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 1lqt_1_B DATA FIRST_RESID 2 DATA SEQUENCE RPYYIAIVGS GPSAFFAAAS LLKAADTTED LDMAVDMLEM LPTPWGLVRS DATA SEQUENCE GVAPDHPKIK SISKQFEKTA EDPRFRFFGN VVVGEHVQPG ELSERYDAVI DATA SEQUENCE YAVGAQSDRM LNIPGEDLPG SIAAVDFVGW YNAHPHFEQV SPDLSGARAV DATA SEQUENCE VIGNGNVALD VARILLTDPD VLARTDIADH ALESLRPRGI QEVVIVGRRG DATA SEQUENCE PLQAAFTTLE LRELADLDGV DVVIDPAELD GITDEDAAAV GKVCKQNIKV DATA SEQUENCE LRGYADREPR PGHRRMVFRF LTSPIEIKGK RKVERIVLGR NELVSDGSGR DATA SEQUENCE VAAKDTGERE ELPAQLVVRS VGYRGVPTPG LPFDDQSGTI PNVGGRINGS DATA SEQUENCE PNEYVVGWIK RGPTGVIGTN KKDAQDTVDT LIKNLGNAKE GAECKSFPXD DATA SEQUENCE HADQVADWLA ARQPKLVTSA HWQVIDAFER AAGEPHGRPR VKLASLAELL DATA SEQUENCE RIGLG 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 2 R HA 0.000 4.318 4.340 -0.036 0.000 0.208 2 R C 0.000 176.181 176.300 -0.198 0.000 0.893 2 R CA 0.000 56.061 56.100 -0.065 0.000 0.921 2 R CB 0.000 30.327 30.300 0.045 0.000 0.687 3 P HA 0.074 4.418 4.420 -0.306 -0.107 0.274 3 P C -1.386 175.646 177.300 -0.445 0.000 1.237 3 P CA -0.712 62.175 63.100 -0.356 0.000 0.793 3 P CB 0.705 32.187 31.700 -0.363 0.000 0.977 4 Y N -1.922 118.268 120.300 -0.184 0.000 2.346 4 Y HA -0.169 4.547 4.550 0.012 -0.158 0.330 4 Y C -0.096 175.670 175.900 -0.222 0.000 1.178 4 Y CA -0.122 57.924 58.100 -0.090 0.000 1.331 4 Y CB 0.999 39.468 38.460 0.016 0.000 1.253 4 Y HN -0.171 7.982 8.280 -0.212 0.000 0.529 5 Y N -0.111 120.391 120.300 0.337 0.000 2.342 5 Y HA 0.317 5.174 4.550 0.249 -0.158 0.338 5 Y C -0.580 175.555 175.900 0.392 0.000 0.965 5 Y CA -0.899 57.369 58.100 0.280 0.000 1.159 5 Y CB 0.881 39.382 38.460 0.069 0.000 1.157 5 Y HN 0.330 9.261 8.280 0.528 -0.335 0.486 6 I N 3.044 123.859 120.570 0.408 0.000 2.406 6 I HA 0.621 5.120 4.170 0.223 -0.196 0.290 6 I C -1.534 174.562 176.117 -0.035 0.000 0.999 6 I CA -3.016 58.402 61.300 0.197 0.000 1.124 6 I CB 2.343 40.387 38.000 0.074 0.000 1.289 6 I HN 0.518 8.929 8.210 0.336 0.000 0.441 7 A N 7.049 129.634 122.820 -0.392 0.000 2.305 7 A HA 0.922 5.065 4.320 -0.635 -0.204 0.322 7 A C -1.611 175.738 177.584 -0.393 0.000 1.187 7 A CA -2.353 49.268 52.037 -0.694 0.000 0.825 7 A CB 2.618 20.875 19.000 -1.239 0.000 1.164 7 A HN 0.261 8.229 8.150 -0.303 0.000 0.498 8 I N 2.838 123.203 120.570 -0.340 0.000 2.406 8 I HA 0.579 4.771 4.170 -0.279 -0.190 0.290 8 I C -1.086 174.853 176.117 -0.296 0.000 0.999 8 I CA -1.289 59.842 61.300 -0.282 0.000 1.124 8 I CB 2.682 40.550 38.000 -0.220 0.000 1.289 8 I HN 0.583 8.589 8.210 -0.340 0.000 0.441 9 V N 6.880 126.597 119.914 -0.330 0.000 2.333 9 V HA 0.508 4.652 4.120 -0.220 -0.156 0.274 9 V C -0.128 175.895 176.094 -0.118 0.000 1.028 9 V CA -1.638 60.507 62.300 -0.258 0.000 0.851 9 V CB -0.847 30.743 31.823 -0.389 0.000 1.000 9 V HN 0.566 8.529 8.190 -0.379 0.000 0.456 10 G N 8.538 117.290 108.800 -0.080 0.000 2.619 10 G HA2 -0.169 3.951 3.960 -0.010 0.000 0.686 10 G HA3 -0.169 3.924 3.960 -0.004 -0.135 0.686 10 G C -2.090 172.773 174.900 -0.062 0.000 1.256 10 G CA -0.090 44.991 45.100 -0.032 0.000 0.826 10 G HN 0.571 8.804 8.290 -0.094 0.000 0.619 11 S N -0.856 114.842 115.700 -0.003 0.000 3.082 11 S HA 0.277 4.659 4.470 -0.147 0.000 0.253 11 S C 0.150 174.836 174.600 0.143 0.000 0.961 11 S CA -0.657 57.565 58.200 0.036 0.000 1.129 11 S CB 1.638 64.981 63.200 0.240 0.000 1.083 11 S HN -0.058 8.353 8.310 0.025 -0.086 0.605 12 G N 2.532 111.345 108.800 0.023 0.000 2.508 12 G HA2 0.297 4.231 3.960 -0.044 0.000 0.278 12 G HA3 0.297 4.343 3.960 0.056 -0.052 0.278 12 G C -2.025 172.737 174.900 -0.230 0.000 1.389 12 G CA -1.370 43.715 45.100 -0.025 0.000 1.050 12 G HN -0.091 8.193 8.290 -0.011 0.000 0.522 13 P HA -0.237 3.585 4.420 -0.996 0.000 0.215 13 P C 1.542 178.533 177.300 -0.516 0.000 1.157 13 P CA 3.117 65.876 63.100 -0.567 0.000 0.868 13 P CB 0.082 31.667 31.700 -0.191 0.000 0.788 14 S N -3.486 112.133 115.700 -0.135 0.000 2.382 14 S HA -0.315 4.303 4.470 0.247 0.000 0.228 14 S C 1.739 176.330 174.600 -0.016 0.000 1.027 14 S CA 3.122 61.358 58.200 0.061 0.000 0.991 14 S CB -0.654 62.614 63.200 0.114 0.000 0.823 14 S HN 0.152 8.397 8.310 -0.107 0.000 0.469 15 A N 2.630 125.376 122.820 -0.123 0.000 1.877 15 A HA -0.218 4.027 4.320 -0.125 0.000 0.216 15 A C 2.188 179.603 177.584 -0.280 0.000 1.186 15 A CA 2.630 54.553 52.037 -0.190 0.000 0.620 15 A CB -0.760 18.090 19.000 -0.249 0.000 0.822 15 A HN -0.041 8.030 8.150 -0.133 0.000 0.443 16 F N -1.980 117.739 119.950 -0.384 0.000 2.206 16 F HA -0.342 4.070 4.527 -0.192 0.000 0.298 16 F C 2.143 177.839 175.800 -0.173 0.000 1.090 16 F CA 3.938 61.686 58.000 -0.419 0.000 1.323 16 F CB -0.106 38.260 39.000 -1.057 0.000 1.028 16 F HN -0.442 7.632 8.300 -0.377 0.000 0.492 17 F N -1.021 118.968 119.950 0.064 0.000 2.134 17 F HA -0.436 4.163 4.527 0.121 0.000 0.299 17 F C 1.901 177.733 175.800 0.053 0.000 1.097 17 F CA 2.117 60.168 58.000 0.085 0.000 1.264 17 F CB -1.507 37.540 39.000 0.079 0.000 1.001 17 F HN 0.149 8.298 8.300 -0.251 0.000 0.479 18 A N -0.884 122.049 122.820 0.188 0.000 1.877 18 A HA -0.402 3.978 4.320 0.101 0.000 0.216 18 A C 1.472 179.103 177.584 0.078 0.000 1.186 18 A CA 2.935 55.029 52.037 0.096 0.000 0.620 18 A CB -1.078 17.946 19.000 0.039 0.000 0.822 18 A HN -0.088 8.154 8.150 0.154 0.000 0.443 19 A N -2.128 120.731 122.820 0.066 0.000 1.883 19 A HA -0.356 4.023 4.320 0.099 0.000 0.217 19 A C 1.821 179.495 177.584 0.150 0.000 1.186 19 A CA 2.998 55.104 52.037 0.115 0.000 0.624 19 A CB -0.747 18.353 19.000 0.167 0.000 0.822 19 A HN -0.090 8.075 8.150 0.025 0.000 0.444 20 A N -2.615 120.310 122.820 0.174 0.000 1.902 20 A HA -0.352 4.059 4.320 0.152 0.000 0.217 20 A C 2.247 179.906 177.584 0.125 0.000 1.181 20 A CA 2.987 55.123 52.037 0.166 0.000 0.623 20 A CB -0.903 18.226 19.000 0.215 0.000 0.818 20 A HN -0.159 8.108 8.150 0.195 0.000 0.443 21 S N -0.124 115.646 115.700 0.117 0.000 2.368 21 S HA -0.329 4.183 4.470 0.070 0.000 0.224 21 S C 2.117 176.753 174.600 0.059 0.000 1.029 21 S CA 3.551 61.797 58.200 0.076 0.000 0.988 21 S CB 0.042 63.280 63.200 0.063 0.000 0.838 21 S HN -0.488 7.904 8.310 0.135 0.000 0.462 22 L N 1.211 122.470 121.223 0.061 0.000 2.017 22 L HA -0.339 4.023 4.340 0.035 0.000 0.208 22 L C 1.785 178.698 176.870 0.071 0.000 1.073 22 L CA 3.447 58.319 54.840 0.053 0.000 0.745 22 L CB -0.229 41.861 42.059 0.052 0.000 0.894 22 L HN -0.258 8.013 8.230 0.068 0.000 0.432 23 L N -2.947 118.330 121.223 0.090 0.000 2.093 23 L HA -0.410 3.982 4.340 0.088 0.000 0.208 23 L C 2.021 178.933 176.870 0.070 0.000 1.085 23 L CA 3.106 58.000 54.840 0.090 0.000 0.755 23 L CB -0.720 41.406 42.059 0.111 0.000 0.904 23 L HN -0.299 7.992 8.230 0.102 0.000 0.435 24 K N -0.480 119.960 120.400 0.067 0.000 2.097 24 K HA -0.376 3.974 4.320 0.050 0.000 0.206 24 K C 2.123 178.750 176.600 0.045 0.000 1.049 24 K CA 3.233 59.551 56.287 0.053 0.000 0.933 24 K CB -0.087 32.444 32.500 0.051 0.000 0.717 24 K HN -0.177 8.117 8.250 0.073 0.000 0.442 25 A N -1.375 121.472 122.820 0.046 0.000 1.877 25 A HA -0.169 4.173 4.320 0.036 0.000 0.216 25 A C 2.573 180.186 177.584 0.048 0.000 1.186 25 A CA 2.721 54.783 52.037 0.042 0.000 0.620 25 A CB -0.712 18.312 19.000 0.040 0.000 0.822 25 A HN -0.480 7.699 8.150 0.048 0.000 0.443 26 A N -1.467 121.386 122.820 0.055 0.000 1.902 26 A HA -0.244 4.216 4.320 0.052 -0.109 0.217 26 A C 2.275 179.882 177.584 0.038 0.000 1.181 26 A CA 2.432 54.499 52.037 0.050 0.000 0.623 26 A CB -0.456 18.576 19.000 0.052 0.000 0.818 26 A HN -0.526 7.660 8.150 0.059 0.000 0.443 27 D N -2.361 118.063 120.400 0.040 0.000 2.219 27 D HA -0.166 4.493 4.640 0.031 0.000 0.205 27 D C 1.889 178.206 176.300 0.028 0.000 0.970 27 D CA 2.789 56.809 54.000 0.033 0.000 0.851 27 D CB -0.222 40.599 40.800 0.036 0.000 0.943 27 D HN -0.070 8.327 8.370 0.044 0.000 0.488 28 T N -5.814 108.757 114.554 0.029 0.000 3.092 28 T HA 0.107 4.470 4.350 0.022 0.000 0.258 28 T C -0.643 174.071 174.700 0.024 0.000 1.031 28 T CA -0.530 61.585 62.100 0.024 0.000 0.925 28 T CB 0.810 69.692 68.868 0.024 0.000 1.036 28 T HN -0.484 7.746 8.240 0.032 0.030 0.544 29 T N 4.386 118.957 114.554 0.027 0.000 2.881 29 T HA 0.195 4.560 4.350 0.025 0.000 0.291 29 T C -1.292 173.422 174.700 0.023 0.000 0.990 29 T CA -0.590 61.527 62.100 0.028 0.000 0.976 29 T CB 2.726 71.616 68.868 0.038 0.000 0.970 29 T HN -0.633 7.624 8.240 0.028 0.000 0.438 30 E N 6.242 126.453 120.200 0.019 0.000 2.398 30 E HA -0.092 4.264 4.350 0.010 0.000 0.263 30 E C 0.300 176.906 176.600 0.011 0.000 1.046 30 E CA 0.923 57.331 56.400 0.012 0.000 0.908 30 E CB 0.497 30.204 29.700 0.011 0.000 0.963 30 E HN 0.196 8.568 8.360 0.019 0.000 0.431 31 D N 0.257 120.656 120.400 -0.001 0.000 2.723 31 D HA -0.297 4.327 4.640 -0.026 0.000 0.236 31 D C -1.983 174.306 176.300 -0.018 0.000 1.138 31 D CA 1.155 55.146 54.000 -0.014 0.000 0.676 31 D CB -0.070 40.725 40.800 -0.007 0.000 1.069 31 D HN 0.329 8.697 8.370 -0.003 0.000 0.430 32 L N -3.332 117.885 121.223 -0.010 0.000 2.541 32 L HA 0.295 4.620 4.340 -0.024 0.000 0.266 32 L C -2.994 173.872 176.870 -0.007 0.000 0.966 32 L CA -0.127 54.718 54.840 0.007 0.000 0.871 32 L CB 2.262 44.364 42.059 0.072 0.000 1.232 32 L HN -0.733 7.478 8.230 -0.006 0.015 0.408 33 D N 7.202 127.565 120.400 -0.062 0.000 2.433 33 D HA 0.392 5.022 4.640 -0.016 0.000 0.236 33 D C -1.779 174.500 176.300 -0.035 0.000 1.026 33 D CA -0.749 53.220 54.000 -0.051 0.000 0.884 33 D CB 4.125 44.871 40.800 -0.089 0.000 1.384 33 D HN 0.247 8.536 8.370 -0.136 0.000 0.477 34 M N -0.312 119.283 119.600 -0.008 0.000 2.457 34 M HA 0.455 5.087 4.480 0.034 -0.131 0.300 34 M C -1.358 174.935 176.300 -0.011 0.000 1.141 34 M CA -1.886 53.426 55.300 0.021 0.000 0.901 34 M CB 4.198 36.841 32.600 0.073 0.000 1.687 34 M HN 0.142 8.430 8.290 -0.003 0.000 0.449 35 A N 1.676 124.480 122.820 -0.028 0.000 2.353 35 A HA 0.550 5.051 4.320 0.057 -0.146 0.299 35 A C -2.804 174.846 177.584 0.110 0.000 1.089 35 A CA -1.160 50.893 52.037 0.027 0.000 0.736 35 A CB 3.699 22.677 19.000 -0.038 0.000 1.195 35 A HN 0.723 8.853 8.150 -0.033 0.000 0.447 36 V N 4.824 124.792 119.914 0.090 0.000 2.409 36 V HA 0.744 5.083 4.120 0.043 -0.193 0.291 36 V C -1.482 174.536 176.094 -0.126 0.000 1.020 36 V CA -1.741 60.566 62.300 0.012 0.000 0.848 36 V CB 2.156 33.998 31.823 0.031 0.000 0.990 36 V HN 0.320 8.564 8.190 0.089 0.000 0.430 37 D N 7.549 127.901 120.400 -0.079 0.000 2.308 37 D HA 0.546 5.276 4.640 -0.129 -0.167 0.242 37 D C -1.715 174.443 176.300 -0.237 0.000 1.059 37 D CA -0.803 53.152 54.000 -0.074 0.000 0.830 37 D CB 3.018 43.939 40.800 0.202 0.000 1.161 37 D HN 0.335 8.684 8.370 -0.035 0.000 0.494 38 M N 4.779 124.195 119.600 -0.308 0.000 2.114 38 M HA 0.585 5.088 4.480 -0.274 -0.188 0.332 38 M C -2.442 173.744 176.300 -0.190 0.000 1.014 38 M CA -1.002 54.133 55.300 -0.275 0.000 0.956 38 M CB 2.931 35.352 32.600 -0.299 0.000 1.551 38 M HN 0.623 8.697 8.290 -0.360 0.000 0.427 39 L N 6.342 127.448 121.223 -0.196 0.000 2.280 39 L HA 0.686 5.090 4.340 -0.204 -0.187 0.287 39 L C -1.540 175.217 176.870 -0.188 0.000 1.023 39 L CA -1.329 53.393 54.840 -0.196 0.000 0.819 39 L CB 0.832 42.786 42.059 -0.175 0.000 1.212 39 L HN 0.856 8.959 8.230 -0.212 0.000 0.420 40 E N 3.932 123.982 120.200 -0.250 0.000 2.210 40 E HA 0.427 4.736 4.350 -0.067 0.000 0.266 40 E C -0.674 175.870 176.600 -0.093 0.000 0.883 40 E CA -2.195 54.126 56.400 -0.132 0.000 0.761 40 E CB 3.084 32.747 29.700 -0.061 0.000 1.156 40 E HN 0.119 8.260 8.360 -0.366 0.000 0.412 41 M N 6.981 126.574 119.600 -0.013 0.000 2.080 41 M HA -0.250 4.409 4.480 0.056 -0.145 0.260 41 M C -0.311 176.002 176.300 0.023 0.000 1.068 41 M CA 3.348 58.672 55.300 0.040 0.000 1.109 41 M CB 0.627 33.285 32.600 0.096 0.000 1.342 41 M HN 0.534 8.827 8.290 0.006 0.000 0.405 42 L N -2.683 118.525 121.223 -0.025 0.000 2.456 42 L HA 0.234 4.555 4.340 -0.031 0.000 0.257 42 L C -0.435 176.422 176.870 -0.020 0.000 1.162 42 L CA -2.023 52.784 54.840 -0.055 0.000 0.808 42 L CB -1.459 40.501 42.059 -0.165 0.000 1.136 42 L HN -0.591 7.957 8.230 -0.033 -0.338 0.466 43 P HA -0.074 4.399 4.420 0.087 0.000 0.222 43 P C -1.082 176.270 177.300 0.088 0.000 1.147 43 P CA 1.407 64.552 63.100 0.074 0.000 0.790 43 P CB 0.247 31.998 31.700 0.086 0.000 0.780 44 T N -5.742 108.750 114.554 -0.104 0.000 2.824 44 T HA 0.313 4.171 4.350 -0.822 0.000 0.280 44 T C -1.798 172.535 174.700 -0.612 0.000 0.995 44 T CA -3.960 57.824 62.100 -0.526 0.000 1.009 44 T CB 1.824 70.456 68.868 -0.394 0.000 0.955 44 T HN -0.448 7.681 8.240 -0.106 0.047 0.452 45 P HA 0.213 4.468 4.420 -0.276 0.000 0.282 45 P C -1.159 175.790 177.300 -0.584 0.000 1.287 45 P CA -0.610 62.007 63.100 -0.806 0.000 0.792 45 P CB 1.639 32.591 31.700 -1.247 0.000 1.163 46 W N -6.626 114.632 121.300 -0.069 0.000 1.119 46 W HA -0.294 4.494 4.660 0.037 -0.106 0.243 46 W C 0.365 176.880 176.519 -0.006 0.000 1.001 46 W CA -0.098 57.245 57.345 -0.002 0.000 0.385 46 W CB -2.140 27.326 29.460 0.010 0.000 2.011 46 W HN 0.116 8.415 8.180 0.198 0.000 1.078 47 G N -0.915 107.970 108.800 0.142 0.000 2.596 47 G HA2 -0.547 3.447 3.960 0.057 0.000 0.295 47 G HA3 -0.547 3.453 3.960 0.067 0.000 0.295 47 G C 0.338 175.289 174.900 0.086 0.000 1.240 47 G CA 0.961 46.110 45.100 0.082 0.000 0.985 47 G HN -0.248 8.038 8.290 0.084 0.055 0.555 48 L N 1.882 123.117 121.223 0.019 0.000 2.353 48 L HA -0.220 4.202 4.340 0.044 -0.056 0.220 48 L C 2.298 179.189 176.870 0.035 0.000 1.133 48 L CA 1.755 56.592 54.840 -0.006 0.000 0.798 48 L CB -0.326 41.634 42.059 -0.165 0.000 0.922 48 L HN 0.094 8.303 8.230 -0.035 0.000 0.445 49 V N -0.498 119.462 119.914 0.077 0.000 2.392 49 V HA -0.523 3.628 4.120 0.052 0.000 0.249 49 V C 1.747 177.931 176.094 0.150 0.000 1.059 49 V CA 4.450 66.810 62.300 0.099 0.000 1.051 49 V CB -0.848 31.044 31.823 0.116 0.000 0.658 49 V HN -0.251 7.969 8.190 0.090 0.025 0.455 50 R N -1.310 119.318 120.500 0.214 0.000 2.066 50 R HA -0.221 4.254 4.340 0.225 0.000 0.224 50 R C 1.849 178.229 176.300 0.134 0.000 1.122 50 R CA 3.430 59.651 56.100 0.203 0.000 0.974 50 R CB 0.480 30.897 30.300 0.195 0.000 0.871 50 R HN -0.519 7.892 8.270 0.232 -0.002 0.435 51 S N -4.857 110.914 115.700 0.119 0.000 2.517 51 S HA 0.195 4.737 4.470 0.119 0.000 0.214 51 S C 0.867 175.534 174.600 0.111 0.000 0.991 51 S CA 1.010 59.288 58.200 0.131 0.000 0.906 51 S CB 1.146 64.472 63.200 0.211 0.000 0.789 51 S HN -0.233 8.147 8.310 0.117 0.000 0.513 52 G N 1.427 110.281 108.800 0.091 0.000 2.808 52 G HA2 0.220 4.211 3.960 0.022 0.000 0.210 52 G HA3 0.220 4.221 3.960 0.068 0.000 0.210 52 G C -0.612 174.355 174.900 0.111 0.000 1.177 52 G CA -0.203 44.937 45.100 0.067 0.000 0.853 52 G HN -0.480 7.750 8.290 0.087 0.112 0.625 53 V N 3.385 123.363 119.914 0.106 0.000 2.681 53 V HA -0.356 3.875 4.120 0.185 0.000 0.306 53 V C -0.092 176.117 176.094 0.192 0.000 1.077 53 V CA 1.191 63.585 62.300 0.157 0.000 1.224 53 V CB -0.350 31.544 31.823 0.119 0.000 0.879 53 V HN -0.324 7.912 8.190 0.076 0.000 0.494 54 A N 8.796 131.749 122.820 0.221 0.000 2.466 54 A HA 0.050 4.530 4.320 0.266 0.000 0.238 54 A C -0.316 177.307 177.584 0.065 0.000 1.074 54 A CA -0.968 51.153 52.037 0.139 0.000 0.774 54 A CB -0.363 18.586 19.000 -0.085 0.000 1.015 54 A HN 0.516 8.832 8.150 0.277 0.000 0.498 55 P HA -0.011 4.521 4.420 0.024 -0.098 0.226 55 P C -0.833 176.440 177.300 -0.045 0.000 1.153 55 P CA 1.311 64.400 63.100 -0.019 0.000 0.777 55 P CB 0.300 31.961 31.700 -0.064 0.000 0.794 56 D N -6.690 113.646 120.400 -0.107 0.000 2.325 56 D HA -0.124 4.490 4.640 -0.043 0.000 0.225 56 D C -0.518 175.780 176.300 -0.003 0.000 1.096 56 D CA -0.121 53.826 54.000 -0.088 0.000 0.844 56 D CB -1.427 39.290 40.800 -0.138 0.000 0.925 56 D HN 0.057 8.303 8.370 -0.168 0.023 0.513 57 H N 0.724 119.803 119.070 0.015 0.000 2.474 57 H HA 0.318 4.883 4.556 0.016 0.000 0.250 57 H C -1.063 174.270 175.328 0.009 0.000 1.307 57 H CA -2.898 53.162 56.048 0.020 0.000 1.058 57 H CB -0.078 29.708 29.762 0.040 0.000 1.693 57 H HN -0.436 7.714 8.280 0.082 0.180 