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 3izi_1_N DATA FIRST_RESID 6670 DATA SEQUENCE VLPENMKRYM GRDAQRMNIL AGRIIAETVR STLGPKGMDK MLVDDLGDVV DATA SEQUENCE VTNDGVTILR EMSVEHPAAK MLIEVAKTQE KEVGDGTTTA VVVAGELLRK DATA SEQUENCE AEELLDQNVH PTIVVKGYQA AAQKAQELLK TIACEVGAQD KEILTKIAMT DATA SEQUENCE SITGKGAEKA KEKLAEIIVE AVSAVVDDEG KVDKDLIKIE KKSGASIDDT DATA SEQUENCE ELIKGVLVDK ERVSAQMPKK VTDAKIALLN CAIEIKETET DAEIRITDPA DATA SEQUENCE KLMEFIEQEE KMLKDMVAEI KASGANVLFC QKGIDDLAQH YLAKEGIVAA DATA SEQUENCE RRVKKSDMEK LAKATGANVI AAIAALSAQD LGDAGLVEER KISGDSMIFV DATA SEQUENCE EECKHPKAVT MLIRGTTEHV IEEVARAVDD AVGVVGCTIE DGRIVSGGGS DATA SEQUENCE TEVELSMKLR EYAEGISGRE QLAVRAFADA LEVIPRTLAE NAGLDAIEIL DATA SEQUENCE VKVRAAHASN GNKCAGLNVF TGAVEDMCEN GVVEPLRVKT QAIQSAAEST DATA SEQUENCE EMLLRIDDVI AAE 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 6670 V HA 0.000 nan 4.120 nan 0.000 0.244 6670 V C 0.000 176.094 176.094 0.000 0.000 1.182 6670 V CA 0.000 62.300 62.300 0.000 0.000 1.235 6670 V CB 0.000 31.825 31.823 0.003 0.000 1.184 6671 L N 3.837 125.059 121.223 -0.002 0.000 2.334 6671 L HA 0.625 4.965 4.340 -0.001 0.000 0.277 6671 L C -2.016 174.851 176.870 -0.006 0.000 1.075 6671 L CA -1.444 53.394 54.840 -0.003 0.000 0.804 6671 L CB 0.254 42.309 42.059 -0.007 0.000 1.174 6671 L HN 0.169 nan 8.230 nan 0.000 0.438 6672 P HA 0.067 nan 4.420 nan 0.000 0.272 6672 P C -0.635 176.659 177.300 -0.010 0.000 1.223 6672 P CA -0.571 62.526 63.100 -0.006 0.000 0.784 6672 P CB 0.578 32.276 31.700 -0.004 0.000 0.923 6673 E N 1.881 122.075 120.200 -0.010 0.000 2.415 6673 E HA -0.042 4.308 4.350 -0.001 0.000 0.260 6673 E C 0.628 177.220 176.600 -0.013 0.000 1.016 6673 E CA 0.811 57.204 56.400 -0.012 0.000 0.924 6673 E CB -0.438 29.256 29.700 -0.010 0.000 0.961 6673 E HN 0.610 nan 8.360 nan 0.000 0.459 6674 N N 2.354 121.044 118.700 -0.018 0.000 2.990 6674 N HA -0.200 4.540 4.740 -0.001 0.000 0.163 6674 N C -0.634 174.865 175.510 -0.019 0.000 1.452 6674 N CA 0.872 53.912 53.050 -0.017 0.000 1.624 6674 N CB -1.140 37.341 38.487 -0.011 0.000 1.088 6674 N HN 0.483 nan 8.380 nan 0.000 0.695 6675 M N 2.605 122.195 119.600 -0.017 0.000 2.238 6675 M HA 0.260 4.739 4.480 -0.001 0.000 0.350 6675 M C -0.419 175.859 176.300 -0.037 0.000 1.321 6675 M CA 0.493 55.785 55.300 -0.015 0.000 1.097 6675 M CB 0.557 33.153 32.600 -0.007 0.000 1.713 6675 M HN 0.055 nan 8.290 nan 0.000 0.455 6676 K N 4.209 124.585 120.400 -0.040 0.000 2.143 6676 K HA 0.512 4.832 4.320 -0.001 0.000 0.272 6676 K C -0.640 175.870 176.600 -0.150 0.000 1.001 6676 K CA -0.664 55.544 56.287 -0.130 0.000 0.915 6676 K CB 1.423 33.843 32.500 -0.135 0.000 1.047 6676 K HN 0.635 nan 8.250 nan 0.000 0.458 6677 R N 2.450 122.778 120.500 -0.287 0.000 2.628 6677 R HA 0.320 4.660 4.340 -0.001 0.000 0.288 6677 R C -1.601 174.483 176.300 -0.360 0.000 0.980 6677 R CA -0.586 55.399 56.100 -0.191 0.000 0.891 6677 R CB 0.950 31.200 30.300 -0.083 0.000 1.188 6677 R HN 0.534 nan 8.270 nan 0.000 0.450 6678 Y N 4.577 124.887 120.300 0.018 0.000 2.446 6678 Y HA 0.546 5.096 4.550 -0.001 0.000 0.345 6678 Y C 0.261 176.168 175.900 0.010 0.000 0.984 6678 Y CA -0.893 57.217 58.100 0.016 0.000 1.058 6678 Y CB 2.209 40.684 38.460 0.024 0.000 1.220 6678 Y HN 0.404 nan 8.280 nan 0.000 0.455 6679 M N 1.103 120.787 119.600 0.140 0.000 2.520 6679 M HA 0.755 5.234 4.480 -0.001 0.000 0.280 6679 M C 0.043 176.377 176.300 0.057 0.000 1.232 6679 M CA -0.203 55.144 55.300 0.078 0.000 0.892 6679 M CB 1.311 33.936 32.600 0.042 0.000 1.728 6679 M HN 0.845 nan 8.290 nan 0.000 0.475 6680 G N 3.035 111.855 108.800 0.034 0.000 2.629 6680 G HA2 -0.408 3.552 3.960 -0.001 0.000 0.313 6680 G HA3 -0.408 3.552 3.960 -0.001 0.000 0.313 6680 G C 0.511 175.417 174.900 0.010 0.000 1.217 6680 G CA 1.525 46.630 45.100 0.010 0.000 0.994 6680 G HN 1.172 nan 8.290 nan 0.000 0.549 6681 R N 1.027 121.531 120.500 0.005 0.000 2.159 6681 R HA -0.004 4.335 4.340 -0.001 0.000 0.237 6681 R C 2.130 178.448 176.300 0.031 0.000 1.131 6681 R CA 2.631 58.734 56.100 0.005 0.000 0.982 6681 R CB -0.622 29.678 30.300 0.001 0.000 0.868 6681 R HN 0.603 nan 8.270 nan 0.000 0.453 6682 D N -0.422 120.018 120.400 0.067 0.000 2.162 6682 D HA -0.012 4.628 4.640 -0.001 0.000 0.203 6682 D C 1.619 178.016 176.300 0.161 0.000 0.967 6682 D CA 1.379 55.464 54.000 0.141 0.000 0.840 6682 D CB -0.138 40.774 40.800 0.187 0.000 0.972 6682 D HN 0.354 nan 8.370 nan 0.000 0.482 6683 A N 1.095 123.995 122.820 0.133 0.000 1.930 6683 A HA -0.174 4.146 4.320 -0.001 0.000 0.217 6683 A C 2.146 179.723 177.584 -0.012 0.000 1.175 6683 A CA 1.153 53.241 52.037 0.085 0.000 0.627 6683 A CB -0.235 18.817 19.000 0.086 0.000 0.815 6683 A HN 0.064 nan 8.150 nan 0.000 0.443 6684 Q N -0.703 119.094 119.800 -0.006 0.000 2.062 6684 Q HA -0.098 4.241 4.340 -0.001 0.000 0.196 6684 Q C 2.276 178.250 176.000 -0.043 0.000 0.967 6684 Q CA 1.375 57.163 55.803 -0.026 0.000 0.832 6684 Q CB -0.412 28.312 28.738 -0.022 0.000 0.899 6684 Q HN 0.750 nan 8.270 nan 0.000 0.442 6685 R N 0.296 120.776 120.500 -0.032 0.000 2.083 6685 R HA -0.109 4.231 4.340 -0.001 0.000 0.237 6685 R C 2.285 178.522 176.300 -0.104 0.000 1.137 6685 R CA 1.367 57.440 56.100 -0.044 0.000 0.951 6685 R CB -0.175 30.119 30.300 -0.010 0.000 0.851 6685 R HN 0.184 nan 8.270 nan 0.000 0.434 6686 M N 1.033 120.539 119.600 -0.157 0.000 2.086 6686 M HA -0.162 4.317 4.480 -0.001 0.000 0.261 6686 M C 1.157 177.251 176.300 -0.343 0.000 1.067 6686 M CA 1.813 56.911 55.300 -0.338 0.000 1.116 6686 M CB -0.769 31.399 32.600 -0.720 0.000 1.348 6686 M HN 0.135 nan 8.290 nan 0.000 0.407 6687 N N 0.863 119.425 118.700 -0.230 0.000 2.166 6687 N HA -0.080 4.660 4.740 -0.001 0.000 0.186 6687 N C 1.809 177.234 175.510 -0.141 0.000 1.019 6687 N CA 1.440 54.390 53.050 -0.166 0.000 0.856 6687 N CB -0.464 37.971 38.487 -0.088 0.000 0.993 6687 N HN 0.483 nan 8.380 nan 0.000 0.426 6688 I N 0.129 120.630 120.570 -0.115 0.000 2.315 6688 I HA -0.196 3.973 4.170 -0.001 0.000 0.248 6688 I C 1.608 177.654 176.117 -0.117 0.000 1.117 6688 I CA 0.539 61.789 61.300 -0.084 0.000 1.404 6688 I CB -0.033 37.936 38.000 -0.051 0.000 1.071 6688 I HN 0.019 nan 8.210 nan 0.000 0.419 6689 L N 0.659 121.782 121.223 -0.167 0.000 2.093 6689 L HA -0.118 4.221 4.340 -0.001 0.000 0.208 6689 L C 2.662 179.377 176.870 -0.259 0.000 1.085 6689 L CA 1.966 56.693 54.840 -0.189 0.000 0.755 6689 L CB -1.264 40.674 42.059 -0.201 0.000 0.904 6689 L HN 0.183 nan 8.230 nan 0.000 0.435 6690 A N -0.624 121.958 122.820 -0.397 0.000 1.858 6690 A HA -0.086 4.233 4.320 -0.001 0.000 0.216 6690 A C 2.409 179.899 177.584 -0.157 0.000 1.190 6690 A CA 1.722 53.516 52.037 -0.405 0.000 0.617 6690 A CB -1.341 17.406 19.000 -0.422 0.000 0.827 6690 A HN 0.419 nan 8.150 nan 0.000 0.443 6691 G N -0.928 107.800 108.800 -0.120 0.000 2.408 6691 G HA2 -0.209 3.751 3.960 -0.001 0.000 0.217 6691 G HA3 -0.209 3.751 3.960 -0.001 0.000 0.217 6691 G C 1.745 176.609 174.900 -0.060 0.000 1.150 6691 G CA 0.985 46.045 45.100 -0.066 0.000 0.776 6691 G HN 0.551 nan 8.290 nan 0.000 0.542 6692 R N 0.003 120.460 120.500 -0.072 0.000 2.075 6692 R HA 0.065 4.404 4.340 -0.001 0.000 0.232 6692 R C 2.506 178.775 176.300 -0.052 0.000 1.126 6692 R CA 1.041 57.105 56.100 -0.059 0.000 0.963 6692 R CB -0.311 29.954 30.300 -0.058 0.000 0.858 6692 R HN 0.406 nan 8.270 nan 0.000 0.435 6693 I N 0.779 121.312 120.570 -0.060 0.000 2.226 6693 I HA -0.288 3.882 4.170 -0.001 0.000 0.245 6693 I C 2.070 178.172 176.117 -0.026 0.000 1.100 6693 I CA 0.821 62.097 61.300 -0.039 0.000 1.374 6693 I CB -0.190 37.789 38.000 -0.036 0.000 1.057 6693 I HN 0.212 nan 8.210 nan 0.000 0.413 6694 I N 1.065 121.619 120.570 -0.026 0.000 2.179 6694 I HA -0.265 3.904 4.170 -0.001 0.000 0.242 6694 I C 2.831 178.934 176.117 -0.023 0.000 1.088 6694 I CA 1.778 63.068 61.300 -0.017 0.000 1.357 6694 I CB -1.507 36.485 38.000 -0.013 0.000 1.051 6694 I HN 0.186 nan 8.210 nan 0.000 0.409 6695 A N 0.156 122.957 122.820 -0.032 0.000 1.969 6695 A HA -0.158 4.162 4.320 -0.001 0.000 0.218 6695 A C 2.170 179.733 177.584 -0.035 0.000 1.169 6695 A CA 1.175 53.190 52.037 -0.037 0.000 0.635 6695 A CB -0.374 18.600 19.000 -0.045 0.000 0.810 6695 A HN 0.338 nan 8.150 nan 0.000 0.445 6696 E N -0.298 119.882 120.200 -0.033 0.000 2.110 6696 E HA -0.112 4.238 4.350 -0.001 0.000 0.193 6696 E C 2.085 178.670 176.600 -0.025 0.000 0.988 6696 E CA 1.699 58.081 56.400 -0.030 0.000 0.804 6696 E CB -0.610 29.073 29.700 -0.028 0.000 0.745 6696 E HN 0.600 nan 8.360 nan 0.000 0.458 6697 T N 0.743 115.284 114.554 -0.022 0.000 2.770 6697 T HA -0.048 4.302 4.350 -0.001 0.000 0.263 6697 T C 2.121 176.809 174.700 -0.020 0.000 1.039 6697 T CA 0.973 63.062 62.100 -0.018 0.000 1.142 6697 T CB -0.099 68.762 68.868 -0.012 0.000 0.868 6697 T HN -0.036 nan 8.240 nan 0.000 0.435 6698 V N 2.758 122.659 119.914 -0.022 0.000 2.591 6698 V HA -0.112 4.007 4.120 -0.001 0.000 0.249 6698 V C 2.630 178.707 176.094 -0.028 0.000 1.053 6698 V CA 1.502 63.788 62.300 -0.023 0.000 1.068 6698 V CB -0.679 31.131 31.823 -0.023 0.000 0.689 6698 V HN 0.522 nan 8.190 nan 0.000 0.462 6699 R N 1.665 122.145 120.500 -0.033 0.000 2.200 6699 R HA -0.143 4.197 4.340 -0.001 0.000 0.234 6699 R C 2.065 178.343 176.300 -0.037 0.000 1.127 6699 R CA 1.733 57.810 56.100 -0.038 0.000 0.989 6699 R CB -0.885 29.390 30.300 -0.042 0.000 0.869 6699 R HN 0.598 nan 8.270 nan 0.000 0.459 6700 S N 0.285 115.965 115.700 -0.033 0.000 2.555 6700 S HA -0.078 4.392 4.470 -0.001 0.000 0.230 6700 S C 1.699 176.279 174.600 -0.033 0.000 0.978 6700 S CA 0.824 59.004 58.200 -0.033 0.000 0.934 6700 S CB -0.063 63.120 63.200 -0.028 0.000 0.766 6700 S HN 0.588 nan 8.310 nan 0.000 0.533 6701 T N -1.036 113.500 114.554 -0.030 0.000 3.060 6701 T HA 0.333 4.683 4.350 -0.001 0.000 0.249 6701 T C 0.376 175.057 174.700 -0.031 0.000 1.079 6701 T CA -0.496 61.587 62.100 -0.028 0.000 1.013 6701 T CB -0.446 68.409 68.868 -0.021 0.000 0.975 6701 T HN 0.279 nan 8.240 nan 0.000 0.518 6702 L N 2.850 124.052 121.223 -0.036 0.000 2.462 6702 L HA 0.523 4.862 4.340 -0.001 0.000 0.272 6702 L C 0.702 177.543 176.870 -0.048 0.000 1.166 6702 L CA 1.596 56.412 54.840 -0.039 0.000 0.880 6702 L CB -0.668 41.364 42.059 -0.044 0.000 1.142 6702 L HN 0.703 nan 8.230 nan 0.000 0.473 6703 G N 4.046 112.821 108.800 -0.042 0.000 2.663 6703 G HA2 -0.149 3.811 3.960 -0.001 0.000 0.686 6703 G HA3 -0.149 3.811 3.960 -0.001 0.000 0.686 6703 G C -2.115 172.747 174.900 -0.064 0.000 1.288 6703 G CA -0.456 44.611 45.100 -0.055 0.000 0.836 6703 G HN 0.482 nan 8.290 nan 0.000 0.584 6704 P HA -0.009 nan 4.420 nan 0.000 0.219 6704 P C 1.369 178.554 177.300 -0.193 0.000 1.146 6704 P CA 1.479 64.510 63.100 -0.115 0.000 0.808 6704 P CB 0.053 31.605 31.700 -0.247 0.000 0.779 6705 K N -0.779 119.483 120.400 -0.230 0.000 2.437 6705 K HA 0.266 4.586 4.320 -0.001 0.000 0.205 6705 K C 0.931 177.469 176.600 -0.103 0.000 1.026 6705 K CA -0.204 55.974 56.287 -0.181 0.000 1.153 6705 K CB -0.301 32.070 32.500 -0.214 0.000 0.863 6705 K HN 0.017 nan 8.250 nan 0.000 0.502 6706 G N 0.522 109.275 108.800 -0.079 0.000 2.594 6706 G HA2 0.168 4.128 3.960 -0.001 0.000 0.243 6706 G HA3 0.168 4.128 3.960 -0.001 0.000 0.243 6706 G C 0.036 174.913 174.900 -0.040 0.000 1.229 6706 G CA -0.386 44.682 45.100 -0.053 0.000 0.843 6706 G HN -0.020 nan 8.290 nan 0.000 0.578 6707 M N 0.072 119.652 119.600 -0.033 0.000 2.705 6707 M HA 0.401 4.880 4.480 -0.001 0.000 0.272 6707 M C -0.482 175.805 176.300 -0.021 0.000 1.172 6707 M CA -0.576 54.709 55.300 -0.026 0.000 0.901 6707 M CB 1.233 33.817 32.600 -0.027 0.000 1.516 6707 M HN 0.344 nan 8.290 nan 0.000 0.530 6708 D N 0.557 120.946 120.400 -0.019 0.000 2.326 6708 D HA 0.473 5.112 4.640 -0.001 0.000 0.248 6708 D C -0.532 175.757 176.300 -0.019 0.000 1.001 6708 D CA -0.335 53.655 54.000 -0.017 0.000 0.961 6708 D CB 1.271 42.061 40.800 -0.017 0.000 1.183 6708 D HN 0.089 nan 8.370 nan 0.000 0.502 6709 K N 0.777 121.166 120.400 -0.019 0.000 2.259 6709 K HA 0.433 4.753 4.320 -0.001 0.000 0.252 6709 K C -0.578 176.008 176.600 -0.024 0.000 0.936 6709 K CA -0.651 55.624 56.287 -0.019 0.000 0.810 6709 K CB 2.310 34.800 32.500 -0.015 0.000 1.143 6709 K HN 0.428 nan 8.250 nan 0.000 0.427 6710 M N 4.055 123.639 119.600 -0.026 0.000 2.036 6710 M HA 0.262 4.742 4.480 -0.001 0.000 0.337 6710 M C -1.544 174.740 176.300 -0.026 0.000 1.012 6710 M CA -0.923 54.357 55.300 -0.033 0.000 0.962 6710 M CB 0.314 32.893 32.600 -0.036 0.000 1.423 6710 M HN 0.333 nan 8.290 nan 0.000 0.405 6711 L N 5.965 127.173 121.223 -0.025 0.000 2.265 6711 L HA 0.493 4.833 4.340 -0.001 0.000 0.289 6711 L C -0.820 176.041 176.870 -0.016 0.000 1.033 6711 L CA -0.236 54.594 54.840 -0.016 0.000 0.814 6711 L CB 1.666 43.719 42.059 -0.010 0.000 1.203 6711 L HN 0.415 nan 8.230 nan 0.000 0.423 6712 V N 2.953 122.860 119.914 -0.012 0.000 2.384 6712 V HA 0.363 4.483 4.120 -0.001 0.000 0.287 6712 V C -0.199 175.893 176.094 -0.004 0.000 1.020 6712 V CA -0.947 61.347 62.300 -0.010 0.000 0.850 6712 V CB 1.523 33.339 31.823 -0.011 0.000 0.987 6712 V HN 0.789 nan 8.190 nan 0.000 0.436 6713 D N 2.373 122.773 120.400 0.000 0.000 2.447 6713 D HA 0.055 4.694 4.640 -0.001 0.000 0.265 6713 D C 0.889 177.191 176.300 0.002 0.000 1.250 6713 D CA -0.473 53.528 54.000 0.002 0.000 1.046 6713 D CB 0.644 41.448 40.800 0.006 0.000 1.095 6713 D HN 0.429 nan 8.370 nan 0.000 0.555 6714 D N -1.692 118.710 120.400 0.002 0.000 2.219 6714 D HA -0.100 4.540 4.640 -0.001 0.000 0.205 6714 D C 1.494 177.796 176.300 0.003 0.000 0.970 6714 D CA 0.687 54.688 54.000 0.002 0.000 0.851 6714 D CB 0.005 40.806 40.800 0.001 0.000 0.943 6714 D HN 0.193 nan 8.370 nan 0.000 0.488 6715 L N -1.098 120.128 121.223 0.005 0.000 2.558 6715 L HA 0.346 4.686 4.340 -0.001 0.000 0.225 6715 L C 2.043 178.918 176.870 0.008 0.000 1.128 6715 L CA 0.973 55.817 54.840 0.007 0.000 0.868 6715 L CB 0.130 42.194 42.059 0.008 0.000 1.006 6715 L HN 0.276 nan 8.230 nan 0.000 0.454 6716 G N -1.496 107.308 108.800 0.007 0.000 2.213 6716 G HA2 -0.262 3.697 3.960 -0.001 0.000 0.226 6716 G HA3 -0.262 3.697 3.960 -0.001 0.000 0.226 6716 G C 0.321 175.228 174.900 0.011 0.000 0.992 6716 G CA 0.114 45.218 45.100 0.007 0.000 0.632 6716 G HN 0.333 nan 8.290 nan 0.000 0.511 6717 D N 0.949 121.359 120.400 0.017 0.000 2.401 6717 D HA 0.414 5.054 4.640 -0.001 0.000 0.254 6717 D C 0.258 176.570 176.300 0.019 0.000 1.192 6717 D CA 0.504 54.521 54.000 0.029 0.000 0.885 6717 D CB 1.316 42.136 40.800 0.034 0.000 1.147 6717 D HN 0.587 nan 8.370 nan 0.000 0.478 6718 V N 4.887 124.808 119.914 0.012 0.000 2.555 6718 V HA 0.608 4.727 4.120 -0.001 0.000 0.302 6718 V C -1.055 175.013 176.094 -0.044 0.000 1.038 6718 V CA -0.638 61.647 62.300 -0.025 0.000 0.887 6718 V CB 1.905 33.695 31.823 -0.055 0.000 0.991 6718 V HN 0.344 nan 8.190 nan 0.000 0.434 6719 V N 6.929 126.820 119.914 -0.038 0.000 2.604 6719 V HA 0.711 4.830 4.120 -0.001 0.000 0.305 6719 V C -0.895 175.167 176.094 -0.053 0.000 1.043 6719 V CA -0.232 62.049 62.300 -0.032 0.000 0.888 6719 V CB 2.272 34.105 31.823 0.016 0.000 0.995 6719 V HN 0.786 nan 8.190 nan 0.000 0.429 6720 V N 5.852 125.726 119.914 -0.067 0.000 2.417 6720 V HA 0.789 4.909 4.120 -0.001 0.000 0.291 6720 V C 0.089 176.172 176.094 -0.018 0.000 1.024 6720 V CA 0.020 62.289 62.300 -0.052 0.000 0.861 6720 V CB 1.596 33.374 31.823 -0.075 0.000 0.985 6720 V HN 1.075 nan 8.190 nan 0.000 0.436 6721 T N 2.593 117.140 114.554 -0.013 0.000 2.769 6721 T HA 0.312 4.662 4.350 -0.001 0.000 0.306 6721 T C 0.070 174.766 174.700 -0.006 0.000 1.400 6721 T CA -0.359 61.739 62.100 -0.003 0.000 1.007 6721 T CB 1.996 70.865 68.868 0.003 0.000 1.392 6721 T HN 0.656 nan 8.240 nan 0.000 0.500 6722 N N 0.803 119.501 118.700 -0.002 0.000 2.210 6722 N HA 0.082 4.821 4.740 -0.001 0.000 0.203 6722 N C -0.315 175.193 175.510 -0.004 0.000 1.175 6722 N CA 0.014 53.061 53.050 -0.005 0.000 0.894 6722 N CB 0.471 38.956 38.487 -0.004 0.000 1.041 6722 N HN 0.693 nan 8.380 nan 0.000 0.506 6723 D N -0.099 120.300 120.400 -0.001 0.000 2.401 6723 D HA 0.186 4.826 4.640 -0.001 0.000 0.254 6723 D C 1.497 177.795 176.300 -0.003 0.000 1.192 6723 D CA 0.291 54.291 54.000 -0.000 0.000 0.885 6723 D CB 1.012 41.814 40.800 0.004 0.000 1.147 6723 D HN 0.269 nan 8.370 nan 0.000 0.478 6724 G N 2.612 111.409 108.800 -0.005 0.000 2.440 6724 G HA2 -0.241 3.719 3.960 -0.001 0.000 0.218 6724 G HA3 -0.241 3.719 3.960 -0.001 0.000 0.218 6724 G C 1.514 176.411 174.900 -0.004 0.000 1.154 6724 G CA 0.732 45.828 45.100 -0.007 0.000 0.767 6724 G HN 0.488 nan 8.290 nan 0.000 0.552 6725 V N 0.823 120.736 119.914 -0.002 0.000 2.270 6725 V HA -0.171 3.949 4.120 -0.001 0.000 0.245 6725 V C 3.179 179.274 176.094 0.001 0.000 1.043 6725 V CA 2.384 64.684 62.300 0.000 0.000 1.014 6725 V CB -0.905 30.919 31.823 0.001 0.000 0.645 6725 V HN 0.401 nan 8.190 nan 0.000 0.447 6726 T N 0.386 114.941 114.554 0.002 0.000 2.720 6726 T HA -0.181 4.168 4.350 -0.001 0.000 0.268 6726 T C 1.795 176.496 174.700 0.002 0.000 1.037 6726 T CA 1.947 64.049 62.100 0.004 0.000 1.144 6726 T CB -0.312 68.560 68.868 0.006 0.000 0.864 6726 T HN 0.338 nan 8.240 nan 0.000 0.444 6727 I N 0.250 120.820 120.570 -0.000 0.000 2.179 6727 I HA -0.138 4.032 4.170 -0.001 0.000 0.242 6727 I C 2.113 178.230 176.117 -0.000 0.000 1.088 6727 I CA 1.007 62.306 61.300 -0.002 0.000 1.357 6727 I CB -0.282 37.715 38.000 -0.005 0.000 1.051 6727 I HN 0.156 nan 8.210 nan 0.000 0.409 6728 L N 0.170 121.393 121.223 0.000 0.000 2.156 6728 L HA -0.088 4.251 4.340 -0.001 0.000 0.208 6728 L C 2.492 179.364 176.870 0.003 0.000 1.095 6728 L CA 1.495 56.337 54.840 0.002 0.000 0.770 6728 L CB -0.957 41.103 42.059 0.001 0.000 0.914 6728 L HN 0.151 nan 8.230 nan 0.000 0.439 6729 R N -0.106 120.396 120.500 0.003 0.000 2.066 6729 R HA -0.106 4.234 4.340 -0.001 0.000 0.232 6729 R C 1.924 178.226 176.300 0.004 0.000 1.131 6729 R CA 1.238 57.340 56.100 0.004 0.000 0.955 6729 R CB 0.044 30.346 30.300 0.004 0.000 0.851 6729 R HN 0.320 nan 8.270 nan 0.000 0.432 6730 E N 1.040 121.242 120.200 0.003 0.000 2.112 6730 E HA -0.075 4.275 4.350 -0.001 0.000 0.190 6730 E C 1.207 177.809 176.600 0.002 0.000 0.979 6730 E CA 0.536 56.938 56.400 0.004 0.000 0.814 6730 E CB -0.355 29.347 29.700 0.004 0.000 0.762 6730 E HN 0.462 nan 8.360 nan 0.000 0.460 6731 M N 0.716 120.317 119.600 0.002 0.000 2.252 6731 M HA 0.097 4.577 4.480 -0.001 0.000 0.333 6731 M C 0.209 176.510 176.300 0.002 0.000 1.111 6731 M CA 0.142 55.443 55.300 0.002 0.000 1.140 6731 M CB 0.431 33.032 32.600 0.002 0.000 