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 3izh_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 TNIKDLSAQD 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 0.000 176.088 176.094 -0.010 0.000 1.182 5644 V CA 0.000 62.294 62.300 -0.010 0.000 1.235 5644 V CB 0.000 31.817 31.823 -0.009 0.000 1.184 5645 L N 2.513 123.728 121.223 -0.013 0.000 2.325 5645 L HA 0.553 4.893 4.340 -0.000 0.000 0.279 5645 L C -2.188 174.674 176.870 -0.014 0.000 1.054 5645 L CA -1.543 53.289 54.840 -0.013 0.000 0.804 5645 L CB 0.863 42.911 42.059 -0.017 0.000 1.200 5645 L HN 0.163 nan 8.230 nan 0.000 0.436 5646 P HA -0.008 nan 4.420 nan 0.000 0.264 5646 P C -0.445 176.847 177.300 -0.014 0.000 1.193 5646 P CA -0.143 62.950 63.100 -0.011 0.000 0.763 5646 P CB 0.402 32.096 31.700 -0.009 0.000 0.810 5647 E N 3.249 123.441 120.200 -0.014 0.000 2.452 5647 E HA -0.114 4.236 4.350 -0.000 0.000 0.261 5647 E C 0.844 177.435 176.600 -0.015 0.000 0.987 5647 E CA 0.388 56.779 56.400 -0.016 0.000 0.926 5647 E CB 0.010 29.702 29.700 -0.014 0.000 0.934 5647 E HN 0.618 nan 8.360 nan 0.000 0.452 5648 N N 2.456 121.146 118.700 -0.018 0.000 2.990 5648 N HA -0.146 4.594 4.740 -0.000 0.000 0.163 5648 N C -0.613 174.886 175.510 -0.018 0.000 1.452 5648 N CA 0.222 53.263 53.050 -0.016 0.000 1.624 5648 N CB -0.631 37.849 38.487 -0.011 0.000 1.088 5648 N HN 0.388 nan 8.380 nan 0.000 0.695 5649 M N 2.058 121.646 119.600 -0.020 0.000 2.228 5649 M HA 0.227 4.707 4.480 -0.000 0.000 0.351 5649 M C 0.301 176.578 176.300 -0.037 0.000 1.233 5649 M CA 0.556 55.843 55.300 -0.021 0.000 1.129 5649 M CB 0.839 33.428 32.600 -0.018 0.000 1.604 5649 M HN 0.162 nan 8.290 nan 0.000 0.457 5650 K N 2.270 122.650 120.400 -0.034 0.000 2.316 5650 K HA 0.621 4.941 4.320 -0.000 0.000 0.251 5650 K C -1.214 175.343 176.600 -0.073 0.000 0.934 5650 K CA -0.573 55.667 56.287 -0.077 0.000 0.802 5650 K CB 1.964 34.441 32.500 -0.038 0.000 1.171 5650 K HN 0.676 nan 8.250 nan 0.000 0.426 5651 R N 3.089 123.462 120.500 -0.212 0.000 2.621 5651 R HA 0.430 4.770 4.340 -0.000 0.000 0.284 5651 R C -1.520 174.570 176.300 -0.350 0.000 0.998 5651 R CA -0.599 55.420 56.100 -0.136 0.000 0.895 5651 R CB 0.893 31.151 30.300 -0.070 0.000 1.195 5651 R HN 0.626 nan 8.270 nan 0.000 0.450 5652 Y N 4.207 124.511 120.300 0.007 0.000 2.462 5652 Y HA 0.541 5.091 4.550 -0.000 0.000 0.346 5652 Y C 0.275 176.182 175.900 0.011 0.000 0.976 5652 Y CA -0.950 57.158 58.100 0.013 0.000 1.044 5652 Y CB 2.226 40.702 38.460 0.026 0.000 1.230 5652 Y HN 0.426 nan 8.280 nan 0.000 0.455 5653 M N 0.861 120.545 119.600 0.141 0.000 2.618 5653 M HA 0.858 5.338 4.480 -0.000 0.000 0.281 5653 M C 0.180 176.519 176.300 0.066 0.000 1.267 5653 M CA -0.144 55.204 55.300 0.080 0.000 0.845 5653 M CB 1.350 33.974 32.600 0.040 0.000 1.732 5653 M HN 0.877 nan 8.290 nan 0.000 0.461 5654 G N 2.285 111.111 108.800 0.043 0.000 2.574 5654 G HA2 -0.357 3.603 3.960 -0.000 0.000 0.286 5654 G HA3 -0.357 3.603 3.960 -0.000 0.000 0.286 5654 G C 0.508 175.426 174.900 0.030 0.000 1.212 5654 G CA 1.067 46.183 45.100 0.027 0.000 0.979 5654 G HN 1.179 nan 8.290 nan 0.000 0.557 5655 R N 0.438 120.952 120.500 0.024 0.000 2.189 5655 R HA -0.043 4.297 4.340 -0.000 0.000 0.223 5655 R C 2.068 178.388 176.300 0.034 0.000 1.092 5655 R CA 1.947 58.059 56.100 0.020 0.000 0.989 5655 R CB -0.373 29.934 30.300 0.012 0.000 0.876 5655 R HN 0.596 nan 8.270 nan 0.000 0.457 5656 D N 0.257 120.694 120.400 0.061 0.000 2.123 5656 D HA -0.106 4.534 4.640 -0.000 0.000 0.200 5656 D C 1.706 178.058 176.300 0.088 0.000 0.976 5656 D CA 1.403 55.463 54.000 0.099 0.000 0.831 5656 D CB -0.126 40.778 40.800 0.175 0.000 0.974 5656 D HN 0.360 nan 8.370 nan 0.000 0.469 5657 A N 0.958 123.839 122.820 0.102 0.000 1.933 5657 A HA -0.216 4.104 4.320 -0.000 0.000 0.218 5657 A C 2.152 179.746 177.584 0.017 0.000 1.175 5657 A CA 1.323 53.405 52.037 0.075 0.000 0.628 5657 A CB -0.517 18.536 19.000 0.088 0.000 0.814 5657 A HN 0.195 nan 8.150 nan 0.000 0.444 5658 Q N -1.110 118.699 119.800 0.016 0.000 2.046 5658 Q HA -0.145 4.195 4.340 -0.000 0.000 0.200 5658 Q C 2.423 178.415 176.000 -0.014 0.000 0.975 5658 Q CA 1.439 57.243 55.803 0.001 0.000 0.836 5658 Q CB -0.197 28.542 28.738 0.002 0.000 0.896 5658 Q HN 0.690 nan 8.270 nan 0.000 0.428 5659 R N 0.688 121.181 120.500 -0.013 0.000 2.083 5659 R HA -0.172 4.168 4.340 -0.000 0.000 0.237 5659 R C 2.292 178.558 176.300 -0.056 0.000 1.137 5659 R CA 1.678 57.763 56.100 -0.025 0.000 0.951 5659 R CB -0.214 30.079 30.300 -0.012 0.000 0.851 5659 R HN 0.293 nan 8.270 nan 0.000 0.434 5660 M N 0.471 120.022 119.600 -0.082 0.000 2.086 5660 M HA -0.204 4.276 4.480 -0.000 0.000 0.261 5660 M C 1.866 178.087 176.300 -0.132 0.000 1.067 5660 M CA 2.335 57.547 55.300 -0.146 0.000 1.116 5660 M CB -0.330 32.121 32.600 -0.248 0.000 1.348 5660 M HN 0.160 nan 8.290 nan 0.000 0.407 5661 N N 0.535 119.186 118.700 -0.082 0.000 2.069 5661 N HA -0.152 4.588 4.740 -0.000 0.000 0.191 5661 N C 1.466 176.944 175.510 -0.054 0.000 1.031 5661 N CA 2.059 55.077 53.050 -0.055 0.000 0.852 5661 N CB -0.354 38.120 38.487 -0.021 0.000 1.018 5661 N HN 0.494 nan 8.380 nan 0.000 0.423 5662 I N -0.411 120.133 120.570 -0.044 0.000 2.179 5662 I HA -0.231 3.939 4.170 -0.000 0.000 0.242 5662 I C 1.704 177.791 176.117 -0.050 0.000 1.088 5662 I CA 0.585 61.864 61.300 -0.034 0.000 1.357 5662 I CB -0.200 37.786 38.000 -0.023 0.000 1.051 5662 I HN 0.194 nan 8.210 nan 0.000 0.409 5663 L N 0.691 121.873 121.223 -0.068 0.000 2.046 5663 L HA -0.160 4.180 4.340 -0.000 0.000 0.208 5663 L C 2.679 179.490 176.870 -0.098 0.000 1.077 5663 L CA 2.125 56.919 54.840 -0.077 0.000 0.747 5663 L CB -1.268 40.739 42.059 -0.087 0.000 0.896 5663 L HN 0.201 nan 8.230 nan 0.000 0.432 5664 A N -0.624 122.114 122.820 -0.137 0.000 1.877 5664 A HA -0.116 4.204 4.320 -0.000 0.000 0.216 5664 A C 2.428 179.957 177.584 -0.091 0.000 1.186 5664 A CA 1.742 53.685 52.037 -0.158 0.000 0.620 5664 A CB -1.385 17.478 19.000 -0.229 0.000 0.822 5664 A HN 0.438 nan 8.150 nan 0.000 0.443 5665 G N -0.396 108.365 108.800 -0.066 0.000 2.418 5665 G HA2 -0.280 3.680 3.960 -0.000 0.000 0.217 5665 G HA3 -0.280 3.680 3.960 -0.000 0.000 0.217 5665 G C 1.701 176.580 174.900 -0.036 0.000 1.158 5665 G CA 1.374 46.450 45.100 -0.040 0.000 0.771 5665 G HN 0.552 nan 8.290 nan 0.000 0.545 5666 R N 0.767 121.243 120.500 -0.039 0.000 2.083 5666 R HA 0.039 4.379 4.340 -0.000 0.000 0.237 5666 R C 2.469 178.748 176.300 -0.034 0.000 1.137 5666 R CA 1.363 57.443 56.100 -0.033 0.000 0.951 5666 R CB -0.790 29.491 30.300 -0.032 0.000 0.851 5666 R HN 0.433 nan 8.270 nan 0.000 0.434 5667 I N 0.210 120.753 120.570 -0.044 0.000 2.226 5667 I HA -0.256 3.914 4.170 -0.000 0.000 0.245 5667 I C 1.835 177.932 176.117 -0.034 0.000 1.100 5667 I CA 0.828 62.103 61.300 -0.041 0.000 1.374 5667 I CB -0.283 37.686 38.000 -0.052 0.000 1.057 5667 I HN 0.160 nan 8.210 nan 0.000 0.413 5668 I N 1.097 121.646 120.570 -0.035 0.000 2.226 5668 I HA -0.272 3.898 4.170 -0.000 0.000 0.245 5668 I C 2.848 178.953 176.117 -0.021 0.000 1.100 5668 I CA 1.708 62.993 61.300 -0.025 0.000 1.374 5668 I CB -1.478 36.508 38.000 -0.023 0.000 1.057 5668 I HN 0.189 nan 8.210 nan 0.000 0.413 5669 A N 0.318 123.124 122.820 -0.022 0.000 1.933 5669 A HA -0.176 4.144 4.320 -0.000 0.000 0.218 5669 A C 2.151 179.723 177.584 -0.020 0.000 1.175 5669 A CA 1.311 53.336 52.037 -0.020 0.000 0.628 5669 A CB -0.407 18.580 19.000 -0.021 0.000 0.814 5669 A HN 0.373 nan 8.150 nan 0.000 0.444 5670 E N -0.466 119.721 120.200 -0.021 0.000 2.150 5670 E HA -0.102 4.248 4.350 -0.000 0.000 0.193 5670 E C 1.999 178.589 176.600 -0.017 0.000 0.985 5670 E CA 1.522 57.910 56.400 -0.020 0.000 0.814 5670 E CB -0.589 29.098 29.700 -0.021 0.000 0.752 5670 E HN 0.590 nan 8.360 nan 0.000 0.466 5671 T N 0.933 115.477 114.554 -0.017 0.000 2.857 5671 T HA -0.083 4.267 4.350 -0.000 0.000 0.266 5671 T C 2.099 176.792 174.700 -0.011 0.000 1.048 5671 T CA 1.485 63.577 62.100 -0.013 0.000 1.139 5671 T CB 0.007 68.867 68.868 -0.013 0.000 0.874 5671 T HN 0.201 nan 8.240 nan 0.000 0.455 5672 V N 0.134 120.040 119.914 -0.012 0.000 2.992 5672 V HA 0.271 4.391 4.120 -0.000 0.000 0.250 5672 V C 2.266 178.353 176.094 -0.012 0.000 1.090 5672 V CA 0.738 63.032 62.300 -0.011 0.000 1.101 5672 V CB -0.692 31.125 31.823 -0.010 0.000 0.743 5672 V HN 0.223 nan 8.190 nan 0.000 0.468 5673 R N 2.248 122.740 120.500 -0.015 0.000 2.211 5673 R HA -0.164 4.176 4.340 -0.000 0.000 0.240 5673 R C 2.174 178.465 176.300 -0.014 0.000 1.144 5673 R CA 1.873 57.963 56.100 -0.017 0.000 0.992 5673 R CB -0.449 29.839 30.300 -0.020 0.000 0.869 5673 R HN 0.794 nan 8.270 nan 0.000 0.462 5674 S N -1.663 114.030 115.700 -0.012 0.000 2.595 5674 S HA -0.034 4.436 4.470 -0.000 0.000 0.235 5674 S C 1.284 175.880 174.600 -0.006 0.000 0.974 5674 S CA 1.165 59.359 58.200 -0.009 0.000 0.942 5674 S CB 0.333 63.529 63.200 -0.007 0.000 0.766 5674 S HN 0.272 nan 8.310 nan 0.000 0.536 5675 T N 1.225 115.775 114.554 -0.007 0.000 3.015 5675 T HA 0.336 4.686 4.350 -0.000 0.000 0.250 5675 T C 0.276 174.973 174.700 -0.006 0.000 1.057 5675 T CA -0.422 61.675 62.100 -0.004 0.000 1.066 5675 T CB -0.151 68.715 68.868 -0.003 0.000 0.959 5675 T HN 0.291 nan 8.240 nan 0.000 0.488 5676 L N 2.499 123.716 121.223 -0.010 0.000 2.499 5676 L HA 0.462 4.802 4.340 -0.000 0.000 0.273 5676 L C 0.721 177.583 176.870 -0.014 0.000 1.195 5676 L CA 1.254 56.085 54.840 -0.014 0.000 0.882 5676 L CB -0.771 41.276 42.059 -0.019 0.000 1.133 5676 L HN 0.441 nan 8.230 nan 0.000 0.483 5677 G N 3.864 112.656 108.800 -0.014 0.000 2.663 5677 G HA2 -0.140 3.820 3.960 -0.000 0.000 0.686 5677 G HA3 -0.140 3.820 3.960 -0.000 0.000 0.686 5677 G C -1.999 172.897 174.900 -0.007 0.000 1.288 5677 G CA -0.451 44.640 45.100 -0.015 0.000 0.836 5677 G HN 0.502 nan 8.290 nan 0.000 0.584 5678 P HA -0.002 nan 4.420 nan 0.000 0.218 5678 P C 1.396 178.706 177.300 0.017 0.000 1.148 5678 P CA 1.269 64.372 63.100 0.005 0.000 0.822 5678 P CB 0.134 31.832 31.700 -0.004 0.000 0.784 5679 K N -0.503 119.903 120.400 0.010 0.000 2.446 5679 K HA 0.258 4.578 4.320 -0.000 0.000 0.203 5679 K C 0.966 177.573 176.600 0.011 0.000 1.027 5679 K CA -0.048 56.250 56.287 0.018 0.000 1.166 5679 K CB -0.149 32.361 32.500 0.016 0.000 0.869 5679 K HN 0.062 nan 8.250 nan 0.000 0.504 5680 G N 1.853 110.657 108.800 0.007 0.000 2.442 5680 G HA2 0.314 4.274 3.960 -0.000 0.000 0.249 5680 G HA3 0.314 4.274 3.960 -0.000 0.000 0.249 5680 G C 0.310 175.214 174.900 0.007 0.000 1.263 5680 G CA -0.422 44.680 45.100 0.003 0.000 0.846 5680 G HN 0.197 nan 8.290 nan 0.000 0.555 5681 M N 0.700 120.303 119.600 0.005 0.000 2.792 5681 M HA 0.731 5.211 4.480 -0.000 0.000 0.294 5681 M C -0.819 175.484 176.300 0.005 0.000 1.215 5681 M CA -1.040 54.264 55.300 0.007 0.000 0.883 5681 M CB 1.827 34.431 32.600 0.006 0.000 1.620 5681 M HN 0.459 nan 8.290 nan 0.000 0.511 5682 D N -0.680 119.723 120.400 0.005 0.000 2.340 5682 D HA 0.578 5.218 4.640 -0.000 0.000 0.243 5682 D C -1.436 174.865 176.300 0.002 0.000 0.988 5682 D CA -0.784 53.218 54.000 0.004 0.000 0.959 5682 D CB 1.404 42.208 40.800 0.005 0.000 1.226 5682 D HN 0.640 nan 8.370 nan 0.000 0.509 5683 K N -0.114 120.287 120.400 0.001 0.000 2.267 5683 K HA 0.483 4.803 4.320 -0.000 0.000 0.246 5683 K C -0.918 175.682 176.600 0.000 0.000 0.954 5683 K CA -1.041 55.246 56.287 0.000 0.000 0.824 5683 K CB 2.326 34.826 32.500 -0.001 0.000 1.167 5683 K HN 0.483 nan 8.250 nan 0.000 0.431 5684 M N 3.581 123.181 119.600 -0.000 0.000 2.078 5684 M HA 0.316 4.796 4.480 -0.000 0.000 0.320 5684 M C -1.859 174.441 176.300 -0.001 0.000 0.969 5684 M CA -0.966 54.334 55.300 -0.001 0.000 0.929 5684 M CB 0.651 33.251 32.600 -0.001 0.000 1.504 5684 M HN 0.382 nan 8.290 nan 0.000 0.419 5685 L N 5.939 127.161 121.223 -0.001 0.000 2.298 5685 L HA 0.533 4.873 4.340 -0.000 0.000 0.284 5685 L C -0.943 175.926 176.870 -0.001 0.000 1.013 5685 L CA -0.324 54.515 54.840 -0.000 0.000 0.824 5685 L CB 1.960 44.019 42.059 -0.000 0.000 1.221 5685 L HN 0.438 nan 8.230 nan 0.000 0.418 5686 V N 3.167 123.081 119.914 -0.000 0.000 2.326 5686 V HA 0.300 4.420 4.120 -0.000 0.000 0.281 5686 V C -0.268 175.826 176.094 0.000 0.000 1.015 5686 V CA -1.050 61.249 62.300 -0.000 0.000 0.823 5686 V CB 1.198 33.021 31.823 -0.001 0.000 1.009 5686 V HN 0.796 nan 8.190 nan 0.000 0.436 5687 D N 3.488 123.888 120.400 0.000 0.000 2.369 5687 D HA -0.060 4.580 4.640 -0.000 0.000 0.241 5687 D C 1.132 177.433 176.300 0.001 0.000 1.271 5687 D CA -0.195 53.805 54.000 0.001 0.000 0.942 5687 D CB 0.609 41.409 40.800 0.001 0.000 1.129 5687 D HN 0.589 nan 8.370 nan 0.000 0.476 5688 D N -0.398 120.003 120.400 0.001 0.000 2.351 5688 D HA -0.160 4.480 4.640 -0.000 0.000 0.216 5688 D C 1.612 177.913 176.300 0.001 0.000 0.968 5688 D CA 0.621 54.622 54.000 0.001 0.000 0.899 5688 D CB -0.138 40.664 40.800 0.002 0.000 0.907 5688 D HN 0.419 nan 8.370 nan 0.000 0.514 5689 L N -0.984 120.240 121.223 0.001 0.000 2.463 5689 L HA 0.295 4.635 4.340 -0.000 0.000 0.219 5689 L C 1.981 178.851 176.870 -0.000 0.000 1.088 5689 L CA 0.611 55.451 54.840 0.000 0.000 0.849 5689 L CB 0.229 42.289 42.059 0.000 0.000 1.012 5689 L HN 0.324 nan 8.230 nan 0.000 0.468 5690 G N -0.583 108.217 108.800 -0.000 0.000 2.278 5690 G HA2 -0.239 3.721 3.960 -0.000 0.000 0.210 5690 G HA3 -0.239 3.721 3.960 -0.000 0.000 0.210 5690 G C 0.123 175.022 174.900 -0.001 0.000 1.000 5690 G CA -0.067 45.033 45.100 -0.001 0.000 0.635 5690 G HN 0.289 nan 8.290 nan 0.000 0.495 5691 D N 1.024 121.423 120.400 -0.001 0.000 2.472 5691 D HA 0.383 5.023 4.640 -0.000 0.000 0.237 5691 D C 0.351 176.650 176.300 -0.002 0.000 1.141 5691 D CA 0.510 54.509 54.000 -0.001 0.000 0.875 5691 D CB 1.199 41.998 40.800 -0.001 0.000 1.192 5691 D HN 0.383 nan 8.370 nan 0.000 0.450 5692 V N 4.216 124.128 119.914 -0.002 0.000 2.540 5692 V HA 0.404 4.524 4.120 -0.000 0.000 0.302 5692 V C -0.175 175.917 176.094 -0.003 0.000 1.035 5692 V CA -0.936 61.362 62.300 -0.002 0.000 0.873 5692 V CB 1.812 33.634 31.823 -0.003 0.000 0.992 5692 V HN 0.402 nan 8.190 nan 0.000 0.428 5693 V N 6.285 126.198 119.914 -0.002 0.000 2.487 5693 V HA 0.680 4.800 4.120 -0.000 0.000 0.298 5693 V C -0.879 175.214 176.094 -0.002 0.000 1.028 5693 V CA -0.247 62.052 62.300 -0.002 0.000 0.860 5693 V CB 2.107 33.929 31.823 -0.001 0.000 0.991 5693 V HN 0.644 nan 8.190 nan 0.000 0.427 5694 V N 6.331 126.244 119.914 -0.002 0.000 2.376 5694 V HA 0.707 4.827 4.120 -0.000 0.000 0.287 5694 V C 0.056 176.150 176.094 -0.000 0.000 1.015 5694 V CA -0.011 62.288 62.300 -0.001 0.000 0.834 5694 V CB 1.364 33.186 31.823 -0.002 0.000 1.001 5694 V HN 1.026 nan 8.190 nan 0.000 0.428 5695 T N 2.548 117.103 114.554 0.001 0.000 2.787 5695 T HA 0.377 4.727 4.350 -0.000 0.000 0.297 5695 T C 0.248 174.949 174.700 0.002 0.000 1.221 5695 T CA -0.176 61.925 62.100 0.001 0.000 1.006 5695 T CB 1.943 70.811 68.868 0.001 0.000 1.328 5695 T HN 0.654 nan 8.240 nan 0.000 0.509 5696 N N 0.540 119.241 118.700 0.002 0.000 2.273 5696 N HA 0.120 4.860 4.740 -0.000 0.000 0.192 5696 N C -0.104 175.406 175.510 0.000 0.000 1.132 5696 N CA -0.146 52.905 53.050 0.002 0.000 0.887 5696 N CB -0.165 38.324 38.487 0.003 0.000 1.048 5696 N HN 0.603 nan 8.380 nan 0.000 0.490 5697 D N 0.440 120.840 120.400 0.001 0.000 2.450 5697 D HA 0.243 4.883 4.640 -0.000 0.000 0.247 5697 D C 1.462 177.762 176.300 -0.001 0.000 1.162 5697 D CA 0.303 54.304 54.000 0.000 0.000 0.879 5697 D CB 1.058 41.859 40.800 0.001 0.000 1.163 5697 D HN 0.244 nan 8.370 nan 0.000 0.472 5698 G N 2.484 111.283 108.800 -0.001 0.000 2.421 5698 G HA2 -0.218 3.742 3.960 -0.000 0.000 0.216 5698 G HA3 -0.218 3.742 3.960 -0.000 0.000 0.216 5698 G C 1.555 176.455 174.900 -0.001 0.000 1.171 5698 G CA 0.726 45.825 45.100 -0.002 0.000 0.775 5698 G HN 0.491 nan 8.290 nan 0.000 0.543 5699 V N 0.968 120.883 119.914 0.000 0.000 2.287 5699 V HA -0.209 3.911 4.120 -0.000 0.000 0.248 5699 V C 3.150 179.244 176.094 0.002 0.000 1.053 5699 V CA 2.417 64.718 62.300 0.001 0.000 1.027 5699 V CB -1.045 30.780 31.823 0.002 0.000 0.646 5699 V HN 0.384 nan 8.190 nan 0.000 0.447 5700 T N 0.235 114.789 114.554 0.001 0.000 2.708 5700 T HA -0.133 4.217 4.350 -0.000 0.000 0.266 5700 T C 1.834 176.534 174.700 0.001 0.000 1.037 5700 T CA 1.882 63.983 62.100 0.001 0.000 1.146 5700 T CB -0.313 68.555 68.868 0.001 0.000 0.865 5700 T HN 0.338 nan 8.240 nan 0.000 0.435 5701 I N 0.463 121.033 120.570 0.000 0.000 2.163 5701 I HA -0.169 4.001 4.170 -0.000 0.000 0.243 5701 I C 2.069 178.187 176.117 0.000 0.000 1.085 5701 I CA 1.082 62.382 61.300 -0.000 0.000 1.347 5701 I CB -0.281 37.718 38.000 -0.001 0.000 1.044 5701 I HN 0.168 nan 8.210 nan 0.000 0.408 5702 L N 0.020 121.243 121.223 0.001 0.000 2.179 5702 L HA -0.066 4.274 4.340 -0.000 0.000 0.208 5702 L C 2.476 179.348 176.870 0.004 0.000 1.096 5702 L CA 1.412 56.254 54.840 0.002 0.000 0.779 5702 L CB -0.924 41.136 42.059 0.001 0.000 0.922 5702 L HN 0.146 nan 8.230 nan 0.000 0.443 5703 R N -0.001 120.501 120.500 0.003 0.000 2.075 5703 R HA -0.118 4.222 4.340 -0.000 0.000 0.232 5703 R C 1.910 178.212 176.300 0.004 0.000 1.126 5703 R CA 1.264 57.367 56.100 0.004 0.000 0.963 5703 R CB 0.036 30.338 30.300 0.003 0.000 0.858 5703 R HN 0.326 nan 8.270 nan 0.000 0.435 5704 E N 0.579 120.781 120.200 0.003 0.000 2.072 5704 E HA -0.109 4.241 4.350 -0.000 0.000 0.190 5704 E C 1.171 177.773 176.600 0.003 0.000 0.982 5704 E CA 0.291 56.693 56.400 0.003 0.000 0.803 5704 E CB -0.280 29.421 29.700 0.002 0.000 0.755 5704 E HN 0.301 nan 8.360 nan 0.000 0.453 5705 M N 0.860 120.462 119.600 0.003 0.000 2.252 5705 M HA -0.053 4.427 4.480 -0.000 0.000 0.321 5705 M C 0.144 176.448 176.300 0.007 0.000 1.070 5705 M CA 0.486 55.789 55.300 0.004 0.000 1.143 5705 M CB 0.579 33.181 32.600 0.004 0.000 1.498 5705 M HN -0.188 nan 8.290 nan 0.000 0.445 5706 S N 4.007 119.711 115.700 0.008 0.000 2.512 5706 S HA 0.423 4.893 4.470 -0.000 0.000 0.291 5706 S C -0.803 173.805 174.600 0.014 0.000 1.151 5706 S CA -0.852 57.353 58.200 0.010 0.000 1.120 5706 S CB 0.003 63.209 63.200 0.008 0.000 1.029 5706 S HN 0.531 nan 8.310 nan 0.000 0.485 5707 V N 4.972 124.897 119.914 0.017 0.000 2.732 5707 V HA 0.328 4.448 4.120 -0.000 0.000 0.297 5707 V C 1.013 177.126 176.094 0.032 0.000 1.060 5707 V CA -0.118 62.199 62.300 0.027 0.000 1.038 5707 V CB 1.489 33.330 31.823 0.030 0.000 1.003 5707 V HN 0.800 nan 8.190 nan 0.000 0.481 5708 E N 0.658 120.886 120.200 