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 3b6d_1_A DATA FIRST_RESID 9 DATA SEQUENCE GYVPAVVIGT GYGAAVSALR LGEAGVQTLM LEMGQLWNQP GPDGNIFCGM DATA SEQUENCE LNPDKRSSWF KNRTEAPLGS FLWLDVVNRN IDPYAGVLDR VNYDQMSVYV DATA SEQUENCE GRGVGGGSLV NGGMAVEPKR SYFEEILPRV DSSEMYDRYF PRANSMLRVN DATA SEQUENCE HIDTKWFEDT EWYKFARVSR EQAGKAGLGT VFVPNVYDFG YMQREAAGEV DATA SEQUENCE PKSALATEVI YGNNHGKQSL DKTYLAAALG TGKVTIQTLH QVKTIRQTKD DATA SEQUENCE GGYALTVEQK DTDGKLLATK EISCRYLFLG AGSLGSTELL VRARDTGTLP DATA SEQUENCE NLNSEVGAGW GPNGNIMTAR ANHMWNPTGA HQSSIPALGI DAWDNSDSSV DATA SEQUENCE FAQIAPMPAG LETWVSLYLA ITKNPQRGTF VYDAATDRAK LNWTRDQNAP DATA SEQUENCE AVNAAKALFD RINKANGTIY RYDLFGTQLK AFADDFCYQP LGGCVLGKAT DATA SEQUENCE DDYGRVAGYK NLYVTDGSLI PGSVGVNPFV TITALAERNV ERIIKQDV 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 9 G HA2 0.000 nan 3.960 nan 0.000 0.244 9 G HA3 0.000 4.003 3.960 0.071 0.000 0.244 9 G C 0.000 174.967 174.900 0.112 0.000 0.946 9 G CA 0.000 45.148 45.100 0.081 0.000 0.502 10 Y N 2.166 122.474 120.300 0.013 0.000 2.330 10 Y HA 0.821 5.595 4.550 0.018 -0.213 0.336 10 Y C -0.863 175.050 175.900 0.022 0.000 1.036 10 Y CA -1.541 56.568 58.100 0.015 0.000 1.125 10 Y CB 1.983 40.446 38.460 0.005 0.000 1.194 10 Y HN -0.032 8.379 8.280 0.218 0.000 0.469 11 V N 2.768 122.216 119.914 -0.777 0.000 2.841 11 V HA 0.590 4.455 4.120 -0.425 0.000 0.310 11 V C -2.565 173.049 176.094 -0.799 0.000 1.090 11 V CA -4.604 57.348 62.300 -0.581 0.000 0.930 11 V CB 2.264 33.946 31.823 -0.235 0.000 1.014 11 V HN 0.451 8.143 8.190 -0.830 0.000 0.425 12 P HA -0.149 4.167 4.420 -0.174 0.000 0.215 12 P C -1.446 175.887 177.300 0.055 0.000 1.157 12 P CA 2.382 65.402 63.100 -0.134 0.000 0.874 12 P CB 0.571 32.331 31.700 0.101 0.000 0.790 13 A N -6.283 116.603 122.820 0.110 0.000 2.355 13 A HA 0.891 5.636 4.320 0.347 -0.218 0.317 13 A C -2.081 175.570 177.584 0.112 0.000 1.094 13 A CA -1.865 50.315 52.037 0.240 0.000 0.764 13 A CB 3.316 22.483 19.000 0.278 0.000 1.230 13 A HN -0.553 7.624 8.150 0.045 0.000 0.448 14 V N 2.528 122.542 119.914 0.168 0.000 2.555 14 V HA 0.791 5.140 4.120 0.048 -0.200 0.302 14 V C -1.380 174.818 176.094 0.173 0.000 1.038 14 V CA -2.013 60.349 62.300 0.103 0.000 0.887 14 V CB 3.351 35.210 31.823 0.061 0.000 0.991 14 V HN 0.118 8.454 8.190 0.244 0.000 0.434 15 V N 6.289 126.253 119.914 0.083 0.000 2.409 15 V HA 0.514 4.932 4.120 0.170 -0.195 0.291 15 V C -0.847 175.272 176.094 0.042 0.000 1.020 15 V CA -2.021 60.327 62.300 0.080 0.000 0.848 15 V CB 1.587 33.397 31.823 -0.021 0.000 0.990 15 V HN 0.508 8.720 8.190 0.036 0.000 0.430 16 I N 6.351 126.952 120.570 0.051 0.000 2.312 16 I HA 0.083 4.263 4.170 0.017 0.000 0.291 16 I C -0.360 175.762 176.117 0.009 0.000 1.031 16 I CA -0.320 60.993 61.300 0.022 0.000 1.293 16 I CB -0.397 37.610 38.000 0.012 0.000 1.403 16 I HN 0.436 8.693 8.210 0.078 0.000 0.484 17 G N 8.484 117.283 108.800 -0.003 0.000 2.661 17 G HA2 -0.244 3.706 3.960 -0.017 0.000 0.685 17 G HA3 -0.244 3.878 3.960 -0.017 -0.172 0.685 17 G C -1.253 173.629 174.900 -0.030 0.000 1.298 17 G CA -0.052 45.038 45.100 -0.016 0.000 0.855 17 G HN 0.670 8.960 8.290 0.001 0.000 0.560 18 T N -3.605 110.922 114.554 -0.045 0.000 3.714 18 T HA 0.255 4.558 4.350 -0.077 0.000 0.309 18 T C -1.007 173.621 174.700 -0.120 0.000 0.958 18 T CA -1.020 61.038 62.100 -0.071 0.000 1.010 18 T CB 0.750 69.587 68.868 -0.051 0.000 1.202 18 T HN -0.114 8.173 8.240 -0.043 -0.073 0.476 19 G N 0.696 109.426 108.800 -0.116 0.000 2.504 19 G HA2 -0.012 3.941 3.960 -0.273 0.000 0.257 19 G HA3 -0.012 3.899 3.960 -0.083 0.000 0.257 19 G C -0.471 174.285 174.900 -0.241 0.000 1.451 19 G CA -1.055 43.938 45.100 -0.179 0.000 1.059 19 G HN -0.643 7.602 8.290 -0.076 0.000 0.550 20 Y N -0.053 120.181 120.300 -0.109 0.000 2.114 20 Y HA -0.393 4.027 4.550 -0.217 0.000 0.284 20 Y C 2.382 178.167 175.900 -0.191 0.000 1.143 20 Y CA 4.169 62.171 58.100 -0.164 0.000 1.135 20 Y CB -0.315 38.087 38.460 -0.097 0.000 0.980 20 Y HN 0.228 8.555 8.280 0.078 0.000 0.499 21 G N -3.416 105.407 108.800 0.038 0.000 2.418 21 G HA2 -0.327 3.606 3.960 -0.044 0.000 0.217 21 G HA3 -0.327 3.775 3.960 0.010 -0.136 0.217 21 G C 0.539 175.395 174.900 -0.073 0.000 1.158 21 G CA 2.173 47.259 45.100 -0.022 0.000 0.771 21 G HN 0.225 8.574 8.290 0.097 0.000 0.545 22 A N 1.749 124.528 122.820 -0.067 0.000 1.902 22 A HA -0.314 3.967 4.320 -0.065 0.000 0.217 22 A C 1.497 178.996 177.584 -0.142 0.000 1.181 22 A CA 2.739 54.725 52.037 -0.084 0.000 0.623 22 A CB -0.712 18.250 19.000 -0.063 0.000 0.818 22 A HN -0.034 8.087 8.150 -0.048 0.000 0.443 23 A N -1.405 121.307 122.820 -0.180 0.000 1.898 23 A HA -0.253 3.992 4.320 -0.125 0.000 0.216 23 A C 1.781 179.234 177.584 -0.217 0.000 1.181 23 A CA 2.648 54.575 52.037 -0.183 0.000 0.620 23 A CB -0.471 18.398 19.000 -0.217 0.000 0.819 23 A HN -0.234 7.803 8.150 -0.189 0.000 0.442 24 V N -1.557 118.122 119.914 -0.391 0.000 2.295 24 V HA -0.485 3.430 4.120 -0.341 0.000 0.246 24 V C 2.055 178.042 176.094 -0.177 0.000 1.049 24 V CA 3.892 65.981 62.300 -0.351 0.000 1.024 24 V CB -0.840 30.755 31.823 -0.381 0.000 0.648 24 V HN -0.381 7.562 8.190 -0.412 0.000 0.447 25 S N 0.359 115.929 115.700 -0.217 0.000 2.356 25 S HA -0.407 3.882 4.470 -0.300 0.000 0.223 25 S C 1.823 176.217 174.600 -0.345 0.000 1.032 25 S CA 4.189 62.198 58.200 -0.317 0.000 1.005 25 S CB -0.545 62.426 63.200 -0.381 0.000 0.867 25 S HN -0.601 7.584 8.310 -0.209 0.000 0.449 26 A N 1.538 124.203 122.820 -0.259 0.000 1.902 26 A HA -0.337 3.828 4.320 -0.258 0.000 0.217 26 A C 1.516 179.021 177.584 -0.130 0.000 1.181 26 A CA 3.038 54.953 52.037 -0.203 0.000 0.623 26 A CB -0.507 18.410 19.000 -0.139 0.000 0.818 26 A HN -0.102 7.912 8.150 -0.226 0.000 0.443 27 L N -1.026 120.159 121.223 -0.063 0.000 2.012 27 L HA -0.357 3.973 4.340 -0.016 0.000 0.210 27 L C 1.773 178.618 176.870 -0.041 0.000 1.073 27 L CA 3.094 57.929 54.840 -0.008 0.000 0.748 27 L CB -0.394 41.733 42.059 0.112 0.000 0.891 27 L HN -0.447 7.750 8.230 -0.053 0.000 0.431 28 R N -2.519 117.942 120.500 -0.064 0.000 2.090 28 R HA -0.181 4.133 4.340 -0.043 0.000 0.228 28 R C 2.977 179.207 176.300 -0.117 0.000 1.110 28 R CA 0.951 57.007 56.100 -0.074 0.000 0.973 28 R CB -0.775 29.482 30.300 -0.072 0.000 0.869 28 R HN -0.571 7.654 8.270 -0.075 0.000 0.440 29 L N -1.061 120.050 121.223 -0.186 0.000 2.017 29 L HA -0.354 3.876 4.340 -0.184 0.000 0.208 29 L C 1.897 178.700 176.870 -0.112 0.000 1.073 29 L CA 3.294 58.021 54.840 -0.188 0.000 0.745 29 L CB -0.651 41.239 42.059 -0.281 0.000 0.894 29 L HN 0.123 8.219 8.230 -0.224 0.000 0.432 30 G N -2.668 106.075 108.800 -0.095 0.000 2.418 30 G HA2 -0.345 3.582 3.960 -0.055 0.000 0.217 30 G HA3 -0.345 3.581 3.960 -0.057 0.000 0.217 30 G C 1.976 176.848 174.900 -0.046 0.000 1.158 30 G CA 1.713 46.776 45.100 -0.061 0.000 0.771 30 G HN -0.180 8.045 8.290 -0.108 0.000 0.545 31 E N 2.717 122.889 120.200 -0.046 0.000 2.204 31 E HA -0.279 4.053 4.350 -0.029 0.000 0.195 31 E C 1.434 178.014 176.600 -0.033 0.000 0.990 31 E CA 2.098 58.477 56.400 -0.035 0.000 0.821 31 E CB -0.036 29.646 29.700 -0.030 0.000 0.750 31 E HN -0.187 8.142 8.360 -0.052 0.000 0.477 32 A N -3.557 119.236 122.820 -0.044 0.000 2.238 32 A HA 0.062 4.363 4.320 -0.032 0.000 0.208 32 A C 0.065 177.633 177.584 -0.027 0.000 1.177 32 A CA 0.050 52.062 52.037 -0.041 0.000 0.804 32 A CB 0.039 19.001 19.000 -0.062 0.000 0.823 32 A HN -0.407 7.581 8.150 -0.057 0.128 0.482 33 G N -2.398 106.388 108.800 -0.023 0.000 2.132 33 G HA2 -0.307 3.648 3.960 -0.009 0.000 0.234 33 G HA3 -0.307 3.652 3.960 -0.001 0.000 0.234 33 G C -0.657 174.245 174.900 0.004 0.000 0.989 33 G CA -0.063 45.032 45.100 -0.008 0.000 0.676 33 G HN -0.471 7.604 8.290 -0.030 0.197 0.522 34 V N 3.162 123.070 119.914 -0.009 0.000 2.385 34 V HA -0.038 4.112 4.120 0.050 0.000 0.269 34 V C -0.857 175.241 176.094 0.007 0.000 1.043 34 V CA -1.185 61.125 62.300 0.018 0.000 0.906 34 V CB -0.380 31.443 31.823 -0.000 0.000 0.995 34 V HN -0.437 7.691 8.190 -0.029 0.045 0.467 35 Q N 9.354 129.168 119.800 0.024 0.000 2.289 35 Q HA 0.038 4.567 4.340 -0.010 -0.194 0.273 35 Q C -0.496 175.500 176.000 -0.007 0.000 1.029 35 Q CA 0.298 56.102 55.803 0.002 0.000 0.896 35 Q CB 0.394 29.136 28.738 0.007 0.000 1.182 35 Q HN 0.587 8.882 8.270 0.042 0.000 0.385 36 T N 8.523 123.059 114.554 -0.029 0.000 2.881 36 T HA 0.564 5.129 4.350 -0.021 -0.228 0.290 36 T C -2.300 172.371 174.700 -0.048 0.000 1.000 36 T CA -0.672 61.405 62.100 -0.039 0.000 0.978 36 T CB 2.548 71.374 68.868 -0.071 0.000 0.997 36 T HN 0.407 8.627 8.240 -0.033 0.000 0.443 37 L N 7.809 129.005 121.223 -0.045 0.000 2.305 37 L HA 0.591 5.047 4.340 -0.060 -0.152 0.284 37 L C -2.391 174.452 176.870 -0.045 0.000 1.013 37 L CA -1.477 53.330 54.840 -0.054 0.000 0.819 37 L CB 2.967 44.988 42.059 -0.062 0.000 1.227 37 L HN 0.603 8.812 8.230 -0.034 0.000 0.417 38 M N 6.105 125.673 119.600 -0.055 0.000 2.209 38 M HA 0.612 5.304 4.480 -0.032 -0.231 0.355 38 M C -1.173 175.097 176.300 -0.050 0.000 1.171 38 M CA -0.594 54.679 55.300 -0.046 0.000 1.069 38 M CB 1.675 34.245 32.600 -0.051 0.000 1.622 38 M HN 0.731 8.984 8.290 -0.062 0.000 0.459 39 L N 2.532 123.739 121.223 -0.025 0.000 2.298 39 L HA 0.674 5.264 4.340 -0.041 -0.275 0.284 39 L C -1.488 175.392 176.870 0.018 0.000 1.013 39 L CA -1.205 53.629 54.840 -0.009 0.000 0.824 39 L CB 1.438 43.510 42.059 0.022 0.000 1.221 39 L HN 0.496 8.718 8.230 -0.013 0.000 0.418 40 E N 4.038 124.258 120.200 0.034 0.000 2.199 40 E HA 0.456 4.820 4.350 0.024 0.000 0.265 40 E C -0.360 176.293 176.600 0.087 0.000 0.882 40 E CA -1.626 54.798 56.400 0.040 0.000 0.759 40 E CB 3.088 32.804 29.700 0.027 0.000 1.148 40 E HN 0.421 8.799 8.360 0.031 0.000 0.412 41 M N 4.583 124.224 119.600 0.069 0.000 2.319 41 M HA 0.067 4.729 4.480 0.159 -0.087 0.265 41 M C 0.326 176.760 176.300 0.222 0.000 1.068 41 M CA 2.223 57.600 55.300 0.129 0.000 1.118 41 M CB 0.619 33.267 32.600 0.079 0.000 1.395 41 M HN 0.497 8.803 8.290 0.027 0.000 0.435 42 G N -1.952 106.929 108.800 0.136 0.000 2.510 42 G HA2 0.103 4.364 3.960 0.501 0.000 0.280 42 G HA3 0.103 4.203 3.960 0.234 0.000 0.280 42 G C -2.028 172.968 174.900 0.160 0.000 1.386 42 G CA -1.787 43.473 45.100 0.266 0.000 1.047 42 G HN -0.284 8.381 8.290 0.054 -0.342 0.527 43 Q N -2.486 117.360 119.800 0.078 0.000 2.260 43 Q HA 0.070 4.316 4.340 -0.156 0.000 0.238 43 Q C -1.065 174.816 176.000 -0.198 0.000 0.948 43 Q CA -0.994 54.672 55.803 -0.228 0.000 0.895 43 Q CB 2.186 30.473 28.738 -0.751 0.000 1.218 43 Q HN 0.340 8.732 8.270 0.204 0.000 0.470 44 L N 1.280 122.383 121.223 -0.199 0.000 2.369 44 L HA 0.070 4.418 4.340 0.013 0.000 0.279 44 L C -1.015 175.728 176.870 -0.212 0.000 1.108 44 L CA 0.040 54.817 54.840 -0.105 0.000 0.852 44 L CB 0.196 42.212 42.059 -0.072 0.000 1.169 44 L HN 0.270 8.387 8.230 -0.188 0.000 0.452 45 W N 7.685 128.981 121.300 -0.006 0.000 2.247 45 W HA -0.010 4.593 4.660 -0.095 0.000 0.394 45 W C -1.456 174.956 176.519 -0.179 0.000 0.939 45 W CA -0.135 57.155 57.345 -0.091 0.000 1.548 45 W CB -1.050 28.394 29.460 -0.026 0.000 1.610 45 W HN 0.411 8.769 8.180 0.296 0.000 0.336 46 N N -1.764 116.902 118.700 -0.056 0.000 2.142 46 N HA 0.036 4.733 4.740 -0.073 0.000 0.233 46 N C -1.092 174.368 175.510 -0.083 0.000 1.335 46 N CA -0.238 52.772 53.050 -0.067 0.000 0.837 46 N CB 1.317 39.777 38.487 -0.045 0.000 1.238 46 N HN -0.509 7.796 8.380 -0.123 0.000 0.501 47 Q N 0.389 120.130 119.800 -0.099 0.000 2.282 47 Q HA 0.506 4.807 4.340 -0.065 0.000 0.260 47 Q C -2.002 173.962 176.000 -0.060 0.000 0.964 47 Q CA -3.411 52.346 55.803 -0.077 0.000 0.880 47 Q CB 0.499 29.187 28.738 -0.084 0.000 1.286 47 Q HN -0.185 8.013 8.270 -0.119 0.000 0.445 48 P HA -0.100 4.298 4.420 -0.037 0.000 0.271 48 P C -0.596 176.692 177.300 -0.020 0.000 1.216 48 P CA -0.219 62.862 63.100 -0.031 0.000 0.776 48 P CB 0.606 32.294 31.700 -0.019 0.000 0.881 49 G N 1.952 110.748 108.800 -0.006 0.000 2.532 49 G HA2 0.325 4.276 3.960 -0.014 0.000 0.291 49 G HA3 0.325 4.291 3.960 0.010 0.000 0.291 49 G C -0.587 174.307 174.900 -0.010 0.000 1.349 49 G CA -1.711 43.387 45.100 -0.004 0.000 1.038 49 G HN 0.215 8.385 8.290 -0.003 0.118 0.518 50 P HA -0.059 4.350 4.420 -0.019 0.000 0.228 50 P C -1.249 176.049 177.300 -0.004 0.000 1.151 50 P CA 1.720 64.809 63.100 -0.018 0.000 0.770 50 P CB -0.055 31.626 31.700 -0.033 0.000 0.786 51 D N -5.340 115.064 120.400 0.008 0.000 2.368 51 D HA -0.018 4.632 4.640 0.017 0.000 0.218 51 D C 0.992 177.307 176.300 0.026 0.000 1.112 51 D CA -1.103 52.909 54.000 0.020 0.000 0.834 51 D CB -1.269 39.550 40.800 0.032 0.000 0.953 51 D HN -0.390 7.942 8.370 0.009 0.043 0.505 52 G N -0.477 108.333 108.800 0.017 0.000 2.179 52 G HA2 -0.481 3.485 3.960 0.010 0.000 0.260 52 G HA3 -0.481 3.494 3.960 0.025 0.000 0.260 52 G C -0.690 174.222 174.900 0.021 0.000 0.977 52 G CA 0.468 45.579 45.100 0.019 0.000 0.641 52 G HN -0.048 7.989 8.290 0.010 0.259 0.533 53 N N -0.686 118.029 118.700 0.024 0.000 2.443 53 N HA 0.350 5.092 4.740 0.004 0.000 0.293 53 N C 0.038 175.534 175.510 -0.022 0.000 1.159 53 N CA -1.491 51.568 53.050 0.015 0.000 0.904 53 N CB 2.077 40.597 38.487 0.056 0.000 1.214 53 N HN -0.519 8.093 8.380 0.029 -0.214 0.513 54 I N 1.174 121.676 120.570 -0.113 0.000 2.202 54 I HA -0.204 4.216 4.170 -0.133 -0.329 0.242 54 I C 0.401 176.385 176.117 -0.221 0.000 1.091 54 I CA 3.647 64.798 61.300 -0.250 0.000 1.368 54 I CB 0.976 38.659 38.000 -0.529 0.000 1.058 54 I HN -0.059 8.164 8.210 -0.125 -0.088 0.410 55 F N -3.048 116.944 119.950 0.071 0.000 2.507 55 F HA 0.255 4.790 4.527 0.013 0.000 0.327 55 F C -0.306 175.519 175.800 0.041 0.000 1.068 55 F CA -0.808 57.202 58.000 0.016 0.000 0.965 55 F CB 2.123 41.081 39.000 -0.070 0.000 1.192 55 F HN -0.469 8.166 8.300 -0.017 -0.346 0.476 56 C N 0.183 119.635 119.300 0.253 0.000 2.563 56 C HA 0.061 4.614 4.460 0.154 0.000 0.358 56 C C 0.389 175.524 174.990 0.243 0.000 1.336 56 C CA -1.065 58.067 59.018 0.189 0.000 2.454 56 C CB 0.399 28.208 27.740 0.115 0.000 2.448 56 C HN 0.431 8.812 8.230 0.252 0.000 0.670 57 G N -1.971 106.951 108.800 0.203 0.000 2.511 57 G HA2 0.458 4.509 3.960 0.151 0.000 0.316 57 G HA3 0.458 4.518 3.960 0.133 -0.020 0.316 57 G C -0.128 174.925 174.900 0.255 0.000 1.210 57 G CA -1.356 43.852 45.100 0.180 0.000 0.969 57 G HN -0.304 8.275 8.290 0.162 -0.192 0.492 58 M N 0.403 120.079 119.600 0.126 0.000 2.394 58 M HA -0.177 4.475 4.480 0.287 0.000 0.264 58 M C 0.850 177.243 176.300 0.155 0.000 1.073 58 M CA 2.359 57.736 55.300 0.129 0.000 1.111 58 M CB 0.297 32.864 32.600 -0.055 0.000 1.401 58 M HN 0.330 8.650 8.290 0.051 0.000 0.448 59 L N -3.273 118.015 121.223 0.109 0.000 2.567 59 L HA -0.013 4.377 4.340 0.084 0.000 0.225 59 L C -0.344 176.577 176.870 0.085 0.000 1.119 59 L CA -0.015 54.877 54.840 0.086 0.000 0.871 59 L CB 0.577 42.674 42.059 0.063 0.000 1.036 59 L HN -0.259 7.998 8.230 0.099 0.032 0.459 60 N N -4.492 114.270 118.700 0.104 0.000 2.679 60 N HA 0.251 5.027 4.740 0.058 0.000 0.302 60 N C -2.680 172.871 175.510 0.067 0.000 1.941 60 N CA -3.128 49.967 53.050 0.074 0.000 0.875 60 N CB -0.169 38.356 38.487 0.063 0.000 1.278 60 N HN -0.685 7.567 8.380 0.132 0.207 0.490 61 P HA 0.047 4.413 4.420 -0.090 0.000 0.271 61 P C -1.309 175.948 177.300 -0.071 0.000 1.218 61 P CA 0.265 63.336 63.100 -0.048 0.000 0.780 61 P CB 0.588 32.255 31.700 -0.056 0.000 0.901 62 D N -0.320 120.009 120.400 -0.119 0.000 3.076 62 D HA 0.077 4.667 4.640 -0.082 0.000 0.301 62 D C -0.741 175.486 176.300 -0.121 0.000 1.260 62 D CA -1.628 52.313 54.000 -0.098 0.000 1.027 62 D CB 1.074 41.828 40.800 -0.076 0.000 1.370 62 D HN -0.560 7.713 8.370 -0.162 0.000 0.602 63 K N -3.723 116.596 120.400 -0.134 0.000 2.280 63 K HA -0.261 4.010 4.320 -0.081 0.000 0.202 63 K C 2.595 179.201 176.600 0.010 0.000 1.047 63 K CA 2.509 58.720 56.287 -0.127 0.000 0.942 63 K CB -0.177 32.157 32.500 -0.277 0.000 0.739 63 K HN 0.093 8.252 8.250 -0.153 0.000 0.457 64 R N -1.558 118.958 120.500 0.028 0.000 2.285 64 R HA -0.207 4.516 4.340 0.638 0.000 0.213 64 R C 1.779 178.164 176.300 0.141 0.000 1.068 64 R CA 2.526 58.811 56.100 0.308 0.000 1.004 64 R CB -0.250 30.241 30.300 0.317 0.000 0.873 64 R HN 0.136 8.849 8.270 -0.057 -0.477 0.467 65 S N -1.560 114.069 115.700 -0.119 0.000 2.470 65 S HA -0.033 4.235 4.470 -0.337 0.000 0.225 65 S C -0.609 173.927 174.600 -0.106 0.000 1.006 65 S CA 2.870 60.826 58.200 -0.407 0.000 0.934 65 S CB 0.531 62.990 63.200 -1.235 0.000 0.778 65 S HN -0.290 7.769 8.310 -0.142 0.165 0.517 66 S N 0.397 116.111 115.700 0.023 0.000 2.532 66 S HA 0.397 5.136 4.470 0.151 -0.178 0.299 66 S C -1.674 173.023 174.600 0.163 0.000 1.105 66 S CA -1.202 57.061 58.200 0.105 0.000 1.018 66 S CB 2.126 65.354 63.200 0.047 0.000 1.021 66 S HN -0.766 7.516 8.310 0.057 0.062 0.483 67 W N 7.063 128.387 121.300 0.039 0.000 2.507 67 W HA -0.001 4.726 4.660 -0.098 -0.126 0.334 67 W C -1.056 175.517 176.519 0.091 0.000 1.165 67 W CA -0.263 57.100 57.345 0.030 0.000 1.460 67 W CB 0.228 29.778 29.460 0.149 0.000 1.404 67 W HN 0.111 8.536 8.180 0.409 0.000 0.435 68 F N 5.038 124.840 119.950 -0.247 0.000 2.866 68 F HA -0.452 4.028 4.527 -0.195 -0.070 0.254 68 F C -1.612 174.158 175.800 -0.050 0.000 1.009 68 F CA 0.946 58.808 58.000 -0.230 0.000 0.907 68 F CB -2.206 36.537 39.000 -0.428 0.000 0.859 68 F HN 0.284 8.009 8.300 -0.958 0.000 0.842 69 K N -1.810 118.621 120.400 0.052 0.000 2.340 69 K HA 0.270 4.641 4.320 0.086 0.000 0.244 69 K C -0.554 176.071 176.600 0.040 0.000 0.973 69 K CA -2.267 54.062 56.287 0.069 0.000 0.828 69 K CB 2.225 34.773 32.500 0.081 0.000 1.226 69 K HN -0.553 7.690 8.250 -0.013 0.000 0.437 70 N N -0.816 117.911 118.700 0.045 0.000 2.230 70 N HA 0.029 4.950 4.740 0.023 -0.167 0.202 70 N C -0.417 175.110 