1.538 6731 M HN -0.230 nan 8.290 nan 0.000 0.448 6732 S N 2.361 118.061 115.700 0.000 0.000 2.955 6732 S HA 0.468 4.937 4.470 -0.001 0.000 0.294 6732 S C -0.253 174.345 174.600 -0.003 0.000 1.198 6732 S CA -1.001 57.197 58.200 -0.002 0.000 1.008 6732 S CB -0.358 62.839 63.200 -0.005 0.000 1.279 6732 S HN 0.570 nan 8.310 nan 0.000 0.508 6733 V N 3.392 123.306 119.914 0.000 0.000 2.686 6733 V HA 0.214 4.334 4.120 -0.001 0.000 0.295 6733 V C 1.394 177.479 176.094 -0.016 0.000 1.055 6733 V CA -0.101 62.202 62.300 0.005 0.000 1.050 6733 V CB 1.268 33.102 31.823 0.018 0.000 0.984 6733 V HN 0.874 nan 8.190 nan 0.000 0.482 6734 E N 1.936 122.109 120.200 -0.044 0.000 2.228 6734 E HA 0.034 4.383 4.350 -0.001 0.000 0.197 6734 E C 0.458 176.969 176.600 -0.149 0.000 0.909 6734 E CA 0.194 56.518 56.400 -0.127 0.000 0.911 6734 E CB 0.297 29.862 29.700 -0.224 0.000 0.887 6734 E HN 0.743 nan 8.360 nan 0.000 0.481 6735 H N 1.678 120.736 119.070 -0.019 0.000 2.848 6735 H HA 0.074 4.630 4.556 -0.000 0.000 0.317 6735 H C -1.675 173.637 175.328 -0.026 0.000 1.046 6735 H CA -1.214 54.812 56.048 -0.036 0.000 1.470 6735 H CB 1.135 30.862 29.762 -0.059 0.000 1.483 6735 H HN 0.082 nan 8.280 nan 0.000 0.548 6736 P HA -0.134 nan 4.420 nan 0.000 0.218 6736 P C 1.335 178.660 177.300 0.042 0.000 1.148 6736 P CA 1.496 64.624 63.100 0.048 0.000 0.822 6736 P CB 0.269 31.992 31.700 0.039 0.000 0.784 6737 A N 0.242 123.088 122.820 0.043 0.000 1.902 6737 A HA -0.136 4.183 4.320 -0.001 0.000 0.217 6737 A C 2.331 179.923 177.584 0.013 0.000 1.181 6737 A CA 2.155 54.199 52.037 0.011 0.000 0.623 6737 A CB -1.602 17.379 19.000 -0.032 0.000 0.818 6737 A HN 0.203 nan 8.150 nan 0.000 0.443 6738 A N -0.281 122.559 122.820 0.033 0.000 1.933 6738 A HA -0.140 4.180 4.320 -0.001 0.000 0.218 6738 A C 2.069 179.669 177.584 0.025 0.000 1.175 6738 A CA 1.730 53.784 52.037 0.028 0.000 0.628 6738 A CB -0.407 18.626 19.000 0.055 0.000 0.814 6738 A HN 0.555 nan 8.150 nan 0.000 0.444 6739 K N -0.994 119.425 120.400 0.031 0.000 2.147 6739 K HA -0.065 4.254 4.320 -0.001 0.000 0.205 6739 K C 1.830 178.440 176.600 0.017 0.000 1.049 6739 K CA 1.327 57.627 56.287 0.021 0.000 0.936 6739 K CB -0.186 32.327 32.500 0.021 0.000 0.722 6739 K HN 0.376 nan 8.250 nan 0.000 0.446 6740 M N 0.345 119.955 119.600 0.017 0.000 2.334 6740 M HA -0.026 4.454 4.480 -0.001 0.000 0.266 6740 M C 2.136 178.444 176.300 0.013 0.000 1.082 6740 M CA 1.028 56.337 55.300 0.015 0.000 1.141 6740 M CB -0.607 32.003 32.600 0.017 0.000 1.380 6740 M HN 0.183 nan 8.290 nan 0.000 0.440 6741 L N 0.336 121.565 121.223 0.010 0.000 2.083 6741 L HA -0.199 4.141 4.340 -0.001 0.000 0.209 6741 L C 2.218 179.091 176.870 0.005 0.000 1.083 6741 L CA 1.041 55.884 54.840 0.006 0.000 0.752 6741 L CB -0.198 41.860 42.059 -0.001 0.000 0.899 6741 L HN 0.181 nan 8.230 nan 0.000 0.433 6742 I N -0.318 120.256 120.570 0.006 0.000 2.335 6742 I HA -0.307 3.863 4.170 -0.001 0.000 0.251 6742 I C 2.368 178.488 176.117 0.005 0.000 1.129 6742 I CA 1.040 62.343 61.300 0.005 0.000 1.402 6742 I CB -0.341 37.663 38.000 0.007 0.000 1.069 6742 I HN 0.306 nan 8.210 nan 0.000 0.424 6743 E N 0.394 120.598 120.200 0.008 0.000 2.204 6743 E HA -0.152 4.198 4.350 -0.001 0.000 0.195 6743 E C 2.401 179.006 176.600 0.007 0.000 0.990 6743 E CA 1.061 57.466 56.400 0.008 0.000 0.821 6743 E CB -0.207 29.499 29.700 0.010 0.000 0.750 6743 E HN 0.384 nan 8.360 nan 0.000 0.477 6744 V N 1.488 121.406 119.914 0.007 0.000 2.307 6744 V HA -0.219 3.900 4.120 -0.001 0.000 0.245 6744 V C 2.480 178.575 176.094 0.002 0.000 1.045 6744 V CA 1.755 64.058 62.300 0.006 0.000 1.024 6744 V CB -0.853 30.973 31.823 0.005 0.000 0.651 6744 V HN 0.241 nan 8.190 nan 0.000 0.449 6745 A N -0.283 122.537 122.820 0.000 0.000 1.940 6745 A HA -0.248 4.072 4.320 -0.001 0.000 0.219 6745 A C 2.295 179.879 177.584 0.001 0.000 1.176 6745 A CA 2.031 54.067 52.037 -0.001 0.000 0.631 6745 A CB -0.416 18.582 19.000 -0.002 0.000 0.814 6745 A HN 0.557 nan 8.150 nan 0.000 0.446 6746 K N -1.606 118.795 120.400 0.002 0.000 2.062 6746 K HA -0.082 4.238 4.320 -0.001 0.000 0.205 6746 K C 2.137 178.739 176.600 0.003 0.000 1.051 6746 K CA 1.535 57.823 56.287 0.003 0.000 0.941 6746 K CB -0.367 32.135 32.500 0.004 0.000 0.719 6746 K HN 0.422 nan 8.250 nan 0.000 0.440 6747 T N 0.773 115.330 114.554 0.004 0.000 2.995 6747 T HA -0.073 4.277 4.350 -0.001 0.000 0.269 6747 T C 1.774 176.476 174.700 0.004 0.000 1.091 6747 T CA 0.807 62.910 62.100 0.004 0.000 1.128 6747 T CB 0.067 68.938 68.868 0.006 0.000 0.891 6747 T HN 0.085 nan 8.240 nan 0.000 0.492 6748 Q N 0.957 120.758 119.800 0.003 0.000 2.020 6748 Q HA -0.046 4.294 4.340 -0.001 0.000 0.202 6748 Q C 2.301 178.302 176.000 0.001 0.000 0.982 6748 Q CA 1.236 57.039 55.803 0.001 0.000 0.838 6748 Q CB -0.484 28.254 28.738 -0.001 0.000 0.899 6748 Q HN 0.538 nan 8.270 nan 0.000 0.423 6749 E N 0.904 121.105 120.200 0.001 0.000 2.106 6749 E HA -0.146 4.204 4.350 -0.001 0.000 0.192 6749 E C 1.719 178.320 176.600 0.002 0.000 0.984 6749 E CA 0.953 57.354 56.400 0.002 0.000 0.806 6749 E CB 0.230 29.931 29.700 0.001 0.000 0.750 6749 E HN 0.282 nan 8.360 nan 0.000 0.458 6750 K N 0.074 120.475 120.400 0.002 0.000 2.076 6750 K HA -0.127 4.192 4.320 -0.001 0.000 0.204 6750 K C 2.154 178.755 176.600 0.002 0.000 1.051 6750 K CA 1.184 57.472 56.287 0.002 0.000 0.949 6750 K CB -0.012 32.489 32.500 0.002 0.000 0.726 6750 K HN -0.088 nan 8.250 nan 0.000 0.443 6751 E N 0.337 120.539 120.200 0.002 0.000 2.086 6751 E HA -0.097 4.253 4.350 -0.001 0.000 0.190 6751 E C 1.593 178.195 176.600 0.002 0.000 0.975 6751 E CA 1.102 57.504 56.400 0.003 0.000 0.813 6751 E CB 0.516 30.218 29.700 0.003 0.000 0.768 6751 E HN 0.160 nan 8.360 nan 0.000 0.457 6752 V N -4.945 114.971 119.914 0.002 0.000 3.497 6752 V HA 0.586 4.705 4.120 -0.001 0.000 0.272 6752 V C 1.389 177.484 176.094 0.003 0.000 1.474 6752 V CA 0.741 63.042 62.300 0.003 0.000 1.025 6752 V CB 0.493 32.318 31.823 0.003 0.000 0.820 6752 V HN 0.304 nan 8.190 nan 0.000 0.437 6753 G N 0.694 109.495 108.800 0.002 0.000 3.586 6753 G HA2 -0.272 3.688 3.960 -0.001 0.000 0.212 6753 G HA3 -0.272 3.688 3.960 -0.001 0.000 0.212 6753 G C 0.203 175.105 174.900 0.002 0.000 1.411 6753 G CA 0.499 45.601 45.100 0.003 0.000 0.898 6753 G HN 0.629 nan 8.290 nan 0.000 0.575 6754 D N 0.804 121.205 120.400 0.003 0.000 2.511 6754 D HA 0.495 5.134 4.640 -0.001 0.000 0.276 6754 D C 1.519 177.819 176.300 -0.001 0.000 1.220 6754 D CA 1.158 55.159 54.000 0.002 0.000 1.077 6754 D CB 0.656 41.458 40.800 0.004 0.000 1.126 6754 D HN 1.595 nan 8.370 nan 0.000 0.583 6755 G N -0.628 108.170 108.800 -0.004 0.000 2.143 6755 G HA2 -0.312 3.647 3.960 -0.001 0.000 0.249 6755 G HA3 -0.312 3.647 3.960 -0.001 0.000 0.249 6755 G C 1.036 175.929 174.900 -0.011 0.000 0.981 6755 G CA 1.480 46.575 45.100 -0.008 0.000 0.665 6755 G HN 0.593 nan 8.290 nan 0.000 0.528 6756 T N -2.058 112.490 114.554 -0.009 0.000 2.588 6756 T HA -0.149 4.200 4.350 -0.001 0.000 0.261 6756 T C 2.202 176.893 174.700 -0.016 0.000 1.069 6756 T CA 2.620 64.714 62.100 -0.010 0.000 1.172 6756 T CB -1.010 67.854 68.868 -0.007 0.000 0.863 6756 T HN 0.342 nan 8.240 nan 0.000 0.408 6757 T N 1.849 116.392 114.554 -0.017 0.000 2.635 6757 T HA -0.151 4.198 4.350 -0.001 0.000 0.267 6757 T C 2.275 176.956 174.700 -0.032 0.000 1.040 6757 T CA 2.089 64.175 62.100 -0.024 0.000 1.156 6757 T CB -1.241 67.613 68.868 -0.024 0.000 0.863 6757 T HN 0.566 nan 8.240 nan 0.000 0.430 6758 T N 1.997 116.532 114.554 -0.032 0.000 2.635 6758 T HA -0.160 4.190 4.350 -0.001 0.000 0.267 6758 T C 2.345 177.015 174.700 -0.050 0.000 1.040 6758 T CA 1.527 63.601 62.100 -0.042 0.000 1.156 6758 T CB -0.698 68.149 68.868 -0.036 0.000 0.863 6758 T HN 0.473 nan 8.240 nan 0.000 0.430 6759 A N 0.663 123.460 122.820 -0.038 0.000 1.933 6759 A HA -0.038 4.282 4.320 -0.001 0.000 0.218 6759 A C 2.601 180.159 177.584 -0.042 0.000 1.175 6759 A CA 1.438 53.453 52.037 -0.038 0.000 0.628 6759 A CB -0.906 18.082 19.000 -0.020 0.000 0.814 6759 A HN 0.377 nan 8.150 nan 0.000 0.444 6760 V N -0.507 119.386 119.914 -0.036 0.000 2.358 6760 V HA -0.196 3.923 4.120 -0.001 0.000 0.246 6760 V C 2.548 178.613 176.094 -0.048 0.000 1.047 6760 V CA 1.837 64.116 62.300 -0.035 0.000 1.035 6760 V CB -0.736 31.071 31.823 -0.026 0.000 0.658 6760 V HN 0.362 nan 8.190 nan 0.000 0.452 6761 V N 0.847 120.728 119.914 -0.055 0.000 2.307 6761 V HA -0.199 3.921 4.120 -0.001 0.000 0.245 6761 V C 2.581 178.622 176.094 -0.088 0.000 1.045 6761 V CA 2.184 64.445 62.300 -0.065 0.000 1.024 6761 V CB -0.538 31.247 31.823 -0.063 0.000 0.651 6761 V HN 0.564 nan 8.190 nan 0.000 0.449 6762 V N -0.953 118.896 119.914 -0.109 0.000 2.626 6762 V HA -0.064 4.055 4.120 -0.001 0.000 0.252 6762 V C 2.403 178.396 176.094 -0.170 0.000 1.067 6762 V CA 1.686 63.886 62.300 -0.165 0.000 1.081 6762 V CB -1.231 30.471 31.823 -0.203 0.000 0.686 6762 V HN 0.372 nan 8.190 nan 0.000 0.468 6763 A N 1.572 124.325 122.820 -0.111 0.000 1.873 6763 A HA 0.096 4.416 4.320 -0.001 0.000 0.215 6763 A C 2.396 179.943 177.584 -0.062 0.000 1.186 6763 A CA 1.855 53.846 52.037 -0.076 0.000 0.616 6763 A CB -1.482 17.494 19.000 -0.040 0.000 0.823 6763 A HN 0.670 nan 8.150 nan 0.000 0.442 6764 G N -0.739 108.024 108.800 -0.061 0.000 2.408 6764 G HA2 -0.178 3.782 3.960 -0.001 0.000 0.217 6764 G HA3 -0.178 3.782 3.960 -0.001 0.000 0.217 6764 G C 1.461 176.327 174.900 -0.057 0.000 1.150 6764 G CA 1.290 46.358 45.100 -0.052 0.000 0.776 6764 G HN 0.535 nan 8.290 nan 0.000 0.542 6765 E N 0.337 120.488 120.200 -0.082 0.000 2.072 6765 E HA 0.026 4.375 4.350 -0.001 0.000 0.191 6765 E C 2.528 179.071 176.600 -0.094 0.000 0.985 6765 E CA 0.513 56.858 56.400 -0.091 0.000 0.801 6765 E CB -0.367 29.261 29.700 -0.120 0.000 0.750 6765 E HN 0.419 nan 8.360 nan 0.000 0.452 6766 L N -0.082 121.057 121.223 -0.141 0.000 2.046 6766 L HA -0.184 4.156 4.340 -0.001 0.000 0.208 6766 L C 2.424 179.328 176.870 0.056 0.000 1.077 6766 L CA 0.943 55.688 54.840 -0.158 0.000 0.747 6766 L CB -0.384 41.499 42.059 -0.293 0.000 0.896 6766 L HN 0.220 nan 8.230 nan 0.000 0.432 6767 L N -0.763 120.484 121.223 0.040 0.000 2.046 6767 L HA -0.219 4.120 4.340 -0.001 0.000 0.208 6767 L C 2.825 179.719 176.870 0.041 0.000 1.077 6767 L CA 1.126 56.003 54.840 0.061 0.000 0.747 6767 L CB -0.517 41.549 42.059 0.013 0.000 0.896 6767 L HN 0.256 nan 8.230 nan 0.000 0.432 6768 R N 0.345 120.851 120.500 0.010 0.000 2.083 6768 R HA -0.172 4.168 4.340 -0.001 0.000 0.237 6768 R C 2.286 178.603 176.300 0.029 0.000 1.137 6768 R CA 1.299 57.402 56.100 0.005 0.000 0.951 6768 R CB 0.053 30.345 30.300 -0.015 0.000 0.851 6768 R HN 0.148 nan 8.270 nan 0.000 0.434 6769 K N 0.225 120.654 120.400 0.050 0.000 2.148 6769 K HA -0.050 4.269 4.320 -0.001 0.000 0.204 6769 K C 1.945 178.625 176.600 0.134 0.000 1.050 6769 K CA 1.186 57.526 56.287 0.089 0.000 0.942 6769 K CB -0.329 32.232 32.500 0.102 0.000 0.724 6769 K HN 0.272 nan 8.250 nan 0.000 0.446 6770 A N 1.424 124.345 122.820 0.168 0.000 1.883 6770 A HA -0.225 4.095 4.320 -0.001 0.000 0.217 6770 A C 2.198 179.806 177.584 0.040 0.000 1.186 6770 A CA 1.916 54.029 52.037 0.126 0.000 0.624 6770 A CB -0.465 18.616 19.000 0.135 0.000 0.822 6770 A HN 0.457 nan 8.150 nan 0.000 0.444 6771 E N -0.470 119.748 120.200 0.030 0.000 2.106 6771 E HA -0.225 4.125 4.350 -0.001 0.000 0.192 6771 E C 2.004 178.608 176.600 0.008 0.000 0.984 6771 E CA 1.123 57.527 56.400 0.006 0.000 0.806 6771 E CB -0.149 29.551 29.700 0.001 0.000 0.750 6771 E HN 0.750 nan 8.360 nan 0.000 0.458 6772 E N -0.085 120.127 120.200 0.021 0.000 2.070 6772 E HA -0.235 4.115 4.350 -0.001 0.000 0.197 6772 E C 1.910 178.522 176.600 0.019 0.000 1.004 6772 E CA 1.143 57.555 56.400 0.021 0.000 0.805 6772 E CB 0.050 29.767 29.700 0.030 0.000 0.744 6772 E HN 0.209 nan 8.360 nan 0.000 0.451 6773 L N 0.278 121.516 121.223 0.025 0.000 2.109 6773 L HA -0.122 4.217 4.340 -0.001 0.000 0.207 6773 L C 2.262 179.127 176.870 -0.008 0.000 1.086 6773 L CA 0.962 55.811 54.840 0.015 0.000 0.760 6773 L CB -0.693 41.378 42.059 0.019 0.000 0.910 6773 L HN 0.233 nan 8.230 nan 0.000 0.437 6774 L N -0.653 120.558 121.223 -0.021 0.000 2.083 6774 L HA -0.218 4.122 4.340 -0.001 0.000 0.209 6774 L C 2.120 178.972 176.870 -0.030 0.000 1.083 6774 L CA 1.649 56.463 54.840 -0.043 0.000 0.752 6774 L CB -0.826 41.202 42.059 -0.052 0.000 0.899 6774 L HN 0.280 nan 8.230 nan 0.000 0.433 6775 D N -1.813 118.578 120.400 -0.015 0.000 2.249 6775 D HA -0.110 4.530 4.640 -0.001 0.000 0.205 6775 D C 1.777 178.075 176.300 -0.003 0.000 0.962 6775 D CA 0.469 54.464 54.000 -0.009 0.000 0.860 6775 D CB 0.218 41.016 40.800 -0.004 0.000 0.955 6775 D HN 0.193 nan 8.370 nan 0.000 0.505 6776 Q N 0.141 119.942 119.800 0.001 0.000 2.373 6776 Q HA 0.060 4.400 4.340 -0.001 0.000 0.206 6776 Q C 0.004 176.008 176.000 0.007 0.000 0.942 6776 Q CA 0.132 55.938 55.803 0.006 0.000 0.953 6776 Q CB 0.206 28.951 28.738 0.012 0.000 1.022 6776 Q HN 0.252 nan 8.270 nan 0.000 0.502 6777 N N -0.855 117.847 118.700 0.003 0.000 2.861 6777 N HA -0.139 4.601 4.740 -0.001 0.000 0.247 6777 N C -1.582 173.939 175.510 0.019 0.000 1.117 6777 N CA 0.262 53.318 53.050 0.010 0.000 0.703 6777 N CB -1.070 37.425 38.487 0.013 0.000 1.052 6777 N HN -0.046 nan 8.380 nan 0.000 0.555 6778 V N 1.822 121.743 119.914 0.010 0.000 2.334 6778 V HA 0.231 4.350 4.120 -0.001 0.000 0.281 6778 V C 0.621 176.726 176.094 0.019 0.000 1.016 6778 V CA -0.870 61.441 62.300 0.019 0.000 0.832 6778 V CB 1.247 33.072 31.823 0.004 0.000 0.999 6778 V HN 0.306 nan 8.190 nan 0.000 0.439 6779 H N 7.782 126.832 119.070 -0.033 0.000 2.928 6779 H HA 0.097 4.653 4.556 -0.000 0.000 0.338 6779 H C -1.731 173.565 175.328 -0.053 0.000 1.047 6779 H CA -1.267 54.761 56.048 -0.035 0.000 1.435 6779 H CB 1.944 31.689 29.762 -0.029 0.000 1.428 6779 H HN 0.351 nan 8.280 nan 0.000 0.590 6780 P HA -0.188 nan 4.420 nan 0.000 0.217 6780 P C 1.402 178.729 177.300 0.045 0.000 1.148 6780 P CA 2.461 65.500 63.100 -0.103 0.000 0.834 6780 P CB 0.019 31.610 31.700 -0.182 0.000 0.783 6781 T N -4.099 110.632 114.554 0.295 0.000 2.995 6781 T HA -0.064 4.286 4.350 -0.001 0.000 0.269 6781 T C 1.624 176.347 174.700 0.039 0.000 1.091 6781 T CA 0.808 62.993 62.100 0.141 0.000 1.128 6781 T CB -0.941 67.987 68.868 0.100 0.000 0.891 6781 T HN -0.048 nan 8.240 nan 0.000 0.492 6782 I N 0.878 121.476 120.570 0.046 0.000 2.480 6782 I HA 0.042 4.212 4.170 -0.001 0.000 0.251 6782 I C 2.576 178.641 176.117 -0.088 0.000 1.124 6782 I CA 0.384 61.675 61.300 -0.016 0.000 1.444 6782 I CB -0.283 37.719 38.000 0.004 0.000 1.098 6782 I HN 0.072 nan 8.210 nan 0.000 0.428 6783 V N 0.723 120.551 119.914 -0.144 0.000 2.295 6783 V HA -0.238 3.881 4.120 -0.001 0.000 0.246 6783 V C 2.561 178.323 176.094 -0.553 0.000 1.049 6783 V CA 2.041 64.119 62.300 -0.371 0.000 1.024 6783 V CB -0.767 30.842 31.823 -0.356 0.000 0.648 6783 V HN 0.439 nan 8.190 nan 0.000 0.447 6784 V N -0.706 119.038 119.914 -0.283 0.000 2.667 6784 V HA -0.144 3.976 4.120 -0.001 0.000 0.252 6784 V C 2.361 178.414 176.094 -0.069 0.000 1.065 6784 V CA 2.189 64.397 62.300 -0.153 0.000 1.083 6784 V CB -0.799 30.992 31.823 -0.053 0.000 0.692 6784 V HN 0.514 nan 8.190 nan 0.000 0.468 6785 K N 2.305 122.664 120.400 -0.069 0.000 2.031 6785 K HA 0.106 4.426 4.320 -0.001 0.000 0.205 6785 K C 2.121 178.714 176.600 -0.013 0.000 1.049 6785 K CA 2.010 58.279 56.287 -0.029 0.000 0.939 6785 K CB -1.264 31.221 32.500 -0.026 0.000 0.717 6785 K HN 0.427 nan 8.250 nan 0.000 0.438 6786 G N -0.717 108.067 108.800 -0.027 0.000 2.408 6786 G HA2 -0.196 3.763 3.960 -0.001 0.000 0.217 6786 G HA3 -0.196 3.763 3.960 -0.001 0.000 0.217 6786 G C 1.135 176.109 174.900 0.124 0.000 1.150 6786 G CA 0.716 45.849 45.100 0.054 0.000 0.776 6786 G HN 0.271 nan 8.290 nan 0.000 0.542 6787 Y N 0.341 120.590 120.300 -0.086 0.000 2.263 6787 Y HA -0.020 4.529 4.550 -0.001 0.000 0.292 6787 Y C 2.852 178.536 175.900 -0.360 0.000 1.130 6787 Y CA 0.915 58.888 58.100 -0.211 0.000 1.179 6787 Y CB -0.927 37.603 38.460 0.117 0.000 0.998 6787 Y HN 0.264 nan 8.280 nan 0.000 0.532 6788 Q N 0.422 120.229 119.800 0.011 0.000 2.083 6788 Q HA -0.047 4.293 4.340 -0.001 0.000 0.198 6788 Q C 2.362 178.303 176.000 -0.098 0.000 0.969 6788 Q CA 1.742 57.525 55.803 -0.032 0.000 0.838 6788 Q CB -0.455 28.287 28.738 0.007 0.000 0.900 6788 Q HN 0.318 nan 8.270 nan 0.000 0.436 6789 A N 0.267 123.055 122.820 -0.054 0.000 1.873 6789 A HA -0.009 4.310 4.320 -0.001 0.000 0.215 6789 A C 2.276 179.817 177.584 -0.073 0.000 1.186 6789 A CA 1.852 53.903 52.037 0.024 0.000 0.616 6789 A CB -1.161 17.930 19.000 0.151 0.000 0.823 6789 A HN 0.500 nan 8.150 nan 0.000 0.442 6790 A N -0.298 122.389 122.820 -0.221 0.000 1.930 6790 A HA 0.224 4.544 4.320 -0.001 0.000 0.217 6790 A C 2.452 179.689 177.584 -0.579 0.000 1.175 6790 A CA 1.885 53.655 52.037 -0.445 0.000 0.627 6790 A CB -0.862 17.763 19.000 -0.625 0.000 0.815 6790 A HN 0.996 nan 8.150 nan 0.000 0.443 6791 A N -1.152 121.258 122.820 -0.684 0.000 1.930 6791 A HA -0.133 4.187 4.320 -0.001 0.000 0.217 6791 A C 2.111 179.603 177.584 -0.153 0.000 1.175 6791 A CA 1.494 53.368 52.037 -0.272 0.000 0.627 6791 A CB -0.393 18.523 19.000 -0.140 0.000 0.815 6791 A HN 0.465 nan 8.150 nan 0.000 0.443 6792 Q N -0.308 119.389 119.800 -0.172 0.000 2.119 6792 Q HA -0.168 4.172 4.340 -0.001 0.000 0.201 6792 Q C 2.018 177.911 176.000 -0.178 0.000 0.972 6792 Q CA 1.849 57.576 55.803 -0.127 0.000 0.847 6792 Q CB -0.339 28.347 28.738 -0.087 0.000 0.903 6792 Q HN 0.633 nan 8.270 nan 0.000 0.433 6793 K N 0.909 121.110 120.400 -0.330 0.000 2.148 6793 K HA 0.009 4.329 4.320 -0.001 0.000 0.204 6793 K C 1.822 178.269 176.600 -0.255 0.000 1.050 6793 K CA 1.150 57.173 56.287 -0.441 0.000 0.942 6793 K CB -0.363 31.490 32.500 -1.079 0.000 0.724 6793 K HN 0.125 nan 8.250 nan 0.000 0.446 6794 A N 0.532 123.241 122.820 -0.184 0.000 1.933 6794 A HA -0.196 4.123 4.320 -0.001 0.000 0.218 6794 A C 2.035 179.596 177.584 -0.039 0.000 1.175 6794 A CA 1.579 53.581 52.037 -0.058 0.000 0.628 6794 A CB -0.483 18.546 19.000 0.049 0.000 0.814 6794 A HN 0.496 nan 8.150 nan 0.000 0.444 6795 Q N -0.876 118.894 119.800 -0.051 0.000 2.084 6795 Q HA -0.211 4.128 4.340 -0.001 0.000 0.202 6795 Q C 2.140 178.118 176.000 -0.035 0.000 0.978 6795 Q CA 1.636 57.420 55.803 -0.033 0.000 0.844 6795 Q CB -0.160 28.559 28.738 -0.033 0.000 0.898 6795 Q HN 0.863 nan 8.270 nan 0.000 0.426 6796 E N 0.767 120.933 120.200 -0.057 0.000 2.072 6796 E HA -0.179 4.171 4.350 -0.001 0.000 0.191 6796 E C 1.988 178.567 