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 3izm_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 0.000 176.084 176.094 -0.017 0.000 1.182 5644 V CA 0.000 62.291 62.300 -0.015 0.000 1.235 5644 V CB 0.000 31.814 31.823 -0.016 0.000 1.184 5645 L N 2.410 123.620 121.223 -0.021 0.000 2.325 5645 L HA 0.621 4.961 4.340 0.000 0.000 0.278 5645 L C -2.351 174.504 176.870 -0.025 0.000 1.023 5645 L CA -1.586 53.239 54.840 -0.026 0.000 0.811 5645 L CB 1.051 43.089 42.059 -0.035 0.000 1.249 5645 L HN 0.158 nan 8.230 nan 0.000 0.431 5646 P HA 0.045 nan 4.420 nan 0.000 0.265 5646 P C -0.582 176.703 177.300 -0.024 0.000 1.193 5646 P CA -0.300 62.788 63.100 -0.021 0.000 0.765 5646 P CB 0.492 32.180 31.700 -0.019 0.000 0.823 5647 E N 2.924 123.112 120.200 -0.020 0.000 2.376 5647 E HA 0.040 4.390 4.350 0.000 0.000 0.266 5647 E C 0.507 177.095 176.600 -0.020 0.000 1.009 5647 E CA 0.621 57.008 56.400 -0.021 0.000 0.902 5647 E CB -0.139 29.552 29.700 -0.015 0.000 0.972 5647 E HN 0.395 nan 8.360 nan 0.000 0.439 5648 N N 1.953 120.638 118.700 -0.025 0.000 2.990 5648 N HA -0.199 4.541 4.740 0.000 0.000 0.163 5648 N C -0.160 175.330 175.510 -0.034 0.000 1.452 5648 N CA 0.654 53.691 53.050 -0.022 0.000 1.624 5648 N CB -1.159 37.319 38.487 -0.015 0.000 1.088 5648 N HN 0.583 nan 8.380 nan 0.000 0.695 5649 M N 2.841 122.415 119.600 -0.043 0.000 2.248 5649 M HA 0.065 4.545 4.480 0.000 0.000 0.345 5649 M C -0.452 175.789 176.300 -0.098 0.000 1.243 5649 M CA 0.666 55.930 55.300 -0.061 0.000 1.090 5649 M CB 0.410 32.976 32.600 -0.057 0.000 1.683 5649 M HN -0.122 nan 8.290 nan 0.000 0.450 5650 K N 5.197 125.520 120.400 -0.129 0.000 2.259 5650 K HA 0.538 4.858 4.320 0.000 0.000 0.252 5650 K C -1.123 175.275 176.600 -0.336 0.000 0.936 5650 K CA -0.575 55.559 56.287 -0.254 0.000 0.810 5650 K CB 2.198 34.572 32.500 -0.209 0.000 1.143 5650 K HN 0.770 nan 8.250 nan 0.000 0.427 5651 R N 2.143 122.332 120.500 -0.519 0.000 2.604 5651 R HA 0.422 4.762 4.340 0.000 0.000 0.281 5651 R C -1.483 174.466 176.300 -0.585 0.000 1.020 5651 R CA -0.530 55.322 56.100 -0.414 0.000 0.899 5651 R CB 1.208 31.389 30.300 -0.198 0.000 1.205 5651 R HN 0.601 nan 8.270 nan 0.000 0.450 5652 Y N 4.284 124.576 120.300 -0.013 0.000 2.512 5652 Y HA 0.594 5.144 4.550 0.000 0.000 0.348 5652 Y C 0.154 176.058 175.900 0.007 0.000 0.990 5652 Y CA -1.073 57.031 58.100 0.006 0.000 1.033 5652 Y CB 2.375 40.851 38.460 0.027 0.000 1.259 5652 Y HN 0.408 nan 8.280 nan 0.000 0.461 5653 M N 0.859 120.556 119.600 0.162 0.000 2.520 5653 M HA 0.773 5.253 4.480 0.000 0.000 0.280 5653 M C 0.052 176.394 176.300 0.070 0.000 1.232 5653 M CA -0.181 55.172 55.300 0.087 0.000 0.892 5653 M CB 1.226 33.853 32.600 0.046 0.000 1.728 5653 M HN 0.898 nan 8.290 nan 0.000 0.475 5654 G N 2.714 111.541 108.800 0.045 0.000 2.622 5654 G HA2 -0.378 3.582 3.960 0.000 0.000 0.307 5654 G HA3 -0.378 3.582 3.960 0.000 0.000 0.307 5654 G C 0.642 175.555 174.900 0.022 0.000 1.226 5654 G CA 1.332 46.446 45.100 0.024 0.000 0.997 5654 G HN 1.189 nan 8.290 nan 0.000 0.551 5655 R N 0.364 120.874 120.500 0.016 0.000 2.096 5655 R HA -0.070 4.270 4.340 0.000 0.000 0.235 5655 R C 2.155 178.467 176.300 0.020 0.000 1.127 5655 R CA 2.199 58.305 56.100 0.009 0.000 0.968 5655 R CB -0.406 29.897 30.300 0.005 0.000 0.861 5655 R HN 0.612 nan 8.270 nan 0.000 0.440 5656 D N 0.044 120.474 120.400 0.050 0.000 2.183 5656 D HA -0.074 4.566 4.640 0.000 0.000 0.203 5656 D C 1.700 178.034 176.300 0.056 0.000 0.969 5656 D CA 1.225 55.267 54.000 0.071 0.000 0.842 5656 D CB -0.060 40.833 40.800 0.156 0.000 0.957 5656 D HN 0.374 nan 8.370 nan 0.000 0.484 5657 A N 1.227 124.106 122.820 0.099 0.000 1.877 5657 A HA -0.191 4.129 4.320 0.000 0.000 0.216 5657 A C 2.155 179.759 177.584 0.034 0.000 1.186 5657 A CA 1.175 53.272 52.037 0.100 0.000 0.620 5657 A CB -0.360 18.707 19.000 0.111 0.000 0.822 5657 A HN 0.067 nan 8.150 nan 0.000 0.443 5658 Q N -0.705 119.105 119.800 0.017 0.000 2.079 5658 Q HA -0.161 4.179 4.340 0.000 0.000 0.200 5658 Q C 2.266 178.250 176.000 -0.026 0.000 0.974 5658 Q CA 1.607 57.408 55.803 -0.003 0.000 0.840 5658 Q CB -0.380 28.352 28.738 -0.010 0.000 0.898 5658 Q HN 0.758 nan 8.270 nan 0.000 0.430 5659 R N -0.158 120.321 120.500 -0.035 0.000 2.066 5659 R HA -0.060 4.280 4.340 0.000 0.000 0.232 5659 R C 2.157 178.395 176.300 -0.103 0.000 1.131 5659 R CA 1.096 57.162 56.100 -0.056 0.000 0.955 5659 R CB 0.049 30.322 30.300 -0.045 0.000 0.851 5659 R HN 0.135 nan 8.270 nan 0.000 0.432 5660 M N 0.764 120.277 119.600 -0.145 0.000 2.229 5660 M HA -0.104 4.376 4.480 0.000 0.000 0.264 5660 M C 1.647 177.786 176.300 -0.268 0.000 1.063 5660 M CA 1.411 56.568 55.300 -0.238 0.000 1.114 5660 M CB -1.096 31.249 32.600 -0.426 0.000 1.387 5660 M HN 0.293 nan 8.290 nan 0.000 0.420 5661 N N 0.223 118.842 118.700 -0.135 0.000 2.171 5661 N HA -0.058 4.682 4.740 0.000 0.000 0.184 5661 N C 1.834 177.265 175.510 -0.132 0.000 1.021 5661 N CA 1.050 54.030 53.050 -0.117 0.000 0.854 5661 N CB 0.083 38.576 38.487 0.009 0.000 0.994 5661 N HN 0.297 nan 8.380 nan 0.000 0.426 5662 I N 0.903 121.419 120.570 -0.091 0.000 2.315 5662 I HA -0.232 3.938 4.170 0.000 0.000 0.248 5662 I C 1.901 177.958 176.117 -0.099 0.000 1.117 5662 I CA 0.707 61.965 61.300 -0.070 0.000 1.404 5662 I CB -0.026 37.949 38.000 -0.042 0.000 1.071 5662 I HN 0.076 nan 8.210 nan 0.000 0.419 5663 L N 0.715 121.859 121.223 -0.133 0.000 2.005 5663 L HA -0.143 4.197 4.340 0.000 0.000 0.207 5663 L C 2.729 179.494 176.870 -0.176 0.000 1.072 5663 L CA 2.191 56.948 54.840 -0.139 0.000 0.744 5663 L CB -1.313 40.660 42.059 -0.143 0.000 0.895 5663 L HN 0.191 nan 8.230 nan 0.000 0.433 5664 A N -0.576 122.067 122.820 -0.295 0.000 1.917 5664 A HA -0.170 4.150 4.320 0.000 0.000 0.219 5664 A C 2.398 179.870 177.584 -0.188 0.000 1.182 5664 A CA 1.959 53.792 52.037 -0.341 0.000 0.633 5664 A CB -1.419 17.131 19.000 -0.750 0.000 0.819 5664 A HN 0.463 nan 8.150 nan 0.000 0.448 5665 G N -0.903 107.805 108.800 -0.154 0.000 2.404 5665 G HA2 -0.241 3.720 3.960 0.000 0.000 0.215 5665 G HA3 -0.241 3.720 3.960 0.000 0.000 0.215 5665 G C 1.751 176.609 174.900 -0.071 0.000 1.174 5665 G CA 1.021 46.069 45.100 -0.086 0.000 0.780 5665 G HN 0.566 nan 8.290 nan 0.000 0.537 5666 R N 0.015 120.470 120.500 -0.074 0.000 2.092 5666 R HA 0.068 4.408 4.340 0.000 0.000 0.231 5666 R C 2.541 178.806 176.300 -0.059 0.000 1.119 5666 R CA 0.910 56.974 56.100 -0.061 0.000 0.970 5666 R CB -0.314 29.952 30.300 -0.057 0.000 0.864 5666 R HN 0.424 nan 8.270 nan 0.000 0.440 5667 I N 0.730 121.258 120.570 -0.070 0.000 2.208 5667 I HA -0.311 3.859 4.170 0.000 0.000 0.245 5667 I C 2.043 178.131 176.117 -0.047 0.000 1.097 5667 I CA 0.922 62.186 61.300 -0.059 0.000 1.363 5667 I CB -0.211 37.747 38.000 -0.070 0.000 1.051 5667 I HN 0.212 nan 8.210 nan 0.000 0.413 5668 I N 1.027 121.568 120.570 -0.049 0.000 2.179 5668 I HA -0.276 3.894 4.170 0.000 0.000 0.242 5668 I C 2.857 178.954 176.117 -0.033 0.000 1.088 5668 I CA 1.769 63.047 61.300 -0.035 0.000 1.357 5668 I CB -1.530 36.451 38.000 -0.032 0.000 1.051 5668 I HN 0.192 nan 8.210 nan 0.000 0.409 5669 A N 0.281 123.078 122.820 -0.039 0.000 1.933 5669 A HA -0.186 4.134 4.320 0.000 0.000 0.218 5669 A C 2.159 179.721 177.584 -0.036 0.000 1.175 5669 A CA 1.371 53.385 52.037 -0.038 0.000 0.628 5669 A CB -0.414 18.560 19.000 -0.044 0.000 0.814 5669 A HN 0.369 nan 8.150 nan 0.000 0.444 5670 E N -0.459 119.719 120.200 -0.037 0.000 2.106 5670 E HA -0.105 4.245 4.350 0.000 0.000 0.192 5670 E C 2.085 178.668 176.600 -0.029 0.000 0.984 5670 E CA 1.613 57.993 56.400 -0.033 0.000 0.806 5670 E CB -0.655 29.025 29.700 -0.034 0.000 0.750 5670 E HN 0.601 nan 8.360 nan 0.000 0.458 5671 T N 1.046 115.584 114.554 -0.027 0.000 2.770 5671 T HA -0.091 4.259 4.350 0.000 0.000 0.263 5671 T C 2.124 176.812 174.700 -0.020 0.000 1.039 5671 T CA 1.637 63.725 62.100 -0.022 0.000 1.142 5671 T CB -0.111 68.746 68.868 -0.018 0.000 0.868 5671 T HN 0.200 nan 8.240 nan 0.000 0.435 5672 V N 1.881 121.782 119.914 -0.022 0.000 2.788 5672 V HA 0.049 4.169 4.120 0.000 0.000 0.251 5672 V C 2.346 178.426 176.094 -0.023 0.000 1.068 5672 V CA 1.127 63.415 62.300 -0.020 0.000 1.090 5672 V CB -0.891 30.921 31.823 -0.019 0.000 0.710 5672 V HN 0.464 nan 8.190 nan 0.000 0.467 5673 R N 2.720 123.203 120.500 -0.028 0.000 2.193 5673 R HA -0.079 4.261 4.340 0.000 0.000 0.229 5673 R C 2.010 178.292 176.300 -0.030 0.000 1.110 5673 R CA 1.668 57.749 56.100 -0.031 0.000 0.988 5673 R CB -1.066 29.213 30.300 -0.035 0.000 0.871 5673 R HN 0.681 nan 8.270 nan 0.000 0.458 5674 S N 0.187 115.870 115.700 -0.027 0.000 2.555 5674 S HA -0.077 4.393 4.470 0.000 0.000 0.230 5674 S C 1.695 176.279 174.600 -0.026 0.000 0.978 5674 S CA 0.788 58.971 58.200 -0.027 0.000 0.934 5674 S CB 0.060 63.245 63.200 -0.024 0.000 0.766 5674 S HN 0.588 nan 8.310 nan 0.000 0.533 5675 T N -1.170 113.370 114.554 -0.024 0.000 3.014 5675 T HA 0.328 4.678 4.350 0.000 0.000 0.250 5675 T C 0.391 175.077 174.700 -0.024 0.000 1.060 5675 T CA -0.452 61.636 62.100 -0.021 0.000 1.040 5675 T CB -0.438 68.421 68.868 -0.015 0.000 0.971 5675 T HN 0.266 nan 8.240 nan 0.000 0.497 5676 L N 2.760 123.966 121.223 -0.028 0.000 2.410 5676 L HA 0.557 4.897 4.340 0.000 0.000 0.273 5676 L C 0.636 177.482 176.870 -0.040 0.000 1.152 5676 L CA 1.556 56.379 54.840 -0.030 0.000 0.855 5676 L CB -0.372 41.668 42.059 -0.031 0.000 1.129 5676 L HN 0.735 nan 8.230 nan 0.000 0.463 5677 G N 3.940 112.716 108.800 -0.040 0.000 2.662 5677 G HA2 -0.127 3.833 3.960 0.000 0.000 0.686 5677 G HA3 -0.127 3.833 3.960 0.000 0.000 0.686 5677 G C -2.146 172.706 174.900 -0.079 0.000 1.271 5677 G CA -0.459 44.604 45.100 -0.062 0.000 0.816 5677 G HN 0.488 nan 8.290 nan 0.000 0.608 5678 P HA -0.023 nan 4.420 nan 0.000 0.217 5678 P C 1.443 178.651 177.300 -0.154 0.000 1.148 5678 P CA 1.489 64.476 63.100 -0.187 0.000 0.828 5678 P CB 0.047 31.440 31.700 -0.512 0.000 0.783 5679 K N -1.010 119.300 120.400 -0.150 0.000 2.410 5679 K HA 0.243 4.563 4.320 0.000 0.000 0.200 5679 K C 1.036 177.595 176.600 -0.069 0.000 1.023 5679 K CA -0.182 56.042 56.287 -0.105 0.000 1.149 5679 K CB -0.128 32.305 32.500 -0.111 0.000 0.859 5679 K HN 0.040 nan 8.250 nan 0.000 0.514 5680 G N 0.534 109.297 108.800 -0.061 0.000 2.527 5680 G HA2 0.199 4.159 3.960 0.000 0.000 0.248 5680 G HA3 0.199 4.159 3.960 0.000 0.000 0.248 5680 G C -0.019 174.862 174.900 -0.032 0.000 1.231 5680 G CA -0.420 44.654 45.100 -0.042 0.000 0.838 5680 G HN -0.054 nan 8.290 nan 0.000 0.570 5681 M N 0.157 119.741 119.600 -0.026 0.000 2.531 5681 M HA 0.427 4.907 4.480 0.000 0.000 0.262 5681 M C -0.608 175.683 176.300 -0.015 0.000 1.168 5681 M CA -0.546 54.742 55.300 -0.020 0.000 0.926 5681 M CB 1.384 33.971 32.600 -0.021 0.000 1.445 5681 M HN 0.351 nan 8.290 nan 0.000 0.531 5682 D N 0.331 120.723 120.400 -0.013 0.000 2.374 5682 D HA 0.505 5.145 4.640 0.000 0.000 0.239 5682 D C -0.624 175.669 176.300 -0.011 0.000 0.991 5682 D CA -0.415 53.580 54.000 -0.009 0.000 0.960 5682 D CB 1.383 42.180 40.800 -0.005 0.000 1.284 5682 D HN 0.100 nan 8.370 nan 0.000 0.512 5683 K N 0.681 121.077 120.400 -0.007 0.000 2.259 5683 K HA 0.503 4.823 4.320 0.000 0.000 0.249 5683 K C -0.679 175.918 176.600 -0.007 0.000 0.942 5683 K CA -0.669 55.613 56.287 -0.007 0.000 0.816 5683 K CB 2.321 34.818 32.500 -0.004 0.000 1.155 5683 K HN 0.438 nan 8.250 nan 0.000 0.428 5684 M N 3.624 123.217 119.600 -0.012 0.000 2.046 5684 M HA 0.287 4.767 4.480 0.000 0.000 0.309 5684 M C -1.683 174.615 176.300 -0.004 0.000 0.935 5684 M CA -0.962 54.329 55.300 -0.015 0.000 0.915 5684 M CB 0.531 33.110 32.600 -0.035 0.000 1.474 5684 M HN 0.348 nan 8.290 nan 0.000 0.415 5685 L N 5.997 127.225 121.223 0.009 0.000 2.280 5685 L HA 0.529 4.869 4.340 0.000 0.000 0.287 5685 L C -0.859 176.024 176.870 0.021 0.000 1.023 5685 L CA -0.331 54.517 54.840 0.013 0.000 0.819 5685 L CB 1.758 43.826 42.059 0.016 0.000 1.212 5685 L HN 0.408 nan 8.230 nan 0.000 0.420 5686 V N 2.829 122.752 119.914 0.015 0.000 2.378 5686 V HA 0.342 4.462 4.120 0.000 0.000 0.288 5686 V C -0.151 175.954 176.094 0.017 0.000 1.016 5686 V CA -0.959 61.353 62.300 0.019 0.000 0.840 5686 V CB 1.395 33.226 31.823 0.013 0.000 0.994 5686 V HN 0.798 nan 8.190 nan 0.000 0.431 5687 D N 3.554 123.967 120.400 0.021 0.000 2.356 5687 D HA -0.007 4.633 4.640 0.000 0.000 0.258 5687 D C 1.042 177.351 176.300 0.014 0.000 1.279 5687 D CA -0.218 53.792 54.000 0.017 0.000 1.016 5687 D CB 0.479 41.290 40.800 0.017 0.000 1.107 5687 D HN 0.562 nan 8.370 nan 0.000 0.544 5688 D N -0.887 119.521 120.400 0.012 0.000 2.371 5688 D HA -0.121 4.519 4.640 0.000 0.000 0.221 5688 D C 1.596 177.902 176.300 0.011 0.000 0.986 5688 D CA 0.494 54.500 54.000 0.011 0.000 0.899 5688 D CB -0.166 40.640 40.800 0.010 0.000 0.902 5688 D HN 0.389 nan 8.370 nan 0.000 0.530 5689 L N -0.941 120.289 121.223 0.012 0.000 2.590 5689 L HA 0.322 4.662 4.340 0.000 0.000 0.227 5689 L C 1.748 178.627 176.870 0.015 0.000 1.099 5689 L CA 0.493 55.341 54.840 0.012 0.000 0.872 5689 L CB 0.339 42.405 42.059 0.012 0.000 1.088 5689 L HN 0.286 nan 8.230 nan 0.000 0.479 5690 G N -0.231 108.580 108.800 0.017 0.000 2.201 5690 G HA2 -0.247 3.713 3.960 0.000 0.000 0.212 5690 G HA3 -0.247 3.713 3.960 0.000 0.000 0.212 5690 G C 0.061 174.980 174.900 0.030 0.000 0.994 5690 G CA -0.063 45.050 45.100 0.020 0.000 0.644 5690 G HN 0.305 nan 8.290 nan 0.000 0.508 5691 D N 1.279 121.698 120.400 0.032 0.000 2.434 5691 D HA 0.376 5.016 4.640 0.000 0.000 0.252 5691 D C 0.523 176.859 176.300 0.062 0.000 1.185 5691 D CA 0.240 54.267 54.000 0.044 0.000 0.886 5691 D CB 1.087 41.906 40.800 0.031 0.000 1.148 5691 D HN 0.230 nan 8.370 nan 0.000 0.483 5692 V N 4.881 124.859 119.914 0.107 0.000 2.370 5692 V HA 0.261 4.381 4.120 0.000 0.000 0.279 5692 V C 0.229 176.465 176.094 0.237 0.000 1.029 5692 V CA -0.834 61.547 62.300 0.134 0.000 0.870 5692 V CB 1.620 33.505 31.823 0.103 0.000 0.984 5692 V HN 0.327 nan 8.190 nan 0.000 0.451 5693 V N 6.016 126.010 119.914 0.134 0.000 2.357 5693 V HA 0.422 4.542 4.120 0.000 0.000 0.284 5693 V C -0.162 175.996 176.094 0.107 0.000 1.018 5693 V CA -0.507 61.875 62.300 0.137 0.000 0.841 5693 V CB 1.802 33.667 31.823 0.071 0.000 0.991 5693 V HN 0.606 nan 8.190 nan 0.000 0.437 5694 V N 4.671 124.689 119.914 0.173 0.000 2.350 5694 V HA 0.710 4.830 4.120 0.000 0.000 0.285 5694 V C 0.074 176.218 176.094 0.083 0.000 1.014 5694 V CA 0.027 62.372 62.300 0.075 0.000 0.831 5694 V CB 1.552 33.365 31.823 -0.017 0.000 1.000 5694 V HN 0.979 nan 8.190 nan 0.000 0.433 5695 T N 2.717 117.297 114.554 0.043 0.000 2.792 5695 T HA 0.334 4.684 4.350 0.000 0.000 0.303 5695 T C 0.151 174.861 174.700 0.017 0.000 1.310 5695 T CA -0.342 61.778 62.100 0.034 0.000 1.007 5695 T CB 2.140 71.028 68.868 0.032 0.000 1.335 5695 T HN 0.560 nan 8.240 nan 0.000 0.504 5696 N N 0.283 118.991 118.700 0.014 0.000 2.257 5696 N HA 0.118 4.858 4.740 0.000 0.000 0.200 5696 N C -0.806 174.706 175.510 0.004 0.000 1.163 5696 N CA 0.082 53.136 53.050 0.006 0.000 0.891 5696 N CB 0.463 38.953 38.487 0.005 0.000 1.067 5696 N HN 0.610 nan 8.380 nan 0.000 0.497 5697 D N -0.007 120.397 120.400 0.008 0.000 2.434 5697 D HA 0.157 4.797 4.640 0.000 0.000 0.252 5697 D C 1.370 177.672 176.300 0.003 0.000 1.185 5697 D CA 0.211 54.214 54.000 0.005 0.000 0.886 5697 D CB 1.115 41.919 40.800 0.008 0.000 1.148 5697 D HN 0.250 nan 8.370 nan 0.000 0.483 5698 G N 1.626 110.426 108.800 -0.001 0.000 2.421 5698 G HA2 -0.241 3.719 3.960 0.000 0.000 0.216 5698 G HA3 -0.241 3.719 3.960 0.000 0.000 0.216 5698 G C 1.536 176.436 174.900 -0.001 0.000 1.171 5698 G CA 0.327 45.425 45.100 -0.003 0.000 0.775 5698 G HN 0.461 nan 8.290 nan 0.000 0.543 5699 V N 0.826 120.740 119.914 0.000 0.000 2.490 5699 V HA -0.129 3.991 4.120 0.000 0.000 0.250 5699 V C 2.925 179.021 176.094 0.005 0.000 1.061 5699 V CA 2.878 65.179 62.300 0.002 0.000 1.064 5699 V CB -0.615 31.209 31.823 0.002 0.000 0.670 5699 V HN 0.403 nan 8.190 nan 0.000 0.461 5700 T N 0.541 115.098 114.554 0.006 0.000 2.812 5700 T HA -0.046 4.304 4.350 0.000 0.000 0.264 5700 T C 1.759 176.465 174.700 0.009 0.000 1.042 5700 T CA 1.915 64.020 62.100 0.008 0.000 1.140 5700 T CB -0.262 68.612 68.868 0.010 0.000 0.870 5700 T HN 0.474 nan 8.240 nan 0.000 0.445 5701 I N 0.652 121.227 120.570 0.008 0.000 2.264 5701 I HA -0.150 4.020 4.170 0.000 0.000 0.248 5701 I C 2.016 178.136 176.117 0.007 0.000 1.111 5701 I CA 0.917 62.221 61.300 0.007 0.000 1.382 5701 I CB -0.273 37.730 38.000 0.003 0.000 1.060 5701 I HN 0.163 nan 8.210 nan 0.000 0.418 5702 L N 0.231 121.457 121.223 0.005 0.000 2.109 5702 L HA -0.101 4.239 4.340 0.000 0.000 0.207 5702 L C 2.524 179.399 176.870 0.009 0.000 1.086 5702 L CA 1.618 56.462 54.840 0.006 0.000 0.760 5702 L CB -0.766 41.295 42.059 0.004 0.000 0.910 5702 L HN 0.095 nan 8.230 nan 0.000 0.437 5703 R N -0.851 119.654 120.500 0.009 0.000 2.075 5703 R HA -0.097 4.243 4.340 0.000 0.000 0.232 5703 R C 2.034 178.341 176.300 0.011 0.000 1.126 5703 R CA 0.957 57.063 56.100 0.010 0.000 0.963 5703 R CB -0.111 30.194 30.300 0.009 0.000 0.858 5703 R HN 0.320 nan 8.270 nan 0.000 0.435 5704 E N 0.875 121.081 120.200 0.012 0.000 2.086 5704 E HA -0.060 4.290 4.350 0.000 0.000 0.190 5704 E C 1.223 177.830 176.600 0.013 0.000 0.975 5704 E CA 0.501 56.909 56.400 0.013 0.000 0.813 5704 E CB -0.125 29.584 29.700 0.015 0.000 0.768 5704 E HN 0.355 nan 8.360 nan 0.000 0.457 5705 M N -0.036 119.571 119.600 0.012 0.000 2.240 5705 M HA 0.091 4.571 4.480 0.000 0.000 0.317 5705 M C 0.509 176.818 176.300 0.014 0.000 1.087 5705 M CA 0.357 55.664 55.300 0.012 0.000 1.176 5705 M CB 0.540 33.146 32.600 0.010 0.000 1.439 5705 M HN -0.257 nan 8.290 nan 0.000 0.452 5706 S N 2.205 117.914 115.700 0.015 0.000 2.473 5706 S HA 0.440 4.910 4.470 0.000 0.000 0.312 5706 S C -0.730 173.884 174.600 0.023 0.000 1.087 5706 S CA -0.790 57.421 58.200 0.018 0.000 1.077 5706 S CB -0.282 62.929 63.200 0.017 0.000 1.065 5706 S HN 0.516 nan 8.310 nan 0.000 0.510 5707 V N 5.665 125.596 119.914 0.027 0.000 2.439 5707 V HA 0.400 4.520 4.120 0.000 0.000 0.282 5707 V C 0.720 176.842 176.094 0.047 0.000 1.039 5707 V CA -0.380 61.943 62.300 0.038 0.000 0.913 5707 V CB 1.638 33.484 31.823 0.038 0.000 0.983 5707 V HN 0.779 nan 8.190 nan 0.000 0.460 5708 E N 1.085 121.324 120.200 0.065 0.000 2.256 5708 E HA 0.084 4.434 4.350 0.000 0.000 0.198 5708 E C 0.727 177.376 176.600 