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 1qpo_1_E DATA FIRST_RESID 2002 DATA SEQUENCE GLSDWELAAA RAAIARGLDE DLRYGPDVTT LATVPASATT TASLVTREAG DATA SEQUENCE VVAGLDVALL TLNEVLGTNG YRVLDRVEDG ARVPPGEALM TLEAQTRGLL DATA SEQUENCE TAERTMLNLV GHLSGIATAT AAWVDAVRGT KAKIRDTRKT LPGLRALQKY DATA SEQUENCE AVRTGGGVNH RLGLGDAALI KDNHVAAAGS VVDALRAVRN AAPDLPCEVE DATA SEQUENCE VDSLEQLDAV LPEKPELILL DNFAVWQTQT AVQRRDSRAP TVMLESSGGL DATA SEQUENCE SLQTAATYAE TGVDYLAVGA LTHSVRVLDI GLDM 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 2002 G HA2 0.000 nan 3.960 nan 0.000 0.244 2002 G HA3 0.000 3.960 3.960 -0.000 0.000 0.244 2002 G C 0.000 174.852 174.900 -0.080 0.000 0.946 2002 G CA 0.000 45.108 45.100 0.013 0.000 0.502 2003 L N 3.253 124.348 121.223 -0.214 0.000 2.416 2003 L HA 0.450 4.790 4.340 -0.000 0.000 0.272 2003 L C 1.385 178.169 176.870 -0.142 0.000 1.161 2003 L CA -0.195 54.452 54.840 -0.323 0.000 0.845 2003 L CB 1.316 43.161 42.059 -0.357 0.000 1.119 2003 L HN 0.492 nan 8.230 nan 0.000 0.464 2004 S N 0.772 116.413 115.700 -0.099 0.000 2.632 2004 S HA 0.165 4.634 4.470 -0.000 0.000 0.267 2004 S C 0.503 175.101 174.600 -0.004 0.000 1.193 2004 S CA -0.587 57.606 58.200 -0.012 0.000 1.003 2004 S CB 0.928 64.157 63.200 0.049 0.000 1.073 2004 S HN 0.617 nan 8.310 nan 0.000 0.553 2005 D N 0.256 120.687 120.400 0.052 0.000 2.078 2005 D HA -0.098 4.542 4.640 -0.000 0.000 0.193 2005 D C 1.576 177.958 176.300 0.137 0.000 0.990 2005 D CA 1.532 55.577 54.000 0.075 0.000 0.827 2005 D CB -0.390 40.464 40.800 0.089 0.000 0.975 2005 D HN 0.722 nan 8.370 nan 0.000 0.451 2006 W N 1.712 122.997 121.300 -0.024 0.000 2.321 2006 W HA -0.259 4.401 4.660 -0.000 0.000 0.306 2006 W C 1.533 178.033 176.519 -0.031 0.000 1.217 2006 W CA 1.283 58.616 57.345 -0.021 0.000 1.257 2006 W CB 0.026 29.479 29.460 -0.012 0.000 1.145 2006 W HN 0.061 nan 8.180 nan 0.000 0.509 2007 E N 0.203 120.243 120.200 -0.266 0.000 2.072 2007 E HA -0.240 4.109 4.350 -0.000 0.000 0.190 2007 E C 2.252 178.661 176.600 -0.318 0.000 0.982 2007 E CA 1.019 57.153 56.400 -0.444 0.000 0.803 2007 E CB -0.479 29.010 29.700 -0.351 0.000 0.755 2007 E HN 0.117 nan 8.360 nan 0.000 0.453 2008 L N 0.853 121.965 121.223 -0.185 0.000 2.046 2008 L HA -0.141 4.199 4.340 -0.000 0.000 0.208 2008 L C 2.298 179.102 176.870 -0.110 0.000 1.077 2008 L CA 1.921 56.682 54.840 -0.132 0.000 0.747 2008 L CB -1.154 40.863 42.059 -0.071 0.000 0.896 2008 L HN 0.097 nan 8.230 nan 0.000 0.432 2009 A N -0.543 122.232 122.820 -0.076 0.000 1.877 2009 A HA -0.144 4.176 4.320 -0.000 0.000 0.216 2009 A C 2.473 179.993 177.584 -0.107 0.000 1.186 2009 A CA 1.861 53.878 52.037 -0.034 0.000 0.620 2009 A CB -0.744 18.305 19.000 0.081 0.000 0.822 2009 A HN 0.479 nan 8.150 nan 0.000 0.443 2010 A N -0.138 122.521 122.820 -0.268 0.000 1.902 2010 A HA 0.151 4.471 4.320 -0.000 0.000 0.217 2010 A C 2.517 179.973 177.584 -0.213 0.000 1.181 2010 A CA 2.175 54.008 52.037 -0.340 0.000 0.623 2010 A CB -1.064 17.533 19.000 -0.672 0.000 0.818 2010 A HN 1.051 nan 8.150 nan 0.000 0.443 2011 A N -0.046 122.651 122.820 -0.205 0.000 1.865 2011 A HA -0.202 4.118 4.320 -0.000 0.000 0.217 2011 A C 2.242 179.768 177.584 -0.097 0.000 1.191 2011 A CA 1.660 53.611 52.037 -0.144 0.000 0.623 2011 A CB -0.569 18.343 19.000 -0.147 0.000 0.826 2011 A HN 0.546 nan 8.150 nan 0.000 0.444 2012 R N -0.629 119.822 120.500 -0.082 0.000 2.091 2012 R HA -0.147 4.193 4.340 -0.000 0.000 0.238 2012 R C 2.424 178.698 176.300 -0.043 0.000 1.136 2012 R CA 1.316 57.385 56.100 -0.051 0.000 0.959 2012 R CB -0.494 29.785 30.300 -0.034 0.000 0.856 2012 R HN 0.541 nan 8.270 nan 0.000 0.437 2013 A N 0.999 123.790 122.820 -0.049 0.000 1.930 2013 A HA -0.034 4.286 4.320 -0.000 0.000 0.217 2013 A C 2.332 179.891 177.584 -0.041 0.000 1.175 2013 A CA 1.476 53.492 52.037 -0.035 0.000 0.627 2013 A CB -0.447 18.537 19.000 -0.027 0.000 0.815 2013 A HN 0.392 nan 8.150 nan 0.000 0.443 2014 A N 0.544 123.329 122.820 -0.059 0.000 1.873 2014 A HA -0.008 4.312 4.320 -0.000 0.000 0.215 2014 A C 2.099 179.655 177.584 -0.046 0.000 1.186 2014 A CA 1.582 53.585 52.037 -0.056 0.000 0.616 2014 A CB -0.741 18.216 19.000 -0.072 0.000 0.823 2014 A HN 1.079 nan 8.150 nan 0.000 0.442 2015 I N -1.338 119.205 120.570 -0.046 0.000 2.286 2015 I HA -0.068 4.102 4.170 -0.000 0.000 0.248 2015 I C 2.248 178.348 176.117 -0.029 0.000 1.115 2015 I CA 1.742 63.020 61.300 -0.037 0.000 1.392 2015 I CB -0.659 37.318 38.000 -0.039 0.000 1.065 2015 I HN 0.165 nan 8.210 nan 0.000 0.418 2016 A N 1.191 123.995 122.820 -0.027 0.000 1.902 2016 A HA -0.145 4.175 4.320 -0.000 0.000 0.217 2016 A C 2.494 180.067 177.584 -0.019 0.000 1.181 2016 A CA 1.759 53.784 52.037 -0.020 0.000 0.623 2016 A CB -0.685 18.305 19.000 -0.017 0.000 0.818 2016 A HN 0.538 nan 8.150 nan 0.000 0.443 2017 R N -0.979 119.508 120.500 -0.021 0.000 2.075 2017 R HA -0.074 4.266 4.340 -0.000 0.000 0.232 2017 R C 2.394 178.685 176.300 -0.016 0.000 1.126 2017 R CA 1.066 57.155 56.100 -0.018 0.000 0.963 2017 R CB -0.579 29.709 30.300 -0.020 0.000 0.858 2017 R HN 0.525 nan 8.270 nan 0.000 0.435 2018 G N 1.066 109.854 108.800 -0.020 0.000 2.408 2018 G HA2 -0.201 3.759 3.960 -0.000 0.000 0.217 2018 G HA3 -0.201 3.759 3.960 -0.000 0.000 0.217 2018 G C 1.443 176.340 174.900 -0.005 0.000 1.150 2018 G CA 0.341 45.432 45.100 -0.014 0.000 0.776 2018 G HN 0.111 nan 8.290 nan 0.000 0.542 2019 L N 0.224 121.441 121.223 -0.010 0.000 2.056 2019 L HA -0.023 4.317 4.340 -0.000 0.000 0.207 2019 L C 2.529 179.397 176.870 -0.003 0.000 1.078 2019 L CA 1.365 56.202 54.840 -0.006 0.000 0.749 2019 L CB -0.301 41.751 42.059 -0.011 0.000 0.901 2019 L HN 0.196 nan 8.230 nan 0.000 0.433 2020 D N 0.160 120.553 120.400 -0.011 0.000 2.144 2020 D HA -0.211 4.429 4.640 -0.000 0.000 0.199 2020 D C 2.018 178.310 176.300 -0.014 0.000 0.984 2020 D CA 1.250 55.237 54.000 -0.021 0.000 0.834 2020 D CB 0.159 40.942 40.800 -0.028 0.000 0.955 2020 D HN 0.275 nan 8.370 nan 0.000 0.465 2021 E N -0.370 119.837 120.200 0.011 0.000 2.110 2021 E HA -0.164 4.186 4.350 -0.000 0.000 0.193 2021 E C 1.376 178.044 176.600 0.113 0.000 0.988 2021 E CA 1.081 57.515 56.400 0.056 0.000 0.804 2021 E CB 0.023 29.752 29.700 0.049 0.000 0.745 2021 E HN 0.317 nan 8.360 nan 0.000 0.458 2022 D N -0.045 120.399 120.400 0.073 0.000 2.194 2022 D HA -0.010 4.630 4.640 -0.000 0.000 0.204 2022 D C 1.520 177.882 176.300 0.103 0.000 0.964 2022 D CA 0.659 54.713 54.000 0.089 0.000 0.846 2022 D CB 0.291 41.117 40.800 0.044 0.000 0.962 2022 D HN 0.111 nan 8.370 nan 0.000 0.490 2023 L N -0.185 121.067 121.223 0.049 0.000 2.640 2023 L HA 0.257 4.597 4.340 -0.000 0.000 0.230 2023 L C 2.157 179.004 176.870 -0.039 0.000 1.123 2023 L CA -0.129 54.724 54.840 0.023 0.000 0.900 2023 L CB 0.138 42.198 42.059 0.001 0.000 1.146 2023 L HN -0.125 nan 8.230 nan 0.000 0.484 2024 R N 0.615 121.041 120.500 -0.123 0.000 2.139 2024 R HA -0.202 4.137 4.340 -0.000 0.000 0.243 2024 R C 1.145 177.107 176.300 -0.562 0.000 1.145 2024 R CA 1.813 57.682 56.100 -0.384 0.000 0.976 2024 R CB -0.095 29.855 30.300 -0.583 0.000 0.866 2024 R HN 0.338 nan 8.270 nan 0.000 0.449 2025 Y N -0.468 119.829 120.300 -0.005 0.000 2.493 2025 Y HA 0.368 4.918 4.550 -0.000 0.000 0.275 2025 Y C 0.910 176.807 175.900 -0.004 0.000 1.183 2025 Y CA 0.311 58.409 58.100 -0.004 0.000 1.258 2025 Y CB 0.732 39.189 38.460 -0.004 0.000 1.108 2025 Y HN 0.328 nan 8.280 nan 0.000 0.521 2026 G N 0.506 109.332 108.800 0.044 0.000 2.479 2026 G HA2 -0.064 3.896 3.960 -0.000 0.000 0.686 2026 G HA3 -0.064 3.896 3.960 -0.000 0.000 0.686 2026 G C -2.928 171.997 174.900 0.042 0.000 1.295 2026 G CA -1.245 43.877 45.100 0.036 0.000 0.922 2026 G HN -0.040 nan 8.290 nan 0.000 0.582 2027 P HA 0.311 nan 4.420 nan 0.000 0.275 2027 P C -0.704 176.613 177.300 0.029 0.000 1.266 2027 P CA -0.277 62.837 63.100 0.024 0.000 0.793 2027 P CB 0.719 32.428 31.700 0.015 0.000 1.074 2028 D N 0.496 120.910 120.400 0.022 0.000 2.489 2028 D HA -0.023 4.616 4.640 -0.000 0.000 0.237 2028 D C 1.387 177.696 176.300 0.016 0.000 1.212 2028 D CA -0.052 53.960 54.000 0.020 0.000 1.058 2028 D CB -0.410 40.399 40.800 0.014 0.000 1.098 2028 D HN 0.006 nan 8.370 nan 0.000 0.509 2029 V N 3.565 123.489 119.914 0.018 0.000 2.380 2029 V HA -0.261 3.859 4.120 -0.000 0.000 0.251 2029 V C 2.118 178.218 176.094 0.010 0.000 1.063 2029 V CA 2.791 65.099 62.300 0.014 0.000 1.055 2029 V CB -0.472 31.360 31.823 0.016 0.000 0.657 2029 V HN 0.647 nan 8.190 nan 0.000 0.455 2030 T N -0.992 113.567 114.554 0.009 0.000 2.821 2030 T HA -0.192 4.158 4.350 -0.000 0.000 0.267 2030 T C 1.995 176.698 174.700 0.005 0.000 1.046 2030 T CA 2.627 64.731 62.100 0.006 0.000 1.139 2030 T CB -0.573 68.297 68.868 0.003 0.000 0.871 2030 T HN 0.855 nan 8.240 nan 0.000 0.454 2031 T N -0.131 114.426 114.554 0.006 0.000 2.985 2031 T HA 0.053 4.402 4.350 -0.000 0.000 0.266 2031 T C 1.898 176.601 174.700 0.006 0.000 1.076 2031 T CA 0.614 62.717 62.100 0.005 0.000 1.135 2031 T CB -0.419 68.453 68.868 0.005 0.000 0.890 2031 T HN 0.242 nan 8.240 nan 0.000 0.480 2032 L N 1.550 122.777 121.223 0.007 0.000 2.056 2032 L HA 0.315 4.655 4.340 -0.000 0.000 0.207 2032 L C 3.077 179.951 176.870 0.006 0.000 1.078 2032 L CA 1.675 56.519 54.840 0.007 0.000 0.749 2032 L CB -1.238 40.826 42.059 0.008 0.000 0.901 2032 L HN 0.447 nan 8.230 nan 0.000 0.433 2033 A N -1.305 121.519 122.820 0.006 0.000 1.929 2033 A HA -0.135 4.185 4.320 -0.000 0.000 0.216 2033 A C 2.324 179.911 177.584 0.004 0.000 1.176 2033 A CA 1.916 53.956 52.037 0.005 0.000 0.628 2033 A CB -0.780 18.223 19.000 0.005 0.000 0.816 2033 A HN 0.501 nan 8.150 nan 0.000 0.444 2034 T N -3.566 110.990 114.554 0.004 0.000 3.039 2034 T HA 0.280 4.630 4.350 -0.000 0.000 0.250 2034 T C 0.533 175.235 174.700 0.004 0.000 1.052 2034 T CA 0.630 62.733 62.100 0.004 0.000 1.125 2034 T CB -0.418 68.452 68.868 0.003 0.000 0.908 2034 T HN 0.746 nan 8.240 nan 0.000 0.473 2035 V N 3.273 123.190 119.914 0.005 0.000 2.448 2035 V HA 0.627 4.747 4.120 -0.000 0.000 0.295 2035 V C -2.934 173.164 176.094 0.006 0.000 1.025 2035 V CA -2.855 59.448 62.300 0.005 0.000 0.859 2035 V CB 1.957 33.783 31.823 0.005 0.000 0.988 2035 V HN 0.085 nan 8.190 nan 