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 3cmx_1_D DATA FIRST_RESID 37 DATA SEQUENCE VETISTGSLS LDIALGAGGL PMGRIVEIYG PESSGKTTLT LQVIAAAQRE DATA SEQUENCE GKTCAFIDAE HALDPIYARK LGVDIDNLLC SQPDTGEQAL EICDALARSG DATA SEQUENCE AVDVIVVDSV AALTPKAEIE GEIGDSHMGL AARMMSQAMR KLAGNLKQSN DATA SEQUENCE TLLIFINQIR MKIGVMFGNP ETTTGGNALK FYASVRLDIR RIGAVKEGEN DATA SEQUENCE VVGSETRVKV VKNKIAAPFK QAEFQILYGE GINFYGELVD LGVKEKLIEK DATA SEQUENCE AGAWYSYKGE KIGQGKANAT AWLKDNPETA KEIEKKVREL LLSNPNSXXX DATA SEQUENCE XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX DATA SEQUENCE XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX DATA SEQUENCE XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX DATA SEQUENCE XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX DATA SEQUENCE XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX DATA SEQUENCE XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX DATA SEQUENCE XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX DATA SEQUENCE XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX DATA SEQUENCE XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX DATA SEQUENCE XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX DATA SEQUENCE XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX DATA SEQUENCE XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX DATA SEQUENCE XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX DATA SEQUENCE XXXXXXXXXX XXXXAIDENK QKALAAALGQ IEKQFGKGSI MRLGEDRSMD DATA SEQUENCE VETISTGSLS LDIALGAGGL PMGRIVEIYG PESSGKTTLT LQVIAAAQRE DATA SEQUENCE GKTCAFIDAE HALDPIYARK LGVDIDNLLC SQPDTGEQAL EICDALARSG DATA SEQUENCE AVDVIVVDSV AALTPKAEIE GEIGDSHMGL AARMMSQAMR KLAGNLKQSN DATA SEQUENCE TLLIFINQIR MKIGVMFGNP ETTTGGNALK FYASVRLDIR RIGAVKEGEN DATA SEQUENCE VVGSETRVKV VKNKIAAPFK QAEFQILYGE GINFYGELVD LGVKEKLIEK DATA SEQUENCE AGAWYSYKGE KIGQGKANAT AWLKDNPETA KEIEKKVREL LLSNPNSXXX DATA SEQUENCE XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX DATA SEQUENCE XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX DATA SEQUENCE XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX DATA SEQUENCE XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX DATA SEQUENCE XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX DATA SEQUENCE XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX DATA SEQUENCE XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX DATA SEQUENCE XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX DATA SEQUENCE XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX DATA SEQUENCE XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX DATA SEQUENCE XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX DATA SEQUENCE XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX DATA SEQUENCE XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX DATA SEQUENCE XXXXXXXXXX XXXXAIDENK QKALAAALGQ IEKQFGKGSI MRLGEDRSMD DATA SEQUENCE VETISTGSLS LDIALGAGGL PMGRIVEIYG PESSGKTTLT LQVIAAAQRE DATA SEQUENCE GKTCAFIDAE HALDPIYARK LGVDIDNLLC SQPDTGEQAL EICDALARSG DATA SEQUENCE AVDVIVVDSV AALTPKAEIE GEIGDSHMGL AARMMSQAMR KLAGNLKQSN DATA SEQUENCE TLLIFINQIR MKIGVMFGNP ETTTGGNALK FYASVRLDIR RIGAVKEGEN DATA SEQUENCE VVGSETRVKV VKNKIAAPFK QAEFQILYGE GINFYGELVD LGVKEKLIEK DATA SEQUENCE AGAWYSYKGE KIGQGKANAT AWLKDNPETA KEIEKKVREL LLSNPNSXXX DATA SEQUENCE XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX DATA SEQUENCE XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX DATA SEQUENCE XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX DATA SEQUENCE XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX DATA SEQUENCE XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX DATA SEQUENCE XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX DATA SEQUENCE XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX DATA SEQUENCE XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX DATA SEQUENCE XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX DATA SEQUENCE XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX DATA SEQUENCE XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX DATA SEQUENCE XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX DATA SEQUENCE XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX DATA SEQUENCE XXXXXXXXXX XXXXAIDENK QKALAAALGQ IEKQFGKGSI MRLGEDRSMD DATA SEQUENCE VETISTGSLS LDIALGAGGL PMGRIVEIYG PESSGKTTLT LQVIAAAQRE DATA SEQUENCE GKTCAFIDAE HALDPIYARK LGVDIDNLLC SQPDTGEQAL EICDALARSG DATA SEQUENCE AVDVIVVDSV AALTPKAEIE GEIGDSHMGL AARMMSQAMR KLAGNLKQSN DATA SEQUENCE TLLIFINQIR MKIGVMFGNP ETTTGGNALK FYASVRLDIR RIGAVKEGEN DATA SEQUENCE VVGSETRVKV VKNKIAAPFK QAEFQILYGE GINFYGELVD LGVKEKLIEK DATA SEQUENCE AGAWYSYKGE KIGQGKANAT AWLKDNPETA KEIEKKVREL LLSNPNSXXX DATA SEQUENCE XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX DATA SEQUENCE XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX DATA SEQUENCE XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX DATA SEQUENCE XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX DATA SEQUENCE XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX DATA SEQUENCE XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX DATA SEQUENCE XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX DATA SEQUENCE XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX DATA SEQUENCE XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX DATA SEQUENCE XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX DATA SEQUENCE XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX DATA SEQUENCE XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX DATA SEQUENCE XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX DATA SEQUENCE XXXXXXXXXX XXXXAIDENK QKALAAALGQ IEKQFGKGSI MRLGEDRSMD DATA SEQUENCE VETISTGSLS LDIALGAGGL PMGRIVEIYG PESSGKTTLT LQVIAAAQRE DATA SEQUENCE GKTCAFIDAE HALDPIYARK LGVDIDNLLC SQPDTGEQAL EICDALARSG DATA SEQUENCE AVDVIVVDSV AALTPKAEXX XXXXXXXXXX XARMMSQAMR KLAGNLKQSN DATA SEQUENCE TLLIFINQIR XXXXXXXXNP ETTTGGNALK FYASVRLDIR RIGAVKEGEN DATA SEQUENCE VVGSETRVKV VKNKIAAPFK QAEFQILYGE GINFYGELVD LGVKEKLIEK DATA SEQUENCE AGAWYSYKGE KIGQGKANAT AWLKDNPETA KEIEKKVREL LL 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 37 V HA 0.000 nan 4.120 nan 0.000 0.244 37 V C 0.000 176.099 176.094 0.009 0.000 1.182 37 V CA 0.000 62.306 62.300 0.010 0.000 1.235 37 V CB 0.000 31.829 31.823 0.010 0.000 1.184 38 E N 2.290 122.495 120.200 0.008 0.000 2.227 38 E HA 0.827 5.199 4.350 0.037 0.000 0.268 38 E C -0.749 175.855 176.600 0.006 0.000 0.907 38 E CA -0.256 56.148 56.400 0.006 0.000 0.786 38 E CB 2.497 32.200 29.700 0.005 0.000 1.191 38 E HN 0.908 nan 8.360 nan 0.000 0.411 39 T N 0.521 115.078 114.554 0.004 0.000 2.916 39 T HA 0.631 5.003 4.350 0.037 0.000 0.292 39 T C -0.400 174.300 174.700 -0.000 0.000 1.064 39 T CA -0.864 61.238 62.100 0.004 0.000 1.011 39 T CB 1.072 69.943 68.868 0.006 0.000 1.152 39 T HN 0.262 nan 8.240 nan 0.000 0.510 40 I N 1.674 122.243 120.570 -0.002 0.000 2.545 40 I HA 0.428 4.620 4.170 0.037 0.000 0.292 40 I C 0.745 176.858 176.117 -0.007 0.000 1.040 40 I CA -0.782 60.514 61.300 -0.008 0.000 1.068 40 I CB 1.708 39.701 38.000 -0.011 0.000 1.251 40 I HN 0.954 nan 8.210 nan 0.000 0.424 41 S N 2.789 118.482 115.700 -0.012 0.000 2.558 41 S HA 0.039 4.531 4.470 0.037 0.000 0.288 41 S C 1.350 175.941 174.600 -0.015 0.000 1.318 41 S CA 0.426 58.621 58.200 -0.007 0.000 1.056 41 S CB 0.376 63.566 63.200 -0.018 0.000 0.853 41 S HN 0.814 nan 8.310 nan 0.000 0.505 42 T N 1.467 116.017 114.554 -0.008 0.000 3.100 42 T HA 0.349 4.720 4.350 0.037 0.000 0.253 42 T C 1.501 176.173 174.700 -0.047 0.000 1.118 42 T CA 0.631 62.719 62.100 -0.021 0.000 1.058 42 T CB -0.351 68.507 68.868 -0.017 0.000 0.953 42 T HN 1.649 nan 8.240 nan 0.000 0.515 43 G N 0.777 109.557 108.800 -0.034 0.000 2.199 43 G HA2 -0.242 3.740 3.960 0.037 0.000 0.254 43 G HA3 -0.242 3.740 3.960 0.037 0.000 0.254 43 G C 0.192 175.100 174.900 0.013 0.000 0.982 43 G CA 0.222 45.291 45.100 -0.051 0.000 0.632 43 G HN 1.095 nan 8.290 nan 0.000 0.529 44 S N -0.238 115.411 115.700 -0.086 0.000 2.498 44 S HA 0.634 5.126 4.470 0.037 0.000 0.317 44 S C 1.162 175.680 174.600 -0.136 0.000 1.090 44 S CA 0.027 58.078 58.200 -0.247 0.000 1.089 44 S CB 1.495 64.336 63.200 -0.598 0.000 0.997 44 S HN 0.930 nan 8.310 nan 0.000 0.470 45 L N 5.779 126.807 121.223 -0.326 0.000 2.027 45 L HA 0.024 4.386 4.340 0.037 0.000 0.206 45 L C 2.573 179.343 176.870 -0.168 0.000 1.074 45 L CA 2.708 57.351 54.840 -0.329 0.000 0.745 45 L CB -0.991 40.611 42.059 -0.763 0.000 0.898 45 L HN 0.895 nan 8.230 nan 0.000 0.433 46 S N -1.143 114.471 115.700 -0.144 0.000 2.402 46 S HA -0.201 4.291 4.470 0.037 0.000 0.229 46 S C 2.100 176.710 174.600 0.018 0.000 1.021 46 S CA 1.364 59.543 58.200 -0.034 0.000 0.974 46 S CB -1.013 62.202 63.200 0.024 0.000 0.800 46 S HN 0.498 nan 8.310 nan 0.000 0.484 47 L N 1.376 122.617 121.223 0.030 0.000 2.093 47 L HA -0.088 4.274 4.340 0.037 0.000 0.208 47 L C 1.864 178.745 176.870 0.019 0.000 1.085 47 L CA 1.661 56.534 54.840 0.055 0.000 0.755 47 L CB -0.417 41.683 42.059 0.069 0.000 0.904 47 L HN 0.192 nan 8.230 nan 0.000 0.435 48 D N -0.039 120.360 120.400 -0.002 0.000 2.178 48 D HA -0.163 4.499 4.640 0.037 0.000 0.201 48 D C 2.174 178.477 176.300 0.004 0.000 0.980 48 D CA 1.312 55.315 54.000 0.005 0.000 0.842 48 D CB 0.013 40.822 40.800 0.014 0.000 0.948 48 D HN 0.394 nan 8.370 nan 0.000 0.472 49 I N 0.926 121.494 120.570 -0.002 0.000 2.286 49 I HA -0.172 4.020 4.170 0.037 0.000 0.245 49 I C 2.442 178.565 176.117 0.009 0.000 1.104 49 I CA 0.837 62.138 61.300 0.002 0.000 1.397 49 I CB -0.168 37.829 38.000 -0.005 0.000 1.072 49 I HN -0.104 nan 8.210 nan 0.000 0.417 50 A N 0.695 123.523 122.820 0.014 0.000 2.019 50 A HA -0.135 4.207 4.320 0.037 0.000 0.219 50 A C 2.253 179.842 177.584 0.009 0.000 1.164 50 A CA 1.324 53.372 52.037 0.018 0.000 0.644 50 A CB -0.831 18.186 19.000 0.028 0.000 0.805 50 A HN 0.418 nan 8.150 nan 0.000 0.449 51 L N -1.605 119.622 121.223 0.006 0.000 2.465 51 L HA 0.027 4.389 4.340 0.037 0.000 0.224 51 L C 2.215 179.084 176.870 -0.002 0.000 1.145 51 L CA 0.657 55.496 54.840 -0.002 0.000 0.834 51 L CB -0.418 41.642 42.059 0.002 0.000 0.944 51 L HN 0.622 nan 8.230 nan 0.000 0.451 52 G N -0.065 108.738 108.800 0.004 0.000 2.779 52 G HA2 -0.462 3.520 3.960 0.037 0.000 0.230 52 G HA3 -0.462 3.520 3.960 0.037 0.000 0.230 52 G C 1.179 176.084 174.900 0.008 0.000 1.243 52 G CA 0.654 45.758 45.100 0.007 0.000 0.769 52 G HN 0.455 nan 8.290 nan 0.000 0.516 53 A N 0.148 122.972 122.820 0.006 0.000 2.119 53 A HA 0.506 4.848 4.320 0.037 0.000 0.216 53 A C 2.789 180.378 177.584 0.009 0.000 1.152 53 A CA 2.254 54.295 52.037 0.007 0.000 0.708 53 A CB -0.550 18.453 19.000 0.006 0.000 0.805 53 A HN 2.674 nan 8.150 nan 0.000 0.460 54 G N -3.300 105.506 108.800 0.010 0.000 2.179 54 G HA2 0.311 4.293 3.960 0.037 0.000 0.220 54 G HA3 0.311 4.293 3.960 0.037 0.000 0.220 54 G C 0.837 175.745 174.900 0.013 0.000 0.990 54 G CA 0.319 45.426 45.100 0.013 0.000 0.646 54 G HN 2.105 nan 8.290 nan 0.000 0.517 55 G N -1.374 107.431 108.800 0.009 0.000 2.317 55 G HA2 0.534 4.516 3.960 0.037 0.000 0.293 55 G HA3 0.534 4.516 3.960 0.037 0.000 0.293 55 G C -0.890 174.013 174.900 0.006 0.000 1.287 55 G CA -0.505 44.599 45.100 0.008 0.000 0.850 55 G HN 0.841 nan 8.290 nan 0.000 0.515 56 L N 2.012 123.238 121.223 0.005 0.000 2.371 56 L HA 0.404 4.766 4.340 0.037 0.000 0.272 56 L C -1.754 175.121 176.870 0.007 0.000 1.124 56 L CA -1.626 53.218 54.840 0.007 0.000 0.816 56 L CB 1.418 43.481 42.059 0.008 0.000 1.129 56 L HN 0.298 nan 8.230 nan 0.000 0.448 57 P HA 0.131 nan 4.420 nan 0.000 0.281 57 P C -0.704 176.604 177.300 0.013 0.000 1.252 57 P CA -0.469 62.638 63.100 0.012 0.000 0.778 57 P CB 0.914 32.624 31.700 0.016 0.000 0.895 58 M N 2.116 121.722 119.600 0.010 0.000 2.245 58 M HA 0.194 4.696 4.480 0.037 0.000 0.344 58 M C 1.582 177.891 176.300 0.015 0.000 1.170 58 M CA 0.878 56.184 55.300 0.009 0.000 1.135 58 M CB -0.593 32.011 32.600 0.005 0.000 1.574 58 M HN 0.834 nan 8.290 nan 0.000 0.452 59 G N 2.601 111.411 108.800 0.015 0.000 2.143 59 G HA2 -0.209 3.773 3.960 0.037 0.000 0.248 59 G HA3 -0.209 3.773 3.960 0.037 0.000 0.248 59 G C 0.219 175.141 174.900 0.037 0.000 0.991 59 G CA 0.009 45.123 45.100 0.023 0.000 0.689 59 G HN 0.561 nan 8.290 nan 0.000 0.522 60 R N -0.989 119.535 120.500 0.040 0.000 2.939 60 R HA 0.777 5.139 4.340 0.037 0.000 0.254 60 R C 0.044 176.390 176.300 0.076 0.000 1.123 60 R CA -1.098 55.038 56.100 0.061 0.000 1.020 60 R CB 0.836 31.167 30.300 0.051 0.000 1.206 60 R HN 0.195 nan 8.270 nan 0.000 0.491 61 I N 0.798 121.435 120.570 0.112 0.000 2.412 61 I HA 0.366 4.558 4.170 0.037 0.000 0.296 61 I C -0.414 175.788 176.117 0.142 0.000 0.987 61 I CA -0.836 60.558 61.300 0.157 0.000 1.180 61 I CB 1.909 40.046 38.000 0.228 0.000 1.340 61 I HN -0.017 nan 8.210 nan 0.000 0.455 62 V N 5.320 125.323 119.914 0.149 0.000 2.656 62 V HA 0.389 4.531 4.120 0.037 0.000 0.307 62 V C -0.474 175.727 176.094 0.179 0.000 1.051 62 V CA -0.691 61.683 62.300 0.123 0.000 0.893 62 V CB 2.034 33.898 31.823 0.068 0.000 0.999 62 V HN 0.734 nan 8.190 nan 0.000 0.426 63 E N 3.867 124.162 120.200 0.159 0.000 2.187 63 E HA 0.670 5.042 4.350 0.037 0.000 0.268 63 E C -1.560 175.130 176.600 0.149 0.000 0.896 63 E CA -0.618 55.896 56.400 0.190 0.000 0.766 63 E CB 1.675 31.488 29.700 0.188 0.000 1.142 63 E HN 0.651 nan 8.360 nan 0.000 0.408 64 I N 5.457 126.112 120.570 0.141 0.000 2.406 64 I HA 0.348 4.540 4.170 0.037 0.000 0.290 64 I C -0.906 175.297 176.117 0.143 0.000 0.999 64 I CA -0.972 60.372 61.300 0.074 0.000 1.124 64 I CB 0.854 38.887 38.000 0.055 0.000 1.289 64 I HN 0.512 nan 8.210 nan 0.000 0.441 65 Y N 3.961 124.298 120.300 0.062 0.000 2.605 65 Y HA 1.006 5.578 4.550 0.037 0.000 0.343 65 Y C -0.157 175.797 175.900 0.092 0.000 1.036 65 Y CA -1.157 56.981 58.100 0.063 0.000 1.065 65 Y CB 1.967 40.448 38.460 0.036 0.000 1.288 65 Y HN 0.677 nan 8.280 nan 0.000 0.481 66 G N 0.551 109.541 108.800 0.317 0.000 2.325 66 G HA2 0.437 4.419 3.960 0.037 0.000 0.297 66 G HA3 0.437 4.419 3.960 0.037 0.000 0.297 66 G C -3.534 171.593 174.900 0.378 0.000 1.448 66 G CA -1.346 43.905 45.100 0.252 0.000 0.838 66 G HN 0.489 nan 8.290 nan 0.000 0.579 67 P HA 0.251 nan 4.420 nan 0.000 0.272 67 P C -0.209 177.082 177.300 -0.014 0.000 1.248 67 P CA -0.132 63.075 63.100 0.179 0.000 0.799 67 P CB 0.275 32.013 31.700 0.063 0.000 0.997 68 E N -0.715 119.137 120.200 -0.581 0.000 2.383 68 E HA 0.256 4.628 4.350 0.037 0.000 0.264 68 E C 0.073 176.564 176.600 -0.181 0.000 1.050 68 E CA -0.408 55.635 56.400 -0.596 0.000 0.896 68 E CB -0.417 28.732 29.700 -0.919 0.000 0.982 68 E HN 0.248 nan 8.360 nan 0.000 0.424 69 S N 0.371 116.027 115.700 -0.074 0.000 3.581 69 S HA -0.221 4.271 4.470 0.037 0.000 0.354 69 S C 0.944 175.583 174.600 0.064 0.000 1.059 69 S CA 0.907 59.105 58.200 -0.003 0.000 1.060 69 S CB -1.623 61.550 63.200 -0.045 0.000 0.908 69 S HN 0.737 nan 8.310 nan 0.000 0.475 70 S N -0.502 115.246 115.700 0.079 0.000 2.470 70 S HA 0.462 4.954 4.470 0.037 0.000 0.222 70 S C 1.550 176.220 174.600 0.116 0.000 1.024 70 S CA 0.905 59.160 58.200 0.091 0.000 0.931 70 S CB 0.702 63.951 63.200 0.082 0.000 0.791 70 S HN 1.827 nan 8.310 nan 0.000 0.513 71 G N 0.927 109.811 108.800 0.139 0.000 2.559 71 G HA2 -0.115 3.867 3.960 0.037 0.000 0.202 71 G HA3 -0.115 3.867 3.960 0.037 0.000 0.202 71 G C 0.674 175.676 174.900 0.170 0.000 0.992 71 G CA 0.082 45.287 45.100 0.174 0.000 0.764 71 G HN 0.394 nan 8.290 nan 0.000 0.525 72 K N 0.501 120.991 120.400 0.151 0.000 1.987 72 K HA -0.107 4.235 4.320 0.037 0.000 0.216 72 K C 2.591 179.285 176.600 0.157 0.000 1.051 72 K CA 2.236 58.609 56.287 0.144 0.000 0.942 72 K CB -0.598 31.990 32.500 0.146 0.000 0.722 72 K HN 0.310 nan 8.250 nan 0.000 0.444 73 T N 0.950 115.608 114.554 0.174 0.000 2.607 73 T HA -0.193 4.179 4.350 0.037 0.000 0.267 73 T C 2.107 176.931 174.700 0.206 0.000 1.049 73 T CA 2.120 64.349 62.100 0.215 0.000 1.162 73 T CB -0.839 68.155 68.868 0.210 0.000 0.863 73 T HN 0.275 nan 8.240 nan 0.000 0.424 74 T N 2.353 117.033 114.554 0.211 0.000 2.624 74 T HA -0.106 4.266 4.350 0.037 0.000 0.268 74 T C 1.938 176.725 174.700 0.144 0.000 1.041 74 T CA 1.447 63.677 62.100 0.216 0.000 1.159 74 T CB -0.694 68.341 68.868 0.278 0.000 0.863 74 T HN 0.240 nan 8.240 nan 0.000 0.434 75 L N 0.324 121.636 121.223 0.150 0.000 2.012 75 L HA -0.191 4.171 4.340 0.037 0.000 0.210 75 L C 2.677 179.595 176.870 0.079 0.000 1.073 75 L CA 1.683 56.588 54.840 0.108 0.000 0.748 75 L CB -0.788 41.355 42.059 0.139 0.000 0.891 75 L HN 0.271 nan 8.230 nan 0.000 0.431 76 T N 0.327 114.948 114.554 0.111 0.000 2.635 76 T HA -0.261 4.111 4.350 0.037 0.000 0.267 76 T C 1.834 176.599 174.700 0.109 0.000 1.040 76 T CA 2.072 64.241 62.100 0.116 0.000 1.156 76 T CB -0.370 68.601 68.868 0.172 0.000 0.863 76 T HN 0.307 nan 8.240 nan 0.000 0.430 77 L N 0.882 122.171 121.223 0.111 0.000 2.131 77 L HA -0.142 4.220 4.340 0.037 0.000 0.210 77 L C 2.987 179.851 176.870 -0.010 0.000 1.092 77 L CA 1.097 55.961 54.840 0.039 0.000 0.759 77 L CB -0.610 41.441 42.059 -0.013 0.000 0.903 77 L HN 0.271 nan 8.230 nan 0.000 0.435 78 Q N -0.272 119.520 119.800 -0.014 0.000 2.124 78 Q HA -0.169 4.193 4.340 0.037 0.000 0.202 78 Q C 2.437 178.406 176.000 -0.052 0.000 0.977 78 Q CA 1.930 57.701 55.803 -0.052 0.000 0.850 78 Q CB -0.518 28.183 28.738 -0.061 0.000 0.901 78 Q HN 0.617 nan 8.270 nan 0.000 0.429 79 V N -1.581 118.320 119.914 -0.022 0.000 2.548 79 V HA -0.139 4.003 4.120 0.037 0.000 0.249 79 V C 2.072 178.154 176.094 -0.020 0.000 1.055 79 V CA 0.951 63.238 62.300 -0.023 0.000 1.065 79 V CB -0.517 31.303 31.823 -0.006 0.000 0.681 79 V HN 0.167 nan 8.190 nan 0.000 0.462 80 I N 1.401 121.969 120.570 -0.002 0.000 2.179 80 I HA -0.155 4.037 4.170 0.037 0.000 0.242 80 I C 3.035 179.133 176.117 -0.031 0.000 1.088 80 I CA 1.790 63.090 61.300 -0.001 0.000 1.357 80 I CB -0.824 37.193 38.000 0.028 0.000 1.051 80 I HN 0.405 nan 8.210 nan 0.000 0.409 81 A N 0.903 123.694 122.820 -0.049 0.000 1.873 81 A HA -0.277 4.065 4.320 0.037 0.000 0.218 81 A C 2.561 180.098 177.584 -0.078 0.000 1.193 81 A CA 2.363 54.357 52.037 -0.072 0.000 0.629 81 A CB -1.117 17.827 19.000 -0.092 0.000 0.826 81 A HN 0.457 nan 8.150 nan 0.000 0.447 82 A N -0.328 122.440 122.820 -0.086 0.000 1.883 82 A HA 0.077 4.419 4.320 0.037 0.000 0.217 82 A C 2.535 180.077 177.584 -0.070 0.000 1.186 82 A CA 2.552 54.532 52.037 -0.096 0.000 0.624 82 A CB -1.130 17.811 19.000 -0.097 0.000 0.822 82 A HN 1.225 nan 8.150 nan 0.000 0.444 83 A N -1.164 121.626 122.820 -0.050 0.000 1.969 83 A HA -0.173 4.169 4.320 0.037 0.000 0.218 83 A C 2.101 179.664 177.584 -0.036 0.000 1.169 83 A CA 1.578 53.593 52.037 -0.037 0.000 0.635 83 A CB -0.471 18.514 19.000 -0.025 0.000 0.810 83 A HN 0.671 nan 8.150 nan 0.000 0.445 84 Q N -1.337 118.439 119.800 -0.040 0.000 2.172 84 Q HA -0.087 4.274 4.340 0.037 0.000 0.200 84 Q C 2.242 178.216 176.000 -0.044 0.000 0.964 84 Q CA 1.085 56.865 55.803 -0.038 0.000 0.855 84 Q CB -0.057 28.657 28.738 -0.039 0.000 0.918 84 Q HN 0.542 nan 8.270 nan 0.000 0.444 85 R N 1.127 121.594 120.500 -0.056 0.000 2.148 85 R HA -0.117 4.245 4.340 0.037 0.000 0.227 85 R C 0.983 177.253 176.300 -0.051 0.000 1.103 85 R CA 1.192 57.255 56.100 -0.061 0.000 0.983 85 R CB 0.216 30.466 30.300 -0.083 0.000 0.874 85 R HN 0.275 nan 8.270 nan 0.000 0.451 86 E N -1.554 118.618 120.200 -0.046 0.000 2.479 86 E HA 0.187 4.559 4.350 0.037 0.000 0.193 86 E C 0.431 177.014 176.600 -0.028 0.000 1.049 86 E CA 0.392 56.771 56.400 -0.036 0.000 0.870 86 E CB 0.772 30.452 29.700 -0.034 0.000 0.944 86 E HN 0.408 nan 8.360 nan 0.000 0.492 87 G N 2.138 110.921 108.800 -0.029 0.000 2.171 87 G HA2 -0.291 3.691 3.960 0.037 0.000 0.238 87 G HA3 -0.291 3.691 3.960 0.037 0.000 0.238 87 G C -0.121 174.767 174.900 -0.019 0.000 1.039 87 G CA -0.094 44.992 45.100 -0.023 0.000 0.759 87 G HN 0.127 nan 8.290 nan 0.000 0.501 88 K N 0.385 120.773 120.400 -0.020 0.000 2.098 88 K HA 0.529 4.871 4.320 0.037 0.000 0.261 88 K C 0.290 176.881 176.600 -0.014 0.000 0.987 88 K CA -0.316 55.962 56.287 -0.016 0.000 0.916 88 K CB 0.934 33.424 32.500 -0.016 0.000 1.039 88 K HN 0.114 nan 8.250 nan 0.000 0.455 89 T N 1.820 116.368 114.554 -0.011 0.000 2.780 89 T HA 0.231 4.603 4.350 0.037 0.000 0.294 89 T C -0.169 174.528 174.700 -0.006 0.000 0.949 89 T CA -0.515 61.581 62.100 -0.008 0.000 1.074 89 T CB 0.082 68.946 68.868 -0.006 0.000 0.910 89 T HN 0.516 nan 8.240 nan 0.000 0.501 90 C N 2.442 121.742 119.300 -0.001 0.000 2.562 90 C HA 0.977 5.459 4.460 0.037 0.000 0.332 90 C C 0.451 175.454 174.990 0.021 0.000 1.201 90 C CA -0.930 58.094 59.018 0.009 0.000 1.803 90 C CB 0.861 28.613 27.740 0.019 0.000 2.328 90 C HN 1.047 nan 8.230 nan 0.000 0.500 91 A N 1.083 123.919 122.820 0.026 0.000 2.475 91 A HA 0.874 5.216 4.320 0.037 0.000 0.301 91 A C -1.506 176.127 177.584 0.081 0.000 1.059 91 A CA -0.257 51.803 52.037 0.039 0.000 0.710 91 A CB 1.127 20.123 19.000 -0.006 0.000 1.288 91 A HN 0.817 nan 8.150 nan 0.000 0.408 92 F N 2.609 122.519 119.950 -0.065 0.000 2.529 92 F HA 0.642 5.191 4.527 0.037 0.000 0.320 92 F C -0.879 174.872 175.800 -0.082 0.000 1.118 92 F CA -0.866 57.091 58.000 -0.072 0.000 0.915 92 F CB 1.615 40.583 39.000 -0.054 0.000 1.161 92 F HN 0.371 nan 8.300 nan 0.000 0.445 93 I N 4.671 124.990 120.570 -0.418 0.000 2.412 93 I HA 0.141 4.333 4.170 0.037 0.000 0.279 93 I C -0.313 175.641 176.117 -0.272 0.000 1.063 93 I CA -0.428 60.719 61.300 -0.255 0.000 1.193 93 I CB 0.559 38.405 38.000 -0.256 0.000 1.370 93 I HN 0.516 nan 8.210 nan 0.000 0.479 94 D N 4.901 125.294 120.400 -0.012 0.000 2.801 94 D HA 0.318 4.980 4.640 0.037 0.000 0.232 94 D C 1.396 177.627 176.300 -0.115 0.000 1.128 94 D CA 0.031 54.077 54.000 0.077 0.000 1.003 94 D CB 0.722 41.655 40.800 0.221 0.000 1.110 94 D HN 0.589 nan 8.370 nan 0.000 0.477 95 A N 1.752 124.524 122.820 -0.080 0.000 2.015 95 A HA -0.146 4.196 4.320 0.037 0.000 0.219 95 A C 1.953 179.651 177.584 0.190 0.000 1.163 95 A CA 0.867 52.913 52.037 0.016 0.000 0.646 95 A CB -0.261 18.755 19.000 0.027 0.000 0.806 95 A HN 0.504 nan 8.150 nan 0.000 0.448 96 E N -1.058 119.209 120.200 0.111 0.000 2.418 96 E HA -0.109 4.263 4.350 0.037 0.000 0.197 96 E C -0.500 176.260 176.600 0.266 0.000 1.026 96 E CA 0.078 56.557 56.400 0.133 0.000 0.862 96 E CB -0.183 29.528 29.700 0.018 0.000 0.799 96 E HN 0.690 nan 8.360 nan 0.000 0.518 97 H N -2.065 117.067 119.070 0.103 0.000 2.677 97 H HA -0.217 4.361 4.556 0.037 0.000 0.321 97 H C 0.130 175.514 175.328 0.092 0.000 1.171 97 H CA 0.515 56.623 56.048 0.101 0.000 1.139 97 H CB -1.228 28.594 29.762 0.100 0.000 1.515 97 H HN 0.292 nan 8.280 nan 0.000 0.423 98 A N 0.431 123.343 122.820 0.152 0.000 2.664 98 A HA 0.174 4.516 4.320 0.037 0.000 0.222 98 A C 0.601 178.225 177.584 0.067 0.000 1.320 98 A CA -0.226 51.876 52.037 0.109 0.000 1.029 98 A CB 0.684 19.744 19.000 0.100 0.000 1.318 98 A HN 0.175 nan 8.150 nan 0.000 0.589 99 L N 1.593 122.853 121.223 0.062 0.000 2.513 99 L HA 0.389 4.751 4.340 0.037 0.000 0.272 99 L C -0.517 176.336 176.870 -0.028 0.000 1.187 99 L CA 0.257 55.088 54.840 -0.016 0.000 0.895 99 L CB 0.338 42.309 42.059 -0.146 0.000 1.147 99 L HN 0.207 nan 8.230 nan 0.000 0.483 100 D N 7.406 127.800 120.400 -0.010 0.000 2.359 100 D HA 0.308 4.970 4.640 0.037 0.000 0.230 100 D C -1.762 174.544 176.300 0.011 0.000 1.118 100 D CA -2.298 51.709 54.000 0.013 0.000 0.844 100 D CB 1.496 42.315 40.800 0.032 0.000 1.059 100 D HN 0.384 nan 8.370 nan 0.000 0.493 101 P HA -0.175 nan 4.420 nan 0.000 0.215 101 P C 1.605 178.897 177.300 -0.013 0.000 1.157 101 P CA 0.878 63.955 63.100 -0.038 0.000 0.868 101 P CB 0.435 32.116 31.700 -0.032 0.000 0.788 102 I N -1.562 119.019 120.570 0.019 0.000 2.226 102 I HA -0.249 3.943 4.170 0.037 0.000 0.245 102 I C 2.770 178.921 176.117 0.056 0.000 1.100 102 I CA 1.471 62.789 61.300 0.030 0.000 1.374 102 I CB -1.358 36.667 38.000 0.042 0.000 1.057 102 I HN -0.142 nan 8.210 nan 0.000 0.413 103 Y N 1.380 121.660 120.300 -0.033 0.000 2.242 103 Y HA -0.212 4.360 4.550 0.037 0.000 0.291 103 Y C 2.478 178.355 175.900 -0.038 0.000 1.137 103 Y CA 1.168 59.254 58.100 -0.024 0.000 1.181 103 Y CB -0.443 38.006 38.460 -0.018 0.000 0.989 103 Y HN 0.121 nan 8.280 nan 0.000 0.527 104 A N 0.631 123.426 122.820 -0.042 0.000 1.908 104 A HA -0.223 4.119 4.320 0.037 0.000 0.218 104 A C 2.429 179.914 177.584 -0.164 0.000 1.181 104 A CA 1.834 53.785 52.037 -0.143 0.000 0.627 104 A CB -0.773 18.142 19.000 -0.143 0.000 0.818 104 A HN 0.493 nan 8.150 nan 0.000 0.445 105 R N -0.031 120.399 120.500 -0.116 0.000 2.092 105 R HA -0.096 4.266 4.340 0.037 0.000 0.231 105 R C 1.935 178.162 176.300 -0.122 0.000 1.119 105 R CA 1.613 57.653 56.100 -0.100 0.000 0.970 105 R CB -0.261 30.001 30.300 -0.062 0.000 0.864 105 R HN 0.529 nan 8.270 nan 0.000 0.440 106 K N 0.346 120.658 120.400 -0.148 0.000 2.211 106 K HA -0.099 4.243 4.320 0.037 0.000 0.204 106 K C 1.947 178.412 176.600 -0.225 0.000 1.047 106 K CA 1.024 57.213 56.287 -0.163 0.000 0.935 106 K CB -0.036 32.371 32.500 -0.155 0.000 0.728 106 K HN 0.262 nan 8.250 nan 0.000 0.452 107 L N -0.537 120.497 121.223 -0.316 0.000 2.492 107 L HA 0.032 4.394 4.340 0.037 0.000 0.223 107 L C 1.033 177.800 176.870 -0.173 0.000 1.132 107 L CA 0.554 55.228 54.840 -0.277 0.000 0.850 107 L CB -0.049 41.814 42.059 -0.327 0.000 0.966 107 L HN 0.445 nan 8.230 nan 0.000 0.454 108 G N 0.234 108.946 108.800 -0.147 0.000 2.145 108 G HA2 -0.190 3.792 3.960 0.037 0.000 0.176 108 G HA3 -0.190 3.792 3.960 0.037 0.000 0.176 108 G C -0.077 174.762 174.900 -0.101 0.000 1.013 108 G CA -0.248 44.785 45.100 -0.112 0.000 0.689 108 G HN 0.039 nan 8.290 nan 0.000 0.506 109 V N 0.639 120.490 119.914 -0.105 0.000 2.607 109 V HA 0.460 4.602 4.120 0.037 0.000 0.289 109 V C 0.551 176.601 176.094 -0.074 0.000 1.053 109 V CA -0.440 61.806 62.300 -0.089 0.000 0.996 109 V CB 1.815 33.577 31.823 -0.102 0.000 0.995 109 V HN 0.342 nan 8.190 nan 0.000 0.476 110 D N 3.691 124.055 120.400 -0.060 0.000 2.383 110 D HA 0.123 4.785 4.640 0.037 0.000 0.245 110 D C 1.074 177.345 176.300 -0.048 0.000 1.263 110 D CA -0.251 53.720 54.000 -0.049 0.000 0.936 110 D CB 0.498 41.274 40.800 -0.040 0.000 1.053 110 D HN 0.291 nan 8.370 nan 0.000 0.507 111 I N 2.596 123.136 120.570 -0.051 0.000 2.226 111 I HA -0.218 3.973 4.170 0.037 0.000 0.245 111 I C 1.389 177.485 176.117 -0.036 0.000 1.100 111 I CA 0.946 62.216 61.300 -0.051 0.000 1.374 111 I CB -0.712 37.258 38.000 -0.049 0.000 1.057 111 I HN 0.339 nan 8.210 nan 0.000 0.413 112 D N 0.566 120.948 120.400 -0.029 0.000 2.263 112 D HA -0.124 4.538 4.640 0.037 0.000 0.208 112 D C 1.722 178.012 176.300 -0.017 0.000 0.971 112 D CA 0.900 54.888 54.000 -0.021 0.000 0.867 112 D CB -0.246 40.543 40.800 -0.018 0.000 0.929 112 D HN 0.437 nan 8.370 nan 0.000 0.492 113 N N -0.189 118.500 118.700 -0.019 0.000 2.197 113 N HA 0.029 4.791 4.740 0.037 0.000 0.201 113 N C 0.048 175.551 175.510 -0.011 0.000 1.148 113 N CA -0.177 52.864 53.050 -0.014 0.000 0.883 113 N CB 1.375 39.852 38.487 -0.016 0.000 1.012 113 N HN 0.135 nan 8.380 nan 0.000 0.507 114 L N 3.237 124.451 121.223 -0.016 0.000 2.385 114 L HA 0.258 4.620 4.340 0.037 0.000 0.281 114 L C -0.126 176.747 176.870 0.005 0.000 1.106 114 L CA 0.067 54.903 54.840 -0.007 0.000 0.856 114 L CB 0.087 42.130 42.059 -0.027 0.000 1.186 114 L HN 0.013 nan 8.230 nan 0.000 0.453 115 L N 5.343 126.577 121.223 0.018 0.000 2.456 115 L HA 0.115 4.477 4.340 0.037 0.000 0.272 115 L C 0.120 177.021 176.870 0.051 0.000 1.189 115 L CA 0.172 55.026 54.840 0.024 0.000 0.846 115 L CB 0.982 43.053 42.059 0.019 0.000 1.111 115 L HN 0.739 nan 8.230 nan 0.000 0.475 116 C N 2.803 122.129 119.300 0.045 0.000 2.891 116 C HA 0.667 5.149 4.460 0.037 0.000 0.342 116 C C -0.497 174.517 174.990 0.041 0.000 1.126 116 C CA -0.429 58.633 59.018 0.073 0.000 1.322 116 C CB 1.590 29.360 27.740 0.050 0.000 1.763 116 C HN 0.822 nan 8.230 nan 0.000 0.491 117 S N 3.714 119.436 115.700 0.037 0.000 2.575 117 S HA 0.563 5.055 4.470 0.037 0.000 0.278 117 S C -1.369 173.200 174.600 -0.051 0.000 1.139 117 S CA -0.287 57.906 58.200 -0.011 0.000 0.954 117 S CB 1.476 64.656 63.200 -0.035 0.000 1.054 117 S HN 0.860 nan 8.310 nan 0.000 0.483 118 Q N 4.774 124.522 119.800 -0.086 0.000 2.466 118 Q HA 0.359 4.721 4.340 0.037 0.000 0.242 118 Q C -2.290 173.650 176.000 -0.099 0.000 1.046 118 Q CA -1.907 53.760 55.803 -0.228 0.000 0.841 118 Q CB 1.328 29.859 28.738 -0.346 0.000 1.193 118 Q HN 0.505 nan 8.270 nan 0.000 0.508 119 P HA 0.108 nan 4.420 nan 0.000 0.276 119 P C -0.386 176.965 177.300 0.085 0.000 1.252 119 P CA -0.245 62.834 63.100 -0.035 0.000 0.802 119 P CB 1.429 33.066 31.700 -0.105 0.000 1.035 120 D N -0.961 119.471 120.400 0.053 0.000 2.269 120 D HA -0.001 4.660 4.640 0.037 0.000 0.220 120 D C 1.005 177.340 176.300 0.058 0.000 0.962 120 D CA 1.413 55.465 54.000 0.087 0.000 0.884 120 D CB -0.286 40.562 40.800 0.080 0.000 1.023 120 D HN 0.507 nan 8.370 nan 0.000 0.484 121 T N -2.702 111.863 114.554 0.019 0.000 2.948 121 T HA 0.533 4.905 4.350 0.037 0.000 0.285 121 T C 1.398 176.087 174.700 -0.018 0.000 1.019 121 T CA -0.287 61.818 62.100 0.008 0.000 1.013 121 T CB 1.917 70.793 68.868 0.014 0.000 1.117 121 T HN -0.030 nan 8.240 nan 0.000 0.533 122 G N 0.153 108.947 108.800 -0.009 0.000 2.402 122 G HA2 -0.082 3.900 3.960 0.037 0.000 0.216 122 G HA3 -0.082 3.900 3.960 0.037 0.000 0.216 122 G C 1.162 176.040 174.900 -0.037 0.000 1.162 122 G CA 0.573 45.664 45.100 -0.014 0.000 0.777 122 G HN 0.799 nan 8.290 nan 0.000 0.539 123 E N 0.054 120.235 120.200 -0.031 0.000 2.085 123 E HA -0.146 4.226 4.350 0.037 0.000 0.194 123 E C 2.393 178.942 176.600 -0.084 0.000 0.994 123 E CA 1.291 57.676 56.400 -0.025 0.000 0.801 123 E CB -0.221 29.488 29.700 0.015 0.000 0.743 123 E HN 0.645 nan 8.360 nan 0.000 0.453 124 Q N 0.320 120.016 119.800 -0.173 0.000 2.030 124 Q HA -0.237 4.125 4.340 0.037 0.000 0.204 124 Q C 2.175 177.892 176.000 -0.471 0.000 0.986 124 Q CA 1.792 57.266 55.803 -0.549 0.000 0.843 124 Q CB -0.254 28.165 28.738 -0.532 0.000 0.904 124 Q HN 0.302 nan 8.270 nan 0.000 0.420 125 A N 0.720 123.389 122.820 -0.252 0.000 1.892 125 A HA -0.214 4.128 4.320 0.037 0.000 0.218 125 A C 2.070 179.576 177.584 -0.131 0.000 1.188 125 A CA 1.784 53.718 52.037 -0.173 0.000 0.631 125 A CB -0.839 18.106 19.000 -0.092 0.000 0.822 125 A HN 0.474 nan 8.150 nan 0.000 0.447 126 L N -1.203 119.972 121.223 -0.080 0.000 2.072 126 L HA -0.098 4.264 4.340 0.037 0.000 0.205 126 L C 2.638 179.489 176.870 -0.033 0.000 1.079 126 L CA 1.048 55.873 54.840 -0.025 0.000 0.752 126 L CB -0.512 41.551 42.059 0.008 0.000 0.906 126 L HN 0.274 nan 8.230 nan 0.000 0.436 127 E N 0.512 120.683 120.200 -0.048 0.000 2.118 127 E HA -0.212 4.160 4.350 0.037 0.000 0.195 127 E C 2.280 178.885 176.600 0.008 0.000 0.992 127 E CA 1.332 57.742 56.400 0.016 0.000 0.804 127 E CB -0.182 29.590 29.700 0.119 0.000 0.741 127 E HN 0.489 nan 8.360 nan 0.000 0.458 128 I N 0.242 120.753 120.570 -0.099 0.000 2.127 128 I HA -0.367 3.825 4.170 0.037 0.000 0.241 128 I C 2.608 178.702 176.117 -0.037 0.000 1.075 128 I CA 0.946 62.205 61.300 -0.069 0.000 1.334 128 I CB -0.320 37.592 38.000 -0.147 0.000 1.040 128 I HN 0.149 nan 8.210 nan 0.000 0.405 129 C N 0.378 119.644 119.300 -0.058 0.000 2.393 129 C HA -0.250 4.232 4.460 0.037 0.000 0.276 129 C C 2.602 177.581 174.990 -0.019 0.000 1.215 129 C CA 1.390 60.376 59.018 -0.052 0.000 1.743 129 C CB -1.064 26.639 27.740 -0.061 0.000 2.044 129 C HN 0.548 nan 8.230 nan 0.000 0.464 130 D N 0.302 120.701 120.400 -0.001 0.000 2.158 130 D HA -0.111 4.551 4.640 0.037 0.000 0.197 130 D C 2.139 178.451 176.300 0.020 0.000 0.995 130 D CA 1.661 55.670 54.000 0.014 0.000 0.846 130 D CB -0.192 40.623 40.800 0.024 0.000 0.941 130 D HN 0.466 nan 8.370 nan 0.000 0.456 131 A N -0.123 122.715 122.820 0.030 0.000 1.873 131 A HA -0.072 4.270 4.320 0.037 0.000 0.215 131 A C 2.408 180.005 177.584 0.020 0.000 1.186 131 A CA 0.978 53.036 52.037 0.036 0.000 0.616 131 A CB -0.760 18.278 19.000 0.063 0.000 0.823 131 A HN 0.325 nan 8.150 nan 0.000 0.442 132 L N -0.808 120.420 121.223 0.008 0.000 2.141 132 L HA -0.140 4.222 4.340 0.037 0.000 0.209 132 L C 3.029 179.896 176.870 -0.005 0.000 1.094 132 L CA 0.775 55.614 54.840 -0.002 0.000 0.763 132 L CB -0.576 41.473 42.059 -0.016 0.000 0.908 132 L HN 0.457 nan 8.230 nan 0.000 0.437 133 A N 0.298 123.115 122.820 -0.005 0.000 1.832 133 A HA -0.199 4.143 4.320 0.037 0.000 0.214 133 A C 2.398 179.985 177.584 0.005 0.000 1.200 133 A CA 1.369 53.405 52.037 -0.002 0.000 0.610 133 A CB -0.553 18.448 19.000 0.001 0.000 0.842 133 A HN 0.240 nan 8.150 nan 0.000 0.444 134 R N 0.185 120.691 120.500 0.010 0.000 2.139 134 R HA -0.156 4.206 4.340 0.037 0.000 0.243 134 R C 2.597 178.903 176.300 0.011 0.000 1.145 134 R CA 1.677 57.784 56.100 0.012 0.000 0.976 134 R CB -0.400 29.910 30.300 0.016 0.000 0.866 134 R HN 0.768 nan 8.270 nan 0.000 0.449 135 S N -0.794 114.912 115.700 0.010 0.000 2.400 135 S HA -0.100 4.392 4.470 0.037 0.000 0.232 135 S C 1.654 176.258 174.600 0.006 0.000 1.025 135 S CA 1.189 59.394 58.200 0.009 0.000 0.993 135 S CB -0.343 62.863 63.200 0.009 0.000 0.808 135 S HN 0.540 nan 8.310 nan 0.000 0.478 136 G N 0.586 109.388 108.800 0.005 0.000 2.155 136 G HA2 -0.200 3.782 3.960 0.037 0.000 0.257 136 G HA3 -0.200 3.782 3.960 0.037 0.000 0.257 136 G C 0.797 175.698 174.900 0.001 0.000 0.983 136 G CA 0.510 45.612 45.100 0.003 0.000 0.676 136 G HN 1.323 nan 8.290 nan 0.000 0.528 137 A N -1.113 121.707 122.820 0.001 0.000 1.956 137 A HA 0.639 4.981 4.320 0.037 0.000 0.212 137 A C 1.267 178.849 177.584 -0.003 0.000 1.188 137 A CA 1.393 53.430 52.037 0.000 0.000 0.675 137 A CB 0.354 19.356 19.000 0.002 0.000 0.845 137 A HN 1.001 nan 8.150 nan 0.000 0.455 138 V N 1.421 121.333 119.914 -0.005 0.000 2.546 138 V HA 0.162 4.304 4.120 0.037 0.000 0.284 138 V C 0.304 176.391 176.094 -0.011 0.000 1.050 138 V CA -0.238 62.057 62.300 -0.009 0.000 0.981 138 V CB 1.406 33.221 31.823 -0.013 0.000 0.990 138 V HN 0.445 nan 8.190 nan 0.000 0.474 139 D N 1.751 122.143 120.400 -0.012 0.000 2.394 139 D HA 0.105 4.767 4.640 0.037 0.000 0.226 139 D C 0.210 176.499 176.300 -0.018 0.000 0.990 139 D CA 1.008 55.001 54.000 -0.012 0.000 0.902 139 D CB 1.578 42.372 40.800 -0.011 0.000 1.038 139 D HN 0.371 nan 8.370 nan 0.000 0.499 140 V N 1.408 121.309 119.914 -0.021 0.000 2.623 140 V HA 0.449 4.591 4.120 0.037 0.000 0.304 140 V C -1.616 174.451 176.094 -0.045 0.000 1.054 140 V CA -0.654 61.628 62.300 -0.031 0.000 0.882 140 V CB 1.835 33.645 31.823 -0.022 0.000 1.002 140 V HN -0.108 nan 8.190 nan 0.000 0.424 141 I N 6.842 127.361 120.570 -0.085 0.000 2.465 141 I HA 0.652 4.844 4.170 0.037 0.000 0.291 141 I C -0.554 175.434 176.117 -0.214 0.000 1.014 141 I CA -1.011 60.209 61.300 -0.134 0.000 1.093 141 I CB 2.028 39.934 38.000 -0.157 0.000 1.267 141 I HN 0.560 nan 8.210 nan 0.000 0.431 142 V N 7.186 126.944 119.914 -0.260 0.000 2.540 142 V HA 0.596 4.738 4.120 0.037 0.000 0.302 142 V C -0.928 174.799 176.094 -0.611 0.000 1.035 142 V CA -0.380 61.682 62.300 -0.396 0.000 0.873 142 V CB 2.107 33.766 31.823 -0.274 0.000 0.992 142 V HN 0.436 nan 8.190 nan 0.000 0.428 143 V N 5.600 125.164 119.914 -0.584 0.000 2.347 143 V HA 0.412 4.554 4.120 0.037 0.000 0.280 143 V C -0.220 175.653 176.094 -0.369 0.000 1.021 143 V CA -0.394 61.610 62.300 -0.492 0.000 0.847 143 V CB 1.320 32.884 31.823 -0.432 0.000 0.990 143 V HN 0.964 nan 8.190 nan 0.000 0.444 144 D N 3.566 123.714 120.400 -0.419 0.000 2.365 144 D HA 0.328 4.990 4.640 0.037 0.000 0.237 144 D C 0.044 176.298 176.300 -0.077 0.000 1.190 144 D CA 0.682 54.558 54.000 -0.207 0.000 0.867 144 D CB 0.564 41.303 40.800 -0.101 0.000 1.050 144 D HN 0.650 nan 8.370 nan 0.000 0.491 145 S N 1.215 116.893 115.700 -0.036 0.000 3.392 145 S HA -0.147 4.345 4.470 0.037 0.000 0.693 145 S C 1.198 175.805 174.600 0.012 0.000 0.620 145 S CA 0.342 58.523 58.200 -0.032 0.000 1.452 145 S CB -1.050 62.086 63.200 -0.105 0.000 0.988 145 S HN 0.532 nan 8.310 nan 0.000 0.932 146 V N 2.224 122.167 119.914 0.048 0.000 2.626 146 V HA -0.037 4.105 4.120 0.037 0.000 0.252 146 V C 2.351 178.448 176.094 0.005 0.000 1.067 146 V CA 2.344 64.673 62.300 0.048 0.000 1.081 146 V CB -1.138 30.680 31.823 -0.008 0.000 0.686 146 V HN 1.451 nan 8.190 nan 0.000 0.468 147 A N 0.886 123.689 122.820 -0.028 0.000 1.958 147 A HA -0.101 4.241 4.320 0.037 0.000 0.221 147 A C 2.355 179.994 177.584 0.091 0.000 1.178 147 A CA 2.622 54.651 52.037 -0.013 0.000 0.642 147 A CB -1.056 17.879 19.000 -0.109 0.000 0.816 147 A HN 1.285 nan 8.150 nan 0.000 0.453 148 A N -1.675 121.196 122.820 0.085 0.000 2.275 148 A HA 0.452 4.794 4.320 0.037 0.000 0.212 148 A C 0.549 178.206 177.584 0.122 0.000 1.201 148 A CA -0.083 52.059 52.037 0.175 0.000 0.843 148 A CB -0.177 18.916 19.000 0.155 0.000 0.873 148 A HN 0.282 nan 8.150 nan 0.000 0.492 149 L N 2.367 123.634 121.223 0.073 0.000 2.376 149 L HA 0.141 4.503 4.340 0.037 0.000 0.250 149 L C 0.172 177.064 176.870 0.035 0.000 1.335 149 L CA 0.553 55.422 54.840 0.048 0.000 1.214 149 L CB -1.052 41.028 42.059 0.035 0.000 1.395 149 L HN 0.098 nan 8.230 nan 0.000 0.424 150 T N 2.982 117.564 114.554 0.047 0.000 2.799 150 T HA 0.192 4.564 4.350 0.037 0.000 0.296 150 T C -2.156 172.545 174.700 0.001 0.000 0.947 150 T CA -1.003 61.114 62.100 0.028 0.000 1.141 150 T CB 0.356 69.245 68.868 0.035 0.000 0.891 150 T HN 0.169 nan 8.240 nan 0.000 0.533 151 P HA 0.093 nan 4.420 nan 0.000 0.268 151 P C 0.999 178.258 177.300 -0.068 0.000 1.208 151 P CA -0.441 62.627 63.100 -0.053 0.000 0.777 151 P CB 0.739 32.388 31.700 -0.086 0.000 0.875 152 K N 2.340 122.705 120.400 -0.059 0.000 2.009 152 K HA -0.233 4.109 4.320 0.037 0.000 0.210 152 K C 1.825 178.374 176.600 -0.085 0.000 1.049 152 K CA 2.015 58.276 56.287 -0.044 0.000 0.929 152 K CB -0.727 31.762 32.500 -0.018 0.000 0.714 152 K HN 0.469 nan 8.250 nan 0.000 0.440 153 A N 0.951 123.672 122.820 -0.165 0.000 1.978 153 A HA -0.225 4.117 4.320 0.037 0.000 0.220 153 A C 1.917 179.303 177.584 -0.331 0.000 1.170 153 A CA 1.921 53.803 52.037 -0.259 0.000 0.636 153 A CB -0.504 18.263 19.000 -0.387 0.000 0.810 153 A HN 0.599 nan 8.150 nan 0.000 0.448 154 E N -0.410 119.588 120.200 -0.336 0.000 2.150 154 E HA -0.110 4.262 4.350 0.037 0.000 0.193 154 E C 1.698 178.310 176.600 0.019 0.000 0.985 154 E CA 0.976 57.320 56.400 -0.093 0.000 0.814 154 E CB -0.180 29.508 29.700 -0.019 0.000 0.752 154 E HN 0.688 nan 8.360 nan 0.000 0.466 155 I N 0.732 121.295 120.570 -0.012 0.000 2.235 155 I HA -0.199 3.993 4.170 0.037 0.000 0.241 155 I C 1.705 177.837 176.117 0.025 0.000 1.085 155 I CA 1.210 62.517 61.300 0.011 0.000 1.378 155 I CB 0.004 38.008 38.000 0.006 0.000 1.076 155 I HN 0.060 nan 8.210 nan 0.000 0.415 156 E N 0.819 121.033 120.200 0.022 0.000 2.435 156 E HA 0.104 4.476 4.350 0.037 0.000 0.195 156 E C 0.891 177.519 176.600 0.046 0.000 1.029 156 E CA 0.216 56.634 56.400 0.031 0.000 0.865 156 E CB -0.251 29.464 29.700 0.024 0.000 0.833 156 E HN 0.362 nan 8.360 nan 0.000 0.510 157 G N 0.602 109.443 108.800 0.069 0.000 2.367 157 G HA2 0.250 4.232 3.960 0.037 0.000 0.314 157 G HA3 0.250 4.232 3.960 0.037 0.000 0.314 157 G C -0.453 174.508 174.900 0.101 0.000 1.130 157 G CA -0.670 44.492 45.100 0.103 0.000 0.864 157 G HN -0.056 nan 8.290 nan 0.000 0.486 158 E N -0.068 120.180 120.200 0.080 0.000 2.461 158 E HA -0.023 4.349 4.350 0.037 0.000 0.263 158 E C 0.105 176.746 176.600 0.068 0.000 1.143 158 E CA 0.380 56.825 56.400 0.075 0.000 0.994 158 E CB 0.996 30.739 29.700 0.071 0.000 0.973 158 E HN 0.290 nan 8.360 nan 0.000 0.457 159 I N 1.112 121.720 120.570 0.064 0.000 2.396 159 I HA 0.141 4.333 4.170 0.037 0.000 0.289 159 I C 1.085 177.220 176.117 0.031 0.000 1.056 159 I CA 0.767 62.092 61.300 0.042 0.000 1.365 159 I CB 0.591 38.610 38.000 0.031 0.000 1.407 159 I HN 0.829 nan 8.210 nan 0.000 0.509 160 G N 4.293 113.097 108.800 0.007 0.000 2.183 160 G HA2 -0.167 3.815 3.960 0.037 0.000 0.168 160 G HA3 -0.167 3.815 3.960 0.037 0.000 0.168 160 G C -0.345 174.533 174.900 -0.036 0.000 1.008 160 G CA -0.638 44.456 45.100 -0.009 0.000 0.677 160 G HN 0.621 nan 8.290 nan 0.000 0.498 161 D N 2.196 122.558 120.400 -0.064 0.000 2.514 161 D HA 0.414 5.076 4.640 0.037 0.000 0.267 161 D C 0.804 176.938 176.300 -0.277 0.000 1.165 161 D CA 0.358 54.267 54.000 -0.153 0.000 0.958 161 D CB 0.830 41.535 40.800 -0.158 0.000 0.992 161 D HN 0.524 nan 8.370 nan 0.000 0.506 162 S N 1.206 116.801 115.700 -0.176 0.000 2.525 162 S HA -0.024 4.468 4.470 0.037 0.000 0.285 162 S C 0.253 174.711 174.600 -0.236 0.000 1.283 162 S CA -0.221 57.898 58.200 -0.135 0.000 1.072 162 S CB 0.460 63.626 63.200 -0.057 0.000 0.867 162 S HN 0.297 nan 8.310 nan 0.000 0.492 163 H N 4.376 123.447 119.070 0.000 0.000 2.908 163 H HA 0.152 4.730 4.556 0.037 0.000 0.269 163 H C 0.262 175.589 175.328 -0.002 0.000 1.303 163 H CA -0.208 55.840 56.048 0.000 0.000 1.341 163 H CB 0.072 29.835 29.762 0.001 0.000 1.519 163 H HN 0.673 nan 8.280 nan 0.000 0.505 164 M N 1.924 121.554 119.600 0.051 0.000 3.155 164 M HA -0.121 4.381 4.480 0.037 0.000 0.376 164 M C 1.190 177.513 176.300 0.039 0.000 1.802 164 M CA 0.735 56.052 55.300 0.029 0.000 1.414 164 M CB -0.717 31.892 32.600 0.015 0.000 1.942 164 M HN 0.846 nan 8.290 nan 0.000 0.479 165 G N 2.758 111.580 108.800 0.037 0.000 2.467 165 G HA2 -0.280 3.702 3.960 0.037 0.000 0.302 165 G HA3 -0.280 3.702 3.960 0.037 0.000 0.302 165 G C 0.780 175.697 174.900 0.028 0.000 0.930 165 G CA 0.617 45.733 45.100 0.027 0.000 1.008 165 G HN 0.818 nan 8.290 nan 0.000 0.512 166 L N -0.350 120.905 121.223 0.053 0.000 2.089 166 L HA -0.074 4.288 4.340 0.037 0.000 0.213 166 L C 3.060 179.932 176.870 0.004 0.000 1.079 166 L CA 2.766 57.627 54.840 0.036 0.000 0.758 166 L CB -0.363 41.726 42.059 0.050 0.000 0.891 166 L HN 0.510 nan 8.230 nan 0.000 0.433 167 A N -0.480 122.342 122.820 0.003 0.000 1.958 167 A HA -0.301 4.041 4.320 0.037 0.000 0.221 167 A C 2.421 179.989 177.584 -0.027 0.000 1.178 167 A CA 2.111 54.139 52.037 -0.014 0.000 0.642 167 A CB -1.060 17.936 19.000 -0.007 0.000 0.816 167 A HN 0.631 nan 8.150 nan 0.000 0.453 168 A N -0.696 122.112 122.820 -0.020 0.000 1.898 168 A HA -0.104 4.238 4.320 0.037 0.000 0.216 168 A C 2.221 179.787 177.584 -0.030 0.000 1.181 168 A CA 1.642 53.663 52.037 -0.028 0.000 0.620 168 A CB -0.426 18.565 19.000 -0.015 0.000 0.819 168 A HN 0.559 nan 8.150 nan 0.000 0.442 169 R N -0.889 119.599 120.500 -0.020 0.000 2.115 169 R HA -0.048 4.314 4.340 0.037 0.000 0.230 169 R C 2.185 178.466 176.300 -0.032 0.000 1.111 169 R CA 1.531 57.618 56.100 -0.021 0.000 0.976 169 R CB -0.291 30.003 30.300 -0.010 0.000 0.870 169 R HN 0.622 nan 8.270 nan 0.000 0.445 170 M N -0.349 119.230 119.600 -0.034 0.000 2.099 170 M HA -0.174 4.328 4.480 0.037 0.000 0.262 170 M C 1.745 178.007 176.300 -0.063 0.000 1.067 170 M CA 1.479 56.755 55.300 -0.041 0.000 1.124 170 M CB 0.043 32.622 32.600 -0.035 0.000 1.353 170 M HN 0.209 nan 8.290 nan 0.000 0.410 171 M N -0.424 119.128 119.600 -0.080 0.000 2.108 171 M HA -0.195 4.307 4.480 0.037 0.000 0.261 171 M C 2.368 178.579 176.300 -0.148 0.000 1.066 171 M CA 1.575 56.797 55.300 -0.130 0.000 1.107 171 M CB -1.368 31.145 32.600 -0.145 0.000 1.356 171 M HN 0.346 nan 8.290 nan 0.000 0.406 172 S N -0.243 115.396 115.700 -0.102 0.000 2.399 172 S HA -0.178 4.314 4.470 0.037 0.000 0.231 172 S C 1.850 176.382 174.600 -0.113 0.000 1.022 172 S CA 1.252 59.396 58.200 -0.093 0.000 0.983 172 S CB -0.123 63.055 63.200 -0.038 0.000 0.803 172 S HN 0.513 nan 8.310 nan 0.000 0.480 173 Q N 0.171 119.919 119.800 -0.086 0.000 2.083 173 Q HA -0.015 4.347 4.340 0.037 0.000 0.198 173 Q C 2.200 178.141 176.000 -0.097 0.000 0.969 173 Q CA 1.157 56.917 55.803 -0.072 0.000 0.838 173 Q CB -0.321 28.391 28.738 -0.043 0.000 0.900 173 Q HN 0.576 nan 8.270 nan 0.000 0.436 174 A N 0.963 123.718 122.820 -0.109 0.000 1.883 174 A HA -0.220 4.122 4.320 0.037 0.000 0.217 174 A C 2.043 179.523 177.584 -0.174 0.000 1.186 174 A CA 1.644 53.620 52.037 -0.102 0.000 0.624 174 A CB -0.535 18.419 19.000 -0.077 0.000 0.822 174 A HN 0.390 nan 8.150 nan 0.000 0.444 175 M N -0.424 118.977 119.600 -0.331 0.000 2.073 175 M HA -0.184 4.318 4.480 0.037 0.000 0.258 175 M C 2.166 178.118 176.300 -0.580 0.000 1.070 175 M CA 1.757 56.666 55.300 -0.652 0.000 1.103 175 M CB -1.461 30.388 32.600 -1.251 0.000 1.321 175 M HN 0.427 nan 8.290 nan 0.000 0.405 176 R N 0.023 120.288 120.500 -0.392 0.000 2.112 176 R HA -0.187 4.175 4.340 0.037 0.000 0.242 176 R C 2.290 178.567 176.300 -0.037 0.000 1.137 176 R CA 1.690 57.733 56.100 -0.095 0.000 0.944 176 R CB -0.374 29.913 30.300 -0.023 0.000 0.857 176 R HN 0.453 nan 8.270 nan 0.000 0.435 177 K N 0.312 120.679 120.400 -0.055 0.000 2.097 177 K HA -0.068 4.274 4.320 0.037 0.000 0.205 177 K C 2.154 178.750 176.600 -0.006 0.000 1.050 177 K CA 1.011 57.287 56.287 -0.018 0.000 0.938 177 K CB -0.020 32.471 32.500 -0.016 0.000 0.718 177 K HN 0.182 nan 8.250 nan 0.000 0.442 178 L N 0.265 121.474 121.223 -0.024 0.000 2.095 178 L HA -0.060 4.302 4.340 0.037 0.000 0.204 178 L C 2.594 179.485 176.870 0.035 0.000 1.080 178 L CA 0.662 55.507 54.840 0.008 0.000 0.759 178 L CB -0.609 41.463 42.059 0.022 0.000 0.914 178 L HN 0.142 nan 8.230 nan 0.000 0.439 179 A N 0.890 123.740 122.820 0.049 0.000 1.896 179 A HA -0.255 4.087 4.320 0.037 0.000 0.220 179 A C 2.374 180.008 177.584 0.085 0.000 1.206 179 A CA 2.322 54.428 52.037 0.116 0.000 0.647 179 A CB -1.503 17.635 19.000 0.230 0.000 0.828 179 A HN 0.454 nan 8.150 nan 0.000 0.455 180 G N -0.796 108.046 108.800 0.069 0.000 2.421 180 G HA2 -0.284 3.698 3.960 0.037 0.000 0.216 180 G HA3 -0.284 3.698 3.960 0.037 0.000 0.216 180 G C 1.435 176.358 174.900 0.038 0.000 1.171 180 G CA 1.120 46.251 45.100 0.051 0.000 0.775 180 G HN 0.725 nan 8.290 nan 0.000 0.543 181 N N -0.258 118.462 118.700 0.033 0.000 2.396 181 N HA 0.067 4.829 4.740 0.037 0.000 0.180 181 N C 2.099 177.623 175.510 0.024 0.000 1.028 181 N CA 0.143 53.208 53.050 0.025 0.000 0.893 181 N CB -0.043 38.456 38.487 0.020 0.000 0.967 181 N HN 0.246 nan 8.380 nan 0.000 0.440 182 L N 0.298 121.539 121.223 0.031 0.000 2.209 182 L HA -0.033 4.329 4.340 0.037 0.000 0.207 182 L C 2.318 179.205 176.870 0.029 0.000 1.094 182 L CA 0.722 55.579 54.840 0.028 0.000 0.790 182 L CB -0.064 42.019 42.059 0.039 0.000 0.932 182 L HN 0.019 nan 8.230 nan 0.000 0.447 183 K N 0.602 121.024 120.400 0.036 0.000 2.031 183 K HA -0.157 4.185 4.320 0.037 0.000 0.205 183 K C 2.041 178.655 176.600 0.023 0.000 1.049 183 K CA 1.530 57.836 56.287 0.032 0.000 0.939 183 K CB -0.170 32.352 32.500 0.038 0.000 0.717 183 K HN 0.101 nan 8.250 nan 0.000 0.438 184 Q N -0.421 119.392 119.800 0.023 0.000 2.437 184 Q HA 0.033 4.395 4.340 0.037 0.000 0.210 184 Q C 1.035 177.044 176.000 0.014 0.000 0.972 184 Q CA 1.328 57.142 55.803 0.018 0.000 0.903 184 Q CB 0.221 28.970 28.738 0.018 0.000 0.967 184 Q HN 0.218 nan 8.270 nan 0.000 0.486 185 S N 0.002 115.711 115.700 0.014 0.000 2.524 185 S HA 0.042 4.534 4.470 0.037 0.000 0.215 185 S C 0.204 174.809 174.600 0.008 0.000 0.986 185 S CA -0.210 57.996 58.200 0.009 0.000 0.911 185 S CB 0.307 63.511 63.200 0.008 0.000 0.805 185 S HN 0.408 nan 8.310 nan 0.000 0.501 186 N N 2.563 121.269 118.700 0.010 0.000 2.705 186 N HA -0.139 4.623 4.740 0.037 0.000 0.255 186 N C -1.354 174.159 175.510 0.004 0.000 1.008 186 N CA 0.742 53.798 53.050 0.009 0.000 0.742 186 N CB -1.424 37.067 38.487 0.007 0.000 0.906 186 N HN 0.282 nan 8.380 nan 0.000 0.541 187 T N 1.164 115.721 114.554 0.004 0.000 2.792 187 T HA 0.460 4.832 4.350 0.037 0.000 0.280 187 T C 0.178 174.874 174.700 -0.006 0.000 0.990 187 T CA -0.721 61.376 62.100 -0.004 0.000 0.960 187 T CB 1.746 70.609 68.868 -0.009 0.000 0.939 187 T HN 0.276 nan 8.240 nan 0.000 0.439 188 L N 4.268 125.483 121.223 -0.013 0.000 2.349 188 L HA 0.618 4.980 4.340 0.037 0.000 0.275 188 L C -0.970 175.872 176.870 -0.048 0.000 1.115 188 L CA -0.308 54.522 54.840 -0.017 0.000 0.820 188 L CB 0.424 42.475 42.059 -0.014 0.000 1.135 188 L HN 0.640 nan 8.230 nan 0.000 0.445 189 L N 6.553 127.744 121.223 -0.053 0.000 2.376 189 L HA 0.553 4.915 4.340 0.037 0.000 0.275 189 L C -1.155 175.627 176.870 -0.146 0.000 0.987 189 L CA -0.452 54.300 54.840 -0.146 0.000 0.828 189 L CB 1.445 43.411 42.059 -0.155 0.000 1.249 189 L HN 0.650 nan 8.230 nan 0.000 0.409 190 I N 4.297 124.731 120.570 -0.226 0.000 2.362 190 I HA 0.315 4.507 4.170 0.037 0.000 0.289 190 I C -0.911 175.041 176.117 -0.275 0.000 0.994 190 I CA -0.323 60.893 61.300 -0.140 0.000 1.158 190 I CB 1.452 39.409 38.000 -0.072 0.000 1.315 190 I HN 0.377 nan 8.210 nan 0.000 0.451 191 F N 6.460 126.391 119.950 -0.031 0.000 2.404 191 F HA 0.475 5.024 4.527 0.037 0.000 0.354 191 F C 0.402 176.191 175.800 -0.018 0.000 1.122 191 F CA -0.451 57.523 58.000 -0.043 0.000 1.080 191 F CB 1.006 39.990 39.000 -0.027 0.000 1.131 191 F HN 0.213 nan 8.300 nan 0.000 0.471 192 I N 3.475 124.111 120.570 0.111 0.000 2.395 192 I HA 0.203 4.395 4.170 0.037 0.000 0.289 192 I C -0.191 175.985 176.117 0.099 0.000 1.023 192 I CA -0.071 61.287 61.300 0.096 0.000 1.350 192 I CB 1.060 39.090 38.000 0.050 0.000 1.409 192 I HN 0.651 nan 8.210 nan 0.000 0.507 193 N N 4.193 122.957 118.700 0.107 0.000 2.265 193 N HA 0.375 5.137 4.740 0.037 0.000 0.300 193 N C -1.268 174.234 175.510 -0.013 0.000 1.148 193 N CA -0.698 52.376 53.050 0.039 0.000 0.772 193 N CB 1.770 40.289 38.487 0.054 0.000 1.434 193 N HN 0.540 nan 8.380 nan 0.000 0.481 194 Q N 0.951 120.616 119.800 -0.226 0.000 2.180 194 Q HA 0.492 4.854 4.340 0.037 0.000 0.241 194 Q C -0.624 175.169 176.000 -0.346 0.000 0.970 194 Q CA -0.615 54.836 55.803 -0.585 0.000 0.919 194 Q CB 2.030 29.999 28.738 -1.281 0.000 1.222 194 Q HN 0.475 nan 8.270 nan 0.000 0.482 195 I N 1.574 121.987 120.570 -0.261 0.000 2.359 195 I HA 0.348 4.540 4.170 0.037 0.000 0.294 195 I C -0.076 176.046 176.117 0.008 0.000 0.987 195 I CA -0.669 60.635 61.300 0.007 0.000 1.225 195 I CB 0.790 38.931 38.000 0.236 0.000 1.366 195 I HN 0.317 nan 8.210 nan 0.000 0.466 196 R N 4.657 125.150 120.500 -0.011 0.000 2.873 196 R HA 0.625 4.987 4.340 0.037 0.000 0.264 196 R C -0.578 175.748 176.300 0.043 0.000 1.026 196 R CA -1.245 54.870 56.100 0.024 0.000 1.002 196 R CB 1.584 31.877 30.300 -0.012 0.000 1.174 196 R HN 0.388 nan 8.270 nan 0.000 0.488 197 M N 1.258 120.891 119.600 0.055 0.000 2.267 197 M HA 0.336 4.838 4.480 0.037 0.000 0.303 197 M C -0.046 176.280 176.300 0.043 0.000 1.164 197 M CA -0.164 55.170 55.300 0.057 0.000 1.060 197 M CB 0.626 33.263 32.600 0.061 0.000 1.455 197 M HN 0.366 nan 8.290 nan 0.000 0.483 198 K N 1.192 121.624 120.400 0.054 0.000 2.427 198 K HA 0.643 4.985 4.320 0.037 0.000 0.252 198 K C -1.168 175.464 176.600 0.053 0.000 0.931 198 K CA -0.584 55.730 56.287 0.044 0.000 0.793 198 K CB 1.586 34.111 32.500 0.041 0.000 1.211 198 K HN 0.629 nan 8.250 nan 0.000 0.426 199 I N 0.392 120.985 120.570 0.038 0.000 3.783 199 I HA 0.212 4.404 4.170 0.037 0.000 0.272 199 I C 1.197 177.338 176.117 0.040 0.000 1.329 199 I CA -0.435 60.888 61.300 0.039 0.000 0.887 199 I CB 0.481 38.497 38.000 0.027 0.000 1.596 199 I HN 1.003 nan 8.210 nan 0.000 0.712 200 G N 1.389 110.211 108.800 0.036 0.000 2.449 200 G HA2 -0.233 3.749 3.960 0.037 0.000 0.304 200 G HA3 -0.233 3.749 3.960 0.037 0.000 0.304 200 G C 0.012 174.942 174.900 0.050 0.000 0.962 200 G CA 0.757 45.877 45.100 0.033 0.000 0.943 200 G HN 0.426 nan 8.290 nan 0.000 0.514 201 V N 0.737 120.705 119.914 0.090 0.000 2.225 201 V HA 0.631 4.773 4.120 0.037 0.000 0.264 201 V C 0.615 176.844 176.094 0.224 0.000 1.067 201 V CA -0.663 61.741 62.300 0.174 0.000 0.903 201 V CB 0.331 32.280 31.823 0.210 0.000 1.136 201 V HN 0.361 nan 8.190 nan 0.000 0.456 202 M N 6.233 125.946 119.600 0.189 0.000 3.462 202 M HA 0.354 4.856 4.480 0.037 0.000 0.219 202 M C 0.319 176.739 176.300 0.199 0.000 1.207 202 M CA 0.129 55.516 55.300 0.145 0.000 1.284 202 M CB -0.019 32.634 32.600 0.088 0.000 1.160 202 M HN 0.742 nan 8.290 nan 0.000 0.598 203 F N -1.732 118.225 119.950 0.012 0.000 2.017 203 F HA 0.809 5.358 4.527 0.037 0.000 0.245 203 F C 0.917 176.724 175.800 0.010 0.000 1.060 203 F CA 0.400 58.406 58.000 0.010 0.000 1.231 203 F CB -0.004 39.001 39.000 0.008 0.000 1.527 203 F HN 0.108 nan 8.300 nan 0.000 0.636 204 G N 0.882 108.649 108.800 -1.721 0.000 3.226 204 G HA2 0.198 4.180 3.960 0.037 0.000 0.175 204 G HA3 0.198 4.180 3.960 0.037 0.000 0.175 204 G C -1.244 173.063 174.900 -0.988 0.000 1.509 204 G CA 0.080 44.161 45.100 -1.698 0.000 1.046 204 G HN 0.564 nan 8.290 nan 0.000 0.768 205 N N 1.489 119.720 118.700 -0.781 0.000 2.314 205 N HA 0.470 5.232 4.740 0.037 0.000 0.304 205 N C -2.681 172.910 175.510 0.135 0.000 1.073 205 N CA -1.833 51.124 53.050 -0.156 0.000 0.822 205 N CB 2.902 41.359 38.487 -0.050 0.000 1.280 205 N HN 0.089 nan 8.380 nan 0.000 0.489 206 P HA 0.235 nan 4.420 nan 0.000 0.253 206 P C -0.717 176.654 177.300 0.118 0.000 1.459 206 P CA 0.241 63.434 63.100 0.155 0.000 0.908 206 P CB 0.117 31.882 31.700 0.109 0.000 1.470 207 E N -0.141 120.124 120.200 0.110 0.000 2.191 207 E HA 0.427 4.798 4.350 0.037 0.000 0.278 207 E C -0.010 176.605 176.600 0.024 0.000 0.972 207 E CA -0.313 56.129 56.400 0.070 0.000 0.804 207 E CB 1.480 31.228 29.700 0.079 0.000 1.110 207 E HN 0.052 nan 8.360 nan 0.000 0.394 208 T N 0.052 114.594 114.554 -0.020 0.000 2.604 208 T HA 0.499 4.871 4.350 0.037 0.000 0.267 208 T C -0.361 174.246 174.700 -0.155 0.000 0.923 208 T CA -0.725 61.322 62.100 -0.089 0.000 1.077 208 T CB 1.644 70.477 68.868 -0.059 0.000 1.392 208 T HN 0.271 nan 8.240 nan 0.000 0.531 209 T N 1.839 116.290 114.554 -0.171 0.000 2.921 209 T HA 0.565 4.937 4.350 0.037 0.000 0.297 209 T C -0.535 174.087 174.700 -0.130 0.000 1.013 209 T CA -0.562 61.418 62.100 -0.201 0.000 0.990 209 T CB 1.343 70.034 68.868 -0.295 0.000 1.023 209 T HN 0.751 nan 8.240 nan 0.000 0.447 210 T N 1.282 115.765 114.554 -0.119 0.000 2.900 210 T HA 0.474 4.846 4.350 0.037 0.000 0.307 210 T C 1.318 175.968 174.700 -0.083 0.000 1.065 210 T CA 0.361 62.409 62.100 -0.087 0.000 1.105 210 T CB 0.541 69.361 68.868 -0.081 0.000 0.979 210 T HN 1.172 nan 8.240 nan 0.000 0.544 211 G N 0.489 109.251 108.800 -0.064 0.000 2.171 211 G HA2 0.247 4.229 3.960 0.037 0.000 0.238 211 G HA3 0.247 4.229 3.960 0.037 0.000 0.238 211 G C 0.719 175.579 174.900 -0.066 0.000 1.039 211 G CA 0.100 45.158 45.100 -0.071 0.000 0.759 211 G HN 1.828 nan 8.290 nan 0.000 0.501 212 G N -0.137 108.636 108.800 -0.045 0.000 2.601 212 G HA2 -0.258 3.724 3.960 0.037 0.000 0.261 212 G HA3 -0.258 3.724 3.960 0.037 0.000 0.261 212 G C 0.686 175.583 174.900 -0.004 0.000 1.289 212 G CA 0.545 45.632 45.100 -0.021 0.000 0.920 212 G HN 0.958 nan 8.290 nan 0.000 0.571 213 N N 0.633 119.363 118.700 0.049 0.000 2.325 213 N HA 0.209 4.971 4.740 0.037 0.000 0.182 213 N C 2.436 178.090 175.510 0.240 0.000 1.088 213 N CA 1.256 54.387 53.050 0.135 0.000 0.879 213 N CB 0.017 38.631 38.487 0.212 0.000 0.983 213 N HN 0.838 nan 8.380 nan 0.000 0.471 214 A N 1.565 124.474 122.820 0.148 0.000 1.873 214 A HA -0.167 4.175 4.320 0.037 0.000 0.218 214 A C 2.162 179.896 177.584 0.250 0.000 1.193 214 A CA 1.235 53.385 52.037 0.188 0.000 0.629 214 A CB -0.764 18.245 19.000 0.015 0.000 0.826 214 A HN 0.218 nan 8.150 nan 0.000 0.447 215 L N -0.187 121.068 121.223 0.055 0.000 2.093 215 L HA -0.125 4.237 4.340 0.037 0.000 0.208 215 L C 2.218 179.138 176.870 0.082 0.000 1.085 215 L CA 2.101 56.941 54.840 0.001 0.000 0.755 215 L CB -0.557 41.392 42.059 -0.184 0.000 0.904 215 L HN 0.368 nan 8.230 nan 0.000 0.435 216 K N -1.077 119.351 120.400 0.046 0.000 2.059 216 K HA -0.242 4.100 4.320 0.037 0.000 0.212 216 K C 2.053 178.598 176.600 -0.092 0.000 1.050 216 K CA 2.174 58.419 56.287 -0.069 0.000 0.927 216 K CB -0.476 31.899 32.500 -0.208 0.000 0.714 216 K HN 0.273 nan 8.250 nan 0.000 0.447 217 F N -0.683 119.295 119.950 0.047 0.000 2.128 217 F HA -0.122 4.427 4.527 0.037 0.000 0.295 217 F C 2.134 177.903 175.800 -0.051 0.000 1.100 217 F CA 1.129 59.116 58.000 -0.021 0.000 1.260 217 F CB -0.393 38.564 39.000 -0.071 0.000 1.009 217 F HN 0.003 nan 8.300 nan 0.000 0.476 218 Y N 0.061 120.465 120.300 0.173 0.000 2.395 218 Y HA 0.193 4.765 4.550 0.037 0.000 0.293 218 Y C 1.623 177.567 175.900 0.072 0.000 1.123 218 Y CA -0.019 58.142 58.100 0.102 0.000 1.227 218 Y CB -0.687 37.815 38.460 0.069 0.000 1.012 218 Y HN -0.111 nan 8.280 nan 0.000 0.552 219 A N -0.096 122.844 122.820 0.199 0.000 2.511 219 A HA 0.135 4.477 4.320 0.037 0.000 0.242 219 A C 1.221 178.853 177.584 0.080 0.000 1.069 219 A CA 0.438 52.555 52.037 0.133 0.000 0.763 219 A CB 0.165 19.228 19.000 0.105 0.000 1.001 219 A HN 0.344 nan 8.150 nan 0.000 0.498 220 S N 0.620 116.363 115.700 0.072 0.000 2.458 220 S HA 0.166 4.658 4.470 0.037 0.000 0.223 220 S C 0.398 175.006 174.600 0.013 0.000 1.019 220 S CA 0.496 58.718 58.200 0.037 0.000 0.937 220 S CB 0.110 63.335 63.200 0.041 0.000 0.788 220 S HN 0.561 nan 8.310 nan 0.000 0.511 221 V N 2.290 122.218 119.914 0.024 0.000 2.760 221 V HA 0.498 4.640 4.120 0.037 0.000 0.309 221 V C -0.764 175.344 176.094 0.023 0.000 1.077 221 V CA -0.835 61.468 62.300 0.004 0.000 0.910 221 V CB 2.091 33.917 31.823 0.005 0.000 1.008 221 V HN 0.127 nan 