0.552 58 P HA -0.170 4.280 4.420 0.050 0.000 0.221 58 P C 1.113 178.420 177.300 0.012 0.000 1.150 58 P CA 1.729 64.858 63.100 0.048 0.000 0.800 58 P CB 0.277 31.993 31.700 0.026 0.000 0.787 59 K N -1.542 118.863 120.400 0.009 0.000 2.026 59 K HA -0.278 4.020 4.320 -0.037 0.000 0.208 59 K C 2.039 178.604 176.600 -0.059 0.000 1.048 59 K CA 3.048 59.317 56.287 -0.029 0.000 0.929 59 K CB -0.492 31.993 32.500 -0.026 0.000 0.713 59 K HN -0.019 8.224 8.250 0.031 0.025 0.439 60 I N -1.859 118.678 120.570 -0.055 0.000 2.614 60 I HA -0.294 3.824 4.170 -0.087 0.000 0.258 60 I C 0.821 176.871 176.117 -0.111 0.000 1.189 60 I CA 1.297 62.550 61.300 -0.078 0.000 1.462 60 I CB 0.067 38.027 38.000 -0.066 0.000 1.092 60 I HN -0.134 8.053 8.210 -0.038 0.000 0.442 61 K N -0.770 119.576 120.400 -0.091 0.000 2.360 61 K HA -0.329 3.903 4.320 -0.147 0.000 0.201 61 K C 2.161 178.603 176.600 -0.264 0.000 1.046 61 K CA 2.632 58.837 56.287 -0.137 0.000 0.945 61 K CB -0.686 31.783 32.500 -0.052 0.000 0.750 61 K HN -0.602 7.591 8.250 -0.051 0.026 0.464 62 S N 0.784 116.348 115.700 -0.227 0.000 2.440 62 S HA -0.309 4.003 4.470 -0.262 0.000 0.238 62 S C 1.277 175.633 174.600 -0.407 0.000 1.010 62 S CA 2.824 60.863 58.200 -0.268 0.000 0.972 62 S CB -0.181 62.911 63.200 -0.180 0.000 0.774 62 S HN -0.481 7.676 8.310 -0.170 0.051 0.501 63 I N 2.287 122.575 120.570 -0.471 0.000 2.530 63 I HA -0.425 3.417 4.170 -0.547 0.000 0.257 63 I C 0.305 175.687 176.117 -1.225 0.000 1.179 63 I CA 1.846 62.731 61.300 -0.692 0.000 1.440 63 I CB -0.282 37.355 38.000 -0.605 0.000 1.087 63 I HN -0.782 7.164 8.210 -0.388 0.031 0.440 64 S N 0.251 115.215 115.700 -1.226 0.000 2.402 64 S HA -0.470 2.765 4.470 -2.057 0.000 0.233 64 S C 1.854 175.799 174.600 -1.092 0.000 1.030 64 S CA 3.007 60.224 58.200 -1.639 0.000 1.003 64 S CB -0.430 61.529 63.200 -2.067 0.000 0.813 64 S HN -0.145 7.559 8.310 -0.963 0.028 0.477 65 K N 1.834 121.818 120.400 -0.693 0.000 2.097 65 K HA -0.195 4.130 4.320 -0.323 -0.199 0.206 65 K C 2.393 178.777 176.600 -0.359 0.000 1.049 65 K CA 2.259 58.304 56.287 -0.404 0.000 0.933 65 K CB -0.497 31.836 32.500 -0.278 0.000 0.717 65 K HN -0.390 7.459 8.250 -0.639 0.017 0.442 66 Q N -1.321 118.205 119.800 -0.457 0.000 2.119 66 Q HA -0.285 3.945 4.340 -0.182 0.000 0.201 66 Q C 2.690 178.571 176.000 -0.199 0.000 0.972 66 Q CA 2.939 58.569 55.803 -0.288 0.000 0.847 66 Q CB -0.046 28.540 28.738 -0.254 0.000 0.903 66 Q HN -0.470 7.357 8.270 -0.580 0.096 0.433 67 F N -1.484 118.142 119.950 -0.540 0.000 2.186 67 F HA -0.253 3.827 4.527 -0.746 0.000 0.299 67 F C 2.369 177.811 175.800 -0.597 0.000 1.090 67 F CA 0.459 57.929 58.000 -0.883 0.000 1.307 67 F CB -1.007 37.026 39.000 -1.612 0.000 1.019 67 F HN -0.658 7.052 8.300 -0.846 0.083 0.489 68 E N -0.878 119.198 120.200 -0.207 0.000 2.110 68 E HA -0.429 3.945 4.350 0.040 0.000 0.193 68 E C 2.130 178.694 176.600 -0.059 0.000 0.988 68 E CA 2.994 59.370 56.400 -0.040 0.000 0.804 68 E CB -0.479 29.232 29.700 0.018 0.000 0.745 68 E HN -0.117 8.066 8.360 -0.295 0.000 0.458 69 K N -1.234 119.116 120.400 -0.083 0.000 2.057 69 K HA -0.201 4.095 4.320 -0.041 0.000 0.206 69 K C 3.002 179.570 176.600 -0.053 0.000 1.050 69 K CA 2.431 58.686 56.287 -0.054 0.000 0.935 69 K CB -0.501 31.969 32.500 -0.050 0.000 0.715 69 K HN -0.691 7.491 8.250 -0.113 0.000 0.439 70 T N 1.471 115.991 114.554 -0.056 0.000 2.720 70 T HA -0.321 4.008 4.350 -0.035 0.000 0.268 70 T C 1.687 176.198 174.700 -0.315 0.000 1.037 70 T CA 4.378 66.428 62.100 -0.083 0.000 1.144 70 T CB -0.309 68.588 68.868 0.049 0.000 0.864 70 T HN -0.555 7.660 8.240 -0.041 0.000 0.444 71 A N -0.603 121.981 122.820 -0.393 0.000 2.121 71 A HA -0.210 3.214 4.320 -1.493 0.000 0.218 71 A C 0.601 178.110 177.584 -0.125 0.000 1.154 71 A CA 1.975 53.660 52.037 -0.587 0.000 0.679 71 A CB -0.686 18.199 19.000 -0.191 0.000 0.795 71 A HN -0.416 7.515 8.150 -0.231 0.081 0.458 72 E N -3.238 116.928 120.200 -0.056 0.000 2.347 72 E HA -0.216 4.161 4.350 0.045 0.000 0.196 72 E C -0.253 176.376 176.600 0.049 0.000 1.008 72 E CA 0.647 57.059 56.400 0.019 0.000 0.852 72 E CB 0.096 29.802 29.700 0.010 0.000 0.783 72 E HN -0.718 7.456 8.360 -0.074 0.142 0.505 73 D N 0.383 120.810 120.400 0.046 0.000 2.458 73 D HA 0.053 4.736 4.640 0.072 0.000 0.243 73 D C 0.498 176.886 176.300 0.147 0.000 1.146 73 D CA -1.366 52.690 54.000 0.094 0.000 0.877 73 D CB 1.454 42.320 40.800 0.111 0.000 1.176 73 D HN -0.860 7.466 8.370 -0.005 0.041 0.461 74 P HA -0.017 4.472 4.420 0.115 0.000 0.225 74 P C 0.389 177.769 177.300 0.134 0.000 1.148 74 P CA 1.299 64.467 63.100 0.113 0.000 0.779 74 P CB 0.221 31.968 31.700 0.077 0.000 0.780 75 R N -3.724 116.866 120.500 0.150 0.000 2.299 75 R HA 0.012 4.423 4.340 0.118 0.000 0.197 75 R C -0.938 175.482 176.300 0.200 0.000 0.971 75 R CA 0.814 57.002 56.100 0.147 0.000 1.030 75 R CB 0.628 31.000 30.300 0.121 0.000 0.932 75 R HN -0.197 8.463 8.270 0.148 -0.301 0.477 76 F N 0.653 120.650 119.950 0.079 0.000 2.443 76 F HA 0.714 5.501 4.527 0.087 -0.207 0.335 76 F C -1.496 174.347 175.800 0.072 0.000 1.104 76 F CA -1.357 56.694 58.000 0.085 0.000 1.013 76 F CB 2.793 41.851 39.000 0.096 0.000 1.136 76 F HN -0.639 7.718 8.300 0.362 0.161 0.470 77 R N 4.173 124.453 120.500 -0.367 0.000 2.686 77 R HA 0.346 4.638 4.340 -0.079 0.000 0.283 77 R C -2.435 173.547 176.300 -0.530 0.000 0.978 77 R CA -1.827 54.096 56.100 -0.295 0.000 0.897 77 R CB 4.027 34.187 30.300 -0.234 0.000 1.192 77 R HN 0.320 8.212 8.270 -0.630 0.000 0.457 78 F N 3.422 123.078 119.950 -0.490 0.000 2.436 78 F HA 0.563 5.050 4.527 -0.315 -0.149 0.340 78 F C -2.245 173.193 175.800 -0.604 0.000 1.113 78 F CA -1.696 56.092 58.000 -0.354 0.000 1.022 78 F CB 3.487 42.489 39.000 0.002 0.000 1.128 78 F HN 0.296 8.541 8.300 -0.091 0.000 0.466 79 F N 5.983 125.475 119.950 -0.763 0.000 2.676 79 F HA 0.358 4.623 4.527 -0.436 0.000 0.371 79 F C -0.857 174.393 175.800 -0.917 0.000 1.141 79 F CA -1.507 56.118 58.000 -0.624 0.000 1.133 79 F CB 1.328 40.118 39.000 -0.350 0.000 1.376 79 F HN 0.667 8.517 8.300 -0.749 0.000 0.491 80 G N 0.594 108.860 108.800 -0.891 0.000 2.562 80 G HA2 0.036 3.784 3.960 -0.353 0.000 0.275 80 G HA3 0.036 3.786 3.960 -0.609 -0.156 0.275 80 G C -0.709 174.068 174.900 -0.204 0.000 1.196 80 G CA -1.008 43.767 45.100 -0.543 0.000 0.908 80 G HN 0.744 8.472 8.290 -0.778 0.095 0.524 81 N N -1.605 117.020 118.700 -0.124 0.000 2.747 81 N HA -0.476 4.435 4.740 -0.036 -0.193 0.249 81 N C -1.486 173.910 175.510 -0.190 0.000 1.107 81 N CA 1.263 54.256 53.050 -0.095 0.000 0.707 81 N CB -0.396 38.045 38.487 -0.078 0.000 1.054 81 N HN 0.020 8.227 8.380 -0.099 0.114 0.555 82 V N -2.200 117.621 119.914 -0.154 0.000 2.376 82 V HA 0.124 4.081 4.120 -0.273 0.000 0.287 82 V C -0.926 175.200 176.094 0.053 0.000 1.015 82 V CA -1.493 60.722 62.300 -0.142 0.000 0.834 82 V CB 0.885 32.590 31.823 -0.198 0.000 1.001 82 V HN -0.142 7.942 8.190 -0.140 0.023 0.428 83 V N 9.208 129.314 119.914 0.321 0.000 2.318 83 V HA 0.090 4.285 4.120 0.125 0.000 0.271 83 V C -1.054 175.105 176.094 0.108 0.000 1.030 83 V CA -1.592 60.820 62.300 0.186 0.000 0.844 83 V CB 0.120 32.026 31.823 0.139 0.000 1.015 83 V HN 0.245 8.918 8.190 0.806 0.000 0.460 84 V N 7.333 127.297 119.914 0.084 0.000 2.572 84 V HA -0.203 4.109 4.120 0.079 -0.145 0.291 84 V C 1.086 177.227 176.094 0.079 0.000 1.039 84 V CA 0.556 62.912 62.300 0.094 0.000 1.055 84 V CB -0.560 31.348 31.823 0.142 0.000 0.969 84 V HN 0.387 8.626 8.190 0.081 0.000 0.482 85 G N 7.553 116.385 108.800 0.053 0.000 2.213 85 G HA2 -0.298 3.665 3.960 0.005 0.000 0.226 85 G HA3 -0.298 3.821 3.960 0.016 -0.149 0.226 85 G C -0.846 174.028 174.900 -0.043 0.000 0.992 85 G CA 0.361 45.467 45.100 0.009 0.000 0.632 85 G HN 0.673 9.001 8.290 0.064 0.000 0.511 86 E N -0.422 119.727 120.200 -0.085 0.000 2.870 86 E HA 0.053 4.299 4.350 -0.173 0.000 0.185 86 E C 0.849 177.288 176.600 -0.268 0.000 1.084 86 E CA 0.386 56.657 56.400 -0.214 0.000 1.246 86 E CB 1.883 31.388 29.700 -0.325 0.000 1.382 86 E HN -0.299 7.961 8.360 -0.057 0.066 0.492 87 H N -1.678 117.349 119.070 -0.073 0.000 2.403 87 H HA -0.076 4.408 4.556 -0.119 0.000 0.298 87 H C -0.353 174.877 175.328 -0.164 0.000 1.059 87 H CA 3.206 59.177 56.048 -0.129 0.000 1.363 87 H CB 1.504 31.166 29.762 -0.166 0.000 1.410 87 H HN -0.211 7.955 8.280 -0.190 0.000 0.528 88 V N -8.131 111.778 119.914 -0.007 0.000 3.049 88 V HA 0.775 5.031 4.120 0.027 -0.119 0.309 88 V C -2.125 174.026 176.094 0.096 0.000 1.148 88 V CA -3.151 59.156 62.300 0.012 0.000 0.990 88 V CB 3.110 34.888 31.823 -0.075 0.000 1.039 88 V HN -0.905 7.297 8.190 0.020 0.000 0.430 89 Q N 1.453 121.350 119.800 0.162 0.000 2.257 89 Q HA 0.680 5.084 4.340 0.107 0.000 0.262 89 Q C -1.116 174.997 176.000 0.189 0.000 0.997 89 Q CA -3.329 52.557 55.803 0.139 0.000 0.873 89 Q CB 0.331 29.133 28.738 0.107 0.000 1.312 89 Q HN 0.172 8.890 8.270 0.216 -0.317 0.450 90 P HA -0.108 4.508 4.420 0.327 0.000 0.216 90 P C 1.303 178.713 177.300 0.183 0.000 1.153 90 P CA 3.053 66.285 63.100 0.221 0.000 0.858 90 P CB 0.276 32.044 31.700 0.112 0.000 0.789 91 G N -4.953 103.922 108.800 0.126 0.000 2.432 91 G HA2 -0.195 3.813 3.960 0.080 0.000 0.219 91 G HA3 -0.195 3.822 3.960 0.095 0.000 0.219 91 G C 1.407 176.376 174.900 0.114 0.000 1.135 91 G CA 1.634 46.795 45.100 0.102 0.000 0.767 91 G HN 0.368 8.722 8.290 0.107 0.000 0.550 92 E N 1.882 122.174 120.200 0.153 0.000 2.046 92 E HA -0.299 4.086 4.350 0.059 0.000 0.190 92 E C 2.429 179.104 176.600 0.126 0.000 0.982 92 E CA 2.320 58.804 56.400 0.140 0.000 0.800 92 E CB -0.262 29.629 29.700 0.318 0.000 0.756 92 E HN -0.717 7.735 8.360 0.178 0.014 0.449 93 L N -1.489 119.890 121.223 0.260 0.000 2.083 93 L HA -0.350 4.216 4.340 0.377 0.000 0.209 93 L C 1.913 178.951 176.870 0.280 0.000 1.083 93 L CA 2.894 57.919 54.840 0.309 0.000 0.752 93 L CB -0.251 41.960 42.059 0.252 0.000 0.899 93 L HN -0.596 7.808 8.230 0.290 0.000 0.433 94 S N -3.641 112.187 115.700 0.213 0.000 2.447 94 S HA -0.386 4.217 4.470 0.222 0.000 0.233 94 S C 1.074 175.776 174.600 0.170 0.000 1.006 94 S CA 2.673 60.989 58.200 0.194 0.000 0.957 94 S CB -0.175 63.114 63.200 0.149 0.000 0.773 94 S HN -0.269 8.160 8.310 0.197 0.000 0.507 95 E N -0.935 119.341 120.200 0.126 0.000 2.276 95 E HA -0.049 4.355 4.350 0.090 0.000 0.193 95 E C 1.524 178.208 176.600 0.139 0.000 0.983 95 E CA 0.611 57.063 56.400 0.088 0.000 0.861 95 E CB 0.226 29.935 29.700 0.014 0.000 0.817 95 E HN -0.702 7.582 8.360 0.108 0.140 0.485 96 R N -3.513 117.027 120.500 0.065 0.000 2.312 96 R HA 0.000 4.332 4.340 -0.014 0.000 0.205 96 R C -0.037 176.067 176.300 -0.327 0.000 0.904 96 R CA 0.927 56.953 56.100 -0.123 0.000 1.052 96 R CB 1.064 31.088 30.300 -0.459 0.000 1.014 96 R HN -0.798 7.413 8.270 0.072 0.102 0.503 97 Y N -3.251 117.140 120.300 0.152 0.000 2.536 97 Y HA 0.166 4.786 4.550 0.116 0.000 0.347 97 Y C -0.405 175.712 175.900 0.362 0.000 1.000 97 Y CA -0.832 57.384 58.100 0.193 0.000 1.051 97 Y CB 3.443 41.982 38.460 0.132 0.000 1.259 97 Y HN -0.619 7.877 8.280 0.360 0.000 0.468 98 D N 1.324 122.065 120.400 0.568 0.000 2.144 98 D HA -0.216 4.656 4.640 0.386 0.000 0.199 98 D C -0.353 176.110 176.300 0.271 0.000 0.984 98 D CA 2.796 57.042 54.000 0.410 0.000 0.834 98 D CB 1.035 42.071 40.800 0.393 0.000 0.955 98 D HN 0.197 8.931 8.370 0.607 0.000 0.465 99 A N -5.499 117.487 122.820 0.276 0.000 2.606 99 A HA 0.437 5.074 4.320 0.268 -0.156 0.293 99 A C -2.526 175.172 177.584 0.191 0.000 1.082 99 A CA -1.104 51.079 52.037 0.243 0.000 0.685 99 A CB 3.648 22.764 19.000 0.194 0.000 1.284 99 A HN -0.803 7.538 8.150 0.318 0.000 0.408 100 V N -0.567 119.466 119.914 0.198 0.000 2.638 100 V HA 0.797 5.069 4.120 -0.090 -0.206 0.306 100 V C -1.594 174.550 176.094 0.083 0.000 1.052 100 V CA -1.902 60.417 62.300 0.031 0.000 0.885 100 V CB 3.169 35.004 31.823 0.019 0.000 0.999 100 V HN 0.082 8.446 8.190 0.289 0.000 0.424 101 I N 5.351 125.871 120.570 -0.084 0.000 2.362 101 I HA 0.183 4.609 4.170 0.191 -0.141 0.289 101 I C -1.473 174.526 176.117 -0.196 0.000 0.994 101 I CA -1.077 60.226 61.300 0.004 0.000 1.158 101 I CB 1.608 39.605 38.000 -0.004 0.000 1.315 101 I HN 0.679 8.780 8.210 -0.182 0.000 0.451 102 Y N 7.444 127.798 120.300 0.088 0.000 2.383 102 Y HA -0.007 4.572 4.550 0.049 0.000 0.344 102 Y C -1.318 174.631 175.900 0.082 0.000 0.986 102 Y CA -0.094 58.049 58.100 0.072 0.000 1.175 102 Y CB 0.615 39.125 38.460 0.084 0.000 1.152 102 Y HN 0.772 9.150 8.280 0.334 0.103 0.511 103 A N 4.336 127.225 122.820 0.115 0.000 2.956 103 A HA 0.541 5.110 4.320 0.135 -0.168 0.294 103 A C -0.851 176.798 177.584 0.108 0.000 0.993 103 A CA -0.962 51.133 52.037 0.097 0.000 1.032 103 A CB 0.700 19.708 19.000 0.014 0.000 1.129 103 A HN 0.688 8.870 8.150 0.055 0.000 0.505 104 V N -4.699 115.322 119.914 0.177 0.000 3.623 104 V HA 0.025 4.231 4.120 0.142 0.000 0.271 104 V C 0.290 176.500 176.094 0.194 0.000 1.248 104 V CA -1.090 61.318 62.300 0.180 0.000 1.156 104 V CB -0.693 31.263 31.823 0.222 0.000 0.870 104 V HN -0.205 8.118 8.190 0.222 0.000 0.453 105 G N 2.053 110.981 108.800 0.214 0.000 2.601 105 G HA2 -0.388 3.701 3.960 0.215 0.000 0.261 105 G HA3 -0.388 3.764 3.960 0.321 0.000 0.261 105 G C -1.828 173.281 174.900 0.348 0.000 1.289 105 G CA 0.046 45.309 45.100 0.273 0.000 0.920 105 G HN -0.033 8.337 8.290 0.210 0.046 0.571 106 A N -1.042 122.038 122.820 0.434 0.000 2.360 106 A HA 0.262 4.804 4.320 0.370 0.000 0.309 106 A C -0.509 177.337 177.584 0.437 0.000 1.311 106 A CA -0.801 51.503 52.037 0.444 0.000 0.805 106 A CB 0.917 20.238 19.000 0.534 0.000 1.144 106 A HN -0.011 8.416 8.150 0.462 0.000 0.486 107 Q N 2.794 122.783 119.800 0.315 0.000 2.392 107 Q HA 0.026 4.559 4.340 0.322 0.000 0.203 107 Q C 0.436 176.571 176.000 0.224 0.000 0.917 107 Q CA 0.416 56.388 55.803 0.281 0.000 0.939 107 Q CB 0.415 29.294 28.738 0.236 0.000 1.063 107 Q HN 0.362 8.799 8.270 0.278 0.000 0.516 108 S N -2.128 113.675 115.700 0.172 0.000 2.874 108 S HA 0.205 4.723 4.470 0.081 0.000 0.318 108 S C -2.071 172.517 174.600 -0.020 0.000 1.109 108 S CA -1.451 56.799 58.200 0.083 0.000 0.878 108 S CB 1.328 64.583 63.200 0.090 0.000 1.307 108 S HN -0.199 8.190 8.310 0.203 0.043 0.592 109 D N -2.071 118.307 120.400 -0.036 0.000 2.527 109 D HA 0.266 4.827 4.640 -0.131 0.000 0.233 109 D C -0.949 175.348 176.300 -0.005 0.000 1.063 109 D CA -1.087 52.865 54.000 -0.081 0.000 0.880 109 D CB 3.050 43.780 40.800 -0.118 0.000 1.457 109 D HN -0.112 8.257 8.370 -0.001 0.000 0.475 110 R N -0.062 120.441 120.500 0.004 0.000 2.438 110 R HA 0.130 4.484 4.340 0.024 0.000 0.287 110 R C -0.249 176.053 176.300 0.003 0.000 1.077 110 R CA -0.131 55.978 56.100 0.015 0.000 1.034 110 R CB 1.109 31.422 30.300 0.021 0.000 0.993 110 R HN 0.109 8.380 8.270 0.003 0.000 0.459 111 M N 2.014 121.618 119.600 0.006 0.000 2.444 111 M HA -0.031 4.518 4.480 -0.004 -0.072 0.319 111 M C 0.353 176.653 176.300 0.000 0.000 1.183 111 M CA 0.206 55.507 55.300 0.001 0.000 1.032 111 M CB 1.834 34.436 32.600 0.003 0.000 1.569 111 M HN 0.228 8.525 8.290 0.012 0.000 0.468 112 L N 0.691 121.912 121.223 -0.004 0.000 2.240 112 L HA -0.157 4.182 4.340 -0.002 0.000 0.211 112 L C 0.353 177.221 176.870 -0.003 0.000 1.106 112 L CA 1.195 56.033 54.840 -0.004 0.000 0.793 112 L CB 0.315 42.369 42.059 -0.008 0.000 0.927 112 L HN 0.481 9.163 8.230 -0.006 -0.456 0.446 113 N N -3.387 115.311 118.700 -0.003 0.000 2.708 113 N HA -0.355 4.384 4.740 -0.002 0.000 0.255 113 N C -1.326 174.181 175.510 -0.004 0.000 1.046 113 N CA 1.436 54.484 53.050 -0.002 0.000 0.715 113 N CB -2.331 36.156 38.487 0.001 0.000 0.895 113 N HN -0.361 8.231 8.380 -0.003 -0.214 0.545 114 I N -7.086 113.480 120.570 -0.006 0.000 2.892 114 I HA 0.638 4.805 4.170 -0.006 0.000 0.306 114 I C -2.777 173.335 176.117 -0.009 0.000 1.078 114 I CA -3.258 58.038 61.300 -0.007 0.000 1.032 114 I CB 1.966 39.961 38.000 -0.008 0.000 1.229 114 I HN -0.909 7.458 8.210 -0.007 -0.162 0.435 115 P HA -0.054 4.361 4.420 -0.009 0.000 0.268 115 P C 0.034 177.327 