175.510 0.028 0.000 1.119 70 N CA -0.570 52.499 53.050 0.032 0.000 0.851 70 N CB 0.818 39.325 38.487 0.034 0.000 0.990 70 N HN 0.311 8.723 8.380 0.053 0.000 0.497 71 R N -1.503 119.019 120.500 0.037 0.000 2.604 71 R HA 0.396 4.908 4.340 0.027 -0.155 0.270 71 R C -1.572 174.758 176.300 0.049 0.000 1.052 71 R CA -0.901 55.223 56.100 0.041 0.000 0.902 71 R CB 3.292 33.625 30.300 0.055 0.000 1.233 71 R HN -0.818 7.366 8.270 0.045 0.112 0.455 72 T N 4.132 118.708 114.554 0.036 0.000 2.802 72 T HA 0.091 4.457 4.350 0.027 0.000 0.305 72 T C -0.805 173.961 174.700 0.109 0.000 1.053 72 T CA -0.409 61.716 62.100 0.041 0.000 1.058 72 T CB 1.124 69.993 68.868 0.001 0.000 0.988 72 T HN 0.231 8.486 8.240 0.025 0.000 0.539 73 E N -0.732 119.564 120.200 0.161 0.000 2.356 73 E HA 0.184 4.730 4.350 0.219 -0.064 0.275 73 E C -1.852 174.912 176.600 0.274 0.000 0.904 73 E CA -2.287 54.249 56.400 0.227 0.000 0.757 73 E CB 3.188 33.033 29.700 0.241 0.000 1.232 73 E HN -0.140 8.314 8.360 0.156 0.000 0.442 74 A N 1.454 124.442 122.820 0.281 0.000 2.462 74 A HA 0.083 4.535 4.320 0.220 0.000 0.243 74 A C -1.690 176.032 177.584 0.231 0.000 1.076 74 A CA -1.023 51.163 52.037 0.250 0.000 0.773 74 A CB -0.809 18.345 19.000 0.256 0.000 1.010 74 A HN 0.090 8.432 8.150 0.320 0.000 0.493 75 P HA -0.137 4.318 4.420 0.059 0.000 0.267 75 P C -0.804 176.556 177.300 0.099 0.000 1.200 75 P CA -0.020 63.122 63.100 0.071 0.000 0.772 75 P CB 0.515 32.199 31.700 -0.027 0.000 0.855 76 L N 1.827 123.081 121.223 0.052 0.000 2.559 76 L HA -0.416 4.001 4.340 0.129 0.000 0.274 76 L C 1.317 178.252 176.870 0.109 0.000 1.205 76 L CA 1.422 56.294 54.840 0.053 0.000 0.907 76 L CB -0.454 41.485 42.059 -0.199 0.000 1.153 76 L HN 0.171 8.410 8.230 0.015 0.000 0.490 77 G N 4.413 113.341 108.800 0.212 0.000 2.232 77 G HA2 -0.313 3.598 3.960 -0.081 0.000 0.226 77 G HA3 -0.313 3.703 3.960 0.094 0.000 0.226 77 G C -0.285 174.695 174.900 0.134 0.000 0.996 77 G CA 0.504 45.658 45.100 0.091 0.000 0.626 77 G HN 0.751 9.202 8.290 0.269 0.000 0.509 78 S N -0.250 115.572 115.700 0.204 0.000 2.650 78 S HA 0.280 5.089 4.470 0.565 0.000 0.240 78 S C -0.388 174.376 174.600 0.274 0.000 1.007 78 S CA -0.489 57.913 58.200 0.337 0.000 0.984 78 S CB 1.392 64.721 63.200 0.215 0.000 0.910 78 S HN -0.402 7.891 8.310 0.183 0.127 0.509 79 F N 4.209 124.188 119.950 0.049 0.000 2.147 79 F HA -0.447 4.096 4.527 0.027 0.000 0.301 79 F C 0.712 176.426 175.800 -0.143 0.000 1.084 79 F CA 4.505 62.495 58.000 -0.016 0.000 1.268 79 F CB 0.152 39.137 39.000 -0.024 0.000 1.009 79 F HN -0.045 8.448 8.300 0.321 0.000 0.486 80 L N -3.910 117.134 121.223 -0.299 0.000 2.191 80 L HA -0.376 3.638 4.340 -0.543 0.000 0.212 80 L C 1.257 177.621 176.870 -0.842 0.000 1.103 80 L CA 2.510 56.891 54.840 -0.766 0.000 0.769 80 L CB -0.634 40.595 42.059 -1.384 0.000 0.908 80 L HN -0.142 7.928 8.230 -0.207 0.036 0.438 81 W N -4.213 117.014 121.300 -0.121 0.000 2.901 81 W HA -0.003 4.594 4.660 -0.105 0.000 0.281 81 W C 0.718 177.163 176.519 -0.122 0.000 1.167 81 W CA 1.385 58.664 57.345 -0.110 0.000 1.506 81 W CB 1.506 30.915 29.460 -0.085 0.000 0.985 81 W HN -0.410 7.601 8.180 -0.039 0.146 0.590 82 L N -3.485 117.773 121.223 0.058 0.000 2.693 82 L HA 0.257 4.619 4.340 0.037 0.000 0.235 82 L C 1.260 178.072 176.870 -0.097 0.000 1.127 82 L CA 0.505 55.355 54.840 0.017 0.000 0.914 82 L CB -0.138 41.969 42.059 0.082 0.000 1.193 82 L HN -0.056 8.200 8.230 0.044 0.000 0.502 83 D N 1.982 122.183 120.400 -0.332 0.000 2.218 83 D HA -0.324 4.154 4.640 -0.270 0.000 0.204 83 D C 1.670 177.843 176.300 -0.212 0.000 0.976 83 D CA 3.143 56.889 54.000 -0.423 0.000 0.853 83 D CB -0.135 40.022 40.800 -1.073 0.000 0.939 83 D HN -0.638 7.467 8.370 -0.442 0.000 0.481 84 V N -1.595 118.219 119.914 -0.167 0.000 2.720 84 V HA -0.353 3.712 4.120 -0.092 0.000 0.256 84 V C 0.511 176.582 176.094 -0.040 0.000 1.082 84 V CA 2.553 64.801 62.300 -0.088 0.000 1.101 84 V CB -0.105 31.680 31.823 -0.063 0.000 0.693 84 V HN 0.016 8.035 8.190 -0.187 0.059 0.479 85 V N -6.988 112.913 119.914 -0.022 0.000 3.647 85 V HA 0.052 4.175 4.120 0.005 0.000 0.279 85 V C -0.251 175.852 176.094 0.014 0.000 1.314 85 V CA -1.079 61.225 62.300 0.008 0.000 1.125 85 V CB -0.320 31.522 31.823 0.031 0.000 0.907 85 V HN -0.778 7.354 8.190 -0.030 0.041 0.434 86 N N 1.485 120.189 118.700 0.007 0.000 2.508 86 N HA 0.122 4.884 4.740 0.037 0.000 0.264 86 N C -0.463 175.057 175.510 0.017 0.000 1.216 86 N CA 0.974 54.040 53.050 0.026 0.000 0.943 86 N CB 0.635 39.149 38.487 0.045 0.000 1.113 86 N HN -0.654 7.547 8.380 -0.014 0.171 0.447 87 R N -1.121 119.389 120.500 0.017 0.000 2.739 87 R HA 0.180 4.526 4.340 0.010 0.000 0.271 87 R C -1.430 174.876 176.300 0.009 0.000 1.010 87 R CA -2.155 53.950 56.100 0.008 0.000 0.897 87 R CB 4.037 34.335 30.300 -0.003 0.000 1.236 87 R HN 0.231 8.513 8.270 0.020 0.000 0.466 88 N N 0.788 119.492 118.700 0.008 0.000 2.492 88 N HA 0.084 4.976 4.740 0.013 -0.144 0.260 88 N C 0.389 175.894 175.510 -0.009 0.000 1.215 88 N CA 0.530 53.583 53.050 0.006 0.000 0.923 88 N CB 0.288 38.780 38.487 0.007 0.000 1.092 88 N HN 0.222 8.607 8.380 0.007 0.000 0.448 89 I N -3.925 116.638 120.570 -0.011 0.000 2.969 89 I HA 0.361 4.507 4.170 -0.041 0.000 0.307 89 I C -1.573 174.530 176.117 -0.024 0.000 1.149 89 I CA -2.101 59.181 61.300 -0.031 0.000 1.008 89 I CB 3.897 41.870 38.000 -0.045 0.000 1.232 89 I HN 0.015 8.113 8.210 -0.002 0.111 0.435 90 D N 2.055 122.431 120.400 -0.039 0.000 2.350 90 D HA 0.129 4.768 4.640 -0.003 0.000 0.249 90 D C -1.596 174.697 176.300 -0.013 0.000 1.119 90 D CA -1.349 52.640 54.000 -0.018 0.000 0.886 90 D CB -0.369 40.416 40.800 -0.025 0.000 1.195 90 D HN 0.062 8.396 8.370 -0.060 0.000 0.437 91 P HA -0.074 4.592 4.420 -0.070 -0.288 0.267 91 P C -1.975 175.245 177.300 -0.134 0.000 1.205 91 P CA 0.129 63.221 63.100 -0.013 0.000 0.765 91 P CB 0.567 32.359 31.700 0.153 0.000 0.828 92 Y N 3.231 123.036 120.300 -0.825 0.000 2.609 92 Y HA 0.294 4.576 4.550 -0.700 -0.151 0.336 92 Y C -1.942 173.039 175.900 -1.531 0.000 1.129 92 Y CA -1.160 56.410 58.100 -0.884 0.000 1.040 92 Y CB 4.496 42.729 38.460 -0.378 0.000 1.310 92 Y HN -0.219 7.609 8.280 -0.753 0.000 0.460 93 A N 4.288 126.069 122.820 -1.732 0.000 3.051 93 A HA 0.140 3.557 4.320 -1.505 0.000 0.257 93 A C -0.831 176.564 177.584 -0.315 0.000 1.785 93 A CA -0.754 50.606 52.037 -1.129 0.000 1.420 93 A CB -2.043 16.599 19.000 -0.597 0.000 1.063 93 A HN -0.032 7.070 8.150 -1.748 0.000 0.630 94 G N -0.746 108.075 108.800 0.036 0.000 2.588 94 G HA2 0.237 4.699 3.960 0.836 0.000 0.278 94 G HA3 0.237 4.574 3.960 0.419 -0.126 0.278 94 G C -0.753 174.524 174.900 0.628 0.000 1.307 94 G CA -1.122 44.301 45.100 0.539 0.000 1.016 94 G HN -0.528 7.551 8.290 -0.229 0.073 0.503 95 V N -1.766 118.348 119.914 0.333 0.000 3.174 95 V HA 0.159 4.626 4.120 0.299 -0.167 0.254 95 V C -1.035 175.123 176.094 0.108 0.000 1.120 95 V CA -0.056 62.306 62.300 0.104 0.000 1.114 95 V CB 1.389 32.915 31.823 -0.495 0.000 0.756 95 V HN -0.227 8.093 8.190 0.216 0.000 0.467 96 L N -0.924 120.406 121.223 0.178 0.000 2.349 96 L HA 0.511 5.054 4.340 0.127 -0.126 0.278 96 L C -2.741 174.272 176.870 0.240 0.000 0.996 96 L CA -1.492 53.460 54.840 0.187 0.000 0.825 96 L CB 3.034 45.247 42.059 0.257 0.000 1.243 96 L HN -0.815 7.539 8.230 0.206 0.000 0.412 97 D N 6.724 127.228 120.400 0.173 0.000 2.381 97 D HA 0.354 5.150 4.640 0.260 0.000 0.235 97 D C -1.857 174.473 176.300 0.050 0.000 1.068 97 D CA -1.629 52.465 54.000 0.157 0.000 0.832 97 D CB 2.616 43.415 40.800 -0.002 0.000 1.101 97 D HN 0.448 8.890 8.370 0.121 0.000 0.515 98 R N 6.528 127.017 120.500 -0.019 0.000 2.210 98 R HA 0.031 4.105 4.340 -0.635 -0.116 0.338 98 R C -1.419 174.755 176.300 -0.211 0.000 1.062 98 R CA -0.065 55.820 56.100 -0.357 0.000 0.902 98 R CB 0.391 30.451 30.300 -0.399 0.000 1.050 98 R HN 0.498 8.813 8.270 0.075 0.000 0.461 99 V N 8.860 128.629 119.914 -0.242 0.000 2.348 99 V HA 0.138 4.129 4.120 -0.214 0.000 0.270 99 V C -1.779 174.086 176.094 -0.382 0.000 1.037 99 V CA -1.455 60.686 62.300 -0.265 0.000 0.872 99 V CB 0.319 32.001 31.823 -0.235 0.000 1.002 99 V HN 0.688 8.716 8.190 -0.271 0.000 0.464 100 N N 7.774 126.261 118.700 -0.354 0.000 2.426 100 N HA 0.161 4.792 4.740 -0.180 0.000 0.257 100 N C -0.669 174.614 175.510 -0.378 0.000 1.002 100 N CA -0.699 52.197 53.050 -0.257 0.000 0.942 100 N CB 1.108 39.527 38.487 -0.114 0.000 1.112 100 N HN 0.446 8.649 8.380 -0.294 0.000 0.499 101 Y N 3.151 123.440 120.300 -0.017 0.000 2.654 101 Y HA 0.049 4.588 4.550 -0.019 0.000 0.328 101 Y C 1.289 177.190 175.900 0.001 0.000 1.174 101 Y CA -0.835 57.249 58.100 -0.026 0.000 1.293 101 Y CB 2.230 40.637 38.460 -0.089 0.000 1.464 101 Y HN 0.097 8.368 8.280 -0.015 0.000 0.559 102 D N -0.484 120.030 120.400 0.191 0.000 2.160 102 D HA -0.349 4.345 4.640 0.090 0.000 0.189 102 D C 0.454 176.825 176.300 0.118 0.000 1.003 102 D CA 3.109 57.178 54.000 0.114 0.000 0.846 102 D CB 0.521 41.371 40.800 0.083 0.000 0.949 102 D HN 0.496 8.999 8.370 0.223 0.000 0.446 103 Q N -5.195 114.702 119.800 0.162 0.000 2.088 103 Q HA 0.177 4.607 4.340 0.150 0.000 0.270 103 Q C -1.916 174.244 176.000 0.267 0.000 0.854 103 Q CA -1.144 54.771 55.803 0.186 0.000 1.104 103 Q CB 0.629 29.464 28.738 0.161 0.000 1.251 103 Q HN 0.211 8.589 8.270 0.180 0.000 0.436 104 M N -0.652 119.083 119.600 0.225 0.000 2.365 104 M HA 0.229 4.975 4.480 0.204 -0.143 0.288 104 M C -2.593 173.817 176.300 0.184 0.000 1.152 104 M CA -0.253 55.164 55.300 0.196 0.000 0.948 104 M CB 4.000 36.647 32.600 0.078 0.000 1.729 104 M HN -0.803 7.611 8.290 0.207 0.000 0.487 105 S N 6.552 122.360 115.700 0.180 0.000 2.530 105 S HA 0.637 5.305 4.470 0.029 -0.181 0.322 105 S C -1.570 173.135 174.600 0.175 0.000 1.085 105 S CA -0.741 57.522 58.200 0.106 0.000 1.096 105 S CB 1.540 64.791 63.200 0.085 0.000 0.988 105 S HN 0.329 8.767 8.310 0.214 0.000 0.466 106 V N 5.120 125.103 119.914 0.114 0.000 2.398 106 V HA 0.396 4.931 4.120 0.395 -0.178 0.286 106 V C -0.959 175.215 176.094 0.133 0.000 1.026 106 V CA -1.542 60.913 62.300 0.258 0.000 0.868 106 V CB 1.105 33.127 31.823 0.332 0.000 0.982 106 V HN 0.513 8.723 8.190 0.032 0.000 0.443 107 Y N 7.011 127.493 120.300 0.303 0.000 2.328 107 Y HA 0.532 5.397 4.550 0.188 -0.201 0.337 107 Y C -0.170 175.824 175.900 0.156 0.000 1.008 107 Y CA -1.155 57.086 58.100 0.234 0.000 1.129 107 Y CB 1.019 39.646 38.460 0.278 0.000 1.185 107 Y HN 0.325 9.051 8.280 0.744 0.000 0.476 108 V N -1.746 118.285 119.914 0.194 0.000 3.007 108 V HA 0.509 4.707 4.120 0.131 0.000 0.311 108 V C -2.021 174.099 176.094 0.043 0.000 1.120 108 V CA -3.203 59.161 62.300 0.108 0.000 0.980 108 V CB 3.738 35.599 31.823 0.064 0.000 1.033 108 V HN 0.143 8.429 8.190 0.161 0.000 0.429 109 G N 0.800 109.608 108.800 0.013 0.000 2.467 109 G HA2 0.262 4.376 3.960 -0.016 0.000 0.257 109 G HA3 0.262 4.357 3.960 -0.030 -0.153 0.257 109 G C -0.698 174.160 174.900 -0.070 0.000 1.227 109 G CA -0.552 44.534 45.100 -0.024 0.000 0.835 109 G HN 0.230 8.538 8.290 0.030 0.000 0.556 110 R N 2.730 123.202 120.500 -0.046 0.000 2.468 110 R HA 0.284 4.514 4.340 -0.183 0.000 0.302 110 R C -1.308 175.108 176.300 0.194 0.000 1.041 110 R CA -1.492 54.550 56.100 -0.097 0.000 0.899 110 R CB 1.437 31.518 30.300 -0.364 0.000 1.167 110 R HN 0.026 8.299 8.270 0.005 0.000 0.483 111 G N 0.665 109.564 108.800 0.166 0.000 2.356 111 G HA2 -0.014 4.301 3.960 0.326 0.000 0.300 111 G HA3 -0.014 4.300 3.960 0.591 0.000 0.300 111 G C -2.410 172.603 174.900 0.188 0.000 1.331 111 G CA 0.152 45.457 45.100 0.342 0.000 0.905 111 G HN -0.355 8.077 8.290 0.056 -0.108 0.587 112 V N 1.936 121.973 119.914 0.205 0.000 2.409 112 V HA -0.359 3.790 4.120 0.049 0.000 0.270 112 V C 0.571 176.705 176.094 0.068 0.000 1.019 112 V CA 0.972 63.330 62.300 0.098 0.000 1.066 112 V CB -2.086 29.781 31.823 0.074 0.000 1.021 112 V HN -0.029 8.321 8.190 0.266 0.000 0.476 113 G N 5.191 113.975 108.800 -0.027 0.000 2.231 113 G HA2 -0.214 3.702 3.960 -0.180 0.000 0.206 113 G HA3 -0.214 3.690 3.960 -0.093 0.000 0.206 113 G C 0.171 174.973 174.900 -0.164 0.000 0.996 113 G CA -0.420 44.609 45.100 -0.118 0.000 0.645 113 G HN 0.223 8.489 8.290 -0.040 0.000 0.498 114 G N 1.642 110.395 108.800 -0.079 0.000 2.596 114 G HA2 -0.454 3.481 3.960 -0.043 0.000 0.295 114 G HA3 -0.454 3.460 3.960 -0.078 0.000 0.295 114 G C -0.059 174.802 174.900 -0.064 0.000 1.240 114 G CA 0.340 45.399 45.100 -0.068 0.000 0.985 114 G HN -0.075 8.095 8.290 -0.030 0.102 0.555 115 G N 0.337 109.131 108.800 -0.010 0.000 2.509 115 G HA2 -0.211 3.751 3.960 0.003 0.000 0.218 115 G HA3 -0.211 3.813 3.960 0.107 0.000 0.218 115 G C 1.053 175.959 174.900 0.010 0.000 1.124 115 G CA 1.465 46.586 45.100 0.036 0.000 0.776 115 G HN 0.271 8.571 8.290 0.017 0.000 0.547 116 S N 1.298 116.942 115.700 -0.093 0.000 2.442 116 S HA -0.256 4.168 4.470 -0.077 0.000 0.236 116 S C 1.156 175.656 174.600 -0.168 0.000 1.007 116 S CA 2.932 61.026 58.200 -0.177 0.000 0.965 116 S CB -0.584 62.338 63.200 -0.463 0.000 0.773 116 S HN -0.529 7.635 8.310 -0.177 0.039 0.504 117 L N -0.898 120.221 121.223 -0.174 0.000 2.093 117 L HA -0.126 4.062 4.340 -0.254 0.000 0.208 117 L C 1.532 178.202 176.870 -0.334 0.000 1.085 117 L CA 2.419 57.104 54.840 -0.258 0.000 0.755 117 L CB 0.182 42.091 42.059 -0.250 0.000 0.904 117 L HN -0.580 7.522 8.230 -0.152 0.037 0.435 118 V N -7.837 111.940 119.914 -0.229 0.000 3.605 118 V HA 0.431 4.506 4.120 -0.299 -0.135 0.284 118 V C -0.374 175.622 176.094 -0.164 0.000 1.386 118 V CA -1.704 60.460 62.300 -0.227 0.000 1.053 118 V CB 0.564 32.283 31.823 -0.173 0.000 0.857 118 V HN -0.621 7.330 8.190 -0.165 0.140 0.436 119 N N 2.969 121.619 118.700 -0.082 0.000 2.379 119 N HA 0.012 4.722 4.740 -0.051 0.000 0.260 119 N C 0.675 176.200 175.510 0.025 0.000 1.254 119 N CA -0.216 52.833 53.050 -0.003 0.000 0.958 119 N CB 0.318 38.880 38.487 0.124 0.000 1.208 119 N HN -0.543 7.792 8.380 -0.076 0.000 0.532 120 G N -5.034 103.816 108.800 0.085 0.000 2.920 120 G HA2 -0.103 3.888 3.960 0.051 0.000 0.208 120 G HA3 -0.103 3.919 3.960 0.104 0.000 0.208 120 G C -0.120 174.881 174.900 0.168 0.000 1.159 120 G CA -0.495 44.664 45.100 0.098 0.000 0.784 120 G HN 0.239 8.592 8.290 0.105 0.000 0.535 121 G N -1.314 107.646 108.800 0.268 0.000 2.189 121 G HA2 -0.380 3.910 3.960 0.437 0.000 0.267 121 G HA3 -0.380 3.899 3.960 0.252 -0.168 0.267 121 G C -0.633 174.496 174.900 0.380 0.000 0.975 121 G CA 0.304 45.621 45.100 0.362 0.000 0.644 121 G HN -0.397 8.222 8.290 0.285 -0.158 0.537 122 M N 0.298 120.023 119.600 0.208 0.000 2.227 122 M HA -0.119 4.558 4.480 0.081 -0.148 0.349 122 M C -0.790 175.300 176.300 -0.351 0.000 1.443 122 M CA 0.521 55.827 55.300 0.009 0.000 1.110 122 M CB 0.219 32.817 32.600 -0.003 0.000 1.773 122 M HN -0.411 7.952 8.290 0.223 0.060 0.463 123 A N 6.485 129.158 122.820 -0.245 0.000 2.328 123 A HA 0.301 4.080 4.320 -0.900 0.000 0.318 123 A C -2.104 175.341 177.584 -0.232 0.000 1.347 123 A CA -1.175 50.619 52.037 -0.405 0.000 0.842 123 A CB 1.267 20.244 19.000 -0.038 0.000 1.148 123 A HN 0.280 8.389 8.150 -0.069 0.000 0.499 124 V N 3.521 123.249 119.914 -0.309 0.000 2.638 124 V HA 0.070 4.116 4.120 -0.124 0.000 0.306 124 V C -1.010 174.949 176.094 -0.225 0.000 1.052 124 V CA -1.637 60.535 62.300 -0.212 0.000 0.885 124 V CB 3.456 35.116 31.823 -0.272 0.000 0.999 124 V HN 0.059 7.983 8.190 -0.442 0.000 0.424 125 E N 6.058 126.129 120.200 -0.215 0.000 2.354 125 E HA 0.068 4.109 4.350 -0.516 0.000 0.269 125 E C -1.777 174.668 176.600 -0.258 0.000 1.036 125 E CA -2.248 53.916 56.400 -0.393 0.000 0.876 125 E CB 0.756 30.172 29.700 -0.473 0.000 1.009 125 E HN 0.121 8.389 8.360 -0.153 0.000 0.416 126 P HA 0.048 4.406 4.420 -0.102 0.000 0.274 126 P C -0.719 176.612 177.300 0.051 0.000 1.246 126 P CA -0.712 62.362 63.100 -0.044 0.000 0.795 126 P CB 1.076 32.866 31.700 0.149 0.000 1.006 127 K N 0.763 121.204 120.400 0.068 0.000 2.451 127 K HA -0.179 4.172 4.320 0.051 0.000 0.280 127 K C 1.495 178.192 176.600 0.160 0.000 1.020 127 K CA 1.067 57.414 56.287 0.100 0.000 1.008 127 K CB 0.305 32.881 32.500 0.127 0.000 0.917 127 K HN 0.437 8.689 8.250 0.003 0.000 0.478 128 R N 6.873 127.340 120.500 -0.055 0.000 2.081 128 R HA -0.397 3.875 4.340 -0.113 0.000 0.235 128 R C 1.750 178.092 176.300 0.070 0.000 1.131 128 R CA 4.004 59.972 56.100 -0.220 0.000 0.960 128 R CB -0.371 29.467 30.300 -0.770 0.000 0.856 128 R HN 0.658 8.845 8.270 -0.138 0.000 0.436 129 S N -2.322 113.427 115.700 0.081 0.000 2.419 129 S HA -0.189 4.502 4.470 0.107 -0.157 0.233 129 S C 1.569 176.317 174.600 0.248 0.000 1.016 129 S CA 3.122 61.407 58.200 0.141 0.000 0.974 129 S CB -0.810 62.465 63.200 0.125 0.000 0.786 129 S HN 0.263 8.600 8.310 0.044 0.000 0.492 130 Y N 4.043 124.450 120.300 0.177 0.000 2.286 130 Y HA -0.195 4.477 4.550 0.203 0.000 0.293 130 Y C 1.089 177.102 175.900 0.189 0.000 1.124 130 Y CA 2.336 60.560 58.100 0.206 0.000 1.178 130 Y CB 0.015 38.620 38.460 0.243 0.000 1.010 130 Y HN -0.847 7.559 8.280 0.382 0.103 0.536 131 F N 1.328 121.335 119.950 0.094 0.000 2.126 131 F HA -0.552 3.964 4.527 -0.019 0.000 0.299 131 F C 1.335 177.142 175.800 0.012 0.000 1.096 131 F CA 4.495 62.533 58.000 0.063 0.000 1.255 131 F CB 0.102 39.277 39.000 0.291 0.000 0.997 131 F HN 0.222 8.795 8.300 0.456 0.000 0.479 132 E N -2.237 118.094 120.200 0.218 0.000 2.150 132 E HA -0.450 3.985 4.350 0.142 0.000 0.193 132 E C 1.919 178.503 176.600 -0.027 0.000 0.985 132 E CA 2.896 59.364 56.400 0.115 0.000 0.814 132 E CB -0.404 29.382 29.700 0.143 0.000 0.752 132 E HN -0.211 8.318 8.360 0.301 0.011 0.466 133 E N -0.329 119.836 120.200 -0.058 0.000 2.047 133 E HA -0.220 4.104 4.350 -0.043 0.000 0.191 133 E C 2.139 178.614 176.600 -0.208 0.000 0.987 133 E CA 2.602 58.945 56.400 -0.096 