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 2pu5_1_A DATA FIRST_RESID 2 DATA SEQUENCE TALTESSTSK FVKINEKGFS DFNIHYNEAG NGETVIMLHG GGPGAGGWSN DATA SEQUENCE YYRNVGPFVD AGYRVILKDS PGFNKSDAVV MDEQRGLVNA RAVKGLMDAL DATA SEQUENCE DIDRAHLVGN SMGGATALNF ALEYPDRIGK LILMGPGGLG PSMFAPMPME DATA SEQUENCE GIKLLFKLYA EPSYETLKQM LQVFLYDQSL ITEELLQGRW EAIQRQPEHL DATA SEQUENCE KNFLISAQKA PLSTWDVTAR LGEIKAKTFI TWGRDDRFVP LDHGLKLLWN DATA SEQUENCE IDDARLHVFS KCGHWAQWEH ADEFNRLVID FLRHA VARS RESID RESNAME ATOMNAME SS_SHIFT SHIFT RC_SHIFT HM_SHIFT EF_SHIFT SIGMA FORMAT %4d %4s %4s %9.3f %9.3f %9.3f %9.3f %9.3f %9.3f 2 T HA 0.000 4.350 4.350 -0.000 0.000 0.228 2 T C 0.000 174.718 174.700 0.031 0.000 1.109 2 T CA 0.000 62.113 62.100 0.022 0.000 1.349 2 T CB 0.000 68.879 68.868 0.018 0.000 0.612 3 A N 2.100 124.937 122.820 0.028 0.000 2.466 3 A HA 0.642 4.962 4.320 -0.001 0.000 0.238 3 A C 0.058 177.673 177.584 0.051 0.000 1.074 3 A CA -0.276 51.785 52.037 0.040 0.000 0.774 3 A CB 0.119 19.137 19.000 0.031 0.000 1.015 3 A HN 0.889 9.039 8.150 -0.000 0.000 0.498 4 L N 2.786 124.059 121.223 0.084 0.000 2.277 4 L HA 0.534 4.873 4.340 -0.001 0.000 0.284 4 L C 0.193 177.161 176.870 0.163 0.000 1.028 4 L CA -0.024 54.895 54.840 0.130 0.000 0.835 4 L CB 0.803 42.965 42.059 0.171 0.000 1.215 4 L HN 1.001 9.231 8.230 -0.000 0.000 0.425 5 T N -1.344 113.250 114.554 0.067 0.000 2.887 5 T HA 0.266 4.616 4.350 -0.001 0.000 0.292 5 T C 0.681 175.085 174.700 -0.494 0.000 1.087 5 T CA -0.571 61.501 62.100 -0.047 0.000 1.009 5 T CB 1.674 70.494 68.868 -0.081 0.000 1.203 5 T HN 0.587 8.827 8.240 -0.000 0.000 0.518 6 E N 0.611 120.182 120.200 -1.049 0.000 2.049 6 E HA -0.180 4.170 4.350 -0.001 0.000 0.198 6 E C 1.889 178.047 176.600 -0.737 0.000 1.007 6 E CA 2.013 57.371 56.400 -1.737 0.000 0.809 6 E CB -0.293 28.401 29.700 -1.676 0.000 0.749 6 E HN 0.633 8.993 8.360 -0.000 0.000 0.450 7 S N 0.127 115.567 115.700 -0.433 0.000 2.387 7 S HA -0.143 4.327 4.470 -0.001 0.000 0.226 7 S C 2.109 176.605 174.600 -0.172 0.000 1.026 7 S CA 1.022 59.079 58.200 -0.239 0.000 0.972 7 S CB -0.222 62.883 63.200 -0.159 0.000 0.814 7 S HN 0.472 8.782 8.310 -0.000 0.000 0.477 8 S N 1.990 117.597 115.700 -0.154 0.000 2.442 8 S HA -0.121 4.349 4.470 -0.001 0.000 0.236 8 S C 1.686 176.239 174.600 -0.079 0.000 1.007 8 S CA 1.532 59.681 58.200 -0.085 0.000 0.965 8 S CB -0.843 62.330 63.200 -0.045 0.000 0.773 8 S HN 0.665 8.975 8.310 -0.000 0.000 0.504 9 T N -1.518 112.965 114.554 -0.118 0.000 3.069 9 T HA 0.294 4.643 4.350 -0.001 0.000 0.252 9 T C 0.631 175.239 174.700 -0.153 0.000 1.053 9 T CA 0.139 62.198 62.100 -0.068 0.000 0.964 9 T CB -0.061 68.838 68.868 0.050 0.000 1.005 9 T HN 0.288 8.528 8.240 -0.000 0.000 0.532 10 S N 1.447 117.037 115.700 -0.182 0.000 2.510 10 S HA 0.420 4.890 4.470 -0.001 0.000 0.279 10 S C -0.427 173.966 174.600 -0.346 0.000 1.284 10 S CA -0.398 57.672 58.200 -0.217 0.000 1.059 10 S