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 1lqu_1_A 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 LRGYADREXR 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 4.337 4.340 -0.005 0.000 0.208 2 R C 0.000 176.202 176.300 -0.164 0.000 0.893 2 R CA 0.000 56.081 56.100 -0.032 0.000 0.921 2 R CB 0.000 30.355 30.300 0.091 0.000 0.687 3 P HA 0.108 4.447 4.420 -0.280 -0.087 0.276 3 P C -1.358 175.692 177.300 -0.416 0.000 1.252 3 P CA -0.743 62.157 63.100 -0.334 0.000 0.802 3 P CB 0.780 32.274 31.700 -0.344 0.000 1.035 4 Y N -2.231 117.970 120.300 -0.165 0.000 2.411 4 Y HA -0.211 4.521 4.550 0.046 -0.154 0.333 4 Y C -0.071 175.716 175.900 -0.188 0.000 1.186 4 Y CA 0.305 58.367 58.100 -0.062 0.000 1.381 4 Y CB 0.857 39.333 38.460 0.027 0.000 1.273 4 Y HN -0.160 8.011 8.280 -0.181 0.000 0.546 5 Y N 0.008 120.544 120.300 0.393 0.000 2.342 5 Y HA 0.267 5.125 4.550 0.269 -0.147 0.338 5 Y C -0.714 175.433 175.900 0.411 0.000 0.965 5 Y CA -0.861 57.432 58.100 0.322 0.000 1.159 5 Y CB 0.913 39.473 38.460 0.167 0.000 1.157 5 Y HN 0.421 9.400 8.280 0.587 -0.347 0.486 6 I N 3.055 123.873 120.570 0.413 0.000 2.406 6 I HA 0.621 5.116 4.170 0.220 -0.193 0.290 6 I C -1.505 174.589 176.117 -0.039 0.000 0.999 6 I CA -3.040 58.377 61.300 0.194 0.000 1.124 6 I CB 2.314 40.360 38.000 0.077 0.000 1.289 6 I HN 0.464 8.880 8.210 0.342 0.000 0.441 7 A N 7.072 129.643 122.820 -0.414 0.000 2.301 7 A HA 0.922 5.050 4.320 -0.656 -0.202 0.312 7 A C -1.612 175.729 177.584 -0.404 0.000 1.182 7 A CA -2.324 49.280 52.037 -0.722 0.000 0.826 7 A CB 2.603 20.844 19.000 -1.265 0.000 1.134 7 A HN 0.224 8.176 8.150 -0.330 0.000 0.501 8 I N 2.548 122.910 120.570 -0.347 0.000 2.406 8 I HA 0.601 4.787 4.170 -0.293 -0.192 0.290 8 I C -1.094 174.843 176.117 -0.301 0.000 0.999 8 I CA -1.299 59.828 61.300 -0.289 0.000 1.124 8 I CB 2.860 40.729 38.000 -0.219 0.000 1.289 8 I HN 0.658 8.662 8.210 -0.342 0.000 0.441 9 V N 6.758 126.470 119.914 -0.337 0.000 2.333 9 V HA 0.544 4.689 4.120 -0.221 -0.157 0.274 9 V C -0.264 175.759 176.094 -0.119 0.000 1.028 9 V CA -1.587 60.558 62.300 -0.258 0.000 0.851 9 V CB -0.635 30.964 31.823 -0.373 0.000 1.000 9 V HN 0.596 8.552 8.190 -0.391 0.000 0.456 10 G N 8.434 117.183 108.800 -0.084 0.000 2.587 10 G HA2 -0.153 3.930 3.960 -0.007 0.000 0.686 10 G HA3 -0.153 3.971 3.960 -0.014 -0.172 0.686 10 G C -2.148 172.712 174.900 -0.066 0.000 1.236 10 G CA -0.103 44.976 45.100 -0.035 0.000 0.820 10 G HN 0.631 8.861 8.290 -0.100 0.000 0.645 11 S N -0.668 115.026 115.700 -0.009 0.000 3.021 11 S HA 0.289 4.660 4.470 -0.165 0.000 0.252 11 S C 0.102 174.774 174.600 0.120 0.000 0.996 11 S CA -0.665 57.547 58.200 0.020 0.000 1.084 11 S CB 1.617 64.958 63.200 0.235 0.000 1.021 11 S HN -0.066 8.354 8.310 0.020 -0.098 0.566 12 G N 2.446 111.250 108.800 0.007 0.000 2.508 12 G HA2 0.316 4.346 3.960 0.036 0.000 0.278 12 G HA3 0.316 4.245 3.960 -0.051 0.000 0.278 12 G C -2.026 172.736 174.900 -0.229 0.000 1.389 12 G CA -1.462 43.616 45.100 -0.037 0.000 1.050 12 G HN -0.105 8.171 8.290 -0.022 0.000 0.522 13 P HA -0.251 3.618 4.420 -0.918 0.000 0.215 13 P C 1.519 178.591 177.300 -0.378 0.000 1.157 13 P CA 3.108 65.923 63.100 -0.476 0.000 0.874 13 P CB 0.078 31.723 31.700 -0.093 0.000 0.790 14 S N -3.681 111.977 115.700 -0.071 0.000 2.382 14 S HA -0.311 4.320 4.470 0.268 0.000 0.228 14 S C 1.798 176.401 174.600 0.004 0.000 1.027 14 S CA 3.052 61.306 58.200 0.090 0.000 0.991 14 S CB -0.586 62.682 63.200 0.112 0.000 0.823 14 S HN 0.137 8.405 8.310 -0.070 0.000 0.469 15 A N 2.657 125.410 122.820 -0.112 0.000 1.877 15 A HA -0.218 4.028 4.320 -0.124 0.000 0.216 15 A C 2.202 179.619 177.584 -0.277 0.000 1.186 15 A CA 2.630 54.554 52.037 -0.188 0.000 0.620 15 A CB -0.760 18.087 19.000 -0.254 0.000 0.822 15 A HN -0.068 8.008 8.150 -0.124 0.000 0.443 16 F N -2.051 117.672 119.950 -0.379 0.000 2.234 16 F HA -0.345 4.053 4.527 -0.215 0.000 0.299 16 F C 2.121 177.797 175.800 -0.206 0.000 1.087 16 F CA 3.930 61.666 58.000 -0.439 0.000 1.340 16 F CB -0.147 38.202 39.000 -1.085 0.000 1.031 16 F HN -0.444 7.629 8.300 -0.378 0.000 0.500 17 F N -1.083 118.907 119.950 0.067 0.000 2.146 17 F HA -0.406 4.195 4.527 0.124 0.000 0.298 17 F C 1.899 177.730 175.800 0.053 0.000 1.096 17 F CA 2.326 60.379 58.000 0.088 0.000 1.275 17 F CB -1.351 37.698 39.000 0.082 0.000 1.008 17 F HN 0.134 8.316 8.300 -0.196 0.000 0.480 18 A N -0.664 122.270 122.820 0.190 0.000 1.877 18 A HA -0.411 3.969 4.320 0.101 0.000 0.216 18 A C 1.425 179.056 177.584 0.077 0.000 1.186 18 A CA 3.000 55.095 52.037 0.096 0.000 0.620 18 A CB -1.103 17.920 19.000 0.038 0.000 0.822 18 A HN -0.043 8.201 8.150 0.157 0.000 0.443 19 A N -2.164 120.694 122.820 0.064 0.000 1.883 19 A HA -0.351 4.027 4.320 0.097 0.000 0.217 19 A C 1.833 179.503 177.584 0.145 0.000 1.186 19 A CA 2.981 55.083 52.037 0.110 0.000 0.624 19 A CB -0.742 18.349 19.000 0.152 0.000 0.822 19 A HN -0.077 8.086 8.150 0.023 0.000 0.444 20 A N -2.535 120.386 122.820 0.169 0.000 1.902 20 A HA -0.358 4.052 4.320 0.149 0.000 0.217 20 A C 2.247 179.908 177.584 0.128 0.000 1.181 20 A CA 2.999 55.134 52.037 0.164 0.000 0.623 20 A CB -0.917 18.212 19.000 0.215 0.000 0.818 20 A HN -0.139 8.125 8.150 0.189 0.000 0.443 21 S N -0.076 115.697 115.700 0.122 0.000 2.368 21 S HA -0.342 4.174 4.470 0.075 0.000 0.225 21 S C 2.141 176.778 174.600 0.061 0.000 1.030 21 S CA 3.591 61.840 58.200 0.080 0.000 0.999 21 S CB 0.023 63.263 63.200 0.067 0.000 0.844 21 S HN -0.461 7.934 8.310 0.141 0.000 0.459 22 L N 1.197 122.457 121.223 0.062 0.000 2.017 22 L HA -0.339 4.022 4.340 0.035 0.000 0.208 22 L C 1.767 178.680 176.870 0.072 0.000 1.073 22 L CA 3.466 58.337 54.840 0.053 0.000 0.745 22 L CB -0.217 41.873 42.059 0.051 0.000 0.894 22 L HN -0.290 7.981 8.230 0.069 0.000 0.432 23 L N -2.989 118.288 121.223 0.091 0.000 2.093 23 L HA -0.411 3.982 4.340 0.089 0.000 0.208 23 L C 2.036 178.949 176.870 0.072 0.000 1.085 23 L CA 3.083 57.978 54.840 0.091 0.000 0.755 23 L CB -0.770 41.355 42.059 0.110 0.000 0.904 23 L HN -0.248 8.043 8.230 0.102 0.000 0.435 24 K N -0.466 119.975 120.400 0.069 0.000 2.057 24 K HA -0.394 3.958 4.320 0.053 0.000 0.207 24 K C 2.121 178.749 176.600 0.048 0.000 1.049 24 K CA 3.275 59.595 56.287 0.056 0.000 0.931 24 K CB -0.067 32.466 32.500 0.055 0.000 0.714 24 K HN -0.197 8.098 8.250 0.075 0.000 0.440 25 A N -1.438 121.411 122.820 0.048 0.000 1.883 25 A HA -0.218 4.125 4.320 0.038 0.000 0.217 25 A C 2.734 180.348 177.584 0.050 0.000 1.186 25 A CA 2.824 54.887 52.037 0.044 0.000 0.624 25 A CB -0.737 18.287 19.000 0.040 0.000 0.822 25 A HN -0.441 7.738 8.150 0.049 0.000 0.444 26 A N -1.475 121.379 122.820 0.058 0.000 1.902 26 A HA -0.247 4.223 4.320 0.058 -0.115 0.217 26 A C 2.228 179.837 177.584 0.043 0.000 1.181 26 A CA 2.444 54.514 52.037 0.055 0.000 0.623 26 A CB -0.513 18.522 19.000 0.058 0.000 0.818 26 A HN -0.485 7.702 8.150 0.062 0.000 0.443 27 D N -2.486 117.940 120.400 0.043 0.000 2.264 27 D HA -0.159 4.501 4.640 0.034 0.000 0.208 27 D C 1.785 178.103 176.300 0.031 0.000 0.966 27 D CA 2.802 56.824 54.000 0.036 0.000 0.864 27 D CB -0.184 40.639 40.800 0.039 0.000 0.933 27 D HN -0.076 8.246 8.370 0.048 0.077 0.499 28 T N -5.590 108.983 114.554 0.032 0.000 3.085 28 T HA 0.189 4.554 4.350 0.024 0.000 0.264 28 T C -0.318 174.398 174.700 0.027 0.000 1.019 28 T CA -0.475 61.641 62.100 0.027 0.000 0.910 28 T CB 1.155 70.039 68.868 0.026 0.000 1.059 28 T HN -0.559 7.669 8.240 0.035 0.033 0.542 29 T N 4.512 119.084 114.554 0.030 0.000 2.879 29 T HA 0.126 4.493 4.350 0.027 0.000 0.290 29 T C -1.303 173.413 174.700 0.027 0.000 0.993 29 T CA -0.210 61.909 62.100 0.031 0.000 0.975 29 T CB 2.567 71.459 68.868 0.040 0.000 0.981 29 T HN -0.716 7.543 8.240 0.032 0.000 0.439 30 E N 6.182 126.395 120.200 0.022 0.000 2.398 30 E HA -0.103 4.256 4.350 0.014 0.000 0.263 30 E C -0.054 176.556 176.600 0.017 0.000 1.046 30 E CA 0.846 57.256 56.400 0.017 0.000 0.908 30 E CB 0.312 30.020 29.700 0.014 0.000 0.963 30 E HN 0.226 8.599 8.360 0.022 0.000 0.431 31 D N -2.348 118.055 120.400 0.006 0.000 2.772 31 D HA -0.332 4.297 4.640 -0.019 0.000 0.233 31 D C -1.817 174.480 176.300 -0.006 0.000 1.143 31 D CA 1.060 55.056 54.000 -0.006 0.000 0.700 31 D CB -0.803 39.996 40.800 -0.001 0.000 1.076 31 D HN 0.245 8.617 8.370 0.002 0.000 0.430 32 L N -3.281 117.943 121.223 0.003 0.000 2.541 32 L HA 0.292 4.635 4.340 0.005 0.000 0.266 32 L C -2.964 173.915 176.870 0.015 0.000 0.966 32 L CA -0.018 54.838 54.840 0.028 0.000 0.871 32 L CB 2.329 44.440 42.059 0.087 0.000 1.232 32 L HN -0.712 7.507 8.230 0.005 0.014 0.408 33 D N 5.702 126.084 120.400 -0.030 0.000 2.527 33 D HA 0.326 4.968 4.640 0.004 0.000 0.233 33 D C -1.838 174.458 176.300 -0.006 0.000 1.063 33 D CA -0.526 53.458 54.000 -0.027 0.000 0.880 33 D CB 4.126 44.885 40.800 -0.069 0.000 1.457 33 D HN 0.250 8.564 8.370 -0.094 0.000 0.475 34 M N -0.651 118.955 119.600 0.010 0.000 2.446 34 M HA 0.549 5.202 4.480 0.053 -0.140 0.294 34 M C -1.899 174.403 176.300 0.003 0.000 1.158 34 M CA -1.457 53.866 55.300 0.037 0.000 0.899 34 M CB 5.068 37.719 32.600 0.084 0.000 1.687 34 M HN 0.237 8.533 8.290 0.009 0.000 0.455 35 A N 1.204 124.015 122.820 -0.014 0.000 2.374 35 A HA 0.574 5.070 4.320 0.073 -0.132 0.305 35 A C -2.871 174.787 177.584 0.122 0.000 1.053 35 A CA -1.357 50.707 52.037 0.044 0.000 0.726 35 A CB 4.006 23.005 19.000 -0.002 0.000 1.229 35 A HN 0.783 8.920 8.150 -0.022 0.000 0.431 36 V N 3.442 123.419 119.914 0.105 0.000 2.444 36 V HA 0.755 5.106 4.120 0.052 -0.200 0.294 36 V C -1.558 174.467 176.094 -0.115 0.000 1.022 36 V CA -1.708 60.607 62.300 0.026 0.000 0.850 36 V CB 2.694 34.545 31.823 0.047 0.000 0.992 36 V HN 0.362 8.616 8.190 0.107 0.000 0.426 37 D N 7.384 127.737 120.400 -0.078 0.000 2.344 37 D HA 0.526 5.243 4.640 -0.144 -0.164 0.239 37 D C -1.688 174.470 176.300 -0.236 0.000 1.064 37 D CA -0.798 53.153 54.000 -0.082 0.000 0.829 37 D CB 2.800 43.712 40.800 0.187 0.000 1.129 37 D HN 0.403 8.753 8.370 -0.034 0.000 0.506 38 M N 5.017 124.426 119.600 -0.319 0.000 2.149 38 M HA 0.622 5.139 4.480 -0.268 -0.198 0.342 38 M C -2.393 173.791 176.300 -0.194 0.000 1.068 38 M CA -0.943 54.194 55.300 -0.271 0.000 0.991 38 M CB 2.896 35.327 32.600 -0.281 0.000 1.596 38 M HN 0.608 8.658 8.290 -0.401 0.000 0.439 39 L N 5.951 127.053 121.223 -0.202 0.000 2.287 39 L HA 0.718 5.110 4.340 -0.224 -0.186 0.287 39 L C -1.554 175.196 176.870 -0.201 0.000 1.022 39 L CA -1.369 53.346 54.840 -0.208 0.000 0.814 39 L CB 1.117 43.067 42.059 -0.182 0.000 1.217 39 L HN 0.825 8.926 8.230 -0.215 0.000 0.420 40 E N 3.470 123.511 120.200 -0.265 0.000 2.234 40 E HA 0.429 4.733 4.350 -0.076 0.000 0.266 40 E C -0.721 175.816 176.600 -0.104 0.000 0.877 40 E CA -2.055 54.258 56.400 -0.145 0.000 0.758 40 E CB 3.235 32.890 29.700 -0.075 0.000 1.170 40 E HN 0.133 8.269 8.360 -0.373 0.000 0.415 41 M N 6.954 126.543 119.600 -0.020 0.000 2.117 41 M HA -0.234 4.426 4.480 0.044 -0.153 0.262 41 M C -0.386 175.923 176.300 0.014 0.000 1.065 41 M CA 3.202 58.521 55.300 0.031 0.000 1.114 41 M CB 0.687 33.342 32.600 0.091 0.000 1.361 41 M HN 0.536 8.827 8.290 0.001 0.000 0.408 42 L N -2.420 118.784 121.223 -0.033 0.000 2.439 42 L HA 0.260 4.569 4.340 -0.052 0.000 0.259 42 L C -0.560 176.297 176.870 -0.021 0.000 1.129 42 L CA -2.137 52.663 54.840 -0.067 0.000 0.803 42 L CB -1.347 40.607 42.059 -0.176 0.000 1.161 42 L HN -0.544 8.009 8.230 -0.037 -0.345 0.462 43 P HA -0.049 4.421 4.420 0.083 0.000 0.226 43 P C -1.599 175.771 177.300 0.116 0.000 1.153 43 P CA 1.148 64.292 63.100 0.073 0.000 0.777 43 P CB 0.234 31.975 31.700 0.069 0.000 0.794 44 T N -7.261 107.253 114.554 -0.068 0.000 2.856 44 T HA 0.353 4.307 4.350 -0.660 0.000 0.283 44 T C -1.949 172.410 174.700 -0.568 0.000 1.008 44 T CA -4.186 57.639 62.100 -0.459 0.000 0.997 44 T CB 2.005 70.644 68.868 -0.383 0.000 0.992 44 T HN -0.643 7.490 8.240 -0.091 0.052 0.454 45 P HA 0.267 4.527 4.420 -0.267 0.000 0.282 45 P C -1.222 175.714 177.300 -0.606 0.000 1.287 45 P CA -0.692 61.930 63.100 -0.797 0.000 0.792 45 P CB 1.710 32.673 31.700 -1.227 0.000 1.163 46 W N -6.618 114.623 121.300 -0.099 0.000 1.119 46 W HA -0.288 4.470 4.660 0.005 -0.095 0.243 46 W C 0.399 176.905 176.519 -0.023 0.000 1.001 46 W CA -0.118 57.209 57.345 -0.030 0.000 0.385 46 W CB -2.103 27.343 29.460 -0.023 0.000 2.011 46 W HN 0.208 8.509 8.180 0.202 0.000 1.078 47 G N -0.746 108.133 108.800 0.132 0.000 2.596 47 G HA2 -0.551 3.443 3.960 0.058 0.000 0.295 47 G HA3 -0.551 3.438 3.960 0.048 0.000 0.295 47 G C 0.282 175.228 174.900 0.076 0.000 1.240 47 G CA 1.085 46.229 45.100 0.072 0.000 0.985 47 G HN -0.237 8.043 8.290 0.076 0.056 0.555 48 L N 1.892 123.121 121.223 0.010 0.000 2.456 48 L HA -0.179 4.235 4.340 0.036 -0.052 0.224 48 L C 2.205 179.089 176.870 0.024 0.000 1.148 48 L CA 1.505 56.337 54.840 -0.013 0.000 0.825 48 L CB -0.323 41.636 42.059 -0.168 0.000 0.937 48 L HN 0.085 8.289 8.230 -0.043 0.000 0.450 49 V N -0.107 119.849 119.914 0.071 0.000 2.407 49 V HA -0.515 3.631 4.120 0.044 0.000 0.248 49 V C 1.675 177.853 176.094 0.140 0.000 1.055 49 V CA 4.637 66.992 62.300 0.092 0.000 1.049 49 V CB -0.777 31.112 31.823 0.111 0.000 0.662 49 V HN -0.192 8.024 8.190 0.088 0.026 0.455 50 R N -1.126 119.496 120.500 0.204 0.000 2.066 50 R HA -0.236 4.236 4.340 0.219 0.000 0.224 50 R C 1.805 178.181 176.300 0.126 0.000 1.122 50 R CA 3.545 59.761 56.100 0.193 0.000 0.974 50 R CB 0.390 30.795 30.300 0.175 0.000 0.871 50 R HN -0.499 7.905 8.270 0.223 0.000 0.435 51 S N -5.104 110.663 115.700 0.111 0.000 2.535 51 S HA 0.217 4.756 4.470 0.115 0.000 0.214 51 S C 0.840 175.499 174.600 0.098 0.000 0.980 51 S CA 0.811 59.086 58.200 0.125 0.000 0.907 51 S CB 1.089 64.415 63.200 0.209 0.000 0.790 51 S HN -0.258 8.117 8.310 0.108 0.000 0.510 52 G N 1.461 110.305 108.800 0.075 0.000 2.865 52 G HA2 0.237 4.224 3.960 0.044 0.000 0.204 52 G HA3 0.237 4.222 3.960 0.002 -0.023 0.204 52 G C -0.634 174.313 174.900 0.077 0.000 1.140 52 G CA -0.172 44.954 45.100 0.044 0.000 0.842 52 G HN -0.465 7.766 8.290 0.073 0.103 0.631 53 V N 3.407 123.360 119.914 0.066 0.000 2.681 53 V HA -0.346 3.812 4.120 0.063 0.000 0.306 53 V C -0.241 175.942 176.094 0.149 0.000 1.077 53 V CA 1.356 63.705 62.300 0.082 0.000 1.224 53 V CB -0.213 31.648 31.823 0.063 0.000 0.879 53 V HN -0.322 7.897 8.190 0.048 0.000 0.494 54 A N 8.443 131.366 122.820 0.172 0.000 2.445 54 A HA 0.080 4.598 4.320 0.331 0.000 0.242 54 A C -0.494 177.205 177.584 0.193 0.000 1.075 54 A CA -1.197 50.983 52.037 0.237 0.000 0.777 54 A CB -0.301 18.833 19.000 0.222 0.000 1.013 54 A HN 0.530 8.753 8.150 0.122 0.000 0.493 55 P HA -0.108 4.463 4.420 0.084 -0.100 0.226 55 P C -0.814 176.511 177.300 0.042 0.000 1.153 55 P CA 1.475 64.616 63.100 0.068 0.000 0.777 55 P CB 0.208 31.915 31.700 0.012 0.000 0.794 56 D N -4.498 115.936 120.400 0.056 0.000 2.328 56 D HA -0.113 4.494 4.640 -0.055 0.000 0.226 56 D C -1.204 175.002 176.300 -0.156 0.000 1.066 56 D CA -0.017 53.968 54.000 -0.026 0.000 0.861 56 D CB -1.530 39.246 40.800 -0.040 0.000 0.912 56 D HN 0.125 8.521 8.370 0.087 0.027 0.521 57 H N 0.805 119.886 119.070 0.018 0.000 2.386 57 H HA 0.340 4.905 4.556 0.014 0.000 0.232 57 H C -1.060 174.274 175.328 0.010 0.000 1.416 57 H CA -2.323 53.736 56.048 0.019 0.000 1.285 57 H CB 0.045 29.826 29.762 0.033 0.000 1.625 57 H HN -0.378 7.855 8.280 0.202 0.167 0.521 58 P HA -0.227 4.217 4.420 0.039 0.000 0.218 58 P C 1.236 178.542 177.300 0.010 0.000 1.148 58 P CA 1.914 65.029 63.100 0.026 0.000 0.822 58 P CB 0.308 32.007 31.700 -0.002 0.000 0.784 59 K N -1.561 118.845 120.400 0.009 0.000 2.097 59 K HA -0.221 4.082 4.320 -0.028 0.000 0.206 59 K C 2.375 178.968 176.600 -0.011 0.000 1.049 59 K CA 2.870 59.153 56.287 -0.007 0.000 0.933 59 K CB -0.775 31.725 32.500 -0.000 0.000 0.717 59 K HN 0.115 