0.000 0.799 133 E CB 0.141 29.822 29.700 -0.033 0.000 0.752 133 E HN -0.822 7.439 8.360 -0.018 0.087 0.449 134 I N -6.770 113.565 120.570 -0.391 0.000 2.716 134 I HA -0.108 3.880 4.170 -0.303 0.000 0.259 134 I C 0.144 176.059 176.117 -0.337 0.000 1.172 134 I CA 2.233 63.295 61.300 -0.397 0.000 1.478 134 I CB 1.126 38.801 38.000 -0.543 0.000 1.104 134 I HN -0.357 7.577 8.210 -0.462 0.000 0.439 135 L N -0.593 120.385 121.223 -0.409 0.000 2.594 135 L HA 0.614 4.789 4.340 -0.275 0.000 0.245 135 L C -1.557 175.181 176.870 -0.220 0.000 1.460 135 L CA -2.811 51.807 54.840 -0.371 0.000 0.865 135 L CB 0.919 42.603 42.059 -0.626 0.000 1.131 135 L HN -0.517 7.448 8.230 -0.442 0.000 0.506 136 P HA -0.018 4.488 4.420 -0.032 -0.106 0.226 136 P C 0.253 177.537 177.300 -0.028 0.000 1.153 136 P CA 1.247 64.315 63.100 -0.054 0.000 0.777 136 P CB 0.276 31.951 31.700 -0.042 0.000 0.794 137 R N -3.051 117.419 120.500 -0.051 0.000 2.299 137 R HA 0.067 4.400 4.340 -0.012 0.000 0.197 137 R C -0.262 176.022 176.300 -0.026 0.000 0.971 137 R CA -0.050 56.031 56.100 -0.032 0.000 1.030 137 R CB -0.156 30.116 30.300 -0.047 0.000 0.932 137 R HN -0.060 8.119 8.270 -0.078 0.043 0.477 138 V N -0.034 119.871 119.914 -0.015 0.000 2.509 138 V HA -0.028 4.076 4.120 -0.027 0.000 0.284 138 V C -1.228 174.949 176.094 0.139 0.000 1.047 138 V CA -1.148 61.173 62.300 0.035 0.000 0.952 138 V CB 0.779 32.648 31.823 0.077 0.000 0.988 138 V HN -0.668 7.449 8.190 -0.030 0.055 0.469 139 D N 5.830 126.310 120.400 0.133 0.000 2.358 139 D HA 0.014 4.745 4.640 0.151 0.000 0.258 139 D C 0.375 176.809 176.300 0.223 0.000 1.223 139 D CA 0.200 54.297 54.000 0.162 0.000 0.886 139 D CB 1.029 41.914 40.800 0.142 0.000 1.120 139 D HN 0.295 8.725 8.370 0.100 0.000 0.482 140 S N 6.984 122.838 115.700 0.258 0.000 2.436 140 S HA -0.209 4.466 4.470 0.341 0.000 0.228 140 S C 1.643 176.405 174.600 0.269 0.000 1.014 140 S CA 2.340 60.732 58.200 0.319 0.000 0.950 140 S CB 0.137 63.549 63.200 0.354 0.000 0.784 140 S HN 0.297 8.744 8.310 0.228 0.000 0.504 141 S N 3.636 119.446 115.700 0.183 0.000 2.368 141 S HA -0.285 4.282 4.470 0.161 0.000 0.225 141 S C 1.872 176.553 174.600 0.134 0.000 1.030 141 S CA 4.198 62.488 58.200 0.149 0.000 0.999 141 S CB -0.050 63.208 63.200 0.097 0.000 0.844 141 S HN 0.095 8.723 8.310 0.162 -0.221 0.459 142 E N 0.648 120.924 120.200 0.128 0.000 2.274 142 E HA -0.238 4.115 4.350 0.004 0.000 0.194 142 E C 2.331 178.980 176.600 0.082 0.000 0.996 142 E CA 2.372 58.821 56.400 0.082 0.000 0.840 142 E CB -0.622 29.179 29.700 0.169 0.000 0.772 142 E HN -0.405 8.537 8.360 0.147 -0.494 0.491 143 M N -0.164 119.505 119.600 0.116 0.000 2.098 143 M HA -0.232 4.244 4.480 -0.007 0.000 0.262 143 M C 2.123 178.372 176.300 -0.085 0.000 1.072 143 M CA 2.455 57.709 55.300 -0.078 0.000 1.133 143 M CB -0.279 32.107 32.600 -0.358 0.000 1.344 143 M HN -0.839 7.525 8.290 0.147 0.014 0.414 144 Y N -2.345 118.022 120.300 0.112 0.000 2.395 144 Y HA -0.110 4.611 4.550 0.285 0.000 0.293 144 Y C 2.696 178.637 175.900 0.068 0.000 1.123 144 Y CA 2.416 60.602 58.100 0.143 0.000 1.227 144 Y CB -0.032 38.458 38.460 0.050 0.000 1.012 144 Y HN -0.304 8.172 8.280 0.327 0.000 0.552 145 D N -2.233 118.241 120.400 0.123 0.000 2.213 145 D HA -0.012 4.664 4.640 0.060 0.000 0.205 145 D C 0.543 176.811 176.300 -0.055 0.000 0.961 145 D CA 2.572 56.594 54.000 0.036 0.000 0.853 145 D CB 0.512 41.320 40.800 0.014 0.000 0.967 145 D HN -0.210 8.236 8.370 0.127 0.000 0.496 146 R N -2.362 118.037 120.500 -0.169 0.000 2.610 146 R HA 0.116 4.316 4.340 -0.232 0.000 0.171 146 R C 1.527 177.621 176.300 -0.343 0.000 0.892 146 R CA 1.510 57.400 56.100 -0.352 0.000 1.086 146 R CB 1.879 31.774 30.300 -0.674 0.000 1.320 146 R HN -0.363 7.814 8.270 -0.155 0.000 0.582 147 Y N -0.842 119.403 120.300 -0.092 0.000 2.314 147 Y HA -0.165 4.327 4.550 -0.097 0.000 0.294 147 Y C 2.573 178.354 175.900 -0.198 0.000 1.119 147 Y CA 2.837 60.838 58.100 -0.166 0.000 1.179 147 Y CB 0.149 38.448 38.460 -0.268 0.000 1.025 147 Y HN -0.576 7.488 8.280 -0.359 0.000 0.541 148 F N -1.638 118.277 119.950 -0.058 0.000 2.102 148 F HA -0.091 4.385 4.527 -0.085 0.000 0.298 148 F C -0.555 175.224 175.800 -0.036 0.000 1.105 148 F CA 4.851 62.782 58.000 -0.115 0.000 1.239 148 F CB -3.267 35.551 39.000 -0.304 0.000 0.991 148 F HN 0.257 8.500 8.300 -0.096 0.000 0.474 149 P HA -0.288 4.198 4.420 0.110 0.000 0.216 149 P C 1.422 178.773 177.300 0.085 0.000 1.150 149 P CA 2.755 65.914 63.100 0.098 0.000 0.837 149 P CB -0.311 31.421 31.700 0.053 0.000 0.786 150 R N -2.154 118.389 120.500 0.071 0.000 2.073 150 R HA -0.437 3.937 4.340 0.056 0.000 0.234 150 R C 1.634 178.012 176.300 0.131 0.000 1.134 150 R CA 3.404 59.553 56.100 0.082 0.000 0.952 150 R CB -0.186 30.170 30.300 0.093 0.000 0.850 150 R HN -0.477 7.824 8.270 0.052 0.000 0.433 151 A N -1.151 121.772 122.820 0.171 0.000 1.902 151 A HA -0.187 4.326 4.320 0.322 0.000 0.217 151 A C 2.102 179.818 177.584 0.220 0.000 1.181 151 A CA 2.871 55.052 52.037 0.239 0.000 0.623 151 A CB -0.592 18.531 19.000 0.206 0.000 0.818 151 A HN -0.069 8.171 8.150 0.150 0.000 0.443 152 N N -2.361 116.447 118.700 0.179 0.000 2.309 152 N HA -0.202 4.643 4.740 0.176 0.000 0.182 152 N C 2.356 177.932 175.510 0.110 0.000 1.018 152 N CA 2.566 55.709 53.050 0.154 0.000 0.876 152 N CB -0.550 38.020 38.487 0.137 0.000 0.972 152 N HN -0.128 8.357 8.380 0.175 0.000 0.434 153 S N 1.006 116.756 115.700 0.082 0.000 2.377 153 S HA -0.101 4.394 4.470 0.042 0.000 0.223 153 S C 1.920 176.516 174.600 -0.008 0.000 1.030 153 S CA 3.470 61.692 58.200 0.037 0.000 0.970 153 S CB -0.103 63.110 63.200 0.022 0.000 0.830 153 S HN -0.327 8.013 8.310 0.090 0.024 0.473 154 M N 2.982 122.561 119.600 -0.036 0.000 2.349 154 M HA -0.150 4.194 4.480 -0.226 0.000 0.266 154 M C 0.838 177.042 176.300 -0.160 0.000 1.076 154 M CA 1.764 56.936 55.300 -0.215 0.000 1.126 154 M CB 0.059 32.369 32.600 -0.483 0.000 1.392 154 M HN -0.397 7.901 8.290 0.013 0.000 0.440 155 L N -6.157 115.112 121.223 0.077 0.000 2.478 155 L HA -0.144 4.302 4.340 0.177 0.000 0.223 155 L C -0.078 176.839 176.870 0.079 0.000 1.140 155 L CA 0.400 55.339 54.840 0.165 0.000 0.842 155 L CB 0.096 42.344 42.059 0.315 0.000 0.953 155 L HN -0.477 7.814 8.230 0.133 0.019 0.452 156 R N -5.954 114.569 120.500 0.037 0.000 3.332 156 R HA -0.392 3.955 4.340 0.012 0.000 0.263 156 R C -0.685 175.634 176.300 0.031 0.000 1.053 156 R CA 0.104 56.213 56.100 0.015 0.000 0.705 156 R CB -3.069 27.218 30.300 -0.021 0.000 1.166 156 R HN -0.667 7.263 8.270 0.030 0.359 0.427 157 V N -1.955 117.994 119.914 0.058 0.000 2.694 157 V HA -0.306 3.994 4.120 0.042 -0.155 0.306 157 V C 0.041 176.104 176.094 -0.052 0.000 1.054 157 V CA 1.377 63.691 62.300 0.024 0.000 1.161 157 V CB -0.610 31.237 31.823 0.040 0.000 0.916 157 V HN -0.701 7.536 8.190 0.078 0.000 0.490 158 N N 6.230 124.862 118.700 -0.113 0.000 2.774 158 N HA 0.171 4.827 4.740 -0.141 0.000 0.264 158 N C -2.467 172.899 175.510 -0.239 0.000 1.415 158 N CA -1.159 51.824 53.050 -0.111 0.000 0.815 158 N CB 2.959 41.498 38.487 0.087 0.000 1.514 158 N HN 0.614 8.951 8.380 -0.072 0.000 0.523 159 H N -2.414 116.803 119.070 0.245 0.000 2.600 159 H HA 0.407 5.012 4.556 0.081 0.000 0.357 159 H C -1.087 174.141 175.328 -0.166 0.000 1.106 159 H CA -1.086 54.995 56.048 0.056 0.000 1.193 159 H CB 2.999 32.732 29.762 -0.048 0.000 1.594 159 H HN 0.202 8.608 8.280 0.210 0.000 0.526 160 I N 2.963 123.137 120.570 -0.659 0.000 2.692 160 I HA -0.143 3.486 4.170 -0.903 0.000 0.284 160 I C -1.014 174.857 176.117 -0.410 0.000 1.159 160 I CA 0.249 60.995 61.300 -0.923 0.000 1.423 160 I CB 1.343 38.590 38.000 -1.256 0.000 1.380 160 I HN 0.054 7.855 8.210 -0.682 0.000 0.580 161 D N 6.458 126.769 120.400 -0.149 0.000 2.383 161 D HA -0.000 4.572 4.640 -0.113 0.000 0.252 161 D C 1.111 177.387 176.300 -0.040 0.000 1.166 161 D CA 0.177 54.144 54.000 -0.055 0.000 0.879 161 D CB 1.380 42.216 40.800 0.060 0.000 1.164 161 D HN 0.341 8.665 8.370 -0.077 0.000 0.462 162 T N 5.606 120.066 114.554 -0.156 0.000 2.867 162 T HA -0.356 3.856 4.350 -0.229 0.000 0.268 162 T C 1.518 176.284 174.700 0.110 0.000 1.057 162 T CA 3.832 65.856 62.100 -0.125 0.000 1.136 162 T CB -0.009 68.759 68.868 -0.167 0.000 0.874 162 T HN 0.377 8.505 8.240 -0.187 0.000 0.466 163 K N 2.503 122.969 120.400 0.109 0.000 2.025 163 K HA -0.218 4.167 4.320 0.107 0.000 0.207 163 K C 1.029 177.733 176.600 0.173 0.000 1.049 163 K CA 2.369 58.733 56.287 0.129 0.000 0.933 163 K CB -0.725 31.841 32.500 0.110 0.000 0.714 163 K HN -0.734 7.778 8.250 0.078 -0.215 0.438 164 W N -0.984 120.354 121.300 0.064 0.000 2.358 164 W HA -0.328 4.382 4.660 0.083 0.000 0.303 164 W C 1.044 177.641 176.519 0.130 0.000 1.208 164 W CA 3.084 60.485 57.345 0.093 0.000 1.274 164 W CB 0.418 29.935 29.460 0.095 0.000 1.138 164 W HN -0.617 8.357 8.180 0.355 -0.581 0.515 165 F N -0.474 119.471 119.950 -0.007 0.000 2.091 165 F HA -0.630 3.710 4.527 -0.311 0.000 0.299 165 F C 1.419 177.131 175.800 -0.146 0.000 1.103 165 F CA 4.220 62.120 58.000 -0.167 0.000 1.228 165 F CB 0.133 39.072 39.000 -0.102 0.000 0.984 165 F HN 0.034 8.580 8.300 0.409 0.000 0.477 166 E N -0.884 119.281 120.200 -0.058 0.000 2.106 166 E HA -0.291 3.934 4.350 -0.207 0.000 0.192 166 E C 1.632 178.101 176.600 -0.219 0.000 0.984 166 E CA 2.072 58.399 56.400 -0.122 0.000 0.806 166 E CB -0.704 29.030 29.700 0.058 0.000 0.750 166 E HN -0.411 8.013 8.360 0.131 0.014 0.458 167 D N -1.918 118.359 120.400 -0.205 0.000 2.240 167 D HA 0.036 4.300 4.640 -0.626 0.000 0.206 167 D C 0.961 177.103 176.300 -0.263 0.000 0.963 167 D CA 0.306 54.200 54.000 -0.177 0.000 0.863 167 D CB 0.186 40.933 40.800 -0.088 0.000 0.973 167 D HN -0.064 nan 8.370 nan 0.000 0.501 168 T N 1.636 115.920 114.554 -0.450 0.000 2.907 168 T HA 0.098 4.291 4.350 -0.261 0.000 0.298 168 T C 0.840 175.369 174.700 -0.285 0.000 1.017 168 T CA -0.465 61.390 62.100 -0.408 0.000 1.118 168 T CB 1.591 69.944 68.868 -0.857 0.000 0.948 168 T HN -0.415 7.477 8.240 -0.580 0.000 0.531 169 E N 8.391 128.453 120.200 -0.229 0.000 2.267 169 E HA -0.183 4.014 4.350 -0.255 0.000 0.197 169 E C 1.590 177.995 176.600 -0.325 0.000 0.998 169 E CA 2.700 58.917 56.400 -0.305 0.000 0.830 169 E CB -0.845 28.621 29.700 -0.389 0.000 0.751 169 E HN 0.593 8.846 8.360 -0.179 0.000 0.491 170 W N -1.411 119.781 121.300 -0.180 0.000 2.699 170 W HA -0.066 4.734 4.660 -0.111 -0.206 0.249 170 W C 0.893 177.193 176.519 -0.364 0.000 1.280 170 W CA 1.489 58.708 57.345 -0.209 0.000 1.345 170 W CB 0.433 29.785 29.460 -0.179 0.000 1.128 170 W HN -0.631 7.462 8.180 -0.053 0.055 0.642 171 Y N -4.048 116.234 120.300 -0.030 0.000 2.641 171 Y HA 0.090 4.561 4.550 -0.131 0.000 0.248 171 Y C -0.067 175.565 175.900 -0.446 0.000 1.170 171 Y CA -0.161 57.775 58.100 -0.273 0.000 1.201 171 Y CB 0.191 38.338 38.460 -0.521 0.000 1.232 171 Y HN -0.522 7.631 8.280 -0.116 0.057 0.537 172 K N 3.081 123.378 120.400 -0.171 0.000 2.113 172 K HA -0.458 3.733 4.320 -0.215 0.000 0.208 172 K C 1.130 177.659 176.600 -0.118 0.000 1.047 172 K CA 4.217 60.404 56.287 -0.167 0.000 0.928 172 K CB -0.358 32.059 32.500 -0.139 0.000 0.716 172 K HN -0.677 7.380 8.250 -0.142 0.108 0.446 173 F N -5.284 114.611 119.950 -0.092 0.000 2.161 173 F HA -0.329 4.137 4.527 -0.101 0.000 0.300 173 F C 1.157 176.970 175.800 0.022 0.000 1.089 173 F CA 2.263 60.222 58.000 -0.068 0.000 1.282 173 F CB -1.439 37.502 39.000 -0.098 0.000 1.010 173 F HN -0.333 8.087 8.300 0.230 0.018 0.485 174 A N 0.495 122.783 122.820 -0.887 0.000 1.930 174 A HA -0.297 3.810 4.320 -0.355 0.000 0.215 174 A C 1.787 179.305 177.584 -0.111 0.000 1.176 174 A CA 2.620 54.371 52.037 -0.477 0.000 0.632 174 A CB -0.416 18.374 19.000 -0.349 0.000 0.819 174 A HN -0.511 6.806 8.150 -1.180 0.125 0.445 175 R N -2.176 118.236 120.500 -0.148 0.000 2.115 175 R HA -0.314 4.036 4.340 0.017 0.000 0.230 175 R C 2.266 178.557 176.300 -0.016 0.000 1.111 175 R CA 3.291 59.356 56.100 -0.059 0.000 0.976 175 R CB -0.110 30.102 30.300 -0.147 0.000 0.870 175 R HN -0.621 7.492 8.270 -0.260 0.000 0.445 176 V N 0.768 120.669 119.914 -0.022 0.000 2.261 176 V HA -0.427 3.712 4.120 0.032 0.000 0.246 176 V C 1.686 177.819 176.094 0.066 0.000 1.047 176 V CA 4.062 66.377 62.300 0.026 0.000 1.015 176 V CB -0.789 31.047 31.823 0.021 0.000 0.642 176 V HN -0.076 8.080 8.190 -0.055 0.000 0.446 177 S N -0.743 115.012 115.700 0.091 0.000 2.399 177 S HA -0.279 4.312 4.470 0.202 0.000 0.231 177 S C 2.163 176.842 174.600 0.132 0.000 1.022 177 S CA 3.690 61.996 58.200 0.177 0.000 0.983 177 S CB -0.374 63.005 63.200 0.298 0.000 0.803 177 S HN -0.678 7.672 8.310 0.066 0.000 0.480 178 R N 1.705 122.251 120.500 0.077 0.000 2.091 178 R HA -0.419 3.938 4.340 0.028 0.000 0.238 178 R C 1.839 178.161 176.300 0.037 0.000 1.136 178 R CA 3.794 59.916 56.100 0.037 0.000 0.959 178 R CB -0.175 30.134 30.300 0.015 0.000 0.856 178 R HN -0.136 8.173 8.270 0.064 0.000 0.437 179 E N -1.043 119.186 120.200 0.048 0.000 2.107 179 E HA -0.278 4.096 4.350 0.040 0.000 0.191 179 E C 2.473 179.110 176.600 0.062 0.000 0.982 179 E CA 3.111 59.542 56.400 0.052 0.000 0.809 179 E CB -0.280 29.457 29.700 0.062 0.000 0.756 179 E HN -0.522 7.869 8.360 0.050 0.000 0.459 180 Q N -1.573 118.273 119.800 0.077 0.000 2.079 180 Q HA -0.211 4.180 4.340 0.084 0.000 0.200 180 Q C 2.532 178.563 176.000 0.052 0.000 0.974 180 Q CA 2.571 58.422 55.803 0.079 0.000 0.840 180 Q CB -0.161 28.633 28.738 0.093 0.000 0.898 180 Q HN -0.365 7.955 8.270 0.083 0.000 0.430 181 A N -1.088 121.760 122.820 0.046 0.000 1.933 181 A HA -0.310 3.998 4.320 -0.019 0.000 0.218 181 A C 1.997 179.572 177.584 -0.015 0.000 1.175 181 A CA 2.579 54.615 52.037 -0.001 0.000 0.628 181 A CB -0.730 18.265 19.000 -0.008 0.000 0.814 181 A HN 0.130 8.320 8.150 0.067 0.000 0.444 182 G N -2.171 106.629 108.800 -0.000 0.000 2.442 182 G HA2 -0.408 3.682 3.960 -0.020 0.000 0.219 182 G HA3 -0.408 3.552 3.960 0.000 0.000 0.219 182 G C 1.783 176.683 174.900 0.001 0.000 1.141 182 G CA 1.681 46.777 45.100 -0.006 0.000 0.763 182 G HN -0.082 8.203 8.290 0.012 0.012 0.554 183 K N -0.117 120.293 120.400 0.017 0.000 2.362 183 K HA -0.094 4.239 4.320 0.022 0.000 0.200 183 K C 0.557 177.162 176.600 0.009 0.000 1.046 183 K CA 1.384 57.685 56.287 0.023 0.000 0.952 183 K CB -0.640 31.889 32.500 0.050 0.000 0.753 183 K HN -0.565 7.682 8.250 0.026 0.019 0.466 184 A N -3.995 118.820 122.820 -0.008 0.000 2.345 184 A HA 0.098 4.408 4.320 -0.016 0.000 0.225 184 A C -0.786 176.775 177.584 -0.038 0.000 1.243 184 A CA -0.613 51.409 52.037 -0.025 0.000 0.875 184 A CB 0.756 19.729 19.000 -0.045 0.000 0.929 184 A HN -0.425 7.563 8.150 -0.009 0.156 0.502 185 G N -2.407 106.373 108.800 -0.033 0.000 2.136 185 G HA2 -0.340 3.600 3.960 -0.033 0.000 0.242 185 G HA3 -0.340 3.596 3.960 -0.040 0.000 0.242 185 G C -0.582 174.284 174.900 -0.057 0.000 0.989 185 G CA 0.282 45.358 45.100 -0.040 0.000 0.682 185 G HN -0.445 7.646 8.290 -0.024 0.184 0.522 186 L N 0.090 121.274 121.223 -0.066 0.000 2.329 186 L HA 0.314 4.599 4.340 -0.092 0.000 0.279 186 L C -0.792 176.030 176.870 -0.081 0.000 1.014 186 L CA -1.085 53.702 54.840 -0.088 0.000 0.814 186 L CB 1.566 43.554 42.059 -0.118 0.000 1.257 186 L HN -0.656 7.507 8.230 -0.057 0.033 0.424 187 G N 0.469 109.212 108.800 -0.095 0.000 2.521 187 G HA2 0.273 4.182 3.960 -0.086 0.000 0.323 187 G HA3 0.273 4.173 3.960 -0.100 0.000 0.323 187 G C -1.280 173.543 174.900 -0.130 0.000 1.211 187 G CA -1.196 43.844 45.100 -0.101 0.000 0.979 187 G HN 0.235 8.463 8.290 -0.103 0.000 0.490 188 T N -2.665 111.799 114.554 -0.149 0.000 2.940 188 T HA 0.731 5.116 4.350 -0.174 -0.140 0.288 188 T C -0.626 173.925 174.700 -0.249 0.000 1.045 188 T CA -2.416 59.569 62.100 -0.191 0.000 1.018 188 T CB 2.872 71.622 68.868 -0.197 0.000 1.151 188 T HN -0.197 7.957 8.240 -0.143 0.000 0.529 189 V N -3.491 116.264 119.914 -0.264 0.000 2.876 189 V HA 0.438 4.411 4.120 -0.245 0.000 0.312 189 V C -1.678 174.253 176.094 -0.271 0.000 1.085 189 V CA -2.237 59.925 62.300 -0.230 0.000 0.945 189 V CB 3.308 35.054 31.823 -0.129 0.000 1.017 189 V HN 0.364 8.416 8.190 -0.230 0.000 0.428 190 F N 2.690 122.572 119.950 -0.113 0.000 2.484 190 F HA 0.208 4.779 4.527 -0.215 -0.173 0.360 190 F C 0.501 176.296 175.800 -0.008 0.000 1.101 190 F CA 0.320 58.232 58.000 -0.145 0.000 1.251 190 F CB 0.957 39.833 39.000 -0.207 0.000 1.132 190 F HN 0.073 8.305 8.300 -0.112 0.000 0.570 191 V N 5.324 125.369 119.914 0.218 0.000 2.347 191 V HA 0.399 4.640 4.120 0.202 0.000 0.280 191 V C -2.074 174.150 176.094 0.217 0.000 1.021 191 V CA -3.645 58.777 62.300 0.205 0.000 0.847 191 V CB 0.981 32.919 31.823 0.192 0.000 0.990 191 V HN 0.130 8.441 8.190 0.203 0.000 0.444 192 P HA 0.137 4.719 4.420 0.118 -0.091 0.272 192 P C -1.570 175.825 177.300 0.158 0.000 1.240 192 P CA -0.458 62.708 63.100 0.111 0.000 0.791 192 P CB 1.002 32.693 31.700 -0.015 0.000 0.978 193 N N -1.232 117.578 118.700 0.182 0.000 2.591 193 N HA 0.561 5.611 4.740 0.170 -0.208 0.263 193 N C -0.206 175.350 175.510 0.077 0.000 1.308 193 N CA -0.668 52.476 53.050 0.157 0.000 0.837 193 N CB 4.280 42.842 38.487 0.125 0.000 1.548 193 N HN -0.071 8.392 8.380 0.139 0.000 0.493 194 V N -1.976 118.015 119.914 0.128 0.000 3.608 194 V HA 0.319 4.463 4.120 0.040 0.000 0.269 194 V C -0.371 175.698 176.094 -0.041 0.000 1.245 194 V CA -0.643 61.696 62.300 0.065 0.000 1.138 194 V CB -0.458 31.436 31.823 0.119 0.000 0.841 194 V HN 0.089 8.404 8.190 0.208 0.000 0.451 195 Y N 3.623 123.797 120.300 -0.210 0.000 2.442 195 Y HA -0.233 4.336 4.550 -0.211 -0.146 0.330 195 Y C -0.899 174.746 175.900 -0.425 0.000 1.129 195 Y CA 1.067 58.987 58.100 -0.300 0.000 1.365 195 Y CB 0.466 38.727 38.460 -0.331 0.000 1.233 195 Y HN -0.039 8.638 8.280 0.030 -0.379 0.529 196 D N 6.998 127.182 