0.257 176.522 176.094 0.284 0.000 1.023 6215 V CA -0.386 62.109 62.300 0.324 0.000 0.857 6215 V CB 1.708 33.707 31.823 0.294 0.000 0.985 6215 V HN 0.674 nan 8.190 nan 0.000 0.443 6216 T N 6.615 121.292 114.554 0.205 0.000 2.771 6216 T HA 0.594 4.946 4.350 0.003 0.000 0.281 6216 T C -0.127 174.714 174.700 0.235 0.000 0.982 6216 T CA -0.157 62.052 62.100 0.182 0.000 0.978 6216 T CB 0.759 69.676 68.868 0.080 0.000 0.930 6216 T HN 0.614 nan 8.240 nan 0.000 0.447 6217 I N 1.862 122.543 120.570 0.185 0.000 2.359 6217 I HA 0.855 5.027 4.170 0.003 0.000 0.294 6217 I C -0.898 175.411 176.117 0.320 0.000 0.987 6217 I CA -1.020 60.381 61.300 0.169 0.000 1.225 6217 I CB 0.911 38.796 38.000 -0.192 0.000 1.366 6217 I HN 0.469 nan 8.210 nan 0.000 0.466 6218 F N 3.219 123.210 119.950 0.068 0.000 2.601 6218 F HA 1.014 5.543 4.527 0.003 0.000 0.309 6218 F C -0.417 175.332 175.800 -0.086 0.000 1.089 6218 F CA -1.406 56.668 58.000 0.124 0.000 0.940 6218 F CB 1.358 40.561 39.000 0.338 0.000 1.273 6218 F HN 0.835 nan 8.300 nan 0.000 0.450 6219 G N 1.407 110.037 108.800 -0.283 0.000 2.576 6219 G HA2 0.551 4.512 3.960 0.003 0.000 0.290 6219 G HA3 0.551 4.512 3.960 0.003 0.000 0.290 6219 G C -2.360 172.311 174.900 -0.383 0.000 1.442 6219 G CA -0.826 43.679 45.100 -0.991 0.000 0.792 6219 G HN 1.078 nan 8.290 nan 0.000 0.491 6220 E N -0.584 119.395 120.200 -0.369 0.000 2.312 6220 E HA 0.808 5.159 4.350 0.003 0.000 0.267 6220 E C 0.581 177.207 176.600 0.043 0.000 0.894 6220 E CA 0.044 56.445 56.400 0.002 0.000 0.773 6220 E CB 1.847 31.645 29.700 0.164 0.000 1.241 6220 E HN 1.109 nan 8.360 nan 0.000 0.432 6221 S N 0.903 116.690 115.700 0.145 0.000 4.069 6221 S HA -0.349 4.123 4.470 0.003 0.000 0.626 6221 S C 1.452 176.160 174.600 0.180 0.000 2.000 6221 S CA 1.767 60.149 58.200 0.304 0.000 4.174 6221 S CB -1.794 61.649 63.200 0.404 0.000 0.210 6221 S HN 1.455 nan 8.310 nan 0.000 0.602 6222 A N 0.822 123.729 122.820 0.144 0.000 2.019 6222 A HA 0.162 4.484 4.320 0.003 0.000 0.219 6222 A C 2.290 179.848 177.584 -0.044 0.000 1.164 6222 A CA 2.379 54.443 52.037 0.044 0.000 0.644 6222 A CB -1.359 17.666 19.000 0.042 0.000 0.805 6222 A HN 1.442 nan 8.150 nan 0.000 0.449 6223 G N -0.598 108.142 108.800 -0.099 0.000 2.408 6223 G HA2 0.078 4.040 3.960 0.003 0.000 0.217 6223 G HA3 0.078 4.040 3.960 0.003 0.000 0.217 6223 G C 1.458 176.213 174.900 -0.243 0.000 1.150 6223 G CA 1.112 46.037 45.100 -0.292 0.000 0.776 6223 G HN 0.648 nan 8.290 nan 0.000 0.542 6224 G N 0.231 108.962 108.800 -0.116 0.000 2.403 6224 G HA2 -0.127 3.835 3.960 0.003 0.000 0.216 6224 G HA3 -0.127 3.835 3.960 0.003 0.000 0.216 6224 G C 1.555 176.438 174.900 -0.028 0.000 1.154 6224 G CA 1.054 46.131 45.100 -0.038 0.000 0.784 6224 G HN 0.425 nan 8.290 nan 0.000 0.538 6225 E N 0.994 121.180 120.200 -0.025 0.000 2.106 6225 E HA -0.081 4.271 4.350 0.003 0.000 0.192 6225 E C 2.524 179.065 176.600 -0.099 0.000 0.984 6225 E CA 1.054 57.427 56.400 -0.045 0.000 0.806 6225 E CB -0.180 29.498 29.700 -0.037 0.000 0.750 6225 E HN 0.335 nan 8.360 nan 0.000 0.458 6226 S N 0.238 115.873 115.700 -0.109 0.000 2.356 6226 S HA -0.117 4.355 4.470 0.003 0.000 0.223 6226 S C 2.146 176.606 174.600 -0.233 0.000 1.032 6226 S CA 1.137 59.250 58.200 -0.146 0.000 1.005 6226 S CB -0.252 62.837 63.200 -0.184 0.000 0.867 6226 S HN 0.132 nan 8.310 nan 0.000 0.449 6227 V N 1.377 121.157 119.914 -0.223 0.000 2.332 6227 V HA -0.176 3.946 4.120 0.003 0.000 0.248 6227 V C 2.602 178.548 176.094 -0.246 0.000 1.055 6227 V CA 2.031 64.175 62.300 -0.260 0.000 1.038 6227 V CB -0.801 30.919 31.823 -0.171 0.000 0.651 6227 V HN 0.558 nan 8.190 nan 0.000 0.450 6228 S N -0.749 114.876 115.700 -0.126 0.000 2.382 6228 S HA -0.156 4.315 4.470 0.003 0.000 0.228 6228 S C 1.956 176.472 174.600 -0.141 0.000 1.027 6228 S CA 1.769 59.928 58.200 -0.069 0.000 0.991 6228 S CB -0.136 63.080 63.200 0.026 0.000 0.823 6228 S HN 0.331 nan 8.310 nan 0.000 0.469 6229 V N 2.035 121.827 119.914 -0.204 0.000 2.307 6229 V HA -0.116 4.005 4.120 0.003 0.000 0.245 6229 V C 2.374 178.333 176.094 -0.224 0.000 1.045 6229 V CA 1.811 63.954 62.300 -0.262 0.000 1.024 6229 V CB -0.660 30.878 31.823 -0.477 0.000 0.651 6229 V HN 0.478 nan 8.190 nan 0.000 0.449 6230 L N -0.525 120.553 121.223 -0.241 0.000 2.042 6230 L HA -0.171 4.171 4.340 0.003 0.000 0.210 6230 L C 2.477 179.346 176.870 -0.002 0.000 1.076 6230 L CA 1.112 55.855 54.840 -0.162 0.000 0.749 6230 L CB -0.788 41.083 42.059 -0.314 0.000 0.893 6230 L HN 0.181 nan 8.230 nan 0.000 0.432 6231 V N 0.216 120.082 119.914 -0.079 0.000 2.469 6231 V HA -0.265 3.857 4.120 0.003 0.000 0.251 6231 V C 2.071 178.236 176.094 0.117 0.000 1.064 6231 V CA 1.637 63.988 62.300 0.085 0.000 1.066 6231 V CB -0.303 31.386 31.823 -0.222 0.000 0.667 6231 V HN 0.398 nan 8.190 nan 0.000 0.461 6232 L N -0.949 120.258 121.223 -0.027 0.000 2.607 6232 L HA 0.194 4.536 4.340 0.003 0.000 0.228 6232 L C 1.062 177.786 176.870 -0.243 0.000 1.123 6232 L CA 0.117 54.865 54.840 -0.153 0.000 0.890 6232 L CB 0.167 42.130 42.059 -0.160 0.000 1.103 6232 L HN 0.188 nan 8.230 nan 0.000 0.468 6233 S N 0.774 116.436 115.700 -0.063 0.000 2.508 6233 S HA 0.321 4.793 4.470 0.003 0.000 0.284 6233 S C -1.464 173.229 174.600 0.156 0.000 1.192 6233 S CA -1.462 56.721 58.200 -0.027 0.000 1.070 6233 S CB 1.133 64.324 63.200 -0.014 0.000 1.004 6233 S HN -0.048 nan 8.310 nan 0.000 0.493 6234 P HA 0.031 nan 4.420 nan 0.000 0.233 6234 P C 1.240 178.650 177.300 0.184 0.000 1.167 6234 P CA 0.515 63.806 63.100 0.319 0.000 0.770 6234 P CB 0.111 31.946 31.700 0.225 0.000 0.837 6235 L N -0.672 120.626 121.223 0.125 0.000 2.313 6235 L HA 0.045 4.387 4.340 0.003 0.000 0.214 6235 L C 2.325 179.266 176.870 0.117 0.000 1.119 6235 L CA 1.120 56.020 54.840 0.100 0.000 0.809 6235 L CB -0.625 41.481 42.059 0.077 0.000 0.933 6235 L HN -0.053 nan 8.230 nan 0.000 0.449 6236 A N -1.094 121.825 122.820 0.165 0.000 2.308 6236 A HA 0.064 4.386 4.320 0.003 0.000 0.217 6236 A C 0.830 178.519 177.584 0.175 0.000 1.216 6236 A CA -0.212 51.965 52.037 0.232 0.000 0.864 6236 A CB -0.052 19.161 19.000 0.356 0.000 0.902 6236 A HN 0.081 nan 8.150 nan 0.000 0.499 6237 K N 1.684 122.144 120.400 0.100 0.000 2.511 6237 K HA -0.029 4.293 4.320 0.003 0.000 0.280 6237 K C -0.149 176.375 176.600 -0.128 0.000 1.008 6237 K CA 0.339 56.597 56.287 -0.048 0.000 1.050 6237 K CB 0.055 32.526 32.500 -0.049 0.000 0.889 6237 K HN 0.465 nan 8.250 nan 0.000 0.484 6238 N N 1.471 120.017 118.700 -0.256 0.000 2.828 6238 N HA -0.219 4.523 4.740 0.003 0.000 0.248 6238 N C 0.278 175.659 175.510 -0.215 0.000 1.044 6238 N CA 0.847 53.752 53.050 -0.241 0.000 0.851 6238 N CB -1.116 37.282 38.487 -0.148 0.000 1.136 6238 N HN 0.542 nan 8.380 nan 0.000 0.572 6239 L N -0.916 120.197 121.223 -0.184 0.000 2.616 6239 L HA 0.262 4.604 4.340 0.003 0.000 0.229 6239 L C 0.228 177.121 176.870 0.039 0.000 1.110 6239 L CA 0.190 55.031 54.840 0.001 0.000 0.884 6239 L CB -0.016 42.133 42.059 0.149 0.000 1.115 6239 L HN 0.173 nan 8.230 nan 0.000 0.481 6240 F N -4.238 115.497 119.950 -0.359 0.000 2.693 6240 F HA 0.442 4.971 4.527 0.003 0.000 0.309 6240 F C 0.276 175.689 175.800 -0.645 0.000 1.129 6240 F CA -1.013 56.745 58.000 -0.403 0.000 0.948 6240 F CB 0.782 39.699 39.000 -0.138 0.000 1.315 6240 F HN -0.112 nan 8.300 nan 0.000 0.447 6241 H N 0.016 119.140 119.070 0.090 0.000 3.058 6241 H HA 0.438 4.995 4.556 0.003 0.000 0.266 6241 H C -0.455 174.875 175.328 0.004 0.000 1.135 6241 H CA -0.185 55.845 56.048 -0.030 0.000 1.174 6241 H CB 0.824 30.565 29.762 -0.035 0.000 1.581 6241 H HN 0.504 nan 8.280 nan 0.000 0.553 6242 R N 0.463 121.091 120.500 0.214 0.000 2.629 6242 R HA 0.709 5.051 4.340 0.003 0.000 0.266 6242 R C -1.425 175.043 176.300 0.280 0.000 1.051 6242 R CA -0.761 55.413 56.100 0.122 0.000 0.895 6242 R CB 2.458 32.647 30.300 -0.185 0.000 1.246 6242 R HN 0.084 nan 8.270 nan 0.000 0.459 6243 A N 2.494 125.516 122.820 0.337 0.000 2.475 6243 A HA 0.820 5.142 4.320 0.003 0.000 0.301 6243 A C -0.998 176.812 177.584 0.378 0.000 1.059 6243 A CA -0.736 51.429 52.037 0.213 0.000 0.710 6243 A CB 1.387 20.282 19.000 -0.175 0.000 1.288 6243 A HN 0.618 nan 8.150 nan 0.000 0.408 6244 I N 1.324 122.057 120.570 0.272 0.000 2.512 6244 I HA 0.315 4.487 4.170 0.003 0.000 0.287 6244 I C -0.314 175.947 176.117 0.240 0.000 1.069 6244 I CA -0.281 61.127 61.300 0.181 0.000 1.056 6244 I CB 2.316 40.342 38.000 0.043 0.000 1.229 6244 I HN 0.484 nan 8.210 nan 0.000 0.429 6245 S N 5.128 120.944 115.700 0.193 0.000 2.474 6245 S HA 0.370 4.841 4.470 0.003 0.000 0.321 6245 S C -0.500 174.168 174.600 0.113 0.000 1.080 6245 S CA -0.602 57.680 58.200 0.137 0.000 1.106 6245 S CB 0.989 64.255 63.200 0.110 0.000 0.984 6245 S HN 0.478 nan 8.310 nan 0.000 0.464 6246 E N 1.831 122.141 120.200 0.182 0.000 2.092 6246 E HA 0.348 4.700 4.350 0.003 0.000 0.271 6246 E C -0.493 176.183 176.600 0.127 0.000 0.919 6246 E CA -0.524 56.019 56.400 0.239 0.000 0.760 6246 E CB 1.107 31.041 29.700 0.390 0.000 1.106 6246 E HN 0.612 nan 8.360 nan 0.000 0.408 6247 S N 2.055 117.799 115.700 0.074 0.000 3.572 6247 S HA -0.125 4.347 4.470 0.003 0.000 0.394 6247 S C 0.030 174.811 174.600 0.302 0.000 0.923 6247 S CA 0.568 58.812 58.200 0.074 0.000 1.291 6247 S CB -1.076 62.067 63.200 -0.095 0.000 0.914 6247 S HN 0.970 nan 8.310 nan 0.000 0.545 6248 G N -0.921 108.059 108.800 0.299 0.000 2.146 6248 G HA2 0.486 4.448 3.960 0.003 0.000 0.261 6248 G HA3 0.486 4.448 3.960 0.003 0.000 0.261 6248 G C -0.797 174.166 174.900 0.104 0.000 1.745 6248 G CA 0.066 45.336 45.100 0.284 0.000 0.905 6248 G HN 1.526 nan 8.290 nan 0.000 0.746 6249 V N -0.573 119.365 119.914 0.039 0.000 3.156 6249 V HA 0.949 5.071 4.120 0.003 0.000 0.310 6249 V C 1.337 177.403 176.094 -0.047 0.000 1.234 6249 V CA -0.010 62.290 62.300 0.001 0.000 1.065 6249 V CB 1.225 33.038 31.823 -0.017 0.000 1.088 6249 V HN 2.145 nan 8.190 nan 0.000 0.451 6250 A N -0.506 122.282 122.820 -0.052 0.000 2.216 6250 A HA 0.232 4.554 4.320 0.003 0.000 0.214 6250 A C 1.544 179.062 177.584 -0.111 0.000 1.160 6250 A CA 1.242 53.224 52.037 -0.091 0.000 0.725 6250 A CB -0.737 18.207 19.000 -0.093 0.000 0.784 6250 A HN 0.802 nan 8.150 nan 0.000 0.472 6251 L N -0.432 120.725 121.223 -0.111 0.000 2.607 6251 L HA 0.051 4.393 4.340 0.003 0.000 0.228 6251 L C 0.291 177.041 176.870 -0.201 0.000 1.123 6251 L CA 0.056 54.809 54.840 -0.145 0.000 0.890 6251 L CB -0.063 41.923 42.059 -0.122 0.000 1.103 6251 L HN 0.094 nan 8.230 nan 0.000 0.468 6252 T N 0.525 114.956 114.554 -0.206 0.000 3.474 6252 T HA -0.003 4.348 4.350 0.003 0.000 0.270 6252 T C 1.535 176.073 174.700 -0.271 0.000 1.079 6252 T CA 0.296 62.219 62.100 -0.295 0.000 1.110 6252 T CB 0.401 69.093 68.868 -0.293 0.000 1.087 6252 T HN 0.408 nan 8.240 nan 0.000 0.784 6253 S N 2.343 117.870 115.700 -0.288 0.000 2.428 6253 S HA -0.158 4.314 4.470 0.003 0.000 0.240 6253 S C 2.093 176.553 174.600 -0.234 0.000 1.036 6253 S CA 1.366 59.408 58.200 -0.263 0.000 1.009 6253 S CB -0.579 62.435 63.200 -0.310 0.000 0.803 6253 S HN 0.501 nan 8.310 nan 0.000 0.486 6254 V N 0.631 120.396 119.914 -0.248 0.000 2.913 6254 V HA 0.159 4.280 4.120 0.003 0.000 0.260 6254 V C 1.783 177.778 176.094 -0.166 0.000 1.098 6254 V CA 1.389 63.571 62.300 -0.197 0.000 1.121 6254 V CB -0.461 31.247 31.823 -0.192 0.000 0.714 6254 V HN 0.649 nan 8.190 nan 0.000 0.487 6255 L N -0.481 120.638 121.223 -0.174 0.000 2.554 6255 L HA 0.251 4.593 4.340 0.003 0.000 0.225 6255 L C 0.163 176.932 176.870 -0.168 0.000 1.104 6255 L CA -0.012 54.727 54.840 -0.170 0.000 0.866 6255 L CB 0.749 42.719 42.059 -0.147 0.000 1.047 6255 L HN 0.087 nan 8.230 nan 0.000 0.468 6256 V N 0.772 120.593 119.914 -0.154 0.000 2.448 6256 V HA 0.317 4.439 4.120 0.003 0.000 0.295 6256 V C -0.247 175.774 176.094 -0.121 0.000 1.025 6256 V CA -0.929 61.292 62.300 -0.133 0.000 0.859 6256 V CB 1.689 33.431 31.823 -0.134 0.000 0.988 6256 V HN 