8.190 nan 0.000 0.424 222 R N 3.888 124.390 120.500 0.002 0.000 2.476 222 R HA 0.635 4.997 4.340 0.037 0.000 0.305 222 R C -1.890 174.400 176.300 -0.016 0.000 0.965 222 R CA -0.828 55.299 56.100 0.045 0.000 0.867 222 R CB 2.204 32.561 30.300 0.096 0.000 1.176 222 R HN 0.370 nan 8.270 nan 0.000 0.447 223 L N 2.138 123.322 121.223 -0.064 0.000 2.329 223 L HA 0.356 4.718 4.340 0.037 0.000 0.279 223 L C -0.157 176.433 176.870 -0.466 0.000 1.014 223 L CA -0.414 54.327 54.840 -0.166 0.000 0.814 223 L CB 1.495 43.507 42.059 -0.078 0.000 1.257 223 L HN 0.452 nan 8.230 nan 0.000 0.424 224 D N 3.846 123.984 120.400 -0.437 0.000 2.461 224 D HA 0.273 4.935 4.640 0.037 0.000 0.240 224 D C -0.852 175.293 176.300 -0.258 0.000 1.094 224 D CA -0.242 53.401 54.000 -0.595 0.000 0.868 224 D CB 0.953 41.513 40.800 -0.400 0.000 1.062 224 D HN 0.448 nan 8.370 nan 0.000 0.530 225 I N 3.107 123.557 120.570 -0.200 0.000 2.392 225 I HA 0.505 4.697 4.170 0.037 0.000 0.295 225 I C -0.810 175.282 176.117 -0.041 0.000 0.985 225 I CA -0.596 60.655 61.300 -0.081 0.000 1.221 225 I CB 0.598 38.591 38.000 -0.011 0.000 1.366 225 I HN 0.231 nan 8.210 nan 0.000 0.467 226 R N 5.692 126.158 120.500 -0.055 0.000 2.584 226 R HA 0.360 4.722 4.340 0.037 0.000 0.276 226 R C -1.061 175.208 176.300 -0.050 0.000 1.046 226 R CA -0.872 55.211 56.100 -0.029 0.000 0.906 226 R CB 1.945 32.228 30.300 -0.028 0.000 1.215 226 R HN 0.573 nan 8.270 nan 0.000 0.449 227 R N 4.199 124.694 120.500 -0.008 0.000 2.316 227 R HA 0.140 4.502 4.340 0.037 0.000 0.314 227 R C 0.691 176.977 176.300 -0.024 0.000 1.069 227 R CA 0.162 56.259 56.100 -0.004 0.000 0.959 227 R CB 0.381 30.719 30.300 0.063 0.000 0.987 227 R HN 0.775 nan 8.270 nan 0.000 0.446 228 I N 0.717 121.253 120.570 -0.057 0.000 4.035 228 I HA 0.466 4.658 4.170 0.037 0.000 0.321 228 I C 0.589 176.672 176.117 -0.056 0.000 1.289 228 I CA -0.132 61.132 61.300 -0.061 0.000 1.236 228 I CB 0.878 38.828 38.000 -0.083 0.000 1.076 228 I HN 0.591 nan 8.210 nan 0.000 0.418 229 G N 0.926 109.689 108.800 -0.061 0.000 2.550 229 G HA2 0.695 4.677 3.960 0.037 0.000 0.293 229 G HA3 0.695 4.677 3.960 0.037 0.000 0.293 229 G C -1.943 172.904 174.900 -0.088 0.000 1.402 229 G CA -0.265 44.792 45.100 -0.071 0.000 0.784 229 G HN 0.288 nan 8.290 nan 0.000 0.482 230 A N -0.473 122.280 122.820 -0.112 0.000 2.305 230 A HA 0.683 5.025 4.320 0.037 0.000 0.322 230 A C -0.182 177.342 177.584 -0.100 0.000 1.187 230 A CA -0.512 51.443 52.037 -0.136 0.000 0.825 230 A CB 1.447 20.322 19.000 -0.208 0.000 1.164 230 A HN 1.292 nan 8.150 nan 0.000 0.498 231 V N 4.369 124.220 119.914 -0.104 0.000 2.356 231 V HA 0.140 4.282 4.120 0.037 0.000 0.258 231 V C 0.498 176.556 176.094 -0.060 0.000 1.065 231 V CA -0.073 62.175 62.300 -0.088 0.000 0.935 231 V CB -0.240 31.513 31.823 -0.117 0.000 1.061 231 V HN 0.825 nan 8.190 nan 0.000 0.484 232 K N 3.053 123.427 120.400 -0.044 0.000 2.090 232 K HA 0.500 4.842 4.320 0.037 0.000 0.249 232 K C 0.046 176.639 176.600 -0.012 0.000 0.995 232 K CA -0.629 55.642 56.287 -0.025 0.000 0.914 232 K CB 1.344 33.826 32.500 -0.030 0.000 1.057 232 K HN 0.457 nan 8.250 nan 0.000 0.462 233 E N 0.722 120.922 120.200 0.002 0.000 4.170 233 E HA 0.136 4.508 4.350 0.037 0.000 0.215 233 E C 0.381 176.986 176.600 0.008 0.000 1.119 233 E CA -0.013 56.392 56.400 0.007 0.000 1.396 233 E CB 0.751 30.463 29.700 0.020 0.000 1.182 233 E HN 1.021 nan 8.360 nan 0.000 0.438 234 G N 1.963 110.763 108.800 0.001 0.000 5.431 234 G HA2 -0.396 3.586 3.960 0.037 0.000 0.322 234 G HA3 -0.396 3.586 3.960 0.037 0.000 0.322 234 G C 1.059 175.961 174.900 0.003 0.000 1.370 234 G CA 0.717 45.818 45.100 0.001 0.000 0.963 234 G HN 0.396 nan 8.290 nan 0.000 0.797 235 E N 1.501 121.708 120.200 0.011 0.000 2.162 235 E HA 0.087 4.459 4.350 0.037 0.000 0.193 235 E C 1.021 177.636 176.600 0.025 0.000 0.953 235 E CA 0.280 56.689 56.400 0.015 0.000 0.849 235 E CB -0.112 29.599 29.700 0.018 0.000 0.810 235 E HN 0.637 nan 8.360 nan 0.000 0.470 236 N N 0.464 119.185 118.700 0.035 0.000 2.525 236 N HA 0.113 4.875 4.740 0.037 0.000 0.271 236 N C -0.793 174.754 175.510 0.063 0.000 1.194 236 N CA -0.085 53.000 53.050 0.058 0.000 0.964 236 N CB 1.640 40.166 38.487 0.065 0.000 1.126 236 N HN -0.214 nan 8.380 nan 0.000 0.452 237 V N 2.343 122.324 119.914 0.111 0.000 2.318 237 V HA 0.122 4.264 4.120 0.037 0.000 0.271 237 V C 0.563 176.806 176.094 0.247 0.000 1.030 237 V CA -0.318 62.063 62.300 0.136 0.000 0.844 237 V CB 1.187 33.096 31.823 0.144 0.000 1.015 237 V HN 0.550 nan 8.190 nan 0.000 0.460 238 V N 4.351 124.337 119.914 0.119 0.000 3.643 238 V HA 0.634 4.776 4.120 0.037 0.000 0.280 238 V C 0.838 176.779 176.094 -0.254 0.000 1.351 238 V CA 1.281 63.639 62.300 0.096 0.000 1.073 238 V CB 0.301 32.153 31.823 0.049 0.000 0.863 238 V HN 0.903 nan 8.190 nan 0.000 0.436 239 G N -1.159 107.326 108.800 -0.525 0.000 2.550 239 G HA2 0.481 4.463 3.960 0.037 0.000 0.293 239 G HA3 0.481 4.463 3.960 0.037 0.000 0.293 239 G C -1.482 173.075 174.900 -0.572 0.000 1.402 239 G CA -0.273 44.218 45.100 -1.015 0.000 0.784 239 G HN -0.014 nan 8.290 nan 0.000 0.482 240 S N -0.098 115.375 115.700 -0.377 0.000 2.456 240 S HA 0.480 4.972 4.470 0.037 0.000 0.316 240 S C -0.305 174.253 174.600 -0.071 0.000 1.089 240 S CA -0.412 57.753 58.200 -0.058 0.000 1.101 240 S CB 1.596 64.879 63.200 0.138 0.000 0.995 240 S HN 0.579 nan 8.310 nan 0.000 0.468 241 E N 2.146 122.298 120.200 -0.079 0.000 2.376 241 E HA 0.283 4.655 4.350 0.037 0.000 0.266 241 E C -0.556 175.955 176.600 -0.147 0.000 1.009 241 E CA 0.507 56.846 56.400 -0.101 0.000 0.902 241 E CB 0.543 30.190 29.700 -0.089 0.000 0.972 241 E HN 0.448 nan 8.360 nan 0.000 0.439 242 T N 4.968 119.354 114.554 -0.281 0.000 2.893 242 T HA 0.497 4.869 4.350 0.037 0.000 0.293 242 T C -0.889 173.476 174.700 -0.558 0.000 1.027 242 T CA -0.793 61.044 62.100 -0.439 0.000 0.988 242 T CB 1.261 69.766 68.868 -0.606 0.000 1.043 242 T HN 0.378 nan 8.240 nan 0.000 0.461 243 R N 2.228 122.499 120.500 -0.382 0.000 2.532 243 R HA 0.694 5.056 4.340 0.037 0.000 0.297 243 R C -1.948 174.230 176.300 -0.205 0.000 0.984 243 R CA -0.507 55.422 56.100 -0.285 0.000 0.884 243 R CB 1.360 31.562 30.300 -0.164 0.000 1.182 243 R HN 0.464 nan 8.270 nan 0.000 0.442 244 V N 4.513 124.340 119.914 -0.146 0.000 2.495 244 V HA 0.424 4.566 4.120 0.037 0.000 0.298 244 V C -0.243 175.831 176.094 -0.035 0.000 1.031 244 V CA -0.796 61.468 62.300 -0.060 0.000 0.871 244 V CB 1.907 33.756 31.823 0.044 0.000 0.988 244 V HN 0.670 nan 8.190 nan 0.000 0.432 245 K N 2.836 123.208 120.400 -0.046 0.000 2.206 245 K HA 0.568 4.910 4.320 0.037 0.000 0.264 245 K C -0.986 175.592 176.600 -0.037 0.000 0.967 245 K CA -0.676 55.602 56.287 -0.014 0.000 0.844 245 K CB 2.182 34.691 32.500 0.016 0.000 1.099 245 K HN 0.459 nan 8.250 nan 0.000 0.441 246 V N 4.676 124.572 119.914 -0.031 0.000 2.415 246 V HA -0.012 4.130 4.120 0.037 0.000 0.267 246 V C 1.047 177.029 176.094 -0.186 0.000 1.042 246 V CA 0.073 62.319 62.300 -0.091 0.000 1.000 246 V CB 0.877 32.646 31.823 -0.090 0.000 1.015 246 V HN 0.648 nan 8.190 nan 0.000 0.478 247 V N 3.973 123.786 119.914 -0.168 0.000 2.949 247 V HA 0.172 4.314 4.120 0.037 0.000 0.245 247 V C 0.829 176.714 176.094 -0.348 0.000 1.086 247 V CA 0.876 63.067 62.300 -0.182 0.000 1.097 247 V CB 0.025 31.885 31.823 0.061 0.000 0.762 247 V HN 0.769 nan 8.190 nan 0.000 0.470 248 K N 1.073 121.335 120.400 -0.230 0.000 2.371 248 K HA 0.430 4.772 4.320 0.037 0.000 0.251 248 K C -1.508 174.982 176.600 -0.183 0.000 0.934 248 K CA -0.571 55.583 56.287 -0.222 0.000 0.798 248 K CB 1.728 34.163 32.500 -0.108 0.000 1.204 248 K HN 0.117 nan 8.250 nan 0.000 0.427 249 N N 2.998 121.592 118.700 -0.177 0.000 2.549 249 N HA 0.191 4.953 4.740 0.037 0.000 0.290 249 N C -0.844 174.626 175.510 -0.067 0.000 1.122 249 N CA -0.306 52.677 53.050 -0.111 0.000 0.885 249 N CB 1.557 39.970 38.487 -0.124 0.000 1.455 249 N HN 0.603 nan 8.380 nan 0.000 0.521 250 K N 2.229 122.606 120.400 -0.038 0.000 2.374 250 K HA 0.256 4.598 4.320 0.037 0.000 0.196 250 K C 0.780 177.375 176.600 -0.009 0.000 1.023 250 K CA 0.137 56.413 56.287 -0.018 0.000 1.103 250 K CB 0.593 33.090 32.500 -0.006 0.000 0.848 250 K HN 0.380 nan 8.250 nan 0.000 0.528 251 I N -0.257 120.305 120.570 -0.013 0.000 3.883 251 I HA 0.156 4.348 4.170 0.037 0.000 0.305 251 I C 0.221 176.336 176.117 -0.004 0.000 1.247 251 I CA 0.035 61.332 61.300 -0.005 0.000 1.350 251 I CB 0.966 38.965 38.000 -0.002 0.000 1.194 251 I HN -0.051 nan 8.210 nan 0.000 0.441 252 A N -0.434 122.379 122.820 -0.011 0.000 2.534 252 A HA 0.851 5.193 4.320 0.037 0.000 0.300 252 A C -0.877 176.700 177.584 -0.011 0.000 1.223 252 A CA -0.182 51.851 52.037 -0.006 0.000 0.666 252 A CB -0.100 18.898 19.000 -0.003 0.000 1.316 252 A HN 0.063 nan 8.150 nan 0.000 0.468 253 A N 1.344 124.165 122.820 0.002 0.000 2.520 253 A HA 0.558 4.900 4.320 0.037 0.000 0.245 253 A C -2.029 175.546 177.584 -0.015 0.000 1.072 253 A CA -0.514 51.531 52.037 0.013 0.000 0.761 253 A CB -0.769 18.253 19.000 0.037 0.000 1.004 253 A HN 0.517 nan 8.150 nan 0.000 0.499 254 P HA 0.520 nan 4.420 nan 0.000 0.282 254 P C -0.128 177.125 177.300 -0.080 0.000 1.287 254 P CA -0.324 62.636 63.100 -0.234 0.000 0.792 254 P CB 0.167 31.528 31.700 -0.565 0.000 1.163 255 F N -4.601 115.353 119.950 0.007 0.000 2.840 255 F HA -0.204 4.345 4.527 0.037 0.000 0.310 255 F C 0.653 176.454 175.800 0.000 0.000 0.688 255 F CA 0.761 58.763 58.000 0.004 0.000 1.286 255 F CB -2.421 36.581 39.000 0.003 0.000 1.612 255 F HN 0.228 nan 8.300 nan 0.000 0.335 256 K N 1.267 121.733 120.400 0.111 0.000 2.202 256 K HA 0.454 4.795 4.320 0.037 0.000 0.264 256 K C 0.441 177.074 176.600 0.054 0.000 1.010 256 K CA -0.268 56.062 56.287 0.073 0.000 0.940 256 K CB 0.739 33.265 32.500 0.043 0.000 0.983 256 K HN 0.419 nan 8.250 nan 0.000 0.475 257 Q N 0.177 120.003 119.800 0.043 0.000 2.397 257 Q HA 0.733 5.095 4.340 0.037 0.000 0.275 257 Q C -1.697 174.318 176.000 0.025 0.000 1.090 257 Q CA -1.255 54.564 55.803 0.028 0.000 0.809 257 Q CB 2.158 30.907 28.738 0.019 0.000 1.362 257 Q HN 0.523 nan 8.270 nan 0.000 0.431 258 A N 1.880 124.719 122.820 0.031 0.000 2.371 258 A HA 0.634 4.976 4.320 0.037 0.000 0.311 258 A C -1.121 176.468 177.584 0.009 0.000 1.068 258 A CA -0.671 51.405 52.037 0.064 0.000 0.744 258 A CB 1.566 20.654 19.000 0.146 0.000 1.239 258 A HN 0.794 nan 8.150 nan 0.000 0.435 259 E N 0.282 120.483 120.200 0.002 0.000 2.244 259 E HA 0.774 5.146 4.350 0.037 0.000 0.266 259 E C -1.095 175.505 176.600 0.000 0.000 0.914 259 E CA -0.397 55.924 56.400 -0.131 0.000 0.794 259 E CB 2.099 31.741 29.700 -0.097 0.000 1.210 259 E HN 0.665 nan 8.360 nan 0.000 0.414 260 F N -1.885 118.046 119.950 -0.032 0.000 3.194 260 F HA 0.347 4.896 4.527 0.036 0.000 0.327 260 F C -1.712 174.068 175.800 -0.033 0.000 1.141 260 F CA -1.181 56.797 58.000 -0.038 0.000 0.862 260 F CB 0.873 39.847 39.000 -0.043 0.000 1.447 260 F HN 0.180 nan 8.300 nan 0.000 0.479 261 Q N 1.278 121.285 119.800 0.345 0.000 2.333 261 Q HA 0.670 5.032 4.340 0.037 0.000 0.267 261 Q C -1.295 174.861 176.000 0.260 0.000 1.012 261 Q CA -0.757 55.151 55.803 0.176 0.000 0.824 261 Q CB 3.008 31.786 28.738 0.067 0.000 1.290 261 Q HN 0.569 nan 8.270 nan 0.000 0.449 262 I N 3.824 124.489 120.570 0.159 0.000 2.307 262 I HA 0.225 4.417 4.170 0.037 0.000 0.289 262 I C -0.524 175.557 176.117 -0.059 0.000 1.021 262 I CA -0.449 60.928 61.300 0.128 0.000 1.224 262 I CB 0.632 38.752 38.000 0.200 0.000 1.376 262 I HN 0.365 nan 8.210 nan 0.000 0.470 263 L N 7.123 128.331 121.223 -0.025 0.000 2.260 263 L HA 0.299 4.661 4.340 0.037 0.000 0.289 263 L C -0.563 176.337 176.870 0.050 0.000 1.057 263 L CA -0.814 53.977 54.840 -0.081 0.000 0.811 263 L CB 0.013 42.066 42.059 -0.010 0.000 1.184 263 L HN 0.393 nan 8.230 nan 0.000 0.429 264 Y N 2.302 122.697 120.300 0.158 0.000 2.721 264 Y HA 0.196 4.768 4.550 0.036 0.000 0.329 264 Y C 1.476 177.512 175.900 0.227 0.000 1.211 264 Y CA 0.566 58.793 58.100 0.212 0.000 1.512 264 Y CB -0.028 38.526 38.460 0.156 0.000 1.249 264 Y HN 0.861 nan 8.280 nan 0.000 0.549 265 G N 2.020 111.149 108.800 0.547 0.000 2.176 265 G HA2 -0.332 3.650 3.960 0.037 0.000 0.253 265 G HA3 -0.332 3.650 3.960 0.037 0.000 0.253 265 G C 0.816 175.758 174.900 0.071 0.000 0.979 265 G CA 0.610 45.907 45.100 0.328 0.000 0.641 265 G HN 0.634 nan 8.290 nan 0.000 0.530 266 E N -1.372 118.863 120.200 0.058 0.000 2.564 266 E HA 0.474 4.846 4.350 0.037 0.000 0.203 266 E C 1.342 177.914 176.600 -0.047 0.000 0.867 266 E CA 1.279 57.674 56.400 -0.008 0.000 1.250 266 E CB 0.710 30.427 29.700 0.028 0.000 1.215 266 E HN 1.628 nan 8.360 nan 0.000 0.566 267 G N 0.631 109.435 108.800 0.006 0.000 2.306 267 G HA2 -0.099 3.883 3.960 0.037 0.000 0.262 267 G HA3 -0.099 3.883 3.960 0.037 0.000 0.262 267 G C -0.899 174.019 174.900 0.029 0.000 1.263 267 G CA -0.466 44.635 45.100 0.001 0.000 1.088 267 G HN 0.136 nan 8.290 nan 0.000 0.489 268 I N 1.549 122.111 120.570 -0.013 0.000 2.598 268 I HA 0.066 4.258 4.170 0.037 0.000 0.284 268 I C 0.641 176.744 176.117 -0.024 0.000 1.140 268 I CA -0.223 61.044 61.300 -0.055 0.000 1.420 268 I CB 0.709 38.552 38.000 -0.263 0.000 1.387 268 I HN 0.435 nan 8.210 nan 0.000 0.553 269 N N 6.493 125.209 118.700 0.026 0.000 2.671 269 N HA -0.040 4.722 4.740 0.037 0.000 0.274 269 N C 0.563 176.079 175.510 0.010 0.000 1.188 269 N CA 0.260 53.335 53.050 0.041 0.000 1.065 269 N CB -0.145 38.377 38.487 0.059 0.000 1.415 269 N HN 0.515 nan 8.380 nan 0.000 0.511 270 F N 2.798 122.628 119.950 -0.200 0.000 2.113 270 F HA -0.163 4.386 4.527 0.036 0.000 0.297 270 F C 0.958 176.619 175.800 -0.231 0.000 1.103 270 F CA 1.447 59.269 58.000 -0.297 0.000 1.248 270 F CB -0.055 38.657 39.000 -0.479 0.000 0.999 270 F HN 0.392 nan 8.300 nan 0.000 0.475 271 Y N 0.525 120.946 120.300 0.203 0.000 2.293 271 Y HA -0.005 4.567 4.550 0.037 0.000 0.291 271 Y C 2.651 178.538 175.900 -0.021 0.000 1.137 271 Y CA 0.843 59.002 58.100 0.099 0.000 1.202 271 Y CB -1.428 37.090 38.460 0.097 0.000 0.990 271 Y HN 0.130 nan 8.280 nan 0.000 0.537 272 G N 0.079 108.945 108.800 0.110 0.000 2.514 272 G HA2 -0.293 3.689 3.960 0.037 0.000 0.217 272 G HA3 -0.293 3.689 3.960 0.037 0.000 0.217 272 G C 1.525 176.410 174.900 -0.024 0.000 1.198 272 G CA 1.259 46.376 45.100 0.029 0.000 0.780 272 G HN 0.421 nan 8.290 nan 0.000 0.565 273 E N -0.259 119.889 120.200 -0.088 0.000 2.070 273 E HA -0.165 4.207 4.350 0.037 0.000 0.197 273 E C 2.417 178.925 176.600 -0.153 0.000 1.004 273 E CA 1.013 57.326 56.400 -0.144 0.000 0.805 273 E CB -0.249 29.279 29.700 -0.286 0.000 0.744 273 E HN 0.315 nan 8.360 nan 0.000 0.451 274 L N 0.732 121.838 121.223 -0.195 0.000 2.046 274 L HA -0.167 4.195 4.340 0.037 0.000 0.208 274 L C 2.223 179.083 176.870 -0.017 0.000 1.077 274 L CA 1.361 56.132 54.840 -0.116 0.000 0.747 274 L CB -0.377 41.672 42.059 -0.016 0.000 0.896 274 L HN -0.035 nan 8.230 nan 0.000 0.432 275 V N -0.188 119.728 119.914 0.004 0.000 2.255 275 V HA -0.318 3.824 4.120 0.037 0.000 0.247 275 V C 2.328 178.447 176.094 0.041 0.000 1.051 275 V CA 2.084 64.388 62.300 0.006 0.000 1.018 275 V CB -0.766 31.010 31.823 -0.077 0.000 0.641 275 V HN 0.431 nan 8.190 nan 0.000 0.445 276 D N -0.144 120.270 120.400 0.023 0.000 2.097 276 D HA -0.124 4.538 4.640 0.037 0.000 0.195 276 D C 2.158 178.481 176.300 0.037 0.000 0.989 276 D CA 1.000 55.027 54.000 0.045 0.000 0.827 276 D CB -0.314 40.500 40.800 0.025 0.000 0.966 276 D HN 0.163 nan 8.370 nan 0.000 0.456 277 L N 0.623 121.848 121.223 0.004 0.000 2.042 277 L HA -0.089 4.273 4.340 0.037 0.000 0.210 277 L C 2.467 179.353 176.870 0.026 0.000 1.076 277 L CA 1.717 56.557 54.840 0.000 0.000 0.749 277 L CB -1.551 40.484 42.059 -0.039 0.000 0.893 277 L HN 0.099 nan 8.230 nan 0.000 0.432 278 G N -0.912 107.912 108.800 0.038 0.000 2.402 278 G HA2 -0.158 3.824 3.960 0.037 0.000 0.216 278 G HA3 -0.158 3.824 3.960 0.037 0.000 0.216 278 G C 1.724 176.680 174.900 0.093 0.000 1.162 278 G CA 0.865 46.006 45.100 0.067 0.000 0.777 278 G HN 0.265 nan 8.290 nan 0.000 0.539 279 V N 0.636 120.615 119.914 0.108 0.000 2.427 279 V HA -0.108 4.034 4.120 0.037 0.000 0.248 279 V C 2.662 178.798 176.094 0.070 0.000 1.051 279 V CA 1.998 64.365 62.300 0.112 0.000 1.048 279 V CB -0.321 31.595 31.823 0.155 0.000 0.666 279 V HN 0.338 nan 8.190 nan 0.000 0.456 280 K N -0.142 120.293 120.400 0.058 0.000 2.097 280 K HA -0.156 4.186 4.320 0.037 0.000 0.205 280 K C 1.812 178.434 176.600 0.037 0.000 1.050 280 K CA 1.145 57.456 56.287 0.040 0.000 0.938 280 K CB 0.036 32.555 32.500 0.031 0.000 0.718 280 K HN 0.362 nan 8.250 nan 0.000 0.442 281 E N 0.617 120.844 120.200 0.044 0.000 2.489 281 E HA -0.018 4.354 4.350 0.037 0.000 0.193 281 E C -0.099 176.532 176.600 0.050 0.000 1.057 281 E CA 0.157 56.583 56.400 0.043 0.000 0.866 281 E CB 0.481 30.207 29.700 0.045 0.000 0.916 281 E HN 0.149 nan 8.360 nan 0.000 0.500 282 K N -0.392 120.041 120.400 0.055 0.000 3.281 282 K HA -0.192 4.150 4.320 0.037 0.000 0.295 282 K C 0.999 177.647 176.600 0.079 0.000 1.233 282 K CA 0.441 56.761 56.287 0.055 0.000 0.866 282 K CB -2.106 30.416 32.500 0.036 0.000 1.265 282 K HN 0.256 nan 8.250 nan 0.000 0.482 283 L N -0.350 120.941 121.223 0.112 0.000 2.307 283 L HA 0.179 4.540 4.340 0.037 0.000 0.211 283 L C 1.174 178.204 176.870 0.266 0.000 1.099 283 L CA 0.645 55.593 54.840 0.180 0.000 0.816 283 L CB 0.091 42.263 42.059 0.188 0.000 0.952 283 L HN 0.105 nan 8.230 nan 0.000 0.455 284 I N -0.340 120.355 120.570 0.207 0.000 2.404 284 I HA 0.204 4.396 4.170 0.037 0.000 0.293 284 I C -0.252 175.952 176.117 0.144 0.000 0.992 284 I CA -0.607 60.831 61.300 0.231 0.000 1.149 284 I CB 2.154 40.292 38.000 0.230 0.000 1.315 284 I HN -0.126 nan 8.210 nan 0.000 0.446 285 E N 5.503 125.770 120.200 0.112 0.000 2.259 285 E HA 0.232 4.604 4.350 0.037 0.000 0.281 285 E C -0.722 175.861 176.600 -0.028 0.000 1.027 285 E CA -0.294 56.126 56.400 0.034 0.000 0.838 285 E CB 0.985 30.693 29.700 0.013 0.000 1.066 285 E HN 0.277 nan 8.360 nan 0.000 0.401 286 K N 2.705 123.041 120.400 -0.107 0.000 2.464 286 K HA 0.496 4.838 4.320 0.037 0.000 0.252 286 K C -1.374 175.125 176.600 -0.168 0.000 1.000 286 K CA -0.603 55.514 56.287 -0.284 0.000 0.951 286 K CB 0.948 33.212 32.500 -0.394 0.000 1.183 286 K HN 0.515 nan 8.250 nan 0.000 0.445 287 A N 3.738 126.494 122.820 -0.105 0.000 3.016 287 A HA 0.504 4.846 4.320 0.037 0.000 0.303 287 A C 0.923 178.513 177.584 0.011 0.000 1.507 287 A CA 0.364 52.384 52.037 -0.028 0.000 1.196 287 A CB -0.454 18.546 19.000 0.000 0.000 1.169 287 A HN 1.056 nan 8.150 nan 0.000 0.544 288 G N 1.474 110.249 108.800 -0.042 0.000 2.889 288 G HA2 -0.147 3.835 3.960 0.037 0.000 0.308 288 G HA3 -0.147 3.835 3.960 0.037 0.000 0.308 288 G C 1.343 176.203 174.900 -0.067 0.000 1.248 288 G CA 0.831 45.918 45.100 -0.023 0.000 0.982 288 G HN 1.898 nan 8.290 nan 0.000 0.571 289 A N -0.808 122.006 122.820 -0.010 0.000 2.348 289 A HA 0.542 4.883 4.320 0.037 0.000 0.224 289 A C 0.470 177.962 177.584 -0.153 0.000 1.227 289 A CA 0.470 52.459 52.037 -0.081 0.000 0.885 289 A CB 0.068 19.011 19.000 -0.095 0.000 0.933 289 A HN 0.544 nan 8.150 nan 0.000 0.506 290 W N -0.694 120.541 121.300 -0.109 0.000 2.390 290 W HA 0.575 5.257 4.660 0.037 0.000 0.312 290 W C -0.860 175.551 176.519 -0.180 0.000 1.123 290 W CA -0.078 57.232 57.345 -0.058 0.000 1.202 290 W CB 0.574 30.002 29.460 -0.052 0.000 1.251 290 W HN 0.187 nan 8.180 nan 0.000 0.511 291 Y N 2.357 122.762 120.300 0.175 0.000 2.328 291 Y HA 0.463 5.035 4.550 0.037 0.000 0.337 291 Y C 0.301 176.238 175.900 0.061 0.000 0.966 291 Y CA -0.581 57.567 58.100 0.080 0.000 1.136 291 Y CB 1.516 39.979 38.460 0.006 0.000 1.170 291 Y HN 0.139 nan 8.280 nan 0.000 0.470 292 S N 2.982 118.773 115.700 0.152 0.000 2.500 292 S HA 0.411 4.903 4.470 0.037 0.000 0.301 292 S C -1.844 172.823 174.600 0.111 0.000 1.092 292 S CA -0.759 57.483 58.200 0.070 0.000 1.030 292 S CB 1.130 64.342 63.200 0.020 0.000 1.031 292 S HN 0.497 nan 8.310 nan 0.000 0.483 293 Y N 2.849 123.092 120.300 -0.095 0.000 2.326 293 Y HA 0.373 4.945 4.550 0.037 0.000 0.331 293 Y C 0.188 176.071 175.900 -0.027 0.000 0.962 293 Y CA -0.987 57.086 58.100 -0.046 0.000 1.167 293 Y CB 0.528 38.962 38.460 -0.044 0.000 1.148 293 Y HN 0.805 nan 8.280 nan 0.000 0.463 294 K N 4.960 125.039 120.400 -0.536 0.000 3.148 294 K HA -0.266 4.076 4.320 0.037 0.000 0.267 294 K C 0.962 177.438 176.600 -0.208 0.000 0.996 294 K CA 0.996 57.017 56.287 -0.443 0.000 0.737 294 K CB -1.618 30.504 32.500 -0.630 0.000 1.308 294 K HN 1.326 nan 8.250 nan 0.000 0.470 295 G N 0.156 108.875 108.800 -0.136 0.000 2.320 295 G HA2 -0.378 3.604 3.960 0.037 0.000 0.242 295 G HA3 -0.378 3.604 3.960 0.037 0.000 0.242 295 G C -0.041 174.813 174.900 -0.077 0.000 1.033 295 G CA 0.516 45.561 45.100 -0.092 0.000 0.620 295 G HN 0.516 nan 8.290 nan 0.000 0.517 296 E N 1.749 121.905 120.200 -0.073 0.000 2.259 296 E HA 0.358 4.730 4.350 0.037 0.000 0.281 296 E C 0.184 176.725 176.600 -0.098 0.000 1.037 296 E CA -0.490 55.872 56.400 -0.063 0.000 0.854 296 E CB 0.255 29.941 29.700 -0.022 0.000 1.051 296 E HN 0.328 nan 8.360 nan 0.000 0.409 297 K N 5.080 125.433 120.400 -0.078 0.000 2.379 297 K HA 0.113 4.455 4.320 0.037 0.000 0.284 297 K C 0.925 177.440 176.600 -0.143 0.000 1.044 297 K CA 0.077 56.351 56.287 -0.021 0.000 0.974 297 K CB 0.642 33.168 32.500 0.043 0.000 0.962 297 K HN 0.572 nan 8.250 nan 0.000 0.474 298 I N -1.676 118.741 120.570 -0.254 0.000 4.187 298 I HA 0.291 4.483 4.170 0.037 0.000 0.326 298 I C 0.613 176.530 176.117 -0.334 0.000 1.302 298 I CA -0.305 60.544 61.300 -0.751 0.000 1.196 298 I CB 1.010 38.240 38.000 -1.284 0.000 1.095 298 I HN 0.540 nan 8.210 nan 0.000 0.411 299 G N 0.759 109.528 108.800 -0.052 0.000 2.506 299 G HA2 0.378 4.360 3.960 0.037 0.000 0.292 299 G HA3 0.378 4.360 3.960 0.037 0.000 0.292 299 G C -2.102 172.695 174.900 -0.171 0.000 1.425 299 G CA -0.573 44.485 45.100 -0.069 0.000 0.788 299 G HN 0.115 nan 8.290 nan 0.000 0.490 300 Q N 0.106 119.682 119.800 -0.373 0.000 2.363 300 Q HA 0.529 4.891 4.340 0.037 0.000 0.265 300 Q C 0.120 175.969 176.000 -0.252 0.000 1.032 300 Q CA 0.229 55.657 55.803 -0.626 0.000 0.746 300 Q CB 1.116 29.253 28.738 -1.000 0.000 1.237 300 Q HN 2.186 nan 8.270 nan 0.000 0.475 301 G N 2.866 111.665 108.800 -0.002 0.000 2.764 301 G HA2 -0.262 3.720 3.960 0.037 0.000 0.686 301 G HA3 -0.262 3.720 3.960 0.037 0.000 0.686 301 G C 0.192 175.037 174.900 -0.092 0.000 1.258 301 G CA 0.016 45.165 45.100 0.081 0.000 0.846 301 G HN 0.759 nan 8.290 nan 0.000 0.596 302 K N 1.170 121.497 120.400 -0.122 0.000 2.144 302 K HA -0.202 4.140 4.320 0.037 0.000 0.209 302 K C 2.900 179.364 176.600 -0.227 0.000 1.047 302 K CA 2.757 58.842 56.287 -0.337 0.000 0.927 302 K CB -0.352 32.073 32.500 -0.125 0.000 0.716 302 K HN 1.257 nan 8.250 nan 0.000 0.454 303 A N 1.280 124.025 122.820 -0.125 0.000 1.869 303 A HA -0.286 4.056 4.320 0.037 0.000 0.218 303 A C 1.763 179.296 177.584 -0.085 0.000 1.203 303 A CA 2.320 54.308 52.037 -0.082 0.000 0.638 303 A CB -0.962 18.003 19.000 -0.059 0.000 0.831 303 A HN 0.626 nan 8.150 nan 0.000 0.450 304 N N -0.262 118.375 118.700 -0.104 0.000 2.171 304 N HA 0.082 4.844 4.740 0.037 0.000 0.184 304 N C 1.969 177.449 175.510 -0.050 0.000 1.021 304 N CA 0.932 53.942 53.050 -0.068 0.000 0.854 304 N CB -0.276 38.162 38.487 -0.083 0.000 0.994 304 N HN 0.497 nan 8.380 nan 0.000 0.426 305 A N 0.832 123.550 122.820 -0.170 0.000 1.917 305 A HA -0.196 4.146 4.320 0.037 0.000 0.219 305 A C 2.264 179.819 177.584 -0.049 0.000 1.182 305 A CA 1.977 53.908 52.037 -0.177 0.000 0.633 305 A CB -1.189 17.462 19.000 -0.580 0.000 0.819 305 A HN 0.237 nan 8.150 nan 0.000 0.448 306 T N 0.373 114.872 114.554 -0.091 0.000 2.652 306 T HA -0.072 4.300 4.350 0.037 0.000 0.267 306 T C 2.220 176.897 174.700 -0.037 0.000 1.039 306 T CA 1.834 63.922 62.100 -0.020 0.000 1.153 306 T CB -0.563 68.305 68.868 -0.001 0.000 0.863 306 T HN 0.641 nan 8.240 nan 0.000 0.428 307 A N 0.028 122.835 122.820 -0.021 0.000 1.978 307 A HA -0.111 4.231 4.320 0.037 0.000 0.220 307 A C 2.034 179.594 177.584 -0.039 0.000 1.170 307 A CA 1.469 53.485 52.037 -0.036 0.000 0.636 307 A CB -1.031 17.965 19.000 -0.006 0.000 0.810 307 A HN 0.722 nan 8.150 nan 0.000 0.448 308 W N 0.262 121.476 121.300 -0.143 0.000 2.407 308 W HA -0.040 4.642 4.660 0.036 0.000 0.305 308 W C 1.732 178.142 176.519 -0.183 0.000 1.196 308 W CA 1.549 58.820 57.345 -0.123 0.000 1.311 308 W CB -0.232 29.185 29.460 -0.071 0.000 1.135 308 W HN 0.227 nan 8.180 nan 0.000 0.514 309 L N 0.746 121.948 121.223 -0.033 0.000 2.191 309 L HA -0.223 4.139 4.340 0.037 0.000 0.212 309 L C 2.477 178.905 176.870 -0.737 0.000 1.103 309 L CA 1.417 56.073 54.840 -0.306 0.000 0.769 309 L CB -0.713 41.269 42.059 -0.129 0.000 0.908 309 L HN -0.040 nan 8.230 nan 0.000 0.438 310 K N -0.028 119.902 120.400 -0.783 0.000 2.026 310 K HA -0.190 4.152 4.320 0.037 0.000 0.208 310 K C 1.524 177.837 176.600 -0.479 0.000 1.048 310 K CA 1.747 57.565 56.287 -0.782 0.000 0.929 310 K CB 0.033 32.288 32.500 -0.408 0.000 0.713 310 K HN 0.220 nan 8.250 nan 0.000 0.439 311 D N 0.039 120.172 120.400 -0.444 0.000 2.277 311 D HA -0.049 4.613 4.640 0.037 0.000 0.208 311 D C -0.271 175.743 176.300 -0.477 0.000 0.962 311 D CA 0.847 54.609 54.000 -0.397 0.000 0.865 311 D CB 0.018 40.597 40.800 -0.369 0.000 0.939 311 D HN 0.128 nan 8.370 nan 0.000 0.510 312 N N 0.288 118.593 118.700 -0.658 0.000 3.012 312 N HA 0.194 4.956 4.740 0.037 0.000 0.270 312 N C -2.125 173.159 175.510 -0.376 0.000 1.469 312 N CA -1.146 51.548 53.050 -0.593 0.000 0.928 312 N CB 1.684 39.567 38.487 -1.007 0.000 1.219 312 N HN -0.070 nan 8.380 nan 0.000 0.492 313 P HA -0.121 nan 4.420 nan 0.000 0.220 313 P C 0.968 178.223 177.300 -0.076 0.000 1.148 313 P CA 1.058 64.081 63.100 -0.129 0.000 0.803 313 P CB 0.501 32.150 31.700 -0.085 0.000 0.782 314 E N -0.554 119.591 120.200 -0.091 0.000 2.047 314 E HA -0.102 4.270 4.350 0.037 0.000 0.191 314 E C 1.835 178.422 176.600 -0.021 0.000 0.987 314 E CA 1.584 57.957 56.400 -0.044 0.000 0.799 314 E CB -1.500 28.176 29.700 -0.040 0.000 0.752 314 E HN 0.295 nan 8.360 nan 0.000 0.449 315 T N 1.468 115.992 114.554 -0.050 0.000 2.904 315 T HA 0.013 4.385 4.350 0.037 0.000 0.267 315 T C 2.028 176.705 174.700 -0.037 0.000 1.059 315 T CA 1.109 63.207 62.100 -0.005 0.000 1.137 315 T CB -0.141 68.744 68.868 0.029 0.000 0.879 315 T HN 0.249 nan 8.240 nan 0.000 0.467 316 A N 2.308 125.101 122.820 -0.045 0.000 1.877 316 A HA -0.107 4.235 4.320 0.037 0.000 0.216 316 A C 2.335 179.971 177.584 0.086 0.000 1.186 316 A CA 1.119 53.179 52.037 0.040 0.000 0.620 316 A CB -0.323 18.741 19.000 0.108 0.000 0.822 316 A HN 0.203 nan 8.150 nan 0.000 0.443 317 K N -0.180 120.260 120.400 0.066 0.000 2.063 317 K HA -0.203 4.139 4.320 0.037 0.000 0.208 317 K C 1.931 178.568 176.600 0.061 0.000 1.048 317 K CA 1.643 57.969 56.287 0.065 0.000 0.928 317 K CB -0.432 32.089 32.500 0.035 0.000 0.713 317 K HN 0.789 nan 8.250 nan 0.000 0.442 318 E N 0.683 120.915 120.200 0.053 0.000 2.077 318 E HA -0.154 4.218 4.350 0.037 0.000 0.193 318 E C 2.063 178.707 176.600 0.072 0.000 0.989 318 E CA 0.936 57.378 56.400 0.071 0.000 0.800 318 E CB -0.002 29.757 29.700 0.100 0.000 0.746 318 E HN 0.251 nan 8.360 nan 0.000 0.452 319 I N 0.808 121.397 120.570 0.033 0.000 2.233 319 I HA -0.199 3.993 4.170 0.037 0.000 0.243 319 I C 2.692 178.840 176.117 0.052 0.000 1.093 319 I CA 1.080 62.394 61.300 0.023 0.000 1.380 319 I CB -0.378 37.576 38.000 -0.076 0.000 1.067 319 I HN 0.213 nan 8.210 nan 0.000 0.413 320 E N 1.835 122.078 120.200 0.071 0.000 2.070 320 E HA -0.315 4.057 4.350 0.037 0.000 0.197 320 E C 2.259 178.900 176.600 0.067 0.000 1.004 320 E CA 1.570 58.020 56.400 0.084 0.000 0.805 320 E CB -0.031 29.762 29.700 0.155 0.000 0.744 320 E HN 0.279 nan 8.360 nan 0.000 0.451 321 K N 0.607 121.046 120.400 0.066 0.000 2.044 321 K HA -0.226 4.116 4.320 0.037 0.000 0.210 321 K C 2.186 178.817 176.600 0.051 0.000 1.049 321 K CA 1.793 58.113 56.287 0.055 0.000 0.927 321 K CB -0.041 32.490 32.500 0.052 0.000 0.713 321 K HN 0.012 nan 8.250 nan 0.000 0.443 322 K N 0.039 120.475 120.400 0.059 0.000 2.097 322 K HA -0.091 4.251 4.320 0.037 0.000 0.206 322 K C 1.998 178.628 176.600 0.049 0.000 1.049 322 K CA 1.100 57.423 56.287 0.060 0.000 0.933 322 K CB 0.049 32.597 32.500 0.080 0.000 0.717 322 K HN -0.024 nan 8.250 nan 0.000 0.442 323 V N 1.172 121.112 119.914 0.045 0.000 2.295 323 V HA -0.251 3.891 4.120 0.037 0.000 0.246 323 V C 2.149 178.257 176.094 0.024 0.000 1.049 323 V CA 1.683 64.001 62.300 0.030 0.000 1.024 323 V CB -0.426 31.406 31.823 0.015 0.000 0.648 323 V HN 0.279 nan 8.190 nan 0.000 0.447 324 R N -0.110 120.406 120.500 0.027 0.000 2.081 324 R HA -0.185 4.177 4.340 0.037 0.000 0.235 324 R C 2.315 178.629 176.300 0.025 0.000 1.131 324 R CA 1.801 57.916 56.100 0.025 0.000 0.960 324 R CB -0.333 29.987 30.300 0.032 0.000 0.856 324 R HN 0.624 nan 8.270 nan 0.000 0.436 325 E N 0.618 120.836 120.200 0.029 0.000 2.077 325 E HA -0.171 4.201 4.350 0.037 0.000 0.193 325 E C 2.020 178.636 176.600 0.025 0.000 0.989 325 E CA 0.955 57.371 56.400 0.027 0.000 0.800 325 E CB -0.067 29.652 29.700 0.031 0.000 0.746 325 E HN 0.294 nan 8.360 nan 0.000 0.452 326 L N 0.144 121.383 121.223 0.027 0.000 2.217 326 L HA -0.099 4.263 4.340 0.037 0.000 0.211 326 L C 1.911 178.794 176.870 0.021 0.000 1.107 326 L CA 0.781 55.637 54.840 0.026 0.000 0.783 326 L CB 0.140 42.216 42.059 0.030 0.000 0.919 326 L HN 0.160 nan 8.230 nan 0.000 0.442 327 L N -1.489 119.746 121.223 0.019 0.000 3.039 327 L HA 0.205 4.567 4.340 0.037 0.000 0.269 327 L C 0.215 177.093 176.870 0.014 0.000 1.169 327 L CA -0.262 54.587 54.840 0.015 0.000 0.986 327 L CB 0.774 42.840 42.059 0.012 0.000 1.377 327 L HN 0.030 nan 8.230 nan 0.000 0.575 328 L N 0.975 122.207 121.223 0.015 0.000 2.369 328 L HA 0.077 4.439 4.340 0.037 0.000 0.279 328 L C 1.659 178.537 176.870 0.015 0.000 1.108 328 L CA -0.019 54.830 54.840 0.014 0.000 0.852 328 L CB 1.542 43.609 42.059 0.015 0.000 1.169 328 L HN 0.188 nan 8.230 nan 0.000 0.452 329 S N 2.344 118.052 115.700 0.014 0.000 2.423 329 S HA -0.079 4.413 4.470 0.037 0.000 0.231 329 S C 0.835 175.443 174.600 0.013 0.000 1.014 329 S CA 0.633 58.842 58.200 0.015 0.000 0.965 329 S CB -0.002 63.208 63.200 0.016 0.000 0.785 329 S HN 0.732 nan 8.310 nan 0.000 0.495 330 N N 2.721 121.428 118.700 0.012 0.000 2.841 330 N HA 0.332 5.094 4.740 0.037 0.000 0.257 330 N C -3.220 172.297 175.510 0.011 0.000 1.396 330 N CA -0.855 52.202 53.050 0.011 0.000 0.823 330 N CB 1.922 40.415 38.487 0.009 0.000 1.162 330 N HN 0.378 nan 8.380 nan 0.000 0.503 331 P HA 0.340 nan 4.420 nan 0.000 0.297 331 P C -0.035 177.272 177.300 0.012 0.000 1.342 331 P CA -0.237 62.871 63.100 0.013 0.000 0.801 331 P CB 1.394 33.103 31.700 0.015 0.000 0.920 332 N N 0.834 119.541 118.700 0.011 0.000 2.129 332 N HA 0.091 4.853 4.740 0.037 0.000 0.222 332 N C -0.157 175.359 175.510 0.010 0.000 1.303 332 N CA 0.057 53.113 53.050 0.010 0.000 0.897 332 N CB 0.833 39.325 38.487 0.009 0.000 1.093 332 N HN 0.295 nan 8.380 nan 0.000 0.501 1002 I N 0.988 121.558 120.570 -0.001 0.000 2.729 1002 I HA 0.058 4.250 4.170 0.037 0.000 0.256 1002 I C 1.775 177.891 176.117 -0.001 0.000 1.115 1002 I CA 1.174 62.473 61.300 -0.001 0.000 1.446 1002 I CB -0.073 37.927 38.000 -0.001 0.000 1.176 1002 I HN 0.372 nan 8.210 nan 0.000 0.446 1003 D N 1.080 121.478 120.400 -0.002 0.000 2.355 1003 D HA -0.120 4.542 4.640 0.037 0.000 0.218 1003 D C 1.422 177.721 176.300 -0.002 0.000 1.004 1003 D CA 0.628 54.627 54.000 -0.002 0.000 0.880 1003 D CB -0.270 40.528 40.800 -0.004 0.000 0.911 1003 D HN 0.423 nan 8.370 nan 0.000 0.528 1004 E N 0.138 120.337 120.200 -0.001 0.000 2.216 1004 E HA -0.029 4.343 4.350 0.037 0.000 0.192 1004 E C 1.584 178.184 176.600 -0.000 0.000 0.988 1004 E CA 0.258 56.657 56.400 -0.001 0.000 0.834 1004 E CB -0.032 29.667 29.700 -0.001 0.000 0.772 1004 E HN 0.208 nan 8.360 nan 0.000 0.479 1005 N N 1.225 119.925 118.700 0.000 0.000 2.270 1005 N HA -0.086 4.676 4.740 0.037 0.000 0.181 1005 N C 1.459 176.970 175.510 0.001 0.000 1.016 1005 N CA 0.804 53.855 53.050 0.001 0.000 0.870 1005 N CB 0.081 38.569 38.487 0.001 0.000 0.979 1005 N HN 0.156 nan 8.380 nan 0.000 0.431 1006 K N 0.920 121.320 120.400 0.001 0.000 2.057 1006 K HA -0.063 4.279 4.320 0.037 0.000 0.207 1006 K C 1.883 178.484 176.600 0.001 0.000 1.049 1006 K CA 0.942 57.230 56.287 0.001 0.000 0.931 1006 K CB -0.004 32.495 32.500 -0.000 0.000 0.714 1006 K HN 0.262 nan 8.250 nan 0.000 0.440 1007 Q N 0.523 120.324 119.800 0.001 0.000 2.297 1007 Q HA -0.105 4.257 4.340 0.037 0.000 0.204 1007 Q C 1.964 177.965 176.000 0.002 0.000 0.962 1007 Q CA 0.791 56.595 55.803 0.001 0.000 0.879 1007 Q CB 0.121 28.859 28.738 0.000 0.000 0.947 1007 Q HN 0.258 nan 8.270 nan 0.000 0.462 1008 K N 0.880 121.282 120.400 0.002 0.000 1.985 1008 K HA -0.126 4.216 4.320 0.037 0.000 0.210 1008 K C 1.962 178.565 176.600 0.004 0.000 1.047 1008 K CA 1.297 57.586 56.287 0.003 0.000 0.932 1008 K CB -0.081 32.421 32.500 0.003 0.000 0.716 1008 K HN 0.114 nan 8.250 nan 0.000 0.439 1009 A N 1.090 123.913 122.820 0.005 0.000 2.066 1009 A HA -0.089 4.253 4.320 0.037 0.000 0.218 1009 A C 1.964 179.552 177.584 0.007 0.000 1.157 1009 A CA 0.911 52.951 52.037 0.006 0.000 0.670 1009 A CB -0.409 18.594 19.000 0.006 0.000 0.804 1009 A HN 0.404 nan 8.150 nan 0.000 0.453 1010 L N -0.108 121.119 121.223 0.006 0.000 1.973 1010 L HA -0.028 4.334 4.340 0.037 0.000 0.208 1010 L C 2.674 179.550 176.870 0.009 0.000 1.073 1010 L CA 2.356 57.200 54.840 0.007 0.000 0.746 1010 L CB -0.827 41.235 42.059 0.005 0.000 0.891 1010 L HN 0.284 nan 8.230 nan 0.000 0.433 1011 A N -0.289 122.536 122.820 0.008 0.000 1.948 1011 A HA -0.208 4.134 4.320 0.037 0.000 0.220 1011 A C 2.434 180.024 177.584 0.011 0.000 1.177 1011 A CA 2.139 54.181 52.037 0.009 0.000 0.636 1011 A CB -1.354 17.650 19.000 0.007 0.000 0.815 1011 A HN 0.682 nan 8.150 nan 0.000 0.449 1012 A N -0.341 122.484 122.820 0.010 0.000 1.933 1012 A HA 0.153 4.495 4.320 0.037 0.000 0.218 1012 A C 2.486 180.079 177.584 0.015 0.000 1.175 1012 A CA 2.103 54.147 52.037 0.010 0.000 0.628 1012 A CB -0.916 18.089 19.000 0.008 0.000 0.814 1012 A HN 1.072 nan 8.150 nan 0.000 0.444 1013 A N -0.744 122.087 122.820 0.017 0.000 1.897 1013 A HA 0.076 4.418 4.320 0.037 0.000 0.215 1013 A C 2.031 179.635 177.584 0.033 0.000 1.181 1013 A CA 1.497 53.549 52.037 0.025 0.000 0.620 1013 A CB -0.508 18.505 19.000 0.022 0.000 0.821 1013 A HN 0.391 nan 8.150 nan 0.000 0.443 1014 L N -0.076 121.163 121.223 0.028 0.000 2.083 1014 L HA -0.051 4.311 4.340 0.037 0.000 0.209 1014 L C 2.741 179.632 176.870 0.034 0.000 1.083 1014 L CA 1.724 56.584 54.840 0.033 0.000 0.752 1014 L CB -0.863 41.211 42.059 0.024 0.000 0.899 1014 L HN 0.412 nan 8.230 nan 0.000 0.433 1015 G N -1.227 107.588 108.800 0.024 0.000 2.421 1015 G HA2 -0.361 3.621 3.960 0.037 0.000 0.216 1015 G HA3 -0.361 3.621 3.960 0.037 0.000 0.216 1015 G C 1.473 176.384 174.900 0.018 0.000 1.171 1015 G CA 0.908 46.019 45.100 0.018 0.000 0.775 1015 G HN 0.409 nan 8.290 nan 0.000 0.543 1016 Q N 0.641 120.453 119.800 0.020 0.000 2.029 1016 Q HA -0.171 4.191 4.340 0.037 0.000 0.209 1016 Q C 2.361 178.380 176.000 0.032 0.000 0.999 1016 Q CA 2.051 57.864 55.803 0.017 0.000 0.857 1016 Q CB -0.534 28.219 28.738 0.025 0.000 0.926 1016 Q HN 0.541 nan 8.270 nan 0.000 0.415 1017 I N 0.263 120.880 120.570 0.078 0.000 2.163 1017 I HA -0.262 3.930 4.170 0.037 0.000 0.243 1017 I C 2.403 178.610 176.117 0.150 0.000 1.085 1017 I CA 1.816 63.215 61.300 0.165 0.000 1.347 1017 I CB -0.397 37.698 38.000 0.159 0.000 1.044 1017 I HN 0.362 nan 8.210 nan 0.000 0.408 1018 E N 0.459 120.712 120.200 0.088 0.000 2.152 1018 E HA -0.172 4.200 4.350 0.037 0.000 0.192 1018 E C 1.751 178.370 176.600 0.031 0.000 0.983 1018 E CA 0.614 57.057 56.400 0.072 0.000 0.818 1018 E CB -0.001 29.730 29.700 0.051 0.000 0.758 1018 E HN 0.314 nan 8.360 nan 0.000 0.467 1019 K N 0.588 120.989 120.400 0.001 0.000 2.522 1019 K HA -0.003 4.339 4.320 0.037 0.000 0.194 1019 K C 1.342 177.888 176.600 -0.091 0.000 1.026 1019 K CA 0.240 56.508 56.287 -0.031 0.000 1.119 1019 K CB 0.305 32.789 32.500 -0.027 0.000 0.856 1019 K HN 0.123 nan 8.250 nan 0.000 0.513 1020 Q N -1.550 118.166 119.800 -0.140 0.000 2.459 1020 Q HA 0.111 4.473 4.340 0.037 0.000 0.260 1020 Q C 0.071 175.728 176.000 -0.570 0.000 0.828 1020 Q CA 0.294 55.859 55.803 -0.396 0.000 0.987 1020 Q CB 0.730 29.147 28.738 -0.535 0.000 1.216 1020 Q HN 0.163 nan 8.270 nan 0.000 0.558 1021 F N 0.034 119.990 119.950 0.010 0.000 2.775 1021 F HA 0.439 4.988 4.527 0.037 0.000 0.313 1021 F C 0.494 176.304 175.800 0.016 0.000 1.121 1021 F CA 0.251 58.259 58.000 0.013 0.000 1.206 1021 F CB 1.744 40.752 39.000 0.014 0.000 1.052 1021 F HN 0.037 nan 8.300 nan 0.000 0.524 1022 G N 0.308 109.181 108.800 0.121 0.000 2.539 1022 G HA2 -0.126 3.856 3.960 0.037 0.000 0.686 1022 G HA3 -0.126 3.856 3.960 0.037 0.000 0.686 1022 G C 0.546 175.488 174.900 0.070 0.000 1.258 1022 G CA -0.905 44.247 45.100 0.087 0.000 0.846 1022 G HN -0.106 nan 8.290 nan 0.000 0.647 1023 K N 0.113 120.543 120.400 0.049 0.000 2.052 1023 K HA -0.161 4.181 4.320 0.037 0.000 0.215 1023 K C 1.802 178.427 176.600 0.042 0.000 1.053 1023 K CA 2.162 58.472 56.287 0.038 0.000 0.934 1023 K CB -0.344 32.175 32.500 0.032 0.000 0.717 1023 K HN 1.469 nan 8.250 nan 0.000 0.450 1024 G N 0.696 109.525 108.800 0.048 0.000 4.885 1024 G HA2 0.168 4.150 3.960 0.037 0.000 0.263 1024 G HA3 0.168 4.150 3.960 0.037 0.000 0.263 1024 G C 0.754 175.685 174.900 0.051 0.000 1.168 1024 G CA 0.144 45.271 45.100 0.045 0.000 0.906 1024 G HN 0.213 nan 8.290 nan 0.000 0.575 1025 S N -0.090 115.651 115.700 0.068 0.000 2.383 1025 S HA 0.113 4.605 4.470 0.037 0.000 0.227 1025 S C 0.937 175.561 174.600 0.040 0.000 1.026 1025 S CA 0.451 58.692 58.200 0.068 0.000 0.981 1025 S CB 0.275 63.546 63.200 0.117 0.000 0.818 1025 S HN 0.471 nan 8.310 nan 0.000 0.472 1026 I N 1.731 122.326 120.570 0.043 0.000 2.466 1026 I HA 0.610 4.802 4.170 0.037 0.000 0.289 1026 I C -0.981 175.152 176.117 0.027 0.000 1.026 1026 I CA -1.324 59.993 61.300 0.028 0.000 1.078 1026 I CB 1.730 39.746 38.000 0.027 0.000 1.249 1026 I HN 0.454 nan 8.210 nan 0.000 0.429 1027 M N 4.632 124.245 119.600 0.021 0.000 2.880 1027 M HA 0.576 5.078 4.480 0.037 0.000 0.269 1027 M C -1.148 175.159 176.300 0.012 0.000 1.248 1027 M CA -1.096 54.214 55.300 0.017 0.000 0.821 1027 M CB 1.408 34.018 32.600 0.016 0.000 1.650 1027 M HN 0.271 nan 8.290 nan 0.000 0.479 1028 R N 1.175 121.680 120.500 0.007 0.000 2.449 1028 R HA 0.252 4.613 4.340 0.037 0.000 0.296 1028 R C 0.983 177.280 176.300 -0.005 0.000 1.047 1028 R CA -0.108 55.992 56.100 0.001 0.000 1.018 1028 R CB 0.275 30.573 30.300 -0.002 0.000 0.962 1028 R HN 0.683 nan 8.270 nan 0.000 0.428 1029 L N 2.437 123.652 121.223 -0.013 0.000 2.081 1029 L HA -0.197 4.165 4.340 0.037 0.000 0.212 1029 L C 1.766 178.621 176.870 -0.024 0.000 1.080 1029 L CA 2.105 56.930 54.840 -0.026 0.000 0.754 1029 L CB -0.393 41.633 42.059 -0.055 0.000 0.893 1029 L HN 0.980 nan 8.230 nan 0.000 0.433 1030 G N -0.450 108.336 108.800 -0.022 0.000 2.471 1030 G HA2 -0.234 3.748 3.960 0.037 0.000 0.219 1030 G HA3 -0.234 3.748 3.960 0.037 0.000 0.219 1030 G C 1.232 176.125 174.900 -0.011 0.000 1.125 1030 G CA 0.765 45.853 45.100 -0.019 0.000 0.775 1030 G HN 0.712 nan 8.290 nan 0.000 0.548 1031 E N -0.465 119.730 120.200 -0.007 0.000 2.473 1031 E HA 0.069 4.441 4.350 0.037 0.000 0.204 1031 E C -0.145 176.456 176.600 0.002 0.000 0.994 1031 E CA -0.432 55.967 56.400 -0.002 0.000 0.945 1031 E CB 0.123 29.823 29.700 0.000 0.000 0.990 1031 E HN 0.126 nan 8.360 nan 0.000 0.493 1032 D N 1.882 122.282 120.400 0.001 0.000 2.342 1032 D HA 0.008 4.670 4.640 0.037 0.000 0.260 1032 D C 0.703 177.008 176.300 0.007 0.000 1.278 1032 D CA -0.013 53.991 54.000 0.006 0.000 0.910 1032 D CB 0.746 41.550 40.800 0.006 0.000 1.079 1032 D HN -0.014 nan 8.370 nan 0.000 0.496 1033 R N 1.789 122.296 120.500 0.011 0.000 2.090 1033 R HA -0.080 4.282 4.340 0.037 0.000 0.228 1033 R C 1.993 178.302 176.300 0.016 0.000 1.110 1033 R CA 0.729 56.836 56.100 0.011 0.000 0.973 1033 R CB -0.900 29.407 30.300 0.012 0.000 0.869 1033 R HN 0.491 nan 8.270 nan 0.000 0.440 1034 S N -0.220 115.493 115.700 0.022 0.000 2.595 1034 S HA -0.087 4.405 4.470 0.037 0.000 0.235 1034 S C 1.706 176.325 174.600 0.033 0.000 0.974 1034 S CA 0.732 58.950 58.200 0.030 0.000 0.942 1034 S CB -0.051 63.172 63.200 0.039 0.000 0.766 1034 S HN 0.086 nan 8.310 nan 0.000 0.536 1035 M N 1.752 121.365 119.600 0.023 0.000 2.492 1035 M HA 0.282 4.783 4.480 0.037 0.000 0.255 1035 M C -0.413 175.896 176.300 0.014 0.000 1.139 1035 M CA 0.162 55.472 55.300 0.018 0.000 1.096 1035 M CB 0.099 32.701 32.600 0.003 0.000 1.360 1035 M HN 0.089 nan 8.290 nan 0.000 0.480 1036 D N 0.355 120.763 120.400 0.013 0.000 2.368 1036 D HA 0.119 4.781 4.640 0.037 0.000 0.240 1036 D C -0.465 175.844 176.300 0.015 0.000 1.169 1036 D CA 0.172 54.179 54.000 0.011 0.000 0.906 1036 D CB 1.086 41.892 40.800 0.010 0.000 1.187 1036 D HN -0.107 nan 8.370 nan 0.000 0.435 1037 V N 1.494 121.416 119.914 0.012 0.000 2.394 1037 V HA 0.202 4.344 4.120 0.037 0.000 0.282 1037 V C 0.404 176.503 176.094 0.009 0.000 1.031 1037 V CA -0.465 61.842 62.300 0.012 0.000 0.881 1037 V CB 1.519 33.347 31.823 0.008 0.000 0.982 1037 V HN 0.422 nan 8.190 nan 0.000 0.451 1038 E N 2.902 123.108 120.200 0.009 0.000 2.227 1038 E HA 0.673 5.045 4.350 0.037 0.000 0.268 1038 E C -0.767 175.835 176.600 0.003 0.000 0.907 1038 E CA -0.416 55.988 56.400 0.006 0.000 0.786 1038 E CB 2.347 32.051 29.700 0.006 0.000 1.191 1038 E HN 0.835 nan 8.360 nan 0.000 0.411 1039 T N 0.522 115.076 114.554 0.000 0.000 2.916 1039 T HA 0.633 5.005 4.350 0.037 0.000 0.292 1039 T C -0.371 174.325 174.700 -0.006 0.000 1.064 1039 T CA -0.862 61.237 62.100 -0.003 0.000 1.011 1039 T CB 1.073 69.939 68.868 -0.003 0.000 1.152 1039 T HN 0.264 nan 8.240 nan 0.000 0.510 1040 I N 1.657 122.221 120.570 -0.009 0.000 2.545 1040 I HA 0.425 4.617 4.170 0.037 0.000 0.292 1040 I C 0.727 176.834 176.117 -0.016 0.000 1.040 1040 I CA -0.782 60.508 61.300 -0.016 0.000 1.068 1040 I CB 1.707 39.695 38.000 -0.019 0.000 1.251 1040 I HN 0.953 nan 8.210 nan 0.000 0.424 1041 S N 2.791 118.478 115.700 -0.023 0.000 2.558 1041 S HA 0.043 4.535 4.470 0.037 0.000 0.288 1041 S C 1.362 175.946 174.600 -0.027 0.000 1.318 1041 S CA 0.412 58.600 58.200 -0.019 0.000 1.056 1041 S CB 0.388 63.567 63.200 -0.036 0.000 0.853 1041 S HN 0.814 nan 8.310 nan 0.000 0.505 1042 T N 1.516 116.060 114.554 -0.018 0.000 3.100 1042 T HA 0.337 4.709 4.350 0.037 0.000 0.253 1042 T C 1.507 176.172 174.700 -0.058 0.000 1.118 1042 T CA 0.650 62.732 62.100 -0.031 0.000 1.058 1042 T CB -0.386 68.467 68.868 -0.025 0.000 0.953 1042 T HN 1.661 nan 8.240 nan 0.000 0.515 1043 G N 0.730 109.500 108.800 -0.050 0.000 2.199 1043 G HA2 -0.238 3.744 3.960 0.037 0.000 0.254 1043 G HA3 -0.238 3.744 3.960 0.037 0.000 0.254 1043 G C 0.186 175.085 174.900 -0.001 0.000 0.982 1043 G CA 0.221 45.276 45.100 -0.074 0.000 0.632 1043 G HN 1.105 nan 8.290 nan 0.000 0.529 1044 S N -0.265 115.385 115.700 -0.084 0.000 2.498 1044 S HA 0.635 5.127 4.470 0.037 0.000 0.317 1044 S C 1.148 175.679 174.600 -0.115 0.000 1.090 1044 S CA 0.025 58.083 58.200 -0.236 0.000 1.089 1044 S CB 1.499 64.343 63.200 -0.594 0.000 0.997 1044 S HN 0.926 nan 8.310 nan 0.000 0.470 1045 L N 5.760 126.806 121.223 -0.295 0.000 2.027 1045 L HA 0.021 4.383 4.340 0.037 0.000 0.206 1045 L C 2.581 179.356 176.870 -0.159 0.000 1.074 1045 L CA 2.733 57.385 54.840 -0.313 0.000 0.745 1045 L CB -0.991 40.607 42.059 -0.769 0.000 0.898 1045 L HN 0.898 nan 8.230 nan 0.000 0.433 1046 S N -1.169 114.449 115.700 -0.136 0.000 2.402 1046 S HA -0.199 4.293 4.470 0.037 0.000 0.229 1046 S C 2.106 176.719 174.600 0.021 0.000 1.021 1046 S CA 1.332 59.515 58.200 -0.029 0.000 0.974 1046 S CB -1.019 62.199 63.200 0.029 0.000 0.800 1046 S HN 0.495 nan 8.310 nan 0.000 0.484 1047 L N 1.386 122.630 121.223 0.034 0.000 2.093 1047 L HA -0.098 4.264 4.340 0.037 0.000 0.208 1047 L C 1.883 178.762 176.870 0.014 0.000 1.085 1047 L CA 1.693 56.565 54.840 0.053 0.000 0.755 1047 L CB -0.427 41.671 42.059 0.065 0.000 0.904 1047 L HN 0.199 nan 8.230 nan 0.000 0.435 1048 D N -0.061 120.337 120.400 -0.004 0.000 2.178 1048 D HA -0.162 4.500 4.640 0.037 0.000 0.201 1048 D C 2.176 178.476 176.300 -0.000 0.000 0.980 1048 D CA 1.310 55.311 54.000 0.001 0.000 0.842 1048 D CB 0.012 40.821 40.800 0.015 0.000 0.948 1048 D HN 0.392 nan 8.370 nan 0.000 0.472 1049 I N 0.960 121.528 120.570 -0.004 0.000 2.233 1049 I HA -0.181 4.011 4.170 0.037 0.000 0.243 1049 I C 2.460 178.579 176.117 0.004 0.000 1.093 1049 I CA 0.876 62.176 61.300 0.000 0.000 1.380 1049 I CB -0.199 37.799 38.000 -0.004 0.000 1.067 1049 I HN -0.104 nan 8.210 nan 0.000 0.413 1050 A N 0.745 123.570 122.820 0.008 0.000 1.978 1050 A HA -0.153 4.189 4.320 0.037 0.000 0.220 1050 A C 2.265 179.841 177.584 -0.014 0.000 1.170 1050 A CA 1.392 53.432 52.037 0.006 0.000 0.636 1050 A CB -0.880 18.131 19.000 0.018 0.000 0.810 1050 A HN 0.423 nan 8.150 nan 0.000 0.448 1051 L N -1.622 119.591 121.223 -0.017 0.000 2.376 1051 L HA 0.013 4.375 4.340 0.037 0.000 0.219 1051 L C 2.228 179.075 176.870 -0.038 0.000 1.133 1051 L CA 0.671 55.490 54.840 -0.035 0.000 0.816 1051 L CB -0.438 41.605 42.059 -0.026 0.000 0.933 1051 L HN 0.630 nan 8.230 nan 0.000 0.449 1052 G N -0.114 108.673 108.800 -0.020 0.000 2.779 1052 G HA2 -0.462 3.520 3.960 0.037 0.000 0.230 1052 G HA3 -0.462 3.520 3.960 0.037 0.000 0.230 1052 G C 1.174 176.070 174.900 -0.007 0.000 1.243 1052 G CA 0.660 45.752 45.100 -0.013 0.000 0.769 1052 G HN 0.459 nan 8.290 nan 0.000 0.516 1053 A N 0.130 122.941 122.820 -0.015 0.000 2.119 1053 A HA 0.513 4.855 4.320 0.037 0.000 0.216 1053 A C 2.763 180.347 177.584 -0.001 0.000 1.152 1053 A CA 2.229 54.261 52.037 -0.008 0.000 0.708 1053 A CB -0.526 18.464 19.000 -0.016 0.000 0.805 1053 A HN 2.668 nan 8.150 nan 0.000 0.460 1054 G N -3.276 105.524 108.800 -0.001 0.000 2.179 1054 G HA2 0.317 4.299 3.960 0.037 0.000 0.220 1054 G HA3 0.317 4.299 3.960 0.037 0.000 0.220 1054 G C 0.836 175.739 174.900 0.005 0.000 0.990 1054 G CA 0.317 45.421 45.100 0.006 0.000 0.646 1054 G HN 2.105 nan 8.290 nan 0.000 0.517 1055 G N -1.383 107.415 108.800 -0.003 0.000 2.317 1055 G HA2 0.532 4.514 3.960 0.037 0.000 0.293 1055 G HA3 0.532 4.514 3.960 0.037 0.000 0.293 1055 G C -0.897 173.997 174.900 -0.010 0.000 1.287 1055 G CA -0.492 44.605 45.100 -0.005 0.000 0.850 1055 G HN 0.848 nan 8.290 nan 0.000 0.515 1056 L N 1.999 123.217 121.223 -0.009 0.000 2.371 1056 L HA 0.420 4.782 4.340 0.037 0.000 0.272 1056 L C -1.765 175.101 176.870 -0.006 0.000 1.124 1056 L CA -1.663 53.172 54.840 -0.008 0.000 0.816 1056 L CB 1.472 43.528 42.059 -0.006 0.000 1.129 1056 L HN 0.302 nan 8.230 nan 0.000 0.448 1057 P HA 0.136 nan 4.420 nan 0.000 0.281 1057 P C -0.734 176.571 177.300 0.009 0.000 1.252 1057 P CA -0.464 62.638 63.100 0.003 0.000 0.778 1057 P CB 0.928 32.630 31.700 0.003 0.000 0.895 1058 M N 2.070 121.675 119.600 0.008 0.000 2.238 1058 M HA 0.204 4.706 4.480 0.037 0.000 0.347 1058 M C 1.579 177.891 176.300 0.020 0.000 1.173 1058 M CA 0.826 56.132 55.300 0.010 0.000 1.147 1058 M CB -0.527 32.077 32.600 0.007 0.000 1.547 1058 M HN 0.831 nan 8.290 nan 0.000 0.455 1059 G N 2.585 111.396 108.800 0.019 0.000 2.153 1059 G HA2 -0.211 3.770 3.960 0.037 0.000 0.252 1059 G HA3 -0.211 3.770 3.960 0.037 0.000 0.252 1059 G C 0.228 175.156 174.900 0.047 0.000 0.994 1059 G CA 0.038 45.156 45.100 0.030 0.000 0.698 1059 G HN 0.564 nan 8.290 nan 0.000 0.521 1060 R N -1.025 119.502 120.500 0.046 0.000 2.960 1060 R HA 0.779 5.141 4.340 0.037 0.000 0.249 1060 R C 0.027 176.372 176.300 0.075 0.000 1.192 1060 R CA -1.087 55.054 56.100 0.068 0.000 1.035 1060 R CB 0.838 31.174 30.300 0.059 0.000 1.234 1060 R HN 0.193 nan 8.270 nan 0.000 0.493 1061 I N 0.778 121.416 120.570 0.114 0.000 2.412 1061 I HA 0.369 4.561 4.170 0.037 0.000 0.296 1061 I C -0.418 175.781 176.117 0.137 0.000 0.987 1061 I CA -0.852 60.541 61.300 0.154 0.000 1.180 1061 I CB 1.942 40.080 38.000 0.230 0.000 1.340 1061 I HN -0.014 nan 8.210 nan 0.000 0.455 1062 V N 5.256 125.255 119.914 0.142 0.000 2.656 1062 V HA 0.393 4.535 4.120 0.037 0.000 0.307 1062 V C -0.471 175.726 176.094 0.172 0.000 1.051 1062 V CA -0.691 61.678 62.300 0.114 0.000 0.893 1062 V CB 2.028 33.885 31.823 0.056 0.000 0.999 1062 V HN 0.736 nan 8.190 nan 0.000 0.426 1063 E N 3.842 124.132 120.200 0.150 0.000 2.187 1063 E HA 0.667 5.038 4.350 0.037 0.000 0.268 1063 E C -1.563 175.120 176.600 0.139 0.000 0.896 1063 E CA -0.622 55.887 56.400 0.182 0.000 0.766 1063 E CB 1.689 31.498 29.700 0.182 0.000 1.142 1063 E HN 0.652 nan 8.360 nan 0.000 0.408 1064 I N 5.455 126.105 120.570 0.133 0.000 2.406 1064 I HA 0.345 4.537 4.170 0.037 0.000 0.290 1064 I C -0.903 175.295 176.117 0.135 0.000 0.999 1064 I CA -0.978 60.361 61.300 0.065 0.000 1.124 1064 I CB 0.841 38.870 38.000 0.048 0.000 1.289 1064 I HN 0.512 nan 8.210 nan 0.000 0.441 1065 Y N 3.983 124.315 120.300 0.054 0.000 2.605 1065 Y HA 1.006 5.578 4.550 0.037 0.000 0.343 1065 Y C -0.147 175.802 175.900 0.081 0.000 1.036 1065 Y CA -1.146 56.987 58.100 0.055 0.000 1.065 1065 Y CB 1.959 40.436 38.460 0.027 0.000 1.288 1065 Y HN 0.666 nan 8.280 nan 0.000 0.481 1066 G N 0.539 109.518 108.800 0.299 0.000 2.328 1066 G HA2 0.450 4.432 3.960 0.037 0.000 0.295 1066 G HA3 0.450 4.432 3.960 0.037 0.000 0.295 1066 G C -3.518 171.592 174.900 0.351 0.000 1.413 1066 G CA -1.375 43.867 45.100 0.236 0.000 0.817 1066 G HN 0.487 nan 8.290 nan 0.000 0.546 1067 P HA 0.243 nan 4.420 nan 0.000 0.272 1067 P C -0.207 177.104 177.300 0.018 0.000 1.248 1067 P CA -0.128 63.079 63.100 0.180 0.000 0.799 1067 P CB 0.264 32.003 31.700 0.065 0.000 0.997 1068 E N -0.827 119.078 120.200 -0.492 0.000 2.383 1068 E HA 0.264 4.636 4.350 0.037 0.000 0.264 1068 E C 0.070 176.574 176.600 -0.160 0.000 1.050 1068 E CA -0.445 55.645 56.400 -0.517 0.000 0.896 1068 E CB -0.411 28.765 29.700 -0.873 0.000 0.982 1068 E HN 0.245 nan 8.360 nan 0.000 0.424 1069 S N 0.351 116.012 115.700 -0.065 0.000 3.614 1069 S HA -0.222 4.270 4.470 0.037 0.000 0.360 1069 S C 0.945 175.585 174.600 0.065 0.000 1.023 1069 S CA 0.908 59.108 58.200 -0.000 0.000 1.114 1069 S CB -1.614 61.562 63.200 -0.041 0.000 0.907 1069 S HN 0.730 nan 8.310 nan 0.000 0.470 1070 S N -0.520 115.227 115.700 0.079 0.000 2.470 1070 S HA 0.461 4.953 4.470 0.037 0.000 0.222 1070 S C 1.545 176.213 174.600 0.113 0.000 1.024 1070 S CA 0.895 59.148 58.200 0.089 0.000 0.931 1070 S CB 0.697 63.944 63.200 0.079 0.000 0.791 1070 S HN 1.804 nan 8.310 nan 0.000 0.513 1071 G N 0.933 109.815 108.800 0.136 0.000 2.559 1071 G HA2 -0.110 3.872 3.960 0.037 0.000 0.202 1071 G HA3 -0.110 3.872 3.960 0.037 0.000 0.202 1071 G C 0.668 175.668 174.900 0.166 0.000 0.992 1071 G CA 0.077 45.280 45.100 0.172 0.000 0.764 1071 G HN 0.394 nan 8.290 nan 0.000 0.525 1072 K N 0.504 120.992 120.400 0.146 0.000 1.987 1072 K HA -0.104 4.238 4.320 0.037 0.000 0.216 1072 K C 2.582 179.273 176.600 0.152 0.000 1.051 1072 K CA 2.213 58.583 56.287 0.138 0.000 0.942 1072 K CB -0.599 31.984 32.500 0.139 0.000 0.722 1072 K HN 0.305 nan 8.250 nan 0.000 0.444 1073 T N 0.981 115.637 114.554 0.170 0.000 2.607 1073 T HA -0.194 4.178 4.350 0.037 0.000 0.267 1073 T C 2.105 176.927 174.700 0.203 0.000 1.049 1073 T CA 2.113 64.340 62.100 0.212 0.000 1.162 1073 T CB -0.844 68.148 68.868 0.207 0.000 0.863 1073 T HN 0.274 nan 8.240 nan 0.000 0.424 1074 T N 2.393 117.072 114.554 0.208 0.000 2.597 1074 T HA -0.122 4.250 4.350 0.037 0.000 0.267 1074 T C 1.933 176.717 174.700 0.140 0.000 1.053 1074 T CA 1.517 63.745 62.100 0.214 0.000 1.165 1074 T CB -0.722 68.311 68.868 0.276 0.000 0.863 1074 T HN 0.245 nan 8.240 nan 0.000 0.427 1075 L N 0.311 121.621 121.223 0.145 0.000 2.013 1075 L HA -0.198 4.164 4.340 0.037 0.000 0.212 1075 L C 2.678 179.592 176.870 0.073 0.000 1.073 1075 L CA 1.739 56.640 54.840 0.102 0.000 0.753 1075 L CB -0.811 41.329 42.059 0.135 0.000 0.890 1075 L HN 0.279 nan 8.230 nan 0.000 0.432 1076 T N 0.342 114.959 114.554 0.104 0.000 2.624 1076 T HA -0.264 4.108 4.350 0.037 0.000 0.268 1076 T C 1.835 176.597 174.700 0.103 0.000 1.041 1076 T CA 2.077 64.243 62.100 0.109 0.000 1.159 1076 T CB -0.371 68.597 68.868 0.166 0.000 0.863 1076 T HN 0.309 nan 8.240 nan 0.000 0.434 1077 L N 0.861 122.147 121.223 0.105 0.000 2.083 1077 L HA -0.137 4.225 4.340 0.037 0.000 0.209 1077 L C 2.990 179.850 176.870 -0.016 0.000 1.083 1077 L CA 1.088 55.948 54.840 0.033 0.000 0.752 1077 L CB -0.604 41.444 42.059 -0.019 0.000 0.899 1077 L HN 0.271 nan 8.230 nan 0.000 0.433 1078 Q N -0.274 119.514 119.800 -0.021 0.000 2.124 1078 Q HA -0.173 4.189 4.340 0.037 0.000 0.202 1078 Q C 2.427 178.391 176.000 -0.060 0.000 0.977 1078 Q CA 1.942 57.709 55.803 -0.060 0.000 0.850 1078 Q CB -0.533 28.163 28.738 -0.069 0.000 0.901 1078 Q HN 0.615 nan 8.270 nan 0.000 0.429 1079 V N -1.580 118.315 119.914 -0.031 0.000 2.591 1079 V HA -0.138 4.004 4.120 0.037 0.000 0.249 1079 V C 2.078 178.155 176.094 -0.028 0.000 1.053 1079 V CA 0.934 63.215 62.300 -0.032 0.000 1.068 1079 V CB -0.519 31.294 31.823 -0.015 0.000 0.689 1079 V HN 0.168 nan 8.190 nan 0.000 0.462 1080 I N 1.421 121.986 120.570 -0.009 0.000 2.142 1080 I HA -0.168 4.024 4.170 0.037 0.000 0.240 1080 I C 3.036 179.131 176.117 -0.036 0.000 1.078 1080 I CA 1.835 63.131 61.300 -0.007 0.000 1.343 1080 I CB -0.832 37.181 38.000 0.022 0.000 1.046 1080 I HN 0.409 nan 8.210 nan 0.000 0.405 1081 A N 0.895 123.682 122.820 -0.055 0.000 1.873 1081 A HA -0.275 4.067 4.320 0.037 0.000 0.218 1081 A C 2.566 180.099 177.584 -0.084 0.000 1.193 1081 A CA 2.366 54.357 52.037 -0.077 0.000 0.629 1081 A CB -1.134 17.808 19.000 -0.097 0.000 0.826 1081 A HN 0.457 nan 8.150 nan 0.000 0.447 1082 A N -0.307 122.457 122.820 -0.094 0.000 1.892 1082 A HA 0.059 4.401 4.320 0.037 0.000 0.218 1082 A C 2.540 180.077 177.584 -0.079 0.000 1.188 1082 A CA 2.626 54.599 52.037 -0.107 0.000 0.631 1082 A CB -1.156 17.778 19.000 -0.111 0.000 0.822 1082 A HN 1.239 nan 8.150 nan 0.000 0.447 1083 A N -1.186 121.599 122.820 -0.058 0.000 1.969 1083 A HA -0.181 4.161 4.320 0.037 0.000 0.218 1083 A C 2.106 179.666 177.584 -0.041 0.000 1.169 1083 A CA 1.603 53.614 52.037 -0.043 0.000 0.635 1083 A CB -0.481 18.500 19.000 -0.031 0.000 0.810 1083 A HN 0.675 nan 8.150 nan 0.000 0.445 1084 Q N -1.352 118.422 119.800 -0.044 0.000 2.172 1084 Q HA -0.091 4.271 4.340 0.037 0.000 0.200 1084 Q C 2.250 178.222 176.000 -0.047 0.000 0.964 1084 Q CA 1.099 56.878 55.803 -0.041 0.000 0.855 1084 Q CB -0.061 28.652 28.738 -0.042 0.000 0.918 1084 Q HN 0.544 nan 8.270 nan 0.000 0.444 1085 R N 1.142 121.606 120.500 -0.059 0.000 2.152 1085 R HA -0.120 4.242 4.340 0.037 0.000 0.232 1085 R C 0.994 177.261 176.300 -0.054 0.000 1.117 1085 R CA 1.208 57.270 56.100 -0.064 0.000 0.981 1085 R CB 0.208 30.456 30.300 -0.086 0.000 0.870 1085 R HN 0.278 nan 8.270 nan 0.000 0.451 1086 E N -1.532 118.638 120.200 -0.050 0.000 2.479 1086 E HA 0.185 4.557 4.350 0.037 0.000 0.193 1086 E C 0.427 177.009 176.600 -0.031 0.000 1.049 1086 E CA 0.391 56.767 56.400 -0.039 0.000 0.870 1086 E CB 0.752 30.430 29.700 -0.038 0.000 0.944 1086 E HN 0.409 nan 8.360 nan 0.000 0.492 1087 G N 2.159 110.940 108.800 -0.031 0.000 2.171 1087 G HA2 -0.294 3.688 3.960 0.037 0.000 0.238 1087 G HA3 -0.294 3.688 3.960 0.037 0.000 0.238 1087 G C -0.133 174.754 174.900 -0.021 0.000 1.039 1087 G CA -0.067 45.019 45.100 -0.025 0.000 0.759 1087 G HN 0.130 nan 8.290 nan 0.000 0.501 1088 K N 0.333 120.720 120.400 -0.022 0.000 2.098 1088 K HA 0.537 4.879 4.320 0.037 0.000 0.261 1088 K C 0.287 176.877 176.600 -0.016 0.000 0.987 1088 K CA -0.330 55.947 56.287 -0.018 0.000 0.916 1088 K CB 0.954 33.443 32.500 -0.019 0.000 1.039 1088 K HN 0.113 nan 8.250 nan 0.000 0.455 1089 T N 1.768 116.315 114.554 -0.013 0.000 2.817 1089 T HA 0.243 4.615 4.350 0.037 0.000 0.293 1089 T C -0.186 174.509 174.700 -0.009 0.000 0.964 1089 T CA -0.528 61.566 62.100 -0.010 0.000 1.085 1089 T CB 0.109 68.972 68.868 -0.008 0.000 0.921 1089 T HN 0.520 nan 8.240 nan 0.000 0.502 1090 C N 2.384 121.682 119.300 -0.004 0.000 2.562 1090 C HA 0.981 5.463 4.460 0.037 0.000 0.332 1090 C C 0.429 175.429 174.990 0.017 0.000 1.201 1090 C CA -0.937 58.084 59.018 0.005 0.000 1.803 1090 C CB 0.870 28.619 27.740 0.015 0.000 2.328 1090 C HN 1.047 nan 8.230 nan 0.000 0.500 1091 A N 1.042 123.875 122.820 0.021 0.000 2.475 1091 A HA 0.871 5.213 4.320 0.037 0.000 0.301 1091 A C -1.514 176.115 177.584 0.074 0.000 1.059 1091 A CA -0.253 51.804 52.037 0.034 0.000 0.710 1091 A CB 1.126 20.119 19.000 -0.012 0.000 1.288 1091 A HN 0.818 nan 8.150 nan 0.000 0.408 1092 F N 2.647 122.555 119.950 -0.069 0.000 2.529 1092 F HA 0.643 5.192 4.527 0.037 0.000 0.320 1092 F C -0.870 174.879 175.800 -0.086 0.000 1.118 1092 F CA -0.867 57.088 58.000 -0.076 0.000 0.915 1092 F CB 1.618 40.583 39.000 -0.057 0.000 1.161 1092 F HN 0.370 nan 8.300 nan 0.000 0.445 1093 I N 4.672 124.988 120.570 -0.423 0.000 2.412 1093 I HA 0.140 4.332 4.170 0.037 0.000 0.279 1093 I C -0.304 175.644 176.117 -0.283 0.000 1.063 1093 I CA -0.439 60.704 61.300 -0.263 0.000 1.193 1093 I CB 0.532 38.376 38.000 -0.261 0.000 1.370 1093 I HN 0.516 nan 8.210 nan 0.000 0.479 1094 D N 4.858 125.247 120.400 -0.018 0.000 2.688 1094 D HA 0.315 4.977 4.640 0.037 0.000 0.228 1094 D C 1.400 177.631 176.300 -0.115 0.000 1.116 1094 D CA 0.045 54.088 54.000 0.073 0.000 1.023 1094 D CB 0.717 41.646 40.800 0.214 0.000 1.100 1094 D HN 0.589 nan 8.370 nan 0.000 0.487 1095 A N 1.762 124.534 122.820 -0.080 0.000 2.015 1095 A HA -0.144 4.198 4.320 0.037 0.000 0.219 1095 A C 1.953 179.650 177.584 0.189 0.000 1.163 1095 A CA 0.849 52.897 52.037 0.017 0.000 0.646 1095 A CB -0.265 18.750 19.000 0.025 0.000 0.806 1095 A HN 0.503 nan 8.150 nan 0.000 0.448 1096 E N -0.991 119.272 120.200 0.106 0.000 2.418 1096 E HA -0.116 4.256 4.350 0.037 0.000 0.197 1096 E C -0.500 176.254 176.600 0.257 0.000 1.026 1096 E CA 0.087 56.561 56.400 0.124 0.000 0.862 1096 E CB -0.203 29.506 29.700 0.015 0.000 0.799 1096 E HN 0.692 nan 8.360 nan 0.000 0.518 1097 H N -2.057 117.070 119.070 0.095 0.000 2.677 1097 H HA -0.220 4.358 4.556 0.037 0.000 0.321 1097 H C 0.149 175.529 175.328 0.086 0.000 1.171 1097 H CA 0.506 56.611 56.048 0.094 0.000 1.139 1097 H CB -1.204 28.614 29.762 0.094 0.000 1.515 1097 H HN 0.291 nan 8.280 nan 0.000 0.423 1098 A N 0.446 123.353 122.820 0.145 0.000 2.664 1098 A HA 0.170 4.512 4.320 0.037 0.000 0.222 1098 A C 0.593 178.214 177.584 0.063 0.000 1.320 1098 A CA -0.239 51.860 52.037 0.103 0.000 1.029 1098 A CB 0.674 19.730 19.000 0.093 0.000 1.318 1098 A HN 0.177 nan 8.150 nan 0.000 0.589 1099 L N 1.614 122.873 121.223 0.059 0.000 2.513 1099 L HA 0.383 4.745 4.340 0.037 0.000 0.272 1099 L C -0.514 176.338 176.870 -0.031 0.000 1.187 1099 L CA 0.274 55.103 54.840 -0.018 0.000 0.895 1099 L CB 0.324 42.295 42.059 -0.146 0.000 1.147 1099 L HN 0.208 nan 8.230 nan 0.000 0.483 1100 D N 7.430 127.823 120.400 -0.012 0.000 2.359 1100 D HA 0.305 4.967 4.640 0.037 0.000 0.230 1100 D C -1.752 174.554 176.300 0.010 0.000 1.118 1100 D CA -2.291 51.716 54.000 0.011 0.000 0.844 1100 D CB 1.493 42.311 40.800 0.031 0.000 1.059 1100 D HN 0.384 nan 8.370 nan 0.000 0.493 1101 P HA -0.174 nan 4.420 nan 0.000 0.215 1101 P C 1.608 178.900 177.300 -0.014 0.000 1.157 1101 P CA 0.875 63.950 63.100 -0.040 0.000 0.868 1101 P CB 0.441 32.121 31.700 -0.034 0.000 0.788 1102 I N -1.574 119.007 120.570 0.019 0.000 2.226 1102 I HA -0.248 3.944 4.170 0.037 0.000 0.245 1102 I C 2.773 178.923 176.117 0.055 0.000 1.100 1102 I CA 1.468 62.785 61.300 0.030 0.000 1.374 1102 I CB -1.335 36.690 38.000 0.041 0.000 1.057 1102 I HN -0.142 nan 8.210 nan 0.000 0.413 1103 Y N 1.369 121.649 120.300 -0.034 0.000 2.242 1103 Y HA -0.213 4.359 4.550 0.036 0.000 0.291 1103 Y C 2.481 178.358 175.900 -0.040 0.000 1.137 1103 Y CA 1.187 59.271 58.100 -0.026 0.000 1.181 1103 Y CB -0.453 37.995 38.460 -0.021 0.000 0.989 1103 Y HN 0.121 nan 8.280 nan 0.000 0.527 1104 A N 0.638 123.432 122.820 -0.044 0.000 1.908 1104 A HA -0.226 4.116 4.320 0.037 0.000 0.218 1104 A C 2.428 179.911 177.584 -0.168 0.000 1.181 1104 A CA 1.845 53.794 52.037 -0.147 0.000 0.627 1104 A CB -0.777 18.135 19.000 -0.146 0.000 0.818 1104 A HN 0.495 nan 8.150 nan 0.000 0.445 1105 R N -0.042 120.387 120.500 -0.118 0.000 2.092 1105 R HA -0.095 4.267 4.340 0.037 0.000 0.231 1105 R C 1.934 178.160 176.300 -0.122 0.000 1.119 1105 R CA 1.602 57.642 56.100 -0.101 0.000 0.970 1105 R CB -0.257 30.005 30.300 -0.063 0.000 0.864 1105 R HN 0.531 nan 8.270 nan 0.000 0.440 1106 K N 0.342 120.652 120.400 -0.149 0.000 2.209 1106 K HA -0.096 4.245 4.320 0.037 0.000 0.204 1106 K C 1.952 178.417 176.600 -0.226 0.000 1.048 1106 K CA 1.021 57.210 56.287 -0.164 0.000 0.940 1106 K CB -0.035 32.370 32.500 -0.159 0.000 0.729 1106 K HN 0.259 nan 8.250 nan 0.000 0.451 1107 L N -0.506 120.526 121.223 -0.319 0.000 2.478 1107 L HA 0.028 4.390 4.340 0.037 0.000 0.223 1107 L C 1.039 177.805 176.870 -0.174 0.000 1.140 1107 L CA 0.569 55.242 54.840 -0.279 0.000 0.842 1107 L CB -0.070 41.789 42.059 -0.332 0.000 0.953 1107 L HN 0.448 nan 8.230 nan 0.000 0.452 1108 G N 0.210 108.922 108.800 -0.147 0.000 2.145 1108 G HA2 -0.193 3.789 3.960 0.037 0.000 0.176 1108 G HA3 -0.193 3.789 3.960 0.037 0.000 0.176 1108 G C -0.057 174.782 174.900 -0.102 0.000 1.013 1108 G CA -0.233 44.800 45.100 -0.112 0.000 0.689 1108 G HN 0.042 nan 8.290 nan 0.000 0.506 1109 V N 0.663 120.513 119.914 -0.106 0.000 2.607 1109 V HA 0.454 4.596 4.120 0.037 0.000 0.289 1109 V C 0.557 176.605 176.094 -0.076 0.000 1.053 1109 V CA -0.426 61.819 62.300 -0.091 0.000 0.996 1109 V CB 1.804 33.565 31.823 -0.105 0.000 0.995 1109 V HN 0.345 nan 8.190 nan 0.000 0.476 1110 D N 3.725 124.088 120.400 -0.062 0.000 2.402 1110 D HA 0.132 4.794 4.640 0.037 0.000 0.235 1110 D C 1.048 177.319 176.300 -0.049 0.000 1.226 1110 D CA -0.265 53.705 54.000 -0.051 0.000 0.918 1110 D CB 0.548 41.323 40.800 -0.042 0.000 1.043 1110 D HN 0.288 nan 8.370 nan 0.000 0.506 1111 I N 2.655 123.193 120.570 -0.052 0.000 2.226 1111 I HA -0.211 3.980 4.170 0.037 0.000 0.245 1111 I C 1.389 177.483 176.117 -0.037 0.000 1.100 1111 I CA 0.911 62.180 61.300 -0.052 0.000 1.374 1111 I CB -0.722 37.247 38.000 -0.051 0.000 1.057 1111 I HN 0.341 nan 8.210 nan 0.000 0.413 1112 D N 0.623 121.005 120.400 -0.030 0.000 2.263 1112 D HA -0.131 4.531 4.640 0.037 0.000 0.208 1112 D C 1.724 178.013 176.300 -0.018 0.000 0.971 1112 D CA 0.931 54.918 54.000 -0.022 0.000 0.867 1112 D CB -0.246 40.543 40.800 -0.019 0.000 0.929 1112 D HN 0.435 nan 8.370 nan 0.000 0.492 1113 N N -0.225 118.462 118.700 -0.021 0.000 2.197 1113 N HA 0.029 4.791 4.740 0.037 0.000 0.201 1113 N C 0.036 175.538 175.510 -0.013 0.000 1.148 1113 N CA -0.179 52.861 53.050 -0.016 0.000 0.883 1113 N CB 1.375 39.852 38.487 -0.017 0.000 1.012 1113 N HN 0.137 nan 8.380 nan 0.000 0.507 1114 L N 3.218 124.430 121.223 -0.018 0.000 2.385 1114 L HA 0.265 4.627 4.340 0.037 0.000 0.281 1114 L C -0.145 176.727 176.870 0.003 0.000 1.106 1114 L CA 0.057 54.891 54.840 -0.009 0.000 0.856 1114 L CB 0.123 42.165 42.059 -0.029 0.000 1.186 1114 L HN 0.009 nan 8.230 nan 0.000 0.453 1115 L N 5.394 126.626 121.223 0.016 0.000 2.456 1115 L HA 0.131 4.493 4.340 0.037 0.000 0.272 1115 L C 0.110 177.009 176.870 0.048 0.000 1.189 1115 L CA 0.147 55.001 54.840 0.022 0.000 0.846 1115 L CB 1.017 43.086 42.059 0.016 0.000 1.111 1115 L HN 0.738 nan 8.230 nan 0.000 0.475 1116 C N 2.797 122.123 119.300 0.042 0.000 2.891 1116 C HA 0.673 5.155 4.460 0.037 0.000 0.342 1116 C C -0.497 174.516 174.990 0.038 0.000 1.126 1116 C CA -0.426 58.635 59.018 0.070 0.000 1.322 1116 C CB 1.618 29.387 27.740 0.049 0.000 1.763 1116 C HN 0.824 nan 8.230 nan 0.000 0.491 1117 S N 3.692 119.412 115.700 0.033 0.000 2.575 1117 S HA 0.560 5.052 4.470 0.037 0.000 0.278 1117 S C -1.382 173.185 174.600 -0.055 0.000 1.139 1117 S CA -0.289 57.902 58.200 -0.014 0.000 0.954 1117 S CB 1.476 64.653 63.200 -0.038 0.000 1.054 1117 S HN 0.860 nan 8.310 nan 0.000 0.483 1118 Q N 4.772 124.517 119.800 -0.091 0.000 2.466 1118 Q HA 0.359 4.721 4.340 0.037 0.000 0.242 1118 Q C -2.293 173.646 176.000 -0.102 0.000 1.046 1118 Q CA -1.903 53.761 55.803 -0.233 0.000 0.841 1118 Q CB 1.324 29.850 28.738 -0.354 0.000 1.193 1118 Q HN 0.505 nan 8.270 nan 0.000 0.508 1119 P HA 0.113 nan 4.420 nan 0.000 0.276 1119 P C -0.376 176.976 177.300 0.087 0.000 1.252 1119 P CA -0.259 62.821 63.100 -0.032 0.000 0.802 1119 P CB 1.429 33.066 31.700 -0.106 0.000 1.035 1120 D N -0.944 119.491 120.400 0.058 0.000 2.269 1120 D HA -0.004 4.658 4.640 0.037 0.000 0.220 1120 D C 1.012 177.346 176.300 0.057 0.000 0.962 1120 D CA 1.433 55.486 54.000 0.088 0.000 0.884 1120 D CB -0.309 40.540 40.800 0.081 0.000 1.023 1120 D HN 0.507 nan 8.370 nan 0.000 0.484 1121 T N -2.692 111.874 114.554 0.020 0.000 2.948 1121 T HA 0.532 4.904 4.350 0.037 0.000 0.285 1121 T C 1.399 176.086 174.700 -0.021 0.000 1.019 1121 T CA -0.284 61.820 62.100 0.006 0.000 1.013 1121 T CB 1.905 70.781 68.868 0.013 0.000 1.117 1121 T HN -0.028 nan 8.240 nan 0.000 0.533 1122 G N 0.137 108.928 108.800 -0.016 0.000 2.402 1122 G HA2 -0.079 3.903 3.960 0.037 0.000 0.216 1122 G HA3 -0.079 3.903 3.960 0.037 0.000 0.216 1122 G C 1.167 176.042 174.900 -0.042 0.000 1.162 1122 G CA 0.563 45.650 45.100 -0.021 0.000 0.777 1122 G HN 0.797 nan 8.290 nan 0.000 0.539 1123 E N 0.069 120.249 120.200 -0.034 0.000 2.085 1123 E HA -0.151 4.221 4.350 0.037 0.000 0.194 1123 E C 2.394 178.942 176.600 -0.087 0.000 0.994 1123 E CA 1.312 57.698 56.400 -0.024 0.000 0.801 1123 E CB -0.227 29.484 29.700 0.019 0.000 0.743 1123 E HN 0.645 nan 8.360 nan 0.000 0.453 1124 Q N 0.305 120.000 119.800 -0.176 0.000 2.030 1124 Q HA -0.243 4.119 4.340 0.037 0.000 0.204 1124 Q C 2.175 177.867 176.000 -0.513 0.000 0.986 1124 Q CA 1.810 57.263 55.803 -0.583 0.000 0.843 1124 Q CB -0.258 28.165 28.738 -0.526 0.000 0.904 1124 Q HN 0.303 nan 8.270 nan 0.000 0.420 1125 A N 0.727 123.385 122.820 -0.269 0.000 1.892 1125 A HA -0.216 4.126 4.320 0.037 0.000 0.218 1125 A C 2.073 179.571 177.584 -0.144 0.000 1.188 1125 A CA 1.812 53.738 52.037 -0.186 0.000 0.631 1125 A CB -0.857 18.084 19.000 -0.098 0.000 0.822 1125 A HN 0.475 nan 8.150 nan 0.000 0.447 1126 L N -1.190 119.979 121.223 -0.090 0.000 2.072 1126 L HA -0.100 4.262 4.340 0.037 0.000 0.205 1126 L C 2.632 179.479 176.870 -0.038 0.000 1.079 1126 L CA 1.056 55.878 54.840 -0.030 0.000 0.752 1126 L CB -0.517 41.546 42.059 0.007 0.000 0.906 1126 L HN 0.276 nan 8.230 nan 0.000 0.436 1127 E N 0.517 120.684 120.200 -0.056 0.000 2.118 1127 E HA -0.210 4.162 4.350 0.037 0.000 0.195 1127 E C 2.285 178.888 176.600 0.005 0.000 0.992 1127 E CA 1.322 57.732 56.400 0.017 0.000 0.804 1127 E CB -0.179 29.605 29.700 0.141 0.000 0.741 1127 E HN 0.490 nan 8.360 nan 0.000 0.458 1128 I N 0.241 120.741 120.570 -0.116 0.000 2.127 1128 I HA -0.369 3.823 4.170 0.037 0.000 0.241 1128 I C 2.608 178.699 176.117 -0.043 0.000 1.075 1128 I CA 0.948 62.200 61.300 -0.080 0.000 1.334 1128 I CB -0.308 37.594 38.000 -0.163 0.000 1.040 1128 I HN 0.151 nan 8.210 nan 0.000 0.405 1129 C N 0.365 119.626 119.300 -0.065 0.000 2.393 1129 C HA -0.249 4.233 4.460 0.037 0.000 0.276 1129 C C 2.604 177.578 174.990 -0.027 0.000 1.215 1129 C CA 1.408 60.390 59.018 -0.060 0.000 1.743 1129 C CB -1.054 26.645 27.740 -0.069 0.000 2.044 1129 C HN 0.548 nan 8.230 nan 0.000 0.464 1130 D N 0.284 120.680 120.400 -0.007 0.000 2.149 1130 D HA -0.107 4.555 4.640 0.037 0.000 0.198 1130 D C 2.137 178.447 176.300 0.016 0.000 0.990 1130 D CA 1.640 55.645 54.000 0.008 0.000 0.839 1130 D CB -0.186 40.627 40.800 0.022 0.000 0.948 1130 D HN 0.463 nan 8.370 nan 0.000 0.460 1131 A N -0.123 122.714 122.820 0.029 0.000 1.873 1131 A HA -0.068 4.274 4.320 0.037 0.000 0.215 1131 A C 2.405 179.999 177.584 0.018 0.000 1.186 1131 A CA 0.949 53.008 52.037 0.037 0.000 0.616 1131 A CB -0.745 18.294 19.000 0.065 0.000 0.823 1131 A HN 0.325 nan 8.150 nan 0.000 0.442 1132 L N -0.827 120.398 121.223 0.005 0.000 2.141 1132 L HA -0.136 4.226 4.340 0.037 0.000 0.209 1132 L C 3.029 179.892 176.870 -0.011 0.000 1.094 1132 L CA 0.773 55.609 54.840 -0.006 0.000 0.763 1132 L CB -0.569 41.477 42.059 -0.021 0.000 0.908 1132 L HN 0.458 nan 8.230 nan 0.000 0.437 1133 A N 0.298 123.109 122.820 -0.014 0.000 1.832 1133 A HA -0.196 4.146 4.320 0.037 0.000 0.214 1133 A C 2.393 179.974 177.584 -0.005 0.000 1.200 1133 A CA 1.348 53.377 52.037 -0.014 0.000 0.610 1133 A CB -0.550 18.439 19.000 -0.018 0.000 0.842 1133 A HN 0.237 nan 8.150 nan 0.000 0.444 1134 R N 0.192 120.692 120.500 0.001 0.000 2.139 1134 R HA -0.157 4.205 4.340 0.037 0.000 0.243 1134 R C 2.598 178.904 176.300 0.009 0.000 1.145 1134 R CA 1.682 57.786 56.100 0.007 0.000 0.976 1134 R CB -0.402 29.906 30.300 0.013 0.000 0.866 1134 R HN 0.767 nan 8.270 nan 0.000 0.449 1135 S N -0.792 114.914 115.700 0.009 0.000 2.400 1135 S HA -0.100 4.392 4.470 0.037 0.000 0.232 1135 S C 1.657 176.261 174.600 0.007 0.000 1.025 1135 S CA 1.195 59.401 58.200 0.009 0.000 0.993 1135 S CB -0.335 62.870 63.200 0.009 0.000 0.808 1135 S HN 0.541 nan 8.310 nan 0.000 0.478 1136 G N 0.579 109.382 108.800 0.004 0.000 2.155 1136 G HA2 -0.202 3.780 3.960 0.037 0.000 0.257 1136 G HA3 -0.202 3.780 3.960 0.037 0.000 0.257 1136 G C 0.802 175.703 174.900 0.002 0.000 0.983 1136 G CA 0.511 45.614 45.100 0.004 0.000 0.676 1136 G HN 1.327 nan 8.290 nan 0.000 0.528 1137 A N -1.120 121.701 122.820 0.001 0.000 1.956 1137 A HA 0.640 4.982 4.320 0.037 0.000 0.212 1137 A C 1.260 178.842 177.584 -0.004 0.000 1.188 1137 A CA 1.409 53.446 52.037 -0.000 0.000 0.675 1137 A CB 0.362 19.363 19.000 0.002 0.000 0.845 1137 A HN 0.999 nan 8.150 nan 0.000 0.455 1138 V N 1.367 121.277 119.914 -0.007 0.000 2.567 1138 V HA 0.170 4.312 4.120 0.037 0.000 0.289 1138 V C 0.293 176.378 176.094 -0.014 0.000 1.049 1138 V CA -0.276 62.017 62.300 -0.012 0.000 0.969 1138 V CB 1.441 33.254 31.823 -0.017 0.000 0.995 1138 V HN 0.444 nan 8.190 nan 0.000 0.471 1139 D N 1.729 122.120 120.400 -0.015 0.000 2.323 1139 D HA 0.102 4.764 4.640 0.037 0.000 0.218 1139 D C 0.211 176.497 176.300 -0.022 0.000 0.973 1139 D CA 1.026 55.017 54.000 -0.015 0.000 0.890 1139 D CB 1.558 42.350 40.800 -0.013 0.000 1.011 1139 D HN 0.366 nan 8.370 nan 0.000 0.499 1140 V N 1.439 121.338 119.914 -0.026 0.000 2.623 1140 V HA 0.446 4.588 4.120 0.037 0.000 0.304 1140 V C -1.593 174.470 176.094 -0.051 0.000 1.054 1140 V CA -0.649 61.628 62.300 -0.037 0.000 0.882 1140 V CB 1.799 33.605 31.823 -0.028 0.000 1.002 1140 V HN -0.105 nan 8.190 nan 0.000 0.424 1141 I N 6.833 127.347 120.570 -0.093 0.000 2.465 1141 I HA 0.664 4.856 4.170 0.037 0.000 0.291 1141 I C -0.574 175.409 176.117 -0.224 0.000 1.014 1141 I CA -1.022 60.193 61.300 -0.141 0.000 1.093 1141 I CB 2.036 39.937 38.000 -0.165 0.000 1.267 1141 I HN 0.559 nan 8.210 nan 0.000 0.431 1142 V N 7.098 126.849 119.914 -0.271 0.000 2.588 1142 V HA 0.597 4.739 4.120 0.037 0.000 0.304 1142 V C -0.983 174.745 176.094 -0.611 0.000 1.042 1142 V CA -0.383 61.675 62.300 -0.403 0.000 0.877 1142 V CB 2.132 33.788 31.823 -0.279 0.000 0.996 1142 V HN 0.435 nan 8.190 nan 0.000 0.425 1143 V N 5.554 125.116 119.914 -0.586 0.000 2.347 1143 V HA 0.418 4.560 4.120 0.037 0.000 0.280 1143 V C -0.251 175.624 176.094 -0.365 0.000 1.021 1143 V CA -0.385 61.621 62.300 -0.490 0.000 0.847 1143 V CB 1.335 32.905 31.823 -0.422 0.000 0.990 1143 V HN 0.968 nan 8.190 nan 0.000 0.444 1144 D N 3.538 123.688 120.400 -0.417 0.000 2.365 1144 D HA 0.336 4.998 4.640 0.037 0.000 0.237 1144 D C 0.048 176.302 176.300 -0.077 0.000 1.190 1144 D CA 0.687 54.562 54.000 -0.208 0.000 0.867 1144 D CB 0.605 41.342 40.800 -0.105 0.000 1.050 1144 D HN 0.645 nan 8.370 nan 0.000 0.491 1145 S N 1.236 116.915 115.700 -0.034 0.000 3.392 1145 S HA -0.147 4.345 4.470 0.037 0.000 0.693 1145 S C 1.202 175.807 174.600 0.009 0.000 0.620 1145 S CA 0.349 58.530 58.200 -0.032 0.000 1.452 1145 S CB -1.011 62.127 63.200 -0.103 0.000 0.988 1145 S HN 0.539 nan 8.310 nan 0.000 0.932 1146 V N 2.348 122.288 119.914 0.044 0.000 2.626 1146 V HA -0.035 4.107 4.120 0.037 0.000 0.252 1146 V C 2.356 178.448 176.094 -0.004 0.000 1.067 1146 V CA 2.345 64.668 62.300 0.039 0.000 1.081 1146 V CB -1.158 30.653 31.823 -0.020 0.000 0.686 1146 V HN 1.463 nan 8.190 nan 0.000 0.468 1147 A N 0.912 123.710 122.820 -0.038 0.000 1.971 1147 A HA -0.119 4.223 4.320 0.037 0.000 0.222 1147 A C 2.350 179.979 177.584 0.075 0.000 1.182 1147 A CA 2.670 54.691 52.037 -0.027 0.000 0.649 1147 A CB -1.078 17.846 19.000 -0.127 0.000 0.818 1147 A HN 1.302 nan 8.150 nan 0.000 0.458 1148 A N -1.708 121.153 122.820 0.069 0.000 2.275 1148 A HA 0.459 4.801 4.320 0.037 0.000 0.212 1148 A C 0.539 178.189 177.584 0.110 0.000 1.201 1148 A CA -0.092 52.039 52.037 0.157 0.000 0.843 1148 A CB -0.180 18.901 19.000 0.135 0.000 0.873 1148 A HN 0.283 nan 8.150 nan 0.000 0.492 1149 L N 2.335 123.595 121.223 0.062 0.000 2.391 1149 L HA 0.147 4.509 4.340 0.037 0.000 0.249 1149 L C 0.168 177.051 176.870 0.022 0.000 1.308 1149 L CA 0.556 55.419 54.840 0.038 0.000 1.209 1149 L CB -0.990 41.084 42.059 0.026 0.000 1.401 1149 L HN 0.100 nan 8.230 nan 0.000 0.416 1150 T N 2.990 117.563 114.554 0.031 0.000 2.799 1150 T HA 0.200 4.572 4.350 0.037 0.000 0.296 1150 T C -2.161 172.524 174.700 -0.025 0.000 0.947 1150 T CA -1.015 61.088 62.100 0.005 0.000 1.141 1150 T CB 0.377 69.252 68.868 0.012 0.000 0.891 1150 T HN 0.167 nan 8.240 nan 0.000 0.533 1151 P HA 0.095 nan 4.420 nan 0.000 0.268 1151 P C 0.991 178.235 177.300 -0.093 0.000 1.208 1151 P CA -0.440 62.612 63.100 -0.079 0.000 0.777 1151 P CB 0.745 32.374 31.700 -0.118 0.000 0.875 1152 K N 2.284 122.645 120.400 -0.066 0.000 2.009 1152 K HA -0.224 4.118 4.320 0.037 0.000 0.210 1152 K C 1.824 178.376 176.600 -0.080 0.000 1.049 1152 K CA 1.972 58.232 56.287 -0.045 0.000 0.929 1152 K CB -0.712 31.780 32.500 -0.013 0.000 0.714 1152 K HN 0.468 nan 8.250 nan 0.000 0.440 1153 A N 0.942 123.685 122.820 -0.128 0.000 1.978 1153 A HA -0.225 4.117 4.320 0.037 0.000 0.220 1153 A C 1.940 179.347 177.584 -0.295 0.000 1.170 1153 A CA 1.911 53.852 52.037 -0.160 0.000 0.636 1153 A CB -0.491 18.418 19.000 -0.151 0.000 0.810 1153 A HN 0.596 nan 8.150 nan 0.000 0.448 1154 E N -0.167 119.755 120.200 -0.464 0.000 2.072 1154 E HA -0.123 4.249 4.350 0.037 0.000 0.191 1154 E C 1.764 178.322 176.600 -0.070 0.000 0.985 1154 E CA 1.222 57.374 56.400 -0.412 0.000 0.801 1154 E CB -0.210 29.298 29.700 -0.320 0.000 0.750 1154 E HN 0.675 nan 8.360 nan 0.000 0.452 1155 I N 0.911 121.445 120.570 -0.059 0.000 2.252 1155 I HA -0.198 3.994 4.170 0.037 0.000 0.245 1155 I C 2.222 178.345 176.117 0.010 0.000 1.102 1155 I CA 1.089 62.383 61.300 -0.010 0.000 1.385 1155 I CB -0.236 37.759 38.000 -0.008 0.000 1.064 1155 I HN 0.113 nan 8.210 nan 0.000 0.414 1156 E N 1.043 121.244 120.200 0.002 0.000 2.150 1156 E HA -0.042 4.330 4.350 0.037 0.000 0.193 1156 E C 1.433 178.060 176.600 0.045 0.000 0.985 1156 E CA 0.597 57.009 56.400 0.020 0.000 0.814 1156 E CB -0.149 29.558 29.700 0.013 0.000 0.752 1156 E HN 0.524 nan 8.360 nan 0.000 0.466 1157 G N 0.892 109.738 108.800 0.077 0.000 2.621 1157 G HA2 0.085 4.067 3.960 0.037 0.000 0.271 1157 G HA3 0.085 4.067 3.960 0.037 0.000 0.271 1157 G C -0.107 174.857 174.900 0.107 0.000 1.236 1157 G CA -0.504 44.675 45.100 0.131 0.000 0.958 1157 G HN -0.005 nan 8.290 nan 0.000 0.512 1158 E N -1.468 118.789 120.200 0.096 0.000 2.330 1158 E HA 0.306 4.678 4.350 0.037 0.000 0.256 1158 E C -0.251 176.398 176.600 0.082 0.000 1.146 1158 E CA -0.524 55.924 56.400 0.081 0.000 0.945 1158 E CB 1.509 31.252 29.700 0.072 0.000 1.182 1158 E HN 0.220 nan 8.360 nan 0.000 0.480 1159 I N 0.946 121.558 120.570 0.070 0.000 2.396 1159 I HA 0.174 4.366 4.170 0.037 0.000 0.289 1159 I C 1.072 177.212 176.117 0.037 0.000 1.056 1159 I CA 0.809 62.139 61.300 0.050 0.000 1.365 1159 I CB 0.654 38.675 38.000 0.035 0.000 1.407 1159 I HN 0.857 nan 8.210 nan 0.000 0.509 1160 G N 4.350 113.159 108.800 0.014 0.000 2.436 1160 G HA2 -0.216 3.766 3.960 0.037 0.000 0.204 1160 G HA3 -0.216 3.766 3.960 0.037 0.000 0.204 1160 G C 0.016 174.886 174.900 -0.050 0.000 1.026 1160 G CA -0.665 44.431 45.100 -0.008 0.000 0.658 1160 G HN 0.527 nan 8.290 nan 0.000 0.499 1161 D N 2.300 122.663 120.400 -0.062 0.000 2.520 1161 D HA 0.432 5.094 4.640 0.037 0.000 0.243 1161 D C 0.907 176.974 176.300 -0.388 0.000 1.160 1161 D CA 1.127 55.012 54.000 -0.192 0.000 0.877 1161 D CB 1.019 41.735 40.800 -0.140 0.000 1.150 1161 D HN 0.626 nan 8.370 nan 0.000 0.494 1162 S N 3.044 118.523 115.700 -0.368 0.000 2.475 1162 S HA 0.300 4.792 4.470 0.037 0.000 0.281 1162 S C -0.267 174.070 174.600 -0.439 0.000 1.198 1162 S CA -0.851 57.166 58.200 -0.305 0.000 1.063 1162 S CB 0.931 64.052 63.200 -0.132 0.000 0.972 1162 S HN 0.382 nan 8.310 nan 0.000 0.486 1163 H N 3.320 122.391 119.070 0.001 0.000 2.539 1163 H HA 0.273 4.851 4.556 0.037 0.000 0.247 1163 H C -0.416 174.912 175.328 -0.000 0.000 1.363 1163 H CA -0.448 55.600 56.048 0.000 0.000 1.371 1163 H CB 0.193 29.955 29.762 -0.000 0.000 1.438 1163 H HN 0.573 nan 8.280 nan 0.000 0.523 1164 M N 0.877 120.514 119.600 0.061 0.000 2.338 1164 M HA -0.015 4.487 4.480 0.037 0.000 0.360 1164 M C 1.298 177.627 176.300 0.048 0.000 1.547 1164 M CA 0.770 56.094 55.300 0.041 0.000 1.001 1164 M CB 0.373 32.987 32.600 0.023 0.000 2.008 1164 M HN 0.872 nan 8.290 nan 0.000 0.464 1165 G N 3.602 112.426 108.800 0.040 0.000 2.468 1165 G HA2 -0.280 3.702 3.960 0.037 0.000 0.311 1165 G HA3 -0.280 3.702 3.960 0.037 0.000 0.311 1165 G C 0.729 175.646 174.900 0.027 0.000 0.942 1165 G CA 0.737 45.854 45.100 0.029 0.000 0.893 1165 G HN 0.830 nan 8.290 nan 0.000 0.513 1166 L N -0.720 120.529 121.223 0.043 0.000 2.056 1166 L HA 0.172 4.534 4.340 0.037 0.000 0.207 1166 L C 3.076 179.946 176.870 -0.001 0.000 1.078 1166 L CA 2.108 56.964 54.840 0.026 0.000 0.749 1166 L CB -0.384 41.701 42.059 0.044 0.000 0.901 1166 L HN 0.377 nan 8.230 nan 0.000 0.433 1167 A N -0.201 122.619 122.820 -0.000 0.000 1.883 1167 A HA -0.233 4.109 4.320 0.037 0.000 0.217 1167 A C 2.410 179.979 177.584 -0.025 0.000 1.186 1167 A CA 1.908 53.935 52.037 -0.017 0.000 0.624 1167 A CB -1.037 17.957 19.000 -0.010 0.000 0.822 1167 A HN 0.545 nan 8.150 nan 0.000 0.444 1168 A N -0.643 122.168 122.820 -0.016 0.000 1.930 1168 A HA -0.127 4.215 4.320 0.037 0.000 0.217 1168 A C 2.232 179.804 177.584 -0.020 0.000 1.175 1168 A CA 1.716 53.741 52.037 -0.020 0.000 0.627 1168 A CB -0.440 18.557 19.000 -0.004 0.000 0.815 1168 A HN 0.554 nan 8.150 nan 0.000 0.443 1169 R N -0.889 119.604 120.500 -0.012 0.000 2.115 1169 R HA -0.041 4.321 4.340 0.037 0.000 0.230 1169 R C 2.173 178.460 176.300 -0.023 0.000 1.111 1169 R CA 1.504 57.597 56.100 -0.011 0.000 0.976 1169 R CB -0.292 30.006 30.300 -0.004 0.000 0.870 1169 R HN 0.622 nan 8.270 nan 0.000 0.445 1170 M N -0.349 119.234 119.600 -0.029 0.000 2.099 1170 M HA -0.170 4.332 4.480 0.037 0.000 0.262 1170 M C 1.733 178.000 176.300 -0.056 0.000 1.067 1170 M CA 1.473 56.752 55.300 -0.036 0.000 1.124 1170 M CB 0.046 32.625 32.600 -0.035 0.000 1.353 1170 M HN 0.210 nan 8.290 nan 0.000 0.410 1171 M N -0.425 119.130 119.600 -0.074 0.000 2.108 1171 M HA -0.191 4.311 4.480 0.037 0.000 0.261 1171 M C 2.363 178.582 176.300 -0.135 0.000 1.066 1171 M CA 1.554 56.780 55.300 -0.123 0.000 1.107 1171 M CB -1.333 31.184 32.600 -0.139 0.000 1.356 1171 M HN 0.347 nan 8.290 nan 0.000 0.406 1172 S N -0.256 115.392 115.700 -0.086 0.000 2.402 1172 S HA -0.172 4.320 4.470 0.037 0.000 0.229 1172 S C 1.845 176.391 174.600 -0.091 0.000 1.021 1172 S CA 1.208 59.365 58.200 -0.071 0.000 0.974 1172 S CB -0.109 63.081 63.200 -0.016 0.000 0.800 1172 S HN 0.510 nan 8.310 nan 0.000 0.484 1173 Q N 0.192 119.953 119.800 -0.065 0.000 2.083 1173 Q HA -0.017 4.345 4.340 0.037 0.000 0.198 1173 Q C 2.200 178.154 176.000 -0.077 0.000 0.969 1173 Q CA 1.180 56.955 55.803 -0.046 0.000 0.838 1173 Q CB -0.322 28.408 28.738 -0.014 0.000 0.900 1173 Q HN 0.577 nan 8.270 nan 0.000 0.436 1174 A N 0.927 123.690 122.820 -0.095 0.000 1.877 1174 A HA -0.214 4.128 4.320 0.037 0.000 0.216 1174 A C 2.043 179.527 177.584 -0.167 0.000 1.186 1174 A CA 1.606 53.588 52.037 -0.092 0.000 0.620 1174 A CB -0.521 18.436 19.000 -0.071 0.000 0.822 1174 A HN 0.388 nan 8.150 nan 0.000 0.443 1175 M N -0.402 119.007 119.600 -0.319 0.000 2.073 1175 M HA -0.185 4.317 4.480 0.037 0.000 0.258 1175 M C 2.168 178.121 176.300 -0.578 0.000 1.070 1175 M CA 1.758 56.672 55.300 -0.643 0.000 1.103 1175 M CB -1.458 30.402 32.600 -1.234 0.000 1.321 1175 M HN 0.425 nan 8.290 nan 0.000 0.405 1176 R N 0.013 120.286 120.500 -0.377 0.000 2.113 1176 R HA -0.183 4.179 4.340 0.037 0.000 0.244 1176 R C 2.292 178.566 176.300 -0.044 0.000 1.142 1176 R CA 1.652 57.701 56.100 -0.085 0.000 0.953 1176 R CB -0.352 29.946 30.300 -0.004 0.000 0.860 1176 R HN 0.454 nan 8.270 nan 0.000 0.438 1177 K N 0.300 120.664 120.400 -0.060 0.000 2.097 1177 K HA -0.064 4.278 4.320 0.037 0.000 0.205 1177 K C 2.145 178.720 176.600 -0.042 0.000 1.050 1177 K CA 0.998 57.267 56.287 -0.031 0.000 0.938 1177 K CB -0.008 32.484 32.500 -0.013 0.000 0.718 1177 K HN 0.180 nan 8.250 nan 0.000 0.442 1178 L N 0.256 121.444 121.223 -0.058 0.000 2.095 1178 L HA -0.055 4.306 4.340 0.037 0.000 0.204 1178 L C 2.593 179.434 176.870 -0.049 0.000 1.080 1178 L CA 0.662 55.479 54.840 -0.038 0.000 0.759 1178 L CB -0.612 41.444 42.059 -0.005 0.000 0.914 1178 L HN 0.138 nan 8.230 nan 0.000 0.439 1179 A N 0.913 123.709 122.820 -0.041 0.000 1.896 1179 A HA -0.254 4.088 4.320 0.037 0.000 0.220 1179 A C 2.377 179.803 177.584 -0.264 0.000 1.206 1179 A CA 2.320 54.345 52.037 -0.021 0.000 0.647 1179 A CB -1.508 17.588 19.000 0.160 0.000 0.828 1179 A HN 0.452 nan 8.150 nan 0.000 0.455 1180 G N -0.775 107.800 108.800 -0.375 0.000 2.421 1180 G HA2 -0.288 3.694 3.960 0.037 0.000 0.216 1180 G HA3 -0.288 3.694 3.960 0.037 0.000 0.216 1180 G C 1.433 176.169 174.900 -0.273 0.000 1.171 1180 G CA 1.127 45.876 45.100 -0.586 0.000 0.775 1180 G HN 0.726 nan 8.290 nan 0.000 0.543 1181 N N -0.263 118.357 118.700 -0.134 0.000 2.396 1181 N HA 0.065 4.827 4.740 0.037 0.000 0.180 1181 N C 2.094 177.576 175.510 -0.047 0.000 1.028 1181 N CA 0.148 53.161 53.050 -0.062 0.000 0.893 1181 N CB -0.043 38.424 38.487 -0.033 0.000 0.967 1181 N HN 0.248 nan 8.380 nan 0.000 0.440 1182 L N 0.271 121.460 121.223 -0.057 0.000 2.162 1182 L HA -0.030 4.332 4.340 0.037 0.000 0.205 1182 L C 2.313 179.178 176.870 -0.008 0.000 1.086 1182 L CA 0.724 55.549 54.840 -0.024 0.000 0.778 1182 L CB -0.053 42.002 42.059 -0.007 0.000 0.928 1182 L HN 0.016 nan 8.230 nan 0.000 0.446 1183 K N 0.571 120.961 120.400 -0.017 0.000 2.031 1183 K HA -0.152 4.190 4.320 0.037 0.000 0.205 1183 K C 2.039 178.671 176.600 0.053 0.000 1.049 1183 K CA 1.514 57.830 56.287 0.049 0.000 0.939 1183 K CB -0.162 32.428 32.500 0.149 0.000 0.717 1183 K HN 0.096 nan 8.250 nan 0.000 0.438 1184 Q N -0.410 119.413 119.800 0.037 0.000 2.437 1184 Q HA 0.031 4.393 4.340 0.037 0.000 0.210 1184 Q C 1.046 177.063 176.000 0.029 0.000 0.972 1184 Q CA 1.339 57.170 55.803 0.046 0.000 0.903 1184 Q CB 0.219 28.986 28.738 0.048 0.000 0.967 1184 Q HN 0.218 nan 8.270 nan 0.000 0.486 1185 S N -0.018 115.691 115.700 0.016 0.000 2.524 1185 S HA 0.042 4.534 4.470 0.037 0.000 0.215 1185 S C 0.211 174.818 174.600 0.011 0.000 0.986 1185 S CA -0.201 58.006 58.200 0.011 0.000 0.911 1185 S CB 0.315 63.516 63.200 0.002 0.000 0.805 1185 S HN 0.408 nan 8.310 nan 0.000 0.501 1186 N N 2.527 121.238 118.700 0.017 0.000 2.714 1186 N HA -0.138 4.624 4.740 0.037 0.000 0.253 1186 N C -1.365 174.149 175.510 0.006 0.000 1.024 1186 N CA 0.741 53.801 53.050 0.017 0.000 0.726 1186 N CB -1.448 37.049 38.487 0.017 0.000 0.908 1186 N HN 0.283 nan 8.380 nan 0.000 0.542 1187 T N 1.168 115.723 114.554 0.002 0.000 2.792 1187 T HA 0.460 4.832 4.350 0.037 0.000 0.280 1187 T C 0.192 174.885 174.700 -0.013 0.000 0.990 1187 T CA -0.720 61.374 62.100 -0.010 0.000 0.960 1187 T CB 1.738 70.596 68.868 -0.017 0.000 0.939 1187 T HN 0.281 nan 8.240 nan 0.000 0.439 1188 L N 4.278 125.489 121.223 -0.019 0.000 2.349 1188 L HA 0.608 4.969 4.340 0.037 0.000 0.275 1188 L C -0.951 175.885 176.870 -0.057 0.000 1.115 1188 L CA -0.288 54.538 54.840 -0.023 0.000 0.820 1188 L CB 0.407 42.454 42.059 -0.020 0.000 1.135 1188 L HN 0.640 nan 8.230 nan 0.000 0.445 1189 L N 6.598 127.783 121.223 -0.063 0.000 2.372 1189 L HA 0.549 4.911 4.340 0.037 0.000 0.274 1189 L C -1.128 175.646 176.870 -0.160 0.000 0.988 1189 L CA -0.461 54.284 54.840 -0.159 0.000 0.833 1189 L CB 1.395 43.354 42.059 -0.168 0.000 1.236 1189 L HN 0.654 nan 8.230 nan 0.000 0.410 1190 I N 4.348 124.777 120.570 -0.236 0.000 2.339 1190 I HA 0.308 4.500 4.170 0.037 0.000 0.290 1190 I C -0.879 175.065 176.117 -0.287 0.000 0.994 1190 I CA -0.313 60.897 61.300 -0.151 0.000 1.191 1190 I CB 1.379 39.332 38.000 -0.078 0.000 1.343 1190 I HN 0.376 nan 8.210 nan 0.000 0.458 1191 F N 6.475 126.402 119.950 -0.037 0.000 2.404 1191 F HA 0.473 5.022 4.527 0.037 0.000 0.354 1191 F C 0.417 176.204 175.800 -0.023 0.000 1.122 1191 F CA -0.454 57.517 58.000 -0.047 0.000 1.080 1191 F CB 0.978 39.959 39.000 -0.031 0.000 1.131 1191 F HN 0.216 nan 8.300 nan 0.000 0.471 1192 I N 3.448 124.084 120.570 0.111 0.000 2.395 1192 I HA 0.202 4.394 4.170 0.037 0.000 0.289 1192 I C -0.176 176.000 176.117 0.098 0.000 1.023 1192 I CA -0.065 61.292 61.300 0.095 0.000 1.350 1192 I CB 1.048 39.078 38.000 0.049 0.000 1.409 1192 I HN 0.653 nan 8.210 nan 0.000 0.507 1193 N N 4.157 122.920 118.700 0.105 0.000 2.262 1193 N HA 0.376 5.138 4.740 0.037 0.000 0.295 1193 N C -1.276 174.229 175.510 -0.008 0.000 1.161 1193 N CA -0.698 52.375 53.050 0.038 0.000 0.767 1193 N CB 1.771 40.287 38.487 0.048 0.000 1.499 1193 N HN 0.541 nan 8.380 nan 0.000 0.476 1194 Q N 0.942 120.614 119.800 -0.214 0.000 2.180 1194 Q HA 0.493 4.855 4.340 0.037 0.000 0.241 1194 Q C -0.619 175.178 176.000 -0.338 0.000 0.970 1194 Q CA -0.623 54.855 55.803 -0.541 0.000 0.919 1194 Q CB 2.022 30.010 28.738 -1.249 0.000 1.222 1194 Q HN 0.477 nan 8.270 nan 0.000 0.482 1195 I N 1.546 121.959 120.570 -0.262 0.000 2.359 1195 I HA 0.350 4.542 4.170 0.037 0.000 0.294 1195 I C -0.067 176.038 176.117 -0.020 0.000 0.987 1195 I CA -0.679 60.614 61.300 -0.012 0.000 1.225 1195 I CB 0.794 38.924 38.000 0.217 0.000 1.366 1195 I HN 0.320 nan 8.210 nan 0.000 0.466 1196 R N 4.695 125.172 120.500 -0.038 0.000 2.873 1196 R HA 0.624 4.986 4.340 0.037 0.000 0.264 1196 R C -0.875 175.430 176.300 0.008 0.000 1.026 1196 R CA -1.335 54.763 56.100 -0.003 0.000 1.002 1196 R CB 1.648 31.927 30.300 -0.035 0.000 1.174 1196 R HN 0.417 nan 8.270 nan 0.000 0.488 1197 M N 1.810 121.420 119.600 0.017 0.000 2.264 1197 M HA 0.259 4.761 4.480 0.037 0.000 0.352 1197 M C -0.201 176.090 176.300 -0.014 0.000 1.173 1197 M CA -0.192 55.110 55.300 0.004 0.000 1.075 1197 M CB 0.922 33.530 32.600 0.012 0.000 1.621 1197 M HN 0.269 nan 8.290 nan 0.000 0.457 1198 K N 4.998 125.380 120.400 -0.030 0.000 2.183 1198 K HA 0.559 4.901 4.320 0.037 0.000 0.274 1198 K C -0.833 175.738 176.600 -0.048 0.000 1.009 1198 K CA -0.587 55.678 56.287 -0.038 0.000 0.888 1198 K CB 1.317 33.789 32.500 -0.048 0.000 1.078 1198 K HN 0.863 nan 8.250 nan 0.000 0.459 1199 I N 0.229 120.777 120.570 -0.037 0.000 2.412 1199 I HA 0.469 4.661 4.170 0.037 0.000 0.296 1199 I C 0.310 176.401 176.117 -0.043 0.000 0.987 1199 I CA 0.267 61.544 61.300 -0.037 0.000 1.180 1199 I CB 1.308 39.296 38.000 -0.019 0.000 1.340 1199 I HN 1.003 nan 8.210 nan 0.000 0.455 1200 G N 4.723 113.491 108.800 -0.053 0.000 2.142 1200 G HA2 -0.168 3.814 3.960 0.037 0.000 0.225 1200 G HA3 -0.168 3.814 3.960 0.037 0.000 0.225 1200 G C -0.555 174.284 174.900 -0.101 0.000 1.015 1200 G CA 0.089 45.157 45.100 -0.052 0.000 0.716 1200 G HN 0.937 nan 8.290 nan 0.000 0.508 1201 V N 1.942 121.750 119.914 -0.177 0.000 2.483 1201 V HA 0.736 4.878 4.120 0.037 0.000 0.297 1201 V C 1.048 176.925 176.094 -0.361 0.000 1.027 1201 V CA -0.260 61.807 62.300 -0.389 0.000 0.855 1201 V CB 1.365 32.893 31.823 -0.491 0.000 0.995 1201 V HN 0.316 nan 8.190 nan 0.000 0.424 1202 M N 6.068 125.441 119.600 -0.378 0.000 2.740 1202 M HA 0.275 4.777 4.480 0.037 0.000 0.253 1202 M C 0.771 177.012 176.300 -0.097 0.000 1.341 1202 M CA 0.592 55.800 55.300 -0.153 0.000 1.176 1202 M CB -0.524 32.064 32.600 -0.019 0.000 1.310 1202 M HN 0.581 nan 8.290 nan 0.000 0.531 1203 F N 1.834 121.787 119.950 0.005 0.000 2.266 1203 F HA 0.686 5.234 4.527 0.037 0.000 0.287 1203 F C 1.302 177.106 175.800 0.008 0.000 1.255 1203 F CA -0.366 57.636 58.000 0.005 0.000 1.201 1203 F CB -1.087 37.913 39.000 0.000 0.000 1.450 1203 F HN 0.426 nan 8.300 nan 0.000 0.510 1204 G N 0.932 109.920 108.800 0.313 0.000 2.578 1204 G HA2 -0.264 3.718 3.960 0.037 0.000 0.284 1204 G HA3 -0.264 3.718 3.960 0.037 0.000 0.284 1204 G C -0.730 174.185 174.900 0.025 0.000 1.283 1204 G CA 0.202 45.412 45.100 0.184 0.000 0.944 1204 G HN 1.460 nan 8.290 nan 0.000 0.558 1205 N N 0.961 119.666 118.700 0.007 0.000 2.370 1205 N HA 0.584 5.346 4.740 0.037 0.000 0.303 1205 N C -2.175 173.303 175.510 -0.052 0.000 1.103 1205 N CA -1.689 51.354 53.050 -0.010 0.000 0.848 1205 N CB 2.279 40.782 38.487 0.026 0.000 1.235 1205 N HN 0.328 nan 8.380 nan 0.000 0.496 1206 P HA 0.247 nan 4.420 nan 0.000 0.253 1206 P C -0.753 176.527 177.300 -0.033 0.000 1.459 1206 P CA 0.207 63.267 63.100 -0.065 0.000 0.908 1206 P CB 0.143 31.811 31.700 -0.053 0.000 1.470 1207 E N -0.120 120.069 120.200 -0.019 0.000 2.191 1207 E HA 0.429 4.801 4.350 0.037 0.000 0.278 1207 E C -0.046 176.522 176.600 -0.055 0.000 0.972 1207 E CA -0.329 56.063 56.400 -0.013 0.000 0.804 1207 E CB 1.506 31.219 29.700 0.023 0.000 1.110 1207 E HN 0.054 nan 8.360 nan 0.000 0.394 1208 T N 0.080 114.589 114.554 -0.075 0.000 2.604 1208 T HA 0.499 4.871 4.350 0.037 0.000 0.267 1208 T C -0.359 174.234 174.700 -0.179 0.000 0.923 1208 T CA -0.728 61.297 62.100 -0.126 0.000 1.077 1208 T CB 1.652 70.469 68.868 -0.086 0.000 1.392 1208 T HN 0.268 nan 8.240 nan 0.000 0.531 1209 T N 1.866 116.308 114.554 -0.186 0.000 2.921 1209 T HA 0.560 4.932 4.350 0.037 0.000 0.297 1209 T C -0.522 174.096 174.700 -0.137 0.000 1.013 1209 T CA -0.564 61.410 62.100 -0.210 0.000 0.990 1209 T CB 1.310 69.998 68.868 -0.300 0.000 1.023 1209 T HN 0.752 nan 8.240 nan 0.000 0.447 1210 T N 1.335 115.813 114.554 -0.127 0.000 2.900 1210 T HA 0.464 4.836 4.350 0.037 0.000 0.307 1210 T C 1.325 175.973 174.700 -0.086 0.000 1.065 1210 T CA 0.379 62.423 62.100 -0.093 0.000 1.105 1210 T CB 0.509 69.323 68.868 -0.089 0.000 0.979 1210 T HN 1.172 nan 8.240 nan 0.000 0.544 1211 G N 0.560 109.321 108.800 -0.065 0.000 2.165 1211 G HA2 0.253 4.235 3.960 0.037 0.000 0.226 1211 G HA3 0.253 4.235 3.960 0.037 0.000 0.226 1211 G C 0.714 175.578 174.900 -0.059 0.000 1.035 1211 G CA 0.090 45.148 45.100 -0.070 0.000 0.744 1211 G HN 1.839 nan 8.290 nan 0.000 0.501 1212 G N -0.120 108.658 108.800 -0.036 0.000 2.601 1212 G HA2 -0.258 3.724 3.960 0.037 0.000 0.261 1212 G HA3 -0.258 3.724 3.960 0.037 0.000 0.261 1212 G C 0.699 175.607 174.900 0.013 0.000 1.289 1212 G CA 0.544 45.641 45.100 -0.006 0.000 0.920 1212 G HN 0.952 nan 8.290 nan 0.000 0.571 1213 N N 0.648 119.391 118.700 0.071 0.000 2.325 1213 N HA 0.196 4.958 4.740 0.037 0.000 0.182 1213 N C 2.453 178.120 175.510 0.262 0.000 1.088 1213 N CA 1.279 54.424 53.050 0.158 0.000 0.879 1213 N CB -0.029 38.603 38.487 0.242 0.000 0.983 1213 N HN 0.840 nan 8.380 nan 0.000 0.471 1214 A N 1.587 124.511 122.820 0.174 0.000 1.873 1214 A HA -0.166 4.176 4.320 0.037 0.000 0.218 1214 A C 2.169 179.918 177.584 0.276 0.000 1.193 1214 A CA 1.230 53.398 52.037 0.218 0.000 0.629 1214 A CB -0.769 18.258 19.000 0.044 0.000 0.826 1214 A HN 0.217 nan 8.150 nan 0.000 0.447 1215 L N -0.177 121.090 121.223 0.074 0.000 2.083 1215 L HA -0.129 4.233 4.340 0.037 0.000 0.209 1215 L C 2.225 179.154 176.870 0.098 0.000 1.083 1215 L CA 2.116 56.967 54.840 0.019 0.000 0.752 1215 L CB -0.566 41.392 42.059 -0.168 0.000 0.899 1215 L HN 0.369 nan 8.230 nan 0.000 0.433 1216 K N -1.075 119.361 120.400 0.060 0.000 2.059 1216 K HA -0.247 4.095 4.320 0.037 0.000 0.212 1216 K C 2.058 178.618 176.600 -0.066 0.000 1.050 1216 K CA 2.197 58.453 56.287 -0.051 0.000 0.927 1216 K CB -0.491 31.899 32.500 -0.183 0.000 0.714 1216 K HN 0.272 nan 8.250 nan 0.000 0.447 1217 F N -0.658 119.334 119.950 0.071 0.000 2.128 1217 F HA -0.130 4.419 4.527 0.037 0.000 0.295 1217 F C 2.156 177.945 175.800 -0.019 0.000 1.100 1217 F CA 1.160 59.166 58.000 0.009 0.000 1.260 1217 F CB -0.412 38.565 39.000 -0.038 0.000 1.009 1217 F HN 0.005 nan 8.300 nan 0.000 0.476 1218 Y N 0.049 120.471 120.300 0.203 0.000 2.395 1218 Y HA 0.192 4.764 4.550 0.036 0.000 0.293 1218 Y C 1.617 177.574 175.900 0.095 0.000 1.123 1218 Y CA -0.022 58.158 58.100 0.134 0.000 1.227 1218 Y CB -0.697 37.822 38.460 0.097 0.000 1.012 1218 Y HN -0.108 nan 8.280 nan 0.000 0.552 1219 A N -0.110 122.837 122.820 0.212 0.000 2.511 1219 A HA 0.140 4.482 4.320 0.037 0.000 0.242 1219 A C 1.220 178.852 177.584 0.080 0.000 1.069 1219 A CA 0.430 52.550 52.037 0.138 0.000 0.763 1219 A CB 0.172 19.234 19.000 0.104 0.000 1.001 1219 A HN 0.343 nan 8.150 nan 0.000 0.498 1220 S N 0.564 116.303 115.700 0.066 0.000 2.458 1220 S HA 0.171 4.663 4.470 0.037 0.000 0.223 1220 S C 0.388 174.974 174.600 -0.023 0.000 1.019 1220 S CA 0.485 58.697 58.200 0.019 0.000 0.937 1220 S CB 0.110 63.327 63.200 0.028 0.000 0.788 1220 S HN 0.559 nan 8.310 nan 0.000 0.511 1221 V N 2.251 122.162 119.914 -0.006 0.000 2.760 1221 V HA 0.496 4.638 4.120 0.037 0.000 0.309 1221 V C -0.769 175.322 176.094 -0.005 0.000 1.077 1221 V CA -0.830 61.450 62.300 -0.033 0.000 0.910 1221 V CB 2.105 33.909 31.823 -0.031 0.000 1.008 1221 V HN 0.123 nan 8.190 nan 0.000 0.424 1222 R N 3.849 124.331 120.500 -0.030 0.000 2.476 1222 R HA 0.622 4.984 4.340 0.037 0.000 0.305 1222 R C -1.874 174.402 176.300 -0.040 0.000 0.965 1222 R CA -0.824 55.288 56.100 0.020 0.000 0.867 1222 R CB 2.171 32.515 30.300 0.073 0.000 1.176 1222 R HN 0.371 nan 8.270 nan 0.000 0.447 1223 L N 2.147 123.323 121.223 -0.079 0.000 2.317 1223 L HA 0.348 4.710 4.340 0.037 0.000 0.281 1223 L C -0.086 176.498 176.870 -0.477 0.000 1.024 1223 L CA -0.385 54.348 54.840 -0.179 0.000 0.810 1223 L CB 1.436 43.440 42.059 -0.092 0.000 1.240 1223 L HN 0.444 nan 8.230 nan 0.000 0.427 1224 D N 3.847 123.976 120.400 -0.451 0.000 2.461 1224 D HA 0.265 4.927 4.640 0.037 0.000 0.240 1224 D C -0.810 175.332 176.300 -0.263 0.000 1.094 1224 D CA -0.249 53.387 54.000 -0.607 0.000 0.868 1224 D CB 0.902 41.455 40.800 -0.411 0.000 1.062 1224 D HN 0.447 nan 8.370 nan 0.000 0.530 1225 I N 3.047 123.496 120.570 -0.203 0.000 2.392 1225 I HA 0.503 4.695 4.170 0.037 0.000 0.295 1225 I C -0.802 175.287 176.117 -0.048 0.000 0.985 1225 I CA -0.605 60.643 61.300 -0.087 0.000 1.221 1225 I CB 0.610 38.598 38.000 -0.019 0.000 1.366 1225 I HN 0.223 nan 8.210 nan 0.000 0.467 1226 R N 5.677 126.141 120.500 -0.060 0.000 2.584 1226 R HA 0.360 4.722 4.340 0.037 0.000 0.276 1226 R C -1.057 175.212 176.300 -0.052 0.000 1.046 1226 R CA -0.865 55.215 56.100 -0.032 0.000 0.906 1226 R CB 1.929 32.212 30.300 -0.030 0.000 1.215 1226 R HN 0.574 nan 8.270 nan 0.000 0.449 1227 R N 4.240 124.734 120.500 -0.010 0.000 2.316 1227 R HA 0.139 4.501 4.340 0.037 0.000 0.314 1227 R C 0.671 176.956 176.300 -0.025 0.000 1.069 1227 R CA 0.166 56.262 56.100 -0.006 0.000 0.959 1227 R CB 0.380 30.717 30.300 0.061 0.000 0.987 1227 R HN 0.776 nan 8.270 nan 0.000 0.446 1228 I N 0.717 121.253 120.570 -0.057 0.000 4.035 1228 I HA 0.466 4.658 4.170 0.037 0.000 0.321 1228 I C 0.587 176.671 176.117 -0.055 0.000 1.289 1228 I CA -0.155 61.109 61.300 -0.060 0.000 1.236 1228 I CB 0.891 38.843 38.000 -0.081 0.000 1.076 1228 I HN 0.590 nan 8.210 nan 0.000 0.418 1229 G N 0.934 109.698 108.800 -0.060 0.000 2.559 1229 G HA2 0.695 4.677 3.960 0.037 0.000 0.291 1229 G HA3 0.695 4.677 3.960 0.037 0.000 0.291 1229 G C -1.942 172.908 174.900 -0.083 0.000 1.424 1229 G CA -0.264 44.795 45.100 -0.068 0.000 0.786 1229 G HN 0.284 nan 8.290 nan 0.000 0.485 1230 A N -0.461 122.296 122.820 -0.104 0.000 2.305 1230 A HA 0.686 5.028 4.320 0.037 0.000 0.322 1230 A C -0.191 177.336 177.584 -0.094 0.000 1.187 1230 A CA -0.516 51.446 52.037 -0.125 0.000 0.825 1230 A CB 1.455 20.342 19.000 -0.187 0.000 1.164 1230 A HN 1.292 nan 8.150 nan 0.000 0.498 1231 V N 4.354 124.207 119.914 -0.101 0.000 2.356 1231 V HA 0.145 4.287 4.120 0.037 0.000 0.258 1231 V C 0.498 176.556 176.094 -0.060 0.000 1.065 1231 V CA -0.094 62.154 62.300 -0.087 0.000 0.935 1231 V CB -0.195 31.558 31.823 -0.118 0.000 1.061 1231 V HN 0.830 nan 8.190 nan 0.000 0.484 1232 K N 3.029 123.403 120.400 -0.043 0.000 2.090 1232 K HA 0.501 4.843 4.320 0.037 0.000 0.249 1232 K C 0.041 176.635 176.600 -0.011 0.000 0.995 1232 K CA -0.630 55.642 56.287 -0.024 0.000 0.914 1232 K CB 1.316 33.799 32.500 -0.028 0.000 1.057 1232 K HN 0.461 nan 8.250 nan 0.000 0.462 1233 E N 0.709 120.910 120.200 0.002 0.000 4.170 1233 E HA 0.135 4.507 4.350 0.037 0.000 0.215 1233 E C 0.368 176.972 176.600 0.008 0.000 1.119 1233 E CA -0.011 56.394 56.400 0.007 0.000 1.396 1233 E CB 0.757 30.469 29.700 0.019 0.000 1.182 1233 E HN 1.019 nan 8.360 nan 0.000 0.438 1234 G N 1.996 110.797 108.800 0.002 0.000 5.431 1234 G HA2 -0.398 3.584 3.960 0.037 0.000 0.322 1234 G HA3 -0.398 3.584 3.960 0.037 0.000 0.322 1234 G C 1.058 175.960 174.900 0.004 0.000 1.370 1234 G CA 0.729 45.831 45.100 0.002 0.000 0.963 1234 G HN 0.400 nan 8.290 nan 0.000 0.797 1235 E N 1.514 121.721 120.200 0.011 0.000 2.162 1235 E HA 0.085 4.457 4.350 0.037 0.000 0.193 1235 E C 1.034 177.649 176.600 0.025 0.000 0.953 1235 E CA 0.288 56.698 56.400 0.015 0.000 0.849 1235 E CB -0.116 29.595 29.700 0.019 0.000 0.810 1235 E HN 0.636 nan 8.360 nan 0.000 0.470 1236 N N 0.449 119.169 118.700 0.034 0.000 2.525 1236 N HA 0.111 4.873 4.740 0.037 0.000 0.271 1236 N C -0.792 174.755 175.510 0.060 0.000 1.194 1236 N CA -0.084 53.000 53.050 0.057 0.000 0.964 1236 N CB 1.622 40.147 38.487 0.064 0.000 1.126 1236 N HN -0.215 nan 8.380 nan 0.000 0.452 1237 V N 2.311 122.289 119.914 0.107 0.000 2.318 1237 V HA 0.122 4.264 4.120 0.037 0.000 0.271 1237 V C 0.561 176.798 176.094 0.239 0.000 1.030 1237 V CA -0.322 62.056 62.300 0.131 0.000 0.844 1237 V CB 1.172 33.077 31.823 0.137 0.000 1.015 1237 V HN 0.549 nan 8.190 nan 0.000 0.460 1238 V N 4.348 124.328 119.914 0.109 0.000 3.660 1238 V HA 0.637 4.779 4.120 0.037 0.000 0.276 1238 V C 0.840 176.770 176.094 -0.274 0.000 1.317 1238 V CA 1.285 63.636 62.300 0.084 0.000 1.097 1238 V CB 0.277 32.126 31.823 0.043 0.000 0.863 1238 V HN 0.906 nan 8.190 nan 0.000 0.438 1239 G N -1.167 107.301 108.800 -0.553 0.000 2.550 1239 G HA2 0.476 4.458 3.960 0.037 0.000 0.293 1239 G HA3 0.476 4.458 3.960 0.037 0.000 0.293 1239 G C -1.483 173.064 174.900 -0.589 0.000 1.402 1239 G CA -0.266 44.207 45.100 -1.045 0.000 0.784 1239 G HN -0.013 nan 8.290 nan 0.000 0.482 1240 S N -0.117 115.352 115.700 -0.385 0.000 2.456 1240 S HA 0.487 4.979 4.470 0.037 0.000 0.316 1240 S C -0.311 174.246 174.600 -0.072 0.000 1.089 1240 S CA -0.416 57.746 58.200 -0.062 0.000 1.101 1240 S CB 1.615 64.897 63.200 0.137 0.000 0.995 1240 S HN 0.585 nan 8.310 nan 0.000 0.468 1241 E N 2.133 122.285 120.200 -0.079 0.000 2.376 1241 E HA 0.281 4.653 4.350 0.037 0.000 0.266 1241 E C -0.563 175.948 176.600 -0.148 0.000 1.009 1241 E CA 0.507 56.846 56.400 -0.101 0.000 0.902 1241 E CB 0.539 30.187 29.700 -0.087 0.000 0.972 1241 E HN 0.448 nan 8.360 nan 0.000 0.439 1242 T N 4.997 119.381 114.554 -0.283 0.000 2.893 1242 T HA 0.499 4.871 4.350 0.037 0.000 0.293 1242 T C -0.881 173.477 174.700 -0.570 0.000 1.027 1242 T CA -0.793 61.038 62.100 -0.449 0.000 0.988 1242 T CB 1.261 69.756 68.868 -0.622 0.000 1.043 1242 T HN 0.377 nan 8.240 nan 0.000 0.461 1243 R N 2.237 122.502 120.500 -0.391 0.000 2.532 1243 R HA 0.690 5.052 4.340 0.037 0.000 0.297 1243 R C -1.948 174.227 176.300 -0.209 0.000 0.984 1243 R CA -0.502 55.424 56.100 -0.289 0.000 0.884 1243 R CB 1.355 31.557 30.300 -0.162 0.000 1.182 1243 R HN 0.464 nan 8.270 nan 0.000 0.442 1244 V N 4.502 124.327 119.914 -0.150 0.000 2.495 1244 V HA 0.428 4.570 4.120 0.037 0.000 0.298 1244 V C -0.237 175.834 176.094 -0.039 0.000 1.031 1244 V CA -0.792 61.470 62.300 -0.064 0.000 0.871 1244 V CB 1.911 33.757 31.823 0.038 0.000 0.988 1244 V HN 0.671 nan 8.190 nan 0.000 0.432 1245 K N 2.782 123.151 120.400 -0.052 0.000 2.206 1245 K HA 0.578 4.920 4.320 0.037 0.000 0.264 1245 K C -1.007 175.562 176.600 -0.051 0.000 0.967 1245 K CA -0.686 55.589 56.287 -0.020 0.000 0.844 1245 K CB 2.204 34.712 32.500 0.014 0.000 1.099 1245 K HN 0.457 nan 8.250 nan 0.000 0.441 1246 V N 4.633 124.516 119.914 -0.053 0.000 2.415 1246 V HA -0.011 4.131 4.120 0.037 0.000 0.267 1246 V C 1.039 176.999 176.094 -0.222 0.000 1.042 1246 V CA 0.065 62.290 62.300 -0.126 0.000 1.000 1246 V CB 0.903 32.643 31.823 -0.138 0.000 1.015 1246 V HN 0.650 nan 8.190 nan 0.000 0.478 1247 V N 3.964 123.758 119.914 -0.201 0.000 2.949 1247 V HA 0.169 4.311 4.120 0.037 0.000 0.245 1247 V C 0.837 176.701 176.094 -0.383 0.000 1.086 1247 V CA 0.871 63.045 62.300 -0.211 0.000 1.097 1247 V CB 0.005 31.851 31.823 0.038 0.000 0.762 1247 V HN 0.766 nan 8.190 nan 0.000 0.470 1248 K N 1.094 121.330 120.400 -0.274 0.000 2.371 1248 K HA 0.428 4.770 4.320 0.037 0.000 0.251 1248 K C -1.475 174.962 176.600 -0.273 0.000 0.934 1248 K CA -0.574 55.542 56.287 -0.284 0.000 0.798 1248 K CB 1.693 34.105 32.500 -0.147 0.000 1.204 1248 K HN 0.121 nan 8.250 nan 0.000 0.427 1249 N N 3.019 121.532 118.700 -0.312 0.000 2.549 1249 N HA 0.192 4.954 4.740 0.037 0.000 0.290 1249 N C -0.838 174.516 175.510 -0.261 0.000 1.122 1249 N CA -0.302 52.586 53.050 -0.269 0.000 0.885 1249 N CB 1.549 39.848 38.487 -0.313 0.000 1.455 1249 N HN 0.602 nan 8.380 nan 0.000 0.521 1250 K N 2.246 122.534 120.400 -0.187 0.000 2.374 1250 K HA 0.254 4.596 4.320 0.037 0.000 0.196 1250 K C 0.774 177.258 176.600 -0.194 0.000 1.023 1250 K CA 0.130 56.307 56.287 -0.182 0.000 1.103 1250 K CB 0.602 33.048 32.500 -0.091 0.000 0.848 1250 K HN 0.379 nan 8.250 nan 0.000 0.528 1251 I N -0.243 120.221 120.570 -0.177 0.000 3.883 1251 I HA 0.157 4.349 4.170 0.037 0.000 0.305 1251 I C 0.231 176.266 176.117 -0.137 0.000 1.247 1251 I CA 0.037 61.261 61.300 -0.126 0.000 1.350 1251 I CB 0.962 38.917 38.000 -0.075 0.000 1.194 1251 I HN -0.051 nan 8.210 nan 0.000 0.441 1252 A N -0.447 122.267 122.820 -0.177 0.000 2.534 1252 A HA 0.852 5.194 4.320 0.037 0.000 0.300 1252 A C -0.875 176.575 177.584 -0.224 0.000 1.223 1252 A CA -0.180 51.769 52.037 -0.146 0.000 0.666 1252 A CB -0.101 18.851 19.000 -0.081 0.000 1.316 1252 A HN 0.064 nan 8.150 nan 0.000 0.468 1253 A N 1.298 124.024 122.820 -0.155 0.000 2.520 1253 A HA 0.562 4.904 4.320 0.037 0.000 0.245 1253 A C -2.079 175.319 177.584 -0.309 0.000 1.072 1253 A CA -0.540 51.351 52.037 -0.243 0.000 0.761 1253 A CB -0.737 18.258 19.000 -0.009 0.000 1.004 1253 A HN 0.510 nan 8.150 nan 0.000 0.499 1254 P HA 0.521 nan 4.420 nan 0.000 0.282 1254 P C -0.132 177.027 177.300 -0.235 0.000 1.287 1254 P CA -0.310 62.473 63.100 -0.527 0.000 0.792 1254 P CB 0.180 31.333 31.700 -0.912 0.000 1.163 1255 F N -4.622 115.283 119.950 -0.075 0.000 2.840 1255 F HA -0.203 4.345 4.527 0.036 0.000 0.310 1255 F C 0.656 176.456 175.800 0.001 0.000 0.688 1255 F CA 0.762 58.755 58.000 -0.013 0.000 1.286 1255 F CB -2.408 36.614 39.000 0.037 0.000 1.612 1255 F HN 0.227 nan 8.300 nan 0.000 0.335 1256 K N 1.260 121.717 120.400 0.094 0.000 2.202 1256 K HA 0.461 4.803 4.320 0.037 0.000 0.264 1256 K C 0.433 177.062 176.600 0.048 0.000 1.010 1256 K CA -0.268 56.060 56.287 0.069 0.000 0.940 1256 K CB 0.749 33.270 32.500 0.035 0.000 0.983 1256 K HN 0.417 nan 8.250 nan 0.000 0.475 1257 Q N 0.137 119.964 119.800 0.044 0.000 2.423 1257 Q HA 0.732 5.094 4.340 0.037 0.000 0.278 1257 Q C -1.712 174.303 176.000 0.026 0.000 1.097 1257 Q CA -1.260 54.559 55.803 0.028 0.000 0.809 1257 Q CB 2.155 30.906 28.738 0.023 0.000 1.391 1257 Q HN 0.522 nan 8.270 nan 0.000 0.428 1258 A N 1.854 124.692 122.820 0.030 0.000 2.371 1258 A HA 0.631 4.973 4.320 0.037 0.000 0.311 1258 A C -1.117 176.473 177.584 0.010 0.000 1.068 1258 A CA -0.671 51.405 52.037 0.064 0.000 0.744 1258 A CB 1.550 20.637 19.000 0.145 0.000 1.239 1258 A HN 0.790 nan 8.150 nan 0.000 0.435 1259 E N 0.299 120.501 120.200 0.004 0.000 2.221 1259 E HA 0.776 5.148 4.350 0.037 0.000 0.268 1259 E C -1.067 175.537 176.600 0.008 0.000 0.933 1259 E CA -0.396 55.928 56.400 -0.126 0.000 0.809 1259 E CB 2.074 31.718 29.700 -0.093 0.000 1.190 1259 E HN 0.668 nan 8.360 nan 0.000 0.406 1260 F N -1.945 117.987 119.950 -0.031 0.000 3.194 1260 F HA 0.340 4.889 4.527 0.036 0.000 0.327 1260 F C -1.727 174.053 175.800 -0.032 0.000 1.141 1260 F CA -1.185 56.792 58.000 -0.037 0.000 0.862 1260 F CB 0.852 39.827 39.000 -0.042 0.000 1.447 1260 F HN 0.182 nan 8.300 nan 0.000 0.479 1261 Q N 1.289 121.296 119.800 0.344 0.000 2.316 1261 Q HA 0.670 5.032 4.340 0.037 0.000 0.264 1261 Q C -1.274 174.886 176.000 0.268 0.000 0.987 1261 Q CA -0.762 55.149 55.803 0.179 0.000 0.852 1261 Q CB 2.994 31.772 28.738 0.067 0.000 1.287 1261 Q HN 0.571 nan 8.270 nan 0.000 0.448 1262 I N 3.813 124.481 120.570 0.164 0.000 2.307 1262 I HA 0.220 4.412 4.170 0.037 0.000 0.289 1262 I C -0.518 175.563 176.117 -0.060 0.000 1.021 1262 I CA -0.443 60.935 61.300 0.130 0.000 1.224 1262 I CB 0.618 38.740 38.000 0.204 0.000 1.376 1262 I HN 0.367 nan 8.210 nan 0.000 0.470 1263 L N 7.146 128.353 121.223 -0.025 0.000 2.278 1263 L HA 0.290 4.652 4.340 0.037 0.000 0.287 1263 L C -0.551 176.349 176.870 0.050 0.000 1.072 1263 L CA -0.814 53.976 54.840 -0.083 0.000 0.819 1263 L CB -0.025 42.027 42.059 -0.013 0.000 1.176 1263 L HN 0.394 nan 8.230 nan 0.000 0.435 1264 Y N 2.362 122.757 120.300 0.158 0.000 2.721 1264 Y HA 0.181 4.754 4.550 0.037 0.000 0.329 1264 Y C 1.484 177.520 175.900 0.227 0.000 1.211 1264 Y CA 0.564 58.792 58.100 0.213 0.000 1.512 1264 Y CB -0.110 38.444 38.460 0.156 0.000 1.249 1264 Y HN 0.863 nan 8.280 nan 0.000 0.549 1265 G N 2.025 111.153 108.800 0.546 0.000 2.176 1265 G HA2 -0.334 3.648 3.960 0.037 0.000 0.253 1265 G HA3 -0.334 3.648 3.960 0.037 0.000 0.253 1265 G C 0.820 175.761 174.900 0.069 0.000 0.979 1265 G CA 0.607 45.902 45.100 0.324 0.000 0.641 1265 G HN 0.632 nan 8.290 nan 0.000 0.530 1266 E N -1.337 118.897 120.200 0.057 0.000 2.444 1266 E HA 0.474 4.846 4.350 0.037 0.000 0.203 1266 E C 1.348 177.919 176.600 -0.048 0.000 0.847 1266 E CA 1.290 57.686 56.400 -0.007 0.000 1.142 1266 E CB 0.706 30.423 29.700 0.028 0.000 1.125 1266 E HN 1.638 nan 8.360 nan 0.000 0.521 1267 G N 0.610 109.413 108.800 0.005 0.000 2.306 1267 G HA2 -0.103 3.879 3.960 0.037 0.000 0.262 1267 G HA3 -0.103 3.879 3.960 0.037 0.000 0.262 1267 G C -0.869 174.047 174.900 0.027 0.000 1.263 1267 G CA -0.463 44.636 45.100 -0.000 0.000 1.088 1267 G HN 0.140 nan 8.290 nan 0.000 0.489 1268 I N 1.462 122.022 120.570 -0.017 0.000 2.618 1268 I HA 0.079 4.271 4.170 0.037 0.000 0.284 1268 I C 0.596 176.695 176.117 -0.031 0.000 1.146 1268 I CA -0.229 61.035 61.300 -0.061 0.000 1.425 1268 I CB 0.740 38.575 38.000 -0.275 0.000 1.383 1268 I HN 0.436 nan 8.210 nan 0.000 0.562 1269 N N 6.373 125.082 118.700 0.016 0.000 2.739 1269 N HA -0.011 4.751 4.740 0.037 0.000 0.266 1269 N C 0.517 176.027 175.510 0.000 0.000 1.168 1269 N CA 0.187 53.257 53.050 0.032 0.000 1.055 1269 N CB -0.094 38.425 38.487 0.053 0.000 1.393 1269 N HN 0.515 nan 8.380 nan 0.000 0.514 1270 F N 2.962 122.787 119.950 -0.209 0.000 2.113 1270 F HA -0.156 4.393 4.527 0.036 0.000 0.297 1270 F C 0.933 176.591 175.800 -0.238 0.000 1.103 1270 F CA 1.450 59.267 58.000 -0.304 0.000 1.248 1270 F CB -0.041 38.667 39.000 -0.487 0.000 0.999 1270 F HN 0.402 nan 8.300 nan 0.000 0.475 1271 Y N 0.536 120.955 120.300 0.198 0.000 2.293 1271 Y HA -0.004 4.570 4.550 0.039 0.000 0.291 1271 Y C 2.657 178.543 175.900 -0.023 0.000 1.137 1271 Y CA 0.834 58.991 58.100 0.094 0.000 1.202 1271 Y CB -1.433 37.083 38.460 0.094 0.000 0.990 1271 Y HN 0.129 nan 8.280 nan 0.000 0.537 1272 G N 0.100 108.965 108.800 0.108 0.000 2.514 1272 G HA2 -0.300 3.682 3.960 0.037 0.000 0.217 1272 G HA3 -0.300 3.682 3.960 0.037 0.000 0.217 1272 G C 1.525 176.410 174.900 -0.025 0.000 1.198 1272 G CA 1.295 46.411 45.100 0.027 0.000 0.780 1272 G HN 0.423 nan 8.290 nan 0.000 0.565 1273 E N -0.247 119.899 120.200 -0.089 0.000 2.070 1273 E HA -0.171 4.201 4.350 0.037 0.000 0.197 1273 E C 2.420 178.929 176.600 -0.152 0.000 1.004 1273 E CA 1.052 57.366 56.400 -0.143 0.000 0.805 1273 E CB -0.263 29.267 29.700 -0.283 0.000 0.744 1273 E HN 0.313 nan 8.360 nan 0.000 0.451 1274 L N 0.747 121.851 121.223 -0.199 0.000 2.042 1274 L HA -0.169 4.193 4.340 0.037 0.000 0.210 1274 L C 2.221 179.081 176.870 -0.016 0.000 1.076 1274 L CA 1.354 56.124 54.840 -0.117 0.000 0.749 1274 L CB -0.357 41.687 42.059 -0.025 0.000 0.893 1274 L HN -0.032 nan 8.230 nan 0.000 0.432 1275 V N -0.225 119.692 119.914 0.005 0.000 2.255 1275 V HA -0.316 3.826 4.120 0.037 0.000 0.247 1275 V C 2.320 178.441 176.094 0.044 0.000 1.051 1275 V CA 2.087 64.393 62.300 0.009 0.000 1.018 1275 V CB -0.754 31.025 31.823 -0.072 0.000 0.641 1275 V HN 0.431 nan 8.190 nan 0.000 0.445 1276 D N -0.177 120.239 120.400 0.026 0.000 2.097 1276 D HA -0.118 4.544 4.640 0.037 0.000 0.195 1276 D C 2.140 178.464 176.300 0.040 0.000 0.989 1276 D CA 0.978 55.006 54.000 0.048 0.000 0.827 1276 D CB -0.282 40.534 40.800 0.028 0.000 0.966 1276 D HN 0.167 nan 8.370 nan 0.000 0.456 1277 L N 0.590 121.817 121.223 0.007 0.000 2.083 1277 L HA -0.067 4.295 4.340 0.037 0.000 0.209 1277 L C 2.454 179.342 176.870 0.030 0.000 1.083 1277 L CA 1.611 56.453 54.840 0.004 0.000 0.752 1277 L CB -1.518 40.520 42.059 -0.035 0.000 0.899 1277 L HN 0.090 nan 8.230 nan 0.000 0.433 1278 G N -0.818 108.007 108.800 0.042 0.000 2.418 1278 G HA2 -0.165 3.817 3.960 0.037 0.000 0.217 1278 G HA3 -0.165 3.817 3.960 0.037 0.000 0.217 1278 G C 1.722 176.680 174.900 0.098 0.000 1.158 1278 G CA 0.880 46.023 45.100 0.071 0.000 0.771 1278 G HN 0.260 nan 8.290 nan 0.000 0.545 1279 V N 0.663 120.645 119.914 0.113 0.000 2.427 1279 V HA -0.119 4.023 4.120 0.037 0.000 0.248 1279 V C 2.664 178.802 176.094 0.074 0.000 1.051 1279 V CA 2.034 64.404 62.300 0.115 0.000 1.048 1279 V CB -0.331 31.586 31.823 0.157 0.000 0.666 1279 V HN 0.342 nan 8.190 nan 0.000 0.456 1280 K N -0.153 120.284 120.400 0.062 0.000 2.097 1280 K HA -0.148 4.194 4.320 0.037 0.000 0.205 1280 K C 1.818 178.442 176.600 0.041 0.000 1.050 1280 K CA 1.107 57.420 56.287 0.044 0.000 0.938 1280 K CB 0.036 32.558 32.500 0.036 0.000 0.718 1280 K HN 0.362 nan 8.250 nan 0.000 0.442 1281 E N 0.685 120.914 120.200 0.048 0.000 2.489 1281 E HA -0.023 4.349 4.350 0.037 0.000 0.193 1281 E C -0.079 176.553 176.600 0.054 0.000 1.057 1281 E CA 0.169 56.598 56.400 0.047 0.000 0.866 1281 E CB 0.449 30.178 29.700 0.049 0.000 0.916 1281 E HN 0.152 nan 8.360 nan 0.000 0.500 1282 K N -0.428 120.007 120.400 0.058 0.000 3.281 1282 K HA -0.194 4.148 4.320 0.037 0.000 0.295 1282 K C 1.022 177.671 176.600 0.081 0.000 1.233 1282 K CA 0.454 56.776 56.287 0.058 0.000 0.866 1282 K CB -2.108 30.416 32.500 0.039 0.000 1.265 1282 K HN 0.258 nan 8.250 nan 0.000 0.482 1283 L N -0.335 120.957 121.223 0.115 0.000 2.270 1283 L HA 0.165 4.527 4.340 0.037 0.000 0.210 1283 L C 1.200 178.231 176.870 0.268 0.000 1.104 1283 L CA 0.689 55.639 54.840 0.183 0.000 0.804 1283 L CB 0.071 42.244 42.059 0.190 0.000 0.937 1283 L HN 0.106 nan 8.230 nan 0.000 0.450 1284 I N -0.349 120.347 120.570 0.210 0.000 2.404 1284 I HA 0.203 4.395 4.170 0.037 0.000 0.293 1284 I C -0.250 175.954 176.117 0.145 0.000 0.992 1284 I CA -0.604 60.836 61.300 0.234 0.000 1.149 1284 I CB 2.154 40.295 38.000 0.235 0.000 1.315 1284 I HN -0.125 nan 8.210 nan 0.000 0.446 1285 E N 5.497 125.763 120.200 0.111 0.000 2.259 1285 E HA 0.233 4.605 4.350 0.037 0.000 0.281 1285 E C -0.726 175.856 176.600 -0.030 0.000 1.027 1285 E CA -0.307 56.113 56.400 0.033 0.000 0.838 1285 E CB 0.992 30.700 29.700 0.013 0.000 1.066 1285 E HN 0.275 nan 8.360 nan 0.000 0.401 1286 K N 2.713 123.048 120.400 -0.107 0.000 2.464 1286 K HA 0.496 4.838 4.320 0.037 0.000 0.252 1286 K C -1.364 175.136 176.600 -0.167 0.000 1.000 1286 K CA -0.601 55.516 56.287 -0.284 0.000 0.951 1286 K CB 0.942 33.204 32.500 -0.397 0.000 1.183 1286 K HN 0.515 nan 8.250 nan 0.000 0.445 1287 A N 3.744 126.502 122.820 -0.103 0.000 3.016 1287 A HA 0.502 4.844 4.320 0.037 0.000 0.303 1287 A C 0.920 178.513 177.584 0.014 0.000 1.507 1287 A CA 0.363 52.385 52.037 -0.026 0.000 1.196 1287 A CB -0.459 18.543 19.000 0.002 0.000 1.169 1287 A HN 1.057 nan 8.150 nan 0.000 0.544 1288 G N 1.442 110.220 108.800 -0.038 0.000 2.889 1288 G HA2 -0.144 3.838 3.960 0.037 0.000 0.308 1288 G HA3 -0.144 3.838 3.960 0.037 0.000 0.308 1288 G C 1.340 176.203 174.900 -0.062 0.000 1.248 1288 G CA 0.816 45.905 45.100 -0.019 0.000 0.982 1288 G HN 1.893 nan 8.290 nan 0.000 0.571 1289 A N -0.804 122.012 122.820 -0.006 0.000 2.348 1289 A HA 0.543 4.885 4.320 0.037 0.000 0.224 1289 A C 0.472 177.967 177.584 -0.148 0.000 1.227 1289 A CA 0.472 52.464 52.037 -0.076 0.000 0.885 1289 A CB 0.068 19.013 19.000 -0.093 0.000 0.933 1289 A HN 0.545 nan 8.150 nan 0.000 0.506 1290 W N -0.721 120.519 121.300 -0.100 0.000 2.390 1290 W HA 0.576 5.236 4.660 0.001 0.000 0.312 1290 W C -0.863 175.553 176.519 -0.172 0.000 1.123 1290 W CA -0.082 57.233 57.345 -0.051 0.000 1.202 1290 W CB 0.588 30.018 29.460 -0.049 0.000 1.251 1290 W HN 0.186 nan 8.180 nan 0.000 0.511 1291 Y N 2.351 122.758 120.300 0.178 0.000 2.328 1291 Y HA 0.459 5.028 4.550 0.031 0.000 0.337 1291 Y C 0.292 176.230 175.900 0.064 0.000 0.966 1291 Y CA -0.597 57.553 58.100 0.083 0.000 1.136 1291 Y CB 1.500 39.966 38.460 0.009 0.000 1.170 1291 Y HN 0.139 nan 8.280 nan 0.000 0.470 1292 S N 2.986 118.776 115.700 0.151 0.000 2.482 1292 S HA 0.414 4.906 4.470 0.037 0.000 0.303 1292 S C -1.832 172.835 174.600 0.112 0.000 1.091 1292 S CA -0.761 57.482 58.200 0.071 0.000 1.057 1292 S CB 1.142 64.355 63.200 0.020 0.000 1.031 1292 S HN 0.497 nan 8.310 nan 0.000 0.485 1293 Y N 2.814 123.059 120.300 -0.092 0.000 2.326 1293 Y HA 0.371 4.942 4.550 0.034 0.000 0.331 1293 Y C 0.190 176.074 175.900 -0.026 0.000 0.962 1293 Y CA -0.980 57.093 58.100 -0.044 0.000 1.167 1293 Y CB 0.525 38.960 38.460 -0.042 0.000 1.148 1293 Y HN 0.805 nan 8.280 nan 