CB 0.062 63.214 63.200 -0.079 0.000 0.901 10 S HN 0.523 8.833 8.310 -0.000 0.000 0.491 11 K N 2.548 122.492 120.400 -0.760 0.000 2.495 11 K HA 0.558 4.878 4.320 -0.001 0.000 0.268 11 K C -1.629 174.335 176.600 -1.059 0.000 1.008 11 K CA -0.677 55.120 56.287 -0.816 0.000 0.882 11 K CB 1.317 33.257 32.500 -0.934 0.000 1.443 11 K HN 0.512 8.762 8.250 -0.000 0.000 0.447 12 F N 0.391 120.186 119.950 -0.258 0.000 2.551 12 F HA 0.601 5.127 4.527 -0.001 0.000 0.316 12 F C -0.674 175.236 175.800 0.182 0.000 1.089 12 F CA -0.950 57.058 58.000 0.014 0.000 0.915 12 F CB 2.198 41.224 39.000 0.043 0.000 1.186 12 F HN 0.071 8.371 8.300 -0.000 0.000 0.456 13 V N 3.647 123.830 119.914 0.448 0.000 2.888 13 V HA 0.517 4.636 4.120 -0.001 0.000 0.309 13 V C -1.266 174.954 176.094 0.210 0.000 1.114 13 V CA -0.873 61.605 62.300 0.297 0.000 0.940 13 V CB 2.071 34.040 31.823 0.243 0.000 1.021 13 V HN 0.530 8.720 8.190 -0.000 0.000 0.426 14 K N 5.796 126.288 120.400 0.153 0.000 2.298 14 K HA 0.524 4.844 4.320 -0.001 0.000 0.280 14 K C -0.343 176.327 176.600 0.117 0.000 1.032 14 K CA 0.021 56.388 56.287 0.133 0.000 0.958 14 K CB 0.990 33.554 32.500 0.108 0.000 0.978 14 K HN 0.781 9.031 8.250 -0.000 0.000 0.472 15 I N -1.020 119.634 120.570 0.140 0.000 2.846 15 I HA 0.484 4.653 4.170 -0.001 0.000 0.307 15 I C -0.144 176.071 176.117 0.163 0.000 1.053 15 I CA -0.643 60.714 61.300 0.095 0.000 1.050 15 I CB 2.087 40.082 38.000 -0.009 0.000 1.239 15 I HN 0.254 8.464 8.210 -0.000 0.000 0.439 16 N N 2.765 121.547 118.700 0.137 0.000 2.622 16 N HA 0.155 4.895 4.740 -0.001 0.000 0.293 16 N C -1.166 174.422 175.510 0.129 0.000 1.788 16 N CA -0.235 52.904 53.050 0.149 0.000 0.860 16 N CB 1.066 39.615 38.487 0.103 0.000 1.388 16 N HN 0.729 9.109 8.380 -0.000 0.000 0.496 17 E N 1.101 121.408 120.200 0.177 0.000 2.151 17 E HA 0.275 4.625 4.350 -0.001 0.000 0.275 17 E C -0.460 176.247 176.600 0.178 0.000 0.936 17 E CA -0.271 56.221 56.400 0.153 0.000 0.777 17 E CB 0.694 30.481 29.700 0.144 0.000 1.108 17 E HN 0.017 8.377 8.360 -0.000 0.000 0.401 18 K N 3.714 124.169 120.400 0.092 0.000 3.689 18 K HA -0.275 4.045 4.320 -0.001 0.000 0.276 18 K C 0.648 177.212 176.600 -0.061 0.000 0.932 18 K CA 0.864 57.171 56.287 0.032 0.000 0.758 18 K CB -1.609 30.925 32.500 0.056 0.000 1.500 18 K HN 1.015 9.265 8.250 -0.000 0.000 0.448 19 G N -0.176 108.593 108.800 -0.052 0.000 2.284 19 G HA2 -0.344 3.615 3.960 -0.001 0.000 0.247 19 G HA3 -0.344 3.615 3.960 -0.001 0.000 0.247 19 G C 0.203 174.977 174.900 -0.210 0.000 1.012 19 G CA 0.136 45.149 45.100 -0.144 0.000 0.618 19 G HN 0.355 8.645 8.290 -0.000 0.000 0.521 20 F N 1.980 121.898 119.950 -0.052 0.000 2.538 20 F HA 0.507 5.034 4.527 -0.001 0.000 0.371 20 F C 0.985 176.814 175.800 0.049 0.000 1.087 20 F CA 0.920 58.887 58.000 -0.054 0.000 1.250 20 F CB 1.541 40.486 39.000 -0.091 0.000 1.110 20 F HN 0.152 8.452 8.300 -0.000 0.000 0.570 21 S N 2.773 118.664 115.700 