0.000 0.431 2036 P HA 0.168 nan 4.420 nan 0.000 0.269 2036 P C 0.654 177.959 177.300 0.007 0.000 1.209 2036 P CA 0.271 63.374 63.100 0.006 0.000 0.776 2036 P CB 1.549 33.253 31.700 0.006 0.000 0.876 2037 A N 3.126 125.950 122.820 0.007 0.000 2.024 2037 A HA -0.163 4.156 4.320 -0.000 0.000 0.220 2037 A C 2.067 179.657 177.584 0.010 0.000 1.164 2037 A CA 2.043 54.085 52.037 0.009 0.000 0.643 2037 A CB -1.412 17.593 19.000 0.008 0.000 0.806 2037 A HN 0.660 nan 8.150 nan 0.000 0.451 2038 S N -0.390 115.315 115.700 0.009 0.000 2.527 2038 S HA 0.452 4.922 4.470 -0.000 0.000 0.222 2038 S C 0.989 175.595 174.600 0.010 0.000 0.985 2038 S CA 0.281 58.486 58.200 0.009 0.000 0.921 2038 S CB -0.655 62.550 63.200 0.007 0.000 0.772 2038 S HN 0.886 nan 8.310 nan 0.000 0.529 2039 A N 1.365 124.191 122.820 0.010 0.000 2.511 2039 A HA 0.512 4.832 4.320 -0.000 0.000 0.242 2039 A C 0.273 177.865 177.584 0.013 0.000 1.069 2039 A CA 0.179 52.223 52.037 0.010 0.000 0.763 2039 A CB 0.019 19.024 19.000 0.009 0.000 1.001 2039 A HN 0.320 nan 8.150 nan 0.000 0.498 2040 T N 1.530 116.092 114.554 0.014 0.000 2.916 2040 T HA 0.702 5.052 4.350 -0.000 0.000 0.298 2040 T C -0.254 174.456 174.700 0.017 0.000 1.031 2040 T CA -0.079 62.032 62.100 0.018 0.000 0.993 2040 T CB 1.700 70.580 68.868 0.020 0.000 1.045 2040 T HN 0.964 nan 8.240 nan 0.000 0.454 2041 T N -0.112 114.454 114.554 0.019 0.000 2.838 2041 T HA 0.700 5.050 4.350 -0.000 0.000 0.292 2041 T C -0.701 174.011 174.700 0.021 0.000 1.113 2041 T CA -0.888 61.222 62.100 0.016 0.000 1.008 2041 T CB 1.685 70.560 68.868 0.012 0.000 1.259 2041 T HN 0.381 nan 8.240 nan 0.000 0.520 2042 T N 1.284 115.848 114.554 0.017 0.000 2.779 2042 T HA 0.749 5.099 4.350 -0.000 0.000 0.280 2042 T C -0.411 174.297 174.700 0.013 0.000 0.987 2042 T CA -0.503 61.608 62.100 0.019 0.000 0.966 2042 T CB 0.947 69.825 68.868 0.017 0.000 0.933 2042 T HN 0.991 nan 8.240 nan 0.000 0.442 2043 A N 2.571 125.398 122.820 0.011 0.000 2.423 2043 A HA 0.889 5.209 4.320 -0.000 0.000 0.304 2043 A C -0.429 177.157 177.584 0.004 0.000 1.104 2043 A CA -0.751 51.288 52.037 0.004 0.000 0.757 2043 A CB 1.691 20.689 19.000 -0.003 0.000 1.313 2043 A HN 0.650 nan 8.150 nan 0.000 0.423 2044 S N 0.733 116.434 115.700 0.001 0.000 2.538 2044 S HA 0.535 5.004 4.470 -0.000 0.000 0.288 2044 S C -1.016 173.583 174.600 -0.002 0.000 1.108 2044 S CA -0.532 57.669 58.200 0.002 0.000 0.971 2044 S CB 1.166 64.369 63.200 0.005 0.000 1.041 2044 S HN 0.538 nan 8.310 nan 0.000 0.483 2045 L N 3.978 125.199 121.223 -0.003 0.000 2.295 2045 L HA 0.437 4.776 4.340 -0.000 0.000 0.288 2045 L C -0.039 176.831 176.870 0.001 0.000 1.079 2045 L CA -0.117 54.721 54.840 -0.004 0.000 0.830 2045 L CB 0.502 42.558 42.059 -0.005 0.000 1.200 2045 L HN 0.543 nan 8.230 nan 0.000 0.438 2046 V N 2.747 122.662 119.914 0.002 0.000 2.604 2046 V HA 0.640 4.760 4.120 -0.000 0.000 0.305 2046 V C 0.352 176.448 176.094 0.004 0.000 1.043 2046 V CA -0.511 61.791 62.300 0.003 0.000 0.888 2046 V CB 2.009 33.834 31.823 0.003 0.000 0.995 2046 V HN 0.842 nan 8.190 nan 0.000 0.429 2047 T N 3.310 117.867 114.554 0.005 0.000 2.919 2047 T HA 0.413 4.763 4.350 -0.000 0.000 0.302 2047 T C 0.628 175.331 174.700 0.004 0.000 1.031 2047 T CA -0.303 61.800 62.100 0.005 0.000 1.127 2047 T CB 1.094 69.965 68.868 0.005 0.000 0.952 2047 T HN 0.792 nan 8.240 nan 0.000 0.540 2048 R N 0.537 121.040 120.500 0.004 0.000 2.312 2048 R HA 0.221 4.561 4.340 -0.000 0.000 0.205 2048 R C 0.624 176.926 176.300 0.003 0.000 0.904 2048 R CA 0.181 56.283 56.100 0.004 0.000 1.052 2048 R CB 0.239 30.542 30.300 0.004 0.000 1.014 2048 R HN 0.926 nan 8.270 nan 0.000 0.503 2049 E N -1.693 118.509 120.200 0.003 0.000 2.449 2049 E HA 0.622 4.972 4.350 -0.000 0.000 0.278 2049 E C -1.418 175.183 176.600 0.002 0.000 0.992 2049 E CA -1.277 55.124 56.400 0.002 0.000 0.807 2049 E CB 1.115 30.816 29.700 0.003 0.000 1.350 2049 E HN -0.069 nan 8.360 nan 0.000 0.462 2050 A N 0.332 123.152 122.820 0.000 0.000 2.340 2050 A HA 0.789 5.109 4.320 -0.000 0.000 0.268 2050 A C 0.310 177.893 177.584 -0.001 0.000 1.100 2050 A CA 0.578 52.614 52.037 -0.001 0.000 0.803 2050 A CB 0.690 19.689 19.000 -0.002 0.000 1.043 2050 A HN 0.863 nan 8.150 nan 0.000 0.488 2051 G N -0.921 107.878 108.800 -0.002 0.000 2.428 2051 G HA2 0.498 4.457 3.960 -0.000 0.000 0.305 2051 G HA3 0.498 4.457 3.960 -0.000 0.000 0.305 2051 G C -1.689 173.208 174.900 -0.004 0.000 1.260 2051 G CA -0.069 45.029 45.100 -0.003 0.000 0.853 2051 G HN 1.138 nan 8.290 nan 0.000 0.480 2052 V N 0.349 120.259 119.914 -0.008 0.000 2.495 2052 V HA 0.634 4.753 4.120 -0.000 0.000 0.298 2052 V C 0.108 176.195 176.094 -0.012 0.000 1.031 2052 V CA -0.782 61.511 62.300 -0.012 0.000 0.871 2052 V CB 1.328 33.139 31.823 -0.020 0.000 0.988 2052 V HN 0.947 nan 8.190 nan 0.000 0.432 2053 V N 5.012 124.924 119.914 -0.004 0.000 2.607 2053 V HA 0.927 5.047 4.120 -0.000 0.000 0.289 2053 V C 0.170 176.269 176.094 0.009 0.000 1.053 2053 V CA 0.366 62.670 62.300 0.006 0.000 0.996 2053 V CB 1.200 33.031 31.823 0.014 0.000 0.995 2053 V HN 1.247 nan 8.190 nan 0.000 0.476 2054 A N 4.165 127.001 122.820 0.027 0.000 2.574 2054 A HA 0.758 5.078 4.320 -0.000 0.000 0.297 2054 A C 0.484 178.139 177.584 0.119 0.000 1.062 2054 A CA -0.025 52.053 52.037 0.068 0.000 0.686 2054 A CB 1.385 20.381 19.000 -0.007 0.000 1.285 2054 A HN 2.425 nan 8.150 nan 0.000 0.403 2055 G N -0.163 108.761 108.800 0.207 0.000 2.132 2055 G HA2 -0.104 3.856 3.960 -0.000 0.000 0.234 2055 G HA3 -0.104 3.856 3.960 -0.000 0.000 0.234 2055 G C 0.563 175.497 174.900 0.057 0.000 0.989 2055 G CA 0.452 45.628 45.100 0.127 0.000 0.676 2055 G HN 1.122 nan 8.290 nan 0.000 0.522 2056 L N 0.995 122.254 121.223 0.060 0.000 2.131 2056 L HA 0.081 4.420 4.340 -0.000 0.000 0.210 2056 L C 2.315 179.191 176.870 0.010 0.000 1.092 2056 L CA 2.321 57.178 54.840 0.030 0.000 0.759 2056 L CB -0.498 41.583 42.059 0.036 0.000 0.903 2056 L HN 0.303 nan 8.230 nan 0.000 0.435 2057 D N -1.088 119.314 120.400 0.003 0.000 2.178 2057 D HA -0.109 4.531 4.640 -0.000 0.000 0.202 2057 D C 2.307 178.585 176.300 -0.036 0.000 0.974 2057 D CA 0.942 54.930 54.000 -0.020 0.000 0.841 2057 D CB 0.016 40.785 40.800 -0.052 0.000 0.953 2057 D HN 0.179 nan 8.370 nan 0.000 0.478 2058 V N 1.396 121.285 119.914 -0.042 0.000 2.594 2058 V HA -0.191 3.929 4.120 -0.000 0.000 0.253 2058 V C 2.479 178.547 176.094 -0.043 0.000 1.069 2058 V CA 1.505 63.777 62.300 -0.048 0.000 1.082 2058 V CB -0.698 31.101 31.823 -0.039 0.000 0.680 2058 V HN 0.159 nan 8.190 nan 0.000 0.469 2059 A N 0.203 123.001 122.820 -0.038 0.000 1.855 2059 A HA -0.098 4.222 4.320 -0.000 0.000 0.215 2059 A C 2.084 179.609 177.584 -0.099 0.000 1.191 2059 A CA 1.412 53.413 52.037 -0.060 0.000 0.613 2059 A CB -0.536 18.434 19.000 -0.050 0.000 0.829 2059 A HN 0.366 nan 8.150 nan 0.000 0.442 2060 L N -0.031 121.146 121.223 -0.075 0.000 2.043 2060 L HA -0.173 4.167 4.340 -0.000 0.000 0.212 2060 L C 2.517 179.357 176.870 -0.050 0.000 1.075 2060 L CA 1.470 56.264 54.840 -0.077 0.000 0.752 2060 L CB -1.577 40.510 42.059 0.047 0.000 0.891 2060 L HN 0.379 nan 8.230 nan 0.000 0.432 2061 L N -1.078 120.128 121.223 -0.028 0.000 2.127 2061 L HA -0.232 4.107 4.340 -0.000 0.000 0.211 2061 L C 2.337 179.187 176.870 -0.034 0.000 1.089 2061 L CA 1.393 56.223 54.840 -0.018 0.000 0.757 2061 L CB -0.796 41.244 42.059 -0.032 0.000 0.899 2061 L HN 0.311 nan 8.230 nan 0.000 0.434 2062 T N -0.280 114.236 114.554 -0.063 0.000 2.857 2062 T HA -0.089 4.260 4.350 -0.000 0.000 0.266 2062 T C 1.867 176.515 174.700 -0.086 0.000 1.048 2062 T CA 0.720 62.780 62.100 -0.065 0.000 1.139 2062 T CB -0.027 68.800 68.868 -0.068 0.000 0.874 2062 T HN 0.020 nan 8.240 nan 0.000 0.455 2063 L N 2.069 123.189 121.223 -0.171 0.000 2.056 2063 L HA 0.007 4.347 4.340 -0.000 0.000 0.207 2063 L C 2.237 179.086 176.870 -0.036 0.000 1.078 2063 L CA 1.431 56.114 54.840 -0.262 0.000 0.749 2063 L CB -1.475 40.083 42.059 -0.836 0.000 0.901 2063 L HN 0.198 nan 8.230 nan 0.000 0.433 2064 N N -0.152 118.592 118.700 0.073 0.000 2.094 2064 N HA -0.233 4.507 4.740 -0.000 0.000 0.191 2064 N C 1.880 177.438 175.510 0.079 0.000 1.023 2064 N CA 1.245 54.393 53.050 0.164 0.000 0.857 2064 N CB -0.136 38.422 38.487 0.119 0.000 1.013 2064 N HN 0.321 nan 8.380 nan 0.000 0.426 2065 E N 0.524 120.742 120.200 0.031 0.000 2.051 2065 E HA -0.051 4.299 4.350 -0.000 0.000 0.192 2065 E C 1.853 178.462 176.600 0.015 0.000 0.991 2065 E CA 0.775 57.184 56.400 0.015 0.000 0.799 2065 E CB -0.098 29.600 29.700 -0.003 0.000 0.748 2065 E HN 0.110 nan 8.360 nan 0.000 0.449 2066 V N -0.026 119.892 119.914 0.007 0.000 2.407 2066 V HA -0.098 4.022 4.120 -0.000 0.000 0.245 2066 V C 2.131 178.242 176.094 0.029 0.000 1.041 2066 V CA 1.390 63.694 62.300 0.008 0.000 1.040 2066 V CB -0.244 31.573 31.823 -0.010 0.000 0.671 2066 V HN 0.247 nan 8.190 nan 0.000 0.455 2067 L N -0.531 120.726 121.223 0.058 0.000 2.638 2067 L HA 0.551 4.891 4.340 -0.000 0.000 0.232 2067 L C 0.995 177.931 176.870 0.111 0.000 1.099 2067 L CA 0.621 55.519 54.840 0.096 0.000 0.883 2067 L CB 0.135 42.290 42.059 0.159 0.000 1.136 2067 L HN 0.507 nan 8.230 nan 0.000 0.492 2068 G N -0.203 108.665 108.800 0.114 0.000 2.692 2068 G HA2 -0.223 3.737 3.960 -0.000 0.000 0.686 2068 G HA3 -0.223 3.737 3.960 -0.000 0.000 0.686 2068 G C 0.403 175.373 174.900 0.117 0.000 1.243 2068 G CA -0.286 44.865 45.100 0.085 0.000 0.782 2068 G HN -0.007 nan 8.290 nan 0.000 0.625 2069 T N 0.475 115.066 114.554 0.062 0.000 2.760 2069 T HA -0.159 4.191 4.350 -0.000 0.000 0.269 2069 T C 1.582 176.175 174.700 -0.178 0.000 1.047 2069 T CA 1.839 63.945 62.100 0.009 0.000 1.139 2069 T CB -0.145 68.717 68.868 -0.011 0.000 0.855 2069 T HN 0.583 nan 8.240 nan 0.000 0.471 2070 N N 0.531 119.148 118.700 -0.140 0.000 2.328 2070 N HA 0.214 4.954 4.740 -0.000 0.000 0.247 2070 N C 1.312 176.730 175.510 -0.154 0.000 1.165 2070 N CA 0.042 52.969 53.050 -0.206 0.000 0.873 2070 N CB 0.732 39.150 38.487 -0.115 0.000 1.125 2070 N HN 0.450 nan 8.380 nan 0.000 0.513 2071 G N 0.049 108.804 108.800 -0.076 0.000 2.985 2071 G HA2 0.046 4.006 3.960 -0.000 0.000 0.209 2071 G HA3 0.046 4.006 3.960 -0.000 0.000 0.209 2071 G C 0.034 175.030 