8.342 8.250 0.008 0.028 0.442 60 I N -1.955 118.634 120.570 0.032 0.000 2.361 60 I HA -0.367 3.802 4.170 -0.001 0.000 0.251 60 I C 1.345 177.430 176.117 -0.053 0.000 1.133 60 I CA 2.503 63.810 61.300 0.011 0.000 1.413 60 I CB -0.260 37.774 38.000 0.056 0.000 1.073 60 I HN -0.628 7.614 8.210 0.077 0.014 0.424 61 K N -1.633 118.737 120.400 -0.051 0.000 2.439 61 K HA -0.210 4.037 4.320 -0.122 0.000 0.197 61 K C 1.750 178.206 176.600 -0.239 0.000 1.041 61 K CA 2.188 58.408 56.287 -0.112 0.000 0.970 61 K CB -0.548 31.933 32.500 -0.031 0.000 0.773 61 K HN -0.510 7.606 8.250 -0.015 0.125 0.479 62 S N -0.028 115.551 115.700 -0.202 0.000 2.500 62 S HA -0.219 4.091 4.470 -0.265 0.000 0.239 62 S C 1.334 175.699 174.600 -0.392 0.000 0.989 62 S CA 2.273 60.320 58.200 -0.255 0.000 0.951 62 S CB -0.279 62.822 63.200 -0.164 0.000 0.759 62 S HN -0.556 7.513 8.310 -0.142 0.157 0.523 63 I N 2.848 123.149 120.570 -0.448 0.000 2.530 63 I HA -0.379 3.485 4.170 -0.511 0.000 0.257 63 I C 0.867 176.262 176.117 -1.203 0.000 1.179 63 I CA 1.680 62.586 61.300 -0.656 0.000 1.440 63 I CB -0.179 37.489 38.000 -0.553 0.000 1.087 63 I HN -0.724 7.232 8.210 -0.361 0.037 0.440 64 S N 0.843 115.818 115.700 -1.207 0.000 2.419 64 S HA -0.418 2.775 4.470 -2.128 0.000 0.235 64 S C 2.006 175.930 174.600 -1.127 0.000 1.019 64 S CA 3.018 60.230 58.200 -1.647 0.000 0.982 64 S CB -0.311 61.674 63.200 -2.026 0.000 0.789 64 S HN -0.110 7.613 8.310 -0.931 0.028 0.490 65 K N 1.126 121.102 120.400 -0.707 0.000 2.097 65 K HA -0.167 4.143 4.320 -0.338 -0.194 0.206 65 K C 2.642 179.017 176.600 -0.376 0.000 1.049 65 K CA 2.637 58.674 56.287 -0.417 0.000 0.933 65 K CB -0.545 31.787 32.500 -0.281 0.000 0.717 65 K HN -0.407 7.436 8.250 -0.643 0.021 0.442 66 Q N -1.309 118.210 119.800 -0.469 0.000 2.084 66 Q HA -0.275 3.954 4.340 -0.185 0.000 0.202 66 Q C 2.638 178.504 176.000 -0.223 0.000 0.978 66 Q CA 2.947 58.572 55.803 -0.297 0.000 0.844 66 Q CB -0.065 28.517 28.738 -0.259 0.000 0.898 66 Q HN -0.505 7.417 8.270 -0.581 0.000 0.426 67 F N -1.755 117.849 119.950 -0.578 0.000 2.171 67 F HA -0.281 3.760 4.527 -0.810 0.000 0.300 67 F C 2.414 177.840 175.800 -0.623 0.000 1.090 67 F CA 0.685 58.125 58.000 -0.934 0.000 1.293 67 F CB -1.137 36.851 39.000 -1.686 0.000 1.013 67 F HN -0.689 6.981 8.300 -0.918 0.079 0.486 68 E N -0.612 119.451 120.200 -0.228 0.000 2.110 68 E HA -0.477 3.889 4.350 0.027 0.000 0.193 68 E C 2.250 178.809 176.600 -0.068 0.000 0.988 68 E CA 3.303 59.672 56.400 -0.052 0.000 0.804 68 E CB -0.478 29.231 29.700 0.016 0.000 0.745 68 E HN -0.203 7.966 8.360 -0.319 0.000 0.458 69 K N -1.553 118.792 120.400 -0.092 0.000 2.057 69 K HA -0.247 4.047 4.320 -0.043 0.000 0.207 69 K C 3.035 179.602 176.600 -0.055 0.000 1.049 69 K CA 3.030 59.282 56.287 -0.058 0.000 0.931 69 K CB -0.136 32.332 32.500 -0.054 0.000 0.714 69 K HN -0.505 7.670 8.250 -0.124 0.000 0.440 70 T N 1.095 115.612 114.554 -0.062 0.000 2.746 70 T HA -0.277 4.056 4.350 -0.029 0.000 0.267 70 T C 1.603 176.130 174.700 -0.290 0.000 1.039 70 T CA 4.139 66.193 62.100 -0.077 0.000 1.142 70 T CB -0.199 68.699 68.868 0.050 0.000 0.866 70 T HN -0.487 7.720 8.240 -0.055 0.000 0.444 71 A N 0.142 122.726 122.820 -0.394 0.000 2.121 71 A HA -0.195 3.201 4.320 -1.540 0.000 0.218 71 A C 1.432 178.937 177.584 -0.130 0.000 1.154 71 A CA 2.366 54.032 52.037 -0.617 0.000 0.679 71 A CB -0.816 18.034 19.000 -0.251 0.000 0.795 71 A HN -0.386 7.616 8.150 -0.248 0.000 0.458 72 E N -3.166 117.001 120.200 -0.055 0.000 2.338 72 E HA -0.144 4.235 4.350 0.048 0.000 0.197 72 E C -0.213 176.420 176.600 0.055 0.000 1.007 72 E CA 0.919 57.332 56.400 0.022 0.000 0.849 72 E CB -0.063 29.644 29.700 0.011 0.000 0.774 72 E HN -0.678 7.501 8.360 -0.074 0.137 0.506 73 D N 0.442 120.873 120.400 0.053 0.000 2.458 73 D HA 0.068 4.755 4.640 0.078 0.000 0.243 73 D C 0.411 176.804 176.300 0.155 0.000 1.146 73 D CA -1.173 52.887 54.000 0.100 0.000 0.877 73 D CB 1.613 42.481 40.800 0.113 0.000 1.176 73 D HN -0.806 7.527 8.370 0.004 0.039 0.461 74 P HA 0.007 4.505 4.420 0.130 0.000 0.228 74 P C 0.347 177.735 177.300 0.146 0.000 1.151 74 P CA 1.218 64.394 63.100 0.125 0.000 0.770 74 P CB 0.220 31.973 31.700 0.088 0.000 0.786 75 R N -3.521 117.076 120.500 0.161 0.000 2.299 75 R HA 0.004 4.423 4.340 0.131 0.000 0.197 75 R C -0.979 175.449 176.300 0.213 0.000 0.971 75 R CA 0.850 57.045 56.100 0.158 0.000 1.030 75 R CB 0.608 30.986 30.300 0.131 0.000 0.932 75 R HN -0.192 8.474 8.270 0.157 -0.301 0.477 76 F N 0.547 120.551 119.950 0.090 0.000 2.443 76 F HA 0.707 5.494 4.527 0.097 -0.202 0.335 76 F C -1.500 174.352 175.800 0.087 0.000 1.104 76 F CA -1.316 56.741 58.000 0.095 0.000 1.013 76 F CB 2.787 41.849 39.000 0.104 0.000 1.136 76 F HN -0.688 7.776 8.300 0.371 0.059 0.470 77 R N 4.254 124.523 120.500 -0.385 0.000 2.744 77 R HA 0.349 4.640 4.340 -0.083 0.000 0.279 77 R C -2.463 173.510 176.300 -0.546 0.000 0.977 77 R CA -1.788 54.131 56.100 -0.301 0.000 0.906 77 R CB 4.167 34.339 30.300 -0.214 0.000 1.197 77 R HN 0.347 8.236 8.270 -0.635 0.000 0.463 78 F N 2.935 122.585 119.950 -0.501 0.000 2.495 78 F HA 0.669 5.167 4.527 -0.320 -0.163 0.327 78 F C -2.308 173.145 175.800 -0.579 0.000 1.103 78 F CA -1.871 55.917 58.000 -0.353 0.000 0.949 78 F CB 3.865 42.871 39.000 0.009 0.000 1.142 78 F HN 0.168 8.391 8.300 -0.129 0.000 0.457 79 F N 5.530 125.024 119.950 -0.761 0.000 2.646 79 F HA 0.411 4.793 4.527 -0.435 -0.116 0.364 79 F C -0.836 174.406 175.800 -0.930 0.000 1.137 79 F CA -1.475 56.148 58.000 -0.628 0.000 1.085 79 F CB 1.796 40.578 39.000 -0.364 0.000 1.331 79 F HN 0.664 8.527 8.300 -0.728 0.000 0.472 80 G N 0.613 108.909 108.800 -0.841 0.000 2.528 80 G HA2 0.077 3.824 3.960 -0.616 0.000 0.289 80 G HA3 0.077 3.847 3.960 -0.318 0.000 0.289 80 G C -0.711 174.062 174.900 -0.212 0.000 1.192 80 G CA -1.202 43.581 45.100 -0.528 0.000 0.921 80 G HN 0.806 8.592 8.290 -0.667 0.104 0.512 81 N N -1.665 116.958 118.700 -0.129 0.000 2.747 81 N HA -0.492 4.429 4.740 -0.045 -0.208 0.249 81 N C -1.431 173.969 175.510 -0.184 0.000 1.107 81 N CA 1.272 54.261 53.050 -0.101 0.000 0.707 81 N CB -0.366 38.067 38.487 -0.090 0.000 1.054 81 N HN 0.042 8.248 8.380 -0.101 0.114 0.555 82 V N -2.135 117.685 119.914 -0.157 0.000 2.350 82 V HA 0.106 4.070 4.120 -0.260 0.000 0.285 82 V C -0.926 175.196 176.094 0.047 0.000 1.014 82 V CA -1.410 60.803 62.300 -0.144 0.000 0.831 82 V CB 0.899 32.598 31.823 -0.207 0.000 1.000 82 V HN -0.160 7.918 8.190 -0.147 0.024 0.433 83 V N 9.112 129.213 119.914 0.312 0.000 2.318 83 V HA 0.095 4.283 4.120 0.115 0.000 0.271 83 V C -0.916 175.234 176.094 0.093 0.000 1.030 83 V CA -1.561 60.843 62.300 0.172 0.000 0.844 83 V CB 0.272 32.169 31.823 0.123 0.000 1.015 83 V HN 0.192 8.860 8.190 0.796 0.000 0.460 84 V N 7.946 127.903 119.914 0.071 0.000 2.521 84 V HA -0.186 4.131 4.120 0.067 -0.157 0.286 84 V C 0.989 177.121 176.094 0.065 0.000 1.034 84 V CA 0.493 62.842 62.300 0.082 0.000 1.045 84 V CB -0.765 31.138 31.823 0.133 0.000 0.974 84 V HN 0.465 8.698 8.190 0.071 0.000 0.480 85 G N 7.783 116.606 108.800 0.039 0.000 2.213 85 G HA2 -0.305 3.826 3.960 0.006 0.000 0.226 85 G HA3 -0.305 3.650 3.960 -0.009 0.000 0.226 85 G C -1.324 173.542 174.900 -0.057 0.000 0.992 85 G CA 0.344 45.442 45.100 -0.003 0.000 0.632 85 G HN 0.584 8.904 8.290 0.050 0.000 0.511 86 E N 0.362 120.497 120.200 -0.109 0.000 2.538 86 E HA 0.054 4.287 4.350 -0.196 0.000 0.188 86 E C 0.589 177.012 176.600 -0.295 0.000 1.014 86 E CA 0.175 56.426 56.400 -0.249 0.000 1.140 86 E CB 1.269 30.729 29.700 -0.400 0.000 1.262 86 E HN -0.287 7.961 8.360 -0.085 0.062 0.488 87 H N -1.811 117.211 119.070 -0.079 0.000 2.403 87 H HA -0.104 4.378 4.556 -0.123 0.000 0.298 87 H C -0.282 174.945 175.328 -0.168 0.000 1.059 87 H CA 3.057 59.023 56.048 -0.135 0.000 1.363 87 H CB 1.516 31.170 29.762 -0.180 0.000 1.410 87 H HN -0.290 7.819 8.280 -0.285 0.000 0.528 88 V N -7.792 112.110 119.914 -0.019 0.000 3.007 88 V HA 0.806 5.083 4.120 0.049 -0.128 0.311 88 V C -2.035 174.121 176.094 0.103 0.000 1.120 88 V CA -3.246 59.062 62.300 0.013 0.000 0.980 88 V CB 3.131 34.888 31.823 -0.110 0.000 1.033 88 V HN -0.901 7.294 8.190 0.007 0.000 0.429 89 Q N 1.869 121.778 119.800 0.182 0.000 2.257 89 Q HA 0.685 5.092 4.340 0.112 0.000 0.262 89 Q C -1.183 174.935 176.000 0.197 0.000 0.997 89 Q CA -3.369 52.523 55.803 0.149 0.000 0.873 89 Q CB 0.433 29.238 28.738 0.113 0.000 1.312 89 Q HN 0.138 8.861 8.270 0.254 -0.300 0.450 90 P HA -0.111 4.512 4.420 0.338 0.000 0.216 90 P C 1.359 178.766 177.300 0.179 0.000 1.153 90 P CA 3.042 66.275 63.100 0.221 0.000 0.858 90 P CB 0.243 32.001 31.700 0.097 0.000 0.789 91 G N -5.603 103.269 108.800 0.120 0.000 2.471 91 G HA2 -0.157 3.856 3.960 0.088 0.000 0.219 91 G HA3 -0.157 3.846 3.960 0.072 0.000 0.219 91 G C 1.123 176.081 174.900 0.097 0.000 1.125 91 G CA 1.441 46.597 45.100 0.094 0.000 0.775 91 G HN 0.350 8.700 8.290 0.100 0.000 0.548 92 E N 1.456 121.737 120.200 0.136 0.000 2.086 92 E HA -0.139 4.220 4.350 0.014 0.000 0.190 92 E C 2.640 179.288 176.600 0.079 0.000 0.975 92 E CA 1.975 58.435 56.400 0.100 0.000 0.813 92 E CB -0.053 29.811 29.700 0.273 0.000 0.768 92 E HN -0.655 7.678 8.360 0.170 0.129 0.457 93 L N -0.720 120.647 121.223 0.240 0.000 2.083 93 L HA -0.343 4.219 4.340 0.370 0.000 0.209 93 L C 1.713 178.751 176.870 0.280 0.000 1.083 93 L CA 2.822 57.844 54.840 0.303 0.000 0.752 93 L CB -0.148 42.065 42.059 0.255 0.000 0.899 93 L HN -0.400 7.996 8.230 0.276 0.000 0.433 94 S N -2.805 113.020 115.700 0.209 0.000 2.447 94 S HA -0.349 4.260 4.470 0.232 0.000 0.233 94 S C 1.870 176.572 174.600 0.170 0.000 1.006 94 S CA 3.043 61.360 58.200 0.195 0.000 0.957 94 S CB -0.232 63.058 63.200 0.150 0.000 0.773 94 S HN -0.107 8.318 8.310 0.191 0.000 0.507 95 E N 0.096 120.362 120.200 0.110 0.000 2.230 95 E HA -0.135 4.264 4.350 0.082 0.000 0.192 95 E C 1.159 177.834 176.600 0.125 0.000 0.987 95 E CA 1.654 58.098 56.400 0.072 0.000 0.841 95 E CB -0.280 29.409 29.700 -0.018 0.000 0.783 95 E HN -0.553 7.732 8.360 0.084 0.125 0.481 96 R N -3.147 117.379 120.500 0.044 0.000 2.312 96 R HA -0.024 4.264 4.340 -0.087 0.000 0.205 96 R C -0.599 175.498 176.300 -0.340 0.000 0.904 96 R CA 0.648 56.651 56.100 -0.161 0.000 1.052 96 R CB 1.687 31.703 30.300 -0.473 0.000 1.014 96 R HN -0.837 7.361 8.270 0.055 0.106 0.503 97 Y N -4.667 115.748 120.300 0.192 0.000 2.545 97 Y HA 0.123 4.813 4.550 0.233 0.000 0.348 97 Y C -1.765 174.380 175.900 0.408 0.000 1.002 97 Y CA -0.819 57.436 58.100 0.258 0.000 1.039 97 Y CB 2.781 41.331 38.460 0.150 0.000 1.271 97 Y HN -0.827 7.677 8.280 0.372 0.000 0.467 98 D N 0.566 121.336 120.400 0.617 0.000 2.144 98 D HA -0.207 4.670 4.640 0.396 0.000 0.199 98 D C -0.276 176.197 176.300 0.288 0.000 0.984 98 D CA 2.853 57.112 54.000 0.432 0.000 0.834 98 D CB 0.908 41.963 40.800 0.425 0.000 0.955 98 D HN 0.021 8.797 8.370 0.676 0.000 0.465 99 A N -5.652 117.342 122.820 0.290 0.000 2.594 99 A HA 0.522 5.174 4.320 0.280 -0.164 0.295 99 A C -2.496 175.203 177.584 0.192 0.000 1.071 99 A CA -1.137 51.051 52.037 0.251 0.000 0.685 99 A CB 3.613 22.729 19.000 0.193 0.000 1.285 99 A HN -0.829 7.521 8.150 0.334 0.000 0.405 100 V N -0.264 119.769 119.914 0.197 0.000 2.588 100 V HA 0.769 5.027 4.120 -0.104 -0.201 0.304 100 V C -1.604 174.534 176.094 0.072 0.000 1.042 100 V CA -1.902 60.411 62.300 0.022 0.000 0.877 100 V CB 3.028 34.857 31.823 0.011 0.000 0.996 100 V HN 0.071 8.436 8.190 0.291 0.000 0.425 101 I N 5.488 125.996 120.570 -0.104 0.000 2.355 101 I HA 0.178 4.596 4.170 0.174 -0.144 0.288 101 I C -1.459 174.525 176.117 -0.222 0.000 0.999 101 I CA -1.068 60.222 61.300 -0.016 0.000 1.163 101 I CB 1.526 39.519 38.000 -0.011 0.000 1.316 101 I HN 0.692 8.781 8.210 -0.201 0.000 0.454 102 Y N 7.474 127.824 120.300 0.083 0.000 2.404 102 Y HA -0.006 4.570 4.550 0.044 0.000 0.344 102 Y C -1.276 174.670 175.900 0.077 0.000 0.995 102 Y CA -0.109 58.032 58.100 0.068 0.000 1.201 102 Y CB 0.548 39.056 38.460 0.080 0.000 1.151 102 Y HN 0.798 9.168 8.280 0.326 0.106 0.517 103 A N 4.204 127.093 122.820 0.114 0.000 2.959 103 A HA 0.538 5.104 4.320 0.131 -0.168 0.280 103 A C -0.787 176.859 177.584 0.104 0.000 0.953 103 A CA -0.939 51.154 52.037 0.094 0.000 1.047 103 A CB 0.730 19.736 19.000 0.010 0.000 1.147 103 A HN 0.706 8.889 8.150 0.055 0.000 0.489 104 V N -2.649 117.368 119.914 0.172 0.000 3.541 104 V HA 0.020 4.222 4.120 0.137 0.000 0.267 104 V C 0.268 176.475 176.094 0.188 0.000 1.213 104 V CA -1.167 61.237 62.300 0.174 0.000 1.149 104 V CB -0.410 31.541 31.823 0.213 0.000 0.822 104 V HN -0.002 8.318 8.190 0.217 0.000 0.462 105 G N 0.225 109.149 108.800 0.207 0.000 2.601 105 G HA2 -0.313 3.831 3.960 0.307 0.000 0.261 105 G HA3 -0.313 3.768 3.960 0.201 0.000 0.261 105 G C -1.931 173.174 174.900 0.342 0.000 1.289 105 G CA 0.029 45.286 45.100 0.262 0.000 0.920 105 G HN -0.101 8.267 8.290 0.205 0.045 0.571 106 A N -1.034 122.043 122.820 0.429 0.000 2.360 106 A HA 0.263 4.804 4.320 0.368 0.000 0.309 106 A C -0.466 177.377 177.584 0.432 0.000 1.311 106 A CA -0.816 51.486 52.037 0.442 0.000 0.805 106 A CB 0.833 20.152 19.000 0.533 0.000 1.144 106 A HN -0.003 8.421 8.150 0.457 0.000 0.486 107 Q N 2.672 122.660 119.800 0.312 0.000 2.392 107 Q HA 0.022 4.555 4.340 0.321 0.000 0.203 107 Q C 0.439 176.571 176.000 0.220 0.000 0.917 107 Q CA 0.418 56.389 55.803 0.280 0.000 0.939 107 Q CB 0.370 29.251 28.738 0.238 0.000 1.063 107 Q HN 0.355 8.791 8.270 0.276 0.000 0.516 108 S N -2.008 113.793 115.700 0.168 0.000 2.874 108 S HA 0.195 4.715 4.470 0.083 0.000 0.318 108 S C -2.066 172.522 174.600 -0.020 0.000 1.109 108 S CA -1.469 56.779 58.200 0.081 0.000 0.878 108 S CB 1.316 64.568 63.200 0.087 0.000 1.307 108 S HN -0.189 8.198 8.310 0.198 0.041 0.592 109 D N -1.987 118.391 120.400 -0.037 0.000 2.433 109 D HA 0.268 4.826 4.640 -0.136 0.000 0.236 109 D C -0.905 175.390 176.300 -0.009 0.000 1.026 109 D CA -1.080 52.869 54.000 -0.085 0.000 0.884 109 D CB 2.957 43.686 40.800 -0.119 0.000 1.384 109 D HN -0.114 8.254 8.370 -0.003 0.000 0.477 110 R N 0.008 120.508 120.500 -0.000 0.000 2.490 110 R HA 0.119 4.472 4.340 0.021 0.000 0.280 110 R C -0.264 176.036 176.300 0.000 0.000 1.077 110 R CA -0.064 56.044 56.100 0.012 0.000 1.065 110 R CB 1.116 31.426 30.300 0.018 0.000 1.003 110 R HN 0.073 8.342 8.270 -0.002 0.000 0.470 111 M N 1.884 121.487 119.600 0.004 0.000 2.444 111 M HA -0.012 4.538 4.480 -0.006 -0.073 0.319 111 M C 0.298 176.597 176.300 -0.001 0.000 1.183 111 M CA 0.133 55.432 55.300 -0.001 0.000 1.032 111 M CB 1.933 34.534 32.600 0.002 0.000 1.569 111 M HN 0.221 8.516 8.290 0.010 0.000 0.468 112 L N 0.792 122.012 121.223 -0.005 0.000 2.240 112 L HA -0.149 4.189 4.340 -0.004 0.000 0.211 112 L C 0.353 177.220 176.870 -0.004 0.000 1.106 112 L CA 1.203 56.039 54.840 -0.005 0.000 0.793 112 L CB 0.366 42.419 42.059 -0.009 0.000 0.927 112 L HN 0.465 9.150 8.230 -0.008 -0.460 0.446 113 N N -3.303 115.394 118.700 -0.004 0.000 2.708 113 N HA -0.355 4.383 4.740 -0.003 0.000 0.255 113 N C -1.331 174.176 175.510 -0.005 0.000 1.046 113 N CA 1.423 54.471 53.050 -0.003 0.000 0.715 113 N CB -2.334 36.152 38.487 -0.001 0.000 0.895 113 N HN -0.332 8.271 8.380 -0.004 -0.225 0.545 114 I N -7.099 113.467 120.570 -0.007 0.000 2.934 114 I HA 0.637 4.804 4.170 -0.006 0.000 0.306 114 I C -2.836 173.276 176.117 -0.009 0.000 1.110 114 I CA -3.262 58.033 61.300 -0.008 0.000 1.019 114 I CB 1.974 39.969 38.000 -0.009 0.000 1.227 114 I HN -0.905 7.465 8.210 -0.008 -0.165 0.434 115 P HA 0.014 4.428 4.420 -0.010 0.000 0.268 115 P C 0.263 177.556 177.300 -0.013 0.000 1.205 115 P CA 0.838 63.932 63.100 -0.010 0.000 0.771 115 P CB -0.124 31.570 31.700 -0.009 0.000 0.858 116 G N 3.073 111.864 108.800 -0.014 0.000 2.179 116 G HA2 -0.498 3.452 3.960 -0.017 0.000 0.260 116 G HA3 -0.498 3.699 3.960 -0.017 -0.248 0.260 116 G C 1.084 175.973 174.900 -0.020 0.000 0.977 116 G CA 0.915 46.005 45.100 -0.017 0.000 0.641 116 G HN 0.604 8.886 8.290 -0.013 0.000 0.533 117 E N 0.478 120.667 120.200 -0.018 0.000 2.265 117 E HA -0.347 3.989 4.350 -0.023 0.000 0.196 117 E C -0.341 176.246 176.600 -0.021 0.000 0.996 117 E CA 2.354 58.742 56.400 -0.020 0.000 0.832 117 E CB 0.104 29.794 29.700 -0.016 0.000 0.756 117 E HN -0.691 7.604 8.360 -0.016 0.055 0.491 118 D N -5.321 115.067 120.400 -0.019 0.000 2.340 118 D HA -0.124 4.505 4.640 -0.019 0.000 0.220 118 D C 0.248 176.534 176.300 -0.023 0.000 1.039 118 D CA -0.256 53.732 54.000 -0.019 0.000 0.866 118 D CB -0.812 39.979 40.800 -0.016 0.000 0.913 118 D HN -0.045 8.278 8.370 -0.018 0.037 0.523 119 L N 1.909 123.117 121.223 -0.025 0.000 2.456 119 L HA 0.098 4.423 4.340 -0.025 0.000 0.272 119 L C -1.508 175.342 176.870 -0.033 0.000 1.189 119 L CA -1.021 53.803 54.840 -0.027 0.000 0.846 119 L CB -0.491 41.551 42.059 -0.027 0.000 1.111 119 L HN -0.633 7.432 8.230 -0.025 0.150 0.475 120 P HA -0.026 4.367 4.420 -0.045 0.000 0.262 120 P C -0.213 177.058 177.300 -0.049 0.000 1.182 120 P CA 1.160 64.235 63.100 -0.042 0.000 0.761 120 P CB 0.173 31.850 31.700 -0.037 0.000 0.795 121 G N 1.444 110.206 108.800 -0.063 0.000 2.194 121 G HA2 -0.454 3.455 3.960 -0.086 0.000 0.236 121 G HA3 -0.454 3.467 3.960 -0.065 0.000 0.236 121 G C -1.270 173.584 174.900 -0.077 0.000 0.987 121 G CA 0.239 45.295 45.100 -0.073 0.000 0.635 121 G HN 0.531 8.780 8.290 -0.068 0.000 0.520 122 S N 2.129 117.791 115.700 -0.063 0.000 2.498 122 S HA 0.933 5.563 4.470 -0.069 -0.201 0.324 122 S C -0.070 174.498 174.600 -0.053 0.000 1.071 122 S CA -1.444 56.721 58.200 -0.059 0.000 1.113 122 S CB 0.997 64.170 63.200 -0.045 0.000 0.976 122 S HN -0.479 7.739 8.310 -0.055 0.059 0.462 123 I N 1.018 121.552 120.570 -0.061 0.000 3.174 123 I HA 0.501 4.653 4.170 -0.030 0.000 0.313 123 I C -2.935 173.159 176.117 -0.037 0.000 1.155 123 I CA -2.284 58.991 61.300 -0.042 0.000 0.977 123 I CB 4.379 42.356 38.000 -0.039 0.000 1.248 123 I HN 0.411 8.576 8.210 -0.075 0.000 0.453 124 A N -1.392 121.413 122.820 -0.025 0.000 2.279 124 A HA 0.583 5.025 4.320 -0.035 -0.143 0.303 124 A C 0.097 177.670 177.584 -0.019 0.000 1.108 124 A CA -2.239 49.775 52.037 -0.039 0.000 0.830 124 A CB 2.221 21.177 19.000 -0.074 0.000 1.106 124 A HN 0.140 8.598 8.150 -0.017 -0.319 0.493 125 A N 1.050 123.868 122.820 -0.002 0.000 1.978 125 A HA -0.236 4.188 4.320 0.175 0.000 0.220 125 A C 1.916 179.468 177.584 -0.054 0.000 1.170 125 A CA 3.299 55.383 52.037 0.078 0.000 0.636 125 A CB -0.593 18.502 19.000 0.159 0.000 0.810 125 A HN 0.543 8.691 8.150 -0.004 0.000 0.448 126 V N -1.701 118.026 119.914 -0.312 0.000 2.282 126 V HA -0.424 3.321 4.120 -0.625 0.000 0.249 126 V C 1.672 177.400 176.094 -0.609 0.000 1.057 126 V CA 4.157 66.098 62.300 -0.599 0.000 1.032 126 V CB -1.033 30.345 31.823 -0.741 0.000 0.645 126 V HN 0.160 8.145 8.190 -0.331 0.007 0.447 127 D N 0.143 120.322 120.400 -0.368 0.000 2.084 127 D HA -0.269 4.086 4.640 -0.474 0.000 0.194 127 D C 2.528 178.762 176.300 -0.111 0.000 0.990 127 D CA 3.236 57.082 54.000 -0.256 0.000 0.826 127 D CB -0.506 40.319 40.800 0.041 0.000 0.971 127 D HN -0.751 7.487 8.370 -0.220 0.000 0.453 128 F N 1.568 121.440 119.950 -0.129 0.000 2.102 128 F HA -0.388 4.216 4.527 0.129 0.000 0.298 128 F C 1.358 177.084 175.800 -0.123 0.000 1.105 128 F CA 3.021 61.038 58.000 0.028 0.000 1.239 128 F CB 0.222 39.272 39.000 0.083 0.000 0.991 128 F HN -0.441 7.951 8.300 0.152 0.000 0.474 129 V N -1.376 118.262 119.914 -0.460 0.000 2.295 129 V HA -0.562 2.174 4.120 -2.307 0.000 0.246 129 V C 2.217 177.878 176.094 -0.722 0.000 1.049 129 V CA 4.650 66.327 62.300 -1.039 0.000 1.024 129 V CB -1.007 30.569 31.823 -0.413 0.000 0.648 129 V HN 0.355 8.435 8.190 -0.183 0.000 0.447 130 G N -1.293 107.197 108.800 -0.518 0.000 2.440 130 G HA2 -0.338 3.523 3.960 -0.164 0.000 0.218 130 G HA3 -0.338 3.166 3.960 -0.759 0.000 0.218 130 G C 0.637 175.569 174.900 0.055 0.000 1.154 130 G CA 2.071 46.963 45.100 -0.345 0.000 0.767 130 G HN -0.248 7.672 8.290 -0.615 0.000 0.552 131 W N 4.127 125.361 121.300 -0.112 0.000 2.355 131 W HA -0.272 4.659 4.660 0.289 -0.097 0.309 131 W C 1.736 178.365 176.519 0.183 0.000 1.206 131 W CA 3.682 61.103 57.345 0.126 0.000 1.284 131 W CB 0.255 29.762 29.460 0.079 0.000 1.145 131 W HN -0.171 8.079 8.180 0.117 0.000 0.502 132 Y N -4.667 115.535 120.300 -0.164 0.000 2.509 132 Y HA -0.176 3.919 4.550 -0.760 0.000 0.293 132 Y C 1.158 176.891 175.900 -0.277 0.000 1.133 132 Y CA -0.398 57.433 58.100 -0.448 0.000 1.283 132 Y CB -1.446 36.745 38.460 -0.448 0.000 1.001 132 Y HN 0.042 8.199 8.280 -0.204 0.000 0.555 133 N N 0.167 118.869 118.700 0.003 0.000 2.268 133 N HA 0.114 4.907 4.740 0.088 0.000 0.204 133 N C -1.326 174.208 175.510 0.039 0.000 1.124 133 N CA -0.537 52.547 53.050 0.057 0.000 0.838 133 N CB 0.525 39.052 38.487 0.067 0.000 0.994 133 N HN -0.334 7.938 8.380 -0.137 0.025 0.489 134 A N -3.336 119.493 122.820 0.016 0.000 2.872 134 A HA -0.476 3.907 4.320 0.105 0.000 0.273 134 A C -1.433 176.257 177.584 0.176 0.000 1.442 134 A CA 1.190 53.262 52.037 0.059 0.000 0.801 134 A CB -2.260 16.707 19.000 -0.056 0.000 1.031 134 A HN -0.678 7.305 8.150 -0.014 0.159 0.582 135 H N 0.522 119.688 119.070 0.160 0.000 2.929 135 H HA 0.102 4.730 4.556 0.119 0.000 0.317 135 H C -0.637 174.833 175.328 0.236 0.000 1.031 135 H CA -0.078 56.088 56.048 0.197 0.000 1.466 135 H CB 1.143 31.095 29.762 0.316 0.000 1.482 135 H HN -0.298 8.168 8.280 0.356 0.027 0.561 136 P HA -0.045 4.746 4.420 0.254 -0.219 0.222 136 P C 1.147 178.687 177.300 0.399 0.000 1.147 136 P CA 1.871 65.138 63.100 0.279 0.000 0.790 136 P CB 0.320 32.107 31.700 0.145 0.000 0.780 137 H N -1.502 117.768 119.070 0.332 0.000 2.555 137 H HA -0.099 4.372 4.556 -0.142 0.000 0.269 137 H C 0.844 175.830 175.328 -0.570 0.000 0.988 137 H CA 1.024 56.949 56.048 -0.206 0.000 1.178 137 H CB 0.312 29.792 29.762 -0.470 0.000 1.373 137 H HN -0.502 8.324 8.280 0.953 0.026 0.588 138 F N -4.161 115.955 119.950 0.277 0.000 2.735 138 F HA 0.296 4.910 4.527 0.146 0.000 0.308 138 F C -0.294 175.669 175.800 0.272 0.000 1.112 138 F CA -1.194 56.928 58.000 0.203 0.000 1.235 138 F CB 0.399 39.493 39.000 0.158 0.000 1.027 138 F HN -0.323 8.165 8.300 0.415 0.061 0.528 139 E N 1.285 121.676 120.200 0.318 0.000 2.153 139 E HA -0.366 4.133 4.350 0.249 0.000 0.194 139 E C -0.260 176.431 176.600 0.152 0.000 0.988 139 E CA 3.319 59.858 56.400 0.232 0.000 0.811 139 E CB 0.137 29.948 29.700 0.184 0.000 0.746 139 E HN -0.533 7.980 8.360 0.255 0.000 0.466 140 Q N -3.869 116.007 119.800 0.127 0.000 2.220 140 Q HA -0.082 4.284 4.340 0.043 0.000 0.205 140 Q C 0.642 176.638 176.000 -0.007 0.000 0.865 140 Q CA -0.101 55.732 55.803 0.051 0.000 0.960 140 Q CB -0.987 27.766 28.738 0.024 0.000 1.097 140 Q HN -0.118 8.202 8.270 0.124 0.025 0.493 141 V N 0.136 120.046 119.914 -0.006 0.000 2.295 141 V HA -0.390 3.687 4.120 -0.073 0.000 0.246 141 V C -0.113 175.739 176.094 -0.404 0.000 1.049 141 V CA 2.567 64.771 62.300 -0.160 0.000 1.024 141 V CB -0.106 31.666 31.823 -0.086 0.000 0.648 141 V HN -0.770 7.448 8.190 0.133 0.052 0.447 142 S N -3.296 111.947 115.700 -0.763 0.000 3.405 142 S HA -0.203 3.898 4.470 -0.616 0.000 0.373 142 S C -1.713 172.614 174.600 -0.454 0.000 0.939 142 S CA -0.322 57.554 58.200 -0.540 0.000 1.295 142 S CB -0.722 62.396 63.200 -0.137 0.000 0.919 142 S HN 0.055 7.691 8.310 -1.122 0.000 0.535 143 P HA 0.027 4.300 4.420 -0.245 0.000 0.274 143 P C -1.435 175.758 177.300 -0.179 0.000 1.231 143 P CA -0.479 62.423 63.100 -0.330 0.000 0.790 143 P CB 0.666 32.185 31.700 -0.302 0.000 0.951 144 D N 0.390 120.729 120.400 -0.101 0.000 2.336 144 D HA -0.010 4.619 4.640 -0.017 0.000 0.249 144 D C -0.039 176.248 176.300 -0.021 0.000 1.213 144 D CA -0.224 53.752 54.000 -0.040 0.000 0.870 144 D CB -0.393 40.386 40.800 -0.036 0.000 1.076 144 D HN 0.174 8.481 8.370 -0.105 0.000 0.483 145 L N 5.332 126.572 121.223 0.029 0.000 2.872 145 L HA 0.246 4.600 4.340 0.024 0.000 0.245 145 L C 0.369 177.266 176.870 0.045 0.000 1.211 145 L CA -0.765 54.108 54.840 0.054 0.000 1.013 145 L CB -0.977 41.169 42.059 0.145 0.000 1.326 145 L HN 0.318 8.579 8.230 0.051 0.000 0.525 146 S N -0.409 115.306 115.700 0.026 0.000 2.503 146 S HA -0.063 4.426 4.470 0.032 0.000 0.217 146 S C 0.802 175.408 174.600 0.009 0.000 0.999 146 S CA 0.652 58.865 58.200 0.023 0.000 0.914 146 S CB 0.587 63.800 63.200 0.021 0.000 0.782 146 S HN -0.542 8.006 8.310 0.017 -0.228 0.520 147 G N -0.481 108.318 108.800 -0.002 0.000 2.476 147 G HA2 0.026 3.982 3.960 -0.007 0.000 0.269 147 G HA3 0.026 4.067 3.960 -0.016 -0.091 0.269 147 G C -0.288 174.606 174.900 -0.010 0.000 1.195 147 G CA -1.219 43.875 45.100 -0.009 0.000 0.843 147 G HN -0.673 7.613 8.290 -0.006 0.000 0.545 148 A N 1.561 124.374 122.820 -0.011 0.000 2.015 148 A HA -0.041 4.456 4.320 -0.007 -0.181 0.219 148 A C 0.095 177.668 177.584 -0.019 0.000 1.163 148 A CA 1.468 53.498 52.037 -0.011 0.000 0.646 148 A CB 0.688 19.683 19.000 -0.008 0.000 0.806 148 A HN 0.508 8.663 8.150 -0.011 -0.011 0.448 149 R N -1.896 118.588 120.500 -0.027 0.000 2.561 149 R HA 0.783 5.297 4.340 -0.038 -0.197 0.297 149 R C -2.598 173.671 176.300 -0.052 0.000 0.969 149 R CA -1.453 54.625 56.100 -0.038 0.000 0.879 149 R CB 3.578 33.857 30.300 -0.036 0.000 1.178 149 R HN -0.243 8.355 8.270 -0.027 -0.344 0.445 150 A N 6.272 129.052 122.820 -0.066 0.000 2.355 150 A HA 0.922 5.356 4.320 -0.090 -0.168 0.324 150 A C -2.492 175.034 177.584 -0.095 0.000 1.117 150 A CA -2.410 49.574 52.037 -0.090 0.000 0.785 150 A CB 3.648 22.582 19.000 -0.110 0.000 1.254 150 A HN 0.632 8.744 8.150 -0.064 0.000 0.453 151 V N 1.383 121.237 119.914 -0.100 0.000 2.495 151 V HA 0.654 4.881 4.120 -0.102 -0.168 0.298 151 V C -1.507 174.526 176.094 -0.101 0.000 1.031 151 V CA -1.695 60.547 62.300 -0.096 0.000 0.871 151 V CB 2.883 34.660 31.823 -0.076 0.000 0.988 151 V HN 0.428 8.557 8.190 -0.102 0.000 0.432 152 V N 7.685 127.539 119.914 -0.101 0.000 2.409 152 V HA 0.615 4.905 4.120 -0.075 -0.215 0.291 152 V C -0.891 175.169 176.094 -0.056 0.000 1.020 152 V CA -1.991 60.263 62.300 -0.077 0.000 0.848 152 V CB 1.922 33.704 31.823 -0.068 0.000 0.990 152 V HN 0.754 8.876 8.190 -0.113 0.000 0.430 153 I N 6.016 126.566 120.570 -0.034 0.000 2.331 153 I HA 0.346 4.633 4.170 -0.029 -0.135 0.292 153 I C -0.141 175.980 176.117 0.007 0.000 0.998 153 I CA -2.513 58.775 61.300 -0.020 0.000 1.267 153 I CB -0.830 37.158 38.000 -0.019 0.000 1.386 153 I HN 0.267 8.458 8.210 -0.032 0.000 0.476 154 G N 7.805 116.612 108.800 0.010 0.000 2.428 154 G HA2 -0.194 3.769 3.960 0.005 0.000 0.681 154 G HA3 -0.194 3.980 3.960 0.036 -0.193 0.681 154 G C -2.769 172.154 174.900 0.038 0.000 1.340 154 G CA -0.135 44.978 45.100 0.022 0.000 0.915 154 G HN 0.514 8.804 8.290 -0.001 0.000 0.645 155 N N -0.274 118.386 118.700 -0.067 0.000 2.517 155 N HA 0.189 4.790 4.740 -0.232 0.000 0.285 155 N C -1.072 174.036 175.510 -0.669 0.000 1.528 155 N CA -0.633 52.179 53.050 -0.397 0.000 0.892 155 N CB 1.231 39.474 38.487 -0.406 0.000 1.356 155 N HN 0.265 8.597 8.380 -0.079 0.000 0.495 156 G N -0.816 107.909 108.800 -0.126 0.000 2.552 156 G HA2 0.318 4.241 3.960 -0.062 0.000 0.324 156 G HA3 0.318 4.311 3.960 0.055 0.000 0.324 156 G C -0.619 174.487 174.900 0.344 0.000 1.217 156 G CA -1.875 43.245 45.100 0.033 0.000 0.989 156 G HN -0.241 8.059 8.290 0.016 0.000 0.490 157 N N -0.745 118.145 118.700 0.316 0.000 2.364 157 N HA -0.246 4.744 4.740 0.417 0.000 0.183 157 N C 1.734 177.395 175.510 0.251 0.000 1.022 157 N CA 2.615 55.857 53.050 0.320 0.000 0.883 157 N CB -0.574 38.044 38.487 0.217 0.000 0.965 157 N HN 0.416 8.936 8.380 0.234 0.000 0.438 158 V N -0.667 119.387 119.914 0.233 0.000 2.427 158 V HA -0.418 3.838 4.120 0.227 0.000 0.248 158 V C 1.535 177.779 176.094 0.249 0.000 1.051 158 V CA 3.891 66.335 62.300 0.239 0.000 1.048 158 V CB -0.874 31.109 31.823 0.266 0.000 0.666 158 V HN -0.060 8.244 8.190 0.219 0.017 0.456 159 A N 0.159 123.130 122.820 0.252 0.000 1.940 159 A HA -0.327 4.101 4.320 0.179 0.000 0.219 159 A C 2.106 179.802 177.584 0.187 0.000 1.176 159 A CA 3.176 55.344 52.037 0.219 0.000 0.631 159 A CB -0.855 18.296 19.000 0.252 0.000 0.814 159 A HN -0.552 7.758 8.150 0.266 0.000 0.446 160 L N -2.330 119.024 121.223 0.218 0.000 2.056 160 L HA -0.442 3.931 4.340 0.055 0.000 0.207 160 L C 2.124 179.072 176.870 0.131 0.000 1.078 160 L CA 2.950 57.862 54.840 0.119 0.000 0.749 160 L CB -0.609 41.505 42.059 0.092 0.000 0.901 160 L HN -0.655 7.668 8.230 0.293 0.083 0.433 161 D N -0.792 119.713 120.400 0.176 0.000 2.104 161 D HA -0.317 4.422 4.640 0.165 0.000 0.194 161 D C 2.564 179.020 176.300 0.260 0.000 0.994 161 D CA 3.492 57.616 54.000 0.206 0.000 0.830 161 D CB -0.606 40.349 40.800 0.258 0.000 0.959 161 D HN -0.486 7.998 8.370 0.189 0.000 0.452 162 V N -0.453 119.654 119.914 0.322 0.000 2.287 162 V HA -0.491 4.028 4.120 0.666 0.000 0.248 162 V C 1.986 178.226 176.094 0.243 0.000 1.053 162 V CA 4.224 66.772 62.300 0.412 0.000 1.027 162 V CB -0.625 31.387 31.823 0.314 0.000 0.646 162 V HN -0.252 8.117 8.190 0.297 0.000 0.447 163 A N -1.500 121.386 122.820 0.111 0.000 1.902 163 A HA -0.350 3.974 4.320 0.006 0.000 0.217 163 A C 2.229 179.837 177.584 0.039 0.000 1.181 163 A CA 3.126 55.177 52.037 0.024 0.000 0.623 163 A CB -0.613 18.347 19.000 -0.068 0.000 0.818 163 A HN -0.345 7.866 8.150 0.102 0.000 0.443 164 R N -2.567 117.968 120.500 0.059 0.000 2.081 164 R HA -0.341 4.017 4.340 0.031 0.000 0.235 164 R C 2.489 178.808 176.300 0.031 0.000 1.131 164 R CA 3.507 59.635 56.100 0.046 0.000 0.960 164 R CB -0.006 30.337 30.300 0.071 0.000 0.856 164 R HN -0.382 7.935 8.270 0.078 0.000 0.436 165 I N -1.481 119.105 120.570 0.026 0.000 2.394 165 I HA -0.318 3.792 4.170 -0.101 0.000 0.251 165 I C 1.608 177.766 176.117 0.067 0.000 1.136 165 I CA 2.075 63.341 61.300 -0.056 0.000 1.425 165 I CB -0.846 36.939 38.000 -0.358 0.000 1.079 165 I HN -0.309 7.937 8.210 0.061 0.000 0.425 166 L N -3.965 117.348 121.223 0.149 0.000 2.217 166 L HA -0.230 4.233 4.340 0.205 0.000 0.211 166 L C 0.980 177.892 176.870 0.070 0.000 1.107 166 L CA 2.152 57.078 54.840 0.143 0.000 0.783 166 L CB 0.272 42.385 42.059 0.091 0.000 0.919 166 L HN -0.588 7.728 8.230 0.159 0.010 0.442 167 L N -6.275 114.972 121.223 0.040 0.000 2.701 167 L HA 0.096 4.449 4.340 0.022 0.000 0.238 167 L C 0.059 176.939 176.870 0.016 0.000 1.106 167 L CA -0.563 54.289 54.840 0.021 0.000 0.898 167 L CB 1.262 43.323 42.059 0.004 0.000 1.188 167 L HN -0.896 7.219 8.230 0.039 0.138 0.508 168 T N 2.005 116.567 114.554 0.013 0.000 2.930 168 T HA -0.128 4.225 4.350 0.006 0.000 0.306 168 T C -0.497 174.204 174.700 0.002 0.000 1.045 168 T CA 2.137 64.239 62.100 0.004 0.000 1.134 168 T CB 0.618 69.480 68.868 -0.009 0.000 0.961 168 T HN -0.587 7.661 8.240 0.013 0.000 0.545 169 D N 6.256 126.657 120.400 0.001 0.000 2.520 169 D HA -0.105 4.536 4.640 0.002 0.000 0.243 169 D C 0.083 176.379 176.300 -0.006 0.000 1.160 169 D CA -1.139 52.860 54.000 -0.001 0.000 0.877 169 D CB 1.059 41.858 40.800 -0.002 0.000 1.150 169 D HN 0.406 8.778 8.370 0.002 0.000 0.494 170 P HA -0.174 4.239 4.420 -0.011 0.000 0.222 170 P C 0.745 178.037 177.300 -0.013 0.000 1.147 170 P CA 1.638 64.734 63.100 -0.006 0.000 0.790 170 P CB 0.240 31.943 31.700 0.005 0.000 0.780 171 D N -1.552 118.842 120.400 -0.010 0.000 2.219 171 D HA -0.209 4.423 4.640 -0.013 0.000 0.205 171 D C 1.620 177.911 176.300 -0.015 0.000 0.970 171 D CA 3.018 57.011 54.000 -0.012 0.000 0.851 171 D CB -0.651 40.144 40.800 -0.008 0.000 0.943 171 D HN -0.264 8.373 8.370 -0.007 -0.271 0.488 172 V N -1.187 118.717 119.914 -0.017 0.000 2.346 172 V HA -0.296 3.811 4.120 -0.020 0.000 0.244 172 V C 2.185 178.261 