0.082 0.000 0.908 5708 E CA 0.072 56.509 56.400 0.062 0.000 0.915 5708 E CB -0.000 29.735 29.700 0.058 0.000 0.890 5708 E HN 0.692 nan 8.360 nan 0.000 0.484 5709 H N 2.795 121.882 119.070 0.028 0.000 2.886 5709 H HA 0.024 4.580 4.556 0.000 0.000 0.329 5709 H C -1.713 173.631 175.328 0.027 0.000 1.044 5709 H CA -1.267 54.800 56.048 0.033 0.000 1.456 5709 H CB 1.447 31.213 29.762 0.007 0.000 1.464 5709 H HN -0.190 nan 8.280 nan 0.000 0.573 5710 P HA -0.125 nan 4.420 nan 0.000 0.218 5710 P C 1.049 178.467 177.300 0.197 0.000 1.148 5710 P CA 1.939 65.094 63.100 0.091 0.000 0.822 5710 P CB 0.146 31.849 31.700 0.004 0.000 0.784 5711 A N 0.005 123.084 122.820 0.431 0.000 1.898 5711 A HA -0.044 4.276 4.320 0.000 0.000 0.216 5711 A C 2.315 179.949 177.584 0.084 0.000 1.181 5711 A CA 1.882 54.041 52.037 0.203 0.000 0.620 5711 A CB -1.539 17.512 19.000 0.086 0.000 0.819 5711 A HN 0.187 nan 8.150 nan 0.000 0.442 5712 A N -0.116 122.751 122.820 0.080 0.000 1.972 5712 A HA -0.136 4.184 4.320 0.000 0.000 0.219 5712 A C 2.071 179.682 177.584 0.045 0.000 1.169 5712 A CA 1.728 53.782 52.037 0.029 0.000 0.635 5712 A CB -0.390 18.624 19.000 0.022 0.000 0.810 5712 A HN 0.546 nan 8.150 nan 0.000 0.446 5713 K N -0.975 119.468 120.400 0.070 0.000 2.097 5713 K HA -0.057 4.263 4.320 0.000 0.000 0.205 5713 K C 1.889 178.513 176.600 0.041 0.000 1.050 5713 K CA 1.340 57.657 56.287 0.051 0.000 0.938 5713 K CB -0.206 32.326 32.500 0.053 0.000 0.718 5713 K HN 0.358 nan 8.250 nan 0.000 0.442 5714 M N 0.591 120.220 119.600 0.048 0.000 2.254 5714 M HA -0.066 4.414 4.480 0.000 0.000 0.265 5714 M C 2.150 178.466 176.300 0.026 0.000 1.066 5714 M CA 1.130 56.452 55.300 0.037 0.000 1.123 5714 M CB -0.654 31.972 32.600 0.043 0.000 1.388 5714 M HN 0.204 nan 8.290 nan 0.000 0.425 5715 L N 0.109 121.345 121.223 0.021 0.000 2.083 5715 L HA -0.201 4.139 4.340 0.000 0.000 0.209 5715 L C 2.215 179.091 176.870 0.009 0.000 1.083 5715 L CA 1.037 55.883 54.840 0.010 0.000 0.752 5715 L CB -0.164 41.894 42.059 -0.002 0.000 0.899 5715 L HN 0.189 nan 8.230 nan 0.000 0.433 5716 I N -0.448 120.130 120.570 0.013 0.000 2.286 5716 I HA -0.283 3.887 4.170 0.000 0.000 0.248 5716 I C 2.439 178.563 176.117 0.012 0.000 1.115 5716 I CA 1.007 62.314 61.300 0.012 0.000 1.392 5716 I CB -0.318 37.691 38.000 0.015 0.000 1.065 5716 I HN 0.278 nan 8.210 nan 0.000 0.418 5717 E N 0.470 120.679 120.200 0.015 0.000 2.110 5717 E HA -0.156 4.194 4.350 0.000 0.000 0.193 5717 E C 2.431 179.038 176.600 0.012 0.000 0.988 5717 E CA 1.110 57.519 56.400 0.014 0.000 0.804 5717 E CB -0.273 29.437 29.700 0.018 0.000 0.745 5717 E HN 0.357 nan 8.360 nan 0.000 0.458 5718 V N 1.539 121.460 119.914 0.012 0.000 2.358 5718 V HA -0.232 3.888 4.120 0.000 0.000 0.246 5718 V C 2.462 178.560 176.094 0.006 0.000 1.047 5718 V CA 1.773 64.079 62.300 0.010 0.000 1.035 5718 V CB -0.820 31.008 31.823 0.009 0.000 0.658 5718 V HN 0.242 nan 8.190 nan 0.000 0.452 5719 A N -0.353 122.470 122.820 0.004 0.000 1.933 5719 A HA -0.217 4.103 4.320 0.000 0.000 0.218 5719 A C 2.284 179.870 177.584 0.004 0.000 1.175 5719 A CA 1.802 53.840 52.037 0.002 0.000 0.628 5719 A CB -0.397 18.604 19.000 0.001 0.000 0.814 5719 A HN 0.543 nan 8.150 nan 0.000 0.444 5720 K N -0.939 119.464 120.400 0.006 0.000 2.148 5720 K HA -0.062 4.258 4.320 0.000 0.000 0.204 5720 K C 1.987 178.591 176.600 0.005 0.000 1.050 5720 K CA 1.516 57.806 56.287 0.006 0.000 0.942 5720 K CB -0.278 32.227 32.500 0.007 0.000 0.724 5720 K HN 0.450 nan 8.250 nan 0.000 0.446 5721 T N 1.419 115.976 114.554 0.006 0.000 2.777 5721 T HA -0.115 4.235 4.350 0.000 0.000 0.266 5721 T C 1.810 176.513 174.700 0.005 0.000 1.040 5721 T CA 1.006 63.110 62.100 0.006 0.000 1.141 5721 T CB -0.032 68.841 68.868 0.008 0.000 0.868 5721 T HN 0.158 nan 8.240 nan 0.000 0.444 5722 Q N 0.744 120.546 119.800 0.004 0.000 2.124 5722 Q HA -0.098 4.242 4.340 0.000 0.000 0.202 5722 Q C 2.349 178.350 176.000 0.002 0.000 0.977 5722 Q CA 1.322 57.126 55.803 0.002 0.000 0.850 5722 Q CB -0.408 28.331 28.738 0.000 0.000 0.901 5722 Q HN 0.553 nan 8.270 nan 0.000 0.429 5723 E N 1.371 121.572 120.200 0.002 0.000 2.051 5723 E HA -0.172 4.178 4.350 0.000 0.000 0.192 5723 E C 1.899 178.500 176.600 0.002 0.000 0.991 5723 E CA 1.388 57.789 56.400 0.002 0.000 0.799 5723 E CB -0.077 29.625 29.700 0.002 0.000 0.748 5723 E HN 0.054 nan 8.360 nan 0.000 0.449 5724 K N 0.056 120.458 120.400 0.002 0.000 2.057 5724 K HA -0.146 4.174 4.320 0.000 0.000 0.206 5724 K C 1.785 178.386 176.600 0.001 0.000 1.050 5724 K CA 1.377 57.665 56.287 0.001 0.000 0.935 5724 K CB 0.009 32.510 32.500 0.002 0.000 0.715 5724 K HN 0.155 nan 8.250 nan 0.000 0.439 5725 E N 0.070 120.272 120.200 0.002 0.000 2.033 5725 E HA -0.094 4.256 4.350 0.000 0.000 0.189 5725 E C 1.994 178.594 176.600 0.001 0.000 0.979 5725 E CA 1.684 58.085 56.400 0.002 0.000 0.802 5725 E CB 0.150 29.852 29.700 0.003 0.000 0.763 5725 E HN 0.339 nan 8.360 nan 0.000 0.449 5726 V N -4.822 115.092 119.914 0.001 0.000 3.562 5726 V HA 0.520 4.640 4.120 0.000 0.000 0.270 5726 V C 1.389 177.484 176.094 0.001 0.000 1.418 5726 V CA 0.855 63.156 62.300 0.001 0.000 1.033 5726 V CB 0.646 32.470 31.823 0.002 0.000 0.820 5726 V HN 0.301 nan 8.190 nan 0.000 0.441 5727 G N 0.762 109.563 108.800 0.001 0.000 4.365 5727 G HA2 -0.277 3.683 3.960 0.000 0.000 0.214 5727 G HA3 -0.277 3.683 3.960 0.000 0.000 0.214 5727 G C 0.161 175.062 174.900 0.002 0.000 1.450 5727 G CA 0.506 45.606 45.100 0.001 0.000 0.937 5727 G HN 0.627 nan 8.290 nan 0.000 0.625 5728 D N 1.170 121.572 120.400 0.003 0.000 2.506 5728 D HA 0.485 5.125 4.640 0.000 0.000 0.272 5728 D C 1.556 177.856 176.300 0.001 0.000 1.214 5728 D CA 1.171 55.173 54.000 0.003 0.000 1.067 5728 D CB 0.657 41.460 40.800 0.006 0.000 1.117 5728 D HN 1.622 nan 8.370 nan 0.000 0.578 5729 G N -0.494 108.306 108.800 -0.000 0.000 2.162 5729 G HA2 -0.341 3.619 3.960 0.000 0.000 0.260 5729 G HA3 -0.341 3.619 3.960 0.000 0.000 0.260 5729 G C 1.091 175.987 174.900 -0.007 0.000 0.976 5729 G CA 1.635 46.732 45.100 -0.004 0.000 0.655 5729 G HN 0.614 nan 8.290 nan 0.000 0.533 5730 T N -2.487 112.063 114.554 -0.006 0.000 2.674 5730 T HA -0.122 4.229 4.350 0.000 0.000 0.265 5730 T C 2.241 176.934 174.700 -0.012 0.000 1.039 5730 T CA 2.558 64.654 62.100 -0.007 0.000 1.150 5730 T CB -0.810 68.056 68.868 -0.004 0.000 0.864 5730 T HN 0.355 nan 8.240 nan 0.000 0.427 5731 T N 2.447 116.993 114.554 -0.012 0.000 2.720 5731 T HA -0.127 4.223 4.350 0.000 0.000 0.268 5731 T C 2.435 177.120 174.700 -0.025 0.000 1.037 5731 T CA 2.146 64.235 62.100 -0.018 0.000 1.144 5731 T CB -1.040 67.819 68.868 -0.016 0.000 0.864 5731 T HN 0.844 nan 8.240 nan 0.000 0.444 5732 T N 0.768 115.308 114.554 -0.024 0.000 2.867 5732 T HA 0.100 4.450 4.350 0.000 0.000 0.268 5732 T C 2.246 176.922 174.700 -0.039 0.000 1.057 5732 T CA 1.018 63.099 62.100 -0.033 0.000 1.136 5732 T CB -0.495 68.356 68.868 -0.028 0.000 0.874 5732 T HN 0.335 nan 8.240 nan 0.000 0.466 5733 A N 1.085 123.887 122.820 -0.030 0.000 1.930 5733 A HA 0.128 4.448 4.320 0.000 0.000 0.217 5733 A C 2.607 180.169 177.584 -0.035 0.000 1.175 5733 A CA 1.474 53.492 52.037 -0.031 0.000 0.627 5733 A CB -0.960 18.029 19.000 -0.018 0.000 0.815 5733 A HN 0.426 nan 8.150 nan 0.000 0.443 5734 V N -0.544 119.351 119.914 -0.031 0.000 2.358 5734 V HA -0.191 3.929 4.120 0.000 0.000 0.246 5734 V C 2.547 178.615 176.094 -0.044 0.000 1.047 5734 V CA 1.847 64.128 62.300 -0.032 0.000 1.035 5734 V CB -0.723 31.085 31.823 -0.025 0.000 0.658 5734 V HN 0.353 nan 8.190 nan 0.000 0.452 5735 V N -0.568 119.318 119.914 -0.047 0.000 2.307 5735 V HA -0.196 3.924 4.120 0.000 0.000 0.245 5735 V C 2.449 178.499 176.094 -0.074 0.000 1.045 5735 V CA 2.048 64.315 62.300 -0.055 0.000 1.024 5735 V CB -0.256 31.536 31.823 -0.051 0.000 0.651 5735 V HN 0.415 nan 8.190 nan 0.000 0.449 5736 V N -0.005 119.858 119.914 -0.086 0.000 2.515 5736 V HA -0.169 3.952 4.120 0.000 0.000 0.250 5736 V C 2.504 178.513 176.094 -0.142 0.000 1.058 5736 V CA 1.958 64.182 62.300 -0.126 0.000 1.064 5736 V CB -0.210 31.530 31.823 -0.138 0.000 0.675 5736 V HN 0.521 nan 8.190 nan 0.000 0.461 5737 A N -0.224 122.535 122.820 -0.100 0.000 1.929 5737 A HA 0.036 4.356 4.320 0.000 0.000 0.216 5737 A C 2.325 179.869 177.584 -0.067 0.000 1.176 5737 A CA 1.584 53.573 52.037 -0.080 0.000 0.628 5737 A CB -1.132 17.840 19.000 -0.046 0.000 0.816 5737 A HN 0.586 nan 8.150 nan 0.000 0.444 5738 G N -0.372 108.390 108.800 -0.064 0.000 2.418 5738 G HA2 -0.219 3.741 3.960 0.000 0.000 0.217 5738 G HA3 -0.219 3.741 3.960 0.000 0.000 0.217 5738 G C 1.472 176.337 174.900 -0.059 0.000 1.158 5738 G CA 1.310 46.376 45.100 -0.055 0.000 0.771 5738 G HN 0.555 nan 8.290 nan 0.000 0.545 5739 E N -0.039 120.114 120.200 -0.077 0.000 2.107 5739 E HA -0.034 4.316 4.350 0.000 0.000 0.191 5739 E C 2.279 178.825 176.600 -0.090 0.000 0.982 5739 E CA 0.383 56.733 56.400 -0.082 0.000 0.809 5739 E CB -0.394 29.245 29.700 -0.101 0.000 0.756 5739 E HN 0.251 nan 8.360 nan 0.000 0.459 5740 L N 0.154 121.298 121.223 -0.131 0.000 2.083 5740 L HA -0.087 4.253 4.340 0.000 0.000 0.209 5740 L C 1.994 178.861 176.870 -0.006 0.000 1.083 5740 L CA 1.596 56.337 54.840 -0.165 0.000 0.752 5740 L CB -0.369 41.540 42.059 -0.251 0.000 0.899 5740 L HN 0.262 nan 8.230 nan 0.000 0.433 5741 L N -1.184 120.042 121.223 0.005 0.000 2.109 5741 L HA -0.150 4.190 4.340 0.000 0.000 0.207 5741 L C 2.690 179.578 176.870 0.029 0.000 1.086 5741 L CA 1.011 55.876 54.840 0.041 0.000 0.760 5741 L CB -0.483 41.580 42.059 0.007 0.000 0.910 5741 L HN 0.242 nan 8.230 nan 0.000 0.437 5742 R N 0.717 121.217 120.500 -0.000 0.000 2.091 5742 R HA -0.145 4.195 4.340 0.000 0.000 0.238 5742 R C 2.199 178.510 176.300 0.020 0.000 1.136 5742 R CA 1.479 57.577 56.100 -0.003 0.000 0.959 5742 R CB -0.116 30.172 30.300 -0.022 0.000 0.856 5742 R HN 0.068 nan 8.270 nan 0.000 0.437 5743 K N -0.089 120.332 120.400 0.035 0.000 2.155 5743 K HA 0.083 4.403 4.320 0.000 0.000 0.203 5743 K C 1.922 178.605 176.600 0.139 0.000 1.052 5743 K CA 1.125 57.456 56.287 0.074 0.000 0.948 5743 K CB -0.220 32.319 32.500 0.065 0.000 0.728 5743 K HN 0.291 nan 8.250 nan 0.000 0.448 5744 A N 1.445 124.374 122.820 0.182 0.000 1.933 5744 A HA -0.190 4.130 4.320 0.000 0.000 0.218 5744 A C 2.128 179.747 177.584 0.058 0.000 1.175 5744 A CA 1.615 53.747 52.037 0.158 0.000 0.628 5744 A CB -0.350 18.768 19.000 0.197 0.000 0.814 5744 A HN 0.420 nan 8.150 nan 0.000 0.444 5745 E N -0.407 119.818 120.200 0.042 0.000 2.106 5745 E HA -0.195 4.155 4.350 0.000 0.000 0.192 5745 E C 1.739 178.346 176.600 0.012 0.000 0.984 5745 E CA 1.029 57.438 56.400 0.014 0.000 0.806 5745 E CB -0.036 29.666 29.700 0.003 0.000 0.750 5745 E HN 0.524 nan 8.360 nan 0.000 0.458 5746 E N 0.502 120.717 120.200 0.024 0.000 2.110 5746 E HA -0.173 4.178 4.350 0.000 0.000 0.193 5746 E C 2.243 178.854 176.600 0.019 0.000 0.988 5746 E CA 0.732 57.145 56.400 0.021 0.000 0.804 5746 E CB -0.144 29.573 29.700 0.029 0.000 0.745 5746 E HN 0.403 nan 8.360 nan 0.000 0.458 5747 L N 0.060 121.299 121.223 0.026 0.000 2.093 5747 L HA -0.163 4.177 4.340 0.000 0.000 0.208 5747 L C 2.293 179.157 176.870 -0.010 0.000 1.085 5747 L CA 0.361 55.206 54.840 0.010 0.000 0.755 5747 L CB -0.284 41.776 42.059 0.000 0.000 0.904 5747 L HN 0.120 nan 8.230 nan 0.000 0.435 5748 L N -0.182 121.033 121.223 -0.014 0.000 2.141 5748 L HA -0.208 4.132 4.340 0.000 0.000 0.209 5748 L C 2.071 178.931 176.870 -0.017 0.000 1.094 5748 L CA 1.666 56.491 54.840 -0.025 0.000 0.763 5748 L CB -0.800 41.243 42.059 -0.027 0.000 0.908 5748 L HN 0.226 nan 8.230 nan 0.000 0.437 5749 D N -1.370 119.026 120.400 -0.007 0.000 2.178 5749 D HA -0.169 4.471 4.640 0.000 0.000 0.202 5749 D C 1.900 178.199 176.300 -0.002 0.000 0.974 5749 D CA 0.755 54.752 54.000 -0.004 0.000 0.841 5749 D CB 0.224 41.024 40.800 -0.000 0.000 0.953 5749 D HN 0.217 nan 8.370 nan 0.000 0.478 5750 Q N 0.033 119.833 119.800 -0.000 0.000 2.444 5750 Q HA 0.056 4.396 4.340 0.000 0.000 0.206 5750 Q C 0.035 176.035 176.000 0.001 0.000 0.948 5750 Q CA 0.209 56.014 55.803 0.002 0.000 0.946 5750 Q CB 0.148 28.890 28.738 0.007 0.000 1.027 5750 Q HN 0.363 nan 8.270 nan 0.000 0.513 5751 N N -0.212 118.485 118.700 -0.005 0.000 2.780 5751 N HA -0.135 4.605 4.740 0.000 0.000 0.248 5751 N C -0.904 174.607 175.510 0.002 0.000 1.102 5751 N CA 0.404 53.450 53.050 -0.005 0.000 0.697 5751 N CB -1.768 36.721 38.487 0.003 0.000 1.028 5751 N HN 0.008 nan 8.380 nan 0.000 0.554 5752 V N 1.770 121.680 119.914 -0.006 0.000 2.408 5752 V HA 0.062 4.182 4.120 0.000 0.000 0.267 5752 V C 1.131 177.223 176.094 -0.004 0.000 1.047 5752 V CA -0.569 61.733 62.300 0.003 0.000 0.937 5752 V CB 1.125 32.941 31.823 -0.013 0.000 0.999 5752 V HN 0.287 nan 8.190 nan 0.000 0.472 5753 H N 8.314 127.362 119.070 -0.036 0.000 3.001 5753 H HA 0.026 4.582 4.556 0.000 0.000 0.334 5753 H C -1.665 173.632 175.328 -0.051 0.000 1.034 5753 H CA -1.130 54.898 56.048 -0.035 0.000 1.420 5753 H CB 1.604 31.349 29.762 -0.028 0.000 1.405 5753 H HN 0.383 nan 8.280 nan 0.000 0.593 5754 P HA -0.187 nan 4.420 nan 0.000 0.217 5754 P C 1.414 178.738 177.300 0.041 0.000 1.148 5754 P CA 2.559 65.594 63.100 -0.109 0.000 0.834 5754 P CB 0.022 31.622 31.700 -0.168 0.000 0.783 5755 T N -4.116 110.607 114.554 0.282 0.000 3.023 5755 T HA 0.000 4.350 4.350 0.000 0.000 0.266 5755 T C 1.753 176.481 174.700 0.047 0.000 1.093 5755 T CA 0.677 62.864 62.100 0.146 0.000 1.129 5755 T CB -1.041 67.895 68.868 0.114 0.000 0.899 5755 T HN 0.059 nan 8.240 nan 0.000 0.491 5756 I N 0.812 121.416 120.570 0.058 0.000 2.333 5756 I HA -0.048 4.122 4.170 0.000 0.000 0.246 5756 I C 2.622 178.685 176.117 -0.090 0.000 1.106 5756 I CA 0.475 61.768 61.300 -0.011 0.000 1.411 5756 I CB -0.331 37.675 38.000 0.010 0.000 1.082 5756 I HN 0.093 nan 8.210 nan 0.000 0.420 5757 V N 1.270 121.095 119.914 -0.148 0.000 2.255 5757 V HA -0.250 3.870 4.120 0.000 0.000 0.247 5757 V C 2.562 178.314 176.094 -0.569 0.000 1.051 5757 V CA 2.200 64.274 62.300 -0.377 0.000 1.018 5757 V CB -0.667 30.940 31.823 -0.361 0.000 0.641 5757 V HN 0.482 nan 8.190 nan 0.000 0.445 5758 V N -1.334 118.407 119.914 -0.289 0.000 2.809 5758 V HA -0.145 3.975 4.120 0.000 0.000 0.256 5758 V C 2.238 178.308 176.094 -0.040 0.000 1.080 5758 V CA 2.137 64.358 62.300 -0.132 0.000 1.102 5758 V CB -0.759 31.052 31.823 -0.021 0.000 0.705 5758 V HN 0.554 nan 8.190 nan 0.000 0.475 5759 K N 1.308 121.674 120.400 -0.057 0.000 2.025 5759 K HA -0.002 4.318 4.320 0.000 0.000 0.207 5759 K C 2.203 178.804 176.600 0.002 0.000 1.049 5759 K CA 1.666 57.942 56.287 -0.018 0.000 0.933 5759 K CB -0.815 31.671 32.500 -0.022 0.000 0.714 5759 K HN 0.526 nan 8.250 nan 0.000 0.438 5760 G N -0.150 108.643 108.800 -0.011 0.000 2.408 5760 G HA2 -0.217 3.743 3.960 0.000 0.000 0.217 5760 G HA3 -0.217 3.743 3.960 0.000 0.000 0.217 5760 G C 1.144 176.138 174.900 0.157 0.000 1.150 5760 G CA 0.556 45.694 45.100 0.064 0.000 0.776 5760 G HN 0.251 nan 8.290 nan 0.000 0.542 5761 Y N 0.396 120.672 120.300 -0.040 0.000 2.242 5761 Y HA -0.051 4.499 4.550 -0.000 0.000 0.291 5761 Y C 2.862 178.606 175.900 -0.260 0.000 1.137 5761 Y CA 1.009 59.036 58.100 -0.121 0.000 1.181 5761 Y CB -0.865 37.657 38.460 0.104 0.000 0.989 5761 Y HN 0.273 nan 8.280 nan 0.000 0.527 5762 Q N 0.311 120.142 119.800 0.052 0.000 2.083 5762 Q HA -0.038 4.302 4.340 0.000 0.000 0.198 5762 Q C 2.365 178.325 176.000 -0.067 0.000 0.969 5762 Q CA 1.689 57.487 55.803 -0.007 0.000 0.838 5762 Q CB -0.473 28.278 28.738 0.021 0.000 0.900 5762 Q HN 0.314 nan 8.270 nan 0.000 0.436 5763 A N 0.368 123.174 122.820 -0.024 0.000 1.877 5763 A HA -0.038 4.282 4.320 0.000 0.000 0.216 5763 A C 2.289 179.843 177.584 -0.050 0.000 1.186 5763 A CA 1.979 54.041 52.037 0.041 0.000 0.620 5763 A CB -1.223 17.872 19.000 0.158 0.000 0.822 5763 A HN 0.505 nan 8.150 nan 0.000 0.443 5764 A N -0.337 122.372 122.820 -0.185 0.000 1.930 5764 A HA 0.216 4.536 4.320 0.000 0.000 0.217 5764 A C 2.461 179.668 177.584 -0.628 0.000 1.175 5764 A CA 1.925 53.709 52.037 -0.421 0.000 0.627 5764 A CB -0.891 17.730 19.000 -0.632 0.000 0.815 5764 A HN 1.025 nan 8.150 nan 0.000 0.443 5765 A N -1.127 121.255 122.820 -0.730 0.000 1.930 5765 A HA -0.142 4.178 4.320 0.000 0.000 0.217 5765 A C 2.119 179.600 177.584 -0.172 0.000 1.175 5765 A CA 1.521 53.344 52.037 -0.357 0.000 0.627 5765 A CB -0.396 18.480 19.000 -0.207 0.000 0.815 5765 A HN 0.477 nan 8.150 nan 0.000 0.443 5766 Q N -0.295 119.401 119.800 -0.172 0.000 2.084 5766 Q HA -0.173 4.168 4.340 0.000 0.000 0.202 5766 Q C 2.054 177.956 176.000 -0.163 0.000 0.978 5766 Q CA 1.868 57.598 55.803 -0.123 0.000 0.844 5766 Q CB -0.369 28.316 28.738 -0.089 0.000 0.898 5766 Q HN 0.613 nan 8.270 nan 0.000 0.426 5767 K N 0.979 121.211 120.400 -0.280 0.000 2.097 5767 K HA 0.011 4.331 4.320 0.000 0.000 0.205 5767 K C 1.832 178.306 176.600 -0.210 0.000 1.050 5767 K CA 1.206 57.279 56.287 -0.357 0.000 0.938 5767 K CB -0.448 31.578 32.500 -0.790 0.000 0.718 5767 K HN 0.122 nan 8.250 nan 0.000 0.442 5768 A N 0.618 123.345 122.820 -0.155 0.000 1.933 5768 A HA -0.210 4.110 4.320 0.000 0.000 0.218 5768 A C 2.079 179.647 177.584 -0.026 0.000 1.175 5768 A CA 1.693 53.706 52.037 -0.040 0.000 0.628 5768 A CB -0.516 18.525 19.000 0.067 0.000 0.814 5768 A HN 0.510 nan 8.150 nan 0.000 0.444 5769 Q N -0.632 119.145 119.800 -0.039 0.000 2.079 5769 Q HA -0.190 4.150 4.340 0.000 0.000 0.200 5769 Q C 1.980 177.961 176.000 -0.031 0.000 0.974 5769 Q CA 1.604 57.392 55.803 -0.025 0.000 0.840 5769 Q CB -0.180 28.543 28.738 -0.026 0.000 0.898 5769 Q HN 0.774 nan 8.270 nan 0.000 0.430 5770 E N 0.524 120.692 120.200 -0.053 0.000 2.106 5770 E HA -0.157 4.194 4.350 0.000 0.000 0.192 5770 E C 2.045 178.623 176.600 -0.036 0.000 0.984 5770 E CA 0.738 57.109 56.400 -0.048 0.000 0.806 5770 E CB -0.026 29.633 29.700 -0.069 0.000 0.750 5770 E HN 0.307 nan 8.360 nan 0.000 0.458 5771 L N 0.566 121.764 121.223 -0.042 0.000 2.056 5771 L HA -0.191 4.149 4.340 0.000 0.000 0.207 5771 L C 2.435 179.304 176.870 -0.003 0.000 1.078 5771 L CA 0.891 55.719 54.840 -0.020 0.000 0.749 5771 L CB -0.325 41.722 42.059 -0.019 0.000 0.901 5771 L HN 0.169 nan 8.230 nan 0.000 0.433 5772 L N -0.444 120.778 121.223 -0.002 0.000 2.056 5772 L HA -0.205 4.135 4.340 0.000 0.000 0.207 5772 L C 2.598 179.469 176.870 0.003 0.000 1.078 5772 L CA 1.336 56.179 54.840 0.006 0.000 0.749 5772 L CB -0.429 