0.002 nan 8.190 nan 0.000 0.431 6257 K N 5.648 125.986 120.400 -0.102 0.000 2.253 6257 K HA 0.413 4.734 4.320 0.003 0.000 0.277 6257 K C -0.079 176.474 176.600 -0.077 0.000 1.053 6257 K CA -0.595 55.641 56.287 -0.085 0.000 0.892 6257 K CB 1.575 34.029 32.500 -0.076 0.000 1.102 6257 K HN 0.707 nan 8.250 nan 0.000 0.469 6258 K N 0.835 121.192 120.400 -0.071 0.000 2.139 6258 K HA 0.687 5.009 4.320 0.003 0.000 0.243 6258 K C 0.522 177.095 176.600 -0.044 0.000 0.983 6258 K CA -0.248 56.002 56.287 -0.063 0.000 0.890 6258 K CB 1.020 33.479 32.500 -0.069 0.000 1.090 6258 K HN 0.563 nan 8.250 nan 0.000 0.445 6259 G N 0.950 109.726 108.800 -0.039 0.000 2.542 6259 G HA2 -0.272 3.690 3.960 0.003 0.000 0.235 6259 G HA3 -0.272 3.690 3.960 0.003 0.000 0.235 6259 G C -1.294 173.587 174.900 -0.031 0.000 1.286 6259 G CA 0.297 45.380 45.100 -0.027 0.000 0.904 6259 G HN 0.878 nan 8.290 nan 0.000 0.577 6260 D N 0.172 120.558 120.400 -0.023 0.000 2.295 6260 D HA 0.460 5.102 4.640 0.003 0.000 0.248 6260 D C 1.584 177.864 176.300 -0.033 0.000 1.154 6260 D CA 0.484 54.468 54.000 -0.027 0.000 0.857 6260 D CB 1.395 42.185 40.800 -0.017 0.000 1.117 6260 D HN 1.190 nan 8.370 nan 0.000 0.468 6261 V N 1.817 121.700 119.914 -0.051 0.000 3.650 6261 V HA 0.181 4.303 4.120 0.003 0.000 0.271 6261 V C 1.960 178.011 176.094 -0.071 0.000 1.281 6261 V CA 0.113 62.373 62.300 -0.066 0.000 1.120 6261 V CB -0.147 31.616 31.823 -0.099 0.000 0.856 6261 V HN 0.286 nan 8.190 nan 0.000 0.443 6262 K N 2.099 122.465 120.400 -0.056 0.000 2.074 6262 K HA -0.044 4.278 4.320 0.003 0.000 0.209 6262 K C -0.198 176.390 176.600 -0.020 0.000 1.048 6262 K CA 2.334 58.595 56.287 -0.043 0.000 0.926 6262 K CB -1.603 30.884 32.500 -0.022 0.000 0.713 6262 K HN 0.444 nan 8.250 nan 0.000 0.444 6263 P HA -0.175 nan 4.420 nan 0.000 0.215 6263 P C 1.400 178.712 177.300 0.019 0.000 1.153 6263 P CA 1.058 64.162 63.100 0.007 0.000 0.853 6263 P CB 0.015 31.719 31.700 0.006 0.000 0.788 6264 L N -0.917 120.315 121.223 0.015 0.000 2.017 6264 L HA -0.190 4.152 4.340 0.003 0.000 0.208 6264 L C 2.202 179.112 176.870 0.066 0.000 1.073 6264 L CA 1.882 56.748 54.840 0.044 0.000 0.745 6264 L CB -0.906 41.173 42.059 0.034 0.000 0.894 6264 L HN -0.044 nan 8.230 nan 0.000 0.432 6265 A N -0.203 122.621 122.820 0.007 0.000 1.908 6265 A HA -0.275 4.047 4.320 0.003 0.000 0.218 6265 A C 1.996 179.677 177.584 0.163 0.000 1.181 6265 A CA 2.023 54.089 52.037 0.049 0.000 0.627 6265 A CB -0.544 18.361 19.000 -0.159 0.000 0.818 6265 A HN 0.605 nan 8.150 nan 0.000 0.445 6266 E N -1.033 119.218 120.200 0.083 0.000 2.152 6266 E HA -0.210 4.142 4.350 0.003 0.000 0.192 6266 E C 2.210 178.850 176.600 0.066 0.000 0.983 6266 E CA 1.081 57.524 56.400 0.073 0.000 0.818 6266 E CB -0.133 29.592 29.700 0.041 0.000 0.758 6266 E HN 0.824 nan 8.360 nan 0.000 0.467 6267 Q N 0.741 120.581 119.800 0.066 0.000 2.119 6267 Q HA -0.140 4.202 4.340 0.003 0.000 0.201 6267 Q C 2.094 178.132 176.000 0.064 0.000 0.972 6267 Q CA 0.993 56.827 55.803 0.052 0.000 0.847 6267 Q CB 0.103 28.870 28.738 0.049 0.000 0.903 6267 Q HN 0.300 nan 8.270 nan 0.000 0.433 6268 I N 0.334 120.975 120.570 0.119 0.000 2.286 6268 I HA -0.209 3.963 4.170 0.003 0.000 0.245 6268 I C 2.417 178.567 176.117 0.054 0.000 1.104 6268 I CA 0.856 62.231 61.300 0.125 0.000 1.397 6268 I CB -0.432 37.717 38.000 0.249 0.000 1.072 6268 I HN 0.254 nan 8.210 nan 0.000 0.417 6269 A N 1.211 124.071 122.820 0.067 0.000 1.902 6269 A HA -0.172 4.150 4.320 0.003 0.000 0.217 6269 A C 2.302 179.884 177.584 -0.004 0.000 1.181 6269 A CA 1.460 53.498 52.037 0.002 0.000 0.623 6269 A CB -0.808 18.213 19.000 0.034 0.000 0.818 6269 A HN 0.352 nan 8.150 nan 0.000 0.443 6270 I N -0.384 120.194 120.570 0.013 0.000 2.179 6270 I HA -0.235 3.937 4.170 0.003 0.000 0.242 6270 I C 2.500 178.613 176.117 -0.007 0.000 1.088 6270 I CA 1.816 63.118 61.300 0.003 0.000 1.357 6270 I CB -0.580 37.425 38.000 0.008 0.000 1.051 6270 I HN 0.259 nan 8.210 nan 0.000 0.409 6271 T N 0.629 115.179 114.554 -0.007 0.000 2.881 6271 T HA -0.104 4.248 4.350 0.003 0.000 0.270 6271 T C 1.781 176.467 174.700 -0.024 0.000 1.068 6271 T CA 1.299 63.388 62.100 -0.019 0.000 1.131 6271 T CB -0.208 68.644 68.868 -0.026 0.000 0.871 6271 T HN 0.477 nan 8.240 nan 0.000 0.479 6272 A N 0.374 123.177 122.820 -0.029 0.000 2.208 6272 A HA 0.507 4.828 4.320 0.003 0.000 0.209 6272 A C 1.816 179.379 177.584 -0.035 0.000 1.161 6272 A CA 0.733 52.745 52.037 -0.042 0.000 0.782 6272 A CB -0.635 18.321 19.000 -0.073 0.000 0.816 6272 A HN 0.736 nan 8.150 nan 0.000 0.477 6273 G N -1.838 106.947 108.800 -0.026 0.000 2.171 6273 G HA2 -0.217 3.745 3.960 0.003 0.000 0.238 6273 G HA3 -0.217 3.745 3.960 0.003 0.000 0.238 6273 G C 0.014 174.901 174.900 -0.020 0.000 1.039 6273 G CA 0.014 45.102 45.100 -0.020 0.000 0.759 6273 G HN 0.590 nan 8.290 nan 0.000 0.501 6274 c N 0.167 118.753 118.600 -0.022 0.000 2.397 6274 c HA 0.696 5.268 4.570 0.003 0.000 0.343 6274 c C 0.931 175.018 174.090 -0.005 0.000 1.188 6274 c CA -0.904 55.414 56.329 -0.019 0.000 1.992 6274 c CB 1.480 43.969 42.510 -0.036 0.000 2.358 6274 c HN 0.522 nan 8.230 nan 0.000 0.518 6275 K N 0.707 121.108 120.400 0.002 0.000 2.168 6275 K HA 0.336 4.658 4.320 0.003 0.000 0.258 6275 K C 0.684 177.291 176.600 0.012 0.000 1.010 6275 K CA 0.160 56.451 56.287 0.007 0.000 0.929 6275 K CB 0.607 33.112 32.500 0.009 0.000 0.998 6275 K HN 0.856 nan 8.250 nan 0.000 0.479 6276 T N -2.368 112.195 114.554 0.014 0.000 3.248 6276 T HA 0.055 4.407 4.350 0.003 0.000 0.271 6276 T C 1.073 175.781 174.700 0.014 0.000 1.005 6276 T CA -0.407 61.705 62.100 0.020 0.000 0.902 6276 T CB 0.004 68.886 68.868 0.023 0.000 1.102 6276 T HN 0.431 nan 8.240 nan 0.000 0.548 6277 T N 2.824 117.382 114.554 0.007 0.000 2.653 6277 T HA -0.062 4.289 4.350 0.003 0.000 0.268 6277 T C 1.194 175.893 174.700 -0.002 0.000 1.035 6277 T CA 2.025 64.126 62.100 0.001 0.000 1.154 6277 T CB -0.438 68.427 68.868 -0.004 0.000 0.862 6277 T HN 0.867 nan 8.240 nan 0.000 0.441 6278 T N -2.732 111.817 114.554 -0.008 0.000 2.762 6278 T HA 0.478 4.830 4.350 0.003 0.000 0.301 6278 T C 0.917 175.607 174.700 -0.017 0.000 1.299 6278 T CA -0.344 61.745 62.100 -0.017 0.000 1.005 6278 T CB 1.549 70.388 68.868 -0.049 0.000 1.377 6278 T HN -0.170 nan 8.240 nan 0.000 0.504 6279 S N 0.334 116.027 115.700 -0.012 0.000 2.356 6279 S HA -0.024 4.448 4.470 0.003 0.000 0.223 6279 S C 2.486 177.050 174.600 -0.060 0.000 1.032 6279 S CA 1.414 59.628 58.200 0.024 0.000 1.005 6279 S CB -1.008 62.280 63.200 0.147 0.000 0.867 6279 S HN 0.952 nan 8.310 nan 0.000 0.449 6280 A N 1.036 123.659 122.820 -0.328 0.000 1.940 6280 A HA -0.062 4.260 4.320 0.003 0.000 0.219 6280 A C 2.323 179.851 177.584 -0.092 0.000 1.176 6280 A CA 1.538 53.357 52.037 -0.364 0.000 0.631 6280 A CB -0.827 17.828 19.000 -0.574 0.000 0.814 6280 A HN 0.355 nan 8.150 nan 0.000 0.446 6281 V N -0.140 119.735 119.914 -0.064 0.000 2.358 6281 V HA -0.292 3.830 4.120 0.003 0.000 0.246 6281 V C 2.633 178.755 176.094 0.046 0.000 1.047 6281 V CA 2.123 64.428 62.300 0.008 0.000 1.035 6281 V CB -0.707 31.112 31.823 -0.007 0.000 0.658 6281 V HN 0.570 nan 8.190 nan 0.000 0.452 6282 M N -0.550 119.070 119.600 0.033 0.000 2.086 6282 M HA -0.164 4.318 4.480 0.003 0.000 0.261 6282 M C 2.261 178.556 176.300 -0.007 0.000 1.067 6282 M CA 1.718 57.038 55.300 0.034 0.000 1.116 6282 M CB -0.619 32.041 32.600 0.100 0.000 1.348 6282 M HN 0.232 nan 8.290 nan 0.000 0.407 6283 V N -0.355 119.584 119.914 0.042 0.000 2.287 6283 V HA -0.309 3.813 4.120 0.003 0.000 0.248 6283 V C 2.319 178.433 176.094 0.034 0.000 1.053 6283 V CA 2.490 64.791 62.300 0.003 0.000 1.027 6283 V CB -1.081 30.814 31.823 0.120 0.000 0.646 6283 V HN 0.502 nan 8.190 nan 0.000 0.447 6284 H N -0.764 118.304 119.070 -0.005 0.000 2.352 6284 H HA -0.229 4.329 4.556 0.003 0.000 0.299 6284 H C 2.343 177.666 175.328 -0.007 0.000 1.097 6284 H CA 2.323 58.373 56.048 0.003 0.000 1.311 6284 H CB -0.585 29.170 29.762 -0.012 0.000 1.377 6284 H HN 0.482 nan 8.280 nan 0.000 0.504 6285 c N -0.179 118.381 118.600 -0.067 0.000 2.446 6285 c HA -0.045 4.527 4.570 0.003 0.000 0.277 6285 c C 2.737 176.743 174.090 -0.139 0.000 1.275 6285 c CA 0.910 57.169 56.329 -0.116 0.000 1.727 6285 c CB -1.422 41.066 42.510 -0.036 0.000 2.010 6285 c HN 0.666 nan 8.230 nan 0.000 0.486 6286 L N 0.222 121.364 121.223 -0.135 0.000 2.201 6286 L HA -0.053 4.289 4.340 0.003 0.000 0.212 6286 L C 2.928 179.798 176.870 0.000 0.000 1.105 6286 L CA 1.241 56.006 54.840 -0.124 0.000 0.775 6286 L CB -0.626 41.232 42.059 -0.334 0.000 0.913 6286 L HN 0.322 nan 8.230 nan 0.000 0.440 6287 R N -0.472 120.033 120.500 0.009 0.000 2.235 6287 R HA -0.098 4.244 4.340 0.003 0.000 0.213 6287 R C 1.964 178.195 176.300 -0.116 0.000 1.059 6287 R CA 0.610 56.694 56.100 -0.027 0.000 0.997 6287 R CB 0.057 30.343 30.300 -0.023 0.000 0.884 6287 R HN 0.402 nan 8.270 nan 0.000 0.462 6288 Q N 0.360 120.064 119.800 -0.161 0.000 2.398 6288 Q HA 0.060 4.402 4.340 0.003 0.000 0.204 6288 Q C 0.194 176.141 176.000 -0.088 0.000 0.932 6288 Q CA 0.635 56.351 55.803 -0.145 0.000 0.916 6288 Q CB 0.267 28.893 28.738 -0.186 0.000 1.024 6288 Q HN 0.018 nan 8.270 nan 0.000 0.504 6289 K N 2.143 122.496 120.400 -0.079 0.000 2.319 6289 K HA 0.107 4.429 4.320 0.003 0.000 0.265 6289 K C 0.681 177.266 176.600 -0.025 0.000 1.000 6289 K CA 0.099 56.355 56.287 -0.052 0.000 0.943 6289 K CB 0.343 32.805 32.500 -0.064 0.000 0.950 6289 K HN 0.193 nan 8.250 nan 0.000 0.485 6290 T N -2.622 111.933 114.554 0.001 0.000 2.816 6290 T HA 0.077 4.429 4.350 0.003 0.000 0.282 6290 T C 1.333 176.089 174.700 0.094 0.000 0.993 6290 T CA -0.581 61.537 62.100 0.031 0.000 0.994 6290 T CB 1.106 69.988 68.868 0.023 0.000 1.025 6290 T HN 0.628 nan 8.240 nan 0.000 0.529 6291 E N 0.168 120.446 120.200 0.130 0.000 2.058 6291 E HA -0.266 4.086 4.350 0.003 0.000 0.194 6291 E C 1.960 178.702 176.600 0.237 0.000 0.997 6291 E CA 1.648 58.195 56.400 0.245 0.000 0.801 6291 E CB -0.143 29.618 29.700 0.101 0.000 0.746 6291 E HN 0.874 nan 8.360 nan 0.000 0.450 6292 E N 0.129 120.401 120.200 0.120 0.000 2.110 6292 E HA -0.238 4.114 4.350 0.003 0.000 0.193 6292 E C 1.916 178.574 176.600 0.096 0.000 0.988 6292 E CA 1.391 57.849 56.400 0.096 0.000 0.804 6292 E CB 0.055 29.785 29.700 0.049 0.000 0.745 6292 E HN 0.362 nan 8.360 nan 0.000 0.458 6293 E N 0.151 120.394 120.200 0.072 0.000 2.072 6293 E HA -0.141 4.211 4.350 0.003 0.000 0.191 6293 E C 2.187 178.807 176.600 0.032 0.000 0.985 6293 E CA 0.855 57.277 56.400 0.037 0.000 0.801 6293 E CB 0.032 29.737 29.700 0.009 0.000 0.750 6293 E HN 0.327 nan 8.360 nan 0.000 0.452 6294 L N 0.465 121.715 121.223 0.045 0.000 2.217 6294 L HA -0.119 4.223 4.340 0.003 0.000 0.211 6294 L C 2.360 179.267 176.870 0.062 0.000 1.107 6294 L CA 0.174 54.970 54.840 -0.073 0.000 0.783 6294 L CB -0.129 41.730 42.059 -0.333 0.000 0.919 6294 L HN 0.198 nan 8.230 nan 0.000 0.442 6295 L N -0.089 121.304 121.223 0.283 0.000 2.109 6295 L HA -0.131 4.211 4.340 0.003 0.000 0.207 6295 L C 2.295 179.265 176.870 0.167 0.000 1.086 6295 L CA 1.682 56.724 54.840 0.336 0.000 0.760 6295 L CB -0.360 41.869 42.059 0.283 0.000 0.910 6295 L HN 0.174 nan 8.230 nan 0.000 0.437 6296 E N -1.367 118.894 120.200 0.102 0.000 2.152 6296 E HA -0.153 4.198 4.350 0.003 0.000 0.192 6296 E C 1.847 178.466 176.600 0.031 0.000 0.983 6296 E CA 1.462 57.895 56.400 0.054 0.000 0.818 6296 E CB -0.042 29.678 29.700 0.034 0.000 0.758 6296 E HN 0.500 nan 8.360 nan 0.000 0.467 6297 T N 0.347 114.916 114.554 0.025 0.000 2.777 6297 T HA -0.108 4.244 4.350 0.003 0.000 0.266 6297 T C 1.990 176.696 174.700 0.010 0.000 1.040 6297 T CA 1.464 63.563 62.100 -0.002 0.000 1.141 6297 T CB -0.297 68.557 68.868 -0.023 0.000 0.868 6297 T HN 0.151 nan 8.240 nan 0.000 0.444 6298 T N 2.471 117.078 114.554 0.088 0.000 2.652 6298 T HA -0.053 4.299 4.350 0.003 0.000 0.267 6298 T C 1.868 176.601 