0.317 0.000 2.736 21 S HA 0.291 4.761 4.470 -0.001 0.000 0.285 21 S C -0.854 173.896 174.600 0.250 0.000 1.163 21 S CA -0.819 57.518 58.200 0.228 0.000 1.025 21 S CB 0.576 63.860 63.200 0.139 0.000 1.030 21 S HN 0.679 8.989 8.310 -0.000 0.000 0.486 22 D N 1.932 122.460 120.400 0.213 0.000 2.692 22 D HA -0.194 4.445 4.640 -0.001 0.000 0.233 22 D C -0.903 175.530 176.300 0.221 0.000 1.172 22 D CA 1.243 55.350 54.000 0.179 0.000 0.636 22 D CB -1.246 39.622 40.800 0.114 0.000 1.028 22 D HN 0.486 8.856 8.370 -0.000 0.000 0.419 23 F N 0.939 120.966 119.950 0.130 0.000 2.415 23 F HA 0.406 4.933 4.527 -0.001 0.000 0.348 23 F C 0.379 176.235 175.800 0.094 0.000 1.119 23 F CA -1.074 57.012 58.000 0.143 0.000 1.069 23 F CB 0.831 39.972 39.000 0.236 0.000 1.124 23 F HN -0.217 8.083 8.300 -0.000 0.000 0.472 24 N N 6.355 124.923 118.700 -0.219 0.000 2.414 24 N HA 0.258 4.998 4.740 -0.001 0.000 0.256 24 N C -1.156 174.407 175.510 0.087 0.000 1.029 24 N CA -0.292 52.747 53.050 -0.018 0.000 0.948 24 N CB 0.432 38.888 38.487 -0.053 0.000 1.102 24 N HN 0.366 8.746 8.380 -0.000 0.000 0.496 25 I N 3.480 124.194 120.570 0.241 0.000 2.312 25 I HA 0.092 4.261 4.170 -0.001 0.000 0.290 25 I C 0.635 176.951 176.117 0.332 0.000 1.008 25 I CA -0.566 60.899 61.300 0.276 0.000 1.226 25 I CB 0.467 38.577 38.000 0.182 0.000 1.371 25 I HN 0.470 8.680 8.210 -0.000 0.000 0.468 26 H N 8.549 127.711 119.070 0.153 0.000 2.722 26 H HA 0.271 4.826 4.556 -0.001 0.000 0.328 26 H C -1.403 173.910 175.328 -0.025 0.000 1.067 26 H CA 0.140 56.039 56.048 -0.248 0.000 1.447 26 H CB 0.737 30.299 29.762 -0.333 0.000 1.469 26 H HN 0.585 8.865 8.280 -0.000 0.000 0.544 27 Y N 1.941 121.585 120.300 -1.094 0.000 2.625 27 Y HA 0.387 4.937 4.550 -0.001 0.000 0.338 27 Y C -1.616 173.905 175.900 -0.631 0.000 1.123 27 Y CA -1.370 56.340 58.100 -0.650 0.000 1.046 27 Y CB 1.018 39.301 38.460 -0.295 0.000 1.299 27 Y HN 0.428 8.708 8.280 -0.000 0.000 0.464 28 N N 1.065 119.692 118.700 -0.123 0.000 2.399 28 N HA 0.338 5.077 4.740 -0.001 0.000 0.280 28 N C -1.842 173.746 175.510 0.131 0.000 1.008 28 N CA -0.904 52.130 53.050 -0.028 0.000 0.894 28 N CB 2.003 40.632 38.487 0.237 0.000 1.273 28 N HN 0.696 9.076 8.380 -0.000 0.000 0.486 29 E N 1.923 122.179 120.200 0.093 0.000 2.234 29 E HA 0.788 5.137 4.350 -0.001 0.000 0.266 29 E C -1.590 175.082 176.600 0.119 0.000 0.877 29 E CA -0.873 55.619 56.400 0.153 0.000 0.758 29 E CB 1.328 31.168 29.700 0.234 0.000 1.170 29 E HN 0.608 8.968 8.360 -0.000 0.000 0.415 30 A N 2.767 125.662 122.820 0.124 0.000 2.569 30 A HA 0.917 5.236 4.320 -0.001 0.000 0.290 30 A C 0.106 177.752 177.584 0.103 0.000 1.136 30 A CA -0.069 52.035 52.037 0.111 0.000 0.710 30 A CB 1.270 20.350 19.000 0.134 0.000 1.303 30 A HN 1.093 9.243 8.150 -0.000 0.000 0.413 31 G N 0.155 109.007 108.800 0.087 0.000 2.782 31 G HA2 0.008 3.968 3.960 -0.001 0.000 0.228 31 G HA3 0.008 3.968 3.960 -0.001 0.000 0.228 31 G