174.900 0.160 0.000 1.165 2071 G CA 0.421 45.570 45.100 0.081 0.000 0.776 2071 G HN 0.368 nan 8.290 nan 0.000 0.541 2072 Y N -2.645 117.654 120.300 -0.001 0.000 2.689 2072 Y HA 0.762 5.312 4.550 -0.000 0.000 0.333 2072 Y C -0.917 174.983 175.900 -0.000 0.000 1.208 2072 Y CA -2.321 55.779 58.100 -0.001 0.000 1.055 2072 Y CB 1.054 39.513 38.460 -0.001 0.000 1.304 2072 Y HN -0.086 nan 8.280 nan 0.000 0.455 2073 R N 1.436 121.995 120.500 0.099 0.000 2.532 2073 R HA 0.747 5.087 4.340 -0.000 0.000 0.297 2073 R C -2.136 174.247 176.300 0.137 0.000 0.984 2073 R CA -0.899 55.217 56.100 0.027 0.000 0.884 2073 R CB 2.085 32.387 30.300 0.004 0.000 1.182 2073 R HN 0.736 nan 8.270 nan 0.000 0.442 2074 V N 6.836 126.825 119.914 0.124 0.000 2.368 2074 V HA 0.110 4.230 4.120 -0.000 0.000 0.266 2074 V C 0.739 176.872 176.094 0.064 0.000 1.045 2074 V CA -0.346 62.028 62.300 0.123 0.000 0.899 2074 V CB 1.169 33.071 31.823 0.131 0.000 1.006 2074 V HN 0.775 nan 8.190 nan 0.000 0.470 2075 L N 2.960 124.216 121.223 0.054 0.000 2.270 2075 L HA 0.293 4.633 4.340 -0.000 0.000 0.210 2075 L C 0.638 177.526 176.870 0.030 0.000 1.104 2075 L CA 1.147 56.008 54.840 0.035 0.000 0.804 2075 L CB -0.605 41.472 42.059 0.030 0.000 0.937 2075 L HN 0.795 nan 8.230 nan 0.000 0.450 2076 D N -1.601 118.820 120.400 0.034 0.000 2.728 2076 D HA 0.479 5.119 4.640 -0.000 0.000 0.249 2076 D C -1.011 175.306 176.300 0.029 0.000 1.225 2076 D CA -0.599 53.418 54.000 0.028 0.000 0.748 2076 D CB 1.274 42.087 40.800 0.021 0.000 1.326 2076 D HN 0.079 nan 8.370 nan 0.000 0.426 2077 R N 0.229 120.745 120.500 0.026 0.000 2.690 2077 R HA 0.760 5.100 4.340 -0.000 0.000 0.269 2077 R C -1.807 174.507 176.300 0.023 0.000 1.037 2077 R CA -0.933 55.182 56.100 0.025 0.000 0.877 2077 R CB 0.705 31.024 30.300 0.031 0.000 1.255 2077 R HN 0.164 nan 8.270 nan 0.000 0.467 2078 V N 0.696 120.623 119.914 0.022 0.000 3.234 2078 V HA 0.378 4.498 4.120 -0.000 0.000 0.317 2078 V C -0.310 175.799 176.094 0.025 0.000 1.081 2078 V CA -0.623 61.690 62.300 0.020 0.000 1.037 2078 V CB 1.885 33.718 31.823 0.017 0.000 1.148 2078 V HN 0.710 nan 8.190 nan 0.000 0.453 2079 E N 1.180 121.395 120.200 0.025 0.000 2.204 2079 E HA 0.323 4.673 4.350 -0.000 0.000 0.276 2079 E C -0.994 175.627 176.600 0.034 0.000 0.974 2079 E CA -0.689 55.730 56.400 0.031 0.000 0.815 2079 E CB 1.106 30.823 29.700 0.028 0.000 1.119 2079 E HN 0.545 nan 8.360 nan 0.000 0.393 2080 D N 0.236 120.667 120.400 0.052 0.000 2.472 2080 D HA 0.234 4.874 4.640 -0.000 0.000 0.237 2080 D C 1.232 177.546 176.300 0.024 0.000 1.141 2080 D CA 1.646 55.679 54.000 0.056 0.000 0.875 2080 D CB 0.642 41.514 40.800 0.121 0.000 1.192 2080 D HN 0.663 nan 8.370 nan 0.000 0.450 2081 G N 0.970 109.769 108.800 -0.002 0.000 2.232 2081 G HA2 -0.168 3.792 3.960 -0.000 0.000 0.226 2081 G HA3 -0.168 3.792 3.960 -0.000 0.000 0.226 2081 G C 0.477 175.373 174.900 -0.008 0.000 0.996 2081 G CA 0.198 45.287 45.100 -0.018 0.000 0.626 2081 G HN 0.861 nan 8.290 nan 0.000 0.509 2082 A N 1.340 124.161 122.820 0.002 0.000 2.477 2082 A HA 0.599 4.918 4.320 -0.000 0.000 0.246 2082 A C 0.800 178.384 177.584 0.000 0.000 1.078 2082 A CA 0.119 52.158 52.037 0.003 0.000 0.770 2082 A CB 0.232 19.237 19.000 0.008 0.000 1.011 2082 A HN 0.397 nan 8.150 nan 0.000 0.494 2083 R N 1.612 122.112 120.500 -0.000 0.000 2.340 2083 R HA 0.475 4.814 4.340 -0.000 0.000 0.300 2083 R C -0.845 175.455 176.300 0.001 0.000 1.069 2083 R CA -0.330 55.769 56.100 -0.001 0.000 0.984 2083 R CB 0.837 31.136 30.300 -0.001 0.000 1.003 2083 R HN 0.400 nan 8.270 nan 0.000 0.459 2084 V N 5.258 125.173 119.914 0.001 0.000 2.789 2084 V HA 0.452 4.572 4.120 -0.000 0.000 0.311 2084 V C -2.065 174.030 176.094 0.001 0.000 1.073 2084 V CA -1.926 60.376 62.300 0.002 0.000 0.921 2084 V CB 2.976 34.801 31.823 0.004 0.000 1.009 2084 V HN 0.689 nan 8.190 nan 0.000 0.426 2085 P HA 0.428 nan 4.420 nan 0.000 0.283 2085 P C -2.529 174.772 177.300 0.002 0.000 1.278 2085 P CA -1.802 61.298 63.100 0.001 0.000 0.834 2085 P CB 1.283 32.984 31.700 0.001 0.000 1.150 2086 P HA -0.183 nan 4.420 nan 0.000 0.214 2086 P C 1.273 178.575 177.300 0.002 0.000 1.164 2086 P CA 2.274 65.375 63.100 0.002 0.000 0.942 2086 P CB -0.613 31.088 31.700 0.001 0.000 0.791 2087 G N -0.848 107.954 108.800 0.002 0.000 3.474 2087 G HA2 0.036 3.996 3.960 -0.000 0.000 0.269 2087 G HA3 0.036 3.996 3.960 -0.000 0.000 0.269 2087 G C -0.082 174.821 174.900 0.004 0.000 1.339 2087 G CA -0.078 45.023 45.100 0.003 0.000 1.258 2087 G HN 0.170 nan 8.290 nan 0.000 0.560 2088 E N 1.061 121.263 120.200 0.004 0.000 2.316 2088 E HA 0.487 4.837 4.350 -0.000 0.000 0.275 2088 E C 0.362 176.966 176.600 0.006 0.000 1.029 2088 E CA -0.309 56.094 56.400 0.005 0.000 0.871 2088 E CB 0.906 30.609 29.700 0.005 0.000 1.022 2088 E HN 0.166 nan 8.360 nan 0.000 0.418 2089 A N 5.981 128.805 122.820 0.007 0.000 2.376 2089 A HA 0.214 4.534 4.320 -0.000 0.000 0.298 2089 A C 0.781 178.370 177.584 0.009 0.000 1.271 2089 A CA -0.282 51.760 52.037 0.007 0.000 0.926 2089 A CB -0.147 18.858 19.000 0.008 0.000 1.141 2089 A HN 0.864 nan 8.150 nan 0.000 0.539 2090 L N 1.846 123.074 121.223 0.008 0.000 2.156 2090 L HA 0.166 4.506 4.340 -0.000 0.000 0.208 2090 L C 1.007 177.885 176.870 0.013 0.000 1.095 2090 L CA 0.796 55.642 54.840 0.011 0.000 0.770 2090 L CB -0.235 41.831 42.059 0.010 0.000 0.914 2090 L HN 0.786 nan 8.230 nan 0.000 0.439 2091 M N -0.894 118.712 119.600 0.011 0.000 2.373 2091 M HA 0.308 4.788 4.480 -0.000 0.000 0.290 2091 M C -1.751 174.557 176.300 0.013 0.000 1.143 2091 M CA -0.160 55.148 55.300 0.014 0.000 0.949 2091 M CB 2.385 34.992 32.600 0.010 0.000 1.756 2091 M HN -0.280 nan 8.290 nan 0.000 0.494 2092 T N 5.402 119.969 114.554 0.021 0.000 2.861 2092 T HA 0.812 5.162 4.350 -0.000 0.000 0.287 2092 T C -1.194 173.527 174.700 0.036 0.000 1.003 2092 T CA -0.601 61.512 62.100 0.022 0.000 0.977 2092 T CB 1.342 70.222 68.868 0.020 0.000 0.996 2092 T HN 0.571 nan 8.240 nan 0.000 0.448 2093 L N 0.113 121.358 121.223 0.038 0.000 2.403 2093 L HA 0.835 5.175 4.340 -0.000 0.000 0.253 2093 L C -0.648 176.260 176.870 0.062 0.000 1.045 2093 L CA -1.095 53.786 54.840 0.068 0.000 0.845 2093 L CB 1.641 43.750 42.059 0.084 0.000 1.447 2093 L HN 0.550 nan 8.230 nan 0.000 0.411 2094 E N 0.265 120.518 120.200 0.088 0.000 2.210 2094 E HA 0.860 5.210 4.350 -0.000 0.000 0.266 2094 E C -1.441 175.222 176.600 0.105 0.000 0.883 2094 E CA -0.688 55.755 56.400 0.070 0.000 0.761 2094 E CB 1.957 31.689 29.700 0.053 0.000 1.156 2094 E HN 1.051 nan 8.360 nan 0.000 0.412 2095 A N 3.687 126.555 122.820 0.080 0.000 2.586 2095 A HA 0.240 4.560 4.320 -0.000 0.000 0.290 2095 A C -1.306 176.311 177.584 0.055 0.000 1.086 2095 A CA -0.755 51.339 52.037 0.096 0.000 0.665 2095 A CB 1.468 20.533 19.000 0.108 0.000 1.279 2095 A HN 0.626 nan 8.150 nan 0.000 0.423 2096 Q N 0.437 120.269 119.800 0.054 0.000 2.274 2096 Q HA 0.154 4.494 4.340 -0.000 0.000 0.280 2096 Q C 0.538 176.552 176.000 0.023 0.000 1.047 2096 Q CA 0.850 56.674 55.803 0.034 0.000 0.907 2096 Q CB 0.521 29.279 28.738 0.033 0.000 1.171 2096 Q HN 0.786 nan 8.270 nan 0.000 0.381 2097 T N 4.666 119.230 114.554 0.017 0.000 2.684 2097 T HA -0.192 4.158 4.350 -0.000 0.000 0.267 2097 T C 1.510 176.214 174.700 0.007 0.000 1.036 2097 T CA 1.607 63.714 62.100 0.010 0.000 1.148 2097 T CB -0.035 68.839 68.868 0.009 0.000 0.863 2097 T HN 0.613 nan 8.240 nan 0.000 0.436 2098 R N 0.442 120.947 120.500 0.009 0.000 2.105 2098 R HA -0.067 4.273 4.340 -0.000 0.000 0.239 2098 R C 2.885 179.188 176.300 0.005 0.000 1.135 2098 R CA 1.374 57.478 56.100 0.007 0.000 0.967 2098 R CB -0.753 29.552 30.300 0.009 0.000 0.861 2098 R HN 0.481 nan 8.270 nan 0.000 0.442 2099 G N 1.051 109.855 108.800 0.007 0.000 2.404 2099 G HA2 -0.213 3.747 3.960 -0.000 0.000 0.215 2099 G HA3 -0.213 3.747 3.960 -0.000 0.000 0.215 2099 G C 1.462 176.355 174.900 -0.012 0.000 1.174 2099 G CA 0.327 45.429 45.100 0.003 0.000 0.780 2099 G HN 0.117 nan 8.290 nan 0.000 0.537 2100 L N -0.280 120.935 121.223 -0.014 0.000 2.012 2100 L HA -0.079 4.261 4.340 -0.000 0.000 0.210 2100 L C 2.746 179.602 176.870 -0.022 0.000 1.073 2100 L CA 0.423 55.247 54.840 -0.028 0.000 0.748 2100 L CB -0.387 41.660 42.059 -0.021 0.000 0.891 2100 L HN 0.126 nan 8.230 nan 0.000 0.431 2101 L N -0.772 120.445 121.223 -0.011 0.000 2.191 2101 L HA -0.162 4.178 4.340 -0.000 0.000 0.212 2101 L C 2.485 179.351 176.870 -0.007 0.000 1.103 2101 L CA 1.773 56.608 54.840 -0.008 0.000 0.769 2101 L CB -1.252 40.805 42.059 -0.003 0.000 0.908 2101 L HN 0.207 nan 8.230 nan 0.000 0.438 2102 T N -1.088 113.461 114.554 -0.007 0.000 2.937 2102 T HA 0.023 4.373 4.350 -0.000 0.000 0.260 2102 T C 1.938 176.631 174.700 -0.012 0.000 1.051 2102 T CA 0.949 63.046 62.100 -0.005 0.000 1.141 2102 T CB 0.008 68.876 68.868 -0.001 0.000 0.879 2102 T HN 0.363 nan 8.240 nan 0.000 0.459 2103 A N 1.404 124.211 122.820 -0.023 0.000 1.897 2103 A HA -0.051 4.268 4.320 -0.000 0.000 0.215 2103 A C 2.027 179.591 177.584 -0.033 0.000 1.181 2103 A CA 1.752 53.768 52.037 -0.035 0.000 0.620 2103 A CB -0.639 18.325 19.000 -0.059 0.000 0.821 2103 A HN 0.583 nan 8.150 nan 0.000 0.443 2104 E N -0.481 119.701 120.200 -0.030 0.000 2.239 2104 E HA -0.404 3.946 4.350 -0.000 0.000 0.240 2104 E C 2.218 178.807 176.600 -0.019 0.000 1.079 2104 E CA 2.303 58.688 56.400 -0.025 0.000 0.991 2104 E CB -0.192 29.498 29.700 -0.017 0.000 0.863 2104 E HN 0.401 nan 8.360 nan 0.000 0.491 2105 R N 0.032 120.524 120.500 -0.013 0.000 2.073 2105 R HA -0.084 4.256 4.340 -0.000 0.000 0.234 2105 R C 2.356 178.649 176.300 -0.011 0.000 1.134 2105 R CA 2.429 58.524 56.100 -0.009 0.000 0.952 2105 R CB -1.122 29.175 30.300 -0.005 0.000 0.850 2105 R HN 0.283 nan 8.270 nan 0.000 0.433 2106 T N 1.048 115.594 114.554 -0.014 0.000 2.684 2106 T HA -0.196 4.154 4.350 -0.000 0.000 0.267 2106 T C 1.745 176.432 174.700 -0.022 0.000 1.036 2106 T CA 1.779 63.868 62.100 -0.018 0.000 1.148 2106 T CB -0.273 68.583 68.868 -0.020 0.000 0.863 2106 T HN 0.370 nan 8.240 nan 0.000 0.436 2107 M N 0.338 119.922 119.600 -0.027 0.000 2.086 2107 M HA -0.086 4.394 4.480 -0.000 0.000 0.261 2107 M C 1.832 178.122 176.300 -0.015 0.000 1.067 2107 M CA 1.588 