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 3izj_1_L DATA FIRST_RESID 5644 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 5644 V HA 0.000 nan 4.120 nan 0.000 0.244 5644 V C 0.000 176.090 176.094 -0.007 0.000 1.182 5644 V CA 0.000 62.296 62.300 -0.007 0.000 1.235 5644 V CB 0.000 31.819 31.823 -0.006 0.000 1.184 5645 L N 2.640 123.857 121.223 -0.010 0.000 2.375 5645 L HA 0.475 4.815 4.340 0.000 0.000 0.271 5645 L C -2.075 174.789 176.870 -0.011 0.000 1.107 5645 L CA -1.503 53.331 54.840 -0.010 0.000 0.806 5645 L CB 0.354 42.404 42.059 -0.015 0.000 1.146 5645 L HN 0.136 nan 8.230 nan 0.000 0.447 5646 P HA 0.028 nan 4.420 nan 0.000 0.265 5646 P C -0.945 176.348 177.300 -0.012 0.000 1.187 5646 P CA -0.198 62.898 63.100 -0.008 0.000 0.766 5646 P CB 0.369 32.066 31.700 -0.005 0.000 0.820 5647 E N 2.814 123.007 120.200 -0.011 0.000 2.417 5647 E HA 0.076 4.426 4.350 0.000 0.000 0.261 5647 E C 0.587 177.179 176.600 -0.013 0.000 1.000 5647 E CA 0.590 56.982 56.400 -0.014 0.000 0.919 5647 E CB -0.049 29.644 29.700 -0.012 0.000 0.955 5647 E HN 0.347 nan 8.360 nan 0.000 0.455 5648 N N 0.596 119.285 118.700 -0.019 0.000 2.990 5648 N HA -0.177 4.563 4.740 0.000 0.000 0.163 5648 N C -0.214 175.284 175.510 -0.020 0.000 1.452 5648 N CA 0.523 53.563 53.050 -0.017 0.000 1.624 5648 N CB -1.038 37.444 38.487 -0.009 0.000 1.088 5648 N HN 0.552 nan 8.380 nan 0.000 0.695 5649 M N 3.014 122.602 119.600 -0.020 0.000 2.248 5649 M HA 0.045 4.525 4.480 0.000 0.000 0.345 5649 M C 0.328 176.599 176.300 -0.048 0.000 1.243 5649 M CA 0.414 55.701 55.300 -0.021 0.000 1.090 5649 M CB 0.458 33.049 32.600 -0.015 0.000 1.683 5649 M HN 0.100 nan 8.290 nan 0.000 0.450 5650 K N 5.166 125.532 120.400 -0.056 0.000 2.164 5650 K HA 0.599 4.919 4.320 0.000 0.000 0.258 5650 K C -1.123 175.373 176.600 -0.175 0.000 0.951 5650 K CA -0.958 55.245 56.287 -0.140 0.000 0.844 5650 K CB 2.025 34.446 32.500 -0.132 0.000 1.099 5650 K HN 0.792 nan 8.250 nan 0.000 0.435 5651 R N 2.650 122.961 120.500 -0.316 0.000 2.673 5651 R HA 0.306 4.646 4.340 0.000 0.000 0.281 5651 R C -1.656 174.363 176.300 -0.467 0.000 0.991 5651 R CA -0.670 55.279 56.100 -0.251 0.000 0.896 5651 R CB 1.319 31.552 30.300 -0.111 0.000 1.201 5651 R HN 0.735 nan 8.270 nan 0.000 0.457 5652 Y N 4.269 124.554 120.300 -0.026 0.000 2.429 5652 Y HA 0.546 5.097 4.550 0.000 0.000 0.342 5652 Y C 0.376 176.259 175.900 -0.028 0.000 1.004 5652 Y CA -0.876 57.205 58.100 -0.033 0.000 1.075 5652 Y CB 2.128 40.559 38.460 -0.048 0.000 1.214 5652 Y HN 0.389 nan 8.280 nan 0.000 0.455 5653 M N 1.083 120.746 119.600 0.105 0.000 2.465 5653 M HA 0.772 5.252 4.480 0.000 0.000 0.284 5653 M C 0.044 176.363 176.300 0.031 0.000 1.212 5653 M CA -0.296 55.033 55.300 0.048 0.000 0.910 5653 M CB 1.275 33.885 32.600 0.015 0.000 1.725 5653 M HN 0.835 nan 8.290 nan 0.000 0.477 5654 G N 3.239 112.046 108.800 0.011 0.000 2.591 5654 G HA2 -0.333 3.627 3.960 0.000 0.000 0.298 5654 G HA3 -0.333 3.627 3.960 0.000 0.000 0.298 5654 G C 0.563 175.457 174.900 -0.010 0.000 1.195 5654 G CA 0.829 45.923 45.100 -0.009 0.000 0.989 5654 G HN 0.944 nan 8.290 nan 0.000 0.551 5655 R N 0.749 121.241 120.500 -0.013 0.000 2.237 5655 R HA 0.050 4.390 4.340 0.000 0.000 0.219 5655 R C 1.962 178.265 176.300 0.004 0.000 1.080 5655 R CA 1.258 57.350 56.100 -0.014 0.000 0.995 5655 R CB -0.197 30.092 30.300 -0.017 0.000 0.875 5655 R HN 0.500 nan 8.270 nan 0.000 0.462 5656 D N 0.591 121.009 120.400 0.030 0.000 2.162 5656 D HA -0.040 4.601 4.640 0.000 0.000 0.203 5656 D C 1.800 178.155 176.300 0.090 0.000 0.967 5656 D CA 1.208 55.255 54.000 0.078 0.000 0.840 5656 D CB -0.119 40.750 40.800 0.115 0.000 0.972 5656 D HN 0.182 nan 8.370 nan 0.000 0.482 5657 A N 0.924 123.793 122.820 0.081 0.000 1.933 5657 A HA -0.184 4.136 4.320 0.000 0.000 0.218 5657 A C 2.077 179.630 177.584 -0.051 0.000 1.175 5657 A CA 1.199 53.260 52.037 0.039 0.000 0.628 5657 A CB -0.318 18.712 19.000 0.049 0.000 0.814 5657 A HN 0.083 nan 8.150 nan 0.000 0.444 5658 Q N -0.808 118.971 119.800 -0.035 0.000 2.123 5658 Q HA -0.134 4.206 4.340 0.000 0.000 0.199 5658 Q C 2.216 178.181 176.000 -0.059 0.000 0.966 5658 Q CA 1.550 57.325 55.803 -0.047 0.000 0.845 5658 Q CB -0.383 28.332 28.738 -0.038 0.000 0.907 5658 Q HN 0.628 nan 8.270 nan 0.000 0.439 5659 R N 1.034 121.503 120.500 -0.051 0.000 2.083 5659 R HA -0.079 4.261 4.340 0.000 0.000 0.237 5659 R C 2.097 178.329 176.300 -0.113 0.000 1.137 5659 R CA 1.489 57.556 56.100 -0.055 0.000 0.951 5659 R CB -0.600 29.686 30.300 -0.023 0.000 0.851 5659 R HN 0.181 nan 8.270 nan 0.000 0.434 5660 M N 0.453 119.930 119.600 -0.206 0.000 2.132 5660 M HA -0.119 4.361 4.480 0.000 0.000 0.263 5660 M C 0.986 177.082 176.300 -0.340 0.000 1.065 5660 M CA 1.793 56.852 55.300 -0.402 0.000 1.122 5660 M CB -0.703 31.401 32.600 -0.827 0.000 1.365 5660 M HN 0.154 nan 8.290 nan 0.000 0.411 5661 N N 0.996 119.553 118.700 -0.239 0.000 2.166 5661 N HA -0.110 4.630 4.740 0.000 0.000 0.186 5661 N C 1.739 177.203 175.510 -0.078 0.000 1.019 5661 N CA 1.335 54.298 53.050 -0.145 0.000 0.856 5661 N CB -0.400 38.030 38.487 -0.096 0.000 0.993 5661 N HN 0.359 nan 8.380 nan 0.000 0.426 5662 I N 1.025 121.557 120.570 -0.064 0.000 2.252 5662 I HA -0.134 4.036 4.170 0.000 0.000 0.245 5662 I C 2.192 178.297 176.117 -0.020 0.000 1.102 5662 I CA 0.682 61.966 61.300 -0.027 0.000 1.385 5662 I CB -1.037 36.952 38.000 -0.019 0.000 1.064 5662 I HN 0.101 nan 8.210 nan 0.000 0.414 5663 L N 0.585 121.785 121.223 -0.038 0.000 2.083 5663 L HA -0.180 4.160 4.340 0.000 0.000 0.209 5663 L C 2.805 179.705 176.870 0.050 0.000 1.083 5663 L CA 1.243 56.081 54.840 -0.005 0.000 0.752 5663 L CB -0.634 41.413 42.059 -0.021 0.000 0.899 5663 L HN 0.183 nan 8.230 nan 0.000 0.433 5664 A N 0.316 123.166 122.820 0.049 0.000 1.858 5664 A HA -0.139 4.181 4.320 0.000 0.000 0.216 5664 A C 2.396 180.029 177.584 0.082 0.000 1.190 5664 A CA 1.866 54.014 52.037 0.184 0.000 0.617 5664 A CB -1.322 17.740 19.000 0.104 0.000 0.827 5664 A HN 0.424 nan 8.150 nan 0.000 0.443 5665 G N -0.911 107.910 108.800 0.035 0.000 2.408 5665 G HA2 -0.189 3.771 3.960 0.000 0.000 0.217 5665 G HA3 -0.189 3.771 3.960 0.000 0.000 0.217 5665 G C 1.700 176.607 174.900 0.013 0.000 1.150 5665 G CA 1.173 46.285 45.100 0.020 0.000 0.776 5665 G HN 0.514 nan 8.290 nan 0.000 0.542 5666 R N 0.515 121.023 120.500 0.013 0.000 2.081 5666 R HA 0.095 4.435 4.340 0.000 0.000 0.235 5666 R C 2.432 178.736 176.300 0.006 0.000 1.131 5666 R CA 1.125 57.229 56.100 0.006 0.000 0.960 5666 R CB -0.591 29.713 30.300 0.006 0.000 0.856 5666 R HN 0.427 nan 8.270 nan 0.000 0.436 5667 I N 0.071 120.651 120.570 0.016 0.000 2.202 5667 I HA -0.249 3.921 4.170 0.000 0.000 0.242 5667 I C 1.785 177.899 176.117 -0.005 0.000 1.091 5667 I CA 0.765 62.070 61.300 0.008 0.000 1.368 5667 I CB -0.266 37.744 38.000 0.016 0.000 1.058 5667 I HN 0.144 nan 8.210 nan 0.000 0.410 5668 I N 1.197 121.766 120.570 -0.002 0.000 2.163 5668 I HA -0.303 3.868 4.170 0.000 0.000 0.243 5668 I C 2.818 178.927 176.117 -0.013 0.000 1.085 5668 I CA 1.915 63.209 61.300 -0.010 0.000 1.347 5668 I CB -1.490 36.507 38.000 -0.005 0.000 1.044 5668 I HN 0.204 nan 8.210 nan 0.000 0.408 5669 A N 0.193 123.007 122.820 -0.010 0.000 1.930 5669 A HA -0.214 4.106 4.320 0.000 0.000 0.217 5669 A C 2.261 179.833 177.584 -0.019 0.000 1.175 5669 A CA 1.682 53.709 52.037 -0.016 0.000 0.627 5669 A CB -0.502 18.488 19.000 -0.017 0.000 0.815 5669 A HN 0.407 nan 8.150 nan 0.000 0.443 5670 E N 0.328 120.519 120.200 -0.015 0.000 2.110 5670 E HA -0.146 4.204 4.350 0.000 0.000 0.193 5670 E C 2.040 178.629 176.600 -0.019 0.000 0.988 5670 E CA 2.222 58.612 56.400 -0.016 0.000 0.804 5670 E CB -0.439 29.254 29.700 -0.011 0.000 0.745 5670 E HN 0.663 nan 8.360 nan 0.000 0.458 5671 T N -2.647 111.896 114.554 -0.019 0.000 2.976 5671 T HA 0.026 4.376 4.350 0.000 0.000 0.257 5671 T C 1.958 176.645 174.700 -0.022 0.000 1.051 5671 T CA 0.807 62.894 62.100 -0.021 0.000 1.141 5671 T CB -0.411 68.443 68.868 -0.023 0.000 0.881 5671 T HN 0.034 nan 8.240 nan 0.000 0.461 5672 V N 2.856 122.758 119.914 -0.021 0.000 2.788 5672 V HA 0.031 4.151 4.120 0.000 0.000 0.251 5672 V C 2.887 178.966 176.094 -0.024 0.000 1.068 5672 V CA 1.422 63.709 62.300 -0.022 0.000 1.090 5672 V CB -0.585 31.226 31.823 -0.020 0.000 0.710 5672 V HN 0.648 nan 8.190 nan 0.000 0.467 5673 R N 0.987 121.472 120.500 -0.026 0.000 2.200 5673 R HA -0.115 4.225 4.340 0.000 0.000 0.234 5673 R C 1.912 178.193 176.300 -0.031 0.000 1.127 5673 R CA 1.773 57.855 56.100 -0.030 0.000 0.989 5673 R CB -1.029 29.252 30.300 -0.031 0.000 0.869 5673 R HN 0.628 nan 8.270 nan 0.000 0.459 5674 S N 0.239 115.922 115.700 -0.029 0.000 2.595 5674 S HA -0.084 4.386 4.470 0.000 0.000 0.235 5674 S C 1.653 176.234 174.600 -0.031 0.000 0.974 5674 S CA 0.873 59.055 58.200 -0.031 0.000 0.942 5674 S CB -0.066 63.117 63.200 -0.028 0.000 0.766 5674 S HN 0.610 nan 8.310 nan 0.000 0.536 5675 T N -1.167 113.369 114.554 -0.029 0.000 3.037 5675 T HA 0.311 4.661 4.350 0.000 0.000 0.251 5675 T C 0.421 175.103 174.700 -0.030 0.000 1.079 5675 T CA -0.476 61.608 62.100 -0.027 0.000 1.067 5675 T CB -0.468 68.387 68.868 -0.022 0.000 0.948 5675 T HN 0.276 nan 8.240 nan 0.000 0.496 5676 L N 2.897 124.099 121.223 -0.034 0.000 2.462 5676 L HA 0.516 4.856 4.340 0.000 0.000 0.272 5676 L C 0.703 177.546 176.870 -0.046 0.000 1.166 5676 L CA 1.617 56.435 54.840 -0.036 0.000 0.880 5676 L CB -0.669 41.367 42.059 -0.038 0.000 1.142 5676 L HN 0.735 nan 8.230 nan 0.000 0.473 5677 G N 4.039 112.813 108.800 -0.042 0.000 2.663 5677 G HA2 -0.147 3.813 3.960 0.000 0.000 0.686 5677 G HA3 -0.147 3.813 3.960 0.000 0.000 0.686 5677 G C -2.099 172.760 174.900 -0.068 0.000 1.288 5677 G CA -0.459 44.606 45.100 -0.058 0.000 0.836 5677 G HN 0.482 nan 8.290 nan 0.000 0.584 5678 P HA -0.015 nan 4.420 nan 0.000 0.218 5678 P C 1.408 178.614 177.300 -0.157 0.000 1.148 5678 P CA 1.492 64.522 63.100 -0.118 0.000 0.822 5678 P CB 0.047 31.577 31.700 -0.283 0.000 0.784 5679 K N -0.692 119.589 120.400 -0.198 0.000 2.446 5679 K HA 0.257 4.577 4.320 0.000 0.000 0.203 5679 K C 0.951 177.497 176.600 -0.090 0.000 1.027 5679 K CA -0.189 56.007 56.287 -0.152 0.000 1.166 5679 K CB -0.373 32.017 32.500 -0.183 0.000 0.869 5679 K HN 0.035 nan 8.250 nan 0.000 0.504 5680 G N 0.376 109.133 108.800 -0.072 0.000 2.569 5680 G HA2 0.223 4.183 3.960 0.000 0.000 0.249 5680 G HA3 0.223 4.183 3.960 0.000 0.000 0.249 5680 G C -0.018 174.859 174.900 -0.038 0.000 1.216 5680 G CA -0.432 44.638 45.100 -0.050 0.000 0.845 5680 G HN -0.030 nan 8.290 nan 0.000 0.568 5681 M N -0.047 119.533 119.600 -0.033 0.000 2.705 5681 M HA 0.409 4.889 4.480 0.000 0.000 0.272 5681 M C -0.690 175.596 176.300 -0.024 0.000 1.172 5681 M CA -0.513 54.771 55.300 -0.027 0.000 0.901 5681 M CB 1.403 33.987 32.600 -0.028 0.000 1.516 5681 M HN 0.389 nan 8.290 nan 0.000 0.530 5682 D N -0.222 120.164 120.400 -0.024 0.000 2.269 5682 D HA 0.474 5.114 4.640 0.000 0.000 0.244 5682 D C -0.977 175.307 176.300 -0.026 0.000 0.992 5682 D CA -0.370 53.616 54.000 -0.024 0.000 0.894 5682 D CB 1.413 42.198 40.800 -0.025 0.000 1.248 5682 D HN 0.098 nan 8.370 nan 0.000 0.468 5683 K N 0.738 121.122 120.400 -0.025 0.000 2.123 5683 K HA 0.612 4.932 4.320 0.000 0.000 0.248 5683 K C -0.809 175.773 176.600 -0.030 0.000 0.969 5683 K CA -0.520 55.751 56.287 -0.026 0.000 0.882 5683 K CB 1.320 33.806 32.500 -0.023 0.000 1.080 5683 K HN 0.364 nan 8.250 nan 0.000 0.441 5684 M N 3.308 122.889 119.600 -0.031 0.000 2.022 5684 M HA 0.328 4.808 4.480 0.000 0.000 0.298 5684 M C -1.706 174.578 176.300 -0.028 0.000 0.909 5684 M CA -0.917 54.361 55.300 -0.036 0.000 0.914 5684 M CB 0.568 33.143 32.600 -0.042 0.000 1.486 5684 M HN 0.308 nan 8.290 nan 0.000 0.415 5685 L N 5.056 126.264 121.223 -0.024 0.000 2.275 5685 L HA 0.563 4.903 4.340 0.000 0.000 0.288 5685 L C -0.680 176.182 176.870 -0.013 0.000 1.046 5685 L CA -0.322 54.508 54.840 -0.017 0.000 0.805 5685 L CB 1.740 43.791 42.059 -0.014 0.000 1.193 5685 L HN 0.360 nan 8.230 nan 0.000 0.426 5686 V N 2.579 122.486 119.914 -0.012 0.000 2.409 5686 V HA 0.349 4.469 4.120 0.000 0.000 0.291 5686 V C -0.058 176.033 176.094 -0.005 0.000 1.020 5686 V CA -0.857 61.438 62.300 -0.008 0.000 0.848 5686 V CB 1.564 33.382 31.823 -0.009 0.000 0.990 5686 V HN 0.633 nan 8.190 nan 0.000 0.430 5687 D N 2.505 122.904 120.400 -0.001 0.000 2.384 5687 D HA 0.045 4.685 4.640 0.000 0.000 0.244 5687 D C 1.021 177.321 176.300 -0.001 0.000 1.251 5687 D CA -0.113 53.887 54.000 -0.001 0.000 0.961 5687 D CB 1.272 42.073 40.800 0.002 0.000 1.116 5687 D HN 0.704 nan 8.370 nan 0.000 0.484 5688 D N -0.479 119.920 120.400 -0.001 0.000 2.263 5688 D HA -0.115 4.525 4.640 0.000 0.000 0.208 5688 D C 1.530 177.830 176.300 0.001 0.000 0.971 5688 D CA 0.831 54.830 54.000 -0.001 0.000 0.867 5688 D CB 0.116 40.916 40.800 -0.001 0.000 0.929 5688 D HN 0.118 nan 8.370 nan 0.000 0.492 5689 L N -1.170 120.055 121.223 0.002 0.000 2.509 5689 L HA 0.344 4.684 4.340 0.000 0.000 0.222 5689 L C 2.047 178.920 176.870 0.005 0.000 1.123 5689 L CA 0.996 55.839 54.840 0.003 0.000 0.856 5689 L CB 0.135 42.197 42.059 0.004 0.000 0.985 5689 L HN 0.267 nan 8.230 nan 0.000 0.456 5690 G N -1.540 107.263 108.800 0.004 0.000 2.201 5690 G HA2 -0.248 3.712 3.960 0.000 0.000 0.212 5690 G HA3 -0.248 3.712 3.960 0.000 0.000 0.212 5690 G C 0.282 175.187 174.900 0.009 0.000 0.994 5690 G CA 0.069 45.172 45.100 0.006 0.000 0.644 5690 G HN 0.317 nan 8.290 nan 0.000 0.508 5691 D N 1.195 121.601 120.400 0.011 0.000 2.487 5691 D HA 0.355 4.995 4.640 0.000 0.000 0.243 5691 D C 0.460 176.770 176.300 0.017 0.000 1.154 5691 D CA 0.390 54.401 54.000 0.018 0.000 0.876 5691 D CB 1.057 41.867 40.800 0.017 0.000 1.161 5691 D HN 0.257 nan 8.370 nan 0.000 0.478 5692 V N 4.939 124.869 119.914 0.027 0.000 2.398 5692 V HA 0.377 4.498 4.120 0.000 0.000 0.286 5692 V C 0.115 176.225 176.094 0.026 0.000 1.026 5692 V CA -0.826 61.482 62.300 0.014 0.000 0.868 5692 V CB 1.684 33.508 31.823 0.001 0.000 0.982 5692 V HN 0.401 nan 8.190 nan 0.000 0.443 5693 V N 6.414 126.331 119.914 0.004 0.000 2.656 5693 V HA 0.675 4.795 4.120 0.000 0.000 0.307 5693 V C -0.774 175.305 176.094 -0.025 0.000 1.051 5693 V CA -0.294 62.011 62.300 0.009 0.000 0.893 5693 V CB 2.341 34.174 31.823 0.016 0.000 0.999 5693 V HN 0.622 nan 8.190 nan 0.000 0.426 5694 V N 5.813 125.704 119.914 -0.039 0.000 2.409 5694 V HA 0.781 4.901 4.120 0.000 0.000 0.291 5694 V C 0.014 176.096 176.094 -0.021 0.000 1.020 5694 V CA -0.087 62.181 62.300 -0.054 0.000 0.848 5694 V CB 1.552 33.309 31.823 -0.108 0.000 0.990 5694 V HN 1.038 nan 8.190 nan 0.000 0.430 5695 T N 2.546 117.089 114.554 -0.018 0.000 2.802 5695 T HA 0.323 4.673 4.350 0.000 0.000 0.311 5695 T C 0.081 174.774 174.700 -0.012 0.000 1.405 5695 T CA -0.378 61.717 62.100 -0.008 0.000 1.016 5695 T CB 2.030 70.897 68.868 -0.002 0.000 1.352 5695 T HN 0.661 nan 8.240 nan 0.000 0.498 5696 N N 1.179 119.875 118.700 -0.008 0.000 2.210 5696 N HA 0.074 4.814 4.740 0.000 0.000 0.203 5696 N C -0.315 175.190 175.510 -0.008 0.000 1.175 5696 N CA -0.006 53.038 53.050 -0.010 0.000 0.894 5696 N CB 0.476 38.959 38.487 -0.008 0.000 1.041 5696 N HN 0.691 nan 8.380 nan 0.000 0.506 5697 D N -0.056 120.341 120.400 -0.005 0.000 2.371 5697 D HA 0.202 4.842 4.640 0.000 0.000 0.256 5697 D C 1.485 177.781 176.300 -0.007 0.000 1.193 5697 D CA 0.207 54.204 54.000 -0.004 0.000 0.881 5697 D CB 1.038 41.838 40.800 -0.001 0.000 1.143 5697 D HN 0.263 nan 8.370 nan 0.000 0.473 5698 G N 2.653 111.448 108.800 -0.008 0.000 2.440 5698 G HA2 -0.246 3.715 3.960 0.000 0.000 0.218 5698 G HA3 -0.246 3.715 3.960 0.000 0.000 0.218 5698 G C 1.532 176.427 174.900 -0.008 0.000 1.154 5698 G CA 0.757 45.851 45.100 -0.010 0.000 0.767 5698 G HN 0.490 nan 8.290 nan 0.000 0.552 5699 V N 0.839 120.749 119.914 -0.005 0.000 2.261 5699 V HA -0.185 3.936 4.120 0.000 0.000 0.246 5699 V C 3.185 179.277 176.094 -0.004 0.000 1.047 5699 V CA 2.421 64.719 62.300 -0.004 0.000 1.015 5699 V CB -0.913 30.909 31.823 -0.002 0.000 0.642 5699 V HN 0.408 nan 8.190 nan 0.000 0.446 5700 T N 0.309 114.861 114.554 -0.003 0.000 2.684 5700 T HA -0.168 4.182 4.350 0.000 0.000 0.267 5700 T C 1.805 176.502 174.700 -0.005 0.000 1.036 5700 T CA 1.914 64.013 62.100 -0.002 0.000 1.148 5700 T CB -0.314 68.553 68.868 -0.000 0.000 0.863 5700 T HN 0.339 nan 8.240 nan 0.000 0.436 5701 I N 0.320 120.886 120.570 -0.007 0.000 2.179 5701 I HA -0.149 4.021 4.170 0.000 0.000 0.242 5701 I C 2.101 178.210 176.117 -0.012 0.000 1.088 5701 I CA 1.002 62.295 61.300 -0.011 0.000 1.357 5701 I CB -0.282 37.710 38.000 -0.013 0.000 1.051 5701 I HN 0.160 nan 8.210 nan 0.000 0.409 5702 L N 0.113 121.330 121.223 -0.010 0.000 2.109 5702 L HA -0.089 4.251 4.340 0.000 0.000 0.207 5702 L C 2.502 179.367 176.870 -0.009 0.000 1.086 5702 L CA 1.506 56.340 54.840 -0.011 0.000 0.760 5702 L CB -0.945 41.110 42.059 -0.008 0.000 0.910 5702 L HN 0.147 nan 8.230 nan 0.000 0.437 5703 R N -0.143 120.353 120.500 -0.006 0.000 2.075 5703 R HA -0.108 4.232 4.340 0.000 0.000 0.232 5703 R C 1.891 178.188 176.300 -0.005 0.000 1.126 5703 R CA 1.238 57.336 56.100 -0.004 0.000 0.963 5703 R CB 0.092 30.391 30.300 -0.002 0.000 0.858 5703 R HN 0.337 nan 8.270 nan 0.000 0.435 5704 E N 0.884 121.080 120.200 -0.006 0.000 2.086 5704 E HA -0.051 4.299 4.350 0.000 0.000 0.190 5704 E C 1.282 177.876 176.600 -0.009 0.000 0.975 5704 E CA 0.466 56.862 56.400 -0.006 0.000 0.813 5704 E CB -0.358 29.340 29.700 -0.004 0.000 0.768 5704 E HN 0.448 nan 8.360 nan 0.000 0.457 5705 M N -0.021 119.571 119.600 -0.013 0.000 2.240 5705 M HA 0.103 4.583 4.480 0.000 0.000 0.317 5705 M C 0.498 176.786 176.300 -0.020 0.000 1.087 5705 M CA 0.330 55.619 55.300 -0.019 0.000 1.176 5705 M CB 0.571 33.157 32.600 -0.024 0.000 1.439 5705 M HN -0.260 nan 8.290 nan 0.000 0.452 5706 S N 2.320 118.005 115.700 -0.025 0.000 2.473 5706 S HA 0.430 4.900 4.470 0.000 0.000 0.312 5706 S C -0.651 173.924 174.600 -0.041 0.000 1.087 5706 S CA -0.801 57.384 58.200 -0.026 0.000 1.077 5706 S CB -0.236 62.950 63.200 -0.022 0.000 1.065 5706 S HN 0.521 nan 8.310 nan 0.000 0.510 5707 V N 5.070 124.962 119.914 -0.036 0.000 2.546 5707 V HA 0.332 4.452 4.120 0.000 0.000 0.284 5707 V C 1.118 177.188 176.094 -0.041 0.000 1.050 5707 V CA -0.229 62.041 62.300 -0.051 0.000 0.981 5707 V CB 1.513 33.317 31.823 -0.031 0.000 0.990 5707 V HN 0.913 nan 8.190 nan 0.000 