41.634 42.059 0.007 0.000 0.901 5772 L HN 0.206 nan 8.230 nan 0.000 0.433 5773 K N -0.731 119.667 120.400 -0.003 0.000 2.148 5773 K HA -0.098 4.223 4.320 0.000 0.000 0.204 5773 K C 2.050 178.649 176.600 -0.002 0.000 1.050 5773 K CA 1.530 57.815 56.287 -0.003 0.000 0.942 5773 K CB -0.169 32.326 32.500 -0.007 0.000 0.724 5773 K HN 0.276 nan 8.250 nan 0.000 0.446 5774 T N 1.944 116.496 114.554 -0.003 0.000 2.777 5774 T HA -0.072 4.278 4.350 0.000 0.000 0.266 5774 T C 1.859 176.561 174.700 0.003 0.000 1.040 5774 T CA 1.262 63.362 62.100 -0.001 0.000 1.141 5774 T CB -0.127 68.739 68.868 -0.002 0.000 0.868 5774 T HN 0.385 nan 8.240 nan 0.000 0.444 5775 I N -0.325 120.250 120.570 0.008 0.000 3.578 5775 I HA 0.451 4.621 4.170 0.000 0.000 0.295 5775 I C 1.036 177.159 176.117 0.009 0.000 1.280 5775 I CA -0.554 60.753 61.300 0.011 0.000 1.347 5775 I CB -0.458 37.557 38.000 0.024 0.000 1.051 5775 I HN -0.055 nan 8.210 nan 0.000 0.460 5776 A N 1.579 124.403 122.820 0.007 0.000 2.548 5776 A HA 0.101 4.421 4.320 0.000 0.000 0.247 5776 A C 0.161 177.747 177.584 0.004 0.000 1.067 5776 A CA -0.015 52.025 52.037 0.006 0.000 0.757 5776 A CB -0.281 18.721 19.000 0.003 0.000 0.996 5776 A HN 0.642 nan 8.150 nan 0.000 0.504 5777 C N 3.612 122.914 119.300 0.004 0.000 2.265 5777 C HA 0.473 4.933 4.460 0.000 0.000 0.332 5777 C C 0.494 175.484 174.990 0.001 0.000 1.248 5777 C CA -0.585 58.434 59.018 0.002 0.000 1.727 5777 C CB -0.799 26.942 27.740 0.002 0.000 2.348 5777 C HN 0.930 nan 8.230 nan 0.000 0.519 5778 E N 3.843 124.043 120.200 -0.000 0.000 2.316 5778 E HA 0.498 4.848 4.350 0.000 0.000 0.275 5778 E C -0.294 176.306 176.600 -0.001 0.000 1.029 5778 E CA -0.200 56.199 56.400 -0.001 0.000 0.871 5778 E CB 0.860 30.559 29.700 -0.001 0.000 1.022 5778 E HN 0.727 nan 8.360 nan 0.000 0.418 5779 V N 0.976 120.889 119.914 -0.001 0.000 3.102 5779 V HA 0.733 4.853 4.120 0.000 0.000 0.312 5779 V C 0.362 176.455 176.094 -0.002 0.000 1.135 5779 V CA -0.784 61.514 62.300 -0.002 0.000 1.022 5779 V CB 1.533 33.355 31.823 -0.002 0.000 1.056 5779 V HN 0.714 nan 8.190 nan 0.000 0.436 5780 G N 0.520 109.319 108.800 -0.003 0.000 2.343 5780 G HA2 0.466 4.426 3.960 0.000 0.000 0.254 5780 G HA3 0.466 4.426 3.960 0.000 0.000 0.254 5780 G C 0.986 175.884 174.900 -0.003 0.000 1.277 5780 G CA 0.173 45.271 45.100 -0.003 0.000 0.909 5780 G HN 1.658 nan 8.290 nan 0.000 0.502 5781 A N 2.476 125.295 122.820 -0.002 0.000 1.978 5781 A HA -0.099 4.221 4.320 0.000 0.000 0.220 5781 A C 2.068 179.650 177.584 -0.003 0.000 1.170 5781 A CA 1.970 54.005 52.037 -0.002 0.000 0.636 5781 A CB -0.091 18.907 19.000 -0.002 0.000 0.810 5781 A HN 0.764 nan 8.150 nan 0.000 0.448 5782 Q N -0.226 119.573 119.800 -0.002 0.000 2.175 5782 Q HA 0.299 4.639 4.340 0.000 0.000 0.225 5782 Q C -0.415 175.583 176.000 -0.003 0.000 0.837 5782 Q CA 0.164 55.966 55.803 -0.002 0.000 1.032 5782 Q CB -0.678 28.059 28.738 -0.002 0.000 1.137 5782 Q HN 0.430 nan 8.270 nan 0.000 0.483 5783 D N 0.891 121.289 120.400 -0.003 0.000 2.346 5783 D HA 0.044 4.684 4.640 0.000 0.000 0.260 5783 D C 0.997 177.294 176.300 -0.004 0.000 1.252 5783 D CA -0.070 53.928 54.000 -0.003 0.000 0.895 5783 D CB 0.901 41.699 40.800 -0.004 0.000 1.097 5783 D HN 0.078 nan 8.370 nan 0.000 0.489 5784 K N 3.621 124.019 120.400 -0.004 0.000 2.052 5784 K HA -0.304 4.016 4.320 0.000 0.000 0.215 5784 K C 1.553 178.149 176.600 -0.006 0.000 1.053 5784 K CA 2.195 58.479 56.287 -0.005 0.000 0.934 5784 K CB -0.209 32.288 32.500 -0.004 0.000 0.717 5784 K HN 0.676 nan 8.250 nan 0.000 0.450 5785 E N -0.534 119.662 120.200 -0.007 0.000 2.021 5785 E HA -0.227 4.123 4.350 0.000 0.000 0.200 5785 E C 2.011 178.605 176.600 -0.009 0.000 1.015 5785 E CA 1.767 58.162 56.400 -0.008 0.000 0.824 5785 E CB -0.299 29.397 29.700 -0.008 0.000 0.762 5785 E HN 0.345 nan 8.360 nan 0.000 0.454 5786 I N 0.551 121.117 120.570 -0.007 0.000 2.614 5786 I HA -0.189 3.981 4.170 0.000 0.000 0.258 5786 I C 1.947 178.060 176.117 -0.006 0.000 1.189 5786 I CA 0.625 61.921 61.300 -0.007 0.000 1.462 5786 I CB -0.067 37.930 38.000 -0.005 0.000 1.092 5786 I HN 0.213 nan 8.210 nan 0.000 0.442 5787 L N 0.032 121.251 121.223 -0.006 0.000 2.093 5787 L HA -0.171 4.169 4.340 0.000 0.000 0.208 5787 L C 2.653 179.519 176.870 -0.007 0.000 1.085 5787 L CA 2.372 57.208 54.840 -0.006 0.000 0.755 5787 L CB -1.409 40.647 42.059 -0.005 0.000 0.904 5787 L HN 0.476 nan 8.230 nan 0.000 0.435 5788 T N -4.833 109.716 114.554 -0.009 0.000 3.014 5788 T HA -0.080 4.270 4.350 0.000 0.000 0.263 5788 T C 1.909 176.601 174.700 -0.014 0.000 1.078 5788 T CA 0.525 62.618 62.100 -0.011 0.000 1.135 5788 T CB -0.101 68.760 68.868 -0.012 0.000 0.895 5788 T HN 0.189 nan 8.240 nan 0.000 0.480 5789 K N 0.521 120.912 120.400 -0.014 0.000 2.062 5789 K HA 0.118 4.438 4.320 0.000 0.000 0.205 5789 K C 2.136 178.728 176.600 -0.012 0.000 1.051 5789 K CA 0.824 57.101 56.287 -0.016 0.000 0.941 5789 K CB -0.156 32.335 32.500 -0.015 0.000 0.719 5789 K HN 0.235 nan 8.250 nan 0.000 0.440 5790 I N 1.338 121.904 120.570 -0.007 0.000 2.202 5790 I HA -0.202 3.968 4.170 0.000 0.000 0.242 5790 I C 2.501 178.617 176.117 -0.002 0.000 1.091 5790 I CA 1.193 62.491 61.300 -0.003 0.000 1.368 5790 I CB -1.359 36.640 38.000 -0.002 0.000 1.058 5790 I HN 0.092 nan 8.210 nan 0.000 0.410 5791 A N 0.723 123.540 122.820 -0.004 0.000 1.865 5791 A HA -0.247 4.073 4.320 0.000 0.000 0.217 5791 A C 2.412 179.994 177.584 -0.004 0.000 1.191 5791 A CA 1.990 54.025 52.037 -0.004 0.000 0.623 5791 A CB -0.622 18.374 19.000 -0.006 0.000 0.826 5791 A HN 0.353 nan 8.150 nan 0.000 0.444 5792 M N -0.324 119.270 119.600 -0.010 0.000 2.099 5792 M HA -0.132 4.348 4.480 0.000 0.000 0.262 5792 M C 2.438 178.731 176.300 -0.011 0.000 1.067 5792 M CA 2.030 57.321 55.300 -0.016 0.000 1.124 5792 M CB -0.680 31.901 32.600 -0.032 0.000 1.353 5792 M HN 0.718 nan 8.290 nan 0.000 0.410 5793 T N -2.758 111.791 114.554 -0.008 0.000 2.867 5793 T HA -0.098 4.252 4.350 0.000 0.000 0.268 5793 T C 1.888 176.606 174.700 0.030 0.000 1.057 5793 T CA 1.642 63.747 62.100 0.009 0.000 1.136 5793 T CB -0.461 68.413 68.868 0.010 0.000 0.874 5793 T HN 0.286 nan 8.240 nan 0.000 0.466 5794 S N 0.973 116.684 115.700 0.019 0.000 2.355 5794 S HA 0.043 4.513 4.470 0.000 0.000 0.222 5794 S C 1.990 176.607 174.600 0.027 0.000 1.031 5794 S CA 0.859 59.072 58.200 0.022 0.000 0.993 5794 S CB -0.603 62.605 63.200 0.012 0.000 0.859 5794 S HN 0.588 nan 8.310 nan 0.000 0.453 5795 I N 1.720 122.303 120.570 0.022 0.000 2.361 5795 I HA -0.108 4.062 4.170 0.000 0.000 0.251 5795 I C 1.219 177.364 176.117 0.045 0.000 1.133 5795 I CA 0.873 62.188 61.300 0.025 0.000 1.413 5795 I CB -0.908 37.101 38.000 0.015 0.000 1.073 5795 I HN 0.427 nan 8.210 nan 0.000 0.424 5796 T N -0.541 114.051 114.554 0.064 0.000 2.932 5796 T HA 0.315 4.665 4.350 0.000 0.000 0.312 5796 T C 1.168 175.947 174.700 0.130 0.000 1.071 5796 T CA 0.100 62.276 62.100 0.127 0.000 1.128 5796 T CB 1.272 70.258 68.868 0.196 0.000 0.984 5796 T HN 0.604 nan 8.240 nan 0.000 0.549 5797 G N 1.324 110.210 108.800 0.143 0.000 2.176 5797 G HA2 -0.216 3.744 3.960 0.000 0.000 0.253 5797 G HA3 -0.216 3.744 3.960 0.000 0.000 0.253 5797 G C -0.039 174.886 174.900 0.043 0.000 0.979 5797 G CA 0.352 45.494 45.100 0.070 0.000 0.641 5797 G HN 0.913 nan 8.290 nan 0.000 0.530 5798 K N -0.461 119.970 120.400 0.051 0.000 2.185 5798 K HA 0.681 5.001 4.320 0.000 0.000 0.240 5798 K C 1.585 178.208 176.600 0.037 0.000 0.983 5798 K CA 0.124 56.432 56.287 0.036 0.000 0.873 5798 K CB 0.841 33.360 32.500 0.032 0.000 1.118 5798 K HN 0.195 nan 8.250 nan 0.000 0.441 5799 G N 0.200 109.018 108.800 0.029 0.000 2.432 5799 G HA2 -0.226 3.734 3.960 0.000 0.000 0.219 5799 G HA3 -0.226 3.734 3.960 0.000 0.000 0.219 5799 G C 1.179 176.096 174.900 0.029 0.000 1.135 5799 G CA 1.024 46.141 45.100 0.028 0.000 0.767 5799 G HN 0.577 nan 8.290 nan 0.000 0.550 5800 A N 0.503 123.339 122.820 0.027 0.000 2.172 5800 A HA 0.081 4.401 4.320 0.000 0.000 0.216 5800 A C 1.988 179.586 177.584 0.024 0.000 1.154 5800 A CA 1.653 53.704 52.037 0.023 0.000 0.701 5800 A CB -0.338 18.674 19.000 0.019 0.000 0.789 5800 A HN 0.508 nan 8.150 nan 0.000 0.465 5801 E N 1.190 121.410 120.200 0.034 0.000 2.171 5801 E HA -0.297 4.053 4.350 0.000 0.000 0.197 5801 E C 1.880 178.496 176.600 0.026 0.000 0.997 5801 E CA 1.670 58.092 56.400 0.037 0.000 0.810 5801 E CB -0.202 29.539 29.700 0.069 0.000 0.738 5801 E HN 0.802 nan 8.360 nan 0.000 0.467 5802 K N -0.458 119.958 120.400 0.028 0.000 2.218 5802 K HA -0.122 4.198 4.320 0.000 0.000 0.205 5802 K C 1.240 177.848 176.600 0.012 0.000 1.046 5802 K CA 1.492 57.792 56.287 0.021 0.000 0.933 5802 K CB -0.018 32.496 32.500 0.022 0.000 0.728 5802 K HN 0.105 nan 8.250 nan 0.000 0.454 5803 A N 1.803 124.630 122.820 0.011 0.000 2.606 5803 A HA 0.136 4.456 4.320 0.000 0.000 0.290 5803 A C 1.369 178.954 177.584 0.002 0.000 1.174 5803 A CA -0.542 51.498 52.037 0.006 0.000 0.958 5803 A CB -0.015 18.989 19.000 0.008 0.000 1.194 5803 A HN 0.423 nan 8.150 nan 0.000 0.526 5804 K N 0.154 120.554 120.400 0.000 0.000 2.281 5804 K HA -0.188 4.132 4.320 0.000 0.000 0.203 5804 K C 0.863 177.457 176.600 -0.010 0.000 1.046 5804 K CA 1.871 58.155 56.287 -0.004 0.000 0.938 5804 K CB -0.096 32.399 32.500 -0.009 0.000 0.737 5804 K HN 0.317 nan 8.250 nan 0.000 0.458 5805 E N 1.500 121.693 120.200 -0.011 0.000 2.046 5805 E HA -0.137 4.213 4.350 0.000 0.000 0.190 5805 E C 1.915 178.510 176.600 -0.008 0.000 0.982 5805 E CA 1.302 57.694 56.400 -0.013 0.000 0.800 5805 E CB -0.049 29.643 29.700 -0.013 0.000 0.756 5805 E HN 0.267 nan 8.360 nan 0.000 0.449 5806 K N 0.212 120.609 120.400 -0.005 0.000 2.097 5806 K HA -0.066 4.254 4.320 0.000 0.000 0.205 5806 K C 1.656 178.254 176.600 -0.003 0.000 1.050 5806 K CA 0.721 57.006 56.287 -0.003 0.000 0.938 5806 K CB -0.199 32.301 32.500 0.000 0.000 0.718 5806 K HN -0.008 nan 8.250 nan 0.000 0.442 5807 L N 0.516 121.738 121.223 -0.003 0.000 2.056 5807 L HA 0.015 4.355 4.340 0.000 0.000 0.207 5807 L C 2.283 179.150 176.870 -0.005 0.000 1.078 5807 L CA 1.975 56.813 54.840 -0.003 0.000 0.749 5807 L CB -1.183 40.876 42.059 -0.000 0.000 0.901 5807 L HN 0.269 nan 8.230 nan 0.000 0.433 5808 A N -0.971 121.846 122.820 -0.006 0.000 1.933 5808 A HA -0.258 4.062 4.320 0.000 0.000 0.218 5808 A C 2.355 179.934 177.584 -0.008 0.000 1.175 5808 A CA 1.801 53.833 52.037 -0.008 0.000 0.628 5808 A CB -0.544 18.450 19.000 -0.011 0.000 0.814 5808 A HN 0.501 nan 8.150 nan 0.000 0.444 5809 E N -0.227 119.969 120.200 -0.008 0.000 2.077 5809 E HA -0.160 4.190 4.350 0.000 0.000 0.193 5809 E C 1.875 178.470 176.600 -0.007 0.000 0.989 5809 E CA 1.229 57.625 56.400 -0.007 0.000 0.800 5809 E CB -0.215 29.481 29.700 -0.006 0.000 0.746 5809 E HN 0.663 nan 8.360 nan 0.000 0.452 5810 I N 0.343 120.909 120.570 -0.007 0.000 2.226 5810 I HA -0.265 3.905 4.170 0.000 0.000 0.245 5810 I C 2.117 178.227 176.117 -0.011 0.000 1.100 5810 I CA 0.738 62.033 61.300 -0.009 0.000 1.374 5810 I CB -0.073 37.922 38.000 -0.009 0.000 1.057 5810 I HN 0.200 nan 8.210 nan 0.000 0.413 5811 I N -0.450 120.114 120.570 -0.009 0.000 2.406 5811 I HA -0.161 4.009 4.170 0.000 0.000 0.249 5811 I C 2.295 178.407 176.117 -0.009 0.000 1.122 5811 I CA 1.073 62.368 61.300 -0.009 0.000 1.431 5811 I CB -0.303 37.693 38.000 -0.007 0.000 1.087 5811 I HN -0.072 nan 8.210 nan 0.000 0.424 5812 V N 0.229 120.138 119.914 -0.008 0.000 2.358 5812 V HA -0.245 3.875 4.120 0.000 0.000 0.246 5812 V C 2.501 178.591 176.094 -0.007 0.000 1.047 5812 V CA 1.862 64.159 62.300 -0.007 0.000 1.035 5812 V CB -0.523 31.296 31.823 -0.006 0.000 0.658 5812 V HN 0.401 nan 8.190 nan 0.000 0.452 5813 E N 0.826 121.021 120.200 -0.007 0.000 2.072 5813 E HA -0.143 4.207 4.350 0.000 0.000 0.191 5813 E C 2.133 178.727 176.600 -0.009 0.000 0.985 5813 E CA 1.597 57.992 56.400 -0.007 0.000 0.801 5813 E CB -0.462 29.233 29.700 -0.008 0.000 0.750 5813 E HN 0.489 nan 8.360 nan 0.000 0.452 5814 A N 0.077 122.890 122.820 -0.012 0.000 1.877 5814 A HA -0.145 4.175 4.320 0.000 0.000 0.216 5814 A C 2.510 180.087 177.584 -0.013 0.000 1.186 5814 A CA 1.746 53.773 52.037 -0.016 0.000 0.620 5814 A CB -0.847 18.142 19.000 -0.019 0.000 0.822 5814 A HN 0.205 nan 8.150 nan 0.000 0.443 5815 V N -0.516 119.392 119.914 -0.010 0.000 2.307 5815 V HA -0.197 3.923 4.120 0.000 0.000 0.245 5815 V C 2.816 178.906 176.094 -0.006 0.000 1.045 5815 V CA 2.272 64.567 62.300 -0.008 0.000 1.024 5815 V CB -0.713 31.106 31.823 -0.007 0.000 0.651 5815 V HN 0.668 nan 8.190 nan 0.000 0.449 5816 S N -0.091 115.606 115.700 -0.004 0.000 2.370 5816 S HA -0.207 4.263 4.470 0.000 0.000 0.226 5816 S C 2.119 176.720 174.600 0.002 0.000 1.033 5816 S CA 1.704 59.904 58.200 -0.001 0.000 1.011 5816 S CB -0.330 62.870 63.200 -0.000 0.000 0.852 5816 S HN 0.616 nan 8.310 nan 0.000 0.457 5817 A N 0.716 123.536 122.820 0.000 0.000 1.933 5817 A HA -0.006 4.314 4.320 0.000 0.000 0.218 5817 A C 2.319 179.906 177.584 0.005 0.000 1.175 5817 A CA 1.861 53.900 52.037 0.004 0.000 0.628 5817 A CB -0.787 18.211 19.000 -0.003 0.000 0.814 5817 A HN 0.987 nan 8.150 nan 0.000 0.444 5818 V N -3.841 116.071 119.914 -0.002 0.000 3.307 5818 V HA 0.090 4.210 4.120 0.000 0.000 0.253 5818 V C 1.996 178.088 176.094 -0.003 0.000 1.149 5818 V CA 1.159 63.456 62.300 -0.004 0.000 1.112 5818 V CB -0.248 31.568 31.823 -0.011 0.000 0.777 5818 V HN 0.171 nan 8.190 nan 0.000 0.464 5819 V N 0.501 120.414 119.914 -0.003 0.000 2.453 5819 V HA -0.033 4.088 4.120 0.000 0.000 0.247 5819 V C 1.627 177.719 176.094 -0.002 0.000 1.048 5819 V CA 2.520 64.818 62.300 -0.003 0.000 1.049 5819 V CB -0.276 31.545 31.823 -0.003 0.000 0.672 5819 V HN 0.810 nan 8.190 nan 0.000 0.457 5820 D N -0.616 119.784 120.400 0.001 0.000 4.438 5820 D HA -0.218 4.422 4.640 0.000 0.000 0.158 5820 D C 0.601 176.899 176.300 -0.004 0.000 0.686 5820 D CA 1.946 55.946 54.000 0.000 0.000 1.183 5820 D CB -1.304 39.494 40.800 -0.003 0.000 0.623 5820 D HN 0.574 nan 8.370 nan 0.000 0.521 5821 D N 1.463 121.859 120.400 -0.007 0.000 2.384 5821 D HA 0.262 4.902 4.640 0.000 0.000 0.244 5821 D C -0.302 175.995 176.300 -0.006 0.000 1.251 5821 D CA 0.308 54.303 54.000 -0.008 0.000 0.961 5821 D CB 0.420 41.214 40.800 -0.010 0.000 1.116 5821 D HN 0.218 nan 8.370 nan 0.000 0.484 5822 E N -0.133 120.063 120.200 -0.006 0.000 2.400 5822 E HA 0.565 4.915 4.350 0.000 0.000 0.232 5822 E C -0.260 176.337 176.600 -0.005 0.000 0.988 5822 E CA -0.657 55.740 56.400 -0.005 0.000 0.823 5822 E CB 0.779 30.477 29.700 -0.004 0.000 1.246 5822 E HN 0.497 nan 8.360 nan 0.000 0.441 5823 G N 1.736 110.533 108.800 -0.005 0.000 2.339 5823 G HA2 0.211 4.171 3.960 0.000 0.000 0.302 5823 G HA3 0.211 4.171 3.960 0.000 0.000 0.302 5823 G C -1.781 173.117 174.900 -0.004 0.000 1.425 5823 G CA -0.814 44.283 45.100 -0.005 0.000 0.899 5823 G HN 0.063 nan 8.290 nan 0.000 0.619 5824 K N 0.312 120.709 120.400 -0.005 0.000 2.550 5824 K HA 0.543 4.863 4.320 0.000 0.000 0.252 5824 K C -1.345 175.252 176.600 -0.005 0.000 0.943 5824 K CA -0.539 55.745 56.287 -0.004 0.000 0.806 5824 K CB 2.196 34.693 32.500 -0.005 0.000 1.289 5824 K HN 0.601 nan 8.250 nan 0.000 0.435 5825 V N 3.324 123.235 119.914 -0.005 0.000 2.370 5825 V HA 0.261 4.381 4.120 0.000 0.000 0.279 5825 V C -0.310 175.780 176.094 -0.006 0.000 1.029 5825 V CA -0.689 61.608 62.300 -0.005 0.000 0.870 5825 V CB 1.370 33.190 31.823 -0.005 0.000 0.984 5825 V HN 0.624 nan 8.190 nan 0.000 0.451 5826 D N 3.812 124.207 120.400 -0.007 0.000 2.453 5826 D HA 0.305 4.945 4.640 0.000 0.000 0.238 5826 D C 0.864 177.157 176.300 -0.010 0.000 1.088 5826 D CA -0.537 53.458 54.000 -0.008 0.000 0.854 5826 D CB 1.598 42.393 40.800 -0.009 0.000 1.076 5826 D HN 0.423 nan 8.370 nan 0.000 0.533 5827 K N 1.965 122.359 120.400 -0.010 0.000 2.360 5827 K HA -0.150 4.170 4.320 0.000 0.000 0.201 5827 K C 0.906 177.497 176.600 -0.014 0.000 1.046 5827 K CA 0.808 57.088 56.287 -0.011 0.000 0.945 5827 K CB 0.242 32.736 32.500 -0.009 0.000 0.750 5827 K HN 0.344 nan 8.250 nan 0.000 0.464 5828 D N 0.785 121.176 120.400 -0.014 0.000 2.310 5828 D HA -0.082 4.559 4.640 0.000 0.000 0.212 5828 D C 1.260 177.547 176.300 -0.022 0.000 0.965 5828 D CA 0.642 54.631 54.000 -0.017 0.000 0.879 5828 D CB 0.137 40.928 40.800 -0.015 0.000 0.921 5828 D HN 0.118 nan 8.370 nan 0.000 0.510 5829 L N -0.155 121.055 121.223 -0.021 0.000 2.554 5829 L HA 0.156 4.496 4.340 0.000 0.000 0.226 5829 L C 0.349 177.202 176.870 -0.029 0.000 1.137 5829 L CA 0.205 55.030 54.840 -0.024 0.000 0.863 5829 L CB 0.075 42.123 42.059 -0.019 0.000 0.985 5829 L HN 0.022 nan 8.230 nan 0.000 0.451 5830 I N 0.650 121.204 120.570 -0.028 0.000 2.390 5830 I HA 0.171 4.341 4.170 0.000 0.000 0.283 5830 I C 0.108 176.204 176.117 -0.035 0.000 1.016 5830 I CA -0.347 60.934 61.300 -0.032 0.000 1.151 5830 I CB 1.416 39.401 38.000 -0.025 0.000 1.293 5830 I HN -0.033 nan 8.210 nan 0.000 0.458 5831 K N 6.814 127.186 120.400 -0.046 0.000 2.276 5831 K HA 0.400 4.720 4.320 0.000 0.000 0.283 5831 K C -0.646 175.924 176.600 -0.049 0.000 1.044 5831 K CA -0.516 55.741 56.287 -0.049 0.000 0.944 5831 K CB 0.876 33.338 32.500 -0.064 0.000 1.012 5831 K HN 0.456 nan 8.250 nan 0.000 0.472 5832 I N 4.324 124.871 120.570 -0.039 0.000 2.307 5832 I HA 0.155 4.325 4.170 0.000 0.000 0.287 5832 I C -0.139 175.958 176.117 -0.033 0.000 1.054 5832 I CA -0.550 60.730 61.300 -0.034 0.000 1.218 5832 I CB 0.683 38.669 38.000 -0.024 0.000 1.398 5832 I HN 0.674 nan 8.210 nan 0.000 0.475 5833 E N 7.300 127.476 120.200 -0.040 0.000 2.216 5833 E HA 0.474 4.824 4.350 0.000 0.000 0.279 5833 E C -0.734 175.857 176.600 -0.016 0.000 0.997 5833 E CA -0.589 55.793 56.400 -0.030 0.000 0.817 5833 E CB 1.047 30.720 29.700 -0.046 0.000 1.096 5833 E HN 0.542 nan 8.360 nan 0.000 0.393 5834 K N 2.882 123.278 120.400 -0.007 0.000 2.541 5834 K HA 0.562 4.882 4.320 0.000 0.000 0.250 5834 K C -1.030 175.574 176.600 0.005 0.000 0.950 5834 K CA -1.086 55.200 56.287 -0.002 0.000 0.805 5834 K CB 1.509 34.003 32.500 -0.010 0.000 1.166 5834 K HN 0.092 nan 8.250 nan 0.000 0.430 5835 K N 2.043 122.452 120.400 0.015 0.000 2.578 5835 K HA 0.197 4.517 4.320 0.000 0.000 0.250 5835 K C -0.895 175.717 176.600 0.019 0.000 0.955 5835 K CA -0.652 55.648 56.287 0.022 0.000 0.825 5835 K CB 2.045 34.570 32.500 0.042 0.000 1.151 5835 K HN 0.776 nan 8.250 nan 0.000 0.432 5836 S N 1.278 116.986 115.700 0.012 0.000 2.568 5836 S