56.869 55.300 -0.030 0.000 1.116 2107 M CB -0.201 32.371 32.600 -0.046 0.000 1.348 2107 M HN 0.116 nan 8.290 nan 0.000 0.407 2108 L N 1.327 122.544 121.223 -0.011 0.000 2.027 2108 L HA -0.178 4.162 4.340 -0.000 0.000 0.206 2108 L C 2.191 179.068 176.870 0.013 0.000 1.074 2108 L CA 1.696 56.536 54.840 0.000 0.000 0.745 2108 L CB -1.774 40.284 42.059 -0.001 0.000 0.898 2108 L HN 0.384 nan 8.230 nan 0.000 0.433 2109 N N -0.662 118.042 118.700 0.007 0.000 2.149 2109 N HA -0.182 4.558 4.740 -0.000 0.000 0.188 2109 N C 1.763 177.290 175.510 0.029 0.000 1.019 2109 N CA 0.987 54.044 53.050 0.012 0.000 0.857 2109 N CB -0.313 38.168 38.487 -0.010 0.000 0.997 2109 N HN 0.133 nan 8.380 nan 0.000 0.426 2110 L N 0.672 121.905 121.223 0.017 0.000 2.068 2110 L HA -0.005 4.335 4.340 -0.000 0.000 0.204 2110 L C 2.237 179.148 176.870 0.070 0.000 1.076 2110 L CA 1.048 55.908 54.840 0.033 0.000 0.753 2110 L CB -0.987 41.073 42.059 0.001 0.000 0.910 2110 L HN 0.124 nan 8.230 nan 0.000 0.439 2111 V N -2.888 117.053 119.914 0.045 0.000 2.871 2111 V HA 0.110 4.230 4.120 -0.000 0.000 0.256 2111 V C 2.129 178.255 176.094 0.055 0.000 1.082 2111 V CA 1.323 63.653 62.300 0.049 0.000 1.105 2111 V CB -1.093 30.747 31.823 0.029 0.000 0.713 2111 V HN 0.333 nan 8.190 nan 0.000 0.473 2112 G N -0.532 108.304 108.800 0.060 0.000 2.421 2112 G HA2 -0.229 3.730 3.960 -0.000 0.000 0.217 2112 G HA3 -0.229 3.730 3.960 -0.000 0.000 0.217 2112 G C 1.402 176.352 174.900 0.082 0.000 1.143 2112 G CA 1.006 46.140 45.100 0.057 0.000 0.784 2112 G HN 0.706 nan 8.290 nan 0.000 0.541 2113 H N 0.346 119.420 119.070 0.008 0.000 2.333 2113 H HA 0.177 4.733 4.556 -0.000 0.000 0.302 2113 H C 2.484 177.819 175.328 0.011 0.000 1.075 2113 H CA 1.075 57.129 56.048 0.010 0.000 1.348 2113 H CB -0.170 29.597 29.762 0.007 0.000 1.393 2113 H HN 0.218 nan 8.280 nan 0.000 0.509 2114 L N -0.584 120.694 121.223 0.092 0.000 2.141 2114 L HA -0.116 4.224 4.340 -0.000 0.000 0.209 2114 L C 2.375 179.229 176.870 -0.027 0.000 1.094 2114 L CA 1.224 56.080 54.840 0.026 0.000 0.763 2114 L CB -0.325 41.800 42.059 0.110 0.000 0.908 2114 L HN 0.254 nan 8.230 nan 0.000 0.437 2115 S N 0.027 115.723 115.700 -0.007 0.000 2.414 2115 S HA -0.041 4.429 4.470 -0.000 0.000 0.227 2115 S C 2.057 176.632 174.600 -0.041 0.000 1.022 2115 S CA 0.907 59.097 58.200 -0.017 0.000 0.958 2115 S CB -0.267 62.934 63.200 0.003 0.000 0.797 2115 S HN 0.580 nan 8.310 nan 0.000 0.493 2116 G N 2.116 110.880 108.800 -0.060 0.000 2.446 2116 G HA2 -0.167 3.793 3.960 -0.000 0.000 0.217 2116 G HA3 -0.167 3.793 3.960 -0.000 0.000 0.217 2116 G C 1.318 176.156 174.900 -0.104 0.000 1.168 2116 G CA 0.739 45.793 45.100 -0.077 0.000 0.771 2116 G HN 0.479 nan 8.290 nan 0.000 0.551 2117 I N 1.389 121.854 120.570 -0.175 0.000 2.179 2117 I HA -0.165 4.005 4.170 -0.000 0.000 0.242 2117 I C 3.301 179.360 176.117 -0.096 0.000 1.088 2117 I CA 1.016 62.221 61.300 -0.158 0.000 1.357 2117 I CB -0.223 37.658 38.000 -0.198 0.000 1.051 2117 I HN 0.246 nan 8.210 nan 0.000 0.409 2118 A N 0.241 123.007 122.820 -0.091 0.000 1.933 2118 A HA -0.197 4.122 4.320 -0.000 0.000 0.218 2118 A C 2.374 179.936 177.584 -0.038 0.000 1.175 2118 A CA 2.403 54.394 52.037 -0.078 0.000 0.628 2118 A CB -1.050 17.898 19.000 -0.088 0.000 0.814 2118 A HN 0.392 nan 8.150 nan 0.000 0.444 2119 T N 0.295 114.832 114.554 -0.028 0.000 2.674 2119 T HA -0.023 4.327 4.350 -0.000 0.000 0.265 2119 T C 2.278 176.994 174.700 0.026 0.000 1.039 2119 T CA 1.692 63.789 62.100 -0.005 0.000 1.150 2119 T CB -0.515 68.349 68.868 -0.008 0.000 0.864 2119 T HN 0.601 nan 8.240 nan 0.000 0.427 2120 A N 1.448 124.290 122.820 0.037 0.000 1.908 2120 A HA -0.149 4.171 4.320 -0.000 0.000 0.218 2120 A C 2.614 180.328 177.584 0.217 0.000 1.181 2120 A CA 2.460 54.569 52.037 0.119 0.000 0.627 2120 A CB -1.367 17.697 19.000 0.107 0.000 0.818 2120 A HN 0.592 nan 8.150 nan 0.000 0.445 2121 T N -1.712 112.904 114.554 0.103 0.000 2.915 2121 T HA 0.086 4.436 4.350 -0.000 0.000 0.269 2121 T C 1.824 176.603 174.700 0.131 0.000 1.071 2121 T CA 1.750 63.913 62.100 0.104 0.000 1.132 2121 T CB -0.432 68.421 68.868 -0.026 0.000 0.878 2121 T HN 0.560 nan 8.240 nan 0.000 0.479 2122 A N 0.979 123.844 122.820 0.075 0.000 2.015 2122 A HA 0.453 4.773 4.320 -0.000 0.000 0.219 2122 A C 2.755 180.379 177.584 0.067 0.000 1.163 2122 A CA 1.552 53.621 52.037 0.053 0.000 0.646 2122 A CB -1.174 17.838 19.000 0.020 0.000 0.806 2122 A HN 0.769 nan 8.150 nan 0.000 0.448 2123 A N -1.404 121.463 122.820 0.079 0.000 1.929 2123 A HA -0.064 4.255 4.320 -0.000 0.000 0.216 2123 A C 1.909 179.492 177.584 -0.001 0.000 1.176 2123 A CA 1.170 53.212 52.037 0.009 0.000 0.628 2123 A CB -0.749 18.226 19.000 -0.043 0.000 0.816 2123 A HN 0.705 nan 8.150 nan 0.000 0.444 2124 W N -0.292 120.995 121.300 -0.022 0.000 2.381 2124 W HA -0.089 4.571 4.660 -0.001 0.000 0.301 2124 W C 2.286 178.798 176.519 -0.012 0.000 1.205 2124 W CA 1.415 58.749 57.345 -0.017 0.000 1.285 2124 W CB -0.524 28.920 29.460 -0.026 0.000 1.133 2124 W HN 0.110 nan 8.180 nan 0.000 0.521 2125 V N 0.466 120.511 119.914 0.219 0.000 2.407 2125 V HA -0.293 3.826 4.120 -0.000 0.000 0.248 2125 V C 1.676 177.813 176.094 0.072 0.000 1.055 2125 V CA 2.154 64.527 62.300 0.122 0.000 1.049 2125 V CB -0.752 31.118 31.823 0.080 0.000 0.662 2125 V HN 0.074 nan 8.190 nan 0.000 0.455 2126 D N 0.368 120.796 120.400 0.047 0.000 2.149 2126 D HA -0.045 4.594 4.640 -0.000 0.000 0.201 2126 D C 2.239 178.540 176.300 0.002 0.000 0.972 2126 D CA 1.427 55.436 54.000 0.014 0.000 0.835 2126 D CB -0.350 40.447 40.800 -0.005 0.000 0.966 2126 D HN 0.423 nan 8.370 nan 0.000 0.476 2127 A N 0.701 123.512 122.820 -0.015 0.000 1.978 2127 A HA -0.132 4.188 4.320 -0.000 0.000 0.220 2127 A C 2.100 179.688 177.584 0.007 0.000 1.170 2127 A CA 1.792 53.802 52.037 -0.044 0.000 0.636 2127 A CB -0.451 18.463 19.000 -0.143 0.000 0.810 2127 A HN 0.259 nan 8.150 nan 0.000 0.448 2128 V N -1.452 118.492 119.914 0.051 0.000 3.444 2128 V HA 0.239 4.359 4.120 -0.000 0.000 0.308 2128 V C 0.598 176.716 176.094 0.039 0.000 1.371 2128 V CA -0.024 62.312 62.300 0.060 0.000 1.141 2128 V CB -1.380 30.503 31.823 0.099 0.000 1.037 2128 V HN 0.625 nan 8.190 nan 0.000 0.433 2129 R N 0.410 120.927 120.500 0.027 0.000 2.643 2129 R HA 0.582 4.922 4.340 -0.000 0.000 0.270 2129 R C 1.070 177.376 176.300 0.011 0.000 1.061 2129 R CA 0.493 56.604 56.100 0.018 0.000 1.107 2129 R CB 0.248 30.556 30.300 0.013 0.000 0.999 2129 R HN 0.827 nan 8.270 nan 0.000 0.460 2130 G N 0.410 109.215 108.800 0.007 0.000 2.176 2130 G HA2 -0.260 3.700 3.960 -0.000 0.000 0.253 2130 G HA3 -0.260 3.700 3.960 -0.000 0.000 0.253 2130 G C 0.021 174.922 174.900 0.003 0.000 0.979 2130 G CA 0.431 45.534 45.100 0.004 0.000 0.641 2130 G HN 0.782 nan 8.290 nan 0.000 0.530 2131 T N -0.753 113.804 114.554 0.005 0.000 2.926 2131 T HA 0.569 4.919 4.350 -0.000 0.000 0.289 2131 T C 1.345 176.040 174.700 -0.010 0.000 1.054 2131 T CA 0.027 62.128 62.100 0.002 0.000 1.015 2131 T CB 1.432 70.310 68.868 0.016 0.000 1.167 2131 T HN 0.368 nan 8.240 nan 0.000 0.526 2132 K N 0.513 120.896 120.400 -0.027 0.000 2.393 2132 K HA 0.473 4.792 4.320 -0.000 0.000 0.193 2132 K C 0.718 177.271 176.600 -0.079 0.000 1.026 2132 K CA -0.209 56.047 56.287 -0.051 0.000 1.064 2132 K CB 0.285 32.744 32.500 -0.069 0.000 0.833 2132 K HN 0.435 nan 8.250 nan 0.000 0.521 2133 A N 1.978 124.765 122.820 -0.055 0.000 2.462 2133 A HA 0.203 4.523 4.320 -0.000 0.000 0.243 2133 A C -0.776 176.796 177.584 -0.019 0.000 1.076 2133 A CA -0.089 51.910 52.037 -0.063 0.000 0.773 2133 A CB 0.194 19.195 19.000 0.001 0.000 1.010 2133 A HN 0.341 nan 8.150 nan 0.000 0.493 2134 K N 1.559 121.956 120.400 -0.005 0.000 2.207 2134 K HA 0.522 4.842 4.320 -0.000 0.000 0.255 2134 K C -0.674 176.012 176.600 0.144 0.000 0.941 2134 K CA -0.472 55.875 56.287 0.101 0.000 0.825 2134 K CB 1.659 34.277 32.500 0.197 0.000 1.119 2134 K HN 0.517 nan 8.250 nan 0.000 0.430 2135 I N 3.522 124.141 120.570 0.082 0.000 2.352 2135 I HA 0.245 4.415 4.170 -0.000 0.000 0.290 2135 I C 0.282 176.375 176.117 -0.041 0.000 1.036 2135 I CA -0.134 61.171 61.300 0.008 0.000 1.336 2135 I CB 0.453 38.452 38.000 -0.001 0.000 1.407 2135 I HN 0.458 nan 8.210 nan 0.000 0.497 2136 R N 4.045 124.485 120.500 -0.100 0.000 2.778 2136 R HA 0.406 4.746 4.340 -0.000 0.000 0.277 2136 R C -0.646 175.559 176.300 -0.158 0.000 0.977 2136 R CA -0.844 55.172 56.100 -0.140 0.000 0.950 2136 R CB 2.143 32.294 30.300 -0.249 0.000 1.165 2136 R HN 0.580 nan 8.270 nan 0.000 0.474 2137 D N -0.244 120.089 120.400 -0.111 0.000 2.511 2137 D HA 0.315 4.955 4.640 -0.000 0.000 0.276 2137 D C 0.283 176.552 176.300 -0.050 0.000 1.220 2137 D CA -0.343 53.590 54.000 -0.111 0.000 1.077 2137 D CB 0.488 41.234 40.800 -0.090 0.000 1.126 2137 D HN 0.523 nan 8.370 nan 0.000 0.583 2138 T N -4.717 109.803 114.554 -0.056 0.000 2.693 2138 T HA 0.464 4.814 4.350 -0.000 0.000 0.278 2138 T C 0.509 175.195 174.700 -0.024 0.000 0.994 2138 T CA -1.029 61.055 62.100 -0.027 0.000 1.033 2138 T CB 1.327 70.176 68.868 -0.031 0.000 1.342 2138 T HN 0.293 nan 8.240 nan 0.000 0.538 2139 R N 0.092 120.580 120.500 -0.020 0.000 2.310 2139 R HA 0.159 4.499 4.340 -0.000 0.000 0.202 2139 R C 0.287 176.599 176.300 0.020 0.000 0.933 2139 R CA 0.019 56.115 56.100 -0.008 0.000 1.054 2139 R CB 0.032 30.319 30.300 -0.022 0.000 0.985 2139 R HN 0.454 nan 8.270 nan 0.000 0.489 2140 K N 2.251 122.672 120.400 0.035 0.000 2.449 2140 K HA 0.028 4.348 4.320 -0.000 0.000 0.237 2140 K C -0.033 176.617 176.600 0.082 0.000 1.265 2140 K CA 0.236 56.574 56.287 0.086 0.000 1.193 2140 K CB 0.149 32.760 32.500 0.184 0.000 1.515 2140 K HN 0.097 nan 8.250 nan 0.000 0.259 2141 T N -2.068 112.524 114.554 0.063 0.000 2.942 2141 T HA 0.389 4.739 4.350 -0.000 0.000 0.289 2141 T C -0.122 174.618 174.700 0.067 0.000 1.044 2141 T CA -1.169 60.971 62.100 0.066 0.000 1.023 2141 T CB 1.342 70.242 68.868 0.053 0.000 1.123 2141 T HN -0.060 nan 8.240 nan 0.000 0.512 2142 L N 3.080 124.346 121.223 0.071 0.000 2.331 2142 L HA 0.388 4.728 4.340 -0.000 0.000 0.278 2142 L C -1.894 174.994 176.870 0.030 0.000 1.106 2142 L CA -2.382 52.486 54.840 0.045 0.000 0.824 2142 L CB 0.106 42.183 42.059 0.030 