174.700 0.055 0.000 1.039 6298 T CA 0.942 63.157 62.100 0.192 0.000 1.153 6298 T CB -0.465 68.599 68.868 0.327 0.000 0.863 6298 T HN 0.088 nan 8.240 nan 0.000 0.428 6299 L N 0.965 122.222 121.223 0.057 0.000 2.083 6299 L HA -0.042 4.300 4.340 0.003 0.000 0.209 6299 L C 2.370 179.206 176.870 -0.058 0.000 1.083 6299 L CA 1.650 56.498 54.840 0.013 0.000 0.752 6299 L CB -0.540 41.537 42.059 0.030 0.000 0.899 6299 L HN 0.208 nan 8.230 nan 0.000 0.433 6300 K N -1.324 119.033 120.400 -0.071 0.000 2.097 6300 K HA -0.083 4.239 4.320 0.003 0.000 0.205 6300 K C 1.936 178.429 176.600 -0.179 0.000 1.050 6300 K CA 0.942 57.172 56.287 -0.096 0.000 0.938 6300 K CB -0.163 32.295 32.500 -0.070 0.000 0.718 6300 K HN 0.220 nan 8.250 nan 0.000 0.442 6301 M N 0.945 120.358 119.600 -0.312 0.000 2.460 6301 M HA -0.049 4.433 4.480 0.003 0.000 0.263 6301 M C 0.086 176.036 176.300 -0.584 0.000 1.071 6301 M CA 1.005 55.959 55.300 -0.576 0.000 1.096 6301 M CB -0.615 31.262 32.600 -1.205 0.000 1.408 6301 M HN 0.074 nan 8.290 nan 0.000 0.463 6302 K N 0.825 120.996 120.400 -0.381 0.000 3.419 6302 K HA -0.179 4.143 4.320 0.003 0.000 0.272 6302 K C -0.580 175.932 176.600 -0.146 0.000 0.973 6302 K CA 0.192 56.363 56.287 -0.193 0.000 0.749 6302 K CB -2.001 30.428 32.500 -0.118 0.000 1.403 6302 K HN 0.207 nan 8.250 nan 0.000 0.456 6303 F N 0.322 120.293 119.950 0.034 0.000 2.435 6303 F HA 0.115 4.644 4.527 0.003 0.000 0.316 6303 F C 2.215 178.032 175.800 0.029 0.000 1.220 6303 F CA 0.067 58.088 58.000 0.035 0.000 1.241 6303 F CB 0.364 39.396 39.000 0.054 0.000 1.234 6303 F HN 0.191 nan 8.300 nan 0.000 0.569 6304 L N -0.517 120.859 121.223 0.255 0.000 4.937 6304 L HA -0.267 4.075 4.340 0.003 0.000 0.422 6304 L C -0.066 176.861 176.870 0.095 0.000 1.059 6304 L CA 0.367 55.287 54.840 0.133 0.000 1.111 6304 L CB -1.916 40.207 42.059 0.107 0.000 2.033 6304 L HN 0.541 nan 8.230 nan 0.000 0.708 6305 S N -0.210 115.549 115.700 0.098 0.000 2.526 6305 S HA 0.676 5.148 4.470 0.003 0.000 0.293 6305 S C -0.564 174.075 174.600 0.065 0.000 1.092 6305 S CA -0.665 57.574 58.200 0.065 0.000 0.980 6305 S CB 2.010 65.230 63.200 0.034 0.000 1.048 6305 S HN 0.196 nan 8.310 nan 0.000 0.483 6306 L N 4.310 125.575 121.223 0.069 0.000 2.369 6306 L HA 0.405 4.747 4.340 0.003 0.000 0.279 6306 L C -0.245 176.628 176.870 0.005 0.000 1.108 6306 L CA 0.083 54.956 54.840 0.056 0.000 0.852 6306 L CB 0.443 42.551 42.059 0.083 0.000 1.169 6306 L HN 0.601 nan 8.230 nan 0.000 0.452 6307 D N 4.176 124.572 120.400 -0.006 0.000 2.348 6307 D HA 0.108 4.750 4.640 0.003 0.000 0.253 6307 D C 0.613 176.885 176.300 -0.047 0.000 1.161 6307 D CA 0.176 54.159 54.000 -0.028 0.000 0.876 6307 D CB 0.824 41.605 40.800 -0.031 0.000 1.160 6307 D HN 0.586 nan 8.370 nan 0.000 0.459 6308 L N 2.460 123.656 121.223 -0.045 0.000 2.667 6308 L HA 0.184 4.526 4.340 0.003 0.000 0.232 6308 L C 0.576 177.425 176.870 -0.035 0.000 1.138 6308 L CA -0.050 54.761 54.840 -0.049 0.000 0.921 6308 L CB -0.149 41.882 42.059 -0.047 0.000 1.180 6308 L HN 0.278 nan 8.230 nan 0.000 0.487 6309 Q N -0.194 119.586 119.800 -0.034 0.000 2.301 6309 Q HA 0.651 4.993 4.340 0.003 0.000 0.267 6309 Q C 0.538 176.521 176.000 -0.027 0.000 1.035 6309 Q CA -0.203 55.586 55.803 -0.023 0.000 0.856 6309 Q CB 2.232 30.959 28.738 -0.020 0.000 1.337 6309 Q HN 0.143 nan 8.270 nan 0.000 0.450 6310 G N 1.654 110.448 108.800 -0.010 0.000 2.601 6310 G HA2 -0.263 3.699 3.960 0.003 0.000 0.252 6310 G HA3 -0.263 3.699 3.960 0.003 0.000 0.252 6310 G C -0.924 173.966 174.900 -0.016 0.000 1.294 6310 G CA -0.168 44.927 45.100 -0.008 0.000 0.912 6310 G HN 0.732 nan 8.290 nan 0.000 0.574 6311 D N 1.176 121.559 120.400 -0.028 0.000 2.316 6311 D HA 0.444 5.086 4.640 0.003 0.000 0.245 6311 D C -0.833 175.351 176.300 -0.195 0.000 1.171 6311 D CA -1.650 52.312 54.000 -0.062 0.000 0.856 6311 D CB 1.274 42.063 40.800 -0.018 0.000 1.090 6311 D HN -0.002 nan 8.370 nan 0.000 0.476 6312 P HA -0.109 nan 4.420 nan 0.000 0.218 6312 P C 1.081 178.176 177.300 -0.342 0.000 1.146 6312 P CA 0.989 63.818 63.100 -0.452 0.000 0.813 6312 P CB 0.262 31.437 31.700 -0.875 0.000 0.778 6313 R N -0.306 119.891 120.500 -0.505 0.000 2.237 6313 R HA -0.083 4.259 4.340 0.003 0.000 0.219 6313 R C 1.657 177.893 176.300 -0.107 0.000 1.080 6313 R CA 0.953 56.805 56.100 -0.413 0.000 0.995 6313 R CB -0.329 29.675 30.300 -0.493 0.000 0.875 6313 R HN 0.406 nan 8.270 nan 0.000 0.462 6314 E N 0.221 120.366 120.200 -0.092 0.000 2.472 6314 E HA 0.013 4.364 4.350 0.003 0.000 0.196 6314 E C -0.128 176.468 176.600 -0.007 0.000 1.033 6314 E CA -0.041 56.340 56.400 -0.031 0.000 0.886 6314 E CB 0.668 30.350 29.700 -0.031 0.000 0.944 6314 E HN 0.173 nan 8.360 nan 0.000 0.492 6315 S N 0.813 116.504 115.700 -0.014 0.000 2.545 6315 S HA 0.287 4.759 4.470 0.003 0.000 0.275 6315 S C -0.038 174.592 174.600 0.051 0.000 1.299 6315 S CA -0.699 57.507 58.200 0.010 0.000 1.048 6315 S CB 1.613 64.805 63.200 -0.012 0.000 0.938 6315 S HN -0.048 nan 8.310 nan 0.000 0.496 6316 Q N 2.512 122.366 119.800 0.091 0.000 2.674 6316 Q HA 0.377 4.719 4.340 0.003 0.000 0.249 6316 Q C -1.873 174.275 176.000 0.246 0.000 1.011 6316 Q CA -2.059 53.827 55.803 0.138 0.000 0.734 6316 Q CB 1.541 30.379 28.738 0.167 0.000 1.201 6316 Q HN 0.560 nan 8.270 nan 0.000 0.498 6317 P HA -0.087 nan 4.420 nan 0.000 0.226 6317 P C -0.455 176.988 177.300 0.239 0.000 1.153 6317 P CA 0.822 64.061 63.100 0.233 0.000 0.777 6317 P CB 0.721 32.493 31.700 0.120 0.000 0.794 6318 L N -0.998 120.257 121.223 0.052 0.000 2.424 6318 L HA 0.446 4.788 4.340 0.003 0.000 0.258 6318 L C -0.311 176.388 176.870 -0.285 0.000 0.995 6318 L CA -1.116 53.616 54.840 -0.180 0.000 0.821 6318 L CB 2.461 44.440 42.059 -0.133 0.000 1.383 6318 L HN -0.303 nan 8.230 nan 0.000 0.410 6319 L N 1.559 122.527 121.223 -0.426 0.000 2.276 6319 L HA 0.674 5.016 4.340 0.003 0.000 0.286 6319 L C 0.354 177.045 176.870 -0.298 0.000 1.024 6319 L CA -0.128 54.546 54.840 -0.276 0.000 0.826 6319 L CB 1.225 43.149 42.059 -0.226 0.000 1.211 6319 L HN 0.812 nan 8.230 nan 0.000 0.422 6320 G N 1.681 110.303 108.800 -0.296 0.000 3.252 6320 G HA2 0.387 4.349 3.960 0.003 0.000 0.181 6320 G HA3 0.387 4.349 3.960 0.003 0.000 0.181 6320 G C -0.558 174.166 174.900 -0.293 0.000 1.187 6320 G CA -0.321 44.462 45.100 -0.528 0.000 0.886 6320 G HN 0.334 nan 8.290 nan 0.000 0.615 6321 T N 0.623 115.060 114.554 -0.196 0.000 2.928 6321 T HA 0.415 4.767 4.350 0.003 0.000 0.305 6321 T C 0.404 175.090 174.700 -0.024 0.000 1.035 6321 T CA 0.308 62.428 62.100 0.035 0.000 1.145 6321 T CB 0.912 69.808 68.868 0.047 0.000 0.963 6321 T HN 1.135 nan 8.240 nan 0.000 0.545 6322 V N 0.086 119.994 119.914 -0.011 0.000 3.102 6322 V HA 0.611 4.733 4.120 0.003 0.000 0.312 6322 V C -0.549 175.500 176.094 -0.074 0.000 1.135 6322 V CA -1.362 60.901 62.300 -0.063 0.000 1.022 6322 V CB 1.841 33.611 31.823 -0.088 0.000 1.056 6322 V HN 0.620 nan 8.190 nan 0.000 0.436 6323 I N 3.713 124.234 120.570 -0.082 0.000 2.241 6323 I HA 0.242 4.414 4.170 0.003 0.000 0.294 6323 I C 1.020 177.086 176.117 -0.085 0.000 1.145 6323 I CA 0.050 61.301 61.300 -0.082 0.000 1.261 6323 I CB -0.167 37.787 38.000 -0.076 0.000 1.475 6323 I HN 0.972 nan 8.210 nan 0.000 0.533 6324 D N 3.859 124.202 120.400 -0.096 0.000 2.234 6324 D HA -0.059 4.583 4.640 0.003 0.000 0.205 6324 D C 1.438 177.692 176.300 -0.076 0.000 0.962 6324 D CA 1.235 55.171 54.000 -0.106 0.000 0.855 6324 D CB 0.352 41.060 40.800 -0.153 0.000 0.951 6324 D HN 0.651 nan 8.370 nan 0.000 0.500 6325 G N -0.304 108.457 108.800 -0.066 0.000 2.179 6325 G HA2 -0.248 3.714 3.960 0.003 0.000 0.220 6325 G HA3 -0.248 3.714 3.960 0.003 0.000 0.220 6325 G C 0.945 175.825 174.900 -0.034 0.000 0.990 6325 G CA 0.532 45.603 45.100 -0.048 0.000 0.646 6325 G HN 0.247 nan 8.290 nan 0.000 0.517 6326 M N -1.215 118.363 119.600 -0.037 0.000 3.058 6326 M HA 0.448 4.929 4.480 0.003 0.000 0.242 6326 M C 2.237 178.528 176.300 -0.016 0.000 1.512 6326 M CA 1.010 56.301 55.300 -0.013 0.000 1.274 6326 M CB -1.132 31.469 32.600 0.001 0.000 1.179 6326 M HN 0.224 nan 8.290 nan 0.000 0.573 6327 L N 0.744 121.947 121.223 -0.033 0.000 2.068 6327 L HA 0.168 4.510 4.340 0.003 0.000 0.204 6327 L C 0.375 177.202 176.870 -0.071 0.000 1.076 6327 L CA 1.387 56.204 54.840 -0.038 0.000 0.753 6327 L CB 0.162 42.195 42.059 -0.043 0.000 0.910 6327 L HN 0.106 nan 8.230 nan 0.000 0.439 6328 L N 0.215 121.387 121.223 -0.085 0.000 2.325 6328 L HA 0.242 4.584 4.340 0.003 0.000 0.281 6328 L C 0.484 177.300 176.870 -0.089 0.000 1.004 6328 L CA -0.390 54.387 54.840 -0.105 0.000 0.823 6328 L CB 1.835 43.824 42.059 -0.116 0.000 1.236 6328 L HN 0.124 nan 8.230 nan 0.000 0.415 6329 L N 2.772 123.938 121.223 -0.094 0.000 2.418 6329 L HA 0.072 4.414 4.340 0.003 0.000 0.218 6329 L C 0.549 177.375 176.870 -0.074 0.000 1.125 6329 L CA 0.819 55.614 54.840 -0.075 0.000 0.835 6329 L CB -0.372 41.644 42.059 -0.071 0.000 0.953 6329 L HN 0.662 nan 8.230 nan 0.000 0.454 6330 K N -1.800 118.548 120.400 -0.087 0.000 2.672 6330 K HA 0.285 4.607 4.320 0.003 0.000 0.295 6330 K C -0.467 176.080 176.600 -0.088 0.000 1.042 6330 K CA -0.760 55.480 56.287 -0.078 0.000 0.869 6330 K CB 0.540 32.998 32.500 -0.069 0.000 1.541 6330 K HN -0.145 nan 8.250 nan 0.000 0.396 6331 T N -1.670 112.836 114.554 -0.080 0.000 2.908 6331 T HA 0.069 4.421 4.350 0.003 0.000 0.325 6331 T C -1.819 172.825 174.700 -0.092 0.000 1.092 6331 T CA -0.562 61.487 62.100 -0.086 0.000 1.125 6331 T CB 0.248 69.069 68.868 -0.079 0.000 1.016 6331 T HN 0.323 nan 8.240 nan 0.000 0.550 6332 P HA -0.053 nan 4.420 nan 0.000 0.216 6332 P C 1.315 178.570 177.300 -0.076 0.000 1.150 6332 P CA 0.985 64.028 63.100 -0.095 0.000 0.837 6332 P CB 0.048 31.689 31.700 -0.099 0.000 0.786 6333 E N -0.196 119.959 120.200 -0.075 0.000 2.110 6333 E HA -0.192 4.160 4.350 0.003 0.000 0.193 6333 E C 1.874 178.445 176.600 -0.048 0.000 0.988 6333 E CA 1.269 57.633 56.400 -0.060 0.000 0.804 6333 E CB -0.643 29.016 29.700 -0.068 0.000 0.745 6333 E HN 0.446 nan 8.360 nan 0.000 0.458 6334 E N 0.094 120.261 120.200 -0.055 0.000 2.112 6334 E HA -0.036 4.316 4.350 0.003 0.000 0.190 6334 E C 1.989 178.556 176.600 -0.056 0.000 0.979 6334 E CA 0.449 56.819 56.400 -0.049 0.000 0.814 6334 E CB -0.041 29.628 29.700 -0.051 0.000 0.762 6334 E HN 0.210 nan 8.360 nan 0.000 0.460 6335 L N 1.063 122.240 121.223 -0.078 0.000 2.275 6335 L HA -0.183 4.159 4.340 0.003 0.000 0.215 6335 L C 2.360 179.184 176.870 -0.076 0.000 1.119 6335 L CA 0.934 55.711 54.840 -0.106 0.000 0.790 6335 L CB -0.215 41.754 42.059 -0.151 0.000 0.919 6335 L HN 0.181 nan 8.230 nan 0.000 0.443 6336 Q N -0.353 119.422 119.800 -0.041 0.000 2.096 6336 Q HA -0.100 4.242 4.340 0.003 0.000 0.197 6336 Q C 2.446 178.451 176.000 0.008 0.000 0.964 6336 Q CA 1.307 57.108 55.803 -0.003 0.000 0.838 6336 Q CB -0.158 28.587 28.738 0.010 0.000 0.906 6336 Q HN 0.532 nan 8.270 nan 0.000 0.444 6337 A N 1.457 124.275 122.820 -0.002 0.000 2.070 6337 A HA -0.147 4.175 4.320 0.003 0.000 0.220 6337 A C 0.624 178.212 177.584 0.007 0.000 1.159 6337 A CA 0.651 52.691 52.037 0.005 0.000 0.656 6337 A CB -0.276 18.723 19.000 -0.001 0.000 0.800 6337 A HN 0.282 nan 8.150 nan 0.000 0.453 6338 E N 1.481 121.681 120.200 0.000 0.000 1.800 6338 E HA 0.024 4.376 4.350 0.003 0.000 0.262 6338 E C -0.365 176.260 176.600 0.041 0.000 1.219 6338 E CA -0.303 56.105 56.400 0.013 0.000 1.051 6338 E CB 0.052 29.748 29.700 -0.006 0.000 1.074 6338 E HN 0.265 nan 8.360 nan 0.000 0.433 6339 R N 2.497 123.018 120.500 0.034 0.000 4.510 6339 R HA -0.017 4.325 4.340 0.003 0.000 0.170 6339 R C 0.204 176.531 176.300 0.045 0.000 1.906 6339 R CA 0.246 56.367 56.100 0.034 0.000 1.492 6339 R CB -0.626 29.686 30.300 0.019 0.000 1.383 6339 R HN 0.442 nan 8.270 nan 0.000 0.823 6340 N N -0.851 117.897 118.700 0.081 0.000 1.848 6340 N HA -0.051 4.691 4.740 0.003 0.000 0.236 6340 N C -0.371 175.218 175.510 0.133 0.000 1.427 