0.000 0.463 1294 K N 4.960 125.032 120.400 -0.546 0.000 3.148 1294 K HA -0.266 4.076 4.320 0.037 0.000 0.267 1294 K C 0.958 177.430 176.600 -0.212 0.000 0.996 1294 K CA 1.007 57.024 56.287 -0.449 0.000 0.737 1294 K CB -1.615 30.504 32.500 -0.635 0.000 1.308 1294 K HN 1.327 nan 8.250 nan 0.000 0.470 1295 G N 0.141 108.858 108.800 -0.139 0.000 2.320 1295 G HA2 -0.374 3.608 3.960 0.037 0.000 0.242 1295 G HA3 -0.374 3.608 3.960 0.037 0.000 0.242 1295 G C -0.048 174.805 174.900 -0.078 0.000 1.033 1295 G CA 0.502 45.547 45.100 -0.093 0.000 0.620 1295 G HN 0.512 nan 8.290 nan 0.000 0.517 1296 E N 1.720 121.876 120.200 -0.074 0.000 2.259 1296 E HA 0.364 4.735 4.350 0.037 0.000 0.281 1296 E C 0.173 176.714 176.600 -0.098 0.000 1.037 1296 E CA -0.504 55.857 56.400 -0.064 0.000 0.854 1296 E CB 0.262 29.947 29.700 -0.024 0.000 1.051 1296 E HN 0.319 nan 8.360 nan 0.000 0.409 1297 K N 5.081 125.434 120.400 -0.078 0.000 2.379 1297 K HA 0.115 4.457 4.320 0.037 0.000 0.284 1297 K C 0.924 177.439 176.600 -0.141 0.000 1.044 1297 K CA 0.074 56.348 56.287 -0.022 0.000 0.974 1297 K CB 0.645 33.169 32.500 0.041 0.000 0.962 1297 K HN 0.571 nan 8.250 nan 0.000 0.474 1298 I N -1.653 118.767 120.570 -0.250 0.000 4.187 1298 I HA 0.290 4.482 4.170 0.037 0.000 0.326 1298 I C 0.620 176.542 176.117 -0.324 0.000 1.302 1298 I CA -0.303 60.554 61.300 -0.738 0.000 1.196 1298 I CB 1.003 38.248 38.000 -1.258 0.000 1.095 1298 I HN 0.536 nan 8.210 nan 0.000 0.411 1299 G N 0.762 109.535 108.800 -0.045 0.000 2.523 1299 G HA2 0.380 4.362 3.960 0.037 0.000 0.291 1299 G HA3 0.380 4.362 3.960 0.037 0.000 0.291 1299 G C -2.100 172.698 174.900 -0.169 0.000 1.450 1299 G CA -0.574 44.487 45.100 -0.064 0.000 0.790 1299 G HN 0.115 nan 8.290 nan 0.000 0.496 1300 Q N 0.120 119.696 119.800 -0.373 0.000 2.363 1300 Q HA 0.529 4.891 4.340 0.037 0.000 0.265 1300 Q C 0.132 175.979 176.000 -0.255 0.000 1.032 1300 Q CA 0.240 55.664 55.803 -0.631 0.000 0.746 1300 Q CB 1.106 29.242 28.738 -1.003 0.000 1.237 1300 Q HN 2.185 nan 8.270 nan 0.000 0.475 1301 G N 2.843 111.642 108.800 -0.003 0.000 2.764 1301 G HA2 -0.262 3.720 3.960 0.037 0.000 0.686 1301 G HA3 -0.262 3.720 3.960 0.037 0.000 0.686 1301 G C 0.186 175.027 174.900 -0.098 0.000 1.258 1301 G CA 0.009 45.158 45.100 0.080 0.000 0.846 1301 G HN 0.753 nan 8.290 nan 0.000 0.596 1302 K N 1.163 121.487 120.400 -0.127 0.000 2.144 1302 K HA -0.190 4.152 4.320 0.037 0.000 0.209 1302 K C 2.907 179.370 176.600 -0.228 0.000 1.047 1302 K CA 2.712 58.794 56.287 -0.342 0.000 0.927 1302 K CB -0.359 32.063 32.500 -0.130 0.000 0.716 1302 K HN 1.254 nan 8.250 nan 0.000 0.454 1303 A N 1.356 124.100 122.820 -0.126 0.000 1.869 1303 A HA -0.294 4.048 4.320 0.037 0.000 0.218 1303 A C 1.767 179.300 177.584 -0.086 0.000 1.203 1303 A CA 2.356 54.343 52.037 -0.083 0.000 0.638 1303 A CB -1.013 17.952 19.000 -0.059 0.000 0.831 1303 A HN 0.630 nan 8.150 nan 0.000 0.450 1304 N N -0.257 118.380 118.700 -0.105 0.000 2.216 1304 N HA 0.076 4.838 4.740 0.037 0.000 0.183 1304 N C 1.957 177.439 175.510 -0.048 0.000 1.017 1304 N CA 0.945 53.955 53.050 -0.067 0.000 0.861 1304 N CB -0.273 38.165 38.487 -0.081 0.000 0.986 1304 N HN 0.506 nan 8.380 nan 0.000 0.428 1305 A N 0.789 123.509 122.820 -0.167 0.000 1.908 1305 A HA -0.184 4.158 4.320 0.037 0.000 0.218 1305 A C 2.266 179.820 177.584 -0.049 0.000 1.181 1305 A CA 1.910 53.843 52.037 -0.174 0.000 0.627 1305 A CB -1.139 17.517 19.000 -0.574 0.000 0.818 1305 A HN 0.231 nan 8.150 nan 0.000 0.445 1306 T N 0.360 114.860 114.554 -0.091 0.000 2.674 1306 T HA -0.057 4.315 4.350 0.037 0.000 0.265 1306 T C 2.221 176.899 174.700 -0.036 0.000 1.039 1306 T CA 1.765 63.852 62.100 -0.021 0.000 1.150 1306 T CB -0.538 68.329 68.868 -0.002 0.000 0.864 1306 T HN 0.629 nan 8.240 nan 0.000 0.427 1307 A N 0.027 122.834 122.820 -0.021 0.000 2.019 1307 A HA -0.106 4.236 4.320 0.037 0.000 0.219 1307 A C 2.030 179.591 177.584 -0.039 0.000 1.164 1307 A CA 1.421 53.437 52.037 -0.035 0.000 0.644 1307 A CB -1.018 17.978 19.000 -0.006 0.000 0.805 1307 A HN 0.721 nan 8.150 nan 0.000 0.449 1308 W N 0.249 121.465 121.300 -0.141 0.000 2.407 1308 W HA -0.037 4.649 4.660 0.043 0.000 0.305 1308 W C 1.728 178.138 176.519 -0.182 0.000 1.196 1308 W CA 1.538 58.810 57.345 -0.122 0.000 1.311 1308 W CB -0.217 29.202 29.460 -0.069 0.000 1.135 1308 W HN 0.226 nan 8.180 nan 0.000 0.514 1309 L N 0.730 121.929 121.223 -0.039 0.000 2.191 1309 L HA -0.216 4.146 4.340 0.037 0.000 0.212 1309 L C 2.476 178.907 176.870 -0.731 0.000 1.103 1309 L CA 1.393 56.050 54.840 -0.305 0.000 0.769 1309 L CB -0.711 41.270 42.059 -0.128 0.000 0.908 1309 L HN -0.045 nan 8.230 nan 0.000 0.438 1310 K N 0.005 119.939 120.400 -0.777 0.000 2.026 1310 K HA -0.196 4.146 4.320 0.037 0.000 0.208 1310 K C 1.535 177.846 176.600 -0.481 0.000 1.048 1310 K CA 1.792 57.613 56.287 -0.777 0.000 0.929 1310 K CB 0.024 32.284 32.500 -0.401 0.000 0.713 1310 K HN 0.222 nan 8.250 nan 0.000 0.439 1311 D N 0.033 120.167 120.400 -0.445 0.000 2.277 1311 D HA -0.052 4.610 4.640 0.037 0.000 0.208 1311 D C -0.257 175.756 176.300 -0.479 0.000 0.962 1311 D CA 0.868 54.629 54.000 -0.399 0.000 0.865 1311 D CB 0.007 40.585 40.800 -0.369 0.000 0.939 1311 D HN 0.133 nan 8.370 nan 0.000 0.510 1312 N N 0.275 118.579 118.700 -0.661 0.000 3.012 1312 N HA 0.194 4.956 4.740 0.037 0.000 0.270 1312 N C -2.124 173.158 175.510 -0.381 0.000 1.469 1312 N CA -1.143 51.549 53.050 -0.598 0.000 0.928 1312 N CB 1.701 39.576 38.487 -1.020 0.000 1.219 1312 N HN -0.070 nan 8.380 nan 0.000 0.492 1313 P HA -0.121 nan 4.420 nan 0.000 0.220 1313 P C 0.975 178.228 177.300 -0.078 0.000 1.148 1313 P CA 1.061 64.082 63.100 -0.131 0.000 0.803 1313 P CB 0.503 32.151 31.700 -0.087 0.000 0.782 1314 E N -0.518 119.627 120.200 -0.092 0.000 2.051 1314 E HA -0.107 4.265 4.350 0.037 0.000 0.192 1314 E C 1.846 178.433 176.600 -0.022 0.000 0.991 1314 E CA 1.601 57.975 56.400 -0.044 0.000 0.799 1314 E CB -1.530 28.146 29.700 -0.040 0.000 0.748 1314 E HN 0.295 nan 8.360 nan 0.000 0.449 1315 T N 1.459 115.982 114.554 -0.052 0.000 2.904 1315 T HA 0.010 4.382 4.350 0.037 0.000 0.267 1315 T C 2.024 176.699 174.700 -0.041 0.000 1.059 1315 T CA 1.126 63.221 62.100 -0.008 0.000 1.137 1315 T CB -0.146 68.737 68.868 0.024 0.000 0.879 1315 T HN 0.253 nan 8.240 nan 0.000 0.467 1316 A N 2.282 125.073 122.820 -0.048 0.000 1.877 1316 A HA -0.105 4.237 4.320 0.037 0.000 0.216 1316 A C 2.335 179.970 177.584 0.084 0.000 1.186 1316 A CA 1.110 53.168 52.037 0.036 0.000 0.620 1316 A CB -0.318 18.743 19.000 0.101 0.000 0.822 1316 A HN 0.203 nan 8.150 nan 0.000 0.443 1317 K N -0.175 120.264 120.400 0.065 0.000 2.063 1317 K HA -0.202 4.140 4.320 0.037 0.000 0.208 1317 K C 1.931 178.567 176.600 0.060 0.000 1.048 1317 K CA 1.644 57.969 56.287 0.064 0.000 0.928 1317 K CB -0.442 32.079 32.500 0.035 0.000 0.713 1317 K HN 0.786 nan 8.250 nan 0.000 0.442 1318 E N 0.685 120.915 120.200 0.051 0.000 2.077 1318 E HA -0.158 4.214 4.350 0.037 0.000 0.193 1318 E C 2.063 178.706 176.600 0.071 0.000 0.989 1318 E CA 0.964 57.405 56.400 0.069 0.000 0.800 1318 E CB -0.006 29.751 29.700 0.097 0.000 0.746 1318 E HN 0.253 nan 8.360 nan 0.000 0.452 1319 I N 0.780 121.369 120.570 0.031 0.000 2.233 1319 I HA -0.198 3.994 4.170 0.037 0.000 0.243 1319 I C 2.688 178.836 176.117 0.052 0.000 1.093 1319 I CA 1.073 62.386 61.300 0.022 0.000 1.380 1319 I CB -0.373 37.581 38.000 -0.076 0.000 1.067 1319 I HN 0.211 nan 8.210 nan 0.000 0.413 1320 E N 1.818 122.059 120.200 0.070 0.000 2.070 1320 E HA -0.313 4.059 4.350 0.037 0.000 0.197 1320 E C 2.257 178.897 176.600 0.067 0.000 1.004 1320 E CA 1.546 57.995 56.400 0.083 0.000 0.805 1320 E CB -0.022 29.771 29.700 0.154 0.000 0.744 1320 E HN 0.283 nan 8.360 nan 0.000 0.451 1321 K N 0.611 121.051 120.400 0.066 0.000 2.032 1321 K HA -0.217 4.125 4.320 0.037 0.000 0.209 1321 K C 2.176 178.807 176.600 0.052 0.000 1.048 1321 K CA 1.716 58.036 56.287 0.056 0.000 0.927 1321 K CB -0.028 32.504 32.500 0.053 0.000 0.712 1321 K HN 0.007 nan 8.250 nan 0.000 0.441 1322 K N 0.054 120.490 120.400 0.060 0.000 2.097 1322 K HA -0.091 4.251 4.320 0.037 0.000 0.206 1322 K C 1.991 178.622 176.600 0.051 0.000 1.049 1322 K CA 1.085 57.409 56.287 0.061 0.000 0.933 1322 K CB 0.052 32.602 32.500 0.082 0.000 0.717 1322 K HN -0.026 nan 8.250 nan 0.000 0.442 1323 V N 1.142 121.084 119.914 0.047 0.000 2.307 1323 V HA -0.245 3.897 4.120 0.037 0.000 0.245 1323 V C 2.143 178.253 176.094 0.027 0.000 1.045 1323 V CA 1.670 63.989 62.300 0.033 0.000 1.024 1323 V CB -0.415 31.419 31.823 0.017 0.000 0.651 1323 V HN 0.276 nan 8.190 nan 0.000 0.449 1324 R N -0.120 120.398 120.500 0.029 0.000 2.081 1324 R HA -0.184 4.178 4.340 0.037 0.000 0.235 1324 R C 2.309 178.626 176.300 0.028 0.000 1.131 1324 R CA 1.783 57.899 56.100 0.027 0.000 0.960 1324 R CB -0.320 30.000 30.300 0.033 0.000 0.856 1324 R HN 0.622 nan 8.270 nan 0.000 0.436 1325 E N 0.595 120.815 120.200 0.032 0.000 2.077 1325 E HA -0.165 4.207 4.350 0.037 0.000 0.193 1325 E C 2.014 178.632 176.600 0.030 0.000 0.989 1325 E CA 0.931 57.349 56.400 0.031 0.000 0.800 1325 E CB -0.051 29.669 29.700 0.034 0.000 0.746 1325 E HN 0.293 nan 8.360 nan 0.000 0.452 1326 L N 0.144 121.386 121.223 0.032 0.000 2.217 1326 L HA -0.097 4.265 4.340 0.037 0.000 0.211 1326 L C 1.902 178.788 176.870 0.028 0.000 1.107 1326 L CA 0.787 55.645 54.840 0.031 0.000 0.783 1326 L CB 0.142 42.222 42.059 0.035 0.000 0.919 1326 L HN 0.159 nan 8.230 nan 0.000 0.442 1327 L N -1.457 119.780 121.223 0.025 0.000 3.039 1327 L HA 0.212 4.574 4.340 0.037 0.000 0.269 1327 L C 0.204 177.087 176.870 0.022 0.000 1.169 1327 L CA -0.269 54.584 54.840 0.022 0.000 0.986 1327 L CB 0.769 42.839 42.059 0.018 0.000 1.377 1327 L HN 0.033 nan 8.230 nan 0.000 0.575 1328 L N 0.118 121.354 121.223 0.022 0.000 2.313 1328 L HA 0.112 4.474 4.340 0.037 0.000 0.282 1328 L C 1.673 178.558 176.870 0.024 0.000 1.092 1328 L CA 0.074 54.926 54.840 0.020 0.000 0.831 1328 L CB 1.609 43.679 42.059 0.019 0.000 1.159 1328 L HN 0.054 nan 8.230 nan 0.000 0.442 1329 S N 3.294 119.009 115.700 0.025 0.000 2.378 1329 S HA -0.182 4.310 4.470 0.037 0.000 0.229 1329 S C 0.745 175.364 174.600 0.032 0.000 1.052 1329 S CA 1.677 59.896 58.200 0.032 0.000 1.084 1329 S CB -0.057 63.159 63.200 0.028 0.000 0.950 1329 S HN 0.768 nan 8.310 nan 0.000 0.440 1330 N N 0.786 119.501 118.700 0.024 0.000 2.404 1330 N HA 0.502 5.264 4.740 0.037 0.000 0.297 1330 N C -2.767 172.756 175.510 0.021 0.000 1.163 1330 N CA -1.642 51.423 53.050 0.025 0.000 0.864 1330 N CB 1.102 39.602 38.487 0.021 0.000 1.247 1330 N HN 0.170 nan 8.380 nan 0.000 0.510 1331 P HA 0.063 nan 4.420 nan 0.000 0.270 1331 P C -0.973 176.337 177.300 0.016 0.000 1.227 1331 P CA -0.149 62.963 63.100 0.019 0.000 0.788 1331 P CB 0.007 31.718 31.700 0.018 0.000 0.926 1332 N N -0.911 117.799 118.700 0.016 0.000 2.665 1332 N HA -0.167 4.595 4.740 0.037 0.000 0.306 1332 N C -0.304 175.213 175.510 0.012 0.000 1.244 1332 N CA 0.733 53.792 53.050 0.014 0.000 0.715 1332 N CB -1.682 36.812 38.487 0.013 0.000 1.011 1332 N HN 0.516 nan 8.380 nan 0.000 0.547 2002 I N 0.976 121.547 120.570 0.001 0.000 2.947 2002 I HA 0.061 4.253 4.170 0.037 0.000 0.263 2002 I C 1.765 177.882 176.117 0.001 0.000 1.130 2002 I CA 1.170 62.471 61.300 0.002 0.000 1.448 2002 I CB -0.063 37.938 38.000 0.001 0.000 1.222 2002 I HN 0.370 nan 8.210 nan 0.000 0.453 2003 D N 1.067 121.467 120.400 -0.000 0.000 2.355 2003 D HA -0.117 4.545 4.640 0.037 0.000 0.218 2003 D C 1.422 177.722 176.300 -0.000 0.000 1.004 2003 D CA 0.611 54.611 54.000 -0.001 0.000 0.880 2003 D CB -0.263 40.535 40.800 -0.003 0.000 0.911 2003 D HN 0.421 nan 8.370 nan 0.000 0.528 2004 E N 0.170 120.370 120.200 0.000 0.000 2.158 2004 E HA -0.033 4.339 4.350 0.037 0.000 0.191 2004 E C 1.590 178.191 176.600 0.002 0.000 0.982 2004 E CA 0.281 56.681 56.400 0.001 0.000 0.823 2004 E CB -0.035 29.665 29.700 0.000 0.000 0.766 2004 E HN 0.209 nan 8.360 nan 0.000 0.468 2005 N N 1.222 119.924 118.700 0.002 0.000 2.270 2005 N HA -0.088 4.674 4.740 0.037 0.000 0.181 2005 N C 1.464 176.976 175.510 0.004 0.000 1.016 2005 N CA 0.807 53.859 53.050 0.004 0.000 0.870 2005 N CB 0.076 38.566 38.487 0.004 0.000 0.979 2005 N HN 0.158 nan 8.380 nan 0.000 0.431 2006 K N 0.932 121.334 120.400 0.003 0.000 2.057 2006 K HA -0.065 4.276 4.320 0.037 0.000 0.207 2006 K C 1.890 178.492 176.600 0.003 0.000 1.049 2006 K CA 0.950 57.239 56.287 0.003 0.000 0.931 2006 K CB -0.010 32.491 32.500 0.001 0.000 0.714 2006 K HN 0.264 nan 8.250 nan 0.000 0.440 2007 Q N 0.542 120.343 119.800 0.002 0.000 2.297 2007 Q HA -0.107 4.255 4.340 0.037 0.000 0.204 2007 Q C 1.972 177.974 176.000 0.004 0.000 0.962 2007 Q CA 0.797 56.601 55.803 0.002 0.000 0.879 2007 Q CB 0.111 28.849 28.738 0.001 0.000 0.947 2007 Q HN 0.259 nan 8.270 nan 0.000 0.462 2008 K N 0.899 121.302 120.400 0.004 0.000 1.985 2008 K HA -0.131 4.211 4.320 0.037 0.000 0.210 2008 K C 1.963 178.566 176.600 0.006 0.000 1.047 2008 K CA 1.319 57.609 56.287 0.005 0.000 0.932 2008 K CB -0.088 32.415 32.500 0.005 0.000 0.716 2008 K HN 0.116 nan 8.250 nan 0.000 0.439 2009 A N 1.071 123.895 122.820 0.007 0.000 2.066 2009 A HA -0.088 4.253 4.320 0.037 0.000 0.218 2009 A C 1.962 179.551 177.584 0.009 0.000 1.157 2009 A CA 0.917 52.959 52.037 0.008 0.000 0.670 2009 A CB -0.405 18.600 19.000 0.008 0.000 0.804 2009 A HN 0.407 nan 8.150 nan 0.000 0.453 2010 L N -0.140 121.088 121.223 0.007 0.000 1.973 2010 L HA -0.014 4.348 4.340 0.037 0.000 0.208 2010 L C 2.667 179.543 176.870 0.010 0.000 1.073 2010 L CA 2.334 57.178 54.840 0.008 0.000 0.746 2010 L CB -0.821 41.241 42.059 0.005 0.000 0.891 2010 L HN 0.279 nan 8.230 nan 0.000 0.433 2011 A N -0.273 122.552 122.820 0.009 0.000 1.948 2011 A HA -0.201 4.141 4.320 0.037 0.000 0.220 2011 A C 2.432 180.024 177.584 0.012 0.000 1.177 2011 A CA 2.109 54.152 52.037 0.010 0.000 0.636 2011 A CB -1.342 17.663 19.000 0.008 0.000 0.815 2011 A HN 0.678 nan 8.150 nan 0.000 0.449 2012 A N -0.332 122.494 122.820 0.011 0.000 1.933 2012 A HA 0.160 4.502 4.320 0.037 0.000 0.218 2012 A C 2.487 180.081 177.584 0.017 0.000 1.175 2012 A CA 2.080 54.124 52.037 0.012 0.000 0.628 2012 A CB -0.916 18.091 19.000 0.011 0.000 0.814 2012 A HN 1.065 nan 8.150 nan 0.000 0.444 2013 A N -0.723 122.108 122.820 0.019 0.000 1.898 2013 A HA 0.071 4.413 4.320 0.037 0.000 0.216 2013 A C 2.034 179.638 177.584 0.034 0.000 1.181 2013 A CA 1.504 53.557 52.037 0.026 0.000 0.620 2013 A CB -0.512 18.502 19.000 0.023 0.000 0.819 2013 A HN 0.392 nan 8.150 nan 0.000 0.442 2014 L N -0.078 121.162 121.223 0.028 0.000 2.083 2014 L HA -0.053 4.309 4.340 0.037 0.000 0.209 2014 L C 2.746 179.637 176.870 0.035 0.000 1.083 2014 L CA 1.726 56.586 54.840 0.033 0.000 0.752 2014 L CB -0.868 41.206 42.059 0.024 0.000 0.899 2014 L HN 0.412 nan 8.230 nan 0.000 0.433 2015 G N -1.215 107.600 108.800 0.025 0.000 2.421 2015 G HA2 -0.364 3.618 3.960 0.037 0.000 0.216 2015 G HA3 -0.364 3.618 3.960 0.037 0.000 0.216 2015 G C 1.471 176.382 174.900 0.020 0.000 1.171 2015 G CA 0.918 46.029 45.100 0.020 0.000 0.775 2015 G HN 0.410 nan 8.290 nan 0.000 0.543 2016 Q N 0.637 120.450 119.800 0.021 0.000 2.029 2016 Q HA -0.174 4.188 4.340 0.037 0.000 0.209 2016 Q C 2.361 178.381 176.000 0.034 0.000 0.999 2016 Q CA 2.069 57.883 55.803 0.019 0.000 0.857 2016 Q CB -0.536 28.219 28.738 0.028 0.000 0.926 2016 Q HN 0.541 nan 8.270 nan 0.000 0.415 2017 I N 0.251 120.869 120.570 0.080 0.000 2.163 2017 I HA -0.261 3.931 4.170 0.037 0.000 0.243 2017 I C 2.404 178.611 176.117 0.151 0.000 1.085 2017 I CA 1.815 63.215 61.300 0.167 0.000 1.347 2017 I CB -0.391 37.705 38.000 0.159 0.000 1.044 2017 I HN 0.362 nan 8.210 nan 0.000 0.408 2018 E N 0.446 120.699 120.200 0.088 0.000 2.152 2018 E HA -0.171 4.201 4.350 0.037 0.000 0.192 2018 E C 1.746 178.365 176.600 0.031 0.000 0.983 2018 E CA 0.607 57.050 56.400 0.072 0.000 0.818 2018 E CB 0.003 29.734 29.700 0.052 0.000 0.758 2018 E HN 0.312 nan 8.360 nan 0.000 0.467 2019 K N 0.591 120.992 120.400 0.001 0.000 2.522 2019 K HA -0.002 4.340 4.320 0.037 0.000 0.194 2019 K C 1.336 177.881 176.600 -0.091 0.000 1.026 2019 K CA 0.240 56.508 56.287 -0.031 0.000 1.119 2019 K CB 0.306 32.791 32.500 -0.026 0.000 0.856 2019 K HN 0.122 nan 8.250 nan 0.000 0.513 2020 Q N -1.543 118.172 119.800 -0.142 0.000 2.384 2020 Q HA 0.112 4.474 4.340 0.037 0.000 0.264 2020 Q C 0.050 175.698 176.000 -0.586 0.000 0.825 2020 Q CA 0.292 55.853 55.803 -0.403 0.000 0.984 2020 Q CB 0.741 29.153 28.738 -0.544 0.000 1.183 2020 Q HN 0.163 nan 8.270 nan 0.000 0.537 2021 F N 0.013 119.969 119.950 0.010 0.000 2.775 2021 F HA 0.438 4.987 4.527 0.037 0.000 0.313 2021 F C 0.492 176.302 175.800 0.016 0.000 1.121 2021 F CA 0.239 58.247 58.000 0.013 0.000 1.206 2021 F CB 1.745 40.753 39.000 0.013 0.000 1.052 2021 F HN 0.034 nan 8.300 nan 0.000 0.524 2022 G N 0.325 109.198 108.800 0.121 0.000 2.515 2022 G HA2 -0.128 3.854 3.960 0.037 0.000 0.686 2022 G HA3 -0.128 3.854 3.960 0.037 0.000 0.686 2022 G C 0.547 175.489 174.900 0.070 0.000 1.274 2022 G CA -0.898 44.254 45.100 0.086 0.000 0.874 2022 G HN -0.104 nan 8.290 nan 0.000 0.631 2023 K N 0.113 120.542 120.400 0.049 0.000 2.052 2023 K HA -0.155 4.187 4.320 0.037 0.000 0.215 2023 K C 1.805 178.430 176.600 0.042 0.000 1.053 2023 K CA 2.152 58.462 56.287 0.038 0.000 0.934 2023 K CB -0.346 32.173 32.500 0.031 0.000 0.717 2023 K HN 1.461 nan 8.250 nan 0.000 0.450 2024 G N 0.713 109.542 108.800 0.048 0.000 4.885 2024 G HA2 0.168 4.150 3.960 0.037 0.000 0.263 2024 G HA3 0.168 4.150 3.960 0.037 0.000 0.263 2024 G C 0.751 175.681 174.900 0.051 0.000 1.168 2024 G CA 0.131 45.257 45.100 0.044 0.000 0.906 2024 G HN 0.212 nan 8.290 nan 0.000 0.575 2025 S N -0.082 115.658 115.700 0.068 0.000 2.383 2025 S HA 0.121 4.613 4.470 0.037 0.000 0.227 2025 S C 0.939 175.562 174.600 0.039 0.000 1.026 2025 S CA 0.433 58.674 58.200 0.068 0.000 0.981 2025 S CB 0.280 63.551 63.200 0.118 0.000 0.818 2025 S HN 0.468 nan 8.310 nan 0.000 0.472 2026 I N 1.725 122.321 120.570 0.042 0.000 2.498 2026 I HA 0.614 4.806 4.170 0.037 0.000 0.290 2026 I C -1.005 175.128 176.117 0.026 0.000 1.032 2026 I CA -1.349 59.967 61.300 0.027 0.000 1.073 2026 I CB 1.751 39.767 38.000 0.025 0.000 1.251 2026 I HN 0.458 nan 8.210 nan 0.000 0.426 2027 M N 4.608 124.219 119.600 0.019 0.000 2.880 2027 M HA 0.573 5.075 4.480 0.037 0.000 0.269 2027 M C -1.161 175.145 176.300 0.010 0.000 1.248 2027 M CA -1.088 54.221 55.300 0.015 0.000 0.821 2027 M CB 1.422 34.031 32.600 0.015 0.000 1.650 2027 M HN 0.277 nan 8.290 nan 0.000 0.479 2028 R N 1.183 121.687 120.500 0.006 0.000 2.449 2028 R HA 0.243 4.605 4.340 0.037 0.000 0.296 2028 R C 0.986 177.283 176.300 -0.006 0.000 1.047 2028 R CA -0.106 55.994 56.100 -0.000 0.000 1.018 2028 R CB 0.266 30.564 30.300 -0.003 0.000 0.962 2028 R HN 0.684 nan 8.270 nan 0.000 0.428 2029 L N 2.449 123.663 121.223 -0.014 0.000 2.081 2029 L HA -0.190 4.171 4.340 0.037 0.000 0.212 2029 L C 1.755 178.611 176.870 -0.024 0.000 1.080 2029 L CA 2.105 56.929 54.840 -0.026 0.000 0.754 2029 L CB -0.394 41.633 42.059 -0.054 0.000 0.893 2029 L HN 0.979 nan 8.230 nan 0.000 0.433 2030 G N -0.448 108.339 108.800 -0.022 0.000 2.471 2030 G HA2 -0.232 3.750 3.960 0.037 0.000 0.219 2030 G HA3 -0.232 3.750 3.960 0.037 0.000 0.219 2030 G C 1.234 176.128 174.900 -0.011 0.000 1.125 2030 G CA 0.751 45.840 45.100 -0.019 0.000 0.775 2030 G HN 0.710 nan 8.290 nan 0.000 0.548 2031 E N -0.457 119.739 120.200 -0.007 0.000 2.473 2031 E HA 0.067 4.439 4.350 0.037 0.000 0.204 2031 E C -0.149 176.452 176.600 0.002 0.000 0.994 2031 E CA -0.434 55.965 56.400 -0.002 0.000 0.945 2031 E CB 0.115 29.815 29.700 -0.000 0.000 0.990 2031 E HN 0.125 nan 8.360 nan 0.000 0.493 2032 D N 1.886 122.287 120.400 0.001 0.000 2.349 2032 D HA 0.006 4.668 4.640 0.037 0.000 0.266 2032 D C 0.702 177.006 176.300 0.007 0.000 1.293 2032 D CA -0.006 53.998 54.000 0.006 0.000 0.926 2032 D CB 0.749 41.552 40.800 0.005 0.000 1.090 2032 D HN -0.013 nan 8.370 nan 0.000 0.502 2033 R N 1.787 122.293 120.500 0.010 0.000 2.090 2033 R HA -0.078 4.284 4.340 0.037 0.000 0.228 2033 R C 1.988 178.298 176.300 0.016 0.000 1.110 2033 R CA 0.714 56.821 56.100 0.011 0.000 0.973 2033 R CB -0.895 29.412 30.300 0.011 0.000 0.869 2033 R HN 0.490 nan 8.270 nan 0.000 0.440 2034 S N -0.235 115.478 115.700 0.021 0.000 2.595 2034 S HA -0.083 4.409 4.470 0.037 0.000 0.235 2034 S C 1.695 176.315 174.600 0.032 0.000 0.974 2034 S CA 0.713 58.931 58.200 0.030 0.000 0.942 2034 S CB -0.048 63.176 63.200 0.039 0.000 0.766 2034 S HN 0.087 nan 8.310 nan 0.000 0.536 2035 M N 1.733 121.346 119.600 0.022 0.000 2.492 2035 M HA 0.286 4.788 4.480 0.037 0.000 0.255 2035 M C -0.395 175.913 176.300 0.013 0.000 1.139 2035 M CA 0.154 55.464 55.300 0.017 0.000 1.096 2035 M CB 0.119 32.720 32.600 0.002 0.000 1.360 2035 M HN 0.093 nan 8.290 nan 0.000 0.480 2036 D N 0.287 120.694 120.400 0.012 0.000 2.368 2036 D HA 0.128 4.790 4.640 0.037 0.000 0.240 2036 D C -0.474 175.834 176.300 0.014 0.000 1.169 2036 D CA 0.171 54.177 54.000 0.010 0.000 0.906 2036 D CB 1.091 41.896 40.800 0.009 0.000 1.187 2036 D HN -0.109 nan 8.370 nan 0.000 0.435 2037 V N 1.343 121.264 119.914 0.011 0.000 2.398 2037 V HA 0.207 4.349 4.120 0.037 0.000 0.286 2037 V C 0.373 176.472 176.094 0.008 0.000 1.026 2037 V CA -0.504 61.802 62.300 0.011 0.000 0.868 2037 V CB 1.576 33.403 31.823 0.007 0.000 0.982 2037 V HN 0.418 nan 8.190 nan 0.000 0.443 2038 E N 2.870 123.075 120.200 0.008 0.000 2.227 2038 E HA 0.676 5.048 4.350 0.037 0.000 0.268 2038 E C -0.780 175.822 176.600 0.002 0.000 0.907 2038 E CA -0.404 55.999 56.400 0.005 0.000 0.786 2038 E CB 2.328 32.032 29.700 0.006 0.000 1.191 2038 E HN 0.838 nan 8.360 nan 0.000 0.411 2039 T N 0.559 115.113 114.554 -0.000 0.000 2.916 2039 T HA 0.628 5.000 4.350 0.037 0.000 0.292 2039 T C -0.371 174.325 174.700 -0.006 0.000 1.064 2039 T CA -0.869 61.229 62.100 -0.003 0.000 1.011 2039 T CB 1.071 69.936 68.868 -0.004 0.000 1.152 2039 T HN 0.261 nan 8.240 nan 0.000 0.510 2040 I N 1.689 122.253 120.570 -0.009 0.000 2.509 2040 I HA 0.424 4.616 4.170 0.037 0.000 0.293 2040 I C 0.758 176.867 176.117 -0.014 0.000 1.020 2040 I CA -0.782 60.510 61.300 -0.014 0.000 1.088 2040 I CB 1.686 39.676 38.000 -0.017 0.000 1.267 2040 I HN 0.953 nan 8.210 nan 0.000 0.430 2041 S N 2.840 118.529 115.700 -0.018 0.000 2.558 2041 S HA 0.033 4.525 4.470 0.037 0.000 0.288 2041 S C 1.364 175.951 174.600 -0.021 0.000 1.318 2041 S CA 0.419 58.611 58.200 -0.013 0.000 1.056 2041 S CB 0.374 63.560 63.200 -0.023 0.000 0.853 2041 S HN 0.814 nan 8.310 nan 0.000 0.505 2042 T N 1.524 116.070 114.554 -0.015 0.000 3.100 2042 T HA 0.342 4.714 4.350 0.037 0.000 0.253 2042 T C 1.508 176.177 174.700 -0.051 0.000 1.118 2042 T CA 0.639 62.722 62.100 -0.028 0.000 1.058 2042 T CB -0.374 68.478 68.868 -0.027 0.000 0.953 2042 T HN 1.655 nan 8.240 nan 0.000 0.515 2043 G N 0.754 109.532 108.800 -0.035 0.000 2.199 2043 G HA2 -0.242 3.740 3.960 0.037 0.000 0.254 2043 G HA3 -0.242 3.740 3.960 0.037 0.000 0.254 2043 G C 0.192 175.107 174.900 0.025 0.000 0.982 2043 G CA 0.222 45.294 45.100 -0.046 0.000 0.632 2043 G HN 1.090 nan 8.290 nan 0.000 0.529 2044 S N -0.248 115.398 115.700 -0.090 0.000 2.498 2044 S HA 0.635 5.127 4.470 0.037 0.000 0.317 2044 S C 1.149 175.654 174.600 -0.157 0.000 1.090 2044 S CA 0.018 58.060 58.200 -0.264 0.000 1.089 2044 S CB 1.494 64.330 63.200 -0.607 0.000 0.997 2044 S HN 0.926 nan 8.310 nan 0.000 0.470 2045 L N 5.783 126.792 121.223 -0.357 0.000 2.027 2045 L HA 0.034 4.396 4.340 0.037 0.000 0.206 2045 L C 2.569 179.334 176.870 -0.173 0.000 1.074 2045 L CA 2.684 57.325 54.840 -0.332 0.000 0.745 2045 L CB -0.987 40.634 42.059 -0.731 0.000 0.898 2045 L HN 0.893 nan 8.230 nan 0.000 0.433 2046 S N -1.113 114.495 115.700 -0.154 0.000 2.402 2046 S HA -0.204 4.288 4.470 0.037 0.000 0.229 2046 S C 2.103 176.710 174.600 0.011 0.000 1.021 2046 S CA 1.371 59.547 58.200 -0.040 0.000 0.974 2046 S CB -1.025 62.187 63.200 0.020 0.000 0.800 2046 S HN 0.498 nan 8.310 nan 0.000 0.484 2047 L N 1.402 122.637 121.223 0.019 0.000 2.093 2047 L HA -0.097 4.265 4.340 0.037 0.000 0.208 2047 L C 1.891 178.764 176.870 0.005 0.000 1.085 2047 L CA 1.708 56.574 54.840 0.043 0.000 0.755 2047 L CB -0.440 41.652 42.059 0.055 0.000 0.904 2047 L HN 0.197 nan 8.230 nan 0.000 0.435 2048 D N -0.025 120.367 120.400 -0.013 0.000 2.178 2048 D HA -0.171 4.491 4.640 0.037 0.000 0.201 2048 D C 2.175 178.471 176.300 -0.006 0.000 0.980 2048 D CA 1.337 55.333 54.000 -0.006 0.000 0.842 2048 D CB -0.008 40.795 40.800 0.005 0.000 0.948 2048 D HN 0.395 nan 8.370 nan 0.000 0.472 2049 I N 0.984 121.549 120.570 -0.010 0.000 2.233 2049 I HA -0.187 4.005 4.170 0.037 0.000 0.243 2049 I C 2.460 178.577 176.117 0.001 0.000 1.093 2049 I CA 0.903 62.201 61.300 -0.004 0.000 1.380 2049 I CB -0.196 37.800 38.000 -0.007 0.000 1.067 2049 I HN -0.101 nan 8.210 nan 0.000 0.413 2050 A N 0.699 123.521 122.820 0.004 0.000 1.978 2050 A HA -0.145 4.197 4.320 0.037 0.000 0.220 2050 A C 2.259 179.833 177.584 -0.016 0.000 1.170 2050 A CA 1.356 53.395 52.037 0.003 0.000 0.636 2050 A CB -0.860 18.149 19.000 0.015 0.000 0.810 2050 A HN 0.422 nan 8.150 nan 0.000 0.448 2051 L N -1.632 119.579 121.223 -0.020 0.000 2.376 2051 L HA 0.020 4.382 4.340 0.037 0.000 0.219 2051 L C 2.222 179.068 176.870 -0.041 0.000 1.133 2051 L CA 0.668 55.486 54.840 -0.038 0.000 0.816 2051 L CB -0.428 41.613 42.059 -0.029 0.000 0.933 2051 L HN 0.627 nan 8.230 nan 0.000 0.449 2052 G N -0.102 108.684 108.800 -0.023 0.000 3.078 2052 G HA2 -0.460 3.522 3.960 0.037 0.000 0.227 2052 G HA3 -0.460 3.522 3.960 0.037 0.000 0.227 2052 G C 1.169 176.063 174.900 -0.009 0.000 1.306 2052 G CA 0.636 45.727 45.100 -0.015 0.000 0.841 2052 G HN 0.453 nan 8.290 nan 0.000 0.530 2053 A N 0.181 122.990 122.820 -0.018 0.000 2.119 2053 A HA 0.514 4.856 4.320 0.037 0.000 0.216 2053 A C 2.760 180.342 177.584 -0.003 0.000 1.152 2053 A CA 2.240 54.271 52.037 -0.010 0.000 0.708 2053 A CB -0.529 18.460 19.000 -0.018 0.000 0.805 2053 A HN 2.679 nan 8.150 nan 0.000 0.460 2054 G N -3.291 105.506 108.800 -0.004 0.000 2.179 2054 G HA2 0.318 4.300 3.960 0.037 0.000 0.220 2054 G HA3 0.318 4.300 3.960 0.037 0.000 0.220 2054 G C 0.830 175.731 174.900 0.002 0.000 0.990 2054 G CA 0.307 45.409 45.100 0.003 0.000 0.646 2054 G HN 2.100 nan 8.290 nan 0.000 0.517 2055 G N -1.372 107.425 108.800 -0.005 0.000 2.317 2055 G HA2 0.533 4.515 3.960 0.037 0.000 0.293 2055 G HA3 0.533 4.515 3.960 0.037 0.000 0.293 2055 G C -0.909 173.985 174.900 -0.011 0.000 1.287 2055 G CA -0.495 44.601 45.100 -0.007 0.000 0.850 2055 G HN 0.843 nan 8.290 nan 0.000 0.515 2056 L N 1.978 123.195 121.223 -0.010 0.000 2.371 2056 L HA 0.423 4.785 4.340 0.037 0.000 0.272 2056 L C -1.774 175.092 176.870 -0.007 0.000 1.124 2056 L CA -1.673 53.161 54.840 -0.010 0.000 0.816 2056 L CB 1.507 43.562 42.059 -0.007 0.000 1.129 2056 L HN 0.301 nan 8.230 nan 0.000 0.448 2057 P HA 0.136 nan 4.420 nan 0.000 0.282 2057 P C -0.728 176.576 177.300 0.007 0.000 1.262 2057 P CA -0.472 62.629 63.100 0.001 0.000 0.773 2057 P CB 0.930 32.631 31.700 0.002 0.000 0.879 2058 M N 2.118 121.722 119.600 0.007 0.000 2.245 2058 M HA 0.195 4.697 4.480 0.037 0.000 0.344 2058 M C 1.589 177.900 176.300 0.019 0.000 1.170 2058 M CA 0.866 56.171 55.300 0.008 0.000 1.135 2058 M CB -0.601 32.003 32.600 0.006 0.000 1.574 2058 M HN 0.831 nan 8.290 nan 0.000 0.452 2059 G N 2.567 111.377 108.800 0.018 0.000 2.153 2059 G HA2 -0.211 3.771 3.960 0.037 0.000 0.252 2059 G HA3 -0.211 3.771 3.960 0.037 0.000 0.252 2059 G C 0.226 175.153 174.900 0.045 0.000 0.994 2059 G CA 0.031 45.148 45.100 0.028 0.000 0.698 2059 G HN 0.561 nan 8.290 nan 0.000 0.521 2060 R N -0.994 119.532 120.500 0.043 0.000 2.939 2060 R HA 0.781 5.143 4.340 0.037 0.000 0.254 2060 R C 0.043 176.386 176.300 0.072 0.000 1.123 2060 R CA -1.100 55.039 56.100 0.065 0.000 1.020 2060 R CB 0.831 31.163 30.300 0.055 0.000 1.206 2060 R HN 0.196 nan 8.270 nan 0.000 0.491 2061 I N 0.793 121.429 120.570 0.109 0.000 2.412 2061 I HA 0.364 4.556 4.170 0.037 0.000 0.296 2061 I C -0.417 175.779 176.117 0.133 0.000 0.987 2061 I CA -0.856 60.534 61.300 0.150 0.000 1.180 2061 I CB 1.943 40.076 38.000 0.222 0.000 1.340 2061 I HN -0.017 nan 8.210 nan 0.000 0.455 2062 V N 5.334 125.330 119.914 0.137 0.000 2.656 2062 V HA 0.395 4.537 4.120 0.037 0.000 0.307 2062 V C -0.445 175.749 176.094 0.167 0.000 1.051 2062 V CA -0.685 61.681 62.300 0.109 0.000 0.893 2062 V CB 2.020 33.875 31.823 0.053 0.000 0.999 2062 V HN 0.732 nan 8.190 nan 0.000 0.426 2063 E N 3.831 124.118 120.200 0.144 0.000 2.187 2063 E HA 0.667 5.039 4.350 0.037 0.000 0.268 2063 E C -1.559 175.119 176.600 0.131 0.000 0.896 2063 E CA -0.628 55.877 56.400 0.175 0.000 0.766 2063 E CB 1.704 31.509 29.700 0.175 0.000 1.142 2063 E HN 0.649 nan 8.360 nan 0.000 0.408 2064 I N 5.393 126.038 120.570 0.126 0.000 2.406 2064 I HA 0.346 4.538 4.170 0.037 0.000 0.290 2064 I C -0.911 175.281 176.117 0.124 0.000 0.999 2064 I CA -0.979 60.355 61.300 0.056 0.000 1.124 2064 I CB 0.852 38.876 38.000 0.040 0.000 1.289 2064 I HN 0.511 nan 8.210 nan 0.000 0.441 2065 Y N 3.983 124.311 120.300 0.047 0.000 2.605 2065 Y HA 1.005 5.576 4.550 0.036 0.000 0.343 2065 Y C -0.171 175.772 175.900 0.073 0.000 1.036 2065 Y CA -1.156 56.972 58.100 0.046 0.000 1.065 2065 Y CB 1.973 40.444 38.460 0.019 0.000 1.288 2065 Y HN 0.674 nan 8.280 nan 0.000 0.481 2066 G N 0.606 109.584 108.800 0.296 0.000 2.338 2066 G HA2 0.443 4.425 3.960 0.037 0.000 0.295 2066 G HA3 0.443 4.425 3.960 0.037 0.000 0.295 2066 G C -3.526 171.583 174.900 0.349 0.000 1.461 2066 G CA -1.356 43.884 45.100 0.234 0.000 0.817 2066 G HN 0.492 nan 8.290 nan 0.000 0.556 2067 P HA 0.245 nan 4.420 nan 0.000 0.272 2067 P C -0.184 177.145 177.300 0.049 0.000 1.248 2067 P CA -0.126 63.098 63.100 0.207 0.000 0.799 2067 P CB 0.266 32.011 31.700 0.074 0.000 0.997 2068 E N -0.787 119.104 120.200 -0.515 0.000 2.383 2068 E HA 0.258 4.630 4.350 0.037 0.000 0.264 2068 E C 0.076 176.572 176.600 -0.172 0.000 1.050 2068 E CA -0.429 55.630 56.400 -0.567 0.000 0.896 2068 E CB -0.414 28.696 29.700 -0.983 0.000 0.982 2068 E HN 0.247 nan 8.360 nan 0.000 0.424 2069 S N 0.344 116.004 115.700 -0.068 0.000 3.614 2069 S HA -0.221 4.270 4.470 0.037 0.000 0.360 2069 S C 0.943 175.581 174.600 0.062 0.000 1.023 2069 S CA 0.901 59.100 58.200 -0.002 0.000 1.114 2069 S CB -1.613 61.562 63.200 -0.041 0.000 0.907 2069 S HN 0.732 nan 8.310 nan 0.000 0.470 2070 S N -0.504 115.243 115.700 0.078 0.000 2.470 2070 S HA 0.460 4.952 4.470 0.037 0.000 0.222 2070 S C 1.553 176.218 174.600 0.110 0.000 1.024 2070 S CA 0.897 59.150 58.200 0.087 0.000 0.931 2070 S CB 0.689 63.937 63.200 0.079 0.000 0.791 2070 S HN 1.828 nan 8.310 nan 0.000 0.513 2071 G N 0.960 109.840 108.800 0.134 0.000 2.370 2071 G HA2 -0.120 3.862 3.960 0.037 0.000 0.174 2071 G HA3 -0.120 3.862 3.960 0.037 0.000 0.174 2071 G C 0.674 175.672 174.900 0.162 0.000 1.002 2071 G CA 0.082 45.283 45.100 0.168 0.000 0.730 2071 G HN 0.397 nan 8.290 nan 0.000 0.497 2072 K N 0.495 120.981 120.400 0.143 0.000 1.987 2072 K HA -0.109 4.233 4.320 0.037 0.000 0.216 2072 K C 2.589 179.279 176.600 0.149 0.000 1.051 2072 K CA 2.219 58.586 56.287 0.134 0.000 0.942 2072 K CB -0.609 31.971 32.500 0.134 0.000 0.722 2072 K HN 0.315 nan 8.250 nan 0.000 0.444 2073 T N 0.983 115.637 114.554 0.167 0.000 2.607 2073 T HA -0.201 4.171 4.350 0.037 0.000 0.267 2073 T C 2.109 176.929 174.700 0.201 0.000 1.049 2073 T CA 2.143 64.368 62.100 0.209 0.000 1.162 2073 T CB -0.858 68.132 68.868 0.204 0.000 0.863 2073 T HN 0.276 nan 8.240 nan 0.000 0.424 2074 T N 2.357 117.034 114.554 0.206 0.000 2.597 2074 T HA -0.112 4.260 4.350 0.037 0.000 0.267 2074 T C 1.938 176.722 174.700 0.141 0.000 1.053 2074 T CA 1.499 63.727 62.100 0.212 0.000 1.165 2074 T CB -0.720 68.311 68.868 0.273 0.000 0.863 2074 T HN 0.245 nan 8.240 nan 0.000 0.427 2075 L N 0.320 121.631 121.223 0.146 0.000 2.013 2075 L HA -0.205 4.157 4.340 0.037 0.000 0.212 2075 L C 2.678 179.593 176.870 0.074 0.000 1.073 2075 L CA 1.757 56.660 54.840 0.104 0.000 0.753 2075 L CB -0.820 41.320 42.059 0.134 0.000 0.890 2075 L HN 0.281 nan 8.230 nan 0.000 0.432 2076 T N 0.332 114.948 114.554 0.104 0.000 2.624 2076 T HA -0.270 4.102 4.350 0.037 0.000 0.268 2076 T C 1.830 176.592 174.700 0.103 0.000 1.041 2076 T CA 2.117 64.283 62.100 0.109 0.000 1.159 2076 T CB -0.388 68.578 68.868 0.165 0.000 0.863 2076 T HN 0.312 nan 8.240 nan 0.000 0.434 2077 L N 0.892 122.178 121.223 0.106 0.000 2.079 2077 L HA -0.148 4.214 4.340 0.037 0.000 0.210 2077 L C 2.983 179.845 176.870 -0.014 0.000 1.081 2077 L CA 1.129 55.990 54.840 0.035 0.000 0.752 2077 L CB -0.620 41.428 42.059 -0.018 0.000 0.896 2077 L HN 0.280 nan 8.230 nan 0.000 0.433 2078 Q N -0.288 119.502 119.800 -0.017 0.000 2.170 2078 Q HA -0.165 4.197 4.340 0.037 0.000 0.203 2078 Q C 2.423 178.390 176.000 -0.055 0.000 0.976 2078 Q CA 1.916 57.686 55.803 -0.055 0.000 0.858 2078 Q CB -0.478 28.222 28.738 -0.063 0.000 0.907 2078 Q HN 0.626 nan 8.270 nan 0.000 0.433 2079 V N -1.754 118.144 119.914 -0.026 0.000 2.591 2079 V HA -0.124 4.018 4.120 0.037 0.000 0.249 2079 V C 2.065 178.144 176.094 -0.025 0.000 1.053 2079 V CA 0.879 63.163 62.300 -0.027 0.000 1.068 2079 V CB -0.499 31.317 31.823 -0.012 0.000 0.689 2079 V HN 0.155 nan 8.190 nan 0.000 0.462 2080 I N 1.430 121.996 120.570 -0.007 0.000 2.142 2080 I HA -0.157 4.035 4.170 0.037 0.000 0.240 2080 I C 3.038 179.135 176.117 -0.034 0.000 1.078 2080 I CA 1.814 63.110 61.300 -0.005 0.000 1.343 2080 I CB -0.816 37.198 38.000 0.024 0.000 1.046 2080 I HN 0.404 nan 8.210 nan 0.000 0.405 2081 A N 0.902 123.690 122.820 -0.052 0.000 1.873 2081 A HA -0.285 4.057 4.320 0.037 0.000 0.218 2081 A C 2.561 180.096 177.584 -0.081 0.000 1.193 2081 A CA 2.400 54.393 52.037 -0.074 0.000 0.629 2081 A CB -1.144 17.799 19.000 -0.095 0.000 0.826 2081 A HN 0.460 nan 8.150 nan 0.000 0.447 2082 A N -0.352 122.414 122.820 -0.089 0.000 1.892 2082 A HA 0.065 4.407 4.320 0.037 0.000 0.218 2082 A C 2.532 180.072 177.584 -0.073 0.000 1.188 2082 A CA 2.600 54.578 52.037 -0.099 0.000 0.631 2082 A CB -1.127 17.813 19.000 -0.100 0.000 0.822 2082 A HN 1.237 nan 8.150 nan 0.000 0.447 2083 A N -1.223 121.565 122.820 -0.053 0.000 1.969 2083 A HA -0.163 4.179 4.320 0.037 0.000 0.218 2083 A C 2.100 179.661 177.584 -0.039 0.000 1.169 2083 A CA 1.554 53.566 52.037 -0.040 0.000 0.635 2083 A CB -0.458 18.525 19.000 -0.029 0.000 0.810 2083 A HN 0.669 nan 8.150 nan 0.000 0.445 2084 Q N -1.309 118.466 119.800 -0.042 0.000 2.172 2084 Q HA -0.087 4.275 4.340 0.037 0.000 0.200 2084 Q C 2.240 178.212 176.000 -0.045 0.000 0.964 2084 Q CA 1.066 56.846 55.803 -0.040 0.000 0.855 2084 Q CB -0.057 28.657 28.738 -0.041 0.000 0.918 2084 Q HN 0.541 nan 8.270 nan 0.000 0.444 2085 R N 1.124 121.590 120.500 -0.058 0.000 2.152 2085 R HA -0.123 4.239 4.340 0.037 0.000 0.232 2085 R C 1.000 177.268 176.300 -0.053 0.000 1.117 2085 R CA 1.223 57.285 56.100 -0.062 0.000 0.981 2085 R CB 0.206 30.455 30.300 -0.085 0.000 0.870 2085 R HN 0.280 nan 8.270 nan 0.000 0.451 2086 E N -1.622 118.549 120.200 -0.048 0.000 2.479 2086 E HA 0.189 4.561 4.350 0.037 0.000 0.193 2086 E C 0.435 177.017 176.600 -0.030 0.000 1.049 2086 E CA 0.394 56.771 56.400 -0.038 0.000 0.870 2086 E CB 0.794 30.473 29.700 -0.036 0.000 0.944 2086 E HN 0.408 nan 8.360 nan 0.000 0.492 2087 G N 2.140 110.922 108.800 -0.030 0.000 2.171 2087 G HA2 -0.285 3.697 3.960 0.037 0.000 0.238 2087 G HA3 -0.285 3.697 3.960 0.037 0.000 0.238 2087 G C -0.131 174.757 174.900 -0.020 0.000 1.039 2087 G CA -0.125 44.961 45.100 -0.024 0.000 0.759 2087 G HN 0.120 nan 8.290 nan 0.000 0.501 2088 K N 0.376 120.763 120.400 -0.022 0.000 2.098 2088 K HA 0.538 4.880 4.320 0.037 0.000 0.261 2088 K C 0.265 176.856 176.600 -0.016 0.000 0.987 2088 K CA -0.315 55.961 56.287 -0.018 0.000 0.916 2088 K CB 0.950 33.439 32.500 -0.018 0.000 1.039 2088 K HN 0.113 nan 8.250 nan 0.000 0.455 2089 T N 1.765 116.311 114.554 -0.013 0.000 2.817 2089 T HA 0.247 4.619 4.350 0.037 0.000 0.293 2089 T C -0.190 174.505 174.700 -0.009 0.000 0.964 2089 T CA -0.533 61.561 62.100 -0.010 0.000 1.085 2089 T CB 0.116 68.979 68.868 -0.008 0.000 0.921 2089 T HN 0.520 nan 8.240 nan 0.000 0.502 2090 C N 2.380 121.677 119.300 -0.004 0.000 2.562 2090 C HA 0.980 5.462 4.460 0.037 0.000 0.332 2090 C C 0.423 175.423 174.990 0.017 0.000 1.201 2090 C CA -0.943 58.078 59.018 0.005 0.000 1.803 2090 C CB 0.878 28.627 27.740 0.015 0.000 2.328 2090 C HN 1.047 nan 8.230 nan 0.000 0.500 2091 A N 1.060 123.893 122.820 0.020 0.000 2.475 2091 A HA 0.869 5.211 4.320 0.037 0.000 0.301 2091 A C -1.500 176.128 177.584 0.073 0.000 1.059 2091 A CA -0.253 51.804 52.037 0.033 0.000 0.710 2091 A CB 1.112 20.105 19.000 -0.012 0.000 1.288 2091 A HN 0.818 nan 8.150 nan 0.000 0.408 2092 F N 2.671 122.580 119.950 -0.069 0.000 2.529 2092 F HA 0.650 5.199 4.527 0.037 0.000 0.320 2092 F C -0.865 174.884 175.800 -0.086 0.000 1.118 2092 F CA -0.879 57.075 58.000 -0.076 0.000 0.915 2092 F CB 1.608 40.573 39.000 -0.058 0.000 1.161 2092 F HN 0.369 nan 8.300 nan 0.000 0.445 2093 I N 4.683 125.000 120.570 -0.421 0.000 2.412 2093 I HA 0.140 4.332 4.170 0.037 0.000 0.279 2093 I C -0.320 175.629 176.117 -0.279 0.000 1.063 2093 I CA -0.449 60.695 61.300 -0.260 0.000 1.193 2093 I CB 0.574 38.419 38.000 -0.259 0.000 1.370 2093 I HN 0.517 nan 8.210 nan 0.000 0.479 2094 D N 4.900 125.288 120.400 -0.020 0.000 2.801 2094 D HA 0.314 4.976 4.640 0.037 0.000 0.232 2094 D C 1.413 177.641 176.300 -0.120 0.000 1.128 2094 D CA 0.036 54.075 54.000 0.065 0.000 1.003 2094 D CB 0.703 41.629 40.800 0.210 0.000 1.110 2094 D HN 0.590 nan 8.370 nan 0.000 0.477 2095 A N 1.650 124.420 122.820 -0.084 0.000 2.019 2095 A HA -0.150 4.192 4.320 0.037 0.000 0.219 2095 A C 1.955 179.653 177.584 0.190 0.000 1.164 2095 A CA 0.886 52.931 52.037 0.013 0.000 0.644 2095 A CB -0.259 18.755 19.000 0.022 0.000 0.805 2095 A HN 0.502 nan 8.150 nan 0.000 0.449 2096 E N -1.089 119.176 120.200 0.107 0.000 2.418 2096 E HA -0.101 4.271 4.350 0.037 0.000 0.197 2096 E C -0.504 176.252 176.600 0.260 0.000 1.026 2096 E CA 0.054 56.529 56.400 0.126 0.000 0.862 2096 E CB -0.171 29.532 29.700 0.006 0.000 0.799 2096 E HN 0.692 nan 8.360 nan 0.000 0.518 2097 H N -2.018 117.109 119.070 0.096 0.000 2.677 2097 H HA -0.216 4.362 4.556 0.037 0.000 0.321 2097 H C 0.122 175.502 175.328 0.087 0.000 1.171 2097 H CA 0.513 56.618 56.048 0.096 0.000 1.139 2097 H CB -1.228 28.591 29.762 0.095 0.000 1.515 2097 H HN 0.292 nan 8.280 nan 0.000 0.423 2098 A N 0.451 123.359 122.820 0.146 0.000 2.664 2098 A HA 0.170 4.512 4.320 0.037 0.000 0.222 2098 A C 0.608 178.230 177.584 0.063 0.000 1.320 2098 A CA -0.223 51.877 52.037 0.104 0.000 1.029 2098 A CB 0.674 19.730 19.000 0.093 0.000 1.318 2098 A HN 0.176 nan 8.150 nan 0.000 0.589 2099 L N 1.645 122.903 121.223 0.059 0.000 2.513 2099 L HA 0.368 4.730 4.340 0.037 0.000 0.272 2099 L C -0.500 176.352 176.870 -0.029 0.000 1.187 2099 L CA 0.285 55.115 54.840 -0.017 0.000 0.895 2099 L CB 0.282 42.254 42.059 -0.145 0.000 1.147 2099 L HN 0.211 nan 8.230 nan 0.000 0.483 2100 D N 7.491 127.885 120.400 -0.010 0.000 2.359 2100 D HA 0.299 4.961 4.640 0.037 0.000 0.230 2100 D C -1.739 174.567 176.300 0.010 0.000 1.118 2100 D CA -2.288 51.719 54.000 0.012 0.000 0.844 2100 D CB 1.466 42.285 40.800 0.031 0.000 1.059 2100 D HN 0.389 nan 8.370 nan 0.000 0.493 2101 P HA -0.177 nan 4.420 nan 0.000 0.215 2101 P C 1.602 178.893 177.300 -0.015 0.000 1.157 2101 P CA 0.875 63.951 63.100 -0.040 0.000 0.874 2101 P CB 0.435 32.115 31.700 -0.034 0.000 0.790 2102 I N -1.526 119.055 120.570 0.018 0.000 2.179 2102 I HA -0.250 3.942 4.170 0.037 0.000 0.242 2102 I C 2.776 178.926 176.117 0.055 0.000 1.088 2102 I CA 1.478 62.795 61.300 0.029 0.000 1.357 2102 I CB -1.383 36.642 38.000 0.041 0.000 1.051 2102 I HN -0.142 nan 8.210 nan 0.000 0.409 2103 Y N 1.400 121.680 120.300 -0.034 0.000 2.224 2103 Y HA -0.220 4.352 4.550 0.036 0.000 0.289 2103 Y C 2.486 178.362 175.900 -0.039 0.000 1.146 2103 Y CA 1.196 59.281 58.100 -0.026 0.000 1.182 2103 Y CB -0.468 37.980 38.460 -0.020 0.000 0.983 2103 Y HN 0.122 nan 8.280 nan 0.000 0.524 2104 A N 0.637 123.428 122.820 -0.049 0.000 1.908 2104 A HA -0.231 4.111 4.320 0.037 0.000 0.218 2104 A C 2.431 179.913 177.584 -0.170 0.000 1.181 2104 A CA 1.869 53.816 52.037 -0.150 0.000 0.627 2104 A CB -0.782 18.129 19.000 -0.147 0.000 0.818 2104 A HN 0.499 nan 8.150 nan 0.000 0.445 2105 R N -0.055 120.373 120.500 -0.120 0.000 2.092 2105 R HA -0.094 4.268 4.340 0.037 0.000 0.231 2105 R C 1.941 178.167 176.300 -0.124 0.000 1.119 2105 R CA 1.599 57.638 56.100 -0.102 0.000 0.970 2105 R CB -0.261 30.001 30.300 -0.064 0.000 0.864 2105 R HN 0.530 nan 8.270 nan 0.000 0.440 2106 K N 0.348 120.657 120.400 -0.151 0.000 2.211 2106 K HA -0.100 4.242 4.320 0.037 0.000 0.204 2106 K C 1.938 178.402 176.600 -0.226 0.000 1.047 2106 K CA 1.026 57.214 56.287 -0.165 0.000 0.935 2106 K CB -0.035 32.370 32.500 -0.158 0.000 0.728 2106 K HN 0.263 nan 8.250 nan 0.000 0.452 2107 L N -0.523 120.509 121.223 -0.318 0.000 2.492 2107 L HA 0.036 4.398 4.340 0.037 0.000 0.223 2107 L C 1.018 177.783 176.870 -0.174 0.000 1.132 2107 L CA 0.527 55.199 54.840 -0.279 0.000 0.850 2107 L CB -0.029 41.830 42.059 -0.334 0.000 0.966 2107 L HN 0.443 nan 8.230 nan 0.000 0.454 2108 G N 0.240 108.951 108.800 -0.148 0.000 2.145 2108 G HA2 -0.191 3.791 3.960 0.037 0.000 0.176 2108 G HA3 -0.191 3.791 3.960 0.037 0.000 0.176 2108 G C -0.075 174.764 174.900 -0.102 0.000 1.013 2108 G CA -0.244 44.788 45.100 -0.112 0.000 0.689 2108 G HN 0.041 nan 8.290 nan 0.000 0.506 2109 V N 0.645 120.495 119.914 -0.107 0.000 2.607 2109 V HA 0.468 4.610 4.120 0.037 0.000 0.289 2109 V C 0.525 176.573 176.094 -0.076 0.000 1.053 2109 V CA -0.444 61.801 62.300 -0.091 0.000 0.996 2109 V CB 1.823 33.583 31.823 -0.105 0.000 0.995 2109 V HN 0.344 nan 8.190 nan 0.000 0.476 2110 D N 3.707 124.069 120.400 -0.062 0.000 2.402 2110 D HA 0.134 4.796 4.640 0.037 0.000 0.235 2110 D C 1.046 177.316 176.300 -0.049 0.000 1.226 2110 D CA -0.264 53.705 54.000 -0.051 0.000 0.918 2110 D CB 0.541 41.316 40.800 -0.042 0.000 1.043 2110 D HN 0.287 nan 8.370 nan 0.000 0.506 2111 I N 2.626 123.165 120.570 -0.052 0.000 2.226 2111 I HA -0.208 3.984 4.170 0.037 0.000 0.245 2111 I C 1.370 177.465 176.117 -0.038 0.000 1.100 2111 I CA 0.902 62.170 61.300 -0.053 0.000 1.374 2111 I CB -0.711 37.258 38.000 -0.051 0.000 1.057 2111 I HN 0.342 nan 8.210 nan 0.000 0.413 2112 D N 0.592 120.973 120.400 -0.031 0.000 2.263 2112 D HA -0.126 4.536 4.640 0.037 0.000 0.208 2112 D C 1.712 178.001 176.300 -0.018 0.000 0.971 2112 D CA 0.906 54.893 54.000 -0.022 0.000 0.867 2112 D CB -0.242 40.547 40.800 -0.020 0.000 0.929 2112 D HN 0.437 nan 8.370 nan 0.000 0.492 2113 N N -0.214 118.473 118.700 -0.021 0.000 2.197 2113 N HA 0.029 4.791 4.740 0.037 0.000 0.201 2113 N C 0.037 175.539 175.510 -0.013 0.000 1.148 2113 N CA -0.182 52.859 53.050 -0.016 0.000 0.883 2113 N CB 1.388 39.864 38.487 -0.017 0.000 1.012 2113 N HN 0.131 nan 8.380 nan 0.000 0.507 2114 L N 3.257 124.469 121.223 -0.018 0.000 2.385 2114 L HA 0.261 4.623 4.340 0.037 0.000 0.281 2114 L C -0.134 176.737 176.870 0.003 0.000 1.106 2114 L CA 0.076 54.910 54.840 -0.010 0.000 0.856 2114 L CB 0.073 42.114 42.059 -0.030 0.000 1.186 2114 L HN 0.015 nan 8.230 nan 0.000 0.453 2115 L N 5.367 126.599 121.223 0.015 0.000 2.456 2115 L HA 0.126 4.488 4.340 0.037 0.000 0.272 2115 L C 0.119 177.018 176.870 0.048 0.000 1.189 2115 L CA 0.162 55.014 54.840 0.022 0.000 0.846 2115 L CB 1.004 43.072 42.059 0.016 0.000 1.111 2115 L HN 0.740 nan 8.230 nan 0.000 0.475 2116 C N 2.774 122.099 119.300 0.041 0.000 2.891 2116 C HA 0.670 5.152 4.460 0.037 0.000 0.342 2116 C C -0.515 174.497 174.990 0.036 0.000 1.126 2116 C CA -0.426 58.633 59.018 0.069 0.000 1.322 2116 C CB 1.603 29.371 27.740 0.047 0.000 1.763 2116 C HN 0.824 nan 8.230 nan 0.000 0.491 2117 S N 3.683 119.402 115.700 0.031 0.000 2.575 2117 S HA 0.561 5.053 4.470 0.037 0.000 0.278 2117 S C -1.397 173.168 174.600 -0.057 0.000 1.139 2117 S CA -0.291 57.900 58.200 -0.016 0.000 0.954 2117 S CB 1.479 64.656 63.200 -0.039 0.000 1.054 2117 S HN 0.859 nan 8.310 nan 0.000 0.483 2118 Q N 4.783 124.527 119.800 -0.093 0.000 2.465 2118 Q HA 0.360 4.722 4.340 0.037 0.000 0.237 2118 Q C -2.297 173.640 176.000 -0.105 0.000 1.051 2118 Q CA -1.903 53.757 55.803 -0.238 0.000 0.874 2118 Q CB 1.327 29.846 28.738 -0.365 0.000 1.207 2118 Q HN 0.500 nan 8.270 nan 0.000 0.508 2119 P HA 0.112 nan 4.420 nan 0.000 0.276 2119 P C -0.390 176.958 177.300 0.079 0.000 1.252 2119 P CA -0.255 62.819 63.100 -0.044 0.000 0.802 2119 P CB 1.438 33.066 31.700 -0.120 0.000 1.035 2120 D N -0.940 119.488 120.400 0.046 0.000 2.269 2120 D HA -0.002 4.660 4.640 0.037 0.000 0.220 2120 D C 1.009 177.339 176.300 0.049 0.000 0.962 2120 D CA 1.426 55.474 54.000 0.081 0.000 0.884 2120 D CB -0.289 40.557 40.800 0.078 0.000 1.023 2120 D HN 0.506 nan 8.370 nan 0.000 0.484 2121 T N -2.714 111.846 114.554 0.010 0.000 2.948 2121 T HA 0.534 4.906 4.350 0.037 0.000 0.285 2121 T C 1.389 176.072 174.700 -0.029 0.000 1.019 2121 T CA -0.290 61.809 62.100 -0.001 0.000 1.013 2121 T CB 1.913 70.786 68.868 0.010 0.000 1.117 2121 T HN -0.030 nan 8.240 nan 0.000 0.533 2122 G N 0.118 108.905 108.800 -0.021 0.000 2.394 2122 G HA2 -0.073 3.909 3.960 0.037 0.000 0.215 2122 G HA3 -0.073 3.909 3.960 0.037 0.000 0.215 2122 G C 1.161 176.034 174.900 -0.044 0.000 1.165 2122 G CA 0.541 45.627 45.100 -0.025 0.000 0.784 2122 G HN 0.797 nan 8.290 nan 0.000 0.535 2123 E N 0.083 120.262 120.200 -0.035 0.000 2.085 2123 E HA -0.151 4.221 4.350 0.037 0.000 0.194 2123 E C 2.389 178.940 176.600 -0.082 0.000 0.994 2123 E CA 1.310 57.696 56.400 -0.023 0.000 0.801 2123 E CB -0.227 29.485 29.700 0.020 0.000 0.743 2123 E HN 0.643 nan 8.360 nan 0.000 0.453 2124 Q N 0.332 120.022 119.800 -0.182 0.000 2.030 2124 Q HA -0.248 4.114 4.340 0.037 0.000 0.204 2124 Q C 2.181 177.881 176.000 -0.499 0.000 0.986 2124 Q CA 1.845 57.284 55.803 -0.607 0.000 0.843 2124 Q CB -0.268 28.091 28.738 -0.632 0.000 0.904 2124 Q HN 0.303 nan 8.270 nan 0.000 0.420 2125 A N 0.692 123.349 122.820 -0.271 0.000 1.892 2125 A HA -0.217 4.125 4.320 0.037 0.000 0.218 2125 A C 2.074 179.577 177.584 -0.134 0.000 1.188 2125 A CA 1.819 53.746 52.037 -0.182 0.000 0.631 2125 A CB -0.851 18.089 19.000 -0.101 0.000 0.822 2125 A HN 0.477 nan 8.150 nan 0.000 0.447 2126 L N -1.222 119.952 121.223 -0.082 0.000 2.072 2126 L HA -0.099 4.263 4.340 0.037 0.000 0.205 2126 L C 2.637 179.490 176.870 -0.030 0.000 1.079 2126 L CA 1.056 55.880 54.840 -0.025 0.000 0.752 2126 L CB -0.525 41.540 42.059 0.009 0.000 0.906 2126 L HN 0.273 nan 8.230 nan 0.000 0.436 2127 E N 0.517 120.694 120.200 -0.038 0.000 2.118 2127 E HA -0.217 4.155 4.350 0.037 0.000 0.195 2127 E C 2.278 178.889 176.600 0.018 0.000 0.992 2127 E CA 1.349 57.766 56.400 0.029 0.000 0.804 2127 E CB -0.188 29.597 29.700 0.142 0.000 0.741 2127 E HN 0.490 nan 8.360 nan 0.000 0.458 2128 I N 0.216 120.738 120.570 -0.081 0.000 2.127 2128 I HA -0.364 3.828 4.170 0.037 0.000 0.241 2128 I C 2.602 178.696 176.117 -0.037 0.000 1.075 2128 I CA 0.933 62.197 61.300 -0.060 0.000 1.334 2128 I CB -0.298 37.618 38.000 -0.139 0.000 1.040 2128 I HN 0.150 nan 8.210 nan 0.000 0.405 2129 C N 0.360 119.624 119.300 -0.059 0.000 2.393 2129 C HA -0.248 4.234 4.460 0.037 0.000 0.276 2129 C C 2.596 177.570 174.990 -0.027 0.000 1.215 2129 C CA 1.373 60.356 59.018 -0.058 0.000 1.743 2129 C CB -1.060 26.639 27.740 -0.069 0.000 2.044 2129 C HN 0.547 nan 8.230 nan 0.000 0.464 2130 D N 0.312 120.708 120.400 -0.007 0.000 2.158 2130 D HA -0.108 4.554 4.640 0.037 0.000 0.197 2130 D C 2.142 178.450 176.300 0.013 0.000 0.995 2130 D CA 1.648 55.652 54.000 0.006 0.000 0.846 2130 D CB -0.191 40.620 40.800 0.020 0.000 0.941 2130 D HN 0.463 nan 8.370 nan 0.000 0.456 2131 A N -0.097 122.738 122.820 0.025 0.000 1.873 2131 A HA -0.074 4.268 4.320 0.037 0.000 0.215 2131 A C 2.411 180.004 177.584 0.014 0.000 1.186 2131 A CA 0.979 53.035 52.037 0.031 0.000 0.616 2131 A CB -0.771 18.263 19.000 0.056 0.000 0.823 2131 A HN 0.326 nan 8.150 nan 0.000 0.442 2132 L N -0.813 120.411 121.223 0.002 0.000 2.141 2132 L HA -0.144 4.218 4.340 0.037 0.000 0.209 2132 L C 3.030 179.892 176.870 -0.012 0.000 1.094 2132 L CA 0.779 55.615 54.840 -0.008 0.000 0.763 2132 L CB -0.574 41.472 42.059 -0.022 0.000 0.908 2132 L HN 0.461 nan 8.230 nan 0.000 0.437 2133 A N 0.288 123.099 122.820 -0.015 0.000 1.832 2133 A HA -0.197 4.145 4.320 0.037 0.000 0.214 2133 A C 2.394 179.974 177.584 -0.006 0.000 1.200 2133 A CA 1.356 53.383 52.037 -0.016 0.000 0.610 2133 A CB -0.550 18.438 19.000 -0.019 0.000 0.842 2133 A HN 0.239 nan 8.150 nan 0.000 0.444 2134 R N 0.190 120.689 120.500 -0.001 0.000 2.139 2134 R HA -0.155 4.207 4.340 0.037 0.000 0.243 2134 R C 2.593 178.898 176.300 0.007 0.000 1.145 2134 R CA 1.672 57.775 56.100 0.005 0.000 0.976 2134 R CB -0.393 29.913 30.300 0.010 0.000 0.866 2134 R HN 0.767 nan 8.270 nan 0.000 0.449 2135 S N -0.809 114.895 115.700 0.007 0.000 2.400 2135 S HA -0.095 4.397 4.470 0.037 0.000 0.232 2135 S C 1.654 176.257 174.600 0.005 0.000 1.025 2135 S CA 1.168 59.372 58.200 0.007 0.000 0.993 2135 S CB -0.316 62.889 63.200 0.007 0.000 0.808 2135 S HN 0.538 nan 8.310 nan 0.000 0.478 2136 G N 0.590 109.391 108.800 0.003 0.000 2.155 2136 G HA2 -0.203 3.779 3.960 0.037 0.000 0.257 2136 G HA3 -0.203 3.779 3.960 0.037 0.000 0.257 2136 G C 0.800 175.701 174.900 0.001 0.000 0.983 2136 G CA 0.499 45.600 45.100 0.002 0.000 0.676 2136 G HN 1.323 nan 8.290 nan 0.000 0.528 2137 A N -1.116 121.704 122.820 -0.000 0.000 1.956 2137 A HA 0.640 4.982 4.320 0.037 0.000 0.212 2137 A C 1.257 178.839 177.584 -0.004 0.000 1.188 2137 A CA 1.393 53.429 52.037 -0.001 0.000 0.675 2137 A CB 0.366 19.366 19.000 0.001 0.000 0.845 2137 A HN 0.998 nan 8.150 nan 0.000 0.455 2138 V N 1.377 121.287 119.914 -0.007 0.000 2.546 2138 V HA 0.170 4.312 4.120 0.037 0.000 0.284 2138 V C 0.295 176.380 176.094 -0.015 0.000 1.050 2138 V CA -0.256 62.037 62.300 -0.012 0.000 0.981 2138 V CB 1.427 33.239 31.823 -0.018 0.000 0.990 2138 V HN 0.442 nan 8.190 nan 0.000 0.474 2139 D N 1.746 122.137 120.400 -0.015 0.000 2.394 2139 D HA 0.108 4.770 4.640 0.037 0.000 0.226 2139 D C 0.192 176.479 176.300 -0.022 0.000 0.990 2139 D CA 1.006 54.997 54.000 -0.016 0.000 0.902 2139 D CB 1.592 42.384 40.800 -0.013 0.000 1.038 2139 D HN 0.368 nan 8.370 nan 0.000 0.499 2140 V N 1.445 121.343 119.914 -0.026 0.000 2.623 2140 V HA 0.446 4.588 4.120 0.037 0.000 0.304 2140 V C -1.613 174.451 176.094 -0.051 0.000 1.054 2140 V CA -0.646 61.632 62.300 -0.037 0.000 0.882 2140 V CB 1.815 33.622 31.823 -0.027 0.000 1.002 2140 V HN -0.105 nan 8.190 nan 0.000 0.424 2141 I N 6.848 127.363 120.570 -0.092 0.000 2.465 2141 I HA 0.655 4.847 4.170 0.037 0.000 0.291 2141 I C -0.561 175.424 176.117 -0.220 0.000 1.014 2141 I CA -1.016 60.199 61.300 -0.140 0.000 1.093 2141 I CB 2.033 39.934 38.000 -0.165 0.000 1.267 2141 I HN 0.559 nan 8.210 nan 0.000 0.431 2142 V N 7.158 126.912 119.914 -0.266 0.000 2.540 2142 V HA 0.598 4.740 4.120 0.037 0.000 0.302 2142 V C -0.945 174.784 176.094 -0.608 0.000 1.035 2142 V CA -0.378 61.682 62.300 -0.400 0.000 0.873 2142 V CB 2.107 33.762 31.823 -0.281 0.000 0.992 2142 V HN 0.435 nan 8.190 nan 0.000 0.428 2143 V N 5.560 125.127 119.914 -0.579 0.000 2.347 2143 V HA 0.419 4.561 4.120 0.037 0.000 0.280 2143 V C -0.250 175.625 176.094 -0.364 0.000 1.021 2143 V CA -0.386 61.623 62.300 -0.485 0.000 0.847 2143 V CB 1.349 32.920 31.823 -0.421 0.000 0.990 2143 V HN 0.967 nan 8.190 nan 0.000 0.444 2144 D N 3.512 123.664 120.400 -0.412 0.000 2.365 2144 D HA 0.338 5.000 4.640 0.037 0.000 0.237 2144 D C 0.044 176.296 176.300 -0.080 0.000 1.190 2144 D CA 0.661 54.535 54.000 -0.209 0.000 0.867 2144 D CB 0.618 41.353 40.800 -0.108 0.000 1.050 2144 D HN 0.644 nan 8.370 nan 0.000 0.491 2145 S N 1.252 116.928 115.700 -0.040 0.000 3.392 2145 S HA -0.148 4.344 4.470 0.037 0.000 0.693 2145 S C 1.212 175.816 174.600 0.007 0.000 0.620 2145 S CA 0.356 58.534 58.200 -0.037 0.000 1.452 2145 S CB -1.007 62.129 63.200 -0.107 0.000 0.988 2145 S HN 0.543 nan 8.310 nan 0.000 0.932 2146 V N 2.309 122.248 119.914 0.042 0.000 2.594 2146 V HA -0.047 4.095 4.120 0.037 0.000 0.253 2146 V C 2.340 178.431 176.094 -0.005 0.000 1.069 2146 V CA 2.364 64.687 62.300 0.038 0.000 1.082 2146 V CB -1.131 30.680 31.823 -0.020 0.000 0.680 2146 V HN 1.436 nan 8.190 nan 0.000 0.469 2147 A N 0.853 123.651 122.820 -0.036 0.000 1.958 2147 A HA -0.081 4.261 4.320 0.037 0.000 0.221 2147 A C 2.346 179.973 177.584 0.071 0.000 1.178 2147 A CA 2.553 54.576 52.037 -0.024 0.000 0.642 2147 A CB -1.033 17.900 19.000 -0.111 0.000 0.816 2147 A HN 1.286 nan 8.150 nan 0.000 0.453 2148 A N -1.653 121.210 122.820 0.071 0.000 2.275 2148 A HA 0.460 4.802 4.320 0.037 0.000 0.212 2148 A C 0.517 178.165 177.584 0.105 0.000 1.201 2148 A CA -0.106 52.025 52.037 0.156 0.000 0.843 2148 A CB -0.175 18.913 19.000 0.146 0.000 0.873 2148 A HN 0.277 nan 8.150 nan 0.000 0.492 2149 L N 2.338 123.596 121.223 0.058 0.000 2.391 2149 L HA 0.148 4.510 4.340 0.037 0.000 0.249 2149 L C 0.174 177.055 176.870 0.018 0.000 1.308 2149 L CA 0.546 55.406 54.840 0.034 0.000 1.209 2149 L CB -1.005 41.068 42.059 0.023 0.000 1.401 2149 L HN 0.099 nan 8.230 nan 0.000 0.416 2150 T N 3.027 117.597 114.554 0.026 0.000 2.799 2150 T HA 0.191 4.563 4.350 0.037 0.000 0.296 2150 T C -2.158 172.525 174.700 -0.029 0.000 0.947 2150 T CA -0.992 61.108 62.100 -0.000 0.000 1.141 2150 T CB 0.341 69.213 68.868 0.007 0.000 0.891 2150 T HN 0.171 nan 8.240 nan 0.000 0.533 2151 P HA 0.096 nan 4.420 nan 0.000 0.268 2151 P C 0.999 178.241 177.300 -0.096 0.000 1.208 2151 P CA -0.446 62.605 63.100 -0.082 0.000 0.777 2151 P CB 0.740 32.368 31.700 -0.120 0.000 0.875 2152 K N 2.354 122.714 120.400 -0.067 0.000 2.020 2152 K HA -0.237 4.105 4.320 0.037 0.000 0.212 2152 K C 1.822 178.374 176.600 -0.080 0.000 1.050 2152 K CA 2.026 58.286 56.287 -0.045 0.000 0.929 2152 K CB -0.723 31.769 32.500 -0.013 0.000 0.714 2152 K HN 0.471 nan 8.250 nan 0.000 0.443 2153 A N 0.915 123.659 122.820 -0.128 0.000 1.978 2153 A HA -0.228 4.114 4.320 0.037 0.000 0.220 2153 A C 1.943 179.352 177.584 -0.293 0.000 1.170 2153 A CA 1.927 53.870 52.037 -0.157 0.000 0.636 2153 A CB -0.495 18.418 19.000 -0.146 0.000 0.810 2153 A HN 0.600 nan 8.150 nan 0.000 0.448 2154 E N -0.169 119.747 120.200 -0.474 0.000 2.072 2154 E HA -0.122 4.249 4.350 0.037 0.000 0.190 2154 E C 1.774 178.333 176.600 -0.069 0.000 0.982 2154 E CA 1.220 57.370 56.400 -0.416 0.000 0.803 2154 E CB -0.211 29.292 29.700 -0.328 0.000 0.755 2154 E HN 0.673 nan 8.360 nan 0.000 0.453 2155 I N 0.948 121.482 120.570 -0.060 0.000 2.252 2155 I HA -0.205 3.987 4.170 0.037 0.000 0.245 2155 I C 2.235 178.358 176.117 0.010 0.000 1.102 2155 I CA 1.127 62.420 61.300 -0.011 0.000 1.385 2155 I CB -0.246 37.748 38.000 -0.009 0.000 1.064 2155 I HN 0.116 nan 8.210 nan 0.000 0.414 2156 E N 1.029 121.231 120.200 0.002 0.000 2.150 2156 E HA -0.041 4.331 4.350 0.037 0.000 0.193 2156 E C 1.420 178.048 176.600 0.047 0.000 0.985 2156 E CA 0.595 57.008 56.400 0.021 0.000 0.814 2156 E CB -0.149 29.559 29.700 0.013 0.000 0.752 2156 E HN 0.526 nan 8.360 nan 0.000 0.466 2157 G N 0.878 109.725 108.800 0.078 0.000 2.621 2157 G HA2 0.096 4.077 3.960 0.037 0.000 0.271 2157 G HA3 0.096 4.077 3.960 0.037 0.000 0.271 2157 G C -0.109 174.856 174.900 0.110 0.000 1.236 2157 G CA -0.507 44.673 45.100 0.133 0.000 0.958 2157 G HN -0.008 nan 8.290 nan 0.000 0.512 2158 E N -1.468 118.792 120.200 0.099 0.000 2.330 2158 E HA 0.311 4.683 4.350 0.037 0.000 0.256 2158 E C -0.257 176.394 176.600 0.084 0.000 1.146 2158 E CA -0.531 55.920 56.400 0.086 0.000 0.945 2158 E CB 1.490 31.238 29.700 0.081 0.000 1.182 2158 E HN 0.221 nan 8.360 nan 0.000 0.480 2159 I N 0.884 121.496 120.570 0.071 0.000 2.352 2159 I HA 0.181 4.373 4.170 0.037 0.000 0.290 2159 I C 1.062 177.199 176.117 0.034 0.000 1.036 2159 I CA 0.799 62.127 61.300 0.047 0.000 1.336 2159 I CB 0.697 38.715 38.000 0.029 0.000 1.407 2159 I HN 0.855 nan 8.210 nan 0.000 0.497 2160 G N 4.340 113.147 108.800 0.011 0.000 2.436 2160 G HA2 -0.216 3.766 3.960 0.037 0.000 0.204 2160 G HA3 -0.216 3.766 3.960 0.037 0.000 0.204 2160 G C 0.016 174.885 174.900 -0.051 0.000 1.026 2160 G CA -0.665 44.428 45.100 -0.012 0.000 0.658 2160 G HN 0.528 nan 8.290 nan 0.000 0.499 2161 D N 2.306 122.669 120.400 -0.062 0.000 2.520 2161 D HA 0.430 5.092 4.640 0.037 0.000 0.243 2161 D C 0.910 176.977 176.300 -0.387 0.000 1.160 2161 D CA 1.136 55.021 54.000 -0.192 0.000 0.877 2161 D CB 1.001 41.720 40.800 -0.136 0.000 1.150 2161 D HN 0.628 nan 8.370 nan 0.000 0.494 2162 S N 3.049 118.527 115.700 -0.370 0.000 2.475 2162 S HA 0.305 4.797 4.470 0.037 0.000 0.281 2162 S C -0.269 174.066 174.600 -0.443 0.000 1.198 2162 S CA -0.852 57.163 58.200 -0.308 0.000 1.063 2162 S CB 0.956 64.075 63.200 -0.136 0.000 0.972 2162 S HN 0.385 nan 8.310 nan 0.000 0.486 2163 H N 3.270 122.339 119.070 -0.002 0.000 2.539 2163 H HA 0.272 4.850 4.556 0.037 0.000 0.247 2163 H C -0.424 174.901 175.328 -0.005 0.000 1.363 2163 H CA -0.448 55.599 56.048 -0.003 0.000 1.371 2163 H CB 0.203 29.963 29.762 -0.003 0.000 1.438 2163 H HN 0.572 nan 8.280 nan 0.000 0.523 2164 M N 0.873 120.506 