0.474 5708 E N 2.474 122.629 120.200 -0.076 0.000 2.256 5708 E HA 0.076 4.426 4.350 0.000 0.000 0.198 5708 E C 0.579 177.228 176.600 0.080 0.000 0.908 5708 E CA 0.435 56.824 56.400 -0.019 0.000 0.915 5708 E CB 0.121 29.793 29.700 -0.046 0.000 0.890 5708 E HN 0.821 nan 8.360 nan 0.000 0.484 5709 H N 1.019 120.076 119.070 -0.023 0.000 2.848 5709 H HA 0.065 4.621 4.556 -0.000 0.000 0.317 5709 H C -1.752 173.554 175.328 -0.035 0.000 1.046 5709 H CA -1.630 54.391 56.048 -0.046 0.000 1.470 5709 H CB 1.368 31.088 29.762 -0.069 0.000 1.483 5709 H HN 0.156 nan 8.280 nan 0.000 0.548 5710 P HA -0.200 nan 4.420 nan 0.000 0.215 5710 P C 1.265 178.580 177.300 0.024 0.000 1.153 5710 P CA 1.503 64.625 63.100 0.036 0.000 0.853 5710 P CB 0.215 31.925 31.700 0.018 0.000 0.788 5711 A N -0.024 122.800 122.820 0.007 0.000 1.930 5711 A HA -0.072 4.248 4.320 0.000 0.000 0.217 5711 A C 2.315 179.914 177.584 0.024 0.000 1.175 5711 A CA 1.929 53.967 52.037 0.001 0.000 0.627 5711 A CB -1.565 17.415 19.000 -0.032 0.000 0.815 5711 A HN 0.187 nan 8.150 nan 0.000 0.443 5712 A N 0.080 122.931 122.820 0.052 0.000 1.933 5712 A HA -0.164 4.156 4.320 0.000 0.000 0.218 5712 A C 2.052 179.650 177.584 0.023 0.000 1.175 5712 A CA 1.755 53.817 52.037 0.041 0.000 0.628 5712 A CB -0.425 18.604 19.000 0.047 0.000 0.814 5712 A HN 0.553 nan 8.150 nan 0.000 0.444 5713 K N -0.955 119.460 120.400 0.026 0.000 2.209 5713 K HA -0.056 4.264 4.320 0.000 0.000 0.204 5713 K C 1.822 178.431 176.600 0.015 0.000 1.048 5713 K CA 1.211 57.509 56.287 0.017 0.000 0.940 5713 K CB -0.190 32.323 32.500 0.020 0.000 0.729 5713 K HN 0.387 nan 8.250 nan 0.000 0.451 5714 M N 0.379 119.988 119.600 0.016 0.000 2.236 5714 M HA -0.042 4.439 4.480 0.000 0.000 0.266 5714 M C 2.178 178.487 176.300 0.014 0.000 1.070 5714 M CA 1.139 56.448 55.300 0.015 0.000 1.137 5714 M CB -0.664 31.945 32.600 0.015 0.000 1.378 5714 M HN 0.176 nan 8.290 nan 0.000 0.426 5715 L N 0.328 121.559 121.223 0.014 0.000 2.131 5715 L HA -0.197 4.143 4.340 0.000 0.000 0.210 5715 L C 2.249 179.124 176.870 0.008 0.000 1.092 5715 L CA 0.889 55.736 54.840 0.012 0.000 0.759 5715 L CB -0.220 41.846 42.059 0.011 0.000 0.903 5715 L HN 0.187 nan 8.230 nan 0.000 0.435 5716 I N -0.241 120.333 120.570 0.007 0.000 2.248 5716 I HA -0.350 3.820 4.170 0.000 0.000 0.248 5716 I C 2.376 178.496 176.117 0.005 0.000 1.107 5716 I CA 1.330 62.632 61.300 0.004 0.000 1.373 5716 I CB -0.213 37.789 38.000 0.003 0.000 1.055 5716 I HN 0.305 nan 8.210 nan 0.000 0.418 5717 E N 0.599 120.804 120.200 0.007 0.000 2.153 5717 E HA -0.153 4.197 4.350 0.000 0.000 0.194 5717 E C 2.135 178.740 176.600 0.008 0.000 0.988 5717 E CA 0.963 57.368 56.400 0.008 0.000 0.811 5717 E CB 0.003 29.709 29.700 0.010 0.000 0.746 5717 E HN 0.265 nan 8.360 nan 0.000 0.466 5718 V N 0.559 120.478 119.914 0.009 0.000 2.295 5718 V HA -0.287 3.833 4.120 0.000 0.000 0.246 5718 V C 2.304 178.401 176.094 0.004 0.000 1.049 5718 V CA 1.892 64.198 62.300 0.009 0.000 1.024 5718 V CB -0.895 30.933 31.823 0.010 0.000 0.648 5718 V HN 0.444 nan 8.190 nan 0.000 0.447 5719 A N -0.493 122.328 122.820 0.002 0.000 1.972 5719 A HA -0.220 4.100 4.320 0.000 0.000 0.219 5719 A C 2.280 179.864 177.584 0.000 0.000 1.169 5719 A CA 1.846 53.883 52.037 -0.001 0.000 0.635 5719 A CB -0.403 18.596 19.000 -0.002 0.000 0.810 5719 A HN 0.557 nan 8.150 nan 0.000 0.446 5720 K N -0.535 119.867 120.400 0.002 0.000 2.097 5720 K HA -0.101 4.219 4.320 0.000 0.000 0.205 5720 K C 2.188 178.790 176.600 0.002 0.000 1.050 5720 K CA 1.726 58.014 56.287 0.002 0.000 0.938 5720 K CB -0.304 32.198 32.500 0.003 0.000 0.718 5720 K HN 0.729 nan 8.250 nan 0.000 0.442 5721 T N -1.304 113.252 114.554 0.004 0.000 2.951 5721 T HA -0.138 4.213 4.350 0.000 0.000 0.268 5721 T C 1.985 176.687 174.700 0.003 0.000 1.073 5721 T CA 0.816 62.918 62.100 0.004 0.000 1.134 5721 T CB -0.001 68.870 68.868 0.006 0.000 0.884 5721 T HN 0.034 nan 8.240 nan 0.000 0.479 5722 Q N 1.209 121.011 119.800 0.002 0.000 2.079 5722 Q HA -0.068 4.272 4.340 0.000 0.000 0.200 5722 Q C 2.439 178.439 176.000 0.001 0.000 0.974 5722 Q CA 1.452 57.255 55.803 0.001 0.000 0.840 5722 Q CB -0.398 28.340 28.738 -0.000 0.000 0.898 5722 Q HN 0.523 nan 8.270 nan 0.000 0.430 5723 E N -0.085 120.115 120.200 0.000 0.000 2.085 5723 E HA -0.205 4.145 4.350 0.000 0.000 0.194 5723 E C 1.613 178.213 176.600 -0.000 0.000 0.994 5723 E CA 1.150 57.550 56.400 -0.000 0.000 0.801 5723 E CB 0.157 29.857 29.700 -0.001 0.000 0.743 5723 E HN 0.233 nan 8.360 nan 0.000 0.453 5724 K N 0.378 120.778 120.400 0.000 0.000 2.031 5724 K HA -0.133 4.187 4.320 0.000 0.000 0.205 5724 K C 2.129 178.729 176.600 0.000 0.000 1.049 5724 K CA 1.070 57.357 56.287 -0.000 0.000 0.939 5724 K CB -0.279 32.221 32.500 0.000 0.000 0.717 5724 K HN 0.051 nan 8.250 nan 0.000 0.438 5725 E N 0.839 121.040 120.200 0.001 0.000 2.076 5725 E HA -0.107 4.243 4.350 0.000 0.000 0.190 5725 E C 1.720 178.320 176.600 0.001 0.000 0.979 5725 E CA 1.299 57.700 56.400 0.001 0.000 0.807 5725 E CB 0.285 29.986 29.700 0.002 0.000 0.761 5725 E HN 0.088 nan 8.360 nan 0.000 0.454 5726 V N -4.928 114.987 119.914 0.001 0.000 3.473 5726 V HA 0.584 4.704 4.120 0.000 0.000 0.253 5726 V C 1.484 177.579 176.094 0.001 0.000 1.340 5726 V CA 0.851 63.151 62.300 0.001 0.000 1.103 5726 V CB 0.450 32.275 31.823 0.002 0.000 0.881 5726 V HN 0.340 nan 8.190 nan 0.000 0.451 5727 G N 0.687 109.487 108.800 0.000 0.000 3.586 5727 G HA2 -0.265 3.695 3.960 0.000 0.000 0.212 5727 G HA3 -0.265 3.695 3.960 0.000 0.000 0.212 5727 G C 0.166 175.067 174.900 0.001 0.000 1.411 5727 G CA 0.468 45.569 45.100 0.000 0.000 0.898 5727 G HN 0.654 nan 8.290 nan 0.000 0.575 5728 D N 1.167 121.568 120.400 0.002 0.000 2.478 5728 D HA 0.480 5.120 4.640 0.000 0.000 0.269 5728 D C 1.537 177.837 176.300 0.000 0.000 1.232 5728 D CA 1.219 55.220 54.000 0.002 0.000 1.059 5728 D CB 0.615 41.418 40.800 0.005 0.000 1.104 5728 D HN 1.612 nan 8.370 nan 0.000 0.566 5729 G N -0.344 108.455 108.800 -0.001 0.000 2.153 5729 G HA2 -0.326 3.634 3.960 0.000 0.000 0.252 5729 G HA3 -0.326 3.634 3.960 0.000 0.000 0.252 5729 G C 1.037 175.932 174.900 -0.008 0.000 0.994 5729 G CA 1.515 46.612 45.100 -0.005 0.000 0.698 5729 G HN 0.584 nan 8.290 nan 0.000 0.521 5730 T N -2.946 111.604 114.554 -0.006 0.000 2.746 5730 T HA -0.113 4.237 4.350 0.000 0.000 0.267 5730 T C 2.215 176.909 174.700 -0.010 0.000 1.039 5730 T CA 2.420 64.516 62.100 -0.007 0.000 1.142 5730 T CB -0.565 68.300 68.868 -0.005 0.000 0.866 5730 T HN 0.308 nan 8.240 nan 0.000 0.444 5731 T N 2.009 116.555 114.554 -0.013 0.000 2.737 5731 T HA -0.087 4.263 4.350 0.000 0.000 0.265 5731 T C 2.280 176.967 174.700 -0.022 0.000 1.038 5731 T CA 1.816 63.906 62.100 -0.017 0.000 1.144 5731 T CB -0.989 67.868 68.868 -0.019 0.000 0.866 5731 T HN 0.518 nan 8.240 nan 0.000 0.434 5732 T N 2.232 116.772 114.554 -0.022 0.000 2.665 5732 T HA -0.135 4.215 4.350 0.000 0.000 0.268 5732 T C 2.371 177.052 174.700 -0.032 0.000 1.035 5732 T CA 1.335 63.418 62.100 -0.029 0.000 1.151 5732 T CB -0.631 68.222 68.868 -0.025 0.000 0.862 5732 T HN 0.447 nan 8.240 nan 0.000 0.438 5733 A N 0.760 123.566 122.820 -0.023 0.000 1.940 5733 A HA -0.057 4.263 4.320 0.000 0.000 0.219 5733 A C 2.592 180.162 177.584 -0.023 0.000 1.176 5733 A CA 1.456 53.480 52.037 -0.021 0.000 0.631 5733 A CB -0.910 18.083 19.000 -0.011 0.000 0.814 5733 A HN 0.385 nan 8.150 nan 0.000 0.446 5734 V N -0.653 119.249 119.914 -0.020 0.000 2.379 5734 V HA -0.178 3.942 4.120 0.000 0.000 0.245 5734 V C 2.552 178.630 176.094 -0.028 0.000 1.044 5734 V CA 1.734 64.023 62.300 -0.019 0.000 1.036 5734 V CB -0.629 31.184 31.823 -0.015 0.000 0.664 5734 V HN 0.363 nan 8.190 nan 0.000 0.453 5735 V N -0.448 119.445 119.914 -0.034 0.000 2.295 5735 V HA -0.218 3.902 4.120 0.000 0.000 0.246 5735 V C 2.465 178.523 176.094 -0.059 0.000 1.049 5735 V CA 2.130 64.405 62.300 -0.043 0.000 1.024 5735 V CB -0.377 31.419 31.823 -0.044 0.000 0.648 5735 V HN 0.425 nan 8.190 nan 0.000 0.447 5736 V N -0.021 119.850 119.914 -0.072 0.000 2.515 5736 V HA -0.183 3.937 4.120 0.000 0.000 0.250 5736 V C 2.525 178.548 176.094 -0.118 0.000 1.058 5736 V CA 1.997 64.230 62.300 -0.112 0.000 1.064 5736 V CB -0.277 31.472 31.823 -0.124 0.000 0.675 5736 V HN 0.522 nan 8.190 nan 0.000 0.461 5737 A N -0.136 122.641 122.820 -0.071 0.000 1.898 5737 A HA 0.004 4.324 4.320 0.000 0.000 0.216 5737 A C 2.342 179.910 177.584 -0.027 0.000 1.181 5737 A CA 1.702 53.715 52.037 -0.041 0.000 0.620 5737 A CB -1.233 17.761 19.000 -0.012 0.000 0.819 5737 A HN 0.599 nan 8.150 nan 0.000 0.442 5738 G N -0.494 108.289 108.800 -0.029 0.000 2.408 5738 G HA2 -0.202 3.758 3.960 0.000 0.000 0.217 5738 G HA3 -0.202 3.758 3.960 0.000 0.000 0.217 5738 G C 1.461 176.347 174.900 -0.024 0.000 1.150 5738 G CA 1.286 46.376 45.100 -0.018 0.000 0.776 5738 G HN 0.583 nan 8.290 nan 0.000 0.542 5739 E N 0.249 120.419 120.200 -0.051 0.000 2.107 5739 E HA 0.041 4.391 4.350 0.000 0.000 0.191 5739 E C 2.454 179.014 176.600 -0.067 0.000 0.982 5739 E CA 0.432 56.795 56.400 -0.063 0.000 0.809 5739 E CB -0.350 29.294 29.700 -0.093 0.000 0.756 5739 E HN 0.416 nan 8.360 nan 0.000 0.459 5740 L N 0.031 121.194 121.223 -0.100 0.000 2.083 5740 L HA -0.159 4.181 4.340 0.000 0.000 0.209 5740 L C 2.371 179.303 176.870 0.104 0.000 1.083 5740 L CA 0.946 55.728 54.840 -0.096 0.000 0.752 5740 L CB -0.335 41.619 42.059 -0.176 0.000 0.899 5740 L HN 0.249 nan 8.230 nan 0.000 0.433 5741 L N -0.866 120.404 121.223 0.077 0.000 2.156 5741 L HA -0.165 4.175 4.340 0.000 0.000 0.208 5741 L C 2.731 179.637 176.870 0.061 0.000 1.095 5741 L CA 0.607 55.499 54.840 0.088 0.000 0.770 5741 L CB -0.385 41.703 42.059 0.049 0.000 0.914 5741 L HN 0.202 nan 8.230 nan 0.000 0.439 5742 R N 0.902 121.423 120.500 0.034 0.000 2.081 5742 R HA -0.169 4.171 4.340 0.000 0.000 0.235 5742 R C 2.115 178.439 176.300 0.040 0.000 1.131 5742 R CA 1.593 57.707 56.100 0.023 0.000 0.960 5742 R CB -0.097 30.204 30.300 0.003 0.000 0.856 5742 R HN 0.008 nan 8.270 nan 0.000 0.436 5743 K N -0.237 120.198 120.400 0.059 0.000 2.155 5743 K HA 0.144 4.464 4.320 0.000 0.000 0.203 5743 K C 1.816 178.500 176.600 0.141 0.000 1.052 5743 K CA 1.303 57.644 56.287 0.090 0.000 0.948 5743 K CB -0.282 32.271 32.500 0.088 0.000 0.728 5743 K HN 0.291 nan 8.250 nan 0.000 0.448 5744 A N 0.752 123.684 122.820 0.187 0.000 1.902 5744 A HA -0.218 4.102 4.320 0.000 0.000 0.217 5744 A C 2.122 179.732 177.584 0.042 0.000 1.181 5744 A CA 1.809 53.929 52.037 0.137 0.000 0.623 5744 A CB -0.480 18.608 19.000 0.148 0.000 0.818 5744 A HN 0.442 nan 8.150 nan 0.000 0.443 5745 E N -0.323 119.900 120.200 0.039 0.000 2.110 5745 E HA -0.215 4.135 4.350 0.000 0.000 0.193 5745 E C 1.722 178.330 176.600 0.012 0.000 0.988 5745 E CA 1.239 57.647 56.400 0.013 0.000 0.804 5745 E CB -0.056 29.650 29.700 0.010 0.000 0.745 5745 E HN 0.563 nan 8.360 nan 0.000 0.458 5746 E N 0.224 120.439 120.200 0.026 0.000 2.106 5746 E HA -0.160 4.190 4.350 0.000 0.000 0.192 5746 E C 2.088 178.701 176.600 0.022 0.000 0.984 5746 E CA 0.555 56.969 56.400 0.024 0.000 0.806 5746 E CB -0.072 29.647 29.700 0.031 0.000 0.750 5746 E HN 0.274 nan 8.360 nan 0.000 0.458 5747 L N 0.436 121.677 121.223 0.029 0.000 2.156 5747 L HA -0.086 4.254 4.340 0.000 0.000 0.208 5747 L C 2.383 179.249 176.870 -0.006 0.000 1.095 5747 L CA 1.050 55.902 54.840 0.020 0.000 0.770 5747 L CB -0.673 41.403 42.059 0.028 0.000 0.914 5747 L HN 0.084 nan 8.230 nan 0.000 0.439 5748 L N -0.963 120.249 121.223 -0.019 0.000 2.093 5748 L HA -0.187 4.153 4.340 0.000 0.000 0.208 5748 L C 1.980 178.836 176.870 -0.024 0.000 1.085 5748 L CA 0.909 55.728 54.840 -0.035 0.000 0.755 5748 L CB -0.525 41.509 42.059 -0.042 0.000 0.904 5748 L HN 0.232 nan 8.230 nan 0.000 0.435 5749 D N -0.568 119.825 120.400 -0.011 0.000 2.224 5749 D HA -0.133 4.507 4.640 0.000 0.000 0.205 5749 D C 2.016 178.315 176.300 -0.002 0.000 0.965 5749 D CA 0.804 54.800 54.000 -0.006 0.000 0.852 5749 D CB -0.029 40.771 40.800 -0.000 0.000 0.947 5749 D HN 0.262 nan 8.370 nan 0.000 0.494 5750 Q N 0.470 120.272 119.800 0.002 0.000 2.415 5750 Q HA -0.007 4.333 4.340 0.000 0.000 0.206 5750 Q C 0.046 176.050 176.000 0.006 0.000 0.946 5750 Q CA 0.010 55.817 55.803 0.007 0.000 0.951 5750 Q CB -0.160 28.587 28.738 0.015 0.000 1.026 5750 Q HN 0.176 nan 8.270 nan 0.000 0.510 5751 N N -0.337 118.361 118.700 -0.002 0.000 2.754 5751 N HA -0.155 4.585 4.740 0.000 0.000 0.248 5751 N C -1.365 174.149 175.510 0.008 0.000 1.093 5751 N CA 0.301 53.349 53.050 -0.002 0.000 0.699 5751 N CB -1.297 37.193 38.487 0.005 0.000 1.016 5751 N HN -0.028 nan 8.380 nan 0.000 0.552 5752 V N 2.116 122.030 119.914 0.001 0.000 2.385 5752 V HA 0.129 4.249 4.120 0.000 0.000 0.269 5752 V C 1.001 177.098 176.094 0.005 0.000 1.043 5752 V CA -0.799 61.510 62.300 0.014 0.000 0.906 5752 V CB 1.029 32.855 31.823 0.005 0.000 0.995 5752 V HN 0.348 nan 8.190 nan 0.000 0.467 5753 H N 8.247 127.300 119.070 -0.028 0.000 3.094 5753 H HA 0.016 4.573 4.556 0.000 0.000 0.320 5753 H C -1.667 173.633 175.328 -0.046 0.000 1.000 5753 H CA -1.054 54.976 56.048 -0.030 0.000 1.413 5753 H CB 1.574 31.321 29.762 -0.025 0.000 1.405 5753 H HN 0.385 nan 8.280 nan 0.000 0.586 5754 P HA -0.187 nan 4.420 nan 0.000 0.217 5754 P C 1.429 178.750 177.300 0.035 0.000 1.148 5754 P CA 2.566 65.598 63.100 -0.113 0.000 0.834 5754 P CB 0.025 31.619 31.700 -0.178 0.000 0.783 5755 T N -4.233 110.483 114.554 0.270 0.000 2.995 5755 T HA -0.034 4.316 4.350 0.000 0.000 0.269 5755 T C 1.703 176.436 174.700 0.056 0.000 1.091 5755 T CA 0.655 62.843 62.100 0.146 0.000 1.128 5755 T CB -0.754 68.187 68.868 0.122 0.000 0.891 5755 T HN -0.082 nan 8.240 nan 0.000 0.492 5756 I N 1.194 121.807 120.570 0.072 0.000 2.333 5756 I HA 0.010 4.180 4.170 0.000 0.000 0.246 5756 I C 2.657 178.748 176.117 -0.044 0.000 1.106 5756 I CA 0.501 61.810 61.300 0.014 0.000 1.411 5756 I CB -1.105 36.915 38.000 0.033 0.000 1.082 5756 I HN 0.175 nan 8.210 nan 0.000 0.420 5757 V N 1.547 121.400 119.914 -0.102 0.000 2.295 5757 V HA -0.219 3.901 4.120 0.000 0.000 0.246 5757 V C 2.732 178.570 176.094 -0.426 0.000 1.049 5757 V CA 1.993 64.116 62.300 -0.295 0.000 1.024 5757 V CB -0.801 30.826 31.823 -0.326 0.000 0.648 5757 V HN 0.414 nan 8.190 nan 0.000 0.447 5758 V N -0.890 118.889 119.914 -0.225 0.000 2.667 5758 V HA -0.106 4.014 4.120 0.000 0.000 0.252 5758 V C 2.360 178.436 176.094 -0.030 0.000 1.065 5758 V CA 2.115 64.342 62.300 -0.123 0.000 1.083 5758 V CB -0.684 31.107 31.823 -0.053 0.000 0.692 5758 V HN 0.493 nan 8.190 nan 0.000 0.468 5759 K N 2.233 122.617 120.400 -0.027 0.000 2.025 5759 K HA 0.098 4.418 4.320 0.000 0.000 0.207 5759 K C 2.137 178.754 176.600 0.029 0.000 1.049 5759 K CA 2.081 58.370 56.287 0.004 0.000 0.933 5759 K CB -1.326 31.174 32.500 -0.001 0.000 0.714 5759 K HN 0.435 nan 8.250 nan 0.000 0.438 5760 G N -0.749 108.076 108.800 0.041 0.000 2.422 5760 G HA2 -0.216 3.744 3.960 0.000 0.000 0.218 5760 G HA3 -0.216 3.744 3.960 0.000 0.000 0.218 5760 G C 1.169 176.173 174.900 0.172 0.000 1.146 5760 G CA 0.828 45.998 45.100 0.117 0.000 0.769 5760 G HN 0.290 nan 8.290 nan 0.000 0.547 5761 Y N 0.309 120.559 120.300 -0.083 0.000 2.314 5761 Y HA -0.014 4.536 4.550 0.000 0.000 0.293 5761 Y C 2.860 178.581 175.900 -0.298 0.000 1.129 5761 Y CA 0.895 58.873 58.100 -0.202 0.000 1.201 5761 Y CB -0.785 37.717 38.460 0.070 0.000 0.999 5761 Y HN 0.260 nan 8.280 nan 0.000 0.541 5762 Q N 0.385 120.206 119.800 0.035 0.000 2.079 5762 Q HA -0.056 4.284 4.340 0.000 0.000 0.200 5762 Q C 2.357 178.310 176.000 -0.077 0.000 0.974 5762 Q CA 1.753 57.547 55.803 -0.015 0.000 0.840 5762 Q CB -0.473 28.274 28.738 0.015 0.000 0.898 5762 Q HN 0.324 nan 8.270 nan 0.000 0.430 5763 A N 0.251 123.047 122.820 -0.041 0.000 1.873 5763 A HA -0.003 4.317 4.320 0.000 0.000 0.215 5763 A C 2.271 179.788 177.584 -0.111 0.000 1.186 5763 A CA 1.870 53.913 52.037 0.010 0.000 0.616 5763 A CB -1.143 17.942 19.000 0.141 0.000 0.823 5763 A HN 0.498 nan 8.150 nan 0.000 0.442 5764 A N -0.342 122.316 122.820 -0.270 0.000 1.930 5764 A HA 0.249 4.569 4.320 0.000 0.000 0.217 5764 A C 2.443 179.622 177.584 -0.676 0.000 1.175 5764 A CA 1.819 53.541 52.037 -0.526 0.000 0.627 5764 A CB -0.843 17.680 19.000 -0.795 0.000 0.815 5764 A HN 0.990 nan 8.150 nan 0.000 0.443 5765 A N -1.150 121.225 122.820 -0.741 0.000 1.930 5765 A HA -0.124 4.197 4.320 0.000 0.000 0.217 5765 A C 2.093 179.580 177.584 -0.160 0.000 1.175 5765 A CA 1.445 53.297 52.037 -0.309 0.000 0.627 5765 A CB -0.377 18.531 19.000 -0.152 0.000 0.815 5765 A HN 0.461 nan 8.150 nan 0.000 0.443 5766 Q N -0.295 119.400 119.800 -0.175 0.000 2.124 5766 Q HA -0.167 4.173 4.340 0.000 0.000 0.202 5766 Q C 2.003 177.901 176.000 -0.170 0.000 0.977 5766 Q CA 1.817 57.544 55.803 -0.126 0.000 0.850 5766 Q CB -0.301 28.382 28.738 -0.091 0.000 0.901 5766 Q HN 0.619 nan 8.270 nan 0.000 0.429 5767 K N 0.888 121.109 120.400 -0.298 0.000 2.103 5767 K HA 0.029 4.349 4.320 0.000 0.000 0.204 5767 K C 1.843 178.317 176.600 -0.211 0.000 1.052 5767 K CA 1.175 57.236 56.287 -0.376 0.000 0.945 5767 K CB -0.413 31.592 32.500 -0.824 0.000 0.722 5767 K HN 0.111 nan 8.250 nan 0.000 0.443 5768 A N 0.354 123.084 122.820 -0.150 0.000 1.933 5768 A HA -0.206 4.114 4.320 0.000 0.000 0.218 5768 A C 2.150 179.719 177.584 -0.025 0.000 1.175 5768 A CA 1.844 53.861 52.037 -0.033 0.000 0.628 5768 A CB -0.653 18.399 19.000 0.086 0.000 0.814 5768 A HN 0.456 nan 8.150 nan 0.000 0.444 5769 Q N 0.097 119.873 119.800 -0.040 0.000 2.084 5769 Q HA -0.183 4.157 4.340 0.000 0.000 0.202 5769 Q C 1.951 177.932 176.000 -0.032 0.000 0.978 5769 Q CA 2.253 58.040 55.803 -0.027 0.000 0.844 5769 Q CB -0.353 28.368 28.738 -0.028 0.000 0.898 5769 Q HN 0.763 nan 8.270 nan 0.000 0.426 5770 E N -0.591 119.577 120.200 -0.053 0.000 2.077 5770 E HA -0.170 4.180 4.350 0.000 0.000 0.193 5770 E C 1.903 178.483 176.600 -0.034 0.000 0.989 5770 E CA 1.114 57.487 56.400 -0.045 0.000 0.800 5770 E CB -0.151 29.511 29.700 -0.064 0.000 0.746 5770 E HN 0.452 nan 8.360 nan 0.000 0.452 5771 L N 0.583 121.781 121.223 -0.041 0.000 2.083 5771 L HA -0.188 4.152 4.340 0.000 0.000 0.209 5771 L C 2.547 179.414 176.870 -0.003 0.000 1.083 5771 L CA 0.708 55.536 54.840 -0.020 0.000 0.752 5771 L CB -0.299 41.748 42.059 -0.021 0.000 0.899 5771 L HN 0.258 nan 8.230 nan 0.000 0.433 5772 L N -0.389 120.831 121.223 -0.005 0.000 2.056 5772 L HA -0.202 4.138 4.340 0.000 