176.094 -0.030 0.000 1.037 172 V CA 3.202 65.489 62.300 -0.022 0.000 1.029 172 V CB 0.035 31.846 31.823 -0.021 0.000 0.663 172 V HN -0.501 7.569 8.190 -0.015 0.111 0.454 173 L N -0.843 120.359 121.223 -0.035 0.000 2.265 173 L HA -0.304 4.004 4.340 -0.054 0.000 0.215 173 L C 2.042 178.884 176.870 -0.047 0.000 1.117 173 L CA 2.702 57.513 54.840 -0.049 0.000 0.782 173 L CB -1.070 40.952 42.059 -0.062 0.000 0.914 173 L HN -0.572 7.639 8.230 -0.031 0.000 0.441 174 A N -2.920 119.878 122.820 -0.037 0.000 2.121 174 A HA -0.240 4.053 4.320 -0.045 0.000 0.218 174 A C 0.351 177.921 177.584 -0.024 0.000 1.154 174 A CA 2.061 54.077 52.037 -0.036 0.000 0.679 174 A CB -0.446 18.536 19.000 -0.030 0.000 0.795 174 A HN -0.287 7.819 8.150 -0.031 0.025 0.458 175 R N -6.219 114.268 120.500 -0.020 0.000 2.388 175 R HA 0.290 4.630 4.340 0.000 0.000 0.247 175 R C 0.008 176.299 176.300 -0.015 0.000 0.931 175 R CA -1.997 54.096 56.100 -0.011 0.000 1.082 175 R CB -0.418 29.875 30.300 -0.011 0.000 1.135 175 R HN -0.633 7.585 8.270 -0.024 0.038 0.525 176 T N -2.923 111.617 114.554 -0.023 0.000 2.919 176 T HA 0.216 4.558 4.350 -0.014 0.000 0.282 176 T C -0.920 173.769 174.700 -0.017 0.000 1.020 176 T CA -2.092 59.996 62.100 -0.021 0.000 0.994 176 T CB 2.851 71.700 68.868 -0.031 0.000 1.180 176 T HN -0.405 7.753 8.240 -0.030 0.063 0.566 177 D N 0.240 120.638 120.400 -0.004 0.000 2.325 177 D HA 0.038 4.824 4.640 -0.005 -0.149 0.234 177 D C -0.030 176.257 176.300 -0.022 0.000 1.122 177 D CA -1.487 52.513 54.000 0.000 0.000 0.850 177 D CB -1.323 39.496 40.800 0.033 0.000 0.921 177 D HN 0.304 8.677 8.370 0.005 0.000 0.513 178 I N -0.045 120.495 120.570 -0.050 0.000 2.932 178 I HA -0.442 3.693 4.170 -0.059 0.000 0.295 178 I C -0.841 175.178 176.117 -0.163 0.000 1.227 178 I CA 0.939 62.182 61.300 -0.095 0.000 1.429 178 I CB 1.006 38.927 38.000 -0.131 0.000 1.339 178 I HN -0.766 7.341 8.210 -0.049 0.074 0.589 179 A N 6.427 129.087 122.820 -0.267 0.000 2.540 179 A HA -0.218 3.872 4.320 -0.384 0.000 0.239 179 A C 0.299 177.611 177.584 -0.453 0.000 1.061 179 A CA 0.765 52.513 52.037 -0.481 0.000 0.758 179 A CB 0.646 19.088 19.000 -0.930 0.000 0.991 179 A HN 0.156 8.159 8.150 -0.244 0.000 0.502 180 D N 4.357 124.542 120.400 -0.358 0.000 2.149 180 D HA -0.405 4.138 4.640 -0.163 0.000 0.198 180 D C 1.268 177.470 176.300 -0.163 0.000 0.990 180 D CA 3.960 57.837 54.000 -0.205 0.000 0.839 180 D CB 0.160 40.891 40.800 -0.115 0.000 0.948 180 D HN 0.638 8.810 8.370 -0.331 0.000 0.460 181 H N -4.178 114.813 119.070 -0.131 0.000 2.421 181 H HA -0.172 4.390 4.556 0.010 0.000 0.298 181 H C 1.118 176.357 175.328 -0.149 0.000 1.087 181 H CA 2.095 58.097 56.048 -0.077 0.000 1.330 181 H CB -0.758 29.004 29.762 0.001 0.000 1.388 181 H HN 0.068 8.022 8.280 -0.544 0.000 0.526 182 A N 0.098 122.700 122.820 -0.365 0.000 1.897 182 A HA -0.275 3.765 4.320 -0.467 0.000 0.215 182 A C 1.519 179.050 177.584 -0.088 0.000 1.181 182 A CA 2.385 54.127 52.037 -0.492 0.000 0.620 182 A CB -0.333 18.162 19.000 -0.842 0.000 0.821 182 A HN -0.599 7.191 8.150 -0.601 0.000 0.443 183 L N -1.360 119.788 121.223 -0.124 0.000 2.042 183 L HA -0.445 3.870 4.340 -0.041 0.000 0.210 183 L C 1.850 178.731 176.870 0.019 0.000 1.076 183 L CA 3.098 57.907 54.840 -0.050 0.000 0.749 183 L CB -0.284 41.728 42.059 -0.079 0.000 0.893 183 L HN -0.271 7.842 8.230 -0.195 0.000 0.432 184 E N -2.096 118.128 120.200 0.041 0.000 2.085 184 E HA -0.384 3.998 4.350 0.053 0.000 0.194 184 E C 2.636 179.311 176.600 0.126 0.000 0.994 184 E CA 2.982 59.429 56.400 0.079 0.000 0.801 184 E CB -0.385 29.374 29.700 0.099 0.000 0.743 184 E HN -0.225 8.149 8.360 0.024 0.000 0.453 185 S N -1.293 114.531 115.700 0.208 0.000 2.453 185 S HA -0.175 4.418 4.470 0.206 0.000 0.231 185 S C 1.138 175.862 174.600 0.206 0.000 1.005 185 S CA 2.611 60.966 58.200 0.258 0.000 0.949 185 S CB 0.410 63.886 63.200 0.460 0.000 0.774 185 S HN -0.698 7.675 8.310 0.239 0.081 0.510 186 L N -1.503 119.824 121.223 0.173 0.000 2.375 186 L HA 0.017 4.446 4.340 0.148 0.000 0.215 186 L C 1.617 178.533 176.870 0.077 0.000 1.108 186 L CA 1.550 56.468 54.840 0.129 0.000 0.830 186 L CB -0.084 42.038 42.059 0.106 0.000 0.959 186 L HN -0.539 7.652 8.230 0.156 0.133 0.457 187 R N -0.686 119.851 120.500 0.062 0.000 2.105 187 R HA -0.278 4.079 4.340 0.028 0.000 0.239 187 R C -0.883 175.439 176.300 0.036 0.000 1.135 187 R CA 4.741 60.864 56.100 0.038 0.000 0.967 187 R CB -1.844 28.474 30.300 0.030 0.000 0.861 187 R HN -0.598 7.713 8.270 0.069 0.000 0.442 188 P HA -0.087 4.350 4.420 0.029 0.000 0.228 188 P C -0.610 176.709 177.300 0.031 0.000 1.151 188 P CA 0.075 63.197 63.100 0.036 0.000 0.770 188 P CB -0.286 31.440 31.700 0.043 0.000 0.786 189 R N -5.186 115.336 120.500 0.037 0.000 3.336 189 R HA -0.358 4.004 4.340 0.036 0.000 0.260 189 R C 0.542 176.858 176.300 0.026 0.000 1.032 189 R CA 0.520 56.638 56.100 0.030 0.000 0.693 189 R CB -3.047 27.262 30.300 0.015 0.000 1.134 189 R HN -0.332 7.920 8.270 0.046 0.046 0.433 190 G N -2.285 106.536 108.800 0.035 0.000 2.402 190 G HA2 -0.197 3.775 3.960 0.020 0.000 0.216 190 G HA3 -0.197 3.915 3.960 0.030 -0.134 0.216 190 G C -0.663 174.247 174.900 0.016 0.000 1.162 190 G CA 0.657 45.772 45.100 0.026 0.000 0.777 190 G HN 0.232 8.550 8.290 0.047 0.000 0.539 191 I N 1.187 121.769 120.570 0.020 0.000 2.452 191 I HA -0.072 4.260 4.170 -0.001 -0.164 0.287 191 I C -0.040 176.079 176.117 0.003 0.000 1.079 191 I CA 0.443 61.747 61.300 0.006 0.000 1.387 191 I CB -0.115 37.889 38.000 0.006 0.000 1.404 191 I HN -0.378 7.851 8.210 0.032 0.000 0.522 192 Q N 6.328 126.126 119.800 -0.004 0.000 2.391 192 Q HA 0.146 4.488 4.340 0.002 0.000 0.211 192 Q C -0.463 175.533 176.000 -0.007 0.000 0.908 192 Q CA 0.278 56.080 55.803 -0.002 0.000 0.920 192 Q CB 1.846 30.583 28.738 -0.000 0.000 1.056 192 Q HN 0.503 8.656 8.270 -0.007 0.114 0.523 193 E N -1.369 118.820 120.200 -0.019 0.000 2.304 193 E HA 0.734 5.294 4.350 -0.032 -0.229 0.277 193 E C -2.724 173.843 176.600 -0.055 0.000 0.898 193 E CA -1.076 55.304 56.400 -0.034 0.000 0.764 193 E CB 3.680 33.362 29.700 -0.030 0.000 1.216 193 E HN -0.528 7.819 8.360 -0.022 0.000 0.419 194 V N 6.153 126.020 119.914 -0.079 0.000 2.417 194 V HA 0.685 4.970 4.120 -0.100 -0.225 0.291 194 V C -1.660 174.342 176.094 -0.153 0.000 1.024 194 V CA -1.910 60.324 62.300 -0.110 0.000 0.861 194 V CB 2.106 33.859 31.823 -0.117 0.000 0.985 194 V HN 0.515 8.656 8.190 -0.082 0.000 0.436 195 V N 8.199 128.024 119.914 -0.147 0.000 2.347 195 V HA 0.368 4.532 4.120 -0.199 -0.163 0.280 195 V C -0.847 175.122 176.094 -0.208 0.000 1.021 195 V CA -1.340 60.858 62.300 -0.171 0.000 0.847 195 V CB 0.464 32.220 31.823 -0.112 0.000 0.990 195 V HN 0.460 8.575 8.190 -0.125 0.000 0.444 196 I N 8.734 129.110 120.570 -0.323 0.000 2.315 196 I HA 0.317 4.552 4.170 -0.208 -0.190 0.291 196 I C -1.175 174.800 176.117 -0.237 0.000 1.006 196 I CA -0.539 60.577 61.300 -0.307 0.000 1.265 196 I CB 1.065 38.746 38.000 -0.531 0.000 1.387 196 I HN 0.919 8.878 8.210 -0.418 0.000 0.475 197 V N 8.178 128.008 119.914 -0.139 0.000 2.350 197 V HA 0.602 4.807 4.120 -0.149 -0.174 0.285 197 V C -0.718 175.335 176.094 -0.068 0.000 1.014 197 V CA -1.984 60.249 62.300 -0.113 0.000 0.831 197 V CB 0.636 32.415 31.823 -0.073 0.000 1.000 197 V HN 0.618 8.745 8.190 -0.105 0.000 0.433 198 G N 5.322 114.073 108.800 -0.082 0.000 2.379 198 G HA2 0.556 4.525 3.960 0.016 0.000 0.327 198 G HA3 0.556 4.760 3.960 0.063 -0.206 0.327 198 G C -0.677 174.266 174.900 0.072 0.000 1.145 198 G CA -1.425 43.686 45.100 0.019 0.000 0.905 198 G HN 0.553 8.747 8.290 -0.160 0.000 0.466 199 R N 3.147 123.683 120.500 0.059 0.000 2.093 199 R HA -0.145 4.419 4.340 0.052 -0.193 0.224 199 R C 0.414 176.761 176.300 0.079 0.000 1.101 199 R CA 1.506 57.640 56.100 0.056 0.000 0.979 199 R CB 0.092 30.409 30.300 0.029 0.000 0.877 199 R HN 0.470 8.766 8.270 0.042 0.000 0.441 200 R N -2.280 118.275 120.500 0.092 0.000 2.601 200 R HA 0.321 4.705 4.340 0.073 0.000 0.220 200 R C 0.142 176.536 176.300 0.157 0.000 1.329 200 R CA -0.731 55.423 56.100 0.089 0.000 1.043 200 R CB 1.675 32.002 30.300 0.044 0.000 1.807 200 R HN -0.411 7.911 8.270 0.085 0.000 0.537 201 G N -2.525 106.321 108.800 0.077 0.000 2.557 201 G HA2 0.513 4.520 3.960 0.078 0.000 0.302 201 G HA3 0.513 4.441 3.960 -0.054 0.000 0.302 201 G C -1.444 173.350 174.900 -0.176 0.000 1.311 201 G CA -2.005 43.093 45.100 -0.004 0.000 1.030 201 G HN -0.327 8.234 8.290 0.036 -0.250 0.509 202 P HA -0.216 3.742 4.420 -0.769 0.000 0.218 202 P C 1.223 178.392 177.300 -0.219 0.000 1.148 202 P CA 2.328 65.043 63.100 -0.641 0.000 0.822 202 P CB 0.133 31.391 31.700 -0.737 0.000 0.784 203 L N -5.167 115.963 121.223 -0.155 0.000 2.376 203 L HA -0.028 4.269 4.340 -0.071 0.000 0.219 203 L C 1.407 178.247 176.870 -0.050 0.000 1.133 203 L CA 1.663 56.455 54.840 -0.081 0.000 0.816 203 L CB -0.632 41.388 42.059 -0.065 0.000 0.933 203 L HN -0.028 8.090 8.230 -0.166 0.013 0.449 204 Q N -3.987 115.785 119.800 -0.047 0.000 2.319 204 Q HA 0.052 4.374 4.340 -0.029 0.000 0.202 204 Q C -0.585 175.389 176.000 -0.042 0.000 0.896 204 Q CA -0.637 55.148 55.803 -0.030 0.000 0.942 204 Q CB -0.228 28.501 28.738 -0.015 0.000 1.083 204 Q HN -0.558 7.541 8.270 -0.057 0.137 0.510 205 A N -0.640 122.152 122.820 -0.046 0.000 2.483 205 A HA -0.154 4.049 4.320 -0.196 0.000 0.238 205 A C -0.125 177.361 177.584 -0.164 0.000 1.070 205 A CA 0.471 52.419 52.037 -0.148 0.000 0.770 205 A CB 0.385 19.336 19.000 -0.081 0.000 1.008 205 A HN -0.854 7.120 8.150 -0.033 0.156 0.497 206 A N 1.338 123.986 122.820 -0.288 0.000 2.308 206 A HA 0.349 4.631 4.320 -0.064 0.000 0.217 206 A C 0.125 177.690 177.584 -0.032 0.000 1.216 206 A CA -0.170 51.787 52.037 -0.134 0.000 0.864 206 A CB 0.636 19.569 19.000 -0.112 0.000 0.902 206 A HN 0.115 8.000 8.150 -0.442 0.000 0.499 207 F N -0.821 119.196 119.950 0.112 0.000 2.589 207 F HA -0.121 4.676 4.527 0.117 -0.199 0.352 207 F C 0.451 176.301 175.800 0.083 0.000 1.168 207 F CA 0.004 58.073 58.000 0.115 0.000 1.353 207 F CB 0.109 39.196 39.000 0.145 0.000 1.116 207 F HN -0.841 7.149 8.300 -0.434 0.049 0.608 208 T N -2.980 111.747 114.554 0.287 0.000 2.949 208 T HA 0.271 4.715 4.350 0.157 0.000 0.287 208 T C 0.665 175.451 174.700 0.144 0.000 1.034 208 T CA -2.082 60.121 62.100 0.173 0.000 1.018 208 T CB 2.562 71.504 68.868 0.123 0.000 1.135 208 T HN -0.042 8.620 8.240 0.295 -0.245 0.532 209 T N 1.911 116.524 114.554 0.098 0.000 2.770 209 T HA -0.129 4.380 4.350 0.077 -0.113 0.263 209 T C 2.144 176.883 174.700 0.066 0.000 1.039 209 T CA 3.637 65.781 62.100 0.073 0.000 1.142 209 T CB -0.126 68.770 68.868 0.047 0.000 0.868 209 T HN 0.262 8.554 8.240 0.086 0.000 0.435 210 L N 0.130 121.394 121.223 0.068 0.000 2.079 210 L HA -0.261 4.117 4.340 0.063 0.000 0.210 210 L C 1.120 178.044 176.870 0.091 0.000 1.081 210 L CA 3.319 58.202 54.840 0.072 0.000 0.752 210 L CB -0.404 41.698 42.059 0.073 0.000 0.896 210 L HN -0.175 8.095 8.230 0.067 0.000 0.433 211 E N -2.788 117.466 120.200 0.091 0.000 2.110 211 E HA -0.321 4.245 4.350 0.098 -0.157 0.193 211 E C 2.098 178.744 176.600 0.078 0.000 0.988 211 E CA 3.237 59.690 56.400 0.089 0.000 0.804 211 E CB -0.717 29.038 29.700 0.092 0.000 0.745 211 E HN 0.127 8.530 8.360 0.090 0.011 0.458 212 L N -2.667 118.594 121.223 0.064 0.000 2.072 212 L HA -0.341 4.010 4.340 0.019 0.000 0.205 212 L C 2.289 179.264 176.870 0.175 0.000 1.079 212 L CA 3.036 57.914 54.840 0.065 0.000 0.752 212 L CB -0.136 41.941 42.059 0.030 0.000 0.906 212 L HN -0.717 7.474 8.230 0.071 0.081 0.436 213 R N -0.479 120.094 120.500 0.121 0.000 2.096 213 R HA -0.294 4.110 4.340 0.106 0.000 0.235 213 R C 2.783 179.177 176.300 0.156 0.000 1.127 213 R CA 3.521 59.690 56.100 0.115 0.000 0.968 213 R CB -0.111 30.220 30.300 0.050 0.000 0.861 213 R HN -0.046 8.277 8.270 0.088 0.000 0.440 214 E N -0.906 119.375 120.200 0.135 0.000 2.338 214 E HA -0.197 4.217 4.350 0.106 0.000 0.197 214 E C 2.270 178.945 176.600 0.125 0.000 1.007 214 E CA 2.110 58.585 56.400 0.125 0.000 0.849 214 E CB -0.417 29.371 29.700 0.146 0.000 0.774 214 E HN -0.330 8.106 8.360 0.127 0.000 0.506 215 L N -1.070 120.237 121.223 0.140 0.000 2.191 215 L HA -0.345 4.032 4.340 0.063 0.000 0.212 215 L C 1.807 178.730 176.870 0.089 0.000 1.103 215 L CA 2.296 57.184 54.840 0.081 0.000 0.769 215 L CB -0.685 41.374 42.059 -0.001 0.000 0.908 215 L HN -0.691 7.599 8.230 0.163 0.038 0.438 216 A N -3.189 119.754 122.820 0.205 0.000 2.121 216 A HA -0.218 4.236 4.320 0.223 0.000 0.218 216 A C 0.471 178.122 177.584 0.112 0.000 1.154 216 A CA 1.855 54.019 52.037 0.212 0.000 0.679 216 A CB -0.273 18.877 19.000 0.251 0.000 0.795 216 A HN -0.672 7.615 8.150 0.270 0.025 0.458 217 D N -2.878 117.573 120.400 0.085 0.000 2.368 217 D HA 0.123 4.794 4.640 0.052 0.000 0.218 217 D C -0.628 175.695 176.300 0.039 0.000 1.112 217 D CA -0.152 53.880 54.000 0.054 0.000 0.834 217 D CB 0.119 40.944 40.800 0.041 0.000 0.953 217 D HN -0.479 7.787 8.370 0.090 0.158 0.505 218 L N 2.049 123.297 121.223 0.042 0.000 2.363 218 L HA -0.020 4.334 4.340 0.023 0.000 0.286 218 L C -0.678 176.213 176.870 0.035 0.000 1.106 218 L CA -0.520 54.339 54.840 0.031 0.000 0.859 218 L CB -0.302 41.773 42.059 0.026 0.000 1.223 218 L HN -0.994 7.205 8.230 0.049 0.060 0.446 219 D N 5.962 126.379 120.400 0.029 0.000 2.493 219 D HA -0.080 4.586 4.640 0.043 0.000 0.240 219 D C 0.721 177.044 176.300 0.038 0.000 1.142 219 D CA 1.709 55.729 54.000 0.034 0.000 0.872 219 D CB 0.637 41.449 40.800 0.020 0.000 1.173 219 D HN 0.029 8.412 8.370 0.021 0.000 0.467 220 G N 2.432 111.270 108.800 0.063 0.000 2.179 220 G HA2 -0.376 3.629 3.960 0.075 0.000 0.260 220 G HA3 -0.376 3.600 3.960 0.026 0.000 0.260 220 G C -1.251 173.704 174.900 0.092 0.000 0.977 220 G CA 0.224 45.362 45.100 0.063 0.000 0.641 220 G HN 0.444 8.783 8.290 0.081 0.000 0.533 221 V N -0.570 119.395 119.914 0.085 0.000 2.487 221 V HA 0.441 4.779 4.120 0.072 -0.175 0.298 221 V C -1.223 174.903 176.094 0.054 0.000 1.028 221 V CA -1.592 60.747 62.300 0.064 0.000 0.860 221 V CB 1.341 33.179 31.823 0.024 0.000 0.991 221 V HN -0.658 7.525 8.190 0.075 0.052 0.427 222 D N 8.338 128.764 120.400 0.043 0.000 2.193 222 D HA 0.246 4.883 4.640 -0.004 0.000 0.244 222 D C -1.207 175.073 176.300 -0.034 0.000 1.064 222 D CA -1.196 52.803 54.000 -0.003 0.000 0.845 222 D CB 2.076 42.861 40.800 -0.025 0.000 1.148 222 D HN 0.403 8.810 8.370 0.061 0.000 0.464 223 V N 3.050 122.912 119.914 -0.085 0.000 2.461 223 V HA 0.263 4.489 4.120 -0.098 -0.165 0.275 223 V C -0.358 175.714 176.094 -0.037 0.000 1.047 223 V CA -0.393 61.815 62.300 -0.152 0.000 0.955 223 V CB 0.420 31.892 31.823 -0.585 0.000 0.988 223 V HN 0.379 8.520 8.190 -0.083 0.000 0.471 224 V N 8.851 128.789 119.914 0.040 0.000 2.409 224 V HA 0.222 4.385 4.120 0.072 0.000 0.291 224 V C -1.883 174.306 176.094 0.158 0.000 1.020 224 V CA -1.366 60.980 62.300 0.078 0.000 0.848 224 V CB 1.740 33.591 31.823 0.047 0.000 0.990 224 V HN 0.834 9.057 8.190 0.055 0.000 0.430 225 I N 5.684 126.350 120.570 0.160 0.000 2.468 225 I HA 0.199 4.506 4.170 0.228 0.000 0.285 225 I C -1.408 174.796 176.117 0.145 0.000 1.039 225 I CA -1.203 60.215 61.300 0.196 0.000 1.074 225 I CB 2.883 41.011 38.000 0.214 0.000 1.228 225 I HN 0.321 8.614 8.210 0.139 0.000 0.436 226 D N 8.486 128.967 120.400 0.135 0.000 2.458 226 D HA 0.070 4.760 4.640 0.083 0.000 0.243 226 D C -0.321 176.038 176.300 0.099 0.000 1.146 226 D CA -1.122 52.938 54.000 0.101 0.000 0.877 226 D CB 1.575 42.430 40.800 0.092 0.000 1.176 226 D HN 0.579 9.036 8.370 0.145 0.000 0.461 227 P HA -0.196 4.259 4.420 0.058 0.000 0.218 227 P C 0.485 177.818 177.300 0.056 0.000 1.146 227 P CA 1.941 65.076 63.100 0.058 0.000 0.813 227 P CB 0.180 31.905 31.700 0.041 0.000 0.778 228 A N -2.552 120.304 122.820 0.061 0.000 2.019 228 A HA -0.214 4.132 4.320 0.044 0.000 0.219 228 A C 2.568 180.196 177.584 0.073 0.000 1.164 228 A CA 2.644 54.716 52.037 0.058 0.000 0.644 228 A CB -0.758 18.276 19.000 0.056 0.000 0.805 228 A HN 0.093 8.605 8.150 0.063 -0.324 0.449 229 E N -1.807 118.460 120.200 0.112 0.000 2.333 229 E HA -0.159 4.293 4.350 0.169 0.000 0.198 229 E C 0.976 177.608 176.600 0.052 0.000 1.007 229 E CA 1.871 58.365 56.400 0.156 0.000 0.845 229 E CB -0.222 29.665 29.700 0.312 0.000 0.766 229 E HN -0.318 7.990 8.360 0.122 0.125 0.507 230 L N -3.311 117.928 121.223 0.026 0.000 2.640 230 L HA 0.152 4.455 4.340 -0.062 0.000 0.230 230 L C -0.777 176.084 176.870 -0.015 0.000 1.123 230 L CA -0.948 53.879 54.840 -0.021 0.000 0.900 230 L CB 0.791 42.839 42.059 -0.017 0.000 1.146 230 L HN -0.605 7.500 8.230 0.043 0.151 0.484 231 D N 0.957 121.360 120.400 0.004 0.000 2.425 231 D HA -0.109 4.532 4.640 0.000 0.000 0.247 231 D C 0.969 177.265 176.300 -0.006 0.000 1.147 231 D CA 2.001 56.003 54.000 0.003 0.000 0.879 231 D CB 0.570 41.379 40.800 0.014 0.000 1.179 231 D HN -0.763 7.501 8.370 0.018 0.117 0.456 232 G N 3.941 112.735 108.800 -0.010 0.000 2.179 232 G HA2 -0.258 3.695 3.960 -0.012 0.000 0.260 232 G HA3 -0.258 3.696 3.960 -0.011 0.000 0.260 232 G C -0.270 174.614 174.900 -0.026 0.000 0.977 232 G CA 0.093 45.185 45.100 -0.014 0.000 0.641 232 G HN 0.147 8.432 8.290 -0.009 0.000 0.533 233 I N 3.621 124.169 120.570 -0.037 0.000 2.330 233 I HA 0.298 4.435 4.170 -0.055 0.000 0.286 233 I C -1.059 175.032 176.117 -0.044 0.000 1.025 233 I CA -2.363 58.904 61.300 -0.054 0.000 1.197 233 I CB -1.919 36.029 38.000 -0.087 0.000 1.358 233 I HN -0.344 7.791 8.210 -0.033 0.055 0.467 234 T N 4.171 118.703 114.554 -0.037 0.000 2.925 234 T HA 0.288 4.621 4.350 -0.029 0.000 0.285 234 T C 0.475 175.156 174.700 -0.031 0.000 1.021 234 T CA -1.905 60.177 62.100 -0.030 0.000 1.042 234 T CB 3.191 72.046 68.868 -0.022 0.000 1.037 234 T HN 0.200 8.418 8.240 -0.038 0.000 0.481 235 D N 4.236 124.619 120.400 -0.027 0.000 2.144 235 D HA -0.288 4.334 4.640 -0.029 0.000 0.199 235 D C 1.915 178.202 176.300 -0.022 0.000 0.984 235 D CA 3.784 57.768 54.000 -0.026 0.000 0.834 235 D CB -0.191 40.595 40.800 -0.023 0.000 0.955 235 D HN 0.524 8.879 8.370 -0.025 0.000 0.465 236 E N -0.344 119.844 120.200 -0.019 0.000 2.051 236 E HA -0.328 4.013 4.350 -0.015 0.000 0.192 236 E C 2.013 178.602 176.600 -0.017 0.000 0.991 236 E CA 3.053 59.444 56.400 -0.016 0.000 0.799 236 E CB -0.086 29.605 29.700 -0.014 0.000 0.748 236 E HN 0.210 8.559 8.360 -0.019 0.000 0.449 237 D N -0.785 119.603 120.400 -0.020 0.000 2.144 237 D HA -0.236 4.394 4.640 -0.018 0.000 0.200 237 D C 2.184 178.470 176.300 -0.023 0.000 0.978 237 D CA 2.908 56.896 54.000 -0.021 0.000 0.833 237 D CB -0.337 40.449 40.800 -0.024 0.000 0.961 237 D HN -0.516 7.841 8.370 -0.021 0.000 0.470 238 A N 0.039 122.843 122.820 -0.027 0.000 1.877 238 A HA -0.249 4.054 4.320 -0.029 0.000 0.216 238 A C 1.625 179.198 177.584 -0.018 0.000 1.186 238 A CA 2.970 54.991 52.037 -0.027 0.000 0.620 238 A CB -0.497 18.484 19.000 -0.031 0.000 0.822 238 A HN -0.313 7.820 8.150 -0.028 0.000 0.443 239 A N -2.233 120.577 122.820 -0.017 0.000 1.933 239 A HA -0.298 4.016 4.320 -0.011 0.000 0.218 239 A C 1.369 178.947 177.584 -0.010 0.000 1.175 239 A CA 2.500 54.530 52.037 -0.012 0.000 0.628 239 A CB -0.334 18.659 19.000 -0.012 0.000 0.814 239 A HN -0.274 7.865 8.150 -0.018 0.000 0.444 240 A N -2.339 120.474 122.820 -0.012 0.000 1.972 240 A HA -0.197 4.118 4.320 -0.009 0.000 0.219 240 A C 1.741 179.319 177.584 -0.010 0.000 1.169 240 A CA 2.480 54.511 52.037 -0.010 0.000 0.635 240 A CB -0.590 18.404 19.000 -0.011 0.000 0.810 240 A HN -0.636 7.414 8.150 -0.013 0.092 0.446 241 V N -3.145 116.762 119.914 -0.011 0.000 2.307 241 V HA -0.246 3.868 4.120 -0.010 0.000 0.245 241 V C 0.820 176.910 176.094 -0.006 0.000 1.045 241 V CA 2.037 64.331 62.300 -0.010 0.000 1.024 241 V CB 0.394 32.209 31.823 -0.013 0.000 0.651 241 V HN -0.678 7.409 8.190 -0.014 0.094 0.449 242 G N -4.533 104.265 108.800 -0.005 0.000 2.320 242 G HA2 -0.063 3.896 3.960 -0.001 0.000 0.297 242 G HA3 -0.063 3.898 3.960 0.002 0.000 0.297 242 G C -1.548 173.352 174.900 0.001 0.000 1.344 242 G CA -0.251 44.848 45.100 -0.001 0.000 0.851 242 G HN -0.810 7.476 8.290 -0.006 0.000 0.567 243 K N 0.366 120.768 120.400 0.004 0.000 2.057 243 K HA -0.267 4.054 4.320 0.001 0.000 0.207 243 K C 1.897 178.502 176.600 0.009 0.000 1.049 243 K CA 2.840 59.130 56.287 0.004 0.000 0.931 243 K CB 0.100 32.603 32.500 0.005 0.000 0.714 243 K HN 0.152 8.405 8.250 0.004 0.000 0.440 244 V N -0.507 119.417 119.914 0.016 0.000 2.343 244 V HA -0.338 3.799 4.120 0.028 0.000 0.247 244 V C 2.105 178.215 176.094 0.027 0.000 1.051 244 V CA 3.631 65.947 62.300 0.027 0.000 1.036 244 V CB -0.885 30.961 31.823 0.038 0.000 0.654 244 V HN -0.158 8.042 8.190 0.016 0.000 0.451 245 C N 0.808 120.119 119.300 0.018 0.000 2.432 245 C HA -0.459 4.015 4.460 0.022 0.000 0.277 245 C C 1.478 176.468 174.990 -0.001 0.000 1.249 245 C CA 3.187 62.212 59.018 0.011 0.000 1.725 245 C CB -2.022 25.717 27.740 -0.001 0.000 2.028 245 C HN 0.132 8.371 8.230 0.015 0.000 0.477 246 K N -0.029 120.368 120.400 -0.005 0.000 2.044 246 K HA -0.521 3.788 4.320 -0.018 0.000 0.210 246 K C 2.324 178.916 176.600 -0.014 0.000 1.049 246 K CA 3.661 59.940 56.287 -0.012 0.000 0.927 246 K CB -0.294 32.200 32.500 -0.011 0.000 0.713 246 K HN -0.335 7.913 8.250 -0.003 0.000 0.443 247 Q N -2.299 117.497 119.800 -0.006 0.000 2.119 247 Q HA -0.281 4.048 4.340 -0.018 0.000 0.201 247 Q C 2.835 178.828 176.000 -0.011 0.000 0.972 247 Q CA 2.490 58.288 55.803 -0.009 0.000 0.847 247 Q CB -0.569 28.169 28.738 0.000 0.000 0.903 247 Q HN -0.462 7.808 8.270 0.000 0.000 0.433 248 N N 0.991 119.697 118.700 0.009 0.000 2.069 248 N HA -0.273 4.482 4.740 0.025 0.000 0.191 248 N C 2.399 177.901 175.510 -0.014 0.000 1.031 248 N CA 3.072 56.136 53.050 0.022 0.000 0.852 248 N CB -0.453 38.075 38.487 0.070 0.000 1.018 248 N HN -0.019 8.372 8.380 0.018 0.000 0.423 249 I N -0.387 120.167 120.570 -0.027 0.000 2.315 249 I HA -0.415 3.719 4.170 -0.059 0.000 0.248 249 I C 1.611 177.692 176.117 -0.059 0.000 1.117 249 I CA 2.080 63.350 61.300 -0.050 0.000 1.404 249 I CB -1.249 36.719 38.000 -0.054 0.000 1.071 249 I HN 0.044 8.241 8.210 -0.021 0.000 0.419 250 K N 0.045 120.411 120.400 -0.057 0.000 2.063 250 K HA -0.370 3.910 4.320 -0.067 0.000 0.208 250 K C 2.708 179.239 176.600 -0.115 0.000 1.048 250 K CA 3.881 60.125 56.287 -0.072 0.000 0.928 250 K CB -0.246 32.218 32.500 -0.060 0.000 0.713 250 K HN -0.773 7.449 8.250 -0.047 0.000 0.442 251 V N -0.104 119.733 119.914 -0.128 0.000 2.343 251 V HA -0.402 3.541 4.120 -0.295 0.000 0.247 251 V C 1.977 177.902 176.094 -0.281 0.000 1.051 251 V CA 4.070 66.231 62.300 -0.233 0.000 1.036 251 V CB -0.502 31.224 31.823 -0.162 0.000 0.654 251 V HN -0.538 7.596 8.190 -0.094 0.000 0.451 252 L N -1.569 119.584 121.223 -0.117 0.000 2.046 252 L HA -0.440 3.936 4.340 0.060 0.000 0.208 252 L C 2.244 179.097 176.870 -0.028 0.000 1.077 252 L CA 3.257 58.079 54.840 -0.031 0.000 0.747 252 L CB -0.777 41.259 42.059 -0.037 0.000 0.896 252 L HN -0.185 7.992 8.230 -0.088 0.000 0.432 253 R N -1.675 118.788 120.500 -0.062 0.000 2.091 253 R HA -0.406 3.924 4.340 -0.017 0.000 0.238 253 R C 2.607 178.873 176.300 -0.057 0.000 1.136 253 R CA 3.493 59.566 56.100 -0.044 0.000 0.959 253 R CB -0.369 29.902 30.300 -0.049 0.000 0.856 253 R HN 0.088 8.313 8.270 -0.074 0.000 0.437 254 G N -2.190 106.527 108.800 -0.137 0.000 2.440 254 G HA2 -0.226 3.667 3.960 -0.112 0.000 0.218 254 G HA3 -0.226 3.576 3.960 -0.262 0.000 0.218 254 G C 2.004 176.833 174.900 -0.119 0.000 1.154 254 G CA 1.847 46.843 45.100 -0.173 0.000 0.767 254 G HN -0.431 7.754 8.290 -0.174 0.000 0.552 255 Y N 1.647 121.932 120.300 -0.025 0.000 2.242 255 Y HA -0.287 4.260 4.550 -0.005 0.000 0.291 255 Y C 2.303 178.206 175.900 0.005 0.000 1.137 255 Y CA 1.689 59.782 58.100 -0.012 0.000 1.181 255 Y CB -0.753 37.692 38.460 -0.026 0.000 0.989 255 Y HN -0.614 7.540 8.280 -0.210 0.000 0.527 256 A N -1.242 121.668 122.820 0.149 0.000 2.067 256 A HA -0.120 4.438 4.320 0.119 -0.167 0.219 256 A C 0.631 178.255 177.584 0.067 0.000 1.158 256 A CA 1.750 53.849 52.037 0.103 0.000 0.661 256 A CB -0.507 18.540 19.000 0.077 0.000 0.801 256 A HN -0.580 7.561 8.150 0.119 0.080 0.452 257 D N -3.655 116.773 120.400 0.047 0.000 2.363 257 D HA -0.049 4.605 4.640 0.023 0.000 0.220 257 D C 0.000 176.319 176.300 0.032 0.000 0.994 257 D CA 1.059 55.074 54.000 0.027 0.000 0.890 257 D CB 0.013 40.816 40.800 0.004 0.000 0.906 257 D HN -0.566 7.688 8.370 0.042 0.141 0.530 258 R N -0.160 120.371 120.500 0.052 0.000 2.297 258 R HA 0.159 4.515 4.340 0.027 0.000 0.308 258 R C -0.217 176.101 176.300 0.031 0.000 1.029 258 R CA -0.381 55.743 56.100 0.041 0.000 0.929 258 R CB 0.637 30.973 30.300 0.059 0.000 1.046 258 R HN -0.764 7.500 8.270 0.074 0.050 0.461 262 P HA 0.252 4.721 4.420 0.081 0.000 0.274 262 P C -0.424 176.991 177.300 0.192 0.000 1.231 262 P CA -0.181 62.979 63.100 0.101 0.000 0.790 262 P CB 0.498 32.237 31.700 0.066 0.000 0.951 263 G N -0.335 108.542 108.800 0.129 0.000 2.234 263 G HA2 -0.252 3.718 3.960 0.016 0.000 0.235 263 G HA3 -0.252 3.734 3.960 0.044 0.000 0.235 263 G C -0.401 174.482 174.900 -0.029 0.000 0.997 263 G CA -0.316 44.818 45.100 0.056 0.000 0.623 263 G HN 0.300 8.646 8.290 0.092 0.000 0.514 264 H N 1.347 120.420 119.070 0.005 0.000 2.502 264 H HA 0.185 4.743 4.556 0.004 0.000 0.338 264 H C -0.300 175.028 175.328 -0.001 0.000 1.155 264 H CA -0.494 55.556 56.048 0.004 0.000 1.237 264 H CB 1.720 31.485 29.762 0.006 0.000 1.534 264 H HN -0.256 8.172 8.280 0.346 0.059 0.523 265 R N 0.397 120.951 120.500 0.090 0.000 2.643 265 R HA 0.004 4.519 4.340 0.035 -0.154 0.270 265 R C -0.554 175.779 176.300 0.055 0.000 1.061 265 R CA 1.029 57.158 56.100 0.049 0.000 1.107 265 R CB 0.889 31.204 30.300 0.025 0.000 0.999 265 R HN -0.054 8.254 8.270 0.064 0.000 0.460 266 R N -0.150 120.361 120.500 0.018 0.000 2.621 266 R HA 0.794 5.331 4.340 0.006 -0.194 0.292 266 R C -1.553 174.721 176.300 -0.042 0.000 0.969 266 R CA -1.263 54.836 56.100 -0.002 0.000 0.887 266 R CB 3.840 34.141 30.300 0.001 0.000 1.180 266 R HN 0.201 8.475 8.270 0.007 0.000 0.450 267 M N 5.668 125.229 119.600 -0.065 0.000 2.072 267 M HA 0.542 5.092 4.480 -0.160 -0.166 0.331 267 M C -2.499 173.713 176.300 -0.146 0.000 1.004 267 M CA -0.804 54.412 55.300 -0.140 0.000 0.952 267 M CB 2.733 35.242 32.600 -0.150 0.000 1.511 267 M HN 0.449 8.708 8.290 -0.052 0.000 0.422 268 V N 7.015 126.815 119.914 -0.191 0.000 2.435 268 V HA 0.679 5.022 4.120 0.003 -0.221 0.290 268 V C -1.426 174.517 176.094 -0.252 0.000 1.030 268 V CA -1.603 60.632 62.300 -0.108 0.000 0.881 268 V CB 1.655 33.436 31.823 -0.069 0.000 0.983 268 V HN 0.842 8.903 8.190 -0.216 0.000 0.445 269 F N 7.173 127.065 119.950 -0.097 0.000 2.415 269 F HA 0.425 4.950 4.527 -0.249 -0.147 0.348 269 F C -0.780 174.882 175.800 -0.231 0.000 1.119 269 F CA -0.655 57.224 58.000 -0.203 0.000 1.069 269 F CB 1.808 40.727 39.000 -0.136 0.000 1.124 269 F HN 0.073 8.557 8.300 0.307 0.000 0.472 270 R N 2.167 122.533 120.500 -0.223 0.000 2.480 270 R HA 0.369 4.708 4.340 -0.001 0.000 0.306 270 R C -2.317 173.796 176.300 -0.313 0.000 0.958 270 R CA -1.284 54.731 56.100 -0.141 0.000 0.861 270 R CB 2.353 32.611 30.300 -0.071 0.000 1.171 270 R HN 0.629 8.720 8.270 -0.297 0.000 0.445 271 F N 0.392 120.415 119.950 0.122 0.000 2.572 271 F HA 0.383 5.101 4.527 0.108 -0.126 0.342 271 F C 0.500 176.337 175.800 0.063 0.000 1.064 271 F CA -1.283 56.777 58.000 0.101 0.000 1.008 271 F CB 3.233 42.296 39.000 0.104 0.000 1.303 271 F HN 0.058 8.853 8.300 0.278 -0.328 0.492 272 L N -2.696 118.681 121.223 0.257 0.000 3.678 272 L HA -0.341 4.282 4.340 0.120 -0.210 0.425 272 L C -1.104 175.820 176.870 0.091 0.000 1.240 272 L CA 0.818 55.742 54.840 0.141 0.000 0.876 272 L CB -2.518 39.614 42.059 0.123 0.000 1.766 272 L HN 0.220 8.631 8.230 0.302 0.000 0.917 273 T N 0.232 114.829 114.554 0.072 0.000 2.952 273 T HA 0.703 5.289 4.350 0.036 -0.215 0.305 273 T C -0.891 173.822 174.700 0.022 0.000 1.064 273 T CA -0.370 61.752 62.100 0.037 0.000 1.008 273 T CB 3.636 72.518 68.868 0.023 0.000 1.078 273 T HN -0.266 8.021 8.240 0.079 0.000 0.459 274 S N 4.008 119.717 115.700 0.014 0.000 2.513 274 S HA 0.515 4.988 4.470 0.005 0.000 0.299 274 S C -2.341 172.258 174.600 -0.002 0.000 1.087 274 S CA -3.100 55.104 58.200 0.006 0.000 1.012 274 S CB 1.927 65.133 63.200 0.008 0.000 1.044 274 S HN 0.584 8.903 8.310 0.015 0.000 0.485 275 P HA 0.110 4.642 4.420 -0.013 -0.120 0.282 275 P C -1.407 175.888 177.300 -0.008 0.000 1.262 275 P CA 0.224 63.318 63.100 -0.011 0.000 0.773 275 P CB 0.664 32.354 31.700 -0.017 0.000 0.879 276 I N 3.136 123.702 120.570 -0.008 0.000 3.039 276 I HA 0.205 4.373 4.170 -0.005 0.000 0.270 276 I C -0.404 175.708 176.117 -0.008 0.000 1.150 276 I CA 0.310 61.606 61.300 -0.006 0.000 1.448 276 I CB 1.102 39.100 38.000 -0.004 0.000 1.197 276 I HN 0.591 8.796 8.210 -0.009 0.000 0.450 277 E N -3.141 117.053 120.200 -0.010 0.000 2.375 277 E HA 0.237 4.711 4.350 -0.012 -0.131 0.280 277 E C -2.391 174.200 176.600 -0.015 0.000 0.972 277 E CA -1.150 55.243 56.400 -0.012 0.000 0.782 277 E CB 3.648 33.343 29.700 -0.010 0.000 1.229 277 E HN -0.919 7.434 8.360 -0.011 0.000 0.439 278 I N 3.677 124.237 120.570 -0.017 0.000 2.404 278 I HA 0.412 4.569 4.170 -0.022 0.000 0.293 278 I C -1.037 175.069 176.117 -0.019 0.000 0.992 278 I CA -0.809 60.478 61.300 -0.021 0.000 1.149 278 I CB 2.009 39.994 38.000 -0.025 0.000 1.315 278 I HN 0.508 8.708 8.210 -0.017 0.000 0.446 279 K N 6.156 126.544 120.400 -0.019 0.000 2.395 279 K HA 0.429 4.740 4.320 -0.016 0.000 0.247 279 K C -1.510 175.079 176.600 -0.018 0.000 0.973 279 K CA -1.448 54.829 56.287 -0.017 0.000 0.828 279 K CB 3.903 36.395 32.500 -0.014 0.000 1.272 279 K HN 0.567 8.804 8.250 -0.021 0.000 0.439 280 G N -1.948 106.842 108.800 -0.016 0.000 2.347 280 G HA2 -0.083 3.868 3.960 -0.015 0.000 0.303 280 G HA3 -0.083 4.102 3.960 -0.019 -0.236 0.303 280 G C -2.374 172.517 174.900 -0.015 0.000 1.481 280 G CA -0.083 45.008 45.100 -0.016 0.000 0.914 280 G HN -0.124 8.157 8.290 -0.015 0.000 0.638 281 K N 1.350 121.741 120.400 -0.014 0.000 2.250 281 K HA 0.066 4.379 4.320 -0.012 0.000 0.280 281 K C 0.243 176.835 176.600 -0.014 0.000 1.098 281 K CA -1.029 55.251 56.287 -0.013 0.000 0.916 281 K CB -0.047 32.446 32.500 -0.011 0.000 1.209 281 K HN 0.221 8.892 8.250 -0.014 -0.429 0.461 282 R N 0.564 121.055 120.500 -0.015 0.000 3.977 282 R HA -0.416 3.914 4.340 -0.016 0.000 0.428 282 R C -1.440 174.848 176.300 -0.020 0.000 1.079 282 R CA 1.571 57.661 56.100 -0.016 0.000 1.269 282 R CB -1.217 29.074 30.300 -0.014 0.000 1.856 282 R HN 0.816 9.077 8.270 -0.014 0.000 0.551 283 K N -6.928 113.459 120.400 -0.021 0.000 2.615 283 K HA 0.258 4.678 4.320 -0.029 -0.117 0.291 283 K C -2.182 174.402 176.600 -0.027 0.000 1.017 283 K CA -1.778 54.493 56.287 -0.027 0.000 0.882 283 K CB 3.156 35.639 32.500 -0.027 0.000 1.522 283 K HN -0.937 7.223 8.250 -0.020 0.078 0.412 284 V N 1.035 120.929 119.914 -0.033 0.000 2.540 284 V HA -0.280 3.940 4.120 -0.031 -0.119 0.297 284 V C 0.293 176.369 176.094 -0.031 0.000 1.024 284 V CA 2.224 64.503 62.300 -0.034 0.000 1.105 284 V CB -0.937 30.860 31.823 -0.043 0.000 0.938 284 V HN 0.189 8.357 8.190 -0.037 0.000 0.482 285 E N 5.743 125.927 120.200 -0.027 0.000 2.467 285 E HA 0.333 4.712 4.350 -0.024 -0.044 0.213 285 E C -0.720 175.866 176.600 -0.023 0.000 0.823 285 E CA 0.264 56.650 56.400 -0.023 0.000 1.233 285 E CB 3.350 33.039 29.700 -0.018 0.000 1.233 285 E HN 0.620 8.965 8.360 -0.025 0.000 0.585 286 R N -3.977 116.509 120.500 -0.023 0.000 2.716 286 R HA 0.603 5.124 4.340 -0.024 -0.195 0.271 286 R C -3.062 173.224 