119.600 0.054 0.000 2.338 2164 M HA -0.017 4.485 4.480 0.037 0.000 0.360 2164 M C 1.294 177.618 176.300 0.039 0.000 1.547 2164 M CA 0.781 56.100 55.300 0.032 0.000 1.001 2164 M CB 0.367 32.975 32.600 0.013 0.000 2.008 2164 M HN 0.873 nan 8.290 nan 0.000 0.464 2165 G N 3.614 112.431 108.800 0.028 0.000 2.468 2165 G HA2 -0.279 3.703 3.960 0.037 0.000 0.311 2165 G HA3 -0.279 3.703 3.960 0.037 0.000 0.311 2165 G C 0.714 175.625 174.900 0.019 0.000 0.942 2165 G CA 0.731 45.841 45.100 0.017 0.000 0.893 2165 G HN 0.830 nan 8.290 nan 0.000 0.513 2166 L N -0.751 120.494 121.223 0.037 0.000 2.072 2166 L HA 0.201 4.563 4.340 0.037 0.000 0.205 2166 L C 3.061 179.929 176.870 -0.004 0.000 1.079 2166 L CA 2.037 56.891 54.840 0.023 0.000 0.752 2166 L CB -0.372 41.712 42.059 0.042 0.000 0.906 2166 L HN 0.371 nan 8.230 nan 0.000 0.436 2167 A N -0.168 122.649 122.820 -0.005 0.000 1.883 2167 A HA -0.228 4.113 4.320 0.037 0.000 0.217 2167 A C 2.411 179.978 177.584 -0.029 0.000 1.186 2167 A CA 1.889 53.913 52.037 -0.021 0.000 0.624 2167 A CB -1.018 17.972 19.000 -0.016 0.000 0.822 2167 A HN 0.544 nan 8.150 nan 0.000 0.444 2168 A N -0.604 122.203 122.820 -0.022 0.000 1.930 2168 A HA -0.132 4.210 4.320 0.037 0.000 0.217 2168 A C 2.237 179.805 177.584 -0.025 0.000 1.175 2168 A CA 1.725 53.746 52.037 -0.026 0.000 0.627 2168 A CB -0.451 18.541 19.000 -0.014 0.000 0.815 2168 A HN 0.551 nan 8.150 nan 0.000 0.443 2169 R N -0.886 119.605 120.500 -0.016 0.000 2.115 2169 R HA -0.059 4.303 4.340 0.037 0.000 0.230 2169 R C 2.181 178.468 176.300 -0.022 0.000 1.111 2169 R CA 1.539 57.631 56.100 -0.013 0.000 0.976 2169 R CB -0.295 30.003 30.300 -0.004 0.000 0.870 2169 R HN 0.629 nan 8.270 nan 0.000 0.445 2170 M N -0.358 119.225 119.600 -0.028 0.000 2.099 2170 M HA -0.176 4.326 4.480 0.037 0.000 0.262 2170 M C 1.756 178.023 176.300 -0.053 0.000 1.067 2170 M CA 1.492 56.772 55.300 -0.034 0.000 1.124 2170 M CB 0.034 32.614 32.600 -0.034 0.000 1.353 2170 M HN 0.212 nan 8.290 nan 0.000 0.410 2171 M N -0.405 119.151 119.600 -0.073 0.000 2.108 2171 M HA -0.191 4.310 4.480 0.037 0.000 0.261 2171 M C 2.360 178.578 176.300 -0.136 0.000 1.066 2171 M CA 1.560 56.787 55.300 -0.122 0.000 1.107 2171 M CB -1.326 31.191 32.600 -0.139 0.000 1.356 2171 M HN 0.346 nan 8.290 nan 0.000 0.406 2172 S N -0.245 115.402 115.700 -0.088 0.000 2.399 2172 S HA -0.173 4.319 4.470 0.037 0.000 0.231 2172 S C 1.842 176.387 174.600 -0.092 0.000 1.022 2172 S CA 1.210 59.364 58.200 -0.076 0.000 0.983 2172 S CB -0.116 63.072 63.200 -0.021 0.000 0.803 2172 S HN 0.509 nan 8.310 nan 0.000 0.480 2173 Q N 0.198 119.961 119.800 -0.061 0.000 2.083 2173 Q HA -0.019 4.343 4.340 0.037 0.000 0.198 2173 Q C 2.199 178.156 176.000 -0.071 0.000 0.969 2173 Q CA 1.182 56.962 55.803 -0.039 0.000 0.838 2173 Q CB -0.315 28.424 28.738 0.001 0.000 0.900 2173 Q HN 0.576 nan 8.270 nan 0.000 0.436 2174 A N 0.904 123.669 122.820 -0.090 0.000 1.877 2174 A HA -0.211 4.131 4.320 0.037 0.000 0.216 2174 A C 2.041 179.528 177.584 -0.163 0.000 1.186 2174 A CA 1.580 53.564 52.037 -0.089 0.000 0.620 2174 A CB -0.512 18.448 19.000 -0.067 0.000 0.822 2174 A HN 0.386 nan 8.150 nan 0.000 0.443 2175 M N -0.374 119.037 119.600 -0.315 0.000 2.073 2175 M HA -0.187 4.315 4.480 0.037 0.000 0.258 2175 M C 2.164 178.115 176.300 -0.581 0.000 1.070 2175 M CA 1.755 56.673 55.300 -0.637 0.000 1.103 2175 M CB -1.459 30.413 32.600 -1.213 0.000 1.321 2175 M HN 0.426 nan 8.290 nan 0.000 0.405 2176 R N 0.050 120.323 120.500 -0.379 0.000 2.112 2176 R HA -0.186 4.176 4.340 0.037 0.000 0.242 2176 R C 2.291 178.560 176.300 -0.050 0.000 1.137 2176 R CA 1.690 57.736 56.100 -0.091 0.000 0.944 2176 R CB -0.376 29.915 30.300 -0.015 0.000 0.857 2176 R HN 0.455 nan 8.270 nan 0.000 0.435 2177 K N 0.326 120.687 120.400 -0.064 0.000 2.097 2177 K HA -0.073 4.269 4.320 0.037 0.000 0.205 2177 K C 2.154 178.727 176.600 -0.045 0.000 1.050 2177 K CA 1.025 57.290 56.287 -0.036 0.000 0.938 2177 K CB -0.027 32.462 32.500 -0.017 0.000 0.718 2177 K HN 0.185 nan 8.250 nan 0.000 0.442 2178 L N 0.247 121.433 121.223 -0.061 0.000 2.095 2178 L HA -0.056 4.306 4.340 0.037 0.000 0.204 2178 L C 2.596 179.435 176.870 -0.050 0.000 1.080 2178 L CA 0.648 55.464 54.840 -0.040 0.000 0.759 2178 L CB -0.601 41.453 42.059 -0.007 0.000 0.914 2178 L HN 0.142 nan 8.230 nan 0.000 0.439 2179 A N 0.883 123.677 122.820 -0.044 0.000 1.884 2179 A HA -0.245 4.097 4.320 0.037 0.000 0.219 2179 A C 2.377 179.806 177.584 -0.259 0.000 1.197 2179 A CA 2.279 54.299 52.037 -0.028 0.000 0.637 2179 A CB -1.481 17.604 19.000 0.141 0.000 0.827 2179 A HN 0.450 nan 8.150 nan 0.000 0.450 2180 G N -0.728 107.859 108.800 -0.354 0.000 2.421 2180 G HA2 -0.288 3.694 3.960 0.037 0.000 0.216 2180 G HA3 -0.288 3.694 3.960 0.037 0.000 0.216 2180 G C 1.434 176.181 174.900 -0.254 0.000 1.171 2180 G CA 1.120 45.901 45.100 -0.533 0.000 0.775 2180 G HN 0.724 nan 8.290 nan 0.000 0.543 2181 N N -0.241 118.383 118.700 -0.127 0.000 2.381 2181 N HA 0.059 4.821 4.740 0.037 0.000 0.182 2181 N C 2.098 177.580 175.510 -0.047 0.000 1.025 2181 N CA 0.163 53.176 53.050 -0.061 0.000 0.888 2181 N CB -0.049 38.418 38.487 -0.034 0.000 0.965 2181 N HN 0.249 nan 8.380 nan 0.000 0.438 2182 L N 0.275 121.464 121.223 -0.057 0.000 2.209 2182 L HA -0.031 4.331 4.340 0.037 0.000 0.207 2182 L C 2.314 179.179 176.870 -0.009 0.000 1.094 2182 L CA 0.722 55.547 54.840 -0.025 0.000 0.790 2182 L CB -0.058 41.996 42.059 -0.009 0.000 0.932 2182 L HN 0.018 nan 8.230 nan 0.000 0.447 2183 K N 0.576 120.964 120.400 -0.020 0.000 2.031 2183 K HA -0.150 4.192 4.320 0.037 0.000 0.205 2183 K C 2.043 178.673 176.600 0.050 0.000 1.049 2183 K CA 1.510 57.823 56.287 0.044 0.000 0.939 2183 K CB -0.159 32.425 32.500 0.140 0.000 0.717 2183 K HN 0.097 nan 8.250 nan 0.000 0.438 2184 Q N -0.412 119.408 119.800 0.034 0.000 2.437 2184 Q HA 0.033 4.395 4.340 0.037 0.000 0.210 2184 Q C 1.077 177.093 176.000 0.027 0.000 0.972 2184 Q CA 1.341 57.170 55.803 0.044 0.000 0.903 2184 Q CB 0.220 28.985 28.738 0.045 0.000 0.967 2184 Q HN 0.218 nan 8.270 nan 0.000 0.486 2185 S N 0.003 115.712 115.700 0.014 0.000 2.524 2185 S HA 0.039 4.531 4.470 0.037 0.000 0.215 2185 S C 0.228 174.834 174.600 0.010 0.000 0.986 2185 S CA -0.183 58.023 58.200 0.009 0.000 0.911 2185 S CB 0.305 63.506 63.200 0.000 0.000 0.805 2185 S HN 0.410 nan 8.310 nan 0.000 0.501 2186 N N 2.512 121.222 118.700 0.016 0.000 2.714 2186 N HA -0.137 4.624 4.740 0.037 0.000 0.253 2186 N C -1.356 174.157 175.510 0.005 0.000 1.024 2186 N CA 0.741 53.800 53.050 0.015 0.000 0.726 2186 N CB -1.461 37.036 38.487 0.016 0.000 0.908 2186 N HN 0.285 nan 8.380 nan 0.000 0.542 2187 T N 1.110 115.664 114.554 0.001 0.000 2.779 2187 T HA 0.465 4.837 4.350 0.037 0.000 0.280 2187 T C 0.217 174.909 174.700 -0.014 0.000 0.987 2187 T CA -0.726 61.367 62.100 -0.011 0.000 0.966 2187 T CB 1.752 70.609 68.868 -0.019 0.000 0.933 2187 T HN 0.282 nan 8.240 nan 0.000 0.442 2188 L N 4.256 125.467 121.223 -0.020 0.000 2.349 2188 L HA 0.616 4.978 4.340 0.037 0.000 0.275 2188 L C -0.965 175.871 176.870 -0.057 0.000 1.115 2188 L CA -0.312 54.514 54.840 -0.024 0.000 0.820 2188 L CB 0.434 42.481 42.059 -0.020 0.000 1.135 2188 L HN 0.644 nan 8.230 nan 0.000 0.445 2189 L N 6.555 127.741 121.223 -0.062 0.000 2.376 2189 L HA 0.550 4.912 4.340 0.037 0.000 0.275 2189 L C -1.137 175.640 176.870 -0.154 0.000 0.987 2189 L CA -0.455 54.291 54.840 -0.156 0.000 0.828 2189 L CB 1.402 43.361 42.059 -0.166 0.000 1.249 2189 L HN 0.656 nan 8.230 nan 0.000 0.409 2190 I N 4.355 124.787 120.570 -0.230 0.000 2.339 2190 I HA 0.303 4.495 4.170 0.037 0.000 0.290 2190 I C -0.881 175.072 176.117 -0.274 0.000 0.994 2190 I CA -0.309 60.903 61.300 -0.146 0.000 1.191 2190 I CB 1.363 39.316 38.000 -0.078 0.000 1.343 2190 I HN 0.376 nan 8.210 nan 0.000 0.458 2191 F N 6.524 126.450 119.950 -0.040 0.000 2.405 2191 F HA 0.464 5.013 4.527 0.036 0.000 0.355 2191 F C 0.435 176.219 175.800 -0.026 0.000 1.121 2191 F CA -0.438 57.533 58.000 -0.050 0.000 1.112 2191 F CB 0.929 39.910 39.000 -0.033 0.000 1.126 2191 F HN 0.222 nan 8.300 nan 0.000 0.481 2192 I N 3.526 124.159 120.570 0.105 0.000 2.395 2192 I HA 0.188 4.379 4.170 0.037 0.000 0.289 2192 I C -0.145 176.027 176.117 0.092 0.000 1.023 2192 I CA -0.024 61.329 61.300 0.088 0.000 1.350 2192 I CB 0.990 39.015 38.000 0.043 0.000 1.409 2192 I HN 0.653 nan 8.210 nan 0.000 0.507 2193 N N 4.201 122.961 118.700 0.099 0.000 2.265 2193 N HA 0.375 5.137 4.740 0.037 0.000 0.300 2193 N C -1.269 174.232 175.510 -0.014 0.000 1.148 2193 N CA -0.703 52.367 53.050 0.034 0.000 0.772 2193 N CB 1.743 40.257 38.487 0.046 0.000 1.434 2193 N HN 0.539 nan 8.380 nan 0.000 0.481 2194 Q N 0.947 120.622 119.800 -0.208 0.000 2.180 2194 Q HA 0.485 4.847 4.340 0.037 0.000 0.241 2194 Q C -0.606 175.206 176.000 -0.315 0.000 0.970 2194 Q CA -0.609 54.886 55.803 -0.513 0.000 0.919 2194 Q CB 2.013 30.060 28.738 -1.152 0.000 1.222 2194 Q HN 0.478 nan 8.270 nan 0.000 0.482 2195 I N 1.611 122.035 120.570 -0.242 0.000 2.353 2195 I HA 0.336 4.528 4.170 0.037 0.000 0.293 2195 I C -0.065 176.036 176.117 -0.028 0.000 0.992 2195 I CA -0.652 60.636 61.300 -0.021 0.000 1.268 2195 I CB 0.738 38.851 38.000 0.188 0.000 1.387 2195 I HN 0.311 nan 8.210 nan 0.000 0.478 2196 R N 4.809 125.282 120.500 -0.045 0.000 2.832 2196 R HA 0.612 4.973 4.340 0.037 0.000 0.271 2196 R C -0.856 175.442 176.300 -0.004 0.000 0.996 2196 R CA -1.334 54.758 56.100 -0.014 0.000 0.977 2196 R CB 1.713 31.988 30.300 -0.043 0.000 1.168 2196 R HN 0.421 nan 8.270 nan 0.000 0.482 2197 M N 1.943 121.546 119.600 0.006 0.000 2.233 2197 M HA 0.251 4.752 4.480 0.037 0.000 0.355 2197 M C -0.128 176.157 176.300 -0.025 0.000 1.191 2197 M CA -0.160 55.137 55.300 -0.005 0.000 1.101 2197 M CB 0.873 33.475 32.600 0.003 0.000 1.592 2197 M HN 0.267 nan 8.290 nan 0.000 0.461 2198 K N 5.002 125.378 120.400 -0.041 0.000 2.183 2198 K HA 0.543 4.885 4.320 0.037 0.000 0.274 2198 K C -0.816 175.749 176.600 -0.059 0.000 1.009 2198 K CA -0.571 55.686 56.287 -0.050 0.000 0.888 2198 K CB 1.251 33.714 32.500 -0.061 0.000 1.078 2198 K HN 0.863 nan 8.250 nan 0.000 0.459 2199 I N 0.293 120.833 120.570 -0.049 0.000 2.412 2199 I HA 0.464 4.656 4.170 0.037 0.000 0.296 2199 I C 0.317 176.401 176.117 -0.055 0.000 0.987 2199 I CA 0.287 61.558 61.300 -0.048 0.000 1.180 2199 I CB 1.275 39.256 38.000 -0.031 0.000 1.340 2199 I HN 1.003 nan 8.210 nan 0.000 0.455 2200 G N 4.734 113.496 108.800 -0.063 0.000 2.142 2200 G HA2 -0.167 3.815 3.960 0.037 0.000 0.225 2200 G HA3 -0.167 3.815 3.960 0.037 0.000 0.225 2200 G C -0.562 174.275 174.900 -0.105 0.000 1.015 2200 G CA 0.086 45.150 45.100 -0.060 0.000 0.716 2200 G HN 0.937 nan 8.290 nan 0.000 0.508 2201 V N 1.912 121.719 119.914 -0.180 0.000 2.483 2201 V HA 0.739 4.881 4.120 0.037 0.000 0.297 2201 V C 1.030 176.908 176.094 -0.361 0.000 1.027 2201 V CA -0.258 61.810 62.300 -0.387 0.000 0.855 2201 V CB 1.377 32.907 31.823 -0.487 0.000 0.995 2201 V HN 0.318 nan 8.190 nan 0.000 0.424 2202 M N 6.058 125.431 119.600 -0.378 0.000 2.740 2202 M HA 0.277 4.779 4.480 0.037 0.000 0.253 2202 M C 0.763 177.006 176.300 -0.094 0.000 1.341 2202 M CA 0.581 55.791 55.300 -0.151 0.000 1.176 2202 M CB -0.512 32.079 32.600 -0.015 0.000 1.310 2202 M HN 0.580 nan 8.290 nan 0.000 0.531 2203 F N 1.817 121.773 119.950 0.008 0.000 2.266 2203 F HA 0.685 5.234 4.527 0.037 0.000 0.287 2203 F C 1.326 177.132 175.800 0.010 0.000 1.255 2203 F CA -0.337 57.668 58.000 0.008 0.000 1.201 2203 F CB -1.083 37.920 39.000 0.005 0.000 1.450 2203 F HN 0.424 nan 8.300 nan 0.000 0.510 2204 G N 0.954 109.938 108.800 0.308 0.000 2.581 2204 G HA2 -0.272 3.710 3.960 0.037 0.000 0.291 2204 G HA3 -0.272 3.710 3.960 0.037 0.000 0.291 2204 G C -0.709 174.205 174.900 0.023 0.000 1.277 2204 G CA 0.276 45.485 45.100 0.181 0.000 0.959 2204 G HN 1.468 nan 8.290 nan 0.000 0.554 2205 N N 1.027 119.728 118.700 0.001 0.000 2.319 2205 N HA 0.586 5.348 4.740 0.037 0.000 0.305 2205 N C -2.266 173.205 175.510 -0.065 0.000 1.103 2205 N CA -1.678 51.360 53.050 -0.019 0.000 0.815 2205 N CB 2.330 40.829 38.487 0.020 0.000 1.288 2205 N HN 0.331 nan 8.380 nan 0.000 0.493 2206 P HA 0.249 nan 4.420 nan 0.000 0.253 2206 P C -0.757 176.517 177.300 -0.045 0.000 1.459 2206 P CA 0.217 63.270 63.100 -0.077 0.000 0.908 2206 P CB 0.139 31.800 31.700 -0.065 0.000 1.470 2207 E N -0.126 120.056 120.200 -0.030 0.000 2.179 2207 E HA 0.426 4.798 4.350 0.037 0.000 0.275 2207 E C -0.045 176.515 176.600 -0.067 0.000 0.945 2207 E CA -0.326 56.059 56.400 -0.025 0.000 0.792 2207 E CB 1.539 31.246 29.700 0.011 0.000 1.125 2207 E HN 0.055 nan 8.360 nan 0.000 0.397 2208 T N 0.085 114.587 114.554 -0.087 0.000 2.604 2208 T HA 0.502 4.874 4.350 0.037 0.000 0.267 2208 T C -0.354 174.231 174.700 -0.190 0.000 0.923 2208 T CA -0.720 61.298 62.100 -0.137 0.000 1.077 2208 T CB 1.641 70.451 68.868 -0.097 0.000 1.392 2208 T HN 0.270 nan 8.240 nan 0.000 0.531 2209 T N 1.860 116.297 114.554 -0.194 0.000 2.921 2209 T HA 0.558 4.930 4.350 0.037 0.000 0.297 2209 T C -0.554 174.061 174.700 -0.141 0.000 1.013 2209 T CA -0.568 61.403 62.100 -0.216 0.000 0.990 2209 T CB 1.326 70.010 68.868 -0.306 0.000 1.023 2209 T HN 0.751 nan 8.240 nan 0.000 0.447 2210 T N 1.311 115.789 114.554 -0.128 0.000 2.900 2210 T HA 0.470 4.842 4.350 0.037 0.000 0.307 2210 T C 1.313 175.960 174.700 -0.089 0.000 1.065 2210 T CA 0.369 62.412 62.100 -0.095 0.000 1.105 2210 T CB 0.531 69.346 68.868 -0.089 0.000 0.979 2210 T HN 1.180 nan 8.240 nan 0.000 0.544 2211 G N 0.571 109.329 108.800 -0.070 0.000 2.171 2211 G HA2 0.254 4.236 3.960 0.037 0.000 0.238 2211 G HA3 0.254 4.236 3.960 0.037 0.000 0.238 2211 G C 0.711 175.571 174.900 -0.066 0.000 1.039 2211 G CA 0.083 45.138 45.100 -0.074 0.000 0.759 2211 G HN 1.828 nan 8.290 nan 0.000 0.501 2212 G N -0.115 108.659 108.800 -0.044 0.000 2.601 2212 G HA2 -0.258 3.724 3.960 0.037 0.000 0.261 2212 G HA3 -0.258 3.724 3.960 0.037 0.000 0.261 2212 G C 0.687 175.589 174.900 0.003 0.000 1.289 2212 G CA 0.537 45.627 45.100 -0.017 0.000 0.920 2212 G HN 0.964 nan 8.290 nan 0.000 0.571 2213 N N 0.630 119.366 118.700 0.060 0.000 2.325 2213 N HA 0.211 4.973 4.740 0.037 0.000 0.182 2213 N C 2.417 178.081 175.510 0.257 0.000 1.088 2213 N CA 1.230 54.370 53.050 0.149 0.000 0.879 2213 N CB 0.051 38.677 38.487 0.232 0.000 0.983 2213 N HN 0.830 nan 8.380 nan 0.000 0.471 2214 A N 1.495 124.413 122.820 0.164 0.000 1.873 2214 A HA -0.157 4.185 4.320 0.037 0.000 0.218 2214 A C 2.162 179.903 177.584 0.262 0.000 1.193 2214 A CA 1.195 53.356 52.037 0.206 0.000 0.629 2214 A CB -0.714 18.306 19.000 0.033 0.000 0.826 2214 A HN 0.214 nan 8.150 nan 0.000 0.447 2215 L N -0.190 121.072 121.223 0.065 0.000 2.093 2215 L HA -0.114 4.248 4.340 0.037 0.000 0.208 2215 L C 2.209 179.132 176.870 0.088 0.000 1.085 2215 L CA 2.070 56.914 54.840 0.008 0.000 0.755 2215 L CB -0.558 41.394 42.059 -0.179 0.000 0.904 2215 L HN 0.360 nan 8.230 nan 0.000 0.435 2216 K N -1.024 119.408 120.400 0.052 0.000 2.059 2216 K HA -0.248 4.094 4.320 0.037 0.000 0.212 2216 K C 2.054 178.607 176.600 -0.078 0.000 1.050 2216 K CA 2.211 58.463 56.287 -0.058 0.000 0.927 2216 K CB -0.500 31.884 32.500 -0.194 0.000 0.714 2216 K HN 0.274 nan 8.250 nan 0.000 0.447 2217 F N -0.678 119.311 119.950 0.065 0.000 2.128 2217 F HA -0.131 4.418 4.527 0.037 0.000 0.295 2217 F C 2.156 177.943 175.800 -0.021 0.000 1.100 2217 F CA 1.160 59.163 58.000 0.005 0.000 1.260 2217 F CB -0.408 38.569 39.000 -0.039 0.000 1.009 2217 F HN 0.006 nan 8.300 nan 0.000 0.476 2218 Y N 0.017 120.435 120.300 0.196 0.000 2.395 2218 Y HA 0.210 4.782 4.550 0.037 0.000 0.293 2218 Y C 1.605 177.559 175.900 0.089 0.000 1.123 2218 Y CA -0.031 58.145 58.100 0.128 0.000 1.227 2218 Y CB -0.662 37.853 38.460 0.091 0.000 1.012 2218 Y HN -0.111 nan 8.280 nan 0.000 0.552 2219 A N -0.118 122.825 122.820 0.205 0.000 2.511 2219 A HA 0.145 4.487 4.320 0.037 0.000 0.242 2219 A C 1.212 178.841 177.584 0.074 0.000 1.069 2219 A CA 0.414 52.530 52.037 0.132 0.000 0.763 2219 A CB 0.178 19.237 19.000 0.098 0.000 1.001 2219 A HN 0.340 nan 8.150 nan 0.000 0.498 2220 S N 0.587 116.324 115.700 0.061 0.000 2.458 2220 S HA 0.170 4.662 4.470 0.037 0.000 0.223 2220 S C 0.394 174.979 174.600 -0.026 0.000 1.019 2220 S CA 0.486 58.695 58.200 0.016 0.000 0.937 2220 S CB 0.106 63.321 63.200 0.024 0.000 0.788 2220 S HN 0.560 nan 8.310 nan 0.000 0.511 2221 V N 2.235 122.143 119.914 -0.009 0.000 2.760 2221 V HA 0.502 4.644 4.120 0.037 0.000 0.309 2221 V C -0.770 175.318 176.094 -0.010 0.000 1.077 2221 V CA -0.841 61.437 62.300 -0.037 0.000 0.910 2221 V CB 2.112 33.914 31.823 -0.035 0.000 1.008 2221 V HN 0.123 nan 8.190 nan 0.000 0.424 2222 R N 3.800 124.279 120.500 -0.035 0.000 2.502 2222 R HA 0.636 4.998 4.340 0.037 0.000 0.300 2222 R C -1.902 174.368 176.300 -0.049 0.000 0.984 2222 R CA -0.827 55.281 56.100 0.014 0.000 0.882 2222 R CB 2.214 32.554 30.300 0.067 0.000 1.180 2222 R HN 0.371 nan 8.270 nan 0.000 0.444 2223 L N 2.091 123.258 121.223 -0.093 0.000 2.329 2223 L HA 0.359 4.721 4.340 0.037 0.000 0.279 2223 L C -0.144 176.433 176.870 -0.488 0.000 1.014 2223 L CA -0.415 54.311 54.840 -0.191 0.000 0.814 2223 L CB 1.484 43.482 42.059 -0.101 0.000 1.257 2223 L HN 0.451 nan 8.230 nan 0.000 0.424 2224 D N 3.761 123.889 120.400 -0.453 0.000 2.461 2224 D HA 0.280 4.942 4.640 0.037 0.000 0.240 2224 D C -0.869 175.270 176.300 -0.268 0.000 1.094 2224 D CA -0.236 53.399 54.000 -0.609 0.000 0.868 2224 D CB 0.966 41.522 40.800 -0.406 0.000 1.062 2224 D HN 0.449 nan 8.370 nan 0.000 0.530 2225 I N 3.080 123.524 120.570 -0.209 0.000 2.392 2225 I HA 0.513 4.705 4.170 0.037 0.000 0.295 2225 I C -0.842 175.245 176.117 -0.050 0.000 0.985 2225 I CA -0.628 60.617 61.300 -0.091 0.000 1.221 2225 I CB 0.659 38.645 38.000 -0.023 0.000 1.366 2225 I HN 0.224 nan 8.210 nan 0.000 0.467 2226 R N 5.663 126.126 120.500 -0.061 0.000 2.584 2226 R HA 0.366 4.728 4.340 0.037 0.000 0.276 2226 R C -1.037 175.231 176.300 -0.053 0.000 1.046 2226 R CA -0.863 55.218 56.100 -0.033 0.000 0.906 2226 R CB 1.949 32.232 30.300 -0.028 0.000 1.215 2226 R HN 0.571 nan 8.270 nan 0.000 0.449 2227 R N 4.206 124.699 120.500 -0.012 0.000 2.316 2227 R HA 0.130 4.492 4.340 0.037 0.000 0.314 2227 R C 0.681 176.966 176.300 -0.025 0.000 1.069 2227 R CA 0.180 56.276 56.100 -0.007 0.000 0.959 2227 R CB 0.371 30.705 30.300 0.058 0.000 0.987 2227 R HN 0.777 nan 8.270 nan 0.000 0.446 2228 I N 0.737 121.273 120.570 -0.056 0.000 4.035 2228 I HA 0.464 4.656 4.170 0.037 0.000 0.321 2228 I C 0.597 176.682 176.117 -0.053 0.000 1.289 2228 I CA -0.130 61.135 61.300 -0.058 0.000 1.236 2228 I CB 0.875 38.827 38.000 -0.079 0.000 1.076 2228 I HN 0.589 nan 8.210 nan 0.000 0.418 2229 G N 0.918 109.684 108.800 -0.057 0.000 2.550 2229 G HA2 0.696 4.678 3.960 0.037 0.000 0.293 2229 G HA3 0.696 4.678 3.960 0.037 0.000 0.293 2229 G C -1.940 172.914 174.900 -0.076 0.000 1.402 2229 G CA -0.264 44.797 45.100 -0.064 0.000 0.784 2229 G HN 0.289 nan 8.290 nan 0.000 0.482 2230 A N -0.494 122.267 122.820 -0.098 0.000 2.305 2230 A HA 0.689 5.031 4.320 0.037 0.000 0.322 2230 A C -0.195 177.336 177.584 -0.088 0.000 1.187 2230 A CA -0.517 51.450 52.037 -0.116 0.000 0.825 2230 A CB 1.467 20.357 19.000 -0.185 0.000 1.164 2230 A HN 1.295 nan 8.150 nan 0.000 0.498 2231 V N 4.295 124.153 119.914 -0.094 0.000 2.356 2231 V HA 0.147 4.289 4.120 0.037 0.000 0.258 2231 V C 0.491 176.552 176.094 -0.055 0.000 1.065 2231 V CA -0.111 62.140 62.300 -0.081 0.000 0.935 2231 V CB -0.198 31.558 31.823 -0.112 0.000 1.061 2231 V HN 0.829 nan 8.190 nan 0.000 0.484 2232 K N 3.021 123.398 120.400 -0.039 0.000 2.090 2232 K HA 0.499 4.841 4.320 0.037 0.000 0.249 2232 K C 0.044 176.640 176.600 -0.007 0.000 0.995 2232 K CA -0.624 55.651 56.287 -0.020 0.000 0.914 2232 K CB 1.302 33.788 32.500 -0.024 0.000 1.057 2232 K HN 0.460 nan 8.250 nan 0.000 0.462 2233 E N 0.695 120.899 120.200 0.006 0.000 4.230 2233 E HA 0.135 4.507 4.350 0.037 0.000 0.216 2233 E C 0.366 176.973 176.600 0.012 0.000 1.132 2233 E CA -0.004 56.402 56.400 0.010 0.000 1.404 2233 E CB 0.751 30.465 29.700 0.023 0.000 1.183 2233 E HN 1.018 nan 8.360 nan 0.000 0.431 2234 G N 1.988 110.791 108.800 0.005 0.000 5.431 2234 G HA2 -0.397 3.585 3.960 0.037 0.000 0.322 2234 G HA3 -0.397 3.585 3.960 0.037 0.000 0.322 2234 G C 1.055 175.961 174.900 0.009 0.000 1.370 2234 G CA 0.718 45.822 45.100 0.006 0.000 0.963 2234 G HN 0.398 nan 8.290 nan 0.000 0.797 2235 E N 1.522 121.732 120.200 0.017 0.000 2.162 2235 E HA 0.085 4.457 4.350 0.037 0.000 0.193 2235 E C 1.024 177.643 176.600 0.032 0.000 0.953 2235 E CA 0.287 56.700 56.400 0.022 0.000 0.849 2235 E CB -0.108 29.607 29.700 0.025 0.000 0.810 2235 E HN 0.638 nan 8.360 nan 0.000 0.470 2236 N N 0.453 119.177 118.700 0.040 0.000 2.525 2236 N HA 0.114 4.876 4.740 0.037 0.000 0.271 2236 N C -0.794 174.757 175.510 0.067 0.000 1.194 2236 N CA -0.092 52.996 53.050 0.063 0.000 0.964 2236 N CB 1.647 40.176 38.487 0.069 0.000 1.126 2236 N HN -0.216 nan 8.380 nan 0.000 0.452 2237 V N 2.328 122.311 119.914 0.115 0.000 2.318 2237 V HA 0.121 4.263 4.120 0.037 0.000 0.271 2237 V C 0.562 176.804 176.094 0.246 0.000 1.030 2237 V CA -0.319 62.065 62.300 0.139 0.000 0.844 2237 V CB 1.175 33.086 31.823 0.147 0.000 1.015 2237 V HN 0.549 nan 8.190 nan 0.000 0.460 2238 V N 4.341 124.324 119.914 0.115 0.000 3.643 2238 V HA 0.636 4.778 4.120 0.037 0.000 0.280 2238 V C 0.840 176.774 176.094 -0.266 0.000 1.351 2238 V CA 1.276 63.628 62.300 0.087 0.000 1.073 2238 V CB 0.286 32.138 31.823 0.047 0.000 0.863 2238 V HN 0.907 nan 8.190 nan 0.000 0.436 2239 G N -1.168 107.310 108.800 -0.537 0.000 2.559 2239 G HA2 0.476 4.458 3.960 0.037 0.000 0.291 2239 G HA3 0.476 4.458 3.960 0.037 0.000 0.291 2239 G C -1.480 173.074 174.900 -0.576 0.000 1.424 2239 G CA -0.271 44.223 45.100 -1.010 0.000 0.786 2239 G HN -0.017 nan 8.290 nan 0.000 0.485 2240 S N -0.106 115.367 115.700 -0.379 0.000 2.456 2240 S HA 0.482 4.974 4.470 0.037 0.000 0.316 2240 S C -0.298 174.260 174.600 -0.070 0.000 1.089 2240 S CA -0.414 57.750 58.200 -0.059 0.000 1.101 2240 S CB 1.601 64.880 63.200 0.131 0.000 0.995 2240 S HN 0.583 nan 8.310 nan 0.000 0.468 2241 E N 2.144 122.299 120.200 -0.076 0.000 2.376 2241 E HA 0.279 4.651 4.350 0.037 0.000 0.266 2241 E C -0.559 175.953 176.600 -0.146 0.000 1.009 2241 E CA 0.512 56.853 56.400 -0.098 0.000 0.902 2241 E CB 0.539 30.188 29.700 -0.084 0.000 0.972 2241 E HN 0.447 nan 8.360 nan 0.000 0.439 2242 T N 4.983 119.370 114.554 -0.279 0.000 2.893 2242 T HA 0.493 4.865 4.350 0.037 0.000 0.293 2242 T C -0.892 173.473 174.700 -0.558 0.000 1.027 2242 T CA -0.792 61.045 62.100 -0.438 0.000 0.988 2242 T CB 1.259 69.759 68.868 -0.614 0.000 1.043 2242 T HN 0.376 nan 8.240 nan 0.000 0.461 2243 R N 2.255 122.525 120.500 -0.382 0.000 2.532 2243 R HA 0.692 5.054 4.340 0.037 0.000 0.297 2243 R C -1.930 174.246 176.300 -0.208 0.000 0.984 2243 R CA -0.504 55.425 56.100 -0.284 0.000 0.884 2243 R CB 1.342 31.547 30.300 -0.159 0.000 1.182 2243 R HN 0.463 nan 8.270 nan 0.000 0.442 2244 V N 4.521 124.346 119.914 -0.149 0.000 2.459 2244 V HA 0.426 4.568 4.120 0.037 0.000 0.295 2244 V C -0.222 175.848 176.094 -0.040 0.000 1.029 2244 V CA -0.790 61.471 62.300 -0.065 0.000 0.874 2244 V CB 1.891 33.735 31.823 0.035 0.000 0.985 2244 V HN 0.670 nan 8.190 nan 0.000 0.438 2245 K N 2.797 123.165 120.400 -0.053 0.000 2.206 2245 K HA 0.580 4.922 4.320 0.037 0.000 0.264 2245 K C -1.017 175.551 176.600 -0.054 0.000 0.967 2245 K CA -0.683 55.591 56.287 -0.022 0.000 0.844 2245 K CB 2.209 34.717 32.500 0.013 0.000 1.099 2245 K HN 0.458 nan 8.250 nan 0.000 0.441 2246 V N 4.618 124.498 119.914 -0.056 0.000 2.405 2246 V HA -0.005 4.137 4.120 0.037 0.000 0.264 2246 V C 1.024 176.978 176.094 -0.232 0.000 1.048 2246 V CA 0.043 62.265 62.300 -0.130 0.000 0.966 2246 V CB 0.930 32.669 31.823 -0.141 0.000 1.015 2246 V HN 0.649 nan 8.190 nan 0.000 0.477 2247 V N 3.974 123.760 119.914 -0.213 0.000 2.949 2247 V HA 0.178 4.320 4.120 0.037 0.000 0.245 2247 V C 0.815 176.668 176.094 -0.401 0.000 1.086 2247 V CA 0.863 63.029 62.300 -0.224 0.000 1.097 2247 V CB 0.039 31.882 31.823 0.035 0.000 0.762 2247 V HN 0.770 nan 8.190 nan 0.000 0.470 2248 K N 1.063 121.289 120.400 -0.289 0.000 2.371 2248 K HA 0.430 4.772 4.320 0.037 0.000 0.251 2248 K C -1.511 174.922 176.600 -0.277 0.000 0.934 2248 K CA -0.573 55.538 56.287 -0.293 0.000 0.798 2248 K CB 1.740 34.148 32.500 -0.154 0.000 1.204 2248 K HN 0.117 nan 8.250 nan 0.000 0.427 2249 N N 3.006 121.520 118.700 -0.310 0.000 2.549 2249 N HA 0.191 4.953 4.740 0.037 0.000 0.290 2249 N C -0.860 174.495 175.510 -0.257 0.000 1.122 2249 N CA -0.303 52.587 53.050 -0.266 0.000 0.885 2249 N CB 1.552 39.854 38.487 -0.308 0.000 1.455 2249 N HN 0.606 nan 8.380 nan 0.000 0.521 2250 K N 2.247 122.536 120.400 -0.185 0.000 2.374 2250 K HA 0.258 4.600 4.320 0.037 0.000 0.196 2250 K C 0.776 177.263 176.600 -0.188 0.000 1.023 2250 K CA 0.121 56.300 56.287 -0.179 0.000 1.103 2250 K CB 0.606 33.051 32.500 -0.091 0.000 0.848 2250 K HN 0.377 nan 8.250 nan 0.000 0.528 2251 I N -0.234 120.232 120.570 -0.172 0.000 3.883 2251 I HA 0.156 4.348 4.170 0.037 0.000 0.305 2251 I C 0.235 176.271 176.117 -0.135 0.000 1.247 2251 I CA 0.034 61.259 61.300 -0.124 0.000 1.350 2251 I CB 0.961 38.916 38.000 -0.075 0.000 1.194 2251 I HN -0.050 nan 8.210 nan 0.000 0.441 2252 A N -0.430 122.285 122.820 -0.175 0.000 2.534 2252 A HA 0.853 5.195 4.320 0.037 0.000 0.300 2252 A C -0.852 176.596 177.584 -0.227 0.000 1.223 2252 A CA -0.181 51.767 52.037 -0.148 0.000 0.666 2252 A CB -0.103 18.848 19.000 -0.083 0.000 1.316 2252 A HN 0.062 nan 8.150 nan 0.000 0.468 2253 A N 1.315 124.037 122.820 -0.162 0.000 2.520 2253 A HA 0.557 4.899 4.320 0.037 0.000 0.245 2253 A C -2.074 175.332 177.584 -0.297 0.000 1.072 2253 A CA -0.510 51.379 52.037 -0.248 0.000 0.761 2253 A CB -0.752 18.232 19.000 -0.026 0.000 1.004 2253 A HN 0.509 nan 8.150 nan 0.000 0.499 2254 P HA 0.530 nan 4.420 nan 0.000 0.284 2254 P C -0.135 177.031 177.300 -0.223 0.000 1.292 2254 P CA -0.328 62.468 63.100 -0.506 0.000 0.800 2254 P CB 0.194 31.364 31.700 -0.883 0.000 1.188 2255 F N -4.567 115.338 119.950 -0.074 0.000 2.840 2255 F HA -0.203 4.346 4.527 0.037 0.000 0.310 2255 F C 0.651 176.450 175.800 -0.002 0.000 0.688 2255 F CA 0.758 58.749 58.000 -0.016 0.000 1.286 2255 F CB -2.405 36.613 39.000 0.029 0.000 1.612 2255 F HN 0.228 nan 8.300 nan 0.000 0.335 2256 K N 1.257 121.713 120.400 0.093 0.000 2.202 2256 K HA 0.459 4.801 4.320 0.037 0.000 0.264 2256 K C 0.433 177.061 176.600 0.047 0.000 1.010 2256 K CA -0.272 56.055 56.287 0.067 0.000 0.940 2256 K CB 0.744 33.263 32.500 0.033 0.000 0.983 2256 K HN 0.415 nan 8.250 nan 0.000 0.475 2257 Q N 0.168 119.994 119.800 0.043 0.000 2.397 2257 Q HA 0.729 5.091 4.340 0.037 0.000 0.275 2257 Q C -1.705 174.310 176.000 0.025 0.000 1.090 2257 Q CA -1.251 54.568 55.803 0.027 0.000 0.809 2257 Q CB 2.158 30.909 28.738 0.023 0.000 1.362 2257 Q HN 0.523 nan 8.270 nan 0.000 0.431 2258 A N 1.922 124.760 122.820 0.029 0.000 2.355 2258 A HA 0.633 4.975 4.320 0.037 0.000 0.317 2258 A C -1.109 176.481 177.584 0.010 0.000 1.094 2258 A CA -0.672 51.402 52.037 0.063 0.000 0.764 2258 A CB 1.549 20.634 19.000 0.141 0.000 1.230 2258 A HN 0.794 nan 8.150 nan 0.000 0.448 2259 E N 0.289 120.493 120.200 0.006 0.000 2.221 2259 E HA 0.772 5.144 4.350 0.037 0.000 0.268 2259 E C -1.088 175.522 176.600 0.015 0.000 0.933 2259 E CA -0.391 55.937 56.400 -0.121 0.000 0.809 2259 E CB 2.074 31.721 29.700 -0.089 0.000 1.190 2259 E HN 0.661 nan 8.360 nan 0.000 0.406 2260 F N -1.918 118.012 119.950 -0.034 0.000 3.194 2260 F HA 0.345 4.894 4.527 0.036 0.000 0.327 2260 F C -1.684 174.095 175.800 -0.034 0.000 1.141 2260 F CA -1.195 56.781 58.000 -0.041 0.000 0.862 2260 F CB 0.861 39.832 39.000 -0.049 0.000 1.447 2260 F HN 0.176 nan 8.300 nan 0.000 0.479 2261 Q N 1.287 121.285 119.800 0.330 0.000 2.316 2261 Q HA 0.667 5.029 4.340 0.037 0.000 0.264 2261 Q C -1.274 174.879 176.000 0.256 0.000 0.987 2261 Q CA -0.757 55.150 55.803 0.172 0.000 0.852 2261 Q CB 2.990 31.768 28.738 0.066 0.000 1.287 2261 Q HN 0.567 nan 8.270 nan 0.000 0.448 2262 I N 3.803 124.466 120.570 0.156 0.000 2.307 2262 I HA 0.217 4.409 4.170 0.037 0.000 0.289 2262 I C -0.508 175.572 176.117 -0.061 0.000 1.021 2262 I CA -0.444 60.932 61.300 0.126 0.000 1.224 2262 I CB 0.616 38.735 38.000 0.198 0.000 1.376 2262 I HN 0.366 nan 8.210 nan 0.000 0.470 2263 L N 7.169 128.377 121.223 -0.024 0.000 2.278 2263 L HA 0.290 4.652 4.340 0.037 0.000 0.287 2263 L C -0.543 176.356 176.870 0.049 0.000 1.072 2263 L CA -0.800 53.991 54.840 -0.081 0.000 0.819 2263 L CB -0.059 41.995 42.059 -0.008 0.000 1.176 2263 L HN 0.395 nan 8.230 nan 0.000 0.435 2264 Y N 2.303 122.698 120.300 0.158 0.000 2.721 2264 Y HA 0.182 4.754 4.550 0.037 0.000 0.329 2264 Y C 1.492 177.530 175.900 0.230 0.000 1.211 2264 Y CA 0.588 58.815 58.100 0.211 0.000 1.512 2264 Y CB -0.049 38.503 38.460 0.152 0.000 1.249 2264 Y HN 0.861 nan 8.280 nan 0.000 0.549 2265 G N 1.985 111.121 108.800 0.560 0.000 2.176 2265 G HA2 -0.338 3.644 3.960 0.037 0.000 0.253 2265 G HA3 -0.338 3.644 3.960 0.037 0.000 0.253 2265 G C 0.823 175.768 174.900 0.075 0.000 0.979 2265 G CA 0.633 45.935 45.100 0.336 0.000 0.641 2265 G HN 0.638 nan 8.290 nan 0.000 0.530 2266 E N -1.373 118.865 120.200 0.063 0.000 2.444 2266 E HA 0.474 4.846 4.350 0.037 0.000 0.203 2266 E C 1.347 177.922 176.600 -0.043 0.000 0.847 2266 E CA 1.283 57.681 56.400 -0.003 0.000 1.142 2266 E CB 0.700 30.420 29.700 0.033 0.000 1.125 2266 E HN 1.628 nan 8.360 nan 0.000 0.521 2267 G N 0.620 109.425 108.800 0.010 0.000 2.306 2267 G HA2 -0.102 3.880 3.960 0.037 0.000 0.262 2267 G HA3 -0.102 3.880 3.960 0.037 0.000 0.262 2267 G C -0.909 174.011 174.900 0.033 0.000 1.263 2267 G CA -0.468 44.634 45.100 0.004 0.000 1.088 2267 G HN 0.138 nan 8.290 nan 0.000 0.489 2268 I N 1.618 122.182 120.570 -0.009 0.000 2.598 2268 I HA 0.058 4.250 4.170 0.037 0.000 0.284 2268 I C 0.640 176.743 176.117 -0.024 0.000 1.140 2268 I CA -0.216 61.052 61.300 -0.053 0.000 1.420 2268 I CB 0.673 38.521 38.000 -0.254 0.000 1.387 2268 I HN 0.434 nan 8.210 nan 0.000 0.553 2269 N N 6.627 125.343 118.700 0.026 0.000 2.671 2269 N HA -0.047 4.715 4.740 0.037 0.000 0.274 2269 N C 0.559 176.070 175.510 0.002 0.000 1.188 2269 N CA 0.280 53.355 53.050 0.041 0.000 1.065 2269 N CB -0.111 38.413 38.487 0.062 0.000 1.415 2269 N HN 0.510 nan 8.380 nan 0.000 0.511 2270 F N 2.988 122.813 119.950 -0.208 0.000 2.113 2270 F HA -0.154 4.395 4.527 0.037 0.000 0.297 2270 F C 0.949 176.604 175.800 -0.242 0.000 1.103 2270 F CA 1.431 59.245 58.000 -0.310 0.000 1.248 2270 F CB -0.054 38.649 39.000 -0.496 0.000 0.999 2270 F HN 0.404 nan 8.300 nan 0.000 0.475 2271 Y N 0.496 120.918 120.300 0.202 0.000 2.293 2271 Y HA 0.005 4.577 4.550 0.036 0.000 0.291 2271 Y C 2.643 178.532 175.900 -0.019 0.000 1.137 2271 Y CA 0.829 58.989 58.100 0.100 0.000 1.202 2271 Y CB -1.418 37.101 38.460 0.098 0.000 0.990 2271 Y HN 0.128 nan 8.280 nan 0.000 0.537 2272 G N 0.089 108.956 108.800 0.112 0.000 2.514 2272 G HA2 -0.289 3.693 3.960 0.037 0.000 0.217 2272 G HA3 -0.289 3.693 3.960 0.037 0.000 0.217 2272 G C 1.522 176.410 174.900 -0.020 0.000 1.198 2272 G CA 1.241 46.360 45.100 0.032 0.000 0.780 2272 G HN 0.417 nan 8.290 nan 0.000 0.565 2273 E N -0.255 119.894 120.200 -0.085 0.000 2.070 2273 E HA -0.170 4.202 4.350 0.037 0.000 0.197 2273 E C 2.420 178.931 176.600 -0.149 0.000 1.004 2273 E CA 1.035 57.351 56.400 -0.139 0.000 0.805 2273 E CB -0.260 29.268 29.700 -0.287 0.000 0.744 2273 E HN 0.310 nan 8.360 nan 0.000 0.451 2274 L N 0.772 121.878 121.223 -0.195 0.000 2.042 2274 L HA -0.175 4.187 4.340 0.037 0.000 0.210 2274 L C 2.239 179.102 176.870 -0.012 0.000 1.076 2274 L CA 1.371 56.145 54.840 -0.110 0.000 0.749 2274 L CB -0.408 41.645 42.059 -0.011 0.000 0.893 2274 L HN -0.031 nan 8.230 nan 0.000 0.432 2275 V N -0.177 119.742 119.914 0.009 0.000 2.233 2275 V HA -0.333 3.809 4.120 0.037 0.000 0.247 2275 V C 2.332 178.453 176.094 0.046 0.000 1.050 2275 V CA 2.123 64.430 62.300 0.011 0.000 1.010 2275 V CB -0.778 31.001 31.823 -0.073 0.000 0.637 2275 V HN 0.434 nan 8.190 nan 0.000 0.444 2276 D N -0.198 120.219 120.400 0.028 0.000 2.097 2276 D HA -0.122 4.540 4.640 0.037 0.000 0.195 2276 D C 2.141 178.466 176.300 0.041 0.000 0.989 2276 D CA 0.991 55.020 54.000 0.050 0.000 0.827 2276 D CB -0.297 40.520 40.800 0.029 0.000 0.966 2276 D HN 0.169 nan 8.370 nan 0.000 0.456 2277 L N 0.573 121.802 121.223 0.009 0.000 2.083 2277 L HA -0.069 4.293 4.340 0.037 0.000 0.209 2277 L C 2.460 179.348 176.870 0.030 0.000 1.083 2277 L CA 1.637 56.480 54.840 0.005 0.000 0.752 2277 L CB -1.521 40.517 42.059 -0.034 0.000 0.899 2277 L HN 0.093 nan 8.230 nan 0.000 0.433 2278 G N -0.859 107.967 108.800 0.042 0.000 2.418 2278 G HA2 -0.159 3.823 3.960 0.037 0.000 0.217 2278 G HA3 -0.159 3.823 3.960 0.037 0.000 0.217 2278 G C 1.721 176.680 174.900 0.098 0.000 1.158 2278 G CA 0.868 46.011 45.100 0.071 0.000 0.771 2278 G HN 0.261 nan 8.290 nan 0.000 0.545 2279 V N 0.648 120.629 119.914 0.113 0.000 2.427 2279 V HA -0.112 4.030 4.120 0.037 0.000 0.248 2279 V C 2.662 178.801 176.094 0.074 0.000 1.051 2279 V CA 2.007 64.377 62.300 0.116 0.000 1.048 2279 V CB -0.332 31.586 31.823 0.158 0.000 0.666 2279 V HN 0.338 nan 8.190 nan 0.000 0.456 2280 K N -0.138 120.300 120.400 0.063 0.000 2.097 2280 K HA -0.159 4.183 4.320 0.037 0.000 0.206 2280 K C 1.800 178.425 176.600 0.042 0.000 1.049 2280 K CA 1.168 57.482 56.287 0.045 0.000 0.933 2280 K CB 0.034 32.556 32.500 0.037 0.000 0.717 2280 K HN 0.364 nan 8.250 nan 0.000 0.442 2281 E N 0.600 120.829 120.200 0.049 0.000 2.465 2281 E HA -0.014 4.358 4.350 0.037 0.000 0.191 2281 E C -0.113 176.520 176.600 0.055 0.000 1.053 2281 E CA 0.144 56.572 56.400 0.048 0.000 0.869 2281 E CB 0.501 30.231 29.700 0.049 0.000 0.977 2281 E HN 0.149 nan 8.360 nan 0.000 0.483 2282 K N -0.367 120.069 120.400 0.059 0.000 3.281 2282 K HA -0.193 4.149 4.320 0.037 0.000 0.295 2282 K C 1.004 177.654 176.600 0.083 0.000 1.233 2282 K CA 0.438 56.760 56.287 0.059 0.000 0.866 2282 K CB -2.100 30.424 32.500 0.040 0.000 1.265 2282 K HN 0.257 nan 8.250 nan 0.000 0.482 2283 L N -0.340 120.952 121.223 0.116 0.000 2.307 2283 L HA 0.174 4.535 4.340 0.037 0.000 0.211 2283 L C 1.190 178.222 176.870 0.271 0.000 1.099 2283 L CA 0.659 55.610 54.840 0.185 0.000 0.816 2283 L CB 0.089 42.264 42.059 0.192 0.000 0.952 2283 L HN 0.107 nan 8.230 nan 0.000 0.455 2284 I N -0.307 120.390 120.570 0.212 0.000 2.404 2284 I HA 0.199 4.391 4.170 0.037 0.000 0.293 2284 I C -0.237 175.968 176.117 0.147 0.000 0.992 2284 I CA -0.601 60.840 61.300 0.235 0.000 1.149 2284 I CB 2.116 40.256 38.000 0.234 0.000 1.315 2284 I HN -0.120 nan 8.210 nan 0.000 0.446 2285 E N 5.529 125.796 120.200 0.113 0.000 2.259 2285 E HA 0.226 4.598 4.350 0.037 0.000 0.281 2285 E C -0.711 175.872 176.600 -0.029 0.000 1.027 2285 E CA -0.292 56.129 56.400 0.035 0.000 0.838 2285 E CB 0.976 30.685 29.700 0.014 0.000 1.066 2285 E HN 0.275 nan 8.360 nan 0.000 0.401 2286 K N 2.718 123.054 120.400 -0.106 0.000 2.464 2286 K HA 0.492 4.834 4.320 0.037 0.000 0.252 2286 K C -1.362 175.139 176.600 -0.166 0.000 1.000 2286 K CA -0.598 55.520 56.287 -0.282 0.000 0.951 2286 K CB 0.932 33.197 32.500 -0.392 0.000 1.183 2286 K HN 0.516 nan 8.250 nan 0.000 0.445 2287 A N 3.745 126.504 122.820 -0.102 0.000 3.016 2287 A HA 0.501 4.843 4.320 0.037 0.000 0.303 2287 A C 0.920 178.514 177.584 0.015 0.000 1.507 2287 A CA 0.363 52.385 52.037 -0.024 0.000 1.196 2287 A CB -0.458 18.544 19.000 0.004 0.000 1.169 2287 A HN 1.056 nan 8.150 nan 0.000 0.544 2288 G N 1.452 110.230 108.800 -0.037 0.000 2.889 2288 G HA2 -0.142 3.839 3.960 0.037 0.000 0.308 2288 G HA3 -0.142 3.839 3.960 0.037 0.000 0.308 2288 G C 1.339 176.201 174.900 -0.062 0.000 1.248 2288 G CA 0.812 45.901 45.100 -0.018 0.000 0.982 2288 G HN 1.895 nan 8.290 nan 0.000 0.571 2289 A N -0.781 122.034 122.820 -0.008 0.000 2.348 2289 A HA 0.541 4.883 4.320 0.037 0.000 0.224 2289 A C 0.465 177.957 177.584 -0.153 0.000 1.227 2289 A CA 0.463 52.453 52.037 -0.080 0.000 0.885 2289 A CB 0.060 19.002 19.000 -0.096 0.000 0.933 2289 A HN 0.545 nan 8.150 nan 0.000 0.506 2290 W N -0.688 120.549 121.300 -0.105 0.000 2.390 2290 W HA 0.572 5.254 4.660 0.036 0.000 0.312 2290 W C -0.857 175.553 176.519 -0.181 0.000 1.123 2290 W CA -0.087 57.224 57.345 -0.057 0.000 1.202 2290 W CB 0.568 29.998 29.460 -0.051 0.000 1.251 2290 W HN 0.188 nan 8.180 nan 0.000 0.511 2291 Y N 2.393 122.800 120.300 0.179 0.000 2.328 2291 Y HA 0.455 5.027 4.550 0.037 0.000 0.337 2291 Y C 0.302 176.241 175.900 0.064 0.000 0.966 2291 Y CA -0.563 57.587 58.100 0.083 0.000 1.136 2291 Y CB 1.499 39.964 38.460 0.009 0.000 1.170 2291 Y HN 0.141 nan 8.280 nan 0.000 0.470 2292 S N 3.027 118.818 115.700 0.152 0.000 2.482 2292 S HA 0.407 4.899 4.470 0.037 0.000 0.303 2292 S C -1.825 172.842 174.600 0.111 0.000 1.091 2292 S CA -0.753 57.489 58.200 0.071 0.000 1.057 2292 S CB 1.109 64.321 63.200 0.020 0.000 1.031 2292 S HN 0.496 nan 8.310 nan 0.000 0.485 2293 Y N 2.850 123.094 120.300 -0.094 0.000 2.331 2293 Y HA 0.371 4.943 4.550 0.036 0.000 0.334 2293 Y C 0.218 176.102 175.900 -0.026 0.000 0.960 2293 Y CA -0.996 57.077 58.100 -0.045 0.000 1.130 2293 Y CB 0.536 38.970 38.460 -0.043 0.000 1.164 2293 Y HN 0.804 nan 8.280 nan 0.000 0.458 2294 K N 4.952 125.022 120.400 -0.551 0.000 3.071 2294 K HA -0.268 4.074 4.320 0.037 0.000 0.262 2294 K C 0.959 177.430 176.600 -0.214 0.000 0.977 2294 K CA 1.010 57.025 56.287 -0.454 0.000 0.721 2294 K CB -1.621 30.494 32.500 -0.641 0.000 1.293 2294 K HN 1.325 nan 8.250 nan 0.000 0.475 2295 G N 0.146 108.863 108.800 -0.139 0.000 2.320 2295 G HA2 -0.373 3.609 3.960 0.037 0.000 0.242 2295 G HA3 -0.373 3.609 3.960 0.037 0.000 0.242 2295 G C -0.052 174.801 174.900 -0.079 0.000 1.033 2295 G CA 0.501 45.545 45.100 -0.093 0.000 0.620 2295 G HN 0.514 nan 8.290 nan 0.000 0.517 2296 E N 1.714 121.868 120.200 -0.076 0.000 2.259 2296 E HA 0.363 4.735 4.350 0.037 0.000 0.281 2296 E C 0.179 176.720 176.600 -0.100 0.000 1.037 2296 E CA -0.504 55.857 56.400 -0.065 0.000 0.854 2296 E CB 0.259 29.944 29.700 -0.025 0.000 1.051 2296 E HN 0.322 nan 8.360 nan 0.000 0.409 2297 K N 5.084 125.437 120.400 -0.079 0.000 2.379 2297 K HA 0.117 4.459 4.320 0.037 0.000 0.284 2297 K C 0.923 177.439 176.600 -0.140 0.000 1.044 2297 K CA 0.072 56.346 56.287 -0.022 0.000 0.974 2297 K CB 0.660 33.185 32.500 0.041 0.000 0.962 2297 K HN 0.575 nan 8.250 nan 0.000 0.474 2298 I N -1.685 118.734 120.570 -0.251 0.000 4.187 2298 I HA 0.292 4.484 4.170 0.037 0.000 0.326 2298 I C 0.610 176.530 176.117 -0.329 0.000 1.302 2298 I CA -0.303 60.551 61.300 -0.743 0.000 1.196 2298 I CB 1.018 38.256 38.000 -1.269 0.000 1.095 2298 I HN 0.540 nan 8.210 nan 0.000 0.411 2299 G N 0.770 109.544 108.800 -0.044 0.000 2.506 2299 G HA2 0.380 4.362 3.960 0.037 0.000 0.292 2299 G HA3 0.380 4.362 3.960 0.037 0.000 0.292 2299 G C -2.100 172.703 174.900 -0.162 0.000 1.425 2299 G CA -0.571 44.492 45.100 -0.061 0.000 0.788 2299 G HN 0.116 nan 8.290 nan 0.000 0.490 2300 Q N 0.109 119.689 119.800 -0.368 0.000 2.363 2300 Q HA 0.528 4.890 4.340 0.037 0.000 0.265 2300 Q C 0.122 175.971 176.000 -0.252 0.000 1.032 2300 Q CA 0.233 55.661 55.803 -0.625 0.000 0.746 2300 Q CB 1.104 29.239 28.738 -1.005 0.000 1.237 2300 Q HN 2.188 nan 8.270 nan 0.000 0.475 2301 G N 2.840 111.640 108.800 -0.001 0.000 2.764 2301 G HA2 -0.263 3.719 3.960 0.037 0.000 0.686 2301 G HA3 -0.263 3.719 3.960 0.037 0.000 0.686 2301 G C 0.186 175.030 174.900 -0.094 0.000 1.258 2301 G CA 0.012 45.162 45.100 0.082 0.000 0.846 2301 G HN 0.755 nan 8.290 nan 0.000 0.596 2302 K N 1.141 121.467 120.400 -0.123 0.000 2.144 2302 K HA -0.191 4.151 4.320 0.037 0.000 0.209 2302 K C 2.898 179.363 176.600 -0.225 0.000 1.047 2302 K CA 2.719 58.805 56.287 -0.336 0.000 0.927 2302 K CB -0.353 32.073 32.500 -0.125 0.000 0.716 2302 K HN 1.241 nan 8.250 nan 0.000 0.454 2303 A N 1.340 124.086 122.820 -0.124 0.000 1.869 2303 A HA -0.288 4.054 4.320 0.037 0.000 0.218 2303 A C 1.767 179.300 177.584 -0.084 0.000 1.203 2303 A CA 2.327 54.315 52.037 -0.081 0.000 0.638 2303 A CB -0.994 17.971 19.000 -0.057 0.000 0.831 2303 A HN 0.623 nan 8.150 nan 0.000 0.450 2304 N N -0.229 118.410 118.700 -0.102 0.000 2.171 2304 N HA 0.066 4.828 4.740 0.037 0.000 0.184 2304 N C 1.958 177.440 175.510 -0.046 0.000 1.021 2304 N CA 0.960 53.972 53.050 -0.064 0.000 0.854 2304 N CB -0.276 38.164 38.487 -0.079 0.000 0.994 2304 N HN 0.504 nan 8.380 nan 0.000 0.426 2305 A N 0.773 123.494 122.820 -0.166 0.000 1.908 2305 A HA -0.185 4.157 4.320 0.037 0.000 0.218 2305 A C 2.265 179.821 177.584 -0.047 0.000 1.181 2305 A CA 1.912 53.845 52.037 -0.173 0.000 0.627 2305 A CB -1.136 17.518 19.000 -0.576 0.000 0.818 2305 A HN 0.233 nan 8.150 nan 0.000 0.445 2306 T N 0.341 114.843 114.554 -0.088 0.000 2.674 2306 T HA -0.053 4.319 4.350 0.037 0.000 0.265 2306 T C 2.224 176.904 174.700 -0.033 0.000 1.039 2306 T CA 1.756 63.845 62.100 -0.018 0.000 1.150 2306 T CB -0.531 68.338 68.868 0.001 0.000 0.864 2306 T HN 0.628 nan 8.240 nan 0.000 0.427 2307 A N 0.047 122.857 122.820 -0.018 0.000 1.972 2307 A HA -0.106 4.236 4.320 0.037 0.000 0.219 2307 A C 2.035 179.598 177.584 -0.034 0.000 1.169 2307 A CA 1.426 53.444 52.037 -0.032 0.000 0.635 2307 A CB -1.028 17.970 19.000 -0.004 0.000 0.810 2307 A HN 0.719 nan 8.150 nan 0.000 0.446 2308 W N 0.293 121.510 121.300 -0.139 0.000 2.407 2308 W HA -0.049 4.633 4.660 0.037 0.000 0.305 2308 W C 1.725 178.136 176.519 -0.180 0.000 1.196 2308 W CA 1.569 58.842 57.345 -0.120 0.000 1.311 2308 W CB -0.224 29.196 29.460 -0.067 0.000 1.135 2308 W HN 0.229 nan 8.180 nan 0.000 0.514 2309 L N 0.736 121.944 121.223 -0.025 0.000 2.191 2309 L HA -0.222 4.140 4.340 0.037 0.000 0.212 2309 L C 2.477 178.906 176.870 -0.734 0.000 1.103 2309 L CA 1.408 56.068 54.840 -0.300 0.000 0.769 2309 L CB -0.716 41.271 42.059 -0.121 0.000 0.908 2309 L HN -0.040 nan 8.230 nan 0.000 0.438 2310 K N -0.010 119.925 120.400 -0.775 0.000 2.026 2310 K HA -0.192 4.150 4.320 0.037 0.000 0.208 2310 K C 1.531 177.841 176.600 -0.483 0.000 1.048 2310 K CA 1.761 57.580 56.287 -0.780 0.000 0.929 2310 K CB 0.030 32.287 32.500 -0.405 0.000 0.713 2310 K HN 0.219 nan 8.250 nan 0.000 0.439 2311 D N 0.042 120.174 120.400 -0.446 0.000 2.277 2311 D HA -0.051 4.611 4.640 0.037 0.000 0.208 2311 D C -0.272 175.741 176.300 -0.479 0.000 0.962 2311 D CA 0.862 54.622 54.000 -0.399 0.000 0.865 2311 D CB 0.015 40.594 40.800 -0.369 0.000 0.939 2311 D HN 0.131 nan 8.370 nan 0.000 0.510 2312 N N 0.221 118.528 118.700 -0.656 0.000 3.012 2312 N HA 0.196 4.958 4.740 0.037 0.000 0.270 2312 N C -2.133 173.150 175.510 -0.379 0.000 1.469 2312 N CA -1.137 51.556 53.050 -0.595 0.000 0.928 2312 N CB 1.719 39.599 38.487 -1.011 0.000 1.219 2312 N HN -0.074 nan 8.380 nan 0.000 0.492 2313 P HA -0.117 nan 4.420 nan 0.000 0.220 2313 P C 0.977 178.231 177.300 -0.077 0.000 1.148 2313 P CA 1.045 64.068 63.100 -0.130 0.000 0.803 2313 P CB 0.506 32.154 31.700 -0.086 0.000 0.782 2314 E N -0.495 119.650 120.200 -0.091 0.000 2.051 2314 E HA -0.109 4.263 4.350 0.037 0.000 0.192 2314 E C 1.847 178.434 176.600 -0.021 0.000 0.991 2314 E CA 1.617 57.991 56.400 -0.044 0.000 0.799 2314 E CB -1.550 28.126 29.700 -0.040 0.000 0.748 2314 E HN 0.292 nan 8.360 nan 0.000 0.449 2315 T N 1.487 116.012 114.554 -0.049 0.000 2.904 2315 T HA 0.009 4.381 4.350 0.037 0.000 0.267 2315 T C 2.028 176.706 174.700 -0.036 0.000 1.059 2315 T CA 1.137 63.235 62.100 -0.003 0.000 1.137 2315 T CB -0.159 68.728 68.868 0.032 0.000 0.879 2315 T HN 0.257 nan 8.240 nan 0.000 0.467 2316 A N 2.284 125.077 122.820 -0.044 0.000 1.877 2316 A HA -0.114 4.228 4.320 0.037 0.000 0.216 2316 A C 2.337 179.973 177.584 0.087 0.000 1.186 2316 A CA 1.139 53.200 52.037 0.041 0.000 0.620 2316 A CB -0.323 18.741 19.000 0.107 0.000 0.822 2316 A HN 0.206 nan 8.150 nan 0.000 0.443 2317 K N -0.202 120.237 120.400 0.066 0.000 2.063 2317 K HA -0.197 4.145 4.320 0.037 0.000 0.208 2317 K C 1.938 178.574 176.600 0.060 0.000 1.048 2317 K CA 1.624 57.950 56.287 0.064 0.000 0.928 2317 K CB -0.436 32.085 32.500 0.034 0.000 0.713 2317 K HN 0.787 nan 8.250 nan 0.000 0.442 2318 E N 0.695 120.927 120.200 0.052 0.000 2.077 2318 E HA -0.158 4.214 4.350 0.037 0.000 0.193 2318 E C 2.064 178.707 176.600 0.071 0.000 0.989 2318 E CA 0.976 57.418 56.400 0.070 0.000 0.800 2318 E CB -0.009 29.750 29.700 0.099 0.000 0.746 2318 E HN 0.248 nan 8.360 nan 0.000 0.452 2319 I N 0.797 121.386 120.570 0.031 0.000 2.286 2319 I HA -0.199 3.993 4.170 0.037 0.000 0.245 2319 I C 2.691 178.839 176.117 0.052 0.000 1.104 2319 I CA 1.080 62.393 61.300 0.021 0.000 1.397 2319 I CB -0.373 37.579 38.000 -0.081 0.000 1.072 2319 I HN 0.215 nan 8.210 nan 0.000 0.417 2320 E N 1.816 122.059 120.200 0.071 0.000 2.070 2320 E HA -0.313 4.059 4.350 0.037 0.000 0.197 2320 E C 2.259 178.899 176.600 0.068 0.000 1.004 2320 E CA 1.553 58.004 56.400 0.085 0.000 0.805 2320 E CB -0.026 29.769 29.700 0.157 0.000 0.744 2320 E HN 0.282 nan 8.360 nan 0.000 0.451 2321 K N 0.619 121.059 120.400 0.067 0.000 2.044 2321 K HA -0.221 4.121 4.320 0.037 0.000 0.210 2321 K C 2.185 178.816 176.600 0.052 0.000 1.049 2321 K CA 1.748 58.069 56.287 0.055 0.000 0.927 2321 K CB -0.038 32.494 32.500 0.052 0.000 0.713 2321 K HN 0.008 nan 8.250 nan 0.000 0.443 2322 K N 0.060 120.496 120.400 0.060 0.000 2.097 2322 K HA -0.095 4.247 4.320 0.037 0.000 0.206 2322 K C 1.997 178.628 176.600 0.051 0.000 1.049 2322 K CA 1.124 57.448 56.287 0.061 0.000 0.933 2322 K CB 0.043 32.593 32.500 0.082 0.000 0.717 2322 K HN -0.023 nan 8.250 nan 0.000 0.442 2323 V N 1.139 121.081 119.914 0.047 0.000 2.295 2323 V HA -0.251 3.891 4.120 0.037 0.000 0.246 2323 V C 2.152 178.261 176.094 0.026 0.000 1.049 2323 V CA 1.680 64.000 62.300 0.032 0.000 1.024 2323 V CB -0.427 31.407 31.823 0.017 0.000 0.648 2323 V HN 0.280 nan 8.190 nan 0.000 0.447 2324 R N -0.096 120.421 120.500 0.029 0.000 2.091 2324 R HA -0.192 4.170 4.340 0.037 0.000 0.238 2324 R C 2.317 178.633 176.300 0.027 0.000 1.136 2324 R CA 1.844 57.959 56.100 0.026 0.000 0.959 2324 R CB -0.343 29.976 30.300 0.032 0.000 0.856 2324 R HN 0.624 nan 8.270 nan 0.000 0.437 2325 E N 0.599 120.818 120.200 0.031 0.000 2.077 2325 E HA -0.175 4.197 4.350 0.037 0.000 0.193 2325 E C 2.031 178.648 176.600 0.030 0.000 0.989 2325 E CA 0.969 57.387 56.400 0.030 0.000 0.800 2325 E CB -0.071 29.649 29.700 0.034 0.000 0.746 2325 E HN 0.296 nan 8.360 nan 0.000 0.452 2326 L N 0.115 121.357 121.223 0.032 0.000 2.217 2326 L HA -0.102 4.260 4.340 0.037 0.000 0.211 2326 L C 1.915 178.802 176.870 0.027 0.000 1.107 2326 L CA 0.805 55.663 54.840 0.031 0.000 0.783 2326 L CB 0.137 42.217 42.059 0.035 0.000 0.919 2326 L HN 0.160 nan 8.230 nan 0.000 0.442 2327 L N -1.452 119.785 121.223 0.024 0.000 3.039 2327 L HA 0.212 4.574 4.340 0.037 0.000 0.269 2327 L C 0.198 177.080 176.870 0.020 0.000 1.169 2327 L CA -0.276 54.577 54.840 0.022 0.000 0.986 2327 L CB 0.756 42.825 42.059 0.017 0.000 1.377 2327 L HN 0.034 nan 8.230 nan 0.000 0.575 2328 L N 0.731 121.966 121.223 0.020 0.000 2.313 2328 L HA 0.103 4.465 4.340 0.037 0.000 0.282 2328 L C 1.541 178.424 176.870 0.022 0.000 1.092 2328 L CA -0.027 54.824 54.840 0.018 0.000 0.831 2328 L CB 1.641 43.709 42.059 0.017 0.000 1.159 2328 L HN 0.186 nan 8.230 nan 0.000 0.442 2329 S N 1.678 117.392 115.700 0.022 0.000 2.425 2329 S HA 0.004 4.496 4.470 0.037 0.000 0.225 2329 S C 0.532 175.151 174.600 0.033 0.000 1.024 2329 S CA 0.135 58.354 58.200 0.031 0.000 0.951 2329 S CB -0.007 63.215 63.200 0.037 0.000 0.796 2329 S HN 0.749 nan 8.310 nan 0.000 0.498 2330 N N 2.159 120.874 118.700 0.025 0.000 2.664 2330 N HA 0.481 5.243 4.740 0.037 0.000 0.257 2330 N C -3.453 172.067 175.510 0.018 0.000 1.108 2330 N CA -1.711 51.355 53.050 0.026 0.000 0.822 2330 N CB 1.055 39.560 38.487 0.031 0.000 1.199 2330 N HN 0.171 nan 8.380 nan 0.000 0.529 2331 P HA 0.154 nan 4.420 nan 0.000 0.276 2331 P C 0.681 177.989 177.300 0.013 0.000 1.235 2331 P CA -0.277 62.832 63.100 0.016 0.000 0.772 2331 P CB 0.758 32.468 31.700 0.018 0.000 0.871 2332 N N 2.055 120.761 118.700 0.010 0.000 2.417 2332 N HA -0.103 4.659 4.740 0.037 0.000 0.217 2332 N C 0.205 175.721 175.510 0.009 0.000 1.206 2332 N CA 1.261 54.316 53.050 0.008 0.000 0.754 2332 N CB -0.069 38.422 38.487 0.007 0.000 0.800 2332 N HN 0.550 nan 8.380 nan 0.000 0.329 3002 I N 0.959 121.530 120.570 0.001 0.000 2.947 3002 I HA 0.063 4.255 4.170 0.037 0.000 0.263 3002 I C 1.759 177.876 176.117 0.001 0.000 1.130 3002 I CA 1.161 62.462 61.300 0.001 0.000 1.448 3002 I CB -0.056 37.945 38.000 0.001 0.000 1.222 3002 I HN 0.367 nan 8.210 nan 0.000 0.453 3003 D N 1.067 121.467 120.400 -0.000 0.000 2.355 3003 D HA -0.116 4.545 4.640 0.037 0.000 0.218 3003 D C 1.421 177.721 176.300 -0.001 0.000 1.004 3003 D CA 0.609 54.609 54.000 -0.001 0.000 0.880 3003 D CB -0.265 40.534 40.800 -0.003 0.000 0.911 3003 D HN 0.419 nan 8.370 nan 0.000 0.528 3004 E N 0.175 120.375 120.200 -0.000 0.000 2.158 3004 E HA -0.035 4.337 4.350 0.037 0.000 0.191 3004 E C 1.588 178.189 176.600 0.001 0.000 0.982 3004 E CA 0.281 56.681 56.400 0.000 0.000 0.823 3004 E CB -0.039 29.661 29.700 0.000 0.000 0.766 3004 E HN 0.211 nan 8.360 nan 0.000 0.468 3005 N N 1.225 119.926 118.700 0.002 0.000 2.270 3005 N HA -0.090 4.672 4.740 0.037 0.000 0.181 3005 N C 1.463 176.975 175.510 0.003 0.000 1.016 3005 N CA 0.812 53.864 53.050 0.003 0.000 0.870 3005 N CB 0.074 38.564 38.487 0.004 0.000 0.979 3005 N HN 0.160 nan 8.380 nan 0.000 0.431 3006 K N 0.921 121.323 120.400 0.002 0.000 2.057 3006 K HA -0.062 4.280 4.320 0.037 0.000 0.207 3006 K C 1.881 178.482 176.600 0.002 0.000 1.049 3006 K CA 0.940 57.229 56.287 0.002 0.000 0.931 3006 K CB -0.007 32.493 32.500 0.001 0.000 0.714 3006 K HN 0.262 nan 8.250 nan 0.000 0.440 3007 Q N 0.522 120.323 119.800 0.002 0.000 2.297 3007 Q HA -0.104 4.258 4.340 0.037 0.000 0.204 3007 Q C 1.955 177.957 176.000 0.003 0.000 0.962 3007 Q CA 0.782 56.586 55.803 0.002 0.000 0.879 3007 Q CB 0.127 28.865 28.738 0.001 0.000 0.947 3007 Q HN 0.258 nan 8.270 nan 0.000 0.462 3008 K N 0.894 121.296 120.400 0.003 0.000 1.985 3008 K HA -0.123 4.219 4.320 0.037 0.000 0.210 3008 K C 1.962 178.565 176.600 0.006 0.000 1.047 3008 K CA 1.289 57.578 56.287 0.004 0.000 0.932 3008 K CB -0.081 32.421 32.500 0.004 0.000 0.716 3008 K HN 0.112 nan 8.250 nan 0.000 0.439 3009 A N 1.089 123.913 122.820 0.006 0.000 2.066 3009 A HA -0.089 4.253 4.320 0.037 0.000 0.218 3009 A C 1.963 179.552 177.584 0.008 0.000 1.157 3009 A CA 0.918 52.960 52.037 0.007 0.000 0.670 3009 A CB -0.410 18.595 19.000 0.007 0.000 0.804 3009 A HN 0.408 nan 8.150 nan 0.000 0.453 3010 L N -0.137 121.090 121.223 0.007 0.000 1.973 3010 L HA -0.018 4.344 4.340 0.037 0.000 0.208 3010 L C 2.667 179.542 176.870 0.009 0.000 1.073 3010 L CA 2.339 57.183 54.840 0.007 0.000 0.746 3010 L CB -0.818 41.243 42.059 0.004 0.000 0.891 3010 L HN 0.280 nan 8.230 nan 0.000 0.433 3011 A N -0.260 122.565 122.820 0.008 0.000 1.948 3011 A HA -0.203 4.139 4.320 0.037 0.000 0.220 3011 A C 2.438 180.028 177.584 0.011 0.000 1.177 3011 A CA 2.124 54.167 52.037 0.009 0.000 0.636 3011 A CB -1.353 17.651 19.000 0.007 0.000 0.815 3011 A HN 0.680 nan 8.150 nan 0.000 0.449 3012 A N -0.325 122.501 122.820 0.010 0.000 1.933 3012 A HA 0.148 4.490 4.320 0.037 0.000 0.218 3012 A C 2.489 180.082 177.584 0.016 0.000 1.175 3012 A CA 2.121 54.165 52.037 0.011 0.000 0.628 3012 A CB -0.924 18.081 19.000 0.010 0.000 0.814 3012 A HN 1.073 nan 8.150 nan 0.000 0.444 3013 A N -0.744 122.087 122.820 0.018 0.000 1.898 3013 A HA 0.074 4.416 4.320 0.037 0.000 0.216 3013 A C 2.034 179.638 177.584 0.033 0.000 1.181 3013 A CA 1.503 53.556 52.037 0.025 0.000 0.620 3013 A CB -0.513 18.500 19.000 0.022 0.000 0.819 3013 A HN 0.392 nan 8.150 nan 0.000 0.442 3014 L N -0.069 121.171 121.223 0.028 0.000 2.083 3014 L HA -0.054 4.308 4.340 0.037 0.000 0.209 3014 L C 2.746 179.636 176.870 0.034 0.000 1.083 3014 L CA 1.731 56.591 54.840 0.032 0.000 0.752 3014 L CB -0.873 41.201 42.059 0.024 0.000 0.899 3014 L HN 0.412 nan 8.230 nan 0.000 0.433 3015 G N -1.219 107.596 108.800 0.024 0.000 2.421 3015 G HA2 -0.363 3.619 3.960 0.037 0.000 0.216 3015 G HA3 -0.363 3.619 3.960 0.037 0.000 0.216 3015 G C 1.471 176.382 174.900 0.019 0.000 1.171 3015 G CA 0.915 46.026 45.100 0.019 0.000 0.775 3015 G HN 0.410 nan 8.290 nan 0.000 0.543 3016 Q N 0.642 120.454 119.800 0.020 0.000 2.029 3016 Q HA -0.175 4.187 4.340 0.037 0.000 0.209 3016 Q C 2.361 178.380 176.000 0.032 0.000 0.999 3016 Q CA 2.072 57.886 55.803 0.018 0.000 0.857 3016 Q CB -0.539 28.214 28.738 0.026 0.000 0.926 3016 Q HN 0.541 nan 8.270 nan 0.000 0.415 3017 I N 0.261 120.878 120.570 0.079 0.000 2.163 3017 I HA -0.264 3.928 4.170 0.037 0.000 0.243 3017 I C 2.403 178.610 176.117 0.151 0.000 1.085 3017 I CA 1.828 63.227 61.300 0.166 0.000 1.347 3017 I CB -0.395 37.700 38.000 0.158 0.000 1.044 3017 I HN 0.364 nan 8.210 nan 0.000 0.408 3018 E N 0.434 120.687 120.200 0.088 0.000 2.152 3018 E HA -0.170 4.202 4.350 0.037 0.000 0.192 3018 E C 1.738 178.357 176.600 0.032 0.000 0.983 3018 E CA 0.605 57.048 56.400 0.072 0.000 0.818 3018 E CB 0.006 29.737 29.700 0.051 0.000 0.758 3018 E HN 0.312 nan 8.360 nan 0.000 0.467 3019 K N 0.589 120.989 120.400 0.001 0.000 2.522 3019 K HA 0.004 4.346 4.320 0.037 0.000 0.194 3019 K C 1.319 177.864 176.600 -0.091 0.000 1.026 3019 K CA 0.222 56.490 56.287 -0.031 0.000 1.119 3019 K CB 0.313 32.797 32.500 -0.026 0.000 0.856 3019 K HN 0.120 nan 8.250 nan 0.000 0.513 3020 Q N -1.541 118.175 119.800 -0.140 0.000 2.459 3020 Q HA 0.113 4.475 4.340 0.037 0.000 0.260 3020 Q C 0.057 175.712 176.000 -0.576 0.000 0.828 3020 Q CA 0.292 55.854 55.803 -0.400 0.000 0.987 3020 Q CB 0.736 29.148 28.738 -0.545 0.000 1.216 3020 Q HN 0.162 nan 8.270 nan 0.000 0.558 3021 F N 0.013 119.968 119.950 0.009 0.000 2.775 3021 F HA 0.439 4.988 4.527 0.037 0.000 0.313 3021 F C 0.484 176.293 175.800 0.015 0.000 1.121 3021 F CA 0.247 58.255 58.000 0.012 0.000 1.206 3021 F CB 1.765 40.773 39.000 0.013 0.000 1.052 3021 F HN 0.035 nan 8.300 nan 0.000 0.524 3022 G N 0.308 109.182 108.800 0.123 0.000 2.539 3022 G HA2 -0.123 3.859 3.960 0.037 0.000 0.686 3022 G HA3 -0.123 3.859 3.960 0.037 0.000 0.686 3022 G C 0.538 175.480 174.900 0.070 0.000 1.258 3022 G CA -0.910 44.242 45.100 0.087 0.000 0.846 3022 G HN -0.110 nan 8.290 nan 0.000 0.647 3023 K N 0.116 120.545 120.400 0.049 0.000 2.052 3023 K HA -0.159 4.182 4.320 0.037 0.000 0.215 3023 K C 1.801 178.427 176.600 0.042 0.000 1.053 3023 K CA 2.163 58.473 56.287 0.038 0.000 0.934 3023 K CB -0.338 32.181 32.500 0.031 0.000 0.717 3023 K HN 1.467 nan 8.250 nan 0.000 0.450 3024 G N 0.675 109.504 108.800 0.048 0.000 4.885 3024 G HA2 0.165 4.147 3.960 0.037 0.000 0.263 3024 G HA3 0.165 4.147 3.960 0.037 0.000 0.263 3024 G C 0.756 175.686 174.900 0.050 0.000 1.168 3024 G CA 0.158 45.284 45.100 0.044 0.000 0.906 3024 G HN 0.214 nan 8.290 nan 0.000 0.575 3025 S N -0.088 115.652 115.700 0.067 0.000 2.383 3025 S HA 0.113 4.605 4.470 0.037 0.000 0.227 3025 S C 0.947 175.570 174.600 0.038 0.000 1.026 3025 S CA 0.453 58.693 58.200 0.067 0.000 0.981 3025 S CB 0.269 63.539 63.200 0.116 0.000 0.818 3025 S HN 0.472 nan 8.310 nan 0.000 0.472 3026 I N 1.738 122.333 120.570 0.041 0.000 2.498 3026 I HA 0.613 4.805 4.170 0.037 0.000 0.290 3026 I C -0.979 175.153 176.117 0.025 0.000 1.032 3026 I CA -1.341 59.974 61.300 0.026 0.000 1.073 3026 I CB 1.733 39.748 38.000 0.025 0.000 1.251 3026 I HN 0.461 nan 8.210 nan 0.000 0.426 3027 M N 4.618 124.229 119.600 0.018 0.000 2.880 3027 M HA 0.572 5.074 4.480 0.037 0.000 0.269 3027 M C -1.139 175.167 176.300 0.010 0.000 1.248 3027 M CA -1.093 54.216 55.300 0.015 0.000 0.821 3027 M CB 1.400 34.009 32.600 0.015 0.000 1.650 3027 M HN 0.273 nan 8.290 nan 0.000 0.479 3028 R N 1.206 121.709 120.500 0.005 0.000 2.449 3028 R HA 0.235 4.597 4.340 0.037 0.000 0.296 3028 R C 0.989 177.285 176.300 -0.006 0.000 1.047 3028 R CA -0.095 56.005 56.100 -0.001 0.000 1.018 3028 R CB 0.232 30.530 30.300 -0.003 0.000 0.962 3028 R HN 0.681 nan 8.270 nan 0.000 0.428 3029 L N 2.465 123.679 121.223 -0.015 0.000 2.081 3029 L HA -0.195 4.167 4.340 0.037 0.000 0.212 3029 L C 1.758 178.614 176.870 -0.024 0.000 1.080 3029 L CA 2.105 56.929 54.840 -0.027 0.000 0.754 3029 L CB -0.390 41.636 42.059 -0.053 0.000 0.893 3029 L HN 0.977 nan 8.230 nan 0.000 0.433 3030 G N -0.457 108.330 108.800 -0.022 0.000 2.471 3030 G HA2 -0.231 3.751 3.960 0.037 0.000 0.219 3030 G HA3 -0.231 3.751 3.960 0.037 0.000 0.219 3030 G C 1.230 176.123 174.900 -0.011 0.000 1.125 3030 G CA 0.750 45.839 45.100 -0.019 0.000 0.775 3030 G HN 0.712 nan 8.290 nan 0.000 0.548 3031 E N -0.457 119.739 120.200 -0.007 0.000 2.490 3031 E HA 0.068 4.440 4.350 0.037 0.000 0.209 3031 E C -0.153 176.447 176.600 0.001 0.000 0.971 3031 E CA -0.436 55.963 56.400 -0.002 0.000 0.988 3031 E CB 0.119 29.819 29.700 -0.000 0.000 1.029 3031 E HN 0.122 nan 8.360 nan 0.000 0.496 3032 D N 1.917 122.317 120.400 0.001 0.000 2.349 3032 D HA 0.005 4.667 4.640 0.037 0.000 0.266 3032 D C 0.706 177.010 176.300 0.006 0.000 1.293 3032 D CA -0.005 53.998 54.000 0.006 0.000 0.926 3032 D CB 0.733 41.536 40.800 0.005 0.000 1.090 3032 D HN -0.011 nan 8.370 nan 0.000 0.502 3033 R N 1.780 122.286 120.500 0.010 0.000 2.090 3033 