0.000 0.207 5772 L C 2.527 179.398 176.870 0.002 0.000 1.078 5772 L CA 1.358 56.199 54.840 0.003 0.000 0.749 5772 L CB -0.389 41.672 42.059 0.002 0.000 0.901 5772 L HN 0.198 nan 8.230 nan 0.000 0.433 5773 K N -0.886 119.512 120.400 -0.003 0.000 2.362 5773 K HA -0.073 4.247 4.320 0.000 0.000 0.200 5773 K C 1.855 178.455 176.600 -0.001 0.000 1.046 5773 K CA 1.250 57.535 56.287 -0.002 0.000 0.952 5773 K CB -0.058 32.438 32.500 -0.006 0.000 0.753 5773 K HN 0.283 nan 8.250 nan 0.000 0.466 5774 T N 1.272 115.826 114.554 -0.000 0.000 3.035 5774 T HA 0.046 4.396 4.350 0.000 0.000 0.259 5774 T C 1.735 176.440 174.700 0.007 0.000 1.078 5774 T CA 0.568 62.669 62.100 0.002 0.000 1.132 5774 T CB 0.070 68.939 68.868 0.001 0.000 0.900 5774 T HN 0.347 nan 8.240 nan 0.000 0.480 5775 I N -0.859 119.718 120.570 0.012 0.000 3.968 5775 I HA 0.536 4.706 4.170 0.000 0.000 0.328 5775 I C 0.941 177.067 176.117 0.015 0.000 1.290 5775 I CA -0.672 60.638 61.300 0.018 0.000 1.163 5775 I CB -0.254 37.766 38.000 0.033 0.000 1.024 5775 I HN -0.095 nan 8.210 nan 0.000 0.413 5776 A N 1.596 124.423 122.820 0.011 0.000 2.546 5776 A HA 0.129 4.449 4.320 0.000 0.000 0.243 5776 A C 0.083 177.671 177.584 0.007 0.000 1.063 5776 A CA 0.032 52.075 52.037 0.009 0.000 0.757 5776 A CB -0.244 18.760 19.000 0.006 0.000 0.991 5776 A HN 0.640 nan 8.150 nan 0.000 0.503 5777 C N 3.663 122.968 119.300 0.008 0.000 2.255 5777 C HA 0.539 4.999 4.460 0.000 0.000 0.326 5777 C C 0.355 175.348 174.990 0.005 0.000 1.258 5777 C CA -0.641 58.381 59.018 0.006 0.000 1.676 5777 C CB -0.346 27.398 27.740 0.008 0.000 2.314 5777 C HN 0.941 nan 8.230 nan 0.000 0.509 5778 E N 3.680 123.882 120.200 0.004 0.000 2.351 5778 E HA 0.405 4.755 4.350 0.000 0.000 0.266 5778 E C -0.093 176.509 176.600 0.003 0.000 1.031 5778 E CA 0.229 56.631 56.400 0.003 0.000 0.911 5778 E CB 0.643 30.345 29.700 0.002 0.000 0.986 5778 E HN 0.712 nan 8.360 nan 0.000 0.446 5779 V N 1.475 121.390 119.914 0.003 0.000 3.102 5779 V HA 0.840 4.960 4.120 0.000 0.000 0.312 5779 V C 0.514 176.610 176.094 0.003 0.000 1.135 5779 V CA -0.793 61.509 62.300 0.003 0.000 1.022 5779 V CB 1.646 33.470 31.823 0.003 0.000 1.056 5779 V HN 0.672 nan 8.190 nan 0.000 0.436 5780 G N 0.423 109.225 108.800 0.002 0.000 2.343 5780 G HA2 0.463 4.423 3.960 0.000 0.000 0.254 5780 G HA3 0.463 4.423 3.960 0.000 0.000 0.254 5780 G C 0.994 175.896 174.900 0.003 0.000 1.277 5780 G CA 0.193 45.294 45.100 0.003 0.000 0.909 5780 G HN 1.671 nan 8.290 nan 0.000 0.502 5781 A N 2.140 124.962 122.820 0.003 0.000 1.940 5781 A HA -0.123 4.197 4.320 0.000 0.000 0.219 5781 A C 1.930 179.516 177.584 0.004 0.000 1.176 5781 A CA 1.855 53.894 52.037 0.004 0.000 0.631 5781 A CB -0.069 18.934 19.000 0.004 0.000 0.814 5781 A HN 0.641 nan 8.150 nan 0.000 0.446 5782 Q N -0.482 119.321 119.800 0.004 0.000 2.155 5782 Q HA 0.120 4.460 4.340 0.000 0.000 0.220 5782 Q C -0.829 175.173 176.000 0.003 0.000 0.819 5782 Q CA -0.267 55.538 55.803 0.004 0.000 1.032 5782 Q CB 0.182 28.924 28.738 0.006 0.000 1.151 5782 Q HN 0.578 nan 8.270 nan 0.000 0.487 5783 D N 1.015 121.416 120.400 0.003 0.000 2.412 5783 D HA -0.073 4.567 4.640 0.000 0.000 0.257 5783 D C 1.262 177.563 176.300 0.001 0.000 1.217 5783 D CA 0.223 54.224 54.000 0.002 0.000 0.897 5783 D CB 0.906 41.707 40.800 0.002 0.000 1.132 5783 D HN -0.030 nan 8.370 nan 0.000 0.493 5784 K N 3.486 123.887 120.400 0.001 0.000 2.032 5784 K HA -0.266 4.054 4.320 0.000 0.000 0.218 5784 K C 1.238 177.837 176.600 -0.001 0.000 1.054 5784 K CA 1.547 57.834 56.287 -0.000 0.000 0.941 5784 K CB -0.019 32.481 32.500 -0.000 0.000 0.720 5784 K HN 0.584 nan 8.250 nan 0.000 0.449 5785 E N 0.568 120.767 120.200 -0.002 0.000 2.023 5785 E HA -0.203 4.147 4.350 0.000 0.000 0.196 5785 E C 2.134 178.732 176.600 -0.003 0.000 1.003 5785 E CA 1.181 57.580 56.400 -0.003 0.000 0.809 5785 E CB -0.457 29.242 29.700 -0.003 0.000 0.755 5785 E HN 0.324 nan 8.360 nan 0.000 0.449 5786 I N 0.726 121.295 120.570 -0.001 0.000 2.493 5786 I HA -0.211 3.959 4.170 0.000 0.000 0.254 5786 I C 2.085 178.202 176.117 0.000 0.000 1.160 5786 I CA 0.636 61.936 61.300 -0.000 0.000 1.445 5786 I CB -0.094 37.907 38.000 0.001 0.000 1.086 5786 I HN 0.013 nan 8.210 nan 0.000 0.433 5787 L N -0.153 121.070 121.223 0.000 0.000 2.093 5787 L HA -0.161 4.179 4.340 0.000 0.000 0.208 5787 L C 2.469 179.339 176.870 -0.001 0.000 1.085 5787 L CA 1.926 56.766 54.840 0.000 0.000 0.755 5787 L CB -1.360 40.699 42.059 0.000 0.000 0.904 5787 L HN 0.201 nan 8.230 nan 0.000 0.435 5788 T N -1.432 113.121 114.554 -0.002 0.000 2.867 5788 T HA -0.154 4.196 4.350 0.000 0.000 0.268 5788 T C 1.958 176.654 174.700 -0.005 0.000 1.057 5788 T CA 1.029 63.127 62.100 -0.004 0.000 1.136 5788 T CB 0.035 68.899 68.868 -0.006 0.000 0.874 5788 T HN 0.059 nan 8.240 nan 0.000 0.466 5789 K N 0.776 121.173 120.400 -0.004 0.000 2.103 5789 K HA 0.156 4.476 4.320 0.000 0.000 0.204 5789 K C 2.033 178.634 176.600 0.001 0.000 1.052 5789 K CA 0.535 56.820 56.287 -0.004 0.000 0.945 5789 K CB -0.336 32.162 32.500 -0.003 0.000 0.722 5789 K HN 0.201 nan 8.250 nan 0.000 0.443 5790 I N 0.741 121.312 120.570 0.003 0.000 2.142 5790 I HA -0.206 3.964 4.170 0.000 0.000 0.240 5790 I C 2.161 178.282 176.117 0.006 0.000 1.078 5790 I CA 1.502 62.805 61.300 0.006 0.000 1.343 5790 I CB -1.359 36.644 38.000 0.005 0.000 1.046 5790 I HN 0.082 nan 8.210 nan 0.000 0.405 5791 A N 0.639 123.462 122.820 0.004 0.000 1.883 5791 A HA -0.282 4.038 4.320 0.000 0.000 0.217 5791 A C 2.471 180.058 177.584 0.005 0.000 1.186 5791 A CA 2.206 54.245 52.037 0.004 0.000 0.624 5791 A CB -0.732 18.268 19.000 0.001 0.000 0.822 5791 A HN 0.480 nan 8.150 nan 0.000 0.444 5792 M N 0.307 119.908 119.600 0.002 0.000 2.086 5792 M HA -0.169 4.311 4.480 0.000 0.000 0.261 5792 M C 2.268 178.574 176.300 0.010 0.000 1.067 5792 M CA 2.555 57.855 55.300 -0.001 0.000 1.116 5792 M CB -0.505 32.088 32.600 -0.013 0.000 1.348 5792 M HN 0.600 nan 8.290 nan 0.000 0.407 5793 T N -2.458 112.105 114.554 0.015 0.000 2.867 5793 T HA -0.093 4.257 4.350 0.000 0.000 0.268 5793 T C 1.979 176.701 174.700 0.038 0.000 1.057 5793 T CA 1.590 63.710 62.100 0.033 0.000 1.136 5793 T CB -0.687 68.200 68.868 0.032 0.000 0.874 5793 T HN 0.486 nan 8.240 nan 0.000 0.466 5794 S N 1.163 116.878 115.700 0.025 0.000 2.355 5794 S HA -0.005 4.465 4.470 0.000 0.000 0.222 5794 S C 2.031 176.647 174.600 0.026 0.000 1.031 5794 S CA 0.935 59.148 58.200 0.022 0.000 0.993 5794 S CB -0.670 62.538 63.200 0.014 0.000 0.859 5794 S HN 0.585 nan 8.310 nan 0.000 0.453 5795 I N 1.714 122.299 120.570 0.024 0.000 2.264 5795 I HA -0.116 4.054 4.170 0.000 0.000 0.248 5795 I C 1.356 177.498 176.117 0.041 0.000 1.111 5795 I CA 1.018 62.334 61.300 0.026 0.000 1.382 5795 I CB -0.965 37.046 38.000 0.018 0.000 1.060 5795 I HN 0.452 nan 8.210 nan 0.000 0.418 5796 T N -0.764 113.826 114.554 0.059 0.000 2.900 5796 T HA 0.366 4.717 4.350 0.000 0.000 0.307 5796 T C 1.142 175.903 174.700 0.102 0.000 1.065 5796 T CA 0.056 62.219 62.100 0.106 0.000 1.105 5796 T CB 1.378 70.347 68.868 0.168 0.000 0.979 5796 T HN 0.599 nan 8.240 nan 0.000 0.544 5797 G N 1.402 110.272 108.800 0.117 0.000 2.176 5797 G HA2 -0.205 3.755 3.960 0.000 0.000 0.253 5797 G HA3 -0.205 3.755 3.960 0.000 0.000 0.253 5797 G C -0.040 174.882 174.900 0.036 0.000 0.979 5797 G CA 0.407 45.542 45.100 0.059 0.000 0.641 5797 G HN 0.935 nan 8.290 nan 0.000 0.530 5798 K N -0.906 119.520 120.400 0.044 0.000 2.352 5798 K HA 0.609 4.929 4.320 0.000 0.000 0.240 5798 K C 1.542 178.162 176.600 0.034 0.000 1.017 5798 K CA -0.539 55.766 56.287 0.030 0.000 0.851 5798 K CB 1.282 33.798 32.500 0.026 0.000 1.261 5798 K HN 0.169 nan 8.250 nan 0.000 0.451 5799 G N 0.395 109.211 108.800 0.027 0.000 2.448 5799 G HA2 -0.252 3.708 3.960 0.000 0.000 0.219 5799 G HA3 -0.252 3.708 3.960 0.000 0.000 0.219 5799 G C 1.266 176.182 174.900 0.028 0.000 1.127 5799 G CA 1.113 46.230 45.100 0.027 0.000 0.766 5799 G HN 0.614 nan 8.290 nan 0.000 0.552 5800 A N 1.531 124.367 122.820 0.026 0.000 2.121 5800 A HA 0.004 4.324 4.320 0.000 0.000 0.218 5800 A C 2.135 179.733 177.584 0.023 0.000 1.154 5800 A CA 1.671 53.722 52.037 0.023 0.000 0.679 5800 A CB -0.386 18.627 19.000 0.021 0.000 0.795 5800 A HN 0.656 nan 8.150 nan 0.000 0.458 5801 E N 0.526 120.744 120.200 0.031 0.000 2.401 5801 E HA -0.216 4.134 4.350 0.000 0.000 0.199 5801 E C 1.457 178.069 176.600 0.020 0.000 1.023 5801 E CA 1.227 57.646 56.400 0.031 0.000 0.859 5801 E CB -0.317 29.418 29.700 0.059 0.000 0.780 5801 E HN 0.612 nan 8.360 nan 0.000 0.523 5802 K N 0.492 120.904 120.400 0.021 0.000 2.147 5802 K HA -0.063 4.258 4.320 0.000 0.000 0.205 5802 K C 1.387 177.991 176.600 0.006 0.000 1.049 5802 K CA 1.289 57.585 56.287 0.014 0.000 0.936 5802 K CB 0.055 32.565 32.500 0.017 0.000 0.722 5802 K HN 0.229 nan 8.250 nan 0.000 0.446 5803 A N 1.269 124.093 122.820 0.006 0.000 2.676 5803 A HA 0.079 4.399 4.320 0.000 0.000 0.297 5803 A C 1.174 178.757 177.584 -0.000 0.000 1.132 5803 A CA -0.488 51.550 52.037 0.002 0.000 0.972 5803 A CB -0.097 18.906 19.000 0.006 0.000 1.197 5803 A HN 0.253 nan 8.150 nan 0.000 0.524 5804 K N 0.117 120.516 120.400 -0.002 0.000 2.286 5804 K HA -0.223 4.097 4.320 0.000 0.000 0.203 5804 K C 0.841 177.435 176.600 -0.009 0.000 1.045 5804 K CA 1.971 58.255 56.287 -0.004 0.000 0.935 5804 K CB -0.110 32.385 32.500 -0.009 0.000 0.737 5804 K HN 0.348 nan 8.250 nan 0.000 0.460 5805 E N 1.434 121.627 120.200 -0.013 0.000 2.046 5805 E HA -0.136 4.214 4.350 0.000 0.000 0.190 5805 E C 1.930 178.525 176.600 -0.007 0.000 0.982 5805 E CA 1.344 57.736 56.400 -0.013 0.000 0.800 5805 E CB -0.048 29.642 29.700 -0.016 0.000 0.756 5805 E HN 0.305 nan 8.360 nan 0.000 0.449 5806 K N 0.278 120.675 120.400 -0.004 0.000 2.057 5806 K HA -0.072 4.248 4.320 0.000 0.000 0.206 5806 K C 1.667 178.267 176.600 0.001 0.000 1.050 5806 K CA 0.794 57.080 56.287 -0.001 0.000 0.935 5806 K CB -0.228 32.273 32.500 0.002 0.000 0.715 5806 K HN -0.014 nan 8.250 nan 0.000 0.439 5807 L N 0.678 121.902 121.223 0.002 0.000 2.083 5807 L HA -0.000 4.340 4.340 0.000 0.000 0.209 5807 L C 2.301 179.172 176.870 0.002 0.000 1.083 5807 L CA 1.933 56.775 54.840 0.004 0.000 0.752 5807 L CB -1.149 40.913 42.059 0.006 0.000 0.899 5807 L HN 0.292 nan 8.230 nan 0.000 0.433 5808 A N -0.821 121.999 122.820 -0.000 0.000 1.902 5808 A HA -0.252 4.068 4.320 0.000 0.000 0.217 5808 A C 2.360 179.943 177.584 -0.002 0.000 1.181 5808 A CA 1.717 53.753 52.037 -0.002 0.000 0.623 5808 A CB -0.563 18.435 19.000 -0.004 0.000 0.818 5808 A HN 0.493 nan 8.150 nan 0.000 0.443 5809 E N -0.132 120.067 120.200 -0.002 0.000 2.077 5809 E HA -0.183 4.167 4.350 0.000 0.000 0.193 5809 E C 1.865 178.465 176.600 -0.000 0.000 0.989 5809 E CA 1.347 57.746 56.400 -0.001 0.000 0.800 5809 E CB -0.245 29.454 29.700 -0.001 0.000 0.746 5809 E HN 0.665 nan 8.360 nan 0.000 0.452 5810 I N 0.953 121.524 120.570 0.001 0.000 2.226 5810 I HA -0.271 3.899 4.170 0.000 0.000 0.245 5810 I C 2.223 178.340 176.117 -0.000 0.000 1.100 5810 I CA 0.642 61.944 61.300 0.002 0.000 1.374 5810 I CB -0.173 37.830 38.000 0.005 0.000 1.057 5810 I HN 0.259 nan 8.210 nan 0.000 0.413 5811 I N 0.526 121.095 120.570 -0.001 0.000 2.353 5811 I HA -0.141 4.029 4.170 0.000 0.000 0.248 5811 I C 2.680 178.795 176.117 -0.004 0.000 1.119 5811 I CA 1.419 62.718 61.300 -0.003 0.000 1.417 5811 I CB -1.017 36.982 38.000 -0.001 0.000 1.078 5811 I HN 0.199 nan 8.210 nan 0.000 0.421 5812 V N -1.110 118.802 119.914 -0.003 0.000 2.809 5812 V HA -0.120 4.000 4.120 0.000 0.000 0.256 5812 V C 2.179 178.270 176.094 -0.004 0.000 1.080 5812 V CA 1.580 63.878 62.300 -0.003 0.000 1.102 5812 V CB -0.819 31.003 31.823 -0.002 0.000 0.705 5812 V HN 0.433 nan 8.190 nan 0.000 0.475 5813 E N 1.080 121.278 120.200 -0.004 0.000 2.076 5813 E HA -0.038 4.312 4.350 0.000 0.000 0.190 5813 E C 2.206 178.799 176.600 -0.011 0.000 0.979 5813 E CA 1.120 57.517 56.400 -0.005 0.000 0.807 5813 E CB -0.241 29.457 29.700 -0.003 0.000 0.761 5813 E HN 0.641 nan 8.360 nan 0.000 0.454 5814 A N 0.741 123.554 122.820 -0.012 0.000 1.858 5814 A HA -0.139 4.181 4.320 0.000 0.000 0.216 5814 A C 2.387 179.958 177.584 -0.022 0.000 1.190 5814 A CA 1.608 53.634 52.037 -0.018 0.000 0.617 5814 A CB -0.780 18.211 19.000 -0.015 0.000 0.827 5814 A HN 0.226 nan 8.150 nan 0.000 0.443 5815 V N -0.282 119.623 119.914 -0.015 0.000 2.515 5815 V HA -0.169 3.951 4.120 0.000 0.000 0.250 5815 V C 2.762 178.848 176.094 -0.014 0.000 1.058 5815 V CA 2.153 64.445 62.300 -0.014 0.000 1.064 5815 V CB -0.590 31.228 31.823 -0.009 0.000 0.675 5815 V HN 0.671 nan 8.190 nan 0.000 0.461 5816 S N -0.010 115.683 115.700 -0.011 0.000 2.383 5816 S HA -0.119 4.351 4.470 0.000 0.000 0.227 5816 S C 2.108 176.699 174.600 -0.015 0.000 1.026 5816 S CA 1.459 59.654 58.200 -0.008 0.000 0.981 5816 S CB -0.186 63.012 63.200 -0.003 0.000 0.818 5816 S HN 0.597 nan 8.310 nan 0.000 0.472 5817 A N 1.066 123.867 122.820 -0.031 0.000 1.873 5817 A HA 0.025 4.346 4.320 0.000 0.000 0.215 5817 A C 2.374 179.903 177.584 -0.091 0.000 1.186 5817 A CA 1.756 53.756 52.037 -0.063 0.000 0.616 5817 A CB -0.983 17.976 19.000 -0.068 0.000 0.823 5817 A HN 0.941 nan 8.150 nan 0.000 0.442 5818 V N -3.064 116.811 119.914 -0.065 0.000 2.788 5818 V HA -0.008 4.112 4.120 0.000 0.000 0.251 5818 V C 2.093 178.166 176.094 -0.035 0.000 1.068 5818 V CA 1.485 63.747 62.300 -0.063 0.000 1.090 5818 V CB -0.548 31.246 31.823 -0.048 0.000 0.710 5818 V HN 0.205 nan 8.190 nan 0.000 0.467 5819 V N 0.498 120.400 119.914 -0.019 0.000 2.515 5819 V HA -0.093 4.027 4.120 0.000 0.000 0.250 5819 V C 1.610 177.714 176.094 0.015 0.000 1.058 5819 V CA 2.402 64.701 62.300 -0.002 0.000 1.064 5819 V CB -0.533 31.290 31.823 0.001 0.000 0.675 5819 V HN 0.869 nan 8.190 nan 0.000 0.461 5820 D N -0.757 119.657 120.400 0.024 0.000 4.344 5820 D HA -0.224 4.417 4.640 0.000 0.000 0.144 5820 D C 0.553 176.886 176.300 0.056 0.000 0.730 5820 D CA 1.935 55.979 54.000 0.073 0.000 1.156 5820 D CB -1.242 39.623 40.800 0.109 0.000 0.570 5820 D HN 0.565 nan 8.370 nan 0.000 0.533 5821 D N 1.634 122.062 120.400 0.047 0.000 2.398 5821 D HA 0.236 4.876 4.640 0.000 0.000 0.247 5821 D C -0.237 176.076 176.300 0.020 0.000 1.227 5821 D CA 0.168 54.186 54.000 0.030 0.000 0.980 5821 D CB 0.610 41.424 40.800 0.024 0.000 1.106 5821 D HN 0.261 nan 8.370 nan 0.000 0.493 5822 E N 0.027 120.236 120.200 0.015 0.000 2.079 5822 E HA 0.518 4.868 4.350 0.000 0.000 0.252 5822 E C -0.703 175.903 176.600 0.009 0.000 0.992 5822 E CA -0.509 55.898 56.400 0.011 0.000 0.829 5822 E CB -0.344 29.361 29.700 0.009 0.000 1.158 5822 E HN 0.515 nan 8.360 nan 0.000 0.435 5823 G N 2.744 111.549 108.800 0.008 0.000 2.358 5823 G HA2 0.173 4.134 3.960 0.000 0.000 0.303 5823 G HA3 0.173 4.134 3.960 0.000 0.000 0.303 5823 G C -1.867 173.037 174.900 0.007 0.000 1.537 5823 G CA -0.844 44.261 45.100 0.009 0.000 0.928 5823 G HN 0.194 nan 8.290 nan 0.000 0.656 5824 K N 0.435 120.839 120.400 0.006 0.000 2.561 5824 K HA 0.577 4.897 4.320 0.000 0.000 0.254 5824 K C -1.425 175.176 176.600 0.002 0.000 0.942 5824 K CA -0.538 55.751 56.287 0.004 0.000 0.818 5824 K CB 2.306 34.809 32.500 0.004 0.000 1.306 5824 K HN 0.601 nan 8.250 nan 0.000 0.435 5825 V N 2.932 122.846 119.914 -0.000 0.000 2.459 5825 V HA 0.346 4.467 4.120 0.000 0.000 0.295 5825 V C -0.538 175.553 176.094 -0.005 0.000 1.029 5825 V CA -0.725 61.574 62.300 -0.003 0.000 0.874 5825 V CB 1.677 33.498 31.823 -0.004 0.000 0.985 5825 V HN 0.673 nan 8.190 nan 0.000 0.438 5826 D N 3.311 123.707 120.400 -0.008 0.000 2.471 5826 D HA 0.240 4.880 4.640 0.000 0.000 0.245 5826 D C 0.778 177.070 176.300 -0.013 0.000 1.116 5826 D CA -0.554 53.441 54.000 -0.009 0.000 0.853 5826 D CB 1.816 42.611 40.800 -0.009 0.000 1.123 5826 D HN 0.523 nan 8.370 nan 0.000 0.540 5827 K N 2.733 123.126 120.400 -0.012 0.000 2.218 5827 K HA -0.237 4.084 4.320 0.000 0.000 0.205 5827 K C 0.921 177.510 176.600 -0.018 0.000 1.046 5827 K CA 1.402 57.681 56.287 -0.014 0.000 0.933 5827 K CB 0.162 32.656 32.500 -0.011 0.000 0.728 5827 K HN 0.349 nan 8.250 nan 0.000 0.454 5828 D N 0.260 120.649 120.400 -0.018 0.000 2.309 5828 D HA -0.126 4.514 4.640 0.000 0.000 0.212 5828 D C 1.483 177.766 176.300 -0.029 0.000 0.968 5828 D CA 0.777 54.763 54.000 -0.023 0.000 0.882 5828 D CB 0.115 40.903 40.800 -0.020 0.000 0.918 5828 D HN 0.282 nan 8.370 nan 0.000 0.503 5829 L N -0.355 120.851 121.223 -0.028 0.000 2.492 5829 L HA 0.171 4.512 4.340 0.000 0.000 0.223 5829 L C 0.410 177.257 176.870 -0.039 0.000 1.132 5829 L CA 0.204 55.023 54.840 -0.035 0.000 0.850 5829 L CB 0.152 42.192 42.059 -0.032 0.000 0.966 5829 L HN 0.015 nan 8.230 nan 0.000 0.454 5830 I N 0.630 121.180 120.570 -0.034 0.000 2.420 5830 I HA 0.180 4.350 4.170 0.000 0.000 0.282 5830 I C 0.023 176.119 176.117 -0.035 0.000 1.019 5830 I CA -0.394 60.886 61.300 -0.034 0.000 1.130 5830 I CB 1.627 39.611 38.000 -0.026 0.000 1.262 5830 I HN -0.040 nan 8.210 nan 0.000 0.454 5831 K N 6.764 127.138 120.400 -0.044 0.000 2.249 5831 K HA 0.405 4.725 4.320 0.000 0.000 0.280 5831 K C -0.634 175.942 176.600 -0.041 0.000 1.033 5831 K CA -0.479 55.780 56.287 -0.047 0.000 0.946 5831 K CB 0.904 33.365 32.500 -0.065 0.000 1.005 5831 K HN 0.460 nan 8.250 nan 0.000 0.469 5832 I N 4.258 124.807 120.570 -0.035 0.000 2.347 5832 I HA 0.184 4.354 4.170 0.000 0.000 0.283 5832 I C -0.217 175.881 176.117 -0.032 0.000 1.058 5832 I CA -0.550 60.734 61.300 -0.027 0.000 1.202 5832 I CB 0.424 38.413 38.000 -0.018 0.000 1.386 5832 I HN 0.668 nan 8.210 nan 0.000 0.475 5833 E N 6.775 126.952 120.200 -0.037 0.000 2.204 5833 E HA 0.589 4.939 4.350 0.000 0.000 0.276 5833 E C -0.783 175.802 176.600 -0.025 0.000 0.974 5833 E CA -0.633 55.741 56.400 -0.043 0.000 0.815 5833 E CB 1.396 31.052 29.700 -0.073 0.000 1.119 5833 E HN 0.544 nan 8.360 nan 0.000 0.393 5834 K N 1.924 122.311 120.400 -0.022 0.000 2.468 5834 K HA 0.698 5.018 4.320 0.000 0.000 0.252 5834 K C -1.250 175.345 176.600 -0.008 0.000 0.932 5834 K CA -1.183 55.098 56.287 -0.010 0.000 0.794 5834 K CB 1.843 34.337 32.500 -0.009 0.000 1.241 5834 K HN 0.189 nan 8.250 nan 0.000 0.428 5835 K N 1.599 122.002 120.400 0.004 0.000 2.588 5835 K HA 0.191 4.511 4.320 0.000 0.000 0.250 5835 K C -0.999 175.608 176.600 0.012 0.000 0.972 5835 K CA -0.341 55.951 56.287 0.009 0.000 0.821 5835 K CB 1.910 34.425 32.500 0.025 0.000 1.249 5835 K HN 0.853 nan 8.250 nan 0.000 0.442 5836 