C -0.888 174.050 174.900 0.062 0.000 1.372 31 G CA -0.124 45.022 45.100 0.076 0.000 0.862 31 G HN 1.285 9.575 8.290 -0.000 0.000 0.547 32 N N -0.081 118.647 118.700 0.045 0.000 2.494 32 N HA 0.693 5.433 4.740 -0.001 0.000 0.270 32 N C 0.410 175.928 175.510 0.013 0.000 1.285 32 N CA 0.701 53.768 53.050 0.028 0.000 0.812 32 N CB 1.855 40.350 38.487 0.014 0.000 1.557 32 N HN 2.340 10.720 8.380 -0.000 0.000 0.487 33 G N 0.723 109.530 108.800 0.011 0.000 2.443 33 G HA2 -0.196 3.764 3.960 -0.001 0.000 0.209 33 G HA3 -0.196 3.764 3.960 -0.001 0.000 0.209 33 G C -0.829 174.090 174.900 0.033 0.000 1.176 33 G CA -0.656 44.443 45.100 -0.003 0.000 1.074 33 G HN 0.618 8.908 8.290 -0.000 0.000 0.577 34 E N 0.892 121.122 120.200 0.051 0.000 2.480 34 E HA 0.405 4.754 4.350 -0.001 0.000 0.258 34 E C 0.088 176.829 176.600 0.234 0.000 0.984 34 E CA 0.578 57.062 56.400 0.139 0.000 0.930 34 E CB 0.239 30.093 29.700 0.258 0.000 0.936 34 E HN 0.428 8.788 8.360 -0.000 0.000 0.466 35 T N 3.073 117.679 114.554 0.087 0.000 2.845 35 T HA 0.341 4.690 4.350 -0.001 0.000 0.288 35 T C -0.591 174.148 174.700 0.065 0.000 0.980 35 T CA -0.654 61.484 62.100 0.063 0.000 1.071 35 T CB 1.168 70.017 68.868 -0.032 0.000 0.941 35 T HN 0.162 8.402 8.240 -0.000 0.000 0.487 36 V N 4.754 124.711 119.914 0.071 0.000 2.407 36 V HA 0.457 4.577 4.120 -0.001 0.000 0.291 36 V C -0.226 175.800 176.094 -0.114 0.000 1.018 36 V CA -0.790 61.512 62.300 0.003 0.000 0.842 36 V CB 1.198 33.009 31.823 -0.020 0.000 0.996 36 V HN 0.783 8.973 8.190 -0.000 0.000 0.426 37 I N 5.604 126.073 120.570 -0.167 0.000 2.359 37 I HA 0.490 4.660 4.170 -0.001 0.000 0.294 37 I C -0.053 175.879 176.117 -0.308 0.000 0.987 37 I CA -0.296 60.864 61.300 -0.233 0.000 1.225 37 I CB 1.570 39.416 38.000 -0.256 0.000 1.366 37 I HN 0.402 8.612 8.210 -0.000 0.000 0.466 38 M N 7.394 126.754 119.600 -0.400 0.000 2.294 38 M HA 0.536 5.015 4.480 -0.001 0.000 0.335 38 M C -1.118 174.945 176.300 -0.394 0.000 1.079 38 M CA -0.561 54.346 55.300 -0.654 0.000 0.982 38 M CB 1.822 33.643 32.600 -1.298 0.000 1.651 38 M HN 0.368 8.658 8.290 -0.000 0.000 0.437 39 L N 3.409 124.498 121.223 -0.223 0.000 2.349 39 L HA 0.475 4.814 4.340 -0.001 0.000 0.278 39 L C -0.221 176.692 176.870 0.072 0.000 0.996 39 L CA -1.013 53.766 54.840 -0.101 0.000 0.825 39 L CB 1.142 43.101 42.059 -0.165 0.000 1.243 39 L HN 0.712 8.942 8.230 -0.000 0.000 0.412 40 H N 0.871 120.015 119.070 0.123 0.000 2.505 40 H HA 0.743 5.298 4.556 -0.001 0.000 0.358 40 H C 0.422 175.702 175.328 -0.079 0.000 1.304 40 H CA -0.413 55.654 56.048 0.031 0.000 1.393 40 H CB 0.631 30.368 29.762 -0.041 0.000 1.591 40 H HN 0.554 8.834 8.280 -0.000 0.000 0.595 41 G N -1.477 107.396 108.800 0.122 0.000 2.508 41 G HA2 0.383 4.342 3.960 -0.001 0.000 0.278 41 G HA3 0.383 4.342 3.960 -0.001 0.000 0.278 41 G C 0.643 175.619 174.900 0.127 0.000 1.389 41 G CA -0.666 44.509 45.100 0.125 0.000 1.050 41 G HN 0.928 9.218 