176.600 -0.035 0.000 0.985 6796 E CA 0.635 57.007 56.400 -0.047 0.000 0.801 6796 E CB 0.001 29.663 29.700 -0.063 0.000 0.750 6796 E HN 0.295 nan 8.360 nan 0.000 0.452 6797 L N 0.601 121.797 121.223 -0.045 0.000 2.042 6797 L HA -0.211 4.128 4.340 -0.001 0.000 0.210 6797 L C 2.565 179.434 176.870 -0.002 0.000 1.076 6797 L CA 0.920 55.747 54.840 -0.021 0.000 0.749 6797 L CB -0.327 41.718 42.059 -0.024 0.000 0.893 6797 L HN 0.265 nan 8.230 nan 0.000 0.432 6798 L N -0.795 120.425 121.223 -0.005 0.000 2.109 6798 L HA -0.136 4.204 4.340 -0.001 0.000 0.207 6798 L C 2.610 179.482 176.870 0.004 0.000 1.086 6798 L CA 0.786 55.628 54.840 0.004 0.000 0.760 6798 L CB -0.429 41.632 42.059 0.004 0.000 0.910 6798 L HN 0.164 nan 8.230 nan 0.000 0.437 6799 K N -0.150 120.248 120.400 -0.003 0.000 2.211 6799 K HA -0.083 4.236 4.320 -0.001 0.000 0.203 6799 K C 2.071 178.671 176.600 0.001 0.000 1.050 6799 K CA 1.770 58.056 56.287 -0.002 0.000 0.945 6799 K CB -0.354 32.142 32.500 -0.006 0.000 0.732 6799 K HN 0.467 nan 8.250 nan 0.000 0.451 6800 T N -1.888 112.666 114.554 0.001 0.000 3.040 6800 T HA 0.062 4.412 4.350 -0.001 0.000 0.252 6800 T C 1.831 176.537 174.700 0.009 0.000 1.064 6800 T CA -0.015 62.087 62.100 0.004 0.000 1.110 6800 T CB -0.006 68.863 68.868 0.002 0.000 0.921 6800 T HN -0.063 nan 8.240 nan 0.000 0.480 6801 I N 2.133 122.712 120.570 0.015 0.000 2.876 6801 I HA 0.443 4.612 4.170 -0.001 0.000 0.264 6801 I C 1.402 177.532 176.117 0.022 0.000 1.204 6801 I CA -0.625 60.690 61.300 0.025 0.000 1.485 6801 I CB -0.616 37.410 38.000 0.043 0.000 1.103 6801 I HN 0.347 nan 8.210 nan 0.000 0.446 6802 A N 0.038 122.867 122.820 0.016 0.000 2.531 6802 A HA 0.097 4.417 4.320 -0.001 0.000 0.236 6802 A C 0.089 177.679 177.584 0.011 0.000 1.062 6802 A CA 0.044 52.089 52.037 0.013 0.000 0.760 6802 A CB -0.468 18.537 19.000 0.009 0.000 0.995 6802 A HN 0.433 nan 8.150 nan 0.000 0.501 6803 C N 3.127 122.434 119.300 0.011 0.000 2.264 6803 C HA 0.434 4.894 4.460 -0.001 0.000 0.324 6803 C C 0.366 175.360 174.990 0.006 0.000 1.267 6803 C CA -0.579 58.444 59.018 0.008 0.000 1.618 6803 C CB -0.510 27.236 27.740 0.010 0.000 2.278 6803 C HN 0.932 nan 8.230 nan 0.000 0.499 6804 E N 1.336 121.539 120.200 0.004 0.000 2.414 6804 E HA 0.358 4.708 4.350 -0.001 0.000 0.263 6804 E C -0.138 176.464 176.600 0.003 0.000 1.000 6804 E CA 0.404 56.806 56.400 0.003 0.000 0.914 6804 E CB 0.521 30.223 29.700 0.002 0.000 0.948 6804 E HN 0.497 nan 8.360 nan 0.000 0.444 6805 V N 2.148 122.063 119.914 0.003 0.000 3.087 6805 V HA 0.627 4.747 4.120 -0.001 0.000 0.306 6805 V C -0.186 175.909 176.094 0.002 0.000 1.187 6805 V CA -0.589 61.712 62.300 0.003 0.000 0.999 6805 V CB 2.255 34.080 31.823 0.003 0.000 1.049 6805 V HN 0.752 nan 8.190 nan 0.000 0.431 6806 G N 3.164 111.966 108.800 0.002 0.000 2.254 6806 G HA2 0.402 4.361 3.960 -0.001 0.000 0.253 6806 G HA3 0.402 4.361 3.960 -0.001 0.000 0.253 6806 G C 1.028 175.929 174.900 0.002 0.000 1.246 6806 G CA 0.383 45.484 45.100 0.002 0.000 0.946 6806 G HN 1.559 nan 8.290 nan 0.000 0.474 6807 A N 2.638 125.459 122.820 0.002 0.000 1.933 6807 A HA -0.071 4.249 4.320 -0.001 0.000 0.218 6807 A C 2.052 179.638 177.584 0.003 0.000 1.175 6807 A CA 1.215 53.253 52.037 0.002 0.000 0.628 6807 A CB -0.023 18.978 19.000 0.002 0.000 0.814 6807 A HN 0.577 nan 8.150 nan 0.000 0.444 6808 Q N -0.207 119.595 119.800 0.003 0.000 2.198 6808 Q HA 0.058 4.398 4.340 -0.001 0.000 0.209 6808 Q C -0.746 175.256 176.000 0.003 0.000 0.848 6808 Q CA -0.124 55.681 55.803 0.003 0.000 0.974 6808 Q CB 0.062 28.802 28.738 0.003 0.000 1.115 6808 Q HN 0.745 nan 8.270 nan 0.000 0.494 6809 D N 1.073 121.474 120.400 0.002 0.000 2.412 6809 D HA -0.048 4.591 4.640 -0.001 0.000 0.257 6809 D C 1.234 177.535 176.300 0.001 0.000 1.217 6809 D CA 0.159 54.160 54.000 0.001 0.000 0.897 6809 D CB 0.917 41.717 40.800 0.001 0.000 1.132 6809 D HN -0.220 nan 8.370 nan 0.000 0.493 6810 K N 2.996 123.396 120.400 0.001 0.000 2.077 6810 K HA -0.257 4.062 4.320 -0.001 0.000 0.213 6810 K C 1.449 178.048 176.600 -0.001 0.000 1.051 6810 K CA 1.688 57.975 56.287 0.000 0.000 0.929 6810 K CB 0.018 32.518 32.500 -0.000 0.000 0.715 6810 K HN 0.492 nan 8.250 nan 0.000 0.451 6811 E N 0.050 120.249 120.200 -0.002 0.000 2.017 6811 E HA -0.185 4.164 4.350 -0.001 0.000 0.193 6811 E C 2.113 178.711 176.600 -0.003 0.000 0.997 6811 E CA 1.400 57.798 56.400 -0.004 0.000 0.804 6811 E CB -0.469 29.229 29.700 -0.004 0.000 0.757 6811 E HN 0.343 nan 8.360 nan 0.000 0.448 6812 I N 1.214 121.784 120.570 -0.001 0.000 2.335 6812 I HA -0.233 3.937 4.170 -0.001 0.000 0.251 6812 I C 2.247 178.364 176.117 0.001 0.000 1.129 6812 I CA 0.940 62.240 61.300 -0.000 0.000 1.402 6812 I CB -0.165 37.836 38.000 0.001 0.000 1.069 6812 I HN 0.035 nan 8.210 nan 0.000 0.424 6813 L N -0.417 120.806 121.223 0.001 0.000 2.056 6813 L HA -0.188 4.152 4.340 -0.001 0.000 0.207 6813 L C 2.496 179.366 176.870 0.001 0.000 1.078 6813 L CA 1.858 56.699 54.840 0.002 0.000 0.749 6813 L CB -1.174 40.886 42.059 0.002 0.000 0.901 6813 L HN 0.405 nan 8.230 nan 0.000 0.433 6814 T N -3.741 110.812 114.554 -0.001 0.000 2.985 6814 T HA -0.093 4.256 4.350 -0.001 0.000 0.266 6814 T C 1.862 176.559 174.700 -0.005 0.000 1.076 6814 T CA 0.576 62.674 62.100 -0.003 0.000 1.135 6814 T CB 0.006 68.871 68.868 -0.005 0.000 0.890 6814 T HN 0.005 nan 8.240 nan 0.000 0.480 6815 K N 0.795 121.192 120.400 -0.005 0.000 2.062 6815 K HA 0.249 4.569 4.320 -0.001 0.000 0.205 6815 K C 2.126 178.726 176.600 -0.001 0.000 1.051 6815 K CA 0.591 56.874 56.287 -0.007 0.000 0.941 6815 K CB -0.428 32.068 32.500 -0.006 0.000 0.719 6815 K HN 0.266 nan 8.250 nan 0.000 0.440 6816 I N 0.739 121.311 120.570 0.002 0.000 2.179 6816 I HA -0.210 3.959 4.170 -0.001 0.000 0.242 6816 I C 2.162 178.283 176.117 0.007 0.000 1.088 6816 I CA 1.436 62.740 61.300 0.006 0.000 1.357 6816 I CB -1.335 36.668 38.000 0.006 0.000 1.051 6816 I HN 0.090 nan 8.210 nan 0.000 0.409 6817 A N 0.814 123.637 122.820 0.005 0.000 1.865 6817 A HA -0.245 4.075 4.320 -0.001 0.000 0.217 6817 A C 2.409 179.998 177.584 0.007 0.000 1.191 6817 A CA 1.997 54.037 52.037 0.006 0.000 0.623 6817 A CB -0.636 18.366 19.000 0.004 0.000 0.826 6817 A HN 0.355 nan 8.150 nan 0.000 0.444 6818 M N -0.309 119.293 119.600 0.003 0.000 2.132 6818 M HA -0.130 4.350 4.480 -0.001 0.000 0.263 6818 M C 2.428 178.735 176.300 0.012 0.000 1.065 6818 M CA 2.019 57.319 55.300 0.000 0.000 1.122 6818 M CB -0.746 31.844 32.600 -0.016 0.000 1.365 6818 M HN 0.725 nan 8.290 nan 0.000 0.411 6819 T N -2.715 111.848 114.554 0.015 0.000 2.867 6819 T HA -0.095 4.255 4.350 -0.001 0.000 0.268 6819 T C 1.888 176.613 174.700 0.042 0.000 1.057 6819 T CA 1.630 63.751 62.100 0.035 0.000 1.136 6819 T CB -0.457 68.430 68.868 0.031 0.000 0.874 6819 T HN 0.298 nan 8.240 nan 0.000 0.466 6820 S N 0.923 116.640 115.700 0.028 0.000 2.368 6820 S HA 0.050 4.519 4.470 -0.001 0.000 0.224 6820 S C 2.001 176.619 174.600 0.029 0.000 1.029 6820 S CA 0.725 58.940 58.200 0.025 0.000 0.988 6820 S CB -0.616 62.594 63.200 0.017 0.000 0.838 6820 S HN 0.589 nan 8.310 nan 0.000 0.462 6821 I N 1.761 122.348 120.570 0.029 0.000 2.361 6821 I HA -0.100 4.069 4.170 -0.001 0.000 0.251 6821 I C 1.274 177.420 176.117 0.047 0.000 1.133 6821 I CA 0.893 62.211 61.300 0.031 0.000 1.413 6821 I CB -0.905 37.109 38.000 0.024 0.000 1.073 6821 I HN 0.429 nan 8.210 nan 0.000 0.424 6822 T N -0.588 114.007 114.554 0.069 0.000 2.932 6822 T HA 0.321 4.671 4.350 -0.001 0.000 0.312 6822 T C 1.160 175.918 174.700 0.097 0.000 1.071 6822 T CA 0.101 62.273 62.100 0.121 0.000 1.128 6822 T CB 1.288 70.282 68.868 0.210 0.000 0.984 6822 T HN 0.603 nan 8.240 nan 0.000 0.549 6823 G N 1.510 110.368 108.800 0.097 0.000 2.176 6823 G HA2 -0.206 3.753 3.960 -0.001 0.000 0.253 6823 G HA3 -0.206 3.753 3.960 -0.001 0.000 0.253 6823 G C -0.069 174.848 174.900 0.028 0.000 0.979 6823 G CA 0.391 45.514 45.100 0.037 0.000 0.641 6823 G HN 0.943 nan 8.290 nan 0.000 0.530 6824 K N -0.937 119.488 120.400 0.040 0.000 2.350 6824 K HA 0.621 4.940 4.320 -0.001 0.000 0.241 6824 K C 1.494 178.115 176.600 0.035 0.000 0.994 6824 K CA -0.521 55.784 56.287 0.030 0.000 0.839 6824 K CB 1.436 33.953 32.500 0.027 0.000 1.244 6824 K HN 0.160 nan 8.250 nan 0.000 0.443 6825 G N 0.380 109.197 108.800 0.028 0.000 2.422 6825 G HA2 -0.223 3.736 3.960 -0.001 0.000 0.218 6825 G HA3 -0.223 3.736 3.960 -0.001 0.000 0.218 6825 G C 1.291 176.209 174.900 0.030 0.000 1.140 6825 G CA 0.986 46.103 45.100 0.029 0.000 0.775 6825 G HN 0.617 nan 8.290 nan 0.000 0.545 6826 A N 1.689 124.527 122.820 0.028 0.000 2.125 6826 A HA -0.029 4.290 4.320 -0.001 0.000 0.219 6826 A C 2.131 179.730 177.584 0.025 0.000 1.156 6826 A CA 1.763 53.815 52.037 0.025 0.000 0.671 6826 A CB -0.438 18.576 19.000 0.023 0.000 0.794 6826 A HN 0.662 nan 8.150 nan 0.000 0.459 6827 E N 1.234 121.454 120.200 0.033 0.000 2.331 6827 E HA -0.294 4.056 4.350 -0.001 0.000 0.199 6827 E C 1.614 178.227 176.600 0.022 0.000 1.008 6827 E CA 1.368 57.788 56.400 0.033 0.000 0.843 6827 E CB -0.547 29.189 29.700 0.060 0.000 0.761 6827 E HN 0.820 nan 8.360 nan 0.000 0.507 6828 K N 0.859 121.273 120.400 0.024 0.000 2.211 6828 K HA -0.073 4.247 4.320 -0.001 0.000 0.204 6828 K C 1.501 178.106 176.600 0.008 0.000 1.047 6828 K CA 1.491 57.788 56.287 0.016 0.000 0.935 6828 K CB -0.006 32.506 32.500 0.019 0.000 0.728 6828 K HN 0.160 nan 8.250 nan 0.000 0.452 6829 A N 1.769 124.594 122.820 0.009 0.000 2.616 6829 A HA 0.145 4.464 4.320 -0.001 0.000 0.294 6829 A C 1.303 178.889 177.584 0.003 0.000 1.091 6829 A CA -0.563 51.477 52.037 0.005 0.000 0.971 6829 A CB -0.054 18.951 19.000 0.008 0.000 1.222 6829 A HN 0.415 nan 8.150 nan 0.000 0.521 6830 K N 0.163 120.564 120.400 0.002 0.000 2.286 6830 K HA -0.211 4.109 4.320 -0.001 0.000 0.203 6830 K C 0.863 177.459 176.600 -0.005 0.000 1.045 6830 K CA 1.928 58.214 56.287 -0.000 0.000 0.935 6830 K CB -0.102 32.396 32.500 -0.004 0.000 0.737 6830 K HN 0.333 nan 8.250 nan 0.000 0.460 6831 E N 1.489 121.684 120.200 -0.009 0.000 2.046 6831 E HA -0.140 4.210 4.350 -0.001 0.000 0.190 6831 E C 1.913 178.511 176.600 -0.004 0.000 0.982 6831 E CA 1.299 57.693 56.400 -0.010 0.000 0.800 6831 E CB -0.072 29.620 29.700 -0.013 0.000 0.756 6831 E HN 0.257 nan 8.360 nan 0.000 0.449 6832 K N 0.334 120.734 120.400 -0.001 0.000 2.097 6832 K HA -0.080 4.240 4.320 -0.001 0.000 0.205 6832 K C 1.636 178.239 176.600 0.005 0.000 1.050 6832 K CA 0.809 57.097 56.287 0.002 0.000 0.938 6832 K CB -0.252 32.251 32.500 0.004 0.000 0.718 6832 K HN 0.005 nan 8.250 nan 0.000 0.442 6833 L N 0.410 121.637 121.223 0.005 0.000 2.093 6833 L HA 0.036 4.376 4.340 -0.001 0.000 0.208 6833 L C 2.276 179.149 176.870 0.006 0.000 1.085 6833 L CA 1.893 56.738 54.840 0.007 0.000 0.755 6833 L CB -1.150 40.915 42.059 0.009 0.000 0.904 6833 L HN 0.269 nan 8.230 nan 0.000 0.435 6834 A N -0.801 122.021 122.820 0.003 0.000 1.898 6834 A HA -0.225 4.095 4.320 -0.001 0.000 0.216 6834 A C 2.314 179.899 177.584 0.002 0.000 1.181 6834 A CA 1.629 53.667 52.037 0.002 0.000 0.620 6834 A CB -0.496 18.502 19.000 -0.002 0.000 0.819 6834 A HN 0.380 nan 8.150 nan 0.000 0.442 6835 E N 0.332 120.533 120.200 0.002 0.000 2.058 6835 E HA -0.159 4.191 4.350 -0.001 0.000 0.194 6835 E C 1.696 178.300 176.600 0.006 0.000 0.997 6835 E CA 1.598 57.999 56.400 0.003 0.000 0.801 6835 E CB -0.388 29.313 29.700 0.002 0.000 0.746 6835 E HN 0.639 nan 8.360 nan 0.000 0.450 6836 I N -0.330 120.244 120.570 0.007 0.000 2.179 6836 I HA -0.234 3.936 4.170 -0.001 0.000 0.242 6836 I C 1.930 178.053 176.117 0.009 0.000 1.088 6836 I CA 0.756 62.062 61.300 0.010 0.000 1.357 6836 I CB -0.152 37.855 38.000 0.012 0.000 1.051 6836 I HN 0.161 nan 8.210 nan 0.000 0.409 6837 I N -0.362 120.212 120.570 0.008 0.000 2.406 6837 I HA -0.163 4.007 4.170 -0.001 0.000 0.249 6837 I C 2.296 178.417 176.117 0.006 0.000 1.122 6837 I CA 1.068 62.372 61.300 0.007 0.000 1.431 6837 I CB -0.287 37.716 38.000 0.006 0.000 1.087 6837 I HN -0.063 nan 8.210 nan 0.000 0.424 6838 V N 0.232 120.149 119.914 0.006 0.000 2.358 6838 V HA -0.259 3.861 4.120 -0.001 0.000 0.246 6838 V C 2.512 178.609 176.094 0.006 0.000 1.047 6838 V CA 1.919 64.222 62.300 0.005 0.000 1.035 6838 V CB -0.548 31.277 31.823 0.004 0.000 0.658 6838 V HN 0.403 nan 8.190 nan 0.000 0.452 6839 E N 0.847 121.051 120.200 0.007 0.000 2.077 6839 E HA -0.163 4.186 4.350 -0.001 0.000 0.193 6839 E C 2.134 178.740 176.600 0.010 0.000 0.989 6839 E CA 1.684 58.089 56.400 0.009 0.000 0.800 6839 E CB -0.494 29.212 29.700 0.010 0.000 0.746 6839 E HN 0.492 nan 8.360 nan 0.000 0.452 6840 A N 0.030 122.855 122.820 0.010 0.000 1.902 6840 A HA -0.137 4.183 4.320 -0.001 0.000 0.217 6840 A C 2.505 180.094 177.584 0.008 0.000 1.181 6840 A CA 1.731 53.773 52.037 0.009 0.000 0.623 6840 A CB -0.785 18.219 19.000 0.008 0.000 0.818 6840 A HN 0.205 nan 8.150 nan 0.000 0.443 6841 V N -0.330 119.588 119.914 0.007 0.000 2.307 6841 V HA -0.194 3.926 4.120 -0.001 0.000 0.245 6841 V C 2.763 178.862 176.094 0.007 0.000 1.045 6841 V CA 2.242 64.545 62.300 0.006 0.000 1.024 6841 V CB -0.852 30.974 31.823 0.005 0.000 0.651 6841 V HN 0.546 nan 8.190 nan 0.000 0.449 6842 S N 0.189 115.894 115.700 0.008 0.000 2.387 6842 S HA -0.219 4.251 4.470 -0.001 0.000 0.230 6842 S C 2.168 176.775 174.600 0.011 0.000 1.035 6842 S CA 1.509 59.715 58.200 0.009 0.000 1.014 6842 S CB -0.472 62.734 63.200 0.009 0.000 0.836 6842 S HN 0.659 nan 8.310 nan 0.000 0.466 6843 A N 1.112 123.940 122.820 0.013 0.000 1.855 6843 A HA -0.043 4.277 4.320 -0.001 0.000 0.215 6843 A C 2.402 179.995 177.584 0.016 0.000 1.191 6843 A CA 1.758 53.806 52.037 0.018 0.000 0.613 6843 A CB -0.820 18.191 19.000 0.019 0.000 0.829 6843 A HN 0.579 nan 8.150 nan 0.000 0.442 6844 V N -3.212 116.709 119.914 0.011 0.000 3.052 6844 V HA 0.040 4.160 4.120 -0.001 0.000 0.254 6844 V C 2.033 178.131 176.094 0.006 0.000 1.100 6844 V CA 1.365 63.670 62.300 0.009 0.000 1.112 6844 V CB -0.365 31.461 31.823 0.005 0.000 0.738 6844 V HN 0.194 nan 8.190 nan 0.000 0.469 6845 V N 0.552 120.470 119.914 0.006 0.000 2.809 6845 V HA -0.059 4.061 4.120 -0.001 0.000 0.256 6845 V C 1.571 177.667 176.094 0.003 0.000 1.080 6845 V CA 2.290 64.592 62.300 0.004 0.000 1.102 6845 V CB -0.538 31.287 31.823 0.004 0.000 0.705 6845 V HN 0.842 nan 8.190 nan 0.000 0.475 6846 D N -0.651 119.752 120.400 0.004 0.000 4.438 6846 D HA -0.218 4.421 4.640 -0.001 0.000 0.158 6846 D C 0.632 176.932 176.300 0.001 0.000 0.686 6846 D CA 1.927 55.928 54.000 0.002 0.000 1.183 6846 D CB -1.243 39.556 40.800 -0.002 0.000 0.623 6846 D HN 0.556 nan 8.370 nan 0.000 0.521 6847 D N 1.020 121.419 120.400 -0.001 0.000 2.393 6847 D HA 0.289 4.928 4.640 -0.001 0.000 0.246 6847 D C -0.157 176.143 176.300 0.000 0.000 1.275 6847 D CA 0.228 54.227 54.000 -0.001 0.000 0.979 6847 D CB 0.402 41.200 40.800 -0.003 0.000 1.101 6847 D HN 0.154 nan 8.370 nan 0.000 0.505 6848 E N -0.604 119.597 120.200 0.000 0.000 2.731 6848 E HA 0.596 4.946 4.350 -0.001 0.000 0.220 6848 E C -0.181 176.419 176.600 0.000 0.000 1.087 6848 E CA -0.503 55.897 56.400 0.001 0.000 1.020 6848 E CB 0.856 30.557 29.700 0.001 0.000 1.339 6848 E HN 0.502 nan 8.360 nan 0.000 0.444 6849 G N 0.590 109.390 108.800 0.000 0.000 2.328 6849 G HA2 0.353 4.313 3.960 -0.001 0.000 0.299 6849 G HA3 0.353 4.313 3.960 -0.001 0.000 0.299 6849 G C -1.738 173.162 174.900 0.000 0.000 1.435 6849 G CA -0.926 44.174 45.100 0.000 0.000 0.865 6849 G HN 0.025 nan 8.290 nan 0.000 0.601 6850 K N 0.301 120.701 120.400 0.000 0.000 2.581 6850 K HA 0.587 4.906 4.320 -0.001 0.000 0.249 6850 K C -1.663 174.937 176.600 0.000 0.000 0.966 6850 K CA -0.581 55.706 56.287 0.000 0.000 0.811 6850 K CB 2.058 34.558 32.500 -0.001 0.000 1.223 6850 K HN 0.880 nan 8.250 nan 0.000 0.438 6851 V N 3.031 122.945 119.914 0.001 0.000 2.547 6851 V HA 0.429 4.549 4.120 -0.001 0.000 0.299 6851 V C -1.123 174.971 176.094 -0.000 0.000 1.040 6851 V CA -0.516 61.785 62.300 0.001 0.000 0.913 6851 V CB 1.694 33.518 31.823 0.001 0.000 0.992 6851 V HN 0.779 nan 8.190 nan 0.000 0.449 6852 D N 4.539 124.938 120.400 -0.001 0.000 2.441 6852 D HA 0.332 4.972 4.640 -0.001 0.000 0.231 6852 D C 0.787 177.086 176.300 -0.003 0.000 1.073 6852 D CA -0.306 53.692 54.000 -0.002 0.000 0.850 6852 D CB 1.678 42.476 40.800 -0.003 0.000 1.062 6852 D HN 0.553 nan 8.370 nan 0.000 0.524 6853 K N 2.041 122.440 120.400 -0.003 0.000 2.280 6853 K HA -0.152 4.167 4.320 -0.001 0.000 0.202 6853 K C 0.882 177.478 176.600 -0.007 0.000 1.047 6853 K CA 0.826 57.111 56.287 -0.004 0.000 0.942 6853 K CB 0.248 32.746 32.500 -0.003 0.000 0.739 6853 K HN 0.355 nan 8.250 nan 0.000 0.457 6854 D N 0.763 121.158 120.400 -0.008 0.000 2.310 6854 D HA -0.072 4.568 4.640 -0.001 0.000 0.212 6854 D C 1.343 177.634 176.300 -0.015 0.000 0.965 6854 D CA 0.627 54.619 54.000 -0.012 0.000 0.879 6854 D CB 0.157 40.950 40.800 -0.012 0.000 0.921 6854 D HN 0.105 nan 8.370 nan 0.000 0.510 6855 L N -0.187 121.030 121.223 -0.011 0.000 2.492 6855 L HA 0.157 4.496 4.340 -0.001 0.000 0.223 6855 L C 0.355 177.218 176.870 -0.011 0.000 1.132 6855 L CA 0.248 55.081 54.840 -0.011 0.000 0.850 6855 L CB 0.134 42.189 42.059 -0.005 0.000 0.966 6855 L HN 0.019 nan 8.230 nan 0.000 0.454 6856 I N 0.566 121.130 120.570 -0.010 0.000 2.390 6856 I HA 0.180 4.350 4.170 -0.001 0.000 0.283 6856 I C -0.089 176.019 176.117 -0.015 0.000 1.016 6856 I CA -0.642 60.653 61.300 -0.009 0.000 1.151 6856 I CB 1.408 39.406 38.000 -0.004 0.000 1.293 6856 I HN -0.148 nan 8.210 nan 0.000 0.458 6857 K N 7.269 127.657 120.400 -0.021 0.000 2.172 6857 K HA 0.451 4.771 4.320 -0.001 0.000 0.276 6857 K C -0.786 175.800 176.600 -0.023 0.000 1.013 6857 K CA -0.238 56.032 56.287 -0.028 0.000 0.913 6857 K CB 0.774 33.247 32.500 -0.045 0.000 1.055 6857 K HN 0.396 nan 8.250 nan 0.000 0.461 6858 I N 3.932 124.489 120.570 -0.021 0.000 2.347 6858 I HA 0.239 4.409 4.170 -0.001 0.000 0.283 6858 I C -0.161 175.943 176.117 -0.022 0.000 1.058 6858 I CA -0.680 60.611 61.300 -0.015 0.000 1.202 6858 I CB 0.345 38.340 38.000 -0.009 0.000 1.386 6858 I HN 0.684 nan 8.210 nan 0.000 0.475 6859 E N 6.973 127.157 120.200 -0.026 0.000 2.214 6859 E HA 0.612 4.962 4.350 -0.001 0.000 0.274 6859 E C -0.784 175.805 176.600 -0.018 0.000 0.977 6859 E CA -0.595 55.785 56.400 -0.034 0.000 0.827 6859 E CB 1.406 31.070 29.700 -0.059 0.000 1.130 6859 E HN 0.563 nan 8.360 nan 0.000 0.394 6860 K N 1.624 122.013 120.400 -0.019 0.000 2.498 6860 K HA 0.688 5.008 4.320 -0.001 0.000 0.254 6860 K C -1.333 175.260 176.600 -0.012 0.000 0.933 6860 K CA -1.213 55.068 56.287 -0.010 0.000 0.806 6860 K CB 1.817 34.311 32.500 -0.011 0.000 1.301 6860 K HN 0.197 nan 8.250 nan 0.000 0.432 6861 K N 1.349 121.748 120.400 -0.001 0.000 2.581 6861 K HA 0.216 4.536 4.320 -0.001 0.000 0.249 6861 K C -1.282 175.320 176.600 0.003 0.000 0.966 6861 K CA -0.339 55.949 56.287 0.001 0.000 0.811 6861 K CB 2.180 34.689 32.500 0.015 0.000 1.223 6861 K HN 0.711 nan 8.250 nan 0.000 0.438 6862 S N 2.579 118.275 115.700 -0.007 0.000 2.568 6862 S HA 0.601 5.071 4.470 -0.001 0.000 0.282 6862 S C 0.136 174.739 174.600 0.004 0.000 1.338 6862 S CA 1.338 59.534 58.200 -0.006 0.000 1.045 6862 S CB -0.222 62.967 63.200 -0.018 0.000 0.873 6862 S HN 1.207 nan 8.310 nan 0.000 0.516 6863 G N 1.786 110.590 108.800 0.007 0.000 2.428 6863 G HA2 0.509 4.469 3.960 -0.001 0.000 0.681 6863 G HA3 0.509 4.469 3.960 -0.001 0.000 0.681 6863 G C -0.099 174.810 174.900 0.014 0.000 1.340 6863 G CA -0.039 45.068 45.100 0.011 0.000 0.915 6863 G HN 2.158 nan 8.290 nan 0.000 0.645 6864 A N -0.816 122.012 122.820 0.013 0.000 6.088 6864 A HA 0.395 4.715 4.320 -0.001 0.000 0.261 6864 A C 1.091 178.682 177.584 0.012 0.000 2.138 6864 A CA 1.912 53.956 52.037 0.012 0.000 0.708 6864 A CB -1.632 17.377 19.000 0.015 0.000 1.068 6864 A HN 2.716 nan 8.150 nan 0.000 0.364 6865 S N -2.556 113.151 115.700 0.012 0.000 2.745 6865 S HA 0.692 5.161 4.470 -0.001 0.000 0.306 6865 S C 1.125 175.733 174.600 0.014 0.000 1.137 6865 S CA 0.144 58.351 58.200 0.012 0.000 0.900 6865 S CB 1.368 64.575 63.200 0.010 0.000 1.176 6865 S HN 1.652 nan 8.310 nan 0.000 0.520 6866 I N 1.115 121.694 120.570 0.014 0.000 2.493 6866 I HA -0.086 4.084 4.170 -0.001 0.000 0.254 6866 I C 1.576 177.701 176.117 0.013 0.000 1.160 6866 I CA 1.599 62.908 61.300 0.014 0.000 1.445 6866 I CB -0.101 37.908 38.000 0.015 0.000 1.086 6866 I HN 0.794 nan 8.210 nan 0.000 0.433 6867 D N 0.755 121.162 120.400 0.011 0.000 2.264 6867 D HA -0.203 4.437 4.640 -0.001 0.000 0.208 6867 D C 1.594 177.899 176.300 0.009 0.000 0.966 6867 D CA 1.118 55.123 54.000 0.008 0.000 0.864 6867 D CB 0.022 40.826 40.800 0.006 0.000 0.933 6867 D HN 0.358 nan 8.370 nan 0.000 0.499 6868 D N -0.461 119.946 120.400 0.011 0.000 2.347 6868 D HA -0.032 4.608 4.640 -0.001 0.000 0.213 6868 D C 0.234 176.546 176.300 0.020 0.000 0.985 6868 D CA 0.384 54.392 54.000 0.013 0.000 0.879 6868 D CB -0.127 40.682 40.800 0.014 0.000 0.919 6868 D HN 0.148 nan 8.370 nan 0.000 0.526 6869 T N 1.563 116.130 114.554 0.021 0.000 2.933 6869 T HA 0.106 4.456 4.350 -0.001 0.000 0.306 6869 T C 0.291 175.007 174.700 0.027 0.000 1.045 6869 T CA 0.675 62.791 62.100 0.026 0.000 1.143 6869 T CB 1.038 69.919 68.868 0.021 0.000 1.003 6869 T HN 0.013 nan 8.240 nan 0.000 0.540 6870 E N 1.480 121.702 120.200 0.038 0.000 2.390 6870 E HA 0.530 4.880 4.350 -0.001 0.000 0.280 6870 E C -1.884 174.747 176.600 0.051 0.000 0.992 6870 E CA -0.813 55.610 56.400 0.038 0.000 0.790 6870 E CB 1.075 30.796 29.700 0.035 0.000 1.248 6870 E HN 0.356 nan 8.360 nan 0.000 0.447 6871 L N 3.340 124.588 121.223 0.042 0.000 2.312 6871 L HA 0.596 4.936 4.340 -0.001 0.000 0.281 6871 L C -1.079 175.827 176.870 0.061 0.000 1.070 6871 L CA -0.183 54.683 54.840 0.043 0.000 0.805 6871 L CB 0.793 42.869 42.059 0.028 0.000 1.174 6871 L HN 0.570 nan 8.230 nan 0.000 0.434 6872 I N 5.455 126.070 120.570 0.076 0.000 2.382 6872 I HA 0.301 4.471 4.170 -0.001 0.000 0.285 6872 I C -0.056 176.099 176.117 0.064 0.000 1.007 6872 I CA -0.461 60.901 61.300 0.102 0.000 1.142 6872 I CB 1.153 39.268 38.000 0.192 0.000 1.289 6872 I HN 0.326 nan 8.210 nan 0.000 0.453 6873 K N 5.779 126.210 120.400 0.051 0.000 2.081 6873 K HA 0.485 4.804 4.320 -0.001 0.000 0.230 6873 K C 0.455 177.077 176.600 0.035 0.000 1.199 6873 K CA -0.005 56.303 56.287 0.034 0.000 1.130 6873 K CB -0.284 32.230 32.500 0.024 0.000 1.386 6873 K HN 0.979 nan 8.250 nan 0.000 0.280 6874 G N -0.660 108.157 108.800 0.029 0.000 2.398 6874 G HA2 0.023 3.982 3.960 -0.001 0.000 0.251 6874 G HA3 0.023 3.982 3.960 -0.001 0.000 0.251 6874 G C -1.606 173.289 174.900 -0.008 0.000 1.277 6874 G CA -0.805 44.305 45.100 0.016 0.000 0.927 6874 G HN 0.085 nan 8.290 nan 0.000 0.477 6875 V N 0.754 120.648 119.914 -0.034 0.000 2.495 6875 V HA 0.705 4.825 4.120 -0.001 0.000 0.298 6875 V C -0.647 175.361 176.094 -0.142 0.000 1.031 6875 V CA -0.623 61.620 62.300 -0.094 0.000 0.871 6875 V CB 1.408 33.149 31.823 -0.136 0.000 0.988 6875 V HN 0.910 nan 8.190 nan 0.000 0.432 6876 L N 7.465 128.565 121.223 -0.204 0.000 2.305 6876 L HA 0.836 5.175 4.340 -0.001 0.000 0.284 6876 L C -0.383 176.316 176.870 -0.286 0.000 1.013 6876 L CA -0.153 54.464 54.840 -0.373 0.000 0.819 6876 L CB 1.692 43.434 42.059 -0.527 0.000 1.227 6876 L HN 0.577 nan 8.230 nan 0.000 0.417 6877 V N 1.574 121.326 119.914 -0.270 0.000 2.769 6877 V HA 0.636 4.755 4.120 -0.001 0.000 0.312 6877 V C -0.491 175.521 176.094 -0.136 0.000 1.061 6877 V CA -0.523 61.673 62.300 -0.174 0.000 0.931 6877 V CB 1.834 33.571 31.823 -0.143 0.000 1.010 6877 V HN 0.822 nan 8.190 nan 0.000 0.433 6878 D N 1.131 121.478 120.400 -0.088 0.000 3.134 6878 D HA 0.340 4.980 4.640 -0.001 0.000 0.248 6878 D C -0.103 176.191 176.300 -0.009 0.000 1.273 6878 D CA -0.264 53.704 54.000 -0.054 0.000 0.904 6878 D CB 0.341 41.114 40.800 -0.047 0.000 1.089 6878 D HN 0.521 nan 8.370 nan 0.000 0.478 6879 K N 0.278 120.688 120.400 0.016 0.000 2.313 6879 K HA 0.534 4.854 4.320 -0.001 0.000 0.235 6879 K C 0.186 176.820 176.600 0.057 0.000 1.035 6879 K CA -0.853 55.465 56.287 0.052 0.000 0.868 6879 K CB 1.726 34.290 32.500 0.106 0.000 1.232 6879 K HN 0.311 nan 8.250 nan 0.000 0.459 6880 E N -0.104 120.126 120.200 0.050 0.000 2.378 6880 E HA 0.481 4.830 4.350 -0.001 0.000 0.265 6880 E C -0.748 175.865 176.600 0.023 0.000 0.932 6880 E CA -1.141 55.282 56.400 0.039 0.000 0.795 6880 E CB 1.118 30.834 29.700 0.028 0.000 1.296 6880 E HN 0.100 nan 8.360 nan 0.000 0.438 6881 R N 1.407 121.913 120.500 0.011 0.000 2.296 6881 R HA 0.074 4.414 4.340 -0.001 0.000 0.323 6881 R C 1.248 177.542 176.300 -0.011 0.000 1.067 6881 R CA 0.161 56.252 56.100 -0.014 0.000 0.946 6881 R CB 0.957 31.247 30.300 -0.016 0.000 0.991 6881 R HN 0.649 nan 8.270 nan 0.000 0.448 6882 V N 0.013 119.915 119.914 -0.020 0.000 2.688 6882 V HA -0.102 4.018 4.120 -0.001 0.000 0.256 6882 V C 0.905 176.996 176.094 -0.006 0.000 1.084 6882 V CA 1.212 63.506 62.300 -0.010 0.000 1.103 6882 V CB -0.252 31.563 31.823 -0.013 0.000 0.688 6882 V HN 0.526 nan 8.190 nan 0.000 0.480 6883 S N -0.904 114.791 115.700 -0.009 0.000 2.521 6883 S HA 0.774 5.244 4.470 -0.001 0.000 0.295 6883 S C 0.827 175.427 174.600 -0.001 0.000 1.098 6883 S CA -0.139 58.061 58.200 -0.000 0.000 0.999 6883 S CB 1.821 65.023 63.200 0.004 0.000 1.034 6883 S HN 0.735 nan 8.310 nan 0.000 0.483 6884 A N 3.476 126.299 122.820 0.005 0.000 2.121 6884 A HA -0.026 4.293 4.320 -0.001 0.000 0.218 6884 A C 1.782 179.369 177.584 0.006 0.000 1.154 6884 A CA 1.113 53.154 52.037 0.006 0.000 0.679 6884 A CB -0.437 18.567 19.000 0.007 0.000 0.795 6884 A HN 0.904 nan 8.150 nan 0.000 0.458 6885 Q N -0.906 118.899 119.800 0.008 0.000 2.389 6885 Q HA 0.144 4.484 4.340 -0.001 0.000 0.204 6885 Q C 0.296 176.288 176.000 -0.013 0.000 0.944 6885 Q CA 0.072 55.877 55.803 0.003 0.000 0.908 6885 Q CB -0.059 28.687 28.738 0.014 0.000 1.002 6885 Q HN 0.665 nan 8.270 nan 0.000 0.493 6886 M N 1.680 121.270 119.600 -0.017 0.000 2.242 6886 M HA 0.178 4.657 4.480 -0.001 0.000 0.344 6886 M C -2.111 174.178 176.300 -0.018 0.000 1.140 6886 M CA -1.920 53.365 55.300 -0.026 0.000 1.160 6886 M CB 0.170 32.750 32.600 -0.034 0.000 1.491 6886 M HN -0.179 nan 8.290 nan 0.000 0.459 6887 P HA 0.006 nan 4.420 nan 0.000 0.266 6887 P C -0.456 176.840 177.300 -0.007 0.000 1.193 6887 P CA 0.278 63.370 63.100 -0.012 0.000 0.770 6887 P CB 0.459 32.151 31.700 -0.014 0.000 0.836 6888 K N 1.273 121.673 120.400 0.001 0.000 2.393 6888 K HA 0.053 4.372 4.320 -0.001 0.000 0.193 6888 K C 0.385 176.996 176.600 0.019 0.000 1.026 6888 K CA 0.474 56.767 56.287 0.011 0.000 1.064 6888 K CB 0.124 32.631 32.500 0.012 0.000 0.833 6888 K HN 0.497 nan 8.250 nan 0.000 0.521 6889 K N -0.384 120.023 120.400 0.012 0.000 2.571 6889 K HA 0.336 4.656 4.320 -0.001 0.000 0.252 6889 K C -1.329 175.277 176.600 0.011 0.000 0.956 6889 K CA -0.788 55.510 56.287 0.017 0.000 0.822 6889 K CB 2.023 34.530 32.500 0.012 0.000 1.286 6889 K HN -0.275 nan 8.250 nan 0.000 0.439 6890 V N 2.096 122.021 119.914 0.017 0.000 2.577 6890 V HA 0.462 4.582 4.120 -0.001 0.000 0.303 6890 V C -0.207 175.899 176.094 0.020 0.000 1.042 6890 V CA -0.538 61.769 62.300 0.012 0.000 0.872 6890 V CB 1.847 33.674 31.823 0.006 0.000 0.998 6890 V HN 1.006 nan 8.190 nan 0.000 0.423 6891 T N -0.167 114.395 114.554 0.013 0.000 2.945 6891 T HA 0.566 4.916 4.350 -0.001 0.000 0.286 6891 T C 0.105 174.812 174.700 0.011 0.000 1.025 6891 T CA -0.257 61.851 62.100 0.013 0.000 1.039 6891 T CB 1.370 70.242 68.868 0.006 0.000 1.068 6891 T HN 0.773 nan 8.240 nan 0.000 0.497 6892 D N 0.057 120.464 120.400 0.011 0.000 2.689 6892 D HA -0.149 4.491 4.640 -0.001 0.000 0.237 6892 D C 0.270 176.580 176.300 0.016 0.000 1.148 6892 D CA 0.845 54.851 54.000 0.010 0.000 0.656 6892 D CB -1.257 39.546 40.800 0.006 0.000 1.050 6892 D HN 1.086 nan 8.370 nan 0.000 0.426 6893 A N 1.306 124.140 122.820 0.024 0.000 2.425 6893 A HA 0.408 4.728 4.320 -0.001 0.000 0.249 6893 A C 0.533 178.138 177.584 0.035 0.000 1.084 6893 A CA 0.062 52.117 52.037 0.031 0.000 0.781 6893 A CB 0.634 19.664 19.000 0.050 0.000 1.019 6893 A HN 0.150 nan 8.150 nan 0.000 0.490 6894 K N 2.722 123.140 120.400 0.030 0.000 2.354 6894 K HA 0.360 4.680 4.320 -0.001 0.000 0.257 6894 K C -1.223 175.403 176.600 0.043 0.000 1.062 6894 K CA -0.195 56.111 56.287 0.032 0.000 0.971 6894 K CB 0.832 33.344 32.500 0.020 0.000 1.305 6894 K HN 0.541 nan 8.250 nan 0.000 0.449 6895 I N 2.197 122.809 120.570 0.070 0.000 2.352 6895 I HA 0.184 4.353 4.170 -0.001 0.000 0.290 6895 I C 0.406 176.582 176.117 0.099 0.000 1.036 6895 I CA -0.131 61.238 61.300 0.115 0.000 1.336 6895 I CB 1.317 39.422 38.000 0.175 0.000 1.407 6895 I HN 0.454 nan 8.210 nan 0.000 0.497 6896 A N 7.635 130.511 122.820 0.095 0.000 2.330 6896 A HA 0.856 5.175 4.320 -0.001 0.000 0.327 6896 A C -0.765 176.894 177.584 0.124 0.000 1.155 6896 A CA -0.583 51.502 52.037 0.080 0.000 0.803 6896 A CB 0.694 19.719 19.000 0.042 0.000 1.208 6896 A HN 0.652 nan 8.150 nan 0.000 0.477 6897 L N 3.336 124.623 121.223 0.106 0.000 2.298 6897 L HA 0.488 4.828 4.340 -0.001 0.000 0.284 6897 L C -0.822 176.092 176.870 0.074 0.000 1.013 6897 L CA -0.189 54.719 54.840 0.114 0.000 0.824 6897 L CB 1.169 43.279 42.059 0.085 0.000 1.221 6897 L HN 0.575 nan 8.230 nan 0.000 0.418 6898 L N 3.099 124.369 121.223 0.078 0.000 2.334 6898 L HA 0.451 4.790 4.340 -0.001 0.000 0.276 6898 L C 0.733 177.634 176.870 0.052 0.000 1.014 6898 L CA -0.379 54.493 54.840 0.053 0.000 0.815 6898 L CB 2.118 44.204 42.059 0.045 0.000 1.268 6898 L HN 0.587 nan 8.230 nan 0.000 0.428 6899 N N 0.483 119.205 118.700 0.037 0.000 2.348 6899 N HA 0.017 4.757 4.740 -0.001 0.000 0.183 6899 N C 0.350 175.877 175.510 0.028 0.000 1.094 6899 N CA -0.050 53.020 53.050 0.032 0.000 0.885 6899 N CB 0.570 39.071 38.487 0.023 0.000 1.065 6899 N HN 0.753 nan 8.380 nan 0.000 0.472 6900 C N 0.798 120.114 119.300 0.026 0.000 2.470 6900 C HA 0.854 5.314 4.460 -0.001 0.000 0.350 6900 C C 1.038 176.043 174.990 0.026 0.000 1.341 6900 C CA -1.259 57.773 59.018 0.023 0.000 2.440 6900 C CB -0.004 27.749 27.740 0.021 0.000 2.295 6900 C HN 0.324 nan 8.230 nan 0.000 0.645 6901 A N 0.763 123.598 122.820 0.024 0.000 2.340 6901 A HA 0.631 4.950 4.320 -0.001 0.000 0.268 6901 A C -0.008 177.592 177.584 0.028 0.000 1.100 6901 A CA -0.640 51.412 52.037 0.026 0.000 0.803 6901 A CB -0.083 18.931 19.000 0.023 0.000 1.043 6901 A HN 0.859 nan 8.150 nan 0.000 0.488 6902 I N 2.246 122.834 120.570 0.030 0.000 2.243 6902 I HA 0.204 4.374 4.170 -0.001 0.000 0.289 6902 I C 0.116 176.258 176.117 0.043 0.000 1.140 6902 I CA 0.471 61.793 61.300 0.036 0.000 1.289 6902 I CB -0.555 37.467 38.000 0.038 0.000 1.498 6902 I HN 0.716 nan 8.210 nan 0.000 0.561 6903 E N 3.528 123.752 120.200 0.039 0.000 2.450 6903 E HA 0.493 4.842 4.350 -0.001 0.000 0.272 6903 E C -0.794 175.831 176.600 0.040 0.000 0.967 6903 E CA -1.120 55.304 56.400 0.040 0.000 0.818 6903 E CB 2.332 32.050 29.700 0.031 0.000 1.401 6903 E HN 0.123 nan 8.360 nan 0.000 0.450 6904 I N 2.310 122.905 120.570 0.041 0.000 2.406 6904 I HA 0.079 4.249 4.170 -0.001 0.000 0.293 6904 I C 0.506 176.641 176.117 0.031 0.000 1.101 6904 I CA 0.174 61.498 61.300 0.041 0.000 1.334 6904 I CB -0.518 37.510 38.000 0.046 0.000 1.421 6904 I HN 0.398 nan 8.210 nan 0.000 0.513 6905 K N 4.902 125.320 120.400 0.029 0.000 2.319 6905 K HA 0.084 4.404 4.320 -0.001 0.000 0.265 6905 K C -0.065 176.548 176.600 0.022 0.000 1.000 6905 K CA -0.199 56.102 56.287 0.023 0.000 0.943 6905 K CB 0.846 33.359 32.500 0.021 0.000 0.950 6905 K HN 0.460 nan 8.250 nan 0.000 0.485 6906 E N 1.421 121.630 120.200 0.016 0.000 2.207 6906 E HA 0.171 4.521 4.350 -0.001 0.000 0.270 6906 E C -1.056 175.552 176.600 0.013 0.000 0.927 6906 E CA -0.591 55.817 56.400 0.013 0.000 0.799 6906 E CB 1.359 31.063 29.700 0.007 0.000 1.172 6906 E HN 0.637 nan 8.360 nan 0.000 0.404 6907 T N 1.100 115.662 114.554 0.013 0.000 2.813 6907 T HA 0.178 4.527 4.350 -0.001 0.000 0.297 6907 T C 0.746 175.451 174.700 0.008 0.000 1.036 6907 T CA -0.378 61.729 62.100 0.012 0.000 1.044 6907 T CB 0.760 69.636 68.868 0.014 0.000 0.993 6907 T HN 0.417 nan 8.240 nan 0.000 0.535 6908 E N 0.334 120.539 120.200 0.008 0.000 2.047 6908 E HA 0.045 4.394 4.350 -0.001 0.000 0.191 6908 E C 1.238 177.841 176.600 0.005 0.000 0.987 6908 E CA 1.032 57.436 56.400 0.006 0.000 0.799 6908 E CB -0.585 29.119 29.700 0.006 0.000 0.752 6908 E HN 0.780 nan 8.360 nan 0.000 0.449 6909 T N 1.315 115.872 114.554 0.006 0.000 2.930 6909 T HA -0.006 4.344 4.350 -0.001 0.000 0.306 6909 T C -0.425 174.277 174.700 0.004 0.000 1.045 6909 T CA -0.692 61.411 62.100 0.005 0.000 1.134 6909 T CB 0.208 69.080 68.868 0.006 0.000 0.961 6909 T HN -0.121 nan 8.240 nan 0.000 0.545 6910 D N 2.829 123.229 120.400 0.001 0.000 2.425 6910 D HA 0.493 5.133 4.640 -0.001 0.000 0.247 6910 D C -0.243 176.055 176.300 -0.002 0.000 1.147 6910 D CA 0.459 54.458 54.000 -0.001 0.000 0.879 6910 D CB 0.868 41.666 40.800 -0.003 0.000 1.179 6910 D HN 0.758 nan 8.370 nan 0.000 0.456 6911 A N 2.639 125.456 122.820 -0.006 0.000 2.547 6911 A HA 0.584 4.903 4.320 -0.001 0.000 0.297 6911 A C -0.849 176.721 177.584 -0.022 0.000 1.056 6911 A CA -0.775 51.258 52.037 -0.008 0.000 0.688 6911 A CB 1.603 20.604 19.000 0.002 0.000 1.282 6911 A HN 0.463 nan 8.150 nan 0.000 0.400 6912 E N 0.926 121.106 120.200 -0.032 0.000 2.314 6912 E HA 0.503 4.853 4.350 -0.001 0.000 0.272 6912 E C -1.428 175.119 176.600 -0.089 0.000 0.884 6912 E CA -0.850 55.514 56.400 -0.061 0.000 0.753 6912 E CB 2.313 31.982 29.700 -0.051 0.000 1.213 6912 E HN 0.497 nan 8.360 nan 0.000 0.432 6913 I N 2.197 122.666 120.570 -0.169 0.000 2.428 6913 I HA 0.153 4.323 4.170 -0.001 0.000 0.289 6913 I C 0.040 176.036 176.117 -0.202 0.000 1.019 6913 I CA -0.187 60.942 61.300 -0.285 0.000 1.351 6913 I CB 0.422 38.013 38.000 -0.682 0.000 1.412 6913 I HN 0.188 nan 8.210 nan 0.000 0.513 6914 R N 6.728 127.150 120.500 -0.130 0.000 2.310 6914 R HA 0.431 4.771 4.340 -0.001 0.000 0.316 6914 R C -0.993 175.295 176.300 -0.021 0.000 1.004 6914 R CA -0.764 55.299 56.100 -0.061 0.000 0.900 6914 R CB 0.854 31.142 30.300 -0.020 0.000 1.152 6914 R HN 0.409 nan 8.270 nan 0.000 0.513 6915 I N 3.047 123.595 120.570 -0.036 0.000 2.416 6915 I HA 0.058 4.228 4.170 -0.001 0.000 0.288 6915 I C 1.642 177.780 176.117 0.035 0.000 1.051 6915 I CA 0.321 61.636 61.300 0.026 0.000 1.375 6915 I CB 1.103 39.108 38.000 0.008 0.000 1.407 6915 I HN 0.519 nan 8.210 nan 0.000 0.516 6916 T N 0.022 114.612 114.554 0.059 0.000 3.040 6916 T HA 0.221 4.571 4.350 -0.001 0.000 0.266 6916 T C 0.261 174.984 174.700 0.040 0.000 1.005 6916 T CA -0.228 61.898 62.100 0.042 0.000 0.906 6916 T CB 0.564 69.457 68.868 0.042 0.000 1.082 6916 T HN 0.576 nan 8.240 nan 0.000 0.531 6917 D N 0.841 121.272 120.400 0.052 0.000 2.886 6917 D HA 0.257 4.897 4.640 -0.001 0.000 0.216 6917 D C -2.302 174.028 176.300 0.050 0.000 1.256 6917 D CA -1.689 52.337 54.000 0.043 0.000 0.844 6917 D CB 2.911 43.734 40.800 0.039 0.000 1.669 6917 D HN -0.242 nan 8.370 nan 0.000 0.513 6918 P HA -0.096 nan 4.420 nan 0.000 0.219 6918 P C 1.042 178.367 177.300 0.041 0.000 1.146 6918 P CA 0.834 63.956 63.100 0.036 0.000 0.808 6918 P CB 0.300 32.014 31.700 0.024 0.000 0.779 6919 A N 0.526 123.368 122.820 0.035 0.000 1.930 6919 A HA -0.157 4.163 4.320 -0.001 0.000 0.217 6919 A C 2.394 180.002 177.584 0.040 0.000 1.175 6919 A CA 1.711 53.765 52.037 0.030 0.000 0.627 6919 A CB -1.071 17.940 19.000 0.017 0.000 0.815 6919 A HN 0.159 nan 8.150 nan 0.000 0.443 6920 K N -0.684 119.754 120.400 0.062 0.000 2.103 6920 K HA -0.073 4.247 4.320 -0.001 0.000 0.204 6920 K C 1.843 178.580 176.600 0.229 0.000 1.052 6920 K CA 1.123 57.474 56.287 0.107 0.000 0.945 6920 K CB -0.258 32.323 32.500 0.135 0.000 0.722 6920 K HN 0.305 nan 8.250 nan 0.000 0.443 6921 L N 1.092 122.422 121.223 0.178 0.000 2.043 6921 L HA -0.206 4.134 4.340 -0.001 0.000 0.212 6921 L C 2.029 179.003 176.870 0.173 0.000 1.075 6921 L CA 1.761 56.706 54.840 0.175 0.000 0.752 6921 L CB -0.305 41.806 42.059 0.085 0.000 0.891 6921 L HN 0.282 nan 8.230 nan 0.000 0.432 6922 M N -1.158 118.507 119.600 0.109 0.000 2.254 6922 M HA -0.119 4.361 4.480 -0.001 0.000 0.265 6922 M C 2.129 178.463 176.300 0.056 0.000 1.066 6922 M CA 1.201 56.545 55.300 0.074 0.000 1.123 6922 M CB -1.036 31.590 32.600 0.043 0.000 1.388 6922 M HN 0.352 nan 8.290 nan 0.000 0.425 6923 E N -0.148 120.068 120.200 0.027 0.000 2.097 6923 E HA -0.199 4.151 4.350 -0.001 0.000 0.196 6923 E C 1.865 178.380 176.600 -0.143 0.000 1.000 6923 E CA 1.398 57.744 56.400 -0.090 0.000 0.804 6923 E CB -0.203 29.388 29.700 -0.182 0.000 0.740 6923 E HN 0.400 nan 8.360 nan 0.000 0.454 6924 F N 0.422 120.378 119.950 0.010 0.000 2.163 6924 F HA -0.068 4.459 4.527 -0.000 0.000 0.297 6924 F C 2.217 178.027 175.800 0.017 0.000 1.094 6924 F CA 0.645 58.652 58.000 0.012 0.000 1.290 6924 F CB -0.178 38.828 39.000 0.010 0.000 1.017 6924 F HN -0.047 nan 8.300 nan 0.000 0.483 6925 I N 0.192 120.885 120.570 0.205 0.000 2.194 6925 I HA -0.321 3.848 4.170 -0.001 0.000 0.246 6925 I C 2.056 178.229 176.117 