6340 N CA -0.202 52.897 53.050 0.082 0.000 0.732 6340 N CB 0.011 38.537 38.487 0.065 0.000 1.067 6340 N HN 0.111 nan 8.380 nan 0.000 0.540 6341 F N 2.210 122.164 119.950 0.006 0.000 2.527 6341 F HA 0.207 4.735 4.527 0.003 0.000 0.316 6341 F C 0.953 176.779 175.800 0.044 0.000 1.258 6341 F CA 0.146 58.160 58.000 0.023 0.000 1.314 6341 F CB 0.312 39.321 39.000 0.014 0.000 1.200 6341 F HN 0.149 nan 8.300 nan 0.000 0.577 6342 H N 1.176 119.813 119.070 -0.722 0.000 2.899 6342 H HA 0.266 4.824 4.556 0.003 0.000 0.303 6342 H C -0.264 174.936 175.328 -0.213 0.000 1.042 6342 H CA -0.017 55.754 56.048 -0.462 0.000 1.479 6342 H CB 0.141 29.541 29.762 -0.602 0.000 1.493 6342 H HN 0.616 nan 8.280 nan 0.000 0.534 6343 T N 2.300 116.563 114.554 -0.484 0.000 2.936 6343 T HA 0.637 4.989 4.350 0.003 0.000 0.282 6343 T C -0.075 174.352 174.700 -0.454 0.000 1.003 6343 T CA -0.279 61.619 62.100 -0.337 0.000 1.005 6343 T CB 1.357 70.117 68.868 -0.181 0.000 1.097 6343 T HN 0.642 nan 8.240 nan 0.000 0.532 6344 V N -3.070 116.782 119.914 -0.104 0.000 3.087 6344 V HA 0.712 4.833 4.120 0.003 0.000 0.306 6344 V C -3.329 172.897 176.094 0.219 0.000 1.187 6344 V CA -3.107 59.174 62.300 -0.033 0.000 0.999 6344 V CB 1.369 33.144 31.823 -0.080 0.000 1.049 6344 V HN 0.706 nan 8.190 nan 0.000 0.431 6345 P HA 0.181 nan 4.420 nan 0.000 0.265 6345 P C -1.468 176.143 177.300 0.517 0.000 1.193 6345 P CA 0.619 63.920 63.100 0.333 0.000 0.765 6345 P CB -0.098 31.645 31.700 0.071 0.000 0.823 6346 Y N 3.421 123.914 120.300 0.322 0.000 2.373 6346 Y HA 0.514 5.066 4.550 0.003 0.000 0.336 6346 Y C -0.761 175.095 175.900 -0.073 0.000 0.979 6346 Y CA -1.477 56.629 58.100 0.011 0.000 1.080 6346 Y CB 1.531 39.579 38.460 -0.687 0.000 1.190 6346 Y HN 0.215 nan 8.280 nan 0.000 0.446 6347 M N 7.750 127.283 119.600 -0.112 0.000 2.227 6347 M HA 0.594 5.076 4.480 0.003 0.000 0.335 6347 M C -2.235 173.784 176.300 -0.467 0.000 1.053 6347 M CA -0.684 54.325 55.300 -0.485 0.000 0.973 6347 M CB 1.064 33.055 32.600 -1.016 0.000 1.623 6347 M HN 0.441 nan 8.290 nan 0.000 0.434 6348 V N 4.593 124.211 119.914 -0.494 0.000 2.483 6348 V HA 0.860 4.982 4.120 0.003 0.000 0.297 6348 V C 0.152 175.957 176.094 -0.482 0.000 1.027 6348 V CA -0.556 61.436 62.300 -0.514 0.000 0.855 6348 V CB 1.530 32.946 31.823 -0.680 0.000 0.995 6348 V HN 1.011 nan 8.190 nan 0.000 0.424 6349 G N 4.045 112.486 108.800 -0.599 0.000 2.642 6349 G HA2 0.905 4.867 3.960 0.003 0.000 0.293 6349 G HA3 0.905 4.867 3.960 0.003 0.000 0.293 6349 G C -1.211 173.291 174.900 -0.664 0.000 1.341 6349 G CA -0.689 43.665 45.100 -1.243 0.000 0.916 6349 G HN 0.914 nan 8.290 nan 0.000 0.474 6350 I N -2.476 117.791 120.570 -0.506 0.000 3.174 6350 I HA 0.602 4.774 4.170 0.003 0.000 0.313 6350 I C -0.990 175.180 176.117 0.089 0.000 1.155 6350 I CA -1.373 59.857 61.300 -0.116 0.000 0.977 6350 I CB 2.449 40.416 38.000 -0.056 0.000 1.248 6350 I HN 0.425 nan 8.210 nan 0.000 0.453 6351 N N 1.404 120.183 118.700 0.131 0.000 2.443 6351 N HA 0.236 4.978 4.740 0.003 0.000 0.293 6351 N C 0.110 175.733 175.510 0.187 0.000 1.159 6351 N CA -0.814 52.384 53.050 0.246 0.000 0.904 6351 N CB 1.995 40.621 38.487 0.230 0.000 1.214 6351 N HN 0.532 nan 8.380 nan 0.000 0.513 6352 K N 0.787 121.314 120.400 0.211 0.000 2.044 6352 K HA -0.165 4.157 4.320 0.003 0.000 0.210 6352 K C 0.133 176.821 176.600 0.146 0.000 1.049 6352 K CA 1.875 58.257 56.287 0.157 0.000 0.927 6352 K CB 0.129 32.711 32.500 0.137 0.000 0.713 6352 K HN 0.546 nan 8.250 nan 0.000 0.443 6353 Q N 0.244 120.140 119.800 0.159 0.000 2.851 6353 Q HA 0.104 4.446 4.340 0.003 0.000 0.331 6353 Q C -0.177 175.923 176.000 0.167 0.000 0.979 6353 Q CA -0.304 55.595 55.803 0.160 0.000 0.955 6353 Q CB 1.331 30.163 28.738 0.156 0.000 1.298 6353 Q HN 0.166 nan 8.270 nan 0.000 0.432 6354 E N 0.102 120.386 120.200 0.141 0.000 2.187 6354 E HA -0.191 4.161 4.350 0.003 0.000 0.199 6354 E C 0.362 177.052 176.600 0.150 0.000 1.004 6354 E CA 1.332 57.774 56.400 0.069 0.000 0.813 6354 E CB 0.141 29.816 29.700 -0.043 0.000 0.736 6354 E HN 0.435 nan 8.360 nan 0.000 0.468 6355 F N -0.063 119.903 119.950 0.027 0.000 2.855 6355 F HA 0.308 4.837 4.527 0.004 0.000 0.317 6355 F C 1.572 177.391 175.800 0.031 0.000 1.169 6355 F CA -0.286 57.706 58.000 -0.013 0.000 1.299 6355 F CB 0.616 39.566 39.000 -0.085 0.000 0.962 6355 F HN -0.090 nan 8.300 nan 0.000 0.506 6356 G N -0.053 108.828 108.800 0.133 0.000 2.403 6356 G HA2 -0.222 3.740 3.960 0.003 0.000 0.216 6356 G HA3 -0.222 3.740 3.960 0.003 0.000 0.216 6356 G C 0.970 176.000 174.900 0.217 0.000 1.154 6356 G CA 1.171 46.374 45.100 0.172 0.000 0.784 6356 G HN 0.620 nan 8.290 nan 0.000 0.538 6357 W N -1.565 119.695 121.300 -0.066 0.000 5.465 6357 W HA 0.246 4.907 4.660 0.002 0.000 0.160 6357 W C 1.728 178.195 176.519 -0.087 0.000 1.373 6357 W CA 0.186 57.494 57.345 -0.061 0.000 1.891 6357 W CB -0.620 28.846 29.460 0.010 0.000 0.552 6357 W HN 0.002 nan 8.180 nan 0.000 1.112 6358 L N 2.097 123.364 121.223 0.072 0.000 1.963 6358 L HA -0.224 4.118 4.340 0.003 0.000 0.220 6358 L C 2.163 178.843 176.870 -0.316 0.000 1.076 6358 L CA 3.115 57.874 54.840 -0.135 0.000 0.772 6358 L CB -1.149 41.071 42.059 0.268 0.000 0.892 6358 L HN 0.224 nan 8.230 nan 0.000 0.435 6359 I N -0.677 119.721 120.570 -0.287 0.000 2.127 6359 I HA -0.240 3.932 4.170 0.003 0.000 0.241 6359 I C -0.288 175.522 176.117 -0.512 0.000 1.075 6359 I CA 1.532 62.609 61.300 -0.371 0.000 1.334 6359 I CB -1.822 35.943 38.000 -0.391 0.000 1.040 6359 I HN 0.296 nan 8.210 nan 0.000 0.405 6360 P HA -0.173 nan 4.420 nan 0.000 0.215 6360 P C 1.116 178.230 177.300 -0.309 0.000 1.153 6360 P CA 1.219 63.947 63.100 -0.620 0.000 0.853 6360 P CB -0.047 31.237 31.700 -0.694 0.000 0.788 6364 M N -0.523 119.041 119.600 -0.060 0.000 2.371 6364 M HA 0.235 4.717 4.480 0.003 0.000 0.246 6364 M C 0.649 176.985 176.300 0.061 0.000 1.103 6364 M CA 0.129 55.448 55.300 0.032 0.000 1.010 6364 M CB 0.768 33.428 32.600 0.100 0.000 1.457 6364 M HN 0.158 nan 8.290 nan 0.000 0.486 6365 S N 0.521 116.233 115.700 0.020 0.000 3.641 6365 S HA -0.201 4.271 4.470 0.003 0.000 0.346 6365 S C -0.165 174.485 174.600 0.083 0.000 1.074 6365 S CA 0.359 58.577 58.200 0.029 0.000 1.026 6365 S CB -2.153 61.055 63.200 0.013 0.000 0.908 6365 S HN 0.590 nan 8.310 nan 0.000 0.479 6366 Y N 2.084 122.381 120.300 -0.005 0.000 2.717 6366 Y HA 0.234 4.785 4.550 0.003 0.000 0.330 6366 Y C -1.782 174.156 175.900 0.064 0.000 1.217 6366 Y CA -1.107 57.031 58.100 0.064 0.000 1.506 6366 Y CB 0.459 38.983 38.460 0.106 0.000 1.268 6366 Y HN 0.049 nan 8.280 nan 0.000 0.561 6367 P HA 0.149 nan 4.420 nan 0.000 0.232 6367 P C -1.124 176.182 177.300 0.009 0.000 1.738 6367 P CA 0.549 63.593 63.100 -0.094 0.000 0.948 6367 P CB -0.276 31.324 31.700 -0.166 0.000 1.943 6368 L N 1.049 122.364 121.223 0.153 0.000 2.404 6368 L HA 0.288 4.630 4.340 0.003 0.000 0.272 6368 L C 0.773 177.732 176.870 0.148 0.000 0.980 6368 L CA -0.075 54.882 54.840 0.194 0.000 0.836 6368 L CB 1.977 44.261 42.059 0.373 0.000 1.238 6368 L HN 0.057 nan 8.230 nan 0.000 0.408 6369 S N 0.113 115.874 115.700 0.102 0.000 2.651 6369 S HA 0.271 4.743 4.470 0.003 0.000 0.259 6369 S C 0.280 174.927 174.600 0.079 0.000 1.073 6369 S CA -0.536 57.718 58.200 0.089 0.000 1.090 6369 S CB 0.580 63.819 63.200 0.065 0.000 1.042 6369 S HN 0.436 nan 8.310 nan 0.000 0.581 6370 E N 1.482 121.723 120.200 0.069 0.000 2.266 6370 E HA 0.461 4.813 4.350 0.003 0.000 0.277 6370 E C 0.860 177.501 176.600 0.068 0.000 1.018 6370 E CA 0.033 56.467 56.400 0.057 0.000 0.840 6370 E CB 1.413 31.135 29.700 0.037 0.000 1.082 6370 E HN 0.357 nan 8.360 nan 0.000 0.395 6371 G N 2.283 111.120 108.800 0.061 0.000 2.650 6371 G HA2 -0.133 3.829 3.960 0.003 0.000 0.214 6371 G HA3 -0.133 3.829 3.960 0.003 0.000 0.214 6371 G C 0.451 175.387 174.900 0.060 0.000 1.136 6371 G CA 0.280 45.420 45.100 0.068 0.000 0.789 6371 G HN 0.327 nan 8.290 nan 0.000 0.536 6372 Q N -0.389 119.438 119.800 0.045 0.000 2.316 6372 Q HA 0.640 4.981 4.340 0.003 0.000 0.264 6372 Q C -1.655 174.358 176.000 0.021 0.000 0.987 6372 Q CA -0.717 55.107 55.803 0.035 0.000 0.852 6372 Q CB 2.801 31.555 28.738 0.027 0.000 1.287 6372 Q HN 0.133 nan 8.270 nan 0.000 0.448 6373 L N 3.374 124.605 121.223 0.013 0.000 2.385 6373 L HA 0.434 4.776 4.340 0.003 0.000 0.273 6373 L C -1.232 175.624 176.870 -0.023 0.000 0.990 6373 L CA -0.349 54.474 54.840 -0.028 0.000 0.821 6373 L CB 1.663 43.681 42.059 -0.069 0.000 1.279 6373 L HN 0.639 nan 8.230 nan 0.000 0.412 6374 D N 3.002 123.381 120.400 -0.035 0.000 2.268 6374 D HA 0.167 4.809 4.640 0.003 0.000 0.249 6374 D C -0.018 176.265 176.300 -0.029 0.000 1.008 6374 D CA -0.538 53.452 54.000 -0.018 0.000 0.939 6374 D CB 1.277 42.070 40.800 -0.011 0.000 1.170 6374 D HN 0.644 nan 8.370 nan 0.000 0.468 6375 Q N -0.028 119.771 119.800 -0.002 0.000 2.170 6375 Q HA -0.167 4.175 4.340 0.003 0.000 0.203 6375 Q C 1.988 177.991 176.000 0.006 0.000 0.976 6375 Q CA 1.116 56.927 55.803 0.012 0.000 0.858 6375 Q CB 0.024 28.782 28.738 0.033 0.000 0.907 6375 Q HN 0.521 nan 8.270 nan 0.000 0.433 6376 K N 0.436 120.836 120.400 0.000 0.000 2.026 6376 K HA -0.144 4.177 4.320 0.003 0.000 0.208 6376 K C 1.949 178.546 176.600 -0.005 0.000 1.048 6376 K CA 1.724 58.012 56.287 0.003 0.000 0.929 6376 K CB 0.034 32.534 32.500 0.000 0.000 0.713 6376 K HN 0.088 nan 8.250 nan 0.000 0.439 6377 T N 0.812 115.348 114.554 -0.031 0.000 2.777 6377 T HA -0.078 4.274 4.350 0.003 0.000 0.266 6377 T C 1.879 176.517 174.700 -0.103 0.000 1.040 6377 T CA 1.145 63.212 62.100 -0.054 0.000 1.141 6377 T CB -0.292 68.533 68.868 -0.072 0.000 0.868 6377 T HN 0.410 nan 8.240 nan 0.000 0.444 6378 A N 1.905 124.626 122.820 -0.164 0.000 1.892 6378 A HA -0.136 4.186 4.320 0.003 0.000 0.218 6378 A C 2.359 179.954 177.584 0.018 0.000 1.188 6378 A CA 1.755 53.616 52.037 -0.294 0.000 0.631 6378 A CB -0.758 18.127 19.000 -0.191 0.000 0.822 6378 A HN 0.464 nan 8.150 nan 0.000 0.447 6379 M N -0.513 119.134 119.600 0.079 0.000 2.159 6379 M HA -0.136 4.346 4.480 0.003 0.000 0.263 6379 M C 2.442 178.852 176.300 0.184 0.000 1.063 6379 M CA 1.721 57.111 55.300 0.150 0.000 1.110 6379 M CB -0.519 32.137 32.600 0.093 0.000 1.374 6379 M HN 0.430 nan 8.290 nan 0.000 0.411 6380 S N 1.066 116.840 115.700 0.123 0.000 2.356 6380 S HA -0.077 4.395 4.470 0.003 0.000 0.223 6380 S C 1.899 176.613 174.600 0.190 0.000 1.032 6380 S CA 1.172 59.465 58.200 0.155 0.000 1.005 6380 S CB -0.418 62.829 63.200 0.080 0.000 0.867 6380 S HN 0.396 nan 8.310 nan 0.000 0.449 6381 L N 0.590 121.889 121.223 0.128 0.000 2.046 6381 L HA -0.096 4.246 4.340 0.003 0.000 0.208 6381 L C 2.392 179.460 176.870 0.330 0.000 1.077 6381 L CA 0.735 55.670 54.840 0.158 0.000 0.747 6381 L CB -0.515 41.612 42.059 0.114 0.000 0.896 6381 L HN 0.268 nan 8.230 nan 0.000 0.432 6382 L N -0.417 121.070 121.223 0.440 0.000 2.046 6382 L HA -0.257 4.084 4.340 0.003 0.000 0.208 6382 L C 2.251 179.349 176.870 0.380 0.000 1.077 6382 L CA 1.792 56.886 54.840 0.423 0.000 0.747 6382 L CB -0.683 41.629 42.059 0.422 0.000 0.896 6382 L HN 0.368 nan 8.230 nan 0.000 0.432 6383 W N 0.180 121.586 121.300 0.176 0.000 2.388 6383 W HA -0.201 4.462 4.660 0.003 0.000 0.294 6383 W C 1.884 178.497 176.519 0.158 0.000 1.212 6383 W CA 0.750 58.192 57.345 0.162 0.000 1.271 6383 W CB 0.106 29.630 29.460 0.106 0.000 1.126 6383 W HN 0.037 nan 8.180 nan 0.000 0.535 6384 K N 0.574 120.997 120.400 0.040 0.000 2.362 6384 K HA -0.045 4.277 4.320 0.003 0.000 0.200 6384 K C 1.635 178.203 176.600 -0.053 0.000 1.046 6384 K CA 0.915 57.131 56.287 -0.119 0.000 0.952 6384 K CB -0.385 32.086 32.500 -0.049 0.000 0.753 6384 K HN 0.021 nan 8.250 nan 0.000 0.466 6385 S N 0.577 116.317 115.700 0.066 0.000 2.605 6385 S HA 0.007 4.479 4.470 0.003 0.000 0.217 6385 S C 1.159 175.771 174.600 0.019 0.000 0.958 6385 S CA -0.396 57.863 58.200 0.099 0.000 0.919 6385 S CB -0.252 63.056 63.200 