176.300 -0.023 0.000 1.028 286 R CA -0.913 55.174 56.100 -0.022 0.000 0.883 286 R CB 3.821 34.111 30.300 -0.017 0.000 1.250 286 R HN -0.325 7.930 8.270 -0.024 0.000 0.465 287 I N 0.111 120.668 120.570 -0.023 0.000 2.582 287 I HA 0.588 4.871 4.170 -0.022 -0.126 0.292 287 I C -2.759 173.347 176.117 -0.018 0.000 1.066 287 I CA -2.452 58.834 61.300 -0.023 0.000 1.053 287 I CB 4.483 42.466 38.000 -0.029 0.000 1.241 287 I HN 0.422 8.619 8.210 -0.023 0.000 0.421 288 V N 7.579 127.484 119.914 -0.015 0.000 2.432 288 V HA 0.437 4.731 4.120 -0.009 -0.179 0.275 288 V C -1.241 174.847 176.094 -0.010 0.000 1.043 288 V CA -0.977 61.317 62.300 -0.010 0.000 0.925 288 V CB 0.021 31.839 31.823 -0.008 0.000 0.985 288 V HN 0.480 8.660 8.190 -0.015 0.000 0.466 289 L N 6.182 127.401 121.223 -0.007 0.000 2.342 289 L HA 0.821 5.330 4.340 -0.006 -0.172 0.271 289 L C -0.873 175.998 176.870 0.001 0.000 1.008 289 L CA -1.901 52.937 54.840 -0.005 0.000 0.818 289 L CB 3.178 45.234 42.059 -0.006 0.000 1.296 289 L HN 0.834 9.060 8.230 -0.006 0.000 0.427 290 G N -0.429 108.374 108.800 0.005 0.000 2.495 290 G HA2 0.613 4.788 3.960 0.009 0.000 0.318 290 G HA3 0.613 4.578 3.960 0.008 0.000 0.318 290 G C -2.754 172.156 174.900 0.016 0.000 1.257 290 G CA -1.386 43.719 45.100 0.009 0.000 0.962 290 G HN 0.558 8.850 8.290 0.004 0.000 0.483 291 R N 2.506 123.017 120.500 0.019 0.000 2.357 291 R HA 0.513 5.034 4.340 0.034 -0.161 0.296 291 R C -1.116 175.201 176.300 0.027 0.000 1.052 291 R CA -0.897 55.220 56.100 0.028 0.000 0.988 291 R CB 1.826 32.143 30.300 0.029 0.000 1.025 291 R HN -0.278 8.003 8.270 0.017 0.000 0.469 292 N N 4.759 123.480 118.700 0.035 0.000 2.404 292 N HA 0.696 5.624 4.740 0.025 -0.173 0.297 292 N C -0.598 174.932 175.510 0.034 0.000 1.163 292 N CA -1.621 51.448 53.050 0.032 0.000 0.864 292 N CB 3.123 41.631 38.487 0.036 0.000 1.247 292 N HN 0.254 8.555 8.380 0.044 0.105 0.510 293 E N 0.089 120.305 120.200 0.026 0.000 2.277 293 E HA 0.341 4.707 4.350 0.027 0.000 0.266 293 E C -1.228 175.383 176.600 0.019 0.000 0.901 293 E CA -1.541 54.873 56.400 0.023 0.000 0.782 293 E CB 3.315 33.025 29.700 0.017 0.000 1.228 293 E HN 0.235 8.608 8.360 0.022 0.000 0.424 294 L N 1.832 123.065 121.223 0.016 0.000 2.292 294 L HA 0.516 5.055 4.340 0.012 -0.191 0.284 294 L C 0.058 176.932 176.870 0.006 0.000 1.065 294 L CA -0.779 54.067 54.840 0.011 0.000 0.806 294 L CB 0.991 43.054 42.059 0.006 0.000 1.175 294 L HN 0.218 8.458 8.230 0.016 0.000 0.431 295 V N 3.527 123.444 119.914 0.004 0.000 2.888 295 V HA 0.312 4.433 4.120 0.002 0.000 0.309 295 V C -1.483 174.611 176.094 0.000 0.000 1.114 295 V CA -1.707 60.594 62.300 0.002 0.000 0.940 295 V CB 4.491 36.315 31.823 0.003 0.000 1.021 295 V HN 0.554 8.747 8.190 0.005 0.000 0.426 296 S N 3.873 119.572 115.700 -0.001 0.000 2.531 296 S HA 0.090 4.744 4.470 -0.003 -0.186 0.279 296 S C 0.296 174.894 174.600 -0.002 0.000 1.305 296 S CA 0.107 58.306 58.200 -0.002 0.000 1.058 296 S CB 0.453 63.651 63.200 -0.003 0.000 0.899 296 S HN 0.331 8.641 8.310 -0.001 0.000 0.493 297 D N 6.156 126.554 120.400 -0.003 0.000 2.369 297 D HA 0.089 4.728 4.640 -0.002 0.000 0.211 297 D C 1.140 177.438 176.300 -0.004 0.000 1.077 297 D CA -0.764 53.234 54.000 -0.003 0.000 0.842 297 D CB -0.139 40.659 40.800 -0.004 0.000 0.947 297 D HN -0.022 8.346 8.370 -0.004 0.000 0.509 298 G N 0.551 109.349 108.800 -0.004 0.000 2.194 298 G HA2 -0.342 3.615 3.960 -0.004 0.000 0.236 298 G HA3 -0.342 3.615 3.960 -0.004 0.000 0.236 298 G C 0.737 175.634 174.900 -0.005 0.000 0.987 298 G CA 0.136 45.233 45.100 -0.004 0.000 0.635 298 G HN -0.312 7.975 8.290 -0.004 0.000 0.520 299 S N 0.972 116.668 115.700 -0.006 0.000 2.548 299 S HA -0.006 4.460 4.470 -0.007 0.000 0.215 299 S C 1.301 175.896 174.600 -0.007 0.000 0.976 299 S CA 0.360 58.556 58.200 -0.007 0.000 0.908 299 S CB 0.944 64.139 63.200 -0.008 0.000 0.781 299 S HN -0.062 8.514 8.310 -0.006 -0.270 0.519 300 G N 0.959 109.755 108.800 -0.007 0.000 2.163 300 G HA2 -0.328 3.628 3.960 -0.006 0.000 0.213 300 G HA3 -0.328 3.627 3.960 -0.007 0.000 0.213 300 G C -1.079 173.816 174.900 -0.008 0.000 0.991 300 G CA -0.433 44.663 45.100 -0.007 0.000 0.653 300 G HN 0.463 8.704 8.290 -0.006 0.046 0.518 301 R N -1.673 118.822 120.500 -0.008 0.000 2.885 301 R HA 0.507 4.841 4.340 -0.009 0.000 0.260 301 R C -2.128 174.168 176.300 -0.007 0.000 1.107 301 R CA -1.498 54.597 56.100 -0.009 0.000 0.978 301 R CB 2.054 32.348 30.300 -0.010 0.000 1.227 301 R HN -0.554 7.712 8.270 -0.007 0.000 0.473 302 V N -3.842 116.068 119.914 -0.007 0.000 2.630 302 V HA 0.773 5.025 4.120 -0.004 -0.135 0.305 302 V C -1.981 174.111 176.094 -0.003 0.000 1.046 302 V CA -2.497 59.800 62.300 -0.005 0.000 0.934 302 V CB 2.687 34.508 31.823 -0.004 0.000 1.003 302 V HN 0.100 8.285 8.190 -0.008 0.000 0.451 303 A N 3.181 126.001 122.820 -0.000 0.000 2.380 303 A HA 0.390 4.711 4.320 0.001 0.000 0.315 303 A C -2.519 175.069 177.584 0.007 0.000 1.101 303 A CA -1.574 50.464 52.037 0.002 0.000 0.771 303 A CB 3.150 22.150 19.000 0.000 0.000 1.287 303 A HN 0.680 8.830 8.150 0.000 0.000 0.436 304 A N 0.572 123.399 122.820 0.010 0.000 2.401 304 A HA 0.313 4.789 4.320 0.019 -0.144 0.259 304 A C -0.477 177.114 177.584 0.012 0.000 1.103 304 A CA -0.440 51.607 52.037 0.016 0.000 0.789 304 A CB 0.664 19.677 19.000 0.021 0.000 1.035 304 A HN 0.232 8.388 8.150 0.009 0.000 0.491 305 K N 4.511 124.918 120.400 0.013 0.000 2.413 305 K HA 0.268 4.593 4.320 0.009 0.000 0.257 305 K C -1.314 175.294 176.600 0.013 0.000 0.946 305 K CA -1.353 54.940 56.287 0.010 0.000 0.823 305 K CB 3.121 35.626 32.500 0.008 0.000 1.109 305 K HN 0.267 8.526 8.250 0.015 0.000 0.427 306 D N 6.952 127.359 120.400 0.011 0.000 2.458 306 D HA -0.120 4.683 4.640 0.014 -0.155 0.243 306 D C 1.215 177.521 176.300 0.011 0.000 1.146 306 D CA 0.741 54.748 54.000 0.011 0.000 0.877 306 D CB 0.283 41.088 40.800 0.008 0.000 1.176 306 D HN 0.356 8.732 8.370 0.009 0.000 0.461 307 T N 4.774 119.336 114.554 0.013 0.000 3.067 307 T HA -0.010 4.346 4.350 0.011 0.000 0.261 307 T C 1.283 175.988 174.700 0.009 0.000 1.110 307 T CA 0.138 62.245 62.100 0.012 0.000 1.113 307 T CB 1.218 70.094 68.868 0.014 0.000 0.917 307 T HN 0.238 8.487 8.240 0.015 0.000 0.499 308 G N 1.706 110.511 108.800 0.009 0.000 2.241 308 G HA2 -0.385 3.579 3.960 0.006 0.000 0.244 308 G HA3 -0.385 3.579 3.960 0.006 0.000 0.244 308 G C -0.511 174.393 174.900 0.007 0.000 0.998 308 G CA -0.264 44.841 45.100 0.007 0.000 0.621 308 G HN -0.376 8.197 8.290 0.009 -0.277 0.519 309 E N 1.147 121.352 120.200 0.009 0.000 2.398 309 E HA -0.058 4.296 4.350 0.008 0.000 0.263 309 E C -0.989 175.616 176.600 0.008 0.000 1.046 309 E CA 0.648 57.053 56.400 0.009 0.000 0.908 309 E CB 0.685 30.392 29.700 0.012 0.000 0.963 309 E HN -0.540 7.757 8.360 0.010 0.069 0.431 310 R N 1.194 121.698 120.500 0.006 0.000 2.628 310 R HA 0.772 5.313 4.340 0.004 -0.198 0.288 310 R C -0.549 175.753 176.300 0.004 0.000 0.980 310 R CA -1.713 54.390 56.100 0.004 0.000 0.891 310 R CB 2.547 32.848 30.300 0.002 0.000 1.188 310 R HN 0.331 8.605 8.270 0.006 0.000 0.450 311 E N 3.663 123.864 120.200 0.002 0.000 2.317 311 E HA 0.330 4.681 4.350 0.002 0.000 0.270 311 E C -2.129 174.469 176.600 -0.002 0.000 0.885 311 E CA -1.337 55.064 56.400 0.001 0.000 0.760 311 E CB 3.576 33.278 29.700 0.004 0.000 1.227 311 E HN 0.448 8.809 8.360 0.002 0.000 0.434 312 E N 4.432 124.629 120.200 -0.004 0.000 2.183 312 E HA 0.784 5.323 4.350 -0.009 -0.195 0.271 312 E C -0.998 175.597 176.600 -0.009 0.000 0.919 312 E CA -1.554 54.842 56.400 -0.007 0.000 0.781 312 E CB 2.376 32.072 29.700 -0.007 0.000 1.140 312 E HN 0.264 8.622 8.360 -0.003 0.000 0.402 313 L N 4.251 125.466 121.223 -0.013 0.000 2.381 313 L HA 0.535 4.867 4.340 -0.013 0.000 0.274 313 L C -3.032 173.827 176.870 -0.019 0.000 0.988 313 L CA -3.471 51.359 54.840 -0.015 0.000 0.824 313 L CB 3.205 45.252 42.059 -0.020 0.000 1.263 313 L HN 0.217 8.438 8.230 -0.015 0.000 0.410 314 P HA 0.221 4.771 4.420 -0.019 -0.142 0.271 314 P C -1.640 175.645 177.300 -0.026 0.000 1.216 314 P CA -0.393 62.695 63.100 -0.019 0.000 0.776 314 P CB 0.296 31.987 31.700 -0.016 0.000 0.881 315 A N 0.729 123.531 122.820 -0.029 0.000 2.605 315 A HA 0.301 4.599 4.320 -0.037 0.000 0.294 315 A C -2.187 175.374 177.584 -0.039 0.000 1.062 315 A CA -0.325 51.689 52.037 -0.038 0.000 0.682 315 A CB 3.567 22.540 19.000 -0.045 0.000 1.278 315 A HN -0.125 7.890 8.150 -0.028 0.118 0.410 316 Q N -1.906 117.867 119.800 -0.044 0.000 2.214 316 Q HA 0.298 4.788 4.340 -0.040 -0.174 0.229 316 Q C -0.598 175.366 176.000 -0.060 0.000 0.835 316 Q CA -0.317 55.459 55.803 -0.044 0.000 0.953 316 Q CB 2.230 30.947 28.738 -0.035 0.000 1.131 316 Q HN 0.099 8.341 8.270 -0.047 0.000 0.501 317 L N -1.212 119.966 121.223 -0.076 0.000 2.493 317 L HA 0.549 5.003 4.340 -0.103 -0.175 0.265 317 L C -2.885 173.920 176.870 -0.110 0.000 0.954 317 L CA -0.221 54.556 54.840 -0.105 0.000 0.844 317 L CB 4.007 45.984 42.059 -0.137 0.000 1.302 317 L HN -0.856 7.330 8.230 -0.073 0.000 0.405 318 V N 6.349 126.197 119.914 -0.109 0.000 2.483 318 V HA 0.707 4.989 4.120 -0.102 -0.223 0.297 318 V C -1.949 174.076 176.094 -0.115 0.000 1.027 318 V CA -1.598 60.643 62.300 -0.099 0.000 0.855 318 V CB 2.776 34.557 31.823 -0.070 0.000 0.995 318 V HN 0.764 8.891 8.190 -0.106 0.000 0.424 319 V N 8.073 127.911 119.914 -0.127 0.000 2.357 319 V HA 0.494 4.758 4.120 -0.110 -0.209 0.284 319 V C -0.957 175.102 176.094 -0.058 0.000 1.018 319 V CA -1.960 60.270 62.300 -0.117 0.000 0.841 319 V CB 1.023 32.736 31.823 -0.183 0.000 0.991 319 V HN 0.734 8.848 8.190 -0.126 0.000 0.437 320 R N 6.622 127.100 120.500 -0.037 0.000 2.216 320 R HA 0.200 4.531 4.340 -0.015 0.000 0.332 320 R C -1.230 175.076 176.300 0.009 0.000 1.056 320 R CA -0.816 55.274 56.100 -0.016 0.000 0.901 320 R CB 0.087 30.376 30.300 -0.018 0.000 1.039 320 R HN 0.608 8.853 8.270 -0.041 0.000 0.456 321 S N 5.395 121.115 115.700 0.034 0.000 2.222 321 S HA 0.248 4.772 4.470 0.090 0.000 0.173 321 S C -0.727 173.917 174.600 0.073 0.000 1.466 321 S CA -2.329 55.920 58.200 0.081 0.000 1.184 321 S CB -0.430 62.843 63.200 0.121 0.000 1.168 321 S HN 0.632 8.958 8.310 0.027 0.000 0.475 322 V N -0.564 119.380 119.914 0.050 0.000 3.177 322 V HA 0.281 4.420 4.120 0.033 0.000 0.342 322 V C -1.218 174.902 176.094 0.044 0.000 1.379 322 V CA -2.131 60.190 62.300 0.035 0.000 1.191 322 V CB -0.213 31.618 31.823 0.014 0.000 1.167 322 V HN -0.337 7.876 8.190 0.038 0.000 0.471 323 G N -1.524 107.331 108.800 0.092 0.000 2.640 323 G HA2 -0.291 3.764 3.960 0.159 0.000 0.686 323 G HA3 -0.291 3.710 3.960 0.068 0.000 0.686 323 G C -1.548 173.464 174.900 0.186 0.000 1.229 323 G CA -0.906 44.271 45.100 0.128 0.000 0.796 323 G HN -0.698 7.598 8.290 0.122 0.067 0.654 324 Y N 0.676 120.996 120.300 0.034 0.000 2.260 324 Y HA 0.231 4.939 4.550 0.099 -0.098 0.339 324 Y C 0.344 176.284 175.900 0.067 0.000 1.317 324 Y CA 0.326 58.482 58.100 0.093 0.000 1.514 324 Y CB 1.649 40.238 38.460 0.215 0.000 1.382 324 Y HN 0.281 8.842 8.280 0.469 0.000 0.581 325 R N -1.648 118.994 120.500 0.238 0.000 2.566 325 R HA 0.290 4.725 4.340 0.158 0.000 0.271 325 R C -1.712 174.735 176.300 0.245 0.000 1.071 325 R CA -1.081 55.129 56.100 0.184 0.000 0.915 325 R CB 4.262 34.636 30.300 0.124 0.000 1.228 325 R HN 0.279 8.640 8.270 0.262 0.067 0.449 326 G N 3.290 112.258 108.800 0.280 0.000 2.594 326 G HA2 0.030 4.186 3.960 0.328 0.000 0.243 326 G HA3 0.030 4.440 3.960 0.432 -0.191 0.243 326 G C -1.457 173.675 174.900 0.386 0.000 1.229 326 G CA -0.472 44.849 45.100 0.369 0.000 0.843 326 G HN -0.076 8.359 8.290 0.240 0.000 0.578 327 V N 0.048 120.086 119.914 0.207 0.000 2.555 327 V HA 0.263 4.322 4.120 -0.102 0.000 0.302 327 V C -1.646 174.165 176.094 -0.473 0.000 1.038 327 V CA -3.353 58.899 62.300 -0.081 0.000 0.887 327 V CB 2.178 33.996 31.823 -0.009 0.000 0.991 327 V HN 0.175 8.493 8.190 0.213 0.000 0.434 328 P HA 0.170 3.726 4.420 -1.441 0.000 0.268 328 P C -1.191 175.866 177.300 -0.405 0.000 1.205 328 P CA -0.435 62.017 63.100 -1.080 0.000 0.771 328 P CB 0.583 31.732 31.700 -0.918 0.000 0.858 329 T N 4.971 119.371 114.554 -0.257 0.000 2.767 329 T HA 0.406 4.690 4.350 -0.111 0.000 0.284 329 T C -2.009 172.612 174.700 -0.132 0.000 0.973 329 T CA -1.405 60.610 62.100 -0.141 0.000 0.996 329 T CB 0.559 69.353 68.868 -0.124 0.000 0.927 329 T HN -0.045 8.050 8.240 -0.242 0.000 0.456 330 P HA -0.177 4.198 4.420 -0.075 0.000 0.261 330 P C 0.054 177.318 177.300 -0.060 0.000 1.183 330 P CA 0.837 63.895 63.100 -0.070 0.000 0.761 330 P CB 0.187 31.858 31.700 -0.049 0.000 0.785 331 G N 2.415 111.184 108.800 -0.052 0.000 2.175 331 G HA2 -0.262 3.682 3.960 -0.028 0.000 0.244 331 G HA3 -0.262 3.680 3.960 -0.030 0.000 0.244 331 G C -0.676 174.183 174.900 -0.068 0.000 0.982 331 G CA 0.107 45.181 45.100 -0.042 0.000 0.641 331 G HN 0.088 8.348 8.290 -0.049 0.000 0.527 332 L N 0.120 121.284 121.223 -0.098 0.000 2.341 332 L HA 0.482 4.761 4.340 -0.101 0.000 0.267 332 L C -2.370 174.482 176.870 -0.029 0.000 1.009 332 L CA -3.242 51.532 54.840 -0.109 0.000 0.819 332 L CB 1.337 43.259 42.059 -0.228 0.000 1.323 332 L HN -0.636 7.482 8.230 -0.099 0.052 0.425 333 P HA 0.100 4.557 4.420 0.062 0.000 0.273 333 P C -2.119 175.286 177.300 0.176 0.000 1.250 333 P CA -0.236 62.899 63.100 0.059 0.000 0.793 333 P CB 0.737 32.450 31.700 0.023 0.000 1.011 334 F N -1.084 118.848 119.950 -0.030 0.000 2.672 334 F HA 0.129 4.767 4.527 -0.016 -0.120 0.311 334 F C -1.906 173.888 175.800 -0.010 0.000 1.113 334 F CA -0.792 57.198 58.000 -0.018 0.000 0.996 334 F CB 3.722 42.713 39.000 -0.016 0.000 1.286 334 F HN -0.394 8.010 8.300 0.175 0.000 0.441 335 D N 6.062 126.145 120.400 -0.528 0.000 2.427 335 D HA 0.226 4.763 4.640 -0.172 0.000 0.226 335 D C -0.406 175.599 176.300 -0.491 0.000 1.076 335 D CA -1.466 52.316 54.000 -0.362 0.000 0.849 335 D CB 1.798 42.428 40.800 -0.283 0.000 1.052 335 D HN 0.231 8.082 8.370 -0.865 0.000 0.515 336 D N 7.908 128.233 120.400 -0.126 0.000 2.123 336 D HA -0.411 4.345 4.640 0.195 0.000 0.196 336 D C 1.208 177.486 176.300 -0.038 0.000 0.992 336 D CA 3.888 57.909 54.000 0.036 0.000 0.833 336 D CB 0.501 41.367 40.800 0.110 0.000 0.954 336 D HN 0.527 8.882 8.370 -0.025 0.000 0.455 337 Q N -1.579 118.180 119.800 -0.067 0.000 2.050 337 Q HA -0.241 4.086 4.340 -0.022 0.000 0.202 337 Q C 1.623 177.577 176.000 -0.076 0.000 0.980 337 Q CA 2.561 58.333 55.803 -0.051 0.000 0.840 337 Q CB 0.132 28.843 28.738 -0.046 0.000 0.898 337 Q HN 0.254 8.480 8.270 -0.074 0.000 0.424 338 S N -4.875 110.743 115.700 -0.137 0.000 2.501 338 S HA -0.067 4.347 4.470 -0.092 0.000 0.220 338 S C 1.357 175.861 174.600 -0.160 0.000 0.997 338 S CA 0.226 58.346 58.200 -0.135 0.000 0.919 338 S CB 1.325 64.440 63.200 -0.142 0.000 0.778 338 S HN -0.540 7.934 8.310 -0.174 -0.268 0.523 339 G N 2.745 111.373 108.800 -0.287 0.000 2.221 339 G HA2 -0.391 3.328 3.960 -0.402 0.000 0.265 339 G HA3 -0.391 3.576 3.960 0.013 0.000 0.265 339 G C -1.441 173.274 174.900 -0.309 0.000 1.041 339 G CA 0.764 45.708 45.100 -0.261 0.000 0.807 339 G HN 0.080 8.155 8.290 -0.357 0.000 0.502 340 T N -4.488 109.752 114.554 -0.523 0.000 2.930 340 T HA 0.541 4.937 4.350 -0.067 -0.086 0.290 340 T C -1.714 172.800 174.700 -0.310 0.000 1.052 340 T CA -2.892 59.061 62.100 -0.244 0.000 1.017 340 T CB 3.019 71.817 68.868 -0.117 0.000 1.137 340 T HN -0.824 7.037 8.240 -0.632 0.000 0.511 341 I N 1.101 121.650 120.570 -0.034 0.000 2.325 341 I HA 0.350 4.533 4.170 0.022 0.000 0.291 341 I C -1.590 174.517 176.117 -0.015 0.000 1.019 341 I CA -2.459 58.853 61.300 0.021 0.000 1.302 341 I CB 1.036 39.093 38.000 0.095 0.000 1.401 341 I HN -0.189 8.044 8.210 0.039 0.000 0.485 342 P HA 0.115 4.513 4.420 -0.037 0.000 0.271 342 P C -1.911 175.383 177.300 -0.010 0.000 1.216 342 P CA -0.090 62.992 63.100 -0.030 