HA 0.503 4.974 4.470 0.000 0.000 0.282 5836 S C 0.358 174.969 174.600 0.019 0.000 1.338 5836 S CA 1.269 59.478 58.200 0.014 0.000 1.045 5836 S CB 0.152 63.359 63.200 0.011 0.000 0.873 5836 S HN 0.873 nan 8.310 nan 0.000 0.516 5837 G N 1.674 110.486 108.800 0.020 0.000 2.465 5837 G HA2 0.509 4.469 3.960 0.000 0.000 0.681 5837 G HA3 0.509 4.469 3.960 0.000 0.000 0.681 5837 G C -0.085 174.828 174.900 0.021 0.000 1.340 5837 G CA -0.050 45.062 45.100 0.020 0.000 0.884 5837 G HN 2.157 nan 8.290 nan 0.000 0.650 5838 A N -0.571 122.261 122.820 0.019 0.000 5.953 5838 A HA 0.393 4.713 4.320 0.000 0.000 0.267 5838 A C 1.120 178.715 177.584 0.018 0.000 2.116 5838 A CA 1.933 53.981 52.037 0.018 0.000 0.711 5838 A CB -1.621 17.392 19.000 0.022 0.000 1.100 5838 A HN 2.723 nan 8.150 nan 0.000 0.364 5839 S N -2.790 112.921 115.700 0.018 0.000 2.811 5839 S HA 0.703 5.173 4.470 0.000 0.000 0.311 5839 S C 1.121 175.732 174.600 0.018 0.000 1.152 5839 S CA 0.148 58.358 58.200 0.017 0.000 0.864 5839 S CB 1.307 64.516 63.200 0.015 0.000 1.226 5839 S HN 1.564 nan 8.310 nan 0.000 0.541 5840 I N 1.304 121.884 120.570 0.016 0.000 2.614 5840 I HA -0.093 4.077 4.170 0.000 0.000 0.258 5840 I C 0.876 177.001 176.117 0.014 0.000 1.189 5840 I CA 1.277 62.586 61.300 0.015 0.000 1.462 5840 I CB -0.086 37.923 38.000 0.015 0.000 1.092 5840 I HN 0.585 nan 8.210 nan 0.000 0.442 5841 D N 1.024 121.432 120.400 0.013 0.000 2.178 5841 D HA -0.180 4.460 4.640 0.000 0.000 0.201 5841 D C 1.436 177.745 176.300 0.014 0.000 0.980 5841 D CA 1.302 55.309 54.000 0.012 0.000 0.842 5841 D CB -0.248 40.559 40.800 0.011 0.000 0.948 5841 D HN 0.480 nan 8.370 nan 0.000 0.472 5842 D N -0.525 119.885 120.400 0.017 0.000 2.347 5842 D HA -0.022 4.618 4.640 0.000 0.000 0.215 5842 D C 0.265 176.580 176.300 0.025 0.000 0.976 5842 D CA 0.452 54.466 54.000 0.022 0.000 0.884 5842 D CB -0.001 40.814 40.800 0.025 0.000 0.915 5842 D HN -0.027 nan 8.370 nan 0.000 0.526 5843 T N 1.096 115.662 114.554 0.019 0.000 2.933 5843 T HA 0.170 4.520 4.350 0.000 0.000 0.306 5843 T C 0.122 174.829 174.700 0.012 0.000 1.045 5843 T CA 0.525 62.634 62.100 0.015 0.000 1.143 5843 T CB 0.655 69.529 68.868 0.010 0.000 1.003 5843 T HN 0.038 nan 8.240 nan 0.000 0.540 5844 E N 1.790 121.995 120.200 0.009 0.000 2.390 5844 E HA 0.520 4.870 4.350 0.000 0.000 0.280 5844 E C -1.949 174.643 176.600 -0.013 0.000 0.992 5844 E CA -0.800 55.603 56.400 0.004 0.000 0.790 5844 E CB 1.037 30.749 29.700 0.019 0.000 1.248 5844 E HN 0.349 nan 8.360 nan 0.000 0.447 5845 L N 3.625 124.837 121.223 -0.017 0.000 2.292 5845 L HA 0.599 4.939 4.340 0.000 0.000 0.284 5845 L C -1.141 175.705 176.870 -0.040 0.000 1.065 5845 L CA -0.217 54.603 54.840 -0.033 0.000 0.806 5845 L CB 0.831 42.874 42.059 -0.026 0.000 1.175 5845 L HN 0.577 nan 8.230 nan 0.000 0.431 5846 I N 5.554 126.082 120.570 -0.071 0.000 2.382 5846 I HA 0.304 4.474 4.170 0.000 0.000 0.285 5846 I C -0.134 175.936 176.117 -0.078 0.000 1.007 5846 I CA -0.493 60.757 61.300 -0.083 0.000 1.142 5846 I CB 1.188 39.087 38.000 -0.168 0.000 1.289 5846 I HN 0.315 nan 8.210 nan 0.000 0.453 5847 K N 5.804 126.174 120.400 -0.049 0.000 2.081 5847 K HA 0.516 4.836 4.320 0.000 0.000 0.230 5847 K C 0.458 177.030 176.600 -0.048 0.000 1.199 5847 K CA -0.049 56.212 56.287 -0.044 0.000 1.130 5847 K CB -0.212 32.269 32.500 -0.032 0.000 1.386 5847 K HN 0.968 nan 8.250 nan 0.000 0.280 5848 G N -0.695 108.064 108.800 -0.068 0.000 2.455 5848 G HA2 0.121 4.081 3.960 0.000 0.000 0.223 5848 G HA3 0.121 4.081 3.960 0.000 0.000 0.223 5848 G C -1.637 173.197 174.900 -0.110 0.000 1.226 5848 G CA -0.721 44.336 45.100 -0.072 0.000 0.948 5848 G HN 0.086 nan 8.290 nan 0.000 0.478 5849 V N 0.446 120.286 119.914 -0.125 0.000 2.588 5849 V HA 0.636 4.756 4.120 0.000 0.000 0.304 5849 V C -0.805 175.176 176.094 -0.189 0.000 1.042 5849 V CA -0.627 61.580 62.300 -0.154 0.000 0.877 5849 V CB 1.559 33.290 31.823 -0.153 0.000 0.996 5849 V HN 0.608 nan 8.190 nan 0.000 0.425 5850 L N 5.213 126.290 121.223 -0.242 0.000 2.255 5850 L HA 0.490 4.830 4.340 0.000 0.000 0.289 5850 L C -0.090 176.734 176.870 -0.077 0.000 1.046 5850 L CA 0.166 54.840 54.840 -0.277 0.000 0.816 5850 L CB 1.471 43.242 42.059 -0.480 0.000 1.197 5850 L HN 0.438 nan 8.230 nan 0.000 0.427 5851 V N 2.685 122.622 119.914 0.038 0.000 2.394 5851 V HA 0.237 4.357 4.120 0.000 0.000 0.282 5851 V C 0.119 176.293 176.094 0.133 0.000 1.031 5851 V CA -0.784 61.556 62.300 0.066 0.000 0.881 5851 V CB 1.570 33.450 31.823 0.094 0.000 0.982 5851 V HN 0.781 nan 8.190 nan 0.000 0.451 5852 D N 3.773 124.228 120.400 0.091 0.000 3.085 5852 D HA 0.176 4.816 4.640 0.000 0.000 0.243 5852 D C 0.117 176.471 176.300 0.090 0.000 1.232 5852 D CA -0.256 53.799 54.000 0.092 0.000 0.913 5852 D CB 0.137 40.973 40.800 0.060 0.000 1.108 5852 D HN 0.268 nan 8.370 nan 0.000 0.468 5853 K N 0.458 120.928 120.400 0.117 0.000 2.409 5853 K HA 0.421 4.741 4.320 0.000 0.000 0.252 5853 K C 0.351 177.007 176.600 0.093 0.000 1.036 5853 K CA -0.651 55.700 56.287 0.107 0.000 0.871 5853 K CB 2.264 34.851 32.500 0.146 0.000 1.374 5853 K HN 0.308 nan 8.250 nan 0.000 0.459 5854 E N 0.733 120.970 120.200 0.062 0.000 2.378 5854 E HA 0.394 4.744 4.350 0.000 0.000 0.265 5854 E C -0.683 175.925 176.600 0.014 0.000 0.932 5854 E CA -0.906 55.515 56.400 0.035 0.000 0.795 5854 E CB 1.244 30.957 29.700 0.021 0.000 1.296 5854 E HN 0.217 nan 8.360 nan 0.000 0.438 5855 R N 1.244 121.743 120.500 -0.002 0.000 2.296 5855 R HA 0.108 4.448 4.340 0.000 0.000 0.323 5855 R C 1.362 177.653 176.300 -0.015 0.000 1.067 5855 R CA 0.223 56.310 56.100 -0.022 0.000 0.946 5855 R CB 0.461 30.747 30.300 -0.023 0.000 0.991 5855 R HN 0.559 nan 8.270 nan 0.000 0.448 5856 V N -0.044 119.857 119.914 -0.022 0.000 2.720 5856 V HA -0.075 4.045 4.120 0.000 0.000 0.256 5856 V C 0.904 177.000 176.094 0.002 0.000 1.082 5856 V CA 1.078 63.371 62.300 -0.011 0.000 1.101 5856 V CB -0.224 31.588 31.823 -0.019 0.000 0.693 5856 V HN 0.524 nan 8.190 nan 0.000 0.479 5857 S N -1.002 114.698 115.700 0.000 0.000 2.526 5857 S HA 0.773 5.244 4.470 0.000 0.000 0.293 5857 S C 0.843 175.443 174.600 -0.000 0.000 1.092 5857 S CA -0.120 58.087 58.200 0.012 0.000 0.980 5857 S CB 1.874 65.089 63.200 0.026 0.000 1.048 5857 S HN 0.711 nan 8.310 nan 0.000 0.483 5858 A N 3.266 126.085 122.820 -0.001 0.000 2.070 5858 A HA -0.043 4.277 4.320 0.000 0.000 0.220 5858 A C 1.776 179.353 177.584 -0.013 0.000 1.159 5858 A CA 1.258 53.290 52.037 -0.009 0.000 0.656 5858 A CB -0.476 18.516 19.000 -0.012 0.000 0.800 5858 A HN 0.899 nan 8.150 nan 0.000 0.453 5859 Q N -1.030 118.763 119.800 -0.012 0.000 2.424 5859 Q HA 0.196 4.536 4.340 0.000 0.000 0.204 5859 Q C 0.213 176.207 176.000 -0.010 0.000 0.933 5859 Q CA -0.019 55.776 55.803 -0.014 0.000 0.929 5859 Q CB 0.027 28.754 28.738 -0.018 0.000 1.037 5859 Q HN 0.658 nan 8.270 nan 0.000 0.511 5860 M N 1.518 121.112 119.600 -0.010 0.000 2.250 5860 M HA 0.222 4.702 4.480 0.000 0.000 0.344 5860 M C -2.138 174.153 176.300 -0.014 0.000 1.150 5860 M CA -2.023 53.269 55.300 -0.013 0.000 1.147 5860 M CB 0.388 32.977 32.600 -0.020 0.000 1.498 5860 M HN -0.191 nan 8.290 nan 0.000 0.461 5861 P HA -0.021 nan 4.420 nan 0.000 0.269 5861 P C -0.156 177.135 177.300 -0.014 0.000 1.211 5861 P CA 0.055 63.148 63.100 -0.012 0.000 0.781 5861 P CB 0.489 32.183 31.700 -0.009 0.000 0.877 5862 K N 1.032 121.425 120.400 -0.013 0.000 2.379 5862 K HA 0.056 4.376 4.320 0.000 0.000 0.194 5862 K C 0.487 177.080 176.600 -0.012 0.000 1.031 5862 K CA 0.810 57.088 56.287 -0.016 0.000 1.037 5862 K CB 0.142 32.630 32.500 -0.019 0.000 0.824 5862 K HN 0.577 nan 8.250 nan 0.000 0.516 5863 K N -0.777 119.620 120.400 -0.005 0.000 2.557 5863 K HA 0.381 4.701 4.320 0.000 0.000 0.257 5863 K C -1.259 175.346 176.600 0.008 0.000 0.933 5863 K CA -0.733 55.557 56.287 0.005 0.000 0.820 5863 K CB 1.987 34.488 32.500 0.002 0.000 1.330 5863 K HN -0.285 nan 8.250 nan 0.000 0.432 5864 V N 2.045 121.971 119.914 0.019 0.000 2.483 5864 V HA 0.429 4.549 4.120 0.000 0.000 0.297 5864 V C -0.283 175.827 176.094 0.027 0.000 1.027 5864 V CA -0.527 61.784 62.300 0.019 0.000 0.855 5864 V CB 1.838 33.671 31.823 0.017 0.000 0.995 5864 V HN 0.998 nan 8.190 nan 0.000 0.424 5865 T N 0.078 114.645 114.554 0.021 0.000 2.929 5865 T HA 0.541 4.891 4.350 0.000 0.000 0.284 5865 T C 0.124 174.836 174.700 0.021 0.000 1.014 5865 T CA -0.276 61.837 62.100 0.022 0.000 1.051 5865 T CB 1.297 70.174 68.868 0.016 0.000 1.028 5865 T HN 0.769 nan 8.240 nan 0.000 0.485 5866 D N 0.338 120.751 120.400 0.022 0.000 2.689 5866 D HA -0.153 4.487 4.640 0.000 0.000 0.237 5866 D C 0.301 176.616 176.300 0.026 0.000 1.148 5866 D CA 0.840 54.852 54.000 0.020 0.000 0.656 5866 D CB -1.252 39.557 40.800 0.015 0.000 1.050 5866 D HN 1.103 nan 8.370 nan 0.000 0.426 5867 A N 1.410 124.251 122.820 0.035 0.000 2.477 5867 A HA 0.377 4.697 4.320 0.000 0.000 0.246 5867 A C 0.542 178.153 177.584 0.046 0.000 1.078 5867 A CA 0.145 52.208 52.037 0.044 0.000 0.770 5867 A CB 0.595 19.633 19.000 0.064 0.000 1.011 5867 A HN 0.156 nan 8.150 nan 0.000 0.494 5868 K N 3.179 123.605 120.400 0.043 0.000 2.347 5868 K HA 0.400 4.720 4.320 0.000 0.000 0.262 5868 K C -0.941 175.694 176.600 0.058 0.000 1.052 5868 K CA 0.158 56.471 56.287 0.044 0.000 0.946 5868 K CB 0.928 33.446 32.500 0.031 0.000 1.220 5868 K HN 0.638 nan 8.250 nan 0.000 0.450 5869 I N 2.033 122.653 120.570 0.083 0.000 2.353 5869 I HA 0.287 4.457 4.170 0.000 0.000 0.293 5869 I C 0.273 176.458 176.117 0.114 0.000 0.992 5869 I CA -0.656 60.723 61.300 0.133 0.000 1.268 5869 I CB 1.589 39.709 38.000 0.199 0.000 1.387 5869 I HN 0.433 nan 8.210 nan 0.000 0.478 5870 A N 7.674 130.565 122.820 0.119 0.000 2.337 5870 A HA 0.840 5.160 4.320 0.000 0.000 0.329 5870 A C -0.779 176.891 177.584 0.143 0.000 1.146 5870 A CA -0.545 51.550 52.037 0.097 0.000 0.800 5870 A CB 0.934 19.968 19.000 0.057 0.000 1.220 5870 A HN 0.703 nan 8.150 nan 0.000 0.472 5871 L N 3.152 124.439 121.223 0.107 0.000 2.345 5871 L HA 0.419 4.759 4.340 0.000 0.000 0.274 5871 L C -0.979 175.934 176.870 0.072 0.000 0.999 5871 L CA -0.090 54.815 54.840 0.108 0.000 0.849 5871 L CB 1.026 43.130 42.059 0.075 0.000 1.220 5871 L HN 0.564 nan 8.230 nan 0.000 0.422 5872 L N 3.351 124.619 121.223 0.075 0.000 2.307 5872 L HA 0.381 4.721 4.340 0.000 0.000 0.284 5872 L C 0.721 177.620 176.870 0.049 0.000 1.023 5872 L CA -0.502 54.368 54.840 0.051 0.000 0.810 5872 L CB 1.761 43.846 42.059 0.043 0.000 1.231 5872 L HN 0.623 nan 8.230 nan 0.000 0.423 5873 N N 0.745 119.466 118.700 0.035 0.000 2.322 5873 N HA -0.021 4.719 4.740 0.000 0.000 0.181 5873 N C 0.444 175.969 175.510 0.025 0.000 1.088 5873 N CA -0.277 52.791 53.050 0.030 0.000 0.885 5873 N CB -0.304 38.197 38.487 0.023 0.000 1.013 5873 N HN 0.586 nan 8.380 nan 0.000 0.472 5874 C N 0.243 119.557 119.300 0.022 0.000 2.595 5874 C HA 0.849 5.309 4.460 0.000 0.000 0.384 5874 C C 0.948 175.950 174.990 0.019 0.000 1.289 5874 C CA -1.449 57.580 59.018 0.018 0.000 2.372 5874 C CB -0.177 27.572 27.740 0.015 0.000 2.593 5874 C HN 0.479 nan 8.230 nan 0.000 0.639 5875 A N 2.431 125.260 122.820 0.015 0.000 2.401 5875 A HA 0.596 4.916 4.320 0.000 0.000 0.259 5875 A C 0.039 177.630 177.584 0.012 0.000 1.103 5875 A CA -0.516 51.529 52.037 0.014 0.000 0.789 5875 A CB -0.161 18.845 19.000 0.011 0.000 1.035 5875 A HN 0.879 nan 8.150 nan 0.000 0.491 5876 I N 2.837 123.413 120.570 0.011 0.000 2.317 5876 I HA 0.266 4.436 4.170 0.000 0.000 0.286 5876 I C -0.284 175.838 176.117 0.009 0.000 1.119 5876 I CA -0.061 61.246 61.300 0.011 0.000 1.228 5876 I CB -0.209 37.798 38.000 0.011 0.000 1.476 5876 I HN 0.828 nan 8.210 nan 0.000 0.514 5877 E N 3.911 124.117 120.200 0.010 0.000 2.445 5877 E HA 0.544 4.894 4.350 0.000 0.000 0.273 5877 E C -0.694 175.916 176.600 0.016 0.000 0.961 5877 E CA -1.045 55.361 56.400 0.010 0.000 0.807 5877 E CB 1.127 30.829 29.700 0.004 0.000 1.362 5877 E HN 0.095 nan 8.360 nan 0.000 0.453 5878 I N 1.465 122.047 120.570 0.020 0.000 2.573 5878 I HA 0.071 4.241 4.170 0.000 0.000 0.295 5878 I C 0.208 176.337 176.117 0.019 0.000 1.141 5878 I CA 0.113 61.428 61.300 0.025 0.000 1.364 5878 I CB -0.731 37.288 38.000 0.032 0.000 1.447 5878 I HN 0.375 nan 8.210 nan 0.000 0.571 5879 K N 7.159 127.569 120.400 0.017 0.000 2.412 5879 K HA 0.143 4.463 4.320 0.000 0.000 0.281 5879 K C -0.035 176.576 176.600 0.017 0.000 1.027 5879 K CA 0.049 56.344 56.287 0.014 0.000 0.989 5879 K CB 0.407 32.914 32.500 0.012 0.000 0.935 5879 K HN 0.688 nan 8.250 nan 0.000 0.475 5880 E N 1.643 121.851 120.200 0.013 0.000 2.227 5880 E HA 0.251 4.601 4.350 0.000 0.000 0.268 5880 E C -0.746 175.860 176.600 0.010 0.000 0.907 5880 E CA -1.110 55.298 56.400 0.013 0.000 0.786 5880 E CB 1.371 31.076 29.700 0.008 0.000 1.191 5880 E HN 0.487 nan 8.360 nan 0.000 0.411 5881 T N 1.061 115.622 114.554 0.011 0.000 2.906 5881 T HA -0.038 4.312 4.350 0.000 0.000 0.320 5881 T C 0.729 175.433 174.700 0.006 0.000 1.088 5881 T CA 0.145 62.251 62.100 0.009 0.000 1.120 5881 T CB 0.513 69.387 68.868 0.011 0.000 1.000 5881 T HN 0.590 nan 8.240 nan 0.000 0.550 5882 E N 1.373 121.576 120.200 0.006 0.000 2.153 5882 E HA 0.020 4.370 4.350 0.000 0.000 0.194 5882 E C 1.270 177.872 176.600 0.003 0.000 0.988 5882 E CA 1.275 57.678 56.400 0.004 0.000 0.811 5882 E CB -0.333 29.369 29.700 0.004 0.000 0.746 5882 E HN 0.868 nan 8.360 nan 0.000 0.466 5883 T N -0.710 113.846 114.554 0.003 0.000 2.868 5883 T HA 0.095 4.445 4.350 0.000 0.000 0.292 5883 T C 0.206 174.907 174.700 0.000 0.000 1.028 5883 T CA -0.915 61.186 62.100 0.002 0.000 1.059 5883 T CB 1.073 69.943 68.868 0.004 0.000 0.991 5883 T HN -0.174 nan 8.240 nan 0.000 0.531 5884 D N 1.067 121.466 120.400 -0.001 0.000 2.382 5884 D HA 0.432 5.072 4.640 0.000 0.000 0.259 5884 D C -0.345 175.952 176.300 -0.005 0.000 1.224 5884 D CA 0.174 54.172 54.000 -0.004 0.000 0.894 5884 D CB -0.148 40.649 40.800 -0.005 0.000 1.127 5884 D HN 0.938 nan 8.370 nan 0.000 0.487 5885 A N 3.704 126.518 122.820 -0.009 0.000 2.587 5885 A HA 0.724 5.044 4.320 0.000 0.000 0.293 5885 A C -1.062 176.507 177.584 -0.026 0.000 1.087 5885 A CA -0.802 51.227 52.037 -0.012 0.000 0.692 5885 A CB 1.498 20.496 19.000 -0.003 0.000 1.291 5885 A HN 0.614 nan 8.150 nan 0.000 0.407 5886 E N 0.487 120.663 120.200 -0.040 0.000 2.392 5886 E HA 0.593 4.943 4.350 0.000 0.000 0.279 5886 E C -1.598 174.931 176.600 -0.118 0.000 0.964 5886 E CA -0.913 55.444 56.400 -0.072 0.000 0.777 5886 E CB 1.086 30.747 29.700 -0.065 0.000 1.249 5886 E HN 0.317 nan 8.360 nan 0.000 0.449 5887 I N 1.795 122.240 120.570 -0.207 0.000 2.556 5887 I HA 0.101 4.271 4.170 0.000 0.000 0.284 5887 I C 0.174 176.088 176.117 -0.339 0.000 1.114 5887 I CA -0.000 61.045 61.300 -0.425 0.000 1.418 5887 I CB 0.291 37.861 38.000 -0.717 0.000 1.394 5887 I HN 0.343 nan 8.210 nan 0.000 0.552 5888 R N 7.057 127.388 120.500 -0.282 0.000 2.332 5888 R HA 0.381 4.721 4.340 0.000 0.000 0.306 5888 R C -0.674 175.592 176.300 -0.056 0.000 1.117 5888 R CA -0.861 55.169 56.100 -0.117 0.000 1.108 5888 R CB 0.382 30.666 30.300 -0.027 0.000 1.126 5888 R HN 0.418 nan 8.270 nan 0.000 0.548 5889 I N 2.689 123.212 120.570 -0.079 0.000 2.648 5889 I HA -0.050 4.120 4.170 0.000 0.000 0.284 5889 I C 1.708 177.867 176.117 0.071 0.000 1.153 5889 I CA 0.790 62.112 61.300 0.038 0.000 1.426 5889 I CB 0.641 38.645 38.000 0.008 0.000 1.381 5889 I HN 0.536 nan 8.210 nan 0.000 0.571 5890 T N -0.123 114.501 114.554 0.116 0.000 2.975 5890 T HA 0.218 4.568 4.350 0.000 0.000 0.261 5890 T C 0.241 174.978 174.700 0.062 0.000 0.984 5890 T CA -0.232 61.915 62.100 0.078 0.000 0.911 5890 T CB 0.748 69.665 68.868 0.081 0.000 1.127 5890 T HN 0.616 nan 8.240 nan 0.000 0.514 5891 D N 0.461 120.906 120.400 0.074 0.000 2.769 5891 D HA 0.275 4.915 4.640 0.000 0.000 0.219 5891 D C -2.559 173.776 176.300 0.059 0.000 1.245 5891 D CA -1.478 52.554 54.000 0.053 0.000 0.801 5891 D CB 2.539 43.364 40.800 0.041 0.000 1.598 5891 D HN -0.325 nan 8.370 nan 0.000 0.485 5892 P HA -0.135 nan 4.420 nan 0.000 0.218 5892 P C 0.950 178.276 177.300 0.043 0.000 1.146 5892 P CA 1.611 64.734 63.100 0.040 0.000 0.820 5892 P CB 0.302 32.019 31.700 0.027 0.000 0.778 5893 A N -0.622 122.220 122.820 0.037 0.000 1.873 5893 A HA -0.181 4.139 4.320 0.000 0.000 0.215 5893 A C 2.128 179.736 177.584 0.039 0.000 1.186 5893 A CA 1.726 53.780 52.037 0.029 0.000 0.616 5893 A CB -0.939 18.070 19.000 0.014 0.000 0.823 5893 A HN 0.027 nan 8.150 nan 0.000 0.442 5894 K N -0.525 119.910 120.400 0.059 0.000 2.152 5894 K HA -0.077 4.243 4.320 0.000 0.000 0.206 5894 K C 1.700 178.449 176.600 0.247 0.000 1.048 5894 K CA 0.961 57.306 56.287 0.097 0.000 0.933 5894 K CB -0.520 32.074 32.500 0.156 0.000 0.721 5894 K HN 0.397 nan 8.250 nan 0.000 0.447 5895 L N 0.167 121.507 121.223 0.195 0.000 2.043 5895 L HA -0.199 4.141 4.340 0.000 0.000 0.212 5895 L C 1.749 178.718 176.870 0.165 0.000 1.075 5895 L CA 1.823 56.771 54.840 0.179 0.000 0.752 5895 L CB -0.263 41.851 42.059 0.092 0.000 0.891 5895 L HN 0.215 nan 8.230 nan 0.000 0.432 5896 M N -1.286 118.379 119.600 0.108 0.000 2.236 5896 M HA -0.111 4.369 4.480 0.000 0.000 0.266 5896 M C 2.211 178.548 176.300 0.061 0.000 1.070 5896 M CA 1.278 56.623 55.300 0.075 0.000 1.137 5896 M CB -1.092 31.534 32.600 0.044 0.000 1.378 5896 M HN 0.395 nan 8.290 nan 0.000 0.426 5897 E N 0.068 120.284 120.200 0.026 0.000 2.085 5897 E HA -0.189 4.161 4.350 0.000 0.000 0.194 5897 E C 1.900 178.446 176.600 -0.090 0.000 0.994 5897 E CA 1.283 57.642 56.400 -0.068 0.000 0.801 5897 E CB -0.040 29.562 29.700 -0.164 0.000 0.743 5897 E HN 0.384 nan 8.360 nan 0.000 0.453 5898 F N 0.493 120.449 119.950 0.010 0.000 2.134 5898 F HA -0.140 4.387 4.527 0.000 0.000 0.299 5898 F C 2.212 178.021 175.800 0.014 0.000 1.097 5898 F CA 0.933 58.939 58.000 0.010 0.000 1.264 5898 F CB -0.067 38.938 39.000 0.009 0.000 1.001 5898 F HN 0.055 nan 8.300 nan 0.000 0.479 5899 I N -0.320 120.373 120.570 0.205 0.000 2.226 5899 I HA -0.232 3.938 4.170 0.000 0.000 0.245 5899 I C 2.254 178.427 176.117 0.093 0.000 1.100 5899 I CA 1.141 62.517 61.300 0.127 0.000 1.374 5899 I CB -0.370 37.687 38.000 0.096 0.000 1.057 5899 I HN 0.095 nan 8.210 nan 0.000 0.413 5900 E N 0.278 120.519 120.200 0.069 0.000 2.150 5900 E HA -0.257 4.093 4.350 0.000 0.000 0.193 5900 E C 2.018 178.636 176.600 0.030 0.000 0.985 5900 E CA 0.974 57.401 56.400 0.045 0.000 0.814 5900 E CB -0.201 