0.179 0.000 0.780 6385 S HN 0.281 nan 8.310 nan 0.000 0.507 6386 Y N 4.099 124.315 120.300 -0.140 0.000 2.096 6386 Y HA -0.203 4.349 4.550 0.003 0.000 0.278 6386 Y C -0.736 175.096 175.900 -0.113 0.000 1.192 6386 Y CA 2.118 60.127 58.100 -0.153 0.000 1.143 6386 Y CB -1.204 37.023 38.460 -0.388 0.000 0.963 6386 Y HN 0.261 nan 8.280 nan 0.000 0.505 6387 P HA -0.198 nan 4.420 nan 0.000 0.219 6387 P C 1.350 178.552 177.300 -0.164 0.000 1.146 6387 P CA 1.922 64.973 63.100 -0.081 0.000 0.808 6387 P CB -0.169 31.533 31.700 0.002 0.000 0.779 6388 L N -1.079 120.052 121.223 -0.152 0.000 2.298 6388 L HA 0.025 4.367 4.340 0.003 0.000 0.209 6388 L C 2.443 179.138 176.870 -0.291 0.000 1.084 6388 L CA 0.756 55.482 54.840 -0.191 0.000 0.816 6388 L CB -0.408 41.575 42.059 -0.125 0.000 0.967 6388 L HN -0.108 nan 8.230 nan 0.000 0.460 6389 V N -6.282 113.455 119.914 -0.296 0.000 3.570 6389 V HA 0.128 4.249 4.120 0.003 0.000 0.257 6389 V C 1.261 177.184 176.094 -0.285 0.000 1.272 6389 V CA -0.260 61.862 62.300 -0.296 0.000 1.079 6389 V CB 0.045 31.726 31.823 -0.237 0.000 0.829 6389 V HN 0.441 nan 8.190 nan 0.000 0.454 6390 C N 1.263 120.237 119.300 -0.543 0.000 4.365 6390 C HA -0.177 4.285 4.460 0.003 0.000 0.299 6390 C C 0.615 175.523 174.990 -0.136 0.000 1.409 6390 C CA 0.127 58.654 59.018 -0.818 0.000 2.007 6390 C CB -3.198 24.220 27.740 -0.537 0.000 1.264 6390 C HN 0.671 nan 8.230 nan 0.000 0.777 6391 I N 1.340 121.988 120.570 0.130 0.000 2.301 6391 I HA 0.436 4.608 4.170 0.003 0.000 0.292 6391 I C 1.110 177.571 176.117 0.574 0.000 1.046 6391 I CA 0.216 61.758 61.300 0.405 0.000 1.282 6391 I CB 0.752 38.953 38.000 0.335 0.000 1.409 6391 I HN 0.481 nan 8.210 nan 0.000 0.484 6392 A N 6.269 129.398 122.820 0.515 0.000 2.587 6392 A HA -0.042 4.279 4.320 0.003 0.000 0.233 6392 A C 1.574 179.320 177.584 0.270 0.000 1.049 6392 A CA 0.110 52.413 52.037 0.442 0.000 0.754 6392 A CB 0.153 19.313 19.000 0.266 0.000 0.977 6392 A HN 0.921 nan 8.150 nan 0.000 0.509 6393 K N 0.782 121.204 120.400 0.038 0.000 2.113 6393 K HA -0.224 4.098 4.320 0.003 0.000 0.208 6393 K C 1.368 177.863 176.600 -0.174 0.000 1.047 6393 K CA 2.277 58.344 56.287 -0.367 0.000 0.928 6393 K CB -0.100 31.752 32.500 -1.081 0.000 0.716 6393 K HN 0.828 nan 8.250 nan 0.000 0.446 6394 E N 0.345 120.488 120.200 -0.096 0.000 2.268 6394 E HA -0.130 4.222 4.350 0.003 0.000 0.195 6394 E C 1.528 178.120 176.600 -0.013 0.000 0.995 6394 E CA 0.844 57.209 56.400 -0.058 0.000 0.836 6394 E CB 0.022 29.700 29.700 -0.036 0.000 0.763 6394 E HN 0.356 nan 8.360 nan 0.000 0.491 6395 L N 0.138 121.379 121.223 0.030 0.000 2.529 6395 L HA 0.076 4.417 4.340 0.003 0.000 0.223 6395 L C 1.647 178.563 176.870 0.077 0.000 1.113 6395 L CA -0.175 54.688 54.840 0.039 0.000 0.861 6395 L CB -0.149 41.934 42.059 0.041 0.000 1.012 6395 L HN 0.124 nan 8.230 nan 0.000 0.461 6396 I N 1.070 121.702 120.570 0.104 0.000 2.145 6396 I HA -0.203 3.969 4.170 0.003 0.000 0.244 6396 I C 0.028 176.218 176.117 0.121 0.000 1.075 6396 I CA 1.997 63.386 61.300 0.149 0.000 1.332 6396 I CB -2.245 35.842 38.000 0.145 0.000 1.033 6396 I HN 0.172 nan 8.210 nan 0.000 0.410 6397 P HA -0.165 nan 4.420 nan 0.000 0.215 6397 P C 1.607 178.951 177.300 0.074 0.000 1.157 6397 P CA 1.533 64.669 63.100 0.060 0.000 0.868 6397 P CB -0.007 31.708 31.700 0.025 0.000 0.788 6398 E N -0.380 119.862 120.200 0.071 0.000 2.031 6398 E HA -0.182 4.170 4.350 0.003 0.000 0.193 6398 E C 2.166 178.861 176.600 0.159 0.000 0.994 6398 E CA 1.337 57.794 56.400 0.096 0.000 0.800 6398 E CB -0.780 28.960 29.700 0.067 0.000 0.752 6398 E HN 0.107 nan 8.360 nan 0.000 0.447 6399 A N 1.032 123.960 122.820 0.181 0.000 1.873 6399 A HA -0.252 4.070 4.320 0.003 0.000 0.218 6399 A C 2.449 180.157 177.584 0.207 0.000 1.193 6399 A CA 2.379 54.547 52.037 0.219 0.000 0.629 6399 A CB -1.211 17.971 19.000 0.304 0.000 0.826 6399 A HN 0.238 nan 8.150 nan 0.000 0.447 6400 T N -0.673 114.000 114.554 0.198 0.000 2.746 6400 T HA -0.136 4.216 4.350 0.003 0.000 0.267 6400 T C 1.917 176.710 174.700 0.155 0.000 1.039 6400 T CA 1.739 63.962 62.100 0.205 0.000 1.142 6400 T CB -0.253 68.727 68.868 0.187 0.000 0.866 6400 T HN 0.620 nan 8.240 nan 0.000 0.444 6401 E N 1.353 121.611 120.200 0.097 0.000 2.077 6401 E HA -0.118 4.234 4.350 0.003 0.000 0.193 6401 E C 2.088 178.686 176.600 -0.003 0.000 0.989 6401 E CA 1.252 57.681 56.400 0.048 0.000 0.800 6401 E CB -0.214 29.504 29.700 0.031 0.000 0.746 6401 E HN 0.242 nan 8.360 nan 0.000 0.452 6402 K N -0.801 119.562 120.400 -0.061 0.000 2.063 6402 K HA -0.163 4.159 4.320 0.003 0.000 0.208 6402 K C 1.731 178.183 176.600 -0.248 0.000 1.048 6402 K CA 1.665 57.779 56.287 -0.289 0.000 0.928 6402 K CB -0.551 31.472 32.500 -0.794 0.000 0.713 6402 K HN 0.266 nan 8.250 nan 0.000 0.442 6403 Y N -0.440 119.760 120.300 -0.166 0.000 2.343 6403 Y HA 0.180 4.732 4.550 0.003 0.000 0.294 6403 Y C 1.767 177.672 175.900 0.008 0.000 1.122 6403 Y CA 0.810 58.874 58.100 -0.060 0.000 1.173 6403 Y CB 0.243 38.722 38.460 0.031 0.000 1.077 6403 Y HN -0.086 nan 8.280 nan 0.000 0.542 6404 L N -1.793 119.548 121.223 0.196 0.000 2.416 6404 L HA 0.165 4.506 4.340 0.003 0.000 0.216 6404 L C 2.296 179.209 176.870 0.071 0.000 1.098 6404 L CA 0.765 55.690 54.840 0.141 0.000 0.840 6404 L CB -0.710 41.443 42.059 0.157 0.000 0.981 6404 L HN 0.211 nan 8.230 nan 0.000 0.462 6405 G N 0.288 109.113 108.800 0.041 0.000 2.625 6405 G HA2 -0.086 3.875 3.960 0.003 0.000 0.214 6405 G HA3 -0.086 3.875 3.960 0.003 0.000 0.214 6405 G C 1.463 176.362 174.900 -0.002 0.000 1.132 6405 G CA 0.620 45.729 45.100 0.014 0.000 0.782 6405 G HN 0.433 nan 8.290 nan 0.000 0.538 6406 G N 0.518 109.314 108.800 -0.007 0.000 2.639 6406 G HA2 0.025 3.986 3.960 0.003 0.000 0.216 6406 G HA3 0.025 3.986 3.960 0.003 0.000 0.216 6406 G C 1.153 176.052 174.900 -0.002 0.000 1.267 6406 G CA 1.650 46.739 45.100 -0.019 0.000 0.801 6406 G HN 0.727 nan 8.290 nan 0.000 0.592 6407 T N -3.215 111.348 114.554 0.014 0.000 2.922 6407 T HA 0.525 4.877 4.350 0.003 0.000 0.281 6407 T C -0.198 174.515 174.700 0.021 0.000 1.005 6407 T CA -0.458 61.652 62.100 0.016 0.000 0.982 6407 T CB 2.096 70.978 68.868 0.022 0.000 1.158 6407 T HN 0.011 nan 8.240 nan 0.000 0.566 6408 D N 0.362 120.773 120.400 0.019 0.000 2.463 6408 D HA 0.160 4.802 4.640 0.003 0.000 0.224 6408 D C -0.592 175.722 176.300 0.022 0.000 1.174 6408 D CA -0.055 53.956 54.000 0.019 0.000 0.829 6408 D CB 0.273 41.081 40.800 0.014 0.000 0.993 6408 D HN 0.530 nan 8.370 nan 0.000 0.497 6409 D N 1.180 121.597 120.400 0.028 0.000 2.443 6409 D HA 0.022 4.664 4.640 0.003 0.000 0.221 6409 D C 1.467 177.791 176.300 0.040 0.000 1.097 6409 D CA -0.185 53.834 54.000 0.031 0.000 0.865 6409 D CB 1.192 42.012 40.800 0.033 0.000 1.034 6409 D HN -0.049 nan 8.370 nan 0.000 0.511 6410 T N 0.205 114.780 114.554 0.035 0.000 2.929 6410 T HA -0.108 4.244 4.350 0.003 0.000 0.271 6410 T C 1.923 176.652 174.700 0.048 0.000 1.085 6410 T CA 0.597 62.719 62.100 0.037 0.000 1.125 6410 T CB -0.027 68.856 68.868 0.026 0.000 0.874 6410 T HN 0.202 nan 8.240 nan 0.000 0.494 6411 V N 1.520 121.463 119.914 0.048 0.000 2.379 6411 V HA -0.039 4.083 4.120 0.003 0.000 0.245 6411 V C 2.743 178.881 176.094 0.073 0.000 1.044 6411 V CA 1.695 64.029 62.300 0.057 0.000 1.036 6411 V CB -0.522 31.329 31.823 0.048 0.000 0.664 6411 V HN 0.479 nan 8.190 nan 0.000 0.453 6412 K N 0.046 120.487 120.400 0.068 0.000 2.288 6412 K HA -0.125 4.197 4.320 0.003 0.000 0.201 6412 K C 2.138 178.802 176.600 0.105 0.000 1.048 6412 K CA 0.986 57.322 56.287 0.080 0.000 0.956 6412 K CB -0.005 32.533 32.500 0.063 0.000 0.746 6412 K HN 0.368 nan 8.250 nan 0.000 0.461 6413 K N 0.775 121.234 120.400 0.099 0.000 2.097 6413 K HA -0.174 4.148 4.320 0.003 0.000 0.205 6413 K C 2.008 178.712 176.600 0.174 0.000 1.050 6413 K CA 1.689 58.050 56.287 0.124 0.000 0.938 6413 K CB 0.029 32.580 32.500 0.086 0.000 0.718 6413 K HN 0.143 nan 8.250 nan 0.000 0.442 6414 K N 0.882 121.374 120.400 0.153 0.000 2.155 6414 K HA -0.087 4.235 4.320 0.003 0.000 0.203 6414 K C 1.256 178.017 176.600 0.269 0.000 1.052 6414 K CA 1.696 58.107 56.287 0.207 0.000 0.948 6414 K CB 0.057 32.645 32.500 0.147 0.000 0.728 6414 K HN -0.088 nan 8.250 nan 0.000 0.448 6415 D N 1.034 121.555 120.400 0.202 0.000 2.117 6415 D HA -0.087 4.555 4.640 0.003 0.000 0.198 6415 D C 1.894 178.319 176.300 0.209 0.000 0.982 6415 D CA 1.178 55.291 54.000 0.188 0.000 0.828 6415 D CB -0.112 40.772 40.800 0.140 0.000 0.967 6415 D HN 0.224 nan 8.370 nan 0.000 0.464 6416 L N -0.343 121.014 121.223 0.224 0.000 2.217 6416 L HA -0.076 4.265 4.340 0.003 0.000 0.211 6416 L C 2.211 179.252 176.870 0.286 0.000 1.107 6416 L CA 0.335 55.334 54.840 0.264 0.000 0.783 6416 L CB -0.266 41.947 42.059 0.256 0.000 0.919 6416 L HN -0.048 nan 8.230 nan 0.000 0.442 6417 F N 0.760 120.789 119.950 0.131 0.000 2.146 6417 F HA -0.158 4.371 4.527 0.003 0.000 0.298 6417 F C 2.103 177.925 175.800 0.036 0.000 1.096 6417 F CA 1.394 59.441 58.000 0.079 0.000 1.275 6417 F CB -0.111 38.953 39.000 0.107 0.000 1.008 6417 F HN -0.127 nan 8.300 nan 0.000 0.480 6418 L N -0.210 121.079 121.223 0.109 0.000 2.141 6418 L HA -0.191 4.151 4.340 0.003 0.000 0.209 6418 L C 2.028 178.886 176.870 -0.019 0.000 1.094 6418 L CA 1.158 56.029 54.840 0.053 0.000 0.763 6418 L CB -0.785 41.413 42.059 0.232 0.000 0.908 6418 L HN 0.079 nan 8.230 nan 0.000 0.437 6419 D N 0.091 120.521 120.400 0.050 0.000 2.144 6419 D HA -0.148 4.493 4.640 0.003 0.000 0.200 6419 D C 2.083 178.355 176.300 -0.048 0.000 0.978 6419 D CA 0.918 54.974 54.000 0.093 0.000 0.833 6419 D CB -0.047 40.893 40.800 0.232 0.000 0.961 6419 D HN 0.157 nan 8.370 nan 0.000 0.470 6420 L N 1.259 122.301 121.223 -0.302 0.000 2.017 6420 L HA -0.151 4.191 4.340 0.003 0.000 0.208 6420 L C 1.944 178.459 176.870 -0.592 0.000 1.073 6420 L CA 1.526 55.921 54.840 -0.741 0.000 0.745 6420 L CB -0.855 40.677 42.059 -0.878 0.000 0.894 6420 L HN -0.079 nan 8.230 nan 0.000 0.432 6421 I N 0.524 120.693 120.570 -0.668 0.000 2.179 6421 I HA -0.259 3.913 4.170 0.003 0.000 0.242 6421 I C 2.763 178.573 176.117 -0.512 0.000 1.088 6421 I CA 1.508 62.348 61.300 -0.766 0.000 1.357 6421 I CB -1.942 35.270 38.000 -1.314 0.000 1.051 6421 I HN 0.391 nan 8.210 nan 0.000 0.409 6422 A N 0.820 123.480 122.820 -0.266 0.000 1.883 6422 A HA -0.243 4.079 4.320 0.003 0.000 0.217 6422 A C 1.994 179.585 177.584 0.011 0.000 1.186 6422 A CA 2.193 54.256 52.037 0.043 0.000 0.624 6422 A CB -0.716 18.366 19.000 0.138 0.000 0.822 6422 A HN 0.381 nan 8.150 nan 0.000 0.444 6423 D N -0.449 119.906 120.400 -0.076 0.000 2.144 6423 D HA -0.088 4.554 4.640 0.003 0.000 0.199 6423 D C 2.025 178.148 176.300 -0.295 0.000 0.984 6423 D CA 1.421 55.378 54.000 -0.071 0.000 0.834 6423 D CB -0.355 40.501 40.800 0.093 0.000 0.955 6423 D HN 0.255 nan 8.370 nan 0.000 0.465 6424 V N 0.558 120.155 119.914 -0.529 0.000 2.453 6424 V HA -0.153 3.969 4.120 0.003 0.000 0.247 6424 V C 2.388 178.190 176.094 -0.486 0.000 1.048 6424 V CA 1.160 63.062 62.300 -0.663 0.000 1.049 6424 V CB -0.296 31.049 31.823 -0.797 0.000 0.672 6424 V HN 0.187 nan 8.190 nan 0.000 0.457 6425 M N -1.606 117.696 119.600 -0.497 0.000 2.248 6425 M HA 0.062 4.544 4.480 0.003 0.000 0.265 6425 M C 1.814 177.570 176.300 -0.906 0.000 1.079 6425 M CA 2.058 56.912 55.300 -0.744 0.000 1.150 6425 M CB -0.063 31.994 32.600 -0.906 0.000 1.366 6425 M HN 0.359 nan 8.290 nan 0.000 0.433 6426 F N -1.800 118.073 119.950 -0.128 0.000 2.495 6426 F HA 0.349 4.878 4.527 0.003 0.000 0.272 6426 F C 2.381 178.129 175.800 -0.087 0.000 0.919 6426 F CA 0.215 58.168 58.000 -0.079 0.000 1.178 6426 F CB -1.280 37.714 39.000 -0.011 0.000 1.030 6426 F HN 0.029 nan 8.300 nan 0.000 0.777 6427 G N 1.021 109.894 108.800 0.122 0.000 2.586 6427 G HA2 -0.234 3.728 3.960 0.003 0.000 0.218 6427 G HA3 -0.234 3.728 3.960 0.003 0.000 0.218 6427 G C 1.689 176.590 174.900 0.001 0.000 1.216 6427 G CA 