0.047 0.000 2.288 5708 E HA 0.073 4.423 4.350 -0.000 0.000 0.200 5708 E C 0.678 177.308 176.600 0.050 0.000 0.880 5708 E CA -0.038 56.386 56.400 0.041 0.000 0.971 5708 E CB 0.011 29.733 29.700 0.038 0.000 0.954 5708 E HN 0.693 nan 8.360 nan 0.000 0.489 5709 H N 2.803 121.870 119.070 -0.005 0.000 2.886 5709 H HA 0.018 4.574 4.556 0.000 0.000 0.329 5709 H C -1.721 173.601 175.328 -0.010 0.000 1.044 5709 H CA -1.190 54.852 56.048 -0.011 0.000 1.456 5709 H CB 1.502 31.249 29.762 -0.026 0.000 1.464 5709 H HN -0.172 nan 8.280 nan 0.000 0.573 5710 P HA -0.126 nan 4.420 nan 0.000 0.215 5710 P C 1.125 178.488 177.300 0.105 0.000 1.153 5710 P CA 1.984 65.074 63.100 -0.016 0.000 0.853 5710 P CB 0.099 31.745 31.700 -0.089 0.000 0.788 5711 A N -0.119 122.873 122.820 0.287 0.000 1.933 5711 A HA -0.095 4.225 4.320 -0.000 0.000 0.218 5711 A C 2.298 179.949 177.584 0.111 0.000 1.175 5711 A CA 2.033 54.191 52.037 0.201 0.000 0.628 5711 A CB -1.538 17.577 19.000 0.191 0.000 0.814 5711 A HN 0.201 nan 8.150 nan 0.000 0.444 5712 A N -0.189 122.715 122.820 0.139 0.000 1.929 5712 A HA -0.091 4.229 4.320 -0.000 0.000 0.216 5712 A C 2.068 179.679 177.584 0.046 0.000 1.176 5712 A CA 1.586 53.652 52.037 0.048 0.000 0.628 5712 A CB -0.371 18.651 19.000 0.038 0.000 0.816 5712 A HN 0.521 nan 8.150 nan 0.000 0.444 5713 K N -1.003 119.433 120.400 0.061 0.000 2.147 5713 K HA -0.093 4.227 4.320 -0.000 0.000 0.205 5713 K C 2.031 178.649 176.600 0.030 0.000 1.049 5713 K CA 1.572 57.882 56.287 0.038 0.000 0.936 5713 K CB -0.235 32.285 32.500 0.033 0.000 0.722 5713 K HN 0.600 nan 8.250 nan 0.000 0.446 5714 M N 0.707 120.328 119.600 0.036 0.000 2.254 5714 M HA -0.091 4.389 4.480 -0.000 0.000 0.265 5714 M C 1.914 178.226 176.300 0.020 0.000 1.066 5714 M CA 0.988 56.304 55.300 0.027 0.000 1.123 5714 M CB 0.119 32.738 32.600 0.031 0.000 1.388 5714 M HN 0.112 nan 8.290 nan 0.000 0.425 5715 L N 0.780 122.014 121.223 0.018 0.000 2.156 5715 L HA -0.120 4.220 4.340 -0.000 0.000 0.208 5715 L C 1.921 178.797 176.870 0.009 0.000 1.095 5715 L CA 1.371 56.217 54.840 0.010 0.000 0.770 5715 L CB -0.603 41.458 42.059 0.002 0.000 0.914 5715 L HN 0.275 nan 8.230 nan 0.000 0.439 5716 I N -0.074 120.503 120.570 0.011 0.000 2.315 5716 I HA -0.246 3.924 4.170 -0.000 0.000 0.251 5716 I C 2.358 178.481 176.117 0.009 0.000 1.125 5716 I CA 1.109 62.415 61.300 0.010 0.000 1.392 5716 I CB -1.287 36.720 38.000 0.012 0.000 1.065 5716 I HN 0.387 nan 8.210 nan 0.000 0.424 5717 E N 0.650 120.856 120.200 0.011 0.000 2.150 5717 E HA -0.115 4.235 4.350 -0.000 0.000 0.193 5717 E C 2.486 179.092 176.600 0.010 0.000 0.985 5717 E CA 0.794 57.200 56.400 0.011 0.000 0.814 5717 E CB -0.227 29.481 29.700 0.012 0.000 0.752 5717 E HN 0.343 nan 8.360 nan 0.000 0.466 5718 V N 1.755 121.676 119.914 0.010 0.000 2.287 5718 V HA -0.276 3.844 4.120 -0.000 0.000 0.248 5718 V C 2.506 178.605 176.094 0.008 0.000 1.053 5718 V CA 1.950 64.256 62.300 0.010 0.000 1.027 5718 V CB -0.941 30.889 31.823 0.010 0.000 0.646 5718 V HN 0.251 nan 8.190 nan 0.000 0.447 5719 A N -0.354 122.470 122.820 0.006 0.000 1.902 5719 A HA -0.244 4.076 4.320 -0.000 0.000 0.217 5719 A C 2.304 179.891 177.584 0.005 0.000 1.181 5719 A CA 2.030 54.070 52.037 0.005 0.000 0.623 5719 A CB -0.443 18.559 19.000 0.003 0.000 0.818 5719 A HN 0.557 nan 8.150 nan 0.000 0.443 5720 K N -1.019 119.384 120.400 0.006 0.000 2.097 5720 K HA -0.078 4.242 4.320 -0.000 0.000 0.205 5720 K C 2.024 178.628 176.600 0.007 0.000 1.050 5720 K CA 1.672 57.963 56.287 0.006 0.000 0.938 5720 K CB -0.334 32.169 32.500 0.006 0.000 0.718 5720 K HN 0.462 nan 8.250 nan 0.000 0.442 5721 T N 0.974 115.533 114.554 0.008 0.000 2.904 5721 T HA -0.146 4.204 4.350 -0.000 0.000 0.267 5721 T C 1.802 176.507 174.700 0.008 0.000 1.059 5721 T CA 1.128 63.234 62.100 0.009 0.000 1.137 5721 T CB -0.080 68.794 68.868 0.010 0.000 0.879 5721 T HN 0.153 nan 8.240 nan 0.000 0.467 5722 Q N 1.182 120.987 119.800 0.008 0.000 2.084 5722 Q HA -0.096 4.244 4.340 -0.000 0.000 0.202 5722 Q C 2.291 178.294 176.000 0.006 0.000 0.978 5722 Q CA 1.425 57.233 55.803 0.007 0.000 0.844 5722 Q CB -0.226 28.515 28.738 0.006 0.000 0.898 5722 Q HN 0.362 nan 8.270 nan 0.000 0.426 5723 E N 0.179 120.382 120.200 0.005 0.000 2.047 5723 E HA -0.166 4.184 4.350 -0.000 0.000 0.191 5723 E C 1.714 178.317 176.600 0.005 0.000 0.987 5723 E CA 1.133 57.536 56.400 0.004 0.000 0.799 5723 E CB 0.079 29.781 29.700 0.004 0.000 0.752 5723 E HN 0.368 nan 8.360 nan 0.000 0.449 5724 K N 0.209 120.612 120.400 0.005 0.000 2.057 5724 K HA -0.121 4.199 4.320 -0.000 0.000 0.206 5724 K C 2.110 178.714 176.600 0.006 0.000 1.050 5724 K CA 1.087 57.378 56.287 0.005 0.000 0.935 5724 K CB 0.052 32.556 32.500 0.006 0.000 0.715 5724 K HN 0.028 nan 8.250 nan 0.000 0.439 5725 E N 0.090 120.294 120.200 0.007 0.000 2.051 5725 E HA -0.075 4.275 4.350 -0.000 0.000 0.189 5725 E C 2.042 178.646 176.600 0.007 0.000 0.979 5725 E CA 1.149 57.554 56.400 0.007 0.000 0.803 5725 E CB 0.203 29.908 29.700 0.009 0.000 0.761 5725 E HN 0.073 nan 8.360 nan 0.000 0.451 5726 V N -1.507 118.411 119.914 0.007 0.000 3.484 5726 V HA 0.290 4.410 4.120 -0.000 0.000 0.252 5726 V C 1.475 177.572 176.094 0.005 0.000 1.282 5726 V CA 0.734 63.038 62.300 0.006 0.000 1.104 5726 V CB 0.716 32.544 31.823 0.007 0.000 0.868 5726 V HN 0.411 nan 8.190 nan 0.000 0.457 5727 G N 0.718 109.520 108.800 0.004 0.000 5.064 5727 G HA2 -0.267 3.693 3.960 -0.000 0.000 0.277 5727 G HA3 -0.267 3.693 3.960 -0.000 0.000 0.277 5727 G C 0.041 174.943 174.900 0.003 0.000 1.580 5727 G CA 0.339 45.441 45.100 0.003 0.000 1.109 5727 G HN 0.463 nan 8.290 nan 0.000 0.695 5728 D N 1.634 122.035 120.400 0.002 0.000 2.383 5728 D HA 0.509 5.149 4.640 -0.000 0.000 0.248 5728 D C 1.418 177.718 176.300 0.000 0.000 1.170 5728 D CA 1.460 55.460 54.000 0.001 0.000 0.977 5728 D CB 0.589 41.390 40.800 0.001 0.000 1.120 5728 D HN 1.827 nan 8.370 nan 0.000 0.481 5729 G N 0.084 108.883 108.800 -0.002 0.000 2.141 5729 G HA2 -0.306 3.654 3.960 -0.000 0.000 0.231 5729 G HA3 -0.306 3.654 3.960 -0.000 0.000 0.231 5729 G C 1.074 175.972 174.900 -0.004 0.000 0.984 5729 G CA 1.267 46.364 45.100 -0.004 0.000 0.660 5729 G HN 0.653 nan 8.290 nan 0.000 0.525 5730 T N -2.362 112.191 114.554 -0.002 0.000 2.674 5730 T HA -0.125 4.225 4.350 -0.000 0.000 0.265 5730 T C 2.232 176.929 174.700 -0.005 0.000 1.039 5730 T CA 2.661 64.760 62.100 -0.002 0.000 1.150 5730 T CB -0.736 68.132 68.868 -0.001 0.000 0.864 5730 T HN 0.334 nan 8.240 nan 0.000 0.427 5731 T N 1.765 116.315 114.554 -0.007 0.000 2.777 5731 T HA -0.057 4.293 4.350 -0.000 0.000 0.266 5731 T C 2.311 177.003 174.700 -0.014 0.000 1.040 5731 T CA 1.732 63.827 62.100 -0.010 0.000 1.141 5731 T CB -0.960 67.902 68.868 -0.010 0.000 0.868 5731 T HN 0.526 nan 8.240 nan 0.000 0.444 5732 T N 2.291 116.836 114.554 -0.015 0.000 2.652 5732 T HA -0.092 4.258 4.350 -0.000 0.000 0.267 5732 T C 2.417 177.104 174.700 -0.022 0.000 1.039 5732 T CA 1.325 63.413 62.100 -0.022 0.000 1.153 5732 T CB -0.631 68.224 68.868 -0.021 0.000 0.863 5732 T HN 0.435 nan 8.240 nan 0.000 0.428 5733 A N 0.772 123.584 122.820 -0.014 0.000 1.933 5733 A HA -0.032 4.288 4.320 -0.000 0.000 0.218 5733 A C 2.604 180.183 177.584 -0.008 0.000 1.175 5733 A CA 1.315 53.347 52.037 -0.009 0.000 0.628 5733 A CB -0.954 18.046 19.000 -0.000 0.000 0.814 5733 A HN 0.360 nan 8.150 nan 0.000 0.444 5734 V N -0.568 119.340 119.914 -0.009 0.000 2.307 5734 V HA -0.198 3.922 4.120 -0.000 0.000 0.245 5734 V C 2.578 178.663 176.094 -0.015 0.000 1.045 5734 V CA 1.924 64.219 62.300 -0.009 0.000 1.024 5734 V CB -0.630 31.188 31.823 -0.009 0.000 0.651 5734 V HN 0.369 nan 8.190 nan 0.000 0.449 5735 V N -0.689 119.213 119.914 -0.020 0.000 2.307 5735 V HA -0.195 3.925 4.120 -0.000 0.000 0.245 5735 V C 2.423 178.497 176.094 -0.034 0.000 1.045 5735 V CA 1.999 64.283 62.300 -0.026 0.000 1.024 5735 V CB -0.274 31.532 31.823 -0.029 0.000 0.651 5735 V HN 0.412 nan 8.190 nan 0.000 0.449 5736 V N 0.111 120.001 119.914 -0.041 0.000 2.358 5736 V HA -0.195 3.925 4.120 -0.000 0.000 0.246 5736 V C 2.595 178.662 176.094 -0.044 0.000 1.047 5736 V CA 2.098 64.362 62.300 -0.060 0.000 1.035 5736 V CB -0.372 31.408 31.823 -0.072 0.000 0.658 5736 V HN 0.520 nan 8.190 nan 0.000 0.452 5737 A N -0.191 122.617 122.820 -0.020 0.000 1.933 5737 A HA -0.042 4.278 4.320 -0.000 0.000 0.218 5737 A C 2.307 179.896 177.584 0.009 0.000 1.175 5737 A CA 1.883 53.922 52.037 0.004 0.000 0.628 5737 A CB -1.220 17.787 19.000 0.011 0.000 0.814 5737 A HN 0.616 nan 8.150 nan 0.000 0.444 5738 G N -0.646 108.151 108.800 -0.005 0.000 2.414 5738 G HA2 -0.161 3.799 3.960 -0.000 0.000 0.215 5738 G HA3 -0.161 3.799 3.960 -0.000 0.000 0.215 5738 G C 1.429 176.328 174.900 -0.003 0.000 1.188 5738 G CA 0.854 45.951 45.100 -0.005 0.000 0.783 5738 G HN 0.451 nan 8.290 nan 0.000 0.537 5739 E N 0.393 120.584 120.200 -0.015 0.000 2.106 5739 E HA -0.011 4.339 4.350 -0.000 0.000 0.192 5739 E C 2.693 179.293 176.600 0.000 0.000 0.984 5739 E CA 0.384 56.773 56.400 -0.018 0.000 0.806 5739 E CB -0.249 29.426 29.700 -0.043 0.000 0.750 5739 E HN 0.415 nan 8.360 nan 0.000 0.458 5740 L N 0.132 121.356 121.223 0.001 0.000 2.056 5740 L HA -0.192 4.148 4.340 -0.000 0.000 0.207 5740 L C 2.394 179.354 176.870 0.150 0.000 1.078 5740 L CA 0.527 55.402 54.840 0.057 0.000 0.749 5740 L CB -0.283 41.792 42.059 0.027 0.000 0.901 5740 L HN 0.132 nan 8.230 nan 0.000 0.433 5741 L N -0.372 120.906 121.223 0.090 0.000 2.093 5741 L HA -0.152 4.188 4.340 -0.000 0.000 0.208 5741 L C 2.674 179.575 176.870 0.052 0.000 1.085 5741 L CA 1.537 56.421 54.840 0.073 0.000 0.755 5741 L CB -0.779 41.305 42.059 0.043 0.000 0.904 5741 L HN 0.163 nan 8.230 nan 0.000 0.435 5742 R N -0.359 120.163 120.500 0.037 0.000 2.066 5742 R HA -0.218 4.122 4.340 -0.000 0.000 0.232 5742 R C 2.281 178.602 176.300 0.035 0.000 1.131 5742 R CA 1.570 57.684 56.100 0.023 0.000 0.955 5742 R CB -0.059 30.246 30.300 0.009 0.000 0.851 5742 R HN 0.056 nan 8.270 nan 0.000 0.432 5743 K N 0.366 120.799 120.400 0.055 0.000 2.148 5743 K HA -0.010 4.310 4.320 -0.000 0.000 0.204 5743 K C 1.668 178.324 176.600 0.094 0.000 1.050 5743 K CA 1.505 57.837 56.287 0.075 0.000 0.942 5743 K CB -0.204 32.351 32.500 0.092 0.000 0.724 5743 K HN 0.298 nan 8.250 nan 0.000 0.446 5744 A N 0.703 123.588 122.820 0.108 0.000 1.930 5744 A HA -0.119 4.201 4.320 -0.000 0.000 0.217 5744 A C 2.113 179.704 177.584 0.012 0.000 1.175 5744 A CA 1.518 53.585 52.037 0.051 0.000 0.627 5744 A CB -0.525 18.503 19.000 0.048 0.000 0.815 5744 A HN 0.419 nan 8.150 nan 0.000 0.443 5745 E N 0.140 120.351 120.200 0.019 0.000 2.204 5745 E HA -0.207 4.143 4.350 -0.000 0.000 0.194 5745 E C 1.848 178.451 176.600 0.004 0.000 0.989 5745 E CA 1.216 57.619 56.400 0.005 0.000 0.824 5745 E CB -0.157 29.546 29.700 0.005 0.000 0.756 5745 E HN 0.789 nan 8.360 nan 0.000 0.477 5746 E N 0.131 120.340 120.200 0.014 0.000 2.204 5746 E HA -0.148 4.202 4.350 -0.000 0.000 0.195 5746 E C 2.229 178.835 176.600 0.010 0.000 0.990 5746 E CA 0.602 57.010 56.400 0.013 0.000 0.821 5746 E CB 0.038 29.750 29.700 0.021 0.000 0.750 5746 E HN 0.279 nan 8.360 nan 0.000 0.477 5747 L N 0.250 121.478 121.223 0.008 0.000 2.131 5747 L HA -0.108 4.232 4.340 -0.000 0.000 0.206 5747 L C 2.459 179.323 176.870 -0.010 0.000 1.087 5747 L CA 0.470 55.311 54.840 0.000 0.000 0.767 5747 L CB -0.292 41.761 42.059 -0.010 0.000 0.917 5747 L HN 0.209 nan 8.230 nan 0.000 0.441 5748 L N -0.095 121.118 121.223 -0.017 0.000 2.046 5748 L HA -0.249 4.091 4.340 -0.000 0.000 0.208 5748 L C 2.172 179.029 176.870 -0.022 0.000 1.077 5748 L CA 1.457 56.281 54.840 -0.028 0.000 0.747 5748 L CB -0.511 41.529 42.059 -0.031 0.000 0.896 5748 L HN 0.284 nan 8.230 nan 0.000 0.432 5749 D N -0.804 119.589 120.400 -0.012 0.000 2.219 5749 D HA -0.183 4.457 4.640 -0.000 0.000 0.205 5749 D C 2.129 178.425 176.300 -0.005 0.000 0.970 5749 D CA 0.794 54.789 54.000 -0.008 0.000 0.851 5749 D CB 0.193 40.991 40.800 -0.003 0.000 0.943 5749 D HN 0.142 nan 8.370 nan 0.000 0.488 5750 Q N 0.166 119.964 119.800 -0.003 0.000 2.482 5750 Q HA 0.037 4.377 4.340 -0.000 0.000 0.209 5750 Q C 0.008 176.008 176.000 -0.001 0.000 0.961 5750 Q CA 0.297 56.100 55.803 0.000 0.000 0.945 5750 Q CB -0.033 28.709 28.738 0.005 0.000 1.012 5750 Q HN 0.366 nan 8.270 nan 0.000 0.515 5751 N N -0.390 118.305 118.700 -0.008 0.000 2.814 5751 N HA -0.124 4.616 4.740 -0.000 0.000 0.247 5751 N C -1.191 174.319 175.510 -0.000 0.000 1.089 5751 N CA 0.381 53.424 53.050 -0.011 0.000 0.682 5751 N CB -1.698 36.786 38.487 -0.006 0.000 0.970 5751 N HN -0.026 nan 8.380 nan 0.000 0.554 5752 V N 1.724 121.638 119.914 -0.001 0.000 2.328 5752 V HA 0.122 4.242 4.120 -0.000 0.000 0.278 5752 V C 0.915 177.026 176.094 0.029 0.000 1.021 5752 V CA -0.767 61.544 62.300 0.018 0.000 0.838 5752 V CB 1.321 33.148 31.823 0.008 0.000 0.999 5752 V HN 0.331 nan 8.190 nan 0.000 0.447 5753 H N 9.458 128.513 119.070 -0.025 0.000 3.167 5753 H HA 0.001 4.557 4.556 0.000 0.000 0.306 5753 H C -1.409 173.894 175.328 -0.041 0.000 0.965 5753 H CA -1.102 54.929 56.048 -0.027 0.000 1.408 5753 H CB 1.482 31.230 29.762 -0.022 0.000 1.406 5753 H HN 0.374 nan 8.280 nan 0.000 0.576 5754 P HA -0.157 nan 4.420 nan 0.000 0.219 5754 P C 1.512 178.902 177.300 0.150 0.000 1.146 5754 P CA 1.336 64.487 63.100 0.085 0.000 0.808 5754 P CB 0.097 31.802 31.700 0.008 0.000 0.779 5755 T N -0.793 113.967 114.554 0.344 0.000 2.881 5755 T HA -0.079 4.271 4.350 -0.000 0.000 0.270 5755 T C 1.774 176.458 174.700 -0.028 0.000 1.068 5755 T CA 0.842 62.967 62.100 0.042 0.000 1.131 5755 T CB -0.647 68.091 68.868 -0.217 0.000 0.871 5755 T HN -0.006 nan 8.240 nan 0.000 0.479 5756 I N 0.171 120.739 120.570 -0.003 0.000 2.233 5756 I HA -0.091 4.079 4.170 -0.000 0.000 0.243 5756 I C 2.453 178.525 176.117 -0.076 0.000 1.093 5756 I CA 0.719 61.998 61.300 -0.034 0.000 1.380 5756 I CB -0.353 37.643 38.000 -0.007 0.000 1.067 5756 I HN 0.087 nan 8.210 nan 0.000 0.413 5757 V N 0.391 120.240 119.914 -0.109 0.000 2.287 5757 V HA -0.268 3.852 4.120 -0.000 0.000 0.248 5757 V C 2.410 178.259 176.094 -0.410 0.000 1.053 5757 V CA 1.878 64.007 62.300 -0.286 0.000 1.027 5757 V CB -0.529 31.123 31.823 -0.285 0.000 0.646 5757 V HN 0.359 nan 8.190 nan 0.000 0.447 5758 V N -0.305 119.486 119.914 -0.206 0.000 2.427 5758 V HA -0.218 3.902 4.120 -0.000 0.000 0.248 5758 V C 2.580 178.654 176.094 -0.033 0.000 1.051 5758 V CA 2.296 64.537 62.300 -0.098 0.000 1.048 5758 V CB -0.404 31.406 31.823 -0.022 0.000 0.666 5758 V HN 0.507 nan 8.190 nan 0.000 0.456 5759 K N 0.144 120.516 120.400 -0.047 0.000 2.025 5759 K HA -0.083 4.237 4.320 -0.000 0.000 0.207 5759 K C 2.116 178.706 176.600 -0.017 0.000 1.049 5759 K CA 1.692 57.962 56.287 -0.028 0.000 0.933 5759 K CB -0.945 31.532 32.500 -0.038 0.000 0.714 5759 K HN 0.555 nan 8.250 nan 0.000 0.438 5760 G N 0.272 109.058 108.800 -0.025 0.000 2.440 5760 G HA2 -0.252 3.708 3.960 -0.000 0.000 0.218 5760 G HA3 -0.252 3.708 3.960 -0.000 0.000 0.218 5760 G C 1.403 176.364 174.900 0.102 0.000 1.154 5760 G CA 0.697 45.812 45.100 0.025 0.000 0.767 5760 G HN 0.253 nan 8.290 nan 0.000 0.552 5761 Y N 0.887 121.160 120.300 -0.046 0.000 2.200 5761 Y HA -0.051 4.499 4.550 -0.000 0.000 0.290 5761 Y C 3.112 178.864 175.900 -0.247 0.000 1.137 5761 Y CA 0.727 58.779 58.100 -0.080 0.000 1.163 5761 Y CB -0.778 37.783 38.460 0.168 0.000 0.988 5761 Y HN 0.199 nan 8.280 nan 0.000 0.518 5762 Q N -0.305 119.530 119.800 0.058 0.000 2.030 5762 Q HA -0.172 4.168 4.340 -0.000 0.000 0.204 5762 Q C 2.596 178.532 176.000 -0.108 0.000 0.986 5762 Q CA 1.637 57.432 55.803 -0.014 0.000 0.843 5762 Q CB -0.716 28.026 28.738 0.006 0.000 0.904 5762 Q HN 0.451 nan 8.270 nan 0.000 0.420 5763 A N 1.036 123.796 122.820 -0.100 0.000 1.883 5763 A HA -0.133 4.187 4.320 -0.000 0.000 0.217 5763 A C 2.323 179.801 177.584 -0.176 0.000 1.186 5763 A CA 2.161 54.134 52.037 -0.108 0.000 0.624 5763 A CB -0.752 18.207 19.000 -0.068 0.000 0.822 5763 A HN 0.400 nan 8.150 nan 0.000 0.444 5764 A N -0.339 122.294 122.820 -0.312 0.000 1.930 5764 A HA 0.205 4.525 4.320 -0.000 0.000 0.217 5764 A C 2.491 179.708 177.584 -0.610 0.000 1.175 5764 A CA 1.976 53.730 52.037 -0.471 0.000 0.627 5764 A CB -0.955 17.624 19.000 -0.701 0.000 0.815 5764 A HN 1.038 nan 8.150 nan 0.000 0.443 5765 A N -1.084 121.274 122.820 -0.771 0.000 1.877 5765 A HA -0.218 4.102 4.320 -0.000 0.000 0.216 5765 A C 2.212 179.735 177.584 -0.100 0.000 1.186 5765 A CA 1.793 53.636 52.037 -0.322 0.000 0.620 5765 A CB -0.534 18.387 19.000 -0.132 0.000 0.822 5765 A HN 0.506 nan 8.150 nan 0.000 0.443 5766 Q N -0.126 119.611 119.800 -0.104 0.000 2.124 5766 Q HA -0.207 4.133 4.340 -0.000 0.000 0.202 5766 Q C 2.006 177.985 176.000 -0.035 0.000 0.977 5766 Q CA 2.110 57.883 55.803 -0.049 0.000 0.850 5766 Q CB -0.173 28.536 28.738 -0.049 0.000 0.901 5766 Q HN 0.539 nan 8.270 nan 0.000 0.429 5767 K N 0.378 120.748 120.400 -0.050 0.000 2.211 5767 K HA 0.013 4.333 4.320 -0.000 0.000 0.203 5767 K C 1.749 178.375 176.600 0.043 0.000 1.050 5767 K CA 1.231 57.515 56.287 -0.005 0.000 0.945 5767 K CB -0.492 32.015 32.500 0.012 0.000 0.732 5767 K HN 0.192 nan 8.250 nan 0.000 0.451 5768 A N 0.583 123.424 122.820 0.034 0.000 1.933 5768 A HA -0.194 4.126 4.320 -0.000 0.000 0.218 5768 A C 2.074 179.696 177.584 0.063 0.000 1.175 5768 A CA 1.627 53.712 52.037 0.082 0.000 0.628 5768 A CB -0.492 18.594 19.000 0.143 0.000 0.814 5768 A HN 0.510 nan 8.150 nan 0.000 0.444 5769 Q N -0.631 119.194 119.800 0.042 0.000 2.119 5769 Q HA -0.183 4.157 4.340 -0.000 0.000 0.201 5769 Q C 1.985 178.002 176.000 0.028 0.000 0.972 5769 Q CA 1.552 57.374 55.803 0.032 0.000 0.847 5769 Q CB -0.151 28.600 28.738 0.022 0.000 0.903 5769 Q HN 0.777 nan 8.270 nan 0.000 0.433 5770 E N 0.586 120.802 120.200 0.026 0.000 2.051 5770 E HA -0.172 4.178 4.350 -0.000 0.000 0.192 5770 E C 2.048 178.672 176.600 0.040 0.000 0.991 5770 E CA 0.866 57.281 56.400 0.025 0.000 0.799 5770 E CB -0.076 29.633 29.700 0.015 0.000 0.748 5770 E HN 0.297 nan 8.360 nan 0.000 0.449 5771 L N 0.460 121.719 121.223 0.060 0.000 2.083 5771 L HA -0.213 4.127 4.340 -0.000 0.000 0.209 5771 L C 2.371 179.270 176.870 0.050 0.000 1.083 5771 L CA 0.439 55.321 54.840 0.071 0.000 0.752 5771 L CB -0.282 41.831 42.059 0.091 0.000 0.899 5771 L HN 0.169 nan 8.230 nan 0.000 0.433 5772 L N -0.092 121.156 121.223 0.042 0.000 2.046 5772 L HA -0.203 4.137 4.340 -0.000 0.000 0.208 5772 L C 2.492 179.377 