177.300 -0.012 0.000 1.205 115 P CA 0.731 63.825 63.100 -0.009 0.000 0.771 115 P CB -0.239 31.456 31.700 -0.008 0.000 0.858 116 G N 4.010 112.802 108.800 -0.013 0.000 2.176 116 G HA2 -0.338 3.878 3.960 -0.017 0.000 0.253 116 G HA3 -0.338 3.612 3.960 -0.016 0.000 0.253 116 G C 1.422 176.311 174.900 -0.019 0.000 0.979 116 G CA 1.069 46.159 45.100 -0.017 0.000 0.641 116 G HN 0.303 8.585 8.290 -0.013 0.000 0.530 117 E N 0.419 120.608 120.200 -0.018 0.000 2.209 117 E HA -0.324 4.012 4.350 -0.023 0.000 0.196 117 E C -0.181 176.407 176.600 -0.021 0.000 0.993 117 E CA 2.375 58.763 56.400 -0.020 0.000 0.819 117 E CB 0.118 29.808 29.700 -0.016 0.000 0.745 117 E HN -0.723 7.571 8.360 -0.015 0.056 0.477 118 D N -3.981 116.408 120.400 -0.019 0.000 2.340 118 D HA -0.017 4.612 4.640 -0.019 0.000 0.220 118 D C 0.291 176.578 176.300 -0.023 0.000 1.039 118 D CA 0.279 54.268 54.000 -0.019 0.000 0.866 118 D CB -0.513 40.277 40.800 -0.016 0.000 0.913 118 D HN -0.025 8.310 8.370 -0.017 0.025 0.523 119 L N 1.736 122.945 121.223 -0.025 0.000 2.485 119 L HA 0.021 4.347 4.340 -0.025 0.000 0.275 119 L C -1.813 175.037 176.870 -0.033 0.000 1.207 119 L CA -0.865 53.958 54.840 -0.027 0.000 0.855 119 L CB -0.376 41.667 42.059 -0.027 0.000 1.114 119 L HN -0.624 7.441 8.230 -0.024 0.151 0.485 120 P HA -0.037 4.357 4.420 -0.043 0.000 0.261 120 P C -0.198 177.073 177.300 -0.048 0.000 1.173 120 P CA 1.210 64.286 63.100 -0.041 0.000 0.760 120 P CB 0.174 31.853 31.700 -0.036 0.000 0.783 121 G N 1.398 110.161 108.800 -0.061 0.000 2.194 121 G HA2 -0.455 3.467 3.960 -0.064 0.000 0.236 121 G HA3 -0.455 3.456 3.960 -0.083 0.000 0.236 121 G C -1.278 173.577 174.900 -0.075 0.000 0.987 121 G CA 0.231 45.289 45.100 -0.071 0.000 0.635 121 G HN 0.501 8.753 8.290 -0.065 0.000 0.520 122 S N 2.125 117.788 115.700 -0.062 0.000 2.498 122 S HA 0.933 5.559 4.470 -0.069 -0.197 0.324 122 S C -0.082 174.486 174.600 -0.053 0.000 1.071 122 S CA -1.431 56.734 58.200 -0.059 0.000 1.113 122 S CB 1.012 64.186 63.200 -0.045 0.000 0.976 122 S HN -0.440 7.780 8.310 -0.054 0.057 0.462 123 I N 0.905 121.439 120.570 -0.061 0.000 3.264 123 I HA 0.504 4.655 4.170 -0.030 0.000 0.315 123 I C -2.950 173.144 176.117 -0.038 0.000 1.154 123 I CA -2.279 58.996 61.300 -0.042 0.000 0.962 123 I CB 4.380 42.357 38.000 -0.038 0.000 1.265 123 I HN 0.447 8.612 8.210 -0.074 0.000 0.463 124 A N -1.829 120.976 122.820 -0.026 0.000 2.293 124 A HA 0.573 5.005 4.320 -0.036 -0.133 0.302 124 A C 0.135 177.707 177.584 -0.020 0.000 1.119 124 A CA -2.284 49.729 52.037 -0.040 0.000 0.823 124 A CB 2.226 21.182 19.000 -0.074 0.000 1.097 124 A HN 0.057 8.512 8.150 -0.017 -0.315 0.491 125 A N 1.391 124.209 122.820 -0.004 0.000 1.940 125 A HA -0.253 4.167 4.320 0.166 0.000 0.219 125 A C 1.887 179.437 177.584 -0.057 0.000 1.176 125 A CA 3.357 55.438 52.037 0.074 0.000 0.631 125 A CB -0.616 18.476 19.000 0.154 0.000 0.814 125 A HN 0.523 8.669 8.150 -0.007 0.000 0.446 126 V N -1.523 118.204 119.914 -0.311 0.000 2.278 126 V HA -0.423 3.314 4.120 -0.639 0.000 0.251 126 V C 1.647 177.389 176.094 -0.587 0.000 1.062 126 V CA 4.077 66.019 62.300 -0.597 0.000 1.038 126 V CB -0.998 30.387 31.823 -0.731 0.000 0.646 126 V HN 0.237 8.224 8.190 -0.332 0.005 0.447 127 D N -0.172 120.015 120.400 -0.356 0.000 2.117 127 D HA -0.254 4.024 4.640 -0.604 0.000 0.198 127 D C 2.562 178.795 176.300 -0.112 0.000 0.982 127 D CA 2.934 56.775 54.000 -0.264 0.000 0.828 127 D CB -0.707 40.120 40.800 0.045 0.000 0.967 127 D HN -0.717 7.527 8.370 -0.211 0.000 0.464 128 F N 1.873 121.738 119.950 -0.142 0.000 2.113 128 F HA -0.375 4.213 4.527 0.102 0.000 0.297 128 F C 1.212 176.915 175.800 -0.161 0.000 1.103 128 F CA 3.072 61.075 58.000 0.005 0.000 1.248 128 F CB 0.316 39.353 39.000 0.061 0.000 0.999 128 F HN -0.497 7.887 8.300 0.140 0.000 0.475 129 V N -1.140 118.481 119.914 -0.488 0.000 2.295 129 V HA -0.563 2.090 4.120 -2.446 0.000 0.246 129 V C 2.236 177.878 176.094 -0.753 0.000 1.049 129 V CA 4.625 66.267 62.300 -1.096 0.000 1.024 129 V CB -1.014 30.566 31.823 -0.407 0.000 0.648 129 V HN 0.399 8.472 8.190 -0.195 0.000 0.447 130 G N -1.434 107.039 108.800 -0.546 0.000 2.440 130 G HA2 -0.339 3.088 3.960 -0.887 0.000 0.218 130 G HA3 -0.339 3.505 3.960 -0.193 0.000 0.218 130 G C 0.586 175.508 174.900 0.036 0.000 1.154 130 G CA 2.107 46.971 45.100 -0.395 0.000 0.767 130 G HN -0.219 7.686 8.290 -0.642 0.000 0.552 131 W N 4.038 125.257 121.300 -0.135 0.000 2.354 131 W HA -0.253 4.673 4.660 0.270 -0.104 0.315 131 W C 1.690 178.301 176.519 0.153 0.000 1.206 131 W CA 3.543 60.950 57.345 0.104 0.000 1.290 131 W CB 0.288 29.777 29.460 0.048 0.000 1.152 131 W HN -0.351 7.883 8.180 0.089 0.000 0.489 132 Y N -4.620 115.567 120.300 -0.188 0.000 2.509 132 Y HA -0.195 3.858 4.550 -0.829 0.000 0.293 132 Y C 1.238 176.950 175.900 -0.313 0.000 1.133 132 Y CA -0.352 57.450 58.100 -0.496 0.000 1.283 132 Y CB -1.512 36.655 38.460 -0.489 0.000 1.001 132 Y HN 0.099 8.229 8.280 -0.251 0.000 0.555 133 N N 0.069 118.763 118.700 -0.011 0.000 2.268 133 N HA 0.108 4.890 4.740 0.070 0.000 0.204 133 N C -1.351 174.178 175.510 0.030 0.000 1.124 133 N CA -0.561 52.517 53.050 0.046 0.000 0.838 133 N CB 0.565 39.092 38.487 0.067 0.000 0.994 133 N HN -0.337 7.927 8.380 -0.148 0.027 0.489 134 A N -3.258 119.567 122.820 0.008 0.000 2.872 134 A HA -0.470 3.927 4.320 0.128 0.000 0.273 134 A C -1.502 176.190 177.584 0.180 0.000 1.442 134 A CA 1.170 53.246 52.037 0.064 0.000 0.801 134 A CB -2.226 16.743 19.000 -0.052 0.000 1.031 134 A HN -0.691 7.289 8.150 -0.025 0.155 0.582 135 H N 0.422 119.590 119.070 0.164 0.000 2.848 135 H HA 0.114 4.746 4.556 0.127 0.000 0.317 135 H C -0.766 174.707 175.328 0.242 0.000 1.046 135 H CA -0.069 56.101 56.048 0.203 0.000 1.470 135 H CB 1.119 31.075 29.762 0.322 0.000 1.483 135 H HN -0.305 8.168 8.280 0.362 0.024 0.548 136 P HA -0.131 4.654 4.420 0.253 -0.213 0.218 136 P C 1.190 178.743 177.300 0.420 0.000 1.148 136 P CA 2.324 65.602 63.100 0.296 0.000 0.822 136 P CB 0.317 32.126 31.700 0.182 0.000 0.784 137 H N -3.050 116.228 119.070 0.346 0.000 2.559 137 H HA -0.134 4.345 4.556 -0.128 0.000 0.273 137 H C 1.027 176.051 175.328 -0.508 0.000 1.000 137 H CA 1.129 57.068 56.048 -0.182 0.000 1.195 137 H CB 0.278 29.765 29.762 -0.458 0.000 1.368 137 H HN -0.493 8.361 8.280 0.989 0.020 0.592 138 F N -4.350 115.763 119.950 0.271 0.000 2.735 138 F HA 0.298 4.911 4.527 0.142 0.000 0.308 138 F C -0.196 175.758 175.800 0.258 0.000 1.112 138 F CA -1.017 57.100 58.000 0.196 0.000 1.235 138 F CB 0.268 39.356 39.000 0.148 0.000 1.027 138 F HN -0.296 8.216 8.300 0.447 0.056 0.528 139 E N 1.256 121.642 120.200 0.309 0.000 2.153 139 E HA -0.378 4.081 4.350 0.181 0.000 0.194 139 E C -0.219 176.454 176.600 0.121 0.000 0.988 139 E CA 3.309 59.825 56.400 0.193 0.000 0.811 139 E CB 0.114 29.908 29.700 0.157 0.000 0.746 139 E HN -0.685 7.829 8.360 0.256 0.000 0.466 140 Q N -3.984 115.888 119.800 0.120 0.000 2.220 140 Q HA -0.077 4.287 4.340 0.041 0.000 0.205 140 Q C 0.684 176.685 176.000 0.001 0.000 0.865 140 Q CA -0.185 55.648 55.803 0.050 0.000 0.960 140 Q CB -0.916 27.834 28.738 0.019 0.000 1.097 140 Q HN -0.123 8.193 8.270 0.119 0.026 0.493 141 V N 0.223 120.145 119.914 0.013 0.000 2.287 141 V HA -0.406 3.673 4.120 -0.068 0.000 0.248 141 V C -0.096 175.766 176.094 -0.388 0.000 1.053 141 V CA 2.689 64.899 62.300 -0.150 0.000 1.027 141 V CB -0.136 31.635 31.823 -0.086 0.000 0.646 141 V HN -0.768 7.468 8.190 0.158 0.049 0.447 142 S N -3.399 111.870 115.700 -0.718 0.000 3.405 142 S HA -0.204 3.945 4.470 -0.535 0.000 0.373 142 S C -1.690 172.651 174.600 -0.432 0.000 0.939 142 S CA -0.330 57.574 58.200 -0.493 0.000 1.295 142 S CB -0.681 62.453 63.200 -0.111 0.000 0.919 142 S HN 0.054 7.731 8.310 -1.054 0.000 0.535 143 P HA 0.007 4.281 4.420 -0.245 0.000 0.271 143 P C -1.336 175.860 177.300 -0.174 0.000 1.218 143 P CA -0.306 62.598 63.100 -0.326 0.000 0.780 143 P CB 0.616 32.134 31.700 -0.304 0.000 0.901 144 D N 0.480 120.820 120.400 -0.102 0.000 2.338 144 D HA -0.027 4.599 4.640 -0.024 0.000 0.255 144 D C 0.005 176.289 176.300 -0.028 0.000 1.237 144 D CA -0.137 53.836 54.000 -0.045 0.000 0.883 144 D CB -0.554 40.222 40.800 -0.040 0.000 1.087 144 D HN 0.175 8.482 8.370 -0.105 0.000 0.485 145 L N 5.552 126.785 121.223 0.017 0.000 2.872 145 L HA 0.241 4.588 4.340 0.013 0.000 0.245 145 L C 0.382 177.272 176.870 0.033 0.000 1.211 145 L CA -0.830 54.034 54.840 0.040 0.000 1.013 145 L CB -1.040 41.092 42.059 0.121 0.000 1.326 145 L HN 0.280 8.533 8.230 0.037 0.000 0.525 146 S N -0.472 115.238 115.700 0.017 0.000 2.496 146 S HA -0.092 4.392 4.470 0.023 0.000 0.224 146 S C 0.752 175.354 174.600 0.003 0.000 0.996 146 S CA 0.623 58.832 58.200 0.015 0.000 0.927 146 S CB 0.518 63.725 63.200 0.013 0.000 0.774 146 S HN -0.578 7.972 8.310 0.009 -0.234 0.524 147 G N -0.314 108.482 108.800 -0.008 0.000 2.444 147 G HA2 0.036 4.079 3.960 -0.021 0.000 0.268 147 G HA3 0.036 3.990 3.960 -0.011 0.000 0.268 147 G C -0.174 174.716 174.900 -0.016 0.000 1.203 147 G CA -1.149 43.943 45.100 -0.014 0.000 0.835 147 G HN -0.645 7.638 8.290 -0.012 0.000 0.543 148 A N 2.784 125.595 122.820 -0.015 0.000 1.969 148 A HA -0.095 4.422 4.320 -0.011 -0.204 0.218 148 A C 0.123 177.692 177.584 -0.025 0.000 1.169 148 A CA 1.342 53.370 52.037 -0.015 0.000 0.635 148 A CB 0.498 19.491 19.000 -0.011 0.000 0.810 148 A HN 0.395 8.540 8.150 -0.014 -0.003 0.445 149 R N -1.829 118.652 120.500 -0.032 0.000 2.534 149 R HA 0.797 5.309 4.340 -0.045 -0.199 0.301 149 R C -2.528 173.737 176.300 -0.059 0.000 0.961 149 R CA -1.605 54.469 56.100 -0.044 0.000 0.871 149 R CB 3.456 33.731 30.300 -0.041 0.000 1.170 149 R HN -0.279 8.306 8.270 -0.031 -0.334 0.446 150 A N 6.324 129.099 122.820 -0.074 0.000 2.355 150 A HA 0.977 5.419 4.320 -0.099 -0.182 0.324 150 A C -2.435 175.087 177.584 -0.104 0.000 1.117 150 A CA -2.461 49.517 52.037 -0.099 0.000 0.785 150 A CB 3.651 22.577 19.000 -0.124 0.000 1.254 150 A HN 0.678 8.784 8.150 -0.073 0.000 0.453 151 V N 1.349 121.199 119.914 -0.108 0.000 2.487 151 V HA 0.641 4.865 4.120 -0.110 -0.169 0.298 151 V C -1.540 174.489 176.094 -0.109 0.000 1.028 151 V CA -1.732 60.506 62.300 -0.103 0.000 0.860 151 V CB 2.955 34.729 31.823 -0.081 0.000 0.991 151 V HN 0.355 8.479 8.190 -0.110 0.000 0.427 152 V N 7.727 127.575 119.914 -0.110 0.000 2.448 152 V HA 0.642 4.933 4.120 -0.082 -0.220 0.295 152 V C -0.854 175.202 176.094 -0.063 0.000 1.025 152 V CA -2.042 60.207 62.300 -0.085 0.000 0.859 152 V CB 2.103 33.878 31.823 -0.079 0.000 0.988 152 V HN 0.721 8.837 8.190 -0.123 0.000 0.431 153 I N 5.801 126.349 120.570 -0.037 0.000 2.331 153 I HA 0.353 4.639 4.170 -0.032 -0.136 0.292 153 I C -0.131 175.989 176.117 0.006 0.000 0.998 153 I CA -2.547 58.739 61.300 -0.022 0.000 1.267 153 I CB -0.808 37.181 38.000 -0.020 0.000 1.386 153 I HN 0.215 8.404 8.210 -0.035 0.000 0.476 154 G N 7.740 116.546 108.800 0.010 0.000 2.428 154 G HA2 -0.196 3.982 3.960 0.037 0.000 0.681 154 G HA3 -0.196 3.767 3.960 0.006 0.000 0.681 154 G C -2.754 172.168 174.900 0.036 0.000 1.340 154 G CA -0.139 44.974 45.100 0.022 0.000 0.915 154 G HN 0.460 8.749 8.290 -0.002 0.000 0.645 155 N N -0.258 118.400 118.700 -0.071 0.000 2.497 155 N HA 0.190 4.777 4.740 -0.254 0.000 0.284 155 N C -1.052 174.038 175.510 -0.701 0.000 1.459 155 N CA -0.643 52.165 53.050 -0.405 0.000 0.899 155 N CB 1.196 39.462 38.487 -0.370 0.000 1.316 155 N HN 0.261 8.593 8.380 -0.080 0.000 0.500 156 G N -0.765 107.940 108.800 -0.159 0.000 2.552 156 G HA2 0.320 4.314 3.960 0.056 0.000 0.324 156 G HA3 0.320 4.226 3.960 -0.091 0.000 0.324 156 G C -0.650 174.457 174.900 0.346 0.000 1.217 156 G CA -1.858 43.250 45.100 0.013 0.000 0.989 156 G HN -0.249 8.039 8.290 -0.003 0.000 0.490 157 N N -0.848 118.064 118.700 0.354 0.000 2.364 157 N HA -0.239 4.809 4.740 0.514 0.000 0.183 157 N C 1.711 177.423 175.510 0.336 0.000 1.022 157 N CA 2.600 55.890 53.050 0.400 0.000 0.883 157 N CB -0.546 38.129 38.487 0.313 0.000 0.965 157 N HN 0.415 8.956 8.380 0.269 0.000 0.438 158 V N -0.452 119.639 119.914 0.293 0.000 2.515 158 V HA -0.318 3.978 4.120 0.294 0.000 0.250 158 V C 1.338 177.602 176.094 0.283 0.000 1.058 158 V CA 3.533 66.008 62.300 0.291 0.000 1.064 158 V CB -0.922 31.084 31.823 0.305 0.000 0.675 158 V HN -0.093 8.242 8.190 0.269 0.017 0.461 159 A N 0.277 123.264 122.820 0.279 0.000 1.933 159 A HA -0.319 4.112 4.320 0.186 0.000 0.218 159 A C 2.081 179.788 177.584 0.205 0.000 1.175 159 A CA 3.190 55.368 52.037 0.234 0.000 0.628 159 A CB -0.853 18.303 19.000 0.260 0.000 0.814 159 A HN -0.550 7.776 8.150 0.293 0.000 0.444 160 L N -2.329 119.048 121.223 0.257 0.000 2.056 160 L HA -0.446 3.943 4.340 0.082 0.000 0.207 160 L C 2.056 179.008 176.870 0.136 0.000 1.078 160 L CA 2.946 57.878 54.840 0.153 0.000 0.749 160 L CB -0.660 41.493 42.059 0.156 0.000 0.901 160 L HN -0.632 7.724 8.230 0.348 0.083 0.433 161 D N -0.590 119.926 120.400 0.193 0.000 2.104 161 D HA -0.307 4.375 4.640 0.069 0.000 0.194 161 D C 2.649 179.079 176.300 0.216 0.000 0.994 161 D CA 3.490 57.594 54.000 0.173 0.000 0.830 161 D CB -0.628 40.334 40.800 0.270 0.000 0.959 161 D HN -0.512 8.001 8.370 0.238 0.000 0.452 162 V N -0.471 119.628 119.914 0.307 0.000 2.287 162 V HA -0.482 4.033 4.120 0.657 0.000 0.248 162 V C 1.997 178.214 176.094 0.204 0.000 1.053 162 V CA 4.148 66.680 62.300 0.387 0.000 1.027 162 V CB -0.701 31.290 31.823 0.280 0.000 0.646 162 V HN -0.281 8.085 8.190 0.293 0.000 0.447 163 A N -1.229 121.640 122.820 0.082 0.000 1.902 163 A HA -0.356 3.952 4.320 -0.022 0.000 0.217 163 A C 2.200 179.785 177.584 0.002 0.000 1.181 163 A CA 3.186 55.221 52.037 -0.003 0.000 0.623 163 A CB -0.592 18.362 19.000 -0.078 0.000 0.818 163 A HN -0.337 7.862 8.150 0.081 0.000 0.443 164 R N -2.672 117.830 120.500 0.004 0.000 2.081 164 R HA -0.345 3.974 4.340 -0.035 0.000 0.235 164 R C 2.549 178.820 176.300 -0.049 0.000 1.131 164 R CA 3.439 59.519 56.100 -0.033 0.000 0.960 164 R CB -0.092 30.171 30.300 -0.063 0.000 0.856 164 R HN -0.254 8.028 8.270 0.021 0.000 0.436 165 I N -1.131 119.407 120.570 -0.052 0.000 2.315 165 I HA -0.324 3.741 4.170 -0.175 0.000 0.248 165 I C 1.293 177.436 176.117 0.043 0.000 1.117 165 I CA 1.824 63.056 61.300 -0.113 0.000 1.404 165 I CB -0.895 36.867 38.000 -0.397 0.000 1.071 165 I HN -0.371 7.829 8.210 -0.017 0.000 0.419 166 L N -3.419 117.881 121.223 0.129 0.000 2.201 166 L HA -0.234 4.215 4.340 0.182 0.000 0.212 166 L C 1.345 178.238 176.870 0.039 0.000 1.105 166 L CA 2.281 57.191 54.840 0.116 0.000 0.775 166 L CB 0.213 42.304 42.059 0.054 0.000 0.913 166 L HN -0.609 7.706 8.230 0.142 0.000 0.440 167 L N -7.475 113.749 121.223 0.003 0.000 2.672 167 L HA 0.170 4.501 4.340 -0.015 0.000 0.236 167 L C -0.065 176.786 176.870 -0.031 0.000 1.092 167 L CA -0.205 54.624 54.840 -0.019 0.000 0.887 167 L CB 1.484 43.523 42.059 -0.034 0.000 1.168 167 L HN -0.854 7.237 8.230 -0.002 0.138 0.502 168 T N 1.415 115.946 114.554 -0.038 0.000 2.940 168 T HA -0.101 4.220 4.350 -0.049 0.000 0.309 168 T C 0.042 174.716 174.700 -0.044 0.000 1.056 168 T CA 2.059 64.129 62.100 -0.048 0.000 1.137 168 T CB 0.532 69.362 68.868 -0.064 0.000 0.976 168 T HN -0.545 7.672 8.240 -0.038 0.000 0.547 169 D N 6.842 127.213 120.400 -0.047 0.000 2.581 169 D HA -0.062 4.555 4.640 -0.039 0.000 0.238 169 D C -0.285 175.992 176.300 -0.039 0.000 1.145 169 D CA -0.762 53.213 54.000 -0.042 0.000 0.866 169 D CB 0.887 41.660 40.800 -0.045 0.000 1.151 169 D HN 0.351 8.690 8.370 -0.051 0.000 0.500 170 P HA -0.184 4.212 4.420 -0.041 0.000 0.222 170 P C 0.527 177.805 177.300 -0.038 0.000 1.147 170 P CA 1.673 64.753 63.100 -0.033 0.000 0.790 170 P CB 0.272 31.961 31.700 -0.018 0.000 0.780 171 D N -2.578 117.803 120.400 -0.032 0.000 2.219 171 D HA -0.193 4.429 4.640 -0.029 0.000 0.205 171 D C 1.420 177.701 176.300 -0.031 0.000 0.970 171 D CA 2.838 56.821 54.000 -0.029 0.000 0.851 171 D CB -0.544 40.243 40.800 -0.021 0.000 0.943 171 D HN -0.286 8.336 8.370 -0.029 -0.269 0.488 172 V N -1.269 118.623 119.914 -0.036 0.000 2.323 172 V HA -0.282 3.820 4.120 -0.031 0.000 0.244 172 V C 2.113 178.177 176.094 -0.049 0.000 1.041 172 V CA 3.003 65.280 62.300 -0.038 0.000 1.025 172 V CB 0.115 31.915 31.823 -0.038 0.000 0.656 172 V HN -0.488 7.569 8.190 -0.037 0.110 0.451 173 L N -0.713 120.473 121.223 -0.062 0.000 2.191 173 L HA -0.329 3.958 4.340 -0.089 0.000 0.212 173 L C 2.150 178.973 176.870 -0.078 0.000 1.103 173 L CA 2.882 57.672 54.840 -0.083 0.000 0.769 173 L CB -1.070 40.928 42.059 -0.102 0.000 0.908 173 L HN -0.560 7.634 8.230 -0.060 0.000 0.438 174 A N -3.242 119.539 122.820 -0.065 0.000 2.172 174 A HA -0.255 4.016 4.320 -0.081 0.000 0.216 174 A C 0.379 177.933 177.584 -0.050 0.000 1.154 174 A CA 2.008 54.005 52.037 -0.066 0.000 0.701 174 A CB -0.546 18.418 19.000 -0.059 0.000 0.789 174 A HN -0.229 7.866 8.150 -0.057 0.021 0.465 175 R N -6.511 113.965 120.500 -0.039 0.000 2.317 175 R HA 0.179 4.509 4.340 -0.016 0.000 0.208 175 R C 0.291 176.572 176.300 -0.031 0.000 0.914 175 R CA -1.139 54.946 56.100 -0.026 0.000 1.060 175 R CB -0.025 30.264 30.300 -0.019 0.000 1.015 175 R HN -0.610 7.594 8.270 -0.042 0.041 0.498 176 T N -2.975 111.551 114.554 -0.047 0.000 2.884 176 T HA 0.125 4.456 4.350 -0.033 0.000 0.277 176 T C -0.641 174.029 174.700 -0.050 0.000 0.976 176 T CA -1.646 60.426 62.100 -0.046 0.000 0.956 176 T CB 2.416 71.247 68.868 -0.062 0.000 1.113 176 T HN -0.383 7.660 8.240 -0.057 0.162 0.554 177 D N -0.173 120.205 120.400 -0.037 0.000 2.352 177 D HA 0.040 4.804 4.640 -0.044 -0.150 0.236 177 D C 0.007 176.271 176.300 -0.059 0.000 1.148 177 D CA -1.517 52.462 54.000 -0.036 0.000 0.844 177 D CB -1.377 39.423 40.800 -0.000 0.000 0.933 177 D HN 0.297 8.652 8.370 -0.025 0.000 0.507 178 I N -0.126 120.390 120.570 -0.091 0.000 2.932 178 I HA -0.451 3.659 4.170 -0.101 0.000 0.295 178 I C -1.271 174.725 176.117 -0.202 0.000 1.227 178 I CA 0.871 62.089 61.300 -0.137 0.000 1.429 178 I CB 1.074 38.966 38.000 -0.180 0.000 1.339 178 I HN -0.733 7.348 8.210 -0.091 0.074 0.589 179 A N 5.858 128.494 122.820 -0.306 0.000 2.540 179 A HA -0.230 3.848 4.320 -0.403 0.000 0.239 179 A C 0.434 177.729 177.584 -0.482 0.000 1.061 179 A CA 0.789 52.518 52.037 -0.513 0.000 0.758 179 A CB 0.694 19.103 19.000 -0.985 0.000 0.991 179 A HN 0.187 8.166 8.150 -0.285 0.000 0.502 180 D N 4.445 124.624 120.400 -0.368 0.000 2.149 180 D HA -0.411 4.116 4.640 -0.189 0.000 0.198 180 D C 1.286 177.474 176.300 -0.186 0.000 0.990 180 D CA 3.998 57.864 54.000 -0.224 0.000 0.839 180 D CB 0.096 40.820 40.800 -0.127 0.000 0.948 180 D HN 0.635 8.808 8.370 -0.328 0.000 0.460 181 H N -4.126 114.861 119.070 -0.138 0.000 2.421 181 H HA -0.098 4.628 4.556 -0.009 -0.175 0.298 181 H C 0.945 176.175 175.328 -0.163 0.000 1.087 181 H CA 1.815 57.810 56.048 -0.088 0.000 1.330 181 H CB -0.938 28.813 29.762 -0.018 0.000 1.388 181 H HN 0.041 8.003 8.280 -0.530 0.000 0.526 182 A N -0.187 122.402 122.820 -0.384 0.000 1.897 182 A HA -0.211 3.792 4.320 -0.529 0.000 0.215 182 A C 1.831 179.338 177.584 -0.128 0.000 1.181 182 A CA 2.356 54.076 52.037 -0.528 0.000 0.620 182 A CB -0.500 17.939 19.000 -0.935 0.000 0.821 182 A HN -0.540 7.110 8.150 -0.662 0.104 0.443 183 L N -1.636 119.495 121.223 -0.154 0.000 2.042 183 L HA -0.549 3.751 4.340 -0.066 0.000 0.210 183 L C 2.232 179.102 176.870 -0.000 0.000 1.076 183 L CA 3.276 58.071 54.840 -0.075 0.000 0.749 183 L CB -0.257 41.739 42.059 -0.104 0.000 0.893 183 L HN -0.267 7.828 8.230 -0.225 0.000 0.432 184 E N -1.251 118.963 120.200 0.023 0.000 2.085 184 E HA -0.335 4.038 4.350 0.039 0.000 0.194 184 E C 2.029 178.699 176.600 0.116 0.000 0.994 184 E CA 2.895 59.334 56.400 0.066 0.000 0.801 184 E CB -0.371 29.382 29.700 0.089 0.000 0.743 184 E HN -0.406 7.957 8.360 0.004 0.000 0.453 185 S N -2.447 113.373 115.700 0.200 0.000 2.453 185 S HA -0.131 4.460 4.470 0.202 0.000 0.231 185 S C 0.977 175.701 174.600 0.206 0.000 1.005 185 S CA 2.434 60.787 58.200 0.255 0.000 0.949 185 S CB 0.241 63.727 63.200 0.477 0.000 0.774 185 S HN -0.662 7.786 8.310 0.230 0.000 0.510 186 L N -1.397 119.927 121.223 0.169 0.000 2.375 186 L HA -0.019 4.410 4.340 0.148 0.000 0.215 186 L C 1.616 178.526 176.870 0.067 0.000 1.108 186 L CA 1.761 56.675 54.840 0.124 0.000 0.830 186 L CB -0.023 42.093 42.059 0.095 0.000 0.959 186 L HN -0.402 7.785 8.230 0.148 0.131 0.457 187 R N -1.067 119.463 120.500 0.051 0.000 2.105 187 R HA -0.252 4.097 4.340 0.015 0.000 0.239 187 R C -0.596 175.721 176.300 0.028 0.000 1.135 187 R CA 4.236 60.352 56.100 0.027 0.000 0.967 187 R CB -1.515 28.795 30.300 0.016 0.000 0.861 187 R HN -0.587 7.717 8.270 0.057 0.000 0.442 188 P HA -0.064 4.371 4.420 0.025 0.000 0.225 188 P C -0.586 176.730 177.300 0.026 0.000 1.148 188 P CA 0.220 63.339 63.100 0.032 0.000 0.779 188 P CB -0.231 31.493 31.700 0.039 0.000 0.780 189 R N -5.660 114.859 120.500 0.030 0.000 3.422 189 R HA -0.389 3.967 4.340 0.025 0.000 0.267 189 R C 0.302 176.613 176.300 0.019 0.000 1.074 189 R CA 0.532 56.645 56.100 0.021 0.000 0.718 189 R CB -3.446 26.858 30.300 0.007 0.000 1.157 189 R HN -0.392 7.862 8.270 0.039 0.040 0.440 190 G N -2.901 105.915 108.800 0.027 0.000 2.418 190 G HA2 -0.197 3.904 3.960 0.022 0.000 0.217 190 G HA3 -0.197 3.772 3.960 0.015 0.000 0.217 190 G C -0.506 174.399 174.900 0.009 0.000 1.158 190 G CA 0.437 45.548 45.100 0.019 0.000 0.771 190 G HN 0.163 8.476 8.290 0.037 0.000 0.545 191 I N 0.766 121.342 120.570 0.010 0.000 2.533 191 I HA -0.195 4.247 4.170 -0.011 -0.279 0.284 191 I C -0.707 175.405 176.117 -0.008 0.000 1.109 191 I CA 1.207 62.504 61.300 -0.004 0.000 1.412 191 I CB -0.149 37.847 38.000 -0.007 0.000 1.396 191 I HN -0.479 7.743 8.210 0.021 0.000 0.543 192 Q N 4.460 124.253 119.800 -0.013 0.000 2.378 192 Q HA 0.205 4.541 4.340 -0.008 0.000 0.229 192 Q C -0.282 175.708 176.000 -0.017 0.000 0.882 192 Q CA -0.328 55.468 55.803 -0.010 0.000 0.936 192 Q CB 2.489 31.224 28.738 -0.004 0.000 1.092 192 Q HN 0.383 8.528 8.270 -0.015 0.116 0.535 193 E N -0.968 119.215 120.200 -0.030 0.000 2.304 193 E HA 0.764 5.317 4.350 -0.042 -0.228 0.277 193 E C -2.756 173.806 176.600 -0.064 0.000 0.898 193 E CA -1.119 55.256 56.400 -0.043 0.000 0.764 193 E CB 3.749 33.427 29.700 -0.036 0.000 1.216 193 E HN -0.501 7.840 8.360 -0.031 0.000 0.419 194 V N 5.957 125.818 119.914 -0.089 0.000 2.448 194 V HA 0.697 4.985 4.120 -0.111 -0.234 0.295 194 V C -1.678 174.320 176.094 -0.160 0.000 1.025 194 V CA -2.047 60.180 62.300 -0.121 0.000 0.859 194 V CB 2.186 33.930 31.823 -0.131 0.000 0.988 194 V HN 0.514 8.650 8.190 -0.090 0.000 0.431 195 V N 8.149 127.970 119.914 -0.154 0.000 2.347 195 V HA 0.365 4.526 4.120 -0.205 -0.164 0.280 195 V C -0.805 175.159 176.094 -0.216 0.000 1.021 195 V CA -1.390 60.803 62.300 -0.177 0.000 0.847 195 V CB 0.509 32.262 31.823 -0.116 0.000 0.990 195 V HN 0.380 8.490 8.190 -0.132 0.000 0.444 196 I N 8.787 129.155 120.570 -0.337 0.000 2.304 196 I HA 0.314 4.545 4.170 -0.225 -0.196 0.291 196 I C -1.142 174.822 176.117 -0.255 0.000 1.018 196 I CA -0.513 60.589 61.300 -0.330 0.000 1.260 196 I CB 0.992 38.635 38.000 -0.595 0.000 1.390 196 I HN 0.873 8.823 8.210 -0.434 0.000 0.475 197 V N 8.317 128.141 119.914 -0.150 0.000 2.334 197 V HA 0.611 4.818 4.120 -0.144 -0.174 0.281 197 V C -0.708 175.344 176.094 -0.071 0.000 1.016 197 V CA -1.924 60.307 62.300 -0.114 0.000 0.832 197 V CB 0.538 32.316 31.823 -0.074 0.000 0.999 197 V HN 0.639 8.759 8.190 -0.116 0.000 0.439 198 G N 5.431 114.180 108.800 -0.084 0.000 2.372 198 G HA2 0.561 4.761 3.960 0.052 0.000 0.323 198 G HA3 0.561 4.531 3.960 0.016 0.000 0.323 198 G C -0.695 174.250 174.900 0.075 0.000 1.152 198 G CA -1.382 43.728 45.100 0.016 0.000 0.906 198 G HN 0.600 8.798 8.290 -0.154 0.000 0.460 199 R N 3.225 123.763 120.500 0.064 0.000 2.093 199 R HA -0.142 4.422 4.340 0.057 -0.189 0.224 199 R C 0.359 176.711 176.300 0.087 0.000 1.101 199 R CA 1.498 57.635 56.100 0.061 0.000 0.979 199 R CB 0.093 30.413 30.300 0.034 0.000 0.877 199 R HN 0.473 8.772 8.270 0.048 0.000 0.441 200 R N -2.292 118.270 120.500 0.103 0.000 2.601 200 R HA 0.343 4.733 4.340 0.083 0.000 0.220 200 R C 0.049 176.456 176.300 0.178 0.000 1.329 200 R CA -0.719 55.442 56.100 0.101 0.000 1.043 200 R CB 1.800 32.133 30.300 0.055 0.000 1.807 200 R HN -0.421 7.908 8.270 0.098 0.000 0.537 201 G N -2.667 106.190 108.800 0.095 0.000 2.705 201 G HA2 0.551 4.482 3.960 -0.049 0.000 0.299 201 G HA3 0.551 4.573 3.960 0.104 0.000 0.299 201 G C -1.577 173.218 174.900 -0.174 0.000 1.315 201 G CA -1.984 43.121 45.100 0.008 0.000 1.045 201 G HN -0.280 8.310 8.290 0.049 -0.270 0.517 202 P HA -0.228 3.782 4.420 -0.684 0.000 0.216 202 P C 1.426 178.608 177.300 -0.196 0.000 1.150 202 P CA 2.434 65.177 63.100 -0.595 0.000 0.837 202 P CB 0.120 31.410 31.700 -0.685 0.000 0.786 203 L N -4.974 116.163 121.223 -0.142 0.000 2.275 203 L HA -0.090 4.213 4.340 -0.061 0.000 0.215 203 L C 1.477 178.324 176.870 -0.038 0.000 1.119 203 L CA 1.783 56.581 54.840 -0.070 0.000 0.790 203 L CB -0.529 41.496 42.059 -0.056 0.000 0.919 203 L HN -0.012 8.123 8.230 -0.158 0.000 0.443 204 Q N -4.349 115.432 119.800 -0.033 0.000 2.319 204 Q HA 0.058 4.388 4.340 -0.016 0.000 0.202 204 Q C -0.599 175.388 176.000 -0.022 0.000 0.896 204 Q CA -0.663 55.131 55.803 -0.016 0.000 0.942 204 Q CB -0.127 28.610 28.738 -0.002 0.000 1.083 204 Q HN -0.562 7.545 8.270 -0.043 0.137 0.510 205 A N -0.658 122.152 122.820 -0.017 0.000 2.483 205 A HA -0.169 4.060 4.320 -0.153 0.000 0.238 205 A C -0.048 177.457 177.584 -0.132 0.000 1.070 205 A CA 0.529 52.505 52.037 -0.100 0.000 0.770 205 A CB 0.375 19.383 19.000 0.012 0.000 1.008 205 A HN -0.849 7.142 8.150 -0.005 0.156 0.497 206 A N 1.228 123.885 122.820 -0.273 0.000 2.275 206 A HA 0.341 4.629 4.320 -0.054 0.000 0.212 206 A C 0.099 177.668 177.584 -0.025 0.000 1.201 206 A CA -0.098 51.861 52.037 -0.129 0.000 0.843 206 A CB 0.651 19.587 19.000 -0.107 0.000 0.873 206 A HN 0.075 7.961 8.150 -0.440 0.000 0.492 207 F N -1.021 119.010 119.950 0.135 0.000 2.545 207 F HA -0.115 4.704 4.527 0.147 -0.203 0.348 207 F C 0.454 176.316 175.800 0.102 0.000 1.163 207 F CA -0.009 58.074 58.000 0.139 0.000 1.331 207 F CB 0.188 39.288 39.000 0.167 0.000 1.138 207 F HN -0.827 7.204 8.300 -0.367 0.050 0.602 208 T N -3.119 111.619 114.554 0.307 0.000 2.949 208 T HA 0.262 4.710 4.350 0.164 0.000 0.287 208 T C 0.623 175.413 174.700 0.151 0.000 1.034 208 T CA -2.085 60.124 62.100 0.182 0.000 1.018 208 T CB 2.482 71.427 68.868 0.128 0.000 1.135 208 T HN -0.079 8.595 8.240 0.323 -0.240 0.532 209 T N 1.939 116.551 114.554 0.096 0.000 2.809 209 T HA -0.119 4.374 4.350 0.073 -0.099 0.260 209 T C 2.155 176.888 174.700 0.056 0.000 1.039 209 T CA 3.492 65.631 62.100 0.067 0.000 1.141 209 T CB -0.183 68.708 68.868 0.038 0.000 0.869 209 T HN 0.251 8.539 8.240 0.081 0.000 0.437 210 L N 0.228 121.481 121.223 0.049 0.000 2.043 210 L HA -0.298 4.065 4.340 0.038 0.000 0.212 210 L C 1.001 177.916 176.870 0.074 0.000 1.075 210 L CA 3.470 58.337 54.840 0.045 0.000 0.752 210 L CB -0.400 41.673 42.059 0.023 0.000 0.891 210 L HN -0.190 8.068 8.230 0.045 0.000 0.432 211 E N -3.078 117.177 120.200 0.093 0.000 2.150 211 E HA -0.312 4.316 4.350 0.159 -0.183 0.193 211 E C 2.246 178.908 176.600 0.104 0.000 0.985 211 E CA 3.236 59.715 56.400 0.133 0.000 0.814 211 E CB -0.690 29.113 29.700 0.171 0.000 0.752 211 E HN 0.119 8.524 8.360 0.091 0.009 0.466 212 L N -2.074 119.194 121.223 0.074 0.000 2.072 212 L HA -0.376 3.979 4.340 0.024 0.000 0.205 212 L C 2.249 179.222 176.870 0.171 0.000 1.079 212 L CA 2.982 57.862 54.840 0.067 0.000 0.752 212 L CB -0.248 41.826 42.059 0.026 0.000 0.906 212 L HN -0.668 7.526 8.230 0.080 0.084 0.436 213 R N -1.233 119.334 120.500 0.111 0.000 2.096 213 R HA -0.293 4.107 4.340 0.100 0.000 0.235 213 R C 2.535 178.925 176.300 0.151 0.000 1.127 213 R CA 3.310 59.474 56.100 0.107 0.000 0.968 213 R CB 0.034 30.358 30.300 0.040 0.000 0.861 213 R HN -0.092 8.153 8.270 0.077 0.071 0.440 214 E N -1.378 118.898 120.200 0.126 0.000 2.418 214 E HA -0.106 4.464 4.350 0.101 -0.160 0.197 214 E C 2.046 178.712 176.600 0.110 0.000 1.026 214 E CA 1.720 58.188 56.400 0.114 0.000 0.862 214 E CB -0.770 29.001 29.700 0.119 0.000 0.799 214 E HN -0.312 8.119 8.360 0.119 0.000 0.518 215 L N 0.348 121.646 121.223 0.125 0.000 2.131 215 L HA -0.323 4.042 4.340 0.041 0.000 0.210 215 L C 2.051 178.953 176.870 0.053 0.000 1.092 215 L CA 2.400 57.277 54.840 0.062 0.000 0.759 215 L CB -0.610 41.451 42.059 0.003 0.000 0.903 215 L HN -0.778 7.504 8.230 0.152 0.039 0.435 216 A N -3.926 118.988 122.820 0.157 0.000 2.168 216 A HA -0.209 4.188 4.320 0.128 0.000 0.215 216 A C 0.230 177.876 177.584 0.103 0.000 1.152 216 A CA 1.553 53.692 52.037 0.170 0.000 0.716 216 A CB -0.505 18.677 19.000 0.303 0.000 0.794 216 A HN -0.515 7.766 8.150 0.246 0.017 0.465 217 D N -3.285 117.162 120.400 0.078 0.000 2.340 217 D HA 0.026 4.698 4.640 0.053 0.000 0.220 217 D C -0.479 175.837 176.300 0.026 0.000 1.039 217 D CA 0.212 54.243 54.000 0.051 0.000 0.866 217 D CB 0.308 41.137 40.800 0.048 0.000 0.913 217 D HN -0.504 7.755 8.370 0.082 0.160 0.523 218 L N 2.004 123.236 121.223 0.016 0.000 2.407 218 L HA -0.070 4.260 4.340 -0.017 0.000 0.282 218 L C -0.673 176.180 176.870 -0.028 0.000 1.110 218 L CA -0.002 54.831 54.840 -0.013 0.000 0.863 218 L CB -0.262 41.783 42.059 -0.023 0.000 1.207 218 L HN -0.946 7.246 8.230 0.023 0.052 0.454 219 D N 5.434 125.809 120.400 -0.041 0.000 2.443 219 D HA -0.134 4.471 4.640 -0.058 0.000 0.239 219 D C 1.190 177.394 176.300 -0.161 0.000 1.136 219 D CA 1.544 55.499 54.000 -0.075 0.000 0.879 219 D CB 1.091 41.857 40.800 -0.057 0.000 1.195 219 D HN 0.142 8.492 8.370 -0.033 0.000 0.443 220 G N 1.357 109.951 108.800 -0.343 0.000 2.179 220 G HA2 -0.365 3.375 3.960 -0.366 0.000 0.260 220 G HA3 -0.365 2.973 3.960 -1.037 0.000 0.260 220 G C -1.432 173.213 174.900 -0.425 0.000 0.977 220 G CA 0.847 45.600 45.100 -0.580 0.000 0.641 220 G HN 0.435 8.505 8.290 -0.366 0.000 0.533 221 V N -0.929 118.870 119.914 -0.191 0.000 2.656 221 V HA 0.507 4.796 4.120 -0.015 -0.178 0.307 221 V C -0.819 175.328 176.094 0.088 0.000 1.051 221 V CA -1.871 60.412 62.300 -0.028 0.000 0.893 221 V CB 2.552 34.351 31.823 -0.040 0.000 0.999 221 V HN -0.758 7.292 8.190 -0.154 0.049 0.426 222 D N 7.837 128.301 120.400 0.106 0.000 2.192 222 D HA 0.322 5.014 4.640 0.087 0.000 0.246 222 D C -1.405 174.890 176.300 -0.008 0.000 1.042 222 D CA -1.120 52.926 54.000 0.077 0.000 0.847 222 D CB 2.732 43.581 40.800 0.082 0.000 1.186 222 D HN 0.456 8.883 8.370 0.096 0.000 0.461 223 V N 3.102 122.963 119.914 -0.089 0.000 2.432 223 V HA 0.264 4.505 4.120 -0.090 -0.175 0.271 223 V C -0.361 175.706 176.094 -0.045 0.000 1.046 223 V CA -0.347 61.848 62.300 -0.174 0.000 0.945 223 V CB 0.206 31.611 31.823 -0.696 0.000 0.992 223 V HN 0.365 8.496 8.190 -0.098 0.000 0.471 224 V N 9.050 128.995 119.914 0.052 0.000 2.409 224 V HA 0.215 4.383 4.120 0.081 0.000 0.291 224 V C -1.853 174.341 176.094 0.166 0.000 1.020 224 V CA -1.382 60.971 62.300 0.090 0.000 0.848 224 V CB 1.547 33.405 31.823 0.059 0.000 0.990 224 V HN 0.761 8.996 8.190 0.075 0.000 0.430 225 I N 5.198 125.866 120.570 0.162 0.000 2.500 225 I HA 0.209 4.517 4.170 0.231 0.000 0.286 225 I C -1.498 174.709 176.117 0.149 0.000 1.063 225 I CA -1.115 60.304 61.300 0.200 0.000 1.062 225 I CB 3.407 41.538 38.000 0.218 0.000 1.223 225 I HN 0.319 8.613 8.210 0.140 0.000 0.435 226 D N 8.156 128.641 120.400 0.141 0.000 2.425 226 D HA 0.118 4.810 4.640 0.088 0.000 0.247 226 D C -0.341 176.021 176.300 0.103 0.000 1.147 226 D CA -1.404 52.659 54.000 0.105 0.000 0.879 226 D CB 1.618 42.476 40.800 0.097 0.000 1.179 226 D HN 0.607 9.069 8.370 0.153 0.000 0.456 227 P HA -0.179 4.277 4.420 0.059 0.000 0.218 227 P C 0.475 177.807 177.300 0.054 0.000 1.146 227 P CA 1.777 64.912 63.100 0.059 0.000 0.813 227 P CB 0.124 31.850 31.700 0.042 0.000 0.778 228 A N -2.544 120.311 122.820 0.060 0.000 2.067 228 A HA -0.160 4.289 4.320 0.040 -0.105 0.219 228 A C 2.359 179.983 177.584 