0.094 0.000 1.093 6925 I CA 1.673 63.047 61.300 0.124 0.000 1.355 6925 I CB -0.459 37.595 38.000 0.089 0.000 1.046 6925 I HN 0.221 nan 8.210 nan 0.000 0.413 6926 E N -0.160 120.081 120.200 0.068 0.000 2.274 6926 E HA -0.242 4.107 4.350 -0.001 0.000 0.194 6926 E C 2.025 178.648 176.600 0.038 0.000 0.996 6926 E CA 0.546 56.975 56.400 0.049 0.000 0.840 6926 E CB 0.020 29.733 29.700 0.022 0.000 0.772 6926 E HN 0.370 nan 8.360 nan 0.000 0.491 6927 Q N 1.153 120.971 119.800 0.030 0.000 2.123 6927 Q HA -0.147 4.192 4.340 -0.001 0.000 0.199 6927 Q C 1.433 177.466 176.000 0.054 0.000 0.966 6927 Q CA 1.332 57.145 55.803 0.017 0.000 0.845 6927 Q CB 0.202 28.931 28.738 -0.015 0.000 0.907 6927 Q HN 0.084 nan 8.270 nan 0.000 0.439 6928 E N 0.172 120.427 120.200 0.091 0.000 2.150 6928 E HA -0.135 4.215 4.350 -0.001 0.000 0.193 6928 E C 1.671 178.340 176.600 0.114 0.000 0.985 6928 E CA 1.143 57.602 56.400 0.097 0.000 0.814 6928 E CB 0.066 29.828 29.700 0.103 0.000 0.752 6928 E HN 0.472 nan 8.360 nan 0.000 0.466 6929 E N 0.428 120.705 120.200 0.128 0.000 2.051 6929 E HA -0.208 4.141 4.350 -0.001 0.000 0.192 6929 E C 1.964 178.622 176.600 0.098 0.000 0.991 6929 E CA 1.049 57.575 56.400 0.210 0.000 0.799 6929 E CB -0.059 29.760 29.700 0.198 0.000 0.748 6929 E HN 0.078 nan 8.360 nan 0.000 0.449 6930 K N 0.834 121.244 120.400 0.017 0.000 2.057 6930 K HA -0.171 4.149 4.320 -0.001 0.000 0.207 6930 K C 2.234 178.789 176.600 -0.075 0.000 1.049 6930 K CA 1.197 57.445 56.287 -0.065 0.000 0.931 6930 K CB -0.063 32.414 32.500 -0.039 0.000 0.714 6930 K HN 0.078 nan 8.250 nan 0.000 0.440 6931 M N 0.767 120.359 119.600 -0.012 0.000 2.067 6931 M HA -0.187 4.292 4.480 -0.001 0.000 0.260 6931 M C 1.878 178.174 176.300 -0.007 0.000 1.069 6931 M CA 1.622 56.921 55.300 -0.001 0.000 1.117 6931 M CB -0.071 32.549 32.600 0.034 0.000 1.334 6931 M HN 0.182 nan 8.290 nan 0.000 0.407 6932 L N -0.009 121.238 121.223 0.041 0.000 2.083 6932 L HA -0.218 4.122 4.340 -0.001 0.000 0.209 6932 L C 2.690 179.547 176.870 -0.022 0.000 1.083 6932 L CA 1.057 55.952 54.840 0.093 0.000 0.752 6932 L CB -0.921 41.289 42.059 0.251 0.000 0.899 6932 L HN 0.379 nan 8.230 nan 0.000 0.433 6933 K N 0.401 120.588 120.400 -0.355 0.000 2.097 6933 K HA -0.208 4.112 4.320 -0.001 0.000 0.206 6933 K C 1.401 177.827 176.600 -0.290 0.000 1.049 6933 K CA 1.733 57.598 56.287 -0.703 0.000 0.933 6933 K CB -0.092 31.849 32.500 -0.933 0.000 0.717 6933 K HN 0.277 nan 8.250 nan 0.000 0.442 6934 D N 0.290 120.586 120.400 -0.173 0.000 2.183 6934 D HA -0.094 4.546 4.640 -0.001 0.000 0.203 6934 D C 1.959 178.223 176.300 -0.060 0.000 0.969 6934 D CA 0.687 54.628 54.000 -0.098 0.000 0.842 6934 D CB 0.051 40.811 40.800 -0.067 0.000 0.957 6934 D HN 0.175 nan 8.370 nan 0.000 0.484 6935 M N 0.212 119.787 119.600 -0.042 0.000 2.132 6935 M HA -0.079 4.400 4.480 -0.001 0.000 0.263 6935 M C 2.251 178.545 176.300 -0.010 0.000 1.065 6935 M CA 0.709 56.002 55.300 -0.011 0.000 1.122 6935 M CB -0.735 31.873 32.600 0.013 0.000 1.365 6935 M HN -0.084 nan 8.290 nan 0.000 0.411 6936 V N 0.298 120.202 119.914 -0.017 0.000 2.453 6936 V HA -0.137 3.983 4.120 -0.001 0.000 0.247 6936 V C 2.668 178.744 176.094 -0.031 0.000 1.048 6936 V CA 1.545 63.840 62.300 -0.009 0.000 1.049 6936 V CB -1.233 30.601 31.823 0.020 0.000 0.672 6936 V HN 0.459 nan 8.190 nan 0.000 0.457 6937 A N -0.016 122.769 122.820 -0.058 0.000 1.972 6937 A HA -0.232 4.087 4.320 -0.001 0.000 0.219 6937 A C 2.168 179.732 177.584 -0.034 0.000 1.169 6937 A CA 1.974 53.978 52.037 -0.054 0.000 0.635 6937 A CB -0.394 18.562 19.000 -0.075 0.000 0.810 6937 A HN 0.550 nan 8.150 nan 0.000 0.446 6938 E N 0.294 120.477 120.200 -0.028 0.000 2.072 6938 E HA -0.088 4.262 4.350 -0.001 0.000 0.190 6938 E C 1.683 178.277 176.600 -0.010 0.000 0.982 6938 E CA 1.197 57.587 56.400 -0.016 0.000 0.803 6938 E CB -0.358 29.334 29.700 -0.012 0.000 0.755 6938 E HN 0.634 nan 8.360 nan 0.000 0.453 6939 I N 0.295 120.860 120.570 -0.008 0.000 2.226 6939 I HA -0.253 3.917 4.170 -0.001 0.000 0.245 6939 I C 2.299 178.411 176.117 -0.007 0.000 1.100 6939 I CA 1.267 62.564 61.300 -0.004 0.000 1.374 6939 I CB -0.250 37.748 38.000 -0.004 0.000 1.057 6939 I HN 0.068 nan 8.210 nan 0.000 0.413 6940 K N 1.579 121.971 120.400 -0.013 0.000 2.097 6940 K HA -0.107 4.213 4.320 -0.001 0.000 0.206 6940 K C 2.035 178.628 176.600 -0.012 0.000 1.049 6940 K CA 1.626 57.905 56.287 -0.014 0.000 0.933 6940 K CB -0.356 32.132 32.500 -0.020 0.000 0.717 6940 K HN 0.276 nan 8.250 nan 0.000 0.442 6941 A N -0.167 122.645 122.820 -0.013 0.000 1.933 6941 A HA -0.119 4.201 4.320 -0.001 0.000 0.218 6941 A C 2.183 179.764 177.584 -0.005 0.000 1.175 6941 A CA 2.063 54.094 52.037 -0.010 0.000 0.628 6941 A CB -0.718 18.274 19.000 -0.012 0.000 0.814 6941 A HN 0.353 nan 8.150 nan 0.000 0.444 6942 S N -1.794 113.905 115.700 -0.003 0.000 2.447 6942 S HA 0.233 4.703 4.470 -0.001 0.000 0.233 6942 S C 1.532 176.134 174.600 0.004 0.000 1.006 6942 S CA 1.255 59.456 58.200 0.002 0.000 0.957 6942 S CB -0.121 63.082 63.200 0.006 0.000 0.773 6942 S HN 1.683 nan 8.310 nan 0.000 0.507 6943 G N 0.581 109.382 108.800 0.001 0.000 2.168 6943 G HA2 -0.072 3.888 3.960 -0.001 0.000 0.197 6943 G HA3 -0.072 3.888 3.960 -0.001 0.000 0.197 6943 G C 0.085 174.987 174.900 0.003 0.000 0.997 6943 G CA -0.178 44.922 45.100 0.002 0.000 0.658 6943 G HN 0.804 nan 8.290 nan 0.000 0.513 6944 A N 0.259 123.081 122.820 0.003 0.000 2.407 6944 A HA 0.639 4.959 4.320 -0.001 0.000 0.248 6944 A C 0.938 178.517 177.584 -0.007 0.000 1.082 6944 A CA 0.940 52.979 52.037 0.003 0.000 0.785 6944 A CB 0.252 19.255 19.000 0.005 0.000 1.020 6944 A HN 1.296 nan 8.150 nan 0.000 0.489 6945 N N -0.633 118.061 118.700 -0.011 0.000 2.036 6945 N HA 0.202 4.941 4.740 -0.001 0.000 0.228 6945 N C -0.958 174.525 175.510 -0.045 0.000 1.368 6945 N CA 0.054 53.090 53.050 -0.024 0.000 0.846 6945 N CB 0.483 38.961 38.487 -0.015 0.000 1.145 6945 N HN 0.268 nan 8.380 nan 0.000 0.502 6946 V N 1.519 121.404 119.914 -0.050 0.000 2.656 6946 V HA 0.561 4.680 4.120 -0.001 0.000 0.307 6946 V C -1.146 174.860 176.094 -0.148 0.000 1.051 6946 V CA -0.770 61.457 62.300 -0.122 0.000 0.893 6946 V CB 2.402 34.197 31.823 -0.047 0.000 0.999 6946 V HN 0.230 nan 8.190 nan 0.000 0.426 6947 L N 5.462 126.498 121.223 -0.312 0.000 2.441 6947 L HA 0.615 4.954 4.340 -0.001 0.000 0.270 6947 L C -1.926 174.708 176.870 -0.394 0.000 0.973 6947 L CA -0.104 54.604 54.840 -0.220 0.000 0.842 6947 L CB 1.599 43.589 42.059 -0.115 0.000 1.239 6947 L HN 0.598 nan 8.230 nan 0.000 0.406 6948 F N 4.391 124.345 119.950 0.006 0.000 2.402 6948 F HA 0.360 4.887 4.527 -0.001 0.000 0.355 6948 F C 0.397 176.200 175.800 0.005 0.000 1.123 6948 F CA -0.479 57.523 58.000 0.004 0.000 1.021 6948 F CB 1.492 40.491 39.000 -0.001 0.000 1.160 6948 F HN 0.437 nan 8.300 nan 0.000 0.451 6949 C N 5.191 124.578 119.300 0.145 0.000 2.281 6949 C HA 0.221 4.680 4.460 -0.001 0.000 0.325 6949 C C 1.625 176.667 174.990 0.088 0.000 1.282 6949 C CA -0.473 58.599 59.018 0.091 0.000 1.640 6949 C CB 0.649 28.419 27.740 0.050 0.000 2.288 6949 C HN 0.960 nan 8.230 nan 0.000 0.507 6950 Q N 3.528 123.370 119.800 0.070 0.000 2.170 6950 Q HA -0.063 4.277 4.340 -0.001 0.000 0.203 6950 Q C 0.751 176.774 176.000 0.038 0.000 0.976 6950 Q CA 1.631 57.464 55.803 0.049 0.000 0.858 6950 Q CB 0.188 28.946 28.738 0.034 0.000 0.907 6950 Q HN 0.761 nan 8.270 nan 0.000 0.433 6951 K N -1.160 119.261 120.400 0.036 0.000 2.632 6951 K HA 0.446 4.765 4.320 -0.001 0.000 0.267 6951 K C 0.319 176.937 176.600 0.030 0.000 1.028 6951 K CA -0.202 56.102 56.287 0.028 0.000 1.045 6951 K CB 0.190 32.704 32.500 0.024 0.000 1.400 6951 K HN 0.112 nan 8.250 nan 0.000 0.522 6952 G N 0.261 109.076 108.800 0.024 0.000 2.599 6952 G HA2 0.436 4.395 3.960 -0.001 0.000 0.264 6952 G HA3 0.436 4.395 3.960 -0.001 0.000 0.264 6952 G C -0.528 174.386 174.900 0.023 0.000 1.200 6952 G CA -0.527 44.586 45.100 0.022 0.000 0.896 6952 G HN 0.367 nan 8.290 nan 0.000 0.536 6953 I N 0.243 120.826 120.570 0.021 0.000 2.499 6953 I HA 0.169 4.339 4.170 -0.001 0.000 0.288 6953 I C -0.495 175.636 176.117 0.022 0.000 1.048 6953 I CA -0.789 60.525 61.300 0.023 0.000 1.062 6953 I CB 2.158 40.168 38.000 0.017 0.000 1.238 6953 I HN 0.429 nan 8.210 nan 0.000 0.426 6954 D N 5.314 125.732 120.400 0.031 0.000 2.443 6954 D HA -0.074 4.566 4.640 -0.001 0.000 0.239 6954 D C 0.756 177.067 176.300 0.018 0.000 1.136 6954 D CA 0.062 54.079 54.000 0.028 0.000 0.879 6954 D CB 1.330 42.156 40.800 0.043 0.000 1.195 6954 D HN 0.639 nan 8.370 nan 0.000 0.443 6955 D N 3.566 123.967 120.400 0.002 0.000 2.158 6955 D HA -0.257 4.383 4.640 -0.001 0.000 0.197 6955 D C 1.955 178.234 176.300 -0.036 0.000 0.995 6955 D CA 0.777 54.768 54.000 -0.015 0.000 0.846 6955 D CB -0.372 40.413 40.800 -0.024 0.000 0.941 6955 D HN 0.362 nan 8.370 nan 0.000 0.456 6956 L N 0.561 121.755 121.223 -0.048 0.000 2.072 6956 L HA 0.147 4.487 4.340 -0.001 0.000 0.205 6956 L C 2.378 179.162 176.870 -0.144 0.000 1.079 6956 L CA 1.861 56.620 54.840 -0.135 0.000 0.752 6956 L CB -0.991 41.017 42.059 -0.084 0.000 0.906 6956 L HN 0.103 nan 8.230 nan 0.000 0.436 6957 A N -1.130 121.719 122.820 0.048 0.000 1.972 6957 A HA -0.244 4.076 4.320 -0.001 0.000 0.219 6957 A C 2.165 179.805 177.584 0.093 0.000 1.169 6957 A CA 1.730 53.867 52.037 0.166 0.000 0.635 6957 A CB -0.520 18.561 19.000 0.136 0.000 0.810 6957 A HN 0.667 nan 8.150 nan 0.000 0.446 6958 Q N -1.651 118.169 119.800 0.035 0.000 2.124 6958 Q HA -0.217 4.123 4.340 -0.001 0.000 0.202 6958 Q C 2.046 178.056 176.000 0.016 0.000 0.977 6958 Q CA 1.684 57.499 55.803 0.020 0.000 0.850 6958 Q CB -0.318 28.426 28.738 0.011 0.000 0.901 6958 Q HN 0.933 nan 8.270 nan 0.000 0.429 6959 H N -0.392 118.609 119.070 -0.115 0.000 2.353 6959 H HA -0.172 4.383 4.556 -0.001 0.000 0.300 6959 H C 1.357 176.633 175.328 -0.087 0.000 1.090 6959 H CA 1.715 57.672 56.048 -0.151 0.000 1.327 6959 H CB -0.079 29.518 29.762 -0.275 0.000 1.383 6959 H HN 0.224 nan 8.280 nan 0.000 0.508 6960 Y N 0.177 120.454 120.300 -0.039 0.000 2.224 6960 Y HA -0.133 4.417 4.550 -0.001 0.000 0.289 6960 Y C 2.565 178.402 175.900 -0.104 0.000 1.146 6960 Y CA 1.037 59.084 58.100 -0.089 0.000 1.182 6960 Y CB -0.642 37.815 38.460 -0.004 0.000 0.983 6960 Y HN 0.219 nan 8.280 nan 0.000 0.524 6961 L N -1.038 120.232 121.223 0.079 0.000 2.046 6961 L HA -0.225 4.115 4.340 -0.001 0.000 0.208 6961 L C 2.641 179.490 176.870 -0.035 0.000 1.077 6961 L CA 1.237 56.085 54.840 0.014 0.000 0.747 6961 L CB -0.830 41.231 42.059 0.003 0.000 0.896 6961 L HN 0.183 nan 8.230 nan 0.000 0.432 6962 A N -0.122 122.656 122.820 -0.069 0.000 1.930 6962 A HA -0.245 4.074 4.320 -0.001 0.000 0.217 6962 A C 2.368 179.880 177.584 -0.119 0.000 1.175 6962 A CA 1.820 53.802 52.037 -0.092 0.000 0.627 6962 A CB -0.424 18.518 19.000 -0.096 0.000 0.815 6962 A HN 0.327 nan 8.150 nan 0.000 0.443 6963 K N -0.424 119.868 120.400 -0.180 0.000 2.147 6963 K HA -0.142 4.177 4.320 -0.001 0.000 0.205 6963 K C 1.031 177.595 176.600 -0.059 0.000 1.049 6963 K CA 1.485 57.686 56.287 -0.143 0.000 0.936 6963 K CB 0.005 32.420 32.500 -0.140 0.000 0.722 6963 K HN 0.335 nan 8.250 nan 0.000 0.446 6964 E N -0.718 119.458 120.200 -0.039 0.000 2.479 6964 E HA 0.058 4.408 4.350 -0.001 0.000 0.193 6964 E C 0.687 177.270 176.600 -0.028 0.000 1.049 6964 E CA 0.665 57.049 56.400 -0.026 0.000 0.870 6964 E CB 0.828 30.517 29.700 -0.018 0.000 0.944 6964 E HN 0.538 nan 8.360 nan 0.000 0.492 6965 G N 1.926 110.705 108.800 -0.036 0.000 2.160 6965 G HA2 -0.286 3.673 3.960 -0.001 0.000 0.244 6965 G HA3 -0.286 3.673 3.960 -0.001 0.000 0.244 6965 G C 0.228 175.108 174.900 -0.034 0.000 1.022 6965 G CA 0.100 45.181 45.100 -0.032 0.000 0.741 6965 G HN 0.271 nan 8.290 nan 0.000 0.508 6966 I N 1.134 121.680 120.570 -0.040 0.000 2.325 6966 I HA 0.403 4.573 4.170 -0.001 0.000 0.291 6966 I C 1.073 177.150 176.117 -0.066 0.000 1.019 6966 I CA -1.054 60.216 61.300 -0.049 0.000 1.302 6966 I CB 1.492 39.466 38.000 -0.043 0.000 1.401 6966 I HN 0.153 nan 8.210 nan 0.000 0.485 6967 V N 3.908 123.771 119.914 -0.085 0.000 2.546 6967 V HA 0.905 5.025 4.120 -0.001 0.000 0.284 6967 V C 0.094 176.071 176.094 -0.195 0.000 1.050 6967 V CA -0.253 61.979 62.300 -0.112 0.000 0.981 6967 V CB 1.101 32.865 31.823 -0.098 0.000 0.990 6967 V HN 0.834 nan 8.190 nan 0.000 0.474 6968 A N 3.533 126.238 122.820 -0.191 0.000 2.549 6968 A HA 1.015 5.335 4.320 -0.001 0.000 0.297 6968 A C -0.399 177.067 177.584 -0.196 0.000 1.061 6968 A CA -0.288 51.606 52.037 -0.238 0.000 0.690 6968 A CB 1.819 20.739 19.000 -0.133 0.000 1.287 6968 A HN 2.381 nan 8.150 nan 0.000 0.402 6969 A N 1.388 124.075 122.820 -0.220 0.000 2.449 6969 A HA 0.847 5.167 4.320 -0.001 0.000 0.302 6969 A C -0.302 177.296 177.584 0.022 0.000 1.048 6969 A CA -0.607 51.399 52.037 -0.053 0.000 0.708 6969 A CB 1.156 20.183 19.000 0.045 0.000 1.274 6969 A HN 1.404 nan 8.150 nan 0.000 0.410 6970 R N 1.388 121.910 120.500 0.037 0.000 2.832 6970 R HA 0.795 5.134 4.340 -0.001 0.000 0.271 6970 R C -0.470 175.861 176.300 0.052 0.000 0.996 6970 R CA -0.767 55.359 56.100 0.044 0.000 0.977 6970 R CB 0.800 31.115 30.300 0.025 0.000 1.168 6970 R HN 0.577 nan 8.270 nan 0.000 0.482 6971 R N -0.137 120.392 120.500 0.048 0.000 3.532 6971 R HA -0.097 4.243 4.340 -0.001 0.000 0.284 6971 R C -0.772 175.554 176.300 0.043 0.000 1.140 6971 R CA 0.603 56.726 56.100 0.038 0.000 0.768 6971 R CB -2.350 27.966 30.300 0.027 0.000 1.252 6971 R HN 0.548 nan 8.270 nan 0.000 0.454 6972 V N 1.496 121.448 119.914 0.064 0.000 2.572 6972 V HA 0.062 4.182 4.120 -0.001 0.000 0.291 6972 V C 1.426 177.531 176.094 0.018 0.000 1.039 6972 V CA -0.111 62.223 62.300 0.057 0.000 1.055 6972 V CB 1.332 33.215 31.823 0.101 0.000 0.969 6972 V HN 0.137 nan 8.190 nan 0.000 0.482 6973 K N 4.154 124.551 120.400 -0.004 0.000 2.448 6973 K HA 0.029 4.349 4.320 -0.001 0.000 0.278 6973 K C 1.388 177.974 176.600 -0.022 0.000 1.009 6973 K CA -0.243 56.036 56.287 -0.014 0.000 0.995 6973 K CB 0.356 32.841 32.500 -0.025 0.000 0.917 6973 K HN 0.609 nan 8.250 nan 0.000 0.481 6974 K N 2.139 122.530 120.400 -0.014 0.000 2.074 6974 K HA -0.197 4.123 4.320 -0.001 0.000 0.209 6974 K C 1.766 178.349 176.600 -0.028 0.000 1.048 6974 K CA 1.957 58.234 56.287 -0.016 0.000 0.926 6974 K CB -0.229 32.265 32.500 -0.009 0.000 0.713 6974 K HN 0.683 nan 8.250 nan 0.000 0.444 6975 S N 1.037 116.718 115.700 -0.031 0.000 2.370 6975 S HA -0.163 4.307 4.470 -0.001 0.000 0.226 6975 S C 1.377 175.941 174.600 -0.061 0.000 1.033 6975 S CA 1.793 59.969 58.200 -0.040 0.000 1.011 6975 S CB -0.216 62.963 63.200 -0.036 0.000 0.852 6975 S HN 0.303 nan 8.310 nan 0.000 0.457 6976 D N 0.837 121.192 120.400 -0.076 0.000 2.144 6976 D HA -0.044 4.596 4.640 -0.001 0.000 0.199 6976 D C 2.000 178.207 176.300 -0.155 0.000 0.984 6976 D CA 0.922 54.849 54.000 -0.123 0.000 0.834 6976 D CB -0.252 40.471 40.800 -0.130 0.000 0.955 6976 D HN 0.384 nan 8.370 nan 0.000 0.465 6977 M N 0.451 119.987 119.600 -0.107 0.000 2.175 6977 M HA -0.081 4.398 4.480 -0.001 0.000 0.264 6977 M C 1.901 178.155 176.300 -0.077 0.000 1.063 6977 M CA 1.192 56.437 55.300 -0.091 0.000 1.119 6977 M CB -0.775 31.805 32.600 -0.033 0.000 1.377 6977 M HN 0.111 nan 8.290 nan 0.000 0.415 6978 E N 0.088 120.252 120.200 -0.061 0.000 2.072 6978 E HA -0.135 4.215 4.350 -0.001 0.000 0.190 6978 E C 2.061 178.628 176.600 -0.056 0.000 0.982 6978 E CA 0.836 57.209 56.400 -0.046 0.000 0.803 6978 E CB -0.006 29.673 29.700 -0.034 0.000 0.755 6978 E HN 0.500 nan 8.360 nan 0.000 0.453 6979 K N 0.649 121.004 120.400 -0.075 0.000 2.097 6979 K HA -0.096 4.223 4.320 -0.001 0.000 0.206 6979 K C 2.200 178.745 176.600 -0.091 0.000 1.049 6979 K CA 0.809 57.050 56.287 -0.077 0.000 0.933 6979 K CB -0.088 32.358 32.500 -0.090 0.000 0.717 6979 K HN 0.110 nan 8.250 nan 0.000 0.442 6980 L N 0.506 121.649 121.223 -0.135 0.000 2.083 6980 L HA -0.182 4.157 4.340 -0.001 0.000 0.209 6980 L C 2.585 179.412 176.870 -0.072 0.000 1.083 6980 L CA 1.084 55.835 54.840 -0.149 0.000 0.752 6980 L CB -0.548 41.347 42.059 -0.274 0.000 0.899 6980 L HN 0.198 nan 8.230 nan 0.000 0.433 6981 A N -0.269 122.520 122.820 -0.052 0.000 1.898 6981 A HA -0.166 4.153 4.320 -0.001 0.000 0.216 6981 A C 2.340 179.917 177.584 -0.012 0.000 1.181 6981 A CA 1.320 53.346 52.037 -0.020 0.000 0.620 6981 A CB -0.241 18.750 19.000 -0.015 0.000 0.819 6981 A HN 0.187 nan 8.150 nan 0.000 0.442 6982 K N -0.008 120.380 120.400 -0.020 0.000 2.002 6982 K HA -0.063 4.256 4.320 -0.001 0.000 0.209 6982 K C 2.342 178.941 176.600 -0.002 0.000 1.048 6982 K CA 1.442 57.723 56.287 -0.011 0.000 0.930 6982 K CB -0.876 31.615 32.500 -0.016 0.000 0.714 6982 K HN 0.435 nan 8.250 nan 0.000 0.438 6983 A N 1.270 124.083 122.820 -0.011 0.000 1.841 6983 A HA -0.146 4.173 4.320 -0.001 0.000 0.214 6983 A C 2.380 179.972 177.584 0.014 0.000 1.195 6983 A CA 2.728 54.764 52.037 -0.001 0.000 0.611 6983 A CB -1.075 17.915 19.000 -0.016 0.000 0.835 6983 A HN 0.517 nan 8.150 nan 0.000 0.443 6984 T N -4.476 110.083 114.554 0.010 0.000 3.043 6984 T HA 0.368 4.718 4.350 -0.001 0.000 0.263 6984 T C 1.490 176.209 174.700 0.032 0.000 1.094 6984 T CA 1.252 63.367 62.100 0.025 0.000 1.127 6984 T CB -0.068 68.819 68.868 0.032 0.000 0.905 6984 T HN 1.833 nan 8.240 nan 0.000 0.490 6985 G N 1.465 110.280 108.800 0.025 0.000 2.143 6985 G HA2 -0.022 3.938 3.960 -0.001 0.000 0.249 6985 G HA3 -0.022 3.938 3.960 -0.001 0.000 0.249 6985 G C 0.280 175.195 174.900 0.025 0.000 0.981 6985 G CA -0.004 45.111 45.100 0.026 0.000 0.665 6985 G HN 1.184 nan 8.290 nan 0.000 0.528 6986 A N -0.283 122.553 122.820 0.027 0.000 2.445 6986 A HA 0.560 4.880 4.320 -0.001 0.000 0.242 6986 A C 0.428 178.028 177.584 0.026 0.000 1.075 6986 A CA 0.674 52.732 52.037 0.035 0.000 0.777 6986 A CB 0.390 19.422 19.000 0.052 0.000 1.013 6986 A HN 0.885 nan 8.150 nan 0.000 0.493 6987 N N 1.490 120.207 118.700 0.030 0.000 2.417 6987 N HA 0.375 5.114 4.740 -0.001 0.000 0.274 6987 N C -1.009 174.517 175.510 0.027 0.000 0.987 6987 N CA -0.421 52.643 53.050 0.023 0.000 0.912 6987 N CB 1.376 39.875 38.487 0.020 0.000 1.177 6987 N HN 0.283 nan 8.380 nan 0.000 0.490 6988 V N 4.816 124.743 119.914 0.022 0.000 2.485 6988 V HA 0.177 4.296 4.120 -0.001 0.000 0.287 6988 V C 0.335 176.442 176.094 0.022 0.000 1.022 6988 V CA -0.070 62.244 62.300 0.025 0.000 1.067 6988 V CB -0.116 31.716 31.823 0.016 0.000 0.967 6988 V HN 0.516 nan 8.190 nan 0.000 0.479 6989 I N 4.130 124.716 120.570 0.027 0.000 2.404 6989 I HA 0.422 4.592 4.170 -0.001 0.000 0.293 