176.870 0.026 0.000 1.077 5772 L CA 1.750 56.609 54.840 0.031 0.000 0.747 5772 L CB -0.668 41.407 42.059 0.028 0.000 0.896 5772 L HN 0.146 nan 8.230 nan 0.000 0.432 5773 K N -1.580 118.835 120.400 0.025 0.000 2.148 5773 K HA -0.096 4.224 4.320 -0.000 0.000 0.204 5773 K C 1.890 178.503 176.600 0.022 0.000 1.050 5773 K CA 1.565 57.864 56.287 0.020 0.000 0.942 5773 K CB -0.194 32.316 32.500 0.017 0.000 0.724 5773 K HN 0.333 nan 8.250 nan 0.000 0.446 5774 T N 1.770 116.341 114.554 0.028 0.000 2.851 5774 T HA -0.036 4.314 4.350 -0.000 0.000 0.262 5774 T C 1.898 176.616 174.700 0.031 0.000 1.043 5774 T CA 1.107 63.225 62.100 0.031 0.000 1.140 5774 T CB -0.092 68.801 68.868 0.041 0.000 0.872 5774 T HN 0.361 nan 8.240 nan 0.000 0.446 5775 I N -0.097 120.494 120.570 0.034 0.000 3.226 5775 I HA 0.416 4.586 4.170 -0.000 0.000 0.277 5775 I C 1.147 177.281 176.117 0.028 0.000 1.243 5775 I CA -0.459 60.862 61.300 0.035 0.000 1.459 5775 I CB -0.526 37.499 38.000 0.042 0.000 1.093 5775 I HN -0.050 nan 8.210 nan 0.000 0.453 5776 A N 1.516 124.350 122.820 0.023 0.000 2.567 5776 A HA 0.074 4.394 4.320 -0.000 0.000 0.240 5776 A C 0.203 177.797 177.584 0.016 0.000 1.053 5776 A CA -0.009 52.039 52.037 0.018 0.000 0.755 5776 A CB -0.248 18.761 19.000 0.015 0.000 0.978 5776 A HN 0.640 nan 8.150 nan 0.000 0.507 5777 C N 4.086 123.395 119.300 0.015 0.000 2.281 5777 C HA 0.499 4.959 4.460 -0.000 0.000 0.336 5777 C C 0.283 175.279 174.990 0.010 0.000 1.217 5777 C CA -0.738 58.288 59.018 0.013 0.000 1.730 5777 C CB -1.484 26.263 27.740 0.013 0.000 2.338 5777 C HN 0.886 nan 8.230 nan 0.000 0.521 5778 E N 3.297 123.502 120.200 0.009 0.000 2.360 5778 E HA 0.451 4.801 4.350 -0.000 0.000 0.269 5778 E C 0.112 176.716 176.600 0.007 0.000 1.022 5778 E CA 0.112 56.517 56.400 0.008 0.000 0.887 5778 E CB 0.913 30.617 29.700 0.007 0.000 0.990 5778 E HN 0.677 nan 8.360 nan 0.000 0.426 5779 V N -0.930 118.987 119.914 0.006 0.000 3.130 5779 V HA 0.802 4.922 4.120 -0.000 0.000 0.310 5779 V C 0.381 176.478 176.094 0.005 0.000 1.158 5779 V CA -1.243 61.060 62.300 0.006 0.000 1.029 5779 V CB 1.803 33.630 31.823 0.006 0.000 1.057 5779 V HN 0.653 nan 8.190 nan 0.000 0.436 5780 G N 0.521 109.324 108.800 0.005 0.000 2.335 5780 G HA2 0.476 4.436 3.960 -0.000 0.000 0.268 5780 G HA3 0.476 4.436 3.960 -0.000 0.000 0.268 5780 G C 1.012 175.915 174.900 0.005 0.000 1.228 5780 G CA 0.234 45.337 45.100 0.004 0.000 0.968 5780 G HN 1.662 nan 8.290 nan 0.000 0.459 5781 A N 2.759 125.581 122.820 0.004 0.000 1.917 5781 A HA -0.152 4.168 4.320 -0.000 0.000 0.219 5781 A C 1.949 179.536 177.584 0.005 0.000 1.182 5781 A CA 1.515 53.554 52.037 0.004 0.000 0.633 5781 A CB -0.124 18.878 19.000 0.004 0.000 0.819 5781 A HN 0.658 nan 8.150 nan 0.000 0.448 5782 Q N -0.309 119.494 119.800 0.005 0.000 2.201 5782 Q HA 0.088 4.428 4.340 -0.000 0.000 0.236 5782 Q C -0.712 175.291 176.000 0.006 0.000 0.857 5782 Q CA -0.407 55.399 55.803 0.005 0.000 1.025 5782 Q CB 0.361 29.102 28.738 0.005 0.000 1.124 5782 Q HN 0.559 nan 8.270 nan 0.000 0.473 5783 D N 1.339 121.743 120.400 0.006 0.000 2.382 5783 D HA -0.049 4.591 4.640 -0.000 0.000 0.259 5783 D C 0.906 177.211 176.300 0.007 0.000 1.224 5783 D CA 0.276 54.280 54.000 0.006 0.000 0.894 5783 D CB 1.170 41.973 40.800 0.006 0.000 1.127 5783 D HN -0.073 nan 8.370 nan 0.000 0.487 5784 K N 3.978 124.383 120.400 0.008 0.000 2.000 5784 K HA -0.272 4.048 4.320 -0.000 0.000 0.218 5784 K C 1.622 178.227 176.600 0.009 0.000 1.053 5784 K CA 2.119 58.411 56.287 0.008 0.000 0.946 5784 K CB -0.315 32.190 32.500 0.008 0.000 0.723 5784 K HN 0.422 nan 8.250 nan 0.000 0.446 5785 E N 0.304 120.509 120.200 0.008 0.000 2.049 5785 E HA -0.157 4.193 4.350 -0.000 0.000 0.198 5785 E C 1.979 178.585 176.600 0.009 0.000 1.007 5785 E CA 2.101 58.506 56.400 0.008 0.000 0.809 5785 E CB -0.377 29.327 29.700 0.007 0.000 0.749 5785 E HN 0.470 nan 8.360 nan 0.000 0.450 5786 I N -0.047 120.528 120.570 0.008 0.000 2.361 5786 I HA -0.229 3.941 4.170 -0.000 0.000 0.251 5786 I C 1.868 177.991 176.117 0.010 0.000 1.133 5786 I CA 0.312 61.617 61.300 0.009 0.000 1.413 5786 I CB -0.165 37.840 38.000 0.008 0.000 1.073 5786 I HN 0.189 nan 8.210 nan 0.000 0.424 5787 L N 0.234 121.462 121.223 0.009 0.000 2.046 5787 L HA -0.177 4.163 4.340 -0.000 0.000 0.208 5787 L C 2.577 179.454 176.870 0.011 0.000 1.077 5787 L CA 1.968 56.814 54.840 0.010 0.000 0.747 5787 L CB -1.269 40.796 42.059 0.010 0.000 0.896 5787 L HN 0.184 nan 8.230 nan 0.000 0.432 5788 T N -1.353 113.208 114.554 0.011 0.000 2.833 5788 T HA -0.192 4.158 4.350 -0.000 0.000 0.269 5788 T C 1.992 176.700 174.700 0.014 0.000 1.054 5788 T CA 1.119 63.226 62.100 0.012 0.000 1.135 5788 T CB -0.025 68.849 68.868 0.011 0.000 0.869 5788 T HN 0.061 nan 8.240 nan 0.000 0.466 5789 K N 0.903 121.311 120.400 0.014 0.000 2.057 5789 K HA 0.173 4.493 4.320 -0.000 0.000 0.206 5789 K C 1.997 178.607 176.600 0.018 0.000 1.050 5789 K CA 0.789 57.086 56.287 0.016 0.000 0.935 5789 K CB -0.464 32.045 32.500 0.014 0.000 0.715 5789 K HN 0.339 nan 8.250 nan 0.000 0.439 5790 I N 0.189 120.768 120.570 0.015 0.000 2.142 5790 I HA -0.325 3.845 4.170 -0.000 0.000 0.240 5790 I C 2.224 178.353 176.117 0.019 0.000 1.078 5790 I CA 1.347 62.657 61.300 0.016 0.000 1.343 5790 I CB -0.439 37.568 38.000 0.013 0.000 1.046 5790 I HN 0.145 nan 8.210 nan 0.000 0.405 5791 A N 0.573 123.403 122.820 0.017 0.000 1.841 5791 A HA -0.301 4.019 4.320 -0.000 0.000 0.216 5791 A C 2.431 180.027 177.584 0.020 0.000 1.199 5791 A CA 2.194 54.241 52.037 0.017 0.000 0.621 5791 A CB -0.849 18.159 19.000 0.014 0.000 0.835 5791 A HN 0.433 nan 8.150 nan 0.000 0.445 5792 M N -0.651 118.961 119.600 0.020 0.000 2.149 5792 M HA -0.156 4.324 4.480 -0.000 0.000 0.261 5792 M C 2.057 178.376 176.300 0.032 0.000 1.064 5792 M CA 2.145 57.457 55.300 0.021 0.000 1.102 5792 M CB -0.353 32.259 32.600 0.019 0.000 1.369 5792 M HN 0.496 nan 8.290 nan 0.000 0.408 5793 T N 0.031 114.607 114.554 0.037 0.000 2.788 5793 T HA -0.106 4.244 4.350 -0.000 0.000 0.268 5793 T C 1.820 176.562 174.700 0.069 0.000 1.044 5793 T CA 1.744 63.877 62.100 0.054 0.000 1.139 5793 T CB -0.187 68.706 68.868 0.043 0.000 0.867 5793 T HN 0.446 nan 8.240 nan 0.000 0.454 5794 S N 1.150 116.880 115.700 0.050 0.000 2.345 5794 S HA 0.023 4.493 4.470 -0.000 0.000 0.220 5794 S C 2.060 176.689 174.600 0.047 0.000 1.031 5794 S CA 0.920 59.150 58.200 0.051 0.000 0.996 5794 S CB -0.397 62.823 63.200 0.034 0.000 0.882 5794 S HN 0.421 nan 8.310 nan 0.000 0.445 5795 I N 1.798 122.386 120.570 0.030 0.000 2.286 5795 I HA -0.124 4.046 4.170 -0.000 0.000 0.248 5795 I C 1.142 177.262 176.117 0.005 0.000 1.115 5795 I CA 0.652 61.961 61.300 0.014 0.000 1.392 5795 I CB -1.020 36.985 38.000 0.009 0.000 1.065 5795 I HN 0.330 nan 8.210 nan 0.000 0.418 5796 T N 0.096 114.661 114.554 0.019 0.000 2.934 5796 T HA 0.305 4.655 4.350 -0.000 0.000 0.306 5796 T C 1.090 175.765 174.700 -0.042 0.000 1.042 5796 T CA 0.139 62.239 62.100 0.001 0.000 1.145 5796 T CB 1.106 69.996 68.868 0.037 0.000 0.982 5796 T HN 0.646 nan 8.240 nan 0.000 0.544 5797 G N 1.947 110.667 108.800 -0.134 0.000 2.157 5797 G HA2 -0.193 3.767 3.960 -0.000 0.000 0.239 5797 G HA3 -0.193 3.767 3.960 -0.000 0.000 0.239 5797 G C -0.066 174.720 174.900 -0.190 0.000 0.982 5797 G CA 0.205 45.132 45.100 -0.288 0.000 0.650 5797 G HN 0.905 nan 8.290 nan 0.000 0.527 5798 K N -0.950 119.385 120.400 -0.108 0.000 2.352 5798 K HA 0.610 4.930 4.320 -0.000 0.000 0.240 5798 K C 1.609 178.165 176.600 -0.074 0.000 1.017 5798 K CA -0.556 55.682 56.287 -0.081 0.000 0.851 5798 K CB 1.269 33.740 32.500 -0.049 0.000 1.261 5798 K HN 0.174 nan 8.250 nan 0.000 0.451 5799 G N 0.511 109.267 108.800 -0.074 0.000 2.442 5799 G HA2 -0.284 3.676 3.960 -0.000 0.000 0.219 5799 G HA3 -0.284 3.676 3.960 -0.000 0.000 0.219 5799 G C 1.206 176.077 174.900 -0.049 0.000 1.141 5799 G CA 1.260 46.321 45.100 -0.066 0.000 0.763 5799 G HN 0.613 nan 8.290 nan 0.000 0.554 5800 A N 0.276 123.070 122.820 -0.043 0.000 2.209 5800 A HA 0.122 4.442 4.320 -0.000 0.000 0.212 5800 A C 2.018 179.588 177.584 -0.024 0.000 1.158 5800 A CA 1.456 53.476 52.037 -0.028 0.000 0.742 5800 A CB -0.247 18.740 19.000 -0.021 0.000 0.790 5800 A HN 0.368 nan 8.150 nan 0.000 0.472 5801 E N 0.966 121.147 120.200 -0.031 0.000 2.267 5801 E HA -0.218 4.132 4.350 -0.000 0.000 0.197 5801 E C 1.150 177.738 176.600 -0.020 0.000 0.998 5801 E CA 0.913 57.297 56.400 -0.026 0.000 0.830 5801 E CB -0.115 29.561 29.700 -0.040 0.000 0.751 5801 E HN 0.443 nan 8.360 nan 0.000 0.491 5802 K N -0.166 120.221 120.400 -0.021 0.000 2.160 5802 K HA -0.131 4.189 4.320 -0.000 0.000 0.206 5802 K C 1.257 177.851 176.600 -0.010 0.000 1.047 5802 K CA 1.251 57.528 56.287 -0.016 0.000 0.930 5802 K CB -0.109 32.381 32.500 -0.017 0.000 0.720 5802 K HN 0.113 nan 8.250 nan 0.000 0.450 5803 A N 1.450 124.264 122.820 -0.009 0.000 2.855 5803 A HA 0.106 4.426 4.320 -0.000 0.000 0.301 5803 A C 1.311 178.894 177.584 -0.002 0.000 1.076 5803 A CA -0.447 51.587 52.037 -0.004 0.000 1.004 5803 A CB 0.003 19.001 19.000 -0.002 0.000 1.152 5803 A HN 0.272 nan 8.150 nan 0.000 0.531 5804 K N -0.172 120.227 120.400 -0.002 0.000 2.147 5804 K HA -0.165 4.155 4.320 -0.000 0.000 0.205 5804 K C 0.930 177.533 176.600 0.005 0.000 1.049 5804 K CA 1.814 58.102 56.287 0.002 0.000 0.936 5804 K CB -0.074 32.427 32.500 0.002 0.000 0.722 5804 K HN 0.313 nan 8.250 nan 0.000 0.446 5805 E N 1.625 121.827 120.200 0.004 0.000 2.028 5805 E HA -0.128 4.222 4.350 -0.000 0.000 0.191 5805 E C 1.985 178.589 176.600 0.006 0.000 0.988 5805 E CA 1.379 57.782 56.400 0.006 0.000 0.799 5805 E CB -0.052 29.651 29.700 0.005 0.000 0.755 5805 E HN 0.372 nan 8.360 nan 0.000 0.447 5806 K N 0.218 120.621 120.400 0.005 0.000 2.026 5806 K HA -0.146 4.174 4.320 -0.000 0.000 0.208 5806 K C 1.809 178.414 176.600 0.008 0.000 1.048 5806 K CA 0.899 57.190 56.287 0.007 0.000 0.929 5806 K CB -0.050 32.453 32.500 0.006 0.000 0.713 5806 K HN -0.003 nan 8.250 nan 0.000 0.439 5807 L N 1.060 122.288 121.223 0.008 0.000 2.046 5807 L HA -0.106 4.234 4.340 -0.000 0.000 0.208 5807 L C 2.469 179.346 176.870 0.010 0.000 1.077 5807 L CA 1.983 56.828 54.840 0.009 0.000 0.747 5807 L CB -1.055 41.008 42.059 0.007 0.000 0.896 5807 L HN 0.254 nan 8.230 nan 0.000 0.432 5808 A N -0.998 121.828 122.820 0.010 0.000 1.933 5808 A HA -0.236 4.084 4.320 -0.000 0.000 0.218 5808 A C 2.304 179.895 177.584 0.011 0.000 1.175 5808 A CA 1.714 53.758 52.037 0.011 0.000 0.628 5808 A CB -0.455 18.552 19.000 0.012 0.000 0.814 5808 A HN 0.406 nan 8.150 nan 0.000 0.444 5809 E N 0.737 120.943 120.200 0.011 0.000 2.028 5809 E HA -0.173 4.177 4.350 -0.000 0.000 0.191 5809 E C 1.866 178.474 176.600 0.013 0.000 0.988 5809 E CA 1.725 58.132 56.400 0.011 0.000 0.799 5809 E CB -0.500 29.206 29.700 0.010 0.000 0.755 5809 E HN 0.724 nan 8.360 nan 0.000 0.447 5810 I N -1.462 119.116 120.570 0.013 0.000 2.286 5810 I HA -0.178 3.992 4.170 -0.000 0.000 0.248 5810 I C 2.219 178.345 176.117 0.015 0.000 1.115 5810 I CA 1.264 62.573 61.300 0.015 0.000 1.392 5810 I CB -0.454 37.555 38.000 0.016 0.000 1.065 5810 I HN 0.038 nan 8.210 nan 0.000 0.418 5811 I N 0.968 121.546 120.570 0.013 0.000 2.202 5811 I HA -0.179 3.991 4.170 -0.000 0.000 0.242 5811 I C 2.659 178.784 176.117 0.012 0.000 1.091 5811 I CA 1.027 62.334 61.300 0.013 0.000 1.368 5811 I CB -0.278 37.730 38.000 0.012 0.000 1.058 5811 I HN 0.085 nan 8.210 nan 0.000 0.410 5812 V N 0.829 120.750 119.914 0.012 0.000 2.343 5812 V HA -0.275 3.845 4.120 -0.000 0.000 0.247 5812 V C 2.522 178.624 176.094 0.013 0.000 1.051 5812 V CA 2.151 64.458 62.300 0.012 0.000 1.036 5812 V CB -0.581 31.249 31.823 0.012 0.000 0.654 5812 V HN 0.436 nan 8.190 nan 0.000 0.451 5813 E N 0.883 121.092 120.200 0.015 0.000 2.072 5813 E HA -0.159 4.191 4.350 -0.000 0.000 0.191 5813 E C 2.114 178.725 176.600 0.018 0.000 0.985 5813 E CA 1.673 58.083 56.400 0.017 0.000 0.801 5813 E CB -0.505 29.206 29.700 0.018 0.000 0.750 5813 E HN 0.484 nan 8.360 nan 0.000 0.452 5814 A N 0.228 123.058 122.820 0.016 0.000 1.883 5814 A HA -0.175 4.145 4.320 -0.000 0.000 0.217 5814 A C 2.529 180.121 177.584 0.014 0.000 1.186 5814 A CA 1.943 53.989 52.037 0.015 0.000 0.624 5814 A CB -0.963 18.045 19.000 0.013 0.000 0.822 5814 A HN 0.206 nan 8.150 nan 0.000 0.444 5815 V N -0.474 119.447 119.914 0.012 0.000 2.295 5815 V HA -0.215 3.905 4.120 -0.000 0.000 0.246 5815 V C 2.792 178.892 176.094 0.011 0.000 1.049 5815 V CA 2.324 64.630 62.300 0.010 0.000 1.024 5815 V CB -0.926 30.903 31.823 0.009 0.000 0.648 5815 V HN 0.664 nan 8.190 nan 0.000 0.447 5816 S N -0.218 115.489 115.700 0.012 0.000 2.383 5816 S HA -0.210 4.260 4.470 -0.000 0.000 0.229 5816 S C 2.074 176.683 174.600 0.015 0.000 1.030 5816 S CA 1.701 59.909 58.200 0.012 0.000 1.002 5816 S CB -0.312 62.896 63.200 0.014 0.000 0.829 5816 S HN 0.622 nan 8.310 nan 0.000 0.467 5817 A N 0.836 123.668 122.820 0.020 0.000 1.898 5817 A HA 0.015 4.335 4.320 -0.000 0.000 0.216 5817 A C 2.370 179.967 177.584 0.021 0.000 1.181 5817 A CA 1.734 53.787 52.037 0.027 0.000 0.620 5817 A CB -0.939 18.082 19.000 0.034 0.000 0.819 5817 A HN 0.944 nan 8.150 nan 0.000 0.442 5818 V N -3.165 116.758 119.914 0.015 0.000 2.951 5818 V HA -0.001 4.119 4.120 -0.000 0.000 0.255 5818 V C 2.059 178.157 176.094 0.006 0.000 1.088 5818 V CA 1.437 63.743 62.300 0.010 0.000 1.109 5818 V CB -0.542 31.286 31.823 0.007 0.000 0.724 5818 V HN 0.179 nan 8.190 nan 0.000 0.471 5819 V N 0.584 120.502 119.914 0.006 0.000 2.626 5819 V HA -0.124 3.996 4.120 -0.000 0.000 0.252 5819 V C 1.699 177.793 176.094 0.000 0.000 1.067 5819 V CA 2.445 64.747 62.300 0.003 0.000 1.081 5819 V CB -0.516 31.309 31.823 0.004 0.000 0.686 5819 V HN 0.850 nan 8.190 nan 0.000 0.468 5820 D N -0.731 119.669 120.400 -0.000 0.000 4.508 5820 D HA -0.222 4.418 4.640 -0.000 0.000 0.178 5820 D C 0.637 176.932 176.300 -0.007 0.000 0.644 5820 D CA 1.991 55.987 54.000 -0.006 0.000 1.244 5820 D CB -1.207 39.589 40.800 -0.007 0.000 0.727 5820 D HN 0.576 nan 8.370 nan 0.000 0.495 5821 D N 1.329 121.725 120.400 -0.007 0.000 2.377 5821 D HA 0.251 4.891 4.640 -0.000 0.000 0.245 5821 D C -0.213 176.085 176.300 -0.003 0.000 1.196 5821 D CA 0.101 54.097 54.000 -0.006 0.000 0.962 5821 D CB 0.620 41.416 40.800 -0.007 0.000 1.127 5821 D HN 0.290 nan 8.370 nan 0.000 0.471 5822 E N 0.338 120.536 120.200 -0.003 0.000 2.136 5822 E HA 0.512 4.862 4.350 -0.000 0.000 0.246 5822 E C -0.924 175.676 176.600 -0.001 0.000 1.017 5822 E CA -0.589 55.810 56.400 -0.001 0.000 0.883 5822 E CB -0.416 29.284 29.700 -0.001 0.000 1.199 5822 E HN 0.494 nan 8.360 nan 0.000 0.447 5823 G N 2.369 111.168 108.800 -0.000 0.000 2.405 5823 G HA2 0.232 4.192 3.960 -0.000 0.000 0.303 5823 G HA3 0.232 4.192 3.960 -0.000 0.000 0.303 5823 G C -1.923 172.978 174.900 0.000 0.000 1.644 5823 G CA -0.937 44.163 45.100 -0.000 0.000 0.899 5823 G HN 0.210 nan 8.290 nan 0.000 0.667 5824 K N 0.365 120.765 120.400 -0.000 0.000 2.427 5824 K HA 0.779 5.099 4.320 -0.000 0.000 0.252 5824 K C -1.292 175.309 176.600 0.001 0.000 0.931 5824 K CA -0.776 55.511 56.287 0.000 0.000 0.793 5824 K CB 2.346 34.846 32.500 -0.000 0.000 1.211 5824 K HN 1.021 nan 8.250 nan 0.000 0.426 5825 V N 2.885 122.800 119.914 0.001 0.000 2.555 5825 V HA 0.562 4.682 4.120 -0.000 0.000 0.302 5825 V C -1.581 174.514 176.094 0.001 0.000 1.038 5825 V CA -0.526 61.775 62.300 0.001 0.000 0.887 5825 V CB 1.843 33.667 31.823 0.003 0.000 0.991 5825 V HN 0.894 nan 8.190 nan 0.000 0.434 5826 D N 4.701 125.101 120.400 0.000 0.000 2.461 5826 D HA 0.248 4.888 4.640 -0.000 0.000 0.240 5826 D C 0.771 177.070 176.300 -0.001 0.000 1.094 5826 D CA -0.299 53.700 54.000 -0.001 0.000 0.868 5826 D CB 1.627 42.426 40.800 -0.003 0.000 1.062 5826 D HN 0.657 nan 8.370 nan 0.000 0.530 5827 K N 2.598 122.998 120.400 -0.001 0.000 2.520 5827 K HA -0.188 4.132 4.320 -0.000 0.000 0.197 5827 K C 0.822 177.420 176.600 -0.003 0.000 1.043 5827 K CA 0.876 57.162 56.287 -0.001 0.000 0.944 5827 K CB 0.235 32.735 32.500 0.001 0.000 0.770 5827 K HN 0.281 nan 8.250 nan 0.000 0.480 5828 D N 0.229 120.625 120.400 -0.005 0.000 2.264 5828 D HA -0.096 4.544 4.640 -0.000 0.000 0.208 5828 D C 1.320 177.613 176.300 -0.011 0.000 0.966 5828 D CA 0.731 54.726 54.000 -0.009 0.000 0.864 5828 D CB 0.177 40.971 40.800 -0.009 0.000 0.933 5828 D HN 0.258 nan 8.370 nan 0.000 0.499 5829 L N -0.105 121.113 121.223 -0.008 0.000 2.591 5829 L HA 0.194 4.534 4.340 -0.000 0.000 0.228 5829 L C 0.269 177.135 176.870 -0.007 0.000 1.133 5829 L CA 0.123 54.958 54.840 -0.009 0.000 0.880 5829 L CB 0.142 42.199 42.059 -0.004 0.000 1.033 5829 L HN 0.012 nan 8.230 nan 0.000 0.450 5830 I N 0.700 121.266 120.570 -0.006 0.000 2.405 5830 I HA 0.182 4.352 4.170 -0.000 0.000 0.280 5830 I C 0.125 176.238 176.117 -0.008 0.000 1.027 5830 I CA -0.325 60.972 61.300 -0.004 0.000 1.161 5830 I CB 1.262 39.262 38.000 0.001 0.000 1.300 5830 I HN -0.007 nan 8.210 nan 0.000 0.463 5831 K N 6.355 126.747 120.400 -0.013 0.000 2.185 5831 K HA 0.470 4.790 4.320 -0.000 0.000 0.271 5831 K C -0.739 175.854 176.600 -0.013 0.000 1.013 5831 K CA -0.471 55.806 56.287 -0.018 0.000 0.943 5831 K CB 1.061 33.542 32.500 -0.030 0.000 0.998 5831 K HN 0.437 nan 8.250 nan 0.000 0.468 5832 I N 3.929 124.492 120.570 -0.012 0.000 2.390 5832 I HA 0.166 4.336 4.170 -0.000 0.000 0.283 5832 I C -0.555 175.556 176.117 -0.010 0.000 1.016 5832 I CA -0.624 60.672 61.300 -0.006 0.000 1.151 5832 I CB 0.977 38.977 38.000 -0.000 0.000 1.293 5832 I HN 0.686 nan 8.210 nan 0.000 0.458 5833 E N 7.560 127.752 120.200 -0.013 0.000 2.151 5833 E HA 0.502 4.852 4.350 -0.000 0.000 0.275 5833 E C -0.890 175.710 176.600 0.000 0.000 0.936 5833 E CA -0.625 55.765 56.400 -0.016 0.000 0.777 5833 E CB 1.145 30.821 29.700 -0.040 0.000 1.108 5833 E HN 0.539 nan 8.360 nan 0.000 0.401 5834 K N 2.782 123.184 120.400 0.004 0.000 2.471 5834 K HA 0.616 4.936 4.320 -0.000 0.000 0.252 5834 K C -1.121 175.490 176.600 0.017 0.000 0.938 5834 K CA -1.164 55.132 56.287 0.015 0.000 0.796 5834 K CB 1.632 34.142 32.500 0.016 0.000 1.161 5834 K HN 0.180 nan 8.250 nan 0.000 0.425 5835 K N 1.875 122.290 120.400 0.025 0.000 2.578 5835 K HA 0.187 4.507 4.320 -0.000 0.000 0.250 5835 K C -1.018 175.600 176.600 0.030 0.000 0.955 5835 K CA -0.376 55.928 56.287 0.028 0.000 0.825 5835 K CB 2.072 34.593 32.500 0.035 0.000 1.151 5835 K HN 0.701 nan 8.250 nan 0.000 0.432 5836 S N 2.629 118.345 115.700 0.027 0.000 2.563 5836 S HA 