0.067 0.000 1.158 228 A CA 2.278 54.347 52.037 0.054 0.000 0.661 228 A CB -0.738 18.295 19.000 0.054 0.000 0.801 228 A HN 0.067 8.585 8.150 0.063 -0.330 0.452 229 E N -1.637 118.625 120.200 0.103 0.000 2.333 229 E HA -0.169 4.272 4.350 0.153 0.000 0.198 229 E C 0.926 177.539 176.600 0.022 0.000 1.007 229 E CA 2.028 58.510 56.400 0.136 0.000 0.845 229 E CB -0.152 29.724 29.700 0.294 0.000 0.766 229 E HN -0.209 8.086 8.360 0.117 0.134 0.507 230 L N -2.746 118.481 121.223 0.007 0.000 2.693 230 L HA 0.166 4.456 4.340 -0.084 0.000 0.235 230 L C -1.050 175.805 176.870 -0.025 0.000 1.127 230 L CA -1.010 53.807 54.840 -0.039 0.000 0.914 230 L CB 0.733 42.773 42.059 -0.031 0.000 1.193 230 L HN -0.577 7.520 8.230 0.029 0.151 0.502 231 D N -0.415 119.982 120.400 -0.004 0.000 2.345 231 D HA -0.117 4.519 4.640 -0.006 0.000 0.247 231 D C 1.118 177.412 176.300 -0.010 0.000 1.108 231 D CA 0.698 54.696 54.000 -0.003 0.000 0.894 231 D CB 0.047 40.852 40.800 0.008 0.000 1.203 231 D HN -0.731 7.536 8.370 0.008 0.108 0.430 232 G N 1.332 110.126 108.800 -0.011 0.000 2.176 232 G HA2 -0.278 3.676 3.960 -0.011 0.000 0.253 232 G HA3 -0.278 3.676 3.960 -0.009 0.000 0.253 232 G C -0.527 174.360 174.900 -0.022 0.000 0.979 232 G CA 0.016 45.108 45.100 -0.013 0.000 0.641 232 G HN 0.223 8.508 8.290 -0.009 0.000 0.530 233 I N 2.293 122.845 120.570 -0.029 0.000 2.382 233 I HA 0.273 4.566 4.170 -0.035 -0.144 0.285 233 I C -0.781 175.317 176.117 -0.032 0.000 1.007 233 I CA -1.183 60.095 61.300 -0.038 0.000 1.142 233 I CB 0.881 38.845 38.000 -0.060 0.000 1.289 233 I HN -0.563 7.578 8.210 -0.028 0.052 0.453 234 T N 5.405 119.943 114.554 -0.027 0.000 2.912 234 T HA 0.310 4.647 4.350 -0.022 0.000 0.280 234 T C 0.235 174.920 174.700 -0.025 0.000 0.989 234 T CA -2.221 59.865 62.100 -0.023 0.000 0.995 234 T CB 1.896 70.754 68.868 -0.017 0.000 1.077 234 T HN 0.175 8.701 8.240 -0.025 -0.301 0.531 235 D N 0.745 121.132 120.400 -0.022 0.000 2.219 235 D HA -0.279 4.346 4.640 -0.025 0.000 0.205 235 D C 2.131 178.420 176.300 -0.019 0.000 0.970 235 D CA 3.975 57.962 54.000 -0.022 0.000 0.851 235 D CB -0.377 40.410 40.800 -0.021 0.000 0.943 235 D HN 0.425 8.783 8.370 -0.020 0.000 0.488 236 E N -0.134 120.056 120.200 -0.016 0.000 2.077 236 E HA -0.308 4.034 4.350 -0.013 0.000 0.193 236 E C 1.965 178.556 176.600 -0.015 0.000 0.989 236 E CA 3.026 59.417 56.400 -0.014 0.000 0.800 236 E CB -0.090 29.603 29.700 -0.012 0.000 0.746 236 E HN 0.232 8.571 8.360 -0.016 0.011 0.452 237 D N -0.522 119.867 120.400 -0.018 0.000 2.123 237 D HA -0.291 4.339 4.640 -0.017 0.000 0.196 237 D C 2.180 178.468 176.300 -0.021 0.000 0.992 237 D CA 2.993 56.981 54.000 -0.019 0.000 0.833 237 D CB -0.506 40.280 40.800 -0.024 0.000 0.954 237 D HN -0.460 7.820 8.370 -0.019 0.079 0.455 238 A N -0.608 122.197 122.820 -0.024 0.000 1.873 238 A HA -0.183 4.121 4.320 -0.026 0.000 0.215 238 A C 1.639 179.213 177.584 -0.016 0.000 1.186 238 A CA 2.797 54.820 52.037 -0.023 0.000 0.616 238 A CB -0.385 18.598 19.000 -0.028 0.000 0.823 238 A HN -0.514 7.621 8.150 -0.025 0.000 0.442 239 A N -2.222 120.589 122.820 -0.015 0.000 1.972 239 A HA -0.280 4.035 4.320 -0.009 0.000 0.219 239 A C 1.272 178.850 177.584 -0.009 0.000 1.169 239 A CA 2.437 54.468 52.037 -0.011 0.000 0.635 239 A CB -0.327 18.667 19.000 -0.011 0.000 0.810 239 A HN -0.173 7.967 8.150 -0.016 0.000 0.446 240 A N -3.052 119.763 122.820 -0.010 0.000 2.015 240 A HA -0.161 4.154 4.320 -0.007 0.000 0.219 240 A C 1.415 178.995 177.584 -0.007 0.000 1.163 240 A CA 2.308 54.340 52.037 -0.008 0.000 0.646 240 A CB -0.524 18.471 19.000 -0.009 0.000 0.806 240 A HN -0.504 7.623 8.150 -0.012 0.015 0.448 241 V N -2.886 117.022 119.914 -0.009 0.000 2.323 241 V HA -0.207 3.909 4.120 -0.007 0.000 0.244 241 V C 0.757 176.850 176.094 -0.003 0.000 1.041 241 V CA 1.648 63.944 62.300 -0.007 0.000 1.025 241 V CB 0.494 32.311 31.823 -0.009 0.000 0.656 241 V HN -0.658 7.431 8.190 -0.011 0.095 0.451 242 G N -4.211 104.588 108.800 -0.002 0.000 2.337 242 G HA2 -0.087 3.876 3.960 0.004 0.000 0.298 242 G HA3 -0.087 3.873 3.960 0.000 0.000 0.298 242 G C -1.489 173.413 174.900 0.002 0.000 1.335 242 G CA -0.245 44.855 45.100 0.001 0.000 0.875 242 G HN -0.843 7.445 8.290 -0.004 0.000 0.579 243 K N 0.312 120.714 120.400 0.004 0.000 2.057 243 K HA -0.249 4.071 4.320 0.001 0.000 0.206 243 K C 1.954 178.560 176.600 0.009 0.000 1.050 243 K CA 2.780 59.070 56.287 0.004 0.000 0.935 243 K CB 0.117 32.619 32.500 0.004 0.000 0.715 243 K HN 0.156 8.409 8.250 0.005 0.000 0.439 244 V N -0.563 119.361 119.914 0.016 0.000 2.295 244 V HA -0.329 3.807 4.120 0.026 0.000 0.246 244 V C 2.127 178.238 176.094 0.028 0.000 1.049 244 V CA 3.583 65.900 62.300 0.027 0.000 1.024 244 V CB -0.976 30.871 31.823 0.040 0.000 0.648 244 V HN -0.125 8.075 8.190 0.017 0.000 0.447 245 C N 0.842 120.154 119.300 0.021 0.000 2.413 245 C HA -0.463 4.013 4.460 0.026 0.000 0.276 245 C C 1.478 176.469 174.990 0.001 0.000 1.236 245 C CA 3.172 62.199 59.018 0.014 0.000 1.735 245 C CB -1.981 25.762 27.740 0.004 0.000 2.031 245 C HN 0.127 8.367 8.230 0.018 0.000 0.474 246 K N -0.078 120.320 120.400 -0.003 0.000 2.044 246 K HA -0.518 3.792 4.320 -0.017 0.000 0.210 246 K C 2.286 178.877 176.600 -0.014 0.000 1.049 246 K CA 3.687 59.968 56.287 -0.012 0.000 0.927 246 K CB -0.314 32.180 32.500 -0.010 0.000 0.713 246 K HN -0.236 8.013 8.250 -0.001 0.000 0.443 247 Q N -2.221 117.575 119.800 -0.007 0.000 2.123 247 Q HA -0.257 4.071 4.340 -0.021 0.000 0.199 247 Q C 2.865 178.856 176.000 -0.014 0.000 0.966 247 Q CA 2.385 58.181 55.803 -0.012 0.000 0.845 247 Q CB -0.565 28.170 28.738 -0.004 0.000 0.907 247 Q HN -0.500 7.770 8.270 -0.001 0.000 0.439 248 N N 1.122 119.827 118.700 0.008 0.000 2.104 248 N HA -0.272 4.481 4.740 0.021 0.000 0.190 248 N C 2.402 177.903 175.510 -0.015 0.000 1.024 248 N CA 3.080 56.142 53.050 0.020 0.000 0.853 248 N CB -0.452 38.079 38.487 0.073 0.000 1.008 248 N HN 0.078 8.469 8.380 0.018 0.000 0.424 249 I N -0.152 120.402 120.570 -0.026 0.000 2.226 249 I HA -0.448 3.688 4.170 -0.058 0.000 0.245 249 I C 1.627 177.707 176.117 -0.061 0.000 1.100 249 I CA 2.538 63.809 61.300 -0.049 0.000 1.374 249 I CB -1.145 36.825 38.000 -0.050 0.000 1.057 249 I HN 0.188 8.386 8.210 -0.019 0.000 0.413 250 K N -0.021 120.343 120.400 -0.059 0.000 2.063 250 K HA -0.378 3.901 4.320 -0.068 0.000 0.208 250 K C 2.738 179.266 176.600 -0.120 0.000 1.048 250 K CA 3.899 60.141 56.287 -0.074 0.000 0.928 250 K CB -0.228 32.234 32.500 -0.062 0.000 0.713 250 K HN -0.739 7.482 8.250 -0.048 0.000 0.442 251 V N -0.244 119.588 119.914 -0.138 0.000 2.343 251 V HA -0.401 3.529 4.120 -0.317 0.000 0.247 251 V C 1.983 177.890 176.094 -0.312 0.000 1.051 251 V CA 3.989 66.135 62.300 -0.257 0.000 1.036 251 V CB -0.541 31.164 31.823 -0.197 0.000 0.654 251 V HN -0.517 7.611 8.190 -0.102 0.000 0.451 252 L N -1.450 119.692 121.223 -0.136 0.000 2.046 252 L HA -0.452 3.909 4.340 0.035 0.000 0.208 252 L C 2.261 179.111 176.870 -0.032 0.000 1.077 252 L CA 3.334 58.148 54.840 -0.044 0.000 0.747 252 L CB -0.834 41.204 42.059 -0.034 0.000 0.896 252 L HN -0.103 8.067 8.230 -0.099 0.000 0.432 253 R N -1.520 118.942 120.500 -0.063 0.000 2.091 253 R HA -0.396 3.934 4.340 -0.017 0.000 0.238 253 R C 2.666 178.935 176.300 -0.052 0.000 1.136 253 R CA 3.693 59.767 56.100 -0.043 0.000 0.959 253 R CB -0.420 29.851 30.300 -0.049 0.000 0.856 253 R HN 0.262 8.487 8.270 -0.075 0.000 0.437 254 G N -2.035 106.686 108.800 -0.132 0.000 2.421 254 G HA2 -0.228 3.584 3.960 -0.247 0.000 0.216 254 G HA3 -0.228 3.674 3.960 -0.096 0.000 0.216 254 G C 2.132 176.985 174.900 -0.079 0.000 1.171 254 G CA 1.846 46.853 45.100 -0.155 0.000 0.775 254 G HN -0.363 7.741 8.290 -0.175 0.081 0.543 255 Y N 1.852 122.141 120.300 -0.018 0.000 2.200 255 Y HA -0.303 4.250 4.550 0.005 0.000 0.290 255 Y C 2.551 178.458 175.900 0.013 0.000 1.137 255 Y CA 1.402 59.499 58.100 -0.004 0.000 1.163 255 Y CB -0.895 37.549 38.460 -0.025 0.000 0.988 255 Y HN -0.550 7.600 8.280 -0.217 0.000 0.518 256 A N -1.285 121.630 122.820 0.158 0.000 2.070 256 A HA -0.151 4.443 4.320 0.124 -0.200 0.220 256 A C 0.788 178.417 177.584 0.075 0.000 1.159 256 A CA 1.837 53.939 52.037 0.109 0.000 0.656 256 A CB -0.381 18.667 19.000 0.081 0.000 0.800 256 A HN -0.416 7.812 8.150 0.129 0.000 0.453 257 D N -3.395 117.039 120.400 0.058 0.000 2.340 257 D HA -0.042 4.618 4.640 0.033 0.000 0.220 257 D C -0.268 176.060 176.300 0.046 0.000 1.039 257 D CA 0.330 54.353 54.000 0.038 0.000 0.866 257 D CB 0.544 41.353 40.800 0.015 0.000 0.913 257 D HN -0.586 7.678 8.370 0.054 0.138 0.523 258 R N -0.211 120.332 120.500 0.072 0.000 2.294 258 R HA 0.132 4.503 4.340 0.051 0.000 0.319 258 R C -1.046 175.287 176.300 0.055 0.000 0.984 258 R CA -0.596 55.546 56.100 0.070 0.000 0.861 258 R CB 0.903 31.270 30.300 0.112 0.000 1.104 258 R HN -0.728 7.438 8.270 0.096 0.162 0.451 259 E N 5.061 125.281 120.200 0.032 0.000 2.259 259 E HA 0.167 4.533 4.350 0.026 0.000 0.281 259 E C -1.324 175.281 176.600 0.007 0.000 1.037 259 E CA -2.342 54.069 56.400 0.019 0.000 0.854 259 E CB 0.375 30.079 29.700 0.008 0.000 1.051 259 E HN 0.172 8.547 8.360 0.026 0.000 0.409 260 P HA 0.042 4.461 4.420 -0.001 0.000 0.269 260 P C -1.222 176.050 177.300 -0.045 0.000 1.215 260 P CA 0.102 63.198 63.100 -0.006 0.000 0.780 260 P CB 0.990 32.696 31.700 0.010 0.000 0.898 261 R N 2.421 122.859 120.500 -0.103 0.000 2.239 261 R HA 0.445 4.714 4.340 -0.118 0.000 0.332 261 R C -0.752 175.491 176.300 -0.095 0.000 0.988 261 R CA -2.223 53.780 56.100 -0.162 0.000 0.859 261 R CB -0.351 29.710 30.300 -0.400 0.000 1.148 261 R HN 0.179 8.745 8.270 -0.112 -0.363 0.482 262 P HA -0.229 4.194 4.420 0.004 0.000 0.221 262 P C 0.449 177.763 177.300 0.023 0.000 1.151 262 P CA 1.636 64.733 63.100 -0.005 0.000 0.843 262 P CB 0.164 31.861 31.700 -0.005 0.000 0.778 263 G N -5.305 103.514 108.800 0.033 0.000 2.920 263 G HA2 -0.072 3.954 3.960 0.111 0.000 0.208 263 G HA3 -0.072 3.935 3.960 0.078 0.000 0.208 263 G C -0.335 174.706 174.900 0.234 0.000 1.159 263 G CA -0.265 44.899 45.100 0.106 0.000 0.784 263 G HN -0.189 8.072 8.290 -0.006 0.025 0.535 264 H N -0.074 118.997 119.070 0.001 0.000 2.496 264 H HA 0.082 4.701 4.556 -0.001 -0.063 0.342 264 H C -0.609 174.715 175.328 -0.006 0.000 1.170 264 H CA -0.576 55.471 56.048 -0.001 0.000 1.274 264 H CB 2.193 31.956 29.762 0.001 0.000 1.538 264 H HN -0.406 7.941 8.280 0.206 0.056 0.542 265 R N -0.554 119.984 120.500 0.063 0.000 2.707 265 R HA -0.007 4.439 4.340 0.023 -0.092 0.270 265 R C -0.471 175.847 176.300 0.031 0.000 1.083 265 R CA 0.996 57.109 56.100 0.022 0.000 1.182 265 R CB 1.160 31.450 30.300 -0.017 0.000 1.084 265 R HN 0.254 8.524 8.270 0.001 0.000 0.528 266 R N -1.842 118.659 120.500 0.003 0.000 2.561 266 R HA 0.673 5.181 4.340 0.009 -0.163 0.297 266 R C -1.507 174.766 176.300 -0.045 0.000 0.969 266 R CA -1.156 54.940 56.100 -0.006 0.000 0.879 266 R CB 3.460 33.758 30.300 -0.004 0.000 1.178 266 R HN 0.201 8.466 8.270 -0.008 0.000 0.445 267 M N 6.017 125.582 119.600 -0.058 0.000 2.023 267 M HA 0.491 5.033 4.480 -0.155 -0.154 0.325 267 M C -2.477 173.750 176.300 -0.121 0.000 0.963 267 M CA -0.803 54.422 55.300 -0.125 0.000 0.928 267 M CB 2.486 35.015 32.600 -0.118 0.000 1.429 267 M HN 0.619 8.886 8.290 -0.039 0.000 0.404 268 V N 7.036 126.845 119.914 -0.175 0.000 2.427 268 V HA 0.615 4.961 4.120 0.027 -0.210 0.286 268 V C -1.469 174.488 176.094 -0.228 0.000 1.034 268 V CA -1.490 60.757 62.300 -0.088 0.000 0.893 268 V CB 1.438 33.224 31.823 -0.063 0.000 0.982 268 V HN 0.829 8.895 8.190 -0.207 0.000 0.452 269 F N 7.270 127.167 119.950 -0.089 0.000 2.411 269 F HA 0.416 4.948 4.527 -0.243 -0.151 0.352 269 F C -0.821 174.856 175.800 -0.206 0.000 1.123 269 F CA -0.793 57.090 58.000 -0.194 0.000 1.044 269 F CB 1.817 40.730 39.000 -0.145 0.000 1.135 269 F HN 0.256 8.755 8.300 0.333 0.000 0.461 270 R N 1.329 121.716 120.500 -0.189 0.000 2.439 270 R HA 0.361 4.720 4.340 0.031 0.000 0.310 270 R C -1.831 174.322 176.300 -0.244 0.000 0.955 270 R CA -1.821 54.218 56.100 -0.102 0.000 0.853 270 R CB 2.026 32.294 30.300 -0.053 0.000 1.171 270 R HN 0.478 8.583 8.270 -0.274 0.000 0.449 271 F N 1.140 121.169 119.950 0.130 0.000 2.461 271 F HA 0.376 5.102 4.527 0.117 -0.128 0.332 271 F C 0.894 176.736 175.800 0.069 0.000 1.073 271 F CA -1.179 56.887 58.000 0.110 0.000 1.017 271 F CB 2.682 41.751 39.000 0.114 0.000 1.301 271 F HN -0.018 8.801 8.300 0.326 -0.323 0.492 272 L N -2.733 118.652 121.223 0.270 0.000 3.678 272 L HA -0.343 4.278 4.340 0.128 -0.205 0.425 272 L C -1.047 175.881 176.870 0.097 0.000 1.240 272 L CA 0.843 55.772 54.840 0.149 0.000 0.876 272 L CB -2.655 39.481 42.059 0.127 0.000 1.766 272 L HN 0.272 8.693 8.230 0.318 0.000 0.917 273 T N 0.266 114.867 114.554 0.078 0.000 2.952 273 T HA 0.722 5.308 4.350 0.039 -0.212 0.305 273 T C -0.838 173.877 174.700 0.024 0.000 1.064 273 T CA -0.379 61.745 62.100 0.041 0.000 1.008 273 T CB 3.594 72.478 68.868 0.027 0.000 1.078 273 T HN -0.262 8.028 8.240 0.086 0.002 0.459 274 S N 4.036 119.746 115.700 0.016 0.000 2.536 274 S HA 0.515 4.988 4.470 0.006 0.000 0.298 274 S C -2.374 172.226 174.600 -0.001 0.000 1.083 274 S CA -3.044 55.161 58.200 0.008 0.000 0.995 274 S CB 1.889 65.095 63.200 0.010 0.000 1.058 274 S HN 0.529 8.849 8.310 0.017 0.000 0.488 275 P HA 0.155 4.691 4.420 -0.013 -0.123 0.282 275 P C -1.390 175.906 177.300 -0.008 0.000 1.262 275 P CA 0.111 63.205 63.100 -0.011 0.000 0.773 275 P CB 0.685 32.375 31.700 -0.017 0.000 0.879 276 I N 3.299 123.864 120.570 -0.007 0.000 2.810 276 I HA 0.191 4.359 4.170 -0.004 0.000 0.262 276 I C -0.422 175.690 176.117 -0.007 0.000 1.131 276 I CA 0.319 61.616 61.300 -0.005 0.000 1.453 276 I CB 1.040 39.038 38.000 -0.003 0.000 1.161 276 I HN 0.533 8.738 8.210 -0.009 0.000 0.444 277 E N -3.192 117.002 120.200 -0.010 0.000 2.375 277 E HA 0.234 4.711 4.350 -0.012 -0.134 0.280 277 E C -2.415 174.176 176.600 -0.015 0.000 0.972 277 E CA -1.175 55.218 56.400 -0.012 0.000 0.782 277 E CB 3.627 33.321 29.700 -0.010 0.000 1.229 277 E HN -0.929 7.424 8.360 -0.011 0.000 0.439 278 I N 3.846 124.405 120.570 -0.018 0.000 2.404 278 I HA 0.408 4.675 4.170 -0.023 -0.110 0.293 278 I C -1.093 175.013 176.117 -0.019 0.000 0.992 278 I CA -0.840 60.447 61.300 -0.022 0.000 1.149 278 I CB 2.135 40.120 38.000 -0.026 0.000 1.315 278 I HN 0.572 8.772 8.210 -0.017 0.000 0.446 279 K N 6.681 127.069 120.400 -0.020 0.000 2.328 279 K HA 0.420 4.731 4.320 -0.016 0.000 0.246 279 K C -1.570 175.019 176.600 -0.019 0.000 0.955 279 K CA -1.332 54.944 56.287 -0.017 0.000 0.817 279 K CB 3.757 36.248 32.500 -0.015 0.000 1.208 279 K HN 0.615 8.852 8.250 -0.021 0.000 0.432 280 G N -1.408 107.382 108.800 -0.017 0.000 2.376 280 G HA2 -0.068 4.125 3.960 -0.019 0.000 0.302 280 G HA3 -0.068 3.882 3.960 -0.016 0.000 0.302 280 G C -2.435 172.456 174.900 -0.015 0.000 1.586 280 G CA -0.007 45.083 45.100 -0.017 0.000 0.907 280 G HN -0.064 8.217 8.290 -0.015 0.000 0.655 281 K N 1.839 122.230 120.400 -0.014 0.000 2.268 281 K HA 0.113 4.426 4.320 -0.013 0.000 0.276 281 K C 0.445 177.037 176.600 -0.014 0.000 1.080 281 K CA -1.119 55.160 56.287 -0.013 0.000 0.910 281 K CB -0.089 32.404 32.500 -0.011 0.000 1.163 281 K HN -0.114 8.422 8.250 -0.014 -0.294 0.465 282 R N 1.940 122.431 120.500 -0.015 0.000 3.769 282 R HA -0.354 3.977 4.340 -0.016 0.000 0.443 282 R C -1.446 174.842 176.300 -0.020 0.000 0.647 282 R CA 1.944 58.034 56.100 -0.016 0.000 1.563 282 R CB -0.918 29.373 30.300 -0.015 0.000 2.174 282 R HN 0.774 9.036 8.270 -0.015 0.000 0.403 283 K N -6.368 114.019 120.400 -0.022 0.000 2.578 283 K HA 0.259 4.671 4.320 -0.029 -0.109 0.287 283 K C -2.161 174.422 176.600 -0.028 0.000 1.010 283 K CA -1.669 54.602 56.287 -0.027 0.000 0.889 283 K CB 3.346 35.830 32.500 -0.028 0.000 1.514 283 K HN -0.837 7.315 8.250 -0.020 0.087 0.424 284 V N 0.804 120.698 119.914 -0.033 0.000 2.599 284 V HA -0.274 3.827 4.120 -0.031 0.000 0.300 284 V C 0.304 176.379 176.094 -0.031 0.000 1.034 284 V CA 2.173 64.452 62.300 -0.034 0.000 1.115 284 V CB -0.912 30.885 31.823 -0.044 0.000 0.934 284 V HN 0.130 8.297 8.190 -0.038 0.000 0.485 285 E N 5.767 125.951 120.200 -0.027 0.000 2.467 285 E HA 0.317 4.688 4.350 -0.025 -0.036 0.213 285 E C -0.667 175.919 176.600 -0.024 0.000 0.823 285 E CA 0.363 56.749 56.400 -0.024 0.000 1.233 285 E CB 3.426 33.115 29.700 -0.019 0.000 1.233 285 E HN 0.591 8.935 8.360 -0.026 0.000 0.585 286 R N -3.879 116.606 120.500 -0.024 0.000 2.716 286 R HA 0.610 5.134 4.340 -0.025 -0.199 0.271 286 R C -3.038 173.247 176.300 -0.024 0.000 1.028 286 R CA -0.989 55.097 56.100 -0.023 0.000 0.883 286 R CB 3.984 34.274 30.300 -0.018 0.000 1.250 286 R HN -0.319 7.936 8.270 -0.024 0.000 0.465 287 I N 0.248 120.804 120.570 -0.024 0.000 2.545 287 I HA 0.598 4.884 4.170 -0.023 -0.130 0.292 287 I C -2.784 173.322 176.117 -0.019 0.000 1.040 287 I CA -2.462 58.823 61.300 -0.024 0.000 1.068 287 I CB 4.518 42.499 38.000 -0.031 0.000 1.251 287 I HN 0.511 8.707 8.210 -0.024 0.000 0.424 288 V N 7.863 127.768 119.914 -0.015 0.000 2.432 288 V HA 0.402 4.690 4.120 -0.010 -0.173 0.275 288 V C -1.229 174.859 176.094 -0.010 0.000 1.043 288 V CA -0.961 61.333 62.300 -0.011 0.000 0.925 288 V CB -0.074 31.744 31.823 -0.008 0.000 0.985 288 V HN 0.508 8.689 8.190 -0.016 0.000 0.466 289 L N 6.610 127.829 121.223 -0.007 0.000 2.334 289 L HA 0.783 5.292 4.340 -0.006 -0.173 0.276 289 L C -0.795 176.076 176.870 0.002 0.000 1.014 289 L CA -1.831 53.006 54.840 -0.004 0.000 0.815 289 L CB 2.716 44.772 42.059 -0.006 0.000 1.268 289 L HN 0.783 9.009 8.230 -0.006 0.000 0.428 290 G N -0.109 108.695 108.800 0.006 0.000 2.452 290 G HA2 0.613 4.578 3.960 0.010 0.000 0.324 290 G HA3 0.613 4.798 3.960 0.010 -0.219 0.324 290 G C -2.724 172.187 174.900 0.018 0.000 1.214 290 G CA -1.456 43.650 45.100 0.010 0.000 0.947 290 G HN 0.623 8.916 8.290 0.005 0.000 0.478 291 R N 2.217 122.730 120.500 0.021 0.000 2.357 291 R HA 0.485 5.007 4.340 0.036 -0.161 0.296 291 R C -1.069 175.249 176.300 0.030 0.000 1.052 291 R CA -0.778 55.340 56.100 0.030 0.000 0.988 291 R CB 1.781 32.100 30.300 0.031 0.000 1.025 291 R HN -0.337 7.944 8.270 0.019 0.000 0.469 292 N N 4.730 123.453 118.700 0.038 0.000 2.404 292 N HA 0.678 5.601 4.740 0.028 -0.166 0.297 292 N C -0.616 174.916 175.510 0.037 0.000 1.163 292 N CA -1.593 51.477 53.050 0.035 0.000 0.864 292 N CB 3.151 41.662 38.487 0.040 0.000 1.247 292 N HN 0.298 8.602 8.380 0.047 0.104 0.510 293 E N 0.101 120.318 120.200 0.029 0.000 2.263 293 E HA 0.344 4.712 4.350 0.030 0.000 0.264 293 E C -1.284 175.330 176.600 0.023 0.000 0.923 293 E CA -1.632 54.783 56.400 0.026 0.000 0.802 293 E CB 3.386 33.098 29.700 0.020 0.000 1.228 293 E HN 0.339 8.714 8.360 0.025 0.000 0.417 294 L N 1.374 122.609 121.223 0.020 0.000 2.292 294 L HA 0.592 5.136 4.340 0.016 -0.194 0.284 294 L C -0.083 176.793 176.870 0.010 0.000 1.065 294 L CA -0.922 53.926 54.840 0.015 0.000 0.806 294 L CB 0.964 43.030 42.059 0.011 0.000 1.175 294 L HN 0.231 8.473 8.230 0.019 0.000 0.431 295 V N 4.668 124.587 119.914 0.008 0.000 2.888 295 V HA 0.333 4.456 4.120 0.005 0.000 0.309 295 V C -2.016 174.080 176.094 0.003 0.000 1.114 295 V CA -2.541 59.762 62.300 0.005 0.000 0.940 295 V CB 4.811 36.638 31.823 0.006 0.000 1.021 295 V HN 0.639 8.834 8.190 0.008 0.000 0.426 296 S N 6.119 121.820 115.700 0.002 0.000 2.533 296 S HA 0.047 4.701 4.470 -0.000 -0.185 0.282 296 S C 0.297 174.897 174.600 0.000 0.000 1.304 296 S CA 0.293 58.494 58.200 0.000 0.000 1.063 296 S CB 0.489 63.688 63.200 -0.000 0.000 0.881 296 S HN 0.314 8.625 8.310 0.002 0.000 0.493 297 D N 6.218 126.618 120.400 -0.000 0.000 2.349 297 D HA 0.052 4.692 4.640 -0.000 0.000 0.214 297 D C 1.146 177.445 176.300 -0.001 0.000 1.063 297 D CA -0.656 53.343 54.000 -0.001 0.000 0.847 297 D CB -0.174 40.626 40.800 -0.001 0.000 0.933 297 D HN -0.037 8.333 8.370 -0.001 0.000 0.513 298 G N 0.425 109.224 108.800 -0.002 0.000 2.195 298 G HA2 -0.348 3.611 3.960 -0.002 0.000 0.246 298 G HA3 -0.348 3.611 3.960 -0.002 0.000 0.246 298 G C 0.719 175.618 174.900 -0.003 0.000 0.984 298 G CA 0.190 45.289 45.100 -0.002 0.000 0.633 298 G HN -0.369 7.875 8.290 -0.002 0.046 0.525 299 S N 0.927 116.625 115.700 -0.003 0.000 2.548 299 S HA 0.008 4.475 4.470 -0.004 0.000 0.215 299 S C 1.230 175.827 174.600 -0.004 0.000 0.976 299 S CA 0.249 58.446 58.200 -0.004 0.000 0.908 299 S CB 1.016 64.213 63.200 -0.005 0.000 0.781 299 S HN 0.026 8.633 8.310 -0.003 -0.299 0.519 300 G N 1.137 109.935 108.800 -0.004 0.000 2.154 300 G HA2 -0.326 3.632 3.960 -0.004 0.000 0.186 300 G HA3 -0.326 3.632 3.960 -0.003 0.000 0.186 300 G C -1.200 173.697 174.900 -0.004 0.000 1.000 300 G CA -0.387 44.711 45.100 -0.004 0.000 0.664 300 G HN 0.471 8.712 8.290 -0.003 0.047 0.513 301 R N -2.115 118.383 120.500 -0.004 0.000 2.831 301 R HA 0.473 4.810 4.340 -0.005 0.000 0.266 301 R C -2.278 174.020 176.300 -0.003 0.000 1.051 301 R CA -1.569 54.529 56.100 -0.004 0.000 0.943 301 R CB 2.055 32.352 30.300 -0.005 0.000 1.228 301 R HN -0.466 7.802 8.270 -0.004 0.000 0.467 302 V N -3.182 116.731 119.914 -0.002 0.000 2.630 302 V HA 0.838 5.107 4.120 0.000 -0.149 0.305 302 V C -1.979 174.116 176.094 0.002 0.000 1.046 302 V CA -2.513 59.787 62.300 0.000 0.000 0.934 302 V CB 2.630 34.453 31.823 0.000 0.000 1.003 302 V HN 0.134 8.322 8.190 -0.003 0.000 0.451 303 A N 3.579 126.402 122.820 0.004 0.000 2.354 303 A HA 0.389 4.713 4.320 0.007 0.000 0.321 303 A C -2.581 175.010 177.584 0.012 0.000 1.125 303 A CA -1.644 50.397 52.037 0.007 0.000 0.799 303 A CB 3.254 22.257 19.000 0.004 0.000 1.293 303 A HN 0.733 8.886 8.150 0.004 0.000 0.452 304 A N 0.014 122.843 122.820 0.015 0.000 2.366 304 A HA 0.459 4.955 4.320 0.024 -0.162 0.272 304 A C -0.511 177.083 177.584 0.016 0.000 1.135 304 A CA -0.595 51.454 52.037 0.021 0.000 0.804 304 A CB 0.732 19.748 19.000 0.027 0.000 1.064 304 A HN 0.202 8.361 8.150 0.014 0.000 0.499 305 K N 4.603 125.013 120.400 0.017 0.000 2.426 305 K HA 0.277 4.604 4.320 0.011 0.000 0.254 305 K C -1.400 175.209 176.600 0.015 0.000 0.936 305 K CA -1.315 54.980 56.287 0.013 0.000 0.801 305 K CB 3.314 35.821 32.500 0.011 0.000 1.139 305 K HN 0.377 8.638 8.250 0.019 0.000 0.424 306 D N 6.697 127.104 120.400 0.013 0.000 2.458 306 D HA -0.095 4.705 4.640 0.016 -0.151 0.243 306 D C 1.092 177.399 176.300 0.013 0.000 1.146 306 D CA 0.674 54.682 54.000 0.013 0.000 0.877 306 D CB 0.300 41.106 40.800 0.010 0.000 1.176 306 D HN 0.336 8.713 8.370 0.011 0.000 0.461 307 T N 4.667 119.230 114.554 0.014 0.000 3.081 307 T HA 0.070 4.427 4.350 0.012 0.000 0.255 307 T C 1.254 175.961 174.700 0.011 0.000 1.113 307 T CA -0.197 61.910 62.100 0.013 0.000 1.082 307 T CB 1.355 70.233 68.868 0.016 0.000 0.939 307 T HN 0.192 8.442 8.240 0.016 0.000 0.506 308 G N 1.891 110.697 108.800 0.010 0.000 2.217 308 G HA2 -0.399 3.565 3.960 0.007 0.000 0.246 308 G HA3 -0.399 3.565 3.960 0.007 0.000 0.246 308 G C -0.506 174.399 174.900 0.008 0.000 0.990 308 G CA -0.192 44.912 45.100 0.008 0.000 0.627 308 G HN -0.301 8.284 8.290 0.011 -0.289 0.522 309 E N 1.014 121.220 120.200 0.010 0.000 2.373 309 E HA -0.028 4.327 4.350 0.009 0.000 0.267 309 E C -1.005 175.601 176.600 0.010 0.000 1.032 309 E CA 0.567 56.973 56.400 0.010 0.000 0.889 309 E CB 0.743 30.451 29.700 0.013 0.000 0.984 309 E HN -0.560 7.740 8.360 0.012 0.067 0.425 310 R N 0.782 121.286 120.500 0.008 0.000 2.795 310 R HA 0.889 5.441 4.340 0.006 -0.208 0.275 310 R C -0.490 175.813 176.300 0.005 0.000 0.981 310 R CA -1.818 54.285 56.100 0.005 0.000 0.917 310 R CB 3.212 33.513 30.300 0.003 0.000 1.202 310 R HN 0.282 8.556 8.270 0.007 0.000 0.469 311 E N 0.884 121.086 120.200 0.003 0.000 2.390 311 E HA 0.357 4.708 4.350 0.002 0.000 0.277 311 E C -2.606 173.992 176.600 -0.003 0.000 0.939 311 E CA -1.362 55.039 56.400 0.002 0.000 0.769 311 E CB 3.819 33.522 29.700 0.004 0.000 1.251 311 E HN 0.455 8.816 8.360 0.002 0.000 0.450 312 E N 3.397 123.595 120.200 -0.004 0.000 2.187 312 E HA 0.658 5.182 4.350 -0.009 -0.180 0.268 312 E C -1.458 175.136 176.600 -0.010 0.000 0.896 312 E CA -1.504 54.892 56.400 -0.008 0.000 0.766 312 E CB 2.428 32.123 29.700 -0.007 0.000 1.142 312 E HN 0.231 8.589 8.360 -0.003 0.000 0.408 313 L N 6.746 127.961 121.223 -0.014 0.000 2.349 313 L HA 0.652 4.983 4.340 -0.015 0.000 0.278 313 L C -2.944 173.914 176.870 -0.021 0.000 0.996 313 L CA -3.511 51.318 54.840 -0.017 0.000 0.825 313 L CB 2.996 45.042 42.059 -0.022 0.000 1.243 313 L HN 0.484 8.704 8.230 -0.016 0.000 0.412 314 P HA 0.143 4.689 4.420 -0.020 -0.139 0.268 314 P C -1.665 175.618 177.300 -0.028 0.000 1.204 314 P CA 0.001 63.089 63.100 -0.021 0.000 0.768 314 P CB 0.197 31.887 31.700 -0.017 0.000 0.842 315 A N 1.189 123.990 122.820 -0.031 0.000 2.594 315 A HA 0.297 4.593 4.320 -0.041 0.000 0.296 315 A C -2.322 175.238 177.584 -0.041 0.000 1.061 315 A CA -0.211 51.802 52.037 -0.040 0.000 0.689 315 A CB 3.463 22.435 19.000 -0.047 0.000 1.280 315 A HN -0.094 7.925 8.150 -0.029 0.114 0.406 316 Q N -1.823 117.948 119.800 -0.047 0.000 2.214 316 Q HA 0.300 4.786 4.340 -0.043 -0.172 0.229 316 Q C -0.637 175.326 176.000 -0.062 0.000 0.835 316 Q CA -0.315 55.459 55.803 -0.047 0.000 0.953 316 Q CB 2.336 31.052 28.738 -0.038 0.000 1.131 316 Q HN 0.120 8.359 8.270 -0.051 0.000 0.501 317 L N -1.169 120.007 121.223 -0.079 0.000 2.493 317 L HA 0.562 5.022 4.340 -0.103 -0.181 0.265 317 L C -2.900 173.902 176.870 -0.113 0.000 0.954 317 L CA -0.182 54.593 54.840 -0.108 0.000 0.844 317 L CB 3.956 45.931 42.059 -0.139 0.000 1.302 317 L HN -0.858 7.326 8.230 -0.077 0.000 0.405 318 V N 6.414 126.262 119.914 -0.110 0.000 2.444 318 V HA 0.701 4.972 4.120 -0.105 -0.214 0.294 318 V C -1.934 174.090 176.094 -0.117 0.000 1.022 318 V CA -1.707 60.532 62.300 -0.102 0.000 0.850 318 V CB 2.808 34.588 31.823 -0.072 0.000 0.992 318 V HN 0.832 8.959 8.190 -0.106 0.000 0.426 319 V N 7.995 127.830 119.914 -0.131 0.000 2.357 319 V HA 0.501 4.767 4.120 -0.111 -0.213 0.284 319 V C -0.976 175.081 176.094 -0.062 0.000 1.018 319 V CA -2.006 60.221 62.300 -0.121 0.000 0.841 319 V CB 1.011 32.717 31.823 -0.195 0.000 0.991 319 V HN 0.743 8.854 8.190 -0.131 0.000 0.437 320 R N 6.652 127.128 120.500 -0.039 0.000 2.234 320 R HA 0.186 4.516 4.340 -0.016 0.000 0.324 320 R C -1.232 175.075 176.300 0.010 0.000 1.054 320 R CA -0.745 55.346 56.100 -0.016 0.000 0.912 320 R CB 0.058 30.348 30.300 -0.017 0.000 1.030 320 R HN 0.549 8.793 8.270 -0.043 0.000 0.455 321 S N 5.424 121.146 115.700 0.036 0.000 2.257 321 S HA 0.250 4.777 4.470 0.096 0.000 0.191 321 S C -0.861 173.786 174.600 0.079 0.000 1.386 321 S CA -2.289 55.962 58.200 0.086 0.000 1.233 321 S CB -0.426 62.850 63.200 0.126 0.000 1.138 321 S HN 0.635 8.962 8.310 0.028 0.000 0.483 322 V N -0.567 119.380 119.914 0.056 0.000 3.043 322 V HA 0.296 4.439 4.120 0.038 0.000 0.357 322 V C -1.233 174.891 176.094 0.050 0.000 1.372 322 V CA -2.190 60.134 62.300 0.040 0.000 1.214 322 V CB -0.258 31.575 31.823 0.018 0.000 1.224 322 V HN -0.351 7.865 8.190 0.044 0.000 0.507 323 G N -1.381 107.480 108.800 0.102 0.000 2.640 323 G HA2 -0.303 3.702 3.960 0.075 0.000 0.686 323 G HA3 -0.303 3.761 3.960 0.173 0.000 0.686 323 G C -1.442 173.574 174.900 0.193 0.000 1.229 323 G CA -0.904 44.278 45.100 0.137 0.000 0.796 323 G HN -0.673 7.629 8.290 0.133 0.068 0.654 324 Y N 0.968 121.293 120.300 0.042 0.000 2.260 324 Y HA 0.178 4.891 4.550 0.106 -0.099 0.339 324 Y C 0.417 176.358 175.900 0.068 0.000 1.317 324 Y CA 0.593 58.753 58.100 0.099 0.000 1.514 324 Y CB 1.568 40.162 38.460 0.224 0.000 1.382 324 Y HN 0.290 8.866 8.280 0.492 0.000 0.581 325 R N -1.678 118.966 120.500 0.240 0.000 2.561 325 R HA 0.272 4.706 4.340 0.157 0.000 0.266 325 R C -1.741 174.706 176.300 0.245 0.000 1.091 325 R CA -0.942 55.269 56.100 0.184 0.000 0.927 325 R CB 4.240 34.615 30.300 0.125 0.000 1.240 325 R HN 0.254 8.619 8.270 0.270 0.068 0.449 326 G N 2.891 111.858 108.800 0.278 0.000 2.594 326 G HA2 0.008 4.415 3.960 0.420 0.000 0.243 326 G HA3 0.008 4.163 3.960 0.326 0.000 0.243 326 G C -1.494 173.643 174.900 0.395 0.000 1.229 326 G CA -0.416 44.904 45.100 0.365 0.000 0.843 326 G HN -0.056 8.375 8.290 0.236 0.000 0.578 327 V N -5.208 114.836 119.914 0.217 0.000 2.769 327 V HA 0.514 4.550 4.120 -0.141 0.000 0.312 327 V C -2.209 173.573 176.094 -0.519 0.000 1.061 327 V CA -4.296 57.940 62.300 -0.107 0.000 0.931 327 V CB 1.281 33.080 31.823 -0.040 0.000 1.010 327 V HN -0.072 8.248 8.190 0.217 0.000 0.433 328 P HA 0.230 3.899 4.420 -1.252 0.000 0.271 328 P C -1.091 175.985 177.300 -0.373 0.000 1.218 328 P CA -0.513 61.981 63.100 -1.010 0.000 0.780 328 P CB 0.730 31.920 31.700 -0.850 0.000 0.901 329 T N 4.487 118.905 114.554 -0.226 0.000 2.767 329 T HA 0.414 4.706 4.350 -0.097 0.000 0.284 329 T C -2.011 172.619 174.700 -0.116 0.000 0.973 329 T CA -1.442 60.584 62.100 -0.123 0.000 0.996 329 T CB 0.519 69.324 68.868 -0.105 0.000 0.927 329 T HN -0.042 8.075 8.240 -0.204 0.000 0.456 330 P HA -0.180 4.200 4.420 -0.067 0.000 0.262 330 P C 0.047 177.318 177.300 -0.049 0.000 1.182 330 P CA 0.839 63.902 63.100 -0.061 0.000 0.761 330 P CB 0.195 31.870 31.700 -0.042 0.000 0.795 331 G N 2.279 111.053 108.800 -0.043 0.000 2.175 331 G HA2 -0.275 3.674 3.960 -0.020 0.000 0.244 331 G HA3 -0.275 3.673 3.960 -0.021 0.000 0.244 331 G C -0.625 174.241 174.900 -0.057 0.000 0.982 331 G CA 0.202 45.282 45.100 -0.033 0.000 0.641 331 G HN 0.008 8.273 8.290 -0.042 0.000 0.527 332 L N -0.001 121.170 121.223 -0.086 0.000 2.341 332 L HA 0.484 4.767 4.340 -0.095 0.000 0.267 332 L C -2.324 174.530 176.870 -0.026 0.000 1.009 332 L CA -3.187 51.592 54.840 -0.102 0.000 0.819 332 L CB 1.557 43.484 42.059 -0.220 0.000 1.323 332 L HN -0.596 7.525 8.230 -0.088 0.056 0.425 333 P HA 0.036 4.494 4.420 0.063 0.000 0.274 333 P C -2.102 175.299 177.300 0.169 0.000 1.246 333 P CA -0.521 62.614 63.100 0.058 0.000 0.795 333 P CB 0.804 32.517 31.700 0.022 0.000 1.006 334 F N -1.781 118.152 119.950 -0.029 0.000 2.665 334 F HA 0.035 4.664 4.527 -0.015 -0.111 0.308 334 F C -2.164 173.632 175.800 -0.008 0.000 1.112 334 F CA -0.704 57.286 58.000 -0.016 0.000 0.972 334 F CB 4.404 43.396 39.000 -0.013 0.000 1.295 334 F HN -0.265 8.145 8.300 0.183 0.000 0.440 335 D N 5.771 125.824 120.400 -0.578 0.000 2.427 335 D HA 0.261 4.778 4.640 -0.205 0.000 0.226 335 D C -0.646 175.308 176.300 -0.577 0.000 1.076 335 D CA -1.951 51.797 54.000 -0.420 0.000 0.849 335 D CB 1.355 41.961 40.800 -0.322 0.000 1.052 335 D HN 0.324 8.153 8.370 -0.900 0.000 0.515 336 D N 6.318 126.608 120.400 -0.184 0.000 2.182 336 D HA -0.302 4.417 4.640 0.131 0.000 0.201 336 D C 1.944 178.209 176.300 -0.059 0.000 0.986 336 D CA 3.410 57.407 54.000 -0.004 0.000 0.847 336 D CB 0.075 40.936 40.800 0.101 0.000 0.942 336 D HN 0.490 8.825 8.370 -0.059 0.000 0.467 337 Q N -1.926 117.822 119.800 -0.088 0.000 2.020 337 Q HA -0.211 4.110 4.340 -0.032 0.000 0.202 337 Q C 1.698 177.649 176.000 -0.082 0.000 0.982 337 Q CA 2.614 58.379 55.803 -0.063 0.000 0.838 337 Q CB -0.024 28.680 28.738 -0.057 0.000 0.899 337 Q HN -0.211 8.198 8.270 -0.098 -0.198 0.423 338 S N -5.027 110.587 115.700 -0.143 0.000 2.517 338 S HA -0.002 4.415 4.470 -0.088 0.000 0.214 338 S C 1.204 175.712 174.600 -0.153 0.000 0.991 338 S CA -0.030 58.092 58.200 -0.130 0.000 0.906 338 S CB 1.197 64.318 63.200 -0.132 0.000 0.789 338 S HN -0.571 8.038 8.310 -0.186 -0.411 0.513 339 G N 2.782 111.414 108.800 -0.280 0.000 2.273 339 G HA2 -0.398 3.572 3.960 0.017 0.000 0.280 339 G HA3 -0.398 3.296 3.960 -0.443 0.000 0.280 339 G C -1.429 173.325 174.900 -0.243 0.000 1.047 339 G CA 0.829 45.778 45.100 -0.252 0.000 0.869 339 G HN 0.082 8.156 8.290 -0.360 0.000 0.502 340 T N -4.594 109.693 114.554 -0.445 0.000 2.930 340 T HA 0.579 5.014 4.350 -0.031 -0.104 0.290 340 T C -1.681 172.867 174.700 -0.253 0.000 1.052 340 T CA -2.930 59.054 62.100 -0.193 0.000 1.017 340 T CB 3.026 71.835 68.868 -0.099 0.000 1.137 340 T HN -0.884 7.011 8.240 -0.575 0.000 0.511 341 I N 1.197 121.756 120.570 -0.018 0.000 2.342 341 I HA 0.343 4.533 4.170 