6989 I C 1.026 177.156 176.117 0.022 0.000 0.992 6989 I CA -0.368 60.945 61.300 0.022 0.000 1.149 6989 I CB 1.405 39.418 38.000 0.022 0.000 1.315 6989 I HN 0.626 nan 8.210 nan 0.000 0.446 6990 A N 5.383 128.214 122.820 0.017 0.000 1.872 6990 A HA 0.313 4.632 4.320 -0.001 0.000 0.214 6990 A C 1.112 178.706 177.584 0.017 0.000 1.187 6990 A CA 1.116 53.163 52.037 0.016 0.000 0.614 6990 A CB -0.038 18.970 19.000 0.013 0.000 0.826 6990 A HN 0.734 nan 8.150 nan 0.000 0.442 6991 A N -0.903 121.926 122.820 0.015 0.000 2.317 6991 A HA 0.654 4.973 4.320 -0.001 0.000 0.327 6991 A C 0.769 178.362 177.584 0.015 0.000 1.178 6991 A CA -0.600 51.446 52.037 0.015 0.000 0.817 6991 A CB 0.420 19.427 19.000 0.012 0.000 1.189 6991 A HN 0.306 nan 8.150 nan 0.000 0.489 6992 I N 1.902 122.481 120.570 0.015 0.000 2.264 6992 I HA -0.312 3.858 4.170 -0.001 0.000 0.248 6992 I C 2.754 178.877 176.117 0.010 0.000 1.111 6992 I CA 1.799 63.107 61.300 0.014 0.000 1.382 6992 I CB -0.207 37.801 38.000 0.014 0.000 1.060 6992 I HN 0.760 nan 8.210 nan 0.000 0.418 6993 A N 0.658 123.483 122.820 0.009 0.000 1.972 6993 A HA -0.129 4.191 4.320 -0.001 0.000 0.219 6993 A C 2.421 180.009 177.584 0.006 0.000 1.169 6993 A CA 1.723 53.764 52.037 0.006 0.000 0.635 6993 A CB -0.657 18.347 19.000 0.006 0.000 0.810 6993 A HN 0.448 nan 8.150 nan 0.000 0.446 6994 A N -0.702 122.124 122.820 0.009 0.000 2.206 6994 A HA 0.341 4.661 4.320 -0.001 0.000 0.211 6994 A C 0.915 178.505 177.584 0.010 0.000 1.158 6994 A CA -0.125 51.917 52.037 0.009 0.000 0.761 6994 A CB -0.494 18.512 19.000 0.010 0.000 0.801 6994 A HN 0.456 nan 8.150 nan 0.000 0.473 6995 L N 1.525 122.754 121.223 0.010 0.000 2.490 6995 L HA 0.193 4.533 4.340 -0.001 0.000 0.274 6995 L C 0.719 177.595 176.870 0.009 0.000 1.201 6995 L CA 0.168 55.015 54.840 0.011 0.000 0.869 6995 L CB 0.560 42.626 42.059 0.011 0.000 1.123 6995 L HN 0.470 nan 8.230 nan 0.000 0.484 6996 S N 1.314 117.020 115.700 0.010 0.000 2.651 6996 S HA 0.611 5.081 4.470 -0.001 0.000 0.279 6996 S C 0.438 175.044 174.600 0.011 0.000 1.148 6996 S CA -0.283 57.922 58.200 0.009 0.000 0.837 6996 S CB 1.651 64.856 63.200 0.008 0.000 1.138 6996 S HN 0.598 nan 8.310 nan 0.000 0.478 6997 A N 0.593 123.419 122.820 0.009 0.000 1.978 6997 A HA -0.068 4.252 4.320 -0.001 0.000 0.220 6997 A C 1.947 179.540 177.584 0.014 0.000 1.170 6997 A CA 1.335 53.379 52.037 0.011 0.000 0.636 6997 A CB -0.845 18.160 19.000 0.009 0.000 0.810 6997 A HN 0.731 nan 8.150 nan 0.000 0.448 6998 Q N 0.119 119.927 119.800 0.013 0.000 2.436 6998 Q HA -0.091 4.249 4.340 -0.001 0.000 0.209 6998 Q C 0.390 176.400 176.000 0.017 0.000 0.965 6998 Q CA 0.939 56.750 55.803 0.014 0.000 0.910 6998 Q CB -0.190 28.555 28.738 0.011 0.000 0.980 6998 Q HN 0.658 nan 8.270 nan 0.000 0.491 6999 D N -0.182 120.229 120.400 0.018 0.000 2.339 6999 D HA 0.083 4.723 4.640 -0.001 0.000 0.217 6999 D C 0.407 176.724 176.300 0.028 0.000 1.050 6999 D CA 0.104 54.117 54.000 0.022 0.000 0.856 6999 D CB 0.606 41.418 40.800 0.021 0.000 0.922 6999 D HN 0.197 nan 8.370 nan 0.000 0.518 7000 L N 0.777 122.017 121.223 0.028 0.000 2.371 7000 L HA 0.430 4.769 4.340 -0.001 0.000 0.272 7000 L C 1.121 178.013 176.870 0.036 0.000 1.124 7000 L CA -0.529 54.331 54.840 0.034 0.000 0.816 7000 L CB 1.392 43.468 42.059 0.029 0.000 1.129 7000 L HN -0.137 nan 8.230 nan 0.000 0.448 7001 G N 1.120 109.947 108.800 0.045 0.000 2.471 7001 G HA2 0.481 4.440 3.960 -0.001 0.000 0.332 7001 G HA3 0.481 4.440 3.960 -0.001 0.000 0.332 7001 G C -1.248 173.680 174.900 0.046 0.000 1.176 7001 G CA -0.459 44.667 45.100 0.044 0.000 0.949 7001 G HN 0.520 nan 8.290 nan 0.000 0.488 7002 D N -0.178 120.246 120.400 0.040 0.000 2.248 7002 D HA 0.621 5.260 4.640 -0.001 0.000 0.246 7002 D C -0.286 176.034 176.300 0.033 0.000 1.027 7002 D CA 0.042 54.063 54.000 0.034 0.000 0.853 7002 D CB 2.137 42.952 40.800 0.026 0.000 1.243 7002 D HN 0.580 nan 8.370 nan 0.000 0.462 7003 A N 0.426 123.267 122.820 0.035 0.000 2.486 7003 A HA 0.628 4.948 4.320 -0.001 0.000 0.300 7003 A C 0.928 178.528 177.584 0.026 0.000 1.048 7003 A CA -0.419 51.639 52.037 0.035 0.000 0.696 7003 A CB 1.718 20.755 19.000 0.062 0.000 1.278 7003 A HN 0.500 nan 8.150 nan 0.000 0.405 7004 G N 0.223 109.033 108.800 0.016 0.000 2.404 7004 G HA2 0.290 4.250 3.960 -0.001 0.000 0.215 7004 G HA3 0.290 4.250 3.960 -0.001 0.000 0.215 7004 G C 0.306 175.218 174.900 0.021 0.000 1.174 7004 G CA 1.682 46.788 45.100 0.009 0.000 0.780 7004 G HN 1.159 nan 8.290 nan 0.000 0.537 7005 L N -0.048 121.196 121.223 0.036 0.000 2.493 7005 L HA 0.647 4.987 4.340 -0.001 0.000 0.265 7005 L C -1.354 175.564 176.870 0.079 0.000 0.954 7005 L CA -0.807 54.060 54.840 0.046 0.000 0.844 7005 L CB 2.578 44.657 42.059 0.033 0.000 1.302 7005 L HN -0.120 nan 8.230 nan 0.000 0.405 7006 V N 4.428 124.393 119.914 0.084 0.000 2.376 7006 V HA 0.638 4.758 4.120 -0.001 0.000 0.287 7006 V C -0.538 175.620 176.094 0.106 0.000 1.015 7006 V CA -0.441 61.932 62.300 0.122 0.000 0.834 7006 V CB 1.420 33.320 31.823 0.128 0.000 1.001 7006 V HN 0.829 nan 8.190 nan 0.000 0.428 7007 E N 3.154 123.442 120.200 0.145 0.000 2.308 7007 E HA 0.388 4.738 4.350 -0.001 0.000 0.275 7007 E C -1.019 175.687 176.600 0.177 0.000 0.890 7007 E CA -0.655 55.816 56.400 0.119 0.000 0.754 7007 E CB 2.193 31.937 29.700 0.073 0.000 1.207 7007 E HN 0.751 nan 8.360 nan 0.000 0.426 7008 E N 4.329 124.603 120.200 0.123 0.000 2.152 7008 E HA 0.237 4.586 4.350 -0.001 0.000 0.285 7008 E C -0.907 175.769 176.600 0.127 0.000 1.043 7008 E CA -0.205 56.274 56.400 0.133 0.000 0.839 7008 E CB 0.678 30.424 29.700 0.078 0.000 1.069 7008 E HN 0.351 nan 8.360 nan 0.000 0.399 7009 R N 3.702 124.322 120.500 0.199 0.000 2.686 7009 R HA 0.396 4.735 4.340 -0.001 0.000 0.283 7009 R C -0.819 175.578 176.300 0.162 0.000 0.978 7009 R CA -0.908 55.281 56.100 0.148 0.000 0.897 7009 R CB 2.021 32.381 30.300 0.101 0.000 1.192 7009 R HN 0.333 nan 8.270 nan 0.000 0.457 7010 K N 2.685 123.141 120.400 0.094 0.000 2.367 7010 K HA 0.406 4.725 4.320 -0.001 0.000 0.263 7010 K C -0.884 175.759 176.600 0.072 0.000 1.000 7010 K CA -0.489 55.846 56.287 0.080 0.000 0.891 7010 K CB 1.213 33.742 32.500 0.049 0.000 1.117 7010 K HN 0.290 nan 8.250 nan 0.000 0.443 7011 I N 1.688 122.313 120.570 0.092 0.000 2.382 7011 I HA 0.083 4.253 4.170 -0.001 0.000 0.286 7011 I C 0.574 176.723 176.117 0.054 0.000 1.002 7011 I CA -0.053 61.292 61.300 0.076 0.000 1.135 7011 I CB 1.907 39.978 38.000 0.118 0.000 1.288 7011 I HN 0.666 nan 8.210 nan 0.000 0.448 7012 S N 4.434 120.155 115.700 0.036 0.000 3.672 7012 S HA -0.181 4.289 4.470 -0.001 0.000 0.319 7012 S C 1.264 175.877 174.600 0.022 0.000 1.151 7012 S CA 1.369 59.583 58.200 0.025 0.000 0.911 7012 S CB -1.249 61.965 63.200 0.023 0.000 0.939 7012 S HN 1.697 nan 8.310 nan 0.000 0.524 7013 G N -0.018 108.796 108.800 0.024 0.000 2.383 7013 G HA2 -0.261 3.699 3.960 -0.001 0.000 0.229 7013 G HA3 -0.261 3.699 3.960 -0.001 0.000 0.229 7013 G C -0.294 174.622 174.900 0.026 0.000 1.089 7013 G CA 0.292 45.404 45.100 0.021 0.000 0.640 7013 G HN 0.688 nan 8.290 nan 0.000 0.510 7014 D N 1.266 121.683 120.400 0.029 0.000 2.345 7014 D HA 0.471 5.110 4.640 -0.001 0.000 0.247 7014 D C 0.446 176.773 176.300 0.045 0.000 1.108 7014 D CA 0.645 54.663 54.000 0.029 0.000 0.894 7014 D CB 1.573 42.386 40.800 0.021 0.000 1.203 7014 D HN 0.258 nan 8.370 nan 0.000 0.430 7015 S N 2.047 117.772 115.700 0.041 0.000 2.523 7015 S HA 0.481 4.951 4.470 -0.001 0.000 0.275 7015 S C -0.131 174.499 174.600 0.050 0.000 1.281 7015 S CA -0.728 57.505 58.200 0.056 0.000 1.050 7015 S CB 0.047 63.274 63.200 0.046 0.000 0.937 7015 S HN 0.405 nan 8.310 nan 0.000 0.492 7016 M N 4.537 124.183 119.600 0.078 0.000 2.421 7016 M HA 0.524 5.003 4.480 -0.001 0.000 0.287 7016 M C -1.867 174.471 176.300 0.064 0.000 1.183 7016 M CA -0.642 54.666 55.300 0.013 0.000 0.916 7016 M CB 1.086 33.638 32.600 -0.079 0.000 1.701 7016 M HN 0.419 nan 8.290 nan 0.000 0.470 7017 I N 2.921 123.495 120.570 0.006 0.000 2.336 7017 I HA 0.421 4.591 4.170 -0.001 0.000 0.292 7017 I C -1.169 174.928 176.117 -0.033 0.000 0.991 7017 I CA -0.392 60.974 61.300 0.110 0.000 1.227 7017 I CB 1.111 39.230 38.000 0.199 0.000 1.366 7017 I HN 0.503 nan 8.210 nan 0.000 0.466 7018 F N 5.830 125.817 119.950 0.063 0.000 2.391 7018 F HA 0.351 4.878 4.527 -0.001 0.000 0.359 7018 F C 0.138 175.971 175.800 0.056 0.000 1.122 7018 F CA -0.648 57.378 58.000 0.042 0.000 1.120 7018 F CB 1.288 40.304 39.000 0.027 0.000 1.142 7018 F HN 0.031 nan 8.300 nan 0.000 0.483 7019 V N 4.383 124.389 119.914 0.152 0.000 2.293 7019 V HA 0.352 4.472 4.120 -0.001 0.000 0.275 7019 V C -0.306 175.846 176.094 0.098 0.000 1.021 7019 V CA -0.558 61.813 62.300 0.118 0.000 0.815 7019 V CB 0.483 32.345 31.823 0.066 0.000 1.025 7019 V HN 0.824 nan 8.190 nan 0.000 0.448 7020 E N 3.045 123.309 120.200 0.106 0.000 2.433 7020 E HA 0.644 4.993 4.350 -0.001 0.000 0.273 7020 E C -0.691 175.938 176.600 0.048 0.000 0.950 7020 E CA -0.872 55.578 56.400 0.083 0.000 0.796 7020 E CB 1.617 31.383 29.700 0.110 0.000 1.330 7020 E HN 0.193 nan 8.360 nan 0.000 0.455 7021 E N -0.957 119.260 120.200 0.028 0.000 2.513 7021 E HA -0.161 4.188 4.350 -0.001 0.000 0.257 7021 E C -0.490 176.104 176.600 -0.010 0.000 1.098 7021 E CA 0.677 57.080 56.400 0.005 0.000 0.752 7021 E CB -2.478 27.224 29.700 0.004 0.000 1.324 7021 E HN 0.593 nan 8.360 nan 0.000 0.403 7022 C N 0.470 119.766 119.300 -0.007 0.000 2.705 7022 C HA 0.071 4.531 4.460 -0.001 0.000 0.382 7022 C C 2.362 177.308 174.990 -0.073 0.000 1.322 7022 C CA -0.066 58.941 59.018 -0.018 0.000 2.290 7022 C CB 0.423 28.164 27.740 0.002 0.000 2.650 7022 C HN 0.408 nan 8.230 nan 0.000 0.695 7023 K N 0.300 120.638 120.400 -0.103 0.000 1.969 7023 K HA -0.106 4.214 4.320 -0.001 0.000 0.216 7023 K C 0.416 176.717 176.600 -0.497 0.000 1.048 7023 K CA 1.468 57.590 56.287 -0.275 0.000 0.948 7023 K CB -0.113 32.276 32.500 -0.184 0.000 0.726 7023 K HN 0.670 nan 8.250 nan 0.000 0.442 7024 H N 0.249 119.325 119.070 0.010 0.000 2.448 7024 H HA 0.225 4.781 4.556 -0.001 0.000 0.237 7024 H C -2.505 172.826 175.328 0.006 0.000 1.391 7024 H CA -2.014 54.038 56.048 0.007 0.000 1.477 7024 H CB 0.613 30.379 29.762 0.006 0.000 1.520 7024 H HN 0.189 nan 8.280 nan 0.000 0.502 7025 P HA 0.069 nan 4.420 nan 0.000 0.271 7025 P C 0.681 178.010 177.300 0.047 0.000 1.226 7025 P CA -0.406 62.721 63.100 0.045 0.000 0.765 7025 P CB 1.674 33.388 31.700 0.023 0.000 0.835 7026 K N 0.936 121.357 120.400 0.034 0.000 2.358 7026 K HA 0.376 4.695 4.320 -0.001 0.000 0.197 7026 K C 0.597 177.203 176.600 0.010 0.000 1.025 7026 K CA 0.003 56.304 56.287 0.023 0.000 1.104 7026 K CB 0.740 33.251 32.500 0.019 0.000 0.855 7026 K HN 0.551 nan 8.250 nan 0.000 0.531 7027 A N 0.898 123.721 122.820 0.005 0.000 2.486 7027 A HA 0.620 4.940 4.320 -0.001 0.000 0.300 7027 A C -0.558 177.023 177.584 -0.005 0.000 1.048 7027 A CA -0.714 51.319 52.037 -0.006 0.000 0.696 7027 A CB 1.515 20.504 19.000 -0.019 0.000 1.278 7027 A HN -0.063 nan 8.150 nan 0.000 0.405 7028 V N -1.215 118.695 119.914 -0.006 0.000 3.102 7028 V HA 0.979 5.099 4.120 -0.001 0.000 0.312 7028 V C -0.433 175.654 176.094 -0.011 0.000 1.135 7028 V CA -0.622 61.678 62.300 -0.002 0.000 1.022 7028 V CB 1.640 33.468 31.823 0.008 0.000 1.056 7028 V HN 0.900 nan 8.190 nan 0.000 0.436 7029 T N 3.332 117.883 114.554 -0.005 0.000 2.886 7029 T HA 0.580 4.930 4.350 -0.001 0.000 0.292 7029 T C -0.632 174.072 174.700 0.006 0.000 1.012 7029 T CA -0.259 61.831 62.100 -0.017 0.000 0.982 7029 T CB 1.515 70.353 68.868 -0.051 0.000 1.018 7029 T HN 0.982 nan 8.240 nan 0.000 0.451 7030 M N 4.256 123.857 119.600 0.001 0.000 2.066 7030 M HA 0.541 5.020 4.480 -0.001 0.000 0.340 7030 M C -1.502 174.806 176.300 0.014 0.000 1.053 7030 M CA -1.102 54.206 55.300 0.015 0.000 0.983 7030 M CB 0.572 33.178 32.600 0.010 0.000 1.520 7030 M HN 0.476 nan 8.290 nan 0.000 0.428 7031 L N 7.579 128.825 121.223 0.039 0.000 2.255 7031 L HA 0.524 4.864 4.340 -0.001 0.000 0.289 7031 L C -1.232 175.663 176.870 0.041 0.000 1.046 7031 L CA 0.063 54.930 54.840 0.046 0.000 0.816 7031 L CB 0.516 42.641 42.059 0.110 0.000 1.197 7031 L HN 0.673 nan 8.230 nan 0.000 0.427 7032 I N 5.884 126.469 120.570 0.025 0.000 2.331 7032 I HA 0.437 4.607 4.170 -0.001 0.000 0.292 7032 I C 0.136 176.267 176.117 0.022 0.000 0.998 7032 I CA -0.585 60.727 61.300 0.021 0.000 1.267 7032 I CB 0.580 38.587 38.000 0.013 0.000 1.386 7032 I HN 0.526 nan 8.210 nan 0.000 0.476 7033 R N 4.125 124.639 120.500 0.023 0.000 2.873 7033 R HA 0.900 5.239 4.340 -0.001 0.000 0.264 7033 R C -0.271 176.039 176.300 0.017 0.000 1.026 7033 R CA -1.041 55.071 56.100 0.021 0.000 1.002 7033 R CB 1.943 32.258 30.300 0.025 0.000 1.174 7033 R HN 0.864 nan 8.270 nan 0.000 0.488 7034 G N -1.034 107.775 108.800 0.015 0.000 2.340 7034 G HA2 -0.002 3.958 3.960 -0.001 0.000 0.298 7034 G HA3 -0.002 3.958 3.960 -0.001 0.000 0.298 7034 G C -0.074 174.834 174.900 0.013 0.000 1.498 7034 G CA -0.250 44.859 45.100 0.014 0.000 0.847 7034 G HN 0.377 nan 8.290 nan 0.000 0.594 7035 T N -0.551 114.012 114.554 0.015 0.000 3.035 7035 T HA 0.316 4.665 4.350 -0.001 0.000 0.268 7035 T C 0.777 175.485 174.700 0.014 0.000 1.109 7035 T CA 2.113 64.221 62.100 0.014 0.000 1.119 7035 T CB -0.235 68.642 68.868 0.016 0.000 0.900 7035 T HN 0.699 nan 8.240 nan 0.000 0.503 7036 T N 0.193 114.756 114.554 0.016 0.000 2.894 7036 T HA 0.298 4.647 4.350 -0.001 0.000 0.309 7036 T C 0.284 174.980 174.700 -0.007 0.000 1.208 7036 T CA -0.682 61.426 62.100 0.013 0.000 1.016 7036 T CB 2.160 71.054 68.868 0.043 0.000 1.192 7036 T HN -0.079 nan 8.240 nan 0.000 0.491 7037 E N 0.706 120.870 120.200 -0.061 0.000 2.085 7037 E HA -0.194 4.156 4.350 -0.001 0.000 0.194 7037 E C 1.566 178.084 176.600 -0.137 0.000 0.994 7037 E CA 1.836 58.156 56.400 -0.133 0.000 0.801 7037 E CB -0.059 29.500 29.700 -0.234 0.000 0.743 7037 E HN 0.608 nan 8.360 nan 0.000 0.453 7038 H N -0.886 118.187 119.070 0.005 0.000 2.495 7038 H HA 0.019 4.574 4.556 -0.001 0.000 0.287 7038 H C 2.035 177.366 175.328 0.005 0.000 1.033 7038 H CA 1.148 57.198 56.048 0.004 0.000 1.307 7038 H CB 0.112 29.876 29.762 0.004 0.000 1.401 7038 H HN 0.113 nan 8.280 nan 0.000 0.555 7039 V N 1.970 121.949 119.914 0.109 0.000 2.283 7039 V HA -0.201 3.919 4.120 -0.001 0.000 0.243 7039 V C 2.656 178.776 176.094 0.043 0.000 1.039 7039 V CA 1.668 64.007 62.300 0.065 0.000 1.016 7039 V CB -0.519 31.331 31.823 0.046 0.000 0.650 7039 V HN 0.401 nan 8.190 nan 0.000 0.449 7040 I N -1.077 119.509 120.570 0.026 0.000 2.756 7040 I HA -0.150 4.019 4.170 -0.001 0.000 0.262 7040 I C 2.239 178.365 176.117 0.015 0.000 1.225 7040 I CA 1.859 63.168 61.300 0.015 0.000 1.472 7040 I CB -0.498 37.503 38.000 0.003 0.000 1.094 7040 I HN 0.422 nan 8.210 nan 0.000 0.454 7041 E N 1.798 122.011 120.200 0.022 0.000 2.046 7041 E HA -0.272 4.078 4.350 -0.001 0.000 0.190 7041 E C 2.232 178.857 176.600 0.042 0.000 0.982 7041 E CA 1.061 57.481 56.400 0.033 0.000 0.800 7041 E CB -0.144 29.592 29.700 0.061 0.000 0.756 7041 E HN 0.542 nan 8.360 nan 0.000 0.449 7042 E N 0.597 120.829 120.200 0.054 0.000 2.153 7042 E HA -0.148 4.202 4.350 -0.001 0.000 0.194 7042 E C 2.093 178.710 176.600 0.029 0.000 0.988 7042 E CA 1.040 57.464 56.400 0.041 0.000 0.811 7042 E CB 0.102 29.828 29.700 0.043 0.000 0.746 7042 E HN 0.215 nan 8.360 nan 0.000 0.466 7043 V N 1.374 121.304 119.914 0.027 0.000 2.358 7043 V HA -0.212 3.908 4.120 -0.001 0.000 0.246 7043 V C 2.666 178.770 176.094 0.017 0.000 1.047 7043 V CA 1.629 63.942 62.300 0.021 0.000 1.035 7043 V CB -0.927 30.907 31.823 0.020 0.000 0.658 7043 V HN 0.359 nan 8.190 nan 0.000 0.452 7044 A N 0.507 123.337 122.820 0.015 0.000 1.908 7044 A HA -0.302 4.018 4.320 -0.001 0.000 0.218 7044 A C 2.309 179.900 177.584 0.011 0.000 1.181 7044 A CA 2.434 54.477 52.037 0.010 0.000 0.627 7044 A CB -0.552 18.452 19.000 0.007 0.000 0.818 7044 A HN 0.469 nan 8.150 nan 0.000 0.445 7045 R N 0.036 120.544 120.500 0.014 0.000 2.075 7045 R HA 0.010 4.350 4.340 -0.001 0.000 0.232 7045 R C 2.174 178.482 176.300 0.012 0.000 1.126 7045 R CA 1.886 57.993 56.100 0.013 0.000 0.963 7045 R CB -0.893 29.417 30.300 0.016 0.000 0.858 7045 R HN 0.393 nan 8.270 nan 0.000 0.435 7046 A N 0.133 122.962 122.820 0.015 0.000 1.883 7046 A HA -0.140 4.180 4.320 -0.001 0.000 0.217 7046 A C 2.225 179.817 177.584 0.013 0.000 1.186 7046 A CA 2.073 54.120 52.037 0.016 0.000 0.624 7046 A CB -0.969 18.042 19.000 0.019 0.000 0.822 7046 A HN 0.329 nan 8.150 nan 0.000 0.444 7047 V N -2.435 117.486 119.914 0.012 0.000 2.871 7047 V HA -0.118 4.002 4.120 -0.001 0.000 0.256 7047 V C 1.913 178.011 176.094 0.007 0.000 1.082 7047 V CA 2.017 64.323 62.300 0.010 0.000 1.105 7047 V CB -0.662 31.167 31.823 0.009 0.000 0.713 7047 V HN 0.549 nan 8.190 nan 0.000 0.473 7048 D N 1.522 121.926 120.400 0.007 0.000 2.104 7048 D HA -0.263 4.377 4.640 -0.001 0.000 0.194 7048 D C 1.626 177.929 176.300 0.005 0.000 0.994 7048 D CA 2.302 56.305 54.000 0.004 0.000 0.830 7048 D CB -0.070 40.733 40.800 0.004 0.000 0.959 7048 D HN 0.601 nan 8.370 nan 0.000 0.452 7049 D N 0.107 120.511 120.400 0.007 0.000 2.144 7049 D HA -0.061 4.579 4.640 -0.001 0.000 0.200 7049 D C 2.039 178.343 176.300 0.007 0.000 0.978 7049 D CA 1.368 55.372 54.000 0.007 0.000 0.833 7049 D CB -0.262 40.543 40.800 0.008 0.000 0.961 7049 D HN 0.255 nan 8.370 nan 0.000 0.470 7050 A N 0.385 123.210 122.820 0.008 0.000 1.908 7050 A HA -0.166 4.154 4.320 -0.001 0.000 0.218 7050 A C 2.364 179.952 177.584 0.006 0.000 1.181 7050 A CA 1.181 53.223 52.037 0.008 0.000 0.627 7050 A CB -0.840 18.166 19.000 0.009 0.000 0.818 7050 A HN 0.152 nan 8.150 nan 0.000 0.445 7051 V N -0.115 119.802 119.914 0.005 0.000 2.295 7051 V HA -0.197 3.922 4.120 -0.001 0.000 0.246 7051 V C 2.830 178.926 176.094 0.004 0.000 1.049 7051 V CA 2.012 64.314 62.300 0.004 0.000 1.024 7051 V CB -1.494 30.331 31.823 0.003 0.000 0.648 7051 V HN 0.618 nan 8.190 nan 0.000 0.447 7052 G N 0.456 109.258 108.800 0.004 0.000 2.446 7052 G HA2 -0.230 3.730 3.960 -0.001 0.000 0.217 7052 G HA3 -0.230 3.730 3.960 -0.001 0.000 0.217 7052 G C 1.724 176.626 174.900 0.004 0.000 1.168 7052 G CA 1.663 46.765 45.100 0.003 0.000 0.771 7052 G HN 0.594 nan 8.290 nan 0.000 0.551 7053 V N -1.443 118.474 119.914 0.005 0.000 2.591 7053 V HA -0.009 4.111 4.120 -0.001 0.000 0.249 7053 V C 2.652 178.749 176.094 0.005 0.000 1.053 7053 V CA 1.366 63.670 62.300 0.005 0.000 1.068 7053 V CB -0.483 31.344 31.823 0.007 0.000 0.689 7053 V HN 0.132 nan 8.190 nan 0.000 0.462 7054 