0.563 5.033 4.470 -0.000 0.000 0.284 5836 S C 0.110 174.725 174.600 0.025 0.000 1.331 5836 S CA 1.270 59.485 58.200 0.025 0.000 1.047 5836 S CB -0.146 63.069 63.200 0.026 0.000 0.859 5836 S HN 1.087 nan 8.310 nan 0.000 0.514 5837 G N 1.503 110.316 108.800 0.021 0.000 2.375 5837 G HA2 0.518 4.478 3.960 -0.000 0.000 0.663 5837 G HA3 0.518 4.478 3.960 -0.000 0.000 0.663 5837 G C -0.115 174.796 174.900 0.018 0.000 1.391 5837 G CA -0.011 45.101 45.100 0.020 0.000 0.949 5837 G HN 2.128 nan 8.290 nan 0.000 0.646 5838 A N -0.627 122.201 122.820 0.014 0.000 5.949 5838 A HA 0.376 4.696 4.320 -0.000 0.000 0.275 5838 A C 1.158 178.746 177.584 0.008 0.000 2.055 5838 A CA 1.932 53.975 52.037 0.010 0.000 0.713 5838 A CB -1.612 17.396 19.000 0.013 0.000 1.146 5838 A HN 2.691 nan 8.150 nan 0.000 0.370 5839 S N -2.944 112.759 115.700 0.005 0.000 2.806 5839 S HA 0.639 5.109 4.470 -0.000 0.000 0.315 5839 S C 1.073 175.675 174.600 0.003 0.000 1.127 5839 S CA 0.218 58.419 58.200 0.002 0.000 0.918 5839 S CB 1.252 64.451 63.200 -0.001 0.000 1.240 5839 S HN 1.906 nan 8.310 nan 0.000 0.552 5840 I N 1.870 122.438 120.570 -0.002 0.000 2.493 5840 I HA -0.027 4.143 4.170 -0.000 0.000 0.254 5840 I C 1.283 177.400 176.117 0.000 0.000 1.160 5840 I CA 1.685 62.984 61.300 -0.002 0.000 1.445 5840 I CB -0.423 37.572 38.000 -0.009 0.000 1.086 5840 I HN 0.581 nan 8.210 nan 0.000 0.433 5841 D N 0.695 121.094 120.400 -0.001 0.000 2.178 5841 D HA -0.178 4.462 4.640 -0.000 0.000 0.201 5841 D C 1.559 177.861 176.300 0.003 0.000 0.980 5841 D CA 1.344 55.344 54.000 -0.000 0.000 0.842 5841 D CB -0.298 40.501 40.800 -0.002 0.000 0.948 5841 D HN 0.444 nan 8.370 nan 0.000 0.472 5842 D N -0.352 120.051 120.400 0.005 0.000 2.348 5842 D HA -0.029 4.611 4.640 -0.000 0.000 0.216 5842 D C 0.362 176.672 176.300 0.016 0.000 0.970 5842 D CA 0.499 54.505 54.000 0.009 0.000 0.889 5842 D CB -0.044 40.762 40.800 0.010 0.000 0.912 5842 D HN 0.019 nan 8.370 nan 0.000 0.524 5843 T N 1.324 115.887 114.554 0.016 0.000 2.939 5843 T HA 0.147 4.497 4.350 -0.000 0.000 0.319 5843 T C 0.318 175.032 174.700 0.024 0.000 1.082 5843 T CA 0.286 62.400 62.100 0.022 0.000 1.133 5843 T CB 0.423 69.300 68.868 0.016 0.000 1.019 5843 T HN 0.318 nan 8.240 nan 0.000 0.548 5844 E N 0.759 120.978 120.200 0.033 0.000 2.429 5844 E HA 0.555 4.905 4.350 -0.000 0.000 0.280 5844 E C -1.814 174.810 176.600 0.040 0.000 1.068 5844 E CA -1.082 55.339 56.400 0.034 0.000 0.837 5844 E CB 0.970 30.692 29.700 0.037 0.000 1.357 5844 E HN 0.349 nan 8.360 nan 0.000 0.455 5845 L N 1.226 122.470 121.223 0.036 0.000 2.317 5845 L HA 0.592 4.932 4.340 -0.000 0.000 0.281 5845 L C -1.533 175.366 176.870 0.047 0.000 1.024 5845 L CA -0.551 54.311 54.840 0.037 0.000 0.810 5845 L CB 1.344 43.419 42.059 0.026 0.000 1.240 5845 L HN 0.627 nan 8.230 nan 0.000 0.427 5846 I N 4.314 124.916 120.570 0.054 0.000 2.411 5846 I HA 0.328 4.498 4.170 -0.000 0.000 0.284 5846 I C -0.227 175.918 176.117 0.046 0.000 1.012 5846 I CA -0.476 60.866 61.300 0.069 0.000 1.119 5846 I CB 1.358 39.429 38.000 0.118 0.000 1.261 5846 I HN 0.419 nan 8.210 nan 0.000 0.448 5847 K N 4.799 125.221 120.400 0.036 0.000 2.199 5847 K HA 0.546 4.866 4.320 -0.000 0.000 0.226 5847 K C 0.426 177.040 176.600 0.023 0.000 1.237 5847 K CA 0.066 56.367 56.287 0.024 0.000 1.170 5847 K CB -0.335 32.173 32.500 0.013 0.000 1.418 5847 K HN 0.874 nan 8.250 nan 0.000 0.255 5848 G N -1.398 107.415 108.800 0.023 0.000 2.441 5848 G HA2 0.263 4.223 3.960 -0.000 0.000 0.225 5848 G HA3 0.263 4.223 3.960 -0.000 0.000 0.225 5848 G C -1.617 173.283 174.900 -0.001 0.000 1.200 5848 G CA -0.630 44.480 45.100 0.017 0.000 0.947 5848 G HN 0.064 nan 8.290 nan 0.000 0.484 5849 V N 0.381 120.285 119.914 -0.016 0.000 3.007 5849 V HA 0.746 4.866 4.120 -0.000 0.000 0.311 5849 V C -0.876 175.143 176.094 -0.125 0.000 1.120 5849 V CA -0.679 61.583 62.300 -0.063 0.000 0.980 5849 V CB 2.013 33.788 31.823 -0.079 0.000 1.033 5849 V HN 0.829 nan 8.190 nan 0.000 0.429 5850 L N 4.050 125.156 121.223 -0.194 0.000 2.345 5850 L HA 0.694 5.034 4.340 -0.000 0.000 0.274 5850 L C -1.204 175.506 176.870 -0.266 0.000 0.999 5850 L CA -0.368 54.239 54.840 -0.389 0.000 0.849 5850 L CB 1.460 43.228 42.059 -0.485 0.000 1.220 5850 L HN 0.487 nan 8.230 nan 0.000 0.422 5851 V N 3.323 123.097 119.914 -0.234 0.000 2.472 5851 V HA 0.255 4.375 4.120 -0.000 0.000 0.290 5851 V C -0.221 175.808 176.094 -0.108 0.000 1.037 5851 V CA -0.657 61.571 62.300 -0.121 0.000 0.908 5851 V CB 1.704 33.502 31.823 -0.040 0.000 0.985 5851 V HN 0.778 nan 8.190 nan 0.000 0.454 5852 D N 3.409 123.769 120.400 -0.066 0.000 2.896 5852 D HA 0.277 4.917 4.640 -0.000 0.000 0.240 5852 D C -0.143 176.154 176.300 -0.005 0.000 1.193 5852 D CA -0.258 53.719 54.000 -0.039 0.000 0.983 5852 D CB 0.202 40.983 40.800 -0.032 0.000 1.074 5852 D HN 0.500 nan 8.370 nan 0.000 0.496 5853 K N -0.087 120.319 120.400 0.010 0.000 2.439 5853 K HA 0.511 4.831 4.320 -0.000 0.000 0.260 5853 K C -0.633 175.987 176.600 0.034 0.000 1.032 5853 K CA -0.919 55.386 56.287 0.031 0.000 0.882 5853 K CB 2.545 35.081 32.500 0.059 0.000 1.420 5853 K HN 0.088 nan 8.250 nan 0.000 0.455 5854 E N 0.706 120.923 120.200 0.029 0.000 2.320 5854 E HA 0.288 4.638 4.350 -0.000 0.000 0.264 5854 E C -1.071 175.534 176.600 0.007 0.000 0.923 5854 E CA -0.841 55.574 56.400 0.024 0.000 0.796 5854 E CB 1.566 31.278 29.700 0.020 0.000 1.262 5854 E HN 0.288 nan 8.360 nan 0.000 0.428 5855 R N 1.824 122.326 120.500 0.002 0.000 2.404 5855 R HA 0.046 4.386 4.340 -0.000 0.000 0.315 5855 R C 1.089 177.378 176.300 -0.018 0.000 1.032 5855 R CA -0.225 55.862 56.100 -0.022 0.000 0.992 5855 R CB 0.472 30.762 30.300 -0.016 0.000 0.959 5855 R HN 0.376 nan 8.270 nan 0.000 0.428 5856 V N 1.773 121.668 119.914 -0.032 0.000 2.380 5856 V HA -0.203 3.917 4.120 -0.000 0.000 0.251 5856 V C 1.211 177.299 176.094 -0.010 0.000 1.063 5856 V CA 1.793 64.080 62.300 -0.023 0.000 1.055 5856 V CB -0.240 31.562 31.823 -0.036 0.000 0.657 5856 V HN 0.709 nan 8.190 nan 0.000 0.455 5857 S N -1.413 114.283 115.700 -0.007 0.000 2.501 5857 S HA 0.658 5.127 4.470 -0.000 0.000 0.301 5857 S C 0.872 175.479 174.600 0.011 0.000 1.096 5857 S CA -0.186 58.022 58.200 0.012 0.000 1.063 5857 S CB 1.894 65.111 63.200 0.029 0.000 1.042 5857 S HN 0.311 nan 8.310 nan 0.000 0.494 5858 A N 3.442 126.272 122.820 0.015 0.000 1.930 5858 A HA -0.023 4.297 4.320 -0.000 0.000 0.217 5858 A C 1.920 179.510 177.584 0.009 0.000 1.175 5858 A CA 1.023 53.066 52.037 0.010 0.000 0.627 5858 A CB -0.476 18.529 19.000 0.008 0.000 0.815 5858 A HN 0.806 nan 8.150 nan 0.000 0.443 5859 Q N -0.489 119.319 119.800 0.013 0.000 2.472 5859 Q HA 0.120 4.460 4.340 -0.000 0.000 0.208 5859 Q C 0.495 176.503 176.000 0.014 0.000 0.958 5859 Q CA 0.209 56.019 55.803 0.011 0.000 0.932 5859 Q CB -0.340 28.404 28.738 0.010 0.000 1.007 5859 Q HN 0.692 nan 8.270 nan 0.000 0.508 5860 M N 1.799 121.406 119.600 0.013 0.000 2.248 5860 M HA 0.092 4.572 4.480 -0.000 0.000 0.337 5860 M C -1.948 174.356 176.300 0.006 0.000 1.121 5860 M CA -1.428 53.876 55.300 0.008 0.000 1.155 5860 M CB -0.106 32.493 32.600 -0.003 0.000 1.514 5860 M HN -0.194 nan 8.290 nan 0.000 0.452 5861 P HA 0.003 nan 4.420 nan 0.000 0.267 5861 P C -0.328 176.976 177.300 0.007 0.000 1.200 5861 P CA 0.195 63.298 63.100 0.007 0.000 0.772 5861 P CB 0.468 32.173 31.700 0.007 0.000 0.855 5862 K N 1.268 121.673 120.400 0.008 0.000 2.393 5862 K HA 0.051 4.371 4.320 -0.000 0.000 0.193 5862 K C 0.089 176.697 176.600 0.014 0.000 1.026 5862 K CA 0.431 56.725 56.287 0.011 0.000 1.064 5862 K CB 0.184 32.689 32.500 0.009 0.000 0.833 5862 K HN 0.142 nan 8.250 nan 0.000 0.521 5863 K N 0.248 120.656 120.400 0.012 0.000 2.571 5863 K HA 0.228 4.548 4.320 -0.000 0.000 0.252 5863 K C -2.224 174.384 176.600 0.013 0.000 0.956 5863 K CA -0.657 55.638 56.287 0.013 0.000 0.822 5863 K CB 2.037 34.542 32.500 0.008 0.000 1.286 5863 K HN -0.117 nan 8.250 nan 0.000 0.439 5864 V N 3.894 123.819 119.914 0.018 0.000 2.638 5864 V HA 0.773 4.893 4.120 -0.000 0.000 0.306 5864 V C -1.257 174.849 176.094 0.020 0.000 1.052 5864 V CA -0.029 62.282 62.300 0.018 0.000 0.885 5864 V CB 1.984 33.819 31.823 0.021 0.000 0.999 5864 V HN 0.953 nan 8.190 nan 0.000 0.424 5865 T N 1.542 116.106 114.554 0.016 0.000 2.855 5865 T HA 0.515 4.865 4.350 -0.000 0.000 0.281 5865 T C 0.029 174.739 174.700 0.016 0.000 1.007 5865 T CA 0.176 62.285 62.100 0.015 0.000 1.009 5865 T CB 1.258 70.131 68.868 0.010 0.000 0.983 5865 T HN 1.076 nan 8.240 nan 0.000 0.455 5866 D N 0.675 121.085 120.400 0.016 0.000 2.689 5866 D HA -0.156 4.484 4.640 -0.000 0.000 0.237 5866 D C 0.396 176.709 176.300 0.022 0.000 1.148 5866 D CA 0.875 54.885 54.000 0.017 0.000 0.656 5866 D CB -1.216 39.592 40.800 0.013 0.000 1.050 5866 D HN 1.121 nan 8.370 nan 0.000 0.426 5867 A N 1.323 124.160 122.820 0.028 0.000 2.498 5867 A HA 0.369 4.689 4.320 -0.000 0.000 0.239 5867 A C 0.536 178.143 177.584 0.038 0.000 1.068 5867 A CA 0.231 52.289 52.037 0.035 0.000 0.766 5867 A CB 0.578 19.605 19.000 0.046 0.000 1.003 5867 A HN 0.162 nan 8.150 nan 0.000 0.497 5868 K N 2.488 122.911 120.400 0.038 0.000 2.389 5868 K HA 0.417 4.737 4.320 -0.000 0.000 0.261 5868 K C -1.253 175.380 176.600 0.054 0.000 1.014 5868 K CA -0.212 56.100 56.287 0.040 0.000 0.920 5868 K CB 1.059 33.578 32.500 0.031 0.000 1.149 5868 K HN 0.537 nan 8.250 nan 0.000 0.444 5869 I N 1.932 122.545 120.570 0.072 0.000 2.365 5869 I HA 0.299 4.469 4.170 -0.000 0.000 0.291 5869 I C 0.354 176.533 176.117 0.102 0.000 1.004 5869 I CA -0.375 60.992 61.300 0.111 0.000 1.311 5869 I CB 1.582 39.676 38.000 0.156 0.000 1.401 5869 I HN 0.485 nan 8.210 nan 0.000 0.491 5870 A N 6.445 129.335 122.820 0.117 0.000 2.318 5870 A HA 0.806 5.126 4.320 -0.000 0.000 0.324 5870 A C -1.129 176.544 177.584 0.147 0.000 1.170 5870 A CA -0.516 51.581 52.037 0.099 0.000 0.810 5870 A CB 0.974 20.013 19.000 0.066 0.000 1.198 5870 A HN 0.600 nan 8.150 nan 0.000 0.484 5871 L N 3.648 124.936 121.223 0.109 0.000 2.324 5871 L HA 0.580 4.920 4.340 -0.000 0.000 0.274 5871 L C -1.213 175.701 176.870 0.073 0.000 1.012 5871 L CA -0.011 54.895 54.840 0.110 0.000 0.859 5871 L CB 0.518 42.611 42.059 0.057 0.000 1.224 5871 L HN 0.646 nan 8.230 nan 0.000 0.429 5872 L N 4.215 125.487 121.223 0.082 0.000 2.334 5872 L HA 0.533 4.873 4.340 -0.000 0.000 0.276 5872 L C 0.804 177.705 176.870 0.052 0.000 1.014 5872 L CA -0.464 54.409 54.840 0.054 0.000 0.815 5872 L CB 1.834 43.921 42.059 0.046 0.000 1.268 5872 L HN 0.600 nan 8.230 nan 0.000 0.428 5873 N N 0.529 119.250 118.700 0.035 0.000 2.397 5873 N HA -0.022 4.718 4.740 -0.000 0.000 0.190 5873 N C 0.250 175.773 175.510 0.023 0.000 1.099 5873 N CA -0.159 52.908 53.050 0.029 0.000 0.876 5873 N CB 0.593 39.092 38.487 0.021 0.000 1.143 5873 N HN 0.580 nan 8.380 nan 0.000 0.468 5874 C N 2.492 121.804 119.300 0.021 0.000 2.644 5874 C HA 0.655 5.115 4.460 -0.000 0.000 0.417 5874 C C 1.003 176.003 174.990 0.016 0.000 1.304 5874 C CA -0.712 58.316 59.018 0.016 0.000 2.035 5874 C CB -0.813 26.936 27.740 0.016 0.000 2.673 5874 C HN 0.430 nan 8.230 nan 0.000 0.602 5875 A N 6.615 129.442 122.820 0.011 0.000 2.462 5875 A HA 0.454 4.774 4.320 -0.000 0.000 0.243 5875 A C 0.252 177.840 177.584 0.006 0.000 1.076 5875 A CA -0.128 51.913 52.037 0.007 0.000 0.773 5875 A CB 0.058 19.060 19.000 0.002 0.000 1.010 5875 A HN 0.799 nan 8.150 nan 0.000 0.493 5876 I N 3.271 123.843 120.570 0.003 0.000 2.234 5876 I HA 0.171 4.341 4.170 -0.000 0.000 0.287 5876 I C 0.618 176.734 176.117 -0.001 0.000 1.131 5876 I CA 0.431 61.734 61.300 0.005 0.000 1.335 5876 I CB -1.471 36.533 38.000 0.006 0.000 1.511 5876 I HN 0.887 nan 8.210 nan 0.000 0.588 5877 E N 3.750 123.951 120.200 0.002 0.000 2.431 5877 E HA 0.517 4.867 4.350 -0.000 0.000 0.268 5877 E C -0.668 175.937 176.600 0.008 0.000 0.953 5877 E CA -1.012 55.387 56.400 -0.001 0.000 0.810 5877 E CB 1.972 31.668 29.700 -0.006 0.000 1.369 5877 E HN -0.038 nan 8.360 nan 0.000 0.440 5878 I N 2.406 122.982 120.570 0.009 0.000 2.483 5878 I HA 0.081 4.251 4.170 -0.000 0.000 0.291 5878 I C 0.384 176.509 176.117 0.013 0.000 1.112 5878 I CA -0.154 61.155 61.300 0.016 0.000 1.350 5878 I CB -0.510 37.502 38.000 0.018 0.000 1.419 5878 I HN 0.411 nan 8.210 nan 0.000 0.523 5879 K N 5.939 126.348 120.400 0.015 0.000 2.414 5879 K HA 0.162 4.482 4.320 -0.000 0.000 0.272 5879 K C 0.265 176.873 176.600 0.014 0.000 0.993 5879 K CA -0.113 56.181 56.287 0.013 0.000 0.964 5879 K CB 1.084 33.592 32.500 0.014 0.000 0.925 5879 K HN 0.425 nan 8.250 nan 0.000 0.487 5880 E N 0.943 121.148 120.200 0.009 0.000 2.288 5880 E HA 0.168 4.518 4.350 -0.000 0.000 0.268 5880 E C -0.423 176.181 176.600 0.008 0.000 0.885 5880 E CA -0.613 55.792 56.400 0.008 0.000 0.767 5880 E CB 1.769 31.471 29.700 0.002 0.000 1.220 5880 E HN 0.622 nan 8.360 nan 0.000 0.427 5881 T N -0.286 114.273 114.554 0.008 0.000 2.903 5881 T HA 0.077 4.427 4.350 -0.000 0.000 0.314 5881 T C 1.071 175.774 174.700 0.004 0.000 1.078 5881 T CA -0.433 61.672 62.100 0.008 0.000 1.114 5881 T CB 0.959 69.833 68.868 0.009 0.000 0.987 5881 T HN 0.231 nan 8.240 nan 0.000 0.548 5882 E N 0.760 120.962 120.200 0.004 0.000 2.077 5882 E HA -0.055 4.295 4.350 -0.000 0.000 0.193 5882 E C 1.290 177.891 176.600 0.002 0.000 0.989 5882 E CA 0.977 57.378 56.400 0.003 0.000 0.800 5882 E CB -0.547 29.155 29.700 0.003 0.000 0.746 5882 E HN 0.805 nan 8.360 nan 0.000 0.452 5883 T N 1.596 116.151 114.554 0.002 0.000 2.919 5883 T HA -0.027 4.323 4.350 -0.000 0.000 0.302 5883 T C -0.188 174.512 174.700 -0.000 0.000 1.031 5883 T CA -0.564 61.537 62.100 0.002 0.000 1.127 5883 T CB 0.586 69.456 68.868 0.003 0.000 0.952 5883 T HN -0.153 nan 8.240 nan 0.000 0.540 5884 D N 2.516 122.915 120.400 -0.002 0.000 2.458 5884 D HA 0.427 5.067 4.640 -0.000 0.000 0.243 5884 D C -0.416 175.881 176.300 -0.006 0.000 1.146 5884 D CA 0.170 54.167 54.000 -0.005 0.000 0.877 5884 D CB 0.520 41.316 40.800 -0.006 0.000 1.176 5884 D HN 0.759 nan 8.370 nan 0.000 0.461 5885 A N 3.431 126.246 122.820 -0.010 0.000 2.556 5885 A HA 0.720 5.040 4.320 -0.000 0.000 0.294 5885 A C -0.895 176.674 177.584 -0.026 0.000 1.091 5885 A CA -0.693 51.336 52.037 -0.012 0.000 0.704 5885 A CB 1.699 20.696 19.000 -0.005 0.000 1.300 5885 A HN 0.588 nan 8.150 nan 0.000 0.406 5886 E N 0.616 120.795 120.200 -0.035 0.000 2.381 5886 E HA 0.455 4.805 4.350 -0.000 0.000 0.286 5886 E C -1.818 174.732 176.600 -0.083 0.000 0.960 5886 E CA -0.672 55.691 56.400 -0.062 0.000 0.793 5886 E CB 1.279 30.948 29.700 -0.052 0.000 1.225 5886 E HN 0.496 nan 8.360 nan 0.000 0.420 5887 I N 3.297 123.772 120.570 -0.160 0.000 2.496 5887 I HA 0.183 4.353 4.170 -0.000 0.000 0.285 5887 I C 0.172 176.190 176.117 -0.165 0.000 1.080 5887 I CA -0.030 61.123 61.300 -0.244 0.000 1.404 5887 I CB 0.553 38.167 38.000 -0.644 0.000 1.403 5887 I HN 0.294 nan 8.210 nan 0.000 0.539 5888 R N 7.357 127.809 120.500 -0.079 0.000 2.423 5888 R HA 0.443 4.783 4.340 -0.000 0.000 0.293 5888 R C -0.625 175.682 176.300 0.012 0.000 1.196 5888 R CA -0.570 55.512 56.100 -0.030 0.000 1.262 5888 R CB 0.205 30.503 30.300 -0.004 0.000 1.116 5888 R HN 0.554 nan 8.270 nan 0.000 0.566 5889 I N 1.897 122.463 120.570 -0.007 0.000 2.588 5889 I HA -0.001 4.169 4.170 -0.000 0.000 0.283 5889 I C 1.439 177.585 176.117 0.048 0.000 1.119 5889 I CA 0.562 61.896 61.300 0.058 0.000 1.419 5889 I CB 1.056 39.080 38.000 0.040 0.000 1.394 5889 I HN 0.524 nan 8.210 nan 0.000 0.562 5890 T N -0.752 113.842 114.554 0.066 0.000 3.087 5890 T HA 0.272 4.622 4.350 -0.000 0.000 0.283 5890 T C 0.071 174.796 174.700 0.042 0.000 0.956 5890 T CA -0.328 61.798 62.100 0.044 0.000 0.894 5890 T CB 0.304 69.196 68.868 0.039 0.000 1.160 5890 T HN 0.450 nan 8.240 nan 0.000 0.532 5891 D N 1.373 121.806 120.400 0.054 0.000 2.857 5891 D HA 0.322 4.962 4.640 -0.000 0.000 0.227 5891 D C -2.326 174.005 176.300 0.051 0.000 1.192 5891 D CA -1.511 52.515 54.000 0.043 0.000 0.857 5891 D CB 2.768 43.589 40.800 0.035 0.000 1.645 5891 D HN -0.235 nan 8.370 nan 0.000 0.482 5892 P HA -0.120 nan 4.420 nan 0.000 0.218 5892 P C 1.157 178.481 177.300 0.040 0.000 1.148 5892 P CA 1.067 64.189 63.100 0.037 0.000 0.822 5892 P CB 0.291 32.006 31.700 0.025 0.000 0.784 5893 A N -0.014 122.825 122.820 0.030 0.000 1.978 5893 A HA -0.236 4.084 4.320 -0.000 0.000 0.220 5893 A C 2.069 179.666 177.584 0.023 0.000 1.170 5893 A CA 1.653 53.701 52.037 0.018 0.000 0.636 5893 A CB -0.950 18.052 19.000 0.003 0.000 0.810 5893 A HN 0.195 nan 8.150 nan 0.000 0.448 5894 K N -0.455 119.981 120.400 0.060 0.000 2.155 5894 K HA 0.069 4.389 4.320 -0.000 0.000 0.203 5894 K C 1.687 178.429 176.600 0.237 0.000 1.052 5894 K CA 0.888 57.250 56.287 0.125 0.000 0.948 5894 K CB -0.310 32.343 32.500 0.255 0.000 0.728 5894 K HN 0.476 nan 8.250 nan 0.000 0.448 5895 L N 0.411 121.730 121.223 0.160 0.000 2.127 5895 L HA -0.213 4.127 4.340 -0.000 0.000 0.211 5895 L C 2.384 179.328 176.870 0.125 0.000 1.089 5895 L CA 0.949 55.872 54.840 0.139 0.000 0.757 5895 L CB -0.310 41.795 42.059 0.077 0.000 0.899 5895 L HN 0.257 nan 8.230 nan 0.000 0.434 5896 M N -1.404 118.246 119.600 0.083 0.000 2.357 5896 M HA -0.074 4.406 4.480 -0.000 0.000 0.266 5896 M C 2.190 178.508 176.300 0.031 0.000 1.095 5896 M CA 1.049 56.380 55.300 0.052 0.000 1.156 5896 M CB -0.952 31.664 32.600 0.026 0.000 1.365 5896 M HN 0.189 nan 8.290 nan 0.000 0.447 5897 E N 0.665 120.857 120.200 -0.013 0.000 2.070 5897 E HA -0.198 4.152 4.350 -0.000 0.000 0.197 5897 E C 1.937 178.435 176.600 -0.169 0.000 1.004 5897 E CA 1.708 58.023 56.400 -0.142 0.000 0.805 5897 E CB -0.195 29.336 29.700 -0.282 0.000 0.744 5897 E HN 0.455 nan 8.360 nan 0.000 0.451 5898 F N 0.400 120.354 119.950 0.007 0.000 2.206 5898 F HA -0.017 4.510 4.527 0.000 0.000 0.298 5898 F C 2.515 178.321 175.800 0.010 0.000 1.090 5898 F CA 0.572 58.577 58.000 0.007 0.000 1.323 5898 F CB -0.194 38.809 39.000 0.006 0.000 1.028 5898 F HN -0.016 nan 8.300 nan 0.000 0.492 5899 I N -0.029 120.655 120.570 0.190 0.000 2.163 5899 I HA -0.268 3.902 4.170 -0.000 0.000 0.243 5899 I C 2.288 178.451 176.117 0.076 0.000 1.085 5899 I CA 1.303 62.671 61.300 0.113 0.000 1.347 5899 I CB -0.391 37.660 38.000 0.084 0.000 1.044 5899 I HN 0.109 nan 8.210 nan 0.000 0.408 5900 E N 0.199 120.429 120.200 0.050 0.000 2.150 5900 E HA -0.252 4.098 4.350 -0.000 0.000 0.193 5900 E C 2.021 178.634 176.600 0.021 0.000 0.985 5900 E CA 0.949 57.364 56.400 0.026 0.000 0.814 5900 E CB -0.189 29.513 