8.290 -0.000 0.000 0.522 42 G N -1.379 107.556 108.800 0.224 0.000 3.377 42 G HA2 0.470 4.429 3.960 -0.001 0.000 0.257 42 G HA3 0.470 4.429 3.960 -0.001 0.000 0.257 42 G C 0.720 175.873 174.900 0.421 0.000 1.038 42 G CA 0.595 45.904 45.100 0.348 0.000 0.809 42 G HN 0.881 9.171 8.290 -0.000 0.000 0.526 43 G N 0.594 109.560 108.800 0.276 0.000 2.636 43 G HA2 0.456 4.415 3.960 -0.001 0.000 0.246 43 G HA3 0.456 4.415 3.960 -0.001 0.000 0.246 43 G C -2.594 172.293 174.900 -0.022 0.000 1.216 43 G CA -0.877 44.294 45.100 0.118 0.000 0.854 43 G HN 0.006 8.296 8.290 -0.000 0.000 0.572 44 P HA 0.194 4.614 4.420 -0.000 0.000 0.265 44 P C 0.910 178.140 177.300 -0.116 0.000 1.193 44 P CA 1.408 64.207 63.100 -0.503 0.000 0.765 44 P CB 0.962 32.233 31.700 -0.716 0.000 0.823 45 G N 1.618 110.404 108.800 -0.024 0.000 2.162 45 G HA2 -0.196 3.763 3.960 -0.001 0.000 0.260 45 G HA3 -0.196 3.763 3.960 -0.001 0.000 0.260 45 G C 0.460 175.407 174.900 0.078 0.000 0.976 45 G CA 0.024 45.148 45.100 0.040 0.000 0.655 45 G HN 0.847 9.137 8.290 -0.000 0.000 0.533 46 A N -0.328 122.580 122.820 0.147 0.000 2.407 46 A HA 0.812 5.132 4.320 -0.001 0.000 0.248 46 A C 0.932 178.383 177.584 -0.222 0.000 1.082 46 A CA 1.124 53.158 52.037 -0.004 0.000 0.785 46 A CB 0.929 19.932 19.000 0.004 0.000 1.020 46 A HN 2.018 10.168 8.150 -0.000 0.000 0.489 47 G N -0.787 107.782 108.800 -0.385 0.000 2.660 47 G HA2 0.505 4.464 3.960 -0.001 0.000 0.290 47 G HA3 0.505 4.464 3.960 -0.001 0.000 0.290 47 G C 0.595 175.404 174.900 -0.151 0.000 1.432 47 G CA 0.239 45.127 45.100 -0.353 0.000 0.807 47 G HN 1.185 9.475 8.290 -0.000 0.000 0.485 48 G N -0.423 108.455 108.800 0.130 0.000 2.459 48 G HA2 -0.196 3.763 3.960 -0.001 0.000 0.217 48 G HA3 -0.196 3.763 3.960 -0.001 0.000 0.217 48 G C 1.436 176.497 174.900 0.267 0.000 1.183 48 G CA 1.366 46.648 45.100 0.304 0.000 0.776 48 G HN 0.545 8.835 8.290 -0.000 0.000 0.552 49 W N 1.273 122.636 121.300 0.106 0.000 2.338 49 W HA -0.146 4.514 4.660 -0.001 0.000 0.304 49 W C 2.696 179.294 176.519 0.130 0.000 1.212 49 W CA 1.814 59.226 57.345 0.112 0.000 1.264 49 W CB -0.529 28.966 29.460 0.059 0.000 1.142 49 W HN 0.318 8.498 8.180 -0.000 0.000 0.512 50 S N 0.331 116.108 115.700 0.129 0.000 2.368 50 S HA -0.206 4.263 4.470 -0.001 0.000 0.225 50 S C 1.599 176.089 174.600 -0.183 0.000 1.030 50 S CA 1.658 59.850 58.200 -0.013 0.000 0.999 50 S CB -0.547 62.623 63.200 -0.051 0.000 0.844 50 S HN 0.372 8.682 8.310 -0.000 0.000 0.459 51 N N -1.278 117.203 118.700 -0.365 0.000 2.171 51 N HA -0.026 4.713 4.740 -0.001 0.000 0.184 51 N C 0.453 175.403 175.510 -0.933 0.000 1.021 51 N CA 1.160 53.693 53.050 -0.861 0.000 0.854 51 N CB -0.001 37.857 38.487 -1.048 0.000 0.994 51 N HN 0.488 8.868 8.380 -0.000 0.000 0.426 52 Y N -0.522 119.592 120.300 -0.309 0.000 2.636 52 Y HA 0.108 4.658 4.550 -0.001 0.000 0.260 52 Y C 0.883 176.470 175.900 -0.521 0.000 1.177 52 Y CA -0.668 57.191 58.100 -0.401 0.000 1.209 52 Y CB -0.204 38.059 38.460 -0.328 0.000 1.166 52 Y HN 0.192 8.472 8.280 -0.000 0.000 0.531 53 Y N -0.956 118.973 120.300 -0.619 0.000 2.574 53 Y HA 0.042 4.591 4.550 -0.001 0.000 0.294 53 Y C 1.525 177.145 175.900 -0.466 0.000 1.142 53 Y CA 0.440 57.982 58.100 -0.930 0.000 1.314 53 Y CB -0.352 37.333 38.460 -1.291 0.000 0.991 53 Y HN -0.101 8.179 8.280 -0.000 0.000 0.555 54 R N 0.390 120.323 120.500 -0.945 0.000 2.317 54 R HA 0.124 4.463 4.340 -0.001 0.000 0.208 54 R C 0.436 176.572 176.300 -0.274 0.000 0.914 54 R CA 0.834 56.578 56.100 -0.593 0.000 1.060 54 R CB -0.147 29.748 30.300 -0.676 0.000 1.015 54 R HN 0.532 8.802 8.270 -0.000 0.000 0.498 55 N N -0.577 118.000 118.700 -0.206 0.000 2.463 55 N HA -0.046 4.694 4.740 -0.001 0.000 0.183 55 N C 1.483 177.017 175.510 0.041 0.000 1.064 55 N CA 0.030 53.081 53.050 0.001 0.000 0.879 55 N CB 0.277 38.733 38.487 -0.050 0.000 1.148 55 N HN -0.129 8.251 8.380 -0.000 0.000 0.451 56 V N 1.172 121.024 119.914 -0.104 0.000 2.287 56 V HA -0.135 3.984 4.120 -0.001 0.000 0.248 56 V C 2.036 178.187 176.094 0.094 0.000 1.053 56 V CA 2.463 64.736 62.300 -0.046 0.000 1.027 56 V CB -1.013 30.745 31.823 -0.110 0.000 0.646 56 V HN 0.389 8.579 8.190 -0.000 0.000 0.447 57 G N -0.202 108.641 108.800 0.071 0.000 2.459 57 G HA2 -0.189 3.771 3.960 -0.001 0.000 0.217 57 G HA3 -0.189 3.771 3.960 -0.001 0.000 0.217 57 G C -0.111 174.869 174.900 0.134 0.000 1.183 57 G CA 1.123 46.287 45.100 0.106 0.000 0.776 57 G HN 0.553 8.843 8.290 -0.000 0.000 0.552 58 P HA -0.055 4.365 4.420 -0.000 0.000 0.216 58 P C 1.380 178.773 177.300 0.154 0.000 1.150 58 P CA 0.735 63.914 63.100 0.131 0.000 0.837 58 P CB -0.100 31.674 31.700 0.123 0.000 0.786 59 F N -0.944 119.048 119.950 0.070 0.000 2.113 59 F HA -0.146 4.381 4.527 -0.001 0.000 0.297 59 F C 2.352 178.267 175.800 0.192 0.000 1.103 59 F CA 1.123 59.200 58.000 0.128 0.000 1.248 59 F CB -1.409 37.625 39.000 0.056 0.000 0.999 59 F HN -0.285 8.015 8.300 -0.000 0.000 0.475 60 V N -0.051 120.049 119.914 0.310 0.000 2.295 60 V HA -0.319 3.801 4.120 -0.001 0.000 0.246 60 V C 2.016 178.178 176.094 0.114 0.000 1.049 60 V CA 2.278 64.695 62.300 0.194 0.000 1.024 60 V CB -0.615 31.298 31.823 0.150 0.000 0.648 60 V HN 0.243 8.433 8.190 -0.000 0.000 0.447 61 D N 0.261 120.721 120.400 0.100 0.000 2.218 61 D HA -0.103 4.537 4.640 -0.001 0.000 0.204 61 D C 1.814 178.124 176.300 0.016 0.000 0.976 61 D CA 1.147 55.177 54.000 0.050 0.000 0.853 61 D CB -0.095 40.732 40.800 0.045 0.000 0.939 61 D HN 0.425 8.795 8.370 -0.000 0.000 0.481 62 A N -0.920 121.919 122.820 0.031 0.000 2.259 62 A HA 0.462 4.781 4.320 -0.001 0.000 0.208 62 A C 1.618 179.106 177.584 -0.160 0.000 1.201 62 A CA 0.767 52.790 52.037 -0.024 0.000 0.824 62 A CB -0.578 18.442 19.000 0.033 0.000 0.838 62 A HN 0.392 8.542 8.150 -0.000 0.000 0.485 63 G N -2.111 106.594 108.800 -0.158 0.000 2.142 63 G HA2 -0.258 3.701 3.960 -0.001 