120.400 -0.360 0.000 2.358 196 D HA -0.132 4.582 4.640 -0.106 -0.139 0.258 196 D C 0.451 176.785 176.300 0.057 0.000 1.223 196 D CA 0.226 54.142 54.000 -0.140 0.000 0.886 196 D CB 0.515 41.238 40.800 -0.128 0.000 1.120 196 D HN -0.002 7.983 8.370 -0.642 0.000 0.482 197 F N 5.933 125.981 119.950 0.164 0.000 2.367 197 F HA -0.272 4.372 4.527 0.195 0.000 0.298 197 F C 1.793 177.569 175.800 -0.041 0.000 1.094 197 F CA 2.676 60.745 58.000 0.114 0.000 1.409 197 F CB 0.062 39.114 39.000 0.087 0.000 1.064 197 F HN 0.288 8.984 8.300 0.132 -0.317 0.528 198 G N -0.584 108.295 108.800 0.131 0.000 2.408 198 G HA2 -0.398 3.518 3.960 -0.074 0.000 0.217 198 G HA3 -0.398 3.572 3.960 0.016 0.000 0.217 198 G C 0.576 175.457 174.900 -0.032 0.000 1.150 198 G CA 2.039 47.138 45.100 -0.001 0.000 0.776 198 G HN 0.228 8.916 8.290 0.157 -0.304 0.542 199 Y N 3.167 123.431 120.300 -0.059 0.000 2.181 199 Y HA -0.458 4.046 4.550 -0.077 0.000 0.288 199 Y C 1.392 177.266 175.900 -0.043 0.000 1.146 199 Y CA 3.997 62.060 58.100 -0.062 0.000 1.164 199 Y CB 0.294 38.699 38.460 -0.091 0.000 0.982 199 Y HN -0.493 8.439 8.280 0.179 -0.544 0.515 200 M N -0.366 119.342 119.600 0.179 0.000 2.108 200 M HA -0.490 4.307 4.480 0.167 -0.217 0.261 200 M C 2.018 178.145 176.300 -0.287 0.000 1.066 200 M CA 3.750 59.097 55.300 0.078 0.000 1.107 200 M CB 0.002 32.740 32.600 0.230 0.000 1.356 200 M HN -0.401 7.974 8.290 0.272 0.078 0.406 201 Q N -1.583 117.866 119.800 -0.585 0.000 2.170 201 Q HA -0.374 3.214 4.340 -1.254 0.000 0.203 201 Q C 2.259 178.028 176.000 -0.384 0.000 0.976 201 Q CA 3.329 58.595 55.803 -0.895 0.000 0.858 201 Q CB -0.274 27.836 28.738 -1.047 0.000 0.907 201 Q HN -0.329 7.664 8.270 -0.460 0.000 0.433 202 R N -0.486 119.812 120.500 -0.337 0.000 2.073 202 R HA -0.221 3.984 4.340 -0.226 0.000 0.229 202 R C 2.557 178.675 176.300 -0.303 0.000 1.120 202 R CA 3.615 59.531 56.100 -0.306 0.000 0.967 202 R CB -0.012 30.053 30.300 -0.391 0.000 0.862 202 R HN -0.466 7.470 8.270 -0.348 0.125 0.436 203 E N -0.072 119.911 120.200 -0.362 0.000 2.070 203 E HA -0.306 3.867 4.350 -0.296 0.000 0.197 203 E C 2.654 179.150 176.600 -0.173 0.000 1.004 203 E CA 3.027 59.259 56.400 -0.280 0.000 0.805 203 E CB -0.276 29.285 29.700 -0.232 0.000 0.744 203 E HN -0.105 8.007 8.360 -0.413 0.000 0.451 204 A N -1.289 121.470 122.820 -0.101 0.000 1.969 204 A HA -0.087 4.244 4.320 0.018 0.000 0.218 204 A C 1.275 178.944 177.584 0.142 0.000 1.169 204 A CA 2.380 54.467 52.037 0.084 0.000 0.635 204 A CB -0.631 18.602 19.000 0.388 0.000 0.810 204 A HN -0.540 7.458 8.150 -0.109 0.086 0.445 205 A N -4.152 118.703 122.820 0.059 0.000 2.238 205 A HA -0.099 4.275 4.320 0.090 0.000 0.208 205 A C 0.200 177.786 177.584 0.004 0.000 1.177 205 A CA -0.112 51.952 52.037 0.045 0.000 0.804 205 A CB -0.047 18.959 19.000 0.010 0.000 0.823 205 A HN -0.505 7.542 8.150 0.006 0.106 0.482 206 G N -1.731 107.055 108.800 -0.023 0.000 2.160 206 G HA2 -0.320 3.614 3.960 -0.043 0.000 0.251 206 G HA3 -0.320 3.632 3.960 -0.013 0.000 0.251 206 G C 0.399 175.259 174.900 -0.067 0.000 1.008 206 G CA 1.061 46.139 45.100 -0.037 0.000 0.724 206 G HN -0.482 7.595 8.290 -0.032 0.193 0.514 207 E N -1.953 118.182 120.200 -0.108 0.000 2.364 207 E HA -0.024 4.276 4.350 -0.083 0.000 0.196 207 E C -0.225 176.282 176.600 -0.156 0.000 0.990 207 E CA 0.553 56.883 56.400 -0.117 0.000 0.886 207 E CB 1.286 30.911 29.700 -0.125 0.000 0.866 207 E HN -0.139 8.118 8.360 -0.128 0.026 0.493 208 V N -5.934 113.843 119.914 -0.229 0.000 3.114 208 V HA 0.530 4.540 4.120 -0.184 0.000 0.308 208 V C -2.937 173.015 176.094 -0.237 0.000 1.168 208 V CA -4.035 58.102 62.300 -0.271 0.000 1.015 208 V CB 1.276 32.783 31.823 -0.527 0.000 1.050 208 V HN -0.789 7.259 8.190 -0.237 0.000 0.433 209 P HA -0.030 4.308 4.420 -0.136 0.000 0.265 209 P C -1.307 175.927 177.300 -0.110 0.000 1.193 209 P CA 0.087 63.054 63.100 -0.222 0.000 0.765 209 P CB 0.219 31.620 31.700 -0.499 0.000 0.823 210 K N 1.496 121.883 120.400 -0.021 0.000 2.185 210 K HA -0.043 4.450 4.320 0.044 -0.146 0.271 210 K C -0.547 176.163 176.600 0.183 0.000 1.013 210 K CA 0.370 56.683 56.287 0.043 0.000 0.943 210 K CB 0.561 33.034 32.500 -0.045 0.000 0.998 210 K HN 0.084 8.316 8.250 -0.029 0.000 0.468 211 S N 3.694 119.529 115.700 0.224 0.000 4.098 211 S HA 0.086 4.765 4.470 0.206 -0.086 0.193 211 S C 1.106 175.771 174.600 0.110 0.000 1.049 211 S CA 1.406 59.749 58.200 0.239 0.000 1.034 211 S CB 1.678 65.091 63.200 0.355 0.000 1.380 211 S HN 0.593 9.411 8.310 0.207 -0.384 0.629 212 A N 4.309 127.186 122.820 0.095 0.000 1.986 212 A HA -0.084 4.139 4.320 -0.161 0.000 0.220 212 A C 1.205 178.670 177.584 -0.198 0.000 1.171 212 A CA 2.799 54.730 52.037 -0.178 0.000 0.640 212 A CB -0.003 18.645 19.000 -0.588 0.000 0.811 212 A HN -0.160 8.173 8.150 0.305 0.000 0.451 213 L N -5.617 115.439 121.223 -0.279 0.000 2.685 213 L HA 0.075 4.027 4.340 -0.646 0.000 0.233 213 L C -0.352 176.336 176.870 -0.302 0.000 1.173 213 L CA -0.089 54.377 54.840 -0.622 0.000 0.961 213 L CB -0.651 40.692 42.059 -1.194 0.000 1.217 213 L HN -0.473 7.886 8.230 -0.193 -0.244 0.478 214 A N -1.619 121.152 122.820 -0.082 0.000 2.674 214 A HA 0.392 4.744 4.320 0.054 0.000 0.286 214 A C -0.845 176.763 177.584 0.041 0.000 0.980 214 A CA -1.136 50.915 52.037 0.022 0.000 1.028 214 A CB 0.553 19.581 19.000 0.046 0.000 1.199 214 A HN -0.371 7.537 8.150 -0.072 0.199 0.499 215 T N -2.393 112.175 114.554 0.022 0.000 4.194 215 T HA -0.524 3.815 4.350 -0.019 0.000 0.339 215 T C -1.347 173.343 174.700 -0.016 0.000 0.757 215 T CA 1.555 63.657 62.100 0.004 0.000 1.931 215 T CB -2.440 66.445 68.868 0.030 0.000 1.886 215 T HN -0.121 8.126 8.240 0.011 0.000 0.878 216 E N -1.436 118.750 120.200 -0.022 0.000 2.187 216 E HA 0.499 4.819 4.350 -0.049 0.000 0.268 216 E C -2.017 174.529 176.600 -0.090 0.000 0.896 216 E CA -0.687 55.691 56.400 -0.036 0.000 0.766 216 E CB 3.801 33.518 29.700 0.027 0.000 1.142 216 E HN -0.642 7.704 8.360 -0.023 0.000 0.408 217 V N 4.224 124.038 119.914 -0.167 0.000 4.496 217 V HA 0.189 4.437 4.120 -0.151 -0.219 0.146 217 V C -0.251 175.676 176.094 -0.279 0.000 1.365 217 V CA 1.944 64.133 62.300 -0.184 0.000 1.001 217 V CB 2.308 34.047 31.823 -0.139 0.000 1.083 217 V HN -0.003 8.060 8.190 -0.210 0.000 0.624 218 I N -4.207 116.134 120.570 -0.383 0.000 3.111 218 I HA -0.011 4.200 4.170 -0.325 -0.236 0.272 218 I C -0.798 175.092 176.117 -0.377 0.000 1.268 218 I CA 2.013 63.060 61.300 -0.421 0.000 1.467 218 I CB 0.437 38.142 38.000 -0.490 0.000 1.087 218 I HN -0.831 7.129 8.210 -0.416 0.000 0.467 219 Y N -2.748 117.431 120.300 -0.202 0.000 2.658 219 Y HA 0.075 4.483 4.550 -0.236 0.000 0.276 219 Y C -0.620 174.977 175.900 -0.505 0.000 1.167 219 Y CA -2.385 55.569 58.100 -0.243 0.000 1.230 219 Y CB -0.796 37.601 38.460 -0.104 0.000 1.144 219 Y HN -0.487 7.475 8.280 -0.475 0.032 0.529 220 G N -0.401 108.037 108.800 -0.604 0.000 2.587 220 G HA2 -0.314 3.175 3.960 -1.184 0.000 0.686 220 G HA3 -0.314 2.178 3.960 -2.446 0.000 0.686 220 G C -2.040 172.467 174.900 -0.654 0.000 1.236 220 G CA -0.426 43.914 45.100 -1.267 0.000 0.820 220 G HN -0.689 7.081 8.290 -0.456 0.247 0.645 221 N N 0.809 119.199 118.700 -0.516 0.000 2.407 221 N HA 0.164 5.006 4.740 -0.034 -0.122 0.277 221 N C -0.805 174.750 175.510 0.075 0.000 0.995 221 N CA -0.584 52.407 53.050 -0.097 0.000 0.903 221 N CB 2.248 40.733 38.487 -0.002 0.000 1.218 221 N HN 0.222 8.189 8.380 -0.688 0.000 0.487 222 N N 2.208 120.965 118.700 0.095 0.000 2.381 222 N HA -0.131 4.626 4.740 0.028 0.000 0.182 222 N C -0.576 174.546 175.510 -0.646 0.000 1.025 222 N CA 1.990 54.949 53.050 -0.151 0.000 0.888 222 N CB 0.951 39.323 38.487 -0.191 0.000 0.965 222 N HN 0.107 8.877 8.380 0.106 -0.325 0.438 223 H N -1.252 117.808 119.070 -0.017 0.000 3.008 223 H HA 0.226 4.621 4.556 -0.269 0.000 0.354 223 H C 0.097 175.140 175.328 -0.474 0.000 1.252 223 H CA -0.321 55.581 56.048 -0.243 0.000 1.117 223 H CB 3.623 33.279 29.762 -0.176 0.000 1.857 223 H HN -1.016 7.205 8.280 -0.037 0.037 0.547 224 G N 1.377 109.693 108.800 -0.806 0.000 2.458 224 G HA2 -0.473 2.714 3.960 -1.289 0.000 0.237 224 G HA3 -0.473 2.541 3.960 -1.577 0.000 0.237 224 G C -1.026 173.123 174.900 -1.251 0.000 1.113 224 G CA 1.039 45.371 45.100 -1.280 0.000 0.655 224 G HN 0.418 8.231 8.290 -0.796 0.000 0.513 225 K N 3.152 123.071 120.400 -0.802 0.000 2.276 225 K HA 0.063 4.093 4.320 -0.483 0.000 0.285 225 K C -0.637 175.799 176.600 -0.273 0.000 1.062 225 K CA -0.939 55.093 56.287 -0.425 0.000 0.918 225 K CB 0.348 32.790 32.500 -0.097 0.000 1.055 225 K HN -0.607 7.208 8.250 -0.585 0.084 0.477 226 Q N 8.455 128.126 119.800 -0.213 0.000 2.664 226 Q HA 0.137 4.383 4.340 -0.156 0.000 0.223 226 Q C -1.062 174.870 176.000 -0.113 0.000 1.298 226 Q CA -1.041 54.674 55.803 -0.147 0.000 0.965 226 Q CB -1.217 27.453 28.738 -0.114 0.000 1.510 226 Q HN -0.164 7.980 8.270 -0.211 0.000 0.567 227 S N 0.799 116.426 115.700 -0.122 0.000 2.634 227 S HA -0.041 4.328 4.470 -0.169 0.000 0.261 227 S C 0.924 175.443 174.600 -0.136 0.000 1.271 227 S CA -1.099 57.016 58.200 -0.142 0.000 0.985 227 S CB 1.106 64.231 63.200 -0.126 0.000 0.968 227 S HN -0.372 7.817 8.310 -0.123 0.047 0.568 228 L N -0.088 121.013 121.223 -0.203 0.000 2.275 228 L HA -0.058 4.217 4.340 -0.109 0.000 0.215 228 L C 1.634 178.454 176.870 -0.082 0.000 1.119 228 L CA 2.471 57.209 54.840 -0.170 0.000 0.790 228 L CB -0.424 41.433 42.059 -0.336 0.000 0.919 228 L HN 0.088 8.160 8.230 -0.263 0.000 0.443 229 D N -1.819 118.540 120.400 -0.068 0.000 2.218 229 D HA -0.291 4.331 4.640 -0.029 0.000 0.204 229 D C 1.151 177.432 176.300 -0.033 0.000 0.976 229 D CA 2.701 56.683 54.000 -0.030 0.000 0.853 229 D CB -1.103 39.702 40.800 0.009 0.000 0.939 229 D HN 0.353 8.645 8.370 -0.078 0.030 0.481 230 K N -3.321 117.050 120.400 -0.047 0.000 2.262 230 K HA -0.006 4.284 4.320 -0.050 0.000 0.200 230 K C 0.318 176.881 176.600 -0.062 0.000 1.049 230 K CA 2.132 58.385 56.287 -0.056 0.000 0.979 230 K CB 0.827 33.283 32.500 -0.074 0.000 0.773 230 K HN -0.400 7.791 8.250 -0.055 0.027 0.474 231 T N -1.974 112.547 114.554 -0.056 0.000 3.507 231 T HA 0.007 4.293 4.350 -0.105 0.000 0.197 231 T C 1.168 175.822 174.700 -0.076 0.000 0.847 231 T CA 2.128 64.178 62.100 -0.083 0.000 1.531 231 T CB 0.294 69.122 68.868 -0.068 0.000 1.834 231 T HN -0.984 7.118 8.240 -0.046 0.110 0.433 232 Y N 1.745 122.000 120.300 -0.076 0.000 2.181 232 Y HA -0.275 4.242 4.550 -0.056 0.000 0.288 232 Y C 2.516 178.368 175.900 -0.079 0.000 1.146 232 Y CA 4.161 62.218 58.100 -0.072 0.000 1.164 232 Y CB -0.119 38.293 38.460 -0.079 0.000 0.982 232 Y HN -0.101 8.281 8.280 0.171 0.000 0.515 233 L N -2.562 118.701 121.223 0.066 0.000 2.109 233 L HA -0.367 3.979 4.340 0.010 0.000 0.207 233 L C 2.086 178.949 176.870 -0.012 0.000 1.086 233 L CA 2.756 57.601 54.840 0.007 0.000 0.760 233 L CB -0.706 41.339 42.059 -0.023 0.000 0.910 233 L HN 0.145 8.410 8.230 0.058 0.000 0.437 234 A N -0.302 122.505 122.820 -0.021 0.000 1.902 234 A HA -0.336 3.966 4.320 -0.029 0.000 0.217 234 A C 1.872 179.435 177.584 -0.035 0.000 1.181 234 A CA 2.968 54.986 52.037 -0.032 0.000 0.623 234 A CB -1.178 17.798 19.000 -0.040 0.000 0.818 234 A HN -0.304 7.833 8.150 -0.021 0.000 0.443 235 A N -2.564 120.230 122.820 -0.043 0.000 1.898 235 A HA -0.293 3.996 4.320 -0.050 0.000 0.216 235 A C 1.811 179.376 177.584 -0.031 0.000 1.181 235 A CA 2.669 54.676 52.037 -0.049 0.000 0.620 235 A CB -0.600 18.351 19.000 -0.082 0.000 0.819 235 A HN -0.348 7.775 8.150 -0.046 0.000 0.442 236 A N -1.326 121.485 122.820 -0.015 0.000 1.902 236 A HA -0.311 3.996 4.320 -0.022 0.000 0.217 236 A C 2.503 180.069 177.584 -0.030 0.000 1.181 236 A CA 2.607 54.632 52.037 -0.020 0.000 0.623 236 A CB -0.494 18.495 19.000 -0.018 0.000 0.818 236 A HN -0.381 7.767 8.150 -0.004 0.000 0.443 237 L N -2.086 119.120 121.223 -0.029 0.000 2.083 237 L HA -0.253 4.068 4.340 -0.032 0.000 0.209 237 L C 3.055 179.908 176.870 -0.029 0.000 1.083 237 L CA 2.131 56.952 54.840 -0.030 0.000 0.752 237 L CB -0.331 41.711 42.059 -0.029 0.000 0.899 237 L HN -0.072 8.142 8.230 -0.027 0.000 0.433 238 G N -2.587 106.195 108.800 -0.029 0.000 2.498 238 G HA2 -0.246 3.698 3.960 -0.027 0.000 0.219 238 G HA3 -0.246 3.695 3.960 -0.031 0.000 0.219 238 G C 0.474 175.358 174.900 -0.027 0.000 1.119 238 G CA 1.877 46.960 45.100 -0.029 0.000 0.766 238 G HN -0.131 8.040 8.290 -0.030 0.101 0.552 239 T N -1.243 113.294 114.554 -0.028 0.000 3.035 239 T HA -0.118 4.217 4.350 -0.025 0.000 0.268 239 T C 1.482 176.168 174.700 -0.023 0.000 1.109 239 T CA 0.477 62.561 62.100 -0.026 0.000 1.119 239 T CB 0.600 69.450 68.868 -0.030 0.000 0.900 239 T HN -0.648 7.404 8.240 -0.029 0.170 0.503 240 G N 1.171 109.957 108.800 -0.023 0.000 2.179 240 G HA2 -0.298 3.650 3.960 -0.020 0.000 0.260 240 G HA3 -0.298 3.652 3.960 -0.017 0.000 0.260 240 G C 0.353 175.241 174.900 -0.020 0.000 0.977 240 G CA 0.805 45.893 45.100 -0.020 0.000 0.641 240 G HN -0.390 7.837 8.290 -0.025 0.048 0.533 241 K N -1.600 118.786 120.400 -0.024 0.000 2.387 241 K HA 0.246 4.555 4.320 -0.018 0.000 0.203 241 K C -1.858 174.722 176.600 -0.033 0.000 1.030 241 K CA -0.200 56.072 56.287 -0.024 0.000 1.099 241 K CB 1.464 33.950 32.500 -0.023 0.000 0.863 241 K HN -0.388 7.775 8.250 -0.027 0.071 0.529 242 V N -0.752 119.140 119.914 -0.037 0.000 2.656 242 V HA 0.985 5.298 4.120 -0.049 -0.221 0.307 242 V C -0.320 175.748 176.094 -0.043 0.000 1.051 242 V CA -2.360 59.913 62.300 -0.045 0.000 0.893 242 V CB 2.758 34.551 31.823 -0.051 0.000 0.999 242 V HN -0.629 7.540 8.190 -0.034 0.000 0.426 243 T N 4.445 118.970 114.554 -0.049 0.000 2.907 243 T HA 0.445 4.767 4.350 -0.048 0.000 0.292 243 T C -1.959 172.704 174.700 -0.062 0.000 1.043 243 T CA -2.092 59.976 62.100 -0.052 0.000 1.003 243 T CB 2.726 71.562 68.868 -0.053 0.000 1.084 243 T HN 0.523 8.732 8.240 -0.052 0.000 0.483 244 I N 1.615 122.147 120.570 -0.064 0.000 2.418 244 I HA 0.294 4.584 4.170 -0.071 -0.163 0.287 244 I C -0.925 175.137 176.117 -0.093 0.000 1.008 244 I CA -1.277 59.982 61.300 -0.069 0.000 1.104 244 I CB 2.301 40.272 38.000 -0.049 0.000 1.264 244 I HN 0.145 8.319 8.210 -0.059 0.000 0.438 245 Q N 9.285 129.004 119.800 -0.136 0.000 2.290 245 Q HA 0.372 4.586 4.340 -0.211 0.000 0.259 245 Q C -1.376 174.557 176.000 -0.111 0.000 0.941 245 Q CA -2.168 53.496 55.803 -0.231 0.000 0.912 245 Q CB 2.101 30.550 28.738 -0.481 0.000 1.244 245 Q HN 0.564 8.759 8.270 -0.126 0.000 0.441 246 T N 0.289 114.836 114.554 -0.012 0.000 2.948 246 T HA 0.369 4.921 4.350 0.074 -0.157 0.285 246 T C 0.461 175.302 174.700 0.235 0.000 1.019 246 T CA -2.187 59.962 62.100 0.082 0.000 1.013 246 T CB 2.041 70.922 68.868 0.022 0.000 1.117 246 T HN 0.180 8.405 8.240 -0.025 0.000 0.533 247 L N -3.009 118.320 121.223 0.177 0.000 3.843 247 L HA -0.485 4.193 4.340 0.173 -0.233 0.411 247 L C -1.866 175.074 176.870 0.118 0.000 1.205 247 L CA 1.162 56.094 54.840 0.154 0.000 0.945 247 L CB -2.450 39.653 42.059 0.074 0.000 1.929 247 L HN 0.198 8.513 8.230 0.142 0.000 0.934 248 H N -1.463 117.634 119.070 0.045 0.000 2.708 248 H HA 0.689 5.470 4.556 0.029 -0.207 0.320 248 H C -0.886 174.464 175.328 0.037 0.000 0.991 248 H CA -1.135 54.931 56.048 0.031 0.000 1.243 248 H CB 1.210 30.981 29.762 0.015 0.000 1.446 248 H HN -0.511 7.900 8.280 0.283 0.038 0.502 249 Q N 5.235 125.089 119.800 0.090 0.000 2.325 249 Q HA 0.350 4.736 4.340 0.077 0.000 0.262 249 Q C -1.476 174.554 176.000 0.051 0.000 0.968 249 Q CA -2.094 53.752 55.803 0.071 0.000 0.877 249 Q CB 2.696 31.475 28.738 0.067 0.000 1.253 249 Q HN 0.453 8.743 8.270 0.034 0.000 0.448 250 V N 9.598 129.538 119.914 0.044 0.000 2.521 250 V HA -0.181 4.094 4.120 0.034 -0.135 0.286 250 V C -0.148 175.954 176.094 0.013 0.000 1.034 250 V CA 1.480 63.796 62.300 0.027 0.000 1.045 250 V CB 0.158 31.990 31.823 0.016 0.000 0.974 250 V HN 0.662 8.878 8.190 0.043 0.000 0.480 251 K N 5.647 126.054 120.400 0.011 0.000 2.262 251 K HA 0.289 4.615 4.320 0.011 0.000 0.200 251 K C -0.258 176.340 176.600 -0.004 0.000 1.058 251 K CA 0.121 56.413 56.287 0.008 0.000 0.974 251 K CB 1.593 34.099 32.500 0.011 0.000 0.910 251 K HN 0.696 8.954 8.250 0.014 0.000 0.484 252 T N -4.668 109.881 114.554 -0.009 0.000 2.903 252 T HA 0.302 4.629 4.350 -0.039 0.000 0.299 252 T C -2.343 172.343 174.700 -0.025 0.000 1.093 252 T CA -1.340 60.746 62.100 -0.024 0.000 1.002 252 T CB 2.639 71.498 68.868 -0.016 0.000 1.127 252 T HN -0.758 7.481 8.240 -0.002 0.000 0.488 253 I N 1.730 122.273 120.570 -0.045 0.000 2.533 253 I HA 0.473 4.790 4.170 -0.010 -0.153 0.290 253 I C -1.915 174.184 176.117 -0.029 0.000 1.056 253 I CA -0.869 60.407 61.300 -0.040 0.000 1.057 253 I CB 3.381 41.319 38.000 -0.103 0.000 1.240 253 I HN 0.556 8.730 8.210 -0.060 0.000 0.423 254 R N 2.476 122.992 120.500 0.027 0.000 2.808 254 R HA 0.665 5.158 4.340 -0.004 -0.156 0.272 254 R C -2.317 174.029 176.300 0.077 0.000 0.995 254 R CA -2.824 53.291 56.100 0.025 0.000 0.917 254 R CB 3.818 34.122 30.300 0.007 0.000 1.217 254 R HN 0.343 8.645 8.270 0.053 0.000 0.471 255 Q N 2.914 122.725 119.800 0.017 0.000 2.274 255 Q HA 0.569 4.858 4.340 -0.328 -0.146 0.256 255 Q C 0.282 176.208 176.000 -0.124 0.000 0.927 255 Q CA -0.927 54.796 55.803 -0.134 0.000 0.939 255 Q CB 1.580 30.299 28.738 -0.031 0.000 1.201 255 Q HN 0.147 8.429 8.270 0.019 0.000 0.426 256 T N 3.962 118.401 114.554 -0.192 0.000 2.748 256 T HA -0.011 4.292 4.350 -0.078 0.000 0.304 256 T C 1.557 176.191 174.700 -0.109 0.000 1.041 256 T CA -0.321 61.707 62.100 -0.120 0.000 1.033 256 T CB 1.268 70.065 68.868 -0.118 0.000 0.995 256 T HN 0.290 8.358 8.240 -0.287 0.000 0.536 257 K N -0.155 120.200 120.400 -0.075 0.000 2.283 257 K HA -0.223 4.066 4.320 -0.051 0.000 0.202 257 K C 0.228 176.785 176.600 -0.071 0.000 1.048 257 K CA 2.348 58.599 