29.700 0.003 0.000 0.752 5900 E HN 0.447 nan 8.360 nan 0.000 0.466 5901 Q N 1.347 121.159 119.800 0.020 0.000 2.079 5901 Q HA -0.133 4.207 4.340 -0.000 0.000 0.200 5901 Q C 1.673 177.703 176.000 0.050 0.000 0.974 5901 Q CA 1.576 57.390 55.803 0.019 0.000 0.840 5901 Q CB 0.018 28.759 28.738 0.004 0.000 0.898 5901 Q HN 0.287 nan 8.270 nan 0.000 0.430 5902 E N -0.407 119.839 120.200 0.076 0.000 2.152 5902 E HA -0.143 4.207 4.350 -0.000 0.000 0.192 5902 E C 1.844 178.481 176.600 0.061 0.000 0.983 5902 E CA 0.809 57.252 56.400 0.072 0.000 0.818 5902 E CB 0.095 29.842 29.700 0.079 0.000 0.758 5902 E HN 0.347 nan 8.360 nan 0.000 0.467 5903 E N 1.051 121.287 120.200 0.060 0.000 2.072 5903 E HA -0.177 4.173 4.350 -0.000 0.000 0.191 5903 E C 1.909 178.541 176.600 0.052 0.000 0.985 5903 E CA 0.848 57.287 56.400 0.065 0.000 0.801 5903 E CB -0.113 29.621 29.700 0.058 0.000 0.750 5903 E HN 0.164 nan 8.360 nan 0.000 0.452 5904 K N 0.653 121.073 120.400 0.034 0.000 2.026 5904 K HA -0.110 4.210 4.320 -0.000 0.000 0.208 5904 K C 2.282 178.898 176.600 0.026 0.000 1.048 5904 K CA 1.363 57.661 56.287 0.020 0.000 0.929 5904 K CB -0.162 32.344 32.500 0.009 0.000 0.713 5904 K HN 0.040 nan 8.250 nan 0.000 0.439 5905 M N 0.939 120.559 119.600 0.033 0.000 2.108 5905 M HA -0.191 4.289 4.480 -0.000 0.000 0.261 5905 M C 2.085 178.410 176.300 0.042 0.000 1.066 5905 M CA 1.472 56.792 55.300 0.035 0.000 1.107 5905 M CB -0.068 32.555 32.600 0.038 0.000 1.356 5905 M HN 0.357 nan 8.290 nan 0.000 0.406 5906 L N 0.095 121.352 121.223 0.056 0.000 2.027 5906 L HA -0.223 4.117 4.340 -0.000 0.000 0.206 5906 L C 2.249 179.176 176.870 0.096 0.000 1.074 5906 L CA 1.546 56.432 54.840 0.077 0.000 0.745 5906 L CB -0.303 41.813 42.059 0.096 0.000 0.898 5906 L HN 0.279 nan 8.230 nan 0.000 0.433 5907 K N -0.349 120.099 120.400 0.080 0.000 2.097 5907 K HA -0.176 4.144 4.320 -0.000 0.000 0.206 5907 K C 1.657 178.270 176.600 0.022 0.000 1.049 5907 K CA 1.576 57.886 56.287 0.038 0.000 0.933 5907 K CB -0.162 32.329 32.500 -0.015 0.000 0.717 5907 K HN 0.356 nan 8.250 nan 0.000 0.442 5908 D N 0.529 120.942 120.400 0.022 0.000 2.144 5908 D HA -0.127 4.513 4.640 -0.000 0.000 0.199 5908 D C 1.937 178.250 176.300 0.022 0.000 0.984 5908 D CA 0.996 55.005 54.000 0.015 0.000 0.834 5908 D CB 0.003 40.812 40.800 0.014 0.000 0.955 5908 D HN 0.069 nan 8.370 nan 0.000 0.465 5909 M N 0.376 119.995 119.600 0.032 0.000 2.084 5909 M HA -0.139 4.341 4.480 -0.000 0.000 0.259 5909 M C 2.455 178.778 176.300 0.037 0.000 1.072 5909 M CA 0.947 56.267 55.300 0.034 0.000 1.107 5909 M CB -1.094 31.529 32.600 0.039 0.000 1.299 5909 M HN -0.071 nan 8.290 nan 0.000 0.413 5910 V N 0.597 120.544 119.914 0.055 0.000 2.287 5910 V HA -0.261 3.859 4.120 -0.000 0.000 0.248 5910 V C 2.734 178.851 176.094 0.038 0.000 1.053 5910 V CA 1.948 64.287 62.300 0.064 0.000 1.027 5910 V CB -1.462 30.435 31.823 0.124 0.000 0.646 5910 V HN 0.544 nan 8.190 nan 0.000 0.447 5911 A N -0.156 122.678 122.820 0.022 0.000 1.940 5911 A HA -0.286 4.034 4.320 -0.000 0.000 0.219 5911 A C 2.192 179.781 177.584 0.009 0.000 1.176 5911 A CA 2.187 54.227 52.037 0.005 0.000 0.631 5911 A CB -0.528 18.468 19.000 -0.007 0.000 0.814 5911 A HN 0.570 nan 8.150 nan 0.000 0.446 5912 E N 0.267 120.476 120.200 0.014 0.000 2.077 5912 E HA -0.129 4.221 4.350 -0.000 0.000 0.193 5912 E C 1.696 178.305 176.600 0.017 0.000 0.989 5912 E CA 1.380 57.788 56.400 0.014 0.000 0.800 5912 E CB -0.393 29.316 29.700 0.016 0.000 0.746 5912 E HN 0.657 nan 8.360 nan 0.000 0.452 5913 I N 0.614 121.197 120.570 0.021 0.000 2.142 5913 I HA -0.277 3.893 4.170 -0.000 0.000 0.240 5913 I C 2.618 178.747 176.117 0.020 0.000 1.078 5913 I CA 1.284 62.598 61.300 0.022 0.000 1.343 5913 I CB -0.444 37.572 38.000 0.025 0.000 1.046 5913 I HN 0.102 nan 8.210 nan 0.000 0.405 5914 K N 1.679 122.090 120.400 0.018 0.000 2.063 5914 K HA -0.197 4.123 4.320 -0.000 0.000 0.208 5914 K C 2.126 178.733 176.600 0.011 0.000 1.048 5914 K CA 1.807 58.103 56.287 0.015 0.000 0.928 5914 K CB -0.239 32.268 32.500 0.011 0.000 0.713 5914 K HN 0.317 nan 8.250 nan 0.000 0.442 5915 A N 0.507 123.332 122.820 0.010 0.000 2.024 5915 A HA -0.149 4.171 4.320 -0.000 0.000 0.220 5915 A C 2.239 179.829 177.584 0.010 0.000 1.164 5915 A CA 2.165 54.207 52.037 0.008 0.000 0.643 5915 A CB -0.653 18.351 19.000 0.007 0.000 0.806 5915 A HN 0.440 nan 8.150 nan 0.000 0.451 5916 S N -1.968 113.740 115.700 0.014 0.000 2.447 5916 S HA 0.216 4.686 4.470 -0.000 0.000 0.233 5916 S C 1.483 176.093 174.600 0.016 0.000 1.006 5916 S CA 1.626 59.835 58.200 0.016 0.000 0.957 5916 S CB -0.321 62.890 63.200 0.019 0.000 0.773 5916 S HN 1.818 nan 8.310 nan 0.000 0.507 5917 G N -0.013 108.796 108.800 0.015 0.000 2.176 5917 G HA2 -0.131 3.829 3.960 -0.000 0.000 0.232 5917 G HA3 -0.131 3.829 3.960 -0.000 0.000 0.232 5917 G C 0.152 175.063 174.900 0.019 0.000 0.986 5917 G CA 0.111 45.220 45.100 0.016 0.000 0.643 5917 G HN 1.019 nan 8.290 nan 0.000 0.522 5918 A N 0.049 122.882 122.820 0.022 0.000 2.477 5918 A HA 0.600 4.920 4.320 -0.000 0.000 0.246 5918 A C 1.080 178.676 177.584 0.020 0.000 1.078 5918 A CA 0.776 52.829 52.037 0.026 0.000 0.770 5918 A CB 0.183 19.201 19.000 0.030 0.000 1.011 5918 A HN 0.378 nan 8.150 nan 0.000 0.494 5919 N N 0.486 119.199 118.700 0.021 0.000 2.159 5919 N HA 0.167 4.907 4.740 -0.000 0.000 0.217 5919 N C -0.881 174.631 175.510 0.002 0.000 1.223 5919 N CA 0.369 53.427 53.050 0.013 0.000 0.896 5919 N CB 1.238 39.734 38.487 0.016 0.000 1.064 5919 N HN 0.360 nan 8.380 nan 0.000 0.518 5920 V N 1.889 121.807 119.914 0.008 0.000 2.709 5920 V HA 0.510 4.630 4.120 -0.000 0.000 0.308 5920 V C -1.076 175.007 176.094 -0.019 0.000 1.062 5920 V CA -0.908 61.378 62.300 -0.024 0.000 0.901 5920 V CB 2.696 34.540 31.823 0.036 0.000 1.003 5920 V HN -0.033 nan 8.190 nan 0.000 0.425 5921 L N 4.563 125.708 121.223 -0.130 0.000 2.470 5921 L HA 0.725 5.065 4.340 -0.000 0.000 0.268 5921 L C -1.727 175.000 176.870 -0.238 0.000 0.964 5921 L CA -0.045 54.750 54.840 -0.075 0.000 0.839 5921 L CB 1.766 43.801 42.059 -0.040 0.000 1.276 5921 L HN 0.476 nan 8.230 nan 0.000 0.403 5922 F N 4.866 124.819 119.950 0.006 0.000 2.388 5922 F HA 0.524 5.051 4.527 -0.000 0.000 0.358 5922 F C 0.208 176.008 175.800 0.001 0.000 1.122 5922 F CA -0.240 57.761 58.000 0.002 0.000 1.056 5922 F CB 1.434 40.434 39.000 0.001 0.000 1.155 5922 F HN 0.575 nan 8.300 nan 0.000 0.461 5923 C N 4.698 124.069 119.300 0.118 0.000 2.376 5923 C HA 0.286 4.746 4.460 -0.000 0.000 0.335 5923 C C 1.503 176.541 174.990 0.079 0.000 1.229 5923 C CA -0.377 58.686 59.018 0.075 0.000 1.867 5923 C CB 1.181 28.935 27.740 0.024 0.000 2.319 5923 C HN 0.946 nan 8.230 nan 0.000 0.515 5924 Q N 2.837 122.672 119.800 0.059 0.000 2.062 5924 Q HA 0.007 4.347 4.340 -0.000 0.000 0.196 5924 Q C 1.106 177.124 176.000 0.030 0.000 0.967 5924 Q CA 1.482 57.313 55.803 0.046 0.000 0.832 5924 Q CB 0.132 28.890 28.738 0.033 0.000 0.899 5924 Q HN 0.696 nan 8.270 nan 0.000 0.442 5925 K N -0.296 120.116 120.400 0.021 0.000 2.894 5925 K HA 0.302 4.622 4.320 -0.000 0.000 0.325 5925 K C 0.583 177.185 176.600 0.004 0.000 0.984 5925 K CA 0.210 56.504 56.287 0.010 0.000 1.266 5925 K CB -0.893 31.610 32.500 0.006 0.000 1.423 5925 K HN 0.169 nan 8.250 nan 0.000 0.614 5926 G N 0.231 109.028 108.800 -0.005 0.000 2.504 5926 G HA2 0.552 4.512 3.960 -0.000 0.000 0.288 5926 G HA3 0.552 4.512 3.960 -0.000 0.000 0.288 5926 G C -0.557 174.328 174.900 -0.025 0.000 1.182 5926 G CA -0.582 44.509 45.100 -0.016 0.000 0.894 5926 G HN 0.300 nan 8.290 nan 0.000 0.521 5927 I N 1.132 121.678 120.570 -0.040 0.000 2.439 5927 I HA 0.148 4.318 4.170 -0.000 0.000 0.283 5927 I C -0.343 175.723 176.117 -0.085 0.000 1.023 5927 I CA -0.738 60.527 61.300 -0.059 0.000 1.100 5927 I CB 1.803 39.766 38.000 -0.062 0.000 1.238 5927 I HN 0.450 nan 8.210 nan 0.000 0.445 5928 D N 5.009 125.351 120.400 -0.097 0.000 2.449 5928 D HA -0.082 4.558 4.640 -0.000 0.000 0.236 5928 D C 0.638 176.811 176.300 -0.213 0.000 1.149 5928 D CA 0.279 54.201 54.000 -0.130 0.000 0.878 5928 D CB 1.277 42.005 40.800 -0.120 0.000 1.198 5928 D HN 0.476 nan 8.370 nan 0.000 0.446 5929 D N 2.476 122.726 120.400 -0.250 0.000 2.133 5929 D HA -0.183 4.457 4.640 -0.000 0.000 0.195 5929 D C 1.757 177.560 176.300 -0.828 0.000 0.997 5929 D CA 0.689 54.434 54.000 -0.424 0.000 0.840 5929 D CB -0.104 40.505 40.800 -0.319 0.000 0.947 5929 D HN 0.339 nan 8.370 nan 0.000 0.452 5930 L N 0.807 121.648 121.223 -0.637 0.000 2.042 5930 L HA -0.110 4.230 4.340 -0.000 0.000 0.210 5930 L C 2.134 178.533 176.870 -0.785 0.000 1.076 5930 L CA 1.753 56.165 54.840 -0.713 0.000 0.749 5930 L CB -0.753 41.040 42.059 -0.443 0.000 0.893 5930 L HN -0.010 nan 8.230 nan 0.000 0.432 5931 A N -1.253 121.281 122.820 -0.477 0.000 1.902 5931 A HA -0.264 4.056 4.320 -0.000 0.000 0.217 5931 A C 2.162 179.628 177.584 -0.195 0.000 1.181 5931 A CA 1.797 53.667 52.037 -0.278 0.000 0.623 5931 A CB -0.554 18.362 19.000 -0.140 0.000 0.818 5931 A HN 0.656 nan 8.150 nan 0.000 0.443 5932 Q N -1.000 118.660 119.800 -0.234 0.000 2.096 5932 Q HA -0.227 4.113 4.340 -0.000 0.000 0.204 5932 Q C 1.913 177.911 176.000 -0.003 0.000 0.982 5932 Q CA 1.837 57.568 55.803 -0.119 0.000 0.850 5932 Q CB -0.412 28.250 28.738 -0.126 0.000 0.901 5932 Q HN 0.897 nan 8.270 nan 0.000 0.422 5933 H N -1.105 117.886 119.070 -0.130 0.000 2.321 5933 H HA -0.160 4.396 4.556 -0.000 0.000 0.300 5933 H C 1.722 177.102 175.328 0.086 0.000 1.087 5933 H CA 1.102 57.108 56.048 -0.069 0.000 1.319 5933 H CB 0.067 29.741 29.762 -0.146 0.000 1.379 5933 H HN 0.252 nan 8.280 nan 0.000 0.501 5934 Y N 0.776 121.144 120.300 0.114 0.000 2.200 5934 Y HA -0.137 4.413 4.550 0.000 0.000 0.290 5934 Y C 2.549 178.468 175.900 0.032 0.000 1.137 5934 Y CA 0.491 58.624 58.100 0.056 0.000 1.163 5934 Y CB -0.884 37.596 38.460 0.034 0.000 0.988 5934 Y HN 0.140 nan 8.280 nan 0.000 0.518 5935 L N -0.525 120.802 121.223 0.174 0.000 2.042 5935 L HA -0.268 4.072 4.340 -0.000 0.000 0.210 5935 L C 2.662 179.572 176.870 0.066 0.000 1.076 5935 L CA 1.385 56.276 54.840 0.084 0.000 0.749 5935 L CB -0.870 41.206 42.059 0.030 0.000 0.893 5935 L HN 0.194 nan 8.230 nan 0.000 0.432 5936 A N -0.045 122.822 122.820 0.078 0.000 1.898 5936 A HA -0.208 4.112 4.320 -0.000 0.000 0.216 5936 A C 2.310 179.931 177.584 0.062 0.000 1.181 5936 A CA 1.622 53.695 52.037 0.061 0.000 0.620 5936 A CB -0.347 18.695 19.000 0.070 0.000 0.819 5936 A HN 0.311 nan 8.150 nan 0.000 0.442 5937 K N -0.289 120.167 120.400 0.093 0.000 2.209 5937 K HA -0.087 4.233 4.320 -0.000 0.000 0.204 5937 K C 1.209 177.837 176.600 0.047 0.000 1.048 5937 K CA 1.175 57.505 56.287 0.072 0.000 0.940 5937 K CB -0.009 32.551 32.500 0.100 0.000 0.729 5937 K HN 0.400 nan 8.250 nan 0.000 0.451 5938 E N -0.305 119.927 120.200 0.053 0.000 2.489 5938 E HA 0.008 4.358 4.350 -0.000 0.000 0.193 5938 E C 0.848 177.462 176.600 0.024 0.000 1.057 5938 E CA 0.421 56.840 56.400 0.032 0.000 0.866 5938 E CB 0.479 30.201 29.700 0.036 0.000 0.916 5938 E HN 0.456 nan 8.360 nan 0.000 0.500 5939 G N 2.125 110.939 108.800 0.025 0.000 2.225 5939 G HA2 -0.303 3.657 3.960 -0.000 0.000 0.267 5939 G HA3 -0.303 3.657 3.960 -0.000 0.000 0.267 5939 G C 0.306 175.212 174.900 0.011 0.000 1.024 5939 G CA 0.302 45.411 45.100 0.016 0.000 0.784 5939 G HN 0.286 nan 8.290 nan 0.000 0.507 5940 I N 0.241 120.818 120.570 0.012 0.000 2.395 5940 I HA 0.340 4.510 4.170 -0.000 0.000 0.289 5940 I C 0.780 176.884 176.117 -0.020 0.000 1.023 5940 I CA -0.872 60.428 61.300 -0.001 0.000 1.350 5940 I CB 1.558 39.560 38.000 0.004 0.000 1.409 5940 I HN -0.125 nan 8.210 nan 0.000 0.507 5941 V N 5.989 125.877 119.914 -0.043 0.000 2.509 5941 V HA 0.668 4.788 4.120 -0.000 0.000 0.284 5941 V C 0.347 176.351 176.094 -0.151 0.000 1.047 5941 V CA -0.279 61.972 62.300 -0.081 0.000 0.952 5941 V CB 1.270 33.047 31.823 -0.077 0.000 0.988 5941 V HN 0.872 nan 8.190 nan 0.000 0.469 5942 A N 4.007 126.727 122.820 -0.168 0.000 2.454 5942 A HA 0.986 5.306 4.320 -0.000 0.000 0.302 5942 A C -0.545 176.883 177.584 -0.260 0.000 1.079 5942 A CA -0.357 51.546 52.037 -0.222 0.000 0.731 5942 A CB 1.949 20.875 19.000 -0.124 0.000 1.299 5942 A HN 1.354 nan 8.150 nan 0.000 0.413 5943 A N 1.479 124.097 122.820 -0.336 0.000 2.393 5943 A HA 0.796 5.116 4.320 -0.000 0.000 0.306 5943 A C -0.121 177.414 177.584 -0.082 0.000 1.050 5943 A CA -0.647 51.259 52.037 -0.218 0.000 0.724 5943 A CB 1.010 19.825 19.000 -0.307 0.000 1.248 5943 A HN 1.258 nan 8.150 nan 0.000 0.424 5944 R N 1.474 121.956 120.500 -0.031 0.000 2.875 5944 R HA 0.735 5.075 4.340 -0.000 0.000 0.251 5944 R C -0.472 175.841 176.300 0.022 0.000 1.123 5944 R CA -0.808 55.289 56.100 -0.004 0.000 1.064 5944 R CB 0.491 30.778 30.300 -0.022 0.000 1.205 5944 R HN 0.489 nan 8.270 nan 0.000 0.503 5945 R N -0.551 119.960 120.500 0.019 0.000 3.405 5945 R HA -0.109 4.231 4.340 -0.000 0.000 0.258 5945 R C -0.669 175.652 176.300 0.035 0.000 1.030 5945 R CA 0.564 56.676 56.100 0.020 0.000 0.691 5945 R CB -2.546 27.760 30.300 0.010 0.000 1.093 5945 R HN 0.509 nan 8.270 nan 0.000 0.448 5946 V N 1.044 120.991 119.914 0.055 0.000 2.686 5946 V HA 0.085 4.205 4.120 -0.000 0.000 0.295 5946 V C 1.470 177.585 176.094 0.035 0.000 1.055 5946 V CA -0.308 62.031 62.300 0.066 0.000 1.050 5946 V CB 1.395 33.285 31.823 0.112 0.000 0.984 5946 V HN 0.175 nan 8.190 nan 0.000 0.482 5947 K N 3.366 123.779 120.400 0.022 0.000 2.414 5947 K HA 0.023 4.343 4.320 -0.000 0.000 0.272 5947 K C 1.346 177.948 176.600 0.004 0.000 0.993 5947 K CA -0.242 56.050 56.287 0.009 0.000 0.964 5947 K CB 0.365 32.866 32.500 0.001 0.000 0.925 5947 K HN 0.620 nan 8.250 nan 0.000 0.487 5948 K N 1.851 122.253 120.400 0.003 0.000 2.057 5948 K HA -0.119 4.201 4.320 -0.000 0.000 0.207 5948 K C 1.530 178.125 176.600 -0.008 0.000 1.049 5948 K CA 1.810 58.097 56.287 -0.000 0.000 0.931 5948 K CB -0.131 32.370 32.500 0.001 0.000 0.714 5948 K HN 0.600 nan 8.250 nan 0.000 0.440 5949 S N 1.516 117.210 115.700 -0.010 0.000 2.399 5949 S HA -0.115 4.355 4.470 -0.000 0.000 0.231 5949 S C 1.340 175.925 174.600 -0.026 0.000 1.022 5949 S CA 1.346 59.536 58.200 -0.016 0.000 0.983 5949 S CB -0.185 63.006 63.200 -0.014 0.000 0.803 5949 S HN 0.343 nan 8.310 nan 0.000 0.480 5950 D N 1.118 121.502 120.400 -0.027 0.000 2.144 5950 D HA 0.013 4.653 4.640 -0.000 0.000 0.200 5950 D C 1.865 178.125 176.300 -0.066 0.000 0.978 5950 D CA 0.724 54.697 54.000 -0.046 0.000 0.833 5950 D CB -0.188 40.591 40.800 -0.035 0.000 0.961 5950 D HN 0.242 nan 8.370 nan 0.000 0.470 5951 M N 0.541 120.116 119.600 -0.042 0.000 2.149 5951 M HA -0.118 4.362 4.480 -0.000 0.000 0.261 5951 M C 1.878 178.147 176.300 -0.052 0.000 1.064 5951 M CA 1.298 56.573 55.300 -0.042 0.000 1.102 5951 M CB -0.813 31.782 32.600 -0.008 0.000 1.369 5951 M HN 0.122 nan 8.290 nan 0.000 0.408 5952 E N -0.202 119.974 120.200 -0.040 0.000 2.107 5952 E HA -0.131 4.219 4.350 -0.000 0.000 0.191 5952 E C 2.069 178.640 176.600 -0.048 0.000 0.982 5952 E CA 0.785 57.163 56.400 -0.036 0.000 0.809 5952 E CB 0.016 29.701 29.700 -0.025 0.000 0.756 5952 E HN 0.492 nan 8.360 nan 0.000 0.459 5953 K N 0.574 120.939 120.400 -0.058 0.000 2.097 5953 K HA -0.070 4.250 4.320 -0.000 0.000 0.205 5953 K C 2.146 178.689 176.600 -0.095 0.000 1.050 5953 K CA 0.706 56.953 56.287 -0.066 0.000 0.938 5953 K CB -0.009 32.452 32.500 -0.065 0.000 0.718 5953 K HN 0.112 nan 8.250 nan 0.000 0.442 5954 L N 0.323 121.466 121.223 -0.134 0.000 2.093 5954 L HA -0.159 4.181 4.340 -0.000 0.000 0.208 5954 L C 2.525 179.309 176.870 -0.142 0.000 1.085 5954 L CA 0.920 55.638 54.840 -0.203 0.000 0.755 5954 L CB -0.477 41.382 42.059 -0.333 0.000 0.904 5954 L HN 0.194 nan 8.230 nan 0.000 0.435 5955 A N 0.224 122.989 122.820 -0.093 0.000 1.873 5955 A HA -0.205 4.115 4.320 -0.000 0.000 0.215 5955 A C 2.319 179.878 177.584 -0.042 0.000 1.186 5955 A CA 1.565 53.570 52.037 -0.054 0.000 0.616 5955 A CB -0.304 18.676 19.000 -0.035 0.000 0.823 5955 A HN 0.280 nan 8.150 nan 0.000 0.442 5956 K N -0.252 120.123 120.400 -0.042 0.000 2.009 5956 K HA -0.096 4.224 4.320 -0.000 0.000 0.210 5956 K C 2.388 178.970 176.600 -0.030 0.000 1.049 5956 K CA 1.279 57.548 56.287 -0.030 0.000 0.929 5956 K CB -0.371 32.111 32.500 -0.029 0.000 0.714 5956 K HN 0.435 nan 8.250 nan 0.000 0.440 5957 A N 0.891 123.683 122.820 -0.047 0.000 1.832 5957 A HA -0.142 4.178 4.320 -0.000 0.000 0.214 5957 A C 2.291 179.853 177.584 -0.036 0.000 1.200 5957 A CA 2.135 54.145 52.037 -0.044 0.000 0.610 5957 A CB -1.093 17.867 19.000 -0.067 0.000 0.842 5957 A HN 0.268 nan 8.150 nan 0.000 0.444 5958 T N -0.872 113.649 114.554 -0.055 0.000 2.951 5958 T HA 0.283 4.633 4.350 -0.000 0.000 0.268 5958 T C 1.321 176.013 174.700 -0.012 0.000 1.073 5958 T CA 1.464 63.542 62.100 -0.037 0.000 1.134 5958 T CB -0.355 68.478 68.868 -0.059 0.000 0.884 5958 T HN 1.637 nan 8.240 nan 0.000 0.479 5959 G N 1.420 110.211 108.800 -0.015 0.000 2.182 5959 G HA2 -0.010 3.950 3.960 -0.000 0.000 0.248 5959 G HA3 -0.010 3.950 3.960 -0.000 0.000 0.248 5959 G C 0.045 174.947 174.900 0.003 0.000 1.042 5959 G CA -0.132 44.968 45.100 -0.001 0.000 0.775 5959 G HN 0.876 nan 8.290 nan 0.000 0.501 5960 A N -0.424 122.393 122.820 -0.004 0.000 2.303 5960 A HA 0.758 5.078 4.320 -0.000 0.000 0.317 5960 A C 0.186 177.772 177.584 0.004 0.000 1.149 5960 A CA -0.233 51.809 52.037 0.008 0.000 0.822 5960 A CB 0.904 19.913 19.000 0.015 0.000 1.131 5960 A HN 0.719 nan 8.150 nan 0.000 0.493 5961 N N 1.509 120.216 118.700 0.012 0.000 2.425 5961 N HA 0.357 5.097 4.740 -0.000 0.000 0.268 5961 N C -0.806 174.713 175.510 0.014 0.000 0.991 5961 N CA -0.278 52.778 53.050 0.010 0.000 0.931 5961 N CB 1.168 39.661 38.487 0.011 0.000 1.130 5961 N HN 0.289 nan 8.380 nan 0.000 0.493 5962 V N 4.882 124.802 119.914 0.010 0.000 2.485 5962 V HA 0.133 4.253 4.120 -0.000 0.000 0.287 5962 V C 0.456 176.559 176.094 0.015 0.000 1.022 5962 V CA 0.005 62.313 62.300 0.014 0.000 1.067 5962 V CB -0.130 31.698 31.823 0.008 0.000 0.967 5962 V HN 0.529 nan 8.190 nan 0.000 0.479 5963 I N 4.795 125.376 120.570 0.019 0.000 2.530 5963 I HA 0.334 4.504 4.170 -0.000 0.000 0.297 5963 I C 1.280 177.408 176.117 0.017 0.000 1.011 5963 I CA -0.230 61.081 61.300 0.017 0.000 1.107 5963 I CB 2.023 40.034 38.000 0.019 0.000 1.285 5963 I HN 0.773 nan 8.210 nan 0.000 0.436 5964 T N 1.939 116.502 114.554 0.014 0.000 2.755 5964 T HA 0.036 4.386 4.350 -0.000 0.000 0.251 5964 T C 0.830 175.539 174.700 0.014 