29.513 29.700 0.023 0.000 0.752 5900 E HN 0.433 nan 8.360 nan 0.000 0.466 5901 Q N 1.201 121.011 119.800 0.017 0.000 2.084 5901 Q HA -0.153 4.188 4.340 0.000 0.000 0.202 5901 Q C 1.826 177.843 176.000 0.029 0.000 0.978 5901 Q CA 1.357 57.159 55.803 -0.002 0.000 0.844 5901 Q CB 0.039 28.753 28.738 -0.041 0.000 0.898 5901 Q HN 0.096 nan 8.270 nan 0.000 0.426 5902 E N 0.218 120.458 120.200 0.067 0.000 2.150 5902 E HA -0.149 4.201 4.350 0.000 0.000 0.193 5902 E C 1.822 178.462 176.600 0.065 0.000 0.985 5902 E CA 0.883 57.325 56.400 0.070 0.000 0.814 5902 E CB 0.001 29.755 29.700 0.089 0.000 0.752 5902 E HN 0.487 nan 8.360 nan 0.000 0.466 5903 E N 0.925 121.174 120.200 0.082 0.000 2.072 5903 E HA -0.162 4.188 4.350 0.000 0.000 0.191 5903 E C 2.024 178.635 176.600 0.018 0.000 0.985 5903 E CA 0.738 57.212 56.400 0.125 0.000 0.801 5903 E CB -0.147 29.645 29.700 0.153 0.000 0.750 5903 E HN 0.222 nan 8.360 nan 0.000 0.452 5904 K N 0.507 120.898 120.400 -0.014 0.000 2.057 5904 K HA -0.092 4.228 4.320 0.000 0.000 0.207 5904 K C 2.282 178.821 176.600 -0.102 0.000 1.049 5904 K CA 1.073 57.317 56.287 -0.072 0.000 0.931 5904 K CB -0.043 32.431 32.500 -0.042 0.000 0.714 5904 K HN 0.014 nan 8.250 nan 0.000 0.440 5905 M N 0.427 119.995 119.600 -0.055 0.000 2.065 5905 M HA -0.212 4.268 4.480 0.000 0.000 0.259 5905 M C 2.214 178.466 176.300 -0.079 0.000 1.069 5905 M CA 1.388 56.659 55.300 -0.048 0.000 1.110 5905 M CB -0.301 32.294 32.600 -0.009 0.000 1.328 5905 M HN 0.191 nan 8.290 nan 0.000 0.405 5906 L N 0.225 121.399 121.223 -0.082 0.000 2.109 5906 L HA -0.095 4.245 4.340 0.000 0.000 0.207 5906 L C 2.279 178.971 176.870 -0.296 0.000 1.086 5906 L CA 1.783 56.572 54.840 -0.086 0.000 0.760 5906 L CB -0.619 41.475 42.059 0.058 0.000 0.910 5906 L HN 0.173 nan 8.230 nan 0.000 0.437 5907 K N -0.665 119.353 120.400 -0.638 0.000 2.063 5907 K HA -0.204 4.116 4.320 0.000 0.000 0.208 5907 K C 1.590 177.959 176.600 -0.386 0.000 1.048 5907 K CA 1.819 57.546 56.287 -0.934 0.000 0.928 5907 K CB -0.060 31.908 32.500 -0.886 0.000 0.713 5907 K HN 0.336 nan 8.250 nan 0.000 0.442 5908 D N 0.368 120.626 120.400 -0.237 0.000 2.144 5908 D HA -0.129 4.511 4.640 0.000 0.000 0.200 5908 D C 1.906 178.149 176.300 -0.096 0.000 0.978 5908 D CA 1.111 55.032 54.000 -0.132 0.000 0.833 5908 D CB -0.048 40.697 40.800 -0.092 0.000 0.961 5908 D HN 0.295 nan 8.370 nan 0.000 0.470 5909 M N 0.031 119.575 119.600 -0.093 0.000 2.080 5909 M HA -0.155 4.325 4.480 0.000 0.000 0.260 5909 M C 2.275 178.551 176.300 -0.040 0.000 1.068 5909 M CA 1.079 56.347 55.300 -0.053 0.000 1.109 5909 M CB -0.212 32.365 32.600 -0.038 0.000 1.342 5909 M HN -0.103 nan 8.290 nan 0.000 0.405 5910 V N 0.193 120.075 119.914 -0.054 0.000 2.427 5910 V HA -0.200 3.920 4.120 0.000 0.000 0.248 5910 V C 2.590 178.671 176.094 -0.022 0.000 1.051 5910 V CA 1.802 64.090 62.300 -0.019 0.000 1.048 5910 V CB -1.116 30.718 31.823 0.018 0.000 0.666 5910 V HN 0.521 nan 8.190 nan 0.000 0.456 5911 A N -0.428 122.361 122.820 -0.051 0.000 1.978 5911 A HA -0.199 4.121 4.320 0.000 0.000 0.220 5911 A C 2.189 179.758 177.584 -0.024 0.000 1.170 5911 A CA 1.615 53.630 52.037 -0.037 0.000 0.636 5911 A CB -0.317 18.649 19.000 -0.056 0.000 0.810 5911 A HN 0.536 nan 8.150 nan 0.000 0.448 5912 E N -0.118 120.066 120.200 -0.025 0.000 2.107 5912 E HA -0.074 4.276 4.350 0.000 0.000 0.191 5912 E C 1.979 178.575 176.600 -0.007 0.000 0.982 5912 E CA 0.835 57.226 56.400 -0.015 0.000 0.809 5912 E CB -0.359 29.331 29.700 -0.016 0.000 0.756 5912 E HN 0.741 nan 8.360 nan 0.000 0.459 5913 I N 1.351 121.918 120.570 -0.005 0.000 2.226 5913 I HA -0.247 3.923 4.170 0.000 0.000 0.245 5913 I C 2.636 178.755 176.117 0.004 0.000 1.100 5913 I CA 1.041 62.343 61.300 0.002 0.000 1.374 5913 I CB -0.257 37.745 38.000 0.004 0.000 1.057 5913 I HN -0.019 nan 8.210 nan 0.000 0.413 5914 K N 1.662 122.064 120.400 0.002 0.000 2.057 5914 K HA -0.141 4.179 4.320 0.000 0.000 0.207 5914 K C 2.125 178.727 176.600 0.003 0.000 1.049 5914 K CA 1.758 58.048 56.287 0.004 0.000 0.931 5914 K CB -0.241 32.262 32.500 0.005 0.000 0.714 5914 K HN 0.296 nan 8.250 nan 0.000 0.440 5915 A N 0.623 123.443 122.820 -0.000 0.000 2.019 5915 A HA -0.107 4.213 4.320 0.000 0.000 0.219 5915 A C 2.202 179.787 177.584 0.003 0.000 1.164 5915 A CA 1.960 53.997 52.037 -0.000 0.000 0.644 5915 A CB -0.467 18.531 19.000 -0.004 0.000 0.805 5915 A HN 0.379 nan 8.150 nan 0.000 0.449 5916 S N -1.720 113.983 115.700 0.005 0.000 2.419 5916 S HA 0.205 4.675 4.470 0.000 0.000 0.233 5916 S C 1.647 176.254 174.600 0.011 0.000 1.016 5916 S CA 1.303 59.508 58.200 0.008 0.000 0.974 5916 S CB -0.199 63.007 63.200 0.010 0.000 0.786 5916 S HN 1.674 nan 8.310 nan 0.000 0.492 5917 G N 0.668 109.474 108.800 0.010 0.000 2.179 5917 G HA2 -0.122 3.838 3.960 0.000 0.000 0.220 5917 G HA3 -0.122 3.838 3.960 0.000 0.000 0.220 5917 G C 0.135 175.043 174.900 0.014 0.000 0.990 5917 G CA -0.124 44.983 45.100 0.011 0.000 0.646 5917 G HN 0.858 nan 8.290 nan 0.000 0.517 5918 A N 0.509 123.337 122.820 0.014 0.000 2.425 5918 A HA 0.598 4.918 4.320 0.000 0.000 0.249 5918 A C 1.081 178.670 177.584 0.008 0.000 1.084 5918 A CA 1.035 53.081 52.037 0.016 0.000 0.781 5918 A CB 0.256 19.266 19.000 0.017 0.000 1.019 5918 A HN 1.217 nan 8.150 nan 0.000 0.490 5919 N N 0.049 118.753 118.700 0.007 0.000 2.067 5919 N HA 0.114 4.854 4.740 0.000 0.000 0.227 5919 N C -0.858 174.639 175.510 -0.022 0.000 1.348 5919 N CA 0.209 53.257 53.050 -0.004 0.000 0.879 5919 N CB 0.312 38.801 38.487 0.003 0.000 1.109 5919 N HN 0.260 nan 8.380 nan 0.000 0.501 5920 V N 1.620 121.521 119.914 -0.021 0.000 2.540 5920 V HA 0.619 4.739 4.120 0.000 0.000 0.302 5920 V C -1.263 174.776 176.094 -0.092 0.000 1.035 5920 V CA -0.878 61.377 62.300 -0.075 0.000 0.873 5920 V CB 1.881 33.702 31.823 -0.002 0.000 0.992 5920 V HN 0.217 nan 8.190 nan 0.000 0.428 5921 L N 5.295 126.370 121.223 -0.247 0.000 2.438 5921 L HA 0.732 5.072 4.340 0.000 0.000 0.270 5921 L C -1.658 174.977 176.870 -0.391 0.000 0.972 5921 L CA -0.030 54.704 54.840 -0.177 0.000 0.831 5921 L CB 1.730 43.734 42.059 -0.090 0.000 1.273 5921 L HN 0.466 nan 8.230 nan 0.000 0.405 5922 F N 4.557 124.517 119.950 0.017 0.000 2.449 5922 F HA 0.558 5.085 4.527 -0.000 0.000 0.342 5922 F C 0.006 175.814 175.800 0.013 0.000 1.127 5922 F CA -0.411 57.599 58.000 0.016 0.000 0.975 5922 F CB 1.702 40.711 39.000 0.016 0.000 1.146 5922 F HN 0.564 nan 8.300 nan 0.000 0.444 5923 C N 4.741 124.133 119.300 0.154 0.000 2.322 5923 C HA 0.276 4.736 4.460 0.000 0.000 0.324 5923 C C 1.523 176.570 174.990 0.096 0.000 1.284 5923 C CA -0.418 58.658 59.018 0.096 0.000 1.606 5923 C CB 0.976 28.746 27.740 0.049 0.000 2.251 5923 C HN 0.958 nan 8.230 nan 0.000 0.502 5924 Q N 3.107 122.952 119.800 0.074 0.000 2.119 5924 Q HA -0.030 4.310 4.340 0.000 0.000 0.201 5924 Q C 0.819 176.845 176.000 0.042 0.000 0.972 5924 Q CA 1.589 57.425 55.803 0.055 0.000 0.847 5924 Q CB 0.172 28.933 28.738 0.038 0.000 0.903 5924 Q HN 0.756 nan 8.270 nan 0.000 0.433 5925 K N -1.070 119.351 120.400 0.036 0.000 2.520 5925 K HA 0.417 4.737 4.320 0.000 0.000 0.256 5925 K C 0.327 176.942 176.600 0.025 0.000 1.033 5925 K CA -0.183 56.120 56.287 0.026 0.000 1.007 5925 K CB 0.071 32.583 32.500 0.020 0.000 1.330 5925 K HN 0.102 nan 8.250 nan 0.000 0.507 5926 G N 0.351 109.161 108.800 0.017 0.000 2.569 5926 G HA2 0.388 4.348 3.960 0.000 0.000 0.249 5926 G HA3 0.388 4.348 3.960 0.000 0.000 0.249 5926 G C -0.487 174.417 174.900 0.006 0.000 1.216 5926 G CA -0.498 44.608 45.100 0.010 0.000 0.845 5926 G HN 0.367 nan 8.290 nan 0.000 0.568 5927 I N 0.917 121.485 120.570 -0.003 0.000 2.439 5927 I HA 0.150 4.320 4.170 0.000 0.000 0.285 5927 I C -0.411 175.687 176.117 -0.031 0.000 1.021 5927 I CA -0.766 60.527 61.300 -0.012 0.000 1.091 5927 I CB 1.936 39.928 38.000 -0.014 0.000 1.242 5927 I HN 0.422 nan 8.210 nan 0.000 0.439 5928 D N 5.228 125.607 120.400 -0.034 0.000 2.455 5928 D HA -0.054 4.586 4.640 0.000 0.000 0.241 5928 D C 0.667 176.889 176.300 -0.130 0.000 1.138 5928 D CA 0.174 54.138 54.000 -0.061 0.000 0.877 5928 D CB 1.314 42.089 40.800 -0.041 0.000 1.187 5928 D HN 0.480 nan 8.370 nan 0.000 0.451 5929 D N 2.861 123.151 120.400 -0.182 0.000 2.172 5929 D HA -0.202 4.438 4.640 0.000 0.000 0.196 5929 D C 1.746 177.553 176.300 -0.821 0.000 0.999 5929 D CA 0.666 54.444 54.000 -0.370 0.000 0.856 5929 D CB 0.006 40.642 40.800 -0.273 0.000 0.934 5929 D HN 0.371 nan 8.370 nan 0.000 0.453 5930 L N 0.621 121.524 121.223 -0.532 0.000 2.083 5930 L HA -0.070 4.270 4.340 0.000 0.000 0.209 5930 L C 2.104 178.855 176.870 -0.199 0.000 1.083 5930 L CA 1.721 56.308 54.840 -0.423 0.000 0.752 5930 L CB -0.696 41.306 42.059 -0.095 0.000 0.899 5930 L HN -0.013 nan 8.230 nan 0.000 0.433 5931 A N -1.174 121.609 122.820 -0.061 0.000 1.930 5931 A HA -0.241 4.079 4.320 0.000 0.000 0.217 5931 A C 2.167 179.769 177.584 0.030 0.000 1.175 5931 A CA 1.693 53.775 52.037 0.074 0.000 0.627 5931 A CB -0.536 18.487 19.000 0.038 0.000 0.815 5931 A HN 0.651 nan 8.150 nan 0.000 0.443 5932 Q N -1.053 118.698 119.800 -0.081 0.000 2.170 5932 Q HA -0.184 4.156 4.340 0.000 0.000 0.203 5932 Q C 1.787 177.815 176.000 0.047 0.000 0.976 5932 Q CA 1.565 57.348 55.803 -0.033 0.000 0.858 5932 Q CB -0.340 28.366 28.738 -0.053 0.000 0.907 5932 Q HN 0.891 nan 8.270 nan 0.000 0.433 5933 H N -1.343 117.668 119.070 -0.098 0.000 2.389 5933 H HA -0.124 4.432 4.556 0.000 0.000 0.299 5933 H C 1.307 176.520 175.328 -0.192 0.000 1.081 5933 H CA 1.030 56.962 56.048 -0.194 0.000 1.345 5933 H CB 0.108 29.669 29.762 -0.335 0.000 1.393 5933 H HN 0.305 nan 8.280 nan 0.000 0.520 5934 Y N 0.382 120.748 120.300 0.109 0.000 2.365 5934 Y HA -0.082 4.468 4.550 0.000 0.000 0.293 5934 Y C 2.404 178.322 175.900 0.029 0.000 1.119 5934 Y CA 0.085 58.218 58.100 0.054 0.000 1.203 5934 Y CB 0.117 38.597 38.460 0.033 0.000 1.026 5934 Y HN 0.072 nan 8.280 nan 0.000 0.549 5935 L N -0.615 120.707 121.223 0.166 0.000 2.083 5935 L HA -0.246 4.094 4.340 0.000 0.000 0.209 5935 L C 2.649 179.552 176.870 0.055 0.000 1.083 5935 L CA 1.069 55.959 54.840 0.083 0.000 0.752 5935 L CB -0.630 41.455 42.059 0.044 0.000 0.899 5935 L HN 0.240 nan 8.230 nan 0.000 0.433 5936 A N -0.164 122.688 122.820 0.053 0.000 1.969 5936 A HA -0.238 4.082 4.320 0.000 0.000 0.218 5936 A C 2.372 179.975 177.584 0.032 0.000 1.169 5936 A CA 1.697 53.752 52.037 0.031 0.000 0.635 5936 A CB -0.384 18.630 19.000 0.023 0.000 0.810 5936 A HN 0.322 nan 8.150 nan 0.000 0.445 5937 K N -0.367 120.068 120.400 0.058 0.000 2.097 5937 K HA -0.144 4.176 4.320 0.000 0.000 0.206 5937 K C 1.030 177.658 176.600 0.047 0.000 1.049 5937 K CA 1.511 57.834 56.287 0.060 0.000 0.933 5937 K CB -0.002 32.565 32.500 0.112 0.000 0.717 5937 K HN 0.353 nan 8.250 nan 0.000 0.442 5938 E N -0.759 119.470 120.200 0.048 0.000 2.474 5938 E HA 0.059 4.409 4.350 0.000 0.000 0.195 5938 E C 0.602 177.214 176.600 0.018 0.000 1.039 5938 E CA 0.628 57.047 56.400 0.031 0.000 0.881 5938 E CB 0.880 30.599 29.700 0.031 0.000 0.970 5938 E HN 0.540 nan 8.360 nan 0.000 0.486 5939 G N 2.119 110.928 108.800 0.016 0.000 2.176 5939 G HA2 -0.288 3.672 3.960 0.000 0.000 0.252 5939 G HA3 -0.288 3.672 3.960 0.000 0.000 0.252 5939 G C 0.231 175.129 174.900 -0.002 0.000 1.024 5939 G CA 0.107 45.211 45.100 0.005 0.000 0.755 5939 G HN 0.273 nan 8.290 nan 0.000 0.507 5940 I N 0.992 121.561 120.570 -0.002 0.000 2.352 5940 I HA 0.378 4.548 4.170 0.000 0.000 0.290 5940 I C 1.125 177.219 176.117 -0.037 0.000 1.036 5940 I CA -0.955 60.334 61.300 -0.017 0.000 1.336 5940 I CB 1.373 39.367 38.000 -0.011 0.000 1.407 5940 I HN 0.165 nan 8.210 nan 0.000 0.497 5941 V N 4.069 123.946 119.914 -0.061 0.000 2.546 5941 V HA 0.889 5.009 4.120 0.000 0.000 0.284 5941 V C 0.116 176.108 176.094 -0.170 0.000 1.050 5941 V CA -0.215 62.029 62.300 -0.093 0.000 0.981 5941 V CB 1.118 32.888 31.823 -0.088 0.000 0.990 5941 V HN 0.830 nan 8.190 nan 0.000 0.474 5942 A N 3.710 126.425 122.820 -0.174 0.000 2.539 5942 A HA 1.020 5.340 4.320 0.000 0.000 0.296 5942 A C -0.356 177.101 177.584 -0.212 0.000 1.073 5942 A CA -0.354 51.547 52.037 -0.226 0.000 0.700 5942 A CB 1.905 20.831 19.000 -0.122 0.000 1.296 5942 A HN 2.417 nan 8.150 nan 0.000 0.405 5943 A N 1.526 124.194 122.820 -0.253 0.000 2.381 5943 A HA 0.740 5.060 4.320 0.000 0.000 0.299 5943 A C -0.092 177.499 177.584 0.012 0.000 1.049 5943 A CA -0.595 51.392 52.037 -0.083 0.000 0.715 5943 A CB 0.925 19.924 19.000 -0.002 0.000 1.222 5943 A HN 1.276 nan 8.150 nan 0.000 0.428 5944 R N 2.019 122.536 120.500 0.029 0.000 2.602 5944 R HA 0.696 5.036 4.340 0.000 0.000 0.237 5944 R C 0.373 176.711 176.300 0.062 0.000 1.219 5944 R CA -0.153 55.972 56.100 0.042 0.000 1.121 5944 R CB 0.341 30.651 30.300 0.017 0.000 1.408 5944 R HN 1.067 nan 8.270 nan 0.000 0.559 5945 R N -1.197 119.333 120.500 0.049 0.000 3.502 5945 R HA -0.130 4.210 4.340 0.000 0.000 0.266 5945 R C -1.235 175.098 176.300 0.056 0.000 1.077 5945 R CA 0.706 56.833 56.100 0.044 0.000 0.718 5945 R CB -2.557 27.763 30.300 0.032 0.000 1.120 5945 R HN 0.291 nan 8.270 nan 0.000 0.457 5946 V N 1.283 121.244 119.914 0.077 0.000 2.614 5946 V HA 0.082 4.202 4.120 0.000 0.000 0.291 5946 V C 1.178 177.297 176.094 0.042 0.000 1.049 5946 V CA -0.179 62.170 62.300 0.081 0.000 1.038 5946 V CB 1.411 33.312 31.823 0.129 0.000 0.980 5946 V HN 0.329 nan 8.190 nan 0.000 0.481 5947 K N 3.073 123.487 120.400 0.024 0.000 2.448 5947 K HA 0.024 4.345 4.320 0.000 0.000 0.278 5947 K C 1.175 177.774 176.600 -0.001 0.000 1.009 5947 K CA -0.290 56.003 56.287 0.009 0.000 0.995 5947 K CB 0.525 33.026 32.500 0.001 0.000 0.917 5947 K HN 0.615 nan 8.250 nan 0.000 0.481 5948 K N 2.311 122.711 120.400 0.001 0.000 2.113 5948 K HA -0.188 4.132 4.320 0.000 0.000 0.208 5948 K C 1.852 178.443 176.600 -0.016 0.000 1.047 5948 K CA 2.127 58.411 56.287 -0.004 0.000 0.928 5948 K CB -0.473 32.026 32.500 -0.001 0.000 0.716 5948 K HN 0.580 nan 8.250 nan 0.000 0.446 5949 S N 0.163 115.853 115.700 -0.018 0.000 2.370 5949 S HA -0.154 4.316 4.470 0.000 0.000 0.226 5949 S C 1.345 175.919 174.600 -0.042 0.000 1.033 5949 S CA 1.759 59.943 58.200 -0.026 0.000 1.011 5949 S CB -0.391 62.795 63.200 -0.022 0.000 0.852 5949 S HN 0.428 nan 8.310 nan 0.000 0.457 5950 D N 0.418 120.788 120.400 -0.050 0.000 2.234 5950 D HA 0.025 4.665 4.640 0.000 0.000 0.205 5950 D C 1.931 178.160 176.300 -0.118 0.000 0.962 5950 D CA 0.607 54.556 54.000 -0.085 0.000 0.855 5950 D CB -0.159 40.591 40.800 -0.083 0.000 0.951 5950 D HN 0.390 nan 8.370 nan 0.000 0.500 5951 M N 0.751 120.302 119.600 -0.080 0.000 2.159 5951 M HA -0.098 4.382 4.480 0.000 0.000 0.263 5951 M C 1.828 178.089 176.300 -0.064 0.000 1.063 5951 M CA 1.232 56.489 55.300 -0.072 0.000 1.110 5951 M CB -0.724 31.864 32.600 -0.020 0.000 1.374 5951 M HN 0.072 nan 8.290 nan 0.000 0.411 5952 E N -0.073 120.096 120.200 -0.051 0.000 2.112 5952 E HA -0.126 4.224 4.350 0.000 0.000 0.190 5952 E C 2.016 178.584 176.600 -0.054 0.000 0.979 5952 E CA 0.791 57.166 56.400 -0.042 0.000 0.814 5952 E CB 0.015 29.697 29.700 -0.030 0.000 0.762 5952 E HN 0.492 nan 8.360 nan 0.000 0.460 5953 K N 0.574 120.932 120.400 -0.070 0.000 2.148 5953 K HA -0.075 4.245 4.320 0.000 0.000 0.204 5953 K C 2.101 178.642 176.600 -0.098 0.000 1.050 5953 K CA 0.750 56.990 56.287 -0.078 0.000 0.942 5953 K CB 0.007 32.454 32.500 -0.087 0.000 0.724 5953 K HN 0.098 nan 8.250 nan 0.000 0.446 5954 L N 0.289 121.430 121.223 -0.136 0.000 2.072 5954 L HA -0.132 4.208 4.340 0.000 0.000 0.205 5954 L C 2.560 179.377 176.870 -0.088 0.000 1.079 5954 L CA 0.971 55.712 54.840 -0.164 0.000 0.752 5954 L CB -0.507 41.374 42.059 -0.295 0.000 0.906 5954 L HN 0.181 nan 8.230 nan 0.000 0.436 5955 A N 0.196 122.979 122.820 -0.062 0.000 1.902 5955 A HA -0.208 4.112 4.320 0.000 0.000 0.217 5955 A C 2.328 179.900 177.584 -0.020 0.000 1.181 5955 A CA 1.640 53.661 52.037 -0.027 0.000 0.623 5955 A CB -0.287 18.701 19.000 -0.019 0.000 0.818 5955 A HN 0.306 nan 8.150 nan 0.000 0.443 5956 K N -0.433 119.951 120.400 -0.027 0.000 2.031 5956 K HA 0.027 4.347 4.320 0.000 0.000 0.205 5956 K C 2.386 178.978 176.600 -0.013 0.000 1.049 5956 K CA 1.068 57.344 56.287 -0.018 0.000 0.939 5956 K CB -0.291 32.195 32.500 -0.024 0.000 0.717 5956 K HN 0.416 nan 8.250 nan 0.000 0.438 5957 A N 1.188 123.992 122.820 -0.028 0.000 1.855 5957 A HA -0.146 4.174 4.320 0.000 0.000 0.215 5957 A C 2.305 179.882 177.584 -0.011 0.000 1.191 5957 A CA 2.225 54.247 52.037 -0.025 0.000 0.613 5957 A CB -1.063 17.908 19.000 -0.049 0.000 0.829 5957 A HN 0.469 nan 8.150 nan 0.000 0.442 5958 T N -4.238 110.307 114.554 -0.015 0.000 3.043 5958 T HA 0.352 4.702 4.350 0.000 0.000 0.263 5958 T C 1.460 176.171 174.700 0.019 0.000 1.094 5958 T CA 1.238 63.341 62.100 0.004 0.000 1.127 5958 T CB -0.185 68.688 68.868 0.008 0.000 0.905 5958 T HN 1.814 nan 8.240 nan 0.000 0.490 5959 G N 1.439 110.248 108.800 0.016 0.000 2.143 5959 G HA2 -0.036 3.924 3.960 0.000 0.000 0.248 5959 G HA3 -0.036 3.924 3.960 0.000 0.000 0.248 5959 G C 0.259 175.172 174.900 0.022 0.000 0.991 5959 G CA 0.023 45.136 45.100 0.023 0.000 0.689 5959 G HN 1.208 nan 8.290 nan 0.000 0.522 5960 A N -0.384 122.447 122.820 0.019 0.000 2.445 5960 A HA 0.594 4.914 4.320 0.000 0.000 0.242 5960 A C 0.378 177.974 177.584 0.021 0.000 1.075 5960 A CA 0.612 52.665 52.037 0.028 0.000 0.777 5960 A CB 0.397 19.420 19.000 0.038 0.000 1.013 5960 A HN 0.912 nan 8.150 nan 0.000 0.493 5961 N N 1.427 120.142 118.700 0.025 0.000 2.417 5961 N HA 0.400 5.140 4.740 0.000 0.000 0.274 5961 N C -0.867 174.657 175.510 0.023 0.000 0.987 5961 N CA -0.373 52.688 53.050 0.019 0.000 0.912 5961 N CB 1.317 39.814 38.487 0.017 0.000 1.177 5961 N HN 0.334 nan 8.380 nan 0.000 0.490 5962 V N 4.055 123.981 119.914 0.019 0.000 2.540 5962 V HA 0.101 4.221 4.120 0.000 0.000 0.297 5962 V C 0.488 176.594 176.094 0.021 0.000 1.024 5962 V CA 0.150 62.464 62.300 0.022 0.000 1.105 5962 V CB -0.126 31.707 31.823 0.016 0.000 0.938 5962 V HN 0.591 nan 8.190 nan 0.000 0.482 5963 I N 4.282 124.867 120.570 0.025 0.000 2.740 5963 I HA 0.472 4.643 4.170 0.000 0.000 0.303 5963 I C 1.107 177.236 176.117 0.020 0.000 1.044 5963 I CA 0.323 61.635 61.300 0.020 0.000 1.064 5963 I CB 2.434 40.446 38.000 0.021 0.000 1.249 5963 I HN 0.784 nan 8.210 nan 0.000 0.433 5964 T N 2.348 116.911 114.554 0.015 0.000 2.904 5964 T HA 0.188 4.538 4.350 0.000 0.000 0.243 5964 T C 0.781 175.488 174.700 