0.000 1.142 2142 L HN 0.577 nan 8.230 nan 0.000 0.443 2143 P HA 0.078 nan 4.420 nan 0.000 0.260 2143 P C 0.762 178.069 177.300 0.013 0.000 1.185 2143 P CA 0.725 63.839 63.100 0.023 0.000 0.763 2143 P CB 0.641 32.352 31.700 0.018 0.000 0.776 2144 G N 2.957 111.771 108.800 0.024 0.000 2.217 2144 G HA2 -0.258 3.702 3.960 -0.000 0.000 0.246 2144 G HA3 -0.258 3.702 3.960 -0.000 0.000 0.246 2144 G C 0.498 175.381 174.900 -0.028 0.000 0.990 2144 G CA 0.131 45.234 45.100 0.006 0.000 0.627 2144 G HN 0.507 nan 8.290 nan 0.000 0.522 2145 L N 0.010 121.223 121.223 -0.017 0.000 2.906 2145 L HA 0.360 4.700 4.340 -0.000 0.000 0.255 2145 L C 2.305 179.172 176.870 -0.005 0.000 1.166 2145 L CA 0.319 55.143 54.840 -0.027 0.000 0.977 2145 L CB 0.145 42.194 42.059 -0.017 0.000 1.313 2145 L HN 0.267 nan 8.230 nan 0.000 0.549 2146 R N 1.650 122.160 120.500 0.018 0.000 2.097 2146 R HA -0.228 4.112 4.340 -0.000 0.000 0.236 2146 R C 2.289 178.603 176.300 0.025 0.000 1.135 2146 R CA 2.126 58.257 56.100 0.051 0.000 0.934 2146 R CB -0.207 30.159 30.300 0.110 0.000 0.846 2146 R HN 0.314 nan 8.270 nan 0.000 0.431 2147 A N 0.960 123.735 122.820 -0.075 0.000 1.908 2147 A HA -0.146 4.173 4.320 -0.000 0.000 0.218 2147 A C 2.278 179.792 177.584 -0.117 0.000 1.181 2147 A CA 1.520 53.434 52.037 -0.203 0.000 0.627 2147 A CB -0.567 17.882 19.000 -0.919 0.000 0.818 2147 A HN 0.406 nan 8.150 nan 0.000 0.445 2148 L N -1.126 120.028 121.223 -0.114 0.000 2.072 2148 L HA -0.212 4.128 4.340 -0.000 0.000 0.205 2148 L C 2.895 179.830 176.870 0.107 0.000 1.079 2148 L CA 1.473 56.315 54.840 0.003 0.000 0.752 2148 L CB -0.656 41.389 42.059 -0.025 0.000 0.906 2148 L HN 0.502 nan 8.230 nan 0.000 0.436 2149 Q N -0.207 119.637 119.800 0.074 0.000 2.167 2149 Q HA -0.226 4.113 4.340 -0.000 0.000 0.202 2149 Q C 2.115 178.133 176.000 0.030 0.000 0.970 2149 Q CA 1.240 57.080 55.803 0.063 0.000 0.855 2149 Q CB 0.029 28.810 28.738 0.072 0.000 0.911 2149 Q HN 0.212 nan 8.270 nan 0.000 0.438 2150 K N 0.042 120.471 120.400 0.049 0.000 2.103 2150 K HA -0.138 4.182 4.320 -0.000 0.000 0.204 2150 K C 1.689 178.321 176.600 0.053 0.000 1.052 2150 K CA 0.801 57.115 56.287 0.044 0.000 0.945 2150 K CB -0.309 32.239 32.500 0.079 0.000 0.722 2150 K HN 0.219 nan 8.250 nan 0.000 0.443 2151 Y N 0.427 120.711 120.300 -0.028 0.000 2.181 2151 Y HA -0.162 4.388 4.550 -0.000 0.000 0.288 2151 Y C 1.836 177.721 175.900 -0.024 0.000 1.146 2151 Y CA 1.599 59.683 58.100 -0.027 0.000 1.164 2151 Y CB -0.579 37.852 38.460 -0.049 0.000 0.982 2151 Y HN 0.035 nan 8.280 nan 0.000 0.515 2152 A N 0.066 122.752 122.820 -0.223 0.000 1.969 2152 A HA -0.106 4.214 4.320 -0.000 0.000 0.218 2152 A C 2.387 179.831 177.584 -0.235 0.000 1.169 2152 A CA 2.005 53.869 52.037 -0.289 0.000 0.635 2152 A CB -1.581 17.362 19.000 -0.095 0.000 0.810 2152 A HN 0.632 nan 8.150 nan 0.000 0.445 2153 V N -1.486 118.333 119.914 -0.158 0.000 2.427 2153 V HA -0.162 3.958 4.120 -0.000 0.000 0.248 2153 V C 2.188 178.202 176.094 -0.133 0.000 1.051 2153 V CA 2.169 64.392 62.300 -0.129 0.000 1.048 2153 V CB -0.845 30.913 31.823 -0.108 0.000 0.666 2153 V HN 0.526 nan 8.190 nan 0.000 0.456 2154 R N 0.129 120.537 120.500 -0.154 0.000 2.091 2154 R HA -0.132 4.208 4.340 -0.000 0.000 0.238 2154 R C 2.439 178.635 176.300 -0.173 0.000 1.136 2154 R CA 2.240 58.260 56.100 -0.133 0.000 0.959 2154 R CB -0.729 29.502 30.300 -0.115 0.000 0.856 2154 R HN 0.658 nan 8.270 nan 0.000 0.437 2155 T N -0.888 113.481 114.554 -0.308 0.000 2.833 2155 T HA -0.098 4.251 4.350 -0.000 0.000 0.269 2155 T C 1.543 176.154 174.700 -0.147 0.000 1.054 2155 T CA 1.349 63.285 62.100 -0.275 0.000 1.135 2155 T CB -0.196 68.405 68.868 -0.446 0.000 0.869 2155 T HN 0.492 nan 8.240 nan 0.000 0.466 2156 G N -0.170 108.553 108.800 -0.128 0.000 2.920 2156 G HA2 0.380 4.339 3.960 -0.000 0.000 0.208 2156 G HA3 0.380 4.339 3.960 -0.000 0.000 0.208 2156 G C 1.097 175.975 174.900 -0.037 0.000 1.159 2156 G CA 0.365 45.424 45.100 -0.067 0.000 0.784 2156 G HN 0.763 nan 8.290 nan 0.000 0.535 2157 G N -1.607 107.166 108.800 -0.046 0.000 2.163 2157 G HA2 0.040 4.000 3.960 -0.000 0.000 0.213 2157 G HA3 0.040 4.000 3.960 -0.000 0.000 0.213 2157 G C 0.661 175.555 174.900 -0.010 0.000 0.991 2157 G CA 0.115 45.204 45.100 -0.019 0.000 0.653 2157 G HN 0.946 nan 8.290 nan 0.000 0.518 2158 G N -1.146 107.636 108.800 -0.031 0.000 2.535 2158 G HA2 0.763 4.723 3.960 -0.000 0.000 0.303 2158 G HA3 0.763 4.723 3.960 -0.000 0.000 0.303 2158 G C 0.016 174.899 174.900 -0.027 0.000 1.237 2158 G CA 0.105 45.186 45.100 -0.031 0.000 0.986 2158 G HN 1.573 nan 8.290 nan 0.000 0.494 2159 V N -0.697 119.201 119.914 -0.027 0.000 2.680 2159 V HA 0.568 4.688 4.120 -0.000 0.000 0.309 2159 V C -0.890 175.180 176.094 -0.039 0.000 1.052 2159 V CA -1.380 60.907 62.300 -0.021 0.000 0.908 2159 V CB 1.800 33.625 31.823 0.004 0.000 1.001 2159 V HN 0.571 nan 8.190 nan 0.000 0.431 2160 N N 3.661 122.352 118.700 -0.015 0.000 2.520 2160 N HA 0.307 5.046 4.740 -0.000 0.000 0.273 2160 N C 0.082 175.610 175.510 0.032 0.000 1.155 2160 N CA 0.033 53.086 53.050 0.006 0.000 0.967 2160 N CB 0.929 39.434 38.487 0.030 0.000 1.092 2160 N HN 1.023 nan 8.380 nan 0.000 0.457 2161 H N 1.985 120.993 119.070 -0.103 0.000 4.055 2161 H HA 0.298 4.854 4.556 -0.000 0.000 0.197 2161 H C 0.010 175.289 175.328 -0.082 0.000 1.410 2161 H CA -0.326 55.643 56.048 -0.132 0.000 1.675 2161 H CB 0.749 30.412 29.762 -0.167 0.000 1.589 2161 H HN 0.261 nan 8.280 nan 0.000 0.467 2162 R N 1.437 121.726 120.500 -0.351 0.000 2.357 2162 R HA 0.147 4.487 4.340 -0.000 0.000 0.296 2162 R C 0.779 177.008 176.300 -0.118 0.000 1.052 2162 R CA -0.156 55.760 56.100 -0.306 0.000 0.988 2162 R CB 1.312 31.345 30.300 -0.445 0.000 1.025 2162 R HN 0.522 nan 8.270 nan 0.000 0.469 2163 L N 0.871 122.054 121.223 -0.067 0.000 2.463 2163 L HA 0.235 4.575 4.340 -0.000 0.000 0.219 2163 L C 1.127 177.990 176.870 -0.011 0.000 1.088 2163 L CA 0.259 55.097 54.840 -0.002 0.000 0.849 2163 L CB 0.356 42.429 42.059 0.024 0.000 1.012 2163 L HN 0.784 nan 8.230 nan 0.000 0.468 2164 G N -1.994 106.775 108.800 -0.052 0.000 2.554 2164 G HA2 0.297 4.256 3.960 -0.000 0.000 0.306 2164 G HA3 0.297 4.256 3.960 -0.000 0.000 0.306 2164 G C -0.470 174.391 174.900 -0.064 0.000 1.320 2164 G CA -0.642 44.430 45.100 -0.046 0.000 0.800 2164 G HN -0.315 nan 8.290 nan 0.000 0.481 2165 L N 0.837 122.030 121.223 -0.050 0.000 2.046 2165 L HA 0.164 4.504 4.340 -0.000 0.000 0.208 2165 L C 2.765 179.600 176.870 -0.059 0.000 1.077 2165 L CA 2.707 57.518 54.840 -0.048 0.000 0.747 2165 L CB -0.821 41.219 42.059 -0.031 0.000 0.896 2165 L HN 0.731 nan 8.230 nan 0.000 0.432 2166 G N -2.375 106.389 108.800 -0.060 0.000 3.088 2166 G HA2 -0.134 3.826 3.960 -0.000 0.000 0.212 2166 G HA3 -0.134 3.826 3.960 -0.000 0.000 0.212 2166 G C 1.122 175.983 174.900 -0.066 0.000 1.173 2166 G CA 0.351 45.414 45.100 -0.061 0.000 0.779 2166 G HN 0.325 nan 8.290 nan 0.000 0.540 2167 D N 0.627 120.983 120.400 -0.074 0.000 2.117 2167 D HA 0.208 4.848 4.640 -0.000 0.000 0.197 2167 D C 1.314 177.572 176.300 -0.069 0.000 0.987 2167 D CA 1.547 55.502 54.000 -0.076 0.000 0.829 2167 D CB 0.138 40.881 40.800 -0.095 0.000 0.961 2167 D HN 0.356 nan 8.370 nan 0.000 0.460 2168 A N -1.406 121.368 122.820 -0.077 0.000 2.610 2168 A HA 0.744 5.064 4.320 -0.000 0.000 0.291 2168 A C -1.475 176.070 177.584 -0.064 0.000 1.086 2168 A CA -0.268 51.732 52.037 -0.061 0.000 0.677 2168 A CB 1.208 20.173 19.000 -0.059 0.000 1.278 2168 A HN 0.131 nan 8.150 nan 0.000 0.414 2169 A N 0.933 123.721 122.820 -0.053 0.000 2.276 2169 A HA 0.607 4.927 4.320 -0.000 0.000 0.300 2169 A C -0.580 176.972 177.584 -0.053 0.000 1.235 2169 A CA -0.276 51.721 52.037 -0.067 0.000 0.867 2169 A CB 0.201 19.162 19.000 -0.066 0.000 1.137 2169 A HN 1.302 nan 8.150 nan 0.000 0.527 2170 L N 5.025 126.213 121.223 -0.059 0.000 2.343 2170 L HA 0.539 4.879 4.340 -0.000 0.000 0.278 2170 L C -1.235 175.647 176.870 0.021 0.000 0.996 2170 L CA -0.470 54.363 54.840 -0.011 0.000 0.831 2170 L CB 0.985 43.042 42.059 -0.003 0.000 1.232 2170 L HN 0.668 nan 8.230 nan 0.000 0.413 2171 I N 5.666 126.266 120.570 0.049 0.000 2.325 2171 I HA 0.259 4.429 4.170 -0.000 0.000 0.291 2171 I C 0.264 176.495 176.117 0.190 0.000 1.019 2171 I CA -0.028 61.356 61.300 0.140 0.000 1.302 2171 I CB 1.031 39.073 38.000 0.070 0.000 1.401 2171 I HN 0.533 nan 8.210 nan 0.000 0.485 2172 K N 4.385 124.970 120.400 0.309 0.000 2.312 2172 K HA 0.317 4.637 4.320 -0.000 0.000 0.236 2172 K C 0.635 177.237 176.600 0.003 0.000 1.079 2172 K CA -0.800 55.538 56.287 0.086 0.000 0.900 2172 K CB 0.861 33.362 32.500 0.002 0.000 1.297 2172 K HN 0.564 nan 8.250 nan 0.000 0.498 2173 D N 0.909 121.286 120.400 -0.038 0.000 2.133 2173 D HA -0.272 4.367 4.640 -0.000 0.000 0.192 2173 D C 0.831 177.077 176.300 -0.090 0.000 1.001 2173 D CA 1.654 55.628 54.000 -0.043 0.000 0.844 2173 D CB -0.447 40.332 40.800 -0.036 0.000 0.944 2173 D HN 0.389 nan 8.370 nan 0.000 0.447 2174 N N 1.010 119.589 118.700 -0.203 0.000 2.069 2174 N HA -0.167 4.573 4.740 -0.000 0.000 0.191 2174 N C 1.865 177.254 175.510 -0.202 0.000 1.031 2174 N CA 1.288 54.191 53.050 -0.246 0.000 0.852 2174 N CB -0.646 37.614 38.487 -0.378 0.000 1.018 2174 N HN 0.495 nan 8.380 nan 0.000 0.423 2175 H N 0.791 119.862 119.070 0.002 0.000 2.357 2175 H HA 0.040 4.596 4.556 -0.000 0.000 0.301 2175 H C 2.455 177.785 175.328 0.004 0.000 1.082 2175 H CA 0.532 56.581 56.048 0.001 0.000 1.342 2175 H CB -0.578 29.184 29.762 -0.000 0.000 1.389 2175 H HN -0.013 nan 8.280 nan 0.000 0.511 2176 V N 1.537 121.511 119.914 0.100 0.000 2.287 2176 V HA -0.289 3.831 4.120 -0.000 0.000 0.248 2176 V C 2.859 178.975 176.094 0.037 0.000 1.053 2176 V CA 1.746 64.082 62.300 0.061 0.000 1.027 2176 V CB -1.117 30.731 31.823 0.041 0.000 0.646 2176 V HN 0.490 nan 8.190 nan 0.000 0.447 2177 A N 0.074 122.904 122.820 0.017 0.000 1.851 2177 A HA -0.173 4.147 4.320 -0.000 0.000 0.216 2177 A C 2.469 180.063 177.584 0.017 0.000 1.195 2177 A CA 2.448 54.491 52.037 0.009 0.000 0.622 2177 A CB -1.084 17.911 19.000 -0.008 0.000 0.831 2177 A HN 0.607 nan 8.150 nan 0.000 0.444 2178 A N -0.349 122.485 122.820 0.024 0.000 1.908 2178 A HA 0.085 4.405 4.320 -0.000 