0.000 1.044 5964 T CA 0.415 62.523 62.100 0.013 0.000 1.154 5964 T CB -0.099 68.776 68.868 0.011 0.000 0.866 5964 T HN 0.441 nan 8.240 nan 0.000 0.416 5965 N N 0.841 119.549 118.700 0.013 0.000 2.438 5965 N HA 0.259 4.999 4.740 -0.000 0.000 0.282 5965 N C 0.665 176.184 175.510 0.015 0.000 1.037 5965 N CA -0.718 52.340 53.050 0.014 0.000 0.942 5965 N CB 1.369 39.863 38.487 0.012 0.000 1.136 5965 N HN 0.174 nan 8.380 nan 0.000 0.481 5966 I N 3.676 124.256 120.570 0.016 0.000 2.335 5966 I HA -0.216 3.954 4.170 -0.000 0.000 0.251 5966 I C 1.818 177.944 176.117 0.015 0.000 1.129 5966 I CA 1.460 62.770 61.300 0.017 0.000 1.402 5966 I CB 0.051 38.062 38.000 0.018 0.000 1.069 5966 I HN 0.489 nan 8.210 nan 0.000 0.424 5967 K N 0.347 120.755 120.400 0.013 0.000 2.152 5967 K HA -0.176 4.144 4.320 -0.000 0.000 0.206 5967 K C 1.629 178.236 176.600 0.011 0.000 1.048 5967 K CA 1.525 57.819 56.287 0.012 0.000 0.933 5967 K CB -0.573 31.934 32.500 0.011 0.000 0.721 5967 K HN 0.426 nan 8.250 nan 0.000 0.447 5968 D N 0.375 120.782 120.400 0.012 0.000 2.289 5968 D HA -0.042 4.598 4.640 -0.000 0.000 0.207 5968 D C 0.595 176.902 176.300 0.013 0.000 0.966 5968 D CA -0.059 53.948 54.000 0.011 0.000 0.868 5968 D CB -0.164 40.643 40.800 0.011 0.000 0.943 5968 D HN -0.021 nan 8.370 nan 0.000 0.514 5969 L N 1.339 122.570 121.223 0.015 0.000 2.559 5969 L HA 0.030 4.370 4.340 -0.000 0.000 0.282 5969 L C 0.377 177.256 176.870 0.015 0.000 1.232 5969 L CA 0.400 55.250 54.840 0.017 0.000 0.885 5969 L CB 0.273 42.344 42.059 0.019 0.000 1.131 5969 L HN -0.002 nan 8.230 nan 0.000 0.498 5970 S N 2.823 118.532 115.700 0.015 0.000 2.651 5970 S HA 0.761 5.231 4.470 -0.000 0.000 0.279 5970 S C 0.608 175.218 174.600 0.016 0.000 1.148 5970 S CA -0.389 57.819 58.200 0.014 0.000 0.837 5970 S CB 1.131 64.338 63.200 0.012 0.000 1.138 5970 S HN 0.838 nan 8.310 nan 0.000 0.478 5971 A N 0.596 123.425 122.820 0.015 0.000 1.978 5971 A HA -0.083 4.237 4.320 -0.000 0.000 0.220 5971 A C 1.985 179.579 177.584 0.017 0.000 1.170 5971 A CA 1.415 53.461 52.037 0.016 0.000 0.636 5971 A CB -0.907 18.101 19.000 0.014 0.000 0.810 5971 A HN 0.729 nan 8.150 nan 0.000 0.448 5972 Q N 0.156 119.965 119.800 0.015 0.000 2.364 5972 Q HA -0.123 4.217 4.340 -0.000 0.000 0.207 5972 Q C 0.615 176.624 176.000 0.016 0.000 0.970 5972 Q CA 1.190 57.001 55.803 0.015 0.000 0.888 5972 Q CB -0.269 28.477 28.738 0.012 0.000 0.951 5972 Q HN 0.684 nan 8.270 nan 0.000 0.469 5973 D N -0.262 120.148 120.400 0.017 0.000 2.354 5973 D HA 0.065 4.705 4.640 -0.000 0.000 0.209 5973 D C 0.592 176.905 176.300 0.023 0.000 1.015 5973 D CA 0.037 54.048 54.000 0.018 0.000 0.867 5973 D CB 0.575 41.386 40.800 0.019 0.000 0.933 5973 D HN 0.200 nan 8.370 nan 0.000 0.520 5974 L N 0.906 122.144 121.223 0.025 0.000 2.461 5974 L HA 0.286 4.626 4.340 -0.000 0.000 0.272 5974 L C 1.216 178.103 176.870 0.028 0.000 1.197 5974 L CA -0.169 54.689 54.840 0.030 0.000 0.836 5974 L CB 0.834 42.911 42.059 0.030 0.000 1.105 5974 L HN -0.092 nan 8.230 nan 0.000 0.477 5975 G N 0.996 109.816 108.800 0.034 0.000 2.509 5975 G HA2 0.484 4.444 3.960 -0.000 0.000 0.328 5975 G HA3 0.484 4.444 3.960 -0.000 0.000 0.328 5975 G C -1.360 173.560 174.900 0.033 0.000 1.194 5975 G CA -0.481 44.636 45.100 0.029 0.000 0.967 5975 G HN 0.536 nan 8.290 nan 0.000 0.488 5976 D N -0.187 120.230 120.400 0.027 0.000 2.498 5976 D HA 0.597 5.237 4.640 -0.000 0.000 0.247 5976 D C -0.459 175.856 176.300 0.026 0.000 1.070 5976 D CA -0.026 53.990 54.000 0.027 0.000 0.842 5976 D CB 2.152 42.965 40.800 0.020 0.000 1.361 5976 D HN 0.573 nan 8.370 nan 0.000 0.484 5977 A N 0.531 123.370 122.820 0.032 0.000 2.398 5977 A HA 0.609 4.929 4.320 -0.000 0.000 0.301 5977 A C 0.949 178.550 177.584 0.029 0.000 1.041 5977 A CA -0.539 51.518 52.037 0.034 0.000 0.711 5977 A CB 1.646 20.679 19.000 0.054 0.000 1.240 5977 A HN 0.521 nan 8.150 nan 0.000 0.420 5978 G N 0.470 109.281 108.800 0.019 0.000 2.443 5978 G HA2 0.313 4.273 3.960 -0.000 0.000 0.219 5978 G HA3 0.313 4.273 3.960 -0.000 0.000 0.219 5978 G C 0.223 175.137 174.900 0.023 0.000 1.131 5978 G CA 1.530 46.638 45.100 0.013 0.000 0.775 5978 G HN 1.109 nan 8.290 nan 0.000 0.547 5979 L N -0.316 120.931 121.223 0.039 0.000 2.549 5979 L HA 0.595 4.935 4.340 -0.000 0.000 0.259 5979 L C -1.531 175.385 176.870 0.077 0.000 0.934 5979 L CA -0.733 54.136 54.840 0.048 0.000 0.865 5979 L CB 2.449 44.532 42.059 0.038 0.000 1.352 5979 L HN -0.160 nan 8.230 nan 0.000 0.410 5980 V N 4.134 124.095 119.914 0.078 0.000 2.443 5980 V HA 0.694 4.814 4.120 -0.000 0.000 0.293 5980 V C -0.614 175.536 176.094 0.094 0.000 1.021 5980 V CA -0.420 61.942 62.300 0.104 0.000 0.848 5980 V CB 1.536 33.419 31.823 0.101 0.000 0.998 5980 V HN 0.820 nan 8.190 nan 0.000 0.424 5981 E N 3.115 123.393 120.200 0.130 0.000 2.343 5981 E HA 0.407 4.757 4.350 -0.000 0.000 0.278 5981 E C -1.137 175.559 176.600 0.161 0.000 0.910 5981 E CA -0.685 55.777 56.400 0.103 0.000 0.757 5981 E CB 2.356 32.085 29.700 0.048 0.000 1.218 5981 E HN 0.743 nan 8.360 nan 0.000 0.435 5982 E N 3.939 124.205 120.200 0.109 0.000 2.194 5982 E HA 0.240 4.590 4.350 -0.000 0.000 0.284 5982 E C -0.883 175.777 176.600 0.099 0.000 1.035 5982 E CA -0.232 56.242 56.400 0.124 0.000 0.836 5982 E CB 0.715 30.460 29.700 0.075 0.000 1.070 5982 E HN 0.329 nan 8.360 nan 0.000 0.401 5983 R N 3.448 124.051 120.500 0.172 0.000 2.750 5983 R HA 0.356 4.696 4.340 -0.000 0.000 0.281 5983 R C -1.018 175.364 176.300 0.138 0.000 0.972 5983 R CA -1.108 55.038 56.100 0.077 0.000 0.912 5983 R CB 1.537 31.741 30.300 -0.161 0.000 1.187 5983 R HN 0.256 nan 8.270 nan 0.000 0.464 5984 K N 2.143 122.583 120.400 0.067 0.000 2.227 5984 K HA 0.390 4.710 4.320 -0.000 0.000 0.280 5984 K C -0.527 176.119 176.600 0.077 0.000 1.041 5984 K CA -0.120 56.210 56.287 0.071 0.000 0.905 5984 K CB 0.835 33.358 32.500 0.039 0.000 1.068 5984 K HN 0.311 nan 8.250 nan 0.000 0.470 5985 I N 2.283 122.915 120.570 0.103 0.000 2.439 5985 I HA 0.144 4.314 4.170 -0.000 0.000 0.283 5985 I C 0.194 176.350 176.117 0.065 0.000 1.023 5985 I CA -0.362 60.997 61.300 0.098 0.000 1.100 5985 I CB 1.181 39.276 38.000 0.158 0.000 1.238 5985 I HN 0.723 nan 8.210 nan 0.000 0.445 5986 S N 4.578 120.305 115.700 0.046 0.000 3.682 5986 S HA -0.218 4.252 4.470 -0.000 0.000 0.354 5986 S C 1.407 176.025 174.600 0.031 0.000 1.034 5986 S CA 1.621 59.841 58.200 0.034 0.000 1.084 5986 S CB -1.038 62.181 63.200 0.033 0.000 0.903 5986 S HN 1.580 nan 8.310 nan 0.000 0.470 5987 G N 0.134 108.953 108.800 0.031 0.000 2.550 5987 G HA2 -0.311 3.649 3.960 -0.000 0.000 0.233 5987 G HA3 -0.311 3.649 3.960 -0.000 0.000 0.233 5987 G C -0.204 174.717 174.900 0.034 0.000 1.170 5987 G CA 0.368 45.484 45.100 0.028 0.000 0.693 5987 G HN 0.723 nan 8.290 nan 0.000 0.512 5988 D N 1.853 122.275 120.400 0.038 0.000 2.443 5988 D HA 0.459 5.099 4.640 -0.000 0.000 0.239 5988 D C 1.022 177.356 176.300 0.056 0.000 1.136 5988 D CA 0.873 54.896 54.000 0.040 0.000 0.879 5988 D CB 1.262 42.082 40.800 0.034 0.000 1.195 5988 D HN 0.709 nan 8.370 nan 0.000 0.443 5989 S N 1.944 117.675 115.700 0.051 0.000 2.523 5989 S HA 0.616 5.086 4.470 -0.000 0.000 0.275 5989 S C 0.023 174.664 174.600 0.069 0.000 1.281 5989 S CA -0.716 57.524 58.200 0.067 0.000 1.050 5989 S CB 0.769 64.000 63.200 0.051 0.000 0.937 5989 S HN 0.384 nan 8.310 nan 0.000 0.492 5990 M N 2.706 122.372 119.600 0.110 0.000 2.575 5990 M HA 0.501 4.981 4.480 -0.000 0.000 0.284 5990 M C -1.303 175.069 176.300 0.119 0.000 1.253 5990 M CA -0.868 54.471 55.300 0.065 0.000 0.861 5990 M CB 1.969 34.571 32.600 0.003 0.000 1.733 5990 M HN 0.432 nan 8.290 nan 0.000 0.462 5991 I N 1.678 122.256 120.570 0.014 0.000 2.412 5991 I HA 0.459 4.629 4.170 -0.000 0.000 0.296 5991 I C -1.104 174.976 176.117 -0.061 0.000 0.987 5991 I CA -0.363 60.989 61.300 0.087 0.000 1.180 5991 I CB 0.985 39.044 38.000 0.098 0.000 1.340 5991 I HN 0.530 nan 8.210 nan 0.000 0.455 5992 F N 4.771 124.749 119.950 0.046 0.000 2.426 5992 F HA 0.418 4.945 4.527 0.000 0.000 0.348 5992 F C 0.215 176.040 175.800 0.042 0.000 1.124 5992 F CA -0.767 57.254 58.000 0.036 0.000 1.008 5992 F CB 1.792 40.806 39.000 0.024 0.000 1.139 5992 F HN -0.006 nan 8.300 nan 0.000 0.452 5993 V N 3.992 123.994 119.914 0.147 0.000 2.257 5993 V HA 0.340 4.460 4.120 -0.000 0.000 0.269 5993 V C -0.485 175.668 176.094 0.098 0.000 1.040 5993 V CA -0.577 61.787 62.300 0.107 0.000 0.813 5993 V CB 0.425 32.281 31.823 0.054 0.000 1.065 5993 V HN 0.795 nan 8.190 nan 0.000 0.457 5994 E N 3.023 123.290 120.200 0.111 0.000 2.369 5994 E HA 0.716 5.066 4.350 -0.000 0.000 0.270 5994 E C -0.653 175.977 176.600 0.049 0.000 0.909 5994 E CA -0.839 55.614 56.400 0.089 0.000 0.775 5994 E CB 1.973 31.747 29.700 0.122 0.000 1.270 5994 E HN 0.198 nan 8.360 nan 0.000 0.445 5995 E N -0.763 119.453 120.200 0.027 0.000 3.169 5995 E HA -0.129 4.221 4.350 -0.000 0.000 0.305 5995 E C -0.670 175.921 176.600 -0.014 0.000 0.912 5995 E CA 0.468 56.868 56.400 0.001 0.000 1.029 5995 E CB -2.463 27.239 29.700 0.003 0.000 1.514 5995 E HN 0.632 nan 8.360 nan 0.000 0.412 5996 C N 1.260 120.555 119.300 -0.009 0.000 2.679 5996 C HA 0.049 4.509 4.460 -0.000 0.000 0.417 5996 C C 2.292 177.239 174.990 -0.071 0.000 1.302 5996 C CA 0.098 59.103 59.018 -0.021 0.000 1.973 5996 C CB 0.281 28.018 27.740 -0.005 0.000 2.715 5996 C HN 0.355 nan 8.230 nan 0.000 0.628 5997 K N 1.153 121.498 120.400 -0.093 0.000 1.969 5997 K HA -0.114 4.206 4.320 -0.000 0.000 0.223 5997 K C 0.445 176.790 176.600 -0.425 0.000 1.048 5997 K CA 1.413 57.559 56.287 -0.235 0.000 0.983 5997 K CB -0.123 32.297 32.500 -0.134 0.000 0.738 5997 K HN 0.696 nan 8.250 nan 0.000 0.446 5998 H N 0.806 119.881 119.070 0.008 0.000 2.423 5998 H HA 0.252 4.808 4.556 -0.000 0.000 0.237 5998 H C -2.368 172.962 175.328 0.004 0.000 1.391 5998 H CA -1.966 54.086 56.048 0.006 0.000 1.453 5998 H CB 0.425 30.190 29.762 0.005 0.000 1.484 5998 H HN 0.256 nan 8.280 nan 0.000 0.505 5999 P HA 0.054 nan 4.420 nan 0.000 0.268 5999 P C 0.692 178.019 177.300 0.046 0.000 1.205 5999 P CA -0.427 62.698 63.100 0.042 0.000 0.771 5999 P CB 1.742 33.454 31.700 0.020 0.000 0.858 6000 K N 0.461 120.878 120.400 0.029 0.000 2.358 6000 K HA 0.381 4.701 4.320 -0.000 0.000 0.197 6000 K C 0.443 177.048 176.600 0.007 0.000 1.025 6000 K CA -0.018 56.281 56.287 0.019 0.000 1.104 6000 K CB 0.615 33.124 32.500 0.014 0.000 0.855 6000 K HN 0.558 nan 8.250 nan 0.000 0.531 6001 A N 1.092 123.914 122.820 0.003 0.000 2.408 6001 A HA 0.563 4.883 4.320 -0.000 0.000 0.295 6001 A C -0.461 177.120 177.584 -0.004 0.000 1.040 6001 A CA -0.732 51.301 52.037 -0.006 0.000 0.707 6001 A CB 1.289 20.278 19.000 -0.019 0.000 1.235 6001 A HN -0.052 nan 8.150 nan 0.000 0.418 6002 V N -0.460 119.453 119.914 -0.002 0.000 2.960 6002 V HA 0.972 5.092 4.120 -0.000 0.000 0.315 6002 V C -0.295 175.797 176.094 -0.004 0.000 1.087 6002 V CA -0.578 61.723 62.300 0.002 0.000 0.982 6002 V CB 1.665 33.495 31.823 0.011 0.000 1.039 6002 V HN 0.804 nan 8.190 nan 0.000 0.437 6003 T N 3.733 118.287 114.554 -0.000 0.000 2.863 6003 T HA 0.568 4.918 4.350 -0.000 0.000 0.285 6003 T C -0.531 174.177 174.700 0.012 0.000 1.009 6003 T CA -0.288 61.808 62.100 -0.006 0.000 0.989 6003 T CB 1.552 70.401 68.868 -0.031 0.000 1.004 6003 T HN 0.920 nan 8.240 nan 0.000 0.455 6004 M N 4.212 123.818 119.600 0.010 0.000 2.060 6004 M HA 0.438 4.918 4.480 -0.000 0.000 0.342 6004 M C -1.113 175.201 176.300 0.023 0.000 1.031 6004 M CA -1.040 54.272 55.300 0.021 0.000 0.981 6004 M CB 0.238 32.847 32.600 0.016 0.000 1.376 6004 M HN 0.474 nan 8.290 nan 0.000 0.397 6005 L N 6.696 127.945 121.223 0.043 0.000 2.433 6005 L HA 0.400 4.740 4.340 -0.000 0.000 0.275 6005 L C -1.124 175.775 176.870 0.047 0.000 1.128 6005 L CA 0.617 55.490 54.840 0.055 0.000 0.875 6005 L CB 0.189 42.318 42.059 0.117 0.000 1.171 6005 L HN 0.601 nan 8.230 nan 0.000 0.463 6006 I N 6.090 126.681 120.570 0.035 0.000 2.359 6006 I HA 0.490 4.660 4.170 -0.000 0.000 0.294 6006 I C -0.038 176.097 176.117 0.031 0.000 0.987 6006 I CA -0.762 60.554 61.300 0.027 0.000 1.225 6006 I CB 0.901 38.913 38.000 0.019 0.000 1.366 6006 I HN 0.532 nan 8.210 nan 0.000 0.466 6007 R N 4.116 124.632 120.500 0.027 0.000 2.832 6007 R HA 0.890 5.230 4.340 -0.000 0.000 0.271 6007 R C -0.363 175.946 176.300 0.014 0.000 0.996 6007 R CA -1.081 55.033 56.100 0.024 0.000 0.977 6007 R CB 1.970 32.286 30.300 0.026 0.000 1.168 6007 R HN 0.877 nan 8.270 nan 0.000 0.482 6008 G N -0.936 107.872 108.800 0.013 0.000 2.519 6008 G HA2 0.155 4.115 3.960 -0.000 0.000 0.292 6008 G HA3 0.155 4.115 3.960 -0.000 0.000 0.292 6008 G C 0.213 175.118 174.900 0.009 0.000 1.507 6008 G CA -0.232 44.872 45.100 0.006 0.000 0.806 6008 G HN 0.444 nan 8.290 nan 0.000 0.523 6009 T N -2.234 112.322 114.554 0.004 0.000 3.155 6009 T HA 0.299 4.649 4.350 -0.000 0.000 0.264 6009 T C 0.836 175.544 174.700 0.013 0.000 1.160 6009 T CA 1.462 63.566 62.100 0.006 0.000 1.075 6009 T CB -0.091 68.778 68.868 0.001 0.000 0.921 6009 T HN 0.690 nan 8.240 nan 0.000 0.533 6010 T N 0.227 114.791 114.554 0.017 0.000 2.885 6010 T HA 0.340 4.690 4.350 -0.000 0.000 0.322 6010 T C 0.296 175.022 174.700 0.043 0.000 1.387 6010 T CA -0.657 61.463 62.100 0.032 0.000 1.041 6010 T CB 2.390 71.282 68.868 0.040 0.000 1.287 6010 T HN 0.004 nan 8.240 nan 0.000 0.491 6011 E N 0.907 121.141 120.200 0.056 0.000 2.038 6011 E HA -0.177 4.173 4.350 -0.000 0.000 0.195 6011 E C 1.659 178.325 176.600 0.110 0.000 1.000 6011 E CA 2.031 58.470 56.400 0.064 0.000 0.803 6011 E CB -0.206 29.524 29.700 0.050 0.000 0.750 6011 E HN 0.756 nan 8.360 nan 0.000 0.448 6012 H N -0.956 118.115 119.070 0.001 0.000 2.422 6012 H HA -0.087 4.469 4.556 0.000 0.000 0.298 6012 H C 1.825 177.153 175.328 0.000 0.000 1.098 6012 H CA 1.147 57.195 56.048 0.001 0.000 1.315 6012 H CB 0.338 30.100 29.762 -0.000 0.000 1.382 6012 H HN 0.115 nan 8.280 nan 0.000 0.523 6013 V N 1.785 121.698 119.914 -0.001 0.000 2.283 6013 V HA -0.255 3.865 4.120 -0.000 0.000 0.243 6013 V C 2.625 178.699 176.094 -0.034 0.000 1.039 6013 V CA 1.806 64.059 62.300 -0.079 0.000 1.016 6013 V CB -0.425 31.369 31.823 -0.047 0.000 0.650 6013 V HN 0.553 nan 8.190 nan 0.000 0.449 6014 I N -1.155 119.418 120.570 0.005 0.000 2.493 6014 I HA -0.171 3.999 4.170 -0.000 0.000 0.254 6014 I C 2.284 178.413 176.117 0.021 0.000 1.160 6014 I CA 1.950 63.257 61.300 0.012 0.000 1.445 6014 I CB -0.554 37.458 38.000 0.021 0.000 1.086 6014 I HN 0.389 nan 8.210 nan 0.000 0.433 6015 E N 1.503 121.729 120.200 0.043 0.000 2.072 6015 E HA -0.205 4.145 4.350 -0.000 0.000 0.191 6015 E C 2.034 178.661 176.600 0.045 0.000 0.985 6015 E CA 1.080 57.516 56.400 0.061 0.000 0.801 6015 E CB 0.098 29.868 29.700 0.117 0.000 0.750 6015 E HN 0.489 nan 8.360 nan 0.000 0.452 6016 E N 0.213 120.424 120.200 0.019 0.000 2.152 6016 E HA -0.113 4.237 4.350 -0.000 0.000 0.192 6016 E C 2.256 178.848 176.600 -0.014 0.000 0.983 6016 E CA 0.652 57.044 56.400 -0.013 0.000 0.818 6016 E CB 0.011 29.655 29.700 -0.094 0.000 0.758 6016 E HN 0.205 nan 8.360 nan 0.000 0.467 6017 V N 1.643 121.547 119.914 -0.016 0.000 2.407 6017 V HA -0.232 3.888 4.120 -0.000 0.000 0.248 6017 V C 2.446 178.542 176.094 0.002 0.000 1.055 6017 V CA 1.706 64.001 62.300 -0.009 0.000 1.049 6017 V CB -0.800 31.019 31.823 -0.008 0.000 0.662 6017 V HN 0.226 nan 8.190 nan 0.000 0.455 6018 A N 0.105 122.930 122.820 0.008 0.000 1.877 6018 A HA -0.257 4.063 4.320 -0.000 0.000 0.216 6018 A C 2.417 180.009 177.584 0.012 0.000 1.186 6018 A CA 2.047 54.091 52.037 0.011 0.000 0.620 6018 A CB -0.578 18.431 19.000 0.015 0.000 0.822 6018 A HN 0.479 nan 8.150 nan 0.000 0.443 6019 R N -0.359 120.150 120.500 0.015 0.000 2.091 6019 R HA -0.123 4.217 4.340 -0.000 0.000 0.238 6019 R C 2.278 178.586 176.300 0.014 0.000 1.136 6019 R CA 1.476 57.586 56.100 0.016 0.000 0.959 6019 R CB -0.418 29.895 30.300 0.022 0.000 0.856 6019 R HN 0.442 nan 8.270 nan 0.000 0.437 6020 A N 0.167 122.993 122.820 0.010 0.000 1.908 6020 A HA -0.112 4.208 4.320 -0.000 0.000 0.218 6020 A C 2.227 179.818 177.584 0.012 0.000 1.181 6020 A CA 1.667 53.711 52.037 0.011 0.000 0.627 6020 A CB -0.446 18.556 19.000 0.004 0.000 0.818 6020 A HN 0.243 nan 8.150 nan 0.000 0.445 6021 V N 0.419 120.339 119.914 0.010 0.000 2.453 6021 V HA -0.183 3.937 4.120 -0.000 0.000 0.247 6021 V C 2.042 178.142 176.094 0.010 0.000 1.048 6021 V CA 2.017 64.323 62.300 0.010 0.000 1.049 6021 V CB -0.793 31.036 31.823 0.009 0.000 0.672 6021 V HN 0.465 nan 8.190 nan 0.000 0.457 6022 D N 0.321 120.727 120.400 0.010 0.000 2.149 6022 D HA -0.170 4.470 4.640 -0.000 0.000 0.198 6022 D C 1.852 178.158 176.300 0.011 0.000 0.990 6022 D CA 1.426 55.432 54.000 0.010 0.000 0.839 6022 D CB -0.219 40.587 40.800 0.010 0.000 0.948 6022 D HN 0.427 nan 8.370 nan 0.000 0.460 6023 D N 0.060 120.468 120.400 0.013 0.000 2.120 6023 D HA -0.007 4.633 4.640 -0.000 0.000 0.202 6023 D C 2.070 178.378 176.300 0.013 0.000 0.972 6023 D CA 1.164 55.173 54.000 0.014 0.000 0.837 6023 D CB -0.362 40.449 40.800 0.018 0.000 0.989 6023 D HN 0.115 nan 8.370 nan 0.000 0.469 6024 A N 0.765 123.594 122.820 0.014 0.000 1.908 6024 A HA -0.155 4.165 4.320 -0.000 0.000 0.218 6024 A C 2.508 180.099 177.584 0.012 0.000 1.181 6024 A CA 1.337 53.382 52.037 0.014 0.000 0.627 6024 A CB -0.846 18.162 19.000 0.014 0.000 0.818 6024 A HN 0.141 nan 8.150 nan 0.000 0.445 6025 V N -0.074 119.846 119.914 0.010 0.000 2.343 6025 V HA -0.200 3.920 4.120 -0.000 0.000 0.247 6025 V C 2.795 178.893 176.094 0.008 0.000 1.051 6025 V CA 1.970 64.275 62.300 0.009 0.000 1.036 6025 V CB -1.435 30.393 31.823 0.008 0.000 0.654 6025 V HN 0.634 nan 8.190 nan 0.000 0.451 6026 G N -0.247 108.558 108.800 0.008 0.000 2.433 6026 G HA2 -0.206 3.754 3.960 -0.000 0.000 0.216 6026 G HA3 -0.206 3.754 3.960 -0.000 0.000 0.216 6026 G C 1.635 176.540 174.900 0.007 0.000 1.186 6026 G CA 1.314 46.418 45.100 0.007 0.000 0.779 6026 G HN 0.405 nan 8.290 nan 0.000 0.543 6027 V N 0.341 120.260 119.914 0.008 0.000 2.548 6027 V HA -0.094 4.026 4.120 -0.000 0.000 0.249 6027 V C 2.967 179.066 176.094 0.008 0.000 1.055 6027 V CA 1.077 63.381 62.300 0.008 0.000 1.065 6027 V CB -0.022 31.806 31.823 0.009 0.000 0.681 6027 V HN 0.227 nan 8.190 nan 0.000 0.462 6028 V N 1.168 121.087 119.914 0.008 0.000 2.427 6028 V HA -0.148 3.972 4.120 -0.000 0.000 0.248 6028 V C 2.602 178.701 176.094 0.007 0.000 1.051 6028 V CA 2.128 64.432 62.300 0.008 0.000 1.048 6028 V CB -1.219 30.609 