R HA -0.080 4.282 4.340 0.037 0.000 0.228 3033 R C 1.983 178.292 176.300 0.015 0.000 1.110 3033 R CA 0.719 56.825 56.100 0.011 0.000 0.973 3033 R CB -0.873 29.433 30.300 0.011 0.000 0.869 3033 R HN 0.484 nan 8.270 nan 0.000 0.440 3034 S N -0.272 115.441 115.700 0.021 0.000 2.595 3034 S HA -0.077 4.415 4.470 0.037 0.000 0.235 3034 S C 1.699 176.318 174.600 0.032 0.000 0.974 3034 S CA 0.685 58.903 58.200 0.029 0.000 0.942 3034 S CB -0.039 63.184 63.200 0.038 0.000 0.766 3034 S HN 0.084 nan 8.310 nan 0.000 0.536 3035 M N 1.761 121.374 119.600 0.022 0.000 2.492 3035 M HA 0.284 4.786 4.480 0.037 0.000 0.255 3035 M C -0.420 175.888 176.300 0.013 0.000 1.139 3035 M CA 0.159 55.469 55.300 0.017 0.000 1.096 3035 M CB 0.110 32.711 32.600 0.003 0.000 1.360 3035 M HN 0.087 nan 8.290 nan 0.000 0.480 3036 D N 0.359 120.766 120.400 0.012 0.000 2.368 3036 D HA 0.119 4.781 4.640 0.037 0.000 0.240 3036 D C -0.474 175.834 176.300 0.013 0.000 1.169 3036 D CA 0.170 54.176 54.000 0.010 0.000 0.906 3036 D CB 1.106 41.911 40.800 0.009 0.000 1.187 3036 D HN -0.111 nan 8.370 nan 0.000 0.435 3037 V N 1.593 121.513 119.914 0.011 0.000 2.394 3037 V HA 0.192 4.334 4.120 0.037 0.000 0.282 3037 V C 0.415 176.514 176.094 0.007 0.000 1.031 3037 V CA -0.446 61.860 62.300 0.010 0.000 0.881 3037 V CB 1.437 33.264 31.823 0.006 0.000 0.982 3037 V HN 0.417 nan 8.190 nan 0.000 0.451 3038 E N 3.045 123.249 120.200 0.007 0.000 2.227 3038 E HA 0.670 5.042 4.350 0.037 0.000 0.268 3038 E C -0.736 175.865 176.600 0.002 0.000 0.907 3038 E CA -0.412 55.991 56.400 0.004 0.000 0.786 3038 E CB 2.340 32.044 29.700 0.005 0.000 1.191 3038 E HN 0.826 nan 8.360 nan 0.000 0.411 3039 T N 0.580 115.134 114.554 -0.001 0.000 2.916 3039 T HA 0.630 5.002 4.350 0.037 0.000 0.292 3039 T C -0.374 174.323 174.700 -0.006 0.000 1.064 3039 T CA -0.864 61.234 62.100 -0.004 0.000 1.011 3039 T CB 1.070 69.935 68.868 -0.005 0.000 1.152 3039 T HN 0.262 nan 8.240 nan 0.000 0.510 3040 I N 1.710 122.275 120.570 -0.008 0.000 2.509 3040 I HA 0.423 4.615 4.170 0.037 0.000 0.293 3040 I C 0.754 176.864 176.117 -0.012 0.000 1.020 3040 I CA -0.774 60.519 61.300 -0.012 0.000 1.088 3040 I CB 1.692 39.683 38.000 -0.014 0.000 1.267 3040 I HN 0.954 nan 8.210 nan 0.000 0.430 3041 S N 2.842 118.533 115.700 -0.014 0.000 2.558 3041 S HA 0.038 4.530 4.470 0.037 0.000 0.288 3041 S C 1.354 175.942 174.600 -0.019 0.000 1.318 3041 S CA 0.427 58.620 58.200 -0.011 0.000 1.056 3041 S CB 0.383 63.577 63.200 -0.009 0.000 0.853 3041 S HN 0.812 nan 8.310 nan 0.000 0.505 3042 T N 1.442 115.983 114.554 -0.021 0.000 3.100 3042 T HA 0.349 4.721 4.350 0.037 0.000 0.253 3042 T C 1.506 176.172 174.700 -0.056 0.000 1.118 3042 T CA 0.624 62.704 62.100 -0.033 0.000 1.058 3042 T CB -0.352 68.496 68.868 -0.033 0.000 0.953 3042 T HN 1.649 nan 8.240 nan 0.000 0.515 3043 G N 0.792 109.566 108.800 -0.043 0.000 2.199 3043 G HA2 -0.244 3.738 3.960 0.037 0.000 0.254 3043 G HA3 -0.244 3.738 3.960 0.037 0.000 0.254 3043 G C 0.195 175.059 174.900 -0.059 0.000 0.982 3043 G CA 0.225 45.297 45.100 -0.046 0.000 0.632 3043 G HN 1.096 nan 8.290 nan 0.000 0.529 3044 S N -0.252 115.353 115.700 -0.159 0.000 2.498 3044 S HA 0.635 5.127 4.470 0.037 0.000 0.317 3044 S C 1.155 175.650 174.600 -0.174 0.000 1.090 3044 S CA 0.025 58.039 58.200 -0.310 0.000 1.089 3044 S CB 1.500 64.333 63.200 -0.612 0.000 0.997 3044 S HN 0.926 nan 8.310 nan 0.000 0.470 3045 L N 5.770 126.834 121.223 -0.264 0.000 2.027 3045 L HA 0.025 4.387 4.340 0.037 0.000 0.206 3045 L C 2.573 179.368 176.870 -0.125 0.000 1.074 3045 L CA 2.702 57.411 54.840 -0.218 0.000 0.745 3045 L CB -0.989 40.792 42.059 -0.463 0.000 0.898 3045 L HN 0.896 nan 8.230 nan 0.000 0.433 3046 S N -1.128 114.505 115.700 -0.111 0.000 2.402 3046 S HA -0.205 4.287 4.470 0.037 0.000 0.229 3046 S C 2.104 176.718 174.600 0.024 0.000 1.021 3046 S CA 1.373 59.563 58.200 -0.017 0.000 0.974 3046 S CB -1.028 62.194 63.200 0.037 0.000 0.800 3046 S HN 0.497 nan 8.310 nan 0.000 0.484 3047 L N 1.414 122.656 121.223 0.031 0.000 2.093 3047 L HA -0.100 4.262 4.340 0.037 0.000 0.208 3047 L C 1.903 178.777 176.870 0.007 0.000 1.085 3047 L CA 1.711 56.580 54.840 0.048 0.000 0.755 3047 L CB -0.437 41.656 42.059 0.057 0.000 0.904 3047 L HN 0.198 nan 8.230 nan 0.000 0.435 3048 D N -0.054 120.337 120.400 -0.014 0.000 2.178 3048 D HA -0.166 4.496 4.640 0.037 0.000 0.201 3048 D C 2.173 178.469 176.300 -0.006 0.000 0.980 3048 D CA 1.325 55.318 54.000 -0.010 0.000 0.842 3048 D CB 0.004 40.799 40.800 -0.007 0.000 0.948 3048 D HN 0.394 nan 8.370 nan 0.000 0.472 3049 I N 0.931 121.498 120.570 -0.006 0.000 2.286 3049 I HA -0.174 4.018 4.170 0.037 0.000 0.245 3049 I C 2.448 178.568 176.117 0.005 0.000 1.104 3049 I CA 0.849 62.150 61.300 0.001 0.000 1.397 3049 I CB -0.178 37.823 38.000 0.001 0.000 1.072 3049 I HN -0.104 nan 8.210 nan 0.000 0.417 3050 A N 0.703 123.528 122.820 0.008 0.000 2.024 3050 A HA -0.141 4.201 4.320 0.037 0.000 0.220 3050 A C 2.256 179.833 177.584 -0.013 0.000 1.164 3050 A CA 1.347 53.389 52.037 0.008 0.000 0.643 3050 A CB -0.844 18.167 19.000 0.019 0.000 0.806 3050 A HN 0.419 nan 8.150 nan 0.000 0.451 3051 L N -1.632 119.581 121.223 -0.018 0.000 2.465 3051 L HA 0.027 4.389 4.340 0.037 0.000 0.224 3051 L C 2.214 179.061 176.870 -0.039 0.000 1.145 3051 L CA 0.665 55.483 54.840 -0.036 0.000 0.834 3051 L CB -0.408 41.634 42.059 -0.029 0.000 0.944 3051 L HN 0.625 nan 8.230 nan 0.000 0.451 3052 G N -0.106 108.682 108.800 -0.021 0.000 2.779 3052 G HA2 -0.458 3.524 3.960 0.037 0.000 0.230 3052 G HA3 -0.458 3.524 3.960 0.037 0.000 0.230 3052 G C 1.167 176.062 174.900 -0.008 0.000 1.243 3052 G CA 0.634 45.726 45.100 -0.013 0.000 0.769 3052 G HN 0.453 nan 8.290 nan 0.000 0.516 3053 A N 0.179 122.988 122.820 -0.017 0.000 2.119 3053 A HA 0.515 4.857 4.320 0.037 0.000 0.216 3053 A C 2.759 180.341 177.584 -0.004 0.000 1.152 3053 A CA 2.215 54.245 52.037 -0.011 0.000 0.708 3053 A CB -0.531 18.458 19.000 -0.018 0.000 0.805 3053 A HN 2.671 nan 8.150 nan 0.000 0.460 3054 G N -3.242 105.555 108.800 -0.005 0.000 2.176 3054 G HA2 0.311 4.293 3.960 0.037 0.000 0.232 3054 G HA3 0.311 4.293 3.960 0.037 0.000 0.232 3054 G C 0.822 175.720 174.900 -0.003 0.000 0.986 3054 G CA 0.308 45.407 45.100 -0.000 0.000 0.643 3054 G HN 2.097 nan 8.290 nan 0.000 0.522 3055 G N -1.386 107.409 108.800 -0.008 0.000 2.315 3055 G HA2 0.537 4.519 3.960 0.037 0.000 0.294 3055 G HA3 0.537 4.519 3.960 0.037 0.000 0.294 3055 G C -0.862 174.030 174.900 -0.013 0.000 1.300 3055 G CA -0.508 44.586 45.100 -0.010 0.000 0.843 3055 G HN 0.842 nan 8.290 nan 0.000 0.527 3056 L N 1.976 123.191 121.223 -0.012 0.000 2.371 3056 L HA 0.405 4.767 4.340 0.037 0.000 0.272 3056 L C -1.754 175.112 176.870 -0.008 0.000 1.124 3056 L CA -1.627 53.206 54.840 -0.011 0.000 0.816 3056 L CB 1.391 43.445 42.059 -0.008 0.000 1.129 3056 L HN 0.298 nan 8.230 nan 0.000 0.448 3057 P HA 0.133 nan 4.420 nan 0.000 0.282 3057 P C -0.714 176.589 177.300 0.006 0.000 1.262 3057 P CA -0.468 62.632 63.100 0.000 0.000 0.773 3057 P CB 0.932 32.632 31.700 0.000 0.000 0.879 3058 M N 2.106 121.710 119.600 0.006 0.000 2.238 3058 M HA 0.198 4.700 4.480 0.037 0.000 0.347 3058 M C 1.595 177.906 176.300 0.018 0.000 1.173 3058 M CA 0.856 56.161 55.300 0.008 0.000 1.147 3058 M CB -0.573 32.030 32.600 0.005 0.000 1.547 3058 M HN 0.833 nan 8.290 nan 0.000 0.455 3059 G N 2.548 111.359 108.800 0.017 0.000 2.155 3059 G HA2 -0.211 3.771 3.960 0.037 0.000 0.257 3059 G HA3 -0.211 3.771 3.960 0.037 0.000 0.257 3059 G C 0.238 175.164 174.900 0.044 0.000 0.983 3059 G CA 0.039 45.156 45.100 0.028 0.000 0.676 3059 G HN 0.560 nan 8.290 nan 0.000 0.528 3060 R N -0.968 119.557 120.500 0.042 0.000 2.939 3060 R HA 0.781 5.143 4.340 0.037 0.000 0.254 3060 R C 0.047 176.388 176.300 0.069 0.000 1.123 3060 R CA -1.101 55.037 56.100 0.063 0.000 1.020 3060 R CB 0.811 31.142 30.300 0.053 0.000 1.206 3060 R HN 0.197 nan 8.270 nan 0.000 0.491 3061 I N 0.799 121.434 120.570 0.107 0.000 2.412 3061 I HA 0.368 4.560 4.170 0.037 0.000 0.296 3061 I C -0.425 175.771 176.117 0.131 0.000 0.987 3061 I CA -0.851 60.538 61.300 0.147 0.000 1.180 3061 I CB 1.930 40.065 38.000 0.224 0.000 1.340 3061 I HN -0.019 nan 8.210 nan 0.000 0.455 3062 V N 5.327 125.322 119.914 0.134 0.000 2.656 3062 V HA 0.394 4.536 4.120 0.037 0.000 0.307 3062 V C -0.473 175.720 176.094 0.164 0.000 1.051 3062 V CA -0.686 61.679 62.300 0.107 0.000 0.893 3062 V CB 2.047 33.900 31.823 0.050 0.000 0.999 3062 V HN 0.734 nan 8.190 nan 0.000 0.426 3063 E N 3.830 124.117 120.200 0.145 0.000 2.187 3063 E HA 0.671 5.043 4.350 0.037 0.000 0.268 3063 E C -1.576 175.103 176.600 0.131 0.000 0.896 3063 E CA -0.621 55.885 56.400 0.177 0.000 0.766 3063 E CB 1.711 31.518 29.700 0.178 0.000 1.142 3063 E HN 0.650 nan 8.360 nan 0.000 0.408 3064 I N 5.420 126.065 120.570 0.125 0.000 2.406 3064 I HA 0.350 4.542 4.170 0.037 0.000 0.290 3064 I C -0.927 175.264 176.117 0.123 0.000 0.999 3064 I CA -0.970 60.363 61.300 0.055 0.000 1.124 3064 I CB 0.879 38.902 38.000 0.038 0.000 1.289 3064 I HN 0.513 nan 8.210 nan 0.000 0.441 3065 Y N 3.997 124.324 120.300 0.046 0.000 2.605 3065 Y HA 1.004 5.576 4.550 0.037 0.000 0.343 3065 Y C -0.177 175.765 175.900 0.071 0.000 1.036 3065 Y CA -1.146 56.980 58.100 0.044 0.000 1.065 3065 Y CB 1.956 40.425 38.460 0.014 0.000 1.288 3065 Y HN 0.676 nan 8.280 nan 0.000 0.481 3066 G N 0.537 109.512 108.800 0.293 0.000 2.328 3066 G HA2 0.442 4.424 3.960 0.037 0.000 0.295 3066 G HA3 0.442 4.424 3.960 0.037 0.000 0.295 3066 G C -3.532 171.585 174.900 0.361 0.000 1.413 3066 G CA -1.340 43.903 45.100 0.238 0.000 0.817 3066 G HN 0.494 nan 8.290 nan 0.000 0.546 3067 P HA 0.261 nan 4.420 nan 0.000 0.272 3067 P C -0.227 177.099 177.300 0.044 0.000 1.248 3067 P CA -0.155 63.074 63.100 0.215 0.000 0.799 3067 P CB 0.269 32.010 31.700 0.068 0.000 0.997 3068 E N -0.802 119.075 120.200 -0.538 0.000 2.383 3068 E HA 0.264 4.636 4.350 0.037 0.000 0.264 3068 E C 0.065 176.561 176.600 -0.172 0.000 1.050 3068 E CA -0.434 55.634 56.400 -0.553 0.000 0.896 3068 E CB -0.412 28.726 29.700 -0.938 0.000 0.982 3068 E HN 0.247 nan 8.360 nan 0.000 0.424 3069 S N 0.360 116.020 115.700 -0.067 0.000 3.614 3069 S HA -0.219 4.273 4.470 0.037 0.000 0.360 3069 S C 0.931 175.567 174.600 0.059 0.000 1.023 3069 S CA 0.901 59.098 58.200 -0.005 0.000 1.114 3069 S CB -1.610 61.562 63.200 -0.047 0.000 0.907 3069 S HN 0.732 nan 8.310 nan 0.000 0.470 3070 S N -0.527 115.219 115.700 0.077 0.000 2.470 3070 S HA 0.466 4.958 4.470 0.037 0.000 0.222 3070 S C 1.542 176.209 174.600 0.111 0.000 1.024 3070 S CA 0.888 59.141 58.200 0.088 0.000 0.931 3070 S CB 0.729 63.977 63.200 0.080 0.000 0.791 3070 S HN 1.821 nan 8.310 nan 0.000 0.513 3071 G N 0.971 109.851 108.800 0.134 0.000 2.559 3071 G HA2 -0.117 3.864 3.960 0.037 0.000 0.202 3071 G HA3 -0.117 3.864 3.960 0.037 0.000 0.202 3071 G C 0.676 175.674 174.900 0.162 0.000 0.992 3071 G CA 0.080 45.281 45.100 0.168 0.000 0.764 3071 G HN 0.391 nan 8.290 nan 0.000 0.525 3072 K N 0.496 120.981 120.400 0.142 0.000 1.987 3072 K HA -0.119 4.223 4.320 0.037 0.000 0.216 3072 K C 2.584 179.273 176.600 0.148 0.000 1.051 3072 K CA 2.247 58.614 56.287 0.132 0.000 0.942 3072 K CB -0.602 31.977 32.500 0.131 0.000 0.722 3072 K HN 0.320 nan 8.250 nan 0.000 0.444 3073 T N 0.937 115.590 114.554 0.165 0.000 2.607 3073 T HA -0.190 4.182 4.350 0.037 0.000 0.267 3073 T C 2.109 176.930 174.700 0.201 0.000 1.049 3073 T CA 2.104 64.329 62.100 0.208 0.000 1.162 3073 T CB -0.832 68.158 68.868 0.203 0.000 0.863 3073 T HN 0.275 nan 8.240 nan 0.000 0.424 3074 T N 2.390 117.068 114.554 0.205 0.000 2.597 3074 T HA -0.111 4.261 4.350 0.037 0.000 0.267 3074 T C 1.937 176.721 174.700 0.140 0.000 1.053 3074 T CA 1.476 63.703 62.100 0.212 0.000 1.165 3074 T CB -0.715 68.317 68.868 0.273 0.000 0.863 3074 T HN 0.239 nan 8.240 nan 0.000 0.427 3075 L N 0.339 121.648 121.223 0.144 0.000 2.013 3075 L HA -0.203 4.159 4.340 0.037 0.000 0.212 3075 L C 2.679 179.594 176.870 0.074 0.000 1.073 3075 L CA 1.749 56.650 54.840 0.101 0.000 0.753 3075 L CB -0.832 41.305 42.059 0.130 0.000 0.890 3075 L HN 0.279 nan 8.230 nan 0.000 0.432 3076 T N 0.354 114.970 114.554 0.104 0.000 2.624 3076 T HA -0.275 4.097 4.350 0.037 0.000 0.268 3076 T C 1.825 176.589 174.700 0.106 0.000 1.041 3076 T CA 2.138 64.305 62.100 0.111 0.000 1.159 3076 T CB -0.392 68.575 68.868 0.165 0.000 0.863 3076 T HN 0.312 nan 8.240 nan 0.000 0.434 3077 L N 0.839 122.127 121.223 0.108 0.000 2.083 3077 L HA -0.136 4.226 4.340 0.037 0.000 0.209 3077 L C 2.990 179.855 176.870 -0.009 0.000 1.083 3077 L CA 1.094 55.958 54.840 0.039 0.000 0.752 3077 L CB -0.607 41.445 42.059 -0.013 0.000 0.899 3077 L HN 0.270 nan 8.230 nan 0.000 0.433 3078 Q N -0.259 119.533 119.800 -0.012 0.000 2.170 3078 Q HA -0.168 4.194 4.340 0.037 0.000 0.203 3078 Q C 2.427 178.402 176.000 -0.042 0.000 0.976 3078 Q CA 1.925 57.700 55.803 -0.046 0.000 0.858 3078 Q CB -0.509 28.195 28.738 -0.056 0.000 0.907 3078 Q HN 0.619 nan 8.270 nan 0.000 0.433 3079 V N -1.683 118.220 119.914 -0.018 0.000 2.591 3079 V HA -0.133 4.009 4.120 0.037 0.000 0.249 3079 V C 2.071 178.155 176.094 -0.016 0.000 1.053 3079 V CA 0.912 63.200 62.300 -0.019 0.000 1.068 3079 V CB -0.515 31.304 31.823 -0.007 0.000 0.689 3079 V HN 0.160 nan 8.190 nan 0.000 0.462 3080 I N 1.417 121.988 120.570 0.000 0.000 2.142 3080 I HA -0.159 4.033 4.170 0.037 0.000 0.240 3080 I C 3.039 179.140 176.117 -0.027 0.000 1.078 3080 I CA 1.812 63.113 61.300 0.001 0.000 1.343 3080 I CB -0.830 37.187 38.000 0.028 0.000 1.046 3080 I HN 0.405 nan 8.210 nan 0.000 0.405 3081 A N 0.919 123.713 122.820 -0.044 0.000 1.873 3081 A HA -0.287 4.054 4.320 0.037 0.000 0.218 3081 A C 2.564 180.108 177.584 -0.067 0.000 1.193 3081 A CA 2.423 54.421 52.037 -0.064 0.000 0.629 3081 A CB -1.158 17.792 19.000 -0.084 0.000 0.826 3081 A HN 0.459 nan 8.150 nan 0.000 0.447 3082 A N -0.352 122.427 122.820 -0.068 0.000 1.892 3082 A HA 0.056 4.398 4.320 0.037 0.000 0.218 3082 A C 2.537 180.088 177.584 -0.055 0.000 1.188 3082 A CA 2.648 54.642 52.037 -0.072 0.000 0.631 3082 A CB -1.146 17.815 19.000 -0.066 0.000 0.822 3082 A HN 1.249 nan 8.150 nan 0.000 0.447 3083 A N -1.215 121.581 122.820 -0.040 0.000 1.969 3083 A HA -0.170 4.172 4.320 0.037 0.000 0.218 3083 A C 2.102 179.667 177.584 -0.032 0.000 1.169 3083 A CA 1.573 53.592 52.037 -0.031 0.000 0.635 3083 A CB -0.470 18.517 19.000 -0.022 0.000 0.810 3083 A HN 0.672 nan 8.150 nan 0.000 0.445 3084 Q N -1.324 118.455 119.800 -0.035 0.000 2.172 3084 Q HA -0.090 4.272 4.340 0.037 0.000 0.200 3084 Q C 2.241 178.217 176.000 -0.040 0.000 0.964 3084 Q CA 1.094 56.876 55.803 -0.035 0.000 0.855 3084 Q CB -0.059 28.657 28.738 -0.037 0.000 0.918 3084 Q HN 0.542 nan 8.270 nan 0.000 0.444 3085 R N 1.114 121.584 120.500 -0.050 0.000 2.152 3085 R HA -0.118 4.244 4.340 0.037 0.000 0.232 3085 R C 0.961 177.233 176.300 -0.047 0.000 1.117 3085 R CA 1.201 57.267 56.100 -0.056 0.000 0.981 3085 R CB 0.220 30.476 30.300 -0.075 0.000 0.870 3085 R HN 0.275 nan 8.270 nan 0.000 0.451 3086 E N -1.601 118.575 120.200 -0.041 0.000 2.474 3086 E HA 0.195 4.567 4.350 0.037 0.000 0.195 3086 E C 0.405 176.990 176.600 -0.026 0.000 1.039 3086 E CA 0.388 56.768 56.400 -0.033 0.000 0.881 3086 E CB 0.825 30.507 29.700 -0.030 0.000 0.970 3086 E HN 0.402 nan 8.360 nan 0.000 0.486 3087 G N 2.147 110.931 108.800 -0.027 0.000 2.171 3087 G HA2 -0.287 3.695 3.960 0.037 0.000 0.238 3087 G HA3 -0.287 3.695 3.960 0.037 0.000 0.238 3087 G C -0.134 174.755 174.900 -0.018 0.000 1.039 3087 G CA -0.119 44.968 45.100 -0.022 0.000 0.759 3087 G HN 0.122 nan 8.290 nan 0.000 0.501 3088 K N 0.359 120.747 120.400 -0.019 0.000 2.098 3088 K HA 0.538 4.880 4.320 0.037 0.000 0.261 3088 K C 0.259 176.850 176.600 -0.014 0.000 0.987 3088 K CA -0.332 55.946 56.287 -0.015 0.000 0.916 3088 K CB 0.966 33.457 32.500 -0.016 0.000 1.039 3088 K HN 0.112 nan 8.250 nan 0.000 0.455 3089 T N 1.792 116.339 114.554 -0.011 0.000 2.780 3089 T HA 0.239 4.611 4.350 0.037 0.000 0.294 3089 T C -0.184 174.511 174.700 -0.008 0.000 0.949 3089 T CA -0.520 61.574 62.100 -0.009 0.000 1.074 3089 T CB 0.096 68.960 68.868 -0.007 0.000 0.910 3089 T HN 0.518 nan 8.240 nan 0.000 0.501 3090 C N 2.430 121.729 119.300 -0.003 0.000 2.562 3090 C HA 0.979 5.461 4.460 0.037 0.000 0.332 3090 C C 0.441 175.441 174.990 0.018 0.000 1.201 3090 C CA -0.931 58.091 59.018 0.006 0.000 1.803 3090 C CB 0.874 28.624 27.740 0.017 0.000 2.328 3090 C HN 1.044 nan 8.230 nan 0.000 0.500 3091 A N 1.073 123.906 122.820 0.022 0.000 2.475 3091 A HA 0.873 5.215 4.320 0.037 0.000 0.301 3091 A C -1.502 176.127 177.584 0.075 0.000 1.059 3091 A CA -0.252 51.806 52.037 0.034 0.000 0.710 3091 A CB 1.115 20.107 19.000 -0.012 0.000 1.288 3091 A HN 0.814 nan 8.150 nan 0.000 0.408 3092 F N 2.628 122.536 119.950 -0.069 0.000 2.529 3092 F HA 0.644 5.193 4.527 0.037 0.000 0.320 3092 F C -0.881 174.867 175.800 -0.085 0.000 1.118 3092 F CA -0.867 57.087 58.000 -0.075 0.000 0.915 3092 F CB 1.630 40.596 39.000 -0.057 0.000 1.161 3092 F HN 0.370 nan 8.300 nan 0.000 0.445 3093 I N 4.660 124.986 120.570 -0.406 0.000 2.412 3093 I HA 0.141 4.333 4.170 0.037 0.000 0.279 3093 I C -0.304 175.651 176.117 -0.270 0.000 1.063 3093 I CA -0.440 60.709 61.300 -0.251 0.000 1.193 3093 I CB 0.568 38.415 38.000 -0.255 0.000 1.370 3093 I HN 0.514 nan 8.210 nan 0.000 0.479 3094 D N 4.901 125.295 120.400 -0.010 0.000 2.801 3094 D HA 0.314 4.976 4.640 0.037 0.000 0.232 3094 D C 1.412 177.644 176.300 -0.113 0.000 1.128 3094 D CA 0.035 54.080 54.000 0.075 0.000 1.003 3094 D CB 0.707 41.635 40.800 0.213 0.000 1.110 3094 D HN 0.589 nan 8.370 nan 0.000 0.477 3095 A N 1.659 124.432 122.820 -0.080 0.000 2.019 3095 A HA -0.154 4.188 4.320 0.037 0.000 0.219 3095 A C 1.955 179.653 177.584 0.191 0.000 1.164 3095 A CA 0.896 52.943 52.037 0.016 0.000 0.644 3095 A CB -0.269 18.746 19.000 0.025 0.000 0.805 3095 A HN 0.501 nan 8.150 nan 0.000 0.449 3096 E N -1.047 119.220 120.200 0.111 0.000 2.418 3096 E HA -0.109 4.263 4.350 0.037 0.000 0.197 3096 E C -0.501 176.258 176.600 0.265 0.000 1.026 3096 E CA 0.067 56.548 56.400 0.134 0.000 0.862 3096 E CB -0.193 29.518 29.700 0.018 0.000 0.799 3096 E HN 0.693 nan 8.360 nan 0.000 0.518 3097 H N -2.032 117.096 119.070 0.098 0.000 2.677 3097 H HA -0.219 4.359 4.556 0.037 0.000 0.321 3097 H C 0.143 175.524 175.328 0.087 0.000 1.171 3097 H CA 0.508 56.613 56.048 0.095 0.000 1.139 3097 H CB -1.207 28.611 29.762 0.093 0.000 1.515 3097 H HN 0.290 nan 8.280 nan 0.000 0.423 3098 A N 0.445 123.354 122.820 0.148 0.000 2.664 3098 A HA 0.169 4.511 4.320 0.037 0.000 0.222 3098 A C 0.595 178.217 177.584 0.064 0.000 1.320 3098 A CA -0.249 51.852 52.037 0.105 0.000 1.029 3098 A CB 0.677 19.734 19.000 0.096 0.000 1.318 3098 A HN 0.174 nan 8.150 nan 0.000 0.589 3099 L N 1.684 122.943 121.223 0.059 0.000 2.534 3099 L HA 0.369 4.731 4.340 0.037 0.000 0.271 3099 L C -0.496 176.356 176.870 -0.031 0.000 1.178 3099 L CA 0.276 55.105 54.840 -0.018 0.000 0.907 3099 L CB 0.275 42.247 42.059 -0.145 0.000 1.164 3099 L HN 0.216 nan 8.230 nan 0.000 0.482 3100 D N 7.494 127.888 120.400 -0.012 0.000 2.359 3100 D HA 0.301 4.963 4.640 0.037 0.000 0.230 3100 D C -1.741 174.565 176.300 0.009 0.000 1.118 3100 D CA -2.282 51.724 54.000 0.011 0.000 0.844 3100 D CB 1.482 42.299 40.800 0.029 0.000 1.059 3100 D HN 0.386 nan 8.370 nan 0.000 0.493 3101 P HA -0.175 nan 4.420 nan 0.000 0.215 3101 P C 1.590 178.881 177.300 -0.015 0.000 1.153 3101 P CA 0.879 63.955 63.100 -0.041 0.000 0.853 3101 P CB 0.440 32.119 31.700 -0.035 0.000 0.788 3102 I N -1.554 119.027 120.570 0.018 0.000 2.179 3102 I HA -0.245 3.947 4.170 0.037 0.000 0.242 3102 I C 2.774 178.924 176.117 0.055 0.000 1.088 3102 I CA 1.448 62.765 61.300 0.029 0.000 1.357 3102 I CB -1.354 36.671 38.000 0.040 0.000 1.051 3102 I HN -0.146 nan 8.210 nan 0.000 0.409 3103 Y N 1.401 121.680 120.300 -0.034 0.000 2.224 3103 Y HA -0.219 4.353 4.550 0.037 0.000 0.289 3103 Y C 2.474 178.351 175.900 -0.039 0.000 1.146 3103 Y CA 1.171 59.256 58.100 -0.026 0.000 1.182 3103 Y CB -0.447 38.001 38.460 -0.020 0.000 0.983 3103 Y HN 0.123 nan 8.280 nan 0.000 0.524 3104 A N 0.638 123.432 122.820 -0.043 0.000 1.908 3104 A HA -0.225 4.117 4.320 0.037 0.000 0.218 3104 A C 2.431 179.915 177.584 -0.167 0.000 1.181 3104 A CA 1.837 53.788 52.037 -0.144 0.000 0.627 3104 A CB -0.779 18.135 19.000 -0.144 0.000 0.818 3104 A HN 0.494 nan 8.150 nan 0.000 0.445 3105 R N -0.023 120.406 120.500 -0.118 0.000 2.092 3105 R HA -0.099 4.263 4.340 0.037 0.000 0.231 3105 R C 1.933 178.158 176.300 -0.124 0.000 1.119 3105 R CA 1.630 57.668 56.100 -0.102 0.000 0.970 3105 R CB -0.262 30.000 30.300 -0.064 0.000 0.864 3105 R HN 0.532 nan 8.270 nan 0.000 0.440 3106 K N 0.333 120.642 120.400 -0.151 0.000 2.209 3106 K HA -0.097 4.245 4.320 0.037 0.000 0.204 3106 K C 1.943 178.405 176.600 -0.229 0.000 1.048 3106 K CA 1.008 57.195 56.287 -0.166 0.000 0.940 3106 K CB -0.029 32.375 32.500 -0.160 0.000 0.729 3106 K HN 0.262 nan 8.250 nan 0.000 0.451 3107 L N -0.549 120.483 121.223 -0.319 0.000 2.492 3107 L HA 0.036 4.397 4.340 0.037 0.000 0.223 3107 L C 1.033 177.799 176.870 -0.174 0.000 1.132 3107 L CA 0.546 55.218 54.840 -0.279 0.000 0.850 3107 L CB -0.025 41.835 42.059 -0.331 0.000 0.966 3107 L HN 0.446 nan 8.230 nan 0.000 0.454 3108 G N 0.205 108.916 108.800 -0.149 0.000 2.145 3108 G HA2 -0.190 3.792 3.960 0.037 0.000 0.176 3108 G HA3 -0.190 3.792 3.960 0.037 0.000 0.176 3108 G C -0.068 174.772 174.900 -0.101 0.000 1.013 3108 G CA -0.248 44.784 45.100 -0.113 0.000 0.689 3108 G HN 0.038 nan 8.290 nan 0.000 0.506 3109 V N 0.663 120.514 119.914 -0.105 0.000 2.607 3109 V HA 0.469 4.611 4.120 0.037 0.000 0.289 3109 V C 0.535 176.584 176.094 -0.075 0.000 1.053 3109 V CA -0.418 61.829 62.300 -0.089 0.000 0.996 3109 V CB 1.817 33.579 31.823 -0.102 0.000 0.995 3109 V HN 0.345 nan 8.190 nan 0.000 0.476 3110 D N 3.648 124.011 120.400 -0.061 0.000 2.402 3110 D HA 0.135 4.797 4.640 0.037 0.000 0.235 3110 D C 1.038 177.309 176.300 -0.049 0.000 1.226 3110 D CA -0.264 53.706 54.000 -0.050 0.000 0.918 3110 D CB 0.544 41.320 40.800 -0.041 0.000 1.043 3110 D HN 0.286 nan 8.370 nan 0.000 0.506 3111 I N 2.652 123.191 120.570 -0.052 0.000 2.226 3111 I HA -0.205 3.987 4.170 0.037 0.000 0.245 3111 I C 1.365 177.459 176.117 -0.038 0.000 1.100 3111 I CA 0.899 62.167 61.300 -0.053 0.000 1.374 3111 I CB -0.698 37.271 38.000 -0.051 0.000 1.057 3111 I HN 0.346 nan 8.210 nan 0.000 0.413 3112 D N 0.591 120.973 120.400 -0.031 0.000 2.264 3112 D HA -0.123 4.539 4.640 0.037 0.000 0.208 3112 D C 1.725 178.014 176.300 -0.019 0.000 0.966 3112 D CA 0.904 54.891 54.000 -0.022 0.000 0.864 3112 D CB -0.241 40.547 40.800 -0.020 0.000 0.933 3112 D HN 0.428 nan 8.370 nan 0.000 0.499 3113 N N -0.167 118.521 118.700 -0.021 0.000 2.197 3113 N HA 0.027 4.789 4.740 0.037 0.000 0.201 3113 N C 0.058 175.560 175.510 -0.013 0.000 1.148 3113 N CA -0.175 52.865 53.050 -0.016 0.000 0.883 3113 N CB 1.360 39.837 38.487 -0.017 0.000 1.012 3113 N HN 0.137 nan 8.380 nan 0.000 0.507 3114 L N 3.200 124.412 121.223 -0.018 0.000 2.385 3114 L HA 0.260 4.622 4.340 0.037 0.000 0.281 3114 L C -0.139 176.733 176.870 0.002 0.000 1.106 3114 L CA 0.065 54.900 54.840 -0.010 0.000 0.856 3114 L CB 0.118 42.159 42.059 -0.030 0.000 1.186 3114 L HN 0.009 nan 8.230 nan 0.000 0.453 3115 L N 5.375 126.607 121.223 0.015 0.000 2.456 3115 L HA 0.138 4.500 4.340 0.037 0.000 0.272 3115 L C 0.102 177.001 176.870 0.047 0.000 1.189 3115 L CA 0.137 54.989 54.840 0.021 0.000 0.846 3115 L CB 1.044 43.112 42.059 0.015 0.000 1.111 3115 L HN 0.741 nan 8.230 nan 0.000 0.475 3116 C N 2.744 122.068 119.300 0.041 0.000 2.891 3116 C HA 0.666 5.148 4.460 0.037 0.000 0.342 3116 C C -0.514 174.498 174.990 0.036 0.000 1.126 3116 C CA -0.430 58.629 59.018 0.068 0.000 1.322 3116 C CB 1.578 29.345 27.740 0.045 0.000 1.763 3116 C HN 0.822 nan 8.230 nan 0.000 0.491 3117 S N 3.714 119.433 115.700 0.032 0.000 2.575 3117 S HA 0.566 5.058 4.470 0.037 0.000 0.278 3117 S C -1.380 173.187 174.600 -0.055 0.000 1.139 3117 S CA -0.289 57.902 58.200 -0.015 0.000 0.954 3117 S CB 1.490 64.666 63.200 -0.039 0.000 1.054 3117 S HN 0.860 nan 8.310 nan 0.000 0.483 3118 Q N 4.761 124.506 119.800 -0.092 0.000 2.466 3118 Q HA 0.361 4.723 4.340 0.037 0.000 0.242 3118 Q C -2.300 173.637 176.000 -0.106 0.000 1.046 3118 Q CA -1.911 53.752 55.803 -0.234 0.000 0.841 3118 Q CB 1.350 29.874 28.738 -0.356 0.000 1.193 3118 Q HN 0.502 nan 8.270 nan 0.000 0.508 3119 P HA 0.113 nan 4.420 nan 0.000 0.276 3119 P C -0.389 176.962 177.300 0.085 0.000 1.252 3119 P CA -0.257 62.824 63.100 -0.032 0.000 0.802 3119 P CB 1.429 33.070 31.700 -0.098 0.000 1.035 3120 D N -0.968 119.465 120.400 0.054 0.000 2.269 3120 D HA -0.002 4.660 4.640 0.037 0.000 0.220 3120 D C 1.007 177.339 176.300 0.052 0.000 0.962 3120 D CA 1.432 55.482 54.000 0.083 0.000 0.884 3120 D CB -0.339 40.506 40.800 0.074 0.000 1.023 3120 D HN 0.505 nan 8.370 nan 0.000 0.484 3121 T N -2.689 111.873 114.554 0.014 0.000 2.948 3121 T HA 0.535 4.907 4.350 0.037 0.000 0.285 3121 T C 1.391 176.076 174.700 -0.024 0.000 1.019 3121 T CA -0.287 61.813 62.100 0.000 0.000 1.013 3121 T CB 1.904 70.776 68.868 0.005 0.000 1.117 3121 T HN -0.026 nan 8.240 nan 0.000 0.533 3122 G N 0.102 108.890 108.800 -0.020 0.000 2.394 3122 G HA2 -0.070 3.912 3.960 0.037 0.000 0.215 3122 G HA3 -0.070 3.912 3.960 0.037 0.000 0.215 3122 G C 1.165 176.038 174.900 -0.045 0.000 1.165 3122 G CA 0.526 45.612 45.100 -0.024 0.000 0.784 3122 G HN 0.795 nan 8.290 nan 0.000 0.535 3123 E N 0.076 120.252 120.200 -0.039 0.000 2.085 3123 E HA -0.147 4.225 4.350 0.037 0.000 0.194 3123 E C 2.391 178.934 176.600 -0.096 0.000 0.994 3123 E CA 1.291 57.672 56.400 -0.032 0.000 0.801 3123 E CB -0.223 29.482 29.700 0.009 0.000 0.743 3123 E HN 0.640 nan 8.360 nan 0.000 0.453 3124 Q N 0.312 120.005 119.800 -0.179 0.000 2.030 3124 Q HA -0.243 4.119 4.340 0.037 0.000 0.204 3124 Q C 2.173 177.899 176.000 -0.456 0.000 0.986 3124 Q CA 1.816 57.298 55.803 -0.536 0.000 0.843 3124 Q CB -0.258 28.184 28.738 -0.493 0.000 0.904 3124 Q HN 0.303 nan 8.270 nan 0.000 0.420 3125 A N 0.712 123.386 122.820 -0.244 0.000 1.892 3125 A HA -0.215 4.127 4.320 0.037 0.000 0.218 3125 A C 2.072 179.575 177.584 -0.134 0.000 1.188 3125 A CA 1.797 53.732 52.037 -0.170 0.000 0.631 3125 A CB -0.848 18.097 19.000 -0.092 0.000 0.822 3125 A HN 0.475 nan 8.150 nan 0.000 0.447 3126 L N -1.198 119.974 121.223 -0.086 0.000 2.072 3126 L HA -0.102 4.260 4.340 0.037 0.000 0.205 3126 L C 2.641 179.485 176.870 -0.043 0.000 1.079 3126 L CA 1.065 55.886 54.840 -0.032 0.000 0.752 3126 L CB -0.525 41.536 42.059 0.004 0.000 0.906 3126 L HN 0.276 nan 8.230 nan 0.000 0.436 3127 E N 0.513 120.674 120.200 -0.064 0.000 2.118 3127 E HA -0.216 4.156 4.350 0.037 0.000 0.195 3127 E C 2.279 178.868 176.600 -0.018 0.000 0.992 3127 E CA 1.349 57.746 56.400 -0.005 0.000 0.804 3127 E CB -0.190 29.560 29.700 0.082 0.000 0.741 3127 E HN 0.490 nan 8.360 nan 0.000 0.458 3128 I N 0.233 120.728 120.570 -0.126 0.000 2.127 3128 I HA -0.365 3.827 4.170 0.037 0.000 0.241 3128 I C 2.604 178.689 176.117 -0.052 0.000 1.075 3128 I CA 0.942 62.188 61.300 -0.091 0.000 1.334 3128 I CB -0.306 37.599 38.000 -0.160 0.000 1.040 3128 I HN 0.149 nan 8.210 nan 0.000 0.405 3129 C N 0.357 119.615 119.300 -0.070 0.000 2.393 3129 C HA -0.247 4.235 4.460 0.037 0.000 0.276 3129 C C 2.595 177.565 174.990 -0.034 0.000 1.215 3129 C CA 1.371 60.350 59.018 -0.065 0.000 1.743 3129 C CB -1.064 26.631 27.740 -0.075 0.000 2.044 3129 C HN 0.547 nan 8.230 nan 0.000 0.464 3130 D N 0.313 120.704 120.400 -0.014 0.000 2.149 3130 D HA -0.103 4.559 4.640 0.037 0.000 0.198 3130 D C 2.146 178.452 176.300 0.009 0.000 0.990 3130 D CA 1.628 55.629 54.000 0.001 0.000 0.839 3130 D CB -0.192 40.617 40.800 0.015 0.000 0.948 3130 D HN 0.458 nan 8.370 nan 0.000 0.460 3131 A N -0.057 122.776 122.820 0.021 0.000 1.873 3131 A HA -0.084 4.258 4.320 0.037 0.000 0.215 3131 A C 2.409 180.000 177.584 0.013 0.000 1.186 3131 A CA 1.027 53.082 52.037 0.030 0.000 0.616 3131 A CB -0.796 18.238 19.000 0.057 0.000 0.823 3131 A HN 0.327 nan 8.150 nan 0.000 0.442 3132 L N -0.811 120.412 121.223 -0.001 0.000 2.141 3132 L HA -0.151 4.211 4.340 0.037 0.000 0.209 3132 L C 3.034 179.895 176.870 -0.014 0.000 1.094 3132 L CA 0.798 55.632 54.840 -0.010 0.000 0.763 3132 L CB -0.603 41.441 42.059 -0.025 0.000 0.908 3132 L HN 0.462 nan 8.230 nan 0.000 0.437 3133 A N 0.309 123.118 122.820 -0.018 0.000 1.832 3133 A HA -0.199 4.143 4.320 0.037 0.000 0.214 3133 A C 2.397 179.977 177.584 -0.008 0.000 1.200 3133 A CA 1.376 53.403 52.037 -0.018 0.000 0.610 3133 A CB -0.564 18.422 19.000 -0.022 0.000 0.842 3133 A HN 0.240 nan 8.150 nan 0.000 0.444 3134 R N 0.182 120.681 120.500 -0.002 0.000 2.139 3134 R HA -0.159 4.203 4.340 0.037 0.000 0.243 3134 R C 2.595 178.899 176.300 0.007 0.000 1.145 3134 R CA 1.694 57.796 56.100 0.004 0.000 0.976 3134 R CB -0.407 29.899 30.300 0.010 0.000 0.866 3134 R HN 0.768 nan 8.270 nan 0.000 0.449 3135 S N -0.794 114.909 115.700 0.006 0.000 2.400 3135 S HA -0.098 4.394 4.470 0.037 0.000 0.232 3135 S C 1.653 176.256 174.600 0.005 0.000 1.025 3135 S CA 1.177 59.381 58.200 0.007 0.000 0.993 3135 S CB -0.332 62.873 63.200 0.007 0.000 0.808 3135 S HN 0.542 nan 8.310 nan 0.000 0.478 3136 G N 0.586 109.387 108.800 0.002 0.000 2.166 3136 G HA2 -0.202 3.780 3.960 0.037 0.000 0.260 3136 G HA3 -0.202 3.780 3.960 0.037 0.000 0.260 3136 G C 0.794 175.695 174.900 0.001 0.000 0.986 3136 G CA 0.503 45.604 45.100 0.002 0.000 0.683 3136 G HN 1.325 nan 8.290 nan 0.000 0.527 3137 A N -1.139 121.681 122.820 -0.000 0.000 1.956 3137 A HA 0.643 4.985 4.320 0.037 0.000 0.212 3137 A C 1.253 178.835 177.584 -0.005 0.000 1.188 3137 A CA 1.389 53.425 52.037 -0.001 0.000 0.675 3137 A CB 0.374 19.374 19.000 0.001 0.000 0.845 3137 A HN 0.997 nan 8.150 nan 0.000 0.455 3138 V N 1.377 121.287 119.914 -0.008 0.000 2.607 3138 V HA 0.171 4.313 4.120 0.037 0.000 0.289 3138 V C 0.291 176.376 176.094 -0.015 0.000 1.053 3138 V CA -0.260 62.032 62.300 -0.013 0.000 0.996 3138 V CB 1.429 33.241 31.823 -0.018 0.000 0.995 3138 V HN 0.442 nan 8.190 nan 0.000 0.476 3139 D N 1.704 122.095 120.400 -0.015 0.000 2.394 3139 D HA 0.110 4.771 4.640 0.037 0.000 0.226 3139 D C 0.190 176.477 176.300 -0.022 0.000 0.990 3139 D CA 1.006 54.997 54.000 -0.015 0.000 0.902 3139 D CB 1.602 42.395 40.800 -0.012 0.000 1.038 3139 D HN 0.367 nan 8.370 nan 0.000 0.499 3140 V N 1.403 121.301 119.914 -0.026 0.000 2.623 3140 V HA 0.450 4.592 4.120 0.037 0.000 0.304 3140 V C -1.640 174.423 176.094 -0.051 0.000 1.054 3140 V CA -0.649 61.629 62.300 -0.037 0.000 0.882 3140 V CB 1.864 33.671 31.823 -0.026 0.000 1.002 3140 V HN -0.106 nan 8.190 nan 0.000 0.424 3141 I N 6.815 127.329 120.570 -0.093 0.000 2.465 3141 I HA 0.664 4.856 4.170 0.037 0.000 0.291 3141 I C -0.584 175.399 176.117 -0.222 0.000 1.014 3141 I CA -1.024 60.191 61.300 -0.141 0.000 1.093 3141 I CB 2.043 39.943 38.000 -0.166 0.000 1.267 3141 I HN 0.562 nan 8.210 nan 0.000 0.431 3142 V N 7.099 126.852 119.914 -0.269 0.000 2.604 3142 V HA 0.606 4.747 4.120 0.037 0.000 0.305 3142 V C -0.993 174.736 176.094 -0.609 0.000 1.043 3142 V CA -0.379 61.679 62.300 -0.402 0.000 0.888 3142 V CB 2.135 33.788 31.823 -0.284 0.000 0.995 3142 V HN 0.436 nan 8.190 nan 0.000 0.429 3143 V N 5.545 125.112 119.914 -0.579 0.000 2.347 3143 V HA 0.422 4.564 4.120 0.037 0.000 0.280 3143 V C -0.275 175.601 176.094 -0.364 0.000 1.021 3143 V CA -0.389 61.620 62.300 -0.484 0.000 0.847 3143 V CB 1.349 32.924 31.823 -0.414 0.000 0.990 3143 V HN 0.968 nan 8.190 nan 0.000 0.444 3144 D N 3.516 123.667 120.400 -0.416 0.000 2.365 3144 D HA 0.338 5.000 4.640 0.037 0.000 0.237 3144 D C 0.039 176.291 176.300 -0.081 0.000 1.190 3144 D CA 0.668 54.543 54.000 -0.210 0.000 0.867 3144 D CB 0.642 41.378 40.800 -0.107 0.000 1.050 3144 D HN 0.644 nan 8.370 nan 0.000 0.491 3145 S N 1.250 116.926 115.700 -0.040 0.000 3.392 3145 S HA -0.147 4.345 4.470 0.037 0.000 0.693 3145 S C 1.204 175.809 174.600 0.008 0.000 0.620 3145 S CA 0.355 58.534 58.200 -0.036 0.000 1.452 3145 S CB -1.015 62.118 63.200 -0.110 0.000 0.988 3145 S HN 0.541 nan 8.310 nan 0.000 0.932 3146 V N 2.222 122.161 119.914 0.042 0.000 2.626 3146 V HA -0.023 4.119 4.120 0.037 0.000 0.252 3146 V C 2.333 178.424 176.094 -0.004 0.000 1.067 3146 V CA 2.305 64.627 62.300 0.038 0.000 1.081 3146 V CB -1.117 30.692 31.823 -0.024 0.000 0.686 3146 V HN 1.425 nan 8.190 nan 0.000 0.468 3147 A N 0.921 123.721 122.820 -0.033 0.000 1.958 3147 A HA -0.094 4.248 4.320 0.037 0.000 0.221 3147 A C 2.355 179.992 177.584 0.089 0.000 1.178 3147 A CA 2.583 54.611 52.037 -0.015 0.000 0.642 3147 A CB -1.060 17.880 19.000 -0.100 0.000 0.816 3147 A HN 1.278 nan 8.150 nan 0.000 0.453 3148 A N -1.645 121.224 122.820 0.083 0.000 2.251 3148 A HA 0.448 4.790 4.320 0.037 0.000 0.209 3148 A C 0.551 178.202 177.584 0.111 0.000 1.187 3148 A CA -0.066 52.073 52.037 0.169 0.000 0.823 3148 A CB -0.196 18.897 19.000 0.155 0.000 0.846 3148 A HN 0.282 nan 8.150 nan 0.000 0.486 3149 L N 2.319 123.579 121.223 0.062 0.000 2.437 3149 L HA 0.143 4.505 4.340 0.037 0.000 0.243 3149 L C 0.188 177.069 176.870 0.018 0.000 1.346 3149 L CA 0.536 55.397 54.840 0.036 0.000 1.233 3149 L CB -1.058 41.015 42.059 0.023 0.000 1.436 3149 L HN 0.097 nan 8.230 nan 0.000 0.416 3150 T N 2.916 117.486 114.554 0.026 0.000 2.799 3150 T HA 0.188 4.560 4.350 0.037 0.000 0.296 3150 T C -2.147 172.534 174.700 -0.032 0.000 0.947 3150 T CA -0.978 61.120 62.100 -0.002 0.000 1.141 3150 T CB 0.351 69.222 68.868 0.005 0.000 0.891 3150 T HN 0.168 nan 8.240 nan 0.000 0.533 3151 P HA 0.093 nan 4.420 nan 0.000 0.268 3151 P C 0.992 178.231 177.300 -0.101 0.000 1.208 3151 P CA -0.438 62.609 63.100 -0.088 0.000 0.777 3151 P CB 0.738 32.361 31.700 -0.129 0.000 0.875 3152 K N 2.228 122.584 120.400 -0.074 0.000 2.009 3152 K HA -0.223 4.119 4.320 0.037 0.000 0.210 3152 K C 1.830 178.379 176.600 -0.085 0.000 1.049 3152 K CA 1.965 58.221 56.287 -0.051 0.000 0.929 3152 K CB -0.718 31.770 32.500 -0.019 0.000 0.714 3152 K HN 0.466 nan 8.250 nan 0.000 0.440 3153 A N 0.944 123.683 122.820 -0.134 0.000 1.978 3153 A HA -0.227 4.115 4.320 0.037 0.000 0.220 3153 A C 1.939 179.348 177.584 -0.292 0.000 1.170 3153 A CA 1.926 53.864 52.037 -0.164 0.000 0.636 3153 A CB -0.492 18.412 19.000 -0.160 0.000 0.810 3153 A HN 0.597 nan 8.150 nan 0.000 0.448 3154 E N -0.202 119.719 120.200 -0.465 0.000 2.072 3154 E HA -0.113 4.259 4.350 0.037 0.000 0.190 3154 E C 1.762 178.319 176.600 -0.073 0.000 0.982 3154 E CA 1.151 57.317 56.400 -0.389 0.000 0.803 3154 E CB -0.202 29.310 29.700 -0.313 0.000 0.755 3154 E HN 0.680 nan 8.360 nan 0.000 0.453 3155 I N 0.902 121.431 120.570 -0.070 0.000 2.286 3155 I HA -0.196 3.996 4.170 0.037 0.000 0.245 3155 I C 2.230 178.345 176.117 -0.003 0.000 1.104 3155 I CA 1.095 62.382 61.300 -0.022 0.000 1.397 3155 I CB -0.244 37.746 38.000 -0.017 0.000 1.072 3155 I HN 0.103 nan 8.210 nan 0.000 0.417 3156 E N 1.071 121.266 120.200 -0.009 0.000 2.150 3156 E HA -0.047 4.325 4.350 0.037 0.000 0.193 3156 E C 1.421 178.042 176.600 0.034 0.000 0.985 3156 E CA 0.624 57.030 56.400 0.010 0.000 0.814 3156 E CB -0.164 29.539 29.700 0.005 0.000 0.752 3156 E HN 0.525 nan 8.360 nan 0.000 0.466 3157 G N 0.885 109.724 108.800 0.064 0.000 2.621 3157 G HA2 0.089 4.071 3.960 0.037 0.000 0.271 3157 G HA3 0.089 4.071 3.960 0.037 0.000 0.271 3157 G C -0.107 174.845 174.900 0.086 0.000 1.236 3157 G CA -0.507 44.663 45.100 0.116 0.000 0.958 3157 G HN -0.006 nan 8.290 nan 0.000 0.512 3158 E N -1.472 118.771 120.200 0.071 0.000 2.330 3158 E HA 0.308 4.680 4.350 0.037 0.000 0.256 3158 E C -0.261 176.367 176.600 0.047 0.000 1.146 3158 E CA -0.525 55.900 56.400 0.042 0.000 0.945 3158 E CB 1.494 31.206 29.700 0.021 0.000 1.182 3158 E HN 0.220 nan 8.360 nan 0.000 0.480 3159 I N 0.930 121.515 120.570 0.025 0.000 2.396 3159 I HA 0.179 4.371 4.170 0.037 0.000 0.289 3159 I C 1.063 177.181 176.117 0.002 0.000 1.056 3159 I CA 0.800 62.111 61.300 0.017 0.000 1.365 3159 I CB 0.661 38.667 38.000 0.010 0.000 1.407 3159 I HN 0.854 nan 8.210 nan 0.000 0.509 3160 G N 4.332 113.126 108.800 -0.009 0.000 2.436 3160 G HA2 -0.215 3.767 3.960 0.037 0.000 0.204 3160 G HA3 -0.215 3.767 3.960 0.037 0.000 0.204 3160 G C 0.014 174.872 174.900 -0.070 0.000 1.026 3160 G CA -0.672 44.410 45.100 -0.031 0.000 0.658 3160 G HN 0.525 nan 8.290 nan 0.000 0.499 3161 D N 2.315 122.665 120.400 -0.083 0.000 2.520 3161 D HA 0.430 5.092 4.640 0.037 0.000 0.243 3161 D C 0.916 176.975 176.300 -0.402 0.000 1.160 3161 D CA 1.124 55.000 54.000 -0.207 0.000 0.877 3161 D CB 1.013 41.723 40.800 -0.151 0.000 1.150 3161 D HN 0.625 nan 8.370 nan 0.000 0.494 3162 S N 3.070 118.541 115.700 -0.381 0.000 2.475 3162 S HA 0.293 4.785 4.470 0.037 0.000 0.281 3162 S C -0.248 174.079 174.600 -0.455 0.000 1.198 3162 S CA -0.840 57.166 58.200 -0.322 0.000 1.063 3162 S CB 0.918 64.028 63.200 -0.149 0.000 0.972 3162 S HN 0.382 nan 8.310 nan 0.000 0.486 3163 H N 3.324 122.385 119.070 -0.014 0.000 2.539 3163 H HA 0.272 4.850 4.556 0.037 0.000 0.247 3163 H C -0.405 174.913 175.328 -0.017 0.000 1.363 3163 H CA -0.447 55.593 56.048 -0.014 0.000 1.371 3163 H CB 0.175 29.928 29.762 -0.013 0.000 1.438 3163 H HN 0.573 nan 8.280 nan 0.000 0.523 3164 M N 0.848 120.473 119.600 0.041 0.000 2.338 3164 M HA -0.020 4.482 4.480 0.037 0.000 0.360 3164 M C 1.299 177.614 176.300 0.026 0.000 1.547 3164 M CA 0.798 56.109 55.300 0.019 0.000 1.001 3164 M CB 0.366 32.965 32.600 -0.001 0.000 2.008 3164 M HN 0.871 nan 8.290 nan 0.000 0.464 3165 G N 3.586 112.396 108.800 0.016 0.000 2.468 3165 G HA2 -0.280 3.702 3.960 0.037 0.000 0.311 3165 G HA3 -0.280 3.702 3.960 0.037 0.000 0.311 3165 G C 0.715 175.620 174.900 0.009 0.000 0.942 3165 G CA 0.744 45.848 45.100 0.007 0.000 0.893 3165 G HN 0.827 nan 8.290 nan 0.000 0.513 3166 L N -0.724 120.515 121.223 0.027 0.000 2.072 3166 L HA 0.197 4.559 4.340 0.037 0.000 0.205 3166 L C 3.075 179.938 176.870 -0.012 0.000 1.079 3166 L CA 2.068 56.916 54.840 0.014 0.000 0.752 3166 L CB -0.391 41.689 42.059 0.034 0.000 0.906 3166 L HN 0.370 nan 8.230 nan 0.000 0.436 3167 A N -0.150 122.662 122.820 -0.013 0.000 1.883 3167 A HA -0.242 4.099 4.320 0.037 0.000 0.217 3167 A C 2.411 179.972 177.584 -0.037 0.000 1.186 3167 A CA 1.945 53.965 52.037 -0.029 0.000 0.624 3167 A CB -1.056 17.931 19.000 -0.022 0.000 0.822 3167 A HN 0.547 nan 8.150 nan 0.000 0.444 3168 A N -0.668 122.134 122.820 -0.030 0.000 1.930 3168 A HA -0.130 4.212 4.320 0.037 0.000 0.217 3168 A C 2.233 179.796 177.584 -0.034 0.000 1.175 3168 A CA 1.724 53.740 52.037 -0.035 0.000 0.627 3168 A CB -0.441 18.545 19.000 -0.023 0.000 0.815 3168 A HN 0.557 nan 8.150 nan 0.000 0.443 3169 R N -0.907 119.578 120.500 -0.025 0.000 2.115 3169 R HA -0.037 4.325 4.340 0.037 0.000 0.230 3169 R C 2.168 178.450 176.300 -0.029 0.000 1.111 3169 R CA 1.485 57.572 56.100 -0.021 0.000 0.976 3169 R CB -0.289 30.003 30.300 -0.013 0.000 0.870 3169 R HN 0.624 nan 8.270 nan 0.000 0.445 3170 M N -0.354 119.225 119.600 -0.036 0.000 2.099 3170 M HA -0.169 4.333 4.480 0.037 0.000 0.262 3170 M C 1.744 178.008 176.300 -0.060 0.000 1.067 3170 M CA 1.468 56.744 55.300 -0.040 0.000 1.124 3170 M CB 0.046 32.622 32.600 -0.041 0.000 1.353 3170 M HN 0.208 nan 8.290 nan 0.000 0.410 3171 M N -0.412 119.140 119.600 -0.081 0.000 2.108 3171 M HA -0.193 4.309 4.480 0.037 0.000 0.261 3171 M C 2.364 178.577 176.300 -0.144 0.000 1.066 3171 M CA 1.563 56.784 55.300 -0.131 0.000 1.107 3171 M CB -1.329 31.181 32.600 -0.149 0.000 1.356 3171 M HN 0.346 nan 8.290 nan 0.000 0.406 3172 S N -0.252 115.392 115.700 -0.095 0.000 2.399 3172 S HA -0.174 4.318 4.470 0.037 0.000 0.231 3172 S C 1.843 176.386 174.600 -0.095 0.000 1.022 3172 S CA 1.218 59.370 58.200 -0.080 0.000 0.983 3172 S CB -0.115 63.069 63.200 -0.027 0.000 0.803 3172 S HN 0.509 nan 8.310 nan 0.000 0.480 3173 Q N 0.188 119.948 119.800 -0.066 0.000 2.083 3173 Q HA -0.023 4.339 4.340 0.037 0.000 0.198 3173 Q C 2.203 178.157 176.000 -0.077 0.000 0.969 3173 Q CA 1.190 56.967 55.803 -0.044 0.000 0.838 3173 Q CB -0.320 28.416 28.738 -0.003 0.000 0.900 3173 Q HN 0.578 nan 8.270 nan 0.000 0.436 3174 A N 0.935 123.697 122.820 -0.096 0.000 1.877 3174 A HA -0.213 4.129 4.320 0.037 0.000 0.216 3174 A C 2.048 179.531 177.584 -0.169 0.000 1.186 3174 A CA 1.616 53.597 52.037 -0.094 0.000 0.620 3174 A CB -0.526 18.431 19.000 -0.072 0.000 0.822 3174 A HN 0.389 nan 8.150 nan 0.000 0.443 3175 M N -0.394 119.014 119.600 -0.321 0.000 2.073 3175 M HA -0.189 4.313 4.480 0.037 0.000 0.258 3175 M C 2.168 178.122 176.300 -0.577 0.000 1.070 3175 M CA 1.763 56.677 55.300 -0.643 0.000 1.103 3175 M CB -1.455 30.410 32.600 -1.226 0.000 1.321 3175 M HN 0.425 nan 8.290 nan 0.000 0.405 3176 R N 0.054 120.331 120.500 -0.371 0.000 2.094 3176 R HA -0.177 4.185 4.340 0.037 0.000 0.239 3176 R C 2.302 178.570 176.300 -0.052 0.000 1.137 3176 R CA 1.634 57.681 56.100 -0.088 0.000 0.943 3176 R CB -0.354 29.938 30.300 -0.014 0.000 0.850 3176 R HN 0.452 nan 8.270 nan 0.000 0.433 3177 K N 0.348 120.707 120.400 -0.067 0.000 2.097 3177 K HA -0.077 4.265 4.320 0.037 0.000 0.205 3177 K C 2.151 178.720 176.600 -0.051 0.000 1.050 3177 K CA 1.044 57.306 56.287 -0.041 0.000 0.938 3177 K CB -0.036 32.451 32.500 -0.022 0.000 0.718 3177 K HN 0.182 nan 8.250 nan 0.000 0.442 3178 L N 0.270 121.454 121.223 -0.065 0.000 2.095 3178 L HA -0.065 4.297 4.340 0.037 0.000 0.204 3178 L C 2.602 179.437 176.870 -0.058 0.000 1.080 3178 L CA 0.677 55.489 54.840 -0.045 0.000 0.759 3178 L CB -0.620 41.432 42.059 -0.011 0.000 0.914 3178 L HN 0.144 nan 8.230 nan 0.000 0.439 3179 A N 0.911 123.700 122.820 -0.050 0.000 1.884 3179 A HA -0.246 4.096 4.320 0.037 0.000 0.219 3179 A C 2.385 179.801 177.584 -0.280 0.000 1.197 3179 A CA 2.293 54.311 52.037 -0.032 0.000 0.637 3179 A CB -1.502 17.586 19.000 0.147 0.000 0.827 3179 A HN 0.449 nan 8.150 nan 0.000 0.450 3180 G N -0.728 107.819 108.800 -0.422 0.000 2.446 3180 G HA2 -0.293 3.689 3.960 0.037 0.000 0.217 3180 G HA3 -0.293 3.689 3.960 0.037 0.000 0.217 3180 G C 1.433 176.163 174.900 -0.283 0.000 1.168 3180 G CA 1.138 45.848 45.100 -0.650 0.000 0.771 3180 G HN 0.725 nan 8.290 nan 0.000 0.551 3181 N N -0.252 118.362 118.700 -0.142 0.000 2.396 3181 N HA 0.065 4.826 4.740 0.037 0.000 0.180 3181 N C 2.096 177.577 175.510 -0.049 0.000 1.028 3181 N CA 0.146 53.156 53.050 -0.066 0.000 0.893 3181 N CB -0.043 38.421 38.487 -0.039 0.000 0.967 3181 N HN 0.251 nan 8.380 nan 0.000 0.440 3182 L N 0.282 121.470 121.223 -0.058 0.000 2.162 3182 L HA -0.029 4.333 4.340 0.037 0.000 0.205 3182 L C 2.317 179.183 176.870 -0.006 0.000 1.086 3182 L CA 0.721 55.546 54.840 -0.025 0.000 0.778 3182 L CB -0.066 41.987 42.059 -0.009 0.000 0.928 3182 L HN 0.015 nan 8.230 nan 0.000 0.446 3183 K N 0.602 120.997 120.400 -0.009 0.000 2.031 3183 K HA -0.157 4.185 4.320 0.037 0.000 0.205 3183 K C 2.042 178.675 176.600 0.055 0.000 1.049 3183 K CA 1.523 57.843 56.287 0.054 0.000 0.939 3183 K CB -0.167 32.426 32.500 0.156 0.000 0.717 3183 K HN 0.101 nan 8.250 nan 0.000 0.438 3184 Q N -0.423 119.402 119.800 0.042 0.000 2.437 3184 Q HA 0.031 4.393 4.340 0.037 0.000 0.210 3184 Q C 1.020 177.036 176.000 0.028 0.000 0.972 3184 Q CA 1.342 57.173 55.803 0.047 0.000 0.903 3184 Q CB 0.218 28.986 28.738 0.050 0.000 0.967 3184 Q HN 0.220 nan 8.270 nan 0.000 0.486 3185 S N -0.032 115.678 115.700 0.016 0.000 2.523 3185 S HA 0.044 4.536 4.470 0.037 0.000 0.217 3185 S C 0.193 174.799 174.600 0.010 0.000 0.996 3185 S CA -0.216 57.990 58.200 0.010 0.000 0.921 3185 S CB 0.320 63.520 63.200 0.000 0.000 0.829 3185 S HN 0.406 nan 8.310 nan 0.000 0.495 3186 N N 2.576 121.286 118.700 0.016 0.000 2.705 3186 N HA -0.139 4.623 4.740 0.037 0.000 0.255 3186 N C -1.355 174.158 175.510 0.005 0.000 1.008 3186 N CA 0.742 53.801 53.050 0.015 0.000 0.742 3186 N CB -1.427 37.069 38.487 0.015 0.000 0.906 3186 N HN 0.283 nan 8.380 nan 0.000 0.541 3187 T N 1.176 115.730 114.554 0.000 0.000 2.792 3187 T HA 0.461 4.833 4.350 0.037 0.000 0.280 3187 T C 0.196 174.887 174.700 -0.015 0.000 0.990 3187 T CA -0.725 61.367 62.100 -0.012 0.000 0.960 3187 T CB 1.744 70.600 68.868 -0.020 0.000 0.939 3187 T HN 0.281 nan 8.240 nan 0.000 0.439 3188 L N 4.264 125.474 121.223 -0.022 0.000 2.349 3188 L HA 0.617 4.979 4.340 0.037 0.000 0.275 3188 L C -0.966 175.868 176.870 -0.061 0.000 1.115 3188 L CA -0.301 54.523 54.840 -0.026 0.000 0.820 3188 L CB 0.421 42.467 42.059 -0.022 0.000 1.135 3188 L HN 0.641 nan 8.230 nan 0.000 0.445 3189 L N 6.548 127.729 121.223 -0.069 0.000 2.376 3189 L HA 0.555 4.917 4.340 0.037 0.000 0.275 3189 L C -1.148 175.620 176.870 -0.169 0.000 0.987 3189 L CA -0.459 54.281 54.840 -0.167 0.000 0.828 3189 L CB 1.438 43.386 42.059 -0.185 0.000 1.249 3189 L HN 0.654 nan 8.230 nan 0.000 0.409 3190 I N 4.262 124.686 120.570 -0.243 0.000 2.378 3190 I HA 0.315 4.507 4.170 0.037 0.000 0.291 3190 I C -0.916 175.027 176.117 -0.291 0.000 0.992 3190 I CA -0.332 60.873 61.300 -0.158 0.000 1.154 3190 I CB 1.467 39.416 38.000 -0.084 0.000 1.315 3190 I HN 0.377 nan 8.210 nan 0.000 0.448 3191 F N 6.437 126.361 119.950 -0.042 0.000 2.404 3191 F HA 0.473 5.022 4.527 0.037 0.000 0.354 3191 F C 0.409 176.192 175.800 -0.029 0.000 1.122 3191 F CA -0.444 57.524 58.000 -0.053 0.000 1.080 3191 F CB 0.986 39.965 39.000 -0.035 0.000 1.131 3191 F HN 0.215 nan 8.300 nan 0.000 0.471 3192 I N 3.497 124.127 120.570 0.102 0.000 2.395 3192 I HA 0.194 4.386 4.170 0.037 0.000 0.289 3192 I C -0.158 176.013 176.117 0.091 0.000 1.023 3192 I CA -0.032 61.320 61.300 0.086 0.000 1.350 3192 I CB 1.014 39.038 38.000 0.040 0.000 1.409 3192 I HN 0.653 nan 8.210 nan 0.000 0.507 3193 N N 4.159 122.918 118.700 0.097 0.000 2.262 3193 N HA 0.378 5.140 4.740 0.037 0.000 0.295 3193 N C -1.296 174.203 175.510 -0.018 0.000 1.161 3193 N CA -0.701 52.368 53.050 0.032 0.000 0.767 3193 N CB 1.772 40.285 38.487 0.043 0.000 1.499 3193 N HN 0.540 nan 8.380 nan 0.000 0.476 3194 Q N 0.939 120.612 119.800 -0.212 0.000 2.180 3194 Q HA 0.496 4.858 4.340 0.037 0.000 0.241 3194 Q C -0.638 175.137 176.000 -0.374 0.000 0.970 3194 Q CA -0.646 54.831 55.803 -0.543 0.000 0.919 3194 Q CB 2.081 30.150 28.738 -1.115 0.000 1.222 3194 Q HN 0.476 nan 8.270 nan 0.000 0.482 3195 I N 1.606 121.962 120.570 -0.357 0.000 2.359 3195 I HA 0.342 4.534 4.170 0.037 0.000 0.294 3195 I C -0.082 175.987 176.117 -0.080 0.000 0.987 3195 I CA -0.663 60.592 61.300 -0.075 0.000 1.225 3195 I CB 0.776 38.878 38.000 0.171 0.000 1.366 3195 I HN 0.310 nan 8.210 nan 0.000 0.466 3196 R N 4.799 125.255 120.500 -0.073 0.000 2.832 3196 R HA 0.604 4.966 4.340 0.037 0.000 0.271 3196 R C -0.840 175.450 176.300 -0.016 0.000 0.996 3196 R CA -1.333 54.748 56.100 -0.031 0.000 0.977 3196 R CB 1.701 31.967 30.300 -0.057 0.000 1.168 3196 R HN 0.422 nan 8.270 nan 0.000 0.482 3197 M N 2.024 121.622 119.600 -0.003 0.000 2.233 3197 M HA 0.235 4.737 4.480 0.037 0.000 0.355 3197 M C -0.086 176.194 176.300 -0.035 0.000 1.191 3197 M CA -0.101 55.190 55.300 -0.016 0.000 1.101 3197 M CB 0.823 33.419 32.600 -0.007 0.000 1.592 3197 M HN 0.258 nan 8.290 nan 0.000 0.461 3198 K N 5.112 125.481 120.400 -0.051 0.000 2.183 3198 K HA 0.541 4.883 4.320 0.037 0.000 0.274 3198 K C -0.800 175.760 176.600 -0.068 0.000 1.009 3198 K CA -0.571 55.680 56.287 -0.059 0.000 0.888 3198 K CB 1.236 33.695 32.500 -0.069 0.000 1.078 3198 K HN 0.862 nan 8.250 nan 0.000 0.459 3199 I N 0.270 120.805 120.570 -0.057 0.000 2.460 3199 I HA 0.465 4.657 4.170 0.037 0.000 0.298 3199 I C 0.349 176.429 176.117 -0.061 0.000 0.989 3199 I CA 0.289 61.556 61.300 -0.056 0.000 1.173 3199 I CB 1.294 39.270 38.000 -0.039 0.000 1.338 3199 I HN 1.000 nan 8.210 nan 0.000 0.456 3200 G N 4.695 113.455 108.800 -0.067 0.000 2.142 3200 G HA2 -0.173 3.809 3.960 0.037 0.000 0.225 3200 G HA3 -0.173 3.809 3.960 0.037 0.000 0.225 3200 G C -0.523 174.312 174.900 -0.109 0.000 1.015 3200 G CA 0.099 45.161 45.100 -0.063 0.000 0.716 3200 G HN 0.935 nan 8.290 nan 0.000 0.508 3201 V N 1.950 121.752 119.914 -0.185 0.000 2.483 3201 V HA 0.736 4.878 4.120 0.037 0.000 0.297 3201 V C 1.049 176.924 176.094 -0.365 0.000 1.027 3201 V CA -0.253 61.811 62.300 -0.392 0.000 0.855 3201 V CB 1.353 32.880 31.823 -0.494 0.000 0.995 3201 V HN 0.314 nan 8.190 nan 0.000 0.424 3202 M N 6.080 125.453 119.600 -0.379 0.000 2.740 3202 M HA 0.276 4.778 4.480 0.037 0.000 0.253 3202 M C 0.754 176.993 176.300 -0.101 0.000 1.341 3202 M CA 0.576 55.782 55.300 -0.157 0.000 1.176 3202 M CB -0.512 32.075 32.600 -0.022 0.000 1.310 3202 M HN 0.579 nan 8.290 nan 0.000 0.531 3203 F N 1.794 121.745 119.950 0.001 0.000 2.299 3203 F HA 0.690 5.239 4.527 0.037 0.000 0.293 3203 F C 1.320 177.121 175.800 0.002 0.000 1.252 3203 F CA -0.346 57.654 58.000 0.001 0.000 1.160 3203 F CB -1.073 37.927 39.000 0.001 0.000 1.405 3203 F HN 0.422 nan 8.300 nan 0.000 0.517 3204 G N 0.949 109.933 108.800 0.307 0.000 2.581 3204 G HA2 -0.274 3.708 3.960 0.037 0.000 0.291 3204 G HA3 -0.274 3.708 3.960 0.037 0.000 0.291 3204 G C -0.712 174.201 174.900 0.021 0.000 1.277 3204 G CA 0.262 45.472 45.100 0.183 0.000 0.959 3204 G HN 1.464 nan 8.290 nan 0.000 0.554 3205 N N 1.079 119.780 118.700 0.001 0.000 2.319 3205 N HA 0.579 5.341 4.740 0.037 0.000 0.305 3205 N C -2.220 173.247 175.510 -0.072 0.000 1.103 3205 N CA -1.685 51.351 53.050 -0.023 0.000 0.815 3205 N CB 2.338 40.836 38.487 0.018 0.000 1.288 3205 N HN 0.325 nan 8.380 nan 0.000 0.493 3206 P HA 0.244 nan 4.420 nan 0.000 0.253 3206 P C -0.745 176.520 177.300 -0.057 0.000 1.459 3206 P CA 0.216 63.262 63.100 -0.091 0.000 0.908 3206 P CB 0.146 31.796 31.700 -0.083 0.000 1.470 3207 E N -0.109 120.067 120.200 -0.040 0.000 2.191 3207 E HA 0.421 4.793 4.350 0.037 0.000 0.278 3207 E C -0.036 176.519 176.600 -0.075 0.000 0.972 3207 E CA -0.313 56.066 56.400 -0.034 0.000 0.804 3207 E CB 1.498 31.199 29.700 0.003 0.000 1.110 3207 E HN 0.057 nan 8.360 nan 0.000 0.394 3208 T N 0.111 114.607 114.554 -0.097 0.000 2.604 3208 T HA 0.500 4.872 4.350 0.037 0.000 0.267 3208 T C -0.343 174.237 174.700 -0.200 0.000 0.923 3208 T CA -0.724 61.288 62.100 -0.146 0.000 1.077 3208 T CB 1.642 70.447 68.868 -0.106 0.000 1.392 3208 T HN 0.267 nan 8.240 nan 0.000 0.531 3209 T N 1.864 116.295 114.554 -0.204 0.000 2.921 3209 T HA 0.559 4.931 4.350 0.037 0.000 0.297 3209 T C -0.538 174.072 174.700 -0.151 0.000 1.013 3209 T CA -0.570 61.395 62.100 -0.226 0.000 0.990 3209 T CB 1.326 70.006 68.868 -0.313 0.000 1.023 3209 T HN 0.752 nan 8.240 nan 0.000 0.447 3210 T N 1.306 115.777 114.554 -0.137 0.000 2.900 3210 T HA 0.468 4.840 4.350 0.037 0.000 0.307 3210 T C 1.314 175.956 174.700 -0.096 0.000 1.065 3210 T CA 0.368 62.406 62.100 -0.102 0.000 1.105 3210 T CB 0.522 69.334 68.868 -0.093 0.000 0.979 3210 T HN 1.176 nan 8.240 nan 0.000 0.544 3211 G N 0.577 109.331 108.800 -0.077 0.000 2.165 3211 G HA2 0.255 4.237 3.960 0.037 0.000 0.226 3211 G HA3 0.255 4.237 3.960 0.037 0.000 0.226 3211 G C 0.712 175.567 174.900 -0.075 0.000 1.035 3211 G CA 0.083 45.134 45.100 -0.082 0.000 0.744 3211 G HN 1.831 nan 8.290 nan 0.000 0.501 3212 G N -0.100 108.668 108.800 -0.053 0.000 2.601 3212 G HA2 -0.262 3.720 3.960 0.037 0.000 0.261 3212 G HA3 -0.262 3.720 3.960 0.037 0.000 0.261 3212 G C 0.702 175.599 174.900 -0.005 0.000 1.289 3212 G CA 0.543 45.628 45.100 -0.025 0.000 0.920 3212 G HN 0.960 nan 8.290 nan 0.000 0.571 3213 N N 0.661 119.392 118.700 0.052 0.000 2.325 3213 N HA 0.204 4.966 4.740 0.037 0.000 0.182 3213 N C 2.434 178.091 175.510 0.244 0.000 1.088 3213 N CA 1.258 54.391 53.050 0.139 0.000 0.879 3213 N CB 0.005 38.625 38.487 0.221 0.000 0.983 3213 N HN 0.833 nan 8.380 nan 0.000 0.471 3214 A N 1.563 124.476 122.820 0.155 0.000 1.873 3214 A HA -0.164 4.178 4.320 0.037 0.000 0.218 3214 A C 2.168 179.905 177.584 0.255 0.000 1.193 3214 A CA 1.219 53.374 52.037 0.198 0.000 0.629 3214 A CB -0.761 18.255 19.000 0.026 0.000 0.826 3214 A HN 0.218 nan 8.150 nan 0.000 0.447 3215 L N -0.172 121.085 121.223 0.057 0.000 2.083 3215 L HA -0.128 4.234 4.340 0.037 0.000 0.209 3215 L C 2.219 179.143 176.870 0.089 0.000 1.083 3215 L CA 2.114 56.957 54.840 0.004 0.000 0.752 3215 L CB -0.558 41.389 42.059 -0.187 0.000 0.899 3215 L HN 0.367 nan 8.230 nan 0.000 0.433 3216 K N -1.065 119.366 120.400 0.051 0.000 2.059 3216 K HA -0.246 4.096 4.320 0.037 0.000 0.212 3216 K C 2.054 178.609 176.600 -0.075 0.000 1.050 3216 K CA 2.194 58.446 56.287 -0.059 0.000 0.927 3216 K CB -0.487 31.898 32.500 -0.192 0.000 0.714 3216 K HN 0.277 nan 8.250 nan 0.000 0.447 3217 F N -0.711 119.277 119.950 0.063 0.000 2.128 3217 F HA -0.122 4.427 4.527 0.036 0.000 0.295 3217 F C 2.126 177.913 175.800 -0.022 0.000 1.100 3217 F CA 1.128 59.130 58.000 0.004 0.000 1.260 3217 F CB -0.370 38.606 39.000 -0.040 0.000 1.009 3217 F HN 0.004 nan 8.300 nan 0.000 0.476 3218 Y N 0.028 120.443 120.300 0.193 0.000 2.395 3218 Y HA 0.208 4.780 4.550 0.037 0.000 0.293 3218 Y C 1.609 177.562 175.900 0.089 0.000 1.123 3218 Y CA -0.030 58.146 58.100 0.126 0.000 1.227 3218 Y CB -0.665 37.849 38.460 0.091 0.000 1.012 3218 Y HN -0.115 nan 8.280 nan 0.000 0.552 3219 A N -0.097 122.847 122.820 0.206 0.000 2.511 3219 A HA 0.139 4.481 4.320 0.037 0.000 0.242 3219 A C 1.207 178.834 177.584 0.073 0.000 1.069 3219 A CA 0.434 52.550 52.037 0.132 0.000 0.763 3219 A CB 0.166 19.226 19.000 0.099 0.000 1.001 3219 A HN 0.342 nan 8.150 nan 0.000 0.498 3220 S N 0.621 116.357 115.700 0.060 0.000 2.458 3220 S HA 0.174 4.666 4.470 0.037 0.000 0.223 3220 S C 0.386 174.970 174.600 -0.028 0.000 1.019 3220 S CA 0.458 58.666 58.200 0.013 0.000 0.937 3220 S CB 0.118 63.331 63.200 0.022 0.000 0.788 3220 S HN 0.559 nan 8.310 nan 0.000 0.511 3221 V N 2.266 122.174 119.914 -0.010 0.000 2.760 3221 V HA 0.500 4.642 4.120 0.037 0.000 0.309 3221 V C -0.768 175.320 176.094 -0.009 0.000 1.077 3221 V CA -0.834 61.443 62.300 -0.037 0.000 0.910 3221 V CB 2.106 33.908 31.823 -0.035 0.000 1.008 3221 V HN 0.124 nan 8.190 nan 0.000 0.424 3222 R N 3.829 124.309 120.500 -0.033 0.000 2.502 3222 R HA 0.630 4.992 4.340 0.037 0.000 0.300 3222 R C -1.888 174.384 176.300 -0.047 0.000 0.984 3222 R CA -0.829 55.281 56.100 0.016 0.000 0.882 3222 R CB 2.202 32.544 30.300 0.069 0.000 1.180 3222 R HN 0.371 nan 8.270 nan 0.000 0.444 3223 L N 2.128 123.297 121.223 -0.091 0.000 2.329 3223 L HA 0.351 4.713 4.340 0.037 0.000 0.279 3223 L C -0.126 176.447 176.870 -0.495 0.000 1.014 3223 L CA -0.394 54.332 54.840 -0.190 0.000 0.814 3223 L CB 1.467 43.467 42.059 -0.100 0.000 1.257 3223 L HN 0.448 nan 8.230 nan 0.000 0.424 3224 D N 3.854 123.979 120.400 -0.459 0.000 2.461 3224 D HA 0.273 4.935 4.640 0.037 0.000 0.240 3224 D C -0.845 175.296 176.300 -0.265 0.000 1.094 3224 D CA -0.238 53.396 54.000 -0.609 0.000 0.868 3224 D CB 0.937 41.495 40.800 -0.403 0.000 1.062 3224 D HN 0.447 nan 8.370 nan 0.000 0.530 3225 I N 3.100 123.546 120.570 -0.207 0.000 2.392 3225 I HA 0.503 4.695 4.170 0.037 0.000 0.295 3225 I C -0.812 175.280 176.117 -0.042 0.000 0.985 3225 I CA -0.612 60.636 61.300 -0.086 0.000 1.221 3225 I CB 0.626 38.615 38.000 -0.019 0.000 1.366 3225 I HN 0.223 nan 8.210 nan 0.000 0.467 3226 R N 5.709 126.178 120.500 -0.052 0.000 2.584 3226 R HA 0.364 4.726 4.340 0.037 0.000 0.276 3226 R C -1.058 175.216 176.300 -0.044 0.000 1.046 3226 R CA -0.867 55.219 56.100 -0.024 0.000 0.906 3226 R CB 1.955 32.245 30.300 -0.016 0.000 1.215 3226 R HN 0.571 nan 8.270 nan 0.000 0.449 3227 R N 4.226 124.723 120.500 -0.006 0.000 2.316 3227 R HA 0.145 4.507 4.340 0.037 0.000 0.314 3227 R C 0.683 176.973 176.300 -0.018 0.000 1.069 3227 R CA 0.150 56.248 56.100 -0.002 0.000 0.959 3227 R CB 0.398 30.733 30.300 0.058 0.000 0.987 3227 R HN 0.780 nan 8.270 nan 0.000 0.446 3228 I N 0.698 121.241 120.570 -0.046 0.000 3.939 3228 I HA 0.467 4.659 4.170 0.037 0.000 0.313 3228 I C 0.586 176.676 176.117 -0.044 0.000 1.274 3228 I CA -0.137 61.135 61.300 -0.045 0.000 1.301 3228 I CB 0.884 38.847 38.000 -0.062 0.000 1.105 3228 I HN 0.589 nan 8.210 nan 0.000 0.427 3229 G N 0.927 109.697 108.800 -0.051 0.000 2.559 3229 G HA2 0.697 4.679 3.960 0.037 0.000 0.291 3229 G HA3 0.697 4.679 3.960 0.037 0.000 0.291 3229 G C -1.936 172.920 174.900 -0.074 0.000 1.424 3229 G CA -0.266 44.798 45.100 -0.061 0.000 0.786 3229 G HN 0.290 nan 8.290 nan 0.000 0.485 3230 A N -0.461 122.301 122.820 -0.097 0.000 2.305 3230 A HA 0.688 5.030 4.320 0.037 0.000 0.322 3230 A C -0.186 177.345 177.584 -0.088 0.000 1.187 3230 A CA -0.516 51.452 52.037 -0.116 0.000 0.825 3230 A CB 1.451 20.339 19.000 -0.186 0.000 1.164 3230 A HN 1.292 nan 8.150 nan 0.000 0.498 3231 V N 4.312 124.170 119.914 -0.094 0.000 2.356 3231 V HA 0.146 4.288 4.120 0.037 0.000 0.258 3231 V C 0.491 176.551 176.094 -0.056 0.000 1.065 3231 V CA -0.102 62.150 62.300 -0.081 0.000 0.935 3231 V CB -0.179 31.577 31.823 -0.111 0.000 1.061 3231 V HN 0.829 nan 8.190 nan 0.000 0.484 3232 K N 3.060 123.436 120.400 -0.041 0.000 2.090 3232 K HA 0.500 4.842 4.320 0.037 0.000 0.249 3232 K C 0.037 176.631 176.600 -0.011 0.000 0.995 3232 K CA -0.631 55.642 56.287 -0.024 0.000 0.914 3232 K CB 1.327 33.810 32.500 -0.028 0.000 1.057 3232 K HN 0.463 nan 8.250 nan 0.000 0.462 3233 E N 0.728 120.929 120.200 0.002 0.000 4.170 3233 E HA 0.135 4.507 4.350 0.037 0.000 0.215 3233 E C 0.376 176.981 176.600 0.008 0.000 1.119 3233 E CA -0.014 56.390 56.400 0.007 