0.033 0.000 0.291 341 I C -1.452 174.657 176.117 -0.013 0.000 1.010 341 I CA -2.415 58.901 61.300 0.027 0.000 1.308 341 I CB 1.115 39.167 38.000 0.088 0.000 1.400 341 I HN -0.227 8.010 8.210 0.045 0.000 0.488 342 P HA 0.031 4.429 4.420 -0.037 0.000 0.268 342 P C -1.836 175.457 177.300 -0.011 0.000 1.204 342 P CA -0.052 63.031 63.100 -0.028 0.000 0.768 342 P CB 0.396 32.078 31.700 -0.030 0.000 0.842 343 N N -0.036 118.661 118.700 -0.004 0.000 2.708 343 N HA 0.378 5.318 4.740 -0.011 -0.206 0.257 343 N C -1.582 173.933 175.510 0.008 0.000 1.373 343 N CA -0.718 52.335 53.050 0.004 0.000 0.843 343 N CB 4.042 42.548 38.487 0.032 0.000 1.503 343 N HN -0.118 8.258 8.380 -0.006 0.000 0.504 344 V N 0.223 120.144 119.914 0.011 0.000 2.349 344 V HA 0.161 4.292 4.120 0.019 0.000 0.284 344 V C 0.902 177.022 176.094 0.045 0.000 1.014 344 V CA -1.106 61.206 62.300 0.019 0.000 0.826 344 V CB 0.082 31.910 31.823 0.009 0.000 1.009 344 V HN 0.814 9.005 8.190 0.003 0.000 0.431 345 G N 8.180 117.012 108.800 0.053 0.000 2.225 345 G HA2 -0.436 3.570 3.960 0.075 0.000 0.267 345 G HA3 -0.436 3.564 3.960 0.066 0.000 0.267 345 G C 0.332 175.303 174.900 0.118 0.000 1.024 345 G CA 0.725 45.870 45.100 0.075 0.000 0.784 345 G HN 0.783 9.100 8.290 0.044 0.000 0.507 346 G N -4.401 104.471 108.800 0.119 0.000 2.217 346 G HA2 -0.548 3.539 3.960 0.211 0.000 0.246 346 G HA3 -0.548 3.558 3.960 0.154 -0.053 0.246 346 G C -1.406 173.628 174.900 0.223 0.000 0.990 346 G CA -0.308 44.900 45.100 0.180 0.000 0.627 346 G HN -0.083 8.516 8.290 0.091 -0.254 0.522 347 R N 1.940 122.508 120.500 0.114 0.000 2.265 347 R HA 0.221 4.378 4.340 -0.492 -0.113 0.314 347 R C -0.322 175.890 176.300 -0.147 0.000 1.053 347 R CA -1.076 54.908 56.100 -0.194 0.000 0.931 347 R CB 1.092 31.267 30.300 -0.208 0.000 1.024 347 R HN -0.592 7.681 8.270 0.110 0.064 0.457 348 I N 6.945 127.402 120.570 -0.188 0.000 2.775 348 I HA -0.320 3.972 4.170 -0.048 -0.151 0.290 348 I C -0.006 176.058 176.117 -0.087 0.000 1.203 348 I CA 1.233 62.477 61.300 -0.094 0.000 1.433 348 I CB -0.076 37.876 38.000 -0.080 0.000 1.354 348 I HN 0.427 8.359 8.210 -0.282 0.108 0.579 349 N N 8.350 127.020 118.700 -0.049 0.000 2.357 349 N HA -0.385 4.333 4.740 -0.038 0.000 0.257 349 N C 0.898 176.383 175.510 -0.041 0.000 1.250 349 N CA 2.344 55.370 53.050 -0.039 0.000 0.862 349 N CB 0.469 38.942 38.487 -0.024 0.000 1.066 349 N HN -0.240 8.118 8.380 -0.036 0.000 0.468 350 G N 2.834 111.611 108.800 -0.038 0.000 2.184 350 G HA2 -0.263 3.681 3.960 -0.026 0.000 0.264 350 G HA3 -0.263 3.681 3.960 -0.026 0.000 0.264 350 G C -1.265 173.611 174.900 -0.040 0.000 0.975 350 G CA -0.013 45.067 45.100 -0.032 0.000 0.642 350 G HN 0.347 8.615 8.290 -0.037 0.000 0.536 351 S N 0.343 116.004 115.700 -0.066 0.000 2.472 351 S HA 0.535 4.977 4.470 -0.047 0.000 0.303 351 S C -1.328 173.213 174.600 -0.098 0.000 1.099 351 S CA -3.649 54.506 58.200 -0.075 0.000 1.077 351 S CB 1.192 64.332 63.200 -0.099 0.000 1.031 351 S HN -0.530 7.681 8.310 -0.081 0.050 0.487 352 P HA 0.133 4.528 4.420 -0.042 0.000 0.245 352 P C -0.513 176.768 177.300 -0.032 0.000 1.203 352 P CA 0.786 63.862 63.100 -0.039 0.000 0.792 352 P CB 0.344 32.044 31.700 -0.001 0.000 0.997 353 N N -4.937 113.732 118.700 -0.051 0.000 2.162 353 N HA 0.097 4.958 4.740 0.202 0.000 0.232 353 N C -2.045 173.517 175.510 0.086 0.000 1.361 353 N CA -0.596 52.506 53.050 0.088 0.000 0.786 353 N CB 1.441 40.018 38.487 0.150 0.000 1.290 353 N HN -0.435 7.866 8.380 -0.070 0.037 0.505 354 E N -0.296 119.795 120.200 -0.182 0.000 2.238 354 E HA 0.861 5.553 4.350 0.215 -0.213 0.267 354 E C -1.545 174.850 176.600 -0.341 0.000 0.887 354 E CA -1.230 55.162 56.400 -0.014 0.000 0.769 354 E CB 3.856 33.623 29.700 0.112 0.000 1.187 354 E HN -0.699 7.484 8.360 -0.295 0.000 0.416 355 Y N 0.337 120.746 120.300 0.182 0.000 2.634 355 Y HA 0.862 5.624 4.550 0.117 -0.142 0.340 355 Y C -1.282 174.734 175.900 0.193 0.000 1.058 355 Y CA -1.633 56.551 58.100 0.141 0.000 1.081 355 Y CB 4.603 43.116 38.460 0.088 0.000 1.295 355 Y HN 0.707 9.234 8.280 0.412 0.000 0.487 356 V N -4.426 115.673 119.914 0.307 0.000 2.789 356 V HA 1.012 5.520 4.120 0.284 -0.218 0.311 356 V C -1.743 174.478 176.094 0.211 0.000 1.073 356 V CA -2.536 59.916 62.300 0.253 0.000 0.921 356 V CB 3.387 35.329 31.823 0.199 0.000 1.009 356 V HN 0.516 8.885 8.190 0.298 0.000 0.426 357 V N -4.291 115.738 119.914 0.191 0.000 3.130 357 V HA 0.694 4.915 4.120 0.168 0.000 0.310 357 V C 0.103 176.310 176.094 0.189 0.000 1.158 357 V CA -3.292 59.110 62.300 0.171 0.000 1.029 357 V CB 3.022 34.931 31.823 0.143 0.000 1.057 357 V HN 0.026 8.334 8.190 0.196 0.000 0.436 358 G N -0.099 108.827 108.800 0.210 0.000 2.598 358 G HA2 -0.324 3.762 3.960 0.210 0.000 0.244 358 G HA3 -0.324 3.995 3.960 0.281 -0.190 0.244 358 G C 0.406 175.536 174.900 0.383 0.000 1.302 358 G CA 0.382 45.640 45.100 0.264 0.000 0.903 358 G HN -0.290 8.123 8.290 0.204 0.000 0.575 359 W N 0.141 121.504 121.300 0.106 0.000 2.364 359 W HA -0.075 4.800 4.660 0.088 -0.162 0.281 359 W C 2.190 178.775 176.519 0.109 0.000 1.219 359 W CA 2.033 59.438 57.345 0.099 0.000 1.220 359 W CB -0.352 29.166 29.460 0.096 0.000 1.127 359 W HN 0.366 8.841 8.180 0.491 0.000 0.556 360 I N -1.073 119.698 120.570 0.335 0.000 2.614 360 I HA -0.376 3.944 4.170 0.250 0.000 0.258 360 I C 0.587 176.811 176.117 0.177 0.000 1.189 360 I CA 0.960 62.410 61.300 0.250 0.000 1.462 360 I CB -0.083 38.070 38.000 0.255 0.000 1.092 360 I HN -0.077 8.318 8.210 0.333 0.015 0.442 361 K N -0.574 119.932 120.400 0.177 0.000 2.121 361 K HA -0.063 4.319 4.320 0.103 0.000 0.203 361 K C 1.647 178.300 176.600 0.089 0.000 1.041 361 K CA 2.232 58.594 56.287 0.126 0.000 0.969 361 K CB 0.422 33.008 32.500 0.144 0.000 0.799 361 K HN -0.464 7.789 8.250 0.211 0.124 0.456 362 R N -3.851 116.716 120.500 0.111 0.000 2.280 362 R HA -0.024 4.344 4.340 0.047 0.000 0.195 362 R C 0.438 176.723 176.300 -0.024 0.000 0.935 362 R CA 0.355 56.491 56.100 0.061 0.000 1.033 362 R CB 0.985 31.353 30.300 0.113 0.000 0.964 362 R HN -0.365 8.004 8.270 0.165 0.000 0.489 363 G N -0.599 108.176 108.800 -0.041 0.000 2.746 363 G HA2 -0.224 3.640 3.960 -0.160 0.000 0.685 363 G HA3 -0.224 3.672 3.960 -0.107 0.000 0.685 363 G C -2.479 172.132 174.900 -0.481 0.000 1.350 363 G CA -0.830 44.173 45.100 -0.161 0.000 0.837 363 G HN -0.535 7.723 8.290 0.024 0.046 0.564 364 P HA 0.146 3.100 4.420 -2.443 0.000 0.212 364 P C -1.772 174.534 177.300 -1.656 0.000 1.816 364 P CA -0.648 61.529 63.100 -1.539 0.000 0.944 364 P CB -1.088 30.215 31.700 -0.662 0.000 1.896 365 T N -2.461 111.326 114.554 -1.277 0.000 2.903 365 T HA 0.084 4.172 4.350 -0.438 0.000 0.299 365 T C -1.554 173.136 174.700 -0.016 0.000 1.093 365 T CA -1.221 60.583 62.100 -0.493 0.000 1.002 365 T CB 2.923 71.650 68.868 -0.237 0.000 1.127 365 T HN -0.305 7.164 8.240 -1.187 0.059 0.488 366 G N 1.354 110.284 108.800 0.215 0.000 2.640 366 G HA2 -0.190 3.950 3.960 0.299 0.000 0.686 366 G HA3 -0.190 3.887 3.960 0.193 0.000 0.686 366 G C -1.035 174.091 174.900 0.376 0.000 1.229 366 G CA -0.767 44.508 45.100 0.291 0.000 0.796 366 G HN -0.233 8.162 8.290 0.175 0.000 0.654 367 V N -0.430 119.622 119.914 0.229 0.000 3.376 367 V HA -0.033 4.191 4.120 0.174 0.000 0.303 367 V C 1.020 177.217 176.094 0.173 0.000 1.100 367 V CA -0.238 62.166 62.300 0.174 0.000 1.126 367 V CB 1.209 33.099 31.823 0.112 0.000 1.085 367 V HN 0.188 8.487 8.190 0.183 0.000 0.480 368 I N 2.434 123.080 120.570 0.126 0.000 2.145 368 I HA -0.428 3.812 4.170 0.117 0.000 0.244 368 I C 1.820 178.110 176.117 0.287 0.000 1.075 368 I CA 3.581 64.977 61.300 0.161 0.000 1.332 368 I CB -0.820 37.257 38.000 0.127 0.000 1.033 368 I HN 0.344 8.612 8.210 0.097 0.000 0.410 369 G N -3.705 105.218 108.800 0.205 0.000 2.509 369 G HA2 -0.114 3.889 3.960 0.072 0.000 0.218 369 G HA3 -0.114 3.941 3.960 0.158 0.000 0.218 369 G C 1.352 176.288 174.900 0.061 0.000 1.124 369 G CA 1.979 47.157 45.100 0.130 0.000 0.776 369 G HN 0.280 8.660 8.290 0.151 0.000 0.547 370 T N -0.215 114.415 114.554 0.126 0.000 3.051 370 T HA -0.280 4.110 4.350 0.066 0.000 0.269 370 T C 1.346 176.128 174.700 0.137 0.000 1.127 370 T CA 3.338 65.508 62.100 0.116 0.000 1.107 370 T CB -0.640 68.323 68.868 0.159 0.000 0.898 370 T HN -0.362 7.937 8.240 0.158 0.036 0.517 371 N N 1.155 119.979 118.700 0.207 0.000 2.463 371 N HA -0.035 4.848 4.740 0.237 0.000 0.181 371 N C 0.913 176.518 175.510 0.158 0.000 1.078 371 N CA 2.326 55.534 53.050 0.264 0.000 0.902 371 N CB 0.122 38.843 38.487 0.391 0.000 0.970 371 N HN -0.548 7.942 8.380 0.261 0.046 0.451 372 K N 1.241 121.523 120.400 -0.196 0.000 2.007 372 K HA -0.335 3.613 4.320 -0.621 0.000 0.206 372 K C 1.539 178.023 176.600 -0.194 0.000 1.047 372 K CA 4.085 60.037 56.287 -0.559 0.000 0.937 372 K CB -0.075 31.795 32.500 -1.050 0.000 0.718 372 K HN -0.486 7.586 8.250 -0.221 0.045 0.438 373 K N -2.017 118.309 120.400 -0.123 0.000 2.057 373 K HA -0.287 3.996 4.320 -0.062 0.000 0.207 373 K C 1.646 178.246 176.600 -0.000 0.000 1.049 373 K CA 3.073 59.328 56.287 -0.053 0.000 0.931 373 K CB -0.559 31.920 32.500 -0.035 0.000 0.714 373 K HN 0.073 8.247 8.250 -0.126 0.000 0.440 374 D N -2.104 118.315 120.400 0.031 0.000 2.144 374 D HA -0.252 4.420 4.640 0.053 0.000 0.199 374 D C 1.518 177.864 176.300 0.076 0.000 0.984 374 D CA 3.409 57.447 54.000 0.063 0.000 0.834 374 D CB -0.072 40.781 40.800 0.090 0.000 0.955 374 D HN -0.068 8.322 8.370 0.033 0.000 0.465 375 A N -0.717 122.159 122.820 0.093 0.000 1.902 375 A HA -0.394 3.991 4.320 0.108 0.000 0.217 375 A C 1.816 179.438 177.584 0.063 0.000 1.181 375 A CA 3.189 55.290 52.037 0.106 0.000 0.623 375 A CB -0.638 18.469 19.000 0.179 0.000 0.818 375 A HN -0.650 7.559 8.150 0.098 0.000 0.443 376 Q N -0.724 119.099 119.800 0.039 0.000 2.096 376 Q HA -0.336 4.019 4.340 0.025 0.000 0.204 376 Q C 2.138 178.146 176.000 0.014 0.000 0.982 376 Q CA 2.849 58.664 55.803 0.020 0.000 0.850 376 Q CB -0.340 28.397 28.738 -0.000 0.000 0.901 376 Q HN -0.223 8.063 8.270 0.026 0.000 0.422 377 D N -1.796 118.616 120.400 0.021 0.000 2.117 377 D HA -0.197 4.452 4.640 0.016 0.000 0.198 377 D C 2.423 178.737 176.300 0.024 0.000 0.982 377 D CA 3.119 57.132 54.000 0.022 0.000 0.828 377 D CB -0.491 40.328 40.800 0.031 0.000 0.967 377 D HN -0.226 8.159 8.370 0.025 0.000 0.464 378 T N 3.142 117.717 114.554 0.036 0.000 2.777 378 T HA -0.253 4.137 4.350 0.066 0.000 0.266 378 T C 1.853 176.506 174.700 -0.079 0.000 1.040 378 T CA 4.688 66.808 62.100 0.034 0.000 1.141 378 T CB -0.059 68.861 68.868 0.085 0.000 0.868 378 T HN -0.535 7.733 8.240 0.047 0.000 0.444 379 V N 2.125 121.995 119.914 -0.072 0.000 2.343 379 V HA -0.498 3.498 4.120 -0.206 0.000 0.247 379 V C 1.697 177.726 176.094 -0.108 0.000 1.051 379 V CA 4.724 66.952 62.300 -0.120 0.000 1.036 379 V CB -0.823 30.969 31.823 -0.051 0.000 0.654 379 V HN -0.020 8.153 8.190 -0.028 0.000 0.451 380 D N -0.316 120.054 120.400 -0.051 0.000 2.104 380 D HA -0.271 4.351 4.640 -0.030 0.000 0.194 380 D C 2.758 179.033 176.300 -0.041 0.000 0.994 380 D CA 3.730 57.711 54.000 -0.033 0.000 0.830 380 D CB -0.636 40.160 40.800 -0.007 0.000 0.959 380 D HN -0.051 8.301 8.370 -0.031 0.000 0.452 381 T N 2.409 116.943 114.554 -0.033 0.000 2.708 381 T HA -0.335 4.029 4.350 0.024 0.000 0.266 381 T C 2.019 176.689 174.700 -0.050 0.000 1.037 381 T CA 4.535 66.638 62.100 0.005 0.000 1.146 381 T CB -0.101 68.815 68.868 0.080 0.000 0.865 381 T HN -0.616 7.609 8.240 -0.025 0.000 0.435 382 L N 2.359 123.409 121.223 -0.289 0.000 2.013 382 L HA -0.319 3.720 4.340 -0.502 0.000 0.212 382 L C 1.788 178.518 176.870 -0.233 0.000 1.073 382 L CA 3.092 57.620 54.840 -0.521 0.000 0.753 382 L CB -0.042 41.457 42.059 -0.934 0.000 0.890 382 L HN -0.146 7.876 8.230 -0.348 0.000 0.432 383 I N -2.332 118.132 120.570 -0.177 0.000 2.315 383 I HA -0.491 3.575 4.170 -0.173 0.000 0.248 383 I C 1.903 177.978 176.117 -0.070 0.000 1.117 383 I CA 2.329 63.556 61.300 -0.122 0.000 1.404 383 I CB -1.386 36.576 38.000 -0.063 0.000 1.071 383 I HN -0.048 8.061 8.210 -0.169 0.000 0.419 384 K N 0.674 121.053 120.400 -0.036 0.000 2.032 384 K HA -0.467 3.855 4.320 0.004 0.000 0.209 384 K C 2.092 178.694 176.600 0.003 0.000 1.048 384 K CA 4.099 60.384 56.287 -0.003 0.000 0.927 384 K CB -0.313 32.194 32.500 0.012 0.000 0.712 384 K HN -0.049 8.177 8.250 -0.039 0.000 0.441 385 N N -0.848 117.859 118.700 0.012 0.000 2.166 385 N HA -0.269 4.496 4.740 0.041 0.000 0.186 385 N C 2.450 177.956 175.510 -0.007 0.000 1.019 385 N CA 3.060 56.132 53.050 0.036 0.000 0.856 385 N CB 0.116 38.675 38.487 0.120 0.000 0.993 385 N HN -0.441 7.947 8.380 0.012 0.000 0.426 386 L N -0.288 120.880 121.223 -0.092 0.000 2.046 386 L HA -0.329 3.919 4.340 -0.154 0.000 0.208 386 L C 2.020 178.856 176.870 -0.057 0.000 1.077 386 L CA 3.157 57.875 54.840 -0.203 0.000 0.747 386 L CB -0.406 41.269 42.059 -0.641 0.000 0.896 386 L HN -0.150 8.010 8.230 -0.117 0.000 0.432 387 G N -2.308 106.487 108.800 -0.008 0.000 2.418 387 G HA2 -0.432 3.563 3.960 0.060 0.000 0.217 387 G HA3 -0.432 3.603 3.960 0.125 0.000 0.217 387 G C 0.798 175.732 174.900 0.056 0.000 1.158 387 G CA 2.130 47.270 45.100 0.068 0.000 0.771 387 G HN 0.015 8.285 8.290 -0.033 0.000 0.545 388 N N 2.153 120.874 118.700 0.035 0.000 2.120 388 N HA -0.366 4.394 4.740 0.034 0.000 0.188 388 N C 2.068 177.599 175.510 0.036 0.000 1.024 388 N CA 2.765 55.835 53.050 0.033 0.000 0.852 388 N CB 0.067 38.571 38.487 0.028 0.000 1.003 388 N HN -0.350 8.045 8.380 0.025 0.000 0.424 389 A N 0.294 123.136 122.820 0.037 0.000 1.902 389 A HA -0.264 4.075 4.320 0.031 0.000 0.217 389 A C 1.514 179.132 177.584 0.057 0.000 1.181 389 A CA 2.894 54.954 52.037 0.039 0.000 0.623 389 A CB -0.590 18.431 19.000 0.035 0.000 0.818 389 A HN -0.249 7.919 8.150 0.030 0.000 0.443 390 K N -0.606 119.849 120.400 0.091 0.000 2.057 390 K HA -0.288 4.092 4.320 0.100 0.000 0.207 390 K C 2.712 179.349 176.600 0.061 0.000 1.049 390 K CA 3.063 59.413 56.287 0.104 0.000 0.931 390 K CB -0.011 32.590 32.500 0.168 0.000 0.714 390 K HN -0.132 8.179 8.250 0.102 0.000 0.440 391 E N 0.049 120.281 120.200 0.054 0.000 2.204 391 E HA -0.172 4.199 4.350 0.034 0.000 0.194 391 E C 1.680 178.296 176.600 0.026 0.000 0.989 391 E CA 1.960 58.382 56.400 0.036 0.000 0.824 391 E CB -0.192 29.528 29.700 0.034 0.000 0.756 391 E HN -0.243 8.152 8.360 0.059 0.000 0.477 392 G N -3.802 105.013 108.800 0.026 0.000 2.985 392 G HA2 -0.021 3.949 3.960 0.017 0.000 0.209 392 G HA3 -0.021 3.947 3.960 0.014 0.000 0.209 392 G C -1.023 173.885 174.900 0.012 0.000 1.165 392 G CA -0.693 44.417 45.100 0.017 0.000 0.776 392 G HN -0.600 7.597 8.290 0.031 0.111 0.541 393 A N -1.956 120.874 122.820 0.016 0.000 2.822 393 A HA -0.333 3.993 4.320 0.010 0.000 0.287 393 A C 0.006 177.589 177.584 -0.001 0.000 1.479 393 A CA 1.147 53.188 52.037 0.007 0.000 0.779 393 A CB -2.243 16.757 19.000 0.000 0.000 1.022 393 A HN -0.391 7.595 8.150 0.023 0.178 0.532 394 E N -3.781 116.423 120.200 0.006 0.000 2.538 394 E HA 0.162 4.502 4.350 -0.016 0.000 0.207 394 E C -0.517 176.076 176.600 -0.011 0.000 1.002 394 E CA -0.404 55.993 56.400 -0.005 0.000 0.952 394 E CB 0.731 30.433 29.700 0.002 0.000 1.031 394 E HN 0.024 8.395 8.360 0.018 0.000 0.476 395 C N -1.120 118.181 119.300 0.002 0.000 2.595 395 C HA -0.009 4.457 4.460 0.010 0.000 0.384 395 C C 1.055 175.979 174.990 -0.109 0.000 1.289 395 C CA -0.325 58.692 59.018 -0.002 0.000 2.372 395 C CB 0.382 28.174 27.740 0.087 0.000 2.593 395 C HN -0.118 8.120 8.230 0.014 0.000 0.639 396 K N 2.743 123.010 120.400 -0.222 0.000 2.355 396 K HA -0.015 4.086 4.320 -0.366 0.000 0.270 396 K C -0.261 176.009 176.600 -0.550 0.000 1.003 396 K CA 0.437 56.431 56.287 -0.487 0.000 0.957 396 K CB 0.663 32.635 32.500 -0.879 0.000 0.939 396 K HN 0.553 8.697 8.250 -0.176 0.000 0.482 397 S N 1.550 116.962 115.700 -0.481 0.000 2.452 397 S HA 0.285 4.612 4.470 -0.238 0.000 0.284 397 S C -1.156 173.174 174.600 -0.451 0.000 1.171 397 S CA -0.403 57.600 58.200 -0.328 0.000 1.064 397 S CB 0.267 