56.287 -0.060 0.000 0.948 257 K CB -0.195 32.278 32.500 -0.045 0.000 0.742 257 K HN 0.531 8.740 8.250 -0.067 0.000 0.458 258 D N -5.850 114.495 120.400 -0.092 0.000 2.363 258 D HA -0.044 4.549 4.640 -0.078 0.000 0.214 258 D C 0.348 176.574 176.300 -0.122 0.000 1.093 258 D CA -0.685 53.258 54.000 -0.094 0.000 0.837 258 D CB 0.018 40.762 40.800 -0.093 0.000 0.948 258 D HN -0.673 7.504 8.370 -0.100 0.133 0.507 259 G N -0.782 107.917 108.800 -0.169 0.000 2.176 259 G HA2 -0.347 3.473 3.960 -0.233 0.000 0.232 259 G HA3 -0.347 3.516 3.960 -0.161 0.000 0.232 259 G C -0.648 174.023 174.900 -0.382 0.000 0.986 259 G CA 0.453 45.417 45.100 -0.227 0.000 0.643 259 G HN -0.300 7.721 8.290 -0.168 0.168 0.522 260 G N -1.290 107.300 108.800 -0.350 0.000 2.508 260 G HA2 0.087 3.828 3.960 -0.366 0.000 0.278 260 G HA3 0.087 4.046 3.960 -0.172 -0.101 0.278 260 G C -1.802 172.666 174.900 -0.721 0.000 1.389 260 G CA -1.150 43.719 45.100 -0.384 0.000 1.050 260 G HN -0.700 7.357 8.290 -0.388 0.000 0.522 261 Y N -3.586 116.709 120.300 -0.008 0.000 2.499 261 Y HA 0.621 5.308 4.550 -0.042 -0.162 0.347 261 Y C -1.760 174.140 175.900 0.000 0.000 0.987 261 Y CA -1.372 56.710 58.100 -0.029 0.000 1.044 261 Y CB 4.333 42.754 38.460 -0.065 0.000 1.245 261 Y HN -0.304 7.989 8.280 0.021 0.000 0.461 262 A N -0.136 122.758 122.820 0.124 0.000 2.386 262 A HA 0.975 5.656 4.320 0.091 -0.306 0.311 262 A C -2.410 175.214 177.584 0.068 0.000 1.068 262 A CA -2.283 49.803 52.037 0.082 0.000 0.743 262 A CB 3.517 22.544 19.000 0.045 0.000 1.258 262 A HN 0.754 8.977 8.150 0.122 0.000 0.429 263 L N 1.780 123.036 121.223 0.055 0.000 2.362 263 L HA 0.920 5.485 4.340 0.027 -0.208 0.271 263 L C 0.231 177.120 176.870 0.033 0.000 1.002 263 L CA -2.279 52.584 54.840 0.037 0.000 0.818 263 L CB 3.550 45.632 42.059 0.037 0.000 1.298 263 L HN 0.769 9.034 8.230 0.059 0.000 0.420 264 T N 1.316 115.884 114.554 0.022 0.000 2.799 264 T HA 0.606 5.143 4.350 0.026 -0.171 0.286 264 T C -0.796 173.919 174.700 0.024 0.000 0.973 264 T CA -1.592 60.521 62.100 0.021 0.000 1.035 264 T CB 0.797 69.672 68.868 0.013 0.000 0.932 264 T HN 0.182 8.432 8.240 0.016 0.000 0.469 265 V N 5.238 125.171 119.914 0.031 0.000 2.525 265 V HA 0.454 4.766 4.120 0.039 -0.169 0.299 265 V C -1.674 174.420 176.094 -0.000 0.000 1.034 265 V CA -1.613 60.713 62.300 0.042 0.000 0.863 265 V CB 2.193 34.078 31.823 0.103 0.000 0.999 265 V HN 0.472 8.679 8.190 0.029 0.000 0.423 266 E N 6.869 127.051 120.200 -0.030 0.000 2.200 266 E HA 0.412 4.856 4.350 -0.083 -0.144 0.283 266 E C -1.564 174.919 176.600 -0.196 0.000 1.015 266 E CA -1.215 55.135 56.400 -0.084 0.000 0.819 266 E CB 1.910 31.576 29.700 -0.057 0.000 1.081 266 E HN 0.426 8.781 8.360 -0.009 0.000 0.397 267 Q N 7.182 126.805 119.800 -0.296 0.000 2.278 267 Q HA 0.706 4.901 4.340 -0.604 -0.217 0.257 267 Q C -1.257 174.613 176.000 -0.217 0.000 0.928 267 Q CA -0.949 54.578 55.803 -0.459 0.000 0.932 267 Q CB 2.426 30.826 28.738 -0.563 0.000 1.221 267 Q HN 0.376 8.513 8.270 -0.223 0.000 0.434 268 K N 6.529 126.833 120.400 -0.159 0.000 2.350 268 K HA 0.911 5.343 4.320 -0.095 -0.168 0.241 268 K C -1.165 175.399 176.600 -0.061 0.000 0.994 268 K CA -2.388 53.844 56.287 -0.093 0.000 0.839 268 K CB 3.596 36.046 32.500 -0.083 0.000 1.244 268 K HN 0.004 8.154 8.250 -0.168 0.000 0.443 269 D N 0.227 120.599 120.400 -0.046 0.000 2.466 269 D HA 0.256 4.875 4.640 -0.035 0.000 0.262 269 D C 1.071 177.352 176.300 -0.031 0.000 1.177 269 D CA -1.361 52.620 54.000 -0.032 0.000 1.035 269 D CB 0.457 41.245 40.800 -0.020 0.000 1.105 269 D HN 0.086 8.426 8.370 -0.050 0.000 0.551 270 T N -6.451 108.065 114.554 -0.064 0.000 3.072 270 T HA -0.202 4.004 4.350 -0.240 0.000 0.266 270 T C 0.289 174.929 174.700 -0.100 0.000 1.127 270 T CA 3.019 65.005 62.100 -0.190 0.000 1.107 270 T CB -0.550 68.147 68.868 -0.286 0.000 0.910 270 T HN 0.158 8.367 8.240 -0.051 0.000 0.513 271 D N 0.721 121.155 120.400 0.057 0.000 2.340 271 D HA 0.081 4.824 4.640 0.172 0.000 0.220 271 D C 1.099 177.533 176.300 0.222 0.000 1.039 271 D CA 0.684 54.772 54.000 0.147 0.000 0.866 271 D CB 0.147 41.002 40.800 0.092 0.000 0.913 271 D HN -0.604 7.914 8.370 0.038 -0.125 0.523 272 G N -1.194 107.683 108.800 0.127 0.000 2.175 272 G HA2 -0.467 3.329 3.960 -0.273 0.000 0.244 272 G HA3 -0.467 3.313 3.960 -0.301 0.000 0.244 272 G C -0.882 173.933 174.900 -0.142 0.000 0.982 272 G CA -0.068 44.937 45.100 -0.157 0.000 0.641 272 G HN -0.304 7.931 8.290 0.106 0.118 0.527 273 K N 1.323 121.686 120.400 -0.061 0.000 2.368 273 K HA -0.061 4.219 4.320 -0.066 0.000 0.282 273 K C -0.732 175.825 176.600 -0.072 0.000 1.035 273 K CA -0.150 56.102 56.287 -0.059 0.000 0.973 273 K CB 1.018 33.500 32.500 -0.031 0.000 0.957 273 K HN -0.530 7.902 8.250 -0.026 -0.197 0.474 274 L N 6.584 127.764 121.223 -0.073 0.000 2.418 274 L HA -0.101 4.188 4.340 -0.084 0.000 0.274 274 L C -0.339 176.496 176.870 -0.059 0.000 1.135 274 L CA 1.128 55.925 54.840 -0.072 0.000 0.870 274 L CB 0.195 42.216 42.059 -0.065 0.000 1.154 274 L HN 0.448 8.635 8.230 -0.071 0.000 0.462 275 L N 7.622 128.804 121.223 -0.068 0.000 2.357 275 L HA 0.119 4.433 4.340 -0.043 0.000 0.211 275 L C 0.002 176.841 176.870 -0.051 0.000 1.075 275 L CA 0.503 55.310 54.840 -0.055 0.000 0.830 275 L CB 0.776 42.800 42.059 -0.058 0.000 0.996 275 L HN 0.947 9.126 8.230 -0.084 0.000 0.467 276 A N -3.749 119.031 122.820 -0.067 0.000 2.599 276 A HA 0.241 4.540 4.320 -0.036 0.000 0.294 276 A C -2.355 175.194 177.584 -0.059 0.000 1.055 276 A CA 0.220 52.226 52.037 -0.051 0.000 0.683 276 A CB 2.646 21.622 19.000 -0.039 0.000 1.278 276 A HN -0.664 7.435 8.150 -0.085 0.000 0.412 277 T N 2.814 117.348 114.554 -0.032 0.000 2.812 277 T HA 0.769 5.283 4.350 -0.034 -0.184 0.282 277 T C -0.365 174.334 174.700 -0.001 0.000 0.990 277 T CA -0.710 61.377 62.100 -0.023 0.000 0.960 277 T CB 1.634 70.492 68.868 -0.016 0.000 0.948 277 T HN 0.044 8.270 8.240 -0.023 0.000 0.438 278 K N 6.345 126.754 120.400 0.015 0.000 2.267 278 K HA 0.392 4.732 4.320 0.032 0.000 0.246 278 K C -2.005 174.619 176.600 0.040 0.000 0.954 278 K CA -1.671 54.639 56.287 0.038 0.000 0.824 278 K CB 2.951 35.495 32.500 0.074 0.000 1.167 278 K HN 0.649 8.905 8.250 0.011 0.000 0.431 279 E N 2.109 122.333 120.200 0.041 0.000 2.113 279 E HA 0.673 5.251 4.350 0.041 -0.203 0.273 279 E C -0.688 175.943 176.600 0.052 0.000 0.924 279 E CA -0.813 55.613 56.400 0.042 0.000 0.764 279 E CB 1.313 31.034 29.700 0.035 0.000 1.104 279 E HN 0.221 8.605 8.360 0.039 0.000 0.406 280 I N 8.177 128.779 120.570 0.054 0.000 2.498 280 I HA 0.458 4.851 4.170 0.055 -0.190 0.290 280 I C -1.715 174.439 176.117 0.062 0.000 1.032 280 I CA -0.992 60.339 61.300 0.052 0.000 1.073 280 I CB 3.161 41.184 38.000 0.039 0.000 1.251 280 I HN 0.254 8.495 8.210 0.052 0.000 0.426 281 S N 5.423 121.173 115.700 0.083 0.000 2.638 281 S HA 1.044 5.727 4.470 0.112 -0.146 0.302 281 S C -1.183 173.457 174.600 0.066 0.000 1.096 281 S CA -2.378 55.900 58.200 0.130 0.000 0.953 281 S CB 3.271 66.587 63.200 0.193 0.000 1.107 281 S HN 0.609 8.968 8.310 0.081 0.000 0.503 282 C N -3.938 115.434 119.300 0.121 0.000 3.320 282 C HA 0.930 5.513 4.460 -0.422 -0.376 0.335 282 C C -0.424 174.669 174.990 0.172 0.000 1.430 282 C CA -1.505 57.495 59.018 -0.029 0.000 1.271 282 C CB 3.769 31.501 27.740 -0.013 0.000 1.609 282 C HN 0.562 8.901 8.230 0.183 0.000 0.457 283 R N 1.590 122.126 120.500 0.061 0.000 2.075 283 R HA -0.000 4.305 4.340 -0.058 0.000 0.220 283 R C -0.412 175.779 176.300 -0.181 0.000 1.118 283 R CA 1.565 57.580 56.100 -0.141 0.000 0.986 283 R CB 1.525 31.579 30.300 -0.411 0.000 0.884 283 R HN -0.058 8.193 8.270 -0.031 0.000 0.439 284 Y N -3.734 116.708 120.300 0.237 0.000 2.352 284 Y HA 0.413 5.394 4.550 0.205 -0.308 0.339 284 Y C -1.650 174.369 175.900 0.198 0.000 0.992 284 Y CA -1.568 56.681 58.100 0.248 0.000 1.100 284 Y CB 2.390 41.087 38.460 0.395 0.000 1.192 284 Y HN -0.337 8.009 8.280 0.110 0.000 0.458 285 L N 2.479 123.759 121.223 0.095 0.000 2.376 285 L HA 0.685 5.288 4.340 0.172 -0.160 0.275 285 L C -2.363 174.427 176.870 -0.132 0.000 0.987 285 L CA -1.340 53.495 54.840 -0.008 0.000 0.828 285 L CB 3.576 45.479 42.059 -0.259 0.000 1.249 285 L HN 0.345 8.543 8.230 -0.052 0.000 0.409 286 F N 5.510 125.510 119.950 0.083 0.000 2.426 286 F HA 0.366 5.140 4.527 0.160 -0.150 0.348 286 F C -1.571 174.235 175.800 0.010 0.000 1.124 286 F CA -1.630 56.427 58.000 0.095 0.000 1.008 286 F CB 2.812 41.859 39.000 0.079 0.000 1.139 286 F HN 0.722 9.275 8.300 0.421 0.000 0.452 287 L N 3.190 124.486 121.223 0.122 0.000 2.264 287 L HA 0.185 4.549 4.340 0.039 0.000 0.289 287 L C -1.096 175.816 176.870 0.069 0.000 1.044 287 L CA -0.151 54.718 54.840 0.049 0.000 0.807 287 L CB 0.407 42.453 42.059 -0.022 0.000 1.192 287 L HN 0.727 9.017 8.230 0.099 0.000 0.425 288 G N 1.626 110.454 108.800 0.047 0.000 4.543 288 G HA2 0.290 4.410 3.960 0.036 0.000 0.286 288 G HA3 0.290 4.265 3.960 0.025 0.000 0.286 288 G C -0.861 174.045 174.900 0.009 0.000 1.112 288 G CA 0.213 45.331 45.100 0.030 0.000 0.870 288 G HN 0.537 8.851 8.290 0.039 0.000 0.540 289 A N 0.757 123.577 122.820 -0.000 0.000 2.278 289 A HA 0.144 4.454 4.320 -0.018 0.000 0.212 289 A C -0.970 176.608 177.584 -0.010 0.000 1.213 289 A CA -0.711 51.317 52.037 -0.015 0.000 0.840 289 A CB 0.297 19.280 19.000 -0.028 0.000 0.866 289 A HN -0.458 7.709 8.150 -0.000 -0.017 0.489 290 G N -1.944 106.863 108.800 0.013 0.000 2.746 290 G HA2 -0.375 3.621 3.960 0.060 0.000 0.685 290 G HA3 -0.375 3.613 3.960 0.045 0.000 0.685 290 G C 0.184 175.105 174.900 0.035 0.000 1.350 290 G CA -0.514 44.611 45.100 0.041 0.000 0.837 290 G HN -0.444 8.038 8.290 0.017 -0.182 0.564 291 S N 0.250 116.005 115.700 0.091 0.000 2.372 291 S HA -0.406 4.182 4.470 0.107 -0.055 0.227 291 S C 1.921 176.525 174.600 0.007 0.000 1.044 291 S CA 3.289 61.569 58.200 0.134 0.000 1.050 291 S CB 0.044 63.421 63.200 0.294 0.000 0.901 291 S HN 0.472 8.850 8.310 0.113 0.000 0.447 292 L N -1.296 119.937 121.223 0.017 0.000 2.023 292 L HA -0.103 4.004 4.340 -0.388 0.000 0.205 292 L C 2.130 178.880 176.870 -0.200 0.000 1.073 292 L CA 2.620 57.380 54.840 -0.135 0.000 0.745 292 L CB -0.513 41.593 42.059 0.078 0.000 0.900 292 L HN -0.228 8.061 8.230 0.097 0.000 0.435 293 G N -2.644 106.103 108.800 -0.089 0.000 2.403 293 G HA2 -0.257 3.655 3.960 -0.081 0.000 0.216 293 G HA3 -0.257 3.794 3.960 -0.059 -0.126 0.216 293 G C 1.272 176.113 174.900 -0.098 0.000 1.154 293 G CA 1.808 46.859 45.100 -0.082 0.000 0.784 293 G HN -0.418 7.844 8.290 -0.047 0.000 0.538 294 S N 2.208 117.854 115.700 -0.090 0.000 2.368 294 S HA -0.281 4.144 4.470 -0.076 0.000 0.224 294 S C 2.019 176.542 174.600 -0.128 0.000 1.029 294 S CA 3.662 61.810 58.200 -0.085 0.000 0.988 294 S CB -0.002 63.169 63.200 -0.049 0.000 0.838 294 S HN 0.003 8.269 8.310 -0.073 0.000 0.462 295 T N 4.531 118.967 114.554 -0.197 0.000 2.746 295 T HA -0.279 3.973 4.350 -0.163 0.000 0.267 295 T C 1.613 176.160 174.700 -0.256 0.000 1.039 295 T CA 4.551 66.495 62.100 -0.260 0.000 1.142 295 T CB -0.264 68.313 68.868 -0.485 0.000 0.866 295 T HN -0.740 7.377 8.240 -0.205 0.000 0.444 296 E N 2.690 122.723 120.200 -0.278 0.000 2.077 296 E HA -0.368 3.908 4.350 -0.123 0.000 0.193 296 E C 2.281 178.828 176.600 -0.089 0.000 0.989 296 E CA 3.371 59.683 56.400 -0.146 0.000 0.800 296 E CB -0.383 29.265 29.700 -0.087 0.000 0.746 296 E HN -0.489 7.681 8.360 -0.318 0.000 0.452 297 L N -1.668 119.497 121.223 -0.097 0.000 2.042 297 L HA -0.373 3.919 4.340 -0.080 0.000 0.210 297 L C 2.367 179.162 176.870 -0.124 0.000 1.076 297 L CA 3.197 57.980 54.840 -0.095 0.000 0.749 297 L CB -0.087 41.919 42.059 -0.089 0.000 0.893 297 L HN -0.614 7.553 8.230 -0.105 0.000 0.432 298 L N -3.477 117.672 121.223 -0.124 0.000 2.162 298 L HA -0.341 3.914 4.340 -0.141 0.000 0.205 298 L C 2.188 178.988 176.870 -0.117 0.000 1.086 298 L CA 2.806 57.572 54.840 -0.123 0.000 0.778 298 L CB -0.362 41.637 42.059 -0.101 0.000 0.928 298 L HN -0.603 7.535 8.230 -0.120 0.020 0.446 299 V N -2.438 117.416 119.914 -0.099 0.000 2.343 299 V HA -0.445 3.635 4.120 -0.066 0.000 0.247 299 V C 1.615 177.544 176.094 -0.275 0.000 1.051 299 V CA 3.744 65.991 62.300 -0.088 0.000 1.036 299 V CB -1.120 30.720 31.823 0.028 0.000 0.654 299 V HN 0.266 8.400 8.190 -0.092 0.000 0.451 300 R N 0.545 120.839 120.500 -0.344 0.000 2.083 300 R HA -0.515 2.935 4.340 -1.484 0.000 0.237 300 R C 2.085 178.099 176.300 -0.477 0.000 1.137 300 R CA 4.107 59.792 56.100 -0.691 0.000 0.951 300 R CB -0.130 29.977 30.300 -0.322 0.000 0.851 300 R HN -0.196 7.951 8.270 -0.204 0.000 0.434 301 A N -2.119 120.543 122.820 -0.264 0.000 1.933 301 A HA -0.171 4.045 4.320 -0.173 0.000 0.218 301 A C 2.579 180.072 177.584 -0.152 0.000 1.175 301 A CA 2.663 54.589 52.037 -0.186 0.000 0.628 301 A CB -0.643 18.259 19.000 -0.162 0.000 0.814 301 A HN -0.292 7.721 8.150 -0.227 0.000 0.444 302 R N -0.987 119.429 120.500 -0.140 0.000 2.070 302 R HA -0.283 4.218 4.340 -0.031 -0.180 0.233 302 R C 1.832 178.080 176.300 -0.087 0.000 1.137 302 R CA 3.049 59.105 56.100 -0.073 0.000 0.945 302 R CB 0.117 30.394 30.300 -0.038 0.000 0.845 302 R HN -0.162 8.015 8.270 -0.155 0.000 0.430 303 D N -2.612 117.687 120.400 -0.168 0.000 2.234 303 D HA -0.093 4.534 4.640 -0.023 0.000 0.205 303 D C 1.874 178.124 176.300 -0.084 0.000 0.962 303 D CA 2.627 56.567 54.000 -0.099 0.000 0.855 303 D CB -0.134 40.641 40.800 -0.042 0.000 0.951 303 D HN -0.144 8.073 8.370 -0.255 0.000 0.500 304 T N -5.551 108.893 114.554 -0.183 0.000 3.129 304 T HA 0.039 4.384 4.350 -0.008 0.000 0.251 304 T C 1.162 175.838 174.700 -0.041 0.000 1.117 304 T CA -0.132 61.921 62.100 -0.078 0.000 1.034 304 T CB 0.369 69.178 68.868 -0.097 0.000 0.968 304 T HN -0.497 7.548 8.240 -0.256 0.041 0.526 305 G N 2.840 111.616 108.800 -0.039 0.000 2.143 305 G HA2 -0.317 3.643 3.960 0.000 0.000 0.248 305 G HA3 -0.317 3.643 3.960 0.001 0.000 0.248 305 G C 0.638 175.535 174.900 -0.006 0.000 0.991 305 G CA 0.659 45.754 45.100 -0.009 0.000 0.689 305 G HN -0.477 7.715 8.290 -0.059 0.062 0.522 306 T N -3.198 111.339 114.554 -0.029 0.000 3.054 306 T HA -0.014 4.333 4.350 -0.005 0.000 0.259 306 T C -1.003 173.685 174.700 -0.020 0.000 1.092 306 T CA 1.601 63.687 62.100 -0.023 0.000 1.121 306 T CB 1.004 69.848 68.868 -0.040 0.000 0.912 306 T HN -0.334 7.830 8.240 -0.054 0.045 0.489 307 L N 1.215 122.420 121.223 -0.030 0.000 2.529 307 L HA 0.732 5.110 4.340 0.063 0.000 0.246 307 L C -2.190 174.769 176.870 0.148 0.000 1.394 307 L CA -2.600 52.237 54.840 -0.004 0.000 0.906 307 L CB 1.008 42.903 42.059 -0.272 0.000 1.170 307 L HN -0.518 7.581 8.230 -0.045 0.103 0.501 308 P HA 0.002 4.463 4.420 0.068 0.000 0.230 308 P C -0.250 177.121 177.300 0.118 0.000 1.158 308 P CA 1.083 64.246 63.100 0.106 0.000 0.769 308 P CB 0.022 31.764 31.700 0.070 0.000 0.807 309 N N -1.620 117.195 118.700 0.192 0.000 2.276 309 N HA 0.171 4.921 4.740 0.017 0.000 0.212 309 N C -0.284 175.294 175.510 0.114 0.000 1.127 309 N CA -0.773 52.301 53.050 0.041 0.000 0.834 309 N CB 0.361 38.720 38.487 -0.214 0.000 1.014 309 N HN -0.437 8.108 8.380 0.356 0.049 0.491 310 L N -0.596 120.773 121.223 0.243 0.000 2.461 310 L HA -0.167 4.294 4.340 0.201 0.000 0.272 310 L C 0.050 176.966 176.870 0.077 0.000 1.197 310 L CA 0.837 55.777 54.840 0.168 0.000 0.836 310 L CB 0.476 42.603 42.059 0.114 0.000 1.105 310 L HN -0.906 7.431 8.230 0.278 0.060 0.477 311 N N 0.525 119.260 118.700 0.058 0.000 2.405 311 N HA 0.031 4.791 4.740 0.033 0.000 0.269 311 N C 0.768 176.301 175.510 0.039 0.000 1.249 311 N CA -0.952 52.121 53.050 0.038 0.000 0.974 311 N CB 0.746 39.250 38.487 0.029 0.000 1.204 311 N HN 0.041 8.460 8.380 0.065 0.000 0.565 312 S N -2.302 113.419 115.700 0.034 0.000 2.481 312 S HA -0.155 4.339 4.470 0.040 0.000 0.231 312 S C 1.178 175.805 174.600 0.045 0.000 0.996 312 S CA 2.448 60.670 58.200 0.038 0.000 0.942 312 S CB -0.531 62.688 63.200 0.033 0.000 0.768 312 S HN 0.371 8.699 8.310 0.030 0.000 0.520 313 E N 1.016 121.242 120.200 0.043 0.000 2.358 313 E HA -0.062 4.321 4.350 0.055 0.000 0.195 313 E C -0.171 176.466 176.600 0.061 0.000 1.010 313 E CA 0.475 56.906 56.400 0.051 0.000 0.856 313 E CB 0.060 29.785 29.700 0.041 0.000 0.795 313 E HN -0.634 7.890 8.360 0.038 -0.141 0.504 314 V N -0.085 119.861 119.914 0.053 0.000 2.540 314 V HA -0.522 3.628 4.120 0.050 0.000 0.297 314 V C 0.962 177.103 176.094 0.079 0.000 1.024 314 V CA 2.442 64.773 62.300 0.051 0.000 1.105 314 V CB -1.732 30.107 31.823 0.027 0.000 0.938 314 V HN -0.836 7.477 8.190 0.047 -0.095 0.482 315 G N 7.161 116.028 108.800 0.112 0.000 2.254 315 G HA2 -0.385 3.717 3.960 0.238 0.000 0.225 315 G HA3 -0.385 3.684 3.960 0.183 0.000 0.225 315 G C -1.570 173.485 174.900 0.257 0.000 1.003 315 G CA 0.316 45.537 45.100 0.202 0.000 0.622 315 G HN 0.917 9.265 8.290 0.097 0.000 0.507 316 A N 0.393 123.321 122.820 0.179 0.000 2.257 316 A HA 0.315 4.735 4.320 0.166 0.000 0.289 316 A C -0.525 177.176 177.584 0.195 0.000 1.095 316 A CA -1.471 50.666 52.037 0.166 0.000 0.836 316 A CB 1.219 20.283 19.000 0.108 0.000 1.111 316 A HN -0.620 7.548 8.150 0.143 0.068 0.497 317 G N -2.574 106.334 108.800 0.180 0.000 2.160 317 G HA2 -0.405 3.634 3.960 0.131 0.000 0.244 317 G HA3 -0.405 3.627 3.960 0.120 0.000 0.244 317 G C -0.658 174.360 174.900 0.197 0.000 1.022 317 G CA -0.111 45.083 45.100 0.156 0.000 0.741 317 G HN 0.373 8.764 8.290 0.168 0.000 0.508 318 W N 2.642 123.987 121.300 0.074 0.000 2.315 318 W HA 0.304 5.181 4.660 0.068 -0.177 0.316 318 W C -1.995 174.516 176.519 -0.014 0.000 1.211 318 W CA -0.006 57.363 57.345 0.041 0.000 1.201 318 W CB 1.658 31.105 29.460 -0.022 0.000 1.184 318 W HN -0.449 7.967 8.180 0.392 0.000 0.544 319 G N 3.956 112.156 108.800 -1.001 0.000 2.690 319 G HA2 0.462 3.739 3.960 -1.139 0.000 0.293 319 G