V N 1.990 121.907 119.914 0.005 0.000 2.453 7054 V HA -0.024 4.096 4.120 -0.001 0.000 0.247 7054 V C 2.903 179.000 176.094 0.004 0.000 1.048 7054 V CA 2.136 64.439 62.300 0.005 0.000 1.049 7054 V CB -1.295 30.531 31.823 0.005 0.000 0.672 7054 V HN 0.625 nan 8.190 nan 0.000 0.457 7055 G N -1.115 107.687 108.800 0.004 0.000 2.422 7055 G HA2 -0.252 3.707 3.960 -0.001 0.000 0.218 7055 G HA3 -0.252 3.707 3.960 -0.001 0.000 0.218 7055 G C 1.722 176.624 174.900 0.003 0.000 1.146 7055 G CA 1.291 46.393 45.100 0.003 0.000 0.769 7055 G HN 0.536 nan 8.290 nan 0.000 0.547 7056 C N 0.542 119.844 119.300 0.003 0.000 2.429 7056 C HA -0.025 4.435 4.460 -0.001 0.000 0.277 7056 C C 3.208 178.200 174.990 0.004 0.000 1.262 7056 C CA 1.506 60.526 59.018 0.003 0.000 1.733 7056 C CB -1.038 26.705 27.740 0.004 0.000 2.010 7056 C HN 0.427 nan 8.230 nan 0.000 0.483 7057 T N 1.098 115.654 114.554 0.004 0.000 2.881 7057 T HA -0.043 4.307 4.350 -0.001 0.000 0.270 7057 T C 1.566 176.268 174.700 0.003 0.000 1.068 7057 T CA 1.204 63.306 62.100 0.004 0.000 1.131 7057 T CB -0.212 68.659 68.868 0.004 0.000 0.871 7057 T HN 0.515 nan 8.240 nan 0.000 0.479 7058 I N 0.460 121.032 120.570 0.003 0.000 2.480 7058 I HA -0.017 4.153 4.170 -0.001 0.000 0.251 7058 I C 2.518 178.636 176.117 0.002 0.000 1.124 7058 I CA 0.939 62.240 61.300 0.003 0.000 1.444 7058 I CB -0.211 37.791 38.000 0.003 0.000 1.098 7058 I HN 0.227 nan 8.210 nan 0.000 0.428 7059 E N 0.134 120.335 120.200 0.002 0.000 2.110 7059 E HA -0.176 4.173 4.350 -0.001 0.000 0.193 7059 E C 0.533 177.134 176.600 0.002 0.000 0.988 7059 E CA 0.830 57.231 56.400 0.002 0.000 0.804 7059 E CB 0.165 29.866 29.700 0.002 0.000 0.745 7059 E HN 0.257 nan 8.360 nan 0.000 0.458 7060 D N -1.045 119.356 120.400 0.002 0.000 2.620 7060 D HA 0.126 4.765 4.640 -0.001 0.000 0.252 7060 D C -0.195 176.107 176.300 0.003 0.000 1.207 7060 D CA -0.363 53.639 54.000 0.002 0.000 0.884 7060 D CB 1.595 42.397 40.800 0.002 0.000 1.262 7060 D HN 0.056 nan 8.370 nan 0.000 0.552 7061 G N 3.398 112.199 108.800 0.002 0.000 3.340 7061 G HA2 0.084 4.044 3.960 -0.001 0.000 0.240 7061 G HA3 0.084 4.044 3.960 -0.001 0.000 0.240 7061 G C 0.405 175.307 174.900 0.003 0.000 1.327 7061 G CA -0.139 44.962 45.100 0.003 0.000 1.170 7061 G HN 0.293 nan 8.290 nan 0.000 0.520 7062 R N -0.460 120.042 120.500 0.004 0.000 2.621 7062 R HA 0.621 4.961 4.340 -0.001 0.000 0.292 7062 R C -0.760 175.544 176.300 0.006 0.000 0.969 7062 R CA -0.789 55.314 56.100 0.005 0.000 0.887 7062 R CB 2.043 32.346 30.300 0.005 0.000 1.180 7062 R HN 0.265 nan 8.270 nan 0.000 0.450 7063 I N -1.050 119.525 120.570 0.007 0.000 3.002 7063 I HA 0.775 4.944 4.170 -0.001 0.000 0.310 7063 I C -0.537 175.587 176.117 0.012 0.000 1.087 7063 I CA -1.187 60.118 61.300 0.009 0.000 1.017 7063 I CB 2.083 40.088 38.000 0.009 0.000 1.226 7063 I HN 0.359 nan 8.210 nan 0.000 0.443 7064 V N -0.144 119.779 119.914 0.015 0.000 2.962 7064 V HA 0.820 4.940 4.120 -0.001 0.000 0.313 7064 V C 0.059 176.167 176.094 0.024 0.000 1.099 7064 V CA -0.466 61.846 62.300 0.021 0.000 0.971 7064 V CB 1.124 32.959 31.823 0.020 0.000 1.028 7064 V HN 1.139 nan 8.190 nan 0.000 0.430 7065 S N 2.176 117.896 115.700 0.033 0.000 2.562 7065 S HA 0.650 5.120 4.470 -0.001 0.000 0.281 7065 S C 0.589 175.208 174.600 0.033 0.000 1.333 7065 S CA 0.160 58.383 58.200 0.037 0.000 1.052 7065 S CB 0.868 64.100 63.200 0.052 0.000 0.884 7065 S HN 1.773 nan 8.310 nan 0.000 0.506 7066 G N 0.571 109.390 108.800 0.032 0.000 2.630 7066 G HA2 0.532 4.492 3.960 -0.001 0.000 0.223 7066 G HA3 0.532 4.492 3.960 -0.001 0.000 0.223 7066 G C 0.931 175.847 174.900 0.027 0.000 1.434 7066 G CA -0.541 44.575 45.100 0.027 0.000 1.057 7066 G HN 2.040 nan 8.290 nan 0.000 0.570 7067 G N -1.917 106.899 108.800 0.026 0.000 2.225 7067 G HA2 0.232 4.191 3.960 -0.001 0.000 0.267 7067 G HA3 0.232 4.191 3.960 -0.001 0.000 0.267 7067 G C 1.478 176.374 174.900 -0.006 0.000 1.024 7067 G CA 1.213 46.325 45.100 0.020 0.000 0.784 7067 G HN 2.457 nan 8.290 nan 0.000 0.507 7068 G N -1.400 107.387 108.800 -0.021 0.000 2.162 7068 G HA2 -0.140 3.820 3.960 -0.001 0.000 0.260 7068 G HA3 -0.140 3.820 3.960 -0.001 0.000 0.260 7068 G C 1.510 176.358 174.900 -0.086 0.000 0.976 7068 G CA 1.692 46.761 45.100 -0.053 0.000 0.655 7068 G HN 1.957 nan 8.290 nan 0.000 0.533 7069 S N 0.118 115.786 115.700 -0.053 0.000 2.370 7069 S HA -0.184 4.286 4.470 -0.001 0.000 0.226 7069 S C 2.801 177.316 174.600 -0.142 0.000 1.033 7069 S CA 2.847 61.001 58.200 -0.076 0.000 1.011 7069 S CB -0.592 62.660 63.200 0.086 0.000 0.852 7069 S HN 1.399 nan 8.310 nan 0.000 0.457 7070 T N 0.025 114.546 114.554 -0.055 0.000 2.614 7070 T HA -0.096 4.254 4.350 -0.001 0.000 0.263 7070 T C 1.568 176.215 174.700 -0.089 0.000 1.055 7070 T CA 1.624 63.700 62.100 -0.041 0.000 1.162 7070 T CB -1.064 67.794 68.868 -0.017 0.000 0.863 7070 T HN 0.417 nan 8.240 nan 0.000 0.414 7071 E N 0.936 121.080 120.200 -0.092 0.000 2.187 7071 E HA -0.076 4.273 4.350 -0.001 0.000 0.199 7071 E C 2.240 178.759 176.600 -0.135 0.000 1.004 7071 E CA 0.969 57.307 56.400 -0.102 0.000 0.813 7071 E CB -0.704 28.936 29.700 -0.099 0.000 0.736 7071 E HN 0.436 nan 8.360 nan 0.000 0.468 7072 V N 0.436 120.216 119.914 -0.223 0.000 2.453 7072 V HA -0.200 3.919 4.120 -0.001 0.000 0.247 7072 V C 2.262 178.170 176.094 -0.311 0.000 1.048 7072 V CA 1.760 63.877 62.300 -0.304 0.000 1.049 7072 V CB -0.366 31.175 31.823 -0.471 0.000 0.672 7072 V HN 0.217 nan 8.190 nan 0.000 0.457 7073 E N 0.785 120.772 120.200 -0.353 0.000 2.077 7073 E HA -0.196 4.154 4.350 -0.001 0.000 0.193 7073 E C 2.017 178.628 176.600 0.019 0.000 0.989 7073 E CA 1.572 57.972 56.400 0.001 0.000 0.800 7073 E CB -0.420 29.365 29.700 0.142 0.000 0.746 7073 E HN 0.553 nan 8.360 nan 0.000 0.452 7074 L N -0.008 121.205 121.223 -0.017 0.000 2.046 7074 L HA -0.146 4.193 4.340 -0.001 0.000 0.208 7074 L C 2.666 179.554 176.870 0.031 0.000 1.077 7074 L CA 1.357 56.206 54.840 0.015 0.000 0.747 7074 L CB -0.670 41.393 42.059 0.007 0.000 0.896 7074 L HN 0.195 nan 8.230 nan 0.000 0.432 7075 S N -0.317 115.379 115.700 -0.006 0.000 2.356 7075 S HA -0.200 4.270 4.470 -0.001 0.000 0.223 7075 S C 2.126 176.749 174.600 0.038 0.000 1.032 7075 S CA 1.257 59.462 58.200 0.008 0.000 1.005 7075 S CB -0.016 63.167 63.200 -0.027 0.000 0.867 7075 S HN 0.212 nan 8.310 nan 0.000 0.449 7076 M N 0.888 120.511 119.600 0.037 0.000 2.117 7076 M HA 0.033 4.513 4.480 -0.001 0.000 0.262 7076 M C 1.997 178.343 176.300 0.076 0.000 1.065 7076 M CA 1.465 56.804 55.300 0.064 0.000 1.114 7076 M CB -0.995 31.662 32.600 0.096 0.000 1.361 7076 M HN 0.239 nan 8.290 nan 0.000 0.408 7077 K N -0.008 120.440 120.400 0.079 0.000 2.211 7077 K HA 0.193 4.513 4.320 -0.001 0.000 0.201 7077 K C 2.066 178.736 176.600 0.118 0.000 1.052 7077 K CA 0.569 56.907 56.287 0.085 0.000 0.973 7077 K CB -0.226 32.312 32.500 0.064 0.000 0.766 7077 K HN 0.351 nan 8.250 nan 0.000 0.466 7078 L N 0.349 121.644 121.223 0.120 0.000 2.240 7078 L HA -0.010 4.329 4.340 -0.001 0.000 0.211 7078 L C 2.299 179.294 176.870 0.209 0.000 1.106 7078 L CA 0.747 55.700 54.840 0.189 0.000 0.793 7078 L CB -0.195 41.980 42.059 0.192 0.000 0.927 7078 L HN 0.076 nan 8.230 nan 0.000 0.446 7079 R N 0.037 120.621 120.500 0.140 0.000 2.148 7079 R HA -0.116 4.224 4.340 -0.001 0.000 0.223 7079 R C 1.976 178.333 176.300 0.095 0.000 1.088 7079 R CA 0.980 57.144 56.100 0.107 0.000 0.985 7079 R CB -0.052 30.294 30.300 0.075 0.000 0.880 7079 R HN 0.446 nan 8.270 nan 0.000 0.451 7080 E N -0.499 119.766 120.200 0.109 0.000 2.112 7080 E HA -0.172 4.178 4.350 -0.001 0.000 0.190 7080 E C 1.437 178.106 176.600 0.116 0.000 0.979 7080 E CA 0.675 57.131 56.400 0.094 0.000 0.814 7080 E CB -0.052 29.702 29.700 0.090 0.000 0.762 7080 E HN 0.280 nan 8.360 nan 0.000 0.460 7081 Y N 1.593 121.910 120.300 0.027 0.000 2.224 7081 Y HA -0.207 4.342 4.550 -0.001 0.000 0.289 7081 Y C 2.180 178.091 175.900 0.019 0.000 1.146 7081 Y CA 1.256 59.368 58.100 0.020 0.000 1.182 7081 Y CB -0.383 38.087 38.460 0.018 0.000 0.983 7081 Y HN -0.013 nan 8.280 nan 0.000 0.524 7082 A N 0.241 123.065 122.820 0.006 0.000 1.940 7082 A HA -0.181 4.139 4.320 -0.001 0.000 0.219 7082 A C 2.119 179.649 177.584 -0.090 0.000 1.176 7082 A CA 1.861 53.864 52.037 -0.055 0.000 0.631 7082 A CB -0.532 18.496 19.000 0.047 0.000 0.814 7082 A HN 0.523 nan 8.150 nan 0.000 0.446 7083 E N -0.499 119.670 120.200 -0.051 0.000 2.072 7083 E HA -0.127 4.222 4.350 -0.001 0.000 0.191 7083 E C 2.186 178.740 176.600 -0.077 0.000 0.985 7083 E CA 1.170 57.544 56.400 -0.043 0.000 0.801 7083 E CB -0.695 28.999 29.700 -0.010 0.000 0.750 7083 E HN 0.590 nan 8.360 nan 0.000 0.452 7084 G N 1.300 110.030 108.800 -0.117 0.000 2.422 7084 G HA2 -0.168 3.791 3.960 -0.001 0.000 0.218 7084 G HA3 -0.168 3.791 3.960 -0.001 0.000 0.218 7084 G C 1.584 176.375 174.900 -0.182 0.000 1.140 7084 G CA 0.248 45.268 45.100 -0.135 0.000 0.775 7084 G HN 0.110 nan 8.290 nan 0.000 0.545 7085 I N 0.210 120.618 120.570 -0.271 0.000 2.233 7085 I HA 0.025 4.195 4.170 -0.001 0.000 0.243 7085 I C 1.678 177.717 176.117 -0.129 0.000 1.093 7085 I CA 1.027 62.181 61.300 -0.243 0.000 1.380 7085 I CB -1.118 36.695 38.000 -0.311 0.000 1.067 7085 I HN 0.300 nan 8.210 nan 0.000 0.413 7086 S N -1.113 114.526 115.700 -0.101 0.000 3.513 7086 S HA -0.107 4.363 4.470 -0.001 0.000 0.636 7086 S C 0.750 175.322 174.600 -0.046 0.000 2.452 7086 S CA 1.349 59.514 58.200 -0.059 0.000 2.644 7086 S CB -1.364 61.806 63.200 -0.050 0.000 0.331 7086 S HN 1.421 nan 8.310 nan 0.000 1.787 7087 G N 1.120 109.902 108.800 -0.031 0.000 2.578 7087 G HA2 -0.326 3.634 3.960 -0.001 0.000 0.275 7087 G HA3 -0.326 3.634 3.960 -0.001 0.000 0.275 7087 G C 0.341 175.233 174.900 -0.014 0.000 1.271 7087 G CA 1.638 46.725 45.100 -0.022 0.000 0.941 7087 G HN 1.879 nan 8.290 nan 0.000 0.564 7088 R N 0.402 120.897 120.500 -0.009 0.000 2.236 7088 R HA 0.228 4.568 4.340 -0.001 0.000 0.208 7088 R C 2.003 178.303 176.300 -0.001 0.000 1.036 7088 R CA 1.646 57.746 56.100 0.000 0.000 1.001 7088 R CB -0.202 30.102 30.300 0.006 0.000 0.896 7088 R HN 0.665 nan 8.270 nan 0.000 0.464 7089 E N 1.568 121.760 120.200 -0.013 0.000 2.204 7089 E HA -0.219 4.130 4.350 -0.001 0.000 0.194 7089 E C 1.809 178.404 176.600 -0.008 0.000 0.989 7089 E CA 1.434 57.824 56.400 -0.017 0.000 0.824 7089 E CB 0.063 29.741 29.700 -0.037 0.000 0.756 7089 E HN 0.596 nan 8.360 nan 0.000 0.477 7090 Q N 0.682 120.472 119.800 -0.017 0.000 2.230 7090 Q HA -0.134 4.205 4.340 -0.001 0.000 0.202 7090 Q C 1.984 178.007 176.000 0.038 0.000 0.963 7090 Q CA 0.949 56.746 55.803 -0.009 0.000 0.866 7090 Q CB -0.305 28.419 28.738 -0.024 0.000 0.931 7090 Q HN 0.207 nan 8.270 nan 0.000 0.452 7091 L N 0.344 121.592 121.223 0.041 0.000 2.109 7091 L HA 0.180 4.519 4.340 -0.001 0.000 0.207 7091 L C 2.244 179.183 176.870 0.114 0.000 1.086 7091 L CA 1.794 56.672 54.840 0.065 0.000 0.760 7091 L CB -0.985 41.101 42.059 0.045 0.000 0.910 7091 L HN 0.301 nan 8.230 nan 0.000 0.437 7092 A N -1.150 121.734 122.820 0.107 0.000 1.898 7092 A HA -0.126 4.194 4.320 -0.001 0.000 0.216 7092 A C 2.232 180.025 177.584 0.349 0.000 1.181 7092 A CA 1.942 54.086 52.037 0.177 0.000 0.620 7092 A CB -1.003 18.013 19.000 0.027 0.000 0.819 7092 A HN 0.265 nan 8.150 nan 0.000 0.442 7093 V N -0.177 119.874 119.914 0.228 0.000 2.427 7093 V HA -0.207 3.913 4.120 -0.001 0.000 0.248 7093 V C 2.619 178.872 176.094 0.265 0.000 1.051 7093 V CA 2.151 64.604 62.300 0.254 0.000 1.048 7093 V CB -0.775 31.157 31.823 0.181 0.000 0.666 7093 V HN 0.620 nan 8.190 nan 0.000 0.456 7094 R N 0.083 120.693 120.500 0.184 0.000 2.096 7094 R HA -0.128 4.212 4.340 -0.001 0.000 0.235 7094 R C 2.258 178.644 176.300 0.144 0.000 1.127 7094 R CA 1.544 57.729 56.100 0.142 0.000 0.968 7094 R CB -0.345 30.011 30.300 0.093 0.000 0.861 7094 R HN 0.503 nan 8.270 nan 0.000 0.440 7095 A N 0.034 122.964 122.820 0.183 0.000 1.929 7095 A HA -0.142 4.178 4.320 -0.001 0.000 0.216 7095 A C 1.895 179.550 177.584 0.117 0.000 1.176 7095 A CA 0.822 52.958 52.037 0.163 0.000 0.628 7095 A CB -0.635 18.504 19.000 0.231 0.000 0.816 7095 A HN 0.479 nan 8.150 nan 0.000 0.444 7096 F N 1.151 121.115 119.950 0.023 0.000 2.095 7096 F HA -0.152 4.375 4.527 -0.001 0.000 0.298 7096 F C 2.528 178.259 175.800 -0.115 0.000 1.104 7096 F CA 1.490 59.373 58.000 -0.195 0.000 1.232 7096 F CB -0.363 38.572 39.000 -0.109 0.000 0.987 7096 F HN 0.249 nan 8.300 nan 0.000 0.475 7097 A N -0.437 122.468 122.820 0.142 0.000 1.902 7097 A HA -0.241 4.079 4.320 -0.001 0.000 0.217 7097 A C 1.982 179.533 177.584 -0.056 0.000 1.181 7097 A CA 1.951 54.016 52.037 0.046 0.000 0.623 7097 A CB -1.174 17.897 19.000 0.118 0.000 0.818 7097 A HN 0.498 nan 8.150 nan 0.000 0.443 7098 D N 0.020 120.401 120.400 -0.032 0.000 2.123 7098 D HA -0.072 4.567 4.640 -0.001 0.000 0.196 7098 D C 2.044 178.279 176.300 -0.107 0.000 0.992 7098 D CA 1.619 55.589 54.000 -0.049 0.000 0.833 7098 D CB -0.248 40.545 40.800 -0.012 0.000 0.954 7098 D HN 0.333 nan 8.370 nan 0.000 0.455 7099 A N -0.116 122.596 122.820 -0.179 0.000 1.898 7099 A HA -0.087 4.233 4.320 -0.001 0.000 0.216 7099 A C 2.146 179.572 177.584 -0.263 0.000 1.181 7099 A CA 0.901 52.795 52.037 -0.237 0.000 0.620 7099 A CB -0.670 18.121 19.000 -0.349 0.000 0.819 7099 A HN 0.300 nan 8.150 nan 0.000 0.442 7100 L N 0.218 121.243 121.223 -0.330 0.000 2.191 7100 L HA -0.125 4.215 4.340 -0.001 0.000 0.212 7100 L C 2.140 178.911 176.870 -0.166 0.000 1.103 7100 L CA 1.723 56.398 54.840 -0.275 0.000 0.769 7100 L CB -0.800 41.086 42.059 -0.290 0.000 0.908 7100 L HN 0.482 nan 8.230 nan 0.000 0.438 7101 E N -1.374 118.746 120.200 -0.135 0.000 2.333 7101 E HA -0.179 4.170 4.350 -0.001 0.000 0.198 7101 E C 2.262 178.809 176.600 -0.090 0.000 1.007 7101 E CA 0.728 57.069 56.400 -0.098 0.000 0.845 7101 E CB -0.158 29.498 29.700 -0.074 0.000 0.766 7101 E HN 0.291 nan 8.360 nan 0.000 0.507 7102 V N 1.132 120.986 119.914 -0.101 0.000 2.720 7102 V HA -0.213 3.907 4.120 -0.001 0.000 0.256 7102 V C 1.717 177.764 176.094 -0.078 0.000 1.082 7102 V CA 1.088 63.337 62.300 -0.085 0.000 1.101 7102 V CB -0.205 31.563 31.823 -0.092 0.000 0.693 7102 V HN 0.258 nan 8.190 nan 0.000 0.479 7103 I N 0.602 121.120 120.570 -0.086 0.000 2.162 7103 I HA -0.034 4.135 4.170 -0.001 0.000 0.238 7103 I C 0.222 176.300 176.117 -0.065 0.000 1.076 7103 I CA 1.466 62.721 61.300 -0.074 0.000 1.353 7103 I CB -2.838 35.115 38.000 -0.078 0.000 1.063 7103 I HN 0.311 nan 8.210 nan 0.000 0.408 7104 P HA -0.171 nan 4.420 nan 0.000 0.216 7104 P C 1.798 179.066 177.300 -0.053 0.000 1.154 7104 P CA 1.755 64.819 63.100 -0.060 0.000 0.865 7104 P CB -0.159 31.500 31.700 -0.068 0.000 0.789 7105 R N -1.467 119.001 120.500 -0.054 0.000 2.075 7105 R HA -0.023 4.316 4.340 -0.001 0.000 0.232 7105 R C 2.033 178.305 176.300 -0.048 0.000 1.126 7105 R CA 1.719 57.790 56.100 -0.048 0.000 0.963 7105 R CB -1.006 29.266 30.300 -0.048 0.000 0.858 7105 R HN 0.199 nan 8.270 nan 0.000 0.435 7106 T N 1.082 115.605 114.554 -0.052 0.000 3.051 7106 T HA 0.132 4.481 4.350 -0.001 0.000 0.255 7106 T C 1.807 176.474 174.700 -0.055 0.000 1.085 7106 T CA 0.139 62.208 62.100 -0.052 0.000 1.109 7106 T CB 0.142 68.979 68.868 -0.052 0.000 0.921 7106 T HN 0.063 nan 8.240 nan 0.000 0.488 7107 L N 0.953 122.142 121.223 -0.057 0.000 2.043 7107 L HA -0.172 4.168 4.340 -0.001 0.000 0.212 7107 L C 2.824 179.649 176.870 -0.074 0.000 1.075 7107 L CA 1.641 56.443 54.840 -0.064 0.000 0.752 7107 L CB -0.443 41.582 42.059 -0.056 0.000 0.891 7107 L HN 0.258 nan 8.230 nan 0.000 0.432 7108 A N -1.252 121.530 122.820 -0.063 0.000 2.030 7108 A HA -0.120 4.200 4.320 -0.001 0.000 0.215 7108 A C 2.186 179.735 177.584 -0.058 0.000 1.164 7108 A CA 0.705 52.704 52.037 -0.063 0.000 0.697 7108 A CB -0.261 18.710 19.000 -0.049 0.000 0.827 7108 A HN 0.417 nan 8.150 nan 0.000 0.457 7109 E N 0.627 120.796 120.200 -0.051 0.000 2.070 7109 E HA -0.260 4.089 4.350 -0.001 0.000 0.197 7109 E C 1.373 177.943 176.600 -0.050 0.000 1.004 7109 E CA 1.625 57.998 56.400 -0.046 0.000 0.805 7109 E CB -0.130 29.544 29.700 -0.042 0.000 0.744 7109 E HN 0.540 nan 8.360 nan 0.000 0.451 7110 N N -0.038 118.627 118.700 -0.058 0.000 2.396 7110 N HA -0.073 4.667 4.740 -0.001 0.000 0.180 7110 N C 1.361 176.827 175.510 -0.074 0.000 1.028 7110 N CA 1.020 54.033 53.050 -0.061 0.000 0.893 7110 N CB -0.142 38.306 38.487 -0.064 0.000 0.967 7110 N HN 0.227 nan 8.380 nan 0.000 0.440 7111 A N 0.066 122.833 122.820 -0.088 0.000 2.119 7111 A HA 0.298 4.618 4.320 -0.001 0.000 0.216 7111 A C 1.467 179.009 177.584 -0.069 0.000 1.152 7111 A CA 1.054 53.030 52.037 -0.101 0.000 0.708 7111 A CB -0.385 18.539 19.000 -0.127 0.000 0.805 7111 A HN 0.306 nan 8.150 nan 0.000 0.460 7112 G N -1.332 107.435 108.800 -0.054 0.000 2.142 7112 G HA2 -0.180 3.780 3.960 -0.001 0.000 0.225 7112 G HA3 -0.180 3.780 3.960 -0.001 0.000 0.225 7112 G C -0.050 174.829 174.900 -0.034 0.000 1.015 7112 G CA 0.280 45.356 45.100 -0.039 0.000 0.716 7112 G HN 0.438 nan 8.290 nan 0.000 0.508 7113 L N -0.150 121.051 121.223 -0.038 0.000 2.387 7113 L HA 0.547 4.887 4.340 -0.001 0.000 0.266 7113 L C 0.358 177.212 176.870 -0.026 0.000 1.059 7113 L CA -1.096 53.726 54.840 -0.031 0.000 0.801 7113 L CB 0.912 42.950 42.059 -0.035 0.000 1.223 7113 L HN 0.098 nan 8.230 nan 0.000 0.456 7114 D N 0.722 121.110 120.400 -0.020 0.000 2.338 7114 D HA 0.199 4.838 4.640 -0.001 0.000 0.255 7114 D C 0.740 177.029 176.300 -0.019 0.000 1.237 7114 D CA -0.006 53.983 54.000 -0.017 0.000 0.883 7114 D CB 1.849 42.642 40.800 -0.012 0.000 1.087 7114 D HN 0.588 nan 8.370 nan 0.000 0.485 7115 A N 5.216 128.023 122.820 -0.021 0.000 1.978 7115 A HA -0.179 4.141 4.320 -0.001 0.000 0.220 7115 A C 2.064 179.637 177.584 -0.018 0.000 1.170 7115 A CA 0.890 52.913 52.037 -0.023 0.000 0.636 7115 A CB -0.327 18.658 19.000 -0.025 0.000 0.810 7115 A HN 0.700 nan 8.150 nan 0.000 0.448 7116 I N -0.534 120.028 120.570 -0.014 0.000 2.235 7116 I HA -0.153 4.017 4.170 -0.001 0.000 0.241 7116 I C 2.434 178.546 176.117 -0.008 0.000 1.085 7116 I CA 1.679 62.973 61.300 -0.011 0.000 1.378 7116 I CB -1.464 36.531 38.000 -0.008 0.000 1.076 7116 I HN 0.572 nan 8.210 nan 0.000 0.415 7117 E N 1.557 121.753 120.200 -0.007 0.000 2.051 7117 E HA -0.219 4.131 4.350 -0.001 0.000 0.192 7117 E C 2.336 178.934 176.600 -0.003 0.000 0.991 7117 E CA 1.643 58.041 56.400 -0.004 0.000 0.799 7117 E CB -0.095 29.603 29.700 -0.004 0.000 0.748 7117 E HN 0.590 nan 8.360 nan 0.000 0.449 7118 I N -0.889 119.677 120.570 -0.007 0.000 2.439 7118 I HA -0.129 