1.893 47.020 45.100 0.045 0.000 0.786 6427 G HN 0.186 nan 8.290 nan 0.000 0.583 6428 V N 2.088 121.996 119.914 -0.010 0.000 2.358 6428 V HA -0.087 4.035 4.120 0.003 0.000 0.246 6428 V C 0.330 176.412 176.094 -0.020 0.000 1.047 6428 V CA 2.154 64.466 62.300 0.020 0.000 1.035 6428 V CB -1.004 30.849 31.823 0.051 0.000 0.658 6428 V HN 0.297 nan 8.190 nan 0.000 0.452 6429 P HA -0.094 nan 4.420 nan 0.000 0.215 6429 P C 2.011 179.266 177.300 -0.075 0.000 1.153 6429 P CA 1.674 64.720 63.100 -0.090 0.000 0.853 6429 P CB -0.052 31.561 31.700 -0.146 0.000 0.788 6430 S N -0.734 114.920 115.700 -0.077 0.000 2.356 6430 S HA -0.111 4.361 4.470 0.003 0.000 0.223 6430 S C 2.008 176.506 174.600 -0.169 0.000 1.032 6430 S CA 1.291 59.415 58.200 -0.127 0.000 1.005 6430 S CB -1.259 61.862 63.200 -0.132 0.000 0.867 6430 S HN -0.050 nan 8.310 nan 0.000 0.449 6431 V N 2.129 121.964 119.914 -0.131 0.000 2.343 6431 V HA -0.140 3.982 4.120 0.003 0.000 0.247 6431 V C 2.039 178.111 176.094 -0.037 0.000 1.051 6431 V CA 1.411 63.639 62.300 -0.120 0.000 1.036 6431 V CB -0.666 31.134 31.823 -0.038 0.000 0.654 6431 V HN 0.452 nan 8.190 nan 0.000 0.451 6432 I N -0.456 120.108 120.570 -0.009 0.000 2.286 6432 I HA -0.195 3.977 4.170 0.003 0.000 0.248 6432 I C 2.338 178.465 176.117 0.017 0.000 1.115 6432 I CA 1.146 62.459 61.300 0.022 0.000 1.392 6432 I CB -0.334 37.677 38.000 0.018 0.000 1.065 6432 I HN 0.162 nan 8.210 nan 0.000 0.418 6433 V N 0.926 120.827 119.914 -0.022 0.000 2.358 6433 V HA -0.233 3.889 4.120 0.003 0.000 0.246 6433 V C 2.695 178.795 176.094 0.011 0.000 1.047 6433 V CA 1.865 64.166 62.300 0.002 0.000 1.035 6433 V CB -0.807 30.999 31.823 -0.027 0.000 0.658 6433 V HN 0.469 nan 8.190 nan 0.000 0.452 6434 A N -0.004 122.752 122.820 -0.107 0.000 1.902 6434 A HA -0.217 4.105 4.320 0.003 0.000 0.217 6434 A C 2.366 180.033 177.584 0.137 0.000 1.181 6434 A CA 1.742 53.697 52.037 -0.137 0.000 0.623 6434 A CB -0.478 18.209 19.000 -0.521 0.000 0.818 6434 A HN 0.493 nan 8.150 nan 0.000 0.443 6435 R N -0.338 120.276 120.500 0.189 0.000 2.081 6435 R HA -0.089 4.253 4.340 0.003 0.000 0.235 6435 R C 1.819 178.217 176.300 0.163 0.000 1.131 6435 R CA 1.405 57.658 56.100 0.255 0.000 0.960 6435 R CB -0.327 30.090 30.300 0.195 0.000 0.856 6435 R HN 0.531 nan 8.270 nan 0.000 0.436 6436 N N -0.039 118.741 118.700 0.133 0.000 2.216 6436 N HA -0.155 4.587 4.740 0.003 0.000 0.183 6436 N C 1.669 177.261 175.510 0.137 0.000 1.017 6436 N CA 1.137 54.253 53.050 0.111 0.000 0.861 6436 N CB -0.210 38.332 38.487 0.091 0.000 0.986 6436 N HN 0.334 nan 8.380 nan 0.000 0.428 6437 H N 1.513 120.646 119.070 0.106 0.000 2.357 6437 H HA 0.046 4.604 4.556 0.003 0.000 0.301 6437 H C 2.281 177.677 175.328 0.114 0.000 1.082 6437 H CA 1.539 57.669 56.048 0.137 0.000 1.342 6437 H CB 0.138 30.026 29.762 0.210 0.000 1.389 6437 H HN 0.061 nan 8.280 nan 0.000 0.511 6438 R N 0.320 120.922 120.500 0.170 0.000 2.070 6438 R HA -0.128 4.214 4.340 0.003 0.000 0.233 6438 R C 1.175 177.485 176.300 0.017 0.000 1.137 6438 R CA 1.962 58.121 56.100 0.098 0.000 0.945 6438 R CB -0.170 30.225 30.300 0.157 0.000 0.845 6438 R HN 0.383 nan 8.270 nan 0.000 0.430 6439 D N 0.341 120.761 120.400 0.034 0.000 2.309 6439 D HA -0.095 4.547 4.640 0.003 0.000 0.212 6439 D C 1.228 177.521 176.300 -0.011 0.000 0.968 6439 D CA 1.120 55.127 54.000 0.011 0.000 0.882 6439 D CB 0.029 40.844 40.800 0.026 0.000 0.918 6439 D HN 0.409 nan 8.370 nan 0.000 0.503 6440 A N -0.206 122.591 122.820 -0.039 0.000 2.238 6440 A HA 0.404 4.725 4.320 0.003 0.000 0.208 6440 A C 1.789 179.323 177.584 -0.084 0.000 1.177 6440 A CA 0.879 52.880 52.037 -0.059 0.000 0.804 6440 A CB -0.210 18.740 19.000 -0.083 0.000 0.823 6440 A HN 0.223 nan 8.150 nan 0.000 0.482 6441 G N -2.205 106.548 108.800 -0.078 0.000 2.143 6441 G HA2 0.095 4.056 3.960 0.003 0.000 0.249 6441 G HA3 0.095 4.056 3.960 0.003 0.000 0.249 6441 G C 0.329 175.179 174.900 -0.083 0.000 0.981 6441 G CA 0.343 45.405 45.100 -0.063 0.000 0.665 6441 G HN 1.598 nan 8.290 nan 0.000 0.528 6442 A N 0.021 122.740 122.820 -0.168 0.000 2.306 6442 A HA 0.855 5.177 4.320 0.003 0.000 0.330 6442 A C -2.301 175.297 177.584 0.022 0.000 1.146 6442 A CA -1.604 50.351 52.037 -0.136 0.000 0.827 6442 A CB 1.047 19.823 19.000 -0.372 0.000 1.178 6442 A HN 0.081 nan 8.150 nan 0.000 0.490 6443 P HA 0.237 nan 4.420 nan 0.000 0.266 6443 P C -0.583 176.869 177.300 0.253 0.000 1.215 6443 P CA 0.670 63.858 63.100 0.147 0.000 0.763 6443 P CB 0.677 32.505 31.700 0.213 0.000 0.806 6444 T N 3.415 117.997 114.554 0.047 0.000 2.876 6444 T HA 0.555 4.907 4.350 0.003 0.000 0.289 6444 T C -0.990 173.530 174.700 -0.300 0.000 1.014 6444 T CA -0.260 61.884 62.100 0.074 0.000 0.986 6444 T CB 0.769 69.778 68.868 0.235 0.000 1.021 6444 T HN 0.118 nan 8.240 nan 0.000 0.458 6445 Y N 1.105 121.362 120.300 -0.071 0.000 2.524 6445 Y HA 0.702 5.254 4.550 0.003 0.000 0.347 6445 Y C -0.042 175.812 175.900 -0.076 0.000 1.005 6445 Y CA -1.112 56.912 58.100 -0.128 0.000 1.025 6445 Y CB 2.112 40.200 38.460 -0.620 0.000 1.275 6445 Y HN 0.360 nan 8.280 nan 0.000 0.460 6446 M N 3.158 122.983 119.600 0.375 0.000 2.550 6446 M HA 0.507 4.988 4.480 0.003 0.000 0.292 6446 M C -1.604 175.001 176.300 0.508 0.000 1.221 6446 M CA -0.955 54.458 55.300 0.187 0.000 0.873 6446 M CB 3.229 35.700 32.600 -0.216 0.000 1.727 6446 M HN 0.782 nan 8.290 nan 0.000 0.459 6447 Y N -1.285 119.153 120.300 0.231 0.000 2.655 6447 Y HA 0.764 5.316 4.550 0.003 0.000 0.336 6447 Y C -1.626 174.362 175.900 0.146 0.000 1.154 6447 Y CA -0.960 57.224 58.100 0.140 0.000 1.055 6447 Y CB 1.633 40.096 38.460 0.004 0.000 1.295 6447 Y HN 0.692 nan 8.280 nan 0.000 0.465 6448 E N 2.115 122.578 120.200 0.440 0.000 2.265 6448 E HA 0.309 4.661 4.350 0.003 0.000 0.262 6448 E C -2.308 174.562 176.600 0.450 0.000 0.889 6448 E CA -0.751 55.850 56.400 0.334 0.000 0.789 6448 E CB 1.478 31.324 29.700 0.244 0.000 1.221 6448 E HN 0.646 nan 8.360 nan 0.000 0.414 6449 F N 3.833 124.004 119.950 0.368 0.000 2.411 6449 F HA 0.267 4.795 4.527 0.003 0.000 0.350 6449 F C -0.303 175.613 175.800 0.193 0.000 1.114 6449 F CA -0.137 58.019 58.000 0.260 0.000 1.135 6449 F CB 1.120 40.288 39.000 0.279 0.000 1.120 6449 F HN 0.439 nan 8.300 nan 0.000 0.495 6450 Q N 7.121 126.739 119.800 -0.303 0.000 2.695 6450 Q HA 0.293 4.635 4.340 0.003 0.000 0.246 6450 Q C -2.345 173.531 176.000 -0.207 0.000 0.961 6450 Q CA -0.616 55.113 55.803 -0.125 0.000 0.708 6450 Q CB 0.993 29.718 28.738 -0.022 0.000 1.282 6450 Q HN 0.796 nan 8.270 nan 0.000 0.482 6451 Y N 1.113 121.234 120.300 -0.299 0.000 2.521 6451 Y HA 0.352 4.903 4.550 0.002 0.000 0.328 6451 Y C -1.924 174.001 175.900 0.042 0.000 1.151 6451 Y CA -0.820 57.161 58.100 -0.198 0.000 1.054 6451 Y CB 1.564 39.790 38.460 -0.391 0.000 1.338 6451 Y HN 0.556 nan 8.280 nan 0.000 0.453 6452 R N 7.101 127.248 120.500 -0.590 0.000 2.247 6452 R HA 0.459 4.800 4.340 0.003 0.000 0.329 6452 R C -2.719 173.313 176.300 -0.447 0.000 1.014 6452 R CA -1.973 53.918 56.100 -0.349 0.000 0.907 6452 R CB 0.794 30.911 30.300 -0.304 0.000 1.146 6452 R HN 0.408 nan 8.270 nan 0.000 0.499 6453 P HA -0.020 nan 4.420 nan 0.000 0.269 6453 P C 0.200 177.288 177.300 -0.352 0.000 1.209 6453 P CA 0.021 63.066 63.100 -0.092 0.000 0.776 6453 P CB 1.391 33.104 31.700 0.021 0.000 0.876 6454 S N 1.094 116.458 115.700 -0.560 0.000 2.474 6454 S HA -0.096 4.376 4.470 0.003 0.000 0.235 6454 S C 1.297 175.467 174.600 -0.717 0.000 0.997 6454 S CA 0.574 58.386 58.200 -0.646 0.000 0.949 6454 S CB -1.130 61.635 63.200 -0.726 0.000 0.766 6454 S HN 0.392 nan 8.310 nan 0.000 0.517 6455 F N 2.404 122.092 119.950 -0.438 0.000 2.811 6455 F HA 0.315 4.843 4.527 0.002 0.000 0.301 6455 F C 1.395 176.922 175.800 -0.455 0.000 1.151 6455 F CA -0.413 57.272 58.000 -0.527 0.000 1.412 6455 F CB -0.634 37.806 39.000 -0.934 0.000 1.113 6455 F HN 0.011 nan 8.300 nan 0.000 0.579 6456 S N 0.220 115.754 115.700 -0.277 0.000 2.569 6456 S HA -0.011 4.461 4.470 0.003 0.000 0.274 6456 S C 0.599 175.140 174.600 -0.099 0.000 1.353 6456 S CA -0.485 57.631 58.200 -0.141 0.000 1.023 6456 S CB 0.617 63.707 63.200 -0.183 0.000 0.876 6456 S HN 0.296 nan 8.310 nan 0.000 0.540 6457 S N 0.406 116.066 115.700 -0.067 0.000 2.562 6457 S HA 0.035 4.507 4.470 0.003 0.000 0.281 6457 S C 0.563 175.054 174.600 -0.181 0.000 1.333 6457 S CA -0.662 57.504 58.200 -0.056 0.000 1.052 6457 S CB 0.216 63.453 63.200 0.061 0.000 0.884 6457 S HN 0.571 nan 8.310 nan 0.000 0.506 6458 D N 3.644 123.986 120.400 -0.096 0.000 2.309 6458 D HA -0.067 4.575 4.640 0.003 0.000 0.212 6458 D C 1.348 177.568 176.300 -0.133 0.000 0.968 6458 D CA 1.344 55.279 54.000 -0.108 0.000 0.882 6458 D CB -0.141 40.629 40.800 -0.050 0.000 0.918 6458 D HN 0.631 nan 8.370 nan 0.000 0.503 6459 M N -0.267 119.256 119.600 -0.128 0.000 2.561 6459 M HA 0.026 4.507 4.480 0.003 0.000 0.238 6459 M C 0.831 176.895 176.300 -0.394 0.000 1.131 6459 M CA 0.155 55.414 55.300 -0.068 0.000 1.046 6459 M CB 0.337 33.079 32.600 0.238 0.000 1.532 6459 M HN -0.242 nan 8.290 nan 0.000 0.497 6460 K N 2.452 122.325 120.400 -0.879 0.000 2.248 6460 K HA 0.305 4.627 4.320 0.003 0.000 0.281 6460 K C -2.486 173.738 176.600 -0.627 0.000 1.054 6460 K CA -1.756 53.699 56.287 -1.388 0.000 0.903 6460 K CB 0.936 32.572 32.500 -1.440 0.000 1.077 6460 K HN -0.155 nan 8.250 nan 0.000 0.474 6461 P HA -0.023 nan 4.420 nan 0.000 0.266 6461 P C -0.314 176.868 177.300 -0.196 0.000 1.195 6461 P CA 0.090 63.062 63.100 -0.214 0.000 0.768 6461 P CB 0.579 32.217 31.700 -0.103 0.000 0.838 6462 K N 0.661 120.973 120.400 -0.147 0.000 2.280 6462 K HA -0.104 4.218 4.320 0.003 0.000 0.202 6462 K C 1.638 178.173 176.600 -0.107 0.000 1.047 6462 K CA 1.736 57.940 56.287 -0.138 0.000 0.942 6462 K CB -0.537 31.893 32.500 -0.116 0.000 0.739 6462 K HN 0.625 nan 8.250 nan 0.000 0.457 6463 T N -1.254 113.255 114.554 -0.074 0.000 2.995 6463 T HA -0.007 4.345 4.350 0.003 0.000 0.269 6463 T C 0.943 175.627 174.700 -0.025 0.000 1.091 6463 T CA 0.099 62.175 62.100 -0.040 0.000 1.128 6463 T CB -0.255 68.607 68.868 -0.010 0.000 0.891 6463 T HN -0.175 nan 8.240 nan 0.000 0.492 6464 V N 2.590 122.483 119.914 -0.036 0.000 2.446 6464 V HA 0.344 4.466 4.120 0.003 0.000 0.276 6464 V C 0.092 176.181 176.094 -0.008 0.000 1.030 6464 V CA -0.276 62.027 62.300 0.006 0.000 1.033 6464 V CB -0.098 31.737 31.823 0.020 0.000 0.993 6464 V HN 0.444 nan 8.190 nan 0.000 0.477 6465 I N 3.769 124.355 120.570 0.026 0.000 2.466 6465 I HA 0.620 4.792 4.170 0.003 0.000 0.289 6465 I C 0.844 177.020 176.117 0.097 0.000 1.026 6465 I CA -0.497 60.813 61.300 0.017 0.000 1.078 6465 I CB 1.813 39.800 38.000 -0.020 0.000 1.249 6465 I HN 0.786 nan 8.210 nan 0.000 0.429 6466 G N 3.641 112.540 108.800 0.165 0.000 2.289 6466 G HA2 -0.228 3.734 3.960 0.003 0.000 0.280 6466 G HA3 -0.228 3.734 3.960 0.003 0.000 0.280 6466 G C -0.324 174.727 174.900 0.252 0.000 1.089 6466 G CA -0.090 45.183 45.100 0.287 0.000 0.939 6466 G HN 0.717 nan 8.290 nan 0.000 0.499 6467 D N -0.826 119.716 120.400 0.236 0.000 2.377 6467 D HA 0.378 5.020 4.640 0.003 0.000 0.245 6467 D C 0.946 177.388 176.300 0.237 0.000 1.196 6467 D CA -0.477 53.666 54.000 0.238 0.000 0.962 6467 D CB 0.388 41.352 40.800 0.273 0.000 1.127 6467 D HN 0.377 nan 8.370 nan 0.000 0.471 6468 H N -0.278 118.857 119.070 0.108 0.000 3.094 6468 H HA 0.286 4.844 4.556 0.003 0.000 0.320 6468 H C 1.377 176.778 175.328 0.121 0.000 1.000 6468 H CA 1.835 57.910 56.048 0.045 0.000 1.413 6468 H CB 0.125 29.896 29.762 0.017 0.000 1.405 6468 H HN 0.583 nan 8.280 nan 0.000 0.586 6469 G N 4.224 112.821 108.800 -0.338 0.000 2.205 6469 G HA2 -0.356 3.606 3.960 0.003 0.000 0.261 6469 G HA3 -0.356 3.606 3.960 0.003 0.000 0.261 6469 G C 1.267 175.989 174.900 -0.296 0.000 0.980 6469 G CA 0.555 45.373 45.100 -0.470 0.000 0.632 6469 G HN 0.652 nan 8.290 nan 0.000 0.533 6470 D N 0.952 121.347 120.400 -0.008 0.000 2.221 6470 D HA -0.057 4.585 4.640 0.003 0.000 0.204 6470 D C 2.433 178.704 176.300 -0.048 0.000 0.982 6470 D CA 1.433 55.549 54.000 0.194 0.000 0.857 6470 D CB -0.062 40.953 40.800 0.359 0.000 0.934 6470 D HN 0.728 nan 8.370 nan 0.000 0.475 6471 E N 1.162 121.012 120.200 -0.584 0.000 2.274 6471 E HA -0.132 4.220 4.350 0.003 0.000 0.194 6471 E C 2.211 178.480 176.600 -0.552 0.000 0.996 6471 E CA 0.259 55.970 56.400 -1.150 0.000 0.840 6471 E CB -0.707 28.262 29.700 -1.219 0.000 0.772 6471 E HN 0.320 nan 8.360 nan 0.000 0.491 6472 L N -0.097 120.872 121.223 -0.422 0.000 2.081 6472 L HA -0.186 4.156 4.340 0.003 0.000 0.212 6472 L C 2.610 179.274 176.870 -0.343 0.000 1.080 6472 L CA 1.705 56.317 54.840 -0.380 0.000 0.754 6472 L CB -0.698 41.029 42.059 -0.554 0.000 0.893 6472 L HN 0.024 nan 8.230 nan 0.000 0.433 6473 F N -0.477 119.368 119.950 -0.175 0.000 2.216 6473 F HA -0.198 4.330 4.527 0.002 0.000 0.300 6473 F C 2.658 178.369 175.800 -0.149 0.000 1.085 6473 F CA 1.349 59.248 58.000 -0.168 0.000 1.326 6473 F CB -0.566 38.381 39.000 -0.088 0.000 1.027 6473 F HN -0.011 nan 8.300 nan 0.000 0.497 6474 S N -0.172 115.530 115.700 0.005 0.000 2.357 6474 S HA -0.106 4.366 4.470 0.003 0.000 0.221 6474 S C 2.291 176.740 174.600 -0.252 0.000 1.031 6474 S CA 0.981 59.130 58.200 -0.085 0.000 0.982 6474 S CB -0.581 62.568 63.200 -0.086 0.000 0.853 6474 S HN 0.120 nan 8.310 nan 0.000 0.458 6475 V N 0.821 120.472 119.914 -0.439 0.000 2.332 6475 V HA -0.144 3.978 4.120 0.003 0.000 0.248 6475 V C 1.393 177.123 176.094 -0.606 0.000 1.055 6475 V CA 1.663 63.563 62.300 -0.667 0.000 1.038 6475 V CB -0.645 30.715 31.823 -0.771 0.000 0.651 6475 V HN 0.470 nan 8.190 nan 0.000 0.450 6476 F N 0.110 119.881 119.950 -0.298 0.000 2.645 6476 F HA 0.451 4.980 4.527 0.003 0.000 0.300 6476 F C 1.621 177.331 175.800 -0.150 0.000 1.115 6476 F CA 0.475 58.328 58.000 -0.246 0.000 1.355 6476 F CB -0.129 38.685 39.000 -0.311 0.000 1.026 6476 F HN 0.232 nan 8.300 nan 0.000 0.536 6477 G N 0.930 109.740 108.800 0.017 0.000 2.323 6477 G HA2 -0.318 3.643 3.960 0.003 0.000 0.292 6477 G HA3 -0.318 3.643 3.960 0.003 0.000 0.292 6477 G C 1.285 176.260 174.900 0.125 0.000 1.040 6477 G CA 0.334 45.539 45.100 0.175 0.000 0.942 6477 G HN 0.577 nan 8.290 nan 0.000 0.506 6478 A N 0.218 123.001 122.820 -0.062 0.000 1.948 6478 A HA 0.058 4.380 4.320 0.003 0.000 0.220 6478 A C 0.648 178.067 177.584 -0.276 0.000 1.177 6478 A CA 2.179 54.049 52.037 -0.278 0.000 0.636 6478 A CB -0.844 17.786 19.000 -0.618 0.000 0.815 6478 A HN 0.482 nan 8.150 nan 0.000 0.449 6479 P HA -0.111 nan 4.420 nan 0.000 0.226 6479 P C 0.461 177.516 177.300 -0.409 0.000 1.146 6479 P CA 0.948 63.928 63.100 -0.200 0.000 0.773 6479 P CB -0.153 31.313 31.700 -0.390 0.000 0.772 6480 F N -2.788 117.191 119.950 0.049 0.000 2.695 6480 F HA 0.226 4.754 4.527 0.001 0.000 0.303 6480 F C 1.736 177.582 175.800 0.078 0.000 1.091 6480 F CA 0.211 58.265 58.000 0.091 0.000 1.300 6480 F CB -0.043 39.036 39.000 0.131 0.000 1.071 6480 F HN -0.188 nan 8.300 nan 0.000 0.578 6481 L N -1.320 119.992 121.223 0.147 0.000 2.600 6481 L HA 0.232 4.574 4.340 0.003 0.000 0.213 6481 L C 0.582 177.489 176.870 0.062 0.000 1.045 6481 L CA 0.113 55.013 54.840 0.098 0.000 0.863 6481 L CB 0.031 42.121 42.059 0.052 0.000 1.189 6481 L HN -0.243 nan 8.230 nan 0.000 0.484 6482 K N 1.224 121.642 120.400 0.031 0.000 2.118 6482 K HA 0.285 4.606 4.320 0.003 0.000 0.264 6482 K C -0.370 176.318 176.600 0.146 0.000 1.000 6482 K CA -0.339 56.001 56.287 0.087 0.000 0.929 6482 K CB 1.131 33.682 32.500 0.084 0.000 1.021 6482 K HN 0.024 nan 8.250 nan 0.000 0.463 6483 E N 0.288 120.568 120.200 0.133 0.000 2.318 6483 E HA 0.317 4.669 4.350 0.003 0.000 0.265 6483 E C -0.175 176.469 176.600 0.073 0.000 1.069 6483 E CA -0.645 55.809 56.400 0.090 0.000 0.893 6483 E CB 1.048 30.781 29.700 0.056 0.000 1.076 6483 E HN 0.731 nan 8.360 nan 0.000 0.414 6484 G N 0.359 109.171 108.800 0.020 0.000 3.379 6484 G HA2 0.133 4.094 3.960 0.003 0.000 0.653 6484 G HA3 0.133 4.094 3.960 0.003 0.000 0.653 6484 G C -0.595 174.253 174.900 -0.088 0.000 0.872 6484 G CA -0.281 44.795 45.100 -0.040 0.000 0.754 6484 G HN 0.780 nan 8.290 nan 0.000 0.467 6485 A N 1.741 124.502 122.820 -0.099 0.000 2.580 6485 A HA 0.922 5.244 4.320 0.003 0.000 0.301 6485 A C 0.145 177.674 177.584 -0.092 0.000 1.054 6485 A CA 0.554 52.511 52.037 -0.133 0.000 0.751 6485 A CB 0.361 19.331 19.000 -0.051 0.000 1.275 6485 A HN 2.523 nan 8.150 nan 0.000 0.403 6486 S N 1.137 116.785 115.700 -0.087 0.000 2.593 6486 S HA 0.340 4.812 4.470 0.003 0.000 0.269 6486 S C 0.749 175.323 174.600 -0.043 0.000 1.334 6486 S CA 0.403 58.571 58.200 -0.053 0.000 1.015 6486 S CB 0.778 63.956 63.200 -0.037 0.000 0.912 6486 S HN 0.711 nan 8.310 nan 0.000 0.541 6487 E N 0.615 120.796 120.200 -0.031 0.000 2.160 6487 E HA -0.242 4.110 4.350 0.003 0.000 0.195 6487 E C 1.929 178.511 176.600 -0.030 0.000 0.991 6487 E CA 1.503 57.888 56.400 -0.025 0.000 0.810 6487 E CB -0.120 29.572 29.700 -0.013 0.000 0.742 6487 E HN 0.916 nan 8.360 nan 0.000 0.466 6488 E N 1.113 121.300 120.200 -0.021 0.000 2.077 6488 E HA -0.254 4.098 4.350 0.003 0.000 0.193 6488 E C 2.002 178.559 176.600 -0.072 0.000 0.989 6488 E CA 1.188 57.571 56.400 -0.028 0.000 0.800 6488 E CB 0.048 29.760 29.700 0.020 0.000 0.746 6488 E HN 0.210 nan 8.360 nan 0.000 0.452 6489 E N 0.146 120.328 120.200 -0.030 0.000 2.107 6489 E HA -0.136 4.216 4.350 0.003 0.000 0.191 6489 E C 2.131 178.681 176.600 -0.083 0.000 0.982 6489 E CA 0.911 57.285 56.400 -0.042 0.000 0.809 6489 E CB -0.005 29.727 29.700 0.054 0.000 0.756 6489 E HN 0.365 nan 8.360 nan 0.000 0.459 6490 I N 0.448 120.957 120.570 -0.103 0.000 2.202 6490 I HA -0.255 3.917 4.170 0.003 0.000 0.242 6490 I C 2.793 178.873 176.117 -0.061 0.000 1.091 6490 I CA 0.993 62.191 61.300 -0.170 0.000 1.368 6490 I CB -0.259 37.649 38.000 -0.153 0.000 1.058 6490 I HN 0.090 nan 8.210 nan 0.000 0.410 6491 R N 0.835 121.310 120.500 -0.042 0.000 2.096 6491 R HA -0.210 4.132 4.340 0.003 0.000 0.235 6491 R C 2.368 178.633 176.300 -0.058 0.000 1.127 6491 R CA 1.423 57.509 56.100 -0.024 0.000 0.968 6491 R CB -0.261 30.018 30.300 -0.035 0.000 0.861 6491 R HN 0.214 nan 8.270 nan 0.000 0.440 6492 L N 0.454 121.606 121.223 -0.117 0.000 2.042 6492 L HA -0.146 4.195 4.340 0.003 0.000 0.210 6492 L C 2.266 179.083 176.870 -0.089 0.000 1.076 6492 L CA 2.124 56.871 54.840 -0.155 0.000 0.749 6492 L CB -0.769 41.089 42.059 -0.335 0.000 0.893 6492 L HN 0.113 nan 8.230 nan 0.000 0.432 6493 S N -1.023 114.643 115.700 -0.056 0.000 2.368 6493 S HA -0.183 4.289 4.470 0.003 0.000 0.224 6493 S C 2.045 176.642 174.600 -0.006 0.000 1.029 6493 S CA 1.321 59.508 58.200 -0.021 0.000 0.988 6493 S CB -0.167 63.053 63.200 0.033 0.000 0.838 6493 S HN 0.536 nan 8.310 nan 0.000 0.462 6494 K N 0.546 120.976 120.400 0.051 0.000 2.057 6494 K HA -0.097 4.225 4.320 0.003 0.000 0.207 6494 K C 2.317 178.878 176.600 -0.064 0.000 1.049 6494 K CA 1.676 57.969 56.287 0.010 0.000 0.931 6494 K CB -0.293 32.249 32.500 0.070 0.000 0.714 6494 K HN 0.447 nan 8.250 nan 0.000 0.440 6495 M N 0.843 120.390 119.600 -0.088 0.000 2.086 6495 M HA -0.173 4.309 4.480 0.003 0.000 0.261 6495 M C 1.967 178.188 176.300 -0.131 0.000 1.067 6495 M CA 1.551 56.742 55.300 -0.181 0.000 1.116 6495 M CB 0.056 32.563 32.600 -0.155 0.000 1.348 6495 M HN -0.049 nan 8.290 nan 0.000 0.407 6496 V N 0.941 120.823 119.914 -0.053 0.000 2.295 6496 V HA -0.313 3.809 4.120 0.003 0.000 0.246 6496 V C 2.432 178.463 176.094 -0.106 0.000 1.049 6496 V CA 2.009 64.262 62.300 -0.080 0.000 1.024 6496 V CB -0.650 30.956 31.823 -0.362 0.000 0.648 6496 V HN 0.560 nan 8.190 nan 0.000 0.447 6497 M N -0.985 118.521 119.600 -0.156 0.000 2.159 6497 M HA -0.165 4.317 4.480 0.003 0.000 0.263 6497 M C 2.372 178.696 176.300 0.040 0.000 1.063 6497 M CA 1.560 56.791 55.300 -0.116 0.000 1.110 6497 M CB -0.475 32.036 32.600 -0.149 0.000 1.374 6497 M HN 0.159 nan 8.290 nan 0.000 0.411 6498 K N 0.382 120.794 120.400 0.019 0.000 2.026 6498 K HA -0.058 4.264 4.320 0.003 0.000 0.208 6498 K C 1.778 178.483 176.600 0.175 0.000 1.048 6498 K CA 1.607 57.912 56.287 0.031 0.000 0.929 6498 K CB -0.583 31.860 32.500 -0.096 0.000 0.713 6498 K HN 0.336 nan 8.250 nan 0.000 0.439 6499 F N -0.803 119.292 119.950 0.241 0.000 2.095 6499 F HA -0.255 4.274 4.527 0.003 0.000 0.298 6499 F C 2.502 178.507 175.800 0.341 0.000 1.104 6499 F CA 0.651 58.858 58.000 0.344 0.000 1.232 6499 F CB -0.166 39.202 39.000 0.612 0.000 0.987 6499 F HN 0.223 nan 8.300 nan 0.000 0.475 6500 W N -0.167 121.236 121.300 0.172 0.000 2.379 6500 W HA -0.176 4.487 4.660 0.004 0.000 0.307 6500 W C 2.583 179.105 176.519 0.005 0.000 1.200 6500 W CA 0.914 58.273 57.345 0.023 0.000 1.297 6500 W CB -0.501 28.898 29.460 -0.102 0.000 1.140 6500 W HN -0.035 nan 8.180 nan 0.000 0.507 6501 A N 0.465 123.418 122.820 0.221 0.000 1.968 6501 A HA -0.187 4.135 4.320 0.003 0.000 0.217 6501 A C 1.684 179.319 177.584 0.085 0.000 1.169 6501 A CA 1.578 53.672 52.037 0.095 0.000 0.638 6501 A CB -0.876 18.160 19.000 0.061 0.000 0.812 6501 A HN 0.209 nan 8.150 nan 0.000 0.446 6502 N N -0.788 117.988 118.700 0.127 0.000 2.120 6502 N HA -0.131 4.611 4.740 0.003 0.000 0.188 6502 N C 1.355 176.897 175.510 0.054 0.000 1.024 6502 N CA 1.355 54.460 53.050 0.092 0.000 0.852 6502 N CB -0.594 37.976 38.487 0.137 0.000 1.003 6502 N HN 0.507 nan 8.380 nan 0.000 0.424 6503 F N 1.634 121.522 119.950 -0.103 0.000 2.171 6503 F HA -0.056 4.472 4.527 0.003 0.000 0.300 6503 F C 2.141 177.862 175.800 -0.130 0.000 1.090 6503 F CA 1.106 58.981 58.000 -0.208 0.000 1.293 6503 F CB -0.418 38.366 39.000 -0.359 0.000 1.013 6503 F HN 0.032 nan 8.300 nan 0.000 0.486 6504 A N 0.451 123.236 122.820 -0.059 0.000 1.902 6504 A HA -0.173 4.149 4.320 0.003 0.000 0.217 6504 A C 2.377 179.885 177.584 -0.126 0.000 1.181 6504 A CA 1.721 53.694 52.037 -0.106 0.000 0.623 6504 A CB -0.622 18.356 19.000 -0.038 0.000 0.818 6504 A HN 0.432 nan 8.150 nan 0.000 0.443 6505 R N -0.536 119.914 120.500 -0.084 0.000 2.057 6505 R HA -0.024 4.318 4.340 0.003 0.000 0.229 6505 R C 0.672 176.908 176.300 -0.107 0.000 1.136 6505 R CA 1.467 57.525 56.100 -0.070 0.000 0.952 6505 R CB -0.176 30.107 30.300 -0.027 0.000 0.848 6505 R HN 0.539 nan 8.270 nan 0.000 0.430 6506 N N -1.091 117.532 118.700 -0.129 0.000 2.177 6506 N HA 0.098 4.840 4.740 0.003 0.000 0.218 6506 N C 0.549 175.936 175.510 -0.205 0.000 1.182 6506 N CA 0.749 53.722 53.050 -0.127 0.000 0.882 6506 N CB 1.730 40.182 38.487 -0.058 0.000 1.052 6506 N HN 0.360 nan 8.380 nan 0.000 0.519 6507 G N 1.530 110.067 108.800 -0.439 0.000 2.168 6507 G HA2 -0.287 3.675 3.960 0.003 0.000 0.257 6507 G HA3 -0.287 3.675 3.960 0.003 0.000 0.257 6507 G C -0.098 174.631 174.900 -0.285 0.000 0.997 6507 G CA 0.359 45.068 45.100 -0.651 0.000 0.708 6507 G HN 0.488 nan 8.290 nan 0.000 0.520 6508 N N -0.547 118.049 118.700 -0.173 0.000 2.454 6508 N HA 0.403 5.145 4.740 0.003 0.000 0.291 6508 N C -1.666 173.754 175.510 -0.151 0.000 1.079 6508 N CA -1.497 51.466 53.050 -0.145 0.000 0.893 6508 N CB 2.353 40.833 38.487 -0.012 0.000 1.512 6508 N HN -0.052 nan 8.380 nan 0.000 0.497 6509 P HA -0.022 nan 4.420 nan 0.000 0.229 6509 P C -0.208 177.211 177.300 0.198 0.000 1.160 6509 P CA 0.363 63.371 63.100 -0.154 0.000 0.777 6509 P CB 0.378 31.659 31.700 -0.698 0.000 0.814 6510 N N 0.833 119.598 118.700 0.107 0.000 2.416 6510 N HA 0.281 5.022 4.740 0.003 0.000 0.246 6510 N C 0.886 176.520 175.510 0.205 0.000 1.260 6510 N CA 1.126 54.333 53.050 0.261 0.000 0.897 6510 N CB 0.516 39.141 38.487 0.230 0.000 1.110 6510 N HN 0.143 nan 8.380 nan 0.000 0.439 6511 G N 0.139 109.061 108.800 0.204 0.000 2.489 6511 G HA2 0.152 4.114 3.960 0.003 0.000 0.291 6511 G HA3 0.152 4.114 3.960 0.003 0.000 0.291 6511 G C -1.440 173.518 174.900 0.097 0.000 1.487 6511 G CA -0.728 44.444 45.100 0.121 0.000 0.795 6511 G HN 0.421 nan 8.290 nan 0.000 0.513 