31.823 0.009 0.000 0.666 6028 V HN 0.603 nan 8.190 nan 0.000 0.456 6029 G N -1.367 107.437 108.800 0.006 0.000 2.402 6029 G HA2 -0.248 3.712 3.960 -0.000 0.000 0.216 6029 G HA3 -0.248 3.712 3.960 -0.000 0.000 0.216 6029 G C 1.758 176.660 174.900 0.005 0.000 1.162 6029 G CA 1.216 46.319 45.100 0.005 0.000 0.777 6029 G HN 0.518 nan 8.290 nan 0.000 0.539 6030 C N 0.483 119.786 119.300 0.005 0.000 2.413 6030 C HA -0.031 4.429 4.460 -0.000 0.000 0.276 6030 C C 3.232 178.225 174.990 0.005 0.000 1.248 6030 C CA 1.623 60.644 59.018 0.005 0.000 1.742 6030 C CB -0.932 26.811 27.740 0.005 0.000 2.017 6030 C HN 0.424 nan 8.230 nan 0.000 0.481 6031 T N 0.536 115.093 114.554 0.005 0.000 2.951 6031 T HA -0.031 4.319 4.350 -0.000 0.000 0.268 6031 T C 1.517 176.220 174.700 0.005 0.000 1.073 6031 T CA 0.906 63.009 62.100 0.005 0.000 1.134 6031 T CB -0.185 68.686 68.868 0.006 0.000 0.884 6031 T HN 0.327 nan 8.240 nan 0.000 0.479 6032 I N 1.152 121.725 120.570 0.005 0.000 2.500 6032 I HA -0.006 4.164 4.170 -0.000 0.000 0.252 6032 I C 2.248 178.367 176.117 0.003 0.000 1.142 6032 I CA 1.226 62.529 61.300 0.004 0.000 1.451 6032 I CB -0.190 37.813 38.000 0.004 0.000 1.093 6032 I HN 0.257 nan 8.210 nan 0.000 0.430 6033 E N -0.739 119.463 120.200 0.003 0.000 2.140 6033 E HA -0.060 4.289 4.350 -0.000 0.000 0.191 6033 E C 0.206 176.808 176.600 0.003 0.000 0.973 6033 E CA 0.495 56.897 56.400 0.003 0.000 0.829 6033 E CB 0.255 29.957 29.700 0.003 0.000 0.781 6033 E HN 0.226 nan 8.360 nan 0.000 0.466 6034 D N -0.485 119.917 120.400 0.004 0.000 2.446 6034 D HA 0.156 4.796 4.640 -0.000 0.000 0.251 6034 D C 0.282 176.584 176.300 0.005 0.000 1.137 6034 D CA -0.392 53.611 54.000 0.004 0.000 0.890 6034 D CB 1.135 41.938 40.800 0.005 0.000 1.071 6034 D HN 0.045 nan 8.370 nan 0.000 0.528 6035 G N 3.106 111.909 108.800 0.005 0.000 3.194 6035 G HA2 -0.046 3.914 3.960 -0.000 0.000 0.208 6035 G HA3 -0.046 3.914 3.960 -0.000 0.000 0.208 6035 G C 0.502 175.405 174.900 0.006 0.000 1.240 6035 G CA 0.064 45.167 45.100 0.005 0.000 1.044 6035 G HN 0.246 nan 8.290 nan 0.000 0.495 6036 R N -0.388 120.115 120.500 0.006 0.000 2.637 6036 R HA 0.697 5.037 4.340 -0.000 0.000 0.291 6036 R C 0.102 176.406 176.300 0.007 0.000 0.963 6036 R CA -0.638 55.466 56.100 0.007 0.000 0.901 6036 R CB 1.697 32.002 30.300 0.008 0.000 1.160 6036 R HN 0.323 nan 8.270 nan 0.000 0.457 6037 I N -1.876 118.699 120.570 0.007 0.000 3.145 6037 I HA 0.861 5.031 4.170 -0.000 0.000 0.313 6037 I C -1.137 174.984 176.117 0.008 0.000 1.122 6037 I CA -1.317 59.987 61.300 0.007 0.000 0.987 6037 I CB 2.476 40.480 38.000 0.006 0.000 1.236 6037 I HN 0.325 nan 8.210 nan 0.000 0.453 6038 V N 1.531 121.449 119.914 0.006 0.000 3.077 6038 V HA 0.429 4.549 4.120 -0.000 0.000 0.299 6038 V C -0.341 175.754 176.094 0.003 0.000 1.276 6038 V CA -0.269 62.035 62.300 0.007 0.000 0.993 6038 V CB 2.604 34.431 31.823 0.006 0.000 1.076 6038 V HN 0.993 nan 8.190 nan 0.000 0.434 6039 S N 3.485 119.190 115.700 0.008 0.000 2.560 6039 S HA 0.503 4.973 4.470 -0.000 0.000 0.284 6039 S C 0.570 175.160 174.600 -0.017 0.000 1.327 6039 S CA 0.378 58.579 58.200 0.002 0.000 1.055 6039 S CB 1.237 64.450 63.200 0.021 0.000 0.868 6039 S HN 1.229 nan 8.310 nan 0.000 0.506 6040 G N 0.623 109.406 108.800 -0.028 0.000 2.882 6040 G HA2 0.522 4.482 3.960 -0.000 0.000 0.164 6040 G HA3 0.522 4.482 3.960 -0.000 0.000 0.164 6040 G C 0.890 175.755 174.900 -0.057 0.000 1.429 6040 G CA -0.197 44.876 45.100 -0.044 0.000 1.059 6040 G HN 1.526 nan 8.290 nan 0.000 0.581 6041 G N -1.504 107.255 108.800 -0.069 0.000 2.258 6041 G HA2 0.247 4.207 3.960 -0.000 0.000 0.274 6041 G HA3 0.247 4.207 3.960 -0.000 0.000 0.274 6041 G C 1.413 176.266 174.900 -0.079 0.000 1.021 6041 G CA 1.252 46.306 45.100 -0.077 0.000 0.798 6041 G HN 2.421 nan 8.290 nan 0.000 0.507 6042 G N -1.459 107.294 108.800 -0.078 0.000 2.160 6042 G HA2 -0.090 3.870 3.960 -0.000 0.000 0.251 6042 G HA3 -0.090 3.870 3.960 -0.000 0.000 0.251 6042 G C 1.331 176.163 174.900 -0.113 0.000 1.008 6042 G CA 1.577 46.625 45.100 -0.087 0.000 0.724 6042 G HN 1.903 nan 8.290 nan 0.000 0.514 6043 S N -0.347 115.282 115.700 -0.118 0.000 2.383 6043 S HA -0.136 4.334 4.470 -0.000 0.000 0.227 6043 S C 2.821 177.334 174.600 -0.145 0.000 1.026 6043 S CA 2.563 60.655 58.200 -0.179 0.000 0.981 6043 S CB -0.456 62.673 63.200 -0.118 0.000 0.818 6043 S HN 1.285 nan 8.310 nan 0.000 0.472 6044 T N 0.205 114.711 114.554 -0.080 0.000 2.622 6044 T HA -0.106 4.243 4.350 -0.000 0.000 0.266 6044 T C 1.581 176.249 174.700 -0.054 0.000 1.047 6044 T CA 1.644 63.715 62.100 -0.048 0.000 1.159 6044 T CB -0.979 67.874 68.868 -0.026 0.000 0.863 6044 T HN 0.386 nan 8.240 nan 0.000 0.422 6045 E N 0.841 121.002 120.200 -0.064 0.000 2.171 6045 E HA -0.057 4.293 4.350 -0.000 0.000 0.197 6045 E C 2.261 178.815 176.600 -0.077 0.000 0.997 6045 E CA 0.827 57.187 56.400 -0.066 0.000 0.810 6045 E CB -0.660 28.989 29.700 -0.084 0.000 0.738 6045 E HN 0.414 nan 8.360 nan 0.000 0.467 6046 V N 0.899 120.745 119.914 -0.113 0.000 2.379 6046 V HA -0.181 3.939 4.120 -0.000 0.000 0.245 6046 V C 2.118 178.151 176.094 -0.102 0.000 1.044 6046 V CA 1.472 63.694 62.300 -0.130 0.000 1.036 6046 V CB -0.316 31.375 31.823 -0.219 0.000 0.664 6046 V HN 0.220 nan 8.190 nan 0.000 0.453 6047 E N 0.054 120.195 120.200 -0.098 0.000 2.051 6047 E HA -0.203 4.147 4.350 -0.000 0.000 0.192 6047 E C 2.193 178.775 176.600 -0.029 0.000 0.991 6047 E CA 1.182 57.562 56.400 -0.033 0.000 0.799 6047 E CB -0.307 29.393 29.700 -0.000 0.000 0.748 6047 E HN 0.338 nan 8.360 nan 0.000 0.449 6048 L N 0.943 122.156 121.223 -0.018 0.000 2.046 6048 L HA -0.140 4.200 4.340 -0.000 0.000 0.208 6048 L C 2.577 179.443 176.870 -0.007 0.000 1.077 6048 L CA 1.465 56.311 54.840 0.010 0.000 0.747 6048 L CB -1.244 40.846 42.059 0.052 0.000 0.896 6048 L HN 0.041 nan 8.230 nan 0.000 0.432 6049 S N -1.246 114.442 115.700 -0.020 0.000 2.368 6049 S HA -0.257 4.213 4.470 -0.000 0.000 0.225 6049 S C 2.049 176.619 174.600 -0.050 0.000 1.030 6049 S CA 1.632 59.818 58.200 -0.023 0.000 0.999 6049 S CB -0.177 63.000 63.200 -0.038 0.000 0.844 6049 S HN 0.330 nan 8.310 nan 0.000 0.459 6050 M N 1.305 120.866 119.600 -0.066 0.000 2.066 6050 M HA 0.034 4.514 4.480 -0.000 0.000 0.259 6050 M C 1.787 177.985 176.300 -0.171 0.000 1.074 6050 M CA 1.887 57.137 55.300 -0.083 0.000 1.114 6050 M CB -0.527 32.042 32.600 -0.051 0.000 1.306 6050 M HN 0.041 nan 8.290 nan 0.000 0.411 6051 K N 0.085 120.340 120.400 -0.241 0.000 2.097 6051 K HA -0.012 4.308 4.320 -0.000 0.000 0.206 6051 K C 1.892 177.938 176.600 -0.922 0.000 1.049 6051 K CA 1.447 57.393 56.287 -0.569 0.000 0.933 6051 K CB -0.776 31.456 32.500 -0.448 0.000 0.717 6051 K HN 0.397 nan 8.250 nan 0.000 0.442 6052 L N 0.352 121.335 121.223 -0.400 0.000 2.131 6052 L HA -0.114 4.226 4.340 -0.000 0.000 0.210 6052 L C 2.594 179.416 176.870 -0.079 0.000 1.092 6052 L CA 0.920 55.672 54.840 -0.146 0.000 0.759 6052 L CB -0.291 41.797 42.059 0.047 0.000 0.903 6052 L HN 0.179 nan 8.230 nan 0.000 0.435 6053 R N 0.753 121.192 120.500 -0.102 0.000 2.092 6053 R HA -0.162 4.178 4.340 -0.000 0.000 0.231 6053 R C 1.864 178.141 176.300 -0.040 0.000 1.119 6053 R CA 1.543 57.618 56.100 -0.041 0.000 0.970 6053 R CB -0.054 30.224 30.300 -0.036 0.000 0.864 6053 R HN 0.485 nan 8.270 nan 0.000 0.440 6054 E N -0.788 119.341 120.200 -0.119 0.000 2.072 6054 E HA -0.154 4.196 4.350 -0.000 0.000 0.190 6054 E C 1.885 178.545 176.600 0.100 0.000 0.982 6054 E CA 0.939 57.310 56.400 -0.048 0.000 0.803 6054 E CB -0.178 29.459 29.700 -0.105 0.000 0.755 6054 E HN 0.317 nan 8.360 nan 0.000 0.453 6055 Y N 0.807 121.117 120.300 0.016 0.000 2.207 6055 Y HA -0.166 4.384 4.550 -0.000 0.000 0.287 6055 Y C 2.397 178.304 175.900 0.011 0.000 1.156 6055 Y CA 0.644 58.750 58.100 0.010 0.000 1.182 6055 Y CB -1.252 37.212 38.460 0.006 0.000 0.979 6055 Y HN 0.041 nan 8.280 nan 0.000 0.521 6056 A N 0.329 123.250 122.820 0.168 0.000 1.883 6056 A HA -0.189 4.131 4.320 -0.000 0.000 0.217 6056 A C 2.203 179.833 177.584 0.077 0.000 1.186 6056 A CA 1.853 53.951 52.037 0.102 0.000 0.624 6056 A CB -0.486 18.561 19.000 0.078 0.000 0.822 6056 A HN 0.343 nan 8.150 nan 0.000 0.444 6057 E N -0.535 119.707 120.200 0.070 0.000 2.150 6057 E HA -0.119 4.231 4.350 -0.000 0.000 0.193 6057 E C 2.156 178.789 176.600 0.055 0.000 0.985 6057 E CA 1.081 57.512 56.400 0.053 0.000 0.814 6057 E CB -0.652 29.074 29.700 0.043 0.000 0.752 6057 E HN 0.603 nan 8.360 nan 0.000 0.466 6058 G N 1.152 109.998 108.800 0.076 0.000 2.402 6058 G HA2 -0.184 3.776 3.960 -0.000 0.000 0.216 6058 G HA3 -0.184 3.776 3.960 -0.000 0.000 0.216 6058 G C 1.739 176.663 174.900 0.039 0.000 1.162 6058 G CA 0.404 45.540 45.100 0.061 0.000 0.777 6058 G HN 0.179 nan 8.290 nan 0.000 0.539 6059 I N -0.144 120.452 120.570 0.044 0.000 2.286 6059 I HA 0.010 4.180 4.170 -0.000 0.000 0.245 6059 I C 1.749 177.879 176.117 0.023 0.000 1.104 6059 I CA 0.624 61.940 61.300 0.026 0.000 1.397 6059 I CB -0.276 37.741 38.000 0.029 0.000 1.072 6059 I HN 0.319 nan 8.210 nan 0.000 0.417 6060 S N -0.724 114.994 115.700 0.030 0.000 3.307 6060 S HA -0.152 4.318 4.470 -0.000 0.000 0.634 6060 S C 0.591 175.203 174.600 0.020 0.000 2.711 6060 S CA 0.943 59.158 58.200 0.025 0.000 2.940 6060 S CB -1.373 61.839 63.200 0.019 0.000 0.331 6060 S HN 1.370 nan 8.310 nan 0.000 1.766 6061 G N 0.624 109.433 108.800 0.016 0.000 2.569 6061 G HA2 -0.262 3.698 3.960 -0.000 0.000 0.259 6061 G HA3 -0.262 3.698 3.960 -0.000 0.000 0.259 6061 G C 0.149 175.058 174.900 0.016 0.000 1.263 6061 G CA 1.166 46.273 45.100 0.013 0.000 0.928 6061 G HN 1.160 nan 8.290 nan 0.000 0.572 6062 R N 0.299 120.807 120.500 0.013 0.000 2.153 6062 R HA 0.195 4.535 4.340 -0.000 0.000 0.218 6062 R C 2.596 178.905 176.300 0.016 0.000 1.072 6062 R CA 1.800 57.909 56.100 0.015 0.000 0.990 6062 R CB -0.363 29.945 30.300 0.014 0.000 0.889 6062 R HN 0.707 nan 8.270 nan 0.000 0.452 6063 E N 0.471 120.678 120.200 0.012 0.000 2.160 6063 E HA -0.281 4.069 4.350 -0.000 0.000 0.195 6063 E C 1.809 178.428 176.600 0.032 0.000 0.991 6063 E CA 1.454 57.861 56.400 0.012 0.000 0.810 6063 E CB -0.010 29.693 29.700 0.004 0.000 0.742 6063 E HN 0.534 nan 8.360 nan 0.000 0.466 6064 Q N 0.444 120.266 119.800 0.036 0.000 2.170 6064 Q HA -0.187 4.153 4.340 -0.000 0.000 0.203 6064 Q C 1.976 178.014 176.000 0.063 0.000 0.976 6064 Q CA 1.048 56.882 55.803 0.052 0.000 0.858 6064 Q CB -0.172 28.593 28.738 0.045 0.000 0.907 6064 Q HN 0.166 nan 8.270 nan 0.000 0.433 6065 L N 1.165 122.420 121.223 0.052 0.000 2.093 6065 L HA -0.062 4.278 4.340 -0.000 0.000 0.208 6065 L C 2.559 179.483 176.870 0.089 0.000 1.085 6065 L CA 1.898 56.774 54.840 0.060 0.000 0.755 6065 L CB -1.077 41.006 42.059 0.039 0.000 0.904 6065 L HN 0.410 nan 8.230 nan 0.000 0.435 6066 A N -1.244 121.621 122.820 0.074 0.000 1.898 6066 A HA -0.112 4.208 4.320 -0.000 0.000 0.216 6066 A C 2.331 180.076 177.584 0.268 0.000 1.181 6066 A CA 1.677 53.769 52.037 0.092 0.000 0.620 6066 A CB -0.802 18.186 19.000 -0.020 0.000 0.819 6066 A HN 0.192 nan 8.150 nan 0.000 0.442 6067 V N -0.124 119.901 119.914 0.186 0.000 2.515 6067 V HA -0.187 3.933 4.120 -0.000 0.000 0.250 6067 V C 2.575 178.799 176.094 0.217 0.000 1.058 6067 V CA 2.043 64.462 62.300 0.198 0.000 1.064 6067 V CB -0.795 31.098 31.823 0.117 0.000 0.675 6067 V HN 0.607 nan 8.190 nan 0.000 0.461 6068 R N 0.227 120.827 120.500 0.167 0.000 2.075 6068 R HA -0.111 4.229 4.340 -0.000 0.000 0.232 6068 R C 2.290 178.679 176.300 0.148 0.000 1.126 6068 R CA 1.498 57.675 56.100 0.128 0.000 0.963 6068 R CB -0.344 30.009 30.300 0.087 0.000 0.858 6068 R HN 0.490 nan 8.270 nan 0.000 0.435 6069 A N 0.005 122.953 122.820 0.212 0.000 1.969 6069 A HA -0.156 4.164 4.320 -0.000 0.000 0.218 6069 A C 1.906 179.597 177.584 0.178 0.000 1.169 6069 A CA 0.894 53.065 52.037 0.223 0.000 0.635 6069 A CB -0.625 18.565 19.000 0.317 0.000 0.810 6069 A HN 0.483 nan 8.150 nan 0.000 0.445 6070 F N 0.882 120.878 119.950 0.077 0.000 2.134 6070 F HA -0.062 4.465 4.527 -0.000 0.000 0.299 6070 F C 2.519 178.248 175.800 -0.118 0.000 1.097 6070 F CA 1.284 59.160 58.000 -0.206 0.000 1.264 6070 F CB -0.228 38.684 39.000 -0.148 0.000 1.001 6070 F HN 0.249 nan 8.300 nan 0.000 0.479 6071 A N -0.271 122.646 122.820 0.162 0.000 1.933 6071 A HA -0.179 4.141 4.320 -0.000 0.000 0.218 6071 A C 1.876 179.438 177.584 -0.037 0.000 1.175 6071 A CA 1.965 54.041 52.037 0.065 0.000 0.628 6071 A CB -0.863 18.187 19.000 0.083 0.000 0.814 6071 A HN 0.413 nan 8.150 nan 0.000 0.444 6072 D N -0.104 120.280 120.400 -0.026 0.000 2.224 6072 D HA 0.057 4.697 4.640 -0.000 0.000 0.205 6072 D C 2.118 178.359 176.300 -0.098 0.000 0.965 6072 D CA 1.227 55.200 54.000 -0.044 0.000 0.852 6072 D CB -0.284 40.512 40.800 -0.007 0.000 0.947 6072 D HN 0.421 nan 8.370 nan 0.000 0.494 6073 A N 0.535 123.253 122.820 -0.170 0.000 1.969 6073 A HA -0.056 4.264 4.320 -0.000 0.000 0.218 6073 A C 2.243 179.663 177.584 -0.274 0.000 1.169 6073 A CA 0.549 52.440 52.037 -0.244 0.000 0.635 6073 A CB -0.630 18.136 19.000 -0.389 0.000 0.810 6073 A HN 0.204 nan 8.150 nan 0.000 0.445 6074 L N -0.574 120.466 121.223 -0.305 0.000 2.265 6074 L HA -0.182 4.158 4.340 -0.000 0.000 0.215 6074 L C 2.411 179.187 176.870 -0.157 0.000 1.117 6074 L CA 1.485 56.175 54.840 -0.251 0.000 0.782 6074 L CB -0.419 41.516 42.059 -0.207 0.000 0.914 6074 L HN 0.564 nan 8.230 nan 0.000 0.441 6075 E N 0.000 120.124 120.200 -0.128 0.000 2.409 6075 E HA -0.195 4.155 4.350 -0.000 0.000 0.198 6075 E C 2.202 178.751 176.600 -0.086 0.000 1.024 6075 E CA 0.503 56.847 56.400 -0.094 0.000 0.861 6075 E CB 0.175 29.831 29.700 -0.074 0.000 0.788 6075 E HN 0.307 nan 8.360 nan 0.000 0.521 6076 V N 0.870 120.725 119.914 -0.098 0.000 2.469 6076 V HA -0.246 3.874 4.120 -0.000 0.000 0.251 6076 V C 1.920 177.969 176.094 -0.075 0.000 1.064 6076 V CA 1.226 63.477 62.300 -0.082 0.000 1.066 6076 V CB -0.296 31.473 31.823 -0.090 0.000 0.667 6076 V HN 0.324 nan 8.190 nan 0.000 0.461 6077 I N 0.635 121.155 120.570 -0.084 0.000 2.113 6077 I HA -0.093 4.077 4.170 -0.000 0.000 0.238 6077 I C 0.309 176.386 176.117 -0.066 0.000 1.070 6077 I CA 1.827 63.083 61.300 -0.074 0.000 1.332 6077 I CB -3.030 34.922 38.000 -0.080 0.000 1.044 6077 I HN 0.336 nan 8.210 nan 0.000 0.402 6078 P HA -0.136 nan 4.420 nan 0.000 0.216 6078 P C 1.727 178.995 177.300 -0.052 0.000 1.153 6078 P CA 1.395 64.457 63.100 -0.062 0.000 0.858 6078 P CB -0.120 31.540 31.700 -0.066 0.000 0.789 6079 R N -0.637 119.832 120.500 -0.051 0.000 2.091 6079 R HA -0.075 4.265 4.340 -0.000 0.000 0.238 6079 R C 2.150 178.428 176.300 -0.038 0.000 1.136 6079 R CA 2.208 58.282 56.100 -0.043 0.000 0.959 6079 R CB -2.034 28.240 30.300 -0.044 0.000 0.856 6079 R HN 0.356 nan 8.270 nan 0.000 0.437 6080 T N -1.902 112.627 114.554 -0.041 0.000 3.057 6080 T HA 0.068 4.418 4.350 -0.000 0.000 0.254 6080 T C 1.903 176.583 174.700 -0.033 0.000 1.094 6080 T CA -0.047 62.032 62.100 -0.035 0.000 1.088 6080 T CB -0.014 68.832 68.868 -0.036 0.000 0.934 6080 T HN -0.103 nan 8.240 nan 0.000 0.497 6081 L N 1.811 123.010 121.223 -0.040 0.000 2.027 6081 L HA 0.298 4.638 4.340 -0.000 0.000 0.206 6081 L C 2.934 179.782 176.870 -0.037 0.000 1.074 6081 L CA 1.766 56.581 54.840 -0.043 0.000 0.745 6081 L CB -1.168 40.858 42.059 -0.054 0.000 0.898 6081 L HN 0.429 nan 8.230 nan 0.000 0.433 6082 A N -1.641 121.159 122.820 -0.035 0.000 2.021 6082 A HA -0.135 4.185 4.320 -0.000 0.000 0.216 6082 A C 2.278 179.851 177.584 -0.018 0.000 1.163 6082 A CA 1.056 53.077 52.037 -0.026 0.000 0.676 6082 A CB -0.388 18.596 19.000 -0.027 0.000 0.818 6082 A HN 0.465 nan 8.150 nan 0.000 0.453 6083 E N 0.339 120.527 120.200 -0.020 0.000 2.028 6083 E HA -0.213 4.137 4.350 -0.000 0.000 0.191 6083 E C 1.483 178.077 176.600 -0.010 0.000 0.988 6083 E CA 1.337 57.728 56.400 -0.015 0.000 0.799 6083 E CB -0.137 29.552 29.700 -0.018 0.000 0.755 6083 E HN 0.512 nan 8.360 nan 0.000 0.447 6084 N N 0.301 118.995 118.700 -0.011 0.000 2.309 6084 N HA -0.107 4.632 4.740 -0.000 0.000 0.182 6084 N C 1.395 176.907 175.510 0.003 0.000 1.018 6084 N CA 1.121 54.168 53.050 -0.005 0.000 0.876 6084 N CB -0.215 38.267 38.487 -0.008 0.000 0.972 6084 N HN 0.233 nan 8.380 nan 0.000 0.434 6085 A N -0.127 122.693 122.820 0.000 0.000 2.067 6085 A HA 0.320 4.640 4.320 -0.000 0.000 0.217 6085 A C 1.512 179.105 177.584 0.015 0.000 1.156 6085 A CA 1.107 53.150 52.037 0.011 0.000 0.683 6085 A CB -0.370 18.631 19.000 0.000 0.000 0.808 6085 A HN 0.312 nan 8.150 nan 0.000 0.455 6086 G N -1.325 107.479 108.800 0.006 0.000 2.137 6086 G HA2 -0.181 3.779 3.960 -0.000 0.000 0.237 6086 G HA3 -0.181 3.779 3.960 -0.000 0.000 0.237 6086 G C -0.025 174.878 174.900 0.005 0.000 1.002 6086 G CA 0.285 45.389 45.100 0.006 0.000 0.702 6086 G HN 0.432 nan 8.290 nan 0.000 0.515 6087 L N 0.135 121.359 121.223 0.001 0.000 2.399 6087 L HA 0.445 4.785 4.340 -0.000 0.000 0.265 6087 L C 0.548 177.415 176.870 -0.006 0.000 1.089 6087 L CA -1.011 53.828 54.840 -0.002 0.000 0.802 6087 L CB 0.842 42.898 42.059 -0.005 0.000 1.180 6087 L HN 0.095 nan 8.230 nan 0.000 0.454 6088 D N 1.186 121.583 120.400 -0.005 0.000 2.346 6088 D HA 0.077 4.717 4.640 -0.000 0.000 0.267 6088 D C 0.754 177.047 176.300 -0.012 0.000 1.320 6088 D CA 0.170 54.166 54.000 -0.007 0.000 0.951 6088 D CB 1.602 42.399 40.800 -0.005 0.000 1.079 6088 D HN 0.638 nan 8.370 nan 0.000 0.509 6089 A N 4.923 127.734 122.820 -0.014 0.000 1.908 6089 A HA -0.194 4.126 4.320 -0.000 0.000 0.218 6089 A C 2.301 179.873 177.584 -0.020 0.000 1.181 6089 A CA 1.020 53.045 52.037 -0.020 0.000 0.627 6089 A CB -0.351 18.636 19.000 -0.021 0.000 0.818 6089 A HN 0.754 nan 8.150 nan 0.000 0.445 6090 I N -1.069 119.491 120.570 -0.016 0.000 2.163 6090 I HA -0.221 3.949 4.170 -0.000 0.000 0.240 6090 I C 2.607 178.716 176.117 -0.013 0.000 1.081 6090 I CA 1.859 63.150 61.300 -0.015 0.000 1.353 6090 I CB -0.328 37.665 38.000 -0.012 0.000 1.054 6090 I HN 0.367 nan 8.210 nan 0.000 0.407 6091 E N 1.226 121.420 120.200 -0.011 0.000 2.072 6091 E HA -0.168 4.182 4.350 -0.000 0.000 0.191 6091 E C 2.131 178.726 176.600 -0.009 0.000 0.985 6091 E CA 1.222 57.617 56.400 -0.008 0.000 0.801 6091 E CB -0.020 29.677 29.700 -0.006 0.000 0.750 6091 E HN 0.238 nan 8.360 nan 0.000 0.452 6092 I N 0.371 120.934 120.570 -0.012 0.000 2.127 6092 I HA -0.248 3.922 4.170 -0.000 0.000 0.241 6092 I C 2.080 178.186 176.117 -0.017 0.000 1.075 6092 I CA 0.947 62.239 61.300 -0.014 