0.000 0.225 63 G HA3 -0.258 3.701 3.960 -0.001 0.000 0.225 63 G C -0.211 174.378 174.900 -0.518 0.000 1.015 63 G CA 0.177 45.094 45.100 -0.305 0.000 0.716 63 G HN 0.451 8.741 8.290 -0.000 0.000 0.508 64 Y N -0.595 119.736 120.300 0.052 0.000 2.457 64 Y HA 0.644 5.193 4.550 -0.001 0.000 0.333 64 Y C 0.910 176.857 175.900 0.078 0.000 1.119 64 Y CA -1.022 57.129 58.100 0.086 0.000 1.143 64 Y CB 1.093 39.648 38.460 0.160 0.000 1.230 64 Y HN 0.173 8.453 8.280 -0.000 0.000 0.469 65 R N 2.064 122.695 120.500 0.219 0.000 2.216 65 R HA 0.528 4.867 4.340 -0.001 0.000 0.332 65 R C -1.843 174.541 176.300 0.140 0.000 1.056 65 R CA -0.259 55.926 56.100 0.142 0.000 0.901 65 R CB 0.375 30.727 30.300 0.086 0.000 1.039 65 R HN 0.561 8.831 8.270 -0.000 0.000 0.456 66 V N 7.276 127.259 119.914 0.114 0.000 2.398 66 V HA 0.391 4.510 4.120 -0.001 0.000 0.286 66 V C 0.050 176.157 176.094 0.022 0.000 1.026 66 V CA -0.634 61.697 62.300 0.051 0.000 0.868 66 V CB 1.703 33.553 31.823 0.046 0.000 0.982 66 V HN 0.724 8.914 8.190 -0.000 0.000 0.443 67 I N 6.140 126.683 120.570 -0.045 0.000 2.382 67 I HA 0.391 4.560 4.170 -0.001 0.000 0.285 67 I C -0.600 175.468 176.117 -0.082 0.000 1.007 67 I CA -0.347 60.932 61.300 -0.034 0.000 1.142 67 I CB 1.501 39.436 38.000 -0.109 0.000 1.289 67 I HN 0.365 8.575 8.210 -0.000 0.000 0.453 68 L N 7.235 128.462 121.223 0.006 0.000 2.270 68 L HA 0.418 4.758 4.340 -0.001 0.000 0.286 68 L C 0.195 177.116 176.870 0.086 0.000 1.059 68 L CA -0.391 54.460 54.840 0.019 0.000 0.839 68 L CB 0.449 42.578 42.059 0.117 0.000 1.221 68 L HN 0.533 8.763 8.230 -0.000 0.000 0.431 69 K N 2.325 122.752 120.400 0.045 0.000 2.143 69 K HA 0.240 4.559 4.320 -0.001 0.000 0.272 69 K C -0.883 175.836 176.600 0.198 0.000 1.001 69 K CA -0.701 55.627 56.287 0.068 0.000 0.915 69 K CB 1.189 33.657 32.500 -0.052 0.000 1.047 69 K HN 0.371 8.621 8.250 -0.000 0.000 0.458 70 D N 2.033 122.571 120.400 0.230 0.000 2.274 70 D HA 0.155 4.794 4.640 -0.001 0.000 0.239 70 D C -0.425 176.084 176.300 0.348 0.000 1.104 70 D CA -0.011 54.217 54.000 0.379 0.000 0.840 70 D CB 1.698 42.716 40.800 0.363 0.000 1.100 70 D HN 0.369 8.739 8.370 -0.000 0.000 0.477 71 S N 2.346 118.302 115.700 0.427 0.000 2.600 71 S HA 0.272 4.741 4.470 -0.001 0.000 0.265 71 S C -2.262 172.560 174.600 0.371 0.000 1.325 71 S CA -0.997 57.332 58.200 0.215 0.000 1.002 71 S CB 0.452 63.641 63.200 -0.017 0.000 0.921 71 S HN 0.309 8.619 8.310 -0.000 0.000 0.554 72 P HA 0.135 4.555 4.420 -0.000 0.000 0.262 72 P C 0.588 178.158 177.300 0.450 0.000 1.182 72 P CA 0.903 64.284 63.100 0.469 0.000 0.761 72 P CB -0.078 31.819 31.700 0.328 0.000 0.795 73 G N 1.077 110.060 108.800 0.305 0.000 2.147 73 G HA2 -0.241 3.718 3.960 -0.001 0.000 0.244 73 G HA3 -0.241 3.718 3.960 -0.001 0.000 0.244 73 G C -0.370 174.077 174.900 -0.755 0.000 1.005 73 G CA -0.424 44.601 45.100 -0.125 0.000 0.713 73 G HN 0.398 8.688 8.290 -0.000 0.000 0.515 74 F N -0.974 