0.000 0.218 2178 A C 2.476 180.080 177.584 0.034 0.000 1.181 2178 A CA 2.428 54.484 52.037 0.031 0.000 0.627 2178 A CB -1.005 18.025 19.000 0.050 0.000 0.818 2178 A HN 1.177 nan 8.150 nan 0.000 0.445 2179 A N -2.604 120.242 122.820 0.043 0.000 2.014 2179 A HA 0.364 4.684 4.320 -0.000 0.000 0.218 2179 A C 2.112 179.711 177.584 0.026 0.000 1.163 2179 A CA 1.783 53.841 52.037 0.035 0.000 0.652 2179 A CB -0.639 18.386 19.000 0.042 0.000 0.808 2179 A HN 1.849 nan 8.150 nan 0.000 0.449 2180 G N -1.691 107.124 108.800 0.025 0.000 2.792 2180 G HA2 -0.084 3.876 3.960 -0.000 0.000 0.201 2180 G HA3 -0.084 3.876 3.960 -0.000 0.000 0.201 2180 G C 0.506 175.418 174.900 0.021 0.000 1.322 2180 G CA 0.555 45.666 45.100 0.019 0.000 0.910 2180 G HN 1.841 nan 8.290 nan 0.000 0.535 2181 S N -0.763 114.952 115.700 0.024 0.000 2.685 2181 S HA 0.702 5.172 4.470 -0.000 0.000 0.282 2181 S C 1.172 175.792 174.600 0.032 0.000 1.159 2181 S CA 0.367 58.583 58.200 0.026 0.000 0.833 2181 S CB 1.707 64.921 63.200 0.023 0.000 1.151 2181 S HN 1.155 nan 8.310 nan 0.000 0.485 2182 V N 1.302 121.236 119.914 0.034 0.000 2.287 2182 V HA -0.167 3.953 4.120 -0.000 0.000 0.248 2182 V C 2.676 178.790 176.094 0.033 0.000 1.053 2182 V CA 2.019 64.342 62.300 0.039 0.000 1.027 2182 V CB -1.665 30.182 31.823 0.039 0.000 0.646 2182 V HN 0.969 nan 8.190 nan 0.000 0.447 2183 V N -1.544 118.386 119.914 0.027 0.000 2.626 2183 V HA -0.164 3.956 4.120 -0.000 0.000 0.252 2183 V C 2.100 178.205 176.094 0.019 0.000 1.067 2183 V CA 2.068 64.381 62.300 0.022 0.000 1.081 2183 V CB -0.871 30.964 31.823 0.020 0.000 0.686 2183 V HN 0.411 nan 8.190 nan 0.000 0.468 2184 D N 1.655 122.068 120.400 0.021 0.000 2.084 2184 D HA -0.075 4.565 4.640 -0.000 0.000 0.194 2184 D C 2.377 178.689 176.300 0.019 0.000 0.990 2184 D CA 2.095 56.107 54.000 0.019 0.000 0.826 2184 D CB -0.423 40.389 40.800 0.020 0.000 0.971 2184 D HN 0.560 nan 8.370 nan 0.000 0.453 2185 A N 1.107 123.944 122.820 0.028 0.000 1.908 2185 A HA -0.153 4.167 4.320 -0.000 0.000 0.218 2185 A C 2.376 179.967 177.584 0.012 0.000 1.181 2185 A CA 0.969 53.024 52.037 0.030 0.000 0.627 2185 A CB -0.924 18.114 19.000 0.063 0.000 0.818 2185 A HN 0.239 nan 8.150 nan 0.000 0.445 2186 L N -1.040 120.193 121.223 0.015 0.000 1.989 2186 L HA -0.232 4.108 4.340 -0.000 0.000 0.211 2186 L C 2.880 179.750 176.870 0.001 0.000 1.071 2186 L CA 1.478 56.322 54.840 0.007 0.000 0.749 2186 L CB -0.282 41.785 42.059 0.013 0.000 0.890 2186 L HN 0.310 nan 8.230 nan 0.000 0.431 2187 R N -0.266 120.236 120.500 0.004 0.000 2.081 2187 R HA -0.102 4.237 4.340 -0.000 0.000 0.235 2187 R C 2.174 178.472 176.300 -0.003 0.000 1.131 2187 R CA 1.364 57.465 56.100 0.001 0.000 0.960 2187 R CB -1.163 29.140 30.300 0.005 0.000 0.856 2187 R HN 0.456 nan 8.270 nan 0.000 0.436 2188 A N 0.748 123.566 122.820 -0.003 0.000 1.873 2188 A HA -0.152 4.168 4.320 -0.000 0.000 0.218 2188 A C 2.488 180.061 177.584 -0.018 0.000 1.193 2188 A CA 2.063 54.095 52.037 -0.008 0.000 0.629 2188 A CB -0.785 18.213 19.000 -0.004 0.000 0.826 2188 A HN 0.115 nan 8.150 nan 0.000 0.447 2189 V N 0.130 120.028 119.914 -0.027 0.000 2.427 2189 V HA -0.218 3.902 4.120 -0.000 0.000 0.248 2189 V C 2.698 178.774 176.094 -0.030 0.000 1.051 2189 V CA 1.911 64.186 62.300 -0.040 0.000 1.048 2189 V CB -0.852 30.936 31.823 -0.060 0.000 0.666 2189 V HN 0.446 nan 8.190 nan 0.000 0.456 2190 R N 0.397 120.885 120.500 -0.020 0.000 2.081 2190 R HA -0.166 4.174 4.340 -0.000 0.000 0.235 2190 R C 2.128 178.420 176.300 -0.014 0.000 1.131 2190 R CA 1.856 57.947 56.100 -0.014 0.000 0.960 2190 R CB -0.941 29.355 30.300 -0.008 0.000 0.856 2190 R HN 0.570 nan 8.270 nan 0.000 0.436 2191 N N 0.394 119.087 118.700 -0.012 0.000 2.331 2191 N HA -0.069 4.671 4.740 -0.000 0.000 0.180 2191 N C 1.366 176.867 175.510 -0.014 0.000 1.019 2191 N CA 1.190 54.233 53.050 -0.011 0.000 0.881 2191 N CB 0.095 38.577 38.487 -0.008 0.000 0.972 2191 N HN 0.209 nan 8.380 nan 0.000 0.435 2192 A N -0.909 121.900 122.820 -0.019 0.000 2.030 2192 A HA 0.571 4.891 4.320 -0.000 0.000 0.215 2192 A C 0.964 178.533 177.584 -0.025 0.000 1.164 2192 A CA 0.794 52.817 52.037 -0.022 0.000 0.697 2192 A CB 0.069 19.053 19.000 -0.027 0.000 0.827 2192 A HN 0.282 nan 8.150 nan 0.000 0.457 2193 A N -0.114 122.690 122.820 -0.027 0.000 3.370 2193 A HA 0.558 4.878 4.320 -0.000 0.000 0.295 2193 A C -1.690 175.879 177.584 -0.023 0.000 1.030 2193 A CA -0.660 51.360 52.037 -0.028 0.000 0.883 2193 A CB 0.386 19.364 19.000 -0.037 0.000 1.191 2193 A HN 0.144 nan 8.150 nan 0.000 0.507 2194 P HA -0.164 nan 4.420 nan 0.000 0.221 2194 P C 0.390 177.683 177.300 -0.013 0.000 1.145 2194 P CA 1.408 64.499 63.100 -0.014 0.000 0.795 2194 P CB 0.160 31.853 31.700 -0.011 0.000 0.775 2195 D N -1.465 118.926 120.400 -0.015 0.000 2.328 2195 D HA 0.047 4.687 4.640 -0.000 0.000 0.221 2195 D C 0.374 176.664 176.300 -0.016 0.000 1.072 2195 D CA -0.220 53.772 54.000 -0.014 0.000 0.850 2195 D CB -0.106 40.685 40.800 -0.015 0.000 0.922 2195 D HN 0.130 nan 8.370 nan 0.000 0.516 2196 L N 1.277 122.488 121.223 -0.019 0.000 2.325 2196 L HA 0.457 4.797 4.340 -0.000 0.000 0.278 2196 L C -2.451 174.409 176.870 -0.016 0.000 1.023 2196 L CA -2.274 52.553 54.840 -0.022 0.000 0.811 2196 L CB 1.665 43.705 42.059 -0.031 0.000 1.249 2196 L HN -0.301 nan 8.230 nan 0.000 0.431 2197 P HA 0.083 nan 4.420 nan 0.000 0.267 2197 P C -1.027 176.270 177.300 -0.005 0.000 1.209 2197 P CA -0.150 62.949 63.100 -0.002 0.000 0.763 2197 P CB 0.344 32.047 31.700 0.005 0.000 0.816 2198 C N 4.766 124.066 119.300 -0.000 0.000 2.273 2198 C HA 0.296 4.756 4.460 -0.000 0.000 0.328 2198 C C 0.050 175.046 174.990 0.010 0.000 1.275 2198 C CA -0.146 58.870 59.018 -0.003 0.000 1.704 2198 C CB -0.962 26.776 27.740 -0.004 0.000 2.326 2198 C HN 0.559 nan 8.230 nan 0.000 0.517 2199 E N 3.112 123.319 120.200 0.012 0.000 2.199 2199 E HA 0.526 4.876 4.350 -0.000 0.000 0.265 2199 E C -1.171 175.443 176.600 0.023 0.000 0.882 2199 E CA -0.388 56.028 56.400 0.027 0.000 0.759 2199 E CB 2.248 31.978 29.700 0.050 0.000 1.148 2199 E HN 0.477 nan 8.360 nan 0.000 0.412 2200 V N 2.539 122.466 119.914 0.022 0.000 2.604 2200 V HA 0.339 4.459 4.120 -0.000 0.000 0.305 2200 V C -0.930 175.175 176.094 0.018 0.000 1.043 2200 V CA -0.525 61.791 62.300 0.026 0.000 0.888 2200 V CB 1.812 33.650 31.823 0.025 0.000 0.995 2200 V HN 0.760 nan 8.190 nan 0.000 0.429 2201 E N 4.658 124.874 120.200 0.028 0.000 2.174 2201 E HA 0.605 4.955 4.350 -0.000 0.000 0.282 2201 E C -0.985 175.630 176.600 0.024 0.000 0.992 2201 E CA -0.568 55.841 56.400 0.015 0.000 0.803 2201 E CB 1.792 31.507 29.700 0.026 0.000 1.090 2201 E HN 0.826 nan 8.360 nan 0.000 0.396 2202 V N 1.709 121.631 119.914 0.013 0.000 2.769 2202 V HA 0.504 4.624 4.120 -0.000 0.000 0.312 2202 V C -0.495 175.695 176.094 0.161 0.000 1.061 2202 V CA -0.660 61.684 62.300 0.073 0.000 0.931 2202 V CB 1.909 33.784 31.823 0.087 0.000 1.010 2202 V HN 0.779 nan 8.190 nan 0.000 0.433 2203 D N 1.063 121.599 120.400 0.227 0.000 2.513 2203 D HA 0.340 4.980 4.640 -0.000 0.000 0.222 2203 D C 0.308 176.748 176.300 0.234 0.000 1.210 2203 D CA 0.517 54.702 54.000 0.308 0.000 0.825 2203 D CB 0.328 41.215 40.800 0.144 0.000 1.037 2203 D HN 1.030 nan 8.370 nan 0.000 0.506 2204 S N -1.267 114.567 115.700 0.224 0.000 2.565 2204 S HA 0.368 4.838 4.470 -0.000 0.000 0.269 2204 S C 0.293 174.917 174.600 0.040 0.000 1.153 2204 S CA -0.953 57.211 58.200 -0.060 0.000 0.835 2204 S CB 0.759 63.942 63.200 -0.029 0.000 1.122 2204 S HN -0.002 nan 8.310 nan 0.000 0.462 2205 L N 0.759 121.907 121.223 -0.126 0.000 2.376 2205 L HA 0.023 4.363 4.340 -0.000 0.000 0.219 2205 L C 2.135 179.036 176.870 0.051 0.000 1.133 2205 L CA 1.037 55.884 54.840 0.012 0.000 0.816 2205 L CB -0.517 41.504 42.059 -0.064 0.000 0.933 2205 L HN 0.714 nan 8.230 nan 0.000 0.449 2206 E N -0.011 120.207 120.200 0.029 0.000 2.046 2206 E HA -0.198 4.151 4.350 -0.000 0.000 0.190 2206 E C 2.202 178.833 176.600 0.052 0.000 0.982 2206 E CA 1.002 57.424 56.400 0.037 0.000 0.800 2206 E CB -0.120 29.595 29.700 0.024 0.000 0.756 2206 E HN 0.432 nan 8.360 nan 0.000 0.449 2207 Q N -0.036 119.804 119.800 0.066 0.000 2.167 2207 Q HA -0.118 4.221 4.340 -0.000 0.000 0.202 2207 Q C 2.208 178.253 176.000 0.076 0.000 0.970 2207 Q CA 0.845 56.690 55.803 0.069 0.000 0.855 2207 Q CB -0.146 28.640 28.738 0.080 0.000 0.911 2207 Q HN 0.206 nan 8.270 nan 0.000 0.438 2208 L N 1.354 122.642 121.223 0.109 0.000 1.970 2208 L HA -0.224 4.116 4.340 -0.000 0.000 0.212 2208 L C 1.524 178.434 176.870 0.066 0.000 1.071 2208 L CA 2.018 56.917 54.840 0.099 0.000 0.751 2208 L CB -0.474 41.678 42.059 0.154 0.000 0.889 2208 L HN 0.087 nan 8.230 nan 0.000 0.432 2209 D N 0.081 120.520 120.400 0.064 0.000 2.158 2209 D HA -0.221 4.418 4.640 -0.000 0.000 0.197 2209 D C 2.156 178.479 176.300 0.039 0.000 0.995 2209 D CA 1.596 55.624 54.000 0.048 0.000 0.846 2209 D CB -0.284 40.543 40.800 0.044 0.000 0.941 2209 D HN 0.575 nan 8.370 nan 0.000 0.456 2210 A N 0.658 123.501 122.820 0.039 0.000 1.898 2210 A HA -0.122 4.198 4.320 -0.000 0.000 0.216 2210 A C 2.466 180.068 177.584 0.030 0.000 1.181 2210 A CA 2.001 54.057 52.037 0.033 0.000 0.620 2210 A CB -0.632 18.388 19.000 0.033 0.000 0.819 2210 A HN 0.246 nan 8.150 nan 0.000 0.442 2211 V N -2.501 117.433 119.914 0.032 0.000 2.788 2211 V HA -0.011 4.109 4.120 -0.000 0.000 0.251 2211 V C 2.200 178.308 176.094 0.023 0.000 1.068 2211 V CA 1.124 63.441 62.300 0.027 0.000 1.090 2211 V CB -0.940 30.900 31.823 0.027 0.000 0.710 2211 V HN 0.413 nan 8.190 nan 0.000 0.467 2212 L N 0.920 122.158 121.223 0.025 0.000 2.021 2212 L HA -0.109 4.231 4.340 -0.000 0.000 0.215 2212 L C 0.619 177.500 176.870 0.018 0.000 1.074 2212 L CA 2.622 57.475 54.840 0.022 0.000 0.760 2212 L CB -1.844 40.231 42.059 0.025 0.000 0.889 2212 L HN 0.376 nan 8.230 nan 0.000 0.433 2213 P HA -0.167 nan 4.420 nan 0.000 0.220 2213 P C 0.983 178.291 177.300 0.014 0.000 1.148 2213 P CA 1.233 64.342 63.100 0.016 0.000 0.803 2213 P CB -0.060 31.650 31.700 0.016 0.000 0.782 2214 E N 0.513 120.722 120.200 0.014 0.000 2.338 2214 E HA -0.091 4.258 4.350 -0.000 0.000 0.197 2214 E C 0.450 177.056 176.600 0.011 0.000 1.007 2214 E CA 0.357 56.765 