S N 2.002 117.702 115.700 0.001 0.000 2.580 5836 S HA 0.685 5.155 4.470 0.000 0.000 0.266 5836 S C 0.531 175.138 174.600 0.011 0.000 1.354 5836 S CA 0.501 58.702 58.200 0.001 0.000 1.008 5836 S CB 0.513 63.706 63.200 -0.011 0.000 0.898 5836 S HN 1.384 nan 8.310 nan 0.000 0.555 5837 G N -0.065 108.742 108.800 0.011 0.000 2.484 5837 G HA2 0.483 4.443 3.960 0.000 0.000 0.685 5837 G HA3 0.483 4.443 3.960 0.000 0.000 0.685 5837 G C -0.060 174.849 174.900 0.015 0.000 1.294 5837 G CA -0.008 45.100 45.100 0.013 0.000 0.879 5837 G HN 2.454 nan 8.290 nan 0.000 0.646 5838 A N -0.710 122.117 122.820 0.013 0.000 5.953 5838 A HA 0.384 4.704 4.320 0.000 0.000 0.267 5838 A C 1.164 178.755 177.584 0.012 0.000 2.116 5838 A CA 1.984 54.028 52.037 0.012 0.000 0.711 5838 A CB -1.623 17.385 19.000 0.015 0.000 1.100 5838 A HN 2.726 nan 8.150 nan 0.000 0.364 5839 S N -2.592 113.116 115.700 0.013 0.000 2.810 5839 S HA 0.750 5.220 4.470 0.000 0.000 0.315 5839 S C 1.302 175.911 174.600 0.014 0.000 1.138 5839 S CA 0.011 58.218 58.200 0.013 0.000 0.889 5839 S CB 0.920 64.127 63.200 0.011 0.000 1.236 5839 S HN 0.966 nan 8.310 nan 0.000 0.548 5840 I N 1.194 121.773 120.570 0.014 0.000 2.315 5840 I HA -0.091 4.079 4.170 0.000 0.000 0.248 5840 I C 1.931 178.056 176.117 0.013 0.000 1.117 5840 I CA 1.392 62.700 61.300 0.015 0.000 1.404 5840 I CB -0.302 37.707 38.000 0.015 0.000 1.071 5840 I HN 0.694 nan 8.210 nan 0.000 0.419 5841 D N 1.017 121.423 120.400 0.011 0.000 2.221 5841 D HA -0.211 4.430 4.640 0.000 0.000 0.204 5841 D C 1.593 177.898 176.300 0.010 0.000 0.982 5841 D CA 1.140 55.145 54.000 0.008 0.000 0.857 5841 D CB -0.016 40.788 40.800 0.005 0.000 0.934 5841 D HN 0.248 nan 8.370 nan 0.000 0.475 5842 D N -0.433 119.974 120.400 0.012 0.000 2.347 5842 D HA -0.038 4.603 4.640 0.000 0.000 0.215 5842 D C 0.239 176.552 176.300 0.022 0.000 0.976 5842 D CA 0.392 54.400 54.000 0.014 0.000 0.884 5842 D CB -0.189 40.620 40.800 0.014 0.000 0.915 5842 D HN 0.162 nan 8.370 nan 0.000 0.526 5843 T N 1.513 116.080 114.554 0.022 0.000 2.933 5843 T HA 0.085 4.435 4.350 0.000 0.000 0.306 5843 T C 0.303 175.019 174.700 0.027 0.000 1.045 5843 T CA 0.688 62.803 62.100 0.026 0.000 1.143 5843 T CB 0.967 69.846 68.868 0.019 0.000 1.003 5843 T HN 0.033 nan 8.240 nan 0.000 0.540 5844 E N 1.626 121.848 120.200 0.037 0.000 2.372 5844 E HA 0.527 4.877 4.350 0.000 0.000 0.279 5844 E C -1.890 174.737 176.600 0.045 0.000 0.946 5844 E CA -0.830 55.593 56.400 0.039 0.000 0.769 5844 E CB 1.087 30.815 29.700 0.046 0.000 1.230 5844 E HN 0.367 nan 8.360 nan 0.000 0.442 5845 L N 3.902 125.146 121.223 0.035 0.000 2.289 5845 L HA 0.622 4.962 4.340 0.000 0.000 0.285 5845 L C -1.246 175.650 176.870 0.043 0.000 1.049 5845 L CA -0.246 54.611 54.840 0.028 0.000 0.804 5845 L CB 0.841 42.907 42.059 0.012 0.000 1.195 5845 L HN 0.596 nan 8.230 nan 0.000 0.428 5846 I N 4.752 125.349 120.570 0.045 0.000 2.354 5846 I HA 0.300 4.470 4.170 0.000 0.000 0.286 5846 I C -0.106 176.026 176.117 0.026 0.000 1.007 5846 I CA -0.443 60.896 61.300 0.065 0.000 1.167 5846 I CB 1.197 39.265 38.000 0.114 0.000 1.320 5846 I HN 0.425 nan 8.210 nan 0.000 0.458 5847 K N 5.266 125.680 120.400 0.023 0.000 2.199 5847 K HA 0.551 4.871 4.320 0.000 0.000 0.226 5847 K C 0.513 177.112 176.600 -0.001 0.000 1.237 5847 K CA -0.078 56.209 56.287 -0.001 0.000 1.170 5847 K CB -0.286 32.213 32.500 -0.003 0.000 1.418 5847 K HN 0.869 nan 8.250 nan 0.000 0.255 5848 G N -1.375 107.417 108.800 -0.012 0.000 2.512 5848 G HA2 0.166 4.126 3.960 0.000 0.000 0.181 5848 G HA3 0.166 4.126 3.960 0.000 0.000 0.181 5848 G C -1.623 173.248 174.900 -0.048 0.000 1.173 5848 G CA -0.739 44.348 45.100 -0.021 0.000 0.988 5848 G HN 0.043 nan 8.290 nan 0.000 0.485 5849 V N 0.835 120.710 119.914 -0.064 0.000 2.487 5849 V HA 0.693 4.814 4.120 0.000 0.000 0.298 5849 V C -0.903 175.102 176.094 -0.148 0.000 1.028 5849 V CA -0.592 61.637 62.300 -0.119 0.000 0.860 5849 V CB 1.449 33.170 31.823 -0.171 0.000 0.991 5849 V HN 0.889 nan 8.190 nan 0.000 0.427 5850 L N 7.609 128.708 121.223 -0.207 0.000 2.305 5850 L HA 0.842 5.182 4.340 0.000 0.000 0.284 5850 L C -0.384 176.328 176.870 -0.263 0.000 1.013 5850 L CA -0.177 54.450 54.840 -0.354 0.000 0.819 5850 L CB 1.648 43.391 42.059 -0.528 0.000 1.227 5850 L HN 0.582 nan 8.230 nan 0.000 0.417 5851 V N 1.585 121.366 119.914 -0.222 0.000 2.769 5851 V HA 0.633 4.753 4.120 0.000 0.000 0.312 5851 V C -0.368 175.668 176.094 -0.096 0.000 1.061 5851 V CA -0.523 61.701 62.300 -0.128 0.000 0.931 5851 V CB 1.820 33.602 31.823 -0.068 0.000 1.010 5851 V HN 0.812 nan 8.190 nan 0.000 0.433 5852 D N 1.001 121.364 120.400 -0.061 0.000 3.134 5852 D HA 0.326 4.966 4.640 0.000 0.000 0.248 5852 D C -0.115 176.189 176.300 0.005 0.000 1.273 5852 D CA -0.218 53.763 54.000 -0.032 0.000 0.904 5852 D CB 0.214 40.996 40.800 -0.030 0.000 1.089 5852 D HN 0.547 nan 8.370 nan 0.000 0.478 5853 K N 0.237 120.655 120.400 0.029 0.000 2.352 5853 K HA 0.558 4.878 4.320 0.000 0.000 0.240 5853 K C 0.003 176.636 176.600 0.055 0.000 1.017 5853 K CA -0.865 55.455 56.287 0.055 0.000 0.851 5853 K CB 1.942 34.503 32.500 0.102 0.000 1.261 5853 K HN 0.294 nan 8.250 nan 0.000 0.451 5854 E N -0.155 120.070 120.200 0.042 0.000 2.416 5854 E HA 0.455 4.805 4.350 0.000 0.000 0.273 5854 E C -0.965 175.638 176.600 0.005 0.000 0.935 5854 E CA -1.091 55.326 56.400 0.029 0.000 0.784 5854 E CB 1.448 31.162 29.700 0.024 0.000 1.301 5854 E HN 0.281 nan 8.360 nan 0.000 0.454 5855 R N 0.922 121.418 120.500 -0.006 0.000 2.401 5855 R HA 0.075 4.415 4.340 0.000 0.000 0.299 5855 R C 1.339 177.625 176.300 -0.023 0.000 1.064 5855 R CA 0.252 56.332 56.100 -0.032 0.000 1.000 5855 R CB 0.879 31.160 30.300 -0.031 0.000 0.973 5855 R HN 0.577 nan 8.270 nan 0.000 0.438 5856 V N -0.138 119.758 119.914 -0.030 0.000 2.867 5856 V HA -0.115 4.005 4.120 0.000 0.000 0.260 5856 V C 0.773 176.859 176.094 -0.012 0.000 1.099 5856 V CA 1.227 63.517 62.300 -0.017 0.000 1.122 5856 V CB -0.153 31.660 31.823 -0.018 0.000 0.708 5856 V HN 0.561 nan 8.190 nan 0.000 0.490 5857 S N -1.012 114.677 115.700 -0.018 0.000 2.521 5857 S HA 0.774 5.244 4.470 0.000 0.000 0.295 5857 S C 0.875 175.466 174.600 -0.014 0.000 1.098 5857 S CA -0.128 58.065 58.200 -0.013 0.000 0.999 5857 S CB 1.858 65.047 63.200 -0.017 0.000 1.034 5857 S HN 0.724 nan 8.310 nan 0.000 0.483 5858 A N 3.019 125.834 122.820 -0.007 0.000 2.070 5858 A HA -0.077 4.243 4.320 0.000 0.000 0.220 5858 A C 1.873 179.451 177.584 -0.011 0.000 1.159 5858 A CA 1.886 53.920 52.037 -0.006 0.000 0.656 5858 A CB -0.675 18.325 19.000 -0.001 0.000 0.800 5858 A HN 0.809 nan 8.150 nan 0.000 0.453 5859 Q N -0.530 119.260 119.800 -0.017 0.000 2.378 5859 Q HA 0.131 4.472 4.340 0.000 0.000 0.205 5859 Q C 0.711 176.689 176.000 -0.037 0.000 0.954 5859 Q CA 0.413 56.199 55.803 -0.028 0.000 0.901 5859 Q CB -0.457 28.255 28.738 -0.045 0.000 0.981 5859 Q HN 0.679 nan 8.270 nan 0.000 0.483 5860 M N 2.252 121.830 119.600 -0.037 0.000 2.245 5860 M HA 0.194 4.674 4.480 0.000 0.000 0.344 5860 M C -1.920 174.363 176.300 -0.029 0.000 1.170 5860 M CA -1.737 53.539 55.300 -0.040 0.000 1.135 5860 M CB 0.389 32.962 32.600 -0.044 0.000 1.574 5860 M HN -0.054 nan 8.290 nan 0.000 0.452 5861 P HA -0.022 nan 4.420 nan 0.000 0.265 5861 P C -0.237 177.055 177.300 -0.013 0.000 1.187 5861 P CA 0.247 63.336 63.100 -0.018 0.000 0.766 5861 P CB 0.467 32.156 31.700 -0.017 0.000 0.820 5862 K N 2.254 122.651 120.400 -0.006 0.000 2.426 5862 K HA 0.008 4.328 4.320 0.000 0.000 0.193 5862 K C 0.148 176.754 176.600 0.010 0.000 1.028 5862 K CA 0.478 56.766 56.287 0.002 0.000 1.047 5862 K CB 0.094 32.595 32.500 0.002 0.000 0.821 5862 K HN 0.448 nan 8.250 nan 0.000 0.513 5863 K N -0.715 119.688 120.400 0.006 0.000 2.561 5863 K HA 0.263 4.583 4.320 0.000 0.000 0.254 5863 K C -1.540 175.065 176.600 0.009 0.000 0.942 5863 K CA -0.942 55.353 56.287 0.012 0.000 0.818 5863 K CB 2.046 34.550 32.500 0.007 0.000 1.306 5863 K HN -0.218 nan 8.250 nan 0.000 0.435 5864 V N 2.206 122.129 119.914 0.017 0.000 2.531 5864 V HA 0.437 4.558 4.120 0.000 0.000 0.301 5864 V C -0.156 175.952 176.094 0.023 0.000 1.034 5864 V CA -0.528 61.780 62.300 0.014 0.000 0.865 5864 V CB 1.811 33.640 31.823 0.009 0.000 0.995 5864 V HN 0.997 nan 8.190 nan 0.000 0.424 5865 T N 0.015 114.580 114.554 0.017 0.000 2.929 5865 T HA 0.534 4.884 4.350 0.000 0.000 0.284 5865 T C 0.178 174.891 174.700 0.021 0.000 1.014 5865 T CA -0.217 61.895 62.100 0.020 0.000 1.051 5865 T CB 1.277 70.154 68.868 0.014 0.000 1.028 5865 T HN 0.777 nan 8.240 nan 0.000 0.485 5866 D N 0.146 120.561 120.400 0.024 0.000 2.689 5866 D HA -0.156 4.484 4.640 0.000 0.000 0.237 5866 D C 0.302 176.619 176.300 0.028 0.000 1.148 5866 D CA 0.825 54.839 54.000 0.024 0.000 0.656 5866 D CB -1.279 39.532 40.800 0.018 0.000 1.050 5866 D HN 1.100 nan 8.370 nan 0.000 0.426 5867 A N 1.347 124.189 122.820 0.036 0.000 2.511 5867 A HA 0.355 4.675 4.320 0.000 0.000 0.242 5867 A C 0.509 178.121 177.584 0.046 0.000 1.069 5867 A CA 0.199 52.261 52.037 0.042 0.000 0.763 5867 A CB 0.546 19.582 19.000 0.060 0.000 1.001 5867 A HN 0.158 nan 8.150 nan 0.000 0.498 5868 K N 3.025 123.449 120.400 0.040 0.000 2.404 5868 K HA 0.383 4.703 4.320 0.000 0.000 0.257 5868 K C -1.214 175.419 176.600 0.055 0.000 1.026 5868 K CA -0.248 56.064 56.287 0.041 0.000 0.951 5868 K CB 0.935 33.452 32.500 0.027 0.000 1.203 5868 K HN 0.524 nan 8.250 nan 0.000 0.446 5869 I N 2.141 122.760 120.570 0.082 0.000 2.371 5869 I HA 0.201 4.371 4.170 0.000 0.000 0.290 5869 I C 0.371 176.556 176.117 0.112 0.000 1.028 5869 I CA -0.145 61.235 61.300 0.133 0.000 1.345 5869 I CB 1.360 39.475 38.000 0.193 0.000 1.407 5869 I HN 0.517 nan 8.210 nan 0.000 0.501 5870 A N 7.501 130.391 122.820 0.117 0.000 2.330 5870 A HA 0.856 5.176 4.320 0.000 0.000 0.327 5870 A C -0.793 176.876 177.584 0.142 0.000 1.155 5870 A CA -0.569 51.524 52.037 0.094 0.000 0.803 5870 A CB 0.706 19.739 19.000 0.054 0.000 1.208 5870 A HN 0.653 nan 8.150 nan 0.000 0.477 5871 L N 3.410 124.696 121.223 0.105 0.000 2.318 5871 L HA 0.420 4.760 4.340 0.000 0.000 0.277 5871 L C -0.919 175.993 176.870 0.070 0.000 1.008 5871 L CA -0.081 54.822 54.840 0.105 0.000 0.846 5871 L CB 0.960 43.060 42.059 0.068 0.000 1.220 5871 L HN 0.572 nan 8.230 nan 0.000 0.423 5872 L N 2.759 124.027 121.223 0.075 0.000 2.325 5872 L HA 0.432 4.772 4.340 0.000 0.000 0.278 5872 L C 0.785 177.684 176.870 0.049 0.000 1.023 5872 L CA -0.341 54.531 54.840 0.052 0.000 0.811 5872 L CB 1.903 43.990 42.059 0.046 0.000 1.249 5872 L HN 0.518 nan 8.230 nan 0.000 0.431 5873 N N 0.823 119.544 118.700 0.036 0.000 2.454 5873 N HA -0.016 4.724 4.740 0.000 0.000 0.177 5873 N C 0.500 176.027 175.510 0.027 0.000 1.049 5873 N CA -0.025 53.043 53.050 0.030 0.000 0.887 5873 N CB 0.331 38.831 38.487 0.022 0.000 1.095 5873 N HN 0.743 nan 8.380 nan 0.000 0.446 5874 C N 1.347 120.662 119.300 0.025 0.000 2.700 5874 C HA 0.779 5.239 4.460 0.000 0.000 0.397 5874 C C 0.984 175.990 174.990 0.025 0.000 1.301 5874 C CA -1.341 57.691 59.018 0.023 0.000 2.219 5874 C CB -0.448 27.305 27.740 0.021 0.000 2.699 5874 C HN 0.426 nan 8.230 nan 0.000 0.669 5875 A N 2.774 125.608 122.820 0.023 0.000 2.388 5875 A HA 0.580 4.900 4.320 0.000 0.000 0.257 5875 A C 0.182 177.782 177.584 0.026 0.000 1.095 5875 A CA -0.597 51.454 52.037 0.024 0.000 0.791 5875 A CB -0.059 18.954 19.000 0.022 0.000 1.029 5875 A HN 0.901 nan 8.150 nan 0.000 0.489 5876 I N 2.760 123.346 120.570 0.027 0.000 2.206 5876 I HA 0.182 4.353 4.170 0.000 0.000 0.292 5876 I C 0.440 176.578 176.117 0.035 0.000 1.156 5876 I CA 0.246 61.564 61.300 0.031 0.000 1.356 5876 I CB -0.692 37.327 38.000 0.032 0.000 1.494 5876 I HN 0.871 nan 8.210 nan 0.000 0.601 5877 E N 3.930 124.150 120.200 0.033 0.000 2.456 5877 E HA 0.469 4.819 4.350 0.000 0.000 0.276 5877 E C -0.753 175.868 176.600 0.034 0.000 0.981 5877 E CA -1.179 55.241 56.400 0.034 0.000 0.814 5877 E CB 1.514 31.231 29.700 0.028 0.000 1.382 5877 E HN 0.020 nan 8.360 nan 0.000 0.459 5878 I N 2.249 122.841 120.570 0.036 0.000 2.705 5878 I HA -0.029 4.141 4.170 0.000 0.000 0.291 5878 I C 0.654 176.790 176.117 0.031 0.000 1.146 5878 I CA 0.463 61.785 61.300 0.037 0.000 1.383 5878 I CB -0.378 37.647 38.000 0.042 0.000 1.454 5878 I HN 0.328 nan 8.210 nan 0.000 0.581 5879 K N 5.191 125.608 120.400 0.028 0.000 2.511 5879 K HA -0.058 4.262 4.320 0.000 0.000 0.280 5879 K C 0.039 176.653 176.600 0.024 0.000 1.008 5879 K CA 0.220 56.521 56.287 0.024 0.000 1.050 5879 K CB 0.390 32.903 32.500 0.022 0.000 0.889 5879 K HN 0.466 nan 8.250 nan 0.000 0.484 5880 E N 2.237 122.449 120.200 0.020 0.000 2.179 5880 E HA 0.151 4.501 4.350 0.000 0.000 0.275 5880 E C -0.836 175.773 176.600 0.015 0.000 0.945 5880 E CA -0.553 55.857 56.400 0.018 0.000 0.792 5880 E CB 0.988 30.696 29.700 0.014 0.000 1.125 5880 E HN 0.578 nan 8.360 nan 0.000 0.397 5881 T N 1.933 116.496 114.554 0.015 0.000 2.903 5881 T HA 0.095 4.445 4.350 0.000 0.000 0.314 5881 T C 0.886 175.592 174.700 0.010 0.000 1.078 5881 T CA -0.490 61.618 62.100 0.014 0.000 1.114 5881 T CB 0.753 69.629 68.868 0.015 0.000 0.987 5881 T HN 0.448 nan 8.240 nan 0.000 0.548 5882 E N 0.726 120.931 120.200 0.010 0.000 2.046 5882 E HA -0.026 4.324 4.350 0.000 0.000 0.190 5882 E C 1.302 177.906 176.600 0.006 0.000 0.982 5882 E CA 0.902 57.306 56.400 0.008 0.000 0.800 5882 E CB -0.581 29.123 29.700 0.008 0.000 0.756 5882 E HN 0.795 nan 8.360 nan 0.000 0.449 5883 T N 1.854 116.412 114.554 0.006 0.000 2.930 5883 T HA -0.005 4.345 4.350 0.000 0.000 0.306 5883 T C -0.327 174.375 174.700 0.004 0.000 1.045 5883 T CA -0.609 61.494 62.100 0.005 0.000 1.134 5883 T CB 0.355 69.226 68.868 0.006 0.000 0.961 5883 T HN -0.178 nan 8.240 nan 0.000 0.545 5884 D N 2.735 123.136 120.400 0.002 0.000 2.450 5884 D HA 0.471 5.111 4.640 0.000 0.000 0.247 5884 D C -0.247 176.052 176.300 -0.002 0.000 1.162 5884 D CA 0.516 54.515 54.000 -0.001 0.000 0.879 5884 D CB 0.705 41.503 40.800 -0.002 0.000 1.163 5884 D HN 0.743 nan 8.370 nan 0.000 0.472 5885 A N 2.803 125.621 122.820 -0.004 0.000 2.547 5885 A HA 0.601 4.921 4.320 0.000 0.000 0.297 5885 A C -0.784 176.790 177.584 -0.017 0.000 1.056 5885 A CA -0.774 51.259 52.037 -0.006 0.000 0.688 5885 A CB 1.655 20.657 19.000 0.002 0.000 1.282 5885 A HN 0.459 nan 8.150 nan 0.000 0.400 5886 E N 0.858 121.041 120.200 -0.029 0.000 2.356 5886 E HA 0.503 4.853 4.350 0.000 0.000 0.275 5886 E C -1.465 175.085 176.600 -0.083 0.000 0.904 5886 E CA -0.836 55.532 56.400 -0.053 0.000 0.757 5886 E CB 2.300 31.970 29.700 -0.049 0.000 1.232 5886 E HN 0.495 nan 8.360 nan 0.000 0.442 5887 I N 2.053 122.535 120.570 -0.147 0.000 2.472 5887 I HA 0.183 4.353 4.170 0.000 0.000 0.290 5887 I C -0.011 175.958 176.117 -0.246 0.000 1.016 5887 I CA -0.254 60.884 61.300 -0.271 0.000 1.348 5887 I CB 0.483 38.152 38.000 -0.552 0.000 1.417 5887 I HN 0.195 nan 8.210 nan 0.000 0.521 5888 R N 6.975 127.346 120.500 -0.216 0.000 2.363 5888 R HA 0.478 4.818 4.340 0.000 0.000 0.297 5888 R C -0.926 175.300 176.300 -0.123 0.000 1.208 5888 R CA -0.527 55.491 56.100 -0.136 0.000 1.121 5888 R CB 0.680 30.939 30.300 -0.068 0.000 1.124 5888 R HN 0.547 nan 8.270 nan 0.000 0.561 5889 I N 0.971 121.452 120.570 -0.147 0.000 2.395 5889 I HA 0.112 4.282 4.170 0.000 0.000 0.289 5889 I C 1.318 177.430 176.117 -0.009 0.000 1.023 5889 I CA 0.263 61.526 61.300 -0.062 0.000 1.350 5889 I CB 1.548 39.509 38.000 -0.066 0.000 1.409 5889 I HN 0.357 nan 8.210 nan 0.000 0.507 5890 T N 3.109 117.681 114.554 0.030 0.000 3.262 5890 T HA 0.113 4.463 4.350 0.000 0.000 0.300 5890 T C -0.501 174.219 174.700 0.035 0.000 0.959 5890 T CA -0.154 61.961 62.100 0.024 0.000 0.936 5890 T CB -0.212 68.668 68.868 0.019 0.000 1.169 5890 T HN 0.619 nan 8.240 nan 0.000 0.532 5891 D N 0.640 121.071 120.400 0.052 0.000 2.896 5891 D HA 0.356 4.996 4.640 0.000 0.000 0.241 5891 D C -2.187 174.145 176.300 0.052 0.000 1.188 5891 D CA -1.811 52.217 54.000 0.048 0.000 0.879 5891 D CB 2.851 43.682 40.800 0.051 0.000 1.553 5891 D HN -0.154 nan 8.370 nan 0.000 0.515 5892 P HA -0.134 nan 4.420 nan 0.000 0.217 5892 P C 0.962 178.285 177.300 0.039 0.000 1.148 5892 P CA 1.348 64.469 63.100 0.034 0.000 0.834 5892 P CB 0.335 32.049 31.700 0.023 0.000 0.783 5893 A N -0.300 122.542 122.820 0.036 0.000 1.898 5893 A HA -0.193 4.127 4.320 0.000 0.000 0.216 5893 A C 2.083 179.694 177.584 0.044 0.000 1.181 5893 A CA 1.578 53.633 52.037 0.030 0.000 0.620 5893 A CB -0.880 18.130 19.000 0.017 0.000 0.819 5893 A HN 0.151 nan 8.150 nan 0.000 0.442 5894 K N -0.812 119.637 120.400 0.081 0.000 2.148 5894 K HA -0.046 4.274 4.320 0.000 0.000 0.204 5894 K C 1.821 178.574 176.600 0.256 0.000 1.050 5894 K CA 1.041 57.427 56.287 0.166 0.000 0.942 5894 K CB -0.307 32.344 32.500 0.252 0.000 0.724 5894 K HN 0.376 nan 8.250 nan 0.000 0.446 5895 L N 0.999 122.318 121.223 0.159 0.000 2.042 5895 L HA -0.199 4.141 4.340 0.000 0.000 0.210 5895 L C 1.995 178.939 176.870 0.122 0.000 1.076 5895 L CA 1.771 56.689 54.840 0.130 0.000 0.749 5895 L CB -0.224 41.877 42.059 0.069 0.000 0.893 5895 L HN 0.177 nan 8.230 nan 0.000 0.432 5896 M N -1.266 118.385 119.600 0.084 0.000 2.193 5896 M HA -0.067 4.413 4.480 0.000 0.000 0.265 5896 M C 2.150 178.475 176.300 0.042 0.000 1.071 5896 M CA 1.135 56.468 55.300 0.054 0.000 1.140 5896 M CB -1.107 31.511 32.600 0.030 0.000 1.369 5896 M HN 0.247 nan 8.290 nan 0.000 0.423 5897 E N 0.013 120.224 120.200 0.019 0.000 2.051 5897 E HA -0.136 4.214 4.350 0.000 0.000 0.192 5897 E C 2.071 178.610 176.600 -0.103 0.000 0.991 5897 E CA 1.403 57.753 56.400 -0.082 0.000 0.799 5897 E CB -0.416 29.175 29.700 -0.182 0.000 0.748 5897 E HN 0.455 nan 8.360 nan 0.000 0.449 5898 F N 0.660 120.613 119.950 0.005 0.000 2.206 5898 F HA -0.051 4.476 4.527 0.000 0.000 0.298 5898 F C 2.401 178.205 175.800 0.008 0.000 1.090 5898 F CA 0.554 58.557 58.000 0.006 0.000 1.323 5898 F CB -0.167 38.836 39.000 0.005 0.000 1.028 5898 F HN -0.053 nan 8.300 nan 0.000 0.492 5899 I N -0.126 120.558 120.570 0.189 0.000 2.286 5899 I HA -0.263 3.907 4.170 0.000 0.000 0.248 5899 I C 2.014 178.176 176.117 0.074 0.000 1.115 5899 I CA 1.514 62.880 61.300 0.110 0.000 1.392 5899 I CB -0.398 37.649 38.000 0.078 0.000 1.065 5899 I HN 0.175 nan 8.210 nan 0.000 0.418 5900 E N -0.012 120.219 120.200 0.052 0.000 2.216 5900 E HA -0.232 4.118 4.350 0.000 0.000 0.192 5900 E C 2.030 178.640 176.600 0.017 0.000 0.988 5900 E CA 0.518 