HA3 0.462 4.048 3.960 -0.625 0.000 0.293 319 G C -3.081 170.792 174.900 -1.711 0.000 1.399 319 G CA -1.217 43.174 45.100 -1.183 0.000 0.890 319 G HN 0.574 8.203 8.290 -1.101 0.000 0.485 320 P HA 0.276 4.125 4.420 -0.952 0.000 0.244 320 P C -0.482 176.535 177.300 -0.473 0.000 1.632 320 P CA -1.087 61.472 63.100 -0.901 0.000 0.944 320 P CB -0.376 30.897 31.700 -0.712 0.000 1.569 321 N N -0.156 118.311 118.700 -0.389 0.000 2.708 321 N HA -0.438 4.336 4.740 -0.140 -0.118 0.249 321 N C -0.185 175.263 175.510 -0.102 0.000 1.097 321 N CA 1.060 53.999 53.050 -0.185 0.000 0.710 321 N CB -1.093 37.305 38.487 -0.148 0.000 1.032 321 N HN -0.399 7.593 8.380 -0.485 0.097 0.551 322 G N -7.242 101.493 108.800 -0.108 0.000 2.203 322 G HA2 -0.546 3.412 3.960 -0.003 0.000 0.263 322 G HA3 -0.546 3.638 3.960 0.062 -0.186 0.263 322 G C -0.451 174.427 174.900 -0.038 0.000 1.012 322 G CA 0.628 45.720 45.100 -0.013 0.000 0.749 322 G HN 0.582 8.735 8.290 -0.175 0.033 0.512 323 N N 1.511 120.113 118.700 -0.162 0.000 2.475 323 N HA 0.200 5.098 4.740 -0.067 -0.197 0.267 323 N C -1.202 174.181 175.510 -0.213 0.000 1.169 323 N CA 0.899 53.823 53.050 -0.210 0.000 0.947 323 N CB 0.911 39.103 38.487 -0.492 0.000 1.061 323 N HN -0.666 7.548 8.380 -0.234 0.026 0.466 324 I N 2.004 122.609 120.570 0.060 0.000 2.619 324 I HA 0.493 4.946 4.170 0.213 -0.155 0.292 324 I C -2.025 174.290 176.117 0.330 0.000 1.100 324 I CA -2.473 58.956 61.300 0.215 0.000 1.043 324 I CB 3.836 41.968 38.000 0.220 0.000 1.239 324 I HN 0.203 8.485 8.210 0.120 0.000 0.420 325 M N 7.292 127.070 119.600 0.297 0.000 2.336 325 M HA 0.866 5.619 4.480 0.147 -0.185 0.342 325 M C -1.711 174.605 176.300 0.026 0.000 1.128 325 M CA -1.551 53.795 55.300 0.078 0.000 1.016 325 M CB 3.450 35.893 32.600 -0.261 0.000 1.665 325 M HN 0.047 8.540 8.290 0.338 0.000 0.445 326 T N 4.967 119.546 114.554 0.043 0.000 2.762 326 T HA 0.724 5.184 4.350 -0.042 -0.135 0.301 326 T C -2.779 171.898 174.700 -0.039 0.000 1.299 326 T CA -2.083 59.932 62.100 -0.141 0.000 1.005 326 T CB 2.726 71.224 68.868 -0.616 0.000 1.377 326 T HN 0.271 8.556 8.240 0.076 0.000 0.504 327 A N -0.629 122.135 122.820 -0.092 0.000 2.574 327 A HA 0.890 5.395 4.320 0.030 -0.167 0.297 327 A C -2.200 175.414 177.584 0.051 0.000 1.062 327 A CA -0.896 51.131 52.037 -0.016 0.000 0.686 327 A CB 3.305 22.244 19.000 -0.103 0.000 1.285 327 A HN 0.292 8.320 8.150 -0.203 0.000 0.403 328 R N -0.163 120.393 120.500 0.092 0.000 2.637 328 R HA 0.452 4.894 4.340 -0.008 -0.107 0.291 328 R C -1.511 174.787 176.300 -0.004 0.000 0.963 328 R CA -1.878 54.246 56.100 0.040 0.000 0.901 328 R CB 4.358 34.718 30.300 0.099 0.000 1.160 328 R HN 0.386 8.718 8.270 0.103 0.000 0.457 329 A N 3.315 126.110 122.820 -0.042 0.000 2.269 329 A HA 0.202 4.526 4.320 0.006 0.000 0.302 329 A C -1.409 176.103 177.584 -0.120 0.000 1.266 329 A CA -0.909 51.105 52.037 -0.039 0.000 0.894 329 A CB 0.592 19.576 19.000 -0.027 0.000 1.147 329 A HN 0.227 8.340 8.150 -0.062 0.000 0.537 330 N N 5.915 124.567 118.700 -0.080 0.000 2.503 330 N HA 0.007 4.557 4.740 -0.316 0.000 0.267 330 N C -0.394 174.925 175.510 -0.318 0.000 1.214 330 N CA -0.093 52.842 53.050 -0.192 0.000 0.959 330 N CB 1.662 40.135 38.487 -0.024 0.000 1.142 330 N HN -0.298 8.088 8.380 0.010 0.000 0.455 331 H N 0.813 119.613 119.070 -0.451 0.000 2.929 331 H HA -0.059 4.019 4.556 -0.795 0.000 0.358 331 H C 1.667 176.551 175.328 -0.740 0.000 1.111 331 H CA 0.657 56.151 56.048 -0.922 0.000 1.409 331 H CB 0.874 29.444 29.762 -1.987 0.000 1.373 331 H HN 0.209 7.994 8.280 -0.824 0.000 0.610 332 M N -0.284 118.959 119.600 -0.595 0.000 2.267 332 M HA -0.226 3.840 4.480 -0.689 0.000 0.263 332 M C 1.574 177.952 176.300 0.130 0.000 1.063 332 M CA 2.125 57.223 55.300 -0.336 0.000 1.090 332 M CB -0.895 31.595 32.600 -0.183 0.000 1.392 332 M HN 0.483 8.383 8.290 -0.651 0.000 0.422 333 W N -5.837 115.557 121.300 0.157 0.000 3.256 333 W HA 0.008 4.754 4.660 0.145 0.000 0.269 333 W C -1.207 175.419 176.519 0.179 0.000 1.310 333 W CA -1.281 56.152 57.345 0.147 0.000 1.673 333 W CB -0.446 29.055 29.460 0.068 0.000 1.115 333 W HN -0.243 7.703 8.180 -0.336 0.033 0.686 334 N N 0.426 119.179 118.700 0.090 0.000 2.818 334 N HA 0.364 5.184 4.740 0.134 0.000 0.301 334 N C -2.620 172.965 175.510 0.124 0.000 1.821 334 N CA -2.168 50.943 53.050 0.102 0.000 0.930 334 N CB -0.234 38.266 38.487 0.022 0.000 1.263 334 N HN -0.421 7.683 8.380 -0.041 0.251 0.487 335 P HA -0.032 4.167 4.420 -0.514 -0.087 0.269 335 P C -0.513 176.656 177.300 -0.218 0.000 1.209 335 P CA -0.064 62.882 63.100 -0.257 0.000 0.776 335 P CB 0.606 32.117 31.700 -0.314 0.000 0.876 336 T N -4.231 110.130 114.554 -0.323 0.000 3.060 336 T HA 0.001 4.290 4.350 -0.102 0.000 0.249 336 T C -0.153 174.420 174.700 -0.212 0.000 1.079 336 T CA -0.140 61.852 62.100 -0.181 0.000 1.013 336 T CB 1.270 70.061 68.868 -0.127 0.000 0.975 336 T HN 0.101 8.416 8.240 -0.486 -0.366 0.518 337 G N 1.166 109.756 108.800 -0.349 0.000 2.712 337 G HA2 -0.224 3.515 3.960 -0.388 0.000 0.686 337 G HA3 -0.224 3.554 3.960 -0.304 0.000 0.686 337 G C -0.600 174.030 174.900 -0.451 0.000 1.181 337 G CA -0.411 44.467 45.100 -0.369 0.000 0.762 337 G HN -0.587 7.877 8.290 -0.440 -0.438 0.641 338 A N 0.744 123.231 122.820 -0.554 0.000 2.067 338 A HA -0.120 3.877 4.320 -0.538 0.000 0.217 338 A C -1.096 176.071 177.584 -0.695 0.000 1.156 338 A CA 1.216 52.862 52.037 -0.651 0.000 0.683 338 A CB 0.653 19.192 19.000 -0.769 0.000 0.808 338 A HN 0.273 8.091 8.150 -0.553 0.000 0.455 339 H N -2.437 116.369 119.070 -0.440 0.000 2.718 339 H HA 0.299 4.592 4.556 -0.438 0.000 0.295 339 H C -1.541 173.545 175.328 -0.403 0.000 1.051 339 H CA -1.604 54.059 56.048 -0.643 0.000 1.260 339 H CB 0.412 29.317 29.762 -1.428 0.000 1.403 339 H HN -0.120 7.731 8.280 -0.647 0.041 0.488 340 Q N 5.286 125.107 119.800 0.034 0.000 2.310 340 Q HA 0.314 4.855 4.340 0.078 -0.154 0.270 340 Q C -1.390 174.682 176.000 0.119 0.000 1.025 340 Q CA -1.569 54.224 55.803 -0.017 0.000 0.772 340 Q CB 2.658 31.130 28.738 -0.443 0.000 1.253 340 Q HN 0.097 8.422 8.270 0.090 0.000 0.450 341 S N 2.800 118.582 115.700 0.136 0.000 2.558 341 S HA -0.274 4.312 4.470 -0.015 -0.125 0.293 341 S C 1.141 175.698 174.600 -0.073 0.000 1.292 341 S CA 0.680 58.864 58.200 -0.028 0.000 1.063 341 S CB 0.959 64.001 63.200 -0.264 0.000 0.831 341 S HN -0.067 8.322 8.310 0.132 0.000 0.499 342 S N 5.675 121.321 115.700 -0.089 0.000 2.481 342 S HA -0.077 4.315 4.470 -0.129 0.000 0.231 342 S C 0.538 175.122 174.600 -0.026 0.000 0.996 342 S CA 1.439 59.582 58.200 -0.096 0.000 0.942 342 S CB 0.472 63.606 63.200 -0.110 0.000 0.768 342 S HN 0.194 8.440 8.310 -0.107 0.000 0.520 343 I N 3.271 123.857 120.570 0.027 0.000 2.325 343 I HA 0.272 4.493 4.170 0.086 0.000 0.291 343 I C -1.725 174.639 176.117 0.412 0.000 1.019 343 I CA -3.835 57.541 61.300 0.126 0.000 1.302 343 I CB -0.598 37.378 38.000 -0.040 0.000 1.401 343 I HN -0.910 7.240 8.210 0.023 0.074 0.485 344 P HA 0.043 4.866 4.420 0.671 0.000 0.271 344 P C -1.534 176.053 177.300 0.478 0.000 1.216 344 P CA -0.244 63.155 63.100 0.498 0.000 0.776 344 P CB 0.774 32.679 31.700 0.343 0.000 0.881 345 A N 0.764 123.842 122.820 0.429 0.000 2.312 345 A HA 0.368 4.849 4.320 0.268 0.000 0.215 345 A C -1.463 176.156 177.584 0.059 0.000 1.256 345 A CA -0.274 51.875 52.037 0.187 0.000 0.966 345 A CB 2.181 21.069 19.000 -0.187 0.000 1.053 345 A HN 0.439 8.874 8.150 0.475 0.000 0.510 346 L N -3.164 118.099 121.223 0.067 0.000 2.370 346 L HA 0.875 5.306 4.340 -0.154 -0.184 0.266 346 L C -1.353 175.580 176.870 0.104 0.000 1.002 346 L CA -1.523 53.285 54.840 -0.052 0.000 0.818 346 L CB 4.596 46.565 42.059 -0.151 0.000 1.325 346 L HN -0.454 7.876 8.230 0.167 0.000 0.418 347 G N -0.099 108.759 108.800 0.096 0.000 2.605 347 G HA2 0.854 5.091 3.960 0.269 0.000 0.296 347 G HA3 0.854 5.032 3.960 0.363 0.000 0.296 347 G C -2.539 172.387 174.900 0.044 0.000 1.304 347 G CA -1.530 43.697 45.100 0.213 0.000 0.941 347 G HN 0.468 8.763 8.290 0.009 0.000 0.475 348 I N -0.003 120.613 120.570 0.076 0.000 2.297 348 I HA 0.189 4.436 4.170 -0.110 -0.143 0.291 348 I C -1.532 174.445 176.117 -0.233 0.000 1.033 348 I CA -0.208 61.053 61.300 -0.065 0.000 1.253 348 I CB 0.944 38.933 38.000 -0.018 0.000 1.396 348 I HN 0.584 8.915 8.210 0.202 0.000 0.476 349 D N 8.963 129.116 120.400 -0.412 0.000 2.456 349 D HA 0.103 4.252 4.640 -0.819 0.000 0.219 349 D C -1.296 174.848 176.300 -0.259 0.000 1.126 349 D CA -0.995 52.645 54.000 -0.602 0.000 0.890 349 D CB 0.310 40.675 40.800 -0.724 0.000 1.025 349 D HN -0.116 8.052 8.370 -0.337 0.000 0.511 350 A N 4.579 127.317 122.820 -0.137 0.000 2.749 350 A HA 0.309 4.570 4.320 -0.099 0.000 0.299 350 A C -0.790 176.787 177.584 -0.012 0.000 1.105 350 A CA -1.030 50.957 52.037 -0.084 0.000 0.987 350 A CB 0.748 19.676 19.000 -0.120 0.000 1.180 350 A HN 0.385 8.473 8.150 -0.104 0.000 0.528 351 W N 2.262 123.483 121.300 -0.131 0.000 2.291 351 W HA 0.196 4.805 4.660 -0.085 0.000 0.312 351 W C -2.550 173.918 176.519 -0.086 0.000 1.061 351 W CA -0.503 56.791 57.345 -0.086 0.000 1.296 351 W CB 2.151 31.599 29.460 -0.019 0.000 1.223 351 W HN -0.052 8.428 8.180 0.116 -0.230 0.421 352 D N 4.171 124.435 120.400 -0.226 0.000 2.513 352 D HA 0.073 4.741 4.640 0.046 0.000 0.222 352 D C -0.077 176.138 176.300 -0.141 0.000 1.210 352 D CA -1.537 52.408 54.000 -0.092 0.000 0.825 352 D CB 1.202 41.942 40.800 -0.099 0.000 1.037 352 D HN -0.249 7.849 8.370 -0.453 0.000 0.506 353 N N -3.033 115.429 118.700 -0.397 0.000 2.965 353 N HA -0.414 4.125 4.740 -0.336 0.000 0.232 353 N C -0.658 174.697 175.510 -0.258 0.000 0.913 353 N CA 1.713 54.626 53.050 -0.228 0.000 0.981 353 N CB -1.293 37.280 38.487 0.144 0.000 1.077 353 N HN -0.056 7.802 8.380 -0.872 0.000 0.589 354 S N -0.452 115.053 115.700 -0.325 0.000 2.655 354 S HA 0.165 4.541 4.470 -0.158 0.000 0.265 354 S C 0.759 175.172 174.600 -0.312 0.000 1.240 354 S CA 0.539 58.596 58.200 -0.238 0.000 0.986 354 S CB 1.693 64.785 63.200 -0.181 0.000 0.985 354 S HN -0.257 8.043 8.310 -0.361 -0.207 0.562 355 D N -1.091 119.188 120.400 -0.203 0.000 2.348 355 D HA -0.065 4.451 4.640 -0.208 0.000 0.216 355 D C 0.855 177.027 176.300 -0.214 0.000 0.970 355 D CA 2.517 56.403 54.000 -0.190 0.000 0.889 355 D CB -0.493 40.242 40.800 -0.110 0.000 0.912 355 D HN 0.371 8.649 8.370 -0.154 0.000 0.524 356 S N -2.972 112.593 115.700 -0.225 0.000 2.575 356 S HA -0.066 4.305 4.470 -0.165 0.000 0.215 356 S C 0.310 174.744 174.600 -0.276 0.000 0.966 356 S CA 0.083 58.162 58.200 -0.202 0.000 0.911 356 S CB 0.451 63.558 63.200 -0.154 0.000 0.780 356 S HN -0.699 7.429 8.310 -0.220 0.050 0.514 357 S N 2.887 118.303 115.700 -0.474 0.000 2.558 357 S HA -0.113 4.241 4.470 -0.493 -0.179 0.288 357 S C -0.881 173.503 174.600 -0.361 0.000 1.318 357 S CA 1.554 59.355 58.200 -0.665 0.000 1.056 357 S CB 0.702 62.857 63.200 -1.741 0.000 0.853 357 S HN -0.585 7.338 8.310 -0.523 0.074 0.505 358 V N 2.991 122.873 119.914 -0.053 0.000 2.777 358 V HA 0.440 4.919 4.120 0.279 -0.191 0.306 358 V C -2.369 173.958 176.094 0.389 0.000 1.112 358 V CA -1.069 61.349 62.300 0.196 0.000 0.917 358 V CB 3.739 35.609 31.823 0.078 0.000 1.018 358 V HN -0.061 7.981 8.190 -0.062 0.112 0.426 359 F N 7.886 128.039 119.950 0.338 0.000 2.434 359 F HA 0.635 5.447 4.527 0.165 -0.185 0.355 359 F C -2.461 173.447 175.800 0.179 0.000 1.115 359 F CA -3.021 55.100 58.000 0.201 0.000 1.010 359 F CB 3.186 42.251 39.000 0.107 0.000 1.234 359 F HN 0.533 9.216 8.300 0.638 0.000 0.439 360 A N 7.682 130.816 122.820 0.524 0.000 2.288 360 A HA 0.631 5.393 4.320 0.449 -0.172 0.320 360 A C -2.098 175.772 177.584 0.476 0.000 1.217 360 A CA -2.410 49.913 52.037 0.478 0.000 0.840 360 A CB 2.712 22.021 19.000 0.515 0.000 1.179 360 A HN 0.765 9.170 8.150 0.425 0.000 0.504 361 Q N 5.945 125.990 119.800 0.408 0.000 2.304 361 Q HA 0.005 4.553 4.340 0.346 0.000 0.260 361 Q C -0.910 175.324 176.000 0.391 0.000 0.965 361 Q CA -0.654 55.358 55.803 0.350 0.000 0.898 361 Q CB 1.500 30.395 28.738 0.262 0.000 1.196 361 Q HN 0.250 8.743 8.270 0.371 0.000 0.402 362 I N 7.598 128.386 120.570 0.363 0.000 2.308 362 I HA -0.016 4.320 4.170 0.277 0.000 0.293 362 I C -1.866 174.462 176.117 0.353 0.000 1.078 362 I CA -0.019 61.474 61.300 0.322 0.000 1.292 362 I CB -0.542 37.635 38.000 0.295 0.000 1.423 362 I HN -0.217 8.193 8.210 0.334 0.000 0.493 363 A N 7.625 130.556 122.820 0.185 0.000 2.290 363 A HA 0.634 5.204 4.320 0.203 -0.128 0.310 363 A C -2.757 174.794 177.584 -0.054 0.000 1.202 363 A CA -3.416 48.696 52.037 0.126 0.000 0.837 363 A CB 0.994 20.020 19.000 0.044 0.000 1.139 363 A HN 0.234 8.409 8.150 0.041 0.000 0.509 364 P HA 0.164 3.797 4.420 -1.501 -0.114 0.274 364 P C -0.114 176.900 177.300 -0.476 0.000 1.237 364 P CA -0.492 62.086 63.100 -0.871 0.000 0.793 364 P CB 0.744 31.958 31.700 -0.811 0.000 0.977 365 M N 4.190 123.484 119.600 -0.510 0.000 2.205 365 M HA 0.463 4.567 4.480 -0.626 0.000 0.344 365 M C -0.919 175.189 176.300 -0.320 0.000 1.085 365 M CA -2.890 52.191 55.300 -0.365 0.000 1.001 365 M CB 1.552 33.896 32.600 -0.427 0.000 1.626 365 M HN -0.010 nan 8.290 nan 0.000 0.442 366 P HA 0.086 nan 4.420 nan 0.000 0.253 366 P C -0.937 176.279 177.300 -0.140 0.000 1.260 366 P CA 0.303 63.313 63.100 -0.150 0.000 0.800 366 P CB 0.365 32.007 31.700 -0.096 0.000 1.162 367 A N -1.554 121.129 122.820 -0.229 0.000 1.986 367 A HA -0.256 4.009 4.320 -0.092 0.000 0.220 367 A C 0.735 178.209 177.584 -0.183 0.000 1.171 367 A CA 1.729 53.629 52.037 -0.227 0.000 0.640 367 A CB -0.220 18.431 19.000 -0.581 0.000 0.811 367 A HN -0.015 7.821 8.150 -0.309 0.128 0.451 368 G N -5.724 102.946 108.800 -0.216 0.000 2.179 368 G HA2 -0.378 3.813 3.960 -0.137 0.000 0.260 368 G HA3 -0.378 3.532 3.960 -0.084 0.000 0.260 368 G C -1.439 173.324 174.900 -0.229 0.000 0.977 368 G CA 0.657 45.663 45.100 -0.157 0.000 0.641 368 G HN 0.481 8.600 8.290 -0.260 0.016 0.533 369 L N -6.777 114.266 121.223 -0.300 0.000 2.403 369 L HA 0.425 4.573 4.340 -0.319 0.000 0.253 369 L C -1.276 175.334 176.870 -0.433 0.000 1.045 369 L CA -3.381 51.272 54.840 -0.311 0.000 0.845 369 L CB 2.435 44.382 42.059 -0.186 0.000 1.447 369 L HN -0.830 7.119 8.230 -0.338 0.078 0.411 370 E N 0.564 120.484 120.200 -0.468 0.000 2.324 370 E HA -0.013 3.915 4.350 -0.702 0.000 0.271 370 E C -0.197 176.022 176.600 -0.635 0.000 1.028 370 E CA 0.729 56.710 56.400 -0.698 0.000 0.890 370 E CB 0.344 29.483 29.700 -0.935 0.000 1.004 370 E HN 0.302 8.423 8.360 -0.398 0.000 0.431 371 T N 1.288 115.473 114.554 -0.616 0.000 3.004 371 T HA 0.162 4.519 4.350 0.011 0.000 0.266 371 T C 0.417 175.173 174.700 0.093 0.000 0.986 371 T CA -0.666 61.281 62.100 -0.256 0.000 0.902 371 T CB 1.173 69.648 68.868 -0.655 0.000 1.118 371 T HN 0.173 8.006 8.240 -0.679 0.000 0.522 372 W N -3.494 117.701 121.300 -0.175 0.000 3.207 372 W HA -0.397 4.257 4.660 -0.144 -0.081 0.291 372 W C -1.879 174.553 176.519 -0.145 0.000 1.105 372 W CA 1.038 58.297 57.345 -0.143 0.000 0.612 372 W CB -2.422 26.968 29.460 -0.117 0.000 2.140 372 W HN -0.173 7.891 8.180 -0.647 -0.272 1.420 373 V N -0.852 119.029 119.914 -0.054 0.000 2.509 373 V HA 0.417 4.683 4.120 -0.011 -0.153 0.284 373 V C 0.540 176.554 176.094 -0.134 0.000 1.047 373 V CA -0.862 61.394 62.300 -0.073 0.000 0.952 373 V CB 0.374 32.133 31.823 -0.107 0.000 0.988 373 V HN -0.722 7.305 8.190 -0.159 0.068 0.469 374 S N 6.554 122.184 115.700 -0.117 0.000 2.437 374 S HA 0.228 4.564 4.470 -0.223 0.000 0.305 374 S C -1.949 172.396 174.600 -0.425 0.000 1.109 374 S CA -1.132 56.928 58.200 -0.235 0.000 1.099 374 S CB 1.382 64.497 63.200 -0.141 0.000 1.004 374 S HN 0.322 8.592 8.310 -0.066 0.000 0.475 375 L N 6.153 127.057 121.223 -0.531 0.000 2.334 375 L HA 0.548 4.824 4.340 -0.312 -0.123 0.276 375 L C -2.226 174.257 176.870 -0.644 0.000 1.014 375 L CA -1.021 53.561 54.840 -0.430 0.000 0.815 375 L CB 3.562 45.494 42.059 -0.212 0.000 1.268 375 L HN 0.340 8.301 8.230 -0.449 0.000 0.428 376 Y N 1.558 121.844 120.300 -0.024 0.000 2.492 376 Y HA 0.625 5.442 4.550 0.123 -0.194 0.346 376 Y C -1.518 174.425 175.900 0.072 0.000 0.997 376 Y CA -2.015 56.105 58.100 0.034 0.000 1.025 376 Y CB 4.020 42.409 38.460 -0.119 0.000 1.263 376 Y HN 0.641 8.894 8.280 -0.046 0.000 0.454 377 L N 2.889 124.293 121.223 0.302 0.000 2.295 377 L HA 0.582 5.212 4.340 0.254 -0.138 0.281 377 L C -1.881 175.179 176.870 0.316 0.000 1.018 377 L CA -1.444 53.558 54.840 0.270 0.000 0.841 377 L CB 2.640 44.835 42.059 0.227 0.000 1.218 377 L HN -0.035 8.391 8.230 0.326 0.000 0.424 378 A N 6.339 129.355 122.820 0.326 0.000 2.309 378 A HA 0.592 5.275 4.320 0.381 -0.134 0.298 378 A C -1.595 176.136 177.584 0.244 0.000 1.165 378 A CA -2.077 50.167 52.037 0.344 0.000 0.821 378 A CB 2.191 21.438 19.000 0.412 0.000 1.102 378 A HN 0.943 9.280 8.150 0.311 0.000 0.500 379 I N 3.896 124.616 120.570 0.249 0.000 2.339 379 I HA 0.235 4.490 4.170 0.142 0.000 0.290 379 I C -0.958 175.381 176.117 0.371 0.000 0.994 379 I CA -0.647 60.777 61.300 0.206 0.000 1.191 379 I CB 1.340 39.385 38.000 0.074 0.000 1.343 379 I HN 0.442 8.831 8.210 0.298 0.000 0.458 380 T N 3.516 118.258 114.554 0.314 0.000 2.910 380 T HA 0.505 5.172 4.350 0.261 -0.160 0.287 380 T C -0.803 174.053 174.700 0.261 0.000 1.050 380 T CA -2.631 59.623 62.100 0.255 0.000 1.011 380 T CB 2.654 71.586 68.868 0.107 0.000 1.195 380 T HN 0.134 8.506 8.240 0.220 0.000 0.540 381 K N 1.576 121.976 120.400 -0.000 0.000 2.414 381 K HA 0.166 4.612 4.320 0.210 0.000 0.251 381 K C -1.549 175.062 176.600 0.018 0.000 1.037 381 K CA -0.965 55.332 56.287 0.017 0.000 0.980 381 K CB 0.276 32.614 32.500 -0.272 0.000 1.280 381 K HN 0.234 8.408 8.250 -0.127 0.000 0.451 382 N N 6.420 125.168 118.700 0.080 0.000 2.442 382 N HA 0.386 5.149 4.740 0.039 0.000 0.274 382 N C -1.215 174.351 175.510 0.093 0.000 1.002 382 N CA -3.128 49.965 53.050 0.071 0.000 0.910 382 N CB 1.822 40.367 38.487 0.097 0.000 1.244 382 N HN 0.144 8.595 8.380 0.118 0.000 0.492 383 P HA 0.109 4.578 4.420 0.081 0.000 0.237 383 P C -0.172 177.178 177.300 0.082 0.000 1.178 383 P CA 0.204 63.346 63.100 0.071 0.000 0.766 383 P CB 0.279 32.004 31.700 0.042 0.000 0.876 384 Q N 1.230 121.087 119.800 0.095 0.000 2.330 384 Q HA -0.099 4.265 4.340 0.039 0.000 0.279 384 Q C -0.520 175.637 176.000 0.262 0.000 1.024 384 Q CA 1.044 56.904 55.803 0.095 0.000 0.900 384 Q CB 0.649 29.370 28.738 -0.029 0.000 1.221 384 Q HN -0.445 8.108 8.270 0.090 -0.229 0.396 385 R N 0.943 121.587 120.500 0.240 0.000 2.795 385 R HA 0.639 5.425 4.340 0.494 -0.150 0.275 385 R C -0.184 176.363 176.300 0.411 0.000 0.981 385 R CA -2.125 54.195 56.100 0.366 0.000 0.917 385 R CB 3.086 33.506 30.300 0.200 0.000 1.202 385 R HN -0.001 8.348 8.270 0.131 0.000 0.469 386 G N -0.836 108.310 108.800 0.576 0.000 2.597 386 G HA2 0.526 4.719 3.960 0.286 0.000 0.317 386 G HA3 0.526 4.829 3.960 0.521 -0.031 0.317 386 G C -1.981 173.021 174.900 0.170 0.000 1.230 386 G CA -1.047 44.294 45.100 0.402 0.000 0.996 386 G HN 0.619 9.186 8.290 0.638 0.106 0.490 387 T N 1.705 116.252 114.554 -0.011 0.000 2.881 387 T HA 0.694 5.257 4.350 0.071 -0.171 0.290 387 T C -1.431 173.161 174.700 -0.180 0.000 1.000 387 T CA -0.793 61.299 62.100 -0.014 0.000 0.978 387 T CB 3.133 72.026 68.868 0.041 0.000 0.997 387 T HN 0.154 8.692 8.240 -0.047 -0.326 0.443 388 F N 6.027 125.944 119.950 -0.055 0.000 2.410 388 F HA 0.420 5.055 4.527 -0.163 -0.206 0.348 388 F C -0.300 175.491 175.800 -0.014 0.000 1.106 388 F CA 0.046 57.987 58.000 -0.098 0.000 1.163 388 F CB 1.013 39.947 39.000 -0.110 0.000 1.129 388 F HN 0.514 8.962 8.300 0.246 0.000 0.516 389 V N -2.605 117.406 119.914 0.161 0.000 2.588 389 V HA 0.430 4.648 4.120 0.163 0.000 0.304 389 V C -1.968 174.231 176.094 0.175 0.000 1.042 389 V CA -2.252 60.134 62.300 0.144 0.000 0.877 389 V CB 2.951 34.821 31.823 0.078 0.000 0.996 389 V HN 0.649 8.912 8.190 0.122 0.000 0.425 390 Y N 7.172 127.507 120.300 0.058 0.000 2.442 390 Y HA -0.139 4.444 4.550 0.056 0.000 0.330 390 Y C -1.171 174.754 175.900 0.041 0.000 1.129 390 Y CA 0.589 58.718 58.100 0.048 0.000 1.365 390 Y CB 0.661 39.142 38.460 0.034 0.000 1.233 390 Y HN 0.640 9.082 8.280 0.270 0.000 0.529 391 D N 7.824 127.916 120.400 -0.514 0.000 2.467 391 D HA 0.121 4.578 4.640 -0.306 0.000 0.220 391 D C -0.783 175.004 176.300 -0.854 0.000 1.103 391 D CA -2.101 51.611 54.000 -0.480 0.000 0.886 391 D CB 0.862 41.520 40.800 -0.236 0.000 1.025 391 D HN 0.012 8.094 8.370 -0.479 0.000 0.514 392 A N 6.617 129.041 122.820 -0.659 0.000 2.019 392 A HA -0.252 3.684 4.320 -0.641 0.000 0.219 392 A C 0.811 178.275 177.584 -0.200 0.000 1.164 392 A CA 2.480 54.271 52.037 -0.409 0.000 0.644 392 A CB -0.355 18.644 19.000 -0.003 0.000 0.805 392 A HN 0.566 8.471 8.150 -0.409 0.000 0.449 393 A N -0.100 122.622 122.820 -0.163 0.000 1.877 393 A HA -0.216 4.070 4.320 -0.057 0.000 0.216 393 A C 1.242 178.776 177.584 -0.084 0.000 1.186 393 A CA 2.579 54.563 52.037 -0.088 0.000 0.620 393 A CB -0.057 18.903 19.000 -0.066 0.000 0.822 393 A HN -0.159 8.051 8.150 -0.183 -0.170 0.443 394 T N -4.725 109.759 114.554 -0.117 0.000 3.086 394 T HA -0.067 4.254 4.350 -0.050 0.000 0.250 394 T C 0.633 175.290 174.700 -0.072 0.000 1.074 394 T CA -0.630 61.425 62.100 -0.076 0.000 0.988 394 T CB 0.943 69.776 68.868 -0.058 0.000 0.988 394 T HN -0.803 7.535 8.240 -0.156 -0.191 0.530 395 D N 1.163 121.478 120.400 -0.141 0.000 2.699 395 D HA -0.434 4.196 4.640 -0.084 -0.040 0.239 395 D C -1.941 174.390 176.300 0.051 0.000 1.136 395 D CA 1.681 55.666 54.000 -0.025 0.000 0.668 395 D CB -0.541 40.319 40.800 0.101 0.000 1.060 395 D HN -0.253 7.817 8.370 -0.228 0.164 0.429 396 R N -4.278 116.179 120.500 -0.071 0.000 2.771 396 R HA 0.595 5.140 4.340 0.132 -0.126 0.274 396 R C -1.966 174.386 176.300 0.088 0.000 0.987 396 R CA -2.283 53.853 56.100 0.061 0.000 0.908 396 R CB 4.270 34.599 30.300 0.048 0.000 1.213 396 R HN -0.773 7.350 8.270 -0.245 0.000 0.468 397 A N 3.348 126.293 122.820 0.209 0.000 2.260 397 A HA 0.757 5.577 4.320 0.245 -0.353 0.312 397 A C -1.429 176.329 177.584 0.289 0.000 1.321 397 A CA -1.412 50.775 52.037 0.249 0.000 0.928 397 A CB 0.789 19.916 19.000 0.211 0.000 1.158 397 A HN 0.525 9.117 8.150 0.201 -0.321 0.542 398 K N 4.340 124.855 120.400 0.192 0.000 2.205 398 K HA 0.183 4.653 4.320 0.249 0.000 0.279 398 K C -1.469 175.070 176.600 -0.103 0.000 1.027 398 K CA -0.798 55.565 56.287 0.127 0.000 0.932 398 K CB 2.077 34.619 32.500 0.071 0.000 1.032 398 K HN 0.463 8.705 8.250 0.165 0.107 0.466 399 L N 4.513 125.440 121.223 -0.493 0.000 2.260 399 L HA 0.084 3.915 4.340 -1.059 -0.127 0.289 399 L C -0.988 175.622 176.870 -0.435 0.000 1.057 399 L CA -0.630 53.645 54.840 -0.941 0.000 0.811 399 L CB 0.744 41.720 42.059 -1.804 0.000 1.184 399 L HN 0.290 8.241 8.230 -0.466 0.000 0.429 400 N N 5.674 124.193 118.700 -0.303 0.000 2.663 400 N HA 0.092 4.784 4.740 -0.079 0.000 0.250 400 N C -1.918 173.583 175.510 -0.015 0.000 1.129 400 N CA -0.187 52.796 53.050 -0.111 0.000 0.995 400 N CB 0.004 38.448 38.487 -0.071 0.000 1.324 400 N HN 0.278 8.442 8.380 -0.361 0.000 0.512 401 W N 5.819 127.001 121.300 -0.197 0.000 2.998 401 W HA 0.666 5.494 4.660 -0.056 -0.202 0.335 401 W C -2.299 174.191 176.519 -0.048 0.000 1.110 401 W CA -1.506 55.780 57.345 -0.099 0.000 1.230 401 W CB 4.412 33.811 29.460 -0.102 0.000 1.405 401 W HN -0.252 7.859 8.180 0.051 0.099 0.493 402 T N 0.378 114.620 114.554 -0.520 0.000 2.885 402 T HA 0.458 4.833 4.350 -0.100 -0.084 0.285 402 T C 0.487 174.944 174.700 -0.405 0.000 1.019 402 T CA -2.059 59.860 62.100 -0.302 0.000 1.010 402 T CB 3.499 72.232 68.868 -0.225 0.000 1.022 402 T HN -0.030 7.988 8.240 -0.842 -0.283 0.466 403 R N 2.906 123.359 120.500 -0.077 0.000 2.127 403 R HA -0.363 4.077 4.340 0.167 0.000 0.238 403 R C 1.706 177.970 176.300 -0.060 0.000 1.134 403 R CA 3.840 59.960 56.100 0.033 0.000 0.975 403 R CB -0.056 30.295 30.300 0.085 0.000 0.865 403 R HN 0.611 9.250 8.270 -0.020 -0.382 0.447 404 D N -2.867 117.456 120.400 -0.128 0.000 2.263 404 D HA -0.228 4.366 4.640 -0.077 0.000 0.208 404 D C 1.759 177.938 176.300 -0.201 0.000 0.971 404 D CA 2.536 56.459 54.000 -0.128 0.000 0.867 404 D CB -1.297 39.431 40.800 -0.120 0.000 0.929 404 D HN 0.368 8.648 8.370 -0.129 0.013 0.492 405 Q N -1.493 118.062 119.800 -0.408 0.000 2.364 405 Q HA -0.186 3.918 4.340 -0.393 0.000 0.207 405 Q C 1.004 176.854 176.000 -0.250 0.000 0.970 405 Q CA 2.115 57.583 55.803 -0.558 0.000 0.888 405 Q CB -0.035 27.895 28.738 -1.347 0.000 0.951 405 Q HN -0.382 7.410 8.270 -0.499 0.178 0.469 406 N N -2.106 116.592 118.700 -0.002 0.000 2.336 406 N HA -0.046 4.853 4.740 0.265 0.000 0.189 406 N C 0.326 175.870 175.510 0.057 0.000 1.113 406 N CA 0.217 53.379 53.050 0.185 0.000 0.858 406 N CB 0.350 39.013 38.487 0.294 0.000 0.970 406 N HN -0.534 7.571 8.380 -0.045 0.249 0.471 407 A N 1.320 124.134 122.820 -0.011 0.000 1.908 407 A HA -0.068 4.232 4.320 -0.035 0.000 0.218 407 A C -1.457 176.104 177.584 -0.039 0.000 1.181 407 A CA 4.788 56.805 52.037 -0.034 0.000 0.627 407 A CB -2.371 16.599 19.000 -0.049 0.000 0.818 407 A HN -0.238 7.718 8.150 -0.040 0.169 0.445 408 P HA -0.183 4.211 4.420 -0.044 0.000 0.218 408 P C 1.057 178.343 177.300 -0.023 0.000 1.149 408 P CA 2.817 65.900 63.100 -0.028 0.000 0.817 408 P CB -0.627 31.063 31.700 -0.016 0.000 0.785 409 A N -1.846 120.981 122.820 0.011 0.000 1.858 409 A HA -0.230 4.103 4.320 0.023 0.000 0.216 409 A C 2.090 179.664 177.584 -0.017 0.000 1.190 409 A CA 3.003 55.054 52.037 0.023 0.000 0.617 409 A CB -0.817 18.223 19.000 0.066 0.000 0.827 409 A HN -0.780 7.390 8.150 0.034 0.000 0.443 410 V N -1.155 118.726 119.914 -0.055 0.000 2.332 410 V HA -0.551 3.445 4.120 -0.207 0.000 0.248 410 V C 1.999 177.909 176.094 -0.308 0.000 1.055 410 V CA 4.265 66.439 62.300 -0.211 0.000 1.038 410 V CB -0.877 30.820 31.823 -0.210 0.000 0.651 410 V HN -0.101 8.074 8.190 -0.024 0.000 0.450 411 N N -0.200 118.391 118.700 -0.182 0.000 2.120 411 N HA -0.296 4.322 4.740 -0.203 0.000 0.188 411 N C 2.198 177.635 175.510 -0.122 0.000 1.024 411 N CA 3.187 56.141 53.050 -0.160 0.000 0.852 411 N CB -0.752 37.675 38.487 -0.100 0.000 1.003 411 N HN -0.112 8.175 8.380 -0.130 0.014 0.424 412 A N -0.198 122.571 122.820 -0.085 0.000 1.873 412 A HA -0.159 4.119 4.320 -0.069 0.000 0.215 412 A C 1.761 179.340 177.584 -0.007 0.000 1.186 412 A CA 3.005 55.007 52.037 -0.058 0.000 0.616 412 A CB -0.763 18.199 19.000 -0.064 0.000 0.823 412 A HN -0.371 7.731 8.150 -0.079 0.000 0.442 413 A N -1.130 121.715 122.820 0.043 0.000 1.877 413 A HA -0.441 4.048 4.320 0.283 0.000 0.216 413 A C 1.471 179.245 177.584 0.316 0.000 1.186 413 A CA 3.291 55.475 52.037 0.244 0.000 0.620 413 A CB -0.758 18.444 19.000 0.336 0.000 0.822 413 A HN -0.186 7.969 8.150 0.009 0.000 0.443 414 K N -0.554 119.818 120.400 -0.046 0.000 2.097 414 K HA -0.265 4.316 4.320 0.435 0.000 0.206 414 K C 1.992 178.696 176.600 0.172 0.000 1.049 414 K CA 3.001 59.319 56.287 0.050 0.000 0.933 414 K CB 0.088 32.346 32.500 -0.403 0.000 0.717 414 K HN 0.134 8.218 8.250 -0.276 0.000 0.442 415 A N -1.122 121.724 122.820 0.044 0.000 1.933 415 A HA -0.242 4.108 4.320 0.050 0.000 0.218 415 A C 2.026 179.616 177.584 0.010 0.000 1.175 415 A CA 2.934 54.988 52.037 0.028 0.000 0.628 415 A CB -0.637 18.349 19.000 -0.024 0.000 0.814 415 A HN -0.341 7.803 8.150 -0.010 0.000 0.444 416 L N -1.593 119.605 121.223 -0.041 0.000 2.027 416 L HA -0.299 3.926 4.340 -0.191 0.000 0.206 416 L C 1.793 178.498 176.870 -0.276 0.000 1.074 416 L CA 3.185 57.895 54.840 -0.216 0.000 0.745 416 L CB 0.007 41.839 42.059 -0.379 0.000 0.898 416 L HN -0.673 7.550 8.230 -0.013 0.000 0.433 417 F N -2.637 117.377 119.950 0.106 0.000 2.456 417 F HA -0.276 4.233 4.527 -0.029 0.000 0.298 417 F C 1.935 177.786 175.800 0.086 0.000 1.104 417 F CA 3.808 61.866 58.000 0.097 0.000 1.435 417 F CB -0.522 38.642 39.000 0.272 0.000 1.078 417 F HN -0.314 8.107 8.300 0.202 0.000 0.546 418 D N -0.634 119.936 120.400 0.283 0.000 2.178 418 D HA -0.276 4.445 4.640 0.136 0.000 0.202 418 D C 2.282 178.612 176.300 0.050 0.000 0.974 418 D CA 3.744 57.843 54.000 0.166 0.000 0.841 418 D CB -0.670 40.242 40.800 0.186 0.000 0.953 418 D HN 0.248 8.790 8.370 0.321 0.021 0.478 419 R N -0.626 119.880 120.500 0.010 0.000 2.081 419 R HA -0.247 4.087 4.340 -0.010 0.000 0.235 419 R C 2.528 178.808 176.300 -0.033 0.000 1.131 419 R CA 3.155 59.240 56.100 -0.025 0.000 0.960 419 R CB -0.133 30.129 30.300 -0.062 0.000 0.856 419 R HN -0.819 7.443 8.270 0.007 0.012 0.436 420 I N -0.380 120.158 120.570 -0.053 0.000 2.226 420 I HA -0.493 3.657 4.170 -0.034 0.000 0.245 420 I C 1.550 177.654 176.117 -0.021 0.000 1.100 420 I CA 3.952 65.230 61.300 -0.036 0.000 1.374 420 I CB -0.316 37.659 38.000 -0.040 0.000 1.057 420 I HN -0.692 7.474 8.210 -0.074 0.000 0.413 421 N N -0.158 118.513 118.700 -0.047 0.000 2.120 421 N HA -0.251 4.432 4.740 -0.096 0.000 0.188 421 N C 2.091 177.585 175.510 -0.026 0.000 1.024 421 N CA 2.548 55.545 53.050 -0.087 0.000 0.852 421 N CB -0.273 38.092 38.487 -0.203 0.000 1.003 421 N HN -0.093 8.262 8.380 -0.041 0.000 0.424 422 K N 0.387 120.784 120.400 -0.005 0.000 2.097 422 K HA -0.318 4.016 4.320 0.022 0.000 0.205 422 K C 2.483 179.100 176.600 0.028 0.000 1.050 422 K CA 3.135 59.432 56.287 0.017 0.000 0.938 422 K CB -0.045 32.467 32.500 0.019 0.000 0.718 422 K HN -0.129 8.116 8.250 -0.008 0.000 0.442 423 A N -2.502 120.331 122.820 0.023 0.000 2.067 423 A HA -0.079 4.262 4.320 0.035 0.000 0.217 423 A C 0.922 178.548 177.584 0.070 0.000 1.156 423 A CA 2.264 54.322 52.037 0.036 0.000 0.683 423 A CB -0.071 18.941 19.000 0.020 0.000 0.808 423 A HN -0.379 7.777 8.150 0.011 0.000 0.455 424 N N -3.772 114.976 118.700 0.081 0.000 2.197 424 N HA 0.026 4.887 4.740 0.202 0.000 0.201 424 N C 0.636 176.284 175.510 0.229 0.000 1.148 424 N CA 0.219 53.366 53.050 0.162 0.000 0.883 424 N CB 1.768 40.314 38.487 0.098 0.000 1.012 424 N HN -0.705 7.624 8.380 0.051 0.082 0.507 425 G N 1.216 110.096 108.800 0.134 0.000 2.198 425 G HA2 -0.393 3.629 3.960 0.103 0.000 0.260 425 G HA3 -0.393 3.696 3.960 0.215 0.000 0.260 425 G C -0.728 174.239 174.900 0.111 0.000 1.025 425 G CA 0.944 46.135 45.100 0.152 0.000 0.769 425 G HN -0.115 8.230 8.290 0.090 0.000 0.507 426 T N -1.749 112.782 114.554 -0.037 0.000 2.948 426 T HA 0.246 4.506 4.350 -0.150 0.000 0.285 426 T C -1.561 173.063 174.700 -0.128 0.000 1.019 426 T CA -1.850 60.157 62.100 -0.156 0.000 1.013 426 T CB 3.038 71.731 68.868 -0.293 0.000 1.117 426 T HN -0.686 7.531 8.240 -0.039 0.000 0.533 427 I N -6.342 114.153 120.570 -0.125 0.000 2.957 427 I HA 0.493 4.571 4.170 -0.153 0.000 0.310 427 I C -1.753 174.265 176.117 -0.164 0.000 1.063 427 I CA -2.509 58.733 61.300 -0.097 0.000 1.033 427 I CB 3.134 41.179 38.000 0.075 0.000 1.230 427 I HN 0.041 8.177 8.210 -0.124 0.000 0.447 428 Y N -0.549 119.725 120.300 -0.043 0.000 2.357 428 Y HA -0.042 4.506 4.550 -0.217 -0.128 0.340 428 Y C 0.881 176.617 175.900 -0.273 0.000 1.260 428 Y CA 1.344 59.277 58.100 -0.278 0.000 1.425 428 Y CB 0.670 38.745 38.460 -0.643 0.000 1.326 428 Y HN 0.096 8.323 8.280 -0.088 0.000 0.580 429 R N -0.529 119.908 120.500 -0.106 0.000 2.490 429 R HA 0.079 4.433 4.340 0.024 0.000 0.280 429 R C -0.270 175.834 176.300 -0.327 0.000 1.077 429 R CA -0.779 55.258 56.100 -0.107 0.000 1.065 429 R CB 0.617 30.869 30.300 -0.080 0.000 1.003 429 R HN -0.096 8.133 8.270 -0.068 0.000 0.470 430 Y N -1.089 119.209 120.300 -0.002 0.000 2.500 430 Y HA 0.093 4.645 4.550 0.003 0.000 0.246 430 Y C -0.618 175.262 175.900 -0.034 0.000 1.146 430 Y CA 1.053 59.153 58.100 -0.000 0.000 1.230 430 Y CB 1.390 39.872 38.460 0.037 0.000 1.214 430 Y HN 0.444 8.837 8.280 0.188 0.000 0.526 431 D N -1.453 118.958 120.400 0.019 0.000 2.479 431 D HA 0.204 4.849 4.640 0.008 0.000 0.218 431 D C 0.698 176.900 176.300 -0.163 0.000 1.177 431 D CA -0.444 53.536 54.000 -0.034 0.000 0.830 431 D CB -1.106 39.680 40.800 -0.023 0.000 1.014 431 D HN -0.076 8.284 8.370 -0.016 0.000 0.503 432 L N -1.373 119.634 121.223 -0.360 0.000 2.418 432 L HA -0.044 4.086 4.340 -0.351 0.000 0.218 432 L C -0.333 176.208 176.870 -0.550 0.000 1.125 432 L CA 1.757 56.261 54.840 -0.559 0.000 0.835 432 L CB -0.004 41.509 42.059 -0.910 0.000 0.953 432 L HN -0.333 7.660 8.230 -0.394 0.000 0.454 433 F N -4.652 115.280 119.950 -0.030 0.000 2.735 433 F HA 0.025 4.515 4.527 -0.062 0.000 0.304 433 F C -0.591 175.155 175.800 -0.089 0.000 1.119 433 F CA -0.761 57.206 58.000 -0.055 0.000 1.280 433 F CB 0.272 39.250 39.000 -0.037 0.000 0.994 433 F HN -0.374 7.741 8.300 -0.234 0.045 0.520 434 G N -1.894 106.897 108.800 -0.015 0.000 2.357 434 G HA2 -0.196 3.662 3.960 -0.170 0.000 0.643 434 G HA3 -0.196 3.748 3.960 -0.027 0.000 0.643 434 G C -0.702 174.188 174.900 -0.016 0.000 1.358 434 G CA -0.930 44.132 45.100 -0.064 0.000 0.986 434 G HN -0.866 7.394 8.290 -0.051 0.000 0.620 435 T N -2.160 112.380 114.554 -0.023 0.000 2.708 435 T HA -0.300 4.052 4.350 0.003 0.000 0.266 435 T C 0.692 175.408 174.700 0.026 0.000 1.037 435 T CA 2.042 64.144 62.100 0.002 0.000 1.146 435 T CB -0.049 68.819 68.868 0.000 0.000 0.865 435 T HN 0.113 8.326 8.240 -0.046 0.000 0.435 436 Q N -0.672 119.150 119.800 0.035 0.000 2.315 436 Q HA -0.090 4.276 4.340 0.044 0.000 0.289 436 Q C -0.267 175.786 176.000 0.088 0.000 1.044 436 Q CA -0.436 55.400 55.803 0.055 0.000 0.920 436 Q CB -0.079 28.695 28.738 0.060 0.000 1.214 436 Q HN -0.028 8.259 8.270 0.028 0.000 0.392 437 L N 1.732 123.010 121.223 0.092 0.000 2.780 437 L HA -0.269 4.338 4.340 0.191 -0.153 0.275 437 L C 0.516 177.525 176.870 0.231 0.000 1.153 437 L CA 0.735 55.667 54.840 0.153 0.000 0.993 437 L CB -0.944 41.149 42.059 0.056 0.000 1.319 437 L HN 0.146 8.413 8.230 0.062 0.000 0.479 438 K N 6.882 127.454 120.400 0.287 0.000 2.652 438 K HA 0.181 4.672 4.320 0.283 0.000 0.249 438 K C -1.212 175.528 176.600 0.234 0.000 0.986 438 K CA -0.615 55.837 56.287 0.275 0.000 0.867 438 K CB 2.510 35.152 32.500 0.236 0.000 1.201 438 K HN 0.105 8.523 8.250 0.281 0.000 0.450 439 A N 3.699 126.566 122.820 0.078 0.000 2.081 439 A HA 0.135 4.376 4.320 -0.385 -0.152 0.214 439 A C -1.078 176.195 177.584 -0.517 0.000 1.158 439 A CA 0.846 52.639 52.037 -0.406 0.000 0.724 439 A CB 0.755 19.183 19.000 -0.953 0.000 0.826 439 A HN 0.379 8.647 8.150 0.198 0.000 0.463 440 F N -2.588 117.363 119.950 0.002 0.000 2.460 440 F HA 0.530 5.392 4.527 -0.045 -0.362 0.341 440 F C -1.003 174.706 175.800 -0.152 0.000 1.130 440 F CA -1.953 56.013 58.000 -0.057 0.000 0.962 440 F CB 2.796 41.755 39.000 -0.068 0.000 1.171 440 F HN -0.580 7.849 8.300 0.216 0.000 0.436 441 A N 5.071 127.670 122.820 -0.368 0.000 2.354 441 A HA 0.121 4.234 4.320 -0.346 0.000 0.281 441 A C -0.979 176.641 177.584 0.060 0.000 1.174 441 A CA -0.286 51.487 52.037 -0.440 0.000 0.828 441 A CB 0.598 18.860 19.000 -1.230 0.000 1.099 441 A HN 0.569 8.422 8.150 -0.494 0.000 0.516 442 D N 0.718 121.184 120.400 0.110 0.000 2.563 442 D HA 0.115 4.829 4.640 0.124 0.000 0.237 442 D C -1.216 175.184 176.300 0.167 0.000 1.282 442 D CA -1.297 52.787 54.000 0.141 0.000 0.816 442 D CB 1.389 42.267 40.800 0.131 0.000 1.066 442 D HN 0.286 8.701 8.370 0.075 0.000 0.501 443 D N -4.466 116.055 120.400 0.202 0.000 2.692 443 D HA 0.083 4.854 4.640 0.219 0.000 0.290 443 D C -1.840 174.617 176.300 0.262 0.000 1.455 443 D CA -0.661 53.468 54.000 0.215 0.000 0.796 443 D CB -0.863 40.058 40.800 0.202 0.000 1.131 443 D HN -0.417 8.103 8.370 0.250 0.000 0.467 444 F N -2.150 117.845 119.950 0.074 0.000 2.611 444 F HA 1.101 5.970 4.527 0.230 -0.204 0.324 444 F C -2.245 173.605 175.800 