56.400 0.012 0.000 0.849 2214 E CB -0.621 29.087 29.700 0.013 0.000 0.774 2214 E HN 0.340 nan 8.360 nan 0.000 0.506 2215 K N 0.765 121.173 120.400 0.012 0.000 3.653 2215 K HA -0.143 4.177 4.320 -0.000 0.000 0.275 2215 K C -2.385 174.222 176.600 0.011 0.000 0.962 2215 K CA 0.253 56.547 56.287 0.011 0.000 0.773 2215 K CB -1.085 31.421 32.500 0.010 0.000 1.463 2215 K HN 0.237 nan 8.250 nan 0.000 0.450 2216 P HA 0.050 nan 4.420 nan 0.000 0.274 2216 P C 0.405 177.714 177.300 0.015 0.000 1.256 2216 P CA -0.077 63.030 63.100 0.012 0.000 0.795 2216 P CB 0.791 32.498 31.700 0.012 0.000 1.038 2217 E N -0.459 119.751 120.200 0.017 0.000 2.077 2217 E HA -0.029 4.321 4.350 -0.000 0.000 0.193 2217 E C 0.504 177.123 176.600 0.033 0.000 0.989 2217 E CA 1.252 57.667 56.400 0.024 0.000 0.800 2217 E CB -0.292 29.423 29.700 0.026 0.000 0.746 2217 E HN 0.304 nan 8.360 nan 0.000 0.452 2218 L N -0.673 120.568 121.223 0.029 0.000 2.466 2218 L HA 0.462 4.802 4.340 -0.000 0.000 0.258 2218 L C -1.625 175.254 176.870 0.015 0.000 0.973 2218 L CA -0.429 54.430 54.840 0.031 0.000 0.826 2218 L CB 1.684 43.762 42.059 0.032 0.000 1.372 2218 L HN -0.140 nan 8.230 nan 0.000 0.409 2219 I N 4.391 124.960 120.570 -0.000 0.000 2.474 2219 I HA 0.400 4.570 4.170 -0.000 0.000 0.294 2219 I C -1.116 174.966 176.117 -0.057 0.000 1.005 2219 I CA -0.680 60.605 61.300 -0.026 0.000 1.113 2219 I CB 1.979 39.957 38.000 -0.037 0.000 1.289 2219 I HN 0.445 nan 8.210 nan 0.000 0.436 2220 L N 6.779 127.962 121.223 -0.066 0.000 2.265 2220 L HA 0.390 4.730 4.340 -0.000 0.000 0.289 2220 L C -0.398 176.357 176.870 -0.192 0.000 1.033 2220 L CA -0.172 54.611 54.840 -0.096 0.000 0.814 2220 L CB 1.005 43.039 42.059 -0.042 0.000 1.203 2220 L HN 0.385 nan 8.230 nan 0.000 0.423 2221 L N 3.279 124.306 121.223 -0.328 0.000 2.363 2221 L HA 0.193 4.533 4.340 -0.000 0.000 0.286 2221 L C -0.054 176.589 176.870 -0.378 0.000 1.106 2221 L CA -0.320 54.097 54.840 -0.705 0.000 0.859 2221 L CB 0.211 41.703 42.059 -0.946 0.000 1.223 2221 L HN 0.525 nan 8.230 nan 0.000 0.446 2222 D N 4.912 125.218 120.400 -0.157 0.000 2.352 2222 D HA 0.035 4.675 4.640 -0.000 0.000 0.245 2222 D C 0.380 176.793 176.300 0.189 0.000 1.224 2222 D CA 0.062 54.079 54.000 0.029 0.000 0.879 2222 D CB 0.269 41.100 40.800 0.051 0.000 1.057 2222 D HN 0.410 nan 8.370 nan 0.000 0.491 2223 N N 3.259 122.042 118.700 0.138 0.000 2.714 2223 N HA -0.228 4.511 4.740 -0.000 0.000 0.253 2223 N C -0.961 174.728 175.510 0.298 0.000 1.024 2223 N CA 0.508 53.661 53.050 0.172 0.000 0.726 2223 N CB -0.998 37.559 38.487 0.116 0.000 0.908 2223 N HN 0.302 nan 8.380 nan 0.000 0.542 2224 F N 0.909 120.874 119.950 0.024 0.000 2.385 2224 F HA 0.523 5.050 4.527 0.000 0.000 0.336 2224 F C 1.293 177.129 175.800 0.061 0.000 1.100 2224 F CA -1.025 56.964 58.000 -0.018 0.000 1.116 2224 F CB 0.846 39.823 39.000 -0.039 0.000 1.166 2224 F HN 0.170 nan 8.300 nan 0.000 0.511 2225 A N 2.666 125.482 122.820 -0.007 0.000 2.346 2225 A HA 0.359 4.678 4.320 -0.000 0.000 0.252 2225 A C 1.149 178.659 177.584 -0.123 0.000 1.089 2225 A CA -0.404 51.616 52.037 -0.028 0.000 0.797 2225 A CB 0.128 19.042 19.000 -0.144 0.000 1.047 2225 A HN 0.679 nan 8.150 nan 0.000 0.494 2226 V N 1.183 120.961 119.914 -0.226 0.000 2.332 2226 V HA -0.258 3.862 4.120 -0.000 0.000 0.248 2226 V C 2.303 178.329 176.094 -0.115 0.000 1.055 2226 V CA 2.354 64.424 62.300 -0.384 0.000 1.038 2226 V CB -1.254 30.322 31.823 -0.411 0.000 0.651 2226 V HN 1.073 nan 8.190 nan 0.000 0.450 2227 W N 0.929 122.188 121.300 -0.068 0.000 2.363 2227 W HA -0.201 4.459 4.660 -0.000 0.000 0.296 2227 W C 1.838 178.365 176.519 0.012 0.000 1.212 2227 W CA 1.313 58.640 57.345 -0.029 0.000 1.260 2227 W CB -1.005 28.436 29.460 -0.031 0.000 1.131 2227 W HN 0.294 nan 8.180 nan 0.000 0.530 2228 Q N 0.621 119.848 119.800 -0.956 0.000 2.172 2228 Q HA -0.091 4.249 4.340 -0.000 0.000 0.200 2228 Q C 2.314 178.262 176.000 -0.088 0.000 0.964 2228 Q CA 2.309 57.599 55.803 -0.854 0.000 0.855 2228 Q CB -0.306 27.734 28.738 -1.163 0.000 0.918 2228 Q HN 0.207 nan 8.270 nan 0.000 0.444 2229 T N 0.638 115.214 114.554 0.037 0.000 2.812 2229 T HA -0.181 4.169 4.350 -0.000 0.000 0.264 2229 T C 1.726 176.468 174.700 0.071 0.000 1.042 2229 T CA 1.300 63.483 62.100 0.138 0.000 1.140 2229 T CB -0.156 68.796 68.868 0.140 0.000 0.870 2229 T HN 0.145 nan 8.240 nan 0.000 0.445 2230 Q N 1.262 121.090 119.800 0.047 0.000 2.096 2230 Q HA -0.113 4.227 4.340 -0.000 0.000 0.204 2230 Q C 2.264 178.310 176.000 0.078 0.000 0.982 2230 Q CA 2.020 57.861 55.803 0.062 0.000 0.850 2230 Q CB -1.014 27.776 28.738 0.086 0.000 0.901 2230 Q HN 0.467 nan 8.270 nan 0.000 0.422 2231 T N 0.268 114.880 114.554 0.097 0.000 2.708 2231 T HA -0.103 4.247 4.350 -0.000 0.000 0.266 2231 T C 1.728 176.480 174.700 0.087 0.000 1.037 2231 T CA 1.439 63.602 62.100 0.104 0.000 1.146 2231 T CB -0.668 68.272 68.868 0.119 0.000 0.865 2231 T HN 0.474 nan 8.240 nan 0.000 0.435 2232 A N 1.030 123.911 122.820 0.102 0.000 1.908 2232 A HA -0.085 4.235 4.320 -0.000 0.000 0.218 2232 A C 2.596 180.209 177.584 0.049 0.000 1.181 2232 A CA 1.529 53.624 52.037 0.097 0.000 0.627 2232 A CB -1.116 17.948 19.000 0.107 0.000 0.818 2232 A HN 0.352 nan 8.150 nan 0.000 0.445 2233 V N -0.190 119.748 119.914 0.039 0.000 2.295 2233 V HA -0.336 3.784 4.120 -0.000 0.000 0.246 2233 V C 2.673 178.782 176.094 0.025 0.000 1.049 2233 V CA 2.358 64.671 62.300 0.021 0.000 1.024 2233 V CB -0.932 30.901 31.823 0.017 0.000 0.648 2233 V HN 0.660 nan 8.190 nan 0.000 0.447 2234 Q N -0.458 119.364 119.800 0.037 0.000 2.061 2234 Q HA -0.217 4.123 4.340 -0.000 0.000 0.204 2234 Q C 2.483 178.504 176.000 0.035 0.000 0.984 2234 Q CA 1.741 57.566 55.803 0.036 0.000 0.846 2234 Q CB -0.241 28.526 28.738 0.047 0.000 0.902 2234 Q HN 0.577 nan 8.270 nan 0.000 0.421 2235 R N 0.129 120.655 120.500 0.043 0.000 2.092 2235 R HA -0.068 4.271 4.340 -0.000 0.000 0.231 2235 R C 2.392 178.709 176.300 0.030 0.000 1.119 2235 R CA 0.832 56.956 56.100 0.040 0.000 0.970 2235 R CB -0.206 30.124 30.300 0.051 0.000 0.864 2235 R HN 0.099 nan 8.270 nan 0.000 0.440 2236 R N 1.453 121.968 120.500 0.025 0.000 2.075 2236 R HA -0.123 4.217 4.340 -0.000 0.000 0.232 2236 R C 1.008 177.315 176.300 0.011 0.000 1.126 2236 R CA 1.747 57.856 56.100 0.015 0.000 0.963 2236 R CB -0.381 29.923 30.300 0.007 0.000 0.858 2236 R HN 0.113 nan 8.270 nan 0.000 0.435 2237 D N 0.075 120.482 120.400 0.011 0.000 2.178 2237 D HA -0.115 4.525 4.640 -0.000 0.000 0.201 2237 D C 1.850 178.156 176.300 0.010 0.000 0.980 2237 D CA 1.913 55.918 54.000 0.007 0.000 0.842 2237 D CB 0.004 40.809 40.800 0.008 0.000 0.948 2237 D HN 0.414 nan 8.370 nan 0.000 0.472 2238 S N -0.510 115.199 115.700 0.014 0.000 2.439 2238 S HA 0.078 4.548 4.470 -0.000 0.000 0.224 2238 S C 1.795 176.404 174.600 0.014 0.000 1.029 2238 S CA 0.056 58.265 58.200 0.015 0.000 0.946 2238 S CB 0.223 63.434 63.200 0.018 0.000 0.797 2238 S HN 0.142 nan 8.310 nan 0.000 0.504 2239 R N 0.976 121.485 120.500 0.016 0.000 2.195 2239 R HA 0.499 4.839 4.340 -0.000 0.000 0.197 2239 R C 0.263 176.571 176.300 0.013 0.000 0.990 2239 R CA 0.710 56.819 56.100 0.016 0.000 1.048 2239 R CB 0.400 30.712 30.300 0.019 0.000 0.997 2239 R HN 0.387 nan 8.270 nan 0.000 0.502 2240 A N 1.277 124.104 122.820 0.012 0.000 3.158 2240 A HA 0.353 4.672 4.320 -0.000 0.000 0.302 2240 A C -2.380 175.208 177.584 0.007 0.000 1.162 2240 A CA -1.047 50.996 52.037 0.010 0.000 0.824 2240 A CB 0.807 19.814 19.000 0.012 0.000 1.322 2240 A HN -0.099 nan 8.150 nan 0.000 0.510 2241 P HA -0.168 nan 4.420 nan 0.000 0.220 2241 P C 1.642 178.942 177.300 -0.001 0.000 1.144 2241 P CA 2.226 65.326 63.100 0.001 0.000 0.800 2241 P CB 0.070 31.771 31.700 0.001 0.000 0.772 2242 T N -4.463 110.092 114.554 0.003 0.000 3.043 2242 T HA 0.041 4.391 4.350 -0.000 0.000 0.263 2242 T C 0.830 175.535 174.700 0.009 0.000 1.094 2242 T CA 0.082 62.185 62.100 0.005 0.000 1.127 2242 T CB -0.936 67.937 68.868 0.008 0.000 0.905 2242 T HN -0.173 nan 8.240 nan 0.000 0.490 2243 V N 4.047 123.966 119.914 0.008 0.000 2.479 2243 V HA 0.209 4.329 4.120 -0.000 0.000 0.281 2243 V C 0.631 176.731 176.094 0.010 0.000 1.031 2243 V CA -0.276 62.031 62.300 0.011 0.000 1.038 2243 V CB 0.174 32.002 31.823 0.009 0.000 0.981 2243 V HN 0.466 nan 8.190 nan 0.000 0.478 2244 M N 5.411 125.027 119.600 0.028 0.000 2.250 2244 M HA 0.409 4.889 4.480 -0.000 0.000 0.344 2244 M C -0.641 175.678 176.300 0.032 0.000 1.150 2244 M CA -0.480 54.843 55.300 0.039 0.000 1.147 2244 M CB 1.126 33.808 32.600 0.136 0.000 1.498 2244 M HN 0.304 nan 8.290 nan 0.000 0.461 2245 L N 1.910 123.138 121.223 0.009 0.000 2.346 2245 L HA 0.470 4.810 4.340 -0.000 0.000 0.276 2245 L C -0.299 176.586 176.870 0.025 0.000 1.006 2245 L CA -0.244 54.589 54.840 -0.012 0.000 0.817 2245 L CB 1.628 43.660 42.059 -0.044 0.000 1.272 2245 L HN 0.702 nan 8.230 nan 0.000 0.421 2246 E N 1.339 121.538 120.200 -0.001 0.000 2.241 2246 E HA 0.485 4.835 4.350 -0.000 0.000 0.263 2246 E C -1.254 175.307 176.600 -0.066 0.000 0.882 2246 E CA -0.393 56.017 56.400 0.018 0.000 0.769 2246 E CB 1.398 31.103 29.700 0.009 0.000 1.185 2246 E HN 0.585 nan 8.360 nan 0.000 0.415 2247 S N 2.223 117.890 115.700 -0.055 0.000 2.523 2247 S HA 0.375 4.845 4.470 -0.000 0.000 0.275 2247 S C -0.613 173.911 174.600 -0.127 0.000 1.281 2247 S CA -0.435 57.704 58.200 -0.101 0.000 1.050 2247 S CB 1.316 64.469 63.200 -0.078 0.000 0.937 2247 S HN 0.429 nan 8.310 nan 0.000 0.492 2248 S N 1.829 117.449 115.700 -0.132 0.000 2.619 2248 S HA 0.739 5.209 4.470 -0.000 0.000 0.280 2248 S C 0.278 174.830 174.600 -0.081 0.000 1.150 2248 S CA 0.322 58.459 58.200 -0.105 0.000 0.978 2248 S CB 0.805 63.963 63.200 -0.070 0.000 1.041 2248 S HN 1.185 nan 8.310 nan 0.000 0.485 2249 G N 3.592 112.347 108.800 -0.076 0.000 1.829 2249 G HA2 -0.006 3.954 3.960 -0.000 0.000 0.214 2249 G HA3 -0.006 3.954 3.960 -0.000 0.000 0.214 2249 G C 0.640 175.520 174.900 -0.033 0.000 1.627 2249 G CA 0.070 45.151 45.100 -0.032 0.000 1.390 2249 G HN 1.605 nan 8.290 nan 0.000 0.458 2250 G N 0.913 109.686 108.800 -0.043 0.000 3.471 2250 G HA2 0.501 4.461 3.960 -0.000 0.000 0.254 2250 G HA3 0.501 4.461 3.960 -0.000 0.000 0.254 2250 G C -0.226 