56.935 56.400 0.029 0.000 0.834 5900 E CB 0.036 29.741 29.700 0.009 0.000 0.772 5900 E HN 0.330 nan 8.360 nan 0.000 0.479 5901 Q N 1.021 120.824 119.800 0.005 0.000 2.172 5901 Q HA -0.148 4.192 4.340 0.000 0.000 0.200 5901 Q C 1.768 177.788 176.000 0.034 0.000 0.964 5901 Q CA 1.136 56.931 55.803 -0.014 0.000 0.855 5901 Q CB 0.214 28.901 28.738 -0.084 0.000 0.918 5901 Q HN 0.147 nan 8.270 nan 0.000 0.444 5902 E N 0.287 120.529 120.200 0.071 0.000 2.051 5902 E HA -0.198 4.152 4.350 0.000 0.000 0.192 5902 E C 1.718 178.355 176.600 0.063 0.000 0.991 5902 E CA 1.123 57.567 56.400 0.073 0.000 0.799 5902 E CB -0.155 29.594 29.700 0.082 0.000 0.748 5902 E HN 0.481 nan 8.360 nan 0.000 0.449 5903 E N 1.388 121.628 120.200 0.066 0.000 2.150 5903 E HA -0.197 4.153 4.350 0.000 0.000 0.193 5903 E C 1.927 178.565 176.600 0.064 0.000 0.985 5903 E CA 1.034 57.487 56.400 0.088 0.000 0.814 5903 E CB 0.131 29.889 29.700 0.097 0.000 0.752 5903 E HN -0.055 nan 8.360 nan 0.000 0.466 5904 K N 0.843 121.257 120.400 0.024 0.000 2.057 5904 K HA -0.072 4.248 4.320 0.000 0.000 0.206 5904 K C 2.295 178.882 176.600 -0.022 0.000 1.050 5904 K CA 1.469 57.746 56.287 -0.016 0.000 0.935 5904 K CB -0.535 31.951 32.500 -0.025 0.000 0.715 5904 K HN 0.148 nan 8.250 nan 0.000 0.439 5905 M N -0.200 119.401 119.600 0.002 0.000 2.065 5905 M HA -0.180 4.300 4.480 0.000 0.000 0.259 5905 M C 1.858 178.163 176.300 0.009 0.000 1.069 5905 M CA 1.743 57.046 55.300 0.006 0.000 1.110 5905 M CB -0.268 32.346 32.600 0.024 0.000 1.328 5905 M HN 0.264 nan 8.290 nan 0.000 0.405 5906 L N 0.767 122.010 121.223 0.033 0.000 2.083 5906 L HA -0.197 4.143 4.340 0.000 0.000 0.209 5906 L C 2.366 179.262 176.870 0.043 0.000 1.083 5906 L CA 1.955 56.829 54.840 0.057 0.000 0.752 5906 L CB -0.779 41.339 42.059 0.098 0.000 0.899 5906 L HN 0.350 nan 8.230 nan 0.000 0.433 5907 K N -0.846 119.541 120.400 -0.021 0.000 2.097 5907 K HA -0.197 4.123 4.320 0.000 0.000 0.206 5907 K C 1.601 178.099 176.600 -0.169 0.000 1.049 5907 K CA 1.768 57.912 56.287 -0.238 0.000 0.933 5907 K CB -0.090 32.155 32.500 -0.425 0.000 0.717 5907 K HN 0.344 nan 8.250 nan 0.000 0.442 5908 D N 0.400 120.743 120.400 -0.095 0.000 2.183 5908 D HA -0.112 4.528 4.640 0.000 0.000 0.203 5908 D C 1.880 178.156 176.300 -0.040 0.000 0.969 5908 D CA 1.067 55.026 54.000 -0.068 0.000 0.842 5908 D CB -0.017 40.755 40.800 -0.046 0.000 0.957 5908 D HN 0.305 nan 8.370 nan 0.000 0.484 5909 M N -0.041 119.547 119.600 -0.021 0.000 2.117 5909 M HA -0.131 4.349 4.480 0.000 0.000 0.262 5909 M C 2.223 178.523 176.300 0.000 0.000 1.065 5909 M CA 0.902 56.201 55.300 -0.001 0.000 1.114 5909 M CB -0.067 32.542 32.600 0.016 0.000 1.361 5909 M HN -0.108 nan 8.290 nan 0.000 0.408 5910 V N 0.244 120.158 119.914 -0.000 0.000 2.358 5910 V HA -0.212 3.908 4.120 0.000 0.000 0.246 5910 V C 2.607 178.691 176.094 -0.016 0.000 1.047 5910 V CA 1.885 64.190 62.300 0.008 0.000 1.035 5910 V CB -1.146 30.703 31.823 0.043 0.000 0.658 5910 V HN 0.513 nan 8.190 nan 0.000 0.452 5911 A N -0.357 122.436 122.820 -0.045 0.000 1.933 5911 A HA -0.245 4.075 4.320 0.000 0.000 0.218 5911 A C 2.166 179.734 177.584 -0.026 0.000 1.175 5911 A CA 1.900 53.909 52.037 -0.046 0.000 0.628 5911 A CB -0.406 18.555 19.000 -0.066 0.000 0.814 5911 A HN 0.638 nan 8.150 nan 0.000 0.444 5912 E N -0.425 119.763 120.200 -0.020 0.000 2.107 5912 E HA -0.086 4.264 4.350 0.000 0.000 0.191 5912 E C 1.838 178.436 176.600 -0.004 0.000 0.982 5912 E CA 0.969 57.363 56.400 -0.010 0.000 0.809 5912 E CB -0.241 29.455 29.700 -0.007 0.000 0.756 5912 E HN 0.700 nan 8.360 nan 0.000 0.459 5913 I N 1.210 121.779 120.570 -0.002 0.000 2.226 5913 I HA -0.274 3.896 4.170 0.000 0.000 0.245 5913 I C 2.444 178.560 176.117 -0.001 0.000 1.100 5913 I CA 0.998 62.300 61.300 0.002 0.000 1.374 5913 I CB -0.117 37.885 38.000 0.005 0.000 1.057 5913 I HN -0.018 nan 8.210 nan 0.000 0.413 5914 K N 1.671 122.068 120.400 -0.005 0.000 2.097 5914 K HA -0.073 4.247 4.320 0.000 0.000 0.205 5914 K C 2.024 178.621 176.600 -0.006 0.000 1.050 5914 K CA 1.618 57.900 56.287 -0.007 0.000 0.938 5914 K CB -0.407 32.086 32.500 -0.011 0.000 0.718 5914 K HN 0.255 nan 8.250 nan 0.000 0.442 5915 A N 0.355 123.170 122.820 -0.007 0.000 1.978 5915 A HA -0.166 4.154 4.320 0.000 0.000 0.220 5915 A C 2.129 179.713 177.584 -0.002 0.000 1.170 5915 A CA 2.162 54.195 52.037 -0.006 0.000 0.636 5915 A CB -1.034 17.961 19.000 -0.008 0.000 0.810 5915 A HN 0.555 nan 8.150 nan 0.000 0.448 5916 S N -1.689 114.011 115.700 0.001 0.000 2.442 5916 S HA 0.232 4.702 4.470 0.000 0.000 0.236 5916 S C 1.642 176.246 174.600 0.007 0.000 1.007 5916 S CA 1.480 59.684 58.200 0.005 0.000 0.965 5916 S CB -0.539 62.666 63.200 0.009 0.000 0.773 5916 S HN 1.987 nan 8.310 nan 0.000 0.504 5917 G N 0.570 109.372 108.800 0.004 0.000 2.176 5917 G HA2 -0.060 3.900 3.960 0.000 0.000 0.232 5917 G HA3 -0.060 3.900 3.960 0.000 0.000 0.232 5917 G C 0.256 175.160 174.900 0.007 0.000 0.986 5917 G CA -0.001 45.102 45.100 0.005 0.000 0.643 5917 G HN 1.365 nan 8.290 nan 0.000 0.522 5918 A N 0.407 123.232 122.820 0.008 0.000 2.498 5918 A HA 0.570 4.890 4.320 0.000 0.000 0.239 5918 A C 1.000 178.583 177.584 -0.001 0.000 1.068 5918 A CA 1.288 53.331 52.037 0.010 0.000 0.766 5918 A CB 0.130 19.137 19.000 0.012 0.000 1.003 5918 A HN 1.356 nan 8.150 nan 0.000 0.497 5919 N N -0.355 118.343 118.700 -0.003 0.000 2.067 5919 N HA 0.176 4.916 4.740 0.000 0.000 0.227 5919 N C -0.902 174.587 175.510 -0.036 0.000 1.348 5919 N CA 0.125 53.165 53.050 -0.016 0.000 0.879 5919 N CB 0.523 39.005 38.487 -0.008 0.000 1.109 5919 N HN 0.269 nan 8.380 nan 0.000 0.501 5920 V N 1.515 121.408 119.914 -0.035 0.000 2.531 5920 V HA 0.600 4.720 4.120 0.000 0.000 0.301 5920 V C -1.355 174.667 176.094 -0.121 0.000 1.034 5920 V CA -0.815 61.428 62.300 -0.094 0.000 0.865 5920 V CB 1.812 33.620 31.823 -0.024 0.000 0.995 5920 V HN 0.219 nan 8.190 nan 0.000 0.424 5921 L N 5.538 126.590 121.223 -0.285 0.000 2.410 5921 L HA 0.736 5.076 4.340 0.000 0.000 0.270 5921 L C -1.573 175.035 176.870 -0.437 0.000 0.983 5921 L CA -0.068 54.647 54.840 -0.209 0.000 0.822 5921 L CB 1.743 43.737 42.059 -0.108 0.000 1.285 5921 L HN 0.476 nan 8.230 nan 0.000 0.409 5922 F N 4.631 124.585 119.950 0.006 0.000 2.427 5922 F HA 0.486 5.013 4.527 0.000 0.000 0.348 5922 F C -0.040 175.762 175.800 0.004 0.000 1.125 5922 F CA -0.439 57.563 58.000 0.003 0.000 0.989 5922 F CB 1.602 40.601 39.000 -0.001 0.000 1.165 5922 F HN 0.507 nan 8.300 nan 0.000 0.442 5923 C N 4.892 124.274 119.300 0.136 0.000 2.303 5923 C HA 0.244 4.704 4.460 0.000 0.000 0.326 5923 C C 1.642 176.684 174.990 0.087 0.000 1.285 5923 C CA -0.403 58.667 59.018 0.088 0.000 1.675 5923 C CB 0.757 28.525 27.740 0.046 0.000 2.289 5923 C HN 0.965 nan 8.230 nan 0.000 0.512 5924 Q N 3.398 123.240 119.800 0.070 0.000 2.124 5924 Q HA -0.052 4.288 4.340 0.000 0.000 0.202 5924 Q C 0.791 176.815 176.000 0.039 0.000 0.977 5924 Q CA 1.632 57.466 55.803 0.051 0.000 0.850 5924 Q CB 0.180 28.939 28.738 0.035 0.000 0.901 5924 Q HN 0.758 nan 8.270 nan 0.000 0.429 5925 K N -1.144 119.277 120.400 0.035 0.000 2.632 5925 K HA 0.433 4.753 4.320 0.000 0.000 0.267 5925 K C 0.330 176.947 176.600 0.028 0.000 1.028 5925 K CA -0.203 56.101 56.287 0.028 0.000 1.045 5925 K CB 0.145 32.660 32.500 0.024 0.000 1.400 5925 K HN 0.114 nan 8.250 nan 0.000 0.522 5926 G N 0.262 109.076 108.800 0.023 0.000 2.599 5926 G HA2 0.429 4.389 3.960 0.000 0.000 0.264 5926 G HA3 0.429 4.389 3.960 0.000 0.000 0.264 5926 G C -0.523 174.390 174.900 0.022 0.000 1.200 5926 G CA -0.514 44.599 45.100 0.021 0.000 0.896 5926 G HN 0.371 nan 8.290 nan 0.000 0.536 5927 I N 0.351 120.933 120.570 0.019 0.000 2.499 5927 I HA 0.169 4.339 4.170 0.000 0.000 0.288 5927 I C -0.585 175.545 176.117 0.021 0.000 1.048 5927 I CA -0.790 60.523 61.300 0.021 0.000 1.062 5927 I CB 2.150 40.160 38.000 0.016 0.000 1.238 5927 I HN 0.419 nan 8.210 nan 0.000 0.426 5928 D N 5.242 125.659 120.400 0.028 0.000 2.414 5928 D HA -0.037 4.603 4.640 0.000 0.000 0.242 5928 D C 0.632 176.947 176.300 0.024 0.000 1.129 5928 D CA 0.141 54.157 54.000 0.026 0.000 0.885 5928 D CB 1.320 42.141 40.800 0.035 0.000 1.198 5928 D HN 0.496 nan 8.370 nan 0.000 0.437 5929 D N 3.134 123.541 120.400 0.012 0.000 2.190 5929 D HA -0.169 4.471 4.640 0.000 0.000 0.200 5929 D C 1.912 178.209 176.300 -0.005 0.000 0.992 5929 D CA 0.766 54.767 54.000 0.002 0.000 0.854 5929 D CB 0.260 41.053 40.800 -0.012 0.000 0.936 5929 D HN 0.342 nan 8.370 nan 0.000 0.462 5930 L N 1.005 122.226 121.223 -0.003 0.000 2.056 5930 L HA -0.075 4.265 4.340 0.000 0.000 0.207 5930 L C 2.525 179.423 176.870 0.046 0.000 1.078 5930 L CA 1.223 56.050 54.840 -0.023 0.000 0.749 5930 L CB -1.067 41.009 42.059 0.029 0.000 0.901 5930 L HN -0.051 nan 8.230 nan 0.000 0.433 5931 A N -1.334 121.551 122.820 0.108 0.000 1.930 5931 A HA -0.225 4.095 4.320 0.000 0.000 0.217 5931 A C 2.213 179.861 177.584 0.107 0.000 1.175 5931 A CA 1.324 53.453 52.037 0.155 0.000 0.627 5931 A CB -0.432 18.631 19.000 0.105 0.000 0.815 5931 A HN 0.525 nan 8.150 nan 0.000 0.443 5932 Q N -1.279 118.555 119.800 0.056 0.000 2.084 5932 Q HA -0.218 4.122 4.340 0.000 0.000 0.202 5932 Q C 2.156 178.169 176.000 0.022 0.000 0.978 5932 Q CA 1.532 57.352 55.803 0.029 0.000 0.844 5932 Q CB -0.392 28.356 28.738 0.017 0.000 0.898 5932 Q HN 0.910 nan 8.270 nan 0.000 0.426 5933 H N -0.251 118.765 119.070 -0.090 0.000 2.293 5933 H HA -0.163 4.393 4.556 0.000 0.000 0.300 5933 H C 1.548 176.816 175.328 -0.100 0.000 1.082 5933 H CA 1.589 57.547 56.048 -0.151 0.000 1.308 5933 H CB -0.056 29.529 29.762 -0.294 0.000 1.375 5933 H HN 0.266 nan 8.280 nan 0.000 0.495 5934 Y N 0.909 121.227 120.300 0.030 0.000 2.274 5934 Y HA -0.119 4.431 4.550 0.000 0.000 0.290 5934 Y C 2.962 178.814 175.900 -0.080 0.000 1.145 5934 Y CA 0.635 58.718 58.100 -0.029 0.000 1.203 5934 Y CB -0.521 37.977 38.460 0.063 0.000 0.984 5934 Y HN 0.155 nan 8.280 nan 0.000 0.533 5935 L N -1.115 120.161 121.223 0.089 0.000 2.046 5935 L HA -0.235 4.105 4.340 0.000 0.000 0.208 5935 L C 2.641 179.491 176.870 -0.034 0.000 1.077 5935 L CA 1.219 56.071 54.840 0.020 0.000 0.747 5935 L CB -0.813 41.252 42.059 0.009 0.000 0.896 5935 L HN 0.191 nan 8.230 nan 0.000 0.432 5936 A N -0.443 122.329 122.820 -0.080 0.000 1.933 5936 A HA -0.168 4.152 4.320 0.000 0.000 0.218 5936 A C 2.249 179.759 177.584 -0.124 0.000 1.175 5936 A CA 1.380 53.352 52.037 -0.108 0.000 0.628 5936 A CB -0.234 18.685 19.000 -0.135 0.000 0.814 5936 A HN 0.195 nan 8.150 nan 0.000 0.444 5937 K N -0.046 120.251 120.400 -0.173 0.000 2.296 5937 K HA -0.003 4.317 4.320 0.000 0.000 0.200 5937 K C 1.152 177.727 176.600 -0.043 0.000 1.048 5937 K CA 0.640 56.852 56.287 -0.125 0.000 0.966 5937 K CB -0.056 32.354 32.500 -0.150 0.000 0.754 5937 K HN 0.475 nan 8.250 nan 0.000 0.466 5938 E N -0.107 120.078 120.200 -0.024 0.000 2.489 5938 E HA 0.023 4.373 4.350 0.000 0.000 0.193 5938 E C 0.742 177.331 176.600 -0.020 0.000 1.057 5938 E CA 0.353 56.746 56.400 -0.012 0.000 0.866 5938 E CB 0.209 29.908 29.700 -0.002 0.000 0.916 5938 E HN 0.433 nan 8.360 nan 0.000 0.500 5939 G N 1.874 110.655 108.800 -0.030 0.000 2.147 5939 G HA2 -0.283 3.677 3.960 0.000 0.000 0.244 5939 G HA3 -0.283 3.677 3.960 0.000 0.000 0.244 5939 G C 0.242 175.124 174.900 -0.031 0.000 1.005 5939 G CA 0.146 45.228 45.100 -0.029 0.000 0.713 5939 G HN 0.257 nan 8.290 nan 0.000 0.515 5940 I N 1.151 121.700 120.570 -0.034 0.000 2.315 5940 I HA 0.442 4.612 4.170 0.000 0.000 0.291 5940 I C 1.018 177.099 176.117 -0.059 0.000 1.006 5940 I CA -1.144 60.131 61.300 -0.041 0.000 1.265 5940 I CB 1.563 39.544 38.000 -0.033 0.000 1.387 5940 I HN 0.151 nan 8.210 nan 0.000 0.475 5941 V N 3.826 123.694 119.914 -0.076 0.000 2.644 5941 V HA 0.937 5.058 4.120 0.000 0.000 0.295 5941 V C 0.050 176.044 176.094 -0.167 0.000 1.053 5941 V CA -0.227 62.011 62.300 -0.103 0.000 0.987 5941 V CB 1.265 33.030 31.823 -0.097 0.000 1.006 5941 V HN 0.855 nan 8.190 nan 0.000 0.472 5942 A N 3.233 125.950 122.820 -0.173 0.000 2.594 5942 A HA 1.004 5.324 4.320 0.000 0.000 0.295 5942 A C -0.468 177.000 177.584 -0.193 0.000 1.071 5942 A CA -0.330 51.577 52.037 -0.217 0.000 0.685 5942 A CB 1.741 20.668 19.000 -0.122 0.000 1.285 5942 A HN 2.449 nan 8.150 nan 0.000 0.405 5943 A N 1.436 124.121 122.820 -0.224 0.000 2.398 5943 A HA 0.764 5.084 4.320 0.000 0.000 0.301 5943 A C -0.153 177.428 177.584 -0.005 0.000 1.041 5943 A CA -0.550 51.434 52.037 -0.088 0.000 0.711 5943 A CB 0.944 19.916 19.000 -0.047 0.000 1.240 5943 A HN 1.353 nan 8.150 nan 0.000 0.420 5944 R N 1.691 122.201 120.500 0.016 0.000 2.608 5944 R HA 0.731 5.071 4.340 0.000 0.000 0.255 5944 R C -0.346 175.982 176.300 0.048 0.000 1.086 5944 R CA -0.741 55.379 56.100 0.033 0.000 1.125 5944 R CB 0.400 30.711 30.300 0.019 0.000 1.193 5944 R HN 0.504 nan 8.270 nan 0.000 0.553 5945 R N -0.944 119.582 120.500 0.043 0.000 3.516 5945 R HA -0.110 4.230 4.340 0.000 0.000 0.271 5945 R C -0.712 175.615 176.300 0.045 0.000 1.098 5945 R CA 0.571 56.693 56.100 0.037 0.000 0.732 5945 R CB -2.662 27.654 30.300 0.026 0.000 1.152 5945 R HN 0.528 nan 8.270 nan 0.000 0.455 5946 V N 1.509 121.463 119.914 0.067 0.000 2.572 5946 V HA 0.035 4.155 4.120 0.000 0.000 0.291 5946 V C 1.492 177.605 176.094 0.031 0.000 1.039 5946 V CA -0.127 62.217 62.300 0.073 0.000 1.055 5946 V CB 1.165 33.069 31.823 0.134 0.000 0.969 5946 V HN 0.148 nan 8.190 nan 0.000 0.482 5947 K N 4.134 124.540 120.400 0.010 0.000 2.489 5947 K HA -0.025 4.295 4.320 0.000 0.000 0.278 5947 K C 1.376 177.967 176.600 -0.015 0.000 1.000 5947 K CA 0.088 56.371 56.287 -0.006 0.000 1.012 5947 K CB 0.322 32.811 32.500 -0.017 0.000 0.903 5947 K HN 0.710 nan 8.250 nan 0.000 0.485 5948 K N 2.295 122.689 120.400 -0.010 0.000 2.113 5948 K HA -0.218 4.102 4.320 0.000 0.000 0.208 5948 K C 1.863 178.446 176.600 -0.028 0.000 1.047 5948 K CA 2.022 58.301 56.287 -0.014 0.000 0.928 5948 K CB -0.138 32.357 32.500 -0.008 0.000 0.716 5948 K HN 0.619 nan 8.250 nan 0.000 0.446 5949 S N 0.655 116.337 115.700 -0.031 0.000 2.368 5949 S HA -0.156 4.314 4.470 0.000 0.000 0.225 5949 S C 1.349 175.911 174.600 -0.062 0.000 1.030 5949 S CA 1.736 59.912 58.200 -0.040 0.000 0.999 5949 S CB -0.340 62.838 63.200 -0.036 0.000 0.844 5949 S HN 0.372 nan 8.310 nan 0.000 0.459 5950 D N 0.858 121.214 120.400 -0.074 0.000 2.144 5950 D HA -0.034 4.606 4.640 0.000 0.000 0.200 5950 D C 1.976 178.182 176.300 -0.155 0.000 0.978 5950 D CA 0.878 54.805 54.000 -0.120 0.000 0.833 5950 D CB -0.235 40.492 40.800 -0.121 0.000 0.961 5950 D HN 0.375 nan 8.370 nan 0.000 0.470 5951 M N 0.476 120.012 119.600 -0.106 0.000 2.159 5951 M HA -0.089 4.391 4.480 0.000 0.000 0.263 5951 M C 1.881 178.131 176.300 -0.084 0.000 1.063 5951 M CA 1.196 56.440 55.300 -0.093 0.000 1.110 5951 M CB -0.736 31.844 32.600 -0.034 0.000 1.374 5951 M HN 0.111 nan 8.290 nan 0.000 0.411 5952 E N -0.005 120.154 120.200 -0.067 0.000 2.107 5952 E HA -0.134 4.216 4.350 0.000 0.000 0.191 5952 E C 2.011 178.571 176.600 -0.068 0.000 0.982 5952 E CA 0.821 57.189 56.400 -0.054 0.000 0.809 5952 E CB 0.022 29.698 29.700 -0.040 0.000 0.756 5952 E HN 0.500 nan 8.360 nan 0.000 0.459 5953 K N 0.533 120.881 120.400 -0.088 0.000 2.148 5953 K HA -0.059 4.261 4.320 0.000 0.000 0.204 5953 K C 2.108 178.638 176.600 -0.117 0.000 1.050 5953 K CA 0.638 56.867 56.287 -0.095 0.000 0.942 5953 K CB 0.031 32.468 32.500 -0.104 0.000 0.724 5953 K HN 0.088 nan 8.250 nan 0.000 0.446 5954 L N 0.371 121.497 121.223 -0.161 0.000 2.093 5954 L HA -0.149 4.191 4.340 0.000 0.000 0.208 5954 L C 2.546 179.355 176.870 -0.101 0.000 1.085 5954 L CA 1.000 55.727 54.840 -0.188 0.000 0.755 5954 L CB -0.492 41.369 42.059 -0.329 0.000 0.904 5954 L HN 0.183 nan 8.230 nan 0.000 0.435 5955 A N 0.225 123.001 122.820 -0.073 0.000 1.877 5955 A HA -0.212 4.108 4.320 0.000 0.000 0.216 5955 A C 2.323 179.891 177.584 -0.026 0.000 1.186 5955 A CA 1.688 53.704 52.037 -0.035 0.000 0.620 5955 A CB -0.301 18.684 19.000 -0.026 0.000 0.822 5955 A HN 0.316 nan 8.150 nan 0.000 0.443 5956 K N -0.437 119.943 120.400 -0.035 0.000 2.103 5956 K HA 0.068 4.388 4.320 0.000 0.000 0.204 5956 K C 2.339 178.922 176.600 -0.028 0.000 1.052 5956 K CA 0.938 57.209 56.287 -0.026 0.000 0.945 5956 K CB -0.256 32.225 32.500 -0.032 0.000 0.722 5956 K HN 0.426 nan 8.250 nan 0.000 0.443 5957 A N 1.344 124.137 122.820 -0.044 0.000 1.840 5957 A HA -0.146 4.175 4.320 0.000 0.000 0.214 5957 A C 2.329 179.900 177.584 -0.021 0.000 1.198 5957 A CA 2.209 54.220 52.037 -0.045 0.000 0.608 5957 A CB -1.096 17.868 19.000 -0.059 0.000 0.839 5957 A HN 0.436 nan 8.150 nan 0.000 0.443 5958 T N -4.157 110.388 114.554 -0.016 0.000 3.043 5958 T HA 0.356 4.706 4.350 0.000 0.000 0.263 5958 T C 1.425 176.137 174.700 0.021 0.000 1.094 5958 T CA 1.245 63.350 62.100 0.009 0.000 1.127 5958 T CB -0.155 68.724 68.868 0.017 0.000 0.905 5958 T HN 1.852 nan 8.240 nan 0.000 0.490 5959 G N 1.349 110.158 108.800 0.014 0.000 2.137 5959 G HA2 -0.001 3.960 3.960 0.000 0.000 0.237 5959 G HA3 -0.001 3.960 3.960 0.000 0.000 0.237 5959 G C 0.220 175.132 174.900 0.020 0.000 1.002 5959 G CA -0.039 45.074 45.100 0.022 0.000 0.702 5959 G HN 1.175 nan 8.290 nan 0.000 0.515 5960 A N -0.386 122.444 122.820 0.016 0.000 2.407 5960 A HA 0.623 4.943 4.320 0.000 0.000 0.248 5960 A C 0.418 178.012 177.584 0.016 0.000 1.082 5960 A CA 0.374 52.425 52.037 0.023 0.000 0.785 5960 A CB 0.475 19.494 19.000 0.032 0.000 1.020 5960 A HN 0.773 nan 8.150 nan 0.000 0.489 5961 N N 1.216 119.928 118.700 0.021 0.000 2.421 5961 N HA 0.371 5.111 4.740 0.000 0.000 0.285 5961 N C -0.879 174.643 175.510 0.019 0.000 1.027 5961 N CA -0.364 52.696 53.050 0.017 0.000 0.918 5961 N CB 1.307 39.803 38.487 0.016 0.000 1.152 5961 N HN 0.281 nan 8.380 nan 0.000 0.485 5962 V N 4.903 124.825 119.914 0.014 0.000 2.446 5962 V HA 0.179 4.300 4.120 0.000 0.000 0.276 5962 V C 0.258 176.362 176.094 0.018 0.000 1.030 5962 V CA -0.086 62.224 62.300 0.016 0.000 1.033 5962 V CB -0.271 31.557 31.823 0.008 0.000 0.993 5962 V HN 0.514 nan 8.190 nan 0.000 0.477 5963 I N 4.009 124.593 120.570 0.024 0.000 2.474 5963 I HA 0.455 4.625 4.170 0.000 0.000 0.294 5963 I C 0.976 177.106 176.117 0.022 0.000 1.005 5963 I CA -0.374 60.939 61.300 0.022 0.000 1.113 5963 I CB 1.479 39.492 38.000 0.023 0.000 1.289 5963 I HN 0.602 nan 8.210 nan 0.000 0.436 5964 A N 5.484 128.315 122.820 0.018 0.000 1.840 5964 A HA 0.361 