0.083 0.000 1.061 444 F CA -2.361 55.720 58.000 0.134 0.000 0.954 444 F CB 3.267 42.312 39.000 0.075 0.000 1.301 444 F HN -0.799 7.601 8.300 0.166 0.000 0.482 445 C N 1.492 120.777 119.300 -0.025 0.000 2.752 445 C HA 0.297 4.393 4.460 -0.607 0.000 0.360 445 C C -1.703 173.517 174.990 0.383 0.000 1.081 445 C CA -0.914 58.020 59.018 -0.139 0.000 1.272 445 C CB 2.603 30.375 27.740 0.053 0.000 1.754 445 C HN 0.136 8.627 8.230 0.435 0.000 0.483 446 Y N 3.690 124.101 120.300 0.186 0.000 2.497 446 Y HA 0.213 4.943 4.550 0.299 0.000 0.265 446 Y C 0.397 176.383 175.900 0.144 0.000 1.111 446 Y CA -1.217 57.017 58.100 0.224 0.000 1.288 446 Y CB 0.889 39.471 38.460 0.204 0.000 1.082 446 Y HN -0.015 8.560 8.280 0.110 -0.229 0.536 447 Q N -1.564 118.361 119.800 0.209 0.000 2.831 447 Q HA 0.450 4.866 4.340 0.127 0.000 0.366 447 Q C -2.633 173.372 176.000 0.009 0.000 0.899 447 Q CA -3.057 52.802 55.803 0.094 0.000 0.987 447 Q CB 0.863 29.618 28.738 0.028 0.000 1.382 447 Q HN -0.736 7.754 8.270 0.144 -0.133 0.403 448 P HA -0.032 4.321 4.420 -0.111 0.000 0.271 448 P C -2.119 175.172 177.300 -0.015 0.000 1.216 448 P CA -0.448 62.721 63.100 0.114 0.000 0.771 448 P CB 0.763 32.780 31.700 0.529 0.000 0.864 449 L N 1.050 122.089 121.223 -0.306 0.000 2.436 449 L HA 0.353 4.806 4.340 -0.046 -0.141 0.268 449 L C -0.700 176.058 176.870 -0.188 0.000 0.974 449 L CA -0.859 53.870 54.840 -0.186 0.000 0.826 449 L CB 3.513 45.452 42.059 -0.199 0.000 1.291 449 L HN -0.046 7.754 8.230 -0.717 0.000 0.406 450 G N 1.445 110.269 108.800 0.040 0.000 2.566 450 G HA2 -0.321 4.138 3.960 0.086 0.000 0.599 450 G HA3 -0.321 3.874 3.960 0.091 -0.180 0.599 450 G C -0.845 174.257 174.900 0.336 0.000 1.292 450 G CA -0.209 44.969 45.100 0.129 0.000 0.922 450 G HN 0.404 8.730 8.290 0.060 0.000 0.514 451 G N -3.528 105.462 108.800 0.317 0.000 2.339 451 G HA2 -0.392 3.884 3.960 0.398 0.000 0.209 451 G HA3 -0.392 3.750 3.960 0.304 0.000 0.209 451 G C -1.360 173.624 174.900 0.141 0.000 1.015 451 G CA 0.723 46.007 45.100 0.307 0.000 0.635 451 G HN -0.227 8.217 8.290 0.256 0.000 0.499 452 C N 1.439 120.793 119.300 0.091 0.000 3.359 452 C HA 0.359 4.847 4.460 0.046 0.000 0.194 452 C C -1.008 174.005 174.990 0.038 0.000 1.659 452 C CA -0.725 58.322 59.018 0.047 0.000 1.338 452 C CB -0.632 27.119 27.740 0.018 0.000 2.109 452 C HN -0.171 8.050 8.230 0.102 0.071 0.518 453 V N 2.201 122.141 119.914 0.043 0.000 2.655 453 V HA -0.156 4.130 4.120 0.013 -0.158 0.300 453 V C -0.022 176.071 176.094 -0.002 0.000 1.044 453 V CA 0.352 62.663 62.300 0.018 0.000 1.095 453 V CB 0.351 32.184 31.823 0.018 0.000 0.952 453 V HN 0.092 8.316 8.190 0.057 0.000 0.485 454 L N 7.269 128.478 121.223 -0.024 0.000 2.584 454 L HA -0.271 4.053 4.340 -0.026 0.000 0.272 454 L C 0.476 177.318 176.870 -0.048 0.000 1.195 454 L CA 1.452 56.267 54.840 -0.041 0.000 0.920 454 L CB -0.327 41.688 42.059 -0.075 0.000 1.173 454 L HN 0.024 8.132 8.230 -0.028 0.105 0.489 455 G N 4.684 113.465 108.800 -0.032 0.000 2.195 455 G HA2 -0.284 3.701 3.960 -0.021 0.000 0.246 455 G HA3 -0.284 3.651 3.960 -0.042 0.000 0.246 455 G C -0.365 174.529 174.900 -0.009 0.000 0.984 455 G CA 0.653 45.737 45.100 -0.027 0.000 0.633 455 G HN -0.003 8.275 8.290 -0.020 0.000 0.525 456 K N -0.845 119.554 120.400 -0.002 0.000 2.418 456 K HA 0.227 4.552 4.320 0.009 0.000 0.208 456 K C -0.269 176.342 176.600 0.020 0.000 1.261 456 K CA 0.359 56.652 56.287 0.010 0.000 0.874 456 K CB 1.676 34.183 32.500 0.012 0.000 1.451 456 K HN -0.155 8.020 8.250 -0.003 0.073 0.466 457 A N -2.337 120.497 122.820 0.024 0.000 2.132 457 A HA 0.163 4.674 4.320 0.031 -0.172 0.213 457 A C -0.773 176.827 177.584 0.027 0.000 1.154 457 A CA 1.101 53.155 52.037 0.029 0.000 0.753 457 A CB 1.663 20.682 19.000 0.031 0.000 0.826 457 A HN -0.236 7.928 8.150 0.022 0.000 0.469 458 T N -6.171 108.397 114.554 0.024 0.000 2.864 458 T HA 0.699 5.193 4.350 0.037 -0.122 0.289 458 T C -1.585 173.135 174.700 0.034 0.000 1.082 458 T CA -2.656 59.464 62.100 0.032 0.000 1.009 458 T CB 3.085 71.974 68.868 0.036 0.000 1.234 458 T HN -0.806 7.332 8.240 0.019 0.114 0.526 459 D N -1.226 119.208 120.400 0.057 0.000 2.398 459 D HA -0.090 4.577 4.640 0.045 0.000 0.264 459 D C 0.746 177.063 176.300 0.029 0.000 1.263 459 D CA -0.946 53.094 54.000 0.066 0.000 1.037 459 D CB 0.347 41.218 40.800 0.118 0.000 1.101 459 D HN -0.010 8.403 8.370 0.072 0.000 0.551 460 D N -3.497 116.900 120.400 -0.005 0.000 2.363 460 D HA -0.114 4.419 4.640 -0.178 0.000 0.226 460 D C -0.442 175.563 176.300 -0.493 0.000 1.020 460 D CA 2.048 55.915 54.000 -0.223 0.000 0.892 460 D CB -0.639 39.989 40.800 -0.288 0.000 0.900 460 D HN 0.392 8.796 8.370 0.057 0.000 0.531 461 Y N -2.768 117.543 120.300 0.018 0.000 2.675 461 Y HA 0.251 4.994 4.550 -0.016 -0.202 0.248 461 Y C 0.176 176.095 175.900 0.033 0.000 1.161 461 Y CA -1.527 56.577 58.100 0.007 0.000 1.203 461 Y CB 1.173 39.635 38.460 0.003 0.000 1.262 461 Y HN -0.344 8.260 8.280 0.142 -0.239 0.544 462 G N -1.032 107.844 108.800 0.126 0.000 2.159 462 G HA2 -0.432 3.574 3.960 0.076 0.000 0.256 462 G HA3 -0.432 3.732 3.960 0.126 -0.129 0.256 462 G C -0.598 174.405 174.900 0.171 0.000 0.977 462 G CA -0.009 45.164 45.100 0.123 0.000 0.652 462 G HN -0.544 7.825 8.290 0.078 -0.032 0.531 463 R N 0.610 121.234 120.500 0.207 0.000 2.370 463 R HA 0.028 4.603 4.340 0.172 -0.132 0.309 463 R C 0.273 176.602 176.300 0.048 0.000 1.059 463 R CA 0.023 56.218 56.100 0.159 0.000 0.981 463 R CB 0.272 30.683 30.300 0.185 0.000 0.972 463 R HN -0.450 8.179 8.270 0.217 -0.229 0.437 464 V N 5.723 125.620 119.914 -0.028 0.000 2.529 464 V HA -0.247 3.881 4.120 0.013 0.000 0.292 464 V C -0.588 175.538 176.094 0.053 0.000 1.028 464 V CA 1.323 63.623 62.300 0.001 0.000 1.074 464 V CB 0.319 32.113 31.823 -0.049 0.000 0.958 464 V HN 0.087 8.211 8.190 -0.110 0.000 0.481 465 A N 7.216 130.069 122.820 0.055 0.000 2.511 465 A HA -0.149 4.188 4.320 0.029 0.000 0.242 465 A C 0.465 178.078 177.584 0.050 0.000 1.069 465 A CA 1.604 53.666 52.037 0.042 0.000 0.763 465 A CB 0.007 19.024 19.000 0.029 0.000 1.001 465 A HN -0.019 8.159 8.150 0.047 0.000 0.498 466 G N 1.776 110.545 108.800 -0.051 0.000 2.213 466 G HA2 -0.232 3.581 3.960 -0.245 0.000 0.236 466 G HA3 -0.232 3.731 3.960 -0.268 -0.164 0.236 466 G C -0.924 173.631 174.900 -0.575 0.000 0.991 466 G CA 0.312 45.256 45.100 -0.260 0.000 0.629 466 G HN 0.355 8.618 8.290 -0.045 0.000 0.517 467 Y N -0.972 119.320 120.300 -0.013 0.000 2.553 467 Y HA 0.133 4.701 4.550 0.030 0.000 0.347 467 Y C -1.143 174.744 175.900 -0.021 0.000 1.019 467 Y CA -0.997 57.108 58.100 0.007 0.000 1.032 467 Y CB 3.639 42.112 38.460 0.022 0.000 1.284 467 Y HN -0.776 7.465 8.280 0.038 0.062 0.466 468 K N 1.727 122.227 120.400 0.167 0.000 2.138 468 K HA 0.205 4.544 4.320 0.032 0.000 0.263 468 K C -0.868 175.783 176.600 0.084 0.000 0.965 468 K CA -0.900 55.437 56.287 0.082 0.000 0.868 468 K CB 2.282 34.825 32.500 0.073 0.000 1.083 468 K HN 0.523 8.907 8.250 0.224 0.000 0.443 469 N N -2.109 116.532 118.700 -0.099 0.000 2.776 469 N HA -0.438 4.230 4.740 -0.120 0.000 0.250 469 N C -2.379 172.745 175.510 -0.643 0.000 1.112 469 N CA 0.474 53.430 53.050 -0.157 0.000 0.733 469 N CB -0.266 38.349 38.487 0.212 0.000 1.097 469 N HN 0.633 8.952 8.380 -0.103 0.000 0.558 470 L N -2.185 118.406 121.223 -1.053 0.000 2.376 470 L HA 0.705 4.615 4.340 -0.978 -0.156 0.275 470 L C -2.248 174.013 176.870 -1.015 0.000 0.987 470 L CA -0.607 53.645 54.840 -0.979 0.000 0.828 470 L CB 2.937 44.586 42.059 -0.683 0.000 1.249 470 L HN -0.683 6.921 8.230 -0.922 0.073 0.409 471 Y N 3.894 123.968 120.300 -0.378 0.000 2.477 471 Y HA 0.654 5.265 4.550 -0.186 -0.173 0.347 471 Y C -1.403 174.404 175.900 -0.155 0.000 0.981 471 Y CA -2.448 55.480 58.100 -0.286 0.000 1.033 471 Y CB 4.153 42.299 38.460 -0.524 0.000 1.245 471 Y HN 0.621 8.549 8.280 -0.585 0.000 0.455 472 V N 1.502 121.468 119.914 0.086 0.000 2.555 472 V HA 0.472 4.765 4.120 0.060 -0.137 0.302 472 V C -0.147 176.008 176.094 0.101 0.000 1.038 472 V CA -1.207 61.133 62.300 0.066 0.000 0.887 472 V CB 2.554 34.389 31.823 0.020 0.000 0.991 472 V HN 0.560 8.813 8.190 0.105 0.000 0.434 473 T N -1.178 113.433 114.554 0.095 0.000 3.058 473 T HA 0.240 4.640 4.350 0.084 0.000 0.278 473 T C -0.716 174.010 174.700 0.044 0.000 0.974 473 T CA -1.085 61.066 62.100 0.085 0.000 0.893 473 T CB 1.431 70.367 68.868 0.113 0.000 1.138 473 T HN 0.300 8.588 8.240 0.080 0.000 0.529 474 D N 0.810 121.236 120.400 0.042 0.000 2.723 474 D HA 0.136 4.804 4.640 0.047 0.000 0.247 474 D C 0.864 177.190 176.300 0.043 0.000 1.134 474 D CA -1.232 52.795 54.000 0.045 0.000 1.099 474 D CB 0.901 41.730 40.800 0.050 0.000 1.287 474 D HN -0.817 7.579 8.370 0.043 0.000 0.634 475 G N -1.983 106.852 108.800 0.057 0.000 2.501 475 G HA2 -0.293 3.688 3.960 0.035 0.000 0.220 475 G HA3 -0.293 3.706 3.960 0.064 0.000 0.220 475 G C 1.139 176.071 174.900 0.054 0.000 1.114 475 G CA 2.213 47.344 45.100 0.051 0.000 0.757 475 G HN 0.420 8.753 8.290 0.070 0.000 0.559 476 S N 2.962 118.699 115.700 0.061 0.000 2.419 476 S HA -0.299 4.362 4.470 0.113 -0.123 0.233 476 S C 1.459 176.089 174.600 0.049 0.000 1.016 476 S CA 3.669 61.911 58.200 0.071 0.000 0.974 476 S CB -0.322 62.903 63.200 0.043 0.000 0.786 476 S HN -0.353 8.228 8.310 0.055 -0.239 0.492 477 L N -0.459 120.779 121.223 0.026 0.000 2.201 477 L HA -0.111 4.649 4.340 0.009 -0.414 0.212 477 L C 0.174 177.035 176.870 -0.015 0.000 1.105 477 L CA 1.539 56.383 54.840 0.006 0.000 0.775 477 L CB -0.055 42.003 42.059 -0.002 0.000 0.913 477 L HN -0.566 7.630 8.230 0.027 0.050 0.440 478 I N -2.756 117.804 120.570 -0.017 0.000 2.496 478 I HA 0.135 4.265 4.170 -0.066 0.000 0.285 478 I C -1.609 174.474 176.117 -0.056 0.000 1.080 478 I CA -3.555 57.717 61.300 -0.047 0.000 1.404 478 I CB -1.335 36.641 38.000 -0.040 0.000 1.403 478 I HN -0.784 7.328 8.210 -0.002 0.097 0.539 479 P HA 0.124 4.522 4.420 -0.037 0.000 0.230 479 P C 0.045 177.304 177.300 -0.069 0.000 1.791 479 P CA -0.424 62.638 63.100 -0.064 0.000 1.020 479 P CB -1.604 30.046 31.700 -0.083 0.000 1.977 480 G N -0.266 108.469 108.800 -0.107 0.000 2.245 480 G HA2 -0.519 3.433 3.960 -0.309 0.000 0.264 480 G HA3 -0.519 3.353 3.960 -0.148 0.000 0.264 480 G C -1.805 173.005 174.900 -0.149 0.000 0.985 480 G CA 1.013 46.002 45.100 -0.185 0.000 0.625 480 G HN 0.227 8.288 8.290 -0.108 0.164 0.536 481 S N -2.035 113.633 115.700 -0.054 0.000 2.543 481 S HA 0.460 5.112 4.470 0.006 -0.179 0.273 481 S C -1.282 173.376 174.600 0.098 0.000 1.152 481 S CA -0.876 57.356 58.200 0.053 0.000 0.910 481 S CB 2.079 65.403 63.200 0.207 0.000 1.105 481 S HN -0.743 7.447 8.310 -0.058 0.086 0.465 482 V N 6.348 126.316 119.914 0.092 0.000 3.392 482 V HA 0.251 4.482 4.120 0.186 0.000 0.294 482 V C -0.750 175.326 176.094 -0.029 0.000 1.561 482 V CA -1.541 60.822 62.300 0.105 0.000 1.056 482 V CB 1.777 33.613 31.823 0.021 0.000 0.882 482 V HN 0.779 9.304 8.190 0.028 -0.319 0.440 483 G N 0.120 108.727 108.800 -0.321 0.000 2.189 483 G HA2 -0.264 2.761 3.960 -1.558 0.000 0.267 483 G HA3 -0.264 2.584 3.960 -1.852 0.000 0.267 483 G C -1.570 172.785 174.900 -0.909 0.000 0.975 483 G CA 1.143 45.495 45.100 -1.246 0.000 0.644 483 G HN -0.536 7.822 8.290 -0.164 -0.167 0.537 484 V N -8.435 111.150 119.914 -0.549 0.000 3.226 484 V HA 0.194 3.814 4.120 -0.833 0.000 0.304 484 V C -2.015 173.837 176.094 -0.405 0.000 1.336 484 V CA -3.119 58.812 62.300 -0.616 0.000 1.066 484 V CB 1.968 33.446 31.823 -0.575 0.000 1.087 484 V HN -0.880 6.902 8.190 -0.404 0.166 0.451 485 N N 0.692 119.137 118.700 -0.426 0.000 2.357 485 N HA -0.012 4.596 4.740 -0.220 0.000 0.257 485 N C -0.490 174.842 175.510 -0.298 0.000 1.250 485 N CA 0.597 53.463 53.050 -0.307 0.000 0.862 485 N CB 0.067 38.354 38.487 -0.333 0.000 1.066 485 N HN 0.048 8.101 8.380 -0.544 0.000 0.468 486 P HA 0.142 4.481 4.420 -0.136 0.000 0.245 486 P C 0.200 177.406 177.300 -0.157 0.000 1.203 486 P CA 1.068 64.078 63.100 -0.149 0.000 0.792 486 P CB 0.609 32.264 31.700 -0.075 0.000 0.997 487 F N -2.069 117.720 119.950 -0.269 0.000 2.234 487 F HA -0.172 4.032 4.527 -0.538 0.000 0.299 487 F C 0.847 176.429 175.800 -0.363 0.000 1.087 487 F CA 2.103 59.771 58.000 -0.552 0.000 1.340 487 F CB -1.739 36.569 39.000 -1.152 0.000 1.031 487 F HN -0.074 8.003 8.300 -0.373 0.000 0.500 488 V N 1.027 120.830 119.914 -0.184 0.000 2.407 488 V HA -0.465 3.763 4.120 0.181 0.000 0.248 488 V C 1.777 177.964 176.094 0.156 0.000 1.055 488 V CA 4.735 67.069 62.300 0.056 0.000 1.049 488 V CB -0.523 31.288 31.823 -0.019 0.000 0.662 488 V HN -0.011 7.884 8.190 -0.492 0.000 0.455 489 T N 2.907 117.549 114.554 0.147 0.000 2.777 489 T HA -0.347 4.185 4.350 0.305 0.000 0.266 489 T C 2.151 176.872 174.700 0.036 0.000 1.040 489 T CA 4.758 66.975 62.100 0.195 0.000 1.141 489 T CB -0.521 68.478 68.868 0.219 0.000 0.868 489 T HN -0.799 7.473 8.240 0.054 0.000 0.444 490 I N 1.539 122.115 120.570 0.010 0.000 2.163 490 I HA -0.563 3.607 4.170 -0.001 0.000 0.243 490 I C 1.813 177.920 176.117 -0.016 0.000 1.085 490 I CA 4.528 65.826 61.300 -0.003 0.000 1.347 490 I CB -0.556 37.445 38.000 0.003 0.000 1.044 490 I HN -0.123 8.086 8.210 -0.001 0.000 0.408 491 T N 1.809 116.367 114.554 0.006 0.000 2.708 491 T HA -0.390 3.938 4.350 -0.037 0.000 0.266 491 T C 1.850 176.511 174.700 -0.065 0.000 1.037 491 T CA 4.676 66.775 62.100 -0.001 0.000 1.146 491 T CB -0.449 68.490 68.868 0.119 0.000 0.865 491 T HN -0.341 7.909 8.240 0.017 0.000 0.435 492 A N 2.066 124.814 122.820 -0.120 0.000 1.902 492 A HA -0.202 4.018 4.320 -0.168 0.000 0.217 492 A C 1.853 179.239 177.584 -0.330 0.000 1.181 492 A CA 2.974 54.832 52.037 -0.298 0.000 0.623 492 A CB -0.688 17.825 19.000 -0.811 0.000 0.818 492 A HN -0.002 8.099 8.150 -0.082 0.000 0.443 493 L N -0.968 120.094 121.223 -0.267 0.000 2.141 493 L HA -0.183 4.002 4.340 -0.258 0.000 0.209 493 L C 1.436 178.195 176.870 -0.184 0.000 1.094 493 L CA 2.279 56.995 54.840 -0.206 0.000 0.763 493 L CB -0.428 41.579 42.059 -0.087 0.000 0.908 493 L HN -0.158 7.937 8.230 -0.226 0.000 0.437 494 A N -1.058 121.678 122.820 -0.139 0.000 1.929 494 A HA -0.346 3.923 4.320 -0.086 0.000 0.216 494 A C 2.022 179.515 177.584 -0.152 0.000 1.176 494 A CA 3.365 55.332 52.037 -0.115 0.000 0.628 494 A CB -0.774 18.167 19.000 -0.099 0.000 0.816 494 A HN -0.151 7.925 8.150 -0.123 0.000 0.444 495 E N -1.469 118.631 120.200 -0.167 0.000 2.051 495 E HA -0.375 3.931 4.350 -0.072 0.000 0.192 495 E C 2.474 178.849 176.600 -0.374 0.000 0.991 495 E CA 3.295 59.611 56.400 -0.140 0.000 0.799 495 E CB -0.274 29.443 29.700 0.028 0.000 0.748 495 E HN -0.261 8.006 8.360 -0.156 0.000 0.449 496 R N -0.963 119.071 120.500 -0.777 0.000 2.081 496 R HA -0.395 2.811 4.340 -1.889 0.000 0.235 496 R C 2.020 178.118 176.300 -0.338 0.000 1.131 496 R CA 3.597 59.028 56.100 -1.115 0.000 0.960 496 R CB -0.109 29.613 30.300 -0.964 0.000 0.856 496 R HN -0.287 7.587 8.270 -0.660 0.000 0.436 497 N N -0.686 117.917 118.700 -0.161 0.000 2.135 497 N HA -0.186 4.705 4.740 0.253 0.000 0.186 497 N C 2.302 177.793 175.510 -0.030 0.000 1.027 497 N CA 2.886 55.961 53.050 0.042 0.000 0.849 497 N CB -0.366 38.144 38.487 0.038 0.000 1.002 497 N HN -0.209 8.041 8.380 -0.217 0.000 0.425 498 V N 1.132 120.999 119.914 -0.079 0.000 2.515 498 V HA -0.406 3.664 4.120 -0.083 0.000 0.250 498 V C 1.023 177.053 176.094 -0.106 0.000 1.058 498 V CA 3.116 65.359 62.300 -0.095 0.000 1.064 498 V CB -0.328 31.417 31.823 -0.131 0.000 0.675 498 V HN -0.066 8.066 8.190 -0.096 0.000 0.461 499 E N 0.327 120.475 120.200 -0.087 0.000 2.077 499 E HA -0.429 3.895 4.350 -0.044 0.000 0.193 499 E C 1.970 178.523 176.600 -0.078 0.000 0.989 499 E CA 3.721 60.093 56.400 -0.047 0.000 0.800 499 E CB -0.185 29.538 29.700 0.039 0.000 0.746 499 E HN -0.631 7.668 8.360 -0.101 0.000 0.452 500 R N -1.090 119.337 120.500 -0.122 0.000 2.075 500 R HA -0.192 4.034 4.340 -0.189 0.000 0.232 500 R C 2.447 178.613 176.300 -0.222 0.000 1.126 500 R CA 2.063 58.024 56.100 -0.231 0.000 0.963 500 R CB -0.692 29.288 30.300 -0.534 0.000 0.858 500 R HN -0.812 7.393 8.270 -0.108 0.000 0.435 501 I N -0.659 119.791 120.570 -0.201 0.000 2.226 501 I HA -0.491 3.569 4.170 -0.183 0.000 0.245 501 I C 1.741 177.752 176.117 -0.176 0.000 1.100 501 I CA 4.376 65.548 61.300 -0.214 0.000 1.374 501 I CB -0.023 37.755 38.000 -0.369 0.000 1.057 501 I HN -0.152 7.952 8.210 -0.177 0.000 0.413 502 I N -0.624 119.852 120.570 -0.156 0.000 2.252 502 I HA -0.590 3.479 4.170 -0.168 0.000 0.245 502 I C 2.207 178.266 176.117 -0.096 0.000 1.102 502 I CA 4.300 65.518 61.300 -0.137 0.000 1.385 502 I CB -0.412 37.514 38.000 -0.123 0.000 1.064 502 I HN -0.208 7.912 8.210 -0.150 0.000 0.414 503 K N -1.112 119.237 120.400 -0.085 0.000 2.057 503 K HA -0.297 3.995 4.320 -0.046 0.000 0.206 503 K C 1.941 178.510 176.600 -0.051 0.000 1.050 503 K CA 3.040 59.291 56.287 -0.060 0.000 0.935 503 K CB 0.048 32.513 32.500 -0.059 0.000 0.715 503 K HN -0.617 7.575 8.250 -0.096 0.000 0.439 504 Q N -3.509 116.251 119.800 -0.067 0.000 2.373 504 Q HA 0.028 4.351 4.340 -0.028 0.000 0.210 504 Q C 1.052 177.054 176.000 0.003 0.000 0.913 504 Q CA 1.513 57.292 55.803 -0.040 0.000 0.911 504 Q CB 0.678 29.379 28.738 -0.063 0.000 1.040 504 Q HN -0.398 7.816 8.270 -0.092 0.000 0.521 505 D N -2.893 117.511 120.400 0.006 0.000 2.473 505 D HA 0.185 4.893 4.640 0.113 0.000 0.230 505 D C -0.693 175.665 176.300 0.097 0.000 1.097 505 D CA 1.074 55.126 54.000 0.086 0.000 0.861 505 D CB 2.411 43.306 40.800 0.157 0.000 1.114 505 D HN 0.119 8.468 8.370 -0.034 0.000 0.500 506 V N 0.000 119.895 119.914 -0.032 0.000 2.409 506 V HA 0.000 4.074 4.120 -0.077 0.000 0.244 506 V CA 0.000 62.229 62.300 -0.118 0.000 1.235 506 V CB 0.000 31.605 31.823 -0.364 0.000 1.184 506 V HN 0.000 8.157 8.190 -0.055 0.000 0.556