0.000 1.396 3233 E CB 0.753 30.465 29.700 0.020 0.000 1.182 3233 E HN 1.019 nan 8.360 nan 0.000 0.438 3234 G N 1.994 110.795 108.800 0.001 0.000 5.431 3234 G HA2 -0.399 3.583 3.960 0.037 0.000 0.322 3234 G HA3 -0.399 3.583 3.960 0.037 0.000 0.322 3234 G C 1.060 175.963 174.900 0.005 0.000 1.370 3234 G CA 0.726 45.828 45.100 0.002 0.000 0.963 3234 G HN 0.400 nan 8.290 nan 0.000 0.797 3235 E N 1.521 121.729 120.200 0.012 0.000 2.162 3235 E HA 0.084 4.456 4.350 0.037 0.000 0.193 3235 E C 1.039 177.655 176.600 0.026 0.000 0.953 3235 E CA 0.294 56.704 56.400 0.017 0.000 0.849 3235 E CB -0.121 29.592 29.700 0.021 0.000 0.810 3235 E HN 0.637 nan 8.360 nan 0.000 0.470 3236 N N 0.451 119.172 118.700 0.035 0.000 2.525 3236 N HA 0.111 4.873 4.740 0.037 0.000 0.271 3236 N C -0.794 174.753 175.510 0.061 0.000 1.194 3236 N CA -0.090 52.995 53.050 0.059 0.000 0.964 3236 N CB 1.630 40.157 38.487 0.066 0.000 1.126 3236 N HN -0.214 nan 8.380 nan 0.000 0.452 3237 V N 2.328 122.307 119.914 0.108 0.000 2.318 3237 V HA 0.119 4.261 4.120 0.037 0.000 0.271 3237 V C 0.567 176.807 176.094 0.244 0.000 1.030 3237 V CA -0.318 62.062 62.300 0.132 0.000 0.844 3237 V CB 1.176 33.077 31.823 0.131 0.000 1.015 3237 V HN 0.547 nan 8.190 nan 0.000 0.460 3238 V N 4.367 124.350 119.914 0.116 0.000 3.660 3238 V HA 0.636 4.778 4.120 0.037 0.000 0.276 3238 V C 0.835 176.774 176.094 -0.258 0.000 1.317 3238 V CA 1.268 63.623 62.300 0.092 0.000 1.097 3238 V CB 0.258 32.110 31.823 0.049 0.000 0.863 3238 V HN 0.910 nan 8.190 nan 0.000 0.438 3239 G N -1.175 107.306 108.800 -0.530 0.000 2.559 3239 G HA2 0.471 4.452 3.960 0.037 0.000 0.291 3239 G HA3 0.471 4.452 3.960 0.037 0.000 0.291 3239 G C -1.475 173.090 174.900 -0.558 0.000 1.424 3239 G CA -0.274 44.223 45.100 -1.004 0.000 0.786 3239 G HN -0.018 nan 8.290 nan 0.000 0.485 3240 S N -0.102 115.376 115.700 -0.369 0.000 2.456 3240 S HA 0.482 4.974 4.470 0.037 0.000 0.316 3240 S C -0.269 174.293 174.600 -0.065 0.000 1.089 3240 S CA -0.413 57.755 58.200 -0.053 0.000 1.101 3240 S CB 1.590 64.870 63.200 0.134 0.000 0.995 3240 S HN 0.586 nan 8.310 nan 0.000 0.468 3241 E N 2.154 122.312 120.200 -0.070 0.000 2.376 3241 E HA 0.281 4.653 4.350 0.037 0.000 0.266 3241 E C -0.549 175.968 176.600 -0.138 0.000 1.009 3241 E CA 0.513 56.858 56.400 -0.092 0.000 0.902 3241 E CB 0.540 30.193 29.700 -0.078 0.000 0.972 3241 E HN 0.452 nan 8.360 nan 0.000 0.439 3242 T N 4.929 119.321 114.554 -0.270 0.000 2.893 3242 T HA 0.504 4.876 4.350 0.037 0.000 0.293 3242 T C -0.903 173.469 174.700 -0.546 0.000 1.027 3242 T CA -0.801 61.043 62.100 -0.427 0.000 0.988 3242 T CB 1.291 69.805 68.868 -0.590 0.000 1.043 3242 T HN 0.382 nan 8.240 nan 0.000 0.461 3243 R N 2.129 122.404 120.500 -0.375 0.000 2.532 3243 R HA 0.693 5.055 4.340 0.037 0.000 0.297 3243 R C -1.969 174.210 176.300 -0.202 0.000 0.984 3243 R CA -0.509 55.423 56.100 -0.280 0.000 0.884 3243 R CB 1.386 31.597 30.300 -0.148 0.000 1.182 3243 R HN 0.466 nan 8.270 nan 0.000 0.442 3244 V N 4.511 124.337 119.914 -0.146 0.000 2.495 3244 V HA 0.424 4.566 4.120 0.037 0.000 0.298 3244 V C -0.238 175.835 176.094 -0.035 0.000 1.031 3244 V CA -0.789 61.474 62.300 -0.061 0.000 0.871 3244 V CB 1.890 33.734 31.823 0.036 0.000 0.988 3244 V HN 0.669 nan 8.190 nan 0.000 0.432 3245 K N 2.869 123.241 120.400 -0.047 0.000 2.206 3245 K HA 0.578 4.920 4.320 0.037 0.000 0.264 3245 K C -1.001 175.570 176.600 -0.050 0.000 0.967 3245 K CA -0.671 55.607 56.287 -0.016 0.000 0.844 3245 K CB 2.189 34.702 32.500 0.022 0.000 1.099 3245 K HN 0.458 nan 8.250 nan 0.000 0.441 3246 V N 4.629 124.512 119.914 -0.052 0.000 2.405 3246 V HA -0.005 4.137 4.120 0.037 0.000 0.264 3246 V C 1.023 176.981 176.094 -0.227 0.000 1.048 3246 V CA 0.039 62.263 62.300 -0.127 0.000 0.966 3246 V CB 0.960 32.700 31.823 -0.138 0.000 1.015 3246 V HN 0.649 nan 8.190 nan 0.000 0.477 3247 V N 3.972 123.761 119.914 -0.208 0.000 2.949 3247 V HA 0.180 4.322 4.120 0.037 0.000 0.245 3247 V C 0.809 176.665 176.094 -0.396 0.000 1.086 3247 V CA 0.846 63.015 62.300 -0.218 0.000 1.097 3247 V CB 0.046 31.893 31.823 0.040 0.000 0.762 3247 V HN 0.771 nan 8.190 nan 0.000 0.470 3248 K N 1.083 121.313 120.400 -0.285 0.000 2.371 3248 K HA 0.432 4.773 4.320 0.037 0.000 0.251 3248 K C -1.511 174.923 176.600 -0.277 0.000 0.934 3248 K CA -0.572 55.541 56.287 -0.290 0.000 0.798 3248 K CB 1.739 34.148 32.500 -0.152 0.000 1.204 3248 K HN 0.122 nan 8.250 nan 0.000 0.427 3249 N N 2.996 121.508 118.700 -0.313 0.000 2.549 3249 N HA 0.192 4.954 4.740 0.037 0.000 0.290 3249 N C -0.856 174.496 175.510 -0.263 0.000 1.122 3249 N CA -0.307 52.582 53.050 -0.269 0.000 0.885 3249 N CB 1.561 39.862 38.487 -0.309 0.000 1.455 3249 N HN 0.607 nan 8.380 nan 0.000 0.521 3250 K N 2.254 122.539 120.400 -0.191 0.000 2.358 3250 K HA 0.258 4.600 4.320 0.037 0.000 0.197 3250 K C 0.772 177.255 176.600 -0.196 0.000 1.025 3250 K CA 0.120 56.294 56.287 -0.188 0.000 1.104 3250 K CB 0.603 33.044 32.500 -0.099 0.000 0.855 3250 K HN 0.378 nan 8.250 nan 0.000 0.531 3251 I N -0.217 120.248 120.570 -0.175 0.000 3.883 3251 I HA 0.155 4.347 4.170 0.037 0.000 0.305 3251 I C 0.238 176.276 176.117 -0.133 0.000 1.247 3251 I CA 0.035 61.260 61.300 -0.126 0.000 1.350 3251 I CB 0.959 38.912 38.000 -0.077 0.000 1.194 3251 I HN -0.051 nan 8.210 nan 0.000 0.441 3252 A N -0.438 122.279 122.820 -0.171 0.000 2.534 3252 A HA 0.852 5.194 4.320 0.037 0.000 0.300 3252 A C -0.864 176.589 177.584 -0.217 0.000 1.223 3252 A CA -0.182 51.771 52.037 -0.141 0.000 0.666 3252 A CB -0.097 18.855 19.000 -0.079 0.000 1.316 3252 A HN 0.060 nan 8.150 nan 0.000 0.468 3253 A N 1.340 124.069 122.820 -0.151 0.000 2.520 3253 A HA 0.558 4.900 4.320 0.037 0.000 0.245 3253 A C -2.054 175.364 177.584 -0.276 0.000 1.072 3253 A CA -0.527 51.374 52.037 -0.227 0.000 0.761 3253 A CB -0.753 18.245 19.000 -0.004 0.000 1.004 3253 A HN 0.511 nan 8.150 nan 0.000 0.499 3254 P HA 0.517 nan 4.420 nan 0.000 0.282 3254 P C -0.122 177.057 177.300 -0.203 0.000 1.287 3254 P CA -0.314 62.493 63.100 -0.488 0.000 0.792 3254 P CB 0.171 31.346 31.700 -0.875 0.000 1.163 3255 F N -4.632 115.282 119.950 -0.059 0.000 2.840 3255 F HA -0.204 4.345 4.527 0.037 0.000 0.310 3255 F C 0.658 176.461 175.800 0.006 0.000 0.688 3255 F CA 0.765 58.761 58.000 -0.006 0.000 1.286 3255 F CB -2.418 36.604 39.000 0.036 0.000 1.612 3255 F HN 0.226 nan 8.300 nan 0.000 0.335 3256 K N 1.243 121.703 120.400 0.100 0.000 2.202 3256 K HA 0.461 4.803 4.320 0.037 0.000 0.264 3256 K C 0.435 177.067 176.600 0.053 0.000 1.010 3256 K CA -0.271 56.060 56.287 0.073 0.000 0.940 3256 K CB 0.751 33.274 32.500 0.038 0.000 0.983 3256 K HN 0.418 nan 8.250 nan 0.000 0.475 3257 Q N 0.123 119.953 119.800 0.049 0.000 2.397 3257 Q HA 0.733 5.095 4.340 0.037 0.000 0.275 3257 Q C -1.718 174.300 176.000 0.031 0.000 1.090 3257 Q CA -1.254 54.569 55.803 0.034 0.000 0.809 3257 Q CB 2.163 30.919 28.738 0.031 0.000 1.362 3257 Q HN 0.525 nan 8.270 nan 0.000 0.431 3258 A N 1.856 124.696 122.820 0.034 0.000 2.386 3258 A HA 0.643 4.985 4.320 0.037 0.000 0.311 3258 A C -1.138 176.452 177.584 0.010 0.000 1.068 3258 A CA -0.674 51.402 52.037 0.065 0.000 0.743 3258 A CB 1.593 20.678 19.000 0.141 0.000 1.258 3258 A HN 0.793 nan 8.150 nan 0.000 0.429 3259 E N 0.247 120.451 120.200 0.005 0.000 2.244 3259 E HA 0.777 5.149 4.350 0.037 0.000 0.266 3259 E C -1.084 175.519 176.600 0.005 0.000 0.914 3259 E CA -0.400 55.924 56.400 -0.127 0.000 0.794 3259 E CB 2.101 31.748 29.700 -0.088 0.000 1.210 3259 E HN 0.668 nan 8.360 nan 0.000 0.414 3260 F N -1.916 118.016 119.950 -0.030 0.000 3.194 3260 F HA 0.345 4.894 4.527 0.037 0.000 0.327 3260 F C -1.731 174.049 175.800 -0.033 0.000 1.141 3260 F CA -1.183 56.794 58.000 -0.039 0.000 0.862 3260 F CB 0.874 39.844 39.000 -0.050 0.000 1.447 3260 F HN 0.182 nan 8.300 nan 0.000 0.479 3261 Q N 1.282 121.288 119.800 0.344 0.000 2.333 3261 Q HA 0.667 5.029 4.340 0.037 0.000 0.267 3261 Q C -1.292 174.863 176.000 0.258 0.000 1.012 3261 Q CA -0.755 55.153 55.803 0.176 0.000 0.824 3261 Q CB 3.010 31.789 28.738 0.068 0.000 1.290 3261 Q HN 0.570 nan 8.270 nan 0.000 0.449 3262 I N 3.862 124.528 120.570 0.161 0.000 2.307 3262 I HA 0.222 4.414 4.170 0.037 0.000 0.289 3262 I C -0.501 175.580 176.117 -0.060 0.000 1.021 3262 I CA -0.444 60.932 61.300 0.126 0.000 1.224 3262 I CB 0.602 38.721 38.000 0.198 0.000 1.376 3262 I HN 0.367 nan 8.210 nan 0.000 0.470 3263 L N 7.106 128.314 121.223 -0.026 0.000 2.278 3263 L HA 0.290 4.652 4.340 0.037 0.000 0.287 3263 L C -0.546 176.352 176.870 0.046 0.000 1.072 3263 L CA -0.805 53.985 54.840 -0.083 0.000 0.819 3263 L CB 0.001 42.054 42.059 -0.010 0.000 1.176 3263 L HN 0.392 nan 8.230 nan 0.000 0.435 3264 Y N 2.302 122.697 120.300 0.159 0.000 2.721 3264 Y HA 0.193 4.765 4.550 0.037 0.000 0.329 3264 Y C 1.475 177.513 175.900 0.230 0.000 1.211 3264 Y CA 0.547 58.775 58.100 0.213 0.000 1.512 3264 Y CB -0.055 38.497 38.460 0.154 0.000 1.249 3264 Y HN 0.862 nan 8.280 nan 0.000 0.549 3265 G N 2.012 111.145 108.800 0.554 0.000 2.176 3265 G HA2 -0.334 3.648 3.960 0.037 0.000 0.253 3265 G HA3 -0.334 3.648 3.960 0.037 0.000 0.253 3265 G C 0.822 175.762 174.900 0.066 0.000 0.979 3265 G CA 0.617 45.914 45.100 0.328 0.000 0.641 3265 G HN 0.632 nan 8.290 nan 0.000 0.530 3266 E N -1.330 118.903 120.200 0.055 0.000 2.520 3266 E HA 0.476 4.848 4.350 0.037 0.000 0.201 3266 E C 1.335 177.905 176.600 -0.050 0.000 0.894 3266 E CA 1.288 57.682 56.400 -0.010 0.000 1.161 3266 E CB 0.712 30.429 29.700 0.028 0.000 1.137 3266 E HN 1.629 nan 8.360 nan 0.000 0.510 3267 G N 0.617 109.419 108.800 0.003 0.000 2.306 3267 G HA2 -0.107 3.875 3.960 0.037 0.000 0.262 3267 G HA3 -0.107 3.875 3.960 0.037 0.000 0.262 3267 G C -0.920 173.995 174.900 0.026 0.000 1.263 3267 G CA -0.476 44.623 45.100 -0.001 0.000 1.088 3267 G HN 0.139 nan 8.290 nan 0.000 0.489 3268 I N 1.863 122.423 120.570 -0.016 0.000 2.671 3268 I HA 0.009 4.201 4.170 0.037 0.000 0.285 3268 I C 0.841 176.943 176.117 -0.025 0.000 1.148 3268 I CA -0.186 61.075 61.300 -0.064 0.000 1.386 3268 I CB 0.315 38.149 38.000 -0.276 0.000 1.406 3268 I HN 0.443 nan 8.210 nan 0.000 0.540 3269 N N 6.611 125.328 118.700 0.029 0.000 2.429 3269 N HA -0.152 4.610 4.740 0.037 0.000 0.298 3269 N C 0.637 176.157 175.510 0.017 0.000 1.256 3269 N CA 0.490 53.567 53.050 0.044 0.000 1.090 3269 N CB -0.106 38.416 38.487 0.059 0.000 1.477 3269 N HN 0.498 nan 8.380 nan 0.000 0.491 3270 F N 3.436 123.273 119.950 -0.188 0.000 2.113 3270 F HA -0.166 4.383 4.527 0.037 0.000 0.297 3270 F C 0.992 176.660 175.800 -0.221 0.000 1.103 3270 F CA 1.395 59.224 58.000 -0.284 0.000 1.248 3270 F CB -0.095 38.625 39.000 -0.466 0.000 0.999 3270 F HN 0.425 nan 8.300 nan 0.000 0.475 3271 Y N 0.519 120.944 120.300 0.207 0.000 2.293 3271 Y HA 0.001 4.573 4.550 0.037 0.000 0.291 3271 Y C 2.651 178.543 175.900 -0.014 0.000 1.137 3271 Y CA 0.827 58.990 58.100 0.105 0.000 1.202 3271 Y CB -1.426 37.095 38.460 0.102 0.000 0.990 3271 Y HN 0.127 nan 8.280 nan 0.000 0.537 3272 G N 0.096 108.967 108.800 0.118 0.000 2.514 3272 G HA2 -0.298 3.684 3.960 0.037 0.000 0.217 3272 G HA3 -0.298 3.684 3.960 0.037 0.000 0.217 3272 G C 1.525 176.417 174.900 -0.013 0.000 1.198 3272 G CA 1.283 46.405 45.100 0.036 0.000 0.780 3272 G HN 0.422 nan 8.290 nan 0.000 0.565 3273 E N -0.248 119.908 120.200 -0.073 0.000 2.070 3273 E HA -0.172 4.200 4.350 0.037 0.000 0.197 3273 E C 2.420 178.936 176.600 -0.140 0.000 1.004 3273 E CA 1.051 57.376 56.400 -0.126 0.000 0.805 3273 E CB -0.263 29.274 29.700 -0.272 0.000 0.744 3273 E HN 0.312 nan 8.360 nan 0.000 0.451 3274 L N 0.755 121.867 121.223 -0.185 0.000 2.042 3274 L HA -0.170 4.192 4.340 0.037 0.000 0.210 3274 L C 2.227 179.092 176.870 -0.008 0.000 1.076 3274 L CA 1.363 56.140 54.840 -0.106 0.000 0.749 3274 L CB -0.379 41.674 42.059 -0.009 0.000 0.893 3274 L HN -0.031 nan 8.230 nan 0.000 0.432 3275 V N -0.201 119.720 119.914 0.012 0.000 2.255 3275 V HA -0.322 3.820 4.120 0.037 0.000 0.247 3275 V C 2.328 178.453 176.094 0.051 0.000 1.051 3275 V CA 2.091 64.400 62.300 0.015 0.000 1.018 3275 V CB -0.771 31.011 31.823 -0.068 0.000 0.641 3275 V HN 0.429 nan 8.190 nan 0.000 0.445 3276 D N -0.139 120.281 120.400 0.033 0.000 2.104 3276 D HA -0.127 4.535 4.640 0.037 0.000 0.194 3276 D C 2.148 178.476 176.300 0.047 0.000 0.994 3276 D CA 1.013 55.046 54.000 0.055 0.000 0.830 3276 D CB -0.312 40.510 40.800 0.036 0.000 0.959 3276 D HN 0.165 nan 8.370 nan 0.000 0.452 3277 L N 0.600 121.831 121.223 0.014 0.000 2.046 3277 L HA -0.079 4.283 4.340 0.037 0.000 0.208 3277 L C 2.467 179.358 176.870 0.034 0.000 1.077 3277 L CA 1.672 56.518 54.840 0.010 0.000 0.747 3277 L CB -1.543 40.498 42.059 -0.029 0.000 0.896 3277 L HN 0.096 nan 8.230 nan 0.000 0.432 3278 G N -0.854 107.973 108.800 0.046 0.000 2.418 3278 G HA2 -0.164 3.818 3.960 0.037 0.000 0.217 3278 G HA3 -0.164 3.818 3.960 0.037 0.000 0.217 3278 G C 1.723 176.684 174.900 0.100 0.000 1.158 3278 G CA 0.883 46.028 45.100 0.074 0.000 0.771 3278 G HN 0.264 nan 8.290 nan 0.000 0.545 3279 V N 0.646 120.629 119.914 0.116 0.000 2.427 3279 V HA -0.114 4.028 4.120 0.037 0.000 0.248 3279 V C 2.666 178.805 176.094 0.076 0.000 1.051 3279 V CA 2.010 64.381 62.300 0.118 0.000 1.048 3279 V CB -0.329 31.589 31.823 0.160 0.000 0.666 3279 V HN 0.339 nan 8.190 nan 0.000 0.456 3280 K N -0.129 120.310 120.400 0.066 0.000 2.097 3280 K HA -0.159 4.183 4.320 0.037 0.000 0.205 3280 K C 1.822 178.449 176.600 0.045 0.000 1.050 3280 K CA 1.168 57.484 56.287 0.048 0.000 0.938 3280 K CB 0.027 32.552 32.500 0.040 0.000 0.718 3280 K HN 0.365 nan 8.250 nan 0.000 0.442 3281 E N 0.630 120.861 120.200 0.051 0.000 2.489 3281 E HA -0.021 4.351 4.350 0.037 0.000 0.193 3281 E C -0.088 176.546 176.600 0.057 0.000 1.057 3281 E CA 0.163 56.593 56.400 0.051 0.000 0.866 3281 E CB 0.466 30.197 29.700 0.052 0.000 0.916 3281 E HN 0.152 nan 8.360 nan 0.000 0.500 3282 K N -0.393 120.044 120.400 0.062 0.000 3.281 3282 K HA -0.193 4.149 4.320 0.037 0.000 0.295 3282 K C 1.006 177.657 176.600 0.085 0.000 1.233 3282 K CA 0.442 56.765 56.287 0.061 0.000 0.866 3282 K CB -2.100 30.425 32.500 0.042 0.000 1.265 3282 K HN 0.257 nan 8.250 nan 0.000 0.482 3283 L N -0.345 120.948 121.223 0.118 0.000 2.270 3283 L HA 0.173 4.535 4.340 0.037 0.000 0.210 3283 L C 1.183 178.216 176.870 0.272 0.000 1.104 3283 L CA 0.668 55.620 54.840 0.186 0.000 0.804 3283 L CB 0.085 42.260 42.059 0.193 0.000 0.937 3283 L HN 0.106 nan 8.230 nan 0.000 0.450 3284 I N -0.352 120.346 120.570 0.213 0.000 2.404 3284 I HA 0.204 4.396 4.170 0.037 0.000 0.293 3284 I C -0.260 175.946 176.117 0.148 0.000 0.992 3284 I CA -0.606 60.835 61.300 0.236 0.000 1.149 3284 I CB 2.158 40.299 38.000 0.235 0.000 1.315 3284 I HN -0.127 nan 8.210 nan 0.000 0.446 3285 E N 5.491 125.760 120.200 0.115 0.000 2.259 3285 E HA 0.232 4.604 4.350 0.037 0.000 0.281 3285 E C -0.722 175.862 176.600 -0.028 0.000 1.027 3285 E CA -0.303 56.119 56.400 0.036 0.000 0.838 3285 E CB 0.989 30.698 29.700 0.016 0.000 1.066 3285 E HN 0.275 nan 8.360 nan 0.000 0.401 3286 K N 2.721 123.057 120.400 -0.107 0.000 2.464 3286 K HA 0.494 4.836 4.320 0.037 0.000 0.252 3286 K C -1.357 175.143 176.600 -0.167 0.000 1.000 3286 K CA -0.597 55.519 56.287 -0.285 0.000 0.951 3286 K CB 0.927 33.190 32.500 -0.396 0.000 1.183 3286 K HN 0.515 nan 8.250 nan 0.000 0.445 3287 A N 3.739 126.498 122.820 -0.103 0.000 3.016 3287 A HA 0.502 4.844 4.320 0.037 0.000 0.303 3287 A C 0.920 178.513 177.584 0.014 0.000 1.507 3287 A CA 0.365 52.387 52.037 -0.025 0.000 1.196 3287 A CB -0.466 18.537 19.000 0.004 0.000 1.169 3287 A HN 1.056 nan 8.150 nan 0.000 0.544 3288 G N 1.432 110.209 108.800 -0.039 0.000 2.889 3288 G HA2 -0.140 3.842 3.960 0.037 0.000 0.308 3288 G HA3 -0.140 3.842 3.960 0.037 0.000 0.308 3288 G C 1.340 176.202 174.900 -0.064 0.000 1.248 3288 G CA 0.800 45.888 45.100 -0.020 0.000 0.982 3288 G HN 1.890 nan 8.290 nan 0.000 0.571 3289 A N -0.775 122.040 122.820 -0.009 0.000 2.348 3289 A HA 0.541 4.883 4.320 0.037 0.000 0.224 3289 A C 0.472 177.966 177.584 -0.150 0.000 1.227 3289 A CA 0.475 52.465 52.037 -0.078 0.000 0.885 3289 A CB 0.056 19.000 19.000 -0.093 0.000 0.933 3289 A HN 0.546 nan 8.150 nan 0.000 0.506 3290 W N -0.712 120.526 121.300 -0.102 0.000 2.390 3290 W HA 0.575 5.257 4.660 0.037 0.000 0.312 3290 W C -0.858 175.556 176.519 -0.175 0.000 1.123 3290 W CA -0.081 57.232 57.345 -0.053 0.000 1.202 3290 W CB 0.574 30.005 29.460 -0.049 0.000 1.251 3290 W HN 0.186 nan 8.180 nan 0.000 0.511 3291 Y N 2.341 122.747 120.300 0.176 0.000 2.328 3291 Y HA 0.461 5.033 4.550 0.037 0.000 0.337 3291 Y C 0.290 176.228 175.900 0.064 0.000 0.966 3291 Y CA -0.598 57.552 58.100 0.082 0.000 1.136 3291 Y CB 1.526 39.991 38.460 0.008 0.000 1.170 3291 Y HN 0.141 nan 8.280 nan 0.000 0.470 3292 S N 2.998 118.790 115.700 0.153 0.000 2.500 3292 S HA 0.409 4.901 4.470 0.037 0.000 0.301 3292 S C -1.829 172.838 174.600 0.112 0.000 1.092 3292 S CA -0.759 57.484 58.200 0.071 0.000 1.030 3292 S CB 1.127 64.340 63.200 0.022 0.000 1.031 3292 S HN 0.498 nan 8.310 nan 0.000 0.483 3293 Y N 2.842 123.087 120.300 -0.093 0.000 2.326 3293 Y HA 0.371 4.943 4.550 0.037 0.000 0.331 3293 Y C 0.204 176.089 175.900 -0.024 0.000 0.962 3293 Y CA -0.992 57.083 58.100 -0.043 0.000 1.167 3293 Y CB 0.527 38.962 38.460 -0.041 0.000 1.148 3293 Y HN 0.805 nan 8.280 nan 0.000 0.463 3294 K N 4.957 125.031 120.400 -0.542 0.000 3.156 3294 K HA -0.266 4.076 4.320 0.037 0.000 0.266 3294 K C 0.962 177.436 176.600 -0.209 0.000 0.966 3294 K CA 1.001 57.021 56.287 -0.445 0.000 0.719 3294 K CB -1.618 30.505 32.500 -0.629 0.000 1.333 3294 K HN 1.324 nan 8.250 nan 0.000 0.468 3295 G N 0.147 108.866 108.800 -0.135 0.000 2.320 3295 G HA2 -0.376 3.606 3.960 0.037 0.000 0.242 3295 G HA3 -0.376 3.606 3.960 0.037 0.000 0.242 3295 G C -0.047 174.807 174.900 -0.076 0.000 1.033 3295 G CA 0.515 45.561 45.100 -0.090 0.000 0.620 3295 G HN 0.516 nan 8.290 nan 0.000 0.517 3296 E N 1.721 121.877 120.200 -0.073 0.000 2.259 3296 E HA 0.359 4.731 4.350 0.037 0.000 0.281 3296 E C 0.187 176.728 176.600 -0.098 0.000 1.037 3296 E CA -0.499 55.863 56.400 -0.063 0.000 0.854 3296 E CB 0.257 29.944 29.700 -0.021 0.000 1.051 3296 E HN 0.322 nan 8.360 nan 0.000 0.409 3297 K N 5.060 125.414 120.400 -0.077 0.000 2.379 3297 K HA 0.115 4.457 4.320 0.037 0.000 0.284 3297 K C 0.922 177.436 176.600 -0.143 0.000 1.044 3297 K CA 0.075 56.350 56.287 -0.020 0.000 0.974 3297 K CB 0.653 33.181 32.500 0.046 0.000 0.962 3297 K HN 0.573 nan 8.250 nan 0.000 0.474 3298 I N -1.690 118.728 120.570 -0.254 0.000 4.181 3298 I HA 0.294 4.486 4.170 0.037 0.000 0.331 3298 I C 0.604 176.518 176.117 -0.338 0.000 1.312 3298 I CA -0.314 60.534 61.300 -0.754 0.000 1.146 3298 I CB 1.024 38.242 38.000 -1.303 0.000 1.074 3298 I HN 0.543 nan 8.210 nan 0.000 0.402 3299 G N 0.771 109.541 108.800 -0.051 0.000 2.523 3299 G HA2 0.372 4.354 3.960 0.037 0.000 0.291 3299 G HA3 0.372 4.354 3.960 0.037 0.000 0.291 3299 G C -2.104 172.695 174.900 -0.168 0.000 1.450 3299 G CA -0.580 44.479 45.100 -0.068 0.000 0.790 3299 G HN 0.116 nan 8.290 nan 0.000 0.496 3300 Q N 0.118 119.696 119.800 -0.369 0.000 2.401 3300 Q HA 0.529 4.891 4.340 0.037 0.000 0.260 3300 Q C 0.123 175.975 176.000 -0.247 0.000 1.034 3300 Q CA 0.237 55.668 55.803 -0.621 0.000 0.737 3300 Q CB 1.100 29.239 28.738 -0.998 0.000 1.227 3300 Q HN 2.202 nan 8.270 nan 0.000 0.488 3301 G N 2.841 111.646 108.800 0.007 0.000 2.767 3301 G HA2 -0.260 3.722 3.960 0.037 0.000 0.686 3301 G HA3 -0.260 3.722 3.960 0.037 0.000 0.686 3301 G C 0.182 175.023 174.900 -0.098 0.000 1.213 3301 G CA 0.005 45.157 45.100 0.086 0.000 0.803 3301 G HN 0.751 nan 8.290 nan 0.000 0.603 3302 K N 1.152 121.475 120.400 -0.128 0.000 2.144 3302 K HA -0.193 4.149 4.320 0.037 0.000 0.209 3302 K C 2.900 179.363 176.600 -0.229 0.000 1.047 3302 K CA 2.727 58.808 56.287 -0.344 0.000 0.927 3302 K CB -0.354 32.070 32.500 -0.127 0.000 0.716 3302 K HN 1.252 nan 8.250 nan 0.000 0.454 3303 A N 1.324 124.068 122.820 -0.126 0.000 1.869 3303 A HA -0.288 4.054 4.320 0.037 0.000 0.218 3303 A C 1.763 179.296 177.584 -0.086 0.000 1.203 3303 A CA 2.333 54.321 52.037 -0.083 0.000 0.638 3303 A CB -0.981 17.984 19.000 -0.059 0.000 0.831 3303 A HN 0.627 nan 8.150 nan 0.000 0.450 3304 N N -0.266 118.372 118.700 -0.105 0.000 2.216 3304 N HA 0.081 4.843 4.740 0.037 0.000 0.183 3304 N C 1.954 177.435 175.510 -0.049 0.000 1.017 3304 N CA 0.931 53.941 53.050 -0.066 0.000 0.861 3304 N CB -0.269 38.169 38.487 -0.081 0.000 0.986 3304 N HN 0.501 nan 8.380 nan 0.000 0.428 3305 A N 0.784 123.502 122.820 -0.171 0.000 1.908 3305 A HA -0.182 4.160 4.320 0.037 0.000 0.218 3305 A C 2.261 179.816 177.584 -0.048 0.000 1.181 3305 A CA 1.898 53.828 52.037 -0.178 0.000 0.627 3305 A CB -1.134 17.515 19.000 -0.586 0.000 0.818 3305 A HN 0.229 nan 8.150 nan 0.000 0.445 3306 T N 0.367 114.868 114.554 -0.090 0.000 2.652 3306 T HA -0.059 4.313 4.350 0.037 0.000 0.267 3306 T C 2.223 176.903 174.700 -0.033 0.000 1.039 3306 T CA 1.768 63.857 62.100 -0.018 0.000 1.153 3306 T CB -0.539 68.329 68.868 0.001 0.000 0.863 3306 T HN 0.628 nan 8.240 nan 0.000 0.428 3307 A N 0.056 122.865 122.820 -0.018 0.000 1.972 3307 A HA -0.109 4.233 4.320 0.037 0.000 0.219 3307 A C 2.034 179.598 177.584 -0.034 0.000 1.169 3307 A CA 1.444 53.462 52.037 -0.032 0.000 0.635 3307 A CB -1.030 17.968 19.000 -0.003 0.000 0.810 3307 A HN 0.718 nan 8.150 nan 0.000 0.446 3308 W N 0.298 121.515 121.300 -0.139 0.000 2.407 3308 W HA -0.052 4.630 4.660 0.037 0.000 0.305 3308 W C 1.741 178.153 176.519 -0.179 0.000 1.196 3308 W CA 1.590 58.864 57.345 -0.120 0.000 1.311 3308 W CB -0.243 29.176 29.460 -0.068 0.000 1.135 3308 W HN 0.229 nan 8.180 nan 0.000 0.514 3309 L N 0.734 121.941 121.223 -0.027 0.000 2.191 3309 L HA -0.226 4.136 4.340 0.037 0.000 0.212 3309 L C 2.482 178.912 176.870 -0.733 0.000 1.103 3309 L CA 1.421 56.081 54.840 -0.301 0.000 0.769 3309 L CB -0.726 41.261 42.059 -0.120 0.000 0.908 3309 L HN -0.036 nan 8.230 nan 0.000 0.438 3310 K N -0.006 119.929 120.400 -0.776 0.000 2.026 3310 K HA -0.194 4.148 4.320 0.037 0.000 0.208 3310 K C 1.526 177.840 176.600 -0.476 0.000 1.048 3310 K CA 1.776 57.597 56.287 -0.776 0.000 0.929 3310 K CB 0.026 32.286 32.500 -0.401 0.000 0.713 3310 K HN 0.222 nan 8.250 nan 0.000 0.439 3311 D N 0.026 120.161 120.400 -0.442 0.000 2.277 3311 D HA -0.049 4.613 4.640 0.037 0.000 0.208 3311 D C -0.275 175.739 176.300 -0.476 0.000 0.962 3311 D CA 0.851 54.614 54.000 -0.395 0.000 0.865 3311 D CB 0.021 40.602 40.800 -0.365 0.000 0.939 3311 D HN 0.129 nan 8.370 nan 0.000 0.510 3312 N N 0.220 118.528 118.700 -0.653 0.000 3.012 3312 N HA 0.195 4.957 4.740 0.037 0.000 0.270 3312 N C -2.131 173.153 175.510 -0.377 0.000 1.469 3312 N CA -1.140 51.555 53.050 -0.591 0.000 0.928 3312 N CB 1.713 39.596 38.487 -1.005 0.000 1.219 3312 N HN -0.076 nan 8.380 nan 0.000 0.492 3313 P HA -0.121 nan 4.420 nan 0.000 0.220 3313 P C 0.973 178.227 177.300 -0.075 0.000 1.148 3313 P CA 1.059 64.082 63.100 -0.128 0.000 0.803 3313 P CB 0.504 32.153 31.700 -0.084 0.000 0.782 3314 E N -0.527 119.619 120.200 -0.091 0.000 2.047 3314 E HA -0.106 4.266 4.350 0.037 0.000 0.191 3314 E C 1.843 178.432 176.600 -0.020 0.000 0.987 3314 E CA 1.603 57.977 56.400 -0.043 0.000 0.799 3314 E CB -1.525 28.151 29.700 -0.039 0.000 0.752 3314 E HN 0.295 nan 8.360 nan 0.000 0.449 3315 T N 1.481 116.005 114.554 -0.049 0.000 2.904 3315 T HA 0.010 4.382 4.350 0.037 0.000 0.267 3315 T C 2.030 176.708 174.700 -0.037 0.000 1.059 3315 T CA 1.127 63.225 62.100 -0.004 0.000 1.137 3315 T CB -0.154 68.731 68.868 0.028 0.000 0.879 3315 T HN 0.253 nan 8.240 nan 0.000 0.467 3316 A N 2.305 125.098 122.820 -0.044 0.000 1.877 3316 A HA -0.113 4.229 4.320 0.037 0.000 0.216 3316 A C 2.337 179.974 177.584 0.088 0.000 1.186 3316 A CA 1.139 53.201 52.037 0.041 0.000 0.620 3316 A CB -0.328 18.737 19.000 0.107 0.000 0.822 3316 A HN 0.204 nan 8.150 nan 0.000 0.443 3317 K N -0.197 120.244 120.400 0.068 0.000 2.063 3317 K HA -0.202 4.140 4.320 0.037 0.000 0.208 3317 K C 1.940 178.577 176.600 0.062 0.000 1.048 3317 K CA 1.645 57.972 56.287 0.066 0.000 0.928 3317 K CB -0.451 32.071 32.500 0.036 0.000 0.713 3317 K HN 0.788 nan 8.250 nan 0.000 0.442 3318 E N 0.684 120.916 120.200 0.054 0.000 2.077 3318 E HA -0.161 4.211 4.350 0.037 0.000 0.193 3318 E C 2.069 178.713 176.600 0.074 0.000 0.989 3318 E CA 0.987 57.430 56.400 0.072 0.000 0.800 3318 E CB -0.011 29.750 29.700 0.101 0.000 0.746 3318 E HN 0.252 nan 8.360 nan 0.000 0.452 3319 I N 0.784 121.375 120.570 0.034 0.000 2.233 3319 I HA -0.201 3.991 4.170 0.037 0.000 0.243 3319 I C 2.695 178.845 176.117 0.054 0.000 1.093 3319 I CA 1.099 62.413 61.300 0.024 0.000 1.380 3319 I CB -0.383 37.572 38.000 -0.076 0.000 1.067 3319 I HN 0.216 nan 8.210 nan 0.000 0.413 3320 E N 1.817 122.060 120.200 0.073 0.000 2.070 3320 E HA -0.315 4.057 4.350 0.037 0.000 0.197 3320 E C 2.260 178.901 176.600 0.069 0.000 1.004 3320 E CA 1.581 58.033 56.400 0.086 0.000 0.805 3320 E CB -0.030 29.765 29.700 0.158 0.000 0.744 3320 E HN 0.278 nan 8.360 nan 0.000 0.451 3321 K N 0.602 121.043 120.400 0.069 0.000 2.044 3321 K HA -0.226 4.116 4.320 0.037 0.000 0.210 3321 K C 2.191 178.823 176.600 0.054 0.000 1.049 3321 K CA 1.793 58.114 56.287 0.057 0.000 0.927 3321 K CB -0.044 32.489 32.500 0.054 0.000 0.713 3321 K HN 0.010 nan 8.250 nan 0.000 0.443 3322 K N 0.047 120.484 120.400 0.062 0.000 2.097 3322 K HA -0.096 4.246 4.320 0.037 0.000 0.206 3322 K C 1.993 178.625 176.600 0.053 0.000 1.049 3322 K CA 1.129 57.454 56.287 0.063 0.000 0.933 3322 K CB 0.046 32.596 32.500 0.084 0.000 0.717 3322 K HN -0.020 nan 8.250 nan 0.000 0.442 3323 V N 1.119 121.062 119.914 0.049 0.000 2.307 3323 V HA -0.243 3.899 4.120 0.037 0.000 0.245 3323 V C 2.143 178.254 176.094 0.028 0.000 1.045 3323 V CA 1.664 63.985 62.300 0.035 0.000 1.024 3323 V CB -0.418 31.417 31.823 0.020 0.000 0.651 3323 V HN 0.277 nan 8.190 nan 0.000 0.449 3324 R N -0.106 120.412 120.500 0.030 0.000 2.081 3324 R HA -0.182 4.180 4.340 0.037 0.000 0.235 3324 R C 2.314 178.631 176.300 0.028 0.000 1.131 3324 R CA 1.780 57.896 56.100 0.027 0.000 0.960 3324 R CB -0.323 29.997 30.300 0.033 0.000 0.856 3324 R HN 0.623 nan 8.270 nan 0.000 0.436 3325 E N 0.617 120.837 120.200 0.032 0.000 2.077 3325 E HA -0.172 4.200 4.350 0.037 0.000 0.193 3325 E C 2.021 178.639 176.600 0.030 0.000 0.989 3325 E CA 0.960 57.379 56.400 0.031 0.000 0.800 3325 E CB -0.067 29.654 29.700 0.035 0.000 0.746 3325 E HN 0.292 nan 8.360 nan 0.000 0.452 3326 L N 0.143 121.386 121.223 0.033 0.000 2.217 3326 L HA -0.101 4.261 4.340 0.037 0.000 0.211 3326 L C 1.914 178.801 176.870 0.029 0.000 1.107 3326 L CA 0.793 55.653 54.840 0.032 0.000 0.783 3326 L CB 0.135 42.216 42.059 0.036 0.000 0.919 3326 L HN 0.161 nan 8.230 nan 0.000 0.442 3327 L N -1.483 119.755 121.223 0.026 0.000 3.039 3327 L HA 0.205 4.567 4.340 0.037 0.000 0.269 3327 L C 0.209 177.092 176.870 0.021 0.000 1.169 3327 L CA -0.266 54.588 54.840 0.023 0.000 0.986 3327 L CB 0.769 42.839 42.059 0.019 0.000 1.377 3327 L HN 0.031 nan 8.230 nan 0.000 0.575 3328 L N 0.580 121.816 121.223 0.020 0.000 2.369 3328 L HA 0.078 4.440 4.340 0.037 0.000 0.279 3328 L C 1.735 178.618 176.870 0.021 0.000 1.108 3328 L CA 0.049 54.900 54.840 0.018 0.000 0.852 3328 L CB 1.524 43.593 42.059 0.017 0.000 1.169 3328 L HN 0.106 nan 8.230 nan 0.000 0.452 3329 S N 3.830 119.543 115.700 0.021 0.000 2.392 3329 S HA -0.173 4.318 4.470 0.037 0.000 0.232 3329 S C 0.514 175.129 174.600 0.025 0.000 1.041 3329 S CA 1.878 60.093 58.200 0.026 0.000 1.026 3329 S CB -0.226 62.988 63.200 0.024 0.000 0.845 3329 S HN 0.908 nan 8.310 nan 0.000 0.465 3330 N N -0.753 117.959 118.700 0.020 0.000 3.343 3330 N HA 0.394 5.156 4.740 0.037 0.000 0.225 3330 N C -3.560 171.958 175.510 0.014 0.000 1.096 3330 N CA -1.318 51.743 53.050 0.019 0.000 1.040 3330 N CB 0.329 38.830 38.487 0.022 0.000 1.611 3330 N HN 0.057 nan 8.380 nan 0.000 0.689 3331 P HA 0.590 nan 4.420 nan 0.000 0.279 3331 P C -0.703 176.604 177.300 0.011 0.000 1.276 3331 P CA -0.235 62.872 63.100 0.012 0.000 0.801 3331 P CB 0.779 32.487 31.700 0.015 0.000 1.127 3332 N N -2.026 116.680 118.700 0.009 0.000 3.533 3332 N HA 0.245 5.007 4.740 0.037 0.000 0.229 3332 N C -1.017 174.497 175.510 0.006 0.000 1.418 3332 N CA -0.537 52.518 53.050 0.008 0.000 0.880 3332 N CB 0.700 39.192 38.487 0.008 0.000 1.415 3332 N HN 0.314 nan 8.380 nan 0.000 0.491 4002 I N 0.978 121.549 120.570 0.001 0.000 2.947 4002 I HA 0.060 4.252 4.170 0.037 0.000 0.263 4002 I C 1.766 177.883 176.117 0.001 0.000 1.130 4002 I CA 1.169 62.469 61.300 0.001 0.000 1.448 4002 I CB -0.063 37.938 38.000 0.001 0.000 1.222 4002 I HN 0.371 nan 8.210 nan 0.000 0.453 4003 D N 1.073 121.473 120.400 -0.000 0.000 2.355 4003 D HA -0.118 4.544 4.640 0.037 0.000 0.218 4003 D C 1.422 177.722 176.300 -0.000 0.000 1.004 4003 D CA 0.618 54.617 54.000 -0.001 0.000 0.880 4003 D CB -0.264 40.535 40.800 -0.002 0.000 0.911 4003 D HN 0.421 nan 8.370 nan 0.000 0.528 4004 E N 0.158 120.358 120.200 0.000 0.000 2.216 4004 E HA -0.032 4.340 4.350 0.037 0.000 0.192 4004 E C 1.586 178.187 176.600 0.001 0.000 0.988 4004 E CA 0.271 56.671 56.400 0.000 0.000 0.834 4004 E CB -0.034 29.666 29.700 0.000 0.000 0.772 4004 E HN 0.210 nan 8.360 nan 0.000 0.479 4005 N N 1.219 119.921 118.700 0.002 0.000 2.270 4005 N HA -0.087 4.675 4.740 0.037 0.000 0.181 4005 N C 1.461 176.973 175.510 0.003 0.000 1.016 4005 N CA 0.803 53.854 53.050 0.003 0.000 0.870 4005 N CB 0.080 38.570 38.487 0.004 0.000 0.979 4005 N HN 0.158 nan 8.380 nan 0.000 0.431 4006 K N 0.925 121.326 120.400 0.003 0.000 2.057 4006 K HA -0.062 4.279 4.320 0.037 0.000 0.207 4006 K C 1.887 178.489 176.600 0.003 0.000 1.049 4006 K CA 0.943 57.231 56.287 0.003 0.000 0.931 4006 K CB -0.007 32.493 32.500 0.001 0.000 0.714 4006 K HN 0.261 nan 8.250 nan 0.000 0.440 4007 Q N 0.537 120.338 119.800 0.002 0.000 2.297 4007 Q HA -0.107 4.255 4.340 0.037 0.000 0.204 4007 Q C 1.967 177.969 176.000 0.003 0.000 0.962 4007 Q CA 0.796 56.600 55.803 0.002 0.000 0.879 4007 Q CB 0.116 28.854 28.738 0.001 0.000 0.947 4007 Q HN 0.258 nan 8.270 nan 0.000 0.462 4008 K N 0.893 121.295 120.400 0.003 0.000 1.985 4008 K HA -0.129 4.213 4.320 0.037 0.000 0.210 4008 K C 1.963 178.566 176.600 0.006 0.000 1.047 4008 K CA 1.307 57.597 56.287 0.004 0.000 0.932 4008 K CB -0.086 32.416 32.500 0.004 0.000 0.716 4008 K HN 0.115 nan 8.250 nan 0.000 0.439 4009 A N 1.087 123.911 122.820 0.006 0.000 2.067 4009 A HA -0.090 4.252 4.320 0.037 0.000 0.219 4009 A C 1.963 179.552 177.584 0.008 0.000 1.158 4009 A CA 0.925 52.967 52.037 0.007 0.000 0.661 4009 A CB -0.408 18.597 19.000 0.008 0.000 0.801 4009 A HN 0.409 nan 8.150 nan 0.000 0.452 4010 L N -0.144 121.083 121.223 0.007 0.000 1.973 4010 L HA -0.015 4.347 4.340 0.037 0.000 0.208 4010 L C 2.665 179.541 176.870 0.009 0.000 1.073 4010 L CA 2.336 57.180 54.840 0.007 0.000 0.746 4010 L CB -0.817 41.244 42.059 0.005 0.000 0.891 4010 L HN 0.279 nan 8.230 nan 0.000 0.433 4011 A N -0.256 122.569 122.820 0.008 0.000 1.948 4011 A HA -0.203 4.139 4.320 0.037 0.000 0.220 4011 A C 2.437 180.027 177.584 0.011 0.000 1.177 4011 A CA 2.119 54.162 52.037 0.009 0.000 0.636 4011 A CB -1.351 17.653 19.000 0.007 0.000 0.815 4011 A HN 0.680 nan 8.150 nan 0.000 0.449 4012 A N -0.336 122.490 122.820 0.010 0.000 1.933 4012 A HA 0.153 4.495 4.320 0.037 0.000 0.218 4012 A C 2.486 180.079 177.584 0.016 0.000 1.175 4012 A CA 2.103 54.147 52.037 0.011 0.000 0.628 4012 A CB -0.914 18.091 19.000 0.010 0.000 0.814 4012 A HN 1.068 nan 8.150 nan 0.000 0.444 4013 A N -0.728 122.102 122.820 0.018 0.000 1.897 4013 A HA 0.076 4.418 4.320 0.037 0.000 0.215 4013 A C 2.029 179.633 177.584 0.033 0.000 1.181 4013 A CA 1.500 53.552 52.037 0.025 0.000 0.620 4013 A CB -0.514 18.499 19.000 0.022 0.000 0.821 4013 A HN 0.391 nan 8.150 nan 0.000 0.443 4014 L N -0.052 121.188 121.223 0.028 0.000 2.083 4014 L HA -0.054 4.307 4.340 0.037 0.000 0.209 4014 L C 2.744 179.634 176.870 0.034 0.000 1.083 4014 L CA 1.733 56.592 54.840 0.032 0.000 0.752 4014 L CB -0.883 41.190 42.059 0.023 0.000 0.899 4014 L HN 0.412 nan 8.230 nan 0.000 0.433 4015 G N -1.216 107.599 108.800 0.024 0.000 2.421 4015 G HA2 -0.362 3.620 3.960 0.037 0.000 0.216 4015 G HA3 -0.362 3.620 3.960 0.037 0.000 0.216 4015 G C 1.471 176.382 174.900 0.018 0.000 1.171 4015 G CA 0.914 46.025 45.100 0.018 0.000 0.775 4015 G HN 0.410 nan 8.290 nan 0.000 0.543 4016 Q N 0.650 120.462 119.800 0.020 0.000 2.029 4016 Q HA -0.177 4.185 4.340 0.037 0.000 0.209 4016 Q C 2.361 178.380 176.000 0.032 0.000 0.999 4016 Q CA 2.078 57.891 55.803 0.018 0.000 0.857 4016 Q CB -0.544 28.210 28.738 0.026 0.000 0.926 4016 Q HN 0.541 nan 8.270 nan 0.000 0.415 4017 I N 0.256 120.873 120.570 0.078 0.000 2.163 4017 I HA -0.264 3.927 4.170 0.037 0.000 0.243 4017 I C 2.402 178.608 176.117 0.149 0.000 1.085 4017 I CA 1.839 63.238 61.300 0.164 0.000 1.347 4017 I CB -0.395 37.699 38.000 0.157 0.000 1.044 4017 I HN 0.365 nan 8.210 nan 0.000 0.408 4018 E N 0.422 120.674 120.200 0.087 0.000 2.152 4018 E HA -0.168 4.204 4.350 0.037 0.000 0.192 4018 E C 1.741 178.360 176.600 0.032 0.000 0.983 4018 E CA 0.589 57.032 56.400 0.072 0.000 0.818 4018 E CB 0.010 29.741 29.700 0.051 0.000 0.758 4018 E HN 0.313 nan 8.360 nan 0.000 0.467 4019 K N 0.577 120.977 120.400 0.001 0.000 2.522 4019 K HA 0.003 4.345 4.320 0.037 0.000 0.194 4019 K C 1.330 177.875 176.600 -0.090 0.000 1.026 4019 K CA 0.230 56.498 56.287 -0.031 0.000 1.119 4019 K CB 0.315 32.799 32.500 -0.027 0.000 0.856 4019 K HN 0.119 nan 8.250 nan 0.000 0.513 4020 Q N -1.547 118.170 119.800 -0.139 0.000 2.459 4020 Q HA 0.113 4.475 4.340 0.037 0.000 0.260 4020 Q C 0.056 175.711 176.000 -0.575 0.000 0.828 4020 Q CA 0.289 55.854 55.803 -0.398 0.000 0.987 4020 Q CB 0.739 29.152 28.738 -0.541 0.000 1.216 4020 Q HN 0.162 nan 8.270 nan 0.000 0.558 4021 F N 0.029 119.984 119.950 0.008 0.000 2.775 4021 F HA 0.440 4.989 4.527 0.037 0.000 0.313 4021 F C 0.492 176.300 175.800 0.013 0.000 1.121 4021 F CA 0.243 58.250 58.000 0.010 0.000 1.206 4021 F CB 1.757 40.763 39.000 0.011 0.000 1.052 4021 F HN 0.036 nan 8.300 nan 0.000 0.524 4022 G N 0.299 109.172 108.800 0.122 0.000 2.539 4022 G HA2 -0.124 3.858 3.960 0.037 0.000 0.686 4022 G HA3 -0.124 3.858 3.960 0.037 0.000 0.686 4022 G C 0.541 175.481 174.900 0.068 0.000 1.258 4022 G CA -0.907 44.245 45.100 0.085 0.000 0.846 4022 G HN -0.108 nan 8.290 nan 0.000 0.647 4023 K N 0.107 120.535 120.400 0.047 0.000 2.052 4023 K HA -0.160 4.182 4.320 0.037 0.000 0.215 4023 K C 1.803 178.428 176.600 0.040 0.000 1.053 4023 K CA 2.165 58.474 56.287 0.036 0.000 0.934 4023 K CB -0.353 32.164 32.500 0.029 0.000 0.717 4023 K HN 1.464 nan 8.250 nan 0.000 0.450 4024 G N 0.694 109.522 108.800 0.046 0.000 4.885 4024 G HA2 0.169 4.151 3.960 0.037 0.000 0.263 4024 G HA3 0.169 4.151 3.960 0.037 0.000 0.263 4024 G C 0.756 175.684 174.900 0.048 0.000 1.168 4024 G CA 0.145 45.270 45.100 0.042 0.000 0.906 4024 G HN 0.216 nan 8.290 nan 0.000 0.575 4025 S N -0.087 115.651 115.700 0.065 0.000 2.383 4025 S HA 0.120 4.612 4.470 0.037 0.000 0.227 4025 S C 0.940 175.561 174.600 0.036 0.000 1.026 4025 S CA 0.434 58.672 58.200 0.064 0.000 0.981 4025 S CB 0.276 63.544 63.200 0.113 0.000 0.818 4025 S HN 0.471 nan 8.310 nan 0.000 0.472 4026 I N 1.716 122.310 120.570 0.039 0.000 2.498 4026 I HA 0.616 4.808 4.170 0.037 0.000 0.290 4026 I C -0.996 175.135 176.117 0.023 0.000 1.032 4026 I CA -1.344 59.970 61.300 0.024 0.000 1.073 4026 I CB 1.747 39.761 38.000 0.023 0.000 1.251 4026 I HN 0.460 nan 8.210 nan 0.000 0.426 4027 M N 4.609 124.219 119.600 0.017 0.000 2.880 4027 M HA 0.571 5.073 4.480 0.037 0.000 0.269 4027 M C -1.163 175.143 176.300 0.009 0.000 1.248 4027 M CA -1.091 54.217 55.300 0.014 0.000 0.821 4027 M CB 1.398 34.006 32.600 0.014 0.000 1.650 4027 M HN 0.276 nan 8.290 nan 0.000 0.479 4028 R N 1.179 121.682 120.500 0.005 0.000 2.449 4028 R HA 0.249 4.611 4.340 0.037 0.000 0.296 4028 R C 0.983 177.280 176.300 -0.006 0.000 1.047 4028 R CA -0.108 55.992 56.100 -0.001 0.000 1.018 4028 R CB 0.270 30.568 30.300 -0.003 0.000 0.962 4028 R HN 0.684 nan 8.270 nan 0.000 0.428 4029 L N 2.453 123.668 121.223 -0.013 0.000 2.081 4029 L HA -0.194 4.168 4.340 0.037 0.000 0.212 4029 L C 1.767 178.623 176.870 -0.024 0.000 1.080 4029 L CA 2.107 56.932 54.840 -0.025 0.000 0.754 4029 L CB -0.403 41.627 42.059 -0.049 0.000 0.893 4029 L HN 0.982 nan 8.230 nan 0.000 0.433 4030 G N -0.423 108.363 108.800 -0.022 0.000 2.471 4030 G HA2 -0.238 3.744 3.960 0.037 0.000 0.219 4030 G HA3 -0.238 3.744 3.960 0.037 0.000 0.219 4030 G C 1.235 176.128 174.900 -0.012 0.000 1.125 4030 G CA 0.781 45.870 45.100 -0.020 0.000 0.775 4030 G HN 0.713 nan 8.290 nan 0.000 0.548 4031 E N -0.477 119.718 120.200 -0.008 0.000 2.473 4031 E HA 0.068 4.440 4.350 0.037 0.000 0.204 4031 E C -0.137 176.464 176.600 0.000 0.000 0.994 4031 E CA -0.431 55.967 56.400 -0.003 0.000 0.945 4031 E CB 0.110 29.809 29.700 -0.001 0.000 0.990 4031 E HN 0.126 nan 8.360 nan 0.000 0.493 4032 D N 1.909 122.309 120.400 -0.000 0.000 2.349 4032 D HA 0.004 4.666 4.640 0.037 0.000 0.266 4032 D C 0.713 177.016 176.300 0.005 0.000 1.293 4032 D CA -0.004 53.999 54.000 0.004 0.000 0.926 4032 D CB 0.738 41.540 40.800 0.003 0.000 1.090 4032 D HN -0.009 nan 8.370 nan 0.000 0.502 4033 R N 1.798 122.303 120.500 0.008 0.000 2.090 4033 R HA -0.084 4.278 4.340 0.037 0.000 0.228 4033 R C 1.999 178.307 176.300 0.013 0.000 1.110 4033 R CA 0.755 56.860 56.100 0.009 0.000 0.973 4033 R CB -0.919 29.386 30.300 0.010 0.000 0.869 4033 R HN 0.490 nan 8.270 nan 0.000 0.440 4034 S N -0.219 115.492 115.700 0.019 0.000 2.595 4034 S HA -0.087 4.405 4.470 0.037 0.000 0.235 4034 S C 1.701 176.319 174.600 0.030 0.000 0.974 4034 S CA 0.742 58.959 58.200 0.028 0.000 0.942 4034 S CB -0.052 63.170 63.200 0.037 0.000 0.766 4034 S HN 0.091 nan 8.310 nan 0.000 0.536 4035 M N 1.730 121.342 119.600 0.019 0.000 2.492 4035 M HA 0.287 4.789 4.480 0.037 0.000 0.255 4035 M C -0.439 175.867 176.300 0.010 0.000 1.139 4035 M CA 0.150 55.458 55.300 0.014 0.000 1.096 4035 M CB 0.127 32.727 32.600 -0.001 0.000 1.360 4035 M HN 0.083 nan 8.290 nan 0.000 0.480 4036 D N 0.361 120.767 120.400 0.010 0.000 2.368 4036 D HA 0.122 4.784 4.640 0.037 0.000 0.240 4036 D C -0.463 175.844 176.300 0.012 0.000 1.169 4036 D CA 0.146 54.151 54.000 0.008 0.000 0.906 4036 D CB 1.124 41.928 40.800 0.007 0.000 1.187 4036 D HN -0.112 nan 8.370 nan 0.000 0.435 4037 V N 1.565 121.485 119.914 0.010 0.000 2.394 4037 V HA 0.185 4.327 4.120 0.037 0.000 0.282 4037 V C 0.439 176.538 176.094 0.008 0.000 1.031 4037 V CA -0.413 61.893 62.300 0.010 0.000 0.881 4037 V CB 1.446 33.273 31.823 0.006 0.000 0.982 4037 V HN 0.419 nan 8.190 nan 0.000 0.451 4038 E N 2.947 123.152 120.200 0.008 0.000 2.227 4038 E HA 0.667 5.039 4.350 0.037 0.000 0.268 4038 E C -0.748 175.853 176.600 0.002 0.000 0.907 4038 E CA -0.416 55.986 56.400 0.005 0.000 0.786 4038 E CB 2.323 32.026 29.700 0.005 0.000 1.191 4038 E HN 0.834 nan 8.360 nan 0.000 0.411 4039 T N 0.545 115.098 114.554 -0.001 0.000 2.916 4039 T HA 0.632 5.004 4.350 0.037 0.000 0.292 4039 T C -0.391 174.306 174.700 -0.006 0.000 1.064 4039 T CA -0.862 61.236 62.100 -0.004 0.000 1.011 4039 T CB 1.076 69.941 68.868 -0.004 0.000 1.152 4039 T HN 0.261 nan 8.240 nan 0.000 0.510 4040 I N 1.654 122.218 120.570 -0.009 0.000 2.545 4040 I HA 0.426 4.618 4.170 0.037 0.000 0.292 4040 I C 0.728 176.837 176.117 -0.014 0.000 1.040 4040 I CA -0.777 60.514 61.300 -0.014 0.000 1.068 4040 I CB 1.723 39.712 38.000 -0.018 0.000 1.251 4040 I HN 0.950 nan 8.210 nan 0.000 0.424 4041 S N 2.763 118.452 115.700 -0.017 0.000 2.558 4041 S HA 0.043 4.535 4.470 0.037 0.000 0.288 4041 S C 1.358 175.945 174.600 -0.021 0.000 1.318 4041 S CA 0.403 58.597 58.200 -0.010 0.000 1.056 4041 S CB 0.379 63.569 63.200 -0.017 0.000 0.853 4041 S HN 0.812 nan 8.310 nan 0.000 0.505 4042 T N 1.525 116.071 114.554 -0.014 0.000 3.100 4042 T HA 0.343 4.715 4.350 0.037 0.000 0.253 4042 T C 1.503 176.171 174.700 -0.053 0.000 1.118 4042 T CA 0.638 62.721 62.100 -0.029 0.000 1.058 4042 T CB -0.347 68.504 68.868 -0.027 0.000 0.953 4042 T HN 1.637 nan 8.240 nan 0.000 0.515 4043 G N 0.749 109.529 108.800 -0.033 0.000 2.199 4043 G HA2 -0.238 3.744 3.960 0.037 0.000 0.254 4043 G HA3 -0.238 3.744 3.960 0.037 0.000 0.254 4043 G C 0.192 175.112 174.900 0.034 0.000 0.982 4043 G CA 0.210 45.284 45.100 -0.044 0.000 0.632 4043 G HN 1.087 nan 8.290 nan 0.000 0.529 4044 S N -0.223 115.426 115.700 -0.086 0.000 2.498 4044 S HA 0.637 5.129 4.470 0.037 0.000 0.317 4044 S C 1.150 175.652 174.600 -0.163 0.000 1.090 4044 S CA 0.019 58.061 58.200 -0.264 0.000 1.089 4044 S CB 1.494 64.338 63.200 -0.592 0.000 0.997 4044 S HN 0.919 nan 8.310 nan 0.000 0.470 4045 L N 5.781 126.789 121.223 -0.359 0.000 2.027 4045 L HA 0.031 4.393 4.340 0.037 0.000 0.206 4045 L C 2.581 179.350 176.870 -0.169 0.000 1.074 4045 L CA 2.700 57.336 54.840 -0.339 0.000 0.745 4045 L CB -0.999 40.640 42.059 -0.700 0.000 0.898 4045 L HN 0.895 nan 8.230 nan 0.000 0.433 4046 S N -1.105 114.512 115.700 -0.140 0.000 2.402 4046 S HA -0.207 4.285 4.470 0.037 0.000 0.229 4046 S C 2.108 176.717 174.600 0.015 0.000 1.021 4046 S CA 1.383 59.564 58.200 -0.032 0.000 0.974 4046 S CB -1.039 62.178 63.200 0.028 0.000 0.800 4046 S HN 0.497 nan 8.310 nan 0.000 0.484 4047 L N 1.380 122.619 121.223 0.026 0.000 2.093 4047 L HA -0.099 4.263 4.340 0.037 0.000 0.208 4047 L C 1.890 178.764 176.870 0.006 0.000 1.085 4047 L CA 1.701 56.568 54.840 0.046 0.000 0.755 4047 L CB -0.433 41.662 42.059 0.060 0.000 0.904 4047 L HN 0.201 nan 8.230 nan 0.000 0.435 4048 D N -0.046 120.345 120.400 -0.014 0.000 2.178 4048 D HA -0.164 4.498 4.640 0.037 0.000 0.201 4048 D C 2.177 178.472 176.300 -0.008 0.000 0.980 4048 D CA 1.316 55.311 54.000 -0.009 0.000 0.842 4048 D CB 0.005 40.806 40.800 0.001 0.000 0.948 4048 D HN 0.392 nan 8.370 nan 0.000 0.472 4049 I N 0.987 121.550 120.570 -0.011 0.000 2.233 4049 I HA -0.185 4.007 4.170 0.037 0.000 0.243 4049 I C 2.462 178.579 176.117 -0.000 0.000 1.093 4049 I CA 0.896 62.194 61.300 -0.005 0.000 1.380 4049 I CB -0.203 37.793 38.000 -0.007 0.000 1.067 4049 I HN -0.103 nan 8.210 nan 0.000 0.413 4050 A N 0.725 123.547 122.820 0.003 0.000 1.978 4050 A HA -0.148 4.194 4.320 0.037 0.000 0.220 4050 A C 2.263 179.836 177.584 -0.018 0.000 1.170 4050 A CA 1.383 53.421 52.037 0.002 0.000 0.636 4050 A CB -0.866 18.143 19.000 0.014 0.000 0.810 4050 A HN 0.424 nan 8.150 nan 0.000 0.448 4051 L N -1.650 119.561 121.223 -0.021 0.000 2.376 4051 L HA 0.027 4.389 4.340 0.037 0.000 0.219 4051 L C 2.220 179.065 176.870 -0.042 0.000 1.133 4051 L CA 0.662 55.478 54.840 -0.039 0.000 0.816 4051 L CB -0.421 41.620 42.059 -0.030 0.000 0.933 4051 L HN 0.627 nan 8.230 nan 0.000 0.449 4052 G N -0.085 108.701 108.800 -0.024 0.000 2.779 4052 G HA2 -0.461 3.521 3.960 0.037 0.000 0.230 4052 G HA3 -0.461 3.521 3.960 0.037 0.000 0.230 4052 G C 1.177 176.071 174.900 -0.010 0.000 1.243 4052 G CA 0.644 45.734 45.100 -0.016 0.000 0.769 4052 G HN 0.452 nan 8.290 nan 0.000 0.516 4053 A N 0.179 122.989 122.820 -0.018 0.000 2.119 4053 A HA 0.507 4.849 4.320 0.037 0.000 0.216 4053 A C 2.787 180.369 177.584 -0.004 0.000 1.152 4053 A CA 2.255 54.286 52.037 -0.011 0.000 0.708 4053 A CB -0.555 18.434 19.000 -0.018 0.000 0.805 4053 A HN 2.680 nan 8.150 nan 0.000 0.460 4054 G N -3.288 105.509 108.800 -0.004 0.000 2.179 4054 G HA2 0.313 4.295 3.960 0.037 0.000 0.220 4054 G HA3 0.313 4.295 3.960 0.037 0.000 0.220 4054 G C 0.838 175.739 174.900 0.001 0.000 0.990 4054 G CA 0.319 45.420 45.100 0.002 0.000 0.646 4054 G HN 2.113 nan 8.290 nan 0.000 0.517 4055 G N -1.391 107.405 108.800 -0.006 0.000 2.315 4055 G HA2 0.533 4.515 3.960 0.037 0.000 0.294 4055 G HA3 0.533 4.515 3.960 0.037 0.000 0.294 4055 G C -0.876 174.017 174.900 -0.012 0.000 1.300 4055 G CA -0.500 44.596 45.100 -0.007 0.000 0.843 4055 G HN 0.844 nan 8.290 nan 0.000 0.527 4056 L N 1.963 123.180 121.223 -0.011 0.000 2.371 4056 L HA 0.414 4.776 4.340 0.037 0.000 0.272 4056 L C -1.751 175.115 176.870 -0.007 0.000 1.124 4056 L CA -1.649 53.185 54.840 -0.010 0.000 0.816 4056 L CB 1.449 43.504 42.059 -0.007 0.000 1.129 4056 L HN 0.302 nan 8.230 nan 0.000 0.448 4057 P HA 0.132 nan 4.420 nan 0.000 0.282 4057 P C -0.715 176.590 177.300 0.008 0.000 1.262 4057 P CA -0.472 62.629 63.100 0.002 0.000 0.773 4057 P CB 0.926 32.628 31.700 0.002 0.000 0.879 4058 M N 2.142 121.746 119.600 0.008 0.000 2.245 4058 M HA 0.191 4.693 4.480 0.037 0.000 0.344 4058 M C 1.599 177.911 176.300 0.020 0.000 1.170 4058 M CA 0.885 56.190 55.300 0.009 0.000 1.135 4058 M CB -0.625 31.979 32.600 0.006 0.000 1.574 4058 M HN 0.832 nan 8.290 nan 0.000 0.452 4059 G N 2.593 111.405 108.800 0.019 0.000 2.153 4059 G HA2 -0.213 3.769 3.960 0.037 0.000 0.252 4059 G HA3 -0.213 3.769 3.960 0.037 0.000 0.252 4059 G C 0.234 175.162 174.900 0.047 0.000 0.994 4059 G CA 0.047 45.165 45.100 0.030 0.000 0.698 4059 G HN 0.563 nan 8.290 nan 0.000 0.521 4060 R N -0.996 119.532 120.500 0.046 0.000 2.939 4060 R HA 0.778 5.140 4.340 0.037 0.000 0.254 4060 R C 0.043 176.389 176.300 0.075 0.000 1.123 4060 R CA -1.093 55.048 56.100 0.068 0.000 1.020 4060 R CB 0.845 31.180 30.300 0.057 0.000 1.206 4060 R HN 0.196 nan 8.270 nan 0.000 0.491 4061 I N 0.794 121.432 120.570 0.114 0.000 2.412 4061 I HA 0.369 4.561 4.170 0.037 0.000 0.296 4061 I C -0.406 175.794 176.117 0.139 0.000 0.987 4061 I CA -0.856 60.537 61.300 0.155 0.000 1.180 4061 I CB 1.933 40.071 38.000 0.229 0.000 1.340 4061 I HN -0.015 nan 8.210 nan 0.000 0.455 4062 V N 5.271 125.271 119.914 0.144 0.000 2.735 4062 V HA 0.399 4.540 4.120 0.037 0.000 0.310 4062 V C -0.471 175.728 176.094 0.175 0.000 1.061 4062 V CA -0.687 61.682 62.300 0.116 0.000 0.913 4062 V CB 2.042 33.898 31.823 0.056 0.000 1.005 4062 V HN 0.737 nan 8.190 nan 0.000 0.428 4063 E N 3.776 124.068 120.200 0.152 0.000 2.187 4063 E HA 0.668 5.040 4.350 0.037 0.000 0.268 4063 E C -1.579 175.103 176.600 0.137 0.000 0.896 4063 E CA -0.629 55.883 56.400 0.187 0.000 0.766 4063 E CB 1.723 31.537 29.700 0.190 0.000 1.142 4063 E HN 0.651 nan 8.360 nan 0.000 0.408 4064 I N 5.396 126.046 120.570 0.133 0.000 2.406 4064 I HA 0.349 4.541 4.170 0.037 0.000 0.290 4064 I C -0.905 175.289 176.117 0.129 0.000 0.999 4064 I CA -0.979 60.355 61.300 0.057 0.000 1.124 4064 I CB 0.843 38.866 38.000 0.038 0.000 1.289 4064 I HN 0.511 nan 8.210 nan 0.000 0.441 4065 Y N 3.987 124.314 120.300 0.045 0.000 2.605 4065 Y HA 1.006 5.578 4.550 0.037 0.000 0.343 4065 Y C -0.161 175.761 175.900 0.037 0.000 1.036 4065 Y CA -1.154 56.970 58.100 0.040 0.000 1.065 4065 Y CB 1.946 40.423 38.460 0.029 0.000 1.288 4065 Y HN 0.677 nan 8.280 nan 0.000 0.481 4066 G N 0.536 109.474 108.800 0.231 0.000 2.328 4066 G HA2 0.445 4.427 3.960 0.037 0.000 0.295 4066 G HA3 0.445 4.427 3.960 0.037 0.000 0.295 4066 G C -3.506 171.470 174.900 0.126 0.000 1.413 4066 G CA -1.344 43.837 45.100 0.135 0.000 0.817 4066 G HN 0.501 nan 8.290 nan 0.000 0.546 4067 P HA 0.258 nan 4.420 nan 0.000 0.272 4067 P C -0.210 177.125 177.300 0.058 0.000 1.248 4067 P CA -0.142 62.999 63.100 0.067 0.000 0.799 4067 P CB 0.263 31.993 31.700 0.050 0.000 0.997 4068 E N -0.830 119.398 120.200 0.047 0.000 2.383 4068 E HA 0.267 4.639 4.350 0.037 0.000 0.264 4068 E C 0.072 176.694 176.600 0.037 0.000 1.050 4068 E CA -0.466 55.958 56.400 0.041 0.000 0.896 4068 E CB -0.399 29.319 29.700 0.030 0.000 0.982 4068 E HN 0.249 nan 8.360 nan 0.000 0.424 4069 S N 0.286 116.007 115.700 0.036 0.000 3.581 4069 S HA -0.223 4.269 4.470 0.037 0.000 0.354 4069 S C 0.953 175.588 174.600 0.059 0.000 1.059 4069 S CA 0.916 59.137 58.200 0.035 0.000 1.060 4069 S CB -1.625 61.580 63.200 0.009 0.000 0.908 4069 S HN 0.730 nan 8.310 nan 0.000 0.475 4070 S N -0.492 115.246 115.700 0.062 0.000 2.470 4070 S HA 0.457 4.949 4.470 0.037 0.000 0.222 4070 S C 1.547 176.194 174.600 0.078 0.000 1.024 4070 S CA 0.908 59.143 58.200 0.057 0.000 0.931 4070 S CB 0.679 63.902 63.200 0.039 0.000 0.791 4070 S HN 1.820 nan 8.310 nan 0.000 0.513 4071 G N 0.928 109.789 108.800 0.102 0.000 2.507 4071 G HA2 -0.114 3.868 3.960 0.037 0.000 0.205 4071 G HA3 -0.114 3.868 3.960 0.037 0.000 0.205 4071 G C 0.668 175.652 174.900 0.138 0.000 0.996 4071 G CA 0.080 45.266 45.100 0.142 0.000 0.776 4071 G HN 0.393 nan 8.290 nan 0.000 0.532 4072 K N 0.472 120.939 120.400 0.112 0.000 1.987 4072 K HA -0.108 4.234 4.320 0.037 0.000 0.216 4072 K C 2.587 179.267 176.600 0.134 0.000 1.051 4072 K CA 2.212 58.564 56.287 0.108 0.000 0.942 4072 K CB -0.583 31.976 32.500 0.098 0.000 0.722 4072 K HN 0.313 nan 8.250 nan 0.000 0.444 4073 T N 0.969 115.615 114.554 0.153 0.000 2.607 4073 T HA -0.191 4.181 4.350 0.037 0.000 0.267 4073 T C 2.106 176.922 174.700 0.193 0.000 1.049 4073 T CA 2.111 64.332 62.100 0.202 0.000 1.162 4073 T CB -0.835 68.153 68.868 0.199 0.000 0.863 4073 T HN 0.273 nan 8.240 nan 0.000 0.424 4074 T N 2.397 117.068 114.554 0.195 0.000 2.597 4074 T HA -0.121 4.251 4.350 0.037 0.000 0.267 4074 T C 1.934 176.712 174.700 0.130 0.000 1.053 4074 T CA 1.500 63.720 62.100 0.201 0.000 1.165 4074 T CB -0.727 68.294 68.868 0.255 0.000 0.863 4074 T HN 0.239 nan 8.240 nan 0.000 0.427 4075 L N 0.318 121.621 121.223 0.133 0.000 1.990 4075 L HA -0.207 4.155 4.340 0.037 0.000 0.213 4075 L C 2.686 179.596 176.870 0.066 0.000 1.072 4075 L CA 1.771 56.666 54.840 0.092 0.000 0.755 4075 L CB -0.822 41.310 42.059 0.122 0.000 0.889 4075 L HN 0.280 nan 8.230 nan 0.000 0.432 4076 T N 0.314 114.926 114.554 0.098 0.000 2.624 4076 T HA -0.268 4.104 4.350 0.037 0.000 0.268 4076 T C 1.829 176.590 174.700 0.100 0.000 1.041 4076 T CA 2.096 64.259 62.100 0.106 0.000 1.159 4076 T CB -0.380 68.585 68.868 0.161 0.000 0.863 4076 T HN 0.309 nan 8.240 nan 0.000 0.434 4077 L N 0.865 122.149 121.223 0.102 0.000 2.079 4077 L HA -0.145 4.217 4.340 0.037 0.000 0.210 4077 L C 2.993 179.851 176.870 -0.019 0.000 1.081 4077 L CA 1.116 55.975 54.840 0.032 0.000 0.752 4077 L CB -0.618 41.431 42.059 -0.018 0.000 0.896 4077 L HN 0.273 nan 8.230 nan 0.000 0.433 4078 Q N -0.265 119.521 119.800 -0.024 0.000 2.124 4078 Q HA -0.172 4.190 4.340 0.037 0.000 0.202 4078 Q C 2.439 178.401 176.000 -0.062 0.000 0.977 4078 Q CA 1.942 57.707 55.803 -0.063 0.000 0.850 4078 Q CB -0.550 28.145 28.738 -0.073 0.000 0.901 4078 Q HN 0.618 nan 8.270 nan 0.000 0.429 4079 V N -1.519 118.376 119.914 -0.032 0.000 2.548 4079 V HA -0.148 3.994 4.120 0.037 0.000 0.249 4079 V C 2.085 178.161 176.094 -0.029 0.000 1.055 4079 V CA 0.976 63.257 62.300 -0.032 0.000 1.065 4079 V CB -0.530 31.284 31.823 -0.015 0.000 0.681 4079 V HN 0.171 nan 8.190 nan 0.000 0.462 4080 I N 1.403 121.966 120.570 -0.011 0.000 2.142 4080 I HA -0.167 4.025 4.170 0.037 0.000 0.240 4080 I C 3.041 179.134 176.117 -0.039 0.000 1.078 4080 I CA 1.838 63.132 61.300 -0.009 0.000 1.343 4080 I CB -0.844 37.168 38.000 0.021 0.000 1.046 4080 I HN 0.408 nan 8.210 nan 0.000 0.405 4081 A N 0.901 123.686 122.820 -0.058 0.000 1.873 4081 A HA -0.284 4.058 4.320 0.037 0.000 0.218 4081 A C 2.563 180.094 177.584 -0.089 0.000 1.193 4081 A CA 2.405 54.393 52.037 -0.081 0.000 0.629 4081 A CB -1.144 17.794 19.000 -0.103 0.000 0.826 4081 A HN 0.461 nan 8.150 nan 0.000 0.447 4082 A N -0.346 122.415 122.820 -0.098 0.000 1.892 4082 A HA 0.064 4.406 4.320 0.037 0.000 0.218 4082 A C 2.535 180.071 177.584 -0.079 0.000 1.188 4082 A CA 2.609 54.582 52.037 -0.108 0.000 0.631 4082 A CB -1.134 17.802 19.000 -0.108 0.000 0.822 4082 A HN 1.238 nan 8.150 nan 0.000 0.447 4083 A N -1.210 121.576 122.820 -0.058 0.000 1.969 4083 A HA -0.166 4.176 4.320 0.037 0.000 0.218 4083 A C 2.101 179.659 177.584 -0.042 0.000 1.169 4083 A CA 1.561 53.572 52.037 -0.044 0.000 0.635 4083 A CB -0.464 18.517 19.000 -0.032 0.000 0.810 4083 A HN 0.671 nan 8.150 nan 0.000 0.445 4084 Q N -1.307 118.465 119.800 -0.046 0.000 2.172 4084 Q HA -0.090 4.272 4.340 0.037 0.000 0.200 4084 Q C 2.242 178.212 176.000 -0.050 0.000 0.964 4084 Q CA 1.089 56.866 55.803 -0.044 0.000 0.855 4084 Q CB -0.061 28.650 28.738 -0.046 0.000 0.918 4084 Q HN 0.541 nan 8.270 nan 0.000 0.444 4085 R N 1.122 121.584 120.500 -0.063 0.000 2.152 4085 R HA -0.120 4.242 4.340 0.037 0.000 0.232 4085 R C 1.005 177.271 176.300 -0.057 0.000 1.117 4085 R CA 1.210 57.270 56.100 -0.068 0.000 0.981 4085 R CB 0.208 30.453 30.300 -0.092 0.000 0.870 4085 R HN 0.278 nan 8.270 nan 0.000 0.451 4086 E N -1.584 118.585 120.200 -0.052 0.000 2.479 4086 E HA 0.184 4.556 4.350 0.037 0.000 0.193 4086 E C 0.421 177.002 176.600 -0.032 0.000 1.049 4086 E CA 0.390 56.766 56.400 -0.041 0.000 0.870 4086 E CB 0.782 30.459 29.700 -0.038 0.000 0.944 4086 E HN 0.414 nan 8.360 nan 0.000 0.492 4087 G N 2.194 110.974 108.800 -0.033 0.000 2.171 4087 G HA2 -0.289 3.693 3.960 0.037 0.000 0.238 4087 G HA3 -0.289 3.693 3.960 0.037 0.000 0.238 4087 G C -0.130 174.756 174.900 -0.023 0.000 1.039 4087 G CA -0.094 44.990 45.100 -0.027 0.000 0.759 4087 G HN 0.122 nan 8.290 nan 0.000 0.501 4088 K N 0.387 120.772 120.400 -0.025 0.000 2.098 4088 K HA 0.532 4.873 4.320 0.037 0.000 0.261 4088 K C 0.279 176.868 176.600 -0.019 0.000 0.987 4088 K CA -0.310 55.965 56.287 -0.021 0.000 0.916 4088 K CB 0.943 33.431 32.500 -0.021 0.000 1.039 4088 K HN 0.115 nan 8.250 nan 0.000 0.455 4089 T N 1.815 116.360 114.554 -0.016 0.000 2.780 4089 T HA 0.238 4.610 4.350 0.037 0.000 0.294 4089 T C -0.181 174.512 174.700 -0.012 0.000 0.949 4089 T CA -0.526 61.565 62.100 -0.014 0.000 1.074 4089 T CB 0.098 68.959 68.868 -0.012 0.000 0.910 4089 T HN 0.518 nan 8.240 nan 0.000 0.501 4090 C N 2.442 121.739 119.300 -0.006 0.000 2.562 4090 C HA 0.978 5.460 4.460 0.037 0.000 0.332 4090 C C 0.442 175.441 174.990 0.016 0.000 1.201 4090 C CA -0.925 58.095 59.018 0.004 0.000 1.803 4090 C CB 0.859 28.607 27.740 0.014 0.000 2.328 4090 C HN 1.047 nan 8.230 nan 0.000 0.500 4091 A N 1.107 123.940 122.820 0.023 0.000 2.475 4091 A HA 0.871 5.213 4.320 0.037 0.000 0.301 4091 A C -1.502 176.132 177.584 0.083 0.000 1.059 4091 A CA -0.255 51.804 52.037 0.038 0.000 0.710 4091 A CB 1.115 20.111 19.000 -0.007 0.000 1.288 4091 A HN 0.816 nan 8.150 nan 0.000 0.408 4092 F N 2.658 122.571 119.950 -0.061 0.000 2.529 4092 F HA 0.645 5.194 4.527 0.037 0.000 0.320 4092 F C -0.863 174.895 175.800 -0.070 0.000 1.118 4092 F CA -0.865 57.096 58.000 -0.064 0.000 0.915 4092 F CB 1.607 40.577 39.000 -0.050 0.000 1.161 4092 F HN 0.373 nan 8.300 nan 0.000 0.445 4093 I N 4.661 124.999 120.570 -0.387 0.000 2.412 4093 I HA 0.141 4.333 4.170 0.037 0.000 0.279 4093 I C -0.344 175.624 176.117 -0.247 0.000 1.063 4093 I CA -0.432 60.734 61.300 -0.224 0.000 1.193 4093 I CB 0.589 38.459 38.000 -0.217 0.000 1.370 4093 I HN 0.516 nan 8.210 nan 0.000 0.479 4094 D N 4.925 125.329 120.400 0.008 0.000 2.688 4094 D HA 0.326 4.988 4.640 0.037 0.000 0.228 4094 D C 1.386 177.624 176.300 -0.103 0.000 1.116 4094 D CA 0.027 54.081 54.000 0.089 0.000 1.023 4094 D CB 0.742 41.674 40.800 0.221 0.000 1.100 4094 D HN 0.591 nan 8.370 nan 0.000 0.487 4095 A N 1.834 124.618 122.820 -0.060 0.000 2.015 4095 A HA -0.148 4.194 4.320 0.037 0.000 0.219 4095 A C 1.951 179.643 177.584 0.180 0.000 1.163 4095 A CA 0.877 52.929 52.037 0.026 0.000 0.646 4095 A CB -0.268 18.759 19.000 0.043 0.000 0.806 4095 A HN 0.508 nan 8.150 nan 0.000 0.448 4096 E N -1.022 119.254 120.200 0.126 0.000 2.418 4096 E HA -0.112 4.260 4.350 0.037 0.000 0.197 4096 E C -0.501 176.243 176.600 0.239 0.000 1.026 4096 E CA 0.071 56.569 56.400 0.163 0.000 0.862 4096 E CB -0.199 29.574 29.700 0.121 0.000 0.799 4096 E HN 0.689 nan 8.360 nan 0.000 0.518 4097 H N -2.034 117.080 119.070 0.073 0.000 2.677 4097 H HA -0.220 4.358 4.556 0.037 0.000 0.321 4097 H C 0.145 175.506 175.328 0.054 0.000 1.171 4097 H CA 0.508 56.594 56.048 0.062 0.000 1.139 4097 H CB -1.195 28.591 29.762 0.041 0.000 1.515 4097 H HN 0.292 nan 8.280 nan 0.000 0.423 4098 A N 0.468 123.367 122.820 0.132 0.000 2.664 4098 A HA 0.172 4.514 4.320 0.037 0.000 0.222 4098 A C 0.595 178.212 177.584 0.055 0.000 1.320 4098 A CA -0.239 51.852 52.037 0.089 0.000 1.029 4098 A CB 0.685 19.735 19.000 0.084 0.000 1.318 4098 A HN 0.177 nan 8.150 nan 0.000 0.589 4099 L N 1.580 122.836 121.223 0.054 0.000 2.462 4099 L HA 0.394 4.756 4.340 0.037 0.000 0.272 4099 L C -0.524 176.325 176.870 -0.035 0.000 1.166 4099 L CA 0.243 55.071 54.840 -0.020 0.000 0.880 4099 L CB 0.337 42.309 42.059 -0.146 0.000 1.142 4099 L HN 0.203 nan 8.230 nan 0.000 0.473 4100 D N 7.392 127.782 120.400 -0.017 0.000 2.359 4100 D HA 0.304 4.966 4.640 0.037 0.000 0.230 4100 D C -1.719 174.584 176.300 0.004 0.000 1.118 4100 D CA -2.258 51.745 54.000 0.005 0.000 0.844 4100 D CB 1.465 42.280 40.800 0.024 0.000 1.059 4100 D HN 0.395 nan 8.370 nan 0.000 0.493 4101 P HA -0.176 nan 4.420 nan 0.000 0.215 4101 P C 1.600 178.887 177.300 -0.021 0.000 1.157 4101 P CA 0.869 63.941 63.100 -0.047 0.000 0.874 4101 P CB 0.435 32.111 31.700 -0.041 0.000 0.790 4102 I N -1.491 119.086 120.570 0.011 0.000 2.163 4102 I HA -0.253 3.939 4.170 0.037 0.000 0.243 4102 I C 2.781 178.926 176.117 0.047 0.000 1.085 4102 I CA 1.493 62.806 61.300 0.022 0.000 1.347 4102 I CB -1.380 36.640 38.000 0.033 0.000 1.044 4102 I HN -0.141 nan 8.210 nan 0.000 0.408 4103 Y N 1.377 121.653 120.300 -0.041 0.000 2.224 4103 Y HA -0.221 4.351 4.550 0.037 0.000 0.289 4103 Y C 2.481 178.353 175.900 -0.046 0.000 1.146 4103 Y CA 1.197 59.277 58.100 -0.032 0.000 1.182 4103 Y CB -0.457 37.988 38.460 -0.026 0.000 0.983 4103 Y HN 0.123 nan 8.280 nan 0.000 0.524 4104 A N 0.656 123.449 122.820 -0.046 0.000 1.908 4104 A HA -0.232 4.110 4.320 0.037 0.000 0.218 4104 A C 2.431 179.912 177.584 -0.171 0.000 1.181 4104 A CA 1.872 53.821 52.037 -0.146 0.000 0.627 4104 A CB -0.791 18.122 19.000 -0.146 0.000 0.818 4104 A HN 0.498 nan 8.150 nan 0.000 0.445 4105 R N -0.044 120.382 120.500 -0.123 0.000 2.075 4105 R HA -0.103 4.259 4.340 0.037 0.000 0.232 4105 R C 1.957 178.179 176.300 -0.131 0.000 1.126 4105 R CA 1.644 57.679 56.100 -0.108 0.000 0.963 4105 R CB -0.266 29.991 30.300 -0.071 0.000 0.858 4105 R HN 0.534 nan 8.270 nan 0.000 0.435 4106 K N 0.340 120.645 120.400 -0.159 0.000 2.211 4106 K HA -0.101 4.240 4.320 0.037 0.000 0.204 4106 K C 1.949 178.406 176.600 -0.238 0.000 1.047 4106 K CA 1.036 57.217 56.287 -0.176 0.000 0.935 4106 K CB -0.042 32.354 32.500 -0.175 0.000 0.728 4106 K HN 0.264 nan 8.250 nan 0.000 0.452 4107 L N -0.515 120.511 121.223 -0.327 0.000 2.478 4107 L HA 0.032 4.394 4.340 0.037 0.000 0.223 4107 L C 1.029 177.790 176.870 -0.182 0.000 1.140 4107 L CA 0.545 55.213 54.840 -0.286 0.000 0.842 4107 L CB -0.050 41.808 42.059 -0.335 0.000 0.953 4107 L HN 0.445 nan 8.230 nan 0.000 0.452 4108 G N 0.220 108.926 108.800 -0.156 0.000 2.145 4108 G HA2 -0.191 3.790 3.960 0.037 0.000 0.176 4108 G HA3 -0.191 3.790 3.960 0.037 0.000 0.176 4108 G C -0.069 174.765 174.900 -0.109 0.000 1.013 4108 G CA -0.238 44.790 45.100 -0.121 0.000 0.689 4108 G HN 0.042 nan 8.290 nan 0.000 0.506 4109 V N 0.631 120.478 119.914 -0.113 0.000 2.607 4109 V HA 0.465 4.607 4.120 0.037 0.000 0.289 4109 V C 0.540 176.586 176.094 -0.082 0.000 1.053 4109 V CA -0.445 61.797 62.300 -0.096 0.000 0.996 4109 V CB 1.818 33.576 31.823 -0.108 0.000 0.995 4109 V HN 0.341 nan 8.190 nan 0.000 0.476 4110 D N 3.681 124.040 120.400 -0.067 0.000 2.383 4110 D HA 0.131 4.793 4.640 0.037 0.000 0.245 4110 D C 1.063 177.330 176.300 -0.055 0.000 1.263 4110 D CA -0.258 53.708 54.000 -0.056 0.000 0.936 4110 D CB 0.519 41.291 40.800 -0.047 0.000 1.053 4110 D HN 0.290 nan 8.370 nan 0.000 0.507 4111 I N 2.616 123.151 120.570 -0.058 0.000 2.226 4111 I HA -0.215 3.977 4.170 0.037 0.000 0.245 4111 I C 1.385 177.475 176.117 -0.044 0.000 1.100 4111 I CA 0.925 62.190 61.300 -0.058 0.000 1.374 4111 I CB -0.722 37.244 38.000 -0.057 0.000 1.057 4111 I HN 0.341 nan 8.210 nan 0.000 0.413 4112 D N 0.613 120.991 120.400 -0.037 0.000 2.263 4112 D HA -0.132 4.530 4.640 0.037 0.000 0.208 4112 D C 1.726 178.011 176.300 -0.025 0.000 0.971 4112 D CA 0.934 54.917 54.000 -0.028 0.000 0.867 4112 D CB -0.254 40.530 40.800 -0.026 0.000 0.929 4112 D HN 0.439 nan 8.370 nan 0.000 0.492 4113 N N -0.213 118.471 118.700 -0.027 0.000 2.197 4113 N HA 0.028 4.790 4.740 0.037 0.000 0.201 4113 N C 0.047 175.546 175.510 -0.019 0.000 1.148 4113 N CA -0.180 52.856 53.050 -0.022 0.000 0.883 4113 N CB 1.367 39.840 38.487 -0.023 0.000 1.012 4113 N HN 0.135 nan 8.380 nan 0.000 0.507 4114 L N 3.228 124.437 121.223 -0.023 0.000 2.385 4114 L HA 0.261 4.623 4.340 0.037 0.000 0.281 4114 L C -0.135 176.734 176.870 -0.002 0.000 1.106 4114 L CA 0.069 54.901 54.840 -0.014 0.000 0.856 4114 L CB 0.100 42.139 42.059 -0.033 0.000 1.186 4114 L HN 0.012 nan 8.230 nan 0.000 0.453 4115 L N 5.375 126.605 121.223 0.011 0.000 2.456 4115 L HA 0.129 4.491 4.340 0.037 0.000 0.272 4115 L C 0.111 177.009 176.870 0.045 0.000 1.189 4115 L CA 0.148 54.999 54.840 0.017 0.000 0.846 4115 L CB 1.018 43.084 42.059 0.011 0.000 1.111 4115 L HN 0.739 nan 8.230 nan 0.000 0.475 4116 C N 2.783 122.106 119.300 0.039 0.000 2.891 4116 C HA 0.666 5.148 4.460 0.037 0.000 0.342 4116 C C -0.494 174.520 174.990 0.040 0.000 1.126 4116 C CA -0.426 58.634 59.018 0.069 0.000 1.322 4116 C CB 1.587 29.353 27.740 0.043 0.000 1.763 4116 C HN 0.822 nan 8.230 nan 0.000 0.491 4117 S N 3.711 119.437 115.700 0.043 0.000 2.575 4117 S HA 0.567 5.059 4.470 0.037 0.000 0.278 4117 S C -1.369 173.211 174.600 -0.035 0.000 1.139 4117 S CA -0.290 57.911 58.200 0.002 0.000 0.954 4117 S CB 1.484 64.680 63.200 -0.007 0.000 1.054 4117 S HN 0.860 nan 8.310 nan 0.000 0.483 4118 Q N 4.675 124.428 119.800 -0.078 0.000 2.466 4118 Q HA 0.364 4.726 4.340 0.037 0.000 0.242 4118 Q C -2.246 173.705 176.000 -0.082 0.000 1.046 4118 Q CA -1.854 53.815 55.803 -0.224 0.000 0.841 4118 Q CB 1.261 29.781 28.738 -0.364 0.000 1.193 4118 Q HN 0.512 nan 8.270 nan 0.000 0.508 4119 P HA 0.125 nan 4.420 nan 0.000 0.276 4119 P C -0.389 176.990 177.300 0.131 0.000 1.252 4119 P CA -0.266 62.860 63.100 0.042 0.000 0.802 4119 P CB 1.433 33.147 31.700 0.024 0.000 1.035 4120 D N -0.960 119.498 120.400 0.096 0.000 2.290 4120 D HA -0.004 4.658 4.640 0.037 0.000 0.224 4120 D C 1.007 177.348 176.300 0.069 0.000 0.967 4120 D CA 1.393 55.450 54.000 0.094 0.000 0.893 4120 D CB -0.314 40.521 40.800 0.058 0.000 1.037 4120 D HN 0.518 nan 8.370 nan 0.000 0.477 4121 T N -2.670 111.912 114.554 0.048 0.000 2.948 4121 T HA 0.533 4.905 4.350 0.037 0.000 0.285 4121 T C 1.395 176.118 174.700 0.038 0.000 1.019 4121 T CA -0.279 61.842 62.100 0.036 0.000 1.013 4121 T CB 1.898 70.778 68.868 0.021 0.000 1.117 4121 T HN -0.026 nan 8.240 nan 0.000 0.533 4122 G N 0.116 108.935 108.800 0.031 0.000 2.394 4122 G HA2 -0.074 3.908 3.960 0.037 0.000 0.215 4122 G HA3 -0.074 3.908 3.960 0.037 0.000 0.215 4122 G C 1.166 176.082 174.900 0.027 0.000 1.165 4122 G CA 0.550 45.670 45.100 0.032 0.000 0.784 4122 G HN 0.797 nan 8.290 nan 0.000 0.535 4123 E N 0.093 120.303 120.200 0.017 0.000 2.085 4123 E HA -0.157 4.215 4.350 0.037 0.000 0.194 4123 E C 2.390 178.999 176.600 0.014 0.000 0.994 4123 E CA 1.335 57.743 56.400 0.012 0.000 0.801 4123 E CB -0.233 29.470 29.700 0.004 0.000 0.743 4123 E HN 0.643 nan 8.360 nan 0.000 0.453 4124 Q N 0.308 120.118 119.800 0.016 0.000 2.030 4124 Q HA -0.247 4.115 4.340 0.037 0.000 0.204 4124 Q C 2.180 178.188 176.000 0.013 0.000 0.986 4124 Q CA 1.834 57.646 55.803 0.015 0.000 0.843 4124 Q CB -0.267 28.483 28.738 0.020 0.000 0.904 4124 Q HN 0.304 nan 8.270 nan 0.000 0.420 4125 A N 0.709 123.539 122.820 0.017 0.000 1.892 4125 A HA -0.221 4.121 4.320 0.037 0.000 0.218 4125 A C 2.074 179.663 177.584 0.008 0.000 1.188 4125 A CA 1.833 53.875 52.037 0.008 0.000 0.631 4125 A CB -0.872 18.138 19.000 0.018 0.000 0.822 4125 A HN 0.478 nan 8.150 nan 0.000 0.447 4126 L N -1.211 120.028 121.223 0.027 0.000 2.072 4126 L HA -0.104 4.258 4.340 0.037 0.000 0.205 4126 L C 2.648 179.528 176.870 0.017 0.000 1.079 4126 L CA 1.070 55.933 54.840 0.038 0.000 0.752 4126 L CB -0.529 41.560 42.059 0.049 0.000 0.906 4126 L HN 0.281 nan 8.230 nan 0.000 0.436 4127 E N 0.516 120.723 120.200 0.011 0.000 2.085 4127 E HA -0.221 4.151 4.350 0.037 0.000 0.194 4127 E C 2.278 178.878 176.600 -0.000 0.000 0.994 4127 E CA 1.373 57.777 56.400 0.006 0.000 0.801 4127 E CB -0.199 29.505 29.700 0.007 0.000 0.743 4127 E HN 0.490 nan 8.360 nan 0.000 0.453 4128 I N 0.252 120.819 120.570 -0.004 0.000 2.127 4128 I HA -0.366 3.826 4.170 0.037 0.000 0.241 4128 I C 2.611 178.715 176.117 -0.021 0.000 1.075 4128 I CA 0.947 62.240 61.300 -0.012 0.000 1.334 4128 I CB -0.309 37.682 38.000 -0.016 0.000 1.040 4128 I HN 0.150 nan 8.210 nan 0.000 0.405 4129 C N 0.362 119.645 119.300 -0.029 0.000 2.393 4129 C HA -0.250 4.232 4.460 0.037 0.000 0.276 4129 C C 2.598 177.572 174.990 -0.027 0.000 1.215 4129 C CA 1.381 60.374 59.018 -0.042 0.000 1.743 4129 C CB -1.066 26.646 27.740 -0.046 0.000 2.044 4129 C HN 0.546 nan 8.230 nan 0.000 0.464 4130 D N 0.299 120.691 120.400 -0.013 0.000 2.158 4130 D HA -0.108 4.554 4.640 0.037 0.000 0.197 4130 D C 2.143 178.436 176.300 -0.011 0.000 0.995 4130 D CA 1.651 55.645 54.000 -0.011 0.000 0.846 4130 D CB -0.195 40.603 40.800 -0.004 0.000 0.941 4130 D HN 0.463 nan 8.370 nan 0.000 0.456 4131 A N -0.085 122.729 122.820 -0.010 0.000 1.873 4131 A HA -0.079 4.262 4.320 0.037 0.000 0.215 4131 A C 2.410 179.987 177.584 -0.012 0.000 1.186 4131 A CA 1.003 53.035 52.037 -0.008 0.000 0.616 4131 A CB -0.783 18.213 19.000 -0.006 0.000 0.823 4131 A HN 0.325 nan 8.150 nan 0.000 0.442 4132 L N -0.793 120.419 121.223 -0.018 0.000 2.141 4132 L HA -0.158 4.204 4.340 0.037 0.000 0.209 4132 L C 3.039 179.896 176.870 -0.022 0.000 1.094 4132 L CA 0.824 55.651 54.840 -0.021 0.000 0.763 4132 L CB -0.606 41.435 42.059 -0.029 0.000 0.908 4132 L HN 0.461 nan 8.230 nan 0.000 0.437 4133 A N 0.294 123.100 122.820 -0.024 0.000 1.832 4133 A HA -0.199 4.143 4.320 0.037 0.000 0.214 4133 A C 2.399 179.973 177.584 -0.016 0.000 1.200 4133 A CA 1.383 53.406 52.037 -0.024 0.000 0.610 4133 A CB -0.564 18.420 19.000 -0.027 0.000 0.842 4133 A HN 0.241 nan 8.150 nan 0.000 0.444 4134 R N 0.172 120.664 120.500 -0.013 0.000 2.139 4134 R HA -0.159 4.203 4.340 0.037 0.000 0.243 4134 R C 2.605 178.902 176.300 -0.004 0.000 1.145 4134 R CA 1.696 57.791 56.100 -0.007 0.000 0.976 4134 R CB -0.408 29.889 30.300 -0.005 0.000 0.866 4134 R HN 0.767 nan 8.270 nan 0.000 0.449 4135 S N -0.771 114.925 115.700 -0.006 0.000 2.400 4135 S HA -0.102 4.390 4.470 0.037 0.000 0.232 4135 S C 1.653 176.251 174.600 -0.004 0.000 1.025 4135 S CA 1.211 59.409 58.200 -0.004 0.000 0.993 4135 S CB -0.345 62.852 63.200 -0.006 0.000 0.808 4135 S HN 0.545 nan 8.310 nan 0.000 0.478 4136 G N 0.567 109.363 108.800 -0.005 0.000 2.155 4136 G HA2 -0.199 3.782 3.960 0.037 0.000 0.257 4136 G HA3 -0.199 3.782 3.960 0.037 0.000 0.257 4136 G C 0.800 175.697 174.900 -0.005 0.000 0.983 4136 G CA 0.520 45.618 45.100 -0.004 0.000 0.676 4136 G HN 1.327 nan 8.290 nan 0.000 0.528 4137 A N -1.127 121.689 122.820 -0.007 0.000 1.956 4137 A HA 0.638 4.980 4.320 0.037 0.000 0.212 4137 A C 1.272 178.850 177.584 -0.010 0.000 1.188 4137 A CA 1.415 53.447 52.037 -0.007 0.000 0.675 4137 A CB 0.350 19.346 19.000 -0.007 0.000 0.845 4137 A HN 1.001 nan 8.150 nan 0.000 0.455 4138 V N 1.356 121.262 119.914 -0.013 0.000 2.607 4138 V HA 0.168 4.310 4.120 0.037 0.000 0.289 4138 V C 0.305 176.389 176.094 -0.018 0.000 1.053 4138 V CA -0.259 62.031 62.300 -0.016 0.000 0.996 4138 V CB 1.435 33.245 31.823 -0.021 0.000 0.995 4138 V HN 0.447 nan 8.190 nan 0.000 0.476 4139 D N 1.659 122.049 120.400 -0.018 0.000 2.394 4139 D HA 0.108 4.770 4.640 0.037 0.000 0.226 4139 D C 0.190 176.476 176.300 -0.023 0.000 0.990 4139 D CA 1.015 55.005 54.000 -0.017 0.000 0.902 4139 D CB 1.591 42.382 40.800 -0.015 0.000 1.038 4139 D HN 0.365 nan 8.370 nan 0.000 0.499 4140 V N 1.403 121.301 119.914 -0.026 0.000 2.623 4140 V HA 0.447 4.589 4.120 0.037 0.000 0.304 4140 V C -1.635 174.431 176.094 -0.048 0.000 1.054 4140 V CA -0.654 61.625 62.300 -0.036 0.000 0.882 4140 V CB 1.861 33.668 31.823 -0.026 0.000 1.002 4140 V HN -0.106 nan 8.190 nan 0.000 0.424 4141 I N 6.842 127.360 120.570 -0.086 0.000 2.465 4141 I HA 0.660 4.852 4.170 0.037 0.000 0.291 4141 I C -0.565 175.425 176.117 -0.211 0.000 1.014 4141 I CA -1.015 60.205 61.300 -0.132 0.000 1.093 4141 I CB 2.026 39.933 38.000 -0.155 0.000 1.267 4141 I HN 0.562 nan 8.210 nan 0.000 0.431 4142 V N 7.144 126.906 119.914 -0.254 0.000 2.604 4142 V HA 0.606 4.748 4.120 0.037 0.000 0.305 4142 V C -0.978 174.764 176.094 -0.587 0.000 1.043 4142 V CA -0.379 61.691 62.300 -0.384 0.000 0.888 4142 V CB 2.143 33.806 31.823 -0.268 0.000 0.995 4142 V HN 0.435 nan 8.190 nan 0.000 0.429 4143 V N 5.508 125.087 119.914 -0.559 0.000 2.347 4143 V HA 0.419 4.561 4.120 0.037 0.000 0.280 4143 V C -0.276 175.617 176.094 -0.335 0.000 1.021 4143 V CA -0.400 61.623 62.300 -0.461 0.000 0.847 4143 V CB 1.361 32.946 31.823 -0.396 0.000 0.990 4143 V HN 0.969 nan 8.190 nan 0.000 0.444 4144 D N 3.525 123.693 120.400 -0.387 0.000 2.365 4144 D HA 0.332 4.994 4.640 0.037 0.000 0.237 4144 D C 0.052 176.341 176.300 -0.017 0.000 1.190 4144 D CA 0.699 54.598 54.000 -0.168 0.000 0.867 4144 D CB 0.590 41.346 40.800 -0.073 0.000 1.050 4144 D HN 0.647 nan 8.370 nan 0.000 0.491 4145 S N 1.237 116.960 115.700 0.038 0.000 3.392 4145 S HA -0.147 4.345 4.470 0.037 0.000 0.693 4145 S C 1.207 175.861 174.600 0.090 0.000 0.620 4145 S CA 0.348 58.593 58.200 0.075 0.000 1.452 4145 S CB -1.018 62.225 63.200 0.072 0.000 0.988 4145 S HN 0.538 nan 8.310 nan 0.000 0.932 4146 V N 2.285 122.270 119.914 0.118 0.000 2.626 4146 V HA -0.036 4.106 4.120 0.037 0.000 0.252 4146 V C 2.348 178.470 176.094 0.047 0.000 1.067 4146 V CA 2.334 64.691 62.300 0.095 0.000 1.081 4146 V CB -1.145 30.697 31.823 0.031 0.000 0.686 4146 V HN 1.445 nan 8.190 nan 0.000 0.468 4147 A N 0.894 123.741 122.820 0.045 0.000 1.958 4147 A HA -0.098 4.244 4.320 0.037 0.000 0.221 4147 A C 2.354 179.961 177.584 0.038 0.000 1.178 4147 A CA 2.608 54.665 52.037 0.034 0.000 0.642 4147 A CB -1.059 17.964 19.000 0.039 0.000 0.816 4147 A HN 1.283 nan 8.150 nan 0.000 0.453 4148 A N -1.661 121.192 122.820 0.054 0.000 2.275 4148 A HA 0.450 4.792 4.320 0.037 0.000 0.212 4148 A C 0.557 178.179 177.584 0.062 0.000 1.201 4148 A CA -0.078 51.996 52.037 0.063 0.000 0.843 4148 A CB -0.188 18.865 19.000 0.088 0.000 0.873 4148 A HN 0.283 nan 8.150 nan 0.000 0.492 4149 L N 2.359 123.613 121.223 0.052 0.000 2.416 4149 L HA 0.140 4.502 4.340 0.037 0.000 0.243 4149 L C 0.185 177.073 176.870 0.030 0.000 1.373 4149 L CA 0.548 55.416 54.840 0.047 0.000 1.227 4149 L CB -1.071 41.018 42.059 0.050 0.000 1.428 4149 L HN 0.101 nan 8.230 nan 0.000 0.425 4150 T N 2.869 117.442 114.554 0.032 0.000 2.799 4150 T HA 0.194 4.566 4.350 0.037 0.000 0.296 4150 T C -2.130 172.578 174.700 0.014 0.000 0.947 4150 T CA -0.976 61.135 62.100 0.019 0.000 1.141 4150 T CB 0.338 69.216 68.868 0.017 0.000 0.891 4150 T HN 0.173 nan 8.240 nan 0.000 0.533 4151 P HA 0.102 nan 4.420 nan 0.000 0.268 4151 P C 0.996 178.297 177.300 0.001 0.000 1.208 4151 P CA -0.456 62.645 63.100 0.001 0.000 0.777 4151 P CB 0.738 32.434 31.700 -0.006 0.000 0.875 4152 K N 2.283 122.683 120.400 -0.000 0.000 2.009 4152 K HA -0.231 4.111 4.320 0.037 0.000 0.210 4152 K C 1.814 178.412 176.600 -0.003 0.000 1.049 4152 K CA 1.990 58.277 56.287 -0.000 0.000 0.929 4152 K CB -0.706 31.792 32.500 -0.003 0.000 0.714 4152 K HN 0.473 nan 8.250 nan 0.000 0.440 4153 A N 1.054 123.870 122.820 -0.006 0.000 2.019 4153 A HA -0.161 4.181 4.320 0.037 0.000 0.219 4153 A C 1.198 178.778 177.584 -0.006 0.000 1.164 4153 A CA 1.052 53.084 52.037 -0.007 0.000 0.644 4153 A CB -0.388 18.607 19.000 -0.010 0.000 0.805 4153 A HN 0.591 nan 8.150 nan 0.000 0.449 4169 R N 0.107 120.590 120.500 -0.028 0.000 2.115 4169 R HA 0.021 4.383 4.340 0.037 0.000 0.230 4169 R C 2.163 178.445 176.300 -0.031 0.000 1.111 4169 R CA 1.807 57.891 56.100 -0.027 0.000 0.976 4169 R CB -0.260 30.026 30.300 -0.023 0.000 0.870 4169 R HN 0.640 nan 8.270 nan 0.000 0.445 4170 M N -0.348 119.232 119.600 -0.033 0.000 2.099 4170 M HA -0.174 4.328 4.480 0.037 0.000 0.262 4170 M C 1.755 178.023 176.300 -0.053 0.000 1.067 4170 M CA 1.482 56.761 55.300 -0.034 0.000 1.124 4170 M CB 0.039 32.623 32.600 -0.027 0.000 1.353 4170 M HN 0.208 nan 8.290 nan 0.000 0.410 4171 M N -0.407 119.150 119.600 -0.071 0.000 2.108 4171 M HA -0.201 4.301 4.480 0.037 0.000 0.261 4171 M C 2.366 178.583 176.300 -0.139 0.000 1.066 4171 M CA 1.601 56.828 55.300 -0.121 0.000 1.107 4171 M CB -1.367 31.152 32.600 -0.136 0.000 1.356 4171 M HN 0.348 nan 8.290 nan 0.000 0.406 4172 S N -0.265 115.379 115.700 -0.094 0.000 2.399 4172 S HA -0.178 4.314 4.470 0.037 0.000 0.231 4172 S C 1.846 176.387 174.600 -0.099 0.000 1.022 4172 S CA 1.247 59.397 58.200 -0.083 0.000 0.983 4172 S CB -0.126 63.056 63.200 -0.030 0.000 0.803 4172 S HN 0.511 nan 8.310 nan 0.000 0.480 4173 Q N 0.165 119.924 119.800 -0.070 0.000 2.123 4173 Q HA -0.014 4.348 4.340 0.037 0.000 0.199 4173 Q C 2.195 178.148 176.000 -0.079 0.000 0.966 4173 Q CA 1.157 56.931 55.803 -0.048 0.000 0.845 4173 Q CB -0.314 28.418 28.738 -0.010 0.000 0.907 4173 Q HN 0.577 nan 8.270 nan 0.000 0.439 4174 A N 0.940 123.702 122.820 -0.096 0.000 1.877 4174 A HA -0.215 4.127 4.320 0.037 0.000 0.216 4174 A C 2.043 179.526 177.584 -0.168 0.000 1.186 4174 A CA 1.615 53.597 52.037 -0.092 0.000 0.620 4174 A CB -0.525 18.436 19.000 -0.065 0.000 0.822 4174 A HN 0.388 nan 8.150 nan 0.000 0.443 4175 M N -0.398 119.008 119.600 -0.323 0.000 2.073 4175 M HA -0.187 4.315 4.480 0.037 0.000 0.258 4175 M C 2.165 178.121 176.300 -0.573 0.000 1.070 4175 M CA 1.761 56.672 55.300 -0.648 0.000 1.103 4175 M CB -1.462 30.382 32.600 -1.260 0.000 1.321 4175 M HN 0.425 nan 8.290 nan 0.000 0.405 4176 R N 0.031 120.308 120.500 -0.372 0.000 2.113 4176 R HA -0.182 4.180 4.340 0.037 0.000 0.244 4176 R C 2.287 178.559 176.300 -0.046 0.000 1.142 4176 R CA 1.643 57.694 56.100 -0.082 0.000 0.953 4176 R CB -0.354 29.939 30.300 -0.013 0.000 0.860 4176 R HN 0.456 nan 8.270 nan 0.000 0.438 4177 K N 0.292 120.652 120.400 -0.066 0.000 2.103 4177 K HA -0.058 4.284 4.320 0.037 0.000 0.204 4177 K C 2.139 178.709 176.600 -0.050 0.000 1.052 4177 K CA 0.971 57.233 56.287 -0.041 0.000 0.945 4177 K CB 0.004 32.488 32.500 -0.026 0.000 0.722 4177 K HN 0.181 nan 8.250 nan 0.000 0.443 4178 L N 0.256 121.441 121.223 -0.063 0.000 2.095 4178 L HA -0.050 4.312 4.340 0.037 0.000 0.204 4178 L C 2.593 179.428 176.870 -0.057 0.000 1.080 4178 L CA 0.648 55.461 54.840 -0.044 0.000 0.759 4178 L CB -0.611 41.444 42.059 -0.007 0.000 0.914 4178 L HN 0.134 nan 8.230 nan 0.000 0.439 4179 A N 0.920 123.714 122.820 -0.043 0.000 1.896 4179 A HA -0.255 4.087 4.320 0.037 0.000 0.220 4179 A C 2.374 179.774 177.584 -0.307 0.000 1.206 4179 A CA 2.331 54.351 52.037 -0.027 0.000 0.647 4179 A CB -1.507 17.595 19.000 0.170 0.000 0.828 4179 A HN 0.452 nan 8.150 nan 0.000 0.455 4180 G N -0.765 107.790 108.800 -0.408 0.000 2.421 4180 G HA2 -0.287 3.695 3.960 0.037 0.000 0.216 4180 G HA3 -0.287 3.695 3.960 0.037 0.000 0.216 4180 G C 1.429 176.131 174.900 -0.330 0.000 1.171 4180 G CA 1.118 45.822 45.100 -0.661 0.000 0.775 4180 G HN 0.726 nan 8.290 nan 0.000 0.543 4181 N N -0.239 118.365 118.700 -0.160 0.000 2.381 4181 N HA 0.058 4.820 4.740 0.037 0.000 0.182 4181 N C 2.092 177.563 175.510 -0.065 0.000 1.025 4181 N CA 0.161 53.163 53.050 -0.080 0.000 0.888 4181 N CB -0.045 38.413 38.487 -0.048 0.000 0.965 4181 N HN 0.251 nan 8.380 nan 0.000 0.438 4182 L N 0.254 121.431 121.223 -0.077 0.000 2.162 4182 L HA -0.026 4.336 4.340 0.037 0.000 0.205 4182 L C 2.315 179.174 176.870 -0.018 0.000 1.086 4182 L CA 0.712 55.530 54.840 -0.037 0.000 0.778 4182 L CB -0.060 41.989 42.059 -0.016 0.000 0.928 4182 L HN 0.012 nan 8.230 nan 0.000 0.446 4183 K N 0.592 120.972 120.400 -0.033 0.000 2.031 4183 K HA -0.159 4.183 4.320 0.037 0.000 0.205 4183 K C 2.039 178.675 176.600 0.060 0.000 1.049 4183 K CA 1.535 57.855 56.287 0.054 0.000 0.939 4183 K CB -0.156 32.463 32.500 0.198 0.000 0.717 4183 K HN 0.101 nan 8.250 nan 0.000 0.438 4184 Q N -0.449 119.376 119.800 0.042 0.000 2.437 4184 Q HA 0.043 4.405 4.340 0.037 0.000 0.210 4184 Q C 1.012 177.029 176.000 0.028 0.000 0.972 4184 Q CA 1.286 57.120 55.803 0.051 0.000 0.903 4184 Q CB 0.244 29.014 28.738 0.054 0.000 0.967 4184 Q HN 0.219 nan 8.270 nan 0.000 0.486 4185 S N -0.015 115.693 115.700 0.013 0.000 2.523 4185 S HA 0.044 4.536 4.470 0.037 0.000 0.217 4185 S C 0.200 174.805 174.600 0.008 0.000 0.996 4185 S CA -0.203 58.001 58.200 0.007 0.000 0.921 4185 S CB 0.321 63.519 63.200 -0.004 0.000 0.829 4185 S HN 0.408 nan 8.310 nan 0.000 0.495 4186 N N 2.526 121.236 118.700 0.016 0.000 2.714 4186 N HA -0.138 4.624 4.740 0.037 0.000 0.253 4186 N C -1.362 174.150 175.510 0.005 0.000 1.024 4186 N CA 0.742 53.801 53.050 0.015 0.000 0.726 4186 N CB -1.458 37.038 38.487 0.016 0.000 0.908 4186 N HN 0.283 nan 8.380 nan 0.000 0.542 4187 T N 1.156 115.710 114.554 -0.000 0.000 2.792 4187 T HA 0.469 4.841 4.350 0.037 0.000 0.280 4187 T C 0.186 174.878 174.700 -0.013 0.000 0.990 4187 T CA -0.721 61.372 62.100 -0.012 0.000 0.960 4187 T CB 1.747 70.603 68.868 -0.020 0.000 0.939 4187 T HN 0.284 nan 8.240 nan 0.000 0.439 4188 L N 4.234 125.446 121.223 -0.019 0.000 2.349 4188 L HA 0.626 4.988 4.340 0.037 0.000 0.275 4188 L C -0.980 175.858 176.870 -0.053 0.000 1.115 4188 L CA -0.323 54.504 54.840 -0.022 0.000 0.820 4188 L CB 0.451 42.499 42.059 -0.019 0.000 1.135 4188 L HN 0.642 nan 8.230 nan 0.000 0.445 4189 L N 6.522 127.710 121.223 -0.058 0.000 2.376 4189 L HA 0.554 4.916 4.340 0.037 0.000 0.275 4189 L C -1.159 175.622 176.870 -0.148 0.000 0.987 4189 L CA -0.457 54.293 54.840 -0.150 0.000 0.828 4189 L CB 1.431 43.395 42.059 -0.160 0.000 1.249 4189 L HN 0.656 nan 8.230 nan 0.000 0.409 4190 I N 4.302 124.737 120.570 -0.225 0.000 2.362 4190 I HA 0.314 4.506 4.170 0.037 0.000 0.289 4190 I C -0.901 175.052 176.117 -0.272 0.000 0.994 4190 I CA -0.323 60.893 61.300 -0.140 0.000 1.158 4190 I CB 1.435 39.392 38.000 -0.072 0.000 1.315 4190 I HN 0.375 nan 8.210 nan 0.000 0.451 4191 F N 6.455 126.391 119.950 -0.023 0.000 2.404 4191 F HA 0.474 5.023 4.527 0.037 0.000 0.354 4191 F C 0.405 176.205 175.800 -0.000 0.000 1.122 4191 F CA -0.444 57.541 58.000 -0.026 0.000 1.080 4191 F CB 0.991 39.986 39.000 -0.008 0.000 1.131 4191 F HN 0.216 nan 8.300 nan 0.000 0.471 4192 I N 3.488 124.141 120.570 0.138 0.000 2.395 4192 I HA 0.204 4.396 4.170 0.037 0.000 0.289 4192 I C -0.191 176.017 176.117 0.151 0.000 1.023 4192 I CA -0.070 61.304 61.300 0.124 0.000 1.350 4192 I CB 1.065 39.109 38.000 0.073 0.000 1.409 4192 I HN 0.653 nan 8.210 nan 0.000 0.507 4193 N N 4.210 123.008 118.700 0.163 0.000 2.262 4193 N HA 0.379 5.141 4.740 0.037 0.000 0.295 4193 N C -1.273 174.322 175.510 0.143 0.000 1.161 4193 N CA -0.695 52.439 53.050 0.140 0.000 0.767 4193 N CB 1.775 40.338 38.487 0.127 0.000 1.499 4193 N HN 0.539 nan 8.380 nan 0.000 0.476 4194 Q N 0.933 120.789 119.800 0.093 0.000 2.180 4194 Q HA 0.495 4.857 4.340 0.037 0.000 0.241 4194 Q C -0.624 175.411 176.000 0.059 0.000 0.970 4194 Q CA -0.633 55.221 55.803 0.084 0.000 0.919 4194 Q CB 2.028 30.800 28.738 0.058 0.000 1.222 4194 Q HN 0.477 nan 8.270 nan 0.000 0.482 4195 I N 1.488 122.095 120.570 0.062 0.000 2.359 4195 I HA 0.343 4.535 4.170 0.037 0.000 0.294 4195 I C 0.091 176.214 176.117 0.010 0.000 0.987 4195 I CA -0.628 60.689 61.300 0.028 0.000 1.225 4195 I CB 0.759 38.799 38.000 0.066 0.000 1.366 4195 I HN 0.363 nan 8.210 nan 0.000 0.466 4206 P HA 0.328 nan 4.420 nan 0.000 0.253 4206 P C -0.823 176.472 177.300 -0.007 0.000 1.459 4206 P CA 0.236 63.334 63.100 -0.002 0.000 0.908 4206 P CB 0.248 31.948 31.700 0.001 0.000 1.470 4207 E N -0.008 120.186 120.200 -0.010 0.000 2.191 4207 E HA 0.426 4.798 4.350 0.037 0.000 0.278 4207 E C -0.157 176.405 176.600 -0.062 0.000 0.972 4207 E CA -0.339 56.047 56.400 -0.023 0.000 0.804 4207 E CB 1.618 31.316 29.700 -0.002 0.000 1.110 4207 E HN 0.095 nan 8.360 nan 0.000 0.394 4208 T N 0.121 114.626 114.554 -0.081 0.000 2.604 4208 T HA 0.498 4.870 4.350 0.037 0.000 0.267 4208 T C -0.331 174.268 174.700 -0.169 0.000 0.923 4208 T CA -0.719 61.306 62.100 -0.127 0.000 1.077 4208 T CB 1.624 70.440 68.868 -0.085 0.000 1.392 4208 T HN 0.268 nan 8.240 nan 0.000 0.531 4209 T N 1.861 116.316 114.554 -0.165 0.000 2.921 4209 T HA 0.561 4.933 4.350 0.037 0.000 0.297 4209 T C -0.543 174.101 174.700 -0.094 0.000 1.013 4209 T CA -0.571 61.427 62.100 -0.170 0.000 0.990 4209 T CB 1.332 70.035 68.868 -0.275 0.000 1.023 4209 T HN 0.751 nan 8.240 nan 0.000 0.447 4210 T N 1.279 115.797 114.554 -0.059 0.000 2.900 4210 T HA 0.469 4.841 4.350 0.037 0.000 0.307 4210 T C 1.321 175.990 174.700 -0.052 0.000 1.065 4210 T CA 0.361 62.437 62.100 -0.041 0.000 1.105 4210 T CB 0.518 69.375 68.868 -0.018 0.000 0.979 4210 T HN 1.179 nan 8.240 nan 0.000 0.544 4211 G N 0.521 109.293 108.800 -0.047 0.000 2.171 4211 G HA2 0.253 4.235 3.960 0.037 0.000 0.238 4211 G HA3 0.253 4.235 3.960 0.037 0.000 0.238 4211 G C 0.714 175.580 174.900 -0.058 0.000 1.039 4211 G CA 0.096 45.160 45.100 -0.059 0.000 0.759 4211 G HN 1.851 nan 8.290 nan 0.000 0.501 4212 G N -0.154 108.623 108.800 -0.039 0.000 2.601 4212 G HA2 -0.251 3.731 3.960 0.037 0.000 0.252 4212 G HA3 -0.251 3.731 3.960 0.037 0.000 0.252 4212 G C 0.685 175.586 174.900 0.002 0.000 1.294 4212 G CA 0.531 45.621 45.100 -0.017 0.000 0.912 4212 G HN 0.951 nan 8.290 nan 0.000 0.574 4213 N N 0.628 119.361 118.700 0.055 0.000 2.325 4213 N HA 0.199 4.961 4.740 0.037 0.000 0.182 4213 N C 2.451 178.110 175.510 0.249 0.000 1.088 4213 N CA 1.279 54.414 53.050 0.142 0.000 0.879 4213 N CB -0.023 38.598 38.487 0.222 0.000 0.983 4213 N HN 0.845 nan 8.380 nan 0.000 0.471 4214 A N 1.596 124.512 122.820 0.160 0.000 1.873 4214 A HA -0.169 4.173 4.320 0.037 0.000 0.218 4214 A C 2.166 179.907 177.584 0.263 0.000 1.193 4214 A CA 1.246 53.405 52.037 0.202 0.000 0.629 4214 A CB -0.784 18.231 19.000 0.025 0.000 0.826 4214 A HN 0.220 nan 8.150 nan 0.000 0.447 4215 L N -0.201 121.061 121.223 0.066 0.000 2.083 4215 L HA -0.126 4.236 4.340 0.037 0.000 0.209 4215 L C 2.222 179.149 176.870 0.095 0.000 1.083 4215 L CA 2.107 56.955 54.840 0.013 0.000 0.752 4215 L CB -0.547 41.409 42.059 -0.172 0.000 0.899 4215 L HN 0.366 nan 8.230 nan 0.000 0.433 4216 K N -1.113 119.321 120.400 0.057 0.000 2.059 4216 K HA -0.236 4.106 4.320 0.037 0.000 0.212 4216 K C 2.054 178.611 176.600 -0.072 0.000 1.050 4216 K CA 2.134 58.387 56.287 -0.056 0.000 0.927 4216 K CB -0.451 31.935 32.500 -0.191 0.000 0.714 4216 K HN 0.275 nan 8.250 nan 0.000 0.447 4217 F N -0.697 119.295 119.950 0.069 0.000 2.128 4217 F HA -0.123 4.426 4.527 0.037 0.000 0.295 4217 F C 2.113 177.904 175.800 -0.015 0.000 1.100 4217 F CA 1.137 59.143 58.000 0.010 0.000 1.260 4217 F CB -0.376 38.604 39.000 -0.033 0.000 1.009 4217 F HN 0.001 nan 8.300 nan 0.000 0.476 4218 Y N 0.026 120.442 120.300 0.192 0.000 2.395 4218 Y HA 0.209 4.781 4.550 0.037 0.000 0.293 4218 Y C 1.603 177.558 175.900 0.090 0.000 1.123 4218 Y CA -0.035 58.141 58.100 0.127 0.000 1.227 4218 Y CB -0.661 37.855 38.460 0.092 0.000 1.012 4218 Y HN -0.113 nan 8.280 nan 0.000 0.552 4219 A N -0.089 122.857 122.820 0.211 0.000 2.511 4219 A HA 0.137 4.479 4.320 0.037 0.000 0.242 4219 A C 1.201 178.831 177.584 0.075 0.000 1.069 4219 A CA 0.437 52.555 52.037 0.135 0.000 0.763 4219 A CB 0.164 19.226 19.000 0.103 0.000 1.001 4219 A HN 0.343 nan 8.150 nan 0.000 0.498 4220 S N 0.616 116.353 115.700 0.063 0.000 2.486 4220 S HA 0.178 4.670 4.470 0.037 0.000 0.220 4220 S C 0.375 174.959 174.600 -0.027 0.000 1.011 4220 S CA 0.445 58.654 58.200 0.015 0.000 0.921 4220 S CB 0.124 63.338 63.200 0.024 0.000 0.785 4220 S HN 0.559 nan 8.310 nan 0.000 0.517 4221 V N 2.273 122.182 119.914 -0.009 0.000 2.760 4221 V HA 0.497 4.639 4.120 0.037 0.000 0.309 4221 V C -0.779 175.309 176.094 -0.010 0.000 1.077 4221 V CA -0.833 61.445 62.300 -0.037 0.000 0.910 4221 V CB 2.110 33.912 31.823 -0.035 0.000 1.008 4221 V HN 0.123 nan 8.190 nan 0.000 0.424 4222 R N 3.853 124.332 120.500 -0.035 0.000 2.476 4222 R HA 0.631 4.993 4.340 0.037 0.000 0.305 4222 R C -1.880 174.388 176.300 -0.054 0.000 0.965 4222 R CA -0.828 55.279 56.100 0.013 0.000 0.867 4222 R CB 2.196 32.537 30.300 0.068 0.000 1.176 4222 R HN 0.370 nan 8.270 nan 0.000 0.447 4223 L N 2.112 123.276 121.223 -0.099 0.000 2.329 4223 L HA 0.352 4.714 4.340 0.037 0.000 0.279 4223 L C -0.123 176.440 176.870 -0.512 0.000 1.014 4223 L CA -0.398 54.322 54.840 -0.201 0.000 0.814 4223 L CB 1.471 43.465 42.059 -0.109 0.000 1.257 4223 L HN 0.449 nan 8.230 nan 0.000 0.424 4224 D N 3.819 123.933 120.400 -0.476 0.000 2.461 4224 D HA 0.275 4.937 4.640 0.037 0.000 0.240 4224 D C -0.845 175.284 176.300 -0.285 0.000 1.094 4224 D CA -0.236 53.387 54.000 -0.628 0.000 0.868 4224 D CB 0.931 41.483 40.800 -0.414 0.000 1.062 4224 D HN 0.447 nan 8.370 nan 0.000 0.530 4225 I N 3.063 123.495 120.570 -0.231 0.000 2.392 4225 I HA 0.510 4.702 4.170 0.037 0.000 0.295 4225 I C -0.825 175.248 176.117 -0.074 0.000 0.985 4225 I CA -0.623 60.611 61.300 -0.111 0.000 1.221 4225 I CB 0.651 38.624 38.000 -0.045 0.000 1.366 4225 I HN 0.224 nan 8.210 nan 0.000 0.467 4226 R N 5.662 126.115 120.500 -0.078 0.000 2.584 4226 R HA 0.359 4.721 4.340 0.037 0.000 0.276 4226 R C -1.055 175.206 176.300 -0.066 0.000 1.046 4226 R CA -0.861 55.209 56.100 -0.049 0.000 0.906 4226 R CB 1.932 32.210 30.300 -0.037 0.000 1.215 4226 R HN 0.571 nan 8.270 nan 0.000 0.449 4227 R N 4.221 124.703 120.500 -0.029 0.000 2.316 4227 R HA 0.134 4.496 4.340 0.037 0.000 0.314 4227 R C 0.676 176.959 176.300 -0.029 0.000 1.069 4227 R CA 0.181 56.266 56.100 -0.025 0.000 0.959 4227 R CB 0.385 30.696 30.300 0.019 0.000 0.987 4227 R HN 0.778 nan 8.270 nan 0.000 0.446 4228 I N 0.722 121.263 120.570 -0.049 0.000 3.939 4228 I HA 0.466 4.658 4.170 0.037 0.000 0.313 4228 I C 0.592 176.693 176.117 -0.026 0.000 1.274 4228 I CA -0.132 61.144 61.300 -0.040 0.000 1.301 4228 I CB 0.886 38.850 38.000 -0.060 0.000 1.105 4228 I HN 0.588 nan 8.210 nan 0.000 0.427 4229 G N 0.928 109.713 108.800 -0.024 0.000 2.559 4229 G HA2 0.696 4.678 3.960 0.037 0.000 0.291 4229 G HA3 0.696 4.678 3.960 0.037 0.000 0.291 4229 G C -1.934 172.963 174.900 -0.004 0.000 1.424 4229 G CA -0.268 44.825 45.100 -0.012 0.000 0.786 4229 G HN 0.289 nan 8.290 nan 0.000 0.485 4230 A N -0.450 122.373 122.820 0.004 0.000 2.305 4230 A HA 0.682 5.024 4.320 0.037 0.000 0.322 4230 A C -0.162 177.415 177.584 -0.013 0.000 1.187 4230 A CA -0.511 51.533 52.037 0.012 0.000 0.825 4230 A CB 1.427 20.449 19.000 0.036 0.000 1.164 4230 A HN 1.293 nan 8.150 nan 0.000 0.498 4231 V N 4.374 124.262 119.914 -0.044 0.000 2.356 4231 V HA 0.138 4.279 4.120 0.037 0.000 0.258 4231 V C 0.502 176.579 176.094 -0.028 0.000 1.065 4231 V CA -0.087 62.181 62.300 -0.054 0.000 0.935 4231 V CB -0.251 31.509 31.823 -0.104 0.000 1.061 4231 V HN 0.825 nan 8.190 nan 0.000 0.484 4232 K N 3.057 123.452 120.400 -0.008 0.000 2.090 4232 K HA 0.490 4.832 4.320 0.037 0.000 0.249 4232 K C 0.057 176.660 176.600 0.005 0.000 0.995 4232 K CA -0.616 55.675 56.287 0.007 0.000 0.914 4232 K CB 1.309 33.816 32.500 0.011 0.000 1.057 4232 K HN 0.461 nan 8.250 nan 0.000 0.462 4233 E N 0.754 120.962 120.200 0.013 0.000 4.170 4233 E HA 0.135 4.507 4.350 0.037 0.000 0.215 4233 E C 0.389 176.996 176.600 0.013 0.000 1.119 4233 E CA -0.022 56.386 56.400 0.012 0.000 1.396 4233 E CB 0.751 30.462 29.700 0.017 0.000 1.182 4233 E HN 1.019 nan 8.360 nan 0.000 0.438 4234 G N 1.993 110.799 108.800 0.010 0.000 5.431 4234 G HA2 -0.398 3.583 3.960 0.037 0.000 0.322 4234 G HA3 -0.398 3.583 3.960 0.037 0.000 0.322 4234 G C 1.061 175.969 174.900 0.013 0.000 1.370 4234 G CA 0.725 45.831 45.100 0.010 0.000 0.963 4234 G HN 0.400 nan 8.290 nan 0.000 0.797 4235 E N 1.517 121.727 120.200 0.016 0.000 2.162 4235 E HA 0.085 4.457 4.350 0.037 0.000 0.193 4235 E C 1.031 177.646 176.600 0.025 0.000 0.953 4235 E CA 0.285 56.696 56.400 0.018 0.000 0.849 4235 E CB -0.113 29.597 29.700 0.017 0.000 0.810 4235 E HN 0.638 nan 8.360 nan 0.000 0.470 4236 N N 0.455 119.172 118.700 0.029 0.000 2.525 4236 N HA 0.112 4.874 4.740 0.037 0.000 0.271 4236 N C -0.793 174.749 175.510 0.054 0.000 1.194 4236 N CA -0.090 52.986 53.050 0.043 0.000 0.964 4236 N CB 1.637 40.151 38.487 0.045 0.000 1.126 4236 N HN -0.214 nan 8.380 nan 0.000 0.452 4237 V N 2.338 122.302 119.914 0.083 0.000 2.318 4237 V HA 0.118 4.260 4.120 0.037 0.000 0.271 4237 V C 0.570 176.775 176.094 0.186 0.000 1.030 4237 V CA -0.318 62.054 62.300 0.119 0.000 0.844 4237 V CB 1.178 33.091 31.823 0.149 0.000 1.015 4237 V HN 0.549 nan 8.190 nan 0.000 0.460 4238 V N 4.375 124.338 119.914 0.081 0.000 3.660 4238 V HA 0.635 4.777 4.120 0.037 0.000 0.276 4238 V C 0.836 176.751 176.094 -0.298 0.000 1.317 4238 V CA 1.280 63.611 62.300 0.052 0.000 1.097 4238 V CB 0.261 32.097 31.823 0.023 0.000 0.863 4238 V HN 0.908 nan 8.190 nan 0.000 0.438 4239 G N -1.172 107.284 108.800 -0.574 0.000 2.559 4239 G HA2 0.474 4.456 3.960 0.037 0.000 0.291 4239 G HA3 0.474 4.456 3.960 0.037 0.000 0.291 4239 G C -1.481 173.055 174.900 -0.607 0.000 1.424 4239 G CA -0.269 44.192 45.100 -1.065 0.000 0.786 4239 G HN -0.013 nan 8.290 nan 0.000 0.485 4240 S N -0.111 115.337 115.700 -0.420 0.000 2.456 4240 S HA 0.487 4.979 4.470 0.037 0.000 0.316 4240 S C -0.302 174.250 174.600 -0.080 0.000 1.089 4240 S CA -0.416 57.730 58.200 -0.089 0.000 1.101 4240 S CB 1.612 64.855 63.200 0.072 0.000 0.995 4240 S HN 0.585 nan 8.310 nan 0.000 0.468 4241 E N 2.135 122.294 120.200 -0.069 0.000 2.376 4241 E HA 0.286 4.658 4.350 0.037 0.000 0.266 4241 E C -0.561 175.954 176.600 -0.143 0.000 1.009 4241 E CA 0.507 56.853 56.400 -0.090 0.000 0.902 4241 E CB 0.542 30.202 29.700 -0.066 0.000 0.972 4241 E HN 0.450 nan 8.360 nan 0.000 0.439 4242 T N 4.958 119.345 114.554 -0.279 0.000 2.893 4242 T HA 0.496 4.868 4.350 0.037 0.000 0.293 4242 T C -0.889 173.474 174.700 -0.562 0.000 1.027 4242 T CA -0.796 61.039 62.100 -0.442 0.000 0.988 4242 T CB 1.267 69.765 68.868 -0.617 0.000 1.043 4242 T HN 0.377 nan 8.240 nan 0.000 0.461 4243 R N 2.226 122.493 120.500 -0.388 0.000 2.532 4243 R HA 0.691 5.053 4.340 0.037 0.000 0.297 4243 R C -1.942 174.229 176.300 -0.215 0.000 0.984 4243 R CA -0.504 55.423 56.100 -0.289 0.000 0.884 4243 R CB 1.338 31.544 30.300 -0.156 0.000 1.182 4243 R HN 0.464 nan 8.270 nan 0.000 0.442 4244 V N 4.532 124.350 119.914 -0.159 0.000 2.495 4244 V HA 0.424 4.566 4.120 0.037 0.000 0.298 4244 V C -0.236 175.831 176.094 -0.046 0.000 1.031 4244 V CA -0.792 61.463 62.300 -0.074 0.000 0.871 4244 V CB 1.900 33.738 31.823 0.024 0.000 0.988 4244 V HN 0.670 nan 8.190 nan 0.000 0.432 4245 K N 2.839 123.204 120.400 -0.059 0.000 2.206 4245 K HA 0.573 4.915 4.320 0.037 0.000 0.264 4245 K C -1.002 175.562 176.600 -0.060 0.000 0.967 4245 K CA -0.677 55.594 56.287 -0.026 0.000 0.844 4245 K CB 2.192 34.698 32.500 0.010 0.000 1.099 4245 K HN 0.459 nan 8.250 nan 0.000 0.441 4246 V N 4.666 124.543 119.914 -0.061 0.000 2.415 4246 V HA -0.010 4.132 4.120 0.037 0.000 0.267 4246 V C 1.048 177.002 176.094 -0.235 0.000 1.042 4246 V CA 0.059 62.279 62.300 -0.135 0.000 1.000 4246 V CB 0.909 32.645 31.823 -0.145 0.000 1.015 4246 V HN 0.649 nan 8.190 nan 0.000 0.478 4247 V N 3.969 123.755 119.914 -0.214 0.000 2.949 4247 V HA 0.170 4.311 4.120 0.037 0.000 0.245 4247 V C 0.835 176.689 176.094 -0.400 0.000 1.086 4247 V CA 0.881 63.047 62.300 -0.223 0.000 1.097 4247 V CB 0.018 31.859 31.823 0.030 0.000 0.762 4247 V HN 0.768 nan 8.190 nan 0.000 0.470 4248 K N 1.084 121.312 120.400 -0.287 0.000 2.371 4248 K HA 0.429 4.771 4.320 0.037 0.000 0.251 4248 K C -1.494 174.938 176.600 -0.279 0.000 0.934 4248 K CA -0.568 55.544 56.287 -0.292 0.000 0.798 4248 K CB 1.703 34.110 32.500 -0.154 0.000 1.204 4248 K HN 0.120 nan 8.250 nan 0.000 0.427 4249 N N 3.003 121.514 118.700 -0.316 0.000 2.549 4249 N HA 0.194 4.956 4.740 0.037 0.000 0.290 4249 N C -0.858 174.493 175.510 -0.266 0.000 1.122 4249 N CA -0.311 52.576 53.050 -0.272 0.000 0.885 4249 N CB 1.564 39.862 38.487 -0.314 0.000 1.455 4249 N HN 0.602 nan 8.380 nan 0.000 0.521 4250 K N 2.266 122.551 120.400 -0.193 0.000 2.358 4250 K HA 0.263 4.605 4.320 0.037 0.000 0.197 4250 K C 0.744 177.224 176.600 -0.200 0.000 1.025 4250 K CA 0.111 56.285 56.287 -0.188 0.000 1.104 4250 K CB 0.609 33.052 32.500 -0.096 0.000 0.855 4250 K HN 0.378 nan 8.250 nan 0.000 0.531 4251 I N -0.254 120.206 120.570 -0.183 0.000 3.883 4251 I HA 0.163 4.355 4.170 0.037 0.000 0.305 4251 I C 0.207 176.238 176.117 -0.143 0.000 1.247 4251 I CA 0.026 61.247 61.300 -0.132 0.000 1.350 4251 I CB 0.996 38.949 38.000 -0.079 0.000 1.194 4251 I HN -0.050 nan 8.210 nan 0.000 0.441 4252 A N -0.421 122.289 122.820 -0.183 0.000 2.534 4252 A HA 0.852 5.194 4.320 0.037 0.000 0.300 4252 A C -0.888 176.559 177.584 -0.228 0.000 1.223 4252 A CA -0.179 51.767 52.037 -0.151 0.000 0.666 4252 A CB -0.094 18.855 19.000 -0.084 0.000 1.316 4252 A HN 0.062 nan 8.150 nan 0.000 0.468 4253 A N 1.337 124.061 122.820 -0.159 0.000 2.520 4253 A HA 0.562 4.904 4.320 0.037 0.000 0.245 4253 A C -2.063 175.344 177.584 -0.297 0.000 1.072 4253 A CA -0.547 51.346 52.037 -0.241 0.000 0.761 4253 A CB -0.743 18.248 19.000 -0.014 0.000 1.004 4253 A HN 0.512 nan 8.150 nan 0.000 0.499 4254 P HA 0.522 nan 4.420 nan 0.000 0.282 4254 P C -0.131 177.026 177.300 -0.239 0.000 1.287 4254 P CA -0.316 62.474 63.100 -0.517 0.000 0.792 4254 P CB 0.183 31.345 31.700 -0.896 0.000 1.163 4255 F N -4.613 115.292 119.950 -0.076 0.000 2.840 4255 F HA -0.203 4.346 4.527 0.037 0.000 0.310 4255 F C 0.653 176.450 175.800 -0.004 0.000 0.688 4255 F CA 0.763 58.752 58.000 -0.018 0.000 1.286 4255 F CB -2.411 36.604 39.000 0.025 0.000 1.612 4255 F HN 0.227 nan 8.300 nan 0.000 0.335 4256 K N 1.257 121.711 120.400 0.090 0.000 2.202 4256 K HA 0.463 4.805 4.320 0.037 0.000 0.264 4256 K C 0.427 177.054 176.600 0.045 0.000 1.010 4256 K CA -0.274 56.052 56.287 0.066 0.000 0.940 4256 K CB 0.759 33.278 32.500 0.031 0.000 0.983 4256 K HN 0.415 nan 8.250 nan 0.000 0.475 4257 Q N 0.154 119.979 119.800 0.042 0.000 2.397 4257 Q HA 0.726 5.088 4.340 0.037 0.000 0.275 4257 Q C -1.723 174.291 176.000 0.024 0.000 1.090 4257 Q CA -1.243 54.576 55.803 0.027 0.000 0.809 4257 Q CB 2.156 30.909 28.738 0.025 0.000 1.362 4257 Q HN 0.525 nan 8.270 nan 0.000 0.431 4258 A N 1.952 124.788 122.820 0.027 0.000 2.355 4258 A HA 0.641 4.983 4.320 0.037 0.000 0.317 4258 A C -1.098 176.489 177.584 0.004 0.000 1.094 4258 A CA -0.666 51.407 52.037 0.060 0.000 0.764 4258 A CB 1.540 20.624 19.000 0.139 0.000 1.230 4258 A HN 0.796 nan 8.150 nan 0.000 0.448 4259 E N 0.246 120.446 120.200 -0.000 0.000 2.235 4259 E HA 0.778 5.150 4.350 0.037 0.000 0.265 4259 E C -1.082 175.517 176.600 -0.002 0.000 0.940 4259 E CA -0.398 55.922 56.400 -0.134 0.000 0.819 4259 E CB 2.087 31.732 29.700 -0.091 0.000 1.206 4259 E HN 0.669 nan 8.360 nan 0.000 0.409 4260 F N -1.966 117.965 119.950 -0.032 0.000 3.194 4260 F HA 0.338 4.887 4.527 0.037 0.000 0.327 4260 F C -1.738 174.041 175.800 -0.035 0.000 1.141 4260 F CA -1.186 56.791 58.000 -0.039 0.000 0.862 4260 F CB 0.851 39.823 39.000 -0.047 0.000 1.447 4260 F HN 0.182 nan 8.300 nan 0.000 0.479 4261 Q N 1.299 121.305 119.800 0.343 0.000 2.316 4261 Q HA 0.671 5.033 4.340 0.037 0.000 0.264 4261 Q C -1.282 174.867 176.000 0.248 0.000 0.987 4261 Q CA -0.755 55.152 55.803 0.174 0.000 0.852 4261 Q CB 2.997 31.773 28.738 0.064 0.000 1.287 4261 Q HN 0.569 nan 8.270 nan 0.000 0.448 4262 I N 3.842 124.499 120.570 0.145 0.000 2.307 4262 I HA 0.226 4.418 4.170 0.037 0.000 0.289 4262 I C -0.515 175.548 176.117 -0.090 0.000 1.021 4262 I CA -0.452 60.910 61.300 0.103 0.000 1.224 4262 I CB 0.623 38.726 38.000 0.171 0.000 1.376 4262 I HN 0.367 nan 8.210 nan 0.000 0.470 4263 L N 7.128 128.321 121.223 -0.050 0.000 2.260 4263 L HA 0.302 4.664 4.340 0.037 0.000 0.289 4263 L C -0.562 176.318 176.870 0.017 0.000 1.057 4263 L CA -0.825 53.949 54.840 -0.109 0.000 0.811 4263 L CB 0.024 42.065 42.059 -0.030 0.000 1.184 4263 L HN 0.393 nan 8.230 nan 0.000 0.429 4264 Y N 2.304 122.676 120.300 0.120 0.000 2.721 4264 Y HA 0.190 4.762 4.550 0.037 0.000 0.329 4264 Y C 1.484 177.503 175.900 0.199 0.000 1.211 4264 Y CA 0.560 58.765 58.100 0.175 0.000 1.512 4264 Y CB -0.063 38.461 38.460 0.106 0.000 1.249 4264 Y HN 0.863 nan 8.280 nan 0.000 0.549 4265 G N 1.998 111.112 108.800 0.523 0.000 2.176 4265 G HA2 -0.336 3.646 3.960 0.037 0.000 0.253 4265 G HA3 -0.336 3.646 3.960 0.037 0.000 0.253 4265 G C 0.822 175.748 174.900 0.044 0.000 0.979 4265 G CA 0.627 45.906 45.100 0.298 0.000 0.641 4265 G HN 0.635 nan 8.290 nan 0.000 0.530 4266 E N -1.358 118.862 120.200 0.034 0.000 2.444 4266 E HA 0.475 4.847 4.350 0.037 0.000 0.203 4266 E C 1.339 177.902 176.600 -0.063 0.000 0.847 4266 E CA 1.287 57.672 56.400 -0.025 0.000 1.142 4266 E CB 0.705 30.413 29.700 0.013 0.000 1.125 4266 E HN 1.628 nan 8.360 nan 0.000 0.521 4267 G N 0.604 109.397 108.800 -0.012 0.000 2.306 4267 G HA2 -0.095 3.887 3.960 0.037 0.000 0.262 4267 G HA3 -0.095 3.887 3.960 0.037 0.000 0.262 4267 G C -0.915 173.992 174.900 0.011 0.000 1.263 4267 G CA -0.470 44.620 45.100 -0.016 0.000 1.088 4267 G HN 0.139 nan 8.290 nan 0.000 0.489 4268 I N 1.534 122.086 120.570 -0.031 0.000 2.598 4268 I HA 0.063 4.255 4.170 0.037 0.000 0.284 4268 I C 0.652 176.744 176.117 -0.042 0.000 1.140 4268 I CA -0.226 61.029 61.300 -0.075 0.000 1.420 4268 I CB 0.704 38.537 38.000 -0.279 0.000 1.387 4268 I HN 0.435 nan 8.210 nan 0.000 0.553 4269 N N 6.513 125.217 118.700 0.008 0.000 2.671 4269 N HA -0.045 4.717 4.740 0.037 0.000 0.274 4269 N C 0.578 176.083 175.510 -0.008 0.000 1.188 4269 N CA 0.271 53.337 53.050 0.027 0.000 1.065 4269 N CB -0.148 38.368 38.487 0.049 0.000 1.415 4269 N HN 0.514 nan 8.380 nan 0.000 0.511 4270 F N 2.816 122.637 119.950 -0.215 0.000 2.113 4270 F HA -0.174 4.375 4.527 0.037 0.000 0.297 4270 F C 0.962 176.617 175.800 -0.242 0.000 1.103 4270 F CA 1.473 59.287 58.000 -0.311 0.000 1.248 4270 F CB -0.062 38.642 39.000 -0.492 0.000 0.999 4270 F HN 0.396 nan 8.300 nan 0.000 0.475 4271 Y N 0.514 120.928 120.300 0.190 0.000 2.293 4271 Y HA -0.007 4.565 4.550 0.037 0.000 0.291 4271 Y C 2.654 178.538 175.900 -0.026 0.000 1.137 4271 Y CA 0.842 58.996 58.100 0.090 0.000 1.202 4271 Y CB -1.437 37.077 38.460 0.090 0.000 0.990 4271 Y HN 0.129 nan 8.280 nan 0.000 0.537 4272 G N 0.087 108.949 108.800 0.103 0.000 2.514 4272 G HA2 -0.295 3.687 3.960 0.037 0.000 0.217 4272 G HA3 -0.295 3.687 3.960 0.037 0.000 0.217 4272 G C 1.522 176.407 174.900 -0.025 0.000 1.198 4272 G CA 1.272 46.387 45.100 0.025 0.000 0.780 4272 G HN 0.421 nan 8.290 nan 0.000 0.565 4273 E N -0.250 119.897 120.200 -0.089 0.000 2.070 4273 E HA -0.172 4.200 4.350 0.037 0.000 0.197 4273 E C 2.419 178.927 176.600 -0.152 0.000 1.004 4273 E CA 1.049 57.363 56.400 -0.143 0.000 0.805 4273 E CB -0.262 29.266 29.700 -0.287 0.000 0.744 4273 E HN 0.311 nan 8.360 nan 0.000 0.451 4274 L N 0.746 121.850 121.223 -0.198 0.000 2.042 4274 L HA -0.170 4.192 4.340 0.037 0.000 0.210 4274 L C 2.222 179.083 176.870 -0.016 0.000 1.076 4274 L CA 1.358 56.129 54.840 -0.116 0.000 0.749 4274 L CB -0.374 41.673 42.059 -0.021 0.000 0.893 4274 L HN -0.031 nan 8.230 nan 0.000 0.432 4275 V N -0.204 119.712 119.914 0.004 0.000 2.233 4275 V HA -0.320 3.822 4.120 0.037 0.000 0.247 4275 V C 2.325 178.445 176.094 0.043 0.000 1.050 4275 V CA 2.095 64.399 62.300 0.007 0.000 1.010 4275 V CB -0.762 31.015 31.823 -0.078 0.000 0.637 4275 V HN 0.429 nan 8.190 nan 0.000 0.444 4276 D N -0.147 120.269 120.400 0.026 0.000 2.097 4276 D HA -0.126 4.536 4.640 0.037 0.000 0.195 4276 D C 2.149 178.474 176.300 0.041 0.000 0.989 4276 D CA 1.002 55.032 54.000 0.050 0.000 0.827 4276 D CB -0.305 40.513 40.800 0.030 0.000 0.966 4276 D HN 0.166 nan 8.370 nan 0.000 0.456 4277 L N 0.606 121.833 121.223 0.008 0.000 2.046 4277 L HA -0.079 4.283 4.340 0.037 0.000 0.208 4277 L C 2.473 179.361 176.870 0.030 0.000 1.077 4277 L CA 1.676 56.519 54.840 0.004 0.000 0.747 4277 L CB -1.551 40.486 42.059 -0.036 0.000 0.896 4277 L HN 0.095 nan 8.230 nan 0.000 0.432 4278 G N -0.835 107.990 108.800 0.041 0.000 2.418 4278 G HA2 -0.165 3.817 3.960 0.037 0.000 0.217 4278 G HA3 -0.165 3.817 3.960 0.037 0.000 0.217 4278 G C 1.726 176.685 174.900 0.098 0.000 1.158 4278 G CA 0.894 46.037 45.100 0.071 0.000 0.771 4278 G HN 0.263 nan 8.290 nan 0.000 0.545 4279 V N 0.655 120.637 119.914 0.114 0.000 2.427 4279 V HA -0.117 4.025 4.120 0.037 0.000 0.248 4279 V C 2.667 178.806 176.094 0.075 0.000 1.051 4279 V CA 2.026 64.397 62.300 0.117 0.000 1.048 4279 V CB -0.340 31.580 31.823 0.161 0.000 0.666 4279 V HN 0.340 nan 8.190 nan 0.000 0.456 4280 K N -0.133 120.306 120.400 0.064 0.000 2.097 4280 K HA -0.162 4.180 4.320 0.037 0.000 0.206 4280 K C 1.837 178.462 176.600 0.043 0.000 1.049 4280 K CA 1.193 57.507 56.287 0.046 0.000 0.933 4280 K CB 0.021 32.544 32.500 0.038 0.000 0.717 4280 K HN 0.364 nan 8.250 nan 0.000 0.442 4281 E N 0.628 120.857 120.200 0.049 0.000 2.489 4281 E HA -0.023 4.349 4.350 0.037 0.000 0.193 4281 E C -0.076 176.557 176.600 0.055 0.000 1.057 4281 E CA 0.173 56.601 56.400 0.048 0.000 0.866 4281 E CB 0.455 30.184 29.700 0.049 0.000 0.916 4281 E HN 0.155 nan 8.360 nan 0.000 0.500 4282 K N -0.416 120.019 120.400 0.060 0.000 3.281 4282 K HA -0.193 4.149 4.320 0.037 0.000 0.295 4282 K C 1.009 177.659 176.600 0.083 0.000 1.233 4282 K CA 0.445 56.768 56.287 0.059 0.000 0.866 4282 K CB -2.105 30.418 32.500 0.040 0.000 1.265 4282 K HN 0.256 nan 8.250 nan 0.000 0.482 4283 L N -0.335 120.957 121.223 0.116 0.000 2.270 4283 L HA 0.171 4.533 4.340 0.037 0.000 0.210 4283 L C 1.179 178.211 176.870 0.270 0.000 1.104 4283 L CA 0.668 55.619 54.840 0.184 0.000 0.804 4283 L CB 0.082 42.256 42.059 0.191 0.000 0.937 4283 L HN 0.106 nan 8.230 nan 0.000 0.450 4284 I N -0.342 120.354 120.570 0.212 0.000 2.404 4284 I HA 0.202 4.394 4.170 0.037 0.000 0.293 4284 I C -0.253 175.952 176.117 0.147 0.000 0.992 4284 I CA -0.608 60.833 61.300 0.235 0.000 1.149 4284 I CB 2.137 40.279 38.000 0.235 0.000 1.315 4284 I HN -0.127 nan 8.210 nan 0.000 0.446 4285 E N 5.523 125.791 120.200 0.113 0.000 2.259 4285 E HA 0.224 4.596 4.350 0.037 0.000 0.281 4285 E C -0.705 175.878 176.600 -0.029 0.000 1.027 4285 E CA -0.279 56.141 56.400 0.034 0.000 0.838 4285 E CB 0.963 30.672 29.700 0.014 0.000 1.066 4285 E HN 0.275 nan 8.360 nan 0.000 0.401 4286 K N 2.742 123.077 120.400 -0.108 0.000 2.464 4286 K HA 0.489 4.831 4.320 0.037 0.000 0.252 4286 K C -1.345 175.154 176.600 -0.169 0.000 1.000 4286 K CA -0.594 55.521 56.287 -0.287 0.000 0.951 4286 K CB 0.915 33.178 32.500 -0.395 0.000 1.183 4286 K HN 0.515 nan 8.250 nan 0.000 0.445 4287 A N 3.736 126.493 122.820 -0.104 0.000 3.016 4287 A HA 0.500 4.842 4.320 0.037 0.000 0.303 4287 A C 0.923 178.515 177.584 0.014 0.000 1.507 4287 A CA 0.368 52.390 52.037 -0.025 0.000 1.196 4287 A CB -0.478 18.524 19.000 0.004 0.000 1.169 4287 A HN 1.056 nan 8.150 nan 0.000 0.544 4288 G N 1.411 110.187 108.800 -0.040 0.000 2.889 4288 G HA2 -0.137 3.845 3.960 0.037 0.000 0.308 4288 G HA3 -0.137 3.845 3.960 0.037 0.000 0.308 4288 G C 1.332 176.193 174.900 -0.065 0.000 1.248 4288 G CA 0.787 45.875 45.100 -0.020 0.000 0.982 4288 G HN 1.890 nan 8.290 nan 0.000 0.571 4289 A N -0.776 122.037 122.820 -0.011 0.000 2.348 4289 A HA 0.544 4.886 4.320 0.037 0.000 0.224 4289 A C 0.455 177.945 177.584 -0.156 0.000 1.227 4289 A CA 0.462 52.450 52.037 -0.081 0.000 0.885 4289 A CB 0.060 19.003 19.000 -0.094 0.000 0.933 4289 A HN 0.546 nan 8.150 nan 0.000 0.506 4290 W N -0.702 120.534 121.300 -0.106 0.000 2.390 4290 W HA 0.575 5.257 4.660 0.037 0.000 0.312 4290 W C -0.857 175.553 176.519 -0.182 0.000 1.123 4290 W CA -0.081 57.229 57.345 -0.057 0.000 1.202 4290 W CB 0.577 30.007 29.460 -0.051 0.000 1.251 4290 W HN 0.187 nan 8.180 nan 0.000 0.511 4291 Y N 2.355 122.760 120.300 0.175 0.000 2.328 4291 Y HA 0.459 5.031 4.550 0.037 0.000 0.337 4291 Y C 0.293 176.231 175.900 0.063 0.000 0.966 4291 Y CA -0.586 57.562 58.100 0.081 0.000 1.136 4291 Y CB 1.517 39.981 38.460 0.007 0.000 1.170 4291 Y HN 0.140 nan 8.280 nan 0.000 0.470 4292 S N 3.015 118.807 115.700 0.152 0.000 2.500 4292 S HA 0.406 4.898 4.470 0.037 0.000 0.301 4292 S C -1.827 172.839 174.600 0.111 0.000 1.092 4292 S CA -0.757 57.486 58.200 0.071 0.000 1.030 4292 S CB 1.110 64.322 63.200 0.021 0.000 1.031 4292 S HN 0.498 nan 8.310 nan 0.000 0.483 4293 Y N 2.873 123.117 120.300 -0.093 0.000 2.326 4293 Y HA 0.370 4.942 4.550 0.037 0.000 0.331 4293 Y C 0.205 176.089 175.900 -0.027 0.000 0.962 4293 Y CA -0.985 57.088 58.100 -0.046 0.000 1.167 4293 Y CB 0.522 38.955 38.460 -0.045 0.000 1.148 4293 Y HN 0.804 nan 8.280 nan 0.000 0.463 4294 K N 4.959 125.031 120.400 -0.547 0.000 3.156 4294 K HA -0.267 4.075 4.320 0.037 0.000 0.266 4294 K C 0.964 177.438 176.600 -0.210 0.000 0.966 4294 K CA 0.999 57.018 56.287 -0.447 0.000 0.719 4294 K CB -1.620 30.502 32.500 -0.630 0.000 1.333 4294 K HN 1.323 nan 8.250 nan 0.000 0.468 4295 G N 0.152 108.870 108.800 -0.137 0.000 2.320 4295 G HA2 -0.377 3.605 3.960 0.037 0.000 0.242 4295 G HA3 -0.377 3.605 3.960 0.037 0.000 0.242 4295 G C -0.045 174.809 174.900 -0.077 0.000 1.033 4295 G CA 0.518 45.563 45.100 -0.092 0.000 0.620 4295 G HN 0.518 nan 8.290 nan 0.000 0.517 4296 E N 1.724 121.880 120.200 -0.074 0.000 2.259 4296 E HA 0.359 4.731 4.350 0.037 0.000 0.281 4296 E C 0.185 176.726 176.600 -0.098 0.000 1.037 4296 E CA -0.500 55.862 56.400 -0.064 0.000 0.854 4296 E CB 0.255 29.941 29.700 -0.023 0.000 1.051 4296 E HN 0.324 nan 8.360 nan 0.000 0.409 4297 K N 5.096 125.449 120.400 -0.078 0.000 2.379 4297 K HA 0.113 4.455 4.320 0.037 0.000 0.284 4297 K C 0.930 177.446 176.600 -0.140 0.000 1.044 4297 K CA 0.075 56.350 56.287 -0.020 0.000 0.974 4297 K CB 0.644 33.170 32.500 0.044 0.000 0.962 4297 K HN 0.574 nan 8.250 nan 0.000 0.474 4298 I N -1.657 118.761 120.570 -0.252 0.000 4.187 4298 I HA 0.289 4.481 4.170 0.037 0.000 0.326 4298 I C 0.616 176.534 176.117 -0.332 0.000 1.302 4298 I CA -0.295 60.558 61.300 -0.745 0.000 1.196 4298 I CB 0.997 38.229 38.000 -1.280 0.000 1.095 4298 I HN 0.540 nan 8.210 nan 0.000 0.411 4299 G N 0.763 109.534 108.800 -0.048 0.000 2.523 4299 G HA2 0.376 4.357 3.960 0.037 0.000 0.291 4299 G HA3 0.376 4.357 3.960 0.037 0.000 0.291 4299 G C -2.102 172.696 174.900 -0.169 0.000 1.450 4299 G CA -0.578 44.482 45.100 -0.067 0.000 0.790 4299 G HN 0.118 nan 8.290 nan 0.000 0.496 4300 Q N 0.111 119.689 119.800 -0.370 0.000 2.363 4300 Q HA 0.529 4.891 4.340 0.037 0.000 0.265 4300 Q C 0.125 175.974 176.000 -0.252 0.000 1.032 4300 Q CA 0.232 55.660 55.803 -0.624 0.000 0.746 4300 Q CB 1.114 29.254 28.738 -0.997 0.000 1.237 4300 Q HN 2.198 nan 8.270 nan 0.000 0.475 4301 G N 2.873 111.672 108.800 -0.001 0.000 2.764 4301 G HA2 -0.263 3.719 3.960 0.037 0.000 0.686 4301 G HA3 -0.263 3.719 3.960 0.037 0.000 0.686 4301 G C 0.193 175.037 174.900 -0.094 0.000 1.258 4301 G CA 0.019 45.169 45.100 0.083 0.000 0.846 4301 G HN 0.758 nan 8.290 nan 0.000 0.596 4302 K N 1.180 121.505 120.400 -0.124 0.000 2.144 4302 K HA -0.195 4.147 4.320 0.037 0.000 0.209 4302 K C 2.896 179.360 176.600 -0.227 0.000 1.047 4302 K CA 2.718 58.801 56.287 -0.340 0.000 0.927 4302 K CB -0.350 32.074 32.500 -0.127 0.000 0.716 4302 K HN 1.241 nan 8.250 nan 0.000 0.454 4303 A N 1.323 124.068 122.820 -0.125 0.000 1.869 4303 A HA -0.285 4.057 4.320 0.037 0.000 0.218 4303 A C 1.761 179.293 177.584 -0.086 0.000 1.203 4303 A CA 2.319 54.306 52.037 -0.083 0.000 0.638 4303 A CB -0.967 17.997 19.000 -0.059 0.000 0.831 4303 A HN 0.624 nan 8.150 nan 0.000 0.450 4304 N N -0.254 118.383 118.700 -0.104 0.000 2.216 4304 N HA 0.077 4.839 4.740 0.037 0.000 0.183 4304 N C 1.957 177.438 175.510 -0.049 0.000 1.017 4304 N CA 0.931 53.941 53.050 -0.067 0.000 0.861 4304 N CB -0.270 38.168 38.487 -0.081 0.000 0.986 4304 N HN 0.501 nan 8.380 nan 0.000 0.428 4305 A N 0.799 123.518 122.820 -0.168 0.000 1.908 4305 A HA -0.187 4.155 4.320 0.037 0.000 0.218 4305 A C 2.265 179.819 177.584 -0.050 0.000 1.181 4305 A CA 1.925 53.855 52.037 -0.177 0.000 0.627 4305 A CB -1.152 17.498 19.000 -0.583 0.000 0.818 4305 A HN 0.230 nan 8.150 nan 0.000 0.445 4306 T N 0.363 114.862 114.554 -0.092 0.000 2.652 4306 T HA -0.062 4.310 4.350 0.037 0.000 0.267 4306 T C 2.222 176.899 174.700 -0.038 0.000 1.039 4306 T CA 1.787 63.874 62.100 -0.021 0.000 1.153 4306 T CB -0.544 68.323 68.868 -0.002 0.000 0.863 4306 T HN 0.631 nan 8.240 nan 0.000 0.428 4307 A N 0.043 122.849 122.820 -0.023 0.000 1.972 4307 A HA -0.108 4.234 4.320 0.037 0.000 0.219 4307 A C 2.035 179.596 177.584 -0.038 0.000 1.169 4307 A CA 1.450 53.465 52.037 -0.037 0.000 0.635 4307 A CB -1.028 17.968 19.000 -0.008 0.000 0.810 4307 A HN 0.721 nan 8.150 nan 0.000 0.446 4308 W N 0.278 121.492 121.300 -0.143 0.000 2.407 4308 W HA -0.043 4.639 4.660 0.037 0.000 0.305 4308 W C 1.728 178.137 176.519 -0.183 0.000 1.196 4308 W CA 1.554 58.824 57.345 -0.124 0.000 1.311 4308 W CB -0.228 29.189 29.460 -0.071 0.000 1.135 4308 W HN 0.227 nan 8.180 nan 0.000 0.514 4309 L N 0.743 121.946 121.223 -0.032 0.000 2.191 4309 L HA -0.222 4.140 4.340 0.037 0.000 0.212 4309 L C 2.480 178.902 176.870 -0.747 0.000 1.103 4309 L CA 1.414 56.069 54.840 -0.308 0.000 0.769 4309 L CB -0.718 41.266 42.059 -0.125 0.000 0.908 4309 L HN -0.041 nan 8.230 nan 0.000 0.438 4310 K N -0.006 119.920 120.400 -0.791 0.000 2.026 4310 K HA -0.193 4.149 4.320 0.037 0.000 0.208 4310 K C 1.538 177.846 176.600 -0.487 0.000 1.048 4310 K CA 1.781 57.596 56.287 -0.787 0.000 0.929 4310 K CB 0.026 32.281 32.500 -0.408 0.000 0.713 4310 K HN 0.220 nan 8.250 nan 0.000 0.439 4311 D N 0.037 120.167 120.400 -0.450 0.000 2.277 4311 D HA -0.051 4.611 4.640 0.037 0.000 0.208 4311 D C -0.264 175.745 176.300 -0.485 0.000 0.962 4311 D CA 0.864 54.622 54.000 -0.404 0.000 0.865 4311 D CB 0.012 40.588 40.800 -0.374 0.000 0.939 4311 D HN 0.131 nan 8.370 nan 0.000 0.510 4312 N N 0.257 118.558 118.700 -0.666 0.000 3.012 4312 N HA 0.196 4.957 4.740 0.037 0.000 0.270 4312 N C -2.129 173.150 175.510 -0.386 0.000 1.469 4312 N CA -1.141 51.548 53.050 -0.602 0.000 0.928 4312 N CB 1.709 39.584 38.487 -1.021 0.000 1.219 4312 N HN -0.072 nan 8.380 nan 0.000 0.492 4313 P HA -0.119 nan 4.420 nan 0.000 0.220 4313 P C 0.974 178.226 177.300 -0.080 0.000 1.148 4313 P CA 1.050 64.070 63.100 -0.134 0.000 0.803 4313 P CB 0.505 32.151 31.700 -0.090 0.000 0.782 4314 E N -0.489 119.654 120.200 -0.095 0.000 2.051 4314 E HA -0.110 4.262 4.350 0.037 0.000 0.192 4314 E C 1.853 178.439 176.600 -0.024 0.000 0.991 4314 E CA 1.622 57.994 56.400 -0.047 0.000 0.799 4314 E CB -1.560 28.114 29.700 -0.043 0.000 0.748 4314 E HN 0.293 nan 8.360 nan 0.000 0.449 4315 T N 1.507 116.030 114.554 -0.053 0.000 2.867 4315 T HA -0.000 4.372 4.350 0.037 0.000 0.268 4315 T C 2.030 176.705 174.700 -0.041 0.000 1.057 4315 T CA 1.164 63.260 62.100 -0.008 0.000 1.136 4315 T CB -0.167 68.716 68.868 0.026 0.000 0.874 4315 T HN 0.258 nan 8.240 nan 0.000 0.466 4316 A N 2.291 125.081 122.820 -0.049 0.000 1.877 4316 A HA -0.112 4.230 4.320 0.037 0.000 0.216 4316 A C 2.339 179.974 177.584 0.085 0.000 1.186 4316 A CA 1.134 53.194 52.037 0.037 0.000 0.620 4316 A CB -0.326 18.738 19.000 0.106 0.000 0.822 4316 A HN 0.208 nan 8.150 nan 0.000 0.443 4317 K N -0.191 120.247 120.400 0.064 0.000 2.063 4317 K HA -0.202 4.140 4.320 0.037 0.000 0.208 4317 K C 1.939 178.574 176.600 0.058 0.000 1.048 4317 K CA 1.640 57.964 56.287 0.062 0.000 0.928 4317 K CB -0.453 32.067 32.500 0.032 0.000 0.713 4317 K HN 0.786 nan 8.250 nan 0.000 0.442 4318 E N 0.700 120.930 120.200 0.050 0.000 2.085 4318 E HA -0.163 4.209 4.350 0.037 0.000 0.194 4318 E C 2.071 178.713 176.600 0.071 0.000 0.994 4318 E CA 1.013 57.454 56.400 0.068 0.000 0.801 4318 E CB -0.017 29.741 29.700 0.097 0.000 0.743 4318 E HN 0.252 nan 8.360 nan 0.000 0.453 4319 I N 0.796 121.384 120.570 0.030 0.000 2.233 4319 I HA -0.202 3.990 4.170 0.037 0.000 0.243 4319 I C 2.697 178.844 176.117 0.050 0.000 1.093 4319 I CA 1.108 62.421 61.300 0.021 0.000 1.380 4319 I CB -0.387 37.565 38.000 -0.080 0.000 1.067 4319 I HN 0.216 nan 8.210 nan 0.000 0.413 4320 E N 1.828 122.069 120.200 0.068 0.000 2.070 4320 E HA -0.314 4.058 4.350 0.037 0.000 0.197 4320 E C 2.261 178.901 176.600 0.065 0.000 1.004 4320 E CA 1.566 58.015 56.400 0.081 0.000 0.805 4320 E CB -0.030 29.762 29.700 0.153 0.000 0.744 4320 E HN 0.282 nan 8.360 nan 0.000 0.451 4321 K N 0.608 121.047 120.400 0.065 0.000 2.044 4321 K HA -0.223 4.119 4.320 0.037 0.000 0.210 4321 K C 2.185 178.816 176.600 0.050 0.000 1.049 4321 K CA 1.772 58.091 56.287 0.054 0.000 0.927 4321 K CB -0.039 32.491 32.500 0.051 0.000 0.713 4321 K HN 0.011 nan 8.250 nan 0.000 0.443 4322 K N 0.054 120.489 120.400 0.059 0.000 2.097 4322 K HA -0.093 4.249 4.320 0.037 0.000 0.206 4322 K C 2.001 178.631 176.600 0.050 0.000 1.049 4322 K CA 1.119 57.442 56.287 0.060 0.000 0.933 4322 K CB 0.041 32.589 32.500 0.081 0.000 0.717 4322 K HN -0.024 nan 8.250 nan 0.000 0.442 4323 V N 1.175 121.116 119.914 0.045 0.000 2.295 4323 V HA -0.253 3.889 4.120 0.037 0.000 0.246 4323 V C 2.152 178.261 176.094 0.025 0.000 1.049 4323 V CA 1.685 64.003 62.300 0.031 0.000 1.024 4323 V CB -0.430 31.402 31.823 0.016 0.000 0.648 4323 V HN 0.280 nan 8.190 nan 0.000 0.447 4324 R N -0.105 120.411 120.500 0.027 0.000 2.091 4324 R HA -0.190 4.172 4.340 0.037 0.000 0.238 4324 R C 2.316 178.631 176.300 0.025 0.000 1.136 4324 R CA 1.833 57.947 56.100 0.024 0.000 0.959 4324 R CB -0.337 29.981 30.300 0.030 0.000 0.856 4324 R HN 0.625 nan 8.270 nan 0.000 0.437 4325 E N 0.608 120.826 120.200 0.030 0.000 2.077 4325 E HA -0.169 4.203 4.350 0.037 0.000 0.193 4325 E C 2.033 178.650 176.600 0.028 0.000 0.989 4325 E CA 0.951 57.368 56.400 0.029 0.000 0.800 4325 E CB -0.068 29.651 29.700 0.032 0.000 0.746 4325 E HN 0.291 nan 8.360 nan 0.000 0.452 4326 L N 0.146 121.387 121.223 0.030 0.000 2.217 4326 L HA -0.108 4.254 4.340 0.037 0.000 0.211 4326 L C 1.920 178.806 176.870 0.026 0.000 1.107 4326 L CA 0.820 55.678 54.840 0.030 0.000 0.783 4326 L CB 0.126 42.205 42.059 0.034 0.000 0.919 4326 L HN 0.162 nan 8.230 nan 0.000 0.442 4327 L N -1.813 119.424 121.223 0.023 0.000 3.039 4327 L HA 0.211 4.573 4.340 0.037 0.000 0.269 4327 L C 0.649 177.530 176.870 0.019 0.000 1.169 4327 L CA -0.300 54.553 54.840 0.020 0.000 0.986 4327 L CB 0.656 42.724 42.059 0.016 0.000 1.377 4327 L HN 0.062 nan 8.230 nan 0.000 0.575 4328 L N 0.000 121.234 121.223 0.018 0.000 2.949 4328 L HA 0.000 4.362 4.340 0.037 0.000 0.249 4328 L CA 0.000 54.850 54.840 0.016 0.000 0.813 4328 L CB 0.000 42.068 42.059 0.015 0.000 0.961 4328 L HN 0.000 nan 8.230 nan 0.000 0.502