4.681 4.320 0.000 0.000 0.214 5964 A C 1.109 178.704 177.584 0.018 0.000 1.198 5964 A CA 1.111 53.158 52.037 0.017 0.000 0.608 5964 A CB -0.156 18.853 19.000 0.014 0.000 0.839 5964 A HN 0.732 nan 8.150 nan 0.000 0.443 5965 A N -1.102 121.728 122.820 0.017 0.000 2.312 5965 A HA 0.651 4.971 4.320 0.000 0.000 0.328 5965 A C 0.824 178.417 177.584 0.016 0.000 1.158 5965 A CA -0.570 51.476 52.037 0.016 0.000 0.821 5965 A CB 0.400 19.408 19.000 0.013 0.000 1.170 5965 A HN 0.347 nan 8.150 nan 0.000 0.490 5966 I N 1.480 122.060 120.570 0.016 0.000 2.226 5966 I HA -0.287 3.883 4.170 0.000 0.000 0.245 5966 I C 2.779 178.903 176.117 0.012 0.000 1.100 5966 I CA 1.750 63.059 61.300 0.015 0.000 1.374 5966 I CB -0.270 37.739 38.000 0.015 0.000 1.057 5966 I HN 0.760 nan 8.210 nan 0.000 0.413 5967 A N 0.726 123.552 122.820 0.010 0.000 1.978 5967 A HA -0.181 4.139 4.320 0.000 0.000 0.220 5967 A C 2.447 180.035 177.584 0.008 0.000 1.170 5967 A CA 1.864 53.905 52.037 0.007 0.000 0.636 5967 A CB -0.714 18.290 19.000 0.006 0.000 0.810 5967 A HN 0.457 nan 8.150 nan 0.000 0.448 5968 A N -0.744 122.082 122.820 0.010 0.000 2.168 5968 A HA 0.308 4.628 4.320 0.000 0.000 0.215 5968 A C 0.991 178.582 177.584 0.011 0.000 1.152 5968 A CA -0.024 52.019 52.037 0.010 0.000 0.716 5968 A CB -0.465 18.541 19.000 0.011 0.000 0.794 5968 A HN 0.460 nan 8.150 nan 0.000 0.465 5969 L N 1.453 122.684 121.223 0.013 0.000 2.490 5969 L HA 0.215 4.555 4.340 0.000 0.000 0.274 5969 L C 0.667 177.544 176.870 0.011 0.000 1.201 5969 L CA 0.251 55.099 54.840 0.014 0.000 0.869 5969 L CB 0.574 42.642 42.059 0.015 0.000 1.123 5969 L HN 0.490 nan 8.230 nan 0.000 0.484 5970 S N 1.205 116.912 115.700 0.013 0.000 2.625 5970 S HA 0.569 5.039 4.470 0.000 0.000 0.271 5970 S C 0.356 174.964 174.600 0.013 0.000 1.161 5970 S CA -0.291 57.916 58.200 0.011 0.000 0.820 5970 S CB 1.520 64.725 63.200 0.009 0.000 1.137 5970 S HN 0.602 nan 8.310 nan 0.000 0.470 5971 A N 0.571 123.398 122.820 0.011 0.000 1.978 5971 A HA -0.133 4.187 4.320 0.000 0.000 0.220 5971 A C 2.057 179.650 177.584 0.014 0.000 1.170 5971 A CA 2.024 54.068 52.037 0.013 0.000 0.636 5971 A CB -1.110 17.896 19.000 0.010 0.000 0.810 5971 A HN 0.901 nan 8.150 nan 0.000 0.448 5972 Q N -0.796 119.012 119.800 0.012 0.000 2.369 5972 Q HA -0.143 4.197 4.340 0.000 0.000 0.206 5972 Q C 0.533 176.542 176.000 0.015 0.000 0.963 5972 Q CA 1.291 57.102 55.803 0.013 0.000 0.894 5972 Q CB 0.008 28.752 28.738 0.010 0.000 0.965 5972 Q HN 0.609 nan 8.270 nan 0.000 0.475 5973 D N -0.147 120.263 120.400 0.017 0.000 2.354 5973 D HA 0.079 4.719 4.640 0.000 0.000 0.209 5973 D C 0.120 176.436 176.300 0.025 0.000 1.015 5973 D CA 0.211 54.223 54.000 0.019 0.000 0.867 5973 D CB 0.392 41.204 40.800 0.019 0.000 0.933 5973 D HN 0.272 nan 8.370 nan 0.000 0.520 5974 L N 0.707 121.946 121.223 0.027 0.000 2.395 5974 L HA 0.397 4.737 4.340 0.000 0.000 0.269 5974 L C 1.194 178.084 176.870 0.034 0.000 1.133 5974 L CA -0.503 54.357 54.840 0.034 0.000 0.812 5974 L CB 1.207 43.285 42.059 0.032 0.000 1.125 5974 L HN -0.138 nan 8.230 nan 0.000 0.452 5975 G N 0.534 109.360 108.800 0.043 0.000 2.491 5975 G HA2 0.498 4.458 3.960 0.000 0.000 0.327 5975 G HA3 0.498 4.458 3.960 0.000 0.000 0.327 5975 G C -1.339 173.589 174.900 0.046 0.000 1.189 5975 G CA -0.424 44.701 45.100 0.041 0.000 0.956 5975 G HN 0.519 nan 8.290 nan 0.000 0.491 5976 D N -0.327 120.098 120.400 0.042 0.000 2.362 5976 D HA 0.657 5.297 4.640 0.000 0.000 0.247 5976 D C -0.268 176.059 176.300 0.046 0.000 1.050 5976 D CA 0.058 54.084 54.000 0.043 0.000 0.839 5976 D CB 1.978 42.800 40.800 0.037 0.000 1.283 5976 D HN 0.590 nan 8.370 nan 0.000 0.477 5977 A N 0.425 123.276 122.820 0.051 0.000 2.486 5977 A HA 0.649 4.969 4.320 0.000 0.000 0.300 5977 A C 1.001 178.614 177.584 0.049 0.000 1.048 5977 A CA -0.407 51.661 52.037 0.053 0.000 0.696 5977 A CB 1.669 20.712 19.000 0.071 0.000 1.278 5977 A HN 0.487 nan 8.150 nan 0.000 0.405 5978 G N 0.179 109.006 108.800 0.044 0.000 2.402 5978 G HA2 0.312 4.272 3.960 0.000 0.000 0.216 5978 G HA3 0.312 4.272 3.960 0.000 0.000 0.216 5978 G C 0.279 175.203 174.900 0.040 0.000 1.162 5978 G CA 1.659 46.781 45.100 0.038 0.000 0.777 5978 G HN 1.178 nan 8.290 nan 0.000 0.539 5979 L N -0.154 121.099 121.223 0.051 0.000 2.493 5979 L HA 0.639 4.979 4.340 0.000 0.000 0.265 5979 L C -1.414 175.506 176.870 0.083 0.000 0.954 5979 L CA -0.800 54.073 54.840 0.055 0.000 0.844 5979 L CB 2.545 44.630 42.059 0.043 0.000 1.302 5979 L HN -0.133 nan 8.230 nan 0.000 0.405 5980 V N 4.218 124.182 119.914 0.084 0.000 2.407 5980 V HA 0.638 4.758 4.120 0.000 0.000 0.291 5980 V C -0.536 175.616 176.094 0.096 0.000 1.018 5980 V CA -0.440 61.929 62.300 0.114 0.000 0.842 5980 V CB 1.456 33.348 31.823 0.114 0.000 0.996 5980 V HN 0.827 nan 8.190 nan 0.000 0.426 5981 E N 3.186 123.466 120.200 0.133 0.000 2.292 5981 E HA 0.412 4.762 4.350 0.000 0.000 0.272 5981 E C -1.038 175.657 176.600 0.160 0.000 0.881 5981 E CA -0.656 55.805 56.400 0.102 0.000 0.754 5981 E CB 2.193 31.921 29.700 0.047 0.000 1.201 5981 E HN 0.751 nan 8.360 nan 0.000 0.425 5982 E N 4.315 124.579 120.200 0.108 0.000 2.130 5982 E HA 0.261 4.611 4.350 0.000 0.000 0.284 5982 E C -0.897 175.761 176.600 0.097 0.000 1.018 5982 E CA -0.286 56.189 56.400 0.125 0.000 0.817 5982 E CB 0.698 30.441 29.700 0.072 0.000 1.078 5982 E HN 0.354 nan 8.360 nan 0.000 0.396 5983 R N 3.426 124.021 120.500 0.158 0.000 2.807 5983 R HA 0.381 4.721 4.340 0.000 0.000 0.276 5983 R C -0.739 175.632 176.300 0.118 0.000 0.979 5983 R CA -0.964 55.178 56.100 0.070 0.000 0.928 5983 R CB 1.879 32.116 30.300 -0.106 0.000 1.191 5983 R HN 0.321 nan 8.270 nan 0.000 0.471 5984 K N 2.487 122.921 120.400 0.057 0.000 2.262 5984 K HA 0.335 4.655 4.320 0.000 0.000 0.282 5984 K C -0.483 176.157 176.600 0.066 0.000 1.066 5984 K CA -0.328 55.996 56.287 0.061 0.000 0.901 5984 K CB 0.792 33.311 32.500 0.031 0.000 1.089 5984 K HN 0.254 nan 8.250 nan 0.000 0.476 5985 I N 2.523 123.153 120.570 0.100 0.000 2.359 5985 I HA 0.051 4.221 4.170 0.000 0.000 0.284 5985 I C 0.700 176.853 176.117 0.061 0.000 1.018 5985 I CA -0.179 61.181 61.300 0.101 0.000 1.173 5985 I CB 0.658 38.763 38.000 0.175 0.000 1.326 5985 I HN 0.727 nan 8.210 nan 0.000 0.462 5986 S N 4.551 120.275 115.700 0.041 0.000 3.635 5986 S HA -0.212 4.258 4.470 0.000 0.000 0.328 5986 S C 1.389 176.002 174.600 0.022 0.000 1.135 5986 S CA 1.544 59.759 58.200 0.025 0.000 0.942 5986 S CB -1.045 62.168 63.200 0.022 0.000 0.930 5986 S HN 1.472 nan 8.310 nan 0.000 0.512 5987 G N -0.049 108.765 108.800 0.025 0.000 2.363 5987 G HA2 -0.283 3.677 3.960 0.000 0.000 0.238 5987 G HA3 -0.283 3.677 3.960 0.000 0.000 0.238 5987 G C -0.296 174.621 174.900 0.028 0.000 1.062 5987 G CA 0.305 45.418 45.100 0.022 0.000 0.629 5987 G HN 0.685 nan 8.290 nan 0.000 0.514 5988 D N 1.893 122.312 120.400 0.032 0.000 2.425 5988 D HA 0.460 5.100 4.640 0.000 0.000 0.247 5988 D C 1.020 177.352 176.300 0.053 0.000 1.147 5988 D CA 0.823 54.844 54.000 0.034 0.000 0.879 5988 D CB 1.276 42.092 40.800 0.027 0.000 1.179 5988 D HN 0.652 nan 8.370 nan 0.000 0.456 5989 S N 2.390 118.119 115.700 0.048 0.000 2.488 5989 S HA 0.460 4.930 4.470 0.000 0.000 0.278 5989 S C 0.129 174.770 174.600 0.070 0.000 1.259 5989 S CA -0.609 57.628 58.200 0.063 0.000 1.061 5989 S CB 0.501 63.728 63.200 0.046 0.000 0.910 5989 S HN 0.365 nan 8.310 nan 0.000 0.491 5990 M N 2.903 122.572 119.600 0.115 0.000 2.550 5990 M HA 0.517 4.997 4.480 0.000 0.000 0.292 5990 M C -1.093 175.297 176.300 0.150 0.000 1.221 5990 M CA -0.576 54.775 55.300 0.084 0.000 0.873 5990 M CB 2.283 34.907 32.600 0.040 0.000 1.727 5990 M HN 0.549 nan 8.290 nan 0.000 0.459 5991 I N 1.783 122.386 120.570 0.056 0.000 2.362 5991 I HA 0.367 4.537 4.170 0.000 0.000 0.289 5991 I C -1.332 174.795 176.117 0.016 0.000 0.994 5991 I CA -0.388 60.996 61.300 0.139 0.000 1.158 5991 I CB 1.064 39.169 38.000 0.176 0.000 1.315 5991 I HN 0.467 nan 8.210 nan 0.000 0.451 5992 F N 6.114 126.102 119.950 0.062 0.000 2.334 5992 F HA 0.333 4.860 4.527 0.000 0.000 0.367 5992 F C 0.129 175.965 175.800 0.060 0.000 1.115 5992 F CA -0.676 57.351 58.000 0.046 0.000 1.116 5992 F CB 1.227 40.244 39.000 0.028 0.000 1.230 5992 F HN 0.037 nan 8.300 nan 0.000 0.484 5993 V N 4.652 124.655 119.914 0.149 0.000 2.304 5993 V HA 0.315 4.435 4.120 0.000 0.000 0.269 5993 V C -0.137 176.013 176.094 0.092 0.000 1.036 5993 V CA -0.516 61.859 62.300 0.124 0.000 0.840 5993 V CB 0.342 32.215 31.823 0.084 0.000 1.036 5993 V HN 0.793 nan 8.190 nan 0.000 0.466 5994 E N 3.158 123.423 120.200 0.107 0.000 2.423 5994 E HA 0.608 4.959 4.350 0.000 0.000 0.269 5994 E C -0.727 175.909 176.600 0.060 0.000 0.948 5994 E CA -0.856 55.595 56.400 0.086 0.000 0.802 5994 E CB 1.568 31.338 29.700 0.117 0.000 1.339 5994 E HN 0.206 nan 8.360 nan 0.000 0.445 5995 E N -0.792 119.434 120.200 0.045 0.000 2.416 5995 E HA -0.150 4.200 4.350 0.000 0.000 0.249 5995 E C -0.725 175.894 176.600 0.032 0.000 1.124 5995 E CA 0.569 56.990 56.400 0.034 0.000 0.732 5995 E CB -2.290 27.431 29.700 0.034 0.000 1.286 5995 E HN 0.567 nan 8.360 nan 0.000 0.394 5996 C N 0.637 119.953 119.300 0.026 0.000 2.676 5996 C HA 0.068 4.528 4.460 0.000 0.000 0.416 5996 C C 2.282 177.291 174.990 0.031 0.000 1.299 5996 C CA -0.158 58.874 59.018 0.024 0.000 2.048 5996 C CB 0.452 28.195 27.740 0.006 0.000 2.713 5996 C HN 0.410 nan 8.230 nan 0.000 0.624 5997 K N 0.627 121.056 120.400 0.047 0.000 1.969 5997 K HA -0.145 4.175 4.320 0.000 0.000 0.216 5997 K C 0.601 177.270 176.600 0.115 0.000 1.048 5997 K CA 1.713 58.042 56.287 0.070 0.000 0.948 5997 K CB -0.124 32.418 32.500 0.070 0.000 0.726 5997 K HN 0.749 nan 8.250 nan 0.000 0.442 5998 H N 0.623 119.697 119.070 0.006 0.000 2.569 5998 H HA 0.216 4.773 4.556 0.000 0.000 0.247 5998 H C -2.675 172.654 175.328 0.001 0.000 1.346 5998 H CA -2.319 53.731 56.048 0.004 0.000 1.502 5998 H CB 0.537 30.301 29.762 0.003 0.000 1.512 5998 H HN -0.020 nan 8.280 nan 0.000 0.502 5999 P HA 0.074 nan 4.420 nan 0.000 0.271 5999 P C 0.318 177.479 177.300 -0.232 0.000 1.220 5999 P CA -0.263 62.749 63.100 -0.148 0.000 0.768 5999 P CB 1.666 33.307 31.700 -0.099 0.000 0.848 6000 K N 1.621 121.942 120.400 -0.131 0.000 2.374 6000 K HA 0.316 4.636 4.320 0.000 0.000 0.196 6000 K C -0.038 176.517 176.600 -0.075 0.000 1.023 6000 K CA -0.080 56.146 56.287 -0.102 0.000 1.103 6000 K CB 0.361 32.839 32.500 -0.037 0.000 0.848 6000 K HN 0.576 nan 8.250 nan 0.000 0.528 6001 A N 0.956 123.731 122.820 -0.075 0.000 2.427 6001 A HA 0.528 4.848 4.320 0.000 0.000 0.298 6001 A C -0.940 176.605 177.584 -0.065 0.000 1.036 6001 A CA -0.740 51.258 52.037 -0.063 0.000 0.701 6001 A CB 1.467 20.430 19.000 -0.061 0.000 1.250 6001 A HN 0.042 nan 8.150 nan 0.000 0.412 6002 V N -0.796 119.084 119.914 -0.057 0.000 3.074 6002 V HA 0.969 5.089 4.120 0.000 0.000 0.314 6002 V C -0.428 175.637 176.094 -0.049 0.000 1.117 6002 V CA -0.612 61.658 62.300 -0.049 0.000 1.014 6002 V CB 1.722 33.520 31.823 -0.041 0.000 1.057 6002 V HN 0.826 nan 8.190 nan 0.000 0.438 6003 T N 3.967 118.494 114.554 -0.045 0.000 2.841 6003 T HA 0.552 4.902 4.350 0.000 0.000 0.285 6003 T C -0.572 174.109 174.700 -0.031 0.000 0.991 6003 T CA -0.207 61.861 62.100 -0.053 0.000 0.966 6003 T CB 1.358 70.173 68.868 -0.089 0.000 0.962 6003 T HN 0.956 nan 8.240 nan 0.000 0.438 6004 M N 4.624 124.207 119.600 -0.028 0.000 2.101 6004 M HA 0.544 5.024 4.480 0.000 0.000 0.340 6004 M C -1.420 174.874 176.300 -0.010 0.000 1.057 6004 M CA -1.087 54.208 55.300 -0.009 0.000 0.984 6004 M CB 0.564 33.159 32.600 -0.008 0.000 1.560 6004 M HN 0.484 nan 8.290 nan 0.000 0.435 6005 L N 7.059 128.289 121.223 0.013 0.000 2.257 6005 L HA 0.518 4.858 4.340 0.000 0.000 0.290 6005 L C -1.386 175.502 176.870 0.030 0.000 1.044 6005 L CA -0.034 54.819 54.840 0.022 0.000 0.810 6005 L CB 0.807 42.909 42.059 0.071 0.000 1.193 6005 L HN 0.674 nan 8.230 nan 0.000 0.425 6006 I N 5.964 126.545 120.570 0.017 0.000 2.331 6006 I HA 0.481 4.651 4.170 0.000 0.000 0.292 6006 I C 0.163 176.294 176.117 0.022 0.000 0.998 6006 I CA -0.074 61.237 61.300 0.017 0.000 1.267 6006 I CB 0.686 38.692 38.000 0.009 0.000 1.386 6006 I HN 0.522 nan 8.210 nan 0.000 0.476 6007 R N 3.993 124.507 120.500 0.024 0.000 2.873 6007 R HA 0.944 5.284 4.340 0.000 0.000 0.264 6007 R C -0.232 176.079 176.300 0.019 0.000 1.026 6007 R CA -1.154 54.961 56.100 0.024 0.000 1.002 6007 R CB 1.798 32.114 30.300 0.028 0.000 1.174 6007 R HN 0.821 nan 8.270 nan 0.000 0.488 6008 G N -0.872 107.939 108.800 0.017 0.000 2.340 6008 G HA2 0.061 4.022 3.960 0.000 0.000 0.298 6008 G HA3 0.061 4.022 3.960 0.000 0.000 0.298 6008 G C -0.008 174.901 174.900 0.015 0.000 1.498 6008 G CA -0.560 44.550 45.100 0.017 0.000 0.847 6008 G HN 0.303 nan 8.290 nan 0.000 0.594 6009 T N 0.372 114.936 114.554 0.017 0.000 2.915 6009 T HA 0.200 4.550 4.350 0.000 0.000 0.269 6009 T C 0.866 175.575 174.700 0.015 0.000 1.071 6009 T CA 2.028 64.138 62.100 0.016 0.000 1.132 6009 T CB -0.163 68.717 68.868 0.019 0.000 0.878 6009 T HN 0.666 nan 8.240 nan 0.000 0.479 6010 T N -0.175 114.390 114.554 0.017 0.000 2.853 6010 T HA 0.279 4.630 4.350 0.000 0.000 0.311 6010 T C 0.604 175.296 174.700 -0.012 0.000 1.307 6010 T CA -0.746 61.359 62.100 0.009 0.000 1.019 6010 T CB 2.549 71.440 68.868 0.038 0.000 1.264 6010 T HN -0.081 nan 8.240 nan 0.000 0.497 6011 E N 0.796 120.952 120.200 -0.073 0.000 2.086 6011 E HA -0.256 4.094 4.350 0.000 0.000 0.200 6011 E C 1.543 178.061 176.600 -0.137 0.000 1.012 6011 E CA 2.052 58.366 56.400 -0.144 0.000 0.812 6011 E CB -0.126 29.419 29.700 -0.258 0.000 0.743 6011 E HN 0.625 nan 8.360 nan 0.000 0.453 6012 H N -0.937 118.136 119.070 0.004 0.000 2.495 6012 H HA 0.014 4.570 4.556 0.000 0.000 0.287 6012 H C 2.122 177.452 175.328 0.004 0.000 1.033 6012 H CA 1.211 57.261 56.048 0.003 0.000 1.307 6012 H CB -0.009 29.755 29.762 0.002 0.000 1.401 6012 H HN 0.120 nan 8.280 nan 0.000 0.555 6013 V N 2.036 122.015 119.914 0.109 0.000 2.283 6013 V HA -0.211 3.909 4.120 0.000 0.000 0.243 6013 V C 2.673 178.793 176.094 0.043 0.000 1.039 6013 V CA 1.745 64.084 62.300 0.064 0.000 1.016 6013 V CB -0.571 31.279 31.823 0.046 0.000 0.650 6013 V HN 0.408 nan 8.190 nan 0.000 0.449 6014 I N -1.016 119.569 120.570 0.026 0.000 2.614 6014 I HA -0.162 4.008 4.170 0.000 0.000 0.258 6014 I C 2.256 178.382 176.117 0.016 0.000 1.189 6014 I CA 1.905 63.214 61.300 0.015 0.000 1.462 6014 I CB -0.520 37.482 38.000 0.003 0.000 1.092 6014 I HN 0.427 nan 8.210 nan 0.000 0.442 6015 E N 1.862 122.077 120.200 0.025 0.000 2.047 6015 E HA -0.293 4.057 4.350 0.000 0.000 0.191 6015 E C 2.210 178.834 176.600 0.040 0.000 0.987 6015 E CA 1.387 57.808 56.400 0.035 0.000 0.799 6015 E CB -0.100 29.642 29.700 0.069 0.000 0.752 6015 E HN 0.681 nan 8.360 nan 0.000 0.449 6016 E N -0.174 120.056 120.200 0.049 0.000 2.106 6016 E HA -0.146 4.204 4.350 0.000 0.000 0.192 6016 E C 2.068 178.683 176.600 0.025 0.000 0.984 6016 E CA 1.088 57.509 56.400 0.036 0.000 0.806 6016 E CB 0.246 29.969 29.700 0.037 0.000 0.750 6016 E HN 0.168 nan 8.360 nan 0.000 0.458 6017 V N 1.040 120.969 119.914 0.024 0.000 2.379 6017 V HA -0.209 3.911 4.120 0.000 0.000 0.245 6017 V C 2.428 178.530 176.094 0.013 0.000 1.044 6017 V CA 1.631 63.942 62.300 0.018 0.000 1.036 6017 V CB -0.654 31.180 31.823 0.018 0.000 0.664 6017 V HN 0.408 nan 8.190 nan 0.000 0.453 6018 A N 0.549 123.376 122.820 0.011 0.000 1.908 6018 A HA -0.292 4.028 4.320 0.000 0.000 0.218 6018 A C 2.304 179.892 177.584 0.005 0.000 1.181 6018 A CA 2.372 54.413 52.037 0.005 0.000 0.627 6018 A CB -0.538 18.464 19.000 0.002 0.000 0.818 6018 A HN 0.481 nan 8.150 nan 0.000 0.445 6019 R N 0.082 120.588 120.500 0.010 0.000 2.075 6019 R HA 0.010 4.350 4.340 0.000 0.000 0.232 6019 R C 2.152 178.457 176.300 0.008 0.000 1.126 6019 R CA 1.920 58.025 56.100 0.009 0.000 0.963 6019 R CB -0.843 29.464 30.300 0.012 0.000 0.858 6019 R HN 0.377 nan 8.270 nan 0.000 0.435 6020 A N 0.201 123.027 122.820 0.011 0.000 1.877 6020 A HA -0.122 4.198 4.320 0.000 0.000 0.216 6020 A C 2.240 179.829 177.584 0.008 0.000 1.186 6020 A CA 1.983 54.026 52.037 0.011 0.000 0.620 6020 A CB -0.952 18.056 19.000 0.015 0.000 0.822 6020 A HN 0.332 nan 8.150 nan 0.000 0.443 6021 V N -2.322 117.597 119.914 0.007 0.000 2.871 6021 V HA -0.130 3.990 4.120 0.000 0.000 0.256 6021 V C 1.926 178.021 176.094 0.001 0.000 1.082 6021 V CA 2.059 64.362 62.300 0.004 0.000 1.105 6021 V CB -0.709 31.116 31.823 0.003 0.000 0.713 6021 V HN 0.543 nan 8.190 nan 0.000 0.473 6022 D N 1.526 121.926 120.400 0.000 0.000 2.123 6022 D HA -0.258 4.382 4.640 0.000 0.000 0.196 6022 D C 1.602 177.901 176.300 -0.001 0.000 0.992 6022 D CA 2.261 56.260 54.000 -0.002 0.000 0.833 6022 D CB -0.068 40.730 40.800 -0.002 0.000 0.954 6022 D HN 0.612 nan 8.370 nan 0.000 0.455 6023 D N -0.035 120.366 120.400 0.002 0.000 2.149 6023 D HA -0.016 4.624 4.640 0.000 0.000 0.201 6023 D C 2.012 178.314 176.300 0.003 0.000 0.972 6023 D CA 1.201 55.203 54.000 0.003 0.000 0.835 6023 D CB -0.239 40.564 40.800 0.005 0.000 0.966 6023 D HN 0.239 nan 8.370 nan 0.000 0.476 6024 A N 0.408 123.230 122.820 0.004 0.000 1.902 6024 A HA -0.144 4.176 4.320 0.000 0.000 0.217 6024 A C 2.334 179.919 177.584 0.001 0.000 1.181 6024 A CA 1.065 53.104 52.037 0.004 0.000 0.623 6024 A CB -0.789 18.213 19.000 0.004 0.000 0.818 6024 A HN 0.149 nan 8.150 nan 0.000 0.443 6025 V N -0.074 119.839 119.914 -0.001 0.000 2.343 6025 V HA -0.183 3.937 4.120 0.000 0.000 0.247 6025 V C 2.805 178.897 176.094 -0.003 0.000 1.051 6025 V CA 1.889 64.186 62.300 -0.004 0.000 1.036 6025 V CB -1.436 30.383 31.823 -0.007 0.000 0.654 6025 V HN 0.618 nan 8.190 nan 0.000 0.451 6026 G N 0.548 109.347 108.800 -0.002 0.000 2.446 6026 G HA2 -0.231 3.729 3.960 0.000 0.000 0.217 6026 G HA3 -0.231 3.729 3.960 0.000 0.000 0.217 6026 G C 1.694 176.594 174.900 0.000 0.000 1.168 6026 G CA 1.671 46.770 45.100 -0.001 0.000 0.771 6026 G HN 0.604 nan 8.290 nan 0.000 0.551 6027 V N -1.722 118.193 119.914 0.001 0.000 2.788 6027 V HA 0.069 4.189 4.120 0.000 0.000 0.251 6027 V C 2.566 178.661 176.094 0.002 0.000 1.068 6027 V CA 1.168 63.470 62.300 0.003 0.000 1.090 6027 V CB -0.181 31.645 31.823 0.005 0.000 0.710 6027 V HN 0.123 nan 8.190 nan 0.000 0.467 6028 V N 1.847 121.761 119.914 0.001 0.000 2.719 6028 V HA 0.077 4.197 4.120 0.000 0.000 0.252 6028 V C 2.783 178.877 176.094 -0.000 0.000 1.065 6028 V CA 1.857 