0.013 0.000 1.024 5964 T CA 0.282 62.390 62.100 0.014 0.000 1.158 5964 T CB -0.341 68.534 68.868 0.011 0.000 0.867 5964 T HN 0.429 nan 8.240 nan 0.000 0.429 5965 N N 0.632 119.339 118.700 0.010 0.000 2.456 5965 N HA 0.364 5.104 4.740 0.000 0.000 0.288 5965 N C 0.950 176.465 175.510 0.009 0.000 1.059 5965 N CA -0.584 52.471 53.050 0.008 0.000 0.946 5965 N CB 1.107 39.598 38.487 0.006 0.000 1.150 5965 N HN 0.288 nan 8.380 nan 0.000 0.479 5966 I N 2.205 122.779 120.570 0.007 0.000 2.264 5966 I HA -0.235 3.935 4.170 0.000 0.000 0.248 5966 I C 1.956 178.074 176.117 0.002 0.000 1.111 5966 I CA 0.899 62.202 61.300 0.005 0.000 1.382 5966 I CB 0.028 38.029 38.000 0.002 0.000 1.060 5966 I HN 0.450 nan 8.210 nan 0.000 0.418 5967 K N 0.406 120.807 120.400 0.000 0.000 2.211 5967 K HA -0.156 4.164 4.320 0.000 0.000 0.203 5967 K C 1.424 178.025 176.600 0.001 0.000 1.050 5967 K CA 1.215 57.501 56.287 -0.002 0.000 0.945 5967 K CB -0.322 32.176 32.500 -0.003 0.000 0.732 5967 K HN 0.335 nan 8.250 nan 0.000 0.451 5968 D N 0.585 120.988 120.400 0.004 0.000 2.249 5968 D HA -0.064 4.576 4.640 0.000 0.000 0.205 5968 D C 0.579 176.884 176.300 0.008 0.000 0.962 5968 D CA 0.033 54.037 54.000 0.006 0.000 0.860 5968 D CB -0.172 40.633 40.800 0.007 0.000 0.955 5968 D HN -0.014 nan 8.370 nan 0.000 0.505 5969 L N 1.580 122.808 121.223 0.010 0.000 2.628 5969 L HA 0.024 4.364 4.340 0.000 0.000 0.274 5969 L C 0.329 177.205 176.870 0.011 0.000 1.209 5969 L CA 0.236 55.084 54.840 0.013 0.000 0.930 5969 L CB 0.042 42.110 42.059 0.015 0.000 1.183 5969 L HN -0.056 nan 8.230 nan 0.000 0.492 5970 S N 3.355 119.062 115.700 0.013 0.000 2.704 5970 S HA 0.800 5.270 4.470 0.000 0.000 0.296 5970 S C 0.854 175.462 174.600 0.015 0.000 1.138 5970 S CA -0.388 57.819 58.200 0.011 0.000 0.875 5970 S CB 1.263 64.468 63.200 0.010 0.000 1.151 5970 S HN 0.812 nan 8.310 nan 0.000 0.500 5971 A N 0.515 123.343 122.820 0.014 0.000 1.978 5971 A HA -0.089 4.231 4.320 0.000 0.000 0.220 5971 A C 2.026 179.620 177.584 0.017 0.000 1.170 5971 A CA 1.376 53.422 52.037 0.016 0.000 0.636 5971 A CB -0.925 18.084 19.000 0.014 0.000 0.810 5971 A HN 0.738 nan 8.150 nan 0.000 0.448 5972 Q N 0.064 119.873 119.800 0.015 0.000 2.437 5972 Q HA -0.114 4.226 4.340 0.000 0.000 0.210 5972 Q C 0.641 176.651 176.000 0.017 0.000 0.972 5972 Q CA 1.157 56.969 55.803 0.015 0.000 0.903 5972 Q CB -0.235 28.510 28.738 0.012 0.000 0.967 5972 Q HN 0.682 nan 8.270 nan 0.000 0.486 5973 D N -0.280 120.132 120.400 0.019 0.000 2.346 5973 D HA 0.076 4.716 4.640 0.000 0.000 0.206 5973 D C 0.489 176.806 176.300 0.029 0.000 1.001 5973 D CA 0.092 54.105 54.000 0.022 0.000 0.871 5973 D CB 0.650 41.462 40.800 0.021 0.000 0.943 5973 D HN 0.198 nan 8.370 nan 0.000 0.518 5974 L N 1.033 122.274 121.223 0.030 0.000 2.380 5974 L HA 0.381 4.721 4.340 0.000 0.000 0.273 5974 L C 1.154 178.047 176.870 0.038 0.000 1.138 5974 L CA -0.451 54.411 54.840 0.037 0.000 0.832 5974 L CB 1.212 43.292 42.059 0.034 0.000 1.124 5974 L HN -0.143 nan 8.230 nan 0.000 0.454 5975 G N 1.207 110.034 108.800 0.046 0.000 2.491 5975 G HA2 0.457 4.417 3.960 0.000 0.000 0.327 5975 G HA3 0.457 4.417 3.960 0.000 0.000 0.327 5975 G C -1.188 173.739 174.900 0.045 0.000 1.189 5975 G CA -0.489 44.636 45.100 0.042 0.000 0.956 5975 G HN 0.533 nan 8.290 nan 0.000 0.491 5976 D N -0.171 120.252 120.400 0.038 0.000 2.248 5976 D HA 0.594 5.234 4.640 0.000 0.000 0.246 5976 D C -0.353 175.965 176.300 0.030 0.000 1.027 5976 D CA 0.029 54.049 54.000 0.033 0.000 0.853 5976 D CB 2.078 42.893 40.800 0.025 0.000 1.243 5976 D HN 0.553 nan 8.370 nan 0.000 0.462 5977 A N 0.589 123.431 122.820 0.037 0.000 2.398 5977 A HA 0.604 4.924 4.320 0.000 0.000 0.301 5977 A C 0.997 178.600 177.584 0.031 0.000 1.041 5977 A CA -0.485 51.573 52.037 0.036 0.000 0.711 5977 A CB 1.655 20.693 19.000 0.063 0.000 1.240 5977 A HN 0.515 nan 8.150 nan 0.000 0.420 5978 G N 0.655 109.467 108.800 0.019 0.000 2.422 5978 G HA2 0.246 4.206 3.960 0.000 0.000 0.218 5978 G HA3 0.246 4.206 3.960 0.000 0.000 0.218 5978 G C 0.326 175.243 174.900 0.029 0.000 1.146 5978 G CA 1.690 46.800 45.100 0.016 0.000 0.769 5978 G HN 1.135 nan 8.290 nan 0.000 0.547 5979 L N -0.073 121.176 121.223 0.043 0.000 2.505 5979 L HA 0.600 4.940 4.340 0.000 0.000 0.266 5979 L C -1.313 175.607 176.870 0.085 0.000 0.954 5979 L CA -0.754 54.120 54.840 0.056 0.000 0.852 5979 L CB 2.505 44.595 42.059 0.053 0.000 1.282 5979 L HN -0.143 nan 8.230 nan 0.000 0.403 5980 V N 4.486 124.453 119.914 0.089 0.000 2.350 5980 V HA 0.632 4.752 4.120 0.000 0.000 0.285 5980 V C -0.413 175.738 176.094 0.095 0.000 1.014 5980 V CA -0.420 61.954 62.300 0.124 0.000 0.831 5980 V CB 1.322 33.229 31.823 0.140 0.000 1.000 5980 V HN 0.823 nan 8.190 nan 0.000 0.433 5981 E N 3.215 123.480 120.200 0.110 0.000 2.308 5981 E HA 0.391 4.741 4.350 0.000 0.000 0.275 5981 E C -0.964 175.643 176.600 0.012 0.000 0.890 5981 E CA -0.681 55.747 56.400 0.047 0.000 0.754 5981 E CB 2.169 31.883 29.700 0.024 0.000 1.207 5981 E HN 0.734 nan 8.360 nan 0.000 0.426 5982 E N 4.135 124.320 120.200 -0.026 0.000 2.180 5982 E HA 0.217 4.567 4.350 0.000 0.000 0.283 5982 E C -0.896 175.612 176.600 -0.153 0.000 1.061 5982 E CA -0.151 56.212 56.400 -0.061 0.000 0.861 5982 E CB 0.641 30.322 29.700 -0.032 0.000 1.056 5982 E HN 0.336 nan 8.360 nan 0.000 0.407 5983 R N 3.680 124.008 120.500 -0.287 0.000 2.686 5983 R HA 0.396 4.736 4.340 0.000 0.000 0.283 5983 R C -0.803 175.322 176.300 -0.292 0.000 0.978 5983 R CA -0.916 54.954 56.100 -0.383 0.000 0.897 5983 R CB 2.007 31.876 30.300 -0.718 0.000 1.192 5983 R HN 0.325 nan 8.270 nan 0.000 0.457 5984 K N 2.390 122.677 120.400 -0.188 0.000 2.213 5984 K HA 0.414 4.734 4.320 0.000 0.000 0.270 5984 K C -0.773 175.776 176.600 -0.085 0.000 1.002 5984 K CA -0.554 55.670 56.287 -0.105 0.000 0.868 5984 K CB 1.272 33.734 32.500 -0.063 0.000 1.093 5984 K HN 0.296 nan 8.250 nan 0.000 0.454 5985 I N 1.945 122.492 120.570 -0.038 0.000 2.390 5985 I HA 0.086 4.256 4.170 0.000 0.000 0.283 5985 I C 0.044 176.170 176.117 0.015 0.000 1.016 5985 I CA -0.178 61.125 61.300 0.006 0.000 1.151 5985 I CB 1.677 39.719 38.000 0.070 0.000 1.293 5985 I HN 0.578 nan 8.210 nan 0.000 0.458 5986 S N 4.473 120.178 115.700 0.009 0.000 3.581 5986 S HA -0.193 4.277 4.470 0.000 0.000 0.354 5986 S C 1.362 175.965 174.600 0.005 0.000 1.059 5986 S CA 1.065 59.270 58.200 0.009 0.000 1.060 5986 S CB -1.329 61.881 63.200 0.016 0.000 0.908 5986 S HN 1.457 nan 8.310 nan 0.000 0.475 5987 G N 0.438 109.237 108.800 -0.002 0.000 2.358 5987 G HA2 -0.264 3.696 3.960 0.000 0.000 0.224 5987 G HA3 -0.264 3.696 3.960 0.000 0.000 0.224 5987 G C -0.365 174.533 174.900 -0.004 0.000 1.073 5987 G CA 0.045 45.142 45.100 -0.005 0.000 0.635 5987 G HN 0.607 nan 8.290 nan 0.000 0.509 5988 D N 1.880 122.284 120.400 0.006 0.000 2.412 5988 D HA 0.386 5.026 4.640 0.000 0.000 0.257 5988 D C 0.476 176.781 176.300 0.008 0.000 1.217 5988 D CA 0.900 54.908 54.000 0.014 0.000 0.897 5988 D CB 1.405 42.222 40.800 0.028 0.000 1.132 5988 D HN 0.276 nan 8.370 nan 0.000 0.493 5989 S N 3.434 119.137 115.700 0.005 0.000 2.481 5989 S HA 0.368 4.838 4.470 0.000 0.000 0.276 5989 S C -0.141 174.475 174.600 0.028 0.000 1.247 5989 S CA -0.425 57.772 58.200 -0.005 0.000 1.053 5989 S CB 0.149 63.346 63.200 -0.005 0.000 0.925 5989 S HN 0.315 nan 8.310 nan 0.000 0.491 5990 M N 4.437 124.051 119.600 0.023 0.000 2.619 5990 M HA 0.534 5.014 4.480 0.000 0.000 0.297 5990 M C -1.068 175.304 176.300 0.121 0.000 1.229 5990 M CA -0.651 54.724 55.300 0.125 0.000 0.860 5990 M CB 2.151 34.922 32.600 0.285 0.000 1.741 5990 M HN 0.441 nan 8.290 nan 0.000 0.462 5991 I N 2.000 122.718 120.570 0.246 0.000 2.330 5991 I HA 0.337 4.507 4.170 0.000 0.000 0.289 5991 I C -1.260 175.149 176.117 0.488 0.000 1.001 5991 I CA -0.457 61.010 61.300 0.279 0.000 1.193 5991 I CB 0.895 39.058 38.000 0.273 0.000 1.345 5991 I HN 0.391 nan 8.210 nan 0.000 0.461 5992 F N 6.256 126.246 119.950 0.066 0.000 2.391 5992 F HA 0.335 4.862 4.527 -0.000 0.000 0.359 5992 F C 0.227 176.061 175.800 0.058 0.000 1.122 5992 F CA -0.994 57.033 58.000 0.045 0.000 1.120 5992 F CB 1.309 40.326 39.000 0.028 0.000 1.142 5992 F HN 0.001 nan 8.300 nan 0.000 0.483 5993 V N 4.915 124.927 119.914 0.163 0.000 2.311 5993 V HA 0.363 4.483 4.120 0.000 0.000 0.275 5993 V C -0.248 175.870 176.094 0.039 0.000 1.022 5993 V CA -0.577 61.785 62.300 0.104 0.000 0.830 5993 V CB 0.697 32.552 31.823 0.054 0.000 1.012 5993 V HN 0.786 nan 8.190 nan 0.000 0.452 5994 E N 3.318 123.553 120.200 0.058 0.000 2.433 5994 E HA 0.679 5.030 4.350 0.000 0.000 0.273 5994 E C -0.819 175.793 176.600 0.020 0.000 0.950 5994 E CA -0.911 55.506 56.400 0.027 0.000 0.796 5994 E CB 1.756 31.487 29.700 0.053 0.000 1.330 5994 E HN 0.231 nan 8.360 nan 0.000 0.455 5995 E N -0.946 119.255 120.200 0.001 0.000 2.596 5995 E HA -0.141 4.209 4.350 0.000 0.000 0.272 5995 E C -0.704 175.880 176.600 -0.026 0.000 1.039 5995 E CA 0.477 56.870 56.400 -0.011 0.000 0.804 5995 E CB -2.405 27.296 29.700 0.001 0.000 1.373 5995 E HN 0.597 nan 8.360 nan 0.000 0.404 5996 C N 0.815 120.097 119.300 -0.031 0.000 2.679 5996 C HA 0.050 4.510 4.460 0.000 0.000 0.417 5996 C C 2.285 177.223 174.990 -0.086 0.000 1.302 5996 C CA 0.054 59.049 59.018 -0.039 0.000 1.973 5996 C CB 0.358 28.080 27.740 -0.029 0.000 2.715 5996 C HN 0.388 nan 8.230 nan 0.000 0.628 5997 K N 0.859 121.193 120.400 -0.110 0.000 1.973 5997 K HA -0.069 4.252 4.320 0.000 0.000 0.212 5997 K C 0.448 176.753 176.600 -0.491 0.000 1.047 5997 K CA 1.303 57.425 56.287 -0.276 0.000 0.937 5997 K CB -0.058 32.328 32.500 -0.191 0.000 0.721 5997 K HN 0.686 nan 8.250 nan 0.000 0.440 5998 H N 0.391 119.460 119.070 -0.002 0.000 2.380 5998 H HA 0.244 4.800 4.556 0.000 0.000 0.231 5998 H C -2.501 172.822 175.328 -0.009 0.000 1.415 5998 H CA -1.983 54.062 56.048 -0.005 0.000 1.433 5998 H CB 0.649 30.409 29.762 -0.004 0.000 1.544 5998 H HN 0.197 nan 8.280 nan 0.000 0.503 5999 P HA 0.137 nan 4.420 nan 0.000 0.275 5999 P C 0.380 177.695 177.300 0.024 0.000 1.227 5999 P CA -0.526 62.586 63.100 0.021 0.000 0.781 5999 P CB 1.842 33.536 31.700 -0.009 0.000 0.906 6000 K N 0.621 121.027 120.400 0.010 0.000 2.373 6000 K HA 0.459 4.779 4.320 0.000 0.000 0.202 6000 K C 0.186 176.779 176.600 -0.012 0.000 1.025 6000 K CA 0.042 56.331 56.287 0.003 0.000 1.115 6000 K CB 0.531 33.031 32.500 0.001 0.000 0.858 6000 K HN 0.574 nan 8.250 nan 0.000 0.525 6001 A N -0.204 122.604 122.820 -0.020 0.000 2.520 6001 A HA 0.716 5.036 4.320 0.000 0.000 0.298 6001 A C -1.612 175.947 177.584 -0.041 0.000 1.051 6001 A CA -0.689 51.328 52.037 -0.033 0.000 0.690 6001 A CB 1.776 20.750 19.000 -0.043 0.000 1.281 6001 A HN -0.051 nan 8.150 nan 0.000 0.402 6002 V N 0.866 120.753 119.914 -0.046 0.000 3.007 6002 V HA 0.852 4.972 4.120 0.000 0.000 0.311 6002 V C -0.801 175.252 176.094 -0.068 0.000 1.120 6002 V CA -0.153 62.114 62.300 -0.054 0.000 0.980 6002 V CB 2.660 34.459 31.823 -0.041 0.000 1.033 6002 V HN 1.084 nan 8.190 nan 0.000 0.429 6003 T N 6.601 121.101 114.554 -0.089 0.000 2.848 6003 T HA 0.498 4.848 4.350 0.000 0.000 0.285 6003 T C -0.608 174.031 174.700 -0.103 0.000 0.995 6003 T CA -0.264 61.771 62.100 -0.107 0.000 0.970 6003 T CB 1.328 70.100 68.868 -0.159 0.000 0.976 6003 T HN 0.751 nan 8.240 nan 0.000 0.441 6004 M N 4.538 124.090 119.600 -0.080 0.000 2.114 6004 M HA 0.570 5.051 4.480 0.000 0.000 0.332 6004 M C -1.559 174.705 176.300 -0.060 0.000 1.014 6004 M CA -1.133 54.130 55.300 -0.062 0.000 0.956 6004 M CB 0.726 33.302 32.600 -0.040 0.000 1.551 6004 M HN 0.493 nan 8.290 nan 0.000 0.427 6005 L N 7.517 128.706 121.223 -0.058 0.000 2.257 6005 L HA 0.561 4.901 4.340 0.000 0.000 0.290 6005 L C -1.409 175.458 176.870 -0.005 0.000 1.044 6005 L CA 0.026 54.846 54.840 -0.034 0.000 0.810 6005 L CB 0.680 42.723 42.059 -0.027 0.000 1.193 6005 L HN 0.697 nan 8.230 nan 0.000 0.425 6006 I N 5.897 126.466 120.570 -0.001 0.000 2.336 6006 I HA 0.495 4.665 4.170 0.000 0.000 0.292 6006 I C 0.061 176.187 176.117 0.015 0.000 0.991 6006 I CA -0.665 60.638 61.300 0.006 0.000 1.227 6006 I CB 0.801 38.801 38.000 0.000 0.000 1.366 6006 I HN 0.550 nan 8.210 nan 0.000 0.466 6007 R N 3.962 124.473 120.500 0.019 0.000 2.902 6007 R HA 0.912 5.252 4.340 0.000 0.000 0.258 6007 R C -0.271 176.041 176.300 0.019 0.000 1.071 6007 R CA -1.064 55.050 56.100 0.022 0.000 1.024 6007 R CB 1.943 32.259 30.300 0.027 0.000 1.184 6007 R HN 0.859 nan 8.270 nan 0.000 0.492 6008 G N -1.107 107.705 108.800 0.021 0.000 2.328 6008 G HA2 -0.018 3.942 3.960 0.000 0.000 0.299 6008 G HA3 -0.018 3.942 3.960 0.000 0.000 0.299 6008 G C -0.003 174.911 174.900 0.023 0.000 1.435 6008 G CA -0.079 45.034 45.100 0.022 0.000 0.865 6008 G HN 0.390 nan 8.290 nan 0.000 0.601 6009 T N -0.813 113.757 114.554 0.025 0.000 2.995 6009 T HA 0.305 4.655 4.350 0.000 0.000 0.269 6009 T C 0.830 175.550 174.700 0.033 0.000 1.091 6009 T CA 2.312 64.428 62.100 0.026 0.000 1.128 6009 T CB -0.249 68.634 68.868 0.025 0.000 0.891 6009 T HN 0.764 nan 8.240 nan 0.000 0.492 6010 T N 0.092 114.670 114.554 0.041 0.000 2.889 6010 T HA 0.305 4.655 4.350 0.000 0.000 0.315 6010 T C 0.260 174.989 174.700 0.047 0.000 1.291 6010 T CA -0.652 61.484 62.100 0.059 0.000 1.028 6010 T CB 2.103 71.025 68.868 0.091 0.000 1.235 6010 T HN -0.020 nan 8.240 nan 0.000 0.491 6011 E N 0.941 121.154 120.200 0.023 0.000 2.049 6011 E HA -0.218 4.132 4.350 0.000 0.000 0.198 6011 E C 1.384 177.928 176.600 -0.093 0.000 1.007 6011 E CA 2.219 58.579 56.400 -0.066 0.000 0.809 6011 E CB -0.230 29.378 29.700 -0.153 0.000 0.749 6011 E HN 0.742 nan 8.360 nan 0.000 0.450 6012 H N -1.156 117.918 119.070 0.007 0.000 2.456 6012 H HA -0.030 4.526 4.556 -0.000 0.000 0.296 6012 H C 1.990 177.321 175.328 0.006 0.000 1.079 6012 H CA 1.253 57.305 56.048 0.006 0.000 1.322 6012 H CB 0.049 29.814 29.762 0.005 0.000 1.388 6012 H HN 0.041 nan 8.280 nan 0.000 0.538 6013 V N 1.193 121.178 119.914 0.117 0.000 2.323 6013 V HA -0.197 3.923 4.120 0.000 0.000 0.244 6013 V C 2.300 178.418 176.094 0.039 0.000 1.041 6013 V CA 1.874 64.215 62.300 0.067 0.000 1.025 6013 V CB -0.439 31.416 31.823 0.053 0.000 0.656 6013 V HN 0.546 nan 8.190 nan 0.000 0.451 6014 I N -1.948 118.637 120.570 0.024 0.000 2.830 6014 I HA -0.069 4.101 4.170 0.000 0.000 0.263 6014 I C 2.078 178.195 176.117 0.001 0.000 1.230 6014 I CA 1.404 62.710 61.300 0.010 0.000 1.480 6014 I CB -0.524 37.478 38.000 0.003 0.000 1.095 6014 I HN 0.294 nan 8.210 nan 0.000 0.455 6015 E N 1.482 121.679 120.200 -0.004 0.000 2.076 6015 E HA -0.202 4.149 4.350 0.000 0.000 0.190 6015 E C 2.045 178.651 176.600 0.010 0.000 0.979 6015 E CA 1.060 57.453 56.400 -0.011 0.000 0.807 6015 E CB -0.009 29.669 29.700 -0.037 0.000 0.761 6015 E HN 0.615 nan 8.360 nan 0.000 0.454 6016 E N 0.720 120.936 120.200 0.027 0.000 2.106 6016 E HA -0.159 4.191 4.350 0.000 0.000 0.192 6016 E C 2.061 178.672 176.600 0.020 0.000 0.984 6016 E CA 0.905 57.322 56.400 0.029 0.000 0.806 6016 E CB 0.237 29.960 29.700 0.039 0.000 0.750 6016 E HN 0.022 nan 8.360 nan 0.000 0.458 6017 V N 1.234 121.159 119.914 0.018 0.000 2.343 6017 V HA -0.250 3.870 4.120 0.000 0.000 0.247 6017 V C 2.464 178.562 176.094 0.007 0.000 1.051 6017 V CA 1.738 64.045 62.300 0.013 0.000 1.036 6017 V CB -0.734 31.096 31.823 0.012 0.000 0.654 6017 V HN 0.437 nan 8.190 nan 0.000 0.451 6018 A N -0.279 122.542 122.820 0.003 0.000 1.933 6018 A HA -0.200 4.120 4.320 0.000 0.000 0.218 6018 A C 2.359 179.942 177.584 -0.001 0.000 1.175 6018 A CA 1.479 53.515 52.037 -0.002 0.000 0.628 6018 A CB -0.416 18.580 19.000 -0.007 0.000 0.814 6018 A HN 0.384 nan 8.150 nan 0.000 0.444 6019 R N -0.545 119.957 120.500 0.004 0.000 2.090 6019 R HA 0.039 4.379 4.340 0.000 0.000 0.228 6019 R C 2.423 178.727 176.300 0.006 0.000 1.110 6019 R CA 1.281 57.384 56.100 0.005 0.000 0.973 6019 R CB -1.088 29.217 30.300 0.009 0.000 0.869 6019 R HN 0.525 nan 8.270 nan 0.000 0.440 6020 A N 0.973 123.799 122.820 0.009 0.000 1.902 6020 A HA -0.128 4.192 4.320 0.000 0.000 0.217 6020 A C 2.271 179.859 177.584 0.007 0.000 1.181 6020 A CA 1.933 53.977 52.037 0.011 0.000 0.623 6020 A CB -0.610 18.398 19.000 0.014 0.000 0.818 6020 A HN 0.211 nan 8.150 nan 0.000 0.443 6021 V N -2.405 117.511 119.914 0.003 0.000 2.719 6021 V HA -0.112 4.008 4.120 0.000 0.000 0.252 6021 V C 1.926 178.018 176.094 -0.003 0.000 1.065 6021 V CA 2.045 64.345 62.300 -0.000 0.000 1.086 6021 V CB -0.629 31.192 31.823 -0.003 0.000 0.700 6021 V HN 0.542 nan 8.190 nan 0.000 0.467 6022 D N 1.079 121.477 120.400 -0.003 0.000 2.097 6022 D HA -0.241 4.399 4.640 0.000 0.000 0.195 6022 D C 1.681 177.980 176.300 -0.002 0.000 0.989 6022 D CA 2.058 56.055 54.000 -0.004 0.000 0.827 6022 D CB -0.059 40.739 40.800 -0.003 0.000 0.966 6022 D HN 0.510 nan 8.370 nan 0.000 0.456 6023 D N 0.338 120.739 120.400 0.001 0.000 2.144 6023 D HA -0.067 4.573 4.640 0.000 0.000 0.200 6023 D C 2.011 178.313 176.300 0.002 0.000 0.978 6023 D CA 1.134 55.136 54.000 0.003 0.000 0.833 6023 D CB -0.442 40.361 40.800 0.005 0.000 0.961 6023 D HN 0.266 nan 8.370 nan 0.000 0.470 6024 A N 0.664 123.486 122.820 0.002 0.000 1.908 6024 A HA -0.153 4.167 4.320 0.000 0.000 0.218 6024 A C 2.508 180.091 177.584 -0.001 0.000 1.181 6024 A CA 1.296 53.334 52.037 0.001 0.000 0.627 6024 A CB -0.786 18.215 19.000 0.001 0.000 0.818 6024 A HN 0.152 nan 8.150 nan 0.000 0.445 6025 V N -0.113 119.799 119.914 -0.003 0.000 2.427 6025 V HA -0.165 3.955 4.120 0.000 0.000 0.248 6025 V C 2.803 178.894 176.094 -0.004 0.000 1.051 6025 V CA 1.859 64.156 62.300 -0.005 0.000 1.048 6025 V CB -1.414 30.404 31.823 -0.008 0.000 0.666 6025 V HN 0.626 nan 8.190 nan 0.000 0.456 6026 G N 0.585 109.383 108.800 -0.003 0.000 2.446 6026 G HA2 -0.231 3.729 3.960 0.000 0.000 0.217 6026 G HA3 -0.231 3.729 3.960 0.000 0.000 0.217 6026 G C 1.701 176.601 174.900 -0.001 0.000 1.168 6026 G CA 1.633 46.732 45.100 -0.002 0.000 0.771 6026 G HN 0.601 nan 8.290 nan 0.000 0.551 6027 V N -1.533 118.381 119.914 0.000 0.000 2.719 6027 V HA 0.028 4.148 4.120 0.000 0.000 0.252 6027 V C 2.614 178.708 176.094 0.000 0.000 1.065 6027 V CA 1.216 63.516 62.300 0.001 0.000 1.086 6027 V CB -0.305 31.520 31.823 0.003 0.000 0.700 6027 V HN 0.130 nan 8.190 nan 0.000 0.467 6028 V N 2.092 122.005 119.914 -0.001 0.000 2.358 6028 V HA -0.032 4.088 4.120 0.000 0.000 0.246 6028 V C 2.919 179.011 176.094 -0.003 0.000 1.047 6028 V CA 2.249 64.547 