4.041 4.170 -0.001 0.000 0.251 7118 I C 2.389 178.502 176.117 -0.007 0.000 1.139 7118 I CA 0.594 61.891 61.300 -0.006 0.000 1.438 7118 I CB -0.272 37.720 38.000 -0.013 0.000 1.085 7118 I HN 0.121 nan 8.210 nan 0.000 0.427 7119 L N 1.231 122.447 121.223 -0.011 0.000 2.046 7119 L HA -0.080 4.260 4.340 -0.001 0.000 0.208 7119 L C 2.343 179.210 176.870 -0.004 0.000 1.077 7119 L CA 1.772 56.605 54.840 -0.012 0.000 0.747 7119 L CB -0.478 41.572 42.059 -0.015 0.000 0.896 7119 L HN 0.119 nan 8.230 nan 0.000 0.432 7120 V N -0.521 119.393 119.914 0.000 0.000 2.302 7120 V HA -0.209 3.911 4.120 -0.001 0.000 0.243 7120 V C 2.521 178.622 176.094 0.012 0.000 1.036 7120 V CA 1.886 64.189 62.300 0.006 0.000 1.020 7120 V CB -0.569 31.257 31.823 0.005 0.000 0.657 7120 V HN 0.401 nan 8.190 nan 0.000 0.453 7121 K N -0.256 120.151 120.400 0.011 0.000 2.103 7121 K HA -0.063 4.257 4.320 -0.001 0.000 0.204 7121 K C 2.046 178.661 176.600 0.025 0.000 1.052 7121 K CA 1.104 57.400 56.287 0.016 0.000 0.945 7121 K CB -0.224 32.284 32.500 0.012 0.000 0.722 7121 K HN 0.300 nan 8.250 nan 0.000 0.443 7122 V N 1.308 121.236 119.914 0.022 0.000 2.379 7122 V HA -0.181 3.939 4.120 -0.001 0.000 0.245 7122 V C 2.382 178.508 176.094 0.054 0.000 1.044 7122 V CA 1.433 63.753 62.300 0.034 0.000 1.036 7122 V CB -0.445 31.387 31.823 0.015 0.000 0.664 7122 V HN 0.297 nan 8.190 nan 0.000 0.453 7123 R N 0.543 121.063 120.500 0.034 0.000 2.083 7123 R HA -0.212 4.128 4.340 -0.001 0.000 0.237 7123 R C 2.265 178.612 176.300 0.077 0.000 1.137 7123 R CA 1.970 58.097 56.100 0.046 0.000 0.951 7123 R CB -0.471 29.841 30.300 0.021 0.000 0.851 7123 R HN 0.474 nan 8.270 nan 0.000 0.434 7124 A N 0.538 123.390 122.820 0.052 0.000 1.898 7124 A HA -0.054 4.266 4.320 -0.001 0.000 0.216 7124 A C 2.361 179.974 177.584 0.048 0.000 1.181 7124 A CA 1.575 53.639 52.037 0.044 0.000 0.620 7124 A CB -0.743 18.274 19.000 0.028 0.000 0.819 7124 A HN 0.562 nan 8.150 nan 0.000 0.442 7125 A N -0.939 121.913 122.820 0.053 0.000 1.902 7125 A HA -0.167 4.152 4.320 -0.001 0.000 0.217 7125 A C 2.025 179.642 177.584 0.055 0.000 1.181 7125 A CA 2.114 54.179 52.037 0.047 0.000 0.623 7125 A CB -0.851 18.178 19.000 0.048 0.000 0.818 7125 A HN 0.781 nan 8.150 nan 0.000 0.443 7126 H N -0.267 118.807 119.070 0.006 0.000 2.299 7126 H HA 0.090 4.646 4.556 -0.000 0.000 0.302 7126 H C 2.211 177.543 175.328 0.007 0.000 1.078 7126 H CA 1.987 58.039 56.048 0.006 0.000 1.323 7126 H CB -0.263 29.502 29.762 0.005 0.000 1.381 7126 H HN 0.371 nan 8.280 nan 0.000 0.498 7127 A N -0.593 122.280 122.820 0.088 0.000 1.940 7127 A HA -0.197 4.123 4.320 -0.001 0.000 0.219 7127 A C 2.578 180.145 177.584 -0.028 0.000 1.176 7127 A CA 2.080 54.140 52.037 0.038 0.000 0.631 7127 A CB -1.063 17.983 19.000 0.077 0.000 0.814 7127 A HN 0.521 nan 8.150 nan 0.000 0.446 7128 S N -0.616 115.071 115.700 -0.021 0.000 2.371 7128 S HA -0.077 4.393 4.470 -0.001 0.000 0.219 7128 S C 1.835 176.407 174.600 -0.046 0.000 1.040 7128 S CA 1.038 59.224 58.200 -0.023 0.000 0.958 7128 S CB -0.380 62.817 63.200 -0.006 0.000 0.860 7128 S HN 0.602 nan 8.310 nan 0.000 0.487 7129 N N 1.054 119.722 118.700 -0.055 0.000 2.409 7129 N HA 0.241 4.981 4.740 -0.001 0.000 0.179 7129 N C 1.053 176.505 175.510 -0.098 0.000 1.032 7129 N CA 0.976 53.991 53.050 -0.058 0.000 0.898 7129 N CB 0.158 38.624 38.487 -0.034 0.000 0.971 7129 N HN 0.609 nan 8.380 nan 0.000 0.441 7130 G N 0.601 109.287 108.800 -0.189 0.000 2.342 7130 G HA2 -0.222 3.738 3.960 -0.001 0.000 0.220 7130 G HA3 -0.222 3.738 3.960 -0.001 0.000 0.220 7130 G C 0.149 174.798 174.900 -0.419 0.000 1.243 7130 G CA 0.140 45.088 45.100 -0.253 0.000 1.083 7130 G HN 0.271 nan 8.290 nan 0.000 0.500 7131 N N 0.139 118.700 118.700 -0.232 0.000 2.436 7131 N HA -0.008 4.732 4.740 -0.001 0.000 0.178 7131 N C 1.621 177.148 175.510 0.028 0.000 1.026 7131 N CA 1.426 54.434 53.050 -0.070 0.000 0.880 7131 N CB -0.139 38.365 38.487 0.027 0.000 1.061 7131 N HN 0.837 nan 8.380 nan 0.000 0.434 7132 K N -0.222 120.176 120.400 -0.003 0.000 2.387 7132 K HA 0.325 4.645 4.320 -0.001 0.000 0.198 7132 K C -0.153 176.451 176.600 0.005 0.000 1.022 7132 K CA -0.159 56.134 56.287 0.012 0.000 1.128 7132 K CB 0.039 32.542 32.500 0.005 0.000 0.853 7132 K HN 0.034 nan 8.250 nan 0.000 0.523 7133 C N 1.213 120.508 119.300 -0.008 0.000 2.955 7133 C HA 0.690 5.150 4.460 -0.001 0.000 0.229 7133 C C 0.382 175.374 174.990 0.003 0.000 1.842 7133 C CA -0.489 58.525 59.018 -0.008 0.000 1.539 7133 C CB -0.684 27.040 27.740 -0.027 0.000 2.869 7133 C HN 0.654 nan 8.230 nan 0.000 0.503 7134 A N 0.042 122.885 122.820 0.039 0.000 5.810 7134 A HA 0.946 5.266 4.320 -0.001 0.000 0.151 7134 A C 0.148 177.780 177.584 0.079 0.000 0.903 7134 A CA 0.404 52.483 52.037 0.070 0.000 1.207 7134 A CB -0.378 18.683 19.000 0.102 0.000 2.339 7134 A HN 1.963 nan 8.150 nan 0.000 1.102 7135 G N -1.856 107.006 108.800 0.103 0.000 2.787 7135 G HA2 0.367 4.326 3.960 -0.001 0.000 0.685 7135 G HA3 0.367 4.326 3.960 -0.001 0.000 0.685 7135 G C -0.755 174.173 174.900 0.047 0.000 1.437 7135 G CA -0.011 45.129 45.100 0.066 0.000 0.872 7135 G HN 2.036 nan 8.290 nan 0.000 0.566 7136 L N 0.696 121.937 121.223 0.030 0.000 2.289 7136 L HA 0.743 5.082 4.340 -0.001 0.000 0.285 7136 L C 0.200 177.092 176.870 0.037 0.000 1.049 7136 L CA -0.997 53.858 54.840 0.024 0.000 0.804 7136 L CB 1.538 43.599 42.059 0.003 0.000 1.195 7136 L HN 0.748 nan 8.230 nan 0.000 0.428 7137 N N 3.001 121.731 118.700 0.051 0.000 2.501 7137 N HA 0.222 4.962 4.740 -0.001 0.000 0.245 7137 N C 0.807 176.355 175.510 0.064 0.000 0.974 7137 N CA -0.271 52.835 53.050 0.094 0.000 0.941 7137 N CB 1.199 39.756 38.487 0.117 0.000 1.122 7137 N HN 0.510 nan 8.380 nan 0.000 0.507 7138 V N 1.622 121.537 119.914 0.001 0.000 2.913 7138 V HA -0.012 4.108 4.120 -0.001 0.000 0.260 7138 V C 1.404 177.405 176.094 -0.154 0.000 1.098 7138 V CA 1.234 63.464 62.300 -0.116 0.000 1.121 7138 V CB -1.200 30.487 31.823 -0.227 0.000 0.714 7138 V HN 0.473 nan 8.190 nan 0.000 0.487 7139 F N 2.524 122.472 119.950 -0.003 0.000 2.259 7139 F HA -0.042 4.485 4.527 -0.000 0.000 0.298 7139 F C 2.675 178.475 175.800 -0.001 0.000 1.088 7139 F CA 1.850 59.849 58.000 -0.002 0.000 1.358 7139 F CB -0.366 38.633 39.000 -0.001 0.000 1.040 7139 F HN 0.380 nan 8.300 nan 0.000 0.505 7140 T N -4.042 110.615 114.554 0.171 0.000 3.022 7140 T HA 0.361 4.711 4.350 -0.001 0.000 0.250 7140 T C 1.547 176.276 174.700 0.049 0.000 1.060 7140 T CA 0.423 62.578 62.100 0.093 0.000 1.013 7140 T CB 0.269 69.183 68.868 0.077 0.000 0.982 7140 T HN 0.355 nan 8.240 nan 0.000 0.508 7141 G N 1.086 109.905 108.800 0.033 0.000 2.225 7141 G HA2 0.231 4.190 3.960 -0.001 0.000 0.264 7141 G HA3 0.231 4.190 3.960 -0.001 0.000 0.264 7141 G C 0.099 175.006 174.900 0.010 0.000 1.060 7141 G CA -0.182 44.921 45.100 0.006 0.000 0.833 7141 G HN 1.436 nan 8.290 nan 0.000 0.498 7142 A N -1.841 120.992 122.820 0.021 0.000 2.608 7142 A HA 0.869 5.189 4.320 -0.001 0.000 0.292 7142 A C 0.032 177.632 177.584 0.027 0.000 1.066 7142 A CA 0.149 52.199 52.037 0.020 0.000 0.676 7142 A CB 1.349 20.362 19.000 0.022 0.000 1.277 7142 A HN 1.779 nan 8.150 nan 0.000 0.413 7143 V N 1.619 121.548 119.914 0.024 0.000 2.673 7143 V HA 0.394 4.514 4.120 -0.001 0.000 0.303 7143 V C 0.011 176.124 176.094 0.032 0.000 1.046 7143 V CA 0.966 63.283 62.300 0.029 0.000 1.126 7143 V CB 0.478 32.318 31.823 0.029 0.000 0.934 7143 V HN 0.917 nan 8.190 nan 0.000 0.487 7144 E N 3.806 124.028 120.200 0.038 0.000 2.359 7144 E HA 0.388 4.738 4.350 -0.001 0.000 0.223 7144 E C -1.405 175.215 176.600 0.034 0.000 0.877 7144 E CA -0.679 55.742 56.400 0.035 0.000 0.887 7144 E CB 0.726 30.451 29.700 0.041 0.000 1.890 7144 E HN 0.704 nan 8.360 nan 0.000 0.419 7145 D N 1.261 121.678 120.400 0.028 0.000 2.472 7145 D HA 0.180 4.820 4.640 -0.001 0.000 0.234 7145 D C 0.839 177.156 176.300 0.027 0.000 1.088 7145 D CA -0.279 53.736 54.000 0.025 0.000 0.882 7145 D CB 0.647 41.456 40.800 0.015 0.000 1.037 7145 D HN 0.188 nan 8.370 nan 0.000 0.520 7146 M N 1.662 121.283 119.600 0.036 0.000 2.159 7146 M HA -0.143 4.337 4.480 -0.001 0.000 0.263 7146 M C 2.321 178.636 176.300 0.025 0.000 1.063 7146 M CA 0.783 56.105 55.300 0.037 0.000 1.110 7146 M CB -1.142 31.485 32.600 0.045 0.000 1.374 7146 M HN 0.530 nan 8.290 nan 0.000 0.411 7147 C N 0.640 119.953 119.300 0.022 0.000 2.432 7147 C HA -0.169 4.290 4.460 -0.001 0.000 0.277 7147 C C 2.705 177.699 174.990 0.007 0.000 1.249 7147 C CA 1.406 60.432 59.018 0.014 0.000 1.725 7147 C CB -0.921 26.827 27.740 0.014 0.000 2.028 7147 C HN 0.636 nan 8.230 nan 0.000 0.477 7148 E N 0.031 120.235 120.200 0.007 0.000 2.110 7148 E HA -0.173 4.176 4.350 -0.001 0.000 0.193 7148 E C 1.378 177.976 176.600 -0.003 0.000 0.988 7148 E CA 1.165 57.566 56.400 0.001 0.000 0.804 7148 E CB -0.182 29.519 29.700 0.002 0.000 0.745 7148 E HN 0.654 nan 8.360 nan 0.000 0.458 7149 N N -0.371 118.329 118.700 -0.001 0.000 2.398 7149 N HA 0.004 4.743 4.740 -0.001 0.000 0.188 7149 N C 0.758 176.257 175.510 -0.019 0.000 1.122 7149 N CA 0.906 53.949 53.050 -0.012 0.000 0.866 7149 N CB 0.978 39.462 38.487 -0.005 0.000 0.970 7149 N HN 0.332 nan 8.380 nan 0.000 0.462 7150 G N 0.471 109.266 108.800 -0.009 0.000 2.153 7150 G HA2 -0.263 3.697 3.960 -0.001 0.000 0.252 7150 G HA3 -0.263 3.697 3.960 -0.001 0.000 0.252 7150 G C 0.048 174.947 174.900 -0.002 0.000 0.994 7150 G CA 0.097 45.192 45.100 -0.009 0.000 0.698 7150 G HN 0.205 nan 8.290 nan 0.000 0.521 7151 V N 1.488 121.408 119.914 0.010 0.000 2.222 7151 V HA 0.495 4.615 4.120 -0.001 0.000 0.253 7151 V C 0.767 176.878 176.094 0.029 0.000 1.210 7151 V CA 0.161 62.478 62.300 0.028 0.000 1.079 7151 V CB 0.411 32.265 31.823 0.052 0.000 1.265 7151 V HN 1.065 nan 8.190 nan 0.000 0.494 7152 V N 1.475 121.402 119.914 0.021 0.000 3.007 7152 V HA 0.894 5.013 4.120 -0.001 0.000 0.311 7152 V C -0.715 175.389 176.094 0.017 0.000 1.120 7152 V CA -0.758 61.553 62.300 0.019 0.000 0.980 7152 V CB 2.560 34.392 31.823 0.015 0.000 1.033 7152 V HN 0.636 nan 8.190 nan 0.000 0.429 7153 E N 1.916 122.125 120.200 0.016 0.000 2.369 7153 E HA 0.660 5.009 4.350 -0.001 0.000 0.270 7153 E C -3.240 173.366 176.600 0.010 0.000 0.909 7153 E CA -2.406 54.001 56.400 0.013 0.000 0.775 7153 E CB 2.153 31.861 29.700 0.012 0.000 1.270 7153 E HN 0.467 nan 8.360 nan 0.000 0.445 7154 P HA -0.007 nan 4.420 nan 0.000 0.268 7154 P C 0.865 178.169 177.300 0.006 0.000 1.205 7154 P CA -0.349 62.755 63.100 0.007 0.000 0.771 7154 P CB 0.478 32.181 31.700 0.006 0.000 0.858 7155 L N 4.534 125.761 121.223 0.006 0.000 2.042 7155 L HA -0.194 4.145 4.340 -0.001 0.000 0.210 7155 L C 2.200 179.073 176.870 0.005 0.000 1.076 7155 L CA 1.895 56.738 54.840 0.006 0.000 0.749 7155 L CB -0.698 41.365 42.059 0.006 0.000 0.893 7155 L HN 0.272 nan 8.230 nan 0.000 0.432 7156 R N -1.198 119.305 120.500 0.004 0.000 2.117 7156 R HA -0.164 4.175 4.340 -0.001 0.000 0.243 7156 R C 2.117 178.419 176.300 0.003 0.000 1.143 7156 R CA 1.616 57.718 56.100 0.004 0.000 0.968 7156 R CB -0.726 29.576 30.300 0.003 0.000 0.863 7156 R HN 0.346 nan 8.270 nan 0.000 0.444 7157 V N 1.324 121.239 119.914 0.003 0.000 2.261 7157 V HA -0.240 3.879 4.120 -0.001 0.000 0.246 7157 V C 2.224 178.318 176.094 -0.000 0.000 1.047 7157 V CA 1.686 63.987 62.300 0.002 0.000 1.015 7157 V CB -0.298 31.526 31.823 0.002 0.000 0.642 7157 V HN 0.217 nan 8.190 nan 0.000 0.446 7158 K N -0.346 120.054 120.400 0.000 0.000 2.167 7158 K HA -0.009 4.310 4.320 -0.001 0.000 0.203 7158 K C 2.174 178.774 176.600 0.001 0.000 1.052 7158 K CA 1.260 57.546 56.287 -0.003 0.000 0.956 7158 K CB -0.558 31.940 32.500 -0.003 0.000 0.735 7158 K HN 0.481 nan 8.250 nan 0.000 0.451 7159 T N 1.254 115.810 114.554 0.004 0.000 2.812 7159 T HA -0.128 4.222 4.350 -0.001 0.000 0.264 7159 T C 1.899 176.605 174.700 0.010 0.000 1.042 7159 T CA 1.210 63.315 62.100 0.007 0.000 1.140 7159 T CB -0.004 68.867 68.868 0.005 0.000 0.870 7159 T HN 0.129 nan 8.240 nan 0.000 0.445 7160 Q N 1.254 121.059 119.800 0.007 0.000 2.123 7160 Q HA 0.158 4.498 4.340 -0.001 0.000 0.199 7160 Q C 2.269 178.274 176.000 0.009 0.000 0.966 7160 Q CA 1.503 57.311 55.803 0.008 0.000 0.845 7160 Q CB -0.619 28.122 28.738 0.006 0.000 0.907 7160 Q HN 0.476 nan 8.270 nan 0.000 0.439 7161 A N 0.506 123.328 122.820 0.003 0.000 1.858 7161 A HA -0.159 4.160 4.320 -0.001 0.000 0.216 7161 A C 1.934 179.518 177.584 -0.000 0.000 1.190 7161 A CA 1.614 53.649 52.037 -0.003 0.000 0.617 7161 A CB -0.712 18.281 19.000 -0.011 0.000 0.827 7161 A HN 0.443 nan 8.150 nan 0.000 0.443 7162 I N -0.120 120.455 120.570 0.008 0.000 2.252 7162 I HA -0.223 3.947 4.170 -0.001 0.000 0.245 7162 I C 2.649 178.807 176.117 0.068 0.000 1.102 7162 I CA 1.771 63.089 61.300 0.030 0.000 1.385 7162 I CB -1.482 36.548 38.000 0.050 0.000 1.064 7162 I HN 0.594 nan 8.210 nan 0.000 0.414 7163 Q N 0.880 120.711 119.800 0.051 0.000 2.002 7163 Q HA -0.205 4.135 4.340 -0.001 0.000 0.204 7163 Q C 2.385 178.414 176.000 0.048 0.000 0.988 7163 Q CA 2.725 58.558 55.803 0.049 0.000 0.843 7163 Q CB 0.091 28.846 28.738 0.027 0.000 0.908 7163 Q HN 0.360 nan 8.270 nan 0.000 0.420 7164 S N 0.286 116.005 115.700 0.032 0.000 2.368 7164 S HA -0.102 4.368 4.470 -0.001 0.000 0.224 7164 S C 1.938 176.557 174.600 0.032 0.000 1.029 7164 S CA 0.884 59.101 58.200 0.028 0.000 0.988 7164 S CB -0.340 62.870 63.200 0.017 0.000 0.838 7164 S HN 0.571 nan 8.310 nan 0.000 0.462 7165 A N 1.670 124.505 122.820 0.025 0.000 1.877 7165 A HA 0.078 4.398 4.320 -0.001 0.000 0.216 7165 A C 2.359 179.967 177.584 0.041 0.000 1.186 7165 A CA 1.755 53.800 52.037 0.013 0.000 0.620 7165 A CB -1.126 17.863 19.000 -0.018 0.000 0.822 7165 A HN 0.516 nan 8.150 nan 0.000 0.443 7166 A N -0.588 122.285 122.820 0.089 0.000 1.930 7166 A HA -0.118 4.202 4.320 -0.001 0.000 0.217 7166 A C 1.976 179.652 177.584 0.153 0.000 1.175 7166 A CA 2.110 54.256 52.037 0.183 0.000 0.627 7166 A CB -0.418 18.775 19.000 0.323 0.000 0.815 7166 A HN 0.543 nan 8.150 nan 0.000 0.443 7167 E N -0.153 120.107 120.200 0.101 0.000 2.072 7167 E HA -0.111 4.238 4.350 -0.001 0.000 0.190 7167 E C 2.221 178.863 176.600 0.070 0.000 0.982 7167 E CA 1.448 57.895 56.400 0.079 0.000 0.803 7167 E CB -0.341 29.391 29.700 0.053 0.000 0.755 7167 E HN 0.461 nan 8.360 nan 0.000 0.453 7168 S N -1.277 114.457 115.700 0.057 0.000 2.383 7168 S HA -0.112 4.358 4.470 -0.001 0.000 0.227 7168 S C 1.885 176.517 174.600 0.054 0.000 1.026 7168 S CA 1.658 59.884 58.200 0.044 0.000 0.981 7168 S CB -0.543 62.675 63.200 0.029 0.000 0.818 7168 S HN 0.407 nan 8.310 nan 0.000 0.472 7169 T N 1.732 116.329 114.554 0.071 0.000 2.652 7169 T HA -0.124 4.225 4.350 -0.001 0.000 0.267 7169 T C 1.761 176.540 174.700 0.133 0.000 1.039 7169 T CA 1.648 63.805 62.100 0.094 0.000 1.153 7169 T CB -0.481 68.451 68.868 0.107 0.000 0.863 7169 T HN 0.587 nan 8.240 nan 0.000 0.428 7170 E N 0.584 120.883 120.200 0.166 0.000 2.085 7170 E HA -0.172 4.177 4.350 -0.001 0.000 0.194 7170 E C 2.253 178.899 176.600 0.077 0.000 0.994 7170 E CA 1.071 57.556 56.400 0.142 0.000 0.801 7170 E CB -0.234 29.550 29.700 0.141 0.000 0.743 7170 E HN 0.459 nan 8.360 nan 0.000 0.453 7171 M N 0.239 119.878 119.600 0.064 0.000 2.082 7171 M HA -0.242 4.237 4.480 -0.001 0.000 0.258 7171 M C 1.952 178.273 176.300 0.035 0.000 1.069 7171 M CA 1.423 56.749 55.300 0.043 0.000 1.102 7171 M CB -0.050 32.572 32.600 0.037 0.000 1.336 7171 M HN 0.178 nan 8.290 nan 0.000 0.404 7172 L N 0.393 121.638 121.223 0.036 0.000 2.083 7172 L HA -0.155 4.185 4.340 -0.001 0.000 0.209 7172 L C 2.143 179.025 176.870 0.019 0.000 1.083 7172 L CA 1.657 56.511 54.840 0.022 0.000 0.752 7172 L CB -0.920 41.150 42.059 0.017 0.000 0.899 7172 L HN 0.402 nan 8.230 nan 0.000 0.433 7173 L N -1.585 119.658 121.223 0.034 0.000 2.395 7173 L HA -0.099 4.241 4.340 -0.001 0.000 0.218 7173 L C 2.489 179.364 176.870 0.008 0.000 1.130 7173 L CA 0.428 55.280 54.840 0.019 0.000 0.826 7173 L CB -0.361 41.714 42.059 0.028 0.000 0.941 7173 L HN 0.206 nan 8.230 nan 0.000 0.451 7174 R N 0.015 120.526 120.500 0.018 0.000 2.115 7174 R HA -0.026 4.314 4.340 -0.001 0.000 0.230 7174 R C 0.273 176.582 176.300 0.016 0.000 1.111 7174 R CA 0.619 56.729 56.100 0.017 0.000 0.976 7174 R CB -0.150 30.164 30.300 0.023 0.000 0.870 7174 R HN 0.140 nan 8.270 nan 0.000 0.445 7175 I N 2.165 122.744 120.570 0.015 0.000 2.496 7175 I HA -0.063 4.107 4.170 -0.001 0.000 0.285 7175 I C 0.656 176.782 176.117 0.015 0.000 1.080 7175 I CA 0.238 61.549 61.300 0.018 0.000 1.404 7175 I CB 1.159 39.170 38.000 0.019 0.000 1.403 7175 I HN 0.140 nan 8.210 nan 0.000 0.539 7176 D N 2.276 122.689 120.400 0.020 0.000 2.469 7176 D HA 0.175 4.815 4.640 -0.001 0.000 0.213 7176 D C -0.311 176.010 176.300 0.035 0.000 1.135 7176 D CA -0.006 54.006 54.000 0.019 0.000 0.834 7176 D CB 0.320 41.127 40.800 0.013 0.000 1.009 7176 D HN 0.358 nan 8.370 nan 0.000 0.507 7177 D N -0.283 120.144 120.400 0.044 0.000 2.812 7177 D HA 0.218 4.857 4.640 -0.001 0.000 0.210 7177 D C -1.672 174.667 176.300 0.064 0.000 1.260 7177 D CA -0.512 53.522 54.000 0.056 0.000 0.817 7177 D CB 2.192 43.016 40.800 0.040 0.000 1.694 7177 D HN -0.183 nan 8.370 nan 0.000 0.530 7178 V N 4.072 124.042 119.914 0.094 0.000 2.384 7178 V HA 0.544 4.663 4.120 -0.001 0.000 0.287 7178 V C 0.045 176.187 176.094 0.079 0.000 1.020 7178 V CA -0.588 61.772 62.300 0.100 0.000 0.850 7178 V CB 1.215 33.137 31.823 0.166 0.000 0.987 7178 V HN 0.415 nan 8.190 nan 0.000 0.436 7179 I N 4.511 125.115 120.570 0.056 0.000 2.355 7179 I HA 0.671 4.840 4.170 -0.001 0.000 0.288 7179 I C 0.431 176.571 176.117 0.038 0.000 0.999 7179 I CA -0.106 61.218 61.300 0.040 0.000 1.163 7179 I CB 1.746 39.763 38.000 0.028 0.000 1.316 7179 I HN 0.652 nan 8.210 nan 0.000 0.454 7180 A N 5.115 127.956 122.820 0.035 0.000 2.276 7180 A HA 0.884 5.203 4.320 -0.001 0.000 0.316 7180 A C 0.167 177.762 177.584 0.018 0.000 1.229 7180 A CA -0.568 51.486 52.037 0.029 0.000 0.851 7180 A CB 0.694 19.714 19.000 0.034 0.000 1.165 7180 A HN 0.780 nan 8.150 nan 0.000 0.513 7181 A N 1.973 124.802 122.820 0.015 0.000 2.371 7181 A HA 0.474 4.794 4.320 -0.001 0.000 0.257 7181 A C 0.593 178.182 177.584 0.008 0.000 1.089 7181 A CA -0.157 51.886 52.037 0.010 0.000 0.794 7181 A CB 0.086 19.092 19.000 0.010 0.000 1.029 7181 A HN 0.951 nan 8.150 nan 0.000 0.488 7182 E N 0.000 120.203 120.200 0.005 0.000 2.725 7182 E HA 0.000 4.350 4.350 -0.001 0.000 0.291 7182 E CA 0.000 56.402 56.400 0.003 0.000 0.976 7182 E CB 0.000 29.701 29.700 0.002 0.000 0.812 7182 E HN 0.000 nan 8.360 nan 0.000 0.440