64.157 62.300 0.001 0.000 1.086 6028 V CB -0.819 31.004 31.823 -0.001 0.000 0.700 6028 V HN 0.616 nan 8.190 nan 0.000 0.467 6029 G N -1.234 107.566 108.800 -0.001 0.000 2.421 6029 G HA2 -0.208 3.752 3.960 0.000 0.000 0.217 6029 G HA3 -0.208 3.752 3.960 0.000 0.000 0.217 6029 G C 1.682 176.582 174.900 0.000 0.000 1.143 6029 G CA 1.157 46.256 45.100 -0.001 0.000 0.784 6029 G HN 0.527 nan 8.290 nan 0.000 0.541 6030 C N 0.619 119.920 119.300 0.001 0.000 2.429 6030 C HA -0.013 4.447 4.460 0.000 0.000 0.277 6030 C C 3.183 178.175 174.990 0.002 0.000 1.262 6030 C CA 1.514 60.533 59.018 0.002 0.000 1.733 6030 C CB -0.922 26.820 27.740 0.002 0.000 2.010 6030 C HN 0.414 nan 8.230 nan 0.000 0.483 6031 T N 1.028 115.583 114.554 0.003 0.000 2.915 6031 T HA -0.004 4.347 4.350 0.000 0.000 0.269 6031 T C 1.574 176.276 174.700 0.003 0.000 1.071 6031 T CA 1.058 63.160 62.100 0.003 0.000 1.132 6031 T CB -0.191 68.679 68.868 0.003 0.000 0.878 6031 T HN 0.504 nan 8.240 nan 0.000 0.479 6032 I N 0.525 121.096 120.570 0.003 0.000 2.333 6032 I HA -0.039 4.131 4.170 0.000 0.000 0.246 6032 I C 2.548 178.667 176.117 0.003 0.000 1.106 6032 I CA 1.115 62.416 61.300 0.003 0.000 1.411 6032 I CB -0.160 37.841 38.000 0.003 0.000 1.082 6032 I HN 0.244 nan 8.210 nan 0.000 0.420 6033 E N -0.079 120.122 120.200 0.003 0.000 2.072 6033 E HA -0.142 4.209 4.350 0.000 0.000 0.190 6033 E C 0.508 177.110 176.600 0.003 0.000 0.982 6033 E CA 0.719 57.121 56.400 0.003 0.000 0.803 6033 E CB 0.245 29.947 29.700 0.003 0.000 0.755 6033 E HN 0.191 nan 8.360 nan 0.000 0.453 6034 D N -0.582 119.819 120.400 0.003 0.000 2.454 6034 D HA 0.126 4.766 4.640 0.000 0.000 0.247 6034 D C -0.075 176.226 176.300 0.003 0.000 1.129 6034 D CA -0.301 53.701 54.000 0.003 0.000 0.877 6034 D CB 1.346 42.148 40.800 0.003 0.000 1.082 6034 D HN 0.088 nan 8.370 nan 0.000 0.537 6035 G N 3.209 112.011 108.800 0.003 0.000 3.332 6035 G HA2 0.030 3.990 3.960 0.000 0.000 0.242 6035 G HA3 0.030 3.990 3.960 0.000 0.000 0.242 6035 G C 0.477 175.379 174.900 0.004 0.000 1.276 6035 G CA -0.178 44.924 45.100 0.003 0.000 0.988 6035 G HN 0.204 nan 8.290 nan 0.000 0.517 6036 R N -0.343 120.159 120.500 0.004 0.000 2.562 6036 R HA 0.658 4.998 4.340 0.000 0.000 0.298 6036 R C -0.319 175.984 176.300 0.005 0.000 0.961 6036 R CA -0.640 55.463 56.100 0.005 0.000 0.881 6036 R CB 1.659 31.962 30.300 0.004 0.000 1.159 6036 R HN 0.294 nan 8.270 nan 0.000 0.450 6037 I N -0.917 119.657 120.570 0.007 0.000 3.145 6037 I HA 0.859 5.029 4.170 0.000 0.000 0.313 6037 I C -0.668 175.456 176.117 0.010 0.000 1.122 6037 I CA -1.254 60.051 61.300 0.008 0.000 0.987 6037 I CB 2.250 40.255 38.000 0.008 0.000 1.236 6037 I HN 0.336 nan 8.210 nan 0.000 0.453 6038 V N -0.250 119.671 119.914 0.013 0.000 3.049 6038 V HA 0.826 4.946 4.120 0.000 0.000 0.309 6038 V C 0.019 176.125 176.094 0.021 0.000 1.148 6038 V CA -0.380 61.930 62.300 0.017 0.000 0.990 6038 V CB 1.023 32.856 31.823 0.018 0.000 1.039 6038 V HN 1.178 nan 8.190 nan 0.000 0.430 6039 S N 1.949 117.666 115.700 0.028 0.000 2.576 6039 S HA 0.705 5.175 4.470 0.000 0.000 0.276 6039 S C 0.574 175.192 174.600 0.031 0.000 1.339 6039 S CA 0.177 58.397 58.200 0.032 0.000 1.039 6039 S CB 1.014 64.239 63.200 0.041 0.000 0.902 6039 S HN 1.826 nan 8.310 nan 0.000 0.516 6040 G N 0.146 108.965 108.800 0.031 0.000 2.630 6040 G HA2 0.532 4.492 3.960 0.000 0.000 0.223 6040 G HA3 0.532 4.492 3.960 0.000 0.000 0.223 6040 G C 0.925 175.842 174.900 0.028 0.000 1.434 6040 G CA -0.512 44.604 45.100 0.027 0.000 1.057 6040 G HN 2.055 nan 8.290 nan 0.000 0.570 6041 G N -2.049 106.766 108.800 0.025 0.000 2.153 6041 G HA2 0.221 4.181 3.960 0.000 0.000 0.252 6041 G HA3 0.221 4.181 3.960 0.000 0.000 0.252 6041 G C 1.525 176.423 174.900 -0.003 0.000 0.994 6041 G CA 1.157 46.269 45.100 0.020 0.000 0.698 6041 G HN 2.470 nan 8.290 nan 0.000 0.521 6042 G N -1.159 107.631 108.800 -0.017 0.000 2.168 6042 G HA2 -0.142 3.818 3.960 0.000 0.000 0.263 6042 G HA3 -0.142 3.818 3.960 0.000 0.000 0.263 6042 G C 1.499 176.356 174.900 -0.073 0.000 0.977 6042 G CA 1.767 46.840 45.100 -0.045 0.000 0.659 6042 G HN 1.981 nan 8.290 nan 0.000 0.533 6043 S N 0.086 115.762 115.700 -0.040 0.000 2.382 6043 S HA -0.159 4.311 4.470 0.000 0.000 0.228 6043 S C 2.799 177.336 174.600 -0.105 0.000 1.027 6043 S CA 2.656 60.820 58.200 -0.059 0.000 0.991 6043 S CB -0.593 62.679 63.200 0.120 0.000 0.823 6043 S HN 1.377 nan 8.310 nan 0.000 0.469 6044 T N 0.140 114.678 114.554 -0.027 0.000 2.569 6044 T HA -0.125 4.225 4.350 0.000 0.000 0.263 6044 T C 1.569 176.229 174.700 -0.066 0.000 1.074 6044 T CA 1.679 63.770 62.100 -0.014 0.000 1.176 6044 T CB -1.072 67.794 68.868 -0.004 0.000 0.863 6044 T HN 0.375 nan 8.240 nan 0.000 0.410 6045 E N 0.859 121.011 120.200 -0.080 0.000 2.219 6045 E HA -0.052 4.298 4.350 0.000 0.000 0.198 6045 E C 2.214 178.737 176.600 -0.128 0.000 0.998 6045 E CA 0.738 57.083 56.400 -0.092 0.000 0.818 6045 E CB -0.727 28.916 29.700 -0.096 0.000 0.741 6045 E HN 0.457 nan 8.360 nan 0.000 0.477 6046 V N 0.376 120.160 119.914 -0.216 0.000 2.453 6046 V HA -0.217 3.903 4.120 0.000 0.000 0.247 6046 V C 2.258 178.181 176.094 -0.286 0.000 1.048 6046 V CA 1.822 63.937 62.300 -0.309 0.000 1.049 6046 V CB -0.363 31.145 31.823 -0.525 0.000 0.672 6046 V HN 0.223 nan 8.190 nan 0.000 0.457 6047 E N 0.518 120.556 120.200 -0.269 0.000 2.051 6047 E HA -0.204 4.146 4.350 0.000 0.000 0.192 6047 E C 1.881 178.501 176.600 0.032 0.000 0.991 6047 E CA 1.447 57.882 56.400 0.059 0.000 0.799 6047 E CB -0.324 29.496 29.700 0.201 0.000 0.748 6047 E HN 0.368 nan 8.360 nan 0.000 0.449 6048 L N 0.356 121.577 121.223 -0.003 0.000 2.093 6048 L HA -0.052 4.288 4.340 0.000 0.000 0.208 6048 L C 2.410 179.293 176.870 0.022 0.000 1.085 6048 L CA 1.514 56.361 54.840 0.013 0.000 0.755 6048 L CB -0.878 41.187 42.059 0.010 0.000 0.904 6048 L HN 0.062 nan 8.230 nan 0.000 0.435 6049 S N -1.097 114.598 115.700 -0.009 0.000 2.356 6049 S HA -0.169 4.301 4.470 0.000 0.000 0.223 6049 S C 1.983 176.600 174.600 0.029 0.000 1.032 6049 S CA 1.226 59.427 58.200 0.001 0.000 1.005 6049 S CB -0.182 62.995 63.200 -0.037 0.000 0.867 6049 S HN 0.292 nan 8.310 nan 0.000 0.449 6050 M N 0.993 120.609 119.600 0.027 0.000 2.099 6050 M HA 0.007 4.487 4.480 0.000 0.000 0.262 6050 M C 1.997 178.335 176.300 0.064 0.000 1.067 6050 M CA 1.503 56.832 55.300 0.048 0.000 1.124 6050 M CB -1.167 31.472 32.600 0.064 0.000 1.353 6050 M HN 0.054 nan 8.290 nan 0.000 0.410 6051 K N 0.392 120.831 120.400 0.064 0.000 2.155 6051 K HA 0.073 4.393 4.320 0.000 0.000 0.203 6051 K C 1.960 178.621 176.600 0.101 0.000 1.052 6051 K CA 0.749 57.079 56.287 0.071 0.000 0.948 6051 K CB -0.428 32.100 32.500 0.048 0.000 0.728 6051 K HN 0.268 nan 8.250 nan 0.000 0.448 6052 L N -0.138 121.144 121.223 0.098 0.000 2.240 6052 L HA -0.057 4.283 4.340 0.000 0.000 0.211 6052 L C 2.114 179.095 176.870 0.185 0.000 1.106 6052 L CA 0.851 55.783 54.840 0.153 0.000 0.793 6052 L CB -0.171 41.977 42.059 0.150 0.000 0.927 6052 L HN 0.113 nan 8.230 nan 0.000 0.446 6053 R N 0.140 120.714 120.500 0.125 0.000 2.092 6053 R HA -0.148 4.193 4.340 0.000 0.000 0.231 6053 R C 2.045 178.401 176.300 0.093 0.000 1.119 6053 R CA 1.238 57.397 56.100 0.099 0.000 0.970 6053 R CB -0.170 30.171 30.300 0.068 0.000 0.864 6053 R HN 0.449 nan 8.270 nan 0.000 0.440 6054 E N -0.370 119.891 120.200 0.102 0.000 2.107 6054 E HA -0.200 4.150 4.350 0.000 0.000 0.191 6054 E C 1.580 178.248 176.600 0.113 0.000 0.982 6054 E CA 0.858 57.312 56.400 0.091 0.000 0.809 6054 E CB -0.099 29.652 29.700 0.086 0.000 0.756 6054 E HN 0.298 nan 8.360 nan 0.000 0.459 6055 Y N 1.383 121.696 120.300 0.021 0.000 2.181 6055 Y HA -0.207 4.343 4.550 0.000 0.000 0.288 6055 Y C 2.211 178.120 175.900 0.014 0.000 1.146 6055 Y CA 1.306 59.415 58.100 0.014 0.000 1.164 6055 Y CB -0.397 38.069 38.460 0.010 0.000 0.982 6055 Y HN -0.010 nan 8.280 nan 0.000 0.515 6056 A N -0.139 122.703 122.820 0.037 0.000 1.933 6056 A HA -0.225 4.095 4.320 0.000 0.000 0.218 6056 A C 2.103 179.647 177.584 -0.066 0.000 1.175 6056 A CA 1.887 53.909 52.037 -0.026 0.000 0.628 6056 A CB -0.791 18.246 19.000 0.061 0.000 0.814 6056 A HN 0.502 nan 8.150 nan 0.000 0.444 6057 E N -0.050 120.130 120.200 -0.033 0.000 2.110 6057 E HA -0.075 4.275 4.350 0.000 0.000 0.193 6057 E C 1.932 178.491 176.600 -0.068 0.000 0.988 6057 E CA 1.495 57.876 56.400 -0.032 0.000 0.804 6057 E CB -0.656 29.041 29.700 -0.005 0.000 0.745 6057 E HN 0.444 nan 8.360 nan 0.000 0.458 6058 G N 0.324 109.056 108.800 -0.113 0.000 2.421 6058 G HA2 -0.134 3.826 3.960 0.000 0.000 0.217 6058 G HA3 -0.134 3.826 3.960 0.000 0.000 0.217 6058 G C 1.433 176.221 174.900 -0.187 0.000 1.143 6058 G CA 0.615 45.632 45.100 -0.140 0.000 0.784 6058 G HN 0.201 nan 8.290 nan 0.000 0.541 6059 I N 0.368 120.779 120.570 -0.264 0.000 2.193 6059 I HA 0.005 4.175 4.170 0.000 0.000 0.240 6059 I C 1.705 177.749 176.117 -0.121 0.000 1.084 6059 I CA 1.086 62.245 61.300 -0.234 0.000 1.365 6059 I CB -1.092 36.743 38.000 -0.275 0.000 1.064 6059 I HN 0.298 nan 8.210 nan 0.000 0.410 6060 S N -1.235 114.411 115.700 -0.090 0.000 3.443 6060 S HA -0.117 4.353 4.470 0.000 0.000 0.635 6060 S C 0.766 175.344 174.600 -0.037 0.000 2.555 6060 S CA 1.447 59.617 58.200 -0.051 0.000 2.778 6060 S CB -1.357 61.815 63.200 -0.046 0.000 0.331 6060 S HN 1.428 nan 8.310 nan 0.000 1.765 6061 G N 1.142 109.927 108.800 -0.025 0.000 2.566 6061 G HA2 -0.337 3.623 3.960 0.000 0.000 0.280 6061 G HA3 -0.337 3.623 3.960 0.000 0.000 0.280 6061 G C 0.350 175.245 174.900 -0.008 0.000 1.225 6061 G CA 1.673 46.762 45.100 -0.017 0.000 0.966 6061 G HN 1.869 nan 8.290 nan 0.000 0.560 6062 R N 0.423 120.921 120.500 -0.003 0.000 2.223 6062 R HA 0.322 4.662 4.340 0.000 0.000 0.198 6062 R C 2.043 178.351 176.300 0.013 0.000 0.984 6062 R CA 1.360 57.464 56.100 0.008 0.000 1.018 6062 R CB -0.208 30.099 30.300 0.012 0.000 0.945 6062 R HN 0.640 nan 8.270 nan 0.000 0.479 6063 E N 2.087 122.289 120.200 0.003 0.000 2.204 6063 E HA -0.257 4.093 4.350 0.000 0.000 0.195 6063 E C 1.984 178.597 176.600 0.021 0.000 0.990 6063 E CA 1.615 58.020 56.400 0.008 0.000 0.821 6063 E CB -0.055 29.639 29.700 -0.010 0.000 0.750 6063 E HN 0.653 nan 8.360 nan 0.000 0.477 6064 Q N 0.843 120.647 119.800 0.007 0.000 2.124 6064 Q HA -0.188 4.152 4.340 0.000 0.000 0.202 6064 Q C 2.247 178.280 176.000 0.056 0.000 0.977 6064 Q CA 1.092 56.903 55.803 0.013 0.000 0.850 6064 Q CB -0.319 28.415 28.738 -0.006 0.000 0.901 6064 Q HN 0.223 nan 8.270 nan 0.000 0.429 6065 L N 1.211 122.468 121.223 0.056 0.000 2.083 6065 L HA -0.052 4.288 4.340 0.000 0.000 0.209 6065 L C 2.429 179.376 176.870 0.129 0.000 1.083 6065 L CA 2.028 56.913 54.840 0.076 0.000 0.752 6065 L CB -0.859 41.233 42.059 0.056 0.000 0.899 6065 L HN 0.338 nan 8.230 nan 0.000 0.433 6066 A N -1.349 121.556 122.820 0.141 0.000 1.902 6066 A HA -0.134 4.186 4.320 0.000 0.000 0.217 6066 A C 2.229 180.039 177.584 0.378 0.000 1.181 6066 A CA 1.928 54.118 52.037 0.256 0.000 0.623 6066 A CB -0.974 18.111 19.000 0.141 0.000 0.818 6066 A HN 0.290 nan 8.150 nan 0.000 0.443 6067 V N -0.124 119.933 119.914 0.238 0.000 2.453 6067 V HA -0.213 3.907 4.120 0.000 0.000 0.247 6067 V C 2.582 178.811 176.094 0.224 0.000 1.048 6067 V CA 1.999 64.435 62.300 0.227 0.000 1.049 6067 V CB -0.812 31.119 31.823 0.180 0.000 0.672 6067 V HN 0.508 nan 8.190 nan 0.000 0.457 6068 R N 0.385 120.986 120.500 0.168 0.000 2.081 6068 R HA -0.088 4.252 4.340 0.000 0.000 0.235 6068 R C 2.444 178.821 176.300 0.128 0.000 1.131 6068 R CA 1.494 57.671 56.100 0.128 0.000 0.960 6068 R CB -0.567 29.787 30.300 0.089 0.000 0.856 6068 R HN 0.520 nan 8.270 nan 0.000 0.436 6069 A N 0.564 123.482 122.820 0.163 0.000 1.930 6069 A HA -0.161 4.159 4.320 0.000 0.000 0.217 6069 A C 1.942 179.579 177.584 0.088 0.000 1.175 6069 A CA 0.889 53.012 52.037 0.144 0.000 0.627 6069 A CB -0.557 18.573 19.000 0.216 0.000 0.815 6069 A HN 0.341 nan 8.150 nan 0.000 0.443 6070 F N 0.916 120.835 119.950 -0.051 0.000 2.102 6070 F HA -0.087 4.440 4.527 0.000 0.000 0.298 6070 F C 2.538 178.253 175.800 -0.141 0.000 1.105 6070 F CA 1.335 59.177 58.000 -0.264 0.000 1.239 6070 F CB -0.264 38.550 39.000 -0.311 0.000 0.991 6070 F HN 0.255 nan 8.300 nan 0.000 0.474 6071 A N -0.159 122.754 122.820 0.155 0.000 1.902 6071 A HA -0.198 4.122 4.320 0.000 0.000 0.217 6071 A C 1.933 179.498 177.584 -0.031 0.000 1.181 6071 A CA 2.028 54.111 52.037 0.077 0.000 0.623 6071 A CB -0.981 18.088 19.000 0.116 0.000 0.818 6071 A HN 0.419 nan 8.150 nan 0.000 0.443 6072 D N -0.110 120.277 120.400 -0.021 0.000 2.178 6072 D HA 0.024 4.664 4.640 0.000 0.000 0.202 6072 D C 2.156 178.403 176.300 -0.089 0.000 0.974 6072 D CA 1.265 55.242 54.000 -0.039 0.000 0.841 6072 D CB -0.329 40.466 40.800 -0.008 0.000 0.953 6072 D HN 0.418 nan 8.370 nan 0.000 0.478 6073 A N 0.427 123.158 122.820 -0.148 0.000 1.972 6073 A HA -0.126 4.194 4.320 0.000 0.000 0.219 6073 A C 1.994 179.440 177.584 -0.230 0.000 1.169 6073 A CA 0.772 52.687 52.037 -0.203 0.000 0.635 6073 A CB -0.500 18.316 19.000 -0.308 0.000 0.810 6073 A HN 0.151 nan 8.150 nan 0.000 0.446 6074 L N 0.364 121.428 121.223 -0.265 0.000 2.353 6074 L HA -0.110 4.230 4.340 0.000 0.000 0.220 6074 L C 2.001 178.785 176.870 -0.143 0.000 1.133 6074 L CA 1.338 56.045 54.840 -0.222 0.000 0.798 6074 L CB -0.583 41.354 42.059 -0.203 0.000 0.922 6074 L HN 0.393 nan 8.230 nan 0.000 0.445 6075 E N -1.013 119.117 120.200 -0.117 0.000 2.409 6075 E HA -0.135 4.215 4.350 0.000 0.000 0.198 6075 E C 2.337 178.888 176.600 -0.081 0.000 1.024 6075 E CA 0.663 57.010 56.400 -0.088 0.000 0.861 6075 E CB -0.402 29.258 29.700 -0.068 0.000 0.788 6075 E HN 0.352 nan 8.360 nan 0.000 0.521 6076 V N 1.283 121.142 119.914 -0.092 0.000 2.568 6076 V HA -0.231 3.889 4.120 0.000 0.000 0.253 6076 V C 1.889 177.941 176.094 -0.070 0.000 1.072 6076 V CA 1.023 63.277 62.300 -0.077 0.000 1.084 6076 V CB -0.273 31.499 31.823 -0.085 0.000 0.676 6076 V HN 0.127 nan 8.190 nan 0.000 0.469 6077 I N 1.363 121.887 120.570 -0.077 0.000 2.133 6077 I HA -0.051 4.119 4.170 0.000 0.000 0.238 6077 I C 0.227 176.310 176.117 -0.058 0.000 1.074 6077 I CA 1.788 63.048 61.300 -0.067 0.000 1.342 6077 I CB -2.910 35.048 38.000 -0.070 0.000 1.053 6077 I HN 0.348 nan 8.210 nan 0.000 0.404 6078 P HA -0.145 nan 4.420 nan 0.000 0.221 6078 P C 1.750 179.022 177.300 -0.047 0.000 1.150 6078 P CA 1.389 64.459 63.100 -0.051 0.000 0.800 6078 P CB -0.131 31.537 31.700 -0.053 0.000 0.787 6079 R N -0.056 120.415 120.500 -0.049 0.000 2.066 6079 R HA -0.050 4.290 4.340 0.000 0.000 0.232 6079 R C 1.978 178.252 176.300 -0.043 0.000 1.131 6079 R CA 1.914 57.989 56.100 -0.043 0.000 0.955 6079 R CB -0.690 29.584 30.300 -0.043 0.000 0.851 6079 R HN 0.052 nan 8.270 nan 0.000 0.432 6080 T N 1.329 115.855 114.554 -0.047 0.000 2.942 6080 T HA 0.016 4.366 4.350 0.000 0.000 0.265 6080 T C 1.774 176.444 174.700 -0.050 0.000 1.062 6080 T CA 0.760 62.833 62.100 -0.046 0.000 1.139 6080 T CB -0.015 68.825 68.868 -0.046 0.000 0.883 6080 T HN 0.142 nan 8.240 nan 0.000 0.468 6081 L N 0.921 122.111 121.223 -0.054 0.000 2.042 6081 L HA -0.136 4.204 4.340 0.000 0.000 0.210 6081 L C 3.003 179.833 176.870 -0.067 0.000 1.076 6081 L CA 1.387 56.189 54.840 -0.063 0.000 0.749 6081 L CB -0.615 41.408 42.059 -0.060 0.000 0.893 6081 L HN 0.250 nan 8.230 nan 0.000 0.432 6082 A N -0.509 122.278 122.820 -0.055 0.000 1.929 6082 A HA -0.185 4.135 4.320 0.000 0.000 0.216 6082 A C 2.169 179.724 177.584 -0.049 0.000 1.176 6082 A CA 1.338 53.344 52.037 -0.051 0.000 0.628 6082 A CB -0.359 18.617 19.000 -0.040 0.000 0.816 6082 A HN 0.416 nan 8.150 nan 0.000 0.444 6083 E N 0.034 120.208 120.200 -0.044 0.000 2.058 6083 E HA -0.193 4.157 4.350 0.000 0.000 0.194 6083 E C 1.643 178.217 176.600 -0.044 0.000 0.997 6083 E CA 1.297 57.673 56.400 -0.040 0.000 0.801 6083 E CB -0.173 29.506 29.700 -0.036 0.000 0.746 6083 E HN 0.530 nan 8.360 nan 0.000 0.450 6084 N N 0.285 118.954 118.700 -0.052 0.000 2.309 6084 N HA -0.084 4.656 4.740 0.000 0.000 0.182 6084 N C 1.450 176.917 175.510 -0.071 0.000 1.018 6084 N CA 1.057 54.072 53.050 -0.058 0.000 0.876 6084 N CB -0.132 38.318 38.487 -0.062 0.000 0.972 6084 N HN 0.109 nan 8.380 nan 0.000 0.434 6085 A N -0.022 122.749 122.820 -0.082 0.000 2.067 6085 A HA 0.320 4.640 4.320 0.000 0.000 0.217 6085 A C 1.464 179.008 177.584 -0.066 0.000 1.156 6085 A CA 1.061 53.040 52.037 -0.096 0.000 0.683 6085 A CB -0.412 18.520 19.000 -0.114 0.000 0.808 6085 A HN 0.310 nan 8.150 nan 0.000 0.455 6086 G N -1.150 107.619 108.800 -0.051 0.000 2.171 6086 G HA2 -0.182 3.778 3.960 0.000 0.000 0.238 6086 G HA3 -0.182 3.778 3.960 0.000 0.000 0.238 6086 G C -0.060 174.821 174.900 -0.031 0.000 1.039 6086 G CA 0.317 45.395 45.100 -0.037 0.000 0.759 6086 G HN 0.446 nan 8.290 nan 0.000 0.501 6087 L N -0.089 121.113 121.223 -0.034 0.000 2.375 6087 L HA 0.484 4.824 4.340 0.000 0.000 0.268 6087 L C 0.476 177.333 176.870 -0.023 0.000 1.058 6087 L CA -1.075 53.748 54.840 -0.027 0.000 0.803 6087 L CB 0.934 42.974 42.059 -0.031 0.000 1.212 6087 L HN 0.113 nan 8.230 nan 0.000 0.451 6088 D N 1.056 121.446 120.400 -0.017 0.000 2.342 6088 D HA 0.118 4.758 4.640 0.000 0.000 0.260 6088 D C 0.739 177.029 176.300 -0.016 0.000 1.278 6088 D CA 0.118 54.109 54.000 -0.014 0.000 0.910 6088 D CB 1.734 42.528 40.800 -0.010 0.000 1.079 6088 D HN 0.632 nan 8.370 nan 0.000 0.496 6089 A N 5.462 128.271 122.820 -0.018 0.000 1.908 6089 A HA -0.196 4.125 4.320 0.000 0.000 0.218 6089 A C 2.159 179.733 177.584 -0.016 0.000 1.181 6089 A CA 0.863 52.888 52.037 -0.020 0.000 0.627 6089 A CB -0.270 18.717 19.000 -0.022 0.000 0.818 6089 A HN 0.705 nan 8.150 nan 0.000 0.445 6090 I N -0.162 120.400 120.570 -0.013 0.000 2.179 6090 I HA -0.213 3.957 4.170 0.000 0.000 0.242 6090 I C 2.452 178.565 176.117 -0.007 0.000 1.088 6090 I CA 1.870 63.164 61.300 -0.010 0.000 1.357 6090 I CB -1.462 36.534 38.000 -0.007 0.000 1.051 6090 I HN 0.601 nan 8.210 nan 0.000 0.409 6091 E N 1.484 121.680 120.200 -0.006 0.000 2.051 6091 E HA -0.228 4.122 4.350 0.000 0.000 0.192 6091 E C 2.343 178.941 176.600 -0.002 0.000 0.991 6091 E CA 1.796 58.194 56.400 -0.003 0.000 0.799 6091 E CB -0.110 29.589 29.700 -0.003 0.000 0.748 6091 E HN 0.610 nan 8.360 nan 0.000 0.449 6092 I N -1.414 119.153 120.570 -0.005 0.000 2.439 6092 I HA -0.163 4.007 4.170 0.000 0.000 0.251 6092 I C 2.225 178.339 176.117 -0.006 0.000 1.139 6092 I CA 