62.300 -0.002 0.000 1.035 6028 V CB -1.336 30.485 31.823 -0.003 0.000 0.658 6028 V HN 0.613 nan 8.190 nan 0.000 0.452 6029 G N -1.266 107.532 108.800 -0.003 0.000 2.422 6029 G HA2 -0.255 3.705 3.960 0.000 0.000 0.218 6029 G HA3 -0.255 3.705 3.960 0.000 0.000 0.218 6029 G C 1.707 176.606 174.900 -0.002 0.000 1.146 6029 G CA 1.293 46.391 45.100 -0.003 0.000 0.769 6029 G HN 0.536 nan 8.290 nan 0.000 0.547 6030 C N 0.249 119.548 119.300 -0.001 0.000 2.440 6030 C HA 0.024 4.484 4.460 0.000 0.000 0.278 6030 C C 3.147 178.137 174.990 -0.000 0.000 1.295 6030 C CA 1.481 60.499 59.018 -0.000 0.000 1.738 6030 C CB -0.807 26.933 27.740 0.001 0.000 1.987 6030 C HN 0.405 nan 8.230 nan 0.000 0.492 6031 T N 0.709 115.263 114.554 -0.001 0.000 3.043 6031 T HA 0.113 4.463 4.350 0.000 0.000 0.263 6031 T C 1.567 176.266 174.700 -0.001 0.000 1.094 6031 T CA 0.737 62.837 62.100 -0.001 0.000 1.127 6031 T CB -0.122 68.746 68.868 -0.001 0.000 0.905 6031 T HN 0.468 nan 8.240 nan 0.000 0.490 6032 I N 0.762 121.331 120.570 -0.002 0.000 2.333 6032 I HA -0.048 4.122 4.170 0.000 0.000 0.246 6032 I C 2.454 178.570 176.117 -0.002 0.000 1.106 6032 I CA 1.210 62.508 61.300 -0.002 0.000 1.411 6032 I CB -0.116 37.883 38.000 -0.003 0.000 1.082 6032 I HN 0.254 nan 8.210 nan 0.000 0.420 6033 E N 0.063 120.261 120.200 -0.002 0.000 2.122 6033 E HA -0.056 4.294 4.350 0.000 0.000 0.190 6033 E C -0.073 176.526 176.600 -0.001 0.000 0.977 6033 E CA 0.660 57.058 56.400 -0.002 0.000 0.820 6033 E CB 0.269 29.968 29.700 -0.002 0.000 0.770 6033 E HN 0.347 nan 8.360 nan 0.000 0.462 6034 D N 0.161 120.561 120.400 -0.001 0.000 2.446 6034 D HA 0.128 4.768 4.640 0.000 0.000 0.251 6034 D C -0.088 176.212 176.300 -0.000 0.000 1.137 6034 D CA -0.099 53.901 54.000 -0.001 0.000 0.890 6034 D CB 1.438 42.238 40.800 0.000 0.000 1.071 6034 D HN 0.092 nan 8.370 nan 0.000 0.528 6035 G N 2.258 111.057 108.800 -0.001 0.000 3.340 6035 G HA2 -0.051 3.909 3.960 0.000 0.000 0.240 6035 G HA3 -0.051 3.909 3.960 0.000 0.000 0.240 6035 G C 0.614 175.514 174.900 -0.000 0.000 1.327 6035 G CA -0.146 44.953 45.100 -0.001 0.000 1.170 6035 G HN 0.080 nan 8.290 nan 0.000 0.520 6036 R N 0.355 120.855 120.500 0.000 0.000 2.494 6036 R HA 0.569 4.909 4.340 0.000 0.000 0.305 6036 R C -0.101 176.201 176.300 0.002 0.000 0.959 6036 R CA -0.643 55.458 56.100 0.001 0.000 0.864 6036 R CB 1.753 32.053 30.300 0.001 0.000 1.159 6036 R HN 0.388 nan 8.270 nan 0.000 0.446 6037 I N -1.265 119.307 120.570 0.003 0.000 3.002 6037 I HA 0.809 4.979 4.170 0.000 0.000 0.310 6037 I C -0.182 175.939 176.117 0.007 0.000 1.087 6037 I CA -1.301 60.001 61.300 0.005 0.000 1.017 6037 I CB 2.445 40.447 38.000 0.004 0.000 1.226 6037 I HN 0.301 nan 8.210 nan 0.000 0.443 6038 V N -0.298 119.622 119.914 0.010 0.000 3.078 6038 V HA 0.673 4.793 4.120 0.000 0.000 0.311 6038 V C 0.094 176.199 176.094 0.018 0.000 1.138 6038 V CA -0.583 61.726 62.300 0.015 0.000 1.007 6038 V CB 1.178 33.012 31.823 0.017 0.000 1.045 6038 V HN 1.026 nan 8.190 nan 0.000 0.432 6039 S N 1.500 117.215 115.700 0.024 0.000 2.562 6039 S HA 0.647 5.117 4.470 0.000 0.000 0.281 6039 S C 0.558 175.178 174.600 0.034 0.000 1.333 6039 S CA 0.170 58.388 58.200 0.029 0.000 1.052 6039 S CB 0.845 64.065 63.200 0.035 0.000 0.884 6039 S HN 1.792 nan 8.310 nan 0.000 0.506 6040 G N 0.364 109.185 108.800 0.035 0.000 2.630 6040 G HA2 0.543 4.503 3.960 0.000 0.000 0.223 6040 G HA3 0.543 4.503 3.960 0.000 0.000 0.223 6040 G C 0.913 175.839 174.900 0.043 0.000 1.434 6040 G CA -0.551 44.571 45.100 0.037 0.000 1.057 6040 G HN 2.030 nan 8.290 nan 0.000 0.570 6041 G N -1.996 106.831 108.800 0.045 0.000 2.179 6041 G HA2 0.236 4.196 3.960 0.000 0.000 0.257 6041 G HA3 0.236 4.196 3.960 0.000 0.000 0.257 6041 G C 1.467 176.382 174.900 0.025 0.000 1.010 6041 G CA 1.176 46.302 45.100 0.044 0.000 0.736 6041 G HN 2.472 nan 8.290 nan 0.000 0.513 6042 G N -1.358 107.450 108.800 0.012 0.000 2.162 6042 G HA2 -0.123 3.837 3.960 0.000 0.000 0.260 6042 G HA3 -0.123 3.837 3.960 0.000 0.000 0.260 6042 G C 1.467 176.357 174.900 -0.015 0.000 0.976 6042 G CA 1.687 46.781 45.100 -0.012 0.000 0.655 6042 G HN 1.952 nan 8.290 nan 0.000 0.533 6043 S N 0.034 115.752 115.700 0.029 0.000 2.370 6043 S HA -0.164 4.306 4.470 0.000 0.000 0.226 6043 S C 2.795 177.427 174.600 0.053 0.000 1.033 6043 S CA 2.764 61.014 58.200 0.083 0.000 1.011 6043 S CB -0.553 62.732 63.200 0.142 0.000 0.852 6043 S HN 1.320 nan 8.310 nan 0.000 0.457 6044 T N 0.103 114.677 114.554 0.033 0.000 2.595 6044 T HA -0.089 4.261 4.350 0.000 0.000 0.264 6044 T C 1.606 176.293 174.700 -0.021 0.000 1.058 6044 T CA 1.595 63.708 62.100 0.022 0.000 1.166 6044 T CB -1.020 67.857 68.868 0.014 0.000 0.863 6044 T HN 0.349 nan 8.240 nan 0.000 0.415 6045 E N 0.900 121.075 120.200 -0.042 0.000 2.171 6045 E HA -0.069 4.281 4.350 0.000 0.000 0.197 6045 E C 2.276 178.811 176.600 -0.107 0.000 0.997 6045 E CA 0.851 57.210 56.400 -0.068 0.000 0.810 6045 E CB -0.829 28.825 29.700 -0.076 0.000 0.738 6045 E HN 0.436 nan 8.360 nan 0.000 0.467 6046 V N 0.408 120.219 119.914 -0.172 0.000 2.379 6046 V HA -0.216 3.904 4.120 0.000 0.000 0.245 6046 V C 2.279 178.148 176.094 -0.375 0.000 1.044 6046 V CA 1.840 63.951 62.300 -0.314 0.000 1.036 6046 V CB -0.426 31.102 31.823 -0.491 0.000 0.664 6046 V HN 0.223 nan 8.190 nan 0.000 0.453 6047 E N 0.428 120.439 120.200 -0.315 0.000 2.085 6047 E HA -0.225 4.125 4.350 0.000 0.000 0.194 6047 E C 1.878 178.487 176.600 0.016 0.000 0.994 6047 E CA 1.472 57.875 56.400 0.004 0.000 0.801 6047 E CB -0.337 29.475 29.700 0.186 0.000 0.743 6047 E HN 0.364 nan 8.360 nan 0.000 0.453 6048 L N 0.584 121.802 121.223 -0.008 0.000 2.056 6048 L HA -0.108 4.232 4.340 0.000 0.000 0.207 6048 L C 2.555 179.444 176.870 0.032 0.000 1.078 6048 L CA 2.020 56.872 54.840 0.021 0.000 0.749 6048 L CB -1.154 40.922 42.059 0.030 0.000 0.901 6048 L HN 0.311 nan 8.230 nan 0.000 0.433 6049 S N -1.907 113.788 115.700 -0.007 0.000 2.423 6049 S HA -0.165 4.305 4.470 0.000 0.000 0.231 6049 S C 1.954 176.567 174.600 0.021 0.000 1.014 6049 S CA 0.840 59.043 58.200 0.005 0.000 0.965 6049 S CB -0.309 62.867 63.200 -0.040 0.000 0.785 6049 S HN 0.253 nan 8.310 nan 0.000 0.495 6050 M N 1.538 121.143 119.600 0.007 0.000 2.064 6050 M HA 0.065 4.545 4.480 0.000 0.000 0.260 6050 M C 2.179 178.518 176.300 0.065 0.000 1.073 6050 M CA 1.411 56.734 55.300 0.039 0.000 1.124 6050 M CB -0.935 31.702 32.600 0.062 0.000 1.326 6050 M HN 0.257 nan 8.290 nan 0.000 0.410 6051 K N 0.614 121.054 120.400 0.067 0.000 2.217 6051 K HA 0.065 4.385 4.320 0.000 0.000 0.202 6051 K C 2.023 178.688 176.600 0.108 0.000 1.051 6051 K CA 0.869 57.201 56.287 0.075 0.000 0.952 6051 K CB -0.481 32.049 32.500 0.050 0.000 0.736 6051 K HN 0.389 nan 8.250 nan 0.000 0.453 6052 L N 0.150 121.439 121.223 0.110 0.000 2.313 6052 L HA -0.030 4.310 4.340 0.000 0.000 0.214 6052 L C 2.385 179.377 176.870 0.203 0.000 1.119 6052 L CA 0.647 55.595 54.840 0.180 0.000 0.809 6052 L CB -0.184 41.980 42.059 0.177 0.000 0.933 6052 L HN 0.097 nan 8.230 nan 0.000 0.449 6053 R N 0.107 120.688 120.500 0.134 0.000 2.090 6053 R HA -0.124 4.216 4.340 0.000 0.000 0.228 6053 R C 2.053 178.408 176.300 0.092 0.000 1.110 6053 R CA 1.170 57.331 56.100 0.102 0.000 0.973 6053 R CB -0.078 30.264 30.300 0.070 0.000 0.869 6053 R HN 0.421 nan 8.270 nan 0.000 0.440 6054 E N -0.466 119.796 120.200 0.103 0.000 2.107 6054 E HA -0.194 4.156 4.350 0.000 0.000 0.191 6054 E C 1.549 178.215 176.600 0.110 0.000 0.982 6054 E CA 0.799 57.252 56.400 0.089 0.000 0.809 6054 E CB -0.087 29.664 29.700 0.085 0.000 0.756 6054 E HN 0.298 nan 8.360 nan 0.000 0.459 6055 Y N 1.583 121.897 120.300 0.023 0.000 2.224 6055 Y HA -0.227 4.323 4.550 -0.000 0.000 0.289 6055 Y C 2.181 178.091 175.900 0.017 0.000 1.146 6055 Y CA 1.289 59.399 58.100 0.017 0.000 1.182 6055 Y CB -0.424 38.045 38.460 0.014 0.000 0.983 6055 Y HN -0.011 nan 8.280 nan 0.000 0.524 6056 A N 0.378 123.191 122.820 -0.012 0.000 1.883 6056 A HA -0.187 4.133 4.320 0.000 0.000 0.217 6056 A C 2.131 179.657 177.584 -0.096 0.000 1.186 6056 A CA 1.911 53.904 52.037 -0.073 0.000 0.624 6056 A CB -0.634 18.389 19.000 0.039 0.000 0.822 6056 A HN 0.517 nan 8.150 nan 0.000 0.444 6057 E N -0.469 119.705 120.200 -0.044 0.000 2.110 6057 E HA -0.139 4.211 4.350 0.000 0.000 0.193 6057 E C 2.163 178.724 176.600 -0.066 0.000 0.988 6057 E CA 1.154 57.532 56.400 -0.037 0.000 0.804 6057 E CB -0.691 29.005 29.700 -0.006 0.000 0.745 6057 E HN 0.599 nan 8.360 nan 0.000 0.458 6058 G N 1.475 110.219 108.800 -0.094 0.000 2.402 6058 G HA2 -0.187 3.773 3.960 0.000 0.000 0.216 6058 G HA3 -0.187 3.773 3.960 0.000 0.000 0.216 6058 G C 1.607 176.412 174.900 -0.157 0.000 1.162 6058 G CA 0.338 45.374 45.100 -0.106 0.000 0.777 6058 G HN 0.116 nan 8.290 nan 0.000 0.539 6059 I N 0.339 120.751 120.570 -0.263 0.000 2.202 6059 I HA -0.011 4.159 4.170 0.000 0.000 0.242 6059 I C 1.707 177.743 176.117 -0.135 0.000 1.091 6059 I CA 1.136 62.287 61.300 -0.249 0.000 1.368 6059 I CB -1.169 36.618 38.000 -0.354 0.000 1.058 6059 I HN 0.324 nan 8.210 nan 0.000 0.410 6060 S N -1.227 114.407 115.700 -0.110 0.000 3.513 6060 S HA -0.105 4.365 4.470 0.000 0.000 0.636 6060 S C 0.715 175.282 174.600 -0.055 0.000 2.452 6060 S CA 1.398 59.559 58.200 -0.065 0.000 2.644 6060 S CB -1.362 61.807 63.200 -0.051 0.000 0.331 6060 S HN 1.473 nan 8.310 nan 0.000 1.787 6061 G N 0.744 109.522 108.800 -0.037 0.000 2.575 6061 G HA2 -0.261 3.700 3.960 0.000 0.000 0.267 6061 G HA3 -0.261 3.700 3.960 0.000 0.000 0.267 6061 G C 0.089 174.976 174.900 -0.023 0.000 1.264 6061 G CA 1.098 46.181 45.100 -0.029 0.000 0.935 6061 G HN 1.196 nan 8.290 nan 0.000 0.568 6062 R N 0.563 121.052 120.500 -0.019 0.000 2.240 6062 R HA 0.249 4.589 4.340 0.000 0.000 0.203 6062 R C 2.411 178.703 176.300 -0.013 0.000 1.011 6062 R CA 1.553 57.646 56.100 -0.012 0.000 1.007 6062 R CB -0.310 29.985 30.300 -0.008 0.000 0.911 6062 R HN 0.620 nan 8.270 nan 0.000 0.468 6063 E N 0.397 120.583 120.200 -0.024 0.000 2.153 6063 E HA -0.181 4.169 4.350 0.000 0.000 0.194 6063 E C 1.703 178.293 176.600 -0.017 0.000 0.988 6063 E CA 0.839 57.223 56.400 -0.025 0.000 0.811 6063 E CB -0.088 29.586 29.700 -0.043 0.000 0.746 6063 E HN 0.191 nan 8.360 nan 0.000 0.466 6064 Q N 0.575 120.358 119.800 -0.029 0.000 2.170 6064 Q HA -0.144 4.196 4.340 0.000 0.000 0.203 6064 Q C 1.989 178.004 176.000 0.024 0.000 0.976 6064 Q CA 1.094 56.885 55.803 -0.019 0.000 0.858 6064 Q CB -0.062 28.658 28.738 -0.030 0.000 0.907 6064 Q HN 0.385 nan 8.270 nan 0.000 0.433 6065 L N 0.041 121.279 121.223 0.024 0.000 2.056 6065 L HA -0.124 4.216 4.340 0.000 0.000 0.207 6065 L C 2.626 179.546 176.870 0.083 0.000 1.078 6065 L CA 1.146 56.012 54.840 0.043 0.000 0.749 6065 L CB -0.681 41.393 42.059 0.025 0.000 0.901 6065 L HN 0.156 nan 8.230 nan 0.000 0.433 6066 A N -0.391 122.473 122.820 0.073 0.000 1.898 6066 A HA -0.105 4.215 4.320 0.000 0.000 0.216 6066 A C 2.316 180.079 177.584 0.298 0.000 1.181 6066 A CA 1.444 53.554 52.037 0.122 0.000 0.620 6066 A CB -0.706 18.281 19.000 -0.022 0.000 0.819 6066 A HN 0.179 nan 8.150 nan 0.000 0.442 6067 V N 0.021 120.056 119.914 0.202 0.000 2.427 6067 V HA -0.202 3.918 4.120 0.000 0.000 0.248 6067 V C 2.651 178.894 176.094 0.249 0.000 1.051 6067 V CA 2.244 64.683 62.300 0.233 0.000 1.048 6067 V CB -0.785 31.124 31.823 0.144 0.000 0.666 6067 V HN 0.615 nan 8.190 nan 0.000 0.456 6068 R N 1.176 121.780 120.500 0.173 0.000 2.081 6068 R HA -0.079 4.261 4.340 0.000 0.000 0.235 6068 R C 2.146 178.537 176.300 0.151 0.000 1.131 6068 R CA 1.893 58.076 56.100 0.138 0.000 0.960 6068 R CB -0.930 29.423 30.300 0.088 0.000 0.856 6068 R HN 0.439 nan 8.270 nan 0.000 0.436 6069 A N -0.473 122.462 122.820 0.192 0.000 1.902 6069 A HA -0.125 4.195 4.320 0.000 0.000 0.217 6069 A C 2.176 179.858 177.584 0.163 0.000 1.181 6069 A CA 1.362 53.513 52.037 0.190 0.000 0.623 6069 A CB -0.848 18.310 19.000 0.264 0.000 0.818 6069 A HN 0.485 nan 8.150 nan 0.000 0.443 6070 F N 0.931 120.930 119.950 0.081 0.000 2.075 6070 F HA -0.089 4.438 4.527 0.000 0.000 0.297 6070 F C 2.557 178.309 175.800 -0.080 0.000 1.113 6070 F CA 1.490 59.409 58.000 -0.135 0.000 1.218 6070 F CB -0.345 38.594 39.000 -0.102 0.000 0.984 6070 F HN 0.249 nan 8.300 nan 0.000 0.472 6071 A N -0.140 122.820 122.820 0.233 0.000 1.940 6071 A HA -0.212 4.108 4.320 0.000 0.000 0.219 6071 A C 1.878 179.453 177.584 -0.014 0.000 1.176 6071 A CA 2.110 54.222 52.037 0.126 0.000 0.631 6071 A CB -0.952 18.142 19.000 0.158 0.000 0.814 6071 A HN 0.472 nan 8.150 nan 0.000 0.446 6072 D N -0.198 120.196 120.400 -0.010 0.000 2.183 6072 D HA 0.068 4.708 4.640 0.000 0.000 0.203 6072 D C 2.170 178.414 176.300 -0.093 0.000 0.969 6072 D CA 1.221 55.199 54.000 -0.036 0.000 0.842 6072 D CB -0.390 40.407 40.800 -0.004 0.000 0.957 6072 D HN 0.414 nan 8.370 nan 0.000 0.484 6073 A N 0.733 123.459 122.820 -0.156 0.000 1.972 6073 A HA -0.119 4.201 4.320 0.000 0.000 0.219 6073 A C 2.241 179.682 177.584 -0.239 0.000 1.169 6073 A CA 0.794 52.701 52.037 -0.216 0.000 0.635 6073 A CB -0.730 18.070 19.000 -0.333 0.000 0.810 6073 A HN 0.235 nan 8.150 nan 0.000 0.446 6074 L N -0.418 120.644 121.223 -0.269 0.000 2.265 6074 L HA -0.122 4.218 4.340 0.000 0.000 0.215 6074 L C 1.960 178.745 176.870 -0.142 0.000 1.117 6074 L CA 0.733 55.440 54.840 -0.223 0.000 0.782 6074 L CB -0.467 41.471 42.059 -0.203 0.000 0.914 6074 L HN 0.315 nan 8.230 nan 0.000 0.441 6075 E N -0.228 119.902 120.200 -0.117 0.000 2.478 6075 E HA -0.115 4.235 4.350 0.000 0.000 0.198 6075 E C 2.179 178.732 176.600 -0.079 0.000 1.046 6075 E CA 0.514 56.862 56.400 -0.088 0.000 0.870 6075 E CB -0.076 29.582 29.700 -0.070 0.000 0.818 6075 E HN 0.293 nan 8.360 nan 0.000 0.527 6076 V N 0.977 120.837 119.914 -0.090 0.000 2.594 6076 V HA -0.203 3.917 4.120 0.000 0.000 0.253 6076 V C 1.818 177.871 176.094 -0.068 0.000 1.069 6076 V CA 0.958 63.212 62.300 -0.076 0.000 1.082 6076 V CB -0.190 31.583 31.823 -0.084 0.000 0.680 6076 V HN 0.132 nan 8.190 nan 0.000 0.469 6077 I N 0.550 121.076 120.570 -0.073 0.000 2.235 6077 I HA -0.017 4.154 4.170 0.000 0.000 0.241 6077 I C 0.196 176.282 176.117 -0.052 0.000 1.085 6077 I CA 1.365 62.628 61.300 -0.062 0.000 1.378 6077 I CB -2.822 35.139 38.000 -0.064 0.000 1.076 6077 I HN 0.319 nan 8.210 nan 0.000 0.415 6078 P HA -0.170 nan 4.420 nan 0.000 0.216 6078 P C 1.849 179.124 177.300 -0.042 0.000 1.150 6078 P CA 1.571 64.644 63.100 -0.045 0.000 0.843 6078 P CB -0.162 31.508 31.700 -0.050 0.000 0.787 6079 R N -0.225 120.247 120.500 -0.046 0.000 2.073 6079 R HA -0.108 4.232 4.340 0.000 0.000 0.234 6079 R C 1.951 178.226 176.300 -0.041 0.000 1.134 6079 R CA 2.331 58.406 56.100 -0.042 0.000 0.952 6079 R CB -0.846 29.428 30.300 -0.043 0.000 0.850 6079 R HN 0.242 nan 8.270 nan 0.000 0.433 6080 T N -0.950 113.578 114.554 -0.044 0.000 3.043 6080 T HA -0.055 4.295 4.350 0.000 0.000 0.263 6080 T C 1.778 176.450 174.700 -0.046 0.000 1.094 6080 T CA 0.540 62.614 62.100 -0.044 0.000 1.127 6080 T CB -0.095 68.746 68.868 -0.044 0.000 0.905 6080 T HN 0.174 nan 8.240 nan 0.000 0.490 6081 L N 1.875 123.070 121.223 -0.047 0.000 2.027 6081 L HA 0.278 4.618 4.340 0.000 0.000 0.206 6081 L C 2.770 179.606 176.870 -0.056 0.000 1.074 6081 L CA 1.890 56.699 54.840 -0.052 0.000 0.745 6081 L CB -1.167 40.865 42.059 -0.046 0.000 0.898 6081 L HN 0.314 nan 8.230 nan 0.000 0.433 6082 A N -1.096 121.696 122.820 -0.046 0.000 1.929 6082 A HA -0.189 4.131 4.320 0.000 0.000 0.216 6082 A C 2.297 179.856 177.584 -0.043 0.000 1.176 6082 A CA 1.370 53.381 52.037 -0.044 0.000 0.628 6082 A CB -0.669 18.311 19.000 -0.033 0.000 0.816 6082 A HN 0.595 nan 8.150 nan 0.000 0.444 6083 E N 0.160 120.336 120.200 -0.040 0.000 2.038 6083 E HA -0.250 4.100 4.350 0.000 0.000 0.195 6083 E C 1.584 178.160 176.600 -0.040 0.000 1.000 6083 E CA 1.551 57.929 56.400 -0.036 0.000 0.803 6083 E CB -0.153 29.526 29.700 -0.034 0.000 0.750 6083 E HN 0.536 nan 8.360 nan 0.000 0.448 6084 N N 0.206 118.878 118.700 -0.046 0.000 2.309 6084 N HA -0.092 4.648 4.740 0.000 0.000 0.182 6084 N C 1.413 176.887 175.510 -0.060 0.000 1.018 6084 N CA 1.107 54.127 53.050 -0.050 0.000 0.876 6084 N CB -0.295 38.161 38.487 -0.053 0.000 0.972 6084 N HN 0.235 nan 8.380 nan 0.000 0.434 6085 A N 0.029 122.808 122.820 -0.069 0.000 2.119 6085 A HA 0.266 4.586 4.320 0.000 0.000 0.217 6085 A C 1.533 179.080 177.584 -0.061 0.000 1.153 6085 A CA 1.150 53.138 52.037 -0.082 0.000 0.692 6085 A CB -0.512 18.431 19.000 -0.094 0.000 0.799 6085 A HN 0.335 nan 8.150 nan 0.000 0.458 6086 G N -1.599 107.173 108.800 -0.047 0.000 2.137 6086 G HA2 -0.195 3.765 3.960 0.000 0.000 0.237 6086 G HA3 -0.195 3.765 3.960 0.000 0.000 0.237 6086 G C -0.021 174.861 174.900 -0.030 0.000 1.002 6086 G CA 0.351 45.430 45.100 -0.036 0.000 0.702 6086 G HN 0.459 nan 8.290 nan 0.000 0.515 6087 L N 0.073 121.277 121.223 -0.032 0.000 2.352 6087 L HA 0.478 4.818 4.340 0.000 0.000 0.269 6087 L C 0.476 177.332 176.870 -0.022 0.000 1.034 6087 L CA -1.109 53.715 54.840 -0.026 0.000 0.806 6087 L CB 0.963 43.006 42.059 -0.028 0.000 1.244 6087 L HN 0.090 nan 8.230 nan 0.000 0.447 6088 D N 1.110 121.500 120.400 -0.017 0.000 2.363 6088 D HA 0.060 4.700 4.640 0.000 0.000 0.263 6088 D C 0.785 177.075 176.300 -0.016 0.000 1.258 6088 D CA 0.221 54.212 54.000 -0.015 0.000 0.907 6088 D CB 1.716 42.510 40.800 -0.011 0.000 1.107 6088 D HN 0.649 nan 8.370 nan 0.000 0.495 6089 A N 5.418 128.226 122.820 -0.019 0.000 1.917 6089 A HA -0.205 4.115 4.320 0.000 0.000 0.219 6089 A C 2.106 179.680 177.584 -0.018 0.000 1.182 6089 A CA 0.971 52.996 52.037 -0.021 0.000 0.633 6089 A CB -0.209 18.778 19.000 -0.022 0.000 0.819 6089 A HN 0.704 nan 8.150 nan 0.000 0.448 6090 I N -0.330 120.231 120.570 -0.014 0.000 2.193 6090 I HA -0.105 4.065 4.170 0.000 0.000 0.240 6090 I C 2.378 178.490 176.117 -0.009 0.000 1.084 6090 I CA 1.133 62.426 61.300 -0.011 0.000 1.365 6090 I CB -1.613 36.381 38.000 -0.009 0.000 1.064 6090 I HN 0.310 nan 8.210 nan 0.000 0.410 6091 E N 0.717 120.913 120.200 -0.007 0.000 2.110 6091 E HA -0.145 4.205 4.350 0.000 0.000 0.193 6091 E C 2.303 178.902 176.600 -0.003 0.000 0.988 6091 E CA 0.918 57.316 56.400 -0.004 0.000 0.804 6091 E CB -0.085 29.613 29.700 -0.003 0.000 0.745 6091 E HN 0.347 nan 8.360 nan 0.000 0.458 6092 I N 0.605 121.171 120.570 -0.006 0.000 2.163 6092 I HA -0.224 3.946 4.170 0.000 0.000 0.240 6092 I C 2.326 178.440 176.117 -0.005 