0.000 1.334 6092 I CB -1.091 36.898 38.000 -0.018 0.000 1.040 6092 I HN 0.226 nan 8.210 nan 0.000 0.405 6093 L N 0.150 121.359 121.223 -0.022 0.000 2.042 6093 L HA -0.186 4.154 4.340 -0.000 0.000 0.210 6093 L C 2.623 179.481 176.870 -0.019 0.000 1.076 6093 L CA 1.385 56.209 54.840 -0.027 0.000 0.749 6093 L CB -1.207 40.834 42.059 -0.031 0.000 0.893 6093 L HN 0.018 nan 8.230 nan 0.000 0.432 6094 V N -0.827 119.079 119.914 -0.013 0.000 2.358 6094 V HA -0.232 3.888 4.120 -0.000 0.000 0.246 6094 V C 2.601 178.694 176.094 -0.001 0.000 1.047 6094 V CA 1.348 63.644 62.300 -0.007 0.000 1.035 6094 V CB -0.520 31.299 31.823 -0.006 0.000 0.658 6094 V HN 0.380 nan 8.190 nan 0.000 0.452 6095 K N -0.072 120.328 120.400 -0.001 0.000 2.057 6095 K HA -0.055 4.265 4.320 -0.000 0.000 0.206 6095 K C 2.141 178.747 176.600 0.010 0.000 1.050 6095 K CA 1.053 57.342 56.287 0.004 0.000 0.935 6095 K CB -0.715 31.786 32.500 0.001 0.000 0.715 6095 K HN 0.383 nan 8.250 nan 0.000 0.439 6096 V N 1.533 121.449 119.914 0.005 0.000 2.261 6096 V HA -0.230 3.890 4.120 -0.000 0.000 0.246 6096 V C 2.496 178.610 176.094 0.035 0.000 1.047 6096 V CA 1.659 63.966 62.300 0.011 0.000 1.015 6096 V CB -0.428 31.386 31.823 -0.014 0.000 0.642 6096 V HN 0.299 nan 8.190 nan 0.000 0.446 6097 R N 0.042 120.550 120.500 0.013 0.000 2.091 6097 R HA -0.176 4.164 4.340 -0.000 0.000 0.238 6097 R C 2.414 178.756 176.300 0.071 0.000 1.136 6097 R CA 1.579 57.697 56.100 0.029 0.000 0.959 6097 R CB -0.658 29.640 30.300 -0.003 0.000 0.856 6097 R HN 0.558 nan 8.270 nan 0.000 0.437 6098 A N 1.252 124.097 122.820 0.041 0.000 1.858 6098 A HA -0.125 4.195 4.320 -0.000 0.000 0.216 6098 A C 2.405 180.012 177.584 0.038 0.000 1.190 6098 A CA 1.722 53.779 52.037 0.033 0.000 0.617 6098 A CB -0.801 18.209 19.000 0.017 0.000 0.827 6098 A HN 0.404 nan 8.150 nan 0.000 0.443 6099 A N -1.207 121.638 122.820 0.041 0.000 1.908 6099 A HA -0.249 4.071 4.320 -0.000 0.000 0.218 6099 A C 2.155 179.766 177.584 0.046 0.000 1.181 6099 A CA 1.869 53.927 52.037 0.035 0.000 0.627 6099 A CB -0.993 18.026 19.000 0.032 0.000 0.818 6099 A HN 0.790 nan 8.150 nan 0.000 0.445 6100 H N 0.024 119.086 119.070 -0.013 0.000 2.353 6100 H HA -0.047 4.509 4.556 0.000 0.000 0.300 6100 H C 2.207 177.528 175.328 -0.012 0.000 1.090 6100 H CA 1.666 57.706 56.048 -0.013 0.000 1.327 6100 H CB -0.215 29.537 29.762 -0.016 0.000 1.383 6100 H HN 0.398 nan 8.280 nan 0.000 0.508 6101 A N -0.084 122.746 122.820 0.017 0.000 2.019 6101 A HA -0.140 4.180 4.320 -0.000 0.000 0.219 6101 A C 2.701 180.239 177.584 -0.075 0.000 1.164 6101 A CA 1.799 53.817 52.037 -0.032 0.000 0.644 6101 A CB -0.624 18.396 19.000 0.034 0.000 0.805 6101 A HN 0.512 nan 8.150 nan 0.000 0.449 6102 S N -0.557 115.108 115.700 -0.058 0.000 2.370 6102 S HA -0.054 4.416 4.470 -0.000 0.000 0.214 6102 S C 1.791 176.350 174.600 -0.068 0.000 1.033 6102 S CA 0.788 58.958 58.200 -0.049 0.000 0.941 6102 S CB -0.354 62.832 63.200 -0.024 0.000 0.886 6102 S HN 0.568 nan 8.310 nan 0.000 0.521 6103 N N 1.309 119.969 118.700 -0.067 0.000 2.396 6103 N HA 0.213 4.953 4.740 -0.000 0.000 0.180 6103 N C 1.069 176.520 175.510 -0.099 0.000 1.028 6103 N CA 1.011 54.023 53.050 -0.063 0.000 0.893 6103 N CB -0.016 38.450 38.487 -0.035 0.000 0.967 6103 N HN 0.634 nan 8.380 nan 0.000 0.440 6104 G N 0.340 109.024 108.800 -0.193 0.000 2.378 6104 G HA2 -0.214 3.746 3.960 -0.000 0.000 0.198 6104 G HA3 -0.214 3.746 3.960 -0.000 0.000 0.198 6104 G C 0.050 174.728 174.900 -0.370 0.000 1.223 6104 G CA -0.035 44.910 45.100 -0.259 0.000 1.088 6104 G HN 0.263 nan 8.290 nan 0.000 0.530 6105 N N 0.430 119.026 118.700 -0.174 0.000 2.415 6105 N HA 0.138 4.878 4.740 -0.000 0.000 0.174 6105 N C 1.619 177.169 175.510 0.067 0.000 1.048 6105 N CA 1.168 54.225 53.050 0.011 0.000 0.895 6105 N CB 0.140 38.660 38.487 0.055 0.000 1.036 6105 N HN 0.609 nan 8.380 nan 0.000 0.449 6106 K N -0.653 119.756 120.400 0.015 0.000 2.399 6106 K HA 0.378 4.698 4.320 -0.000 0.000 0.204 6106 K C -0.539 176.069 176.600 0.013 0.000 1.023 6106 K CA 0.010 56.309 56.287 0.019 0.000 1.127 6106 K CB 0.333 32.838 32.500 0.008 0.000 0.856 6106 K HN 0.016 nan 8.250 nan 0.000 0.514 6107 C N 1.295 120.601 119.300 0.011 0.000 3.401 6107 C HA 0.706 5.166 4.460 -0.000 0.000 0.204 6107 C C 0.406 175.411 174.990 0.026 0.000 1.522 6107 C CA -0.507 58.515 59.018 0.007 0.000 1.409 6107 C CB -0.542 27.189 27.740 -0.015 0.000 1.967 6107 C HN 0.662 nan 8.230 nan 0.000 0.496 6108 A N 0.477 123.326 122.820 0.050 0.000 3.169 6108 A HA 0.930 5.250 4.320 -0.000 0.000 0.146 6108 A C 0.531 178.136 177.584 0.034 0.000 1.265 6108 A CA 0.559 52.637 52.037 0.069 0.000 2.339 6108 A CB -0.749 18.347 19.000 0.160 0.000 2.810 6108 A HN 1.986 nan 8.150 nan 0.000 1.169 6109 G N -1.369 107.450 108.800 0.031 0.000 2.960 6109 G HA2 0.229 4.189 3.960 -0.000 0.000 0.267 6109 G HA3 0.229 4.189 3.960 -0.000 0.000 0.267 6109 G C -0.321 174.563 174.900 -0.027 0.000 1.492 6109 G CA 0.208 45.299 45.100 -0.016 0.000 0.953 6109 G HN 2.018 nan 8.290 nan 0.000 0.555 6110 L N 0.085 121.278 121.223 -0.051 0.000 2.312 6110 L HA 0.732 5.072 4.340 -0.000 0.000 0.281 6110 L C 0.231 177.050 176.870 -0.086 0.000 1.070 6110 L CA -0.828 53.977 54.840 -0.058 0.000 0.805 6110 L CB 1.600 43.620 42.059 -0.064 0.000 1.174 6110 L HN 0.675 nan 8.230 nan 0.000 0.434 6111 N N 3.112 121.767 118.700 -0.074 0.000 2.800 6111 N HA 0.232 4.972 4.740 -0.000 0.000 0.240 6111 N C 0.657 176.108 175.510 -0.098 0.000 1.096 6111 N CA -0.311 52.674 53.050 -0.108 0.000 0.877 6111 N CB 0.943 39.404 38.487 -0.044 0.000 1.138 6111 N HN 0.515 nan 8.380 nan 0.000 0.509 6112 V N 2.527 122.327 119.914 -0.189 0.000 2.453 6112 V HA -0.246 3.874 4.120 -0.000 0.000 0.252 6112 V C 1.485 177.623 176.094 0.073 0.000 1.068 6112 V CA 1.545 63.785 62.300 -0.100 0.000 1.070 6112 V CB -0.815 30.914 31.823 -0.157 0.000 0.664 6112 V HN 0.581 nan 8.190 nan 0.000 0.461 6113 F N 1.179 121.127 119.950 -0.004 0.000 2.146 6113 F HA -0.107 4.420 4.527 -0.000 0.000 0.298 6113 F C 2.665 178.463 175.800 -0.003 0.000 1.096 6113 F CA 1.774 59.772 58.000 -0.004 0.000 1.275 6113 F CB -1.583 37.415 39.000 -0.004 0.000 1.008 6113 F HN 0.383 nan 8.300 nan 0.000 0.480 6114 T N -3.750 110.916 114.554 0.187 0.000 3.044 6114 T HA 0.370 4.720 4.350 -0.000 0.000 0.250 6114 T C 1.562 176.299 174.700 0.061 0.000 1.081 6114 T CA 0.476 62.636 62.100 0.100 0.000 1.040 6114 T CB -0.121 68.793 68.868 0.077 0.000 0.962 6114 T HN 0.421 nan 8.240 nan 0.000 0.506 6115 G N 1.191 110.022 108.800 0.052 0.000 2.295 6115 G HA2 0.199 4.159 3.960 -0.000 0.000 0.287 6115 G HA3 0.199 4.159 3.960 -0.000 0.000 0.287 6115 G C 0.112 175.021 174.900 0.015 0.000 1.055 6115 G CA -0.056 45.060 45.100 0.027 0.000 0.922 6115 G HN 1.442 nan 8.290 nan 0.000 0.503 6116 A N -1.699 121.128 122.820 0.011 0.000 2.608 6116 A HA 0.943 5.263 4.320 -0.000 0.000 0.292 6116 A C 0.309 177.895 177.584 0.002 0.000 1.066 6116 A CA 0.048 52.090 52.037 0.008 0.000 0.676 6116 A CB 0.881 19.889 19.000 0.013 0.000 1.277 6116 A HN 1.942 nan 8.150 nan 0.000 0.413 6117 V N -0.647 119.269 119.914 0.003 0.000 3.209 6117 V HA 0.515 4.635 4.120 -0.000 0.000 0.305 6117 V C 0.173 176.271 176.094 0.006 0.000 1.127 6117 V CA 0.366 62.669 62.300 0.004 0.000 1.235 6117 V CB 0.180 32.009 31.823 0.011 0.000 0.987 6117 V HN 0.941 nan 8.190 nan 0.000 0.499 6118 E N 0.673 120.877 120.200 0.006 0.000 2.296 6118 E HA 0.383 4.733 4.350 -0.000 0.000 0.224 6118 E C -1.413 175.192 176.600 0.010 0.000 0.949 6118 E CA -0.597 55.808 56.400 0.008 0.000 0.879 6118 E CB 0.823 30.527 29.700 0.008 0.000 1.922 6118 E HN 0.877 nan 8.360 nan 0.000 0.437 6119 D N 1.262 121.668 120.400 0.009 0.000 2.441 6119 D HA 0.187 4.827 4.640 -0.000 0.000 0.231 6119 D C 0.870 177.174 176.300 0.008 0.000 1.073 6119 D CA -0.304 53.702 54.000 0.009 0.000 0.850 6119 D CB 0.802 41.607 40.800 0.008 0.000 1.062 6119 D HN 0.188 nan 8.370 nan 0.000 0.524 6120 M N 1.947 121.552 119.600 0.007 0.000 2.108 6120 M HA -0.146 4.334 4.480 -0.000 0.000 0.261 6120 M C 2.280 178.583 176.300 0.005 0.000 1.066 6120 M CA 0.859 56.160 55.300 0.001 0.000 1.107 6120 M CB -1.094 31.507 32.600 0.001 0.000 1.356 6120 M HN 0.547 nan 8.290 nan 0.000 0.406 6121 C N 0.447 119.752 119.300 0.008 0.000 2.453 6121 C HA -0.170 4.290 4.460 -0.000 0.000 0.277 6121 C C 2.713 177.708 174.990 0.009 0.000 1.262 6121 C CA 1.497 60.520 59.018 0.008 0.000 1.718 6121 C CB -0.857 26.888 27.740 0.008 0.000 2.031 6121 C HN 0.596 nan 8.230 nan 0.000 0.480 6122 E N 1.153 121.358 120.200 0.009 0.000 2.118 6122 E HA -0.157 4.193 4.350 -0.000 0.000 0.195 6122 E C 1.612 178.220 176.600 0.014 0.000 0.992 6122 E CA 1.682 58.088 56.400 0.010 0.000 0.804 6122 E CB -0.373 29.332 29.700 0.010 0.000 0.741 6122 E HN 0.632 nan 8.360 nan 0.000 0.458 6123 N N -0.435 118.274 118.700 0.015 0.000 2.398 6123 N HA 0.070 4.810 4.740 -0.000 0.000 0.188 6123 N C 0.547 176.069 175.510 0.020 0.000 1.122 6123 N CA 0.899 53.961 53.050 0.021 0.000 0.866 6123 N CB 0.527 39.028 38.487 0.022 0.000 0.970 6123 N HN 0.287 nan 8.380 nan 0.000 0.462 6124 G N 0.540 109.349 108.800 0.014 0.000 2.283 6124 G HA2 -0.263 3.697 3.960 -0.000 0.000 0.280 6124 G HA3 -0.263 3.697 3.960 -0.000 0.000 0.280 6124 G C -0.091 174.815 174.900 0.010 0.000 1.029 6124 G CA 0.261 45.368 45.100 0.013 0.000 0.840 6124 G HN 0.200 nan 8.290 nan 0.000 0.505 6125 V N 1.063 120.979 119.914 0.002 0.000 2.222 6125 V HA 0.478 4.598 4.120 -0.000 0.000 0.253 6125 V C 0.792 176.877 176.094 -0.015 0.000 1.210 6125 V CA 0.068 62.361 62.300 -0.012 0.000 1.079 6125 V CB 0.541 32.343 31.823 -0.034 0.000 1.265 6125 V HN 0.961 nan 8.190 nan 0.000 0.494 6126 V N 1.914 121.824 119.914 -0.007 0.000 2.914 6126 V HA 0.888 5.008 4.120 -0.000 0.000 0.314 6126 V C -0.575 175.515 176.094 -0.007 0.000 1.084 6126 V CA -0.851 61.446 62.300 -0.006 0.000 0.963 6126 V CB 2.296 34.119 31.823 0.000 0.000 1.025 6126 V HN 0.777 nan 8.190 nan 0.000 0.432 6127 E N 2.151 122.347 120.200 -0.008 0.000 2.336 6127 E HA 0.723 5.073 4.350 -0.000 0.000 0.267 6127 E C -3.108 173.490 176.600 -0.002 0.000 0.906 6127 E CA -2.475 53.922 56.400 -0.006 0.000 0.781 6127 E CB 2.130 31.823 29.700 -0.012 0.000 1.261 6127 E HN 0.494 nan 8.360 nan 0.000 0.436 6128 P HA -0.032 nan 4.420 nan 0.000 0.269 6128 P C 0.335 177.636 177.300 0.001 0.000 1.209 6128 P CA -0.410 62.691 63.100 0.002 0.000 0.776 6128 P CB 0.524 32.225 31.700 0.002 0.000 0.876 6129 L N 3.410 124.635 121.223 0.004 0.000 2.093 6129 L HA -0.106 4.234 4.340 -0.000 0.000 0.208 6129 L C 2.202 179.075 176.870 0.006 0.000 1.085 6129 L CA 1.714 56.557 54.840 0.005 0.000 0.755 6129 L CB -0.628 41.436 42.059 0.008 0.000 0.904 6129 L HN 0.268 nan 8.230 nan 0.000 0.435 6130 R N -1.441 119.062 120.500 0.005 0.000 2.127 6130 R HA -0.148 4.192 4.340 -0.000 0.000 0.238 6130 R C 2.103 178.405 176.300 0.004 0.000 1.134 6130 R CA 1.415 57.519 56.100 0.005 0.000 0.975 6130 R CB -0.598 29.705 30.300 0.005 0.000 0.865 6130 R HN 0.293 nan 8.270 nan 0.000 0.447 6131 V N 1.361 121.276 119.914 0.002 0.000 2.255 6131 V HA -0.272 3.848 4.120 -0.000 0.000 0.247 6131 V C 2.290 178.383 176.094 -0.001 0.000 1.051 6131 V CA 1.710 64.010 62.300 -0.001 0.000 1.018 6131 V CB -0.332 31.489 31.823 -0.004 0.000 0.641 6131 V HN 0.221 nan 8.190 nan 0.000 0.445 6132 K N -0.263 120.136 120.400 -0.001 0.000 2.103 6132 K HA -0.061 4.259 4.320 -0.000 0.000 0.204 6132 K C 2.233 178.838 176.600 0.008 0.000 1.052 6132 K CA 1.568 57.855 56.287 -0.001 0.000 0.945 6132 K CB -0.705 31.794 32.500 -0.002 0.000 0.722 6132 K HN 0.501 nan 8.250 nan 0.000 0.443 6133 T N 1.344 115.905 114.554 0.011 0.000 2.737 6133 T HA -0.155 4.195 4.350 -0.000 0.000 0.265 6133 T C 1.928 176.638 174.700 0.017 0.000 1.038 6133 T CA 1.436 63.546 62.100 0.017 0.000 1.144 6133 T CB -0.075 68.802 68.868 0.015 0.000 0.866 6133 T HN 0.157 nan 8.240 nan 0.000 0.434 6134 Q N 1.314 121.121 119.800 0.012 0.000 2.079 6134 Q HA 0.119 4.459 4.340 -0.000 0.000 0.200 6134 Q C 2.312 178.319 176.000 0.012 0.000 0.974 6134 Q CA 1.665 57.475 55.803 0.012 0.000 0.840 6134 Q CB -0.741 28.002 28.738 0.008 0.000 0.898 6134 Q HN 0.471 nan 8.270 nan 0.000 0.430 6135 A N 0.402 123.226 122.820 0.008 0.000 1.892 6135 A HA -0.204 4.116 4.320 -0.000 0.000 0.218 6135 A C 2.145 179.735 177.584 0.010 0.000 1.188 6135 A CA 1.781 53.820 52.037 0.003 0.000 0.631 6135 A CB -0.878 18.119 19.000 -0.005 0.000 0.822 6135 A HN 0.488 nan 8.150 nan 0.000 0.447 6136 I N -1.086 119.496 120.570 0.020 0.000 2.202 6136 I HA -0.273 3.897 4.170 -0.000 0.000 0.242 6136 I C 2.783 178.931 176.117 0.052 0.000 1.091 6136 I CA 1.775 63.101 61.300 0.043 0.000 1.368 6136 I CB -0.347 37.694 38.000 0.067 0.000 1.058 6136 I HN 0.439 nan 8.210 nan 0.000 0.410 6137 Q N 1.101 120.924 119.800 0.039 0.000 1.975 6137 Q HA -0.191 4.149 4.340 -0.000 0.000 0.205 6137 Q C 2.295 178.315 176.000 0.034 0.000 0.990 6137 Q CA 2.630 58.455 55.803 0.036 0.000 0.845 6137 Q CB -0.375 28.378 28.738 0.025 0.000 0.913 6137 Q HN 0.327 nan 8.270 nan 0.000 0.420 6138 S N 0.192 115.907 115.700 0.025 0.000 2.383 6138 S HA -0.159 4.311 4.470 -0.000 0.000 0.229 6138 S C 1.898 176.512 174.600 0.024 0.000 1.030 6138 S CA 0.988 59.200 58.200 0.021 0.000 1.002 6138 S CB -0.667 62.542 63.200 0.014 0.000 0.829 6138 S HN 0.587 nan 8.310 nan 0.000 0.467 6139 A N 1.550 124.384 122.820 0.024 0.000 1.877 6139 A HA 0.099 4.419 4.320 -0.000 0.000 0.216 6139 A C 2.363 179.972 177.584 0.041 0.000 1.186 6139 A CA 1.728 53.778 52.037 0.021 0.000 0.620 6139 A CB -1.082 17.922 19.000 0.005 0.000 0.822 6139 A HN 0.524 nan 8.150 nan 0.000 0.443 6140 A N -0.319 122.540 122.820 0.065 0.000 1.930 6140 A HA -0.126 4.194 4.320 -0.000 0.000 0.217 6140 A C 1.885 179.518 177.584 0.081 0.000 1.175 6140 A CA 1.514 53.611 52.037 0.099 0.000 0.627 6140 A CB -0.504 18.569 19.000 0.123 0.000 0.815 6140 A HN 0.626 nan 8.150 nan 0.000 0.443 6141 E N 0.054 120.288 120.200 0.058 0.000 2.153 6141 E HA -0.108 4.242 4.350 -0.000 0.000 0.194 6141 E C 2.165 178.791 176.600 0.044 0.000 0.988 6141 E CA 1.243 57.671 56.400 0.047 0.000 0.811 6141 E CB -0.094 29.626 29.700 0.034 0.000 0.746 6141 E HN 0.605 nan 8.360 nan 0.000 0.466 6142 S N 0.179 115.904 115.700 0.041 0.000 2.377 6142 S HA -0.084 4.386 4.470 -0.000 0.000 0.223 6142 S C 2.106 176.734 174.600 0.047 0.000 1.030 6142 S CA 1.144 59.366 58.200 0.036 0.000 0.970 6142 S CB -0.157 63.059 63.200 0.027 0.000 0.830 6142 S HN 0.255 nan 8.310 nan 0.000 0.473 6143 T N 1.975 116.567 114.554 0.063 0.000 2.788 6143 T HA -0.084 4.266 4.350 -0.000 0.000 0.268 6143 T C 1.786 176.545 174.700 0.098 0.000 1.044 6143 T CA 1.048 63.200 62.100 0.087 0.000 1.139 6143 T CB -0.236 68.705 68.868 0.121 0.000 0.867 6143 T HN 0.329 nan 8.240 nan 0.000 0.454 6144 E N 1.016 121.272 120.200 0.093 0.000 2.150 6144 E HA -0.119 4.231 4.350 -0.000 0.000 0.193 6144 E C 2.155 178.788 176.600 0.055 0.000 0.985 6144 E CA 0.710 57.158 56.400 0.080 0.000 0.814 6144 E CB -0.258 29.484 29.700 0.070 0.000 0.752 6144 E HN 0.341 nan 8.360 nan 0.000 0.466 6145 M N 0.652 120.281 119.600 0.047 0.000 2.117 6145 M HA -0.152 4.328 4.480 -0.000 0.000 0.262 6145 M C 2.144 178.465 176.300 0.035 0.000 1.065 6145 M CA 1.180 56.501 55.300 0.036 0.000 1.114 6145 M CB -0.492 32.126 32.600 0.031 0.000 1.361 6145 M HN 0.127 nan 8.290 nan 0.000 0.408 6146 L N -0.104 121.143 121.223 0.040 0.000 2.056 6146 L HA -0.202 4.138 4.340 -0.000 0.000 0.207 6146 L C 2.464 179.356 176.870 0.037 0.000 1.078 6146 L CA 0.852 55.714 54.840 0.036 0.000 0.749 6146 L CB -0.747 41.335 42.059 0.039 0.000 0.901 6146 L HN 0.294 nan 8.230 nan 0.000 0.433 6147 L N -0.379 120.872 121.223 0.048 0.000 2.191 6147 L HA -0.192 4.148 4.340 -0.000 0.000 0.212 6147 L C 2.770 179.659 176.870 0.031 0.000 1.103 6147 L CA 0.989 55.853 54.840 0.041 0.000 0.769 6147 L CB -0.426 41.664 42.059 0.052 0.000 0.908 6147 L HN 0.261 nan 8.230 nan 0.000 0.438 6148 R N 0.571 121.091 120.500 0.033 0.000 2.148 6148 R HA -0.013 4.327 4.340 -0.000 0.000 0.223 6148 R C 0.768 177.083 176.300 0.026 0.000 1.088 6148 R CA 0.312 56.430 56.100 0.030 0.000 0.985 6148 R CB -0.009 30.307 30.300 0.028 0.000 0.880 6148 R HN 0.228 nan 8.270 nan 0.000 0.451 6149 I N 2.167 122.752 120.570 0.024 0.000 2.517 6149 I HA -0.054 4.116 4.170 -0.000 0.000 0.285 6149 I C -0.000 176.127 176.117 0.018 0.000 1.106 6149 I CA 0.477 61.790 61.300 0.021 0.000 1.402 6149 I CB 0.963 38.976 38.000 0.021 0.000 1.399 6149 I HN 0.100 nan 8.210 nan 0.000 0.535 6150 D N 4.169 124.579 120.400 0.017 0.000 2.535 6150 D HA 0.146 4.786 4.640 -0.000 0.000 0.229 6150 D C -0.498 175.810 176.300 0.013 0.000 1.238 6150 D CA 0.244 54.251 54.000 0.011 0.000 0.824 6150 D CB 0.684 41.490 40.800 0.010 0.000 1.045 6150 D HN 0.466 nan 8.370 nan 0.000 0.500 6151 D N 0.473 120.884 120.400 0.018 0.000 2.931 6151 D HA 0.184 4.824 4.640 -0.000 0.000 0.215 6151 D C -1.445 174.871 176.300 0.027 0.000 1.297 6151 D CA -0.421 53.593 54.000 0.023 0.000 0.892 6151 D CB 2.064 42.876 40.800 0.020 0.000 1.642 6151 D HN -0.322 nan 8.370 nan 0.000 0.560 6152 V N 5.011 124.947 119.914 0.036 0.000 2.443 6152 V HA 0.516 4.636 4.120 -0.000 0.000 0.293 6152 V C 0.027 176.155 176.094 0.057 0.000 1.021 6152 V CA -0.568 61.758 62.300 0.042 0.000 0.848 6152 V CB 1.587 33.435 31.823 0.041 0.000 0.998 6152 V HN 0.519 nan 8.190 nan 0.000 0.424 6153 I N 4.540 125.139 120.570 0.049 0.000 2.437 6153 I HA 0.668 4.838 4.170 -0.000 0.000 0.279 6153 I C 0.222 176.369 176.117 0.050 0.000 1.028 6153 I CA -0.403 60.929 61.300 0.052 0.000 1.142 6153 I CB 1.608 39.629 38.000 0.035 0.000 1.266 6153 I HN 0.660 nan 8.210 nan 0.000 0.461 6154 A N 5.146 128.008 122.820 0.070 0.000 2.287 6154 A HA 0.859 5.179 4.320 -0.000 0.000 0.317 6154 A C 0.297 177.909 177.584 0.048 0.000 1.220 6154 A CA -0.437 51.632 52.037 0.053 0.000 0.835 6154 A CB 0.965 19.996 19.000 0.053 0.000 1.180 6154 A HN 0.744 nan 8.150 nan 0.000 0.500 6155 A N 1.982 124.816 122.820 0.023 0.000 2.429 6155 A HA 0.468 4.788 4.320 -0.000 0.000 0.242 6155 A C 0.615 178.200 177.584 0.002 0.000 1.088 6155 A CA 0.177 52.221 52.037 0.012 0.000 0.784 6155 A CB -0.020 18.983 19.000 0.005 0.000 1.038 6155 A HN 0.946 nan 8.150 nan 0.000 0.501 6156 E N 0.000 120.198 120.200 -0.003 0.000 2.725 6156 E HA 0.000 4.350 4.350 -0.000 0.000 0.291 6156 E CA 0.000 56.392 56.400 -0.014 0.000 0.976 6156 E CB 0.000 29.693 29.700 -0.011 0.000 0.812 6156 E HN 0.000 nan 8.360 nan 0.000 0.440