6512 E N -0.383 119.857 120.200 0.067 0.000 2.414 6512 E HA 0.378 4.730 4.350 0.003 0.000 0.263 6512 E C 1.244 177.860 176.600 0.027 0.000 1.000 6512 E CA 1.355 57.786 56.400 0.052 0.000 0.914 6512 E CB 0.828 30.552 29.700 0.039 0.000 0.948 6512 E HN 1.685 nan 8.360 nan 0.000 0.444 6513 G N 2.762 111.578 108.800 0.028 0.000 2.176 6513 G HA2 -0.272 3.690 3.960 0.003 0.000 0.253 6513 G HA3 -0.272 3.690 3.960 0.003 0.000 0.253 6513 G C -0.010 174.877 174.900 -0.022 0.000 0.979 6513 G CA -0.179 44.924 45.100 0.004 0.000 0.641 6513 G HN 0.377 nan 8.290 nan 0.000 0.530 6514 L N 1.582 122.800 121.223 -0.008 0.000 2.346 6514 L HA 0.536 4.877 4.340 0.003 0.000 0.274 6514 L C -1.636 175.314 176.870 0.133 0.000 1.007 6514 L CA -2.370 52.435 54.840 -0.059 0.000 0.818 6514 L CB 1.845 43.750 42.059 -0.257 0.000 1.284 6514 L HN -0.088 nan 8.230 nan 0.000 0.424 6515 P HA -0.028 nan 4.420 nan 0.000 0.268 6515 P C -0.886 176.658 177.300 0.406 0.000 1.208 6515 P CA -0.128 63.130 63.100 0.262 0.000 0.777 6515 P CB 0.388 32.216 31.700 0.213 0.000 0.875 6516 H N 1.649 120.861 119.070 0.238 0.000 2.848 6516 H HA 0.134 4.692 4.556 0.003 0.000 0.317 6516 H C -0.919 174.593 175.328 0.307 0.000 1.046 6516 H CA 0.191 56.399 56.048 0.266 0.000 1.470 6516 H CB 0.127 29.997 29.762 0.182 0.000 1.483 6516 H HN 0.369 nan 8.280 nan 0.000 0.548 6517 W N 10.048 131.102 121.300 -0.410 0.000 2.299 6517 W HA 0.305 4.967 4.660 0.002 0.000 0.319 6517 W C -2.763 173.540 176.519 -0.360 0.000 1.008 6517 W CA -3.209 53.949 57.345 -0.311 0.000 1.384 6517 W CB 0.692 29.942 29.460 -0.350 0.000 1.220 6517 W HN 0.572 nan 8.180 nan 0.000 0.402 6518 P HA 0.022 nan 4.420 nan 0.000 0.272 6518 P C -0.083 177.387 177.300 0.283 0.000 1.223 6518 P CA 0.264 63.474 63.100 0.184 0.000 0.784 6518 P CB 1.391 33.216 31.700 0.208 0.000 0.923 6519 E N 1.152 121.403 120.200 0.085 0.000 2.383 6519 E HA -0.012 4.340 4.350 0.003 0.000 0.264 6519 E C -0.813 175.726 176.600 -0.101 0.000 1.050 6519 E CA -0.448 55.764 56.400 -0.314 0.000 0.896 6519 E CB 0.268 29.797 29.700 -0.285 0.000 0.982 6519 E HN 0.394 nan 8.360 nan 0.000 0.424 6520 Y N 5.569 125.702 120.300 -0.278 0.000 2.568 6520 Y HA 0.028 4.580 4.550 0.003 0.000 0.338 6520 Y C -0.040 175.821 175.900 -0.065 0.000 1.245 6520 Y CA -0.377 57.677 58.100 -0.077 0.000 1.667 6520 Y CB -0.697 37.735 38.460 -0.047 0.000 1.568 6520 Y HN 0.442 nan 8.280 nan 0.000 0.471 6521 N N 0.186 118.739 118.700 -0.245 0.000 2.786 6521 N HA 0.092 4.834 4.740 0.003 0.000 0.315 6521 N C 0.775 176.117 175.510 -0.280 0.000 1.359 6521 N CA -0.305 52.626 53.050 -0.198 0.000 0.846 6521 N CB 0.121 38.548 38.487 -0.100 0.000 1.117 6521 N HN 0.195 nan 8.380 nan 0.000 0.541 6522 Q N -0.230 119.475 119.800 -0.158 0.000 2.291 6522 Q HA -0.014 4.328 4.340 0.003 0.000 0.206 6522 Q C 0.970 176.887 176.000 -0.138 0.000 0.976 6522 Q CA 1.258 56.980 55.803 -0.135 0.000 0.875 6522 Q CB -0.341 28.356 28.738 -0.069 0.000 0.927 6522 Q HN 0.619 nan 8.270 nan 0.000 0.450 6523 K N 0.584 120.909 120.400 -0.124 0.000 2.486 6523 K HA -0.016 4.306 4.320 0.003 0.000 0.194 6523 K C -0.064 176.473 176.600 -0.105 0.000 1.033 6523 K CA -0.031 56.210 56.287 -0.076 0.000 1.004 6523 K CB 0.252 32.736 32.500 -0.027 0.000 0.798 6523 K HN 0.204 nan 8.250 nan 0.000 0.495 6524 E N 0.170 120.190 120.200 -0.300 0.000 2.360 6524 E HA -0.165 4.187 4.350 0.003 0.000 0.238 6524 E C 0.062 176.692 176.600 0.050 0.000 1.186 6524 E CA 0.128 56.238 56.400 -0.483 0.000 0.719 6524 E CB -1.613 27.930 29.700 -0.261 0.000 1.236 6524 E HN 0.502 nan 8.360 nan 0.000 0.386 6525 G N 0.598 109.451 108.800 0.089 0.000 2.483 6525 G HA2 0.392 4.354 3.960 0.003 0.000 0.248 6525 G HA3 0.392 4.354 3.960 0.003 0.000 0.248 6525 G C -0.304 174.872 174.900 0.460 0.000 1.248 6525 G CA 0.104 45.339 45.100 0.225 0.000 0.838 6525 G HN 0.314 nan 8.290 nan 0.000 0.566 6526 Y N -0.263 120.174 120.300 0.228 0.000 2.655 6526 Y HA 0.714 5.265 4.550 0.003 0.000 0.336 6526 Y C -1.497 174.404 175.900 0.002 0.000 1.154 6526 Y CA -1.842 56.392 58.100 0.223 0.000 1.055 6526 Y CB 1.614 40.188 38.460 0.189 0.000 1.295 6526 Y HN 0.565 nan 8.280 nan 0.000 0.465 6527 L N 2.411 123.509 121.223 -0.207 0.000 2.307 6527 L HA 0.495 4.837 4.340 0.003 0.000 0.284 6527 L C -0.948 175.769 176.870 -0.255 0.000 1.023 6527 L CA -0.513 53.985 54.840 -0.571 0.000 0.810 6527 L CB 1.842 43.039 42.059 -1.436 0.000 1.231 6527 L HN 0.776 nan 8.230 nan 0.000 0.423 6528 Q N 5.911 125.568 119.800 -0.238 0.000 2.360 6528 Q HA 0.468 4.810 4.340 0.003 0.000 0.254 6528 Q C -1.000 174.941 176.000 -0.099 0.000 0.975 6528 Q CA -0.105 55.666 55.803 -0.053 0.000 0.912 6528 Q CB 1.496 30.202 28.738 -0.053 0.000 1.212 6528 Q HN 0.581 nan 8.270 nan 0.000 0.452 6529 I N 2.061 122.593 120.570 -0.063 0.000 2.331 6529 I HA 0.667 4.839 4.170 0.003 0.000 0.292 6529 I C 0.649 176.598 176.117 -0.280 0.000 0.998 6529 I CA -0.207 61.020 61.300 -0.122 0.000 1.267 6529 I CB 1.387 39.374 38.000 -0.020 0.000 1.386 6529 I HN 0.753 nan 8.210 nan 0.000 0.476 6530 G N 3.158 111.805 108.800 -0.256 0.000 2.348 6530 G HA2 0.391 4.353 3.960 0.003 0.000 0.296 6530 G HA3 0.391 4.353 3.960 0.003 0.000 0.296 6530 G C 0.306 175.092 174.900 -0.190 0.000 1.258 6530 G CA 0.028 44.956 45.100 -0.287 0.000 0.868 6530 G HN 0.561 nan 8.290 nan 0.000 0.488 6531 A N -0.421 122.370 122.820 -0.048 0.000 1.903 6531 A HA -0.013 4.309 4.320 0.003 0.000 0.219 6531 A C 1.015 178.574 177.584 -0.041 0.000 1.191 6531 A CA 1.834 53.864 52.037 -0.013 0.000 0.638 6531 A CB -0.783 18.277 19.000 0.100 0.000 0.823 6531 A HN 0.616 nan 8.150 nan 0.000 0.451 6532 N N -0.630 118.051 118.700 -0.032 0.000 2.417 6532 N HA 0.421 5.163 4.740 0.003 0.000 0.274 6532 N C -1.483 174.002 175.510 -0.041 0.000 0.987 6532 N CA -0.257 52.777 53.050 -0.028 0.000 0.912 6532 N CB 1.587 40.065 38.487 -0.014 0.000 1.177 6532 N HN 0.049 nan 8.380 nan 0.000 0.490 6533 T N 2.405 116.939 114.554 -0.033 0.000 2.770 6533 T HA 0.385 4.736 4.350 0.003 0.000 0.283 6533 T C -0.610 174.075 174.700 -0.024 0.000 0.988 6533 T CA -0.552 61.527 62.100 -0.035 0.000 0.957 6533 T CB 1.037 69.906 68.868 0.002 0.000 0.930 6533 T HN 0.448 nan 8.240 nan 0.000 0.443 6534 Q N 1.222 120.984 119.800 -0.063 0.000 2.511 6534 Q HA 0.785 5.126 4.340 0.003 0.000 0.289 6534 Q C -0.855 175.061 176.000 -0.141 0.000 1.021 6534 Q CA -0.960 54.807 55.803 -0.061 0.000 0.785 6534 Q CB 1.226 29.937 28.738 -0.044 0.000 1.472 6534 Q HN 0.726 nan 8.270 nan 0.000 0.411 6535 A N 0.386 123.137 122.820 -0.114 0.000 2.304 6535 A HA 0.912 5.234 4.320 0.003 0.000 0.271 6535 A C -0.526 176.908 177.584 -0.250 0.000 1.091 6535 A CA 0.465 52.391 52.037 -0.185 0.000 0.812 6535 A CB 0.390 19.366 19.000 -0.040 0.000 1.056 6535 A HN 0.888 nan 8.150 nan 0.000 0.489 6536 A N 0.381 122.935 122.820 -0.442 0.000 2.568 6536 A HA 0.736 5.058 4.320 0.003 0.000 0.291 6536 A C -0.971 176.431 177.584 -0.302 0.000 1.159 6536 A CA -0.588 51.198 52.037 -0.418 0.000 0.679 6536 A CB 1.005 19.649 19.000 -0.594 0.000 1.285 6536 A HN 0.831 nan 8.150 nan 0.000 0.428 6537 Q N 0.023 119.833 119.800 0.017 0.000 2.451 6537 Q HA 0.587 4.929 4.340 0.003 0.000 0.281 6537 Q C -1.409 174.812 176.000 0.369 0.000 1.099 6537 Q CA -1.019 54.919 55.803 0.224 0.000 0.806 6537 Q CB 2.079 30.883 28.738 0.110 0.000 1.419 6537 Q HN 0.633 nan 8.270 nan 0.000 0.427 6538 K N 0.995 121.587 120.400 0.321 0.000 3.619 6538 K HA -0.202 4.120 4.320 0.003 0.000 0.275 6538 K C -0.860 175.846 176.600 0.176 0.000 0.993 6538 K CA -0.047 56.371 56.287 0.218 0.000 0.787 6538 K CB -1.272 31.313 32.500 0.141 0.000 1.431 6538 K HN 0.416 nan 8.250 nan 0.000 0.451 6539 L N 2.241 123.482 121.223 0.029 0.000 2.418 6539 L HA 0.083 4.425 4.340 0.003 0.000 0.274 6539 L C 0.454 177.264 176.870 -0.100 0.000 1.135 6539 L CA 0.510 55.151 54.840 -0.332 0.000 0.870 6539 L CB 0.348 41.845 42.059 -0.936 0.000 1.154 6539 L HN 0.332 nan 8.230 nan 0.000 0.462 6540 K N 3.049 123.427 120.400 -0.037 0.000 3.069 6540 K HA -0.268 4.054 4.320 0.003 0.000 0.267 6540 K C 0.842 177.492 176.600 0.084 0.000 1.082 6540 K CA 1.098 57.410 56.287 0.042 0.000 0.782 6540 K CB -1.530 30.993 32.500 0.038 0.000 1.230 6540 K HN 0.901 nan 8.250 nan 0.000 0.488 6541 D N 1.143 121.591 120.400 0.081 0.000 2.092 6541 D HA -0.116 4.526 4.640 0.003 0.000 0.193 6541 D C 1.528 177.885 176.300 0.097 0.000 0.994 6541 D CA 1.374 55.428 54.000 0.091 0.000 0.828 6541 D CB 0.278 41.127 40.800 0.081 0.000 0.963 6541 D HN 0.467 nan 8.370 nan 0.000 0.450 6542 K N 0.146 120.594 120.400 0.079 0.000 2.097 6542 K HA -0.141 4.181 4.320 0.003 0.000 0.205 6542 K C 2.158 178.831 176.600 0.123 0.000 1.050 6542 K CA 0.968 57.297 56.287 0.070 0.000 0.938 6542 K CB 0.028 32.537 32.500 0.015 0.000 0.718 6542 K HN 0.082 nan 8.250 nan 0.000 0.442 6543 E N 0.512 120.813 120.200 0.170 0.000 2.072 6543 E HA -0.136 4.216 4.350 0.003 0.000 0.191 6543 E C 1.983 178.853 176.600 0.450 0.000 0.985 6543 E CA 0.912 57.519 56.400 0.345 0.000 0.801 6543 E CB -0.187 29.752 29.700 0.398 0.000 0.750 6543 E HN -0.017 nan 8.360 nan 0.000 0.452 6544 V N 1.055 121.149 119.914 0.301 0.000 2.343 6544 V HA -0.288 3.833 4.120 0.003 0.000 0.247 6544 V C 2.214 178.443 176.094 0.226 0.000 1.051 6544 V CA 1.827 64.290 62.300 0.271 0.000 1.036 6544 V CB -0.882 31.045 31.823 0.172 0.000 0.654 6544 V HN 0.360 nan 8.190 nan 0.000 0.451 6545 A N -0.274 122.646 122.820 0.167 0.000 1.877 6545 A HA -0.255 4.067 4.320 0.003 0.000 0.216 6545 A C 2.125 179.755 177.584 0.076 0.000 1.186 6545 A CA 2.147 54.249 52.037 0.108 0.000 0.620 6545 A CB -0.759 18.293 19.000 0.087 0.000 0.822 6545 A HN 0.524 nan 8.150 nan 0.000 0.443 6546 F N -0.821 119.097 119.950 -0.053 0.000 2.069 6546 F HA -0.193 4.336 4.527 0.003 0.000 0.298 6546 F C 1.998 177.629 175.800 -0.283 0.000 1.113 6546 F CA 1.854 59.722 58.000 -0.220 0.000 1.214 6546 F CB -0.588 38.192 39.000 -0.367 0.000 0.978 6546 F HN 0.382 nan 8.300 nan 0.000 0.474 6547 W N 0.317 121.595 121.300 -0.036 0.000 2.425 6547 W HA -0.112 4.551 4.660 0.003 0.000 0.277 6547 W C 2.531 179.006 176.519 -0.073 0.000 1.231 6547 W CA 1.510 58.761 57.345 -0.158 0.000 1.248 6547 W CB -0.919 28.626 29.460 0.143 0.000 1.117 6547 W HN -0.116 nan 8.180 nan 0.000 0.568 6548 T N -0.267 114.395 114.554 0.180 0.000 2.857 6548 T HA -0.209 4.143 4.350 0.003 0.000 0.266 6548 T C 1.463 176.187 174.700 0.039 0.000 1.048 6548 T CA 1.655 63.851 62.100 0.160 0.000 1.139 6548 T CB -0.417 68.523 68.868 0.120 0.000 0.874 6548 T HN 0.128 nan 8.240 nan 0.000 0.455 6549 N N 0.827 119.468 118.700 -0.099 0.000 2.216 6549 N HA -0.017 4.725 4.740 0.003 0.000 0.183 6549 N C 1.703 177.072 175.510 -0.233 0.000 1.017 6549 N CA 0.583 53.545 53.050 -0.148 0.000 0.861 6549 N CB -0.399 37.983 38.487 -0.176 0.000 0.986 6549 N HN 0.176 nan 8.380 nan 0.000 0.428 6550 L N -0.311 120.633 121.223 -0.464 0.000 2.005 6550 L HA 0.097 4.439 4.340 0.003 0.000 0.207 6550 L C 1.655 178.366 176.870 -0.264 0.000 1.072 6550 L CA 1.664 56.182 54.840 -0.536 0.000 0.744 6550 L CB -0.970 40.493 42.059 -0.993 0.000 0.895 6550 L HN 0.193 nan 8.230 nan 0.000 0.433 6551 F N -0.567 119.363 119.950 -0.032 0.000 2.451 6551 F HA -0.128 4.401 4.527 0.003 0.000 0.299 6551 F C 2.366 178.165 175.800 -0.001 0.000 1.101 6551 F CA 0.510 58.525 58.000 0.025 0.000 1.436 6551 F CB -0.519 38.515 39.000 0.057 0.000 1.074 6551 F HN 0.237 nan 8.300 nan 0.000 0.553 6552 A N 0.231 123.127 122.820 0.127 0.000 1.902 6552 A HA -0.129 4.192 4.320 0.003 0.000 0.217 6552 A C 1.465 179.077 177.584 0.046 0.000 1.181 6552 A CA 0.741 52.819 52.037 0.069 0.000 0.623 6552 A CB -0.500 18.514 19.000 0.024 0.000 0.818 6552 A HN 0.201 nan 8.150 nan 0.000 0.443 6553 K N 0.000 120.410 120.400 0.016 0.000 2.780 6553 K HA 0.000 4.322 4.320 0.003 0.000 0.191 6553 K CA 0.000 56.292 56.287 0.009 0.000 0.838 6553 K CB 0.000 32.489 32.500 -0.018 0.000 1.064 6553 K HN 0.000 nan 8.250 nan 0.000 0.543