0.000 1.081 6092 I CA 0.778 62.075 61.300 -0.005 0.000 1.353 6092 I CB -0.956 37.038 38.000 -0.011 0.000 1.054 6092 I HN 0.118 nan 8.210 nan 0.000 0.407 6093 L N 0.109 121.326 121.223 -0.010 0.000 2.083 6093 L HA -0.151 4.189 4.340 0.000 0.000 0.209 6093 L C 2.548 179.414 176.870 -0.007 0.000 1.083 6093 L CA 1.314 56.145 54.840 -0.014 0.000 0.752 6093 L CB -0.982 41.065 42.059 -0.020 0.000 0.899 6093 L HN 0.002 nan 8.230 nan 0.000 0.433 6094 V N -1.229 118.683 119.914 -0.003 0.000 2.323 6094 V HA -0.222 3.898 4.120 0.000 0.000 0.244 6094 V C 2.503 178.604 176.094 0.010 0.000 1.041 6094 V CA 1.317 63.619 62.300 0.003 0.000 1.025 6094 V CB -0.381 31.444 31.823 0.003 0.000 0.656 6094 V HN 0.285 nan 8.190 nan 0.000 0.451 6095 K N -0.081 120.326 120.400 0.010 0.000 2.148 6095 K HA -0.050 4.270 4.320 0.000 0.000 0.204 6095 K C 1.887 178.503 176.600 0.026 0.000 1.050 6095 K CA 0.954 57.250 56.287 0.016 0.000 0.942 6095 K CB -0.529 31.979 32.500 0.013 0.000 0.724 6095 K HN 0.305 nan 8.250 nan 0.000 0.446 6096 V N 0.548 120.477 119.914 0.025 0.000 2.323 6096 V HA -0.168 3.952 4.120 0.000 0.000 0.244 6096 V C 2.139 178.271 176.094 0.063 0.000 1.041 6096 V CA 1.535 63.859 62.300 0.040 0.000 1.025 6096 V CB -0.304 31.532 31.823 0.023 0.000 0.656 6096 V HN 0.244 nan 8.190 nan 0.000 0.451 6097 R N 0.092 120.613 120.500 0.034 0.000 2.096 6097 R HA -0.103 4.237 4.340 0.000 0.000 0.235 6097 R C 2.418 178.764 176.300 0.077 0.000 1.127 6097 R CA 1.424 57.548 56.100 0.040 0.000 0.968 6097 R CB -0.546 29.755 30.300 0.001 0.000 0.861 6097 R HN 0.534 nan 8.270 nan 0.000 0.440 6098 A N 1.249 124.100 122.820 0.052 0.000 1.877 6098 A HA -0.100 4.220 4.320 0.000 0.000 0.216 6098 A C 2.364 179.980 177.584 0.053 0.000 1.186 6098 A CA 1.672 53.737 52.037 0.046 0.000 0.620 6098 A CB -0.586 18.431 19.000 0.029 0.000 0.822 6098 A HN 0.387 nan 8.150 nan 0.000 0.443 6099 A N -1.201 121.652 122.820 0.056 0.000 1.930 6099 A HA -0.143 4.177 4.320 0.000 0.000 0.217 6099 A C 1.991 179.607 177.584 0.053 0.000 1.175 6099 A CA 2.010 54.075 52.037 0.046 0.000 0.627 6099 A CB -0.832 18.194 19.000 0.044 0.000 0.815 6099 A HN 0.773 nan 8.150 nan 0.000 0.443 6100 H N -0.247 118.826 119.070 0.006 0.000 2.321 6100 H HA 0.045 4.601 4.556 0.000 0.000 0.300 6100 H C 2.206 177.539 175.328 0.008 0.000 1.087 6100 H CA 1.979 58.031 56.048 0.007 0.000 1.319 6100 H CB -0.136 29.630 29.762 0.006 0.000 1.379 6100 H HN 0.400 nan 8.280 nan 0.000 0.501 6101 A N -0.786 122.122 122.820 0.147 0.000 1.930 6101 A HA -0.142 4.178 4.320 0.000 0.000 0.217 6101 A C 2.529 180.124 177.584 0.018 0.000 1.175 6101 A CA 1.754 53.845 52.037 0.090 0.000 0.627 6101 A CB -0.905 18.149 19.000 0.091 0.000 0.815 6101 A HN 0.497 nan 8.150 nan 0.000 0.443 6102 S N -0.414 115.292 115.700 0.011 0.000 2.341 6102 S HA -0.087 4.383 4.470 0.000 0.000 0.216 6102 S C 1.856 176.442 174.600 -0.025 0.000 1.034 6102 S CA 1.254 59.452 58.200 -0.002 0.000 0.964 6102 S CB -0.348 62.855 63.200 0.006 0.000 0.882 6102 S HN 0.610 nan 8.310 nan 0.000 0.469 6103 N N 0.736 119.413 118.700 -0.039 0.000 2.368 6103 N HA 0.291 5.031 4.740 0.000 0.000 0.176 6103 N C 1.012 176.464 175.510 -0.097 0.000 1.021 6103 N CA 1.004 54.022 53.050 -0.053 0.000 0.888 6103 N CB 0.227 38.691 38.487 -0.039 0.000 0.995 6103 N HN 0.599 nan 8.380 nan 0.000 0.437 6104 G N 0.762 109.452 108.800 -0.183 0.000 2.373 6104 G HA2 -0.204 3.756 3.960 0.000 0.000 0.634 6104 G HA3 -0.204 3.756 3.960 0.000 0.000 0.634 6104 G C -0.196 174.414 174.900 -0.483 0.000 1.267 6104 G CA 0.009 44.930 45.100 -0.298 0.000 1.008 6104 G HN 0.320 nan 8.290 nan 0.000 0.497 6105 N N -0.714 117.735 118.700 -0.418 0.000 2.412 6105 N HA 0.121 4.861 4.740 0.000 0.000 0.184 6105 N C 1.273 176.749 175.510 -0.057 0.000 1.101 6105 N CA 1.045 53.953 53.050 -0.236 0.000 0.881 6105 N CB 0.326 38.806 38.487 -0.010 0.000 0.969 6105 N HN 0.369 nan 8.380 nan 0.000 0.459 6106 K N -0.289 120.068 120.400 -0.072 0.000 2.358 6106 K HA 0.286 4.606 4.320 0.000 0.000 0.200 6106 K C -0.421 176.160 176.600 -0.031 0.000 1.030 6106 K CA -0.008 56.260 56.287 -0.032 0.000 1.097 6106 K CB 0.311 32.795 32.500 -0.027 0.000 0.862 6106 K HN 0.203 nan 8.250 nan 0.000 0.534 6107 C N 1.185 120.455 119.300 -0.051 0.000 3.206 6107 C HA 0.724 5.184 4.460 0.000 0.000 0.206 6107 C C 0.500 175.476 174.990 -0.024 0.000 1.836 6107 C CA -0.714 58.283 59.018 -0.035 0.000 1.382 6107 C CB -0.603 27.109 27.740 -0.047 0.000 2.405 6107 C HN 0.424 nan 8.230 nan 0.000 0.516 6108 A N 0.058 122.882 122.820 0.007 0.000 3.963 6108 A HA 0.966 5.286 4.320 0.000 0.000 0.283 6108 A C 0.047 177.674 177.584 0.071 0.000 1.085 6108 A CA 0.332 52.401 52.037 0.053 0.000 0.591 6108 A CB -0.170 18.887 19.000 0.095 0.000 1.632 6108 A HN 2.014 nan 8.150 nan 0.000 0.761 6109 G N -2.006 106.854 108.800 0.100 0.000 2.787 6109 G HA2 0.359 4.319 3.960 0.000 0.000 0.685 6109 G HA3 0.359 4.319 3.960 0.000 0.000 0.685 6109 G C -0.700 174.232 174.900 0.054 0.000 1.437 6109 G CA -0.016 45.128 45.100 0.073 0.000 0.872 6109 G HN 2.092 nan 8.290 nan 0.000 0.566 6110 L N 1.031 122.279 121.223 0.042 0.000 2.276 6110 L HA 0.601 4.941 4.340 0.000 0.000 0.286 6110 L C 0.591 177.493 176.870 0.054 0.000 1.061 6110 L CA -0.668 54.192 54.840 0.034 0.000 0.807 6110 L CB 1.272 43.338 42.059 0.011 0.000 1.177 6110 L HN 0.698 nan 8.230 nan 0.000 0.429 6111 N N 4.233 122.972 118.700 0.066 0.000 2.699 6111 N HA 0.109 4.849 4.740 0.000 0.000 0.232 6111 N C 0.925 176.484 175.510 0.082 0.000 1.027 6111 N CA -0.127 52.994 53.050 0.119 0.000 0.920 6111 N CB 1.139 39.703 38.487 0.129 0.000 1.148 6111 N HN 0.703 nan 8.380 nan 0.000 0.509 6112 V N 1.623 121.541 119.914 0.007 0.000 2.913 6112 V HA -0.075 4.045 4.120 0.000 0.000 0.260 6112 V C 1.515 177.525 176.094 -0.140 0.000 1.098 6112 V CA 1.014 63.249 62.300 -0.110 0.000 1.121 6112 V CB -1.131 30.561 31.823 -0.220 0.000 0.714 6112 V HN 0.408 nan 8.190 nan 0.000 0.487 6113 F N 2.696 122.646 119.950 -0.001 0.000 2.134 6113 F HA -0.097 4.430 4.527 0.000 0.000 0.299 6113 F C 2.772 178.571 175.800 -0.001 0.000 1.097 6113 F CA 2.154 60.153 58.000 -0.001 0.000 1.264 6113 F CB -0.654 38.346 39.000 -0.001 0.000 1.001 6113 F HN 0.385 nan 8.300 nan 0.000 0.479 6114 T N -3.700 110.963 114.554 0.181 0.000 3.044 6114 T HA 0.374 4.724 4.350 0.000 0.000 0.250 6114 T C 1.496 176.227 174.700 0.051 0.000 1.081 6114 T CA 0.417 62.574 62.100 0.095 0.000 1.040 6114 T CB 0.182 69.096 68.868 0.077 0.000 0.962 6114 T HN 0.427 nan 8.240 nan 0.000 0.506 6115 G N 0.957 109.780 108.800 0.037 0.000 2.248 6115 G HA2 0.248 4.208 3.960 0.000 0.000 0.263 6115 G HA3 0.248 4.208 3.960 0.000 0.000 0.263 6115 G C 0.054 174.961 174.900 0.012 0.000 1.082 6115 G CA -0.228 44.876 45.100 0.007 0.000 0.863 6115 G HN 1.395 nan 8.290 nan 0.000 0.495 6116 A N -1.637 121.197 122.820 0.023 0.000 2.612 6116 A HA 0.891 5.211 4.320 0.000 0.000 0.293 6116 A C 0.039 177.641 177.584 0.029 0.000 1.075 6116 A CA 0.121 52.171 52.037 0.022 0.000 0.680 6116 A CB 1.532 20.545 19.000 0.023 0.000 1.279 6116 A HN 1.804 nan 8.150 nan 0.000 0.411 6117 V N 1.673 121.602 119.914 0.025 0.000 2.673 6117 V HA 0.434 4.554 4.120 0.000 0.000 0.303 6117 V C -0.043 176.070 176.094 0.032 0.000 1.046 6117 V CA 0.952 63.270 62.300 0.030 0.000 1.126 6117 V CB 0.457 32.298 31.823 0.029 0.000 0.934 6117 V HN 0.918 nan 8.190 nan 0.000 0.487 6118 E N 3.867 124.089 120.200 0.038 0.000 2.390 6118 E HA 0.383 4.733 4.350 0.000 0.000 0.242 6118 E C -1.478 175.141 176.600 0.031 0.000 0.907 6118 E CA -0.668 55.752 56.400 0.033 0.000 0.884 6118 E CB 0.845 30.569 29.700 0.040 0.000 1.788 6118 E HN 0.719 nan 8.360 nan 0.000 0.427 6119 D N 1.313 121.727 120.400 0.024 0.000 2.460 6119 D HA 0.186 4.826 4.640 0.000 0.000 0.232 6119 D C 0.799 177.111 176.300 0.020 0.000 1.079 6119 D CA -0.279 53.732 54.000 0.017 0.000 0.864 6119 D CB 0.676 41.480 40.800 0.006 0.000 1.048 6119 D HN 0.186 nan 8.370 nan 0.000 0.523 6120 M N 1.828 121.445 119.600 0.029 0.000 2.132 6120 M HA -0.120 4.360 4.480 0.000 0.000 0.263 6120 M C 2.339 178.649 176.300 0.017 0.000 1.065 6120 M CA 0.696 56.014 55.300 0.031 0.000 1.122 6120 M CB -1.200 31.426 32.600 0.043 0.000 1.365 6120 M HN 0.554 nan 8.290 nan 0.000 0.411 6121 C N 0.766 120.074 119.300 0.013 0.000 2.436 6121 C HA -0.187 4.274 4.460 0.000 0.000 0.277 6121 C C 2.686 177.675 174.990 -0.001 0.000 1.241 6121 C CA 1.690 60.711 59.018 0.005 0.000 1.721 6121 C CB -0.863 26.878 27.740 0.001 0.000 2.043 6121 C HN 0.582 nan 8.230 nan 0.000 0.472 6122 E N 1.068 121.267 120.200 -0.002 0.000 2.150 6122 E HA -0.108 4.242 4.350 0.000 0.000 0.193 6122 E C 1.659 178.254 176.600 -0.009 0.000 0.985 6122 E CA 1.371 57.767 56.400 -0.006 0.000 0.814 6122 E CB -0.468 29.229 29.700 -0.005 0.000 0.752 6122 E HN 0.645 nan 8.360 nan 0.000 0.466 6123 N N -0.228 118.468 118.700 -0.007 0.000 2.521 6123 N HA 0.034 4.774 4.740 0.000 0.000 0.188 6123 N C 0.661 176.156 175.510 -0.026 0.000 1.146 6123 N CA 0.964 54.003 53.050 -0.017 0.000 0.893 6123 N CB 0.468 38.949 38.487 -0.011 0.000 0.975 6123 N HN 0.306 nan 8.380 nan 0.000 0.451 6124 G N -0.134 108.655 108.800 -0.018 0.000 2.153 6124 G HA2 -0.264 3.696 3.960 0.000 0.000 0.252 6124 G HA3 -0.264 3.696 3.960 0.000 0.000 0.252 6124 G C -0.089 174.801 174.900 -0.017 0.000 0.994 6124 G CA 0.200 45.288 45.100 -0.019 0.000 0.698 6124 G HN 0.202 nan 8.290 nan 0.000 0.521 6125 V N 1.440 121.350 119.914 -0.006 0.000 2.267 6125 V HA 0.514 4.634 4.120 0.000 0.000 0.254 6125 V C 0.751 176.855 176.094 0.016 0.000 1.144 6125 V CA 0.077 62.382 62.300 0.008 0.000 0.992 6125 V CB 0.548 32.388 31.823 0.029 0.000 1.199 6125 V HN 1.035 nan 8.190 nan 0.000 0.493 6126 V N 1.791 121.712 119.914 0.011 0.000 3.007 6126 V HA 0.912 5.032 4.120 0.000 0.000 0.311 6126 V C -0.696 175.405 176.094 0.012 0.000 1.120 6126 V CA -0.742 61.565 62.300 0.012 0.000 0.980 6126 V CB 2.510 34.337 31.823 0.007 0.000 1.033 6126 V HN 0.688 nan 8.190 nan 0.000 0.429 6127 E N 1.720 121.928 120.200 0.012 0.000 2.393 6127 E HA 0.646 4.996 4.350 0.000 0.000 0.273 6127 E C -3.273 173.332 176.600 0.008 0.000 0.918 6127 E CA -2.369 54.038 56.400 0.011 0.000 0.773 6127 E CB 2.048 31.756 29.700 0.013 0.000 1.275 6127 E HN 0.457 nan 8.360 nan 0.000 0.451 6128 P HA -0.020 nan 4.420 nan 0.000 0.266 6128 P C 0.804 178.107 177.300 0.005 0.000 1.195 6128 P CA -0.258 62.844 63.100 0.005 0.000 0.768 6128 P CB 0.452 32.154 31.700 0.003 0.000 0.838 6129 L N 4.439 125.665 121.223 0.005 0.000 2.046 6129 L HA -0.134 4.206 4.340 0.000 0.000 0.208 6129 L C 2.402 179.274 176.870 0.005 0.000 1.077 6129 L CA 1.790 56.633 54.840 0.005 0.000 0.747 6129 L CB -0.848 41.214 42.059 0.004 0.000 0.896 6129 L HN 0.294 nan 8.230 nan 0.000 0.432 6130 R N -0.969 119.533 120.500 0.004 0.000 2.117 6130 R HA -0.177 4.163 4.340 0.000 0.000 0.243 6130 R C 2.026 178.328 176.300 0.004 0.000 1.143 6130 R CA 1.992 58.094 56.100 0.003 0.000 0.968 6130 R CB -0.400 29.902 30.300 0.003 0.000 0.863 6130 R HN 0.378 nan 8.270 nan 0.000 0.444 6131 V N 1.284 121.200 119.914 0.004 0.000 2.332 6131 V HA -0.253 3.867 4.120 0.000 0.000 0.248 6131 V C 2.284 178.380 176.094 0.002 0.000 1.055 6131 V CA 1.849 64.151 62.300 0.003 0.000 1.038 6131 V CB -0.347 31.478 31.823 0.003 0.000 0.651 6131 V HN 0.309 nan 8.190 nan 0.000 0.450 6132 K N 0.232 120.634 120.400 0.003 0.000 2.186 6132 K HA -0.035 4.285 4.320 0.000 0.000 0.202 6132 K C 2.263 178.867 176.600 0.007 0.000 1.052 6132 K CA 1.653 57.942 56.287 0.003 0.000 0.965 6132 K CB -0.674 31.828 32.500 0.005 0.000 0.746 6132 K HN 0.718 nan 8.250 nan 0.000 0.457 6133 T N -1.212 113.347 114.554 0.008 0.000 2.978 6133 T HA -0.082 4.268 4.350 0.000 0.000 0.262 6133 T C 2.016 176.724 174.700 0.012 0.000 1.063 6133 T CA 0.698 62.804 62.100 0.010 0.000 1.140 6133 T CB 0.036 68.908 68.868 0.007 0.000 0.886 6133 T HN -0.047 nan 8.240 nan 0.000 0.470 6134 Q N 1.826 121.631 119.800 0.009 0.000 2.123 6134 Q HA 0.261 4.601 4.340 0.000 0.000 0.199 6134 Q C 2.408 178.415 176.000 0.011 0.000 0.966 6134 Q CA 1.608 57.416 55.803 0.009 0.000 0.845 6134 Q CB -0.924 27.817 28.738 0.006 0.000 0.907 6134 Q HN 0.624 nan 8.270 nan 0.000 0.439 6135 A N 0.573 123.397 122.820 0.007 0.000 1.883 6135 A HA -0.174 4.146 4.320 0.000 0.000 0.217 6135 A C 1.952 179.543 177.584 0.011 0.000 1.186 6135 A CA 1.590 53.628 52.037 0.002 0.000 0.624 6135 A CB -0.750 18.246 19.000 -0.008 0.000 0.822 6135 A HN 0.451 nan 8.150 nan 0.000 0.444 6136 I N -0.134 120.451 120.570 0.025 0.000 2.179 6136 I HA -0.263 3.907 4.170 0.000 0.000 0.242 6136 I C 2.660 178.819 176.117 0.069 0.000 1.088 6136 I CA 1.659 62.997 61.300 0.063 0.000 1.357 6136 I CB -1.634 36.413 38.000 0.077 0.000 1.051 6136 I HN 0.493 nan 8.210 nan 0.000 0.409 6137 Q N 0.202 120.028 119.800 0.043 0.000 1.993 6137 Q HA -0.164 4.176 4.340 0.000 0.000 0.202 6137 Q C 2.465 178.488 176.000 0.040 0.000 0.984 6137 Q CA 2.203 58.028 55.803 0.037 0.000 0.837 6137 Q CB -0.168 28.584 28.738 0.023 0.000 0.902 6137 Q HN 0.376 nan 8.270 nan 0.000 0.423 6138 S N 0.503 116.220 115.700 0.030 0.000 2.383 6138 S HA -0.130 4.340 4.470 0.000 0.000 0.227 6138 S C 1.985 176.604 174.600 0.031 0.000 1.026 6138 S CA 0.928 59.144 58.200 0.027 0.000 0.981 6138 S CB -0.263 62.948 63.200 0.017 0.000 0.818 6138 S HN 0.477 nan 8.310 nan 0.000 0.472 6139 A N 1.631 124.468 122.820 0.028 0.000 1.873 6139 A HA 0.155 4.475 4.320 0.000 0.000 0.215 6139 A C 2.363 179.978 177.584 0.051 0.000 1.186 6139 A CA 1.648 53.698 52.037 0.022 0.000 0.616 6139 A CB -1.135 17.861 19.000 -0.007 0.000 0.823 6139 A HN 0.505 nan 8.150 nan 0.000 0.442 6140 A N -0.528 122.346 122.820 0.090 0.000 1.898 6140 A HA -0.120 4.200 4.320 0.000 0.000 0.216 6140 A C 1.943 179.602 177.584 0.125 0.000 1.181 6140 A CA 1.675 53.802 52.037 0.150 0.000 0.620 6140 A CB -0.370 18.747 19.000 0.195 0.000 0.819 6140 A HN 0.454 nan 8.150 nan 0.000 0.442 6141 E N 0.133 120.385 120.200 0.085 0.000 2.107 6141 E HA -0.055 4.295 4.350 0.000 0.000 0.191 6141 E C 2.243 178.882 176.600 0.065 0.000 0.982 6141 E CA 1.242 57.684 56.400 0.070 0.000 0.809 6141 E CB -0.422 29.308 29.700 0.049 0.000 0.756 6141 E HN 0.538 nan 8.360 nan 0.000 0.459 6142 S N 0.426 116.161 115.700 0.057 0.000 2.406 6142 S HA -0.055 4.415 4.470 0.000 0.000 0.228 6142 S C 2.039 176.674 174.600 0.060 0.000 1.020 6142 S CA 1.066 59.296 58.200 0.049 0.000 0.965 6142 S CB -0.109 63.113 63.200 0.036 0.000 0.798 6142 S HN 0.255 nan 8.310 nan 0.000 0.488 6143 T N 1.848 116.449 114.554 0.078 0.000 2.777 6143 T HA -0.085 4.265 4.350 0.000 0.000 0.266 6143 T C 1.847 176.623 174.700 0.128 0.000 1.040 6143 T CA 1.045 63.207 62.100 0.103 0.000 1.141 6143 T CB -0.252 68.694 68.868 0.131 0.000 0.868 6143 T HN 0.356 nan 8.240 nan 0.000 0.444 6144 E N 0.963 121.246 120.200 0.138 0.000 2.110 6144 E HA -0.154 4.196 4.350 0.000 0.000 0.193 6144 E C 2.167 178.812 176.600 0.074 0.000 0.988 6144 E CA 0.868 57.336 56.400 0.115 0.000 0.804 6144 E CB -0.267 29.497 29.700 0.107 0.000 0.745 6144 E HN 0.331 nan 8.360 nan 0.000 0.458 6145 M N 0.938 120.577 119.600 0.065 0.000 2.067 6145 M HA -0.163 4.317 4.480 0.000 0.000 0.260 6145 M C 2.494 178.823 176.300 0.049 0.000 1.069 6145 M CA 1.144 56.474 55.300 0.051 0.000 1.117 6145 M CB -0.862 31.766 32.600 0.046 0.000 1.334 6145 M HN 0.276 nan 8.290 nan 0.000 0.407 6146 L N 0.675 121.930 121.223 0.052 0.000 2.013 6146 L HA -0.264 4.076 4.340 0.000 0.000 0.212 6146 L C 2.285 179.180 176.870 0.043 0.000 1.073 6146 L CA 1.461 56.330 54.840 0.048 0.000 0.753 6146 L CB -0.394 41.691 42.059 0.044 0.000 0.890 6146 L HN 0.355 nan 8.230 nan 0.000 0.432 6147 L N -0.642 120.610 121.223 0.049 0.000 2.201 6147 L HA -0.191 4.149 4.340 0.000 0.000 0.212 6147 L C 2.720 179.602 176.870 0.021 0.000 1.105 6147 L CA 0.914 55.774 54.840 0.033 0.000 0.775 6147 L CB -0.523 41.561 42.059 0.042 0.000 0.913 6147 L HN 0.315 nan 8.230 nan 0.000 0.440 6148 R N 0.187 120.706 120.500 0.031 0.000 2.193 6148 R HA -0.016 4.324 4.340 0.000 0.000 0.213 6148 R C 0.628 176.944 176.300 0.028 0.000 1.055 6148 R CA 0.274 56.391 56.100 0.029 0.000 0.995 6148 R CB 0.307 30.627 30.300 0.034 0.000 0.893 6148 R HN 0.104 nan 8.270 nan 0.000 0.459 6149 I N 3.082 123.671 120.570 0.033 0.000 2.471 6149 I HA -0.021 4.149 4.170 0.000 0.000 0.286 6149 I C 0.189 176.327 176.117 0.035 0.000 1.079 6149 I CA 0.307 61.629 61.300 0.037 0.000 1.398 6149 I CB 1.126 39.154 38.000 0.047 0.000 1.403 6149 I HN 0.219 nan 8.210 nan 0.000 0.530 6150 D N 2.690 123.111 120.400 0.034 0.000 2.540 6150 D HA 0.152 4.793 4.640 0.000 0.000 0.229 6150 D C -0.208 176.119 176.300 0.045 0.000 1.250 6150 D CA -0.137 53.883 54.000 0.033 0.000 0.817 6150 D CB 0.461 41.272 40.800 0.018 0.000 1.060 6150 D HN 0.360 nan 8.370 nan 0.000 0.508 6151 D N 0.210 120.640 120.400 0.050 0.000 2.738 6151 D HA 0.265 4.905 4.640 0.000 0.000 0.218 6151 D C -1.647 174.685 176.300 0.054 0.000 1.345 6151 D CA -0.440 53.591 54.000 0.051 0.000 0.943 6151 D CB 1.998 42.817 40.800 0.031 0.000 1.514 6151 D HN -0.163 nan 8.370 nan 0.000 0.585 6152 V N 4.355 124.314 119.914 0.075 0.000 2.444 6152 V HA 0.554 4.674 4.120 0.000 0.000 0.294 6152 V C -0.135 175.974 176.094 0.026 0.000 1.022 6152 V CA -0.666 61.673 62.300 0.065 0.000 0.850 6152 V CB 1.544 33.432 31.823 0.108 0.000 0.992 6152 V HN 0.416 nan 8.190 nan 0.000 0.426 6153 I N 4.219 124.786 120.570 -0.005 0.000 2.382 6153 I HA 0.681 4.851 4.170 0.000 0.000 0.285 6153 I C 0.367 176.460 176.117 -0.040 0.000 1.007 6153 I CA -0.248 61.030 61.300 -0.037 0.000 1.142 6153 I CB 1.835 39.816 38.000 -0.031 0.000 1.289 6153 I HN 0.645 nan 8.210 nan 0.000 0.453 6154 A N 5.394 128.178 122.820 -0.061 0.000 2.394 6154 A HA 0.862 5.182 4.320 0.000 0.000 0.333 6154 A C 0.340 177.895 177.584 -0.049 0.000 1.397 6154 A CA -0.558 51.447 52.037 -0.053 0.000 0.884 6154 A CB 0.225 19.185 19.000 -0.067 0.000 1.147 6154 A HN 0.752 nan 8.150 nan 0.000 0.505 6155 A N 2.010 124.809 122.820 -0.035 0.000 2.425 6155 A HA 0.502 4.822 4.320 0.000 0.000 0.242 6155 A C 0.584 178.155 177.584 -0.022 0.000 1.077 6155 A CA -0.067 51.952 52.037 -0.029 0.000 0.781 6155 A CB 0.115 19.102 19.000 -0.021 0.000 1.020 6155 A HN 0.861 nan 8.150 nan 0.000 0.494 6156 E N 0.000 120.188 120.200 -0.020 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 -0.013 0.000 0.976 6156 E CB 0.000 29.692 29.700 -0.012 0.000 0.812 6156 E HN 0.000 nan 8.360 nan 0.000 0.440