0.874 62.171 61.300 -0.005 0.000 1.438 6092 I CB -0.340 37.654 38.000 -0.010 0.000 1.085 6092 I HN 0.073 nan 8.210 nan 0.000 0.427 6093 L N 0.778 121.995 121.223 -0.010 0.000 2.093 6093 L HA -0.110 4.230 4.340 0.000 0.000 0.208 6093 L C 2.681 179.548 176.870 -0.005 0.000 1.085 6093 L CA 0.808 55.640 54.840 -0.013 0.000 0.755 6093 L CB -0.404 41.645 42.059 -0.017 0.000 0.904 6093 L HN 0.168 nan 8.230 nan 0.000 0.435 6094 V N -0.267 119.647 119.914 -0.001 0.000 2.323 6094 V HA -0.231 3.889 4.120 0.000 0.000 0.244 6094 V C 2.377 178.478 176.094 0.012 0.000 1.041 6094 V CA 1.650 63.953 62.300 0.005 0.000 1.025 6094 V CB -0.381 31.445 31.823 0.005 0.000 0.656 6094 V HN 0.384 nan 8.190 nan 0.000 0.451 6095 K N -0.369 120.037 120.400 0.011 0.000 2.103 6095 K HA -0.047 4.273 4.320 0.000 0.000 0.204 6095 K C 2.046 178.662 176.600 0.027 0.000 1.052 6095 K CA 1.005 57.302 56.287 0.017 0.000 0.945 6095 K CB -0.187 32.321 32.500 0.013 0.000 0.722 6095 K HN 0.292 nan 8.250 nan 0.000 0.443 6096 V N 1.185 121.113 119.914 0.023 0.000 2.323 6096 V HA -0.176 3.944 4.120 0.000 0.000 0.244 6096 V C 2.356 178.484 176.094 0.057 0.000 1.041 6096 V CA 1.460 63.782 62.300 0.035 0.000 1.025 6096 V CB -0.394 31.436 31.823 0.012 0.000 0.656 6096 V HN 0.270 nan 8.190 nan 0.000 0.451 6097 R N 0.093 120.611 120.500 0.030 0.000 2.081 6097 R HA -0.165 4.175 4.340 0.000 0.000 0.235 6097 R C 2.292 178.640 176.300 0.080 0.000 1.131 6097 R CA 1.722 57.844 56.100 0.037 0.000 0.960 6097 R CB -0.411 29.894 30.300 0.009 0.000 0.856 6097 R HN 0.500 nan 8.270 nan 0.000 0.436 6098 A N 0.491 123.344 122.820 0.055 0.000 1.873 6098 A HA -0.050 4.270 4.320 0.000 0.000 0.215 6098 A C 2.316 179.932 177.584 0.054 0.000 1.186 6098 A CA 1.537 53.603 52.037 0.049 0.000 0.616 6098 A CB -0.752 18.266 19.000 0.031 0.000 0.823 6098 A HN 0.506 nan 8.150 nan 0.000 0.442 6099 A N -0.985 121.868 122.820 0.056 0.000 1.933 6099 A HA -0.147 4.173 4.320 0.000 0.000 0.218 6099 A C 1.983 179.599 177.584 0.053 0.000 1.175 6099 A CA 2.070 54.134 52.037 0.046 0.000 0.628 6099 A CB -0.847 18.178 19.000 0.042 0.000 0.814 6099 A HN 0.805 nan 8.150 nan 0.000 0.444 6100 H N -0.111 118.962 119.070 0.005 0.000 2.293 6100 H HA 0.049 4.605 4.556 0.000 0.000 0.300 6100 H C 2.180 177.511 175.328 0.005 0.000 1.082 6100 H CA 2.063 58.114 56.048 0.005 0.000 1.308 6100 H CB -0.246 29.518 29.762 0.004 0.000 1.375 6100 H HN 0.367 nan 8.280 nan 0.000 0.495 6101 A N -0.540 122.336 122.820 0.094 0.000 1.940 6101 A HA -0.188 4.132 4.320 0.000 0.000 0.219 6101 A C 2.582 180.147 177.584 -0.032 0.000 1.176 6101 A CA 2.012 54.076 52.037 0.045 0.000 0.631 6101 A CB -1.066 17.987 19.000 0.088 0.000 0.814 6101 A HN 0.530 nan 8.150 nan 0.000 0.446 6102 S N -0.496 115.190 115.700 -0.024 0.000 2.341 6102 S HA -0.087 4.383 4.470 0.000 0.000 0.216 6102 S C 1.859 176.428 174.600 -0.051 0.000 1.034 6102 S CA 1.061 59.245 58.200 -0.027 0.000 0.964 6102 S CB -0.405 62.790 63.200 -0.008 0.000 0.882 6102 S HN 0.598 nan 8.310 nan 0.000 0.469 6103 N N 1.159 119.824 118.700 -0.058 0.000 2.396 6103 N HA 0.215 4.956 4.740 0.000 0.000 0.180 6103 N C 1.074 176.522 175.510 -0.104 0.000 1.028 6103 N CA 1.000 54.013 53.050 -0.062 0.000 0.893 6103 N CB -0.072 38.392 38.487 -0.038 0.000 0.967 6103 N HN 0.623 nan 8.380 nan 0.000 0.440 6104 G N 0.363 109.043 108.800 -0.200 0.000 2.396 6104 G HA2 -0.227 3.733 3.960 0.000 0.000 0.254 6104 G HA3 -0.227 3.733 3.960 0.000 0.000 0.254 6104 G C 0.014 174.670 174.900 -0.406 0.000 1.248 6104 G CA 0.042 44.981 45.100 -0.268 0.000 1.033 6104 G HN 0.253 nan 8.290 nan 0.000 0.502 6105 N N -0.478 118.081 118.700 -0.234 0.000 2.414 6105 N HA 0.028 4.768 4.740 0.000 0.000 0.177 6105 N C 1.502 177.017 175.510 0.008 0.000 1.062 6105 N CA 0.754 53.768 53.050 -0.060 0.000 0.890 6105 N CB 0.037 38.555 38.487 0.052 0.000 1.070 6105 N HN 0.296 nan 8.380 nan 0.000 0.454 6106 K N 0.004 120.393 120.400 -0.019 0.000 2.404 6106 K HA 0.156 4.476 4.320 0.000 0.000 0.194 6106 K C -0.250 176.347 176.600 -0.005 0.000 1.023 6106 K CA 0.064 56.349 56.287 -0.003 0.000 1.094 6106 K CB 0.033 32.529 32.500 -0.007 0.000 0.841 6106 K HN 0.094 nan 8.250 nan 0.000 0.523 6107 C N 0.156 119.447 119.300 -0.015 0.000 3.517 6107 C HA 0.820 5.280 4.460 0.000 0.000 0.202 6107 C C -0.264 174.726 174.990 0.000 0.000 1.370 6107 C CA -0.167 58.845 59.018 -0.009 0.000 1.308 6107 C CB -1.397 26.328 27.740 -0.024 0.000 1.840 6107 C HN 0.450 nan 8.230 nan 0.000 0.525 6108 A N 1.289 124.131 122.820 0.037 0.000 5.650 6108 A HA 0.955 5.275 4.320 0.000 0.000 0.194 6108 A C 0.427 178.059 177.584 0.080 0.000 0.895 6108 A CA 0.473 52.554 52.037 0.075 0.000 0.804 6108 A CB -0.380 18.711 19.000 0.151 0.000 2.103 6108 A HN 2.342 nan 8.150 nan 0.000 1.022 6109 G N -1.865 106.998 108.800 0.104 0.000 2.846 6109 G HA2 0.341 4.301 3.960 0.000 0.000 0.660 6109 G HA3 0.341 4.301 3.960 0.000 0.000 0.660 6109 G C -0.624 174.304 174.900 0.045 0.000 1.464 6109 G CA 0.044 45.182 45.100 0.064 0.000 0.891 6109 G HN 2.104 nan 8.290 nan 0.000 0.552 6110 L N 0.918 122.158 121.223 0.029 0.000 2.289 6110 L HA 0.620 4.960 4.340 0.000 0.000 0.285 6110 L C 0.522 177.414 176.870 0.037 0.000 1.049 6110 L CA -0.770 54.083 54.840 0.023 0.000 0.804 6110 L CB 1.402 43.462 42.059 0.001 0.000 1.195 6110 L HN 0.731 nan 8.230 nan 0.000 0.428 6111 N N 4.067 122.797 118.700 0.051 0.000 2.485 6111 N HA 0.125 4.865 4.740 0.000 0.000 0.243 6111 N C 0.905 176.451 175.510 0.059 0.000 0.987 6111 N CA -0.155 52.951 53.050 0.094 0.000 0.940 6111 N CB 1.401 39.959 38.487 0.117 0.000 1.122 6111 N HN 0.713 nan 8.380 nan 0.000 0.509 6112 V N 2.078 121.986 119.914 -0.010 0.000 2.970 6112 V HA -0.040 4.080 4.120 0.000 0.000 0.260 6112 V C 1.409 177.399 176.094 -0.173 0.000 1.100 6112 V CA 1.011 63.231 62.300 -0.135 0.000 1.122 6112 V CB -1.079 30.591 31.823 -0.254 0.000 0.721 6112 V HN 0.475 nan 8.190 nan 0.000 0.483 6113 F N 2.471 122.419 119.950 -0.002 0.000 2.293 6113 F HA -0.021 4.506 4.527 0.000 0.000 0.297 6113 F C 2.658 178.458 175.800 -0.001 0.000 1.089 6113 F CA 1.777 59.776 58.000 -0.002 0.000 1.377 6113 F CB -0.330 38.669 39.000 -0.001 0.000 1.051 6113 F HN 0.377 nan 8.300 nan 0.000 0.511 6114 T N -4.106 110.550 114.554 0.170 0.000 3.001 6114 T HA 0.375 4.725 4.350 0.000 0.000 0.251 6114 T C 1.482 176.211 174.700 0.048 0.000 1.040 6114 T CA 0.415 62.570 62.100 0.092 0.000 0.985 6114 T CB 0.328 69.241 68.868 0.076 0.000 1.011 6114 T HN 0.342 nan 8.240 nan 0.000 0.509 6115 G N 1.099 109.919 108.800 0.033 0.000 2.248 6115 G HA2 0.273 4.233 3.960 0.000 0.000 0.263 6115 G HA3 0.273 4.233 3.960 0.000 0.000 0.263 6115 G C 0.060 174.966 174.900 0.010 0.000 1.082 6115 G CA -0.226 44.877 45.100 0.005 0.000 0.863 6115 G HN 1.424 nan 8.290 nan 0.000 0.495 6116 A N -1.663 121.168 122.820 0.020 0.000 2.608 6116 A HA 0.881 5.201 4.320 0.000 0.000 0.292 6116 A C 0.034 177.634 177.584 0.026 0.000 1.066 6116 A CA 0.129 52.178 52.037 0.019 0.000 0.676 6116 A CB 1.389 20.401 19.000 0.021 0.000 1.277 6116 A HN 1.802 nan 8.150 nan 0.000 0.413 6117 V N 1.667 121.595 119.914 0.023 0.000 2.673 6117 V HA 0.407 4.527 4.120 0.000 0.000 0.303 6117 V C 0.020 176.133 176.094 0.032 0.000 1.046 6117 V CA 1.024 63.341 62.300 0.029 0.000 1.126 6117 V CB 0.443 32.284 31.823 0.029 0.000 0.934 6117 V HN 0.914 nan 8.190 nan 0.000 0.487 6118 E N 3.827 124.049 120.200 0.038 0.000 2.359 6118 E HA 0.372 4.722 4.350 0.000 0.000 0.223 6118 E C -1.475 175.146 176.600 0.035 0.000 0.877 6118 E CA -0.654 55.767 56.400 0.035 0.000 0.887 6118 E CB 0.828 30.553 29.700 0.041 0.000 1.890 6118 E HN 0.707 nan 8.360 nan 0.000 0.419 6119 D N 1.236 121.654 120.400 0.029 0.000 2.472 6119 D HA 0.192 4.832 4.640 0.000 0.000 0.234 6119 D C 0.832 177.149 176.300 0.028 0.000 1.088 6119 D CA -0.273 53.742 54.000 0.025 0.000 0.882 6119 D CB 0.578 41.387 40.800 0.015 0.000 1.037 6119 D HN 0.186 nan 8.370 nan 0.000 0.520 6120 M N 1.746 121.368 119.600 0.037 0.000 2.117 6120 M HA -0.142 4.338 4.480 0.000 0.000 0.262 6120 M C 2.310 178.626 176.300 0.027 0.000 1.065 6120 M CA 0.818 56.141 55.300 0.039 0.000 1.114 6120 M CB -1.158 31.470 32.600 0.047 0.000 1.361 6120 M HN 0.549 nan 8.290 nan 0.000 0.408 6121 C N 0.600 119.914 119.300 0.023 0.000 2.432 6121 C HA -0.184 4.276 4.460 0.000 0.000 0.277 6121 C C 2.731 177.726 174.990 0.008 0.000 1.249 6121 C CA 1.619 60.646 59.018 0.015 0.000 1.725 6121 C CB -0.871 26.877 27.740 0.013 0.000 2.028 6121 C HN 0.600 nan 8.230 nan 0.000 0.477 6122 E N 1.123 121.327 120.200 0.007 0.000 2.110 6122 E HA -0.139 4.211 4.350 0.000 0.000 0.193 6122 E C 1.609 178.208 176.600 -0.002 0.000 0.988 6122 E CA 1.569 57.970 56.400 0.001 0.000 0.804 6122 E CB -0.421 29.280 29.700 0.002 0.000 0.745 6122 E HN 0.624 nan 8.360 nan 0.000 0.458 6123 N N -0.337 118.364 118.700 0.000 0.000 2.461 6123 N HA 0.054 4.795 4.740 0.000 0.000 0.188 6123 N C 0.624 176.125 175.510 -0.015 0.000 1.134 6123 N CA 0.945 53.989 53.050 -0.009 0.000 0.878 6123 N CB 0.554 39.040 38.487 -0.002 0.000 0.972 6123 N HN 0.319 nan 8.380 nan 0.000 0.456 6124 G N -0.084 108.712 108.800 -0.006 0.000 2.153 6124 G HA2 -0.265 3.695 3.960 0.000 0.000 0.252 6124 G HA3 -0.265 3.695 3.960 0.000 0.000 0.252 6124 G C -0.051 174.850 174.900 0.001 0.000 0.994 6124 G CA 0.182 45.279 45.100 -0.006 0.000 0.698 6124 G HN 0.207 nan 8.290 nan 0.000 0.521 6125 V N 1.468 121.390 119.914 0.013 0.000 2.222 6125 V HA 0.487 4.607 4.120 0.000 0.000 0.253 6125 V C 0.787 176.898 176.094 0.028 0.000 1.210 6125 V CA 0.120 62.438 62.300 0.030 0.000 1.079 6125 V CB 0.462 32.317 31.823 0.052 0.000 1.265 6125 V HN 1.046 nan 8.190 nan 0.000 0.494 6126 V N 1.565 121.491 119.914 0.021 0.000 2.876 6126 V HA 0.900 5.020 4.120 0.000 0.000 0.312 6126 V C -0.630 175.474 176.094 0.017 0.000 1.085 6126 V CA -0.711 61.601 62.300 0.019 0.000 0.945 6126 V CB 2.489 34.320 31.823 0.014 0.000 1.017 6126 V HN 0.657 nan 8.190 nan 0.000 0.428 6127 E N 2.372 122.581 120.200 0.015 0.000 2.336 6127 E HA 0.654 5.004 4.350 0.000 0.000 0.267 6127 E C -3.234 173.372 176.600 0.010 0.000 0.906 6127 E CA -2.433 53.975 56.400 0.012 0.000 0.781 6127 E CB 2.092 31.799 29.700 0.012 0.000 1.261 6127 E HN 0.464 nan 8.360 nan 0.000 0.436 6128 P HA -0.026 nan 4.420 nan 0.000 0.266 6128 P C 0.892 178.195 177.300 0.006 0.000 1.195 6128 P CA -0.304 62.800 63.100 0.006 0.000 0.768 6128 P CB 0.444 32.147 31.700 0.005 0.000 0.838 6129 L N 4.030 125.256 121.223 0.006 0.000 2.079 6129 L HA -0.206 4.135 4.340 0.000 0.000 0.210 6129 L C 2.087 178.959 176.870 0.004 0.000 1.081 6129 L CA 1.947 56.790 54.840 0.006 0.000 0.752 6129 L CB -0.616 41.446 42.059 0.005 0.000 0.896 6129 L HN 0.242 nan 8.230 nan 0.000 0.433 6130 R N -0.532 119.971 120.500 0.004 0.000 2.117 6130 R HA -0.129 4.211 4.340 0.000 0.000 0.243 6130 R C 2.231 178.533 176.300 0.003 0.000 1.143 6130 R CA 1.558 57.660 56.100 0.004 0.000 0.968 6130 R CB -1.365 28.937 30.300 0.003 0.000 0.863 6130 R HN 0.389 nan 8.270 nan 0.000 0.444 6131 V N 1.653 121.569 119.914 0.003 0.000 2.287 6131 V HA -0.239 3.881 4.120 0.000 0.000 0.248 6131 V C 2.393 178.486 176.094 -0.001 0.000 1.053 6131 V CA 1.754 64.055 62.300 0.001 0.000 1.027 6131 V CB -0.300 31.524 31.823 0.002 0.000 0.646 6131 V HN 0.212 nan 8.190 nan 0.000 0.447 6132 K N -0.716 119.684 120.400 -0.000 0.000 2.137 6132 K HA -0.038 4.282 4.320 0.000 0.000 0.202 6132 K C 2.291 178.891 176.600 0.001 0.000 1.052 6132 K CA 1.499 57.785 56.287 -0.002 0.000 0.961 6132 K CB -0.663 31.836 32.500 -0.002 0.000 0.741 6132 K HN 0.458 nan 8.250 nan 0.000 0.452 6133 T N 0.712 115.268 114.554 0.004 0.000 2.942 6133 T HA -0.119 4.232 4.350 0.000 0.000 0.265 6133 T C 1.823 176.528 174.700 0.009 0.000 1.062 6133 T CA 1.204 63.308 62.100 0.007 0.000 1.139 6133 T CB 0.174 69.046 68.868 0.006 0.000 0.883 6133 T HN 0.071 nan 8.240 nan 0.000 0.468 6134 Q N 0.637 120.441 119.800 0.007 0.000 2.137 6134 Q HA 0.317 4.657 4.340 0.000 0.000 0.198 6134 Q C 2.209 178.213 176.000 0.008 0.000 0.960 6134 Q CA 1.532 57.339 55.803 0.007 0.000 0.847 6134 Q CB -0.685 28.056 28.738 0.005 0.000 0.915 6134 Q HN 0.514 nan 8.270 nan 0.000 0.448 6135 A N 0.748 123.570 122.820 0.003 0.000 1.865 6135 A HA -0.160 4.160 4.320 0.000 0.000 0.217 6135 A C 1.931 179.518 177.584 0.004 0.000 1.191 6135 A CA 1.626 53.662 52.037 -0.002 0.000 0.623 6135 A CB -0.762 18.232 19.000 -0.011 0.000 0.826 6135 A HN 0.450 nan 8.150 nan 0.000 0.444 6136 I N -0.239 120.338 120.570 0.011 0.000 2.286 6136 I HA -0.191 3.979 4.170 0.000 0.000 0.248 6136 I C 2.658 178.807 176.117 0.053 0.000 1.115 6136 I CA 1.199 62.521 61.300 0.037 0.000 1.392 6136 I CB -1.357 36.672 38.000 0.048 0.000 1.065 6136 I HN 0.396 nan 8.210 nan 0.000 0.418 6137 Q N 0.536 120.357 119.800 0.035 0.000 1.965 6137 Q HA -0.115 4.225 4.340 0.000 0.000 0.200 6137 Q C 2.485 178.507 176.000 0.037 0.000 0.981 6137 Q CA 1.764 57.587 55.803 0.033 0.000 0.834 6137 Q CB -0.426 28.325 28.738 0.021 0.000 0.900 6137 Q HN 0.372 nan 8.270 nan 0.000 0.426 6138 S N 0.986 116.703 115.700 0.027 0.000 2.368 6138 S HA -0.117 4.354 4.470 0.000 0.000 0.225 6138 S C 1.951 176.571 174.600 0.033 0.000 1.030 6138 S CA 1.050 59.266 58.200 0.026 0.000 0.999 6138 S CB -0.235 62.975 63.200 0.017 0.000 0.844 6138 S HN 0.492 nan 8.310 nan 0.000 0.459 6139 A N 1.566 124.404 122.820 0.031 0.000 1.873 6139 A HA 0.136 4.456 4.320 0.000 0.000 0.215 6139 A C 2.362 179.986 177.584 0.066 0.000 1.186 6139 A CA 1.678 53.734 52.037 0.032 0.000 0.616 6139 A CB -1.118 17.886 19.000 0.006 0.000 0.823 6139 A HN 0.509 nan 8.150 nan 0.000 0.442 6140 A N -0.617 122.260 122.820 0.096 0.000 1.902 6140 A HA -0.131 4.189 4.320 0.000 0.000 0.217 6140 A C 1.991 179.657 177.584 0.136 0.000 1.181 6140 A CA 1.707 53.842 52.037 0.163 0.000 0.623 6140 A CB -0.375 18.736 19.000 0.186 0.000 0.818 6140 A HN 0.449 nan 8.150 nan 0.000 0.443 6141 E N -0.501 119.752 120.200 0.089 0.000 2.072 6141 E HA -0.088 4.262 4.350 0.000 0.000 0.190 6141 E C 2.309 178.948 176.600 0.065 0.000 0.982 6141 E CA 1.234 57.676 56.400 0.070 0.000 0.803 6141 E CB -0.488 29.241 29.700 0.047 0.000 0.755 6141 E HN 0.519 nan 8.360 nan 0.000 0.453 6142 S N -0.115 115.620 115.700 0.058 0.000 2.387 6142 S HA -0.083 4.387 4.470 0.000 0.000 0.226 6142 S C 1.997 176.633 174.600 0.059 0.000 1.026 6142 S CA 1.431 59.660 58.200 0.048 0.000 0.972 6142 S CB -0.106 63.115 63.200 0.036 0.000 0.814 6142 S HN 0.194 nan 8.310 nan 0.000 0.477 6143 T N 1.504 116.108 114.554 0.082 0.000 2.708 6143 T HA -0.094 4.256 4.350 0.000 0.000 0.266 6143 T C 1.750 176.533 174.700 0.137 0.000 1.037 6143 T CA 1.579 63.746 62.100 0.111 0.000 1.146 6143 T CB -0.371 68.581 68.868 0.140 0.000 0.865 6143 T HN 0.578 nan 8.240 nan 0.000 0.435 6144 E N 0.521 120.816 120.200 0.159 0.000 2.106 6144 E HA -0.113 4.237 4.350 0.000 0.000 0.192 6144 E C 2.216 178.854 176.600 0.064 0.000 0.984 6144 E CA 0.782 57.261 56.400 0.131 0.000 0.806 6144 E CB -0.184 29.600 29.700 0.139 0.000 0.750 6144 E HN 0.470 nan 8.360 nan 0.000 0.458 6145 M N 0.192 119.826 119.600 0.057 0.000 2.086 6145 M HA -0.196 4.284 4.480 0.000 0.000 0.261 6145 M C 1.791 178.106 176.300 0.025 0.000 1.067 6145 M CA 1.236 56.558 55.300 0.035 0.000 1.116 6145 M CB -0.005 32.615 32.600 0.033 0.000 1.348 6145 M HN 0.186 nan 8.290 nan 0.000 0.407 6146 L N 0.791 122.031 121.223 0.029 0.000 2.042 6146 L HA -0.173 4.167 4.340 0.000 0.000 0.210 6146 L C 2.239 179.113 176.870 0.006 0.000 1.076 6146 L CA 1.749 56.598 54.840 0.016 0.000 0.749 6146 L CB -1.070 41.002 42.059 0.020 0.000 0.893 6146 L HN 0.401 nan 8.230 nan 0.000 0.432 6147 L N -1.467 119.764 121.223 0.013 0.000 2.201 6147 L HA -0.153 4.187 4.340 0.000 0.000 0.212 6147 L C 2.481 179.337 176.870 -0.023 0.000 1.105 6147 L CA 0.745 55.576 54.840 -0.014 0.000 0.775 6147 L CB -0.387 41.654 42.059 -0.030 0.000 0.913 6147 L HN 0.214 nan 8.230 nan 0.000 0.440 6148 R N -0.075 120.421 120.500 -0.006 0.000 2.193 6148 R HA 0.102 4.442 4.340 0.000 0.000 0.213 6148 R C 0.536 176.834 176.300 -0.003 0.000 1.055 6148 R CA 0.316 56.414 56.100 -0.003 0.000 0.995 6148 R CB -0.042 30.263 30.300 0.008 0.000 0.893 6148 R HN 0.254 nan 8.270 nan 0.000 0.459 6149 I N 2.580 123.148 120.570 -0.003 0.000 2.471 6149 I HA -0.047 4.123 4.170 0.000 0.000 0.286 6149 I C 0.408 176.520 176.117 -0.009 0.000 1.079 6149 I CA 0.049 61.348 61.300 -0.003 0.000 1.398 6149 I CB 0.992 38.990 38.000 -0.003 0.000 1.403 6149 I HN 0.134 nan 8.210 nan 0.000 0.530 6150 D N 3.000 123.398 120.400 -0.003 0.000 2.469 6150 D HA 0.127 4.767 4.640 0.000 0.000 0.215 6150 D C -0.286 176.020 176.300 0.011 0.000 1.154 6150 D CA -0.040 53.957 54.000 -0.005 0.000 0.832 6150 D CB 0.386 41.179 40.800 -0.012 0.000 1.008 6150 D HN 0.354 nan 8.370 nan 0.000 0.506 6151 D N 0.059 120.472 120.400 0.022 0.000 2.688 6151 D HA 0.248 4.888 4.640 0.000 0.000 0.210 6151 D C -1.711 174.620 176.300 0.051 0.000 1.333 6151 D CA -0.472 53.551 54.000 0.038 0.000 0.920 6151 D CB 1.932 42.746 40.800 0.025 0.000 1.554 6151 D HN -0.170 nan 8.370 nan 0.000 0.579 6152 V N 4.267 124.239 119.914 0.096 0.000 2.444 6152 V HA 0.556 4.676 4.120 0.000 0.000 0.294 6152 V C -0.122 176.058 176.094 0.143 0.000 1.022 6152 V CA -0.668 61.703 62.300 0.118 0.000 0.850 6152 V CB 1.479 33.380 31.823 0.130 0.000 0.992 6152 V HN 0.431 nan 8.190 nan 0.000 0.426 6153 I N 4.574 125.197 120.570 0.089 0.000 2.390 6153 I HA 0.772 4.942 4.170 0.000 0.000 0.283 6153 I C 0.291 176.448 176.117 0.066 0.000 1.016 6153 I CA -0.054 61.282 61.300 0.060 0.000 1.151 6153 I CB 1.632 39.651 38.000 0.031 0.000 1.293 6153 I HN 0.684 nan 8.210 nan 0.000 0.458 6154 A N 4.344 127.211 122.820 0.079 0.000 2.401 6154 A HA 0.949 5.269 4.320 0.000 0.000 0.310 6154 A C -0.062 177.553 177.584 0.052 0.000 1.075 6154 A CA -0.684 51.402 52.037 0.082 0.000 0.746 6154 A CB 1.245 20.328 19.000 0.138 0.000 1.277 6154 A HN 0.748 nan 8.150 nan 0.000 0.425 6155 A N 0.743 123.589 122.820 0.044 0.000 2.448 6155 A HA 0.428 4.748 4.320 0.000 0.000 0.239 6155 A C 0.844 178.447 177.584 0.032 0.000 1.080 6155 A CA 0.013 52.067 52.037 0.029 0.000 0.779 6155 A CB -0.016 19.000 19.000 0.026 0.000 1.026 6155 A HN 0.923 nan 8.150 nan 0.000 0.499 6156 E N 0.000 120.211 120.200 0.019 0.000 2.725 6156 E HA 0.000 4.350 4.350 0.000 0.000 0.291 6156 E CA 0.000 56.411 56.400 0.018 0.000 0.976 6156 E CB 0.000 29.705 29.700 0.008 0.000 0.812 6156 E HN 0.000 nan 8.360 nan 0.000 0.440