0.000 0.771 342 P CB 0.353 32.033 31.700 -0.034 0.000 0.864 343 N N -1.222 117.476 118.700 -0.002 0.000 2.710 343 N HA 0.485 5.359 4.740 -0.005 -0.137 0.257 343 N C -1.917 173.603 175.510 0.016 0.000 1.327 343 N CA -0.916 52.139 53.050 0.009 0.000 0.861 343 N CB 3.681 42.190 38.487 0.036 0.000 1.532 343 N HN -0.239 8.139 8.380 -0.003 0.000 0.499 344 V N 1.176 121.102 119.914 0.020 0.000 2.409 344 V HA 0.334 4.471 4.120 0.028 0.000 0.290 344 V C -0.034 176.094 176.094 0.057 0.000 1.017 344 V CA -1.961 60.357 62.300 0.030 0.000 0.841 344 V CB 1.424 33.258 31.823 0.018 0.000 1.003 344 V HN 0.208 8.406 8.190 0.014 0.000 0.426 345 G N 8.238 117.076 108.800 0.063 0.000 2.225 345 G HA2 -0.430 3.572 3.960 0.071 0.000 0.267 345 G HA3 -0.430 3.580 3.960 0.083 0.000 0.267 345 G C 0.146 175.123 174.900 0.129 0.000 1.024 345 G CA 0.591 45.741 45.100 0.083 0.000 0.784 345 G HN 0.905 9.226 8.290 0.052 0.000 0.507 346 G N -4.111 104.768 108.800 0.131 0.000 2.217 346 G HA2 -0.556 3.582 3.960 0.162 0.000 0.246 346 G HA3 -0.556 3.540 3.960 0.227 0.000 0.246 346 G C -1.376 173.666 174.900 0.237 0.000 0.990 346 G CA -0.305 44.911 45.100 0.194 0.000 0.627 346 G HN -0.207 8.324 8.290 0.101 -0.181 0.522 347 R N 1.957 122.540 120.500 0.138 0.000 2.298 347 R HA 0.112 4.287 4.340 -0.461 -0.111 0.310 347 R C -0.271 175.951 176.300 -0.129 0.000 1.068 347 R CA -0.669 55.335 56.100 -0.161 0.000 0.957 347 R CB 0.945 31.144 30.300 -0.169 0.000 1.003 347 R HN -0.548 7.655 8.270 0.136 0.148 0.454 348 I N 7.377 127.837 120.570 -0.182 0.000 2.668 348 I HA -0.237 4.054 4.170 -0.044 -0.147 0.285 348 I C -0.308 175.758 176.117 -0.086 0.000 1.168 348 I CA 1.029 62.275 61.300 -0.090 0.000 1.424 348 I CB -0.291 37.661 38.000 -0.079 0.000 1.377 348 I HN 0.268 8.305 8.210 -0.288 0.000 0.560 349 N N 9.571 128.242 118.700 -0.048 0.000 2.412 349 N HA -0.262 4.453 4.740 -0.042 0.000 0.258 349 N C 0.582 176.068 175.510 -0.040 0.000 1.236 349 N CA 2.231 55.257 53.050 -0.039 0.000 0.882 349 N CB 0.174 38.647 38.487 -0.024 0.000 1.066 349 N HN -0.248 8.112 8.380 -0.035 0.000 0.465 350 G N 0.440 109.217 108.800 -0.038 0.000 2.199 350 G HA2 -0.257 3.687 3.960 -0.025 0.000 0.254 350 G HA3 -0.257 3.687 3.960 -0.027 0.000 0.254 350 G C -1.384 173.492 174.900 -0.039 0.000 0.982 350 G CA -0.115 44.965 45.100 -0.032 0.000 0.632 350 G HN 0.295 8.564 8.290 -0.036 0.000 0.529 351 S N 0.448 116.109 115.700 -0.065 0.000 2.501 351 S HA 0.532 4.975 4.470 -0.046 0.000 0.301 351 S C -1.341 173.202 174.600 -0.095 0.000 1.096 351 S CA -3.650 54.506 58.200 -0.074 0.000 1.063 351 S CB 1.202 64.344 63.200 -0.097 0.000 1.042 351 S HN -0.537 7.611 8.310 -0.080 0.114 0.494 352 P HA 0.130 4.527 4.420 -0.038 0.000 0.245 352 P C -0.486 176.797 177.300 -0.028 0.000 1.203 352 P CA 0.826 63.905 63.100 -0.035 0.000 0.792 352 P CB 0.328 32.030 31.700 0.003 0.000 0.997 353 N N -4.973 113.697 118.700 -0.049 0.000 2.193 353 N HA 0.093 4.951 4.740 0.197 0.000 0.236 353 N C -1.989 173.571 175.510 0.084 0.000 1.347 353 N CA -0.603 52.500 53.050 0.088 0.000 0.812 353 N CB 1.519 40.100 38.487 0.156 0.000 1.297 353 N HN -0.388 7.916 8.380 -0.066 0.036 0.499 354 E N -0.095 119.996 120.200 -0.183 0.000 2.212 354 E HA 0.845 5.529 4.350 0.213 -0.206 0.268 354 E C -1.536 174.855 176.600 -0.349 0.000 0.902 354 E CA -1.198 55.192 56.400 -0.017 0.000 0.779 354 E CB 3.649 33.416 29.700 0.111 0.000 1.172 354 E HN -0.658 7.533 8.360 -0.283 0.000 0.409 355 Y N 0.188 120.600 120.300 0.187 0.000 2.638 355 Y HA 0.912 5.684 4.550 0.118 -0.151 0.339 355 Y C -1.233 174.784 175.900 0.196 0.000 1.084 355 Y CA -1.650 56.535 58.100 0.142 0.000 1.068 355 Y CB 4.585 43.098 38.460 0.087 0.000 1.294 355 Y HN 0.700 9.222 8.280 0.403 0.000 0.480 356 V N -4.855 115.242 119.914 0.306 0.000 2.876 356 V HA 1.012 5.516 4.120 0.278 -0.216 0.312 356 V C -1.623 174.595 176.094 0.206 0.000 1.085 356 V CA -2.851 59.599 62.300 0.250 0.000 0.945 356 V CB 3.753 35.695 31.823 0.199 0.000 1.017 356 V HN 0.594 8.965 8.190 0.301 0.000 0.428 357 V N -4.284 115.741 119.914 0.184 0.000 3.159 357 V HA 0.491 4.708 4.120 0.161 0.000 0.308 357 V C -0.164 176.039 176.094 0.182 0.000 1.190 357 V CA -2.842 59.556 62.300 0.164 0.000 1.037 357 V CB 2.985 34.889 31.823 0.135 0.000 1.060 357 V HN -0.012 8.292 8.190 0.189 0.000 0.437 358 G N 0.258 109.179 108.800 0.201 0.000 2.593 358 G HA2 -0.313 3.998 3.960 0.268 0.000 0.237 358 G HA3 -0.313 3.768 3.960 0.201 0.000 0.237 358 G C 0.172 175.298 174.900 0.378 0.000 1.312 358 G CA 0.317 45.570 45.100 0.254 0.000 0.896 358 G HN 0.208 8.938 8.290 0.194 -0.324 0.574 359 W N 0.116 121.475 121.300 0.099 0.000 2.392 359 W HA -0.041 4.829 4.660 0.079 -0.162 0.279 359 W C 2.143 178.724 176.519 0.102 0.000 1.225 359 W CA 1.914 59.314 57.345 0.091 0.000 1.233 359 W CB -0.327 29.186 29.460 0.088 0.000 1.122 359 W HN 0.361 8.820 8.180 0.465 0.000 0.561 360 I N -0.861 119.909 120.570 0.333 0.000 2.676 360 I HA -0.359 3.960 4.170 0.248 0.000 0.259 360 I C 0.589 176.811 176.117 0.175 0.000 1.194 360 I CA 0.849 62.299 61.300 0.249 0.000 1.473 360 I CB -0.049 38.104 38.000 0.256 0.000 1.096 360 I HN -0.057 8.335 8.210 0.330 0.016 0.443 361 K N -0.522 119.984 120.400 0.176 0.000 2.099 361 K HA -0.092 4.291 4.320 0.106 0.000 0.203 361 K C 1.587 178.238 176.600 0.085 0.000 1.047 361 K CA 2.394 58.756 56.287 0.126 0.000 0.963 361 K CB 0.356 32.942 32.500 0.143 0.000 0.759 361 K HN -0.513 7.735 8.250 0.209 0.128 0.451 362 R N -4.142 116.419 120.500 0.102 0.000 2.308 362 R HA 0.074 4.436 4.340 0.036 0.000 0.202 362 R C 0.244 176.529 176.300 -0.025 0.000 0.898 362 R CA -0.122 56.008 56.100 0.049 0.000 1.046 362 R CB 1.352 31.703 30.300 0.086 0.000 1.026 362 R HN -0.505 7.855 8.270 0.151 0.000 0.512 363 G N -0.047 108.730 108.800 -0.038 0.000 2.707 363 G HA2 -0.213 3.689 3.960 -0.098 0.000 0.686 363 G HA3 -0.213 3.655 3.960 -0.154 0.000 0.686 363 G C -2.609 172.030 174.900 -0.435 0.000 1.315 363 G CA -0.781 44.231 45.100 -0.148 0.000 0.832 363 G HN -0.513 7.793 8.290 0.026 0.000 0.573 364 P HA 0.136 3.176 4.420 -2.300 0.000 0.214 364 P C -1.749 174.554 177.300 -1.662 0.000 1.826 364 P CA -0.608 61.597 63.100 -1.491 0.000 0.977 364 P CB -1.120 30.183 31.700 -0.662 0.000 1.930 365 T N -2.345 111.438 114.554 -1.284 0.000 2.909 365 T HA 0.095 4.147 4.350 -0.497 0.000 0.299 365 T C -1.440 173.223 174.700 -0.061 0.000 1.073 365 T CA -1.216 60.566 62.100 -0.529 0.000 0.999 365 T CB 2.906 71.619 68.868 -0.259 0.000 1.098 365 T HN -0.231 7.253 8.240 -1.164 0.058 0.477 366 G N 1.453 110.367 108.800 0.190 0.000 2.697 366 G HA2 -0.180 3.888 3.960 0.180 0.000 0.684 366 G HA3 -0.180 3.957 3.960 0.295 0.000 0.684 366 G C -1.106 174.014 174.900 0.366 0.000 1.274 366 G CA -0.749 44.518 45.100 0.279 0.000 0.806 366 G HN -0.224 8.159 8.290 0.155 0.000 0.644 367 V N -0.126 119.921 119.914 0.222 0.000 3.376 367 V HA -0.030 4.191 4.120 0.170 0.000 0.303 367 V C 0.946 177.140 176.094 0.168 0.000 1.100 367 V CA -0.215 62.187 62.300 0.170 0.000 1.126 367 V CB 1.229 33.121 31.823 0.114 0.000 1.085 367 V HN 0.197 8.492 8.190 0.175 0.000 0.480 368 I N 2.321 122.968 120.570 0.128 0.000 2.145 368 I HA -0.420 3.829 4.170 0.132 0.000 0.244 368 I C 1.850 178.129 176.117 0.270 0.000 1.075 368 I CA 3.544 64.944 61.300 0.168 0.000 1.332 368 I CB -0.847 37.239 38.000 0.143 0.000 1.033 368 I HN 0.331 8.602 8.210 0.102 0.000 0.410 369 G N -3.397 105.512 108.800 0.180 0.000 2.498 369 G HA2 -0.134 3.872 3.960 0.076 0.000 0.219 369 G HA3 -0.134 3.854 3.960 0.046 0.000 0.219 369 G C 1.417 176.331 174.900 0.023 0.000 1.119 369 G CA 2.080 47.231 45.100 0.085 0.000 0.766 369 G HN 0.296 8.670 8.290 0.140 0.000 0.552 370 T N 0.060 114.673 114.554 0.098 0.000 3.007 370 T HA -0.311 4.068 4.350 0.049 0.000 0.270 370 T C 1.424 176.186 174.700 0.104 0.000 1.107 370 T CA 3.542 65.698 62.100 0.093 0.000 1.118 370 T CB -0.623 68.332 68.868 0.145 0.000 0.889 370 T HN -0.368 7.922 8.240 0.134 0.030 0.506 371 N N 1.297 120.095 118.700 0.164 0.000 2.494 371 N HA -0.083 4.782 4.740 0.209 0.000 0.182 371 N C 1.102 176.677 175.510 0.109 0.000 1.076 371 N CA 2.472 55.659 53.050 0.229 0.000 0.908 371 N CB -0.072 38.642 38.487 0.377 0.000 0.967 371 N HN -0.444 8.019 8.380 0.209 0.042 0.449 372 K N 1.392 121.621 120.400 -0.285 0.000 1.991 372 K HA -0.330 3.534 4.320 -0.760 0.000 0.207 372 K C 1.427 177.902 176.600 -0.208 0.000 1.045 372 K CA 4.047 59.958 56.287 -0.628 0.000 0.937 372 K CB -0.061 31.838 32.500 -1.002 0.000 0.720 372 K HN -0.420 7.608 8.250 -0.294 0.045 0.438 373 K N -1.945 118.376 120.400 -0.131 0.000 2.097 373 K HA -0.310 3.975 4.320 -0.058 0.000 0.205 373 K C 1.580 178.178 176.600 -0.003 0.000 1.050 373 K CA 3.276 59.531 56.287 -0.054 0.000 0.938 373 K CB -0.385 32.093 32.500 -0.036 0.000 0.718 373 K HN 0.002 8.169 8.250 -0.138 0.000 0.442 374 D N -0.887 119.528 120.400 0.025 0.000 2.092 374 D HA -0.311 4.366 4.640 0.061 0.000 0.193 374 D C 1.584 177.930 176.300 0.076 0.000 0.994 374 D CA 3.329 57.369 54.000 0.067 0.000 0.828 374 D CB -0.174 40.690 40.800 0.107 0.000 0.963 374 D HN -0.642 7.740 8.370 0.021 0.000 0.450 375 A N -1.574 121.301 122.820 0.092 0.000 1.902 375 A HA -0.376 4.007 4.320 0.105 0.000 0.217 375 A C 1.959 179.580 177.584 0.062 0.000 1.181 375 A CA 3.120 55.220 52.037 0.104 0.000 0.623 375 A CB -0.615 18.491 19.000 0.176 0.000 0.818 375 A HN -0.527 7.681 8.150 0.096 0.000 0.443 376 Q N -1.293 118.530 119.800 0.038 0.000 2.084 376 Q HA -0.356 3.999 4.340 0.025 0.000 0.202 376 Q C 2.077 178.086 176.000 0.014 0.000 0.978 376 Q CA 2.889 58.704 55.803 0.020 0.000 0.844 376 Q CB -0.457 28.282 28.738 0.001 0.000 0.898 376 Q HN -0.273 8.012 8.270 0.025 0.000 0.426 377 D N -1.388 119.025 120.400 0.022 0.000 2.097 377 D HA -0.232 4.419 4.640 0.019 0.000 0.195 377 D C 2.468 178.785 176.300 0.029 0.000 0.989 377 D CA 3.271 57.286 54.000 0.026 0.000 0.827 377 D CB -0.515 40.306 40.800 0.035 0.000 0.966 377 D HN -0.196 8.189 8.370 0.025 0.000 0.456 378 T N 3.139 117.718 114.554 0.041 0.000 2.708 378 T HA -0.286 4.276 4.350 0.082 -0.163 0.266 378 T C 2.052 176.710 174.700 -0.070 0.000 1.037 378 T CA 4.706 66.832 62.100 0.042 0.000 1.146 378 T CB -0.013 68.904 68.868 0.083 0.000 0.865 378 T HN -0.551 7.720 8.240 0.052 0.000 0.435 379 V N 1.760 121.634 119.914 -0.067 0.000 2.407 379 V HA -0.479 3.522 4.120 -0.199 0.000 0.248 379 V C 1.745 177.775 176.094 -0.107 0.000 1.055 379 V CA 4.693 66.923 62.300 -0.116 0.000 1.049 379 V CB -0.782 31.012 31.823 -0.048 0.000 0.662 379 V HN -0.037 8.139 8.190 -0.024 0.000 0.455 380 D N -0.178 120.191 120.400 -0.050 0.000 2.123 380 D HA -0.249 4.372 4.640 -0.031 0.000 0.196 380 D C 2.745 179.021 176.300 -0.041 0.000 0.992 380 D CA 3.723 57.703 54.000 -0.033 0.000 0.833 380 D CB -0.603 40.194 40.800 -0.006 0.000 0.954 380 D HN 0.015 8.367 8.370 -0.030 0.000 0.455 381 T N 2.514 117.050 114.554 -0.030 0.000 2.708 381 T HA -0.351 4.018 4.350 0.031 0.000 0.266 381 T C 1.999 176.671 174.700 -0.046 0.000 1.037 381 T CA 4.492 66.599 62.100 0.011 0.000 1.146 381 T CB -0.144 68.786 68.868 0.104 0.000 0.865 381 T HN -0.641 7.586 8.240 -0.021 0.000 0.435 382 L N 2.209 123.255 121.223 -0.296 0.000 2.012 382 L HA -0.296 3.702 4.340 -0.570 0.000 0.210 382 L C 1.831 178.553 176.870 -0.246 0.000 1.073 382 L CA 3.133 57.638 54.840 -0.558 0.000 0.748 382 L CB -0.110 41.375 42.059 -0.957 0.000 0.891 382 L HN -0.296 7.726 8.230 -0.346 0.000 0.431 383 I N -1.828 118.630 120.570 -0.188 0.000 2.252 383 I HA -0.626 3.430 4.170 -0.190 0.000 0.245 383 I C 1.692 177.763 176.117 -0.078 0.000 1.102 383 I CA 4.078 65.298 61.300 -0.134 0.000 1.385 383 I CB -0.302 37.653 38.000 -0.076 0.000 1.064 383 I HN -0.063 8.040 8.210 -0.178 0.000 0.414 384 K N 0.053 120.428 120.400 -0.041 0.000 2.032 384 K HA -0.468 3.853 4.320 0.001 0.000 0.209 384 K C 2.111 178.712 176.600 0.002 0.000 1.048 384 K CA 3.995 60.279 56.287 -0.005 0.000 0.927 384 K CB -0.361 32.146 32.500 0.011 0.000 0.712 384 K HN -0.209 8.015 8.250 -0.043 0.000 0.441 385 N N -0.915 117.792 118.700 0.011 0.000 2.188 385 N HA -0.265 4.502 4.740 0.044 0.000 0.184 385 N C 2.413 177.924 175.510 0.001 0.000 1.018 385 N CA 2.955 56.029 53.050 0.040 0.000 0.858 385 N CB 0.144 38.707 38.487 0.127 0.000 0.989 385 N HN -0.455 7.931 8.380 0.010 0.000 0.426 386 L N -0.305 120.868 121.223 -0.083 0.000 2.056 386 L HA -0.313 3.954 4.340 -0.121 0.000 0.207 386 L C 2.052 178.898 176.870 -0.041 0.000 1.078 386 L CA 3.138 57.872 54.840 -0.176 0.000 0.749 386 L CB -0.394 41.302 42.059 -0.605 0.000 0.901 386 L HN -0.094 8.067 8.230 -0.115 0.000 0.433 387 G N -2.196 106.601 108.800 -0.005 0.000 2.418 387 G HA2 -0.447 3.589 3.960 0.127 0.000 0.217 387 G HA3 -0.447 3.548 3.960 0.059 0.000 0.217 387 G C 0.799 175.734 174.900 0.059 0.000 1.158 387 G CA 2.162 47.303 45.100 0.069 0.000 0.771 387 G HN -0.075 8.195 8.290 -0.034 0.000 0.545 388 N N 2.146 120.869 118.700 0.037 0.000 2.120 388 N HA -0.406 4.355 4.740 0.035 0.000 0.188 388 N C 2.134 177.668 175.510 0.039 0.000 1.024 388 N CA 2.730 55.801 53.050 0.036 0.000 0.852 388 N CB 0.030 38.536 38.487 0.031 0.000 1.003 388 N HN -0.433 7.964 8.380 0.028 0.000 0.424 389 A N 0.267 123.112 122.820 0.041 0.000 1.902 389 A HA -0.290 4.051 4.320 0.035 0.000 0.217 389 A C 1.491 179.110 177.584 0.058 0.000 1.181 389 A CA 2.963 55.027 52.037 0.044 0.000 0.623 389 A CB -0.621 18.406 19.000 0.044 0.000 0.818 389 A HN -0.250 7.921 8.150 0.036 0.000 0.443 390 K N -1.167 119.288 120.400 0.092 0.000 2.057 390 K HA -0.297 4.080 4.320 0.096 0.000 0.206 390 K C 2.737 179.372 176.600 0.059 0.000 1.050 390 K CA 3.083 59.432 56.287 0.102 0.000 0.935 390 K CB -0.050 32.551 32.500 0.167 0.000 0.715 390 K HN -0.202 8.111 8.250 0.105 0.000 0.439 391 E N -0.060 120.172 120.200 0.053 0.000 2.204 391 E HA -0.146 4.224 4.350 0.033 0.000 0.194 391 E C 1.564 178.179 176.600 0.026 0.000 0.989 391 E CA 1.775 58.197 56.400 0.036 0.000 0.824 391 E CB -0.126 29.595 29.700 0.035 0.000 0.756 391 E HN -0.337 8.058 8.360 0.059 0.000 0.477 392 G N -3.440 105.375 108.800 0.026 0.000 3.141 392 G HA2 -0.006 3.962 3.960 0.014 0.000 0.218 392 G HA3 -0.006 3.964 3.960 0.017 0.000 0.218 392 G C -1.082 173.825 174.900 0.012 0.000 1.170 392 G CA -0.758 44.352 45.100 0.017 0.000 0.769 392 G HN -0.642 7.550 8.290 0.031 0.116 0.546 393 A N -1.873 120.956 122.820 0.014 0.000 2.687 393 A HA -0.349 3.975 4.320 0.007 0.000 0.299 393 A C -0.123 177.459 177.584 -0.002 0.000 1.497 393 A CA 1.124 53.164 52.037 0.005 0.000 0.751 393 A CB -2.161 16.838 19.000 -0.001 0.000 1.048 393 A HN -0.475 7.505 8.150 0.021 0.182 0.464 394 E N -3.926 116.277 120.200 0.006 0.000 2.583 394 E HA 0.137 4.478 4.350 -0.014 0.000 0.213 394 E C -0.522 176.074 176.600 -0.007 0.000 0.989 394 E CA -0.499 55.899 56.400 -0.003 0.000 0.991 394 E CB 1.238 30.941 29.700 0.006 0.000 1.040 394 E HN 0.152 8.523 8.360 0.018 0.000 0.481 395 C N -0.829 118.472 119.300 0.002 0.000 2.657 395 C HA -0.035 4.439 4.460 0.022 0.000 0.404 395 C C 1.075 176.001 174.990 -0.107 0.000 1.291 395 C CA 0.151 59.169 59.018 -0.000 0.000 2.218 395 C CB 0.436 28.216 27.740 0.068 0.000 2.687 395 C HN -0.058 8.178 8.230 0.011 0.000 0.634 396 K N 3.180 123.455 120.400 -0.209 0.000 2.276 396 K HA -0.008 4.106 4.320 -0.343 0.000 0.259 396 K C -0.367 175.901 176.600 -0.553 0.000 1.001 396 K CA 0.438 56.447 56.287 -0.463 0.000 0.927 396 K CB 0.777 32.790 32.500 -0.811 0.000 0.969 396 K HN 0.559 8.715 8.250 -0.155 0.000 0.490 397 S N 0.979 116.359 115.700 -0.534 0.000 2.429 397 S HA 0.343 4.645 4.470 -0.279 0.000 0.302 397 S C -1.338 172.975 174.600 -0.477 0.000 1.115 397 S CA -0.679 57.298 58.200 -0.372 0.000 1.095 397 S CB 0.245 63.325 63.200 -0.201 0.000 0.987 397 S HN 0.090 8.112 8.310 -0.481 0.000 0.474 398 F N 6.665 126.522 119.950 -0.154 0.000 2.551 398 F HA 0.432 4.727 4.527 -0.386 0.000 0.316 398 F C -1.513 174.195 175.800 -0.153 0.000 1.089 398 F CA -2.950 54.867 58.000 -0.306 0.000 0.915 398 F CB -0.262 38.421 39.000 -0.528 0.000 1.186 398 F HN 0.099 8.342 8.300 -0.095 0.000 0.456 402 H N 2.116 121.100 119.070 -0.144 0.000 2.390 402 H HA -0.407 4.107 4.556 -0.318 -0.149 0.298 402 H C 0.472 175.544 175.328 -0.427 0.000 1.106 402 H CA 2.882 58.704 56.048 -0.376 0.000 1.297 402 H CB 0.560 29.916 29.762 -0.677 0.000 1.375 402 H HN 0.263 8.615 8.280 0.120 0.000 0.509 403 A N -2.416 120.186 122.820 -0.364 0.000 1.908 403 A HA -0.354 3.693 4.320 -0.456 0.000 0.218 403 A C 2.161 179.639 177.584 -0.175 0.000 1.181 403 A CA 3.017 54.891 52.037 -0.272 0.000 0.627 403 A CB -0.780 18.238 19.000 0.029 0.000 0.818 403 A HN 0.530 8.576 8.150 -0.158 0.010 0.445 404 D N -1.427 118.916 120.400 -0.095 0.000 2.117 404 D HA -0.248 4.385 4.640 -0.010 0.000 0.198 404 D C 2.339 178.591 176.300 -0.080 0.000 0.982 404 D CA 2.985 56.958 54.000 -0.045 0.000 0.828 404 D CB -0.584 40.209 40.800 -0.011 0.000 0.967 404 D HN -0.517 7.810 8.370 -0.071 0.000 0.464 405 Q N -0.045 119.677 119.800 -0.131 0.000 2.079 405 Q HA -0.300 4.005 4.340 -0.058 0.000 0.200 405 Q C 2.540 178.449 176.000 -0.153 0.000 0.974 405 Q CA 3.014 58.747 55.803 -0.117 0.000 0.840 405 Q CB 0.142 28.824 28.738 -0.093 0.000 0.898 405 Q HN -0.697 7.483 8.270 -0.151 0.000 0.430 406 V N -0.033 119.676 119.914 -0.341 0.000 2.427 406 V HA -0.415 3.610 4.120 -0.159 0.000 0.248 406 V C 0.962 176.999 176.094 -0.095 0.000 1.051 406 V CA 2.613 64.750 62.300 -0.272 0.000 1.048 406 V CB -0.449 31.002 31.823 -0.620 0.000 0.666 406 V HN -0.116 7.771 8.190 -0.505 0.000 0.456 407 A N 0.020 122.761 122.820 -0.131 0.000 1.930 407 A HA -0.376 3.769 4.320 -0.292 0.000 0.217 407 A C 1.756 179.302 177.584 -0.062 0.000 1.175 407 A CA 3.398 55.371 52.037 -0.107 0.000 0.627 407 A CB -0.564 18.484 19.000 0.081 0.000 0.815 407 A HN -0.299 7.770 8.150 -0.135 0.000 0.443 408 D N -0.977 119.415 120.400 -0.013 0.000 2.144 408 D HA -0.227 4.410 4.640 -0.005 0.000 0.199 408 D C 1.857 178.178 176.300 0.036 0.000 0.984 408 D CA 3.120 57.125 54.000 0.008 0.000 0.834 408 D CB -0.329 40.483 40.800 0.019 0.000 0.955 408 D HN -0.331 8.028 8.370 -0.017 0.000 0.465 409 W N 1.397 122.613 121.300 -0.140 0.000 2.355 409 W HA -0.321 4.283 4.660 -0.095 0.000 0.309 409 W C 1.433 177.866 176.519 -0.143 0.000 1.206 409 W CA 4.031 61.300 57.345 -0.126 0.000 1.284 409 W CB 0.018 29.397 29.460 -0.135 0.000 1.145 409 W HN -0.508 7.793 8.180 0.201 0.000 0.502 410 L N -2.038 118.967 121.223 -0.363 0.000 2.046 410 L HA -0.576 3.215 4.340 -0.915 0.000 0.208 410 L C 2.365 178.985 176.870 -0.417 0.000 1.077 410 L CA 3.026 57.493 54.840 -0.622 0.000 0.747 410 L CB -0.545 41.114 42.059 -0.666 0.000 0.896 410 L HN -0.176 7.961 8.230 -0.156 0.000 0.432 411 A N -2.024 120.650 122.820 -0.244 0.000 1.969 411 A HA -0.244 4.119 4.320 -0.166 -0.143 0.218 411 A C 1.724 179.216 177.584 -0.155 0.000 1.169 411 A CA 2.444 54.386 52.037 -0.160 0.000 0.635 411 A CB -0.632 18.322 19.000 -0.077 0.000 0.810 411 A HN -0.142 7.891 8.150 -0.196 0.000 0.445 412 A N -2.170 120.559 122.820 -0.150 0.000 1.898 412 A HA -0.242 4.031 4.320 -0.079 0.000 0.216 412 A C 1.997 179.488 177.584 -0.156 0.000 1.181 412 A CA 2.540 54.510 52.037 -0.112 0.000 0.620 412 A CB -0.437 18.533 19.000 -0.050 0.000 0.819 412 A HN -0.361 7.701 8.150 -0.147 0.000 0.442 413 R N -4.575 115.756 120.500 -0.282 0.000 2.153 413 R HA -0.017 4.221 4.340 -0.171 0.000 0.218 413 R C 0.186 176.367 176.300 -0.199 0.000 1.072 413 R CA 0.551 56.492 56.100 -0.265 0.000 0.990 413 R CB 0.836 30.847 30.300 -0.482 0.000 0.889 413 R HN -0.512 7.524 8.270 -0.390 0.000 0.452 414 Q N -2.288 117.345 119.800 -0.278 0.000 3.021 414 Q HA 0.494 4.662 4.340 -0.288 0.000 0.234 414 Q C -2.271 173.591 176.000 -0.230 0.000 0.930 414 Q CA -2.912 52.694 55.803 -0.327 0.000 0.714 414 Q CB 0.047 28.448 28.738 -0.562 0.000 1.325 414 Q HN -0.444 7.648 8.270 -0.298 0.000 0.473 415 P HA -0.013 4.442 4.420 -0.110 -0.102 0.225 415 P C -0.096 177.133 177.300 -0.118 0.000 1.148 415 P CA 1.021 64.051 63.100 -0.116 0.000 0.779 415 P CB 0.437 32.087 31.700 -0.082 0.000 0.780 416 K N -2.490 117.826 120.400 -0.139 0.000 2.675 416 K HA 0.124 4.378 4.320 -0.111 0.000 0.213 416 K C -0.239 176.278 176.600 -0.138 0.000 1.074 416 K CA -0.600 55.612 56.287 -0.124 0.000 1.172 416 K CB -0.064 32.377 32.500 -0.100 0.000 0.927 416 K HN -0.381 8.045 8.250 -0.163 -0.274 0.471 417 L N -3.791 117.344 121.223 -0.146 0.000 2.464 417 L HA 0.115 4.498 4.340 -0.147 -0.131 0.264 417 L C 0.071 176.902 176.870 -0.064 0.000 1.199 417 L CA -0.604 54.165 54.840 -0.117 0.000 0.818 417 L CB 0.667 42.674 42.059 -0.087 0.000 1.102 417 L HN -0.702 7.372 8.230 -0.147 0.068 0.473 418 V N 2.108 122.007 119.914 -0.025 0.000 2.326 418 V HA 0.258 4.407 4.120 0.048 0.000 0.281 418 V C -0.201 175.978 176.094 0.141 0.000 1.015 418 V CA -1.389 60.954 62.300 0.073 0.000 0.823 418 V CB 0.869 32.781 31.823 0.148 0.000 1.009 418 V HN 0.287 8.342 8.190 -0.055 0.101 0.436 419 T N 4.101 118.754 114.554 0.165 0.000 2.754 419 T HA 0.400 4.949 4.350 -0.008 -0.205 0.286 419 T C 1.269 176.185 174.700 0.360 0.000 0.997 419 T CA -1.161 61.031 62.100 0.153 0.000 0.982 419 T CB 1.079 70.020 68.868 0.122 0.000 1.027 419 T HN 0.331 8.659 8.240 0.147 0.000 0.529 420 S N 2.219 118.105 115.700 0.311 0.000 2.359 420 S HA -0.494 4.208 4.470 0.387 0.000 0.224 420 S C 1.488 176.215 174.600 0.212 0.000 1.035 420 S CA 3.862 62.253 58.200 0.319 0.000 1.018 420 S CB -0.645 62.707 63.200 0.253 0.000 0.876 420 S HN 0.599 9.026 8.310 0.194 0.000 0.448 421 A N -0.107 122.784 122.820 0.120 0.000 1.940 421 A HA -0.269 4.015 4.320 -0.059 0.000 0.219 421 A C 1.756 179.236 177.584 -0.173 0.000 1.176 421 A CA 2.602 54.612 52.037 -0.046 0.000 0.631 421 A CB -0.837 18.108 19.000 -0.091 0.000 0.814 421 A HN 0.248 8.478 8.150 0.134 0.000 0.446 422 H N -2.428 116.681 119.070 0.064 0.000 2.436 422 H HA -0.104 4.453 4.556 0.002 0.000 0.294 422 H C 1.983 177.350 175.328 0.064 0.000 1.048 422 H CA 3.691 59.768 56.048 0.048 0.000 1.353 422 H CB 0.607 30.403 29.762 0.058 0.000 1.414 422 H HN -0.846 7.594 8.280 0.280 0.008 0.536 423 W N 0.931 122.281 121.300 0.084 0.000 2.338 423 W HA -0.485 4.163 4.660 -0.020 0.000 0.304 423 W C 1.071 177.540 176.519 -0.083 0.000 1.212 423 W CA 3.769 61.095 57.345 -0.031 0.000 1.264 423 W CB -0.169 29.205 29.460 -0.144 0.000 1.142 423 W HN 0.184 8.623 8.180 0.430 0.000 0.512 424 Q N -2.719 116.732 119.800 -0.581 0.000 2.170 424 Q HA -0.462 3.222 4.340 -1.093 0.000 0.203 424 Q C 2.248 177.947 176.000 -0.502 0.000 0.976 424 Q CA 3.502 58.887 55.803 -0.696 0.000 0.858 424 Q CB -0.330 28.206 28.738 -0.336 0.000 0.907 424 Q HN -0.228 7.810 8.270 -0.247 0.084 0.433 425 V N 0.246 119.967 119.914 -0.320 0.000 2.307 425 V HA -0.373 3.645 4.120 -0.171 0.000 0.245 425 V C 1.915 177.907 176.094 -0.171 0.000 1.045 425 V CA 3.600 65.784 62.300 -0.194 0.000 1.024 425 V CB -0.730 31.020 31.823 -0.122 0.000 0.651 425 V HN -0.802 7.124 8.190 -0.272 0.102 0.449 426 I N 0.855 121.303 120.570 -0.203 0.000 2.151 426 I HA -0.640 3.468 4.170 -0.103 0.000 0.243 426 I C 1.561 177.527 176.117 -0.251 0.000 1.080 426 I CA 4.933 66.138 61.300 -0.158 0.000 1.339 426 I CB -0.457 37.530 38.000 -0.022 0.000 1.039 426 I HN -0.588 7.514 8.210 -0.180 0.000 0.409 427 D N -0.658 119.310 120.400 -0.719 0.000 2.104 427 D HA -0.340 3.971 4.640 -0.548 0.000 0.194 427 D C 1.654 177.776 176.300 -0.297 0.000 0.994 427 D CA 3.283 56.849 54.000 -0.724 0.000 0.830 427 D CB -0.043 39.960 40.800 -1.328 0.000 0.959 427 D HN -0.160 7.581 8.370 -1.048 0.000 0.452 428 A N -1.129 121.533 122.820 -0.263 0.000 1.902 428 A HA -0.257 3.983 4.320 -0.133 0.000 0.217 428 A C 1.921 179.479 177.584 -0.042 0.000 1.181 428 A CA 2.914 54.872 52.037 -0.133 0.000 0.623 428 A CB -0.785 18.140 19.000 -0.125 0.000 0.818 428 A HN -0.477 7.472 8.150 -0.336 0.000 0.443 429 F N -0.761 119.103 119.950 -0.143 0.000 2.102 429 F HA -0.477 4.007 4.527 -0.073 0.000 0.298 429 F C 1.712 177.473 175.800 -0.065 0.000 1.105 429 F CA 4.105 62.053 58.000 -0.087 0.000 1.239 429 F CB 0.475 39.432 39.000 -0.072 0.000 0.991 429 F HN -0.138 8.235 8.300 0.121 0.000 0.474 430 E N -0.751 119.568 120.200 0.198 0.000 2.072 430 E HA -0.366 4.202 4.350 0.180 -0.110 0.191 430 E C 2.893 179.502 176.600 0.015 0.000 0.985 430 E CA 2.950 59.426 56.400 0.127 0.000 0.801 430 E CB -0.137 29.634 29.700 0.118 0.000 0.750 430 E HN -0.302 8.165 8.360 0.178 0.000 0.452 431 R N -0.912 119.579 120.500 -0.016 0.000 2.081 431 R HA -0.209 4.291 4.340 -0.010 -0.166 0.235 431 R C 2.247 178.506 176.300 -0.069 0.000 1.131 431 R CA 3.337 59.418 56.100 -0.031 0.000 0.960 431 R CB 0.059 30.337 30.300 -0.036 0.000 0.856 431 R HN -0.161 8.095 8.270 -0.025 0.000 0.436 432 A N -1.474 121.278 122.820 -0.113 0.000 2.015 432 A HA -0.118 4.125 4.320 -0.128 0.000 0.219 432 A C 1.532 179.012 177.584 -0.174 0.000 1.163 432 A CA 2.407 54.352 52.037 -0.153 0.000 0.646 432 A CB -0.804 18.082 19.000 -0.190 0.000 0.806 432 A HN -0.241 7.838 8.150 -0.117 0.000 0.448 433 A N -3.587 119.123 122.820 -0.182 0.000 1.969 433 A HA -0.225 4.006 4.320 -0.149 0.000 0.218 433 A C 1.227 178.814 177.584 0.004 0.000 1.169 433 A CA 1.993 53.956 52.037 -0.124 0.000 0.635 433 A CB -0.000 18.929 19.000 -0.118 0.000 0.810 433 A HN -0.384 7.544 8.150 -0.187 0.110 0.445 434 G N -2.907 105.890 108.800 -0.006 0.000 2.490 434 G HA2 -0.028 3.991 3.960 0.099 0.000 0.211 434 G HA3 -0.028 3.946 3.960 0.024 0.000 0.211 434 G C 1.469 176.364 174.900 -0.010 0.000 1.159 434 G CA 0.641 45.762 45.100 0.035 0.000 0.819 434 G HN -0.770 7.400 8.290 -0.030 0.102 0.539 435 E N 2.147 122.311 120.200 -0.060 0.000 2.085 435 E HA -0.074 4.372 4.350 -0.051 -0.126 0.194 435 E C 0.151 176.673 176.600 -0.131 0.000 0.994 435 E CA 4.048 60.402 56.400 -0.077 0.000 0.801 435 E CB -1.348 28.307 29.700 -0.075 0.000 0.743 435 E HN -0.325 7.995 8.360 -0.066 0.000 0.453 436 P HA -0.120 4.154 4.420 -0.243 0.000 0.225 436 P C 0.213 177.247 177.300 -0.444 0.000 1.148 436 P CA 1.361 64.244 63.100 -0.362 0.000 0.779 436 P CB -0.257 31.153 31.700 -0.484 0.000 0.780 437 H N -5.030 114.016 119.070 -0.040 0.000 2.542 437 H HA 0.245 4.782 4.556 -0.032 0.000 0.283 437 H C 0.824 176.133 175.328 -0.032 0.000 1.059 437 H CA -1.104 54.923 56.048 -0.035 0.000 1.162 437 H CB 0.620 30.360 29.762 -0.036 0.000 1.539 437 H HN -0.311 7.690 8.280 -0.202 0.157 0.543 438 G N 0.123 108.936 108.800 0.022 0.000 2.148 438 G HA2 -0.502 3.451 3.960 -0.012 0.000 0.254 438 G HA3 -0.502 3.465 3.960 0.013 0.000 0.254 438 G C -0.840 174.066 174.900 0.011 0.000 0.981 438 G CA 0.627 45.732 45.100 0.008 0.000 0.670 438 G HN -0.132 7.982 8.290 -0.025 0.161 0.528 439 R N -0.929 119.585 120.500 0.022 0.000 2.604 439 R HA 0.435 4.961 4.340 0.009 -0.181 0.287 439 R C -1.886 174.418 176.300 0.008 0.000 0.970 439 R CA -3.433 52.677 56.100 0.017 0.000 0.946 439 R CB 0.502 30.821 30.300 0.032 0.000 1.127 439 R HN -0.630 7.626 8.270 0.032 0.033 0.473 440 P HA -0.179 4.243 4.420 0.003 0.000 0.218 440 P C -1.218 176.095 177.300 0.020 0.000 1.149 440 P CA 1.717 64.824 63.100 0.013 0.000 0.817 440 P CB 0.456 32.170 31.700 0.023 0.000 0.785 441 R N -8.889 111.628 120.500 0.028 0.000 2.728 441 R HA 0.197 4.681 4.340 0.020 -0.132 0.274 441 R C -2.600 173.719 176.300 0.032 0.000 1.032 441 R CA -0.840 55.279 56.100 0.033 0.000 0.866 441 R CB 2.722 33.057 30.300 0.058 0.000 1.263 441 R HN -0.707 7.579 8.270 0.026 0.000 0.475 442 V N 1.282 121.218 119.914 0.037 0.000 2.378 442 V HA 0.271 4.396 4.120 0.009 0.000 0.288 442 V C -1.122 175.007 176.094 0.058 0.000 1.016 442 V CA -2.006 60.313 62.300 0.030 0.000 0.840 442 V CB 1.858 33.699 31.823 0.029 0.000 0.994 442 V HN 0.075 8.289 8.190 0.039 0.000 0.431 443 K N 6.729 127.149 120.400 0.033 0.000 2.185 443 K HA -0.086 4.434 4.320 0.083 -0.150 0.271 443 K C -0.496 176.136 176.600 0.054 0.000 1.013 443 K CA -0.300 56.018 56.287 0.052 0.000 0.943 443 K CB 0.835 33.352 32.500 0.027 0.000 0.998 443 K HN 0.259 8.510 8.250 0.001 0.000 0.468 444 L N 2.393 123.661 121.223 0.075 0.000 2.369 444 L HA -0.073 4.306 4.340 0.064 0.000 0.279 444 L C 0.031 176.931 176.870 0.051 0.000 1.108 444 L CA -0.125 54.748 54.840 0.055 0.000 0.852 444 L CB 0.203 42.271 42.059 0.015 0.000 1.169 444 L HN -0.037 8.551 8.230 0.086 -0.307 0.452 445 A N 1.264 124.125 122.820 0.068 0.000 2.308 445 A HA 0.205 4.742 4.320 0.099 -0.158 0.217 445 A C -0.594 177.081 177.584 0.152 0.000 1.216 445 A CA 0.013 52.119 52.037 0.115 0.000 0.864 445 A CB 0.511 19.598 19.000 0.145 0.000 0.902 445 A HN 0.394 8.587 8.150 0.071 0.000 0.499 446 S N -5.006 110.757 115.700 0.106 0.000 2.599 446 S HA 0.202 4.748 4.470 0.125 0.000 0.287 446 S C 0.172 174.812 174.600 0.067 0.000 1.105 446 S CA -2.345 55.915 58.200 0.100 0.000 0.899 446 S CB 3.018 66.271 63.200 0.088 0.000 1.100 446 S HN -0.778 7.635 8.310 0.081 -0.054 0.482 447 L N 3.224 124.491 121.223 0.072 0.000 2.042 447 L HA -0.323 4.044 4.340 0.045 0.000 0.210 447 L C 0.902 177.787 176.870 0.025 0.000 1.076 447 L CA 3.291 58.162 54.840 0.052 0.000 0.749 447 L CB -0.142 41.957 42.059 0.066 0.000 0.893 447 L HN 0.734 9.018 8.230 0.090 0.000 0.432 448 A N -2.687 120.148 122.820 0.025 0.000 1.908 448 A HA -0.413 3.909 4.320 0.002 0.000 0.218 448 A C 2.332 179.910 177.584 -0.010 0.000 1.181 448 A CA 3.150 55.192 52.037 0.008 0.000 0.627 448 A CB -0.928 18.080 19.000 0.013 0.000 0.818 448 A HN 0.074 8.245 8.150 0.035 0.000 0.445 449 E N -1.156 119.041 120.200 -0.005 0.000 2.072 449 E HA -0.339 3.981 4.350 -0.049 0.000 0.191 449 E C 2.643 179.195 176.600 -0.080 0.000 0.985 449 E CA 2.720 59.097 56.400 -0.037 0.000 0.801 449 E CB -0.116 29.579 29.700 -0.008 0.000 0.750 449 E HN -0.699 7.669 8.360 0.014 0.000 0.452 450 L N -0.767 120.431 121.223 -0.041 0.000 2.046 450 L HA -0.360 3.939 4.340 -0.069 0.000 0.208 450 L C 2.213 179.054 176.870 -0.049 0.000 1.077 450 L CA 3.374 58.188 54.840 -0.042 0.000 0.747 450 L CB -0.134 41.929 42.059 0.006 0.000 0.896 450 L HN -0.216 8.007 8.230 -0.012 0.000 0.432 451 L N -3.388 117.815 121.223 -0.033 0.000 2.217 451 L HA -0.346 3.979 4.340 -0.025 0.000 0.211 451 L C 2.092 178.930 176.870 -0.053 0.000 1.107 451 L CA 2.602 57.422 54.840 -0.034 0.000 0.783 451 L CB -0.777 41.267 42.059 -0.026 0.000 0.919 451 L HN 0.128 8.344 8.230 -0.023 0.000 0.442 452 R N 0.330 120.788 120.500 -0.070 0.000 2.105 452 R HA -0.313 3.994 4.340 -0.056 0.000 0.239 452 R C 2.152 178.386 176.300 -0.111 0.000 1.135 452 R CA 3.425 59.477 56.100 -0.079 0.000 0.967 452 R CB -0.125 30.125 30.300 -0.083 0.000 0.861 452 R HN -0.432 7.797 8.270 -0.068 0.000 0.442 453 I N -4.004 116.457 120.570 -0.183 0.000 2.494 453 I HA -0.052 3.992 4.170 -0.209 0.000 0.250 453 I C 1.961 178.028 176.117 -0.083 0.000 1.112 453 I CA 0.394 61.555 61.300 -0.232 0.000 1.438 453 I CB -0.445 37.232 38.000 -0.538 0.000 1.111 453 I HN -0.790 7.296 8.210 -0.196 0.006 0.431 454 G N -0.916 107.861 108.800 -0.039 0.000 2.403 454 G HA2 -0.195 3.826 3.960 0.101 0.000 0.216 454 G HA3 -0.195 3.806 3.960 0.067 0.000 0.216 454 G C 0.614 175.569 174.900 0.092 0.000 1.154 454 G CA 1.806 46.945 45.100 0.065 0.000 0.784 454 G HN -0.055 8.199 8.290 -0.060 0.000 0.538 455 L N -2.307 118.911 121.223 -0.009 0.000 2.416 455 L HA 0.032 4.246 4.340 -0.210 0.000 0.216 455 L C 0.772 177.621 176.870 -0.035 0.000 1.098 455 L CA -0.308 54.477 54.840 -0.091 0.000 0.840 455 L CB 0.140 42.147 42.059 -0.087 0.000 0.981 455 L HN -0.472 7.744 8.230 -0.023 0.000 0.462 456 G N 0.000 108.811 108.800 0.019 0.000 5.446 456 G HA2 0.000 nan 3.960 nan 0.000 0.244 456 G HA3 0.000 3.979 3.960 0.031 0.000 0.244 456 G CA 0.000 45.117 45.100 0.029 0.000 0.502 456 G HN 0.000 8.264 8.290 0.012 0.033 0.925