174.634 174.900 -0.067 0.000 1.199 2250 G CA 0.146 45.242 45.100 -0.006 0.000 1.683 2250 G HN 0.422 nan 8.290 nan 0.000 0.625 2251 L N 1.505 122.678 121.223 -0.082 0.000 2.309 2251 L HA 0.646 4.986 4.340 -0.000 0.000 0.282 2251 L C 0.490 177.499 176.870 0.232 0.000 1.036 2251 L CA -0.829 54.005 54.840 -0.010 0.000 0.806 2251 L CB 1.634 43.669 42.059 -0.040 0.000 1.220 2251 L HN 0.230 nan 8.230 nan 0.000 0.429 2252 S N 1.809 117.661 115.700 0.254 0.000 2.595 2252 S HA 0.435 4.905 4.470 -0.000 0.000 0.281 2252 S C 0.435 174.960 174.600 -0.126 0.000 1.117 2252 S CA -0.706 57.606 58.200 0.186 0.000 0.873 2252 S CB 1.202 64.455 63.200 0.090 0.000 1.108 2252 S HN 0.399 nan 8.310 nan 0.000 0.477 2253 L N 1.510 122.441 121.223 -0.486 0.000 2.261 2253 L HA -0.054 4.286 4.340 -0.000 0.000 0.216 2253 L C 2.507 179.118 176.870 -0.432 0.000 1.114 2253 L CA 1.845 56.124 54.840 -0.936 0.000 0.777 2253 L CB -0.965 40.583 42.059 -0.853 0.000 0.910 2253 L HN 0.821 nan 8.230 nan 0.000 0.440 2254 Q N -1.592 118.084 119.800 -0.206 0.000 2.187 2254 Q HA -0.044 4.295 4.340 -0.000 0.000 0.199 2254 Q C 1.837 177.817 176.000 -0.034 0.000 0.957 2254 Q CA 1.555 57.297 55.803 -0.101 0.000 0.857 2254 Q CB -1.042 27.668 28.738 -0.047 0.000 0.929 2254 Q HN 0.652 nan 8.270 nan 0.000 0.453 2255 T N -2.648 111.921 114.554 0.024 0.000 3.060 2255 T HA 0.447 4.797 4.350 -0.000 0.000 0.249 2255 T C 1.919 176.759 174.700 0.233 0.000 1.079 2255 T CA 0.436 62.630 62.100 0.156 0.000 1.013 2255 T CB 0.126 69.167 68.868 0.289 0.000 0.975 2255 T HN 0.226 nan 8.240 nan 0.000 0.518 2256 A N 2.250 125.133 122.820 0.104 0.000 1.884 2256 A HA 0.089 4.409 4.320 -0.000 0.000 0.219 2256 A C 2.790 180.478 177.584 0.174 0.000 1.197 2256 A CA 2.203 54.344 52.037 0.172 0.000 0.637 2256 A CB -1.515 17.496 19.000 0.018 0.000 0.827 2256 A HN 0.789 nan 8.150 nan 0.000 0.450 2257 A N -1.467 121.402 122.820 0.082 0.000 1.933 2257 A HA -0.061 4.259 4.320 -0.000 0.000 0.218 2257 A C 2.289 179.920 177.584 0.079 0.000 1.175 2257 A CA 2.278 54.355 52.037 0.068 0.000 0.628 2257 A CB -1.232 17.781 19.000 0.023 0.000 0.814 2257 A HN 0.472 nan 8.150 nan 0.000 0.444 2258 T N -1.233 113.371 114.554 0.083 0.000 2.708 2258 T HA -0.158 4.191 4.350 -0.000 0.000 0.266 2258 T C 1.732 176.432 174.700 -0.000 0.000 1.037 2258 T CA 1.846 63.958 62.100 0.021 0.000 1.146 2258 T CB -0.440 68.418 68.868 -0.017 0.000 0.865 2258 T HN 0.563 nan 8.240 nan 0.000 0.435 2259 Y N 1.360 121.693 120.300 0.055 0.000 2.163 2259 Y HA 0.035 4.585 4.550 -0.000 0.000 0.288 2259 Y C 2.776 178.701 175.900 0.042 0.000 1.136 2259 Y CA 0.818 58.951 58.100 0.056 0.000 1.147 2259 Y CB -0.734 37.770 38.460 0.073 0.000 0.987 2259 Y HN 0.178 nan 8.280 nan 0.000 0.509 2260 A N 0.130 123.075 122.820 0.207 0.000 1.940 2260 A HA -0.258 4.061 4.320 -0.000 0.000 0.219 2260 A C 1.972 179.594 177.584 0.063 0.000 1.176 2260 A CA 1.997 54.103 52.037 0.115 0.000 0.631 2260 A CB -0.675 18.386 19.000 0.101 0.000 0.814 2260 A HN 0.551 nan 8.150 nan 0.000 0.446 2261 E N -0.682 119.548 120.200 0.051 0.000 2.268 2261 E HA -0.126 4.224 4.350 -0.000 0.000 0.195 2261 E C 2.060 178.670 176.600 0.016 0.000 0.995 2261 E CA 1.294 57.709 56.400 0.024 0.000 0.836 2261 E CB -0.224 29.485 29.700 0.014 0.000 0.763 2261 E HN 0.894 nan 8.360 nan 0.000 0.491 2262 T N -3.257 111.309 114.554 0.021 0.000 2.962 2262 T HA -0.000 4.349 4.350 -0.000 0.000 0.270 2262 T C 1.617 176.327 174.700 0.017 0.000 1.088 2262 T CA 0.869 62.980 62.100 0.017 0.000 1.127 2262 T CB 0.175 69.056 68.868 0.021 0.000 0.883 2262 T HN 0.275 nan 8.240 nan 0.000 0.493 2263 G N 0.736 109.543 108.800 0.013 0.000 2.184 2263 G HA2 -0.173 3.787 3.960 -0.000 0.000 0.206 2263 G HA3 -0.173 3.787 3.960 -0.000 0.000 0.206 2263 G C 0.155 175.040 174.900 -0.025 0.000 0.995 2263 G CA -0.092 45.003 45.100 -0.007 0.000 0.651 2263 G HN 1.359 nan 8.290 nan 0.000 0.511 2264 V N -1.309 118.600 119.914 -0.009 0.000 3.178 2264 V HA 0.326 4.446 4.120 -0.000 0.000 0.306 2264 V C 1.246 177.276 176.094 -0.106 0.000 1.107 2264 V CA 0.883 63.162 62.300 -0.035 0.000 1.195 2264 V CB 0.777 32.604 31.823 0.007 0.000 0.993 2264 V HN 0.189 nan 8.190 nan 0.000 0.493 2265 D N 0.662 120.942 120.400 -0.201 0.000 2.213 2265 D HA 0.089 4.729 4.640 -0.000 0.000 0.205 2265 D C -0.214 175.683 176.300 -0.672 0.000 0.961 2265 D CA 1.635 55.346 54.000 -0.481 0.000 0.853 2265 D CB 0.220 40.629 40.800 -0.652 0.000 0.967 2265 D HN 0.703 nan 8.370 nan 0.000 0.496 2266 Y N -0.704 119.560 120.300 -0.060 0.000 2.588 2266 Y HA 0.445 4.995 4.550 -0.000 0.000 0.343 2266 Y C -0.799 175.054 175.900 -0.079 0.000 1.065 2266 Y CA -1.052 56.999 58.100 -0.081 0.000 1.038 2266 Y CB 1.509 39.885 38.460 -0.141 0.000 1.297 2266 Y HN -0.312 nan 8.280 nan 0.000 0.467 2267 L N 2.082 123.366 121.223 0.102 0.000 2.343 2267 L HA 0.759 5.098 4.340 -0.000 0.000 0.278 2267 L C -0.369 176.442 176.870 -0.097 0.000 0.996 2267 L CA -0.776 54.060 54.840 -0.007 0.000 0.831 2267 L CB 1.494 43.566 42.059 0.022 0.000 1.232 2267 L HN 0.776 nan 8.230 nan 0.000 0.413 2268 A N 4.421 127.163 122.820 -0.129 0.000 2.310 2268 A HA 0.629 4.948 4.320 -0.000 0.000 0.300 2268 A C -0.461 176.975 177.584 -0.247 0.000 1.269 2268 A CA -0.348 51.590 52.037 -0.164 0.000 0.909 2268 A CB 0.134 19.070 19.000 -0.108 0.000 1.144 2268 A HN 0.409 nan 8.150 nan 0.000 0.540 2269 V N 3.967 123.667 119.914 -0.356 0.000 2.275 2269 V HA 0.331 4.451 4.120 -0.000 0.000 0.272 2269 V C 1.442 177.283 176.094 -0.421 0.000 1.028 2269 V CA 0.225 62.210 62.300 -0.526 0.000 0.810 2269 V CB 0.693 31.896 31.823 -1.034 0.000 1.043 2269 V HN 1.034 nan 8.190 nan 0.000 0.453 2270 G N 3.384 111.993 108.800 -0.319 0.000 2.422 2270 G HA2 -0.151 3.809 3.960 -0.000 0.000 0.218 2270 G HA3 -0.151 3.809 3.960 -0.000 0.000 0.218 2270 G C 1.559 175.973 174.900 -0.810 0.000 1.140 2270 G CA 1.024 45.910 45.100 -0.357 0.000 0.775 2270 G HN 0.823 nan 8.290 nan 0.000 0.545 2271 A N 0.371 122.752 122.820 -0.731 0.000 2.076 2271 A HA 0.045 4.365 4.320 -0.000 0.000 0.220 2271 A C 2.261 179.610 177.584 -0.392 0.000 1.160 2271 A CA 1.150 52.812 52.037 -0.625 0.000 0.653 2271 A CB -0.276 18.626 19.000 -0.163 0.000 0.801 2271 A HN 0.301 nan 8.150 nan 0.000 0.455 2272 L N 0.041 121.032 121.223 -0.387 0.000 2.079 2272 L HA -0.137 4.203 4.340 -0.000 0.000 0.210 2272 L C 2.815 179.564 176.870 -0.201 0.000 1.081 2272 L CA 2.581 57.262 54.840 -0.265 0.000 0.752 2272 L CB -1.029 40.847 42.059 -0.304 0.000 0.896 2272 L HN 0.674 nan 8.230 nan 0.000 0.433 2273 T N -4.321 110.105 114.554 -0.214 0.000 3.034 2273 T HA 0.076 4.426 4.350 -0.000 0.000 0.248 2273 T C 0.664 175.370 174.700 0.010 0.000 1.040 2273 T CA 0.103 62.148 62.100 -0.092 0.000 1.107 2273 T CB -0.376 68.458 68.868 -0.056 0.000 0.932 2273 T HN 0.422 nan 8.240 nan 0.000 0.474 2274 H N 0.745 119.816 119.070 0.003 0.000 2.508 2274 H HA 0.715 5.271 4.556 -0.000 0.000 0.344 2274 H C 0.178 175.521 175.328 0.025 0.000 1.192 2274 H CA -0.950 55.112 56.048 0.024 0.000 1.290 2274 H CB 0.540 30.309 29.762 0.011 0.000 1.571 2274 H HN 0.017 nan 8.280 nan 0.000 0.555 2275 S N -1.121 114.774 115.700 0.324 0.000 3.706 2275 S HA -0.143 4.327 4.470 -0.000 0.000 0.363 2275 S C -0.001 174.658 174.600 0.100 0.000 0.999 2275 S CA 0.585 58.918 58.200 0.221 0.000 1.143 2275 S CB -2.386 60.999 63.200 0.309 0.000 0.902 2275 S HN 1.085 nan 8.310 nan 0.000 0.476 2276 V N -0.364 119.596 119.914 0.078 0.000 2.532 2276 V HA 0.730 4.850 4.120 -0.000 0.000 0.295 2276 V C 0.206 176.319 176.094 0.032 0.000 1.041 2276 V CA -1.059 61.245 62.300 0.007 0.000 0.926 2276 V CB 1.884 33.627 31.823 -0.133 0.000 0.992 2276 V HN 0.451 nan 8.190 nan 0.000 0.457 2277 R N 4.184 124.693 120.500 0.014 0.000 2.255 2277 R HA 0.554 4.894 4.340 -0.000 0.000 0.326 2277 R C -0.670 175.638 176.300 0.014 0.000 0.986 2277 R CA -0.530 55.586 56.100 0.027 0.000 0.847 2277 R CB 1.705 32.022 30.300 0.027 0.000 1.111 2277 R HN 0.845 nan 8.270 nan 0.000 0.452 2278 V N 5.422 125.357 119.914 0.036 0.000 2.901 2278 V HA -0.025 4.095 4.120 -0.000 0.000 0.307 2278 V C -0.118 175.987 176.094 0.020 0.000 1.084 2278 V CA 0.010 62.332 62.300 0.037 0.000 1.184 2278 V CB 0.856 32.714 31.823 0.058 0.000 0.941 2278 V HN 0.597 nan 8.190 nan 0.000 0.493 2279 L N 5.559 126.790 121.223 0.014 0.000 2.290 2279 L HA 0.415 4.755 4.340 -0.000 0.000 0.284 2279 L C -0.079 176.800 176.870 0.016 0.000 1.078 2279 L CA 0.052 54.898 54.840 0.010 0.000 0.815 2279 L CB 1.035 43.097 42.059 0.005 0.000 1.162 2279 L HN 0.754 nan 8.230 nan 0.000 0.435 2280 D N 5.558 125.966 120.400 0.013 0.000 2.339 2280 D HA 0.309 4.949 4.640 -0.000 0.000 0.256 2280 D C -0.654 175.652 176.300 0.010 0.000 1.214 2280 D CA 0.381 54.388 54.000 0.013 0.000 0.877 2280 D CB 0.180 40.987 40.800 0.010 0.000 1.111 2280 D HN 0.415 nan 8.370 nan 0.000 0.478 2281 I N 2.381 122.957 120.570 0.011 0.000 2.647 2281 I HA 0.586 4.756 4.170 -0.000 0.000 0.295 2281 I C 0.661 176.781 176.117 0.005 0.000 1.078 2281 I CA -1.048 60.257 61.300 0.008 0.000 1.048 2281 I CB 2.448 40.453 38.000 0.009 0.000 1.239 2281 I HN 0.360 nan 8.210 nan 0.000 0.421 2282 G N 3.926 112.728 108.800 0.003 0.000 2.569 2282 G HA2 0.663 4.623 3.960 -0.000 0.000 0.300 2282 G HA3 0.663 4.623 3.960 -0.000 0.000 0.300 2282 G C -1.909 172.990 174.900 -0.002 0.000 1.269 2282 G CA -0.600 44.500 45.100 0.001 0.000 0.959 2282 G HN 0.386 nan 8.290 nan 0.000 0.478 2283 L N 1.115 122.335 121.223 -0.004 0.000 2.262 2283 L HA 0.514 4.854 4.340 -0.000 0.000 0.288 2283 L C -1.141 175.727 176.870 -0.004 0.000 1.035 2283 L CA -0.774 54.062 54.840 -0.007 0.000 0.820 2283 L CB 1.097 43.149 42.059 -0.012 0.000 1.204 2283 L HN 0.250 nan 8.230 nan 0.000 0.424 2284 D N 6.430 126.828 120.400 -0.002 0.000 2.233 2284 D HA 0.517 5.156 4.640 -0.000 0.000 0.240 2284 D C -0.128 176.173 176.300 0.000 0.000 1.074 2284 D CA 0.087 54.087 54.000 -0.000 0.000 0.838 2284 D CB 1.654 42.455 40.800 0.001 0.000 1.124 2284 D HN 0.508 nan 8.370 nan 0.000 0.475 2285 M N 0.000 119.600 119.600 0.001 0.000 2.572 2285 M HA 0.000 4.480 4.480 -0.000 0.000 0.227 2285 M CA 0.000 55.301 55.300 0.002 0.000 0.988 2285 M CB 0.000 32.601 32.600 0.002 0.000 1.302 2285 M HN 0.000 nan 8.290 nan 0.000 0.411