63.361 63.200 -0.178 0.000 0.967 397 S HN 0.087 8.145 8.310 -0.420 0.000 0.484 398 F N 7.085 126.947 119.950 -0.147 0.000 2.546 398 F HA 0.308 4.639 4.527 -0.327 0.000 0.320 398 F C -1.652 174.076 175.800 -0.121 0.000 1.076 398 F CA -3.258 54.574 58.000 -0.281 0.000 0.928 398 F CB 0.841 39.507 39.000 -0.556 0.000 1.189 398 F HN 0.084 8.346 8.300 -0.063 0.000 0.465 402 H N 1.508 120.511 119.070 -0.112 0.000 2.387 402 H HA -0.361 4.009 4.556 -0.310 0.000 0.299 402 H C 0.328 175.424 175.328 -0.387 0.000 1.099 402 H CA 3.568 59.404 56.048 -0.354 0.000 1.315 402 H CB 0.986 30.329 29.762 -0.698 0.000 1.380 402 H HN -0.156 8.208 8.280 0.140 0.000 0.513 403 A N -1.815 120.895 122.820 -0.184 0.000 1.902 403 A HA -0.341 3.851 4.320 -0.213 0.000 0.217 403 A C 2.097 179.609 177.584 -0.120 0.000 1.181 403 A CA 3.125 55.102 52.037 -0.100 0.000 0.623 403 A CB -0.760 18.341 19.000 0.170 0.000 0.818 403 A HN 0.485 8.650 8.150 0.025 0.000 0.443 404 D N -1.665 118.692 120.400 -0.072 0.000 2.117 404 D HA -0.243 4.395 4.640 -0.003 0.000 0.198 404 D C 2.320 178.562 176.300 -0.097 0.000 0.982 404 D CA 2.912 56.887 54.000 -0.042 0.000 0.828 404 D CB -0.584 40.210 40.800 -0.010 0.000 0.967 404 D HN -0.552 7.790 8.370 -0.046 0.000 0.464 405 Q N -0.862 118.831 119.800 -0.177 0.000 2.079 405 Q HA -0.198 4.079 4.340 -0.105 0.000 0.200 405 Q C 2.632 178.487 176.000 -0.242 0.000 0.974 405 Q CA 2.409 58.098 55.803 -0.190 0.000 0.840 405 Q CB -0.117 28.504 28.738 -0.195 0.000 0.898 405 Q HN -0.565 7.586 8.270 -0.199 0.000 0.430 406 V N -0.787 118.846 119.914 -0.468 0.000 2.515 406 V HA -0.424 3.524 4.120 -0.286 0.000 0.250 406 V C 1.722 177.741 176.094 -0.125 0.000 1.058 406 V CA 3.316 65.391 62.300 -0.376 0.000 1.064 406 V CB -1.166 30.234 31.823 -0.705 0.000 0.675 406 V HN 0.141 7.941 8.190 -0.649 0.000 0.461 407 A N 0.412 123.144 122.820 -0.146 0.000 1.930 407 A HA -0.370 3.748 4.320 -0.338 0.000 0.217 407 A C 1.746 179.288 177.584 -0.069 0.000 1.175 407 A CA 3.338 55.302 52.037 -0.122 0.000 0.627 407 A CB -0.551 18.507 19.000 0.096 0.000 0.815 407 A HN -0.463 7.598 8.150 -0.148 0.000 0.443 408 D N -0.919 119.468 120.400 -0.021 0.000 2.144 408 D HA -0.219 4.421 4.640 -0.001 0.000 0.199 408 D C 1.800 178.119 176.300 0.032 0.000 0.984 408 D CA 3.062 57.065 54.000 0.004 0.000 0.834 408 D CB -0.338 40.468 40.800 0.011 0.000 0.955 408 D HN -0.440 7.911 8.370 -0.033 0.000 0.465 409 W N 1.386 122.594 121.300 -0.153 0.000 2.355 409 W HA -0.341 4.258 4.660 -0.102 0.000 0.309 409 W C 1.492 177.925 176.519 -0.143 0.000 1.206 409 W CA 4.167 61.430 57.345 -0.136 0.000 1.284 409 W CB 0.001 29.368 29.460 -0.155 0.000 1.145 409 W HN -0.427 7.862 8.180 0.183 0.000 0.502 410 L N -2.291 118.743 121.223 -0.315 0.000 2.042 410 L HA -0.591 3.242 4.340 -0.845 0.000 0.210 410 L C 2.384 179.017 176.870 -0.394 0.000 1.076 410 L CA 3.022 57.521 54.840 -0.569 0.000 0.749 410 L CB -0.552 41.136 42.059 -0.618 0.000 0.893 410 L HN -0.271 7.894 8.230 -0.109 0.000 0.432 411 A N -2.050 120.635 122.820 -0.224 0.000 1.969 411 A HA -0.239 4.156 4.320 -0.130 -0.153 0.218 411 A C 1.722 179.224 177.584 -0.138 0.000 1.169 411 A CA 2.457 54.414 52.037 -0.133 0.000 0.635 411 A CB -0.615 18.359 19.000 -0.045 0.000 0.810 411 A HN -0.181 7.862 8.150 -0.179 0.000 0.445 412 A N -2.343 120.389 122.820 -0.147 0.000 1.930 412 A HA -0.227 4.046 4.320 -0.077 0.000 0.217 412 A C 2.001 179.488 177.584 -0.162 0.000 1.175 412 A CA 2.509 54.476 52.037 -0.116 0.000 0.627 412 A CB -0.428 18.535 19.000 -0.062 0.000 0.815 412 A HN -0.349 7.712 8.150 -0.149 0.000 0.443 413 R N -4.569 115.753 120.500 -0.295 0.000 2.153 413 R HA -0.032 4.196 4.340 -0.186 0.000 0.218 413 R C 0.180 176.362 176.300 -0.196 0.000 1.072 413 R CA 0.488 56.422 56.100 -0.276 0.000 0.990 413 R CB 0.753 30.754 30.300 -0.497 0.000 0.889 413 R HN -0.539 7.488 8.270 -0.406 0.000 0.452 414 Q N -2.151 117.492 119.800 -0.262 0.000 3.021 414 Q HA 0.484 4.671 4.340 -0.254 0.000 0.234 414 Q C -2.279 173.611 176.000 -0.183 0.000 0.930 414 Q CA -2.877 52.751 55.803 -0.292 0.000 0.714 414 Q CB 0.212 28.642 28.738 -0.513 0.000 1.325 414 Q HN -0.516 7.495 8.270 -0.277 0.093 0.473 415 P HA -0.064 4.432 4.420 -0.063 -0.114 0.226 415 P C -0.304 176.959 177.300 -0.062 0.000 1.153 415 P CA 0.786 63.843 63.100 -0.072 0.000 0.777 415 P CB 0.470 32.139 31.700 -0.051 0.000 0.794 416 K N -2.141 118.207 120.400 -0.087 0.000 2.965 416 K HA 0.211 4.491 4.320 -0.066 0.000 0.216 416 K C -0.152 176.402 176.600 -0.077 0.000 1.164 416 K CA -1.303 54.938 56.287 -0.077 0.000 1.153 416 K CB -0.584 31.872 32.500 -0.073 0.000 1.045 416 K HN -0.406 8.061 8.250 -0.114 -0.285 0.460 417 L N -0.164 121.029 121.223 -0.049 0.000 2.514 417 L HA -0.205 4.223 4.340 -0.060 -0.123 0.280 417 L C 0.542 177.468 176.870 0.093 0.000 1.223 417 L CA 0.233 55.073 54.840 -0.000 0.000 0.864 417 L CB 0.617 42.724 42.059 0.080 0.000 1.118 417 L HN -0.615 7.514 8.230 -0.045 0.074 0.494 418 V N 4.568 124.536 119.914 0.090 0.000 2.294 418 V HA 0.248 4.558 4.120 0.316 0.000 0.272 418 V C -0.276 175.957 176.094 0.233 0.000 1.027 418 V CA -1.657 60.774 62.300 0.219 0.000 0.823 418 V CB -0.647 31.297 31.823 0.202 0.000 1.030 418 V HN 0.358 8.456 8.190 0.018 0.103 0.457 419 T N 3.950 118.655 114.554 0.252 0.000 2.754 419 T HA 0.350 4.877 4.350 -0.028 -0.193 0.286 419 T C 1.382 176.245 174.700 0.272 0.000 0.997 419 T CA -1.011 61.145 62.100 0.093 0.000 0.982 419 T CB 1.097 69.916 68.868 -0.083 0.000 1.027 419 T HN 0.071 8.528 8.240 0.361 0.000 0.529 420 S N 2.063 117.903 115.700 0.234 0.000 2.374 420 S HA -0.492 4.210 4.470 0.387 0.000 0.227 420 S C 1.413 176.108 174.600 0.158 0.000 1.037 420 S CA 3.896 62.259 58.200 0.272 0.000 1.024 420 S CB -0.647 62.675 63.200 0.203 0.000 0.861 420 S HN 0.646 9.033 8.310 0.127 0.000 0.456 421 A N 0.188 123.014 122.820 0.010 0.000 1.902 421 A HA -0.242 4.056 4.320 -0.036 0.000 0.217 421 A C 1.768 179.334 177.584 -0.031 0.000 1.181 421 A CA 2.605 54.601 52.037 -0.069 0.000 0.623 421 A CB -0.875 18.024 19.000 -0.168 0.000 0.818 421 A HN 0.151 8.280 8.150 -0.035 0.000 0.443 422 H N -1.500 117.621 119.070 0.086 0.000 2.363 422 H HA -0.110 4.465 4.556 0.032 0.000 0.301 422 H C 2.383 177.771 175.328 0.099 0.000 1.074 422 H CA 2.541 58.635 56.048 0.076 0.000 1.354 422 H CB -0.106 29.710 29.762 0.091 0.000 1.397 422 H HN -0.704 7.524 8.280 -0.087 0.000 0.516 423 W N 0.540 121.925 121.300 0.141 0.000 2.338 423 W HA -0.510 4.171 4.660 0.036 0.000 0.304 423 W C 1.186 177.692 176.519 -0.020 0.000 1.212 423 W CA 3.650 61.013 57.345 0.030 0.000 1.264 423 W CB -0.099 29.327 29.460 -0.058 0.000 1.142 423 W HN 0.238 8.694 8.180 0.460 0.000 0.512 424 Q N -2.492 117.062 119.800 -0.409 0.000 2.181 424 Q HA -0.413 3.391 4.340 -0.893 0.000 0.205 424 Q C 2.449 178.215 176.000 -0.390 0.000 0.980 424 Q CA 3.492 58.972 55.803 -0.539 0.000 0.862 424 Q CB -0.257 28.342 28.738 -0.232 0.000 0.905 424 Q HN -0.062 8.134 8.270 -0.122 0.000 0.429 425 V N 0.127 119.925 119.914 -0.193 0.000 2.323 425 V HA -0.373 3.691 4.120 -0.093 0.000 0.244 425 V C 1.845 177.879 176.094 -0.100 0.000 1.041 425 V CA 3.519 65.760 62.300 -0.099 0.000 1.025 425 V CB -0.731 31.086 31.823 -0.010 0.000 0.656 425 V HN -0.795 7.326 8.190 -0.115 0.000 0.451 426 I N 1.045 121.544 120.570 -0.119 0.000 2.118 426 I HA -0.653 3.537 4.170 0.033 0.000 0.241 426 I C 1.653 177.665 176.117 -0.175 0.000 1.070 426 I CA 4.899 66.165 61.300 -0.056 0.000 1.327 426 I CB -0.522 37.525 38.000 0.078 0.000 1.034 426 I HN -0.509 7.646 8.210 -0.092 0.000 0.405 427 D N -0.502 119.494 120.400 -0.673 0.000 2.084 427 D HA -0.326 3.966 4.640 -0.580 0.000 0.194 427 D C 1.713 177.820 176.300 -0.321 0.000 0.990 427 D CA 3.193 56.738 54.000 -0.757 0.000 0.826 427 D CB -0.072 39.846 40.800 -1.469 0.000 0.971 427 D HN -0.064 7.722 8.370 -0.974 0.000 0.453 428 A N -1.290 121.363 122.820 -0.277 0.000 1.933 428 A HA -0.251 3.980 4.320 -0.149 0.000 0.218 428 A C 1.978 179.512 177.584 -0.084 0.000 1.175 428 A CA 2.877 54.826 52.037 -0.148 0.000 0.628 428 A CB -0.739 18.189 19.000 -0.119 0.000 0.814 428 A HN -0.511 7.435 8.150 -0.341 0.000 0.444 429 F N -0.558 119.313 119.950 -0.132 0.000 2.102 429 F HA -0.431 4.056 4.527 -0.068 0.000 0.298 429 F C 1.494 177.256 175.800 -0.064 0.000 1.105 429 F CA 3.456 61.407 58.000 -0.082 0.000 1.239 429 F CB 0.312 39.271 39.000 -0.069 0.000 0.991 429 F HN 0.055 8.419 8.300 0.107 0.000 0.474 430 E N -0.252 119.882 120.200 -0.110 0.000 2.077 430 E HA -0.420 3.870 4.350 -0.250 -0.089 0.193 430 E C 2.881 179.351 176.600 -0.216 0.000 0.989 430 E CA 3.140 59.444 56.400 -0.159 0.000 0.800 430 E CB -0.238 29.479 29.700 0.029 0.000 0.746 430 E HN -0.167 8.239 8.360 0.077 0.000 0.452 431 R N -1.020 119.385 120.500 -0.159 0.000 2.081 431 R HA -0.206 4.253 4.340 -0.093 -0.175 0.235 431 R C 2.844 179.043 176.300 -0.168 0.000 1.131 431 R CA 3.063 59.088 56.100 -0.124 0.000 0.960 431 R CB 0.011 30.260 30.300 -0.085 0.000 0.856 431 R HN -0.292 7.895 8.270 -0.139 0.000 0.436 432 A N -0.974 121.713 122.820 -0.222 0.000 1.972 432 A HA -0.151 4.075 4.320 -0.157 0.000 0.219 432 A C 2.143 179.564 177.584 -0.273 0.000 1.169 432 A CA 2.627 54.531 52.037 -0.221 0.000 0.635 432 A CB -0.902 17.973 19.000 -0.208 0.000 0.810 432 A HN -0.103 7.908 8.150 -0.231 0.000 0.446 433 A N -2.849 119.708 122.820 -0.440 0.000 2.019 433 A HA -0.178 3.933 4.320 -0.349 0.000 0.219 433 A C 1.314 178.791 177.584 -0.178 0.000 1.164 433 A CA 2.362 54.166 52.037 -0.389 0.000 0.644 433 A CB -0.494 18.163 19.000 -0.572 0.000 0.805 433 A HN -0.107 7.689 8.150 -0.569 0.013 0.449 434 G N -4.263 104.449 108.800 -0.147 0.000 2.494 434 G HA2 -0.068 3.973 3.960 -0.066 0.000 0.216 434 G HA3 -0.068 3.868 3.960 -0.040 0.000 0.216 434 G C 1.009 175.878 174.900 -0.051 0.000 1.140 434 G CA 0.738 45.796 45.100 -0.070 0.000 0.801 434 G HN -0.519 7.538 8.290 -0.172 0.129 0.536 435 E N 2.612 122.764 120.200 -0.079 0.000 2.085 435 E HA -0.143 4.173 4.350 -0.056 0.000 0.194 435 E C 0.139 176.697 176.600 -0.070 0.000 0.994 435 E CA 4.153 60.512 56.400 -0.068 0.000 0.801 435 E CB -1.468 28.186 29.700 -0.077 0.000 0.743 435 E HN -0.501 7.797 8.360 -0.103 0.000 0.453 436 P HA -0.117 4.213 4.420 -0.149 0.000 0.223 436 P C 0.201 177.349 177.300 -0.254 0.000 1.151 436 P CA 1.728 64.730 63.100 -0.163 0.000 0.787 436 P CB -0.212 31.372 31.700 -0.194 0.000 0.788 437 H N -4.688 114.353 119.070 -0.049 0.000 2.505 437 H HA 0.233 4.768 4.556 -0.035 0.000 0.286 437 H C -0.079 175.224 175.328 -0.042 0.000 1.072 437 H CA -0.414 55.609 56.048 -0.041 0.000 1.141 437 H CB 0.008 29.746 29.762 -0.040 0.000 1.550 437 H HN -0.735 7.565 8.280 0.032 0.000 0.547 438 G N 0.210 109.023 108.800 0.023 0.000 2.333 438 G HA2 -0.483 3.479 3.960 0.003 0.000 0.296 438 G HA3 -0.483 3.538 3.960 -0.015 -0.070 0.296 438 G C -1.309 173.593 174.900 0.002 0.000 1.059 438 G CA 0.635 45.736 45.100 0.002 0.000 1.050 438 G HN -0.287 7.822 8.290 -0.009 0.175 0.508 439 R N -0.862 119.636 120.500 -0.004 0.000 2.807 439 R HA 0.605 5.133 4.340 -0.015 -0.197 0.276 439 R C -1.552 174.733 176.300 -0.024 0.000 0.979 439 R CA -3.478 52.613 56.100 -0.014 0.000 0.928 439 R CB 1.660 31.950 30.300 -0.016 0.000 1.191 439 R HN -0.309 7.847 8.270 -0.007 0.110 0.471 440 P HA -0.113 4.294 4.420 -0.022 0.000 0.221 440 P C -1.426 175.861 177.300 -0.022 0.000 1.150 440 P CA 1.184 64.274 63.100 -0.017 0.000 0.800 440 P CB 0.659 32.358 31.700 -0.003 0.000 0.787 441 R N -7.945 112.540 120.500 -0.026 0.000 2.709 441 R HA 0.238 4.687 4.340 -0.070 -0.151 0.270 441 R C -2.654 173.619 176.300 -0.046 0.000 1.038 441 R CA -0.666 55.410 56.100 -0.040 0.000 0.872 441 R CB 2.811 33.108 30.300 -0.005 0.000 1.259 441 R HN -0.702 7.554 8.270 -0.024 0.000 0.473 442 V N 1.605 121.480 119.914 -0.066 0.000 2.350 442 V HA 0.269 4.358 4.120 -0.051 0.000 0.285 442 V C -1.140 174.948 176.094 -0.010 0.000 1.014 442 V CA -2.019 60.251 62.300 -0.051 0.000 0.831 442 V CB 1.521 33.308 31.823 -0.060 0.000 1.000 442 V HN 0.136 8.267 8.190 -0.098 0.000 0.433 443 K N 6.847 127.245 120.400 -0.003 0.000 2.270 443 K HA -0.130 4.395 4.320 0.069 -0.163 0.276 443 K C -0.328 176.308 176.600 0.061 0.000 1.023 443 K CA -0.351 55.958 56.287 0.038 0.000 0.955 443 K CB 0.628 33.139 32.500 0.017 0.000 0.975 443 K HN 0.230 8.462 8.250 -0.030 0.000 0.471 444 L N 3.535 124.824 121.223 0.110 0.000 2.369 444 L HA -0.038 4.366 4.340 0.107 0.000 0.279 444 L C -0.105 176.814 176.870 0.082 0.000 1.108 444 L CA -0.254 54.650 54.840 0.107 0.000 0.852 444 L CB 0.296 42.424 42.059 0.115 0.000 1.169 444 L HN -0.040 8.577 8.230 0.131 -0.309 0.452 445 A N 1.366 124.240 122.820 0.089 0.000 2.345 445 A HA 0.209 4.741 4.320 0.110 -0.147 0.225 445 A C -0.725 176.950 177.584 0.152 0.000 1.243 445 A CA -0.095 52.017 52.037 0.126 0.000 0.875 445 A CB 0.265 19.362 19.000 0.162 0.000 0.929 445 A HN 0.427 8.632 8.150 0.091 0.000 0.502 446 S N -4.508 111.259 115.700 0.112 0.000 2.595 446 S HA 0.184 4.730 4.470 0.126 0.000 0.281 446 S C 0.171 174.817 174.600 0.076 0.000 1.117 446 S CA -1.908 56.355 58.200 0.104 0.000 0.873 446 S CB 2.881 66.134 63.200 0.089 0.000 1.108 446 S HN -0.806 7.510 8.310 0.093 0.049 0.477 447 L N 2.757 124.027 121.223 0.077 0.000 2.012 447 L HA -0.337 4.035 4.340 0.053 0.000 0.210 447 L C 0.758 177.647 176.870 0.031 0.000 1.073 447 L CA 3.602 58.476 54.840 0.056 0.000 0.748 447 L CB -0.110 41.989 42.059 0.066 0.000 0.891 447 L HN 0.648 8.934 8.230 0.093 0.000 0.431 448 A N -3.254 119.583 122.820 0.027 0.000 1.908 448 A HA -0.383 3.937 4.320 -0.001 0.000 0.218 448 A C 2.188 179.770 177.584 -0.004 0.000 1.181 448 A CA 3.136 55.178 52.037 0.008 0.000 0.627 448 A CB -1.011 17.994 19.000 0.010 0.000 0.818 448 A HN 0.042 8.214 8.150 0.036 0.000 0.445 449 E N -1.414 118.792 120.200 0.010 0.000 2.072 449 E HA -0.286 4.048 4.350 -0.026 0.000 0.191 449 E C 2.573 179.159 176.600 -0.024 0.000 0.985 449 E CA 2.607 59.004 56.400 -0.006 0.000 0.801 449 E CB -0.235 29.481 29.700 0.026 0.000 0.750 449 E HN -0.641 7.734 8.360 0.027 0.000 0.452 450 L N -0.572 120.656 121.223 0.008 0.000 2.012 450 L HA -0.351 4.002 4.340 0.022 0.000 0.210 450 L C 2.345 179.205 176.870 -0.017 0.000 1.073 450 L CA 3.385 58.236 54.840 0.017 0.000 0.748 450 L CB -0.140 41.948 42.059 0.049 0.000 0.891 450 L HN -0.208 8.037 8.230 0.025 0.000 0.431 451 L N -3.322 117.885 121.223 -0.026 0.000 2.156 451 L HA -0.354 3.948 4.340 -0.063 0.000 0.208 451 L C 2.267 179.083 176.870 -0.089 0.000 1.095 451 L CA 2.615 57.421 54.840 -0.057 0.000 0.770 451 L CB -0.827 41.202 42.059 -0.049 0.000 0.914 451 L HN 0.021 8.242 8.230 -0.015 0.000 0.439 452 R N 0.313 120.762 120.500 -0.086 0.000 2.083 452 R HA -0.379 3.904 4.340 -0.095 0.000 0.237 452 R C 2.272 178.480 176.300 -0.154 0.000 1.137 452 R CA 3.510 59.545 56.100 -0.108 0.000 0.951 452 R CB -0.156 30.085 30.300 -0.098 0.000 0.851 452 R HN -0.319 7.909 8.270 -0.069 0.000 0.434 453 I N -3.667 116.783 120.570 -0.199 0.000 2.277 453 I HA -0.153 3.841 4.170 -0.293 0.000 0.243 453 I C 2.831 178.853 176.117 -0.159 0.000 1.094 453 I CA 1.323 62.463 61.300 -0.267 0.000 1.393 453 I CB -0.842 36.887 38.000 -0.452 0.000 1.078 453 I HN -0.697 7.403 8.210 -0.183 0.000 0.417 454 G N -0.110 108.625 108.800 -0.108 0.000 2.408 454 G HA2 -0.218 3.725 3.960 -0.027 0.000 0.217 454 G HA3 -0.218 3.733 3.960 -0.015 0.000 0.217 454 G C 0.148 174.927 174.900 -0.201 0.000 1.150 454 G CA 2.035 47.096 45.100 -0.066 0.000 0.776 454 G HN 0.042 8.275 8.290 -0.096 0.000 0.542 455 L N -2.417 118.657 121.223 -0.250 0.000 2.700 455 L HA 0.249 4.253 4.340 -0.559 0.000 0.234 455 L C 0.058 176.824 176.870 -0.174 0.000 1.156 455 L CA -1.339 53.299 54.840 -0.337 0.000 0.946 455 L CB -0.527 41.362 42.059 -0.283 0.000 1.216 455 L HN -0.192 7.820 8.230 -0.187 0.106 0.493 456 G N 0.000 108.724 108.800 -0.127 0.000 5.446 456 G HA2 0.000 nan 3.960 nan 0.000 0.244 456 G HA3 0.000 3.912 3.960 -0.081 0.000 0.244 456 G CA 0.000 45.047 45.100 -0.087 0.000 0.502 456 G HN 0.000 8.042 8.290 -0.132 0.169 0.925