118.730 119.950 -0.409 0.000 2.588 74 F HA 0.634 5.160 4.527 -0.001 0.000 0.310 74 F C 0.843 176.630 175.800 -0.023 0.000 1.082 74 F CA -0.183 57.694 58.000 -0.205 0.000 0.929 74 F CB 1.780 40.848 39.000 0.114 0.000 1.254 74 F HN 0.183 8.483 8.300 -0.000 0.000 0.455 75 N N 1.207 120.073 118.700 0.278 0.000 1.293 75 N HA -0.325 4.415 4.740 -0.001 0.000 0.140 75 N C 0.632 176.308 175.510 0.277 0.000 0.753 75 N CA 2.395 55.588 53.050 0.238 0.000 0.979 75 N CB -0.464 38.120 38.487 0.161 0.000 1.228 75 N HN 0.720 9.100 8.380 -0.000 0.000 0.509 76 K N -0.144 120.371 120.400 0.191 0.000 2.367 76 K HA 0.313 4.632 4.320 -0.001 0.000 0.194 76 K C 0.142 176.942 176.600 0.333 0.000 1.027 76 K CA 0.107 56.491 56.287 0.161 0.000 1.075 76 K CB 0.260 32.630 32.500 -0.218 0.000 0.845 76 K HN 0.258 8.508 8.250 -0.000 0.000 0.529 77 S N 1.645 117.553 115.700 0.347 0.000 2.587 77 S HA -0.000 4.469 4.470 -0.001 0.000 0.260 77 S C 0.066 174.786 174.600 0.200 0.000 1.353 77 S CA -0.393 57.987 58.200 0.300 0.000 0.995 77 S CB 0.391 63.781 63.200 0.317 0.000 0.912 77 S HN 0.125 8.435 8.310 -0.000 0.000 0.568 78 D N 1.103 121.450 120.400 -0.088 0.000 2.419 78 D HA 0.367 5.007 4.640 -0.001 0.000 0.236 78 D C 0.268 176.678 176.300 0.183 0.000 1.165 78 D CA 0.199 54.048 54.000 -0.252 0.000 0.882 78 D CB 0.334 40.443 40.800 -1.151 0.000 1.201 78 D HN 0.577 8.947 8.370 -0.000 0.000 0.443 79 A N 0.775 123.762 122.820 0.279 0.000 2.304 79 A HA 0.567 4.886 4.320 -0.001 0.000 0.271 79 A C -0.366 177.489 177.584 0.452 0.000 1.091 79 A CA -0.392 51.905 52.037 0.434 0.000 0.812 79 A CB 1.006 20.169 19.000 0.272 0.000 1.056 79 A HN 0.383 8.533 8.150 -0.000 0.000 0.489 80 V N 1.875 122.022 119.914 0.388 0.000 2.966 80 V HA 0.410 4.529 4.120 -0.001 0.000 0.288 80 V C -1.371 174.846 176.094 0.205 0.000 1.380 80 V CA -0.511 61.987 62.300 0.329 0.000 0.966 80 V CB 2.056 34.114 31.823 0.392 0.000 1.115 80 V HN 0.846 9.036 8.190 -0.000 0.000 0.436 81 V N 7.611 127.608 119.914 0.139 0.000 2.364 81 V HA 0.461 4.581 4.120 -0.001 0.000 0.272 81 V C 0.434 176.553 176.094 0.042 0.000 1.036 81 V CA -0.172 62.178 62.300 0.083 0.000 0.880 81 V CB 1.301 33.164 31.823 0.067 0.000 0.991 81 V HN 0.849 9.039 8.190 -0.000 0.000 0.460 82 M N 4.608 124.221 119.600 0.022 0.000 2.144 82 M HA 0.283 4.762 4.480 -0.001 0.000 0.356 82 M C 0.518 176.806 176.300 -0.019 0.000 1.217 82 M CA -0.489 54.803 55.300 -0.013 0.000 1.087 82 M CB 1.160 33.751 32.600 -0.014 0.000 1.609 82 M HN 0.765 9.055 8.290 -0.000 0.000 0.467 83 D N 1.184 121.566 120.400 -0.031 0.000 2.340 83 D HA 0.087 4.727 4.640 -0.001 0.000 0.217 83 D C -0.184 176.105 176.300 -0.019 0.000 1.081 83 D CA 0.221 54.210 54.000 -0.020 0.000 0.842 83 D CB 0.279 41.068 40.800 -0.020 0.000 0.934 83 D HN 0.527 8.897 8.370 -0.000 0.000 0.511 84 E N 0.079 120.258 120.200 -0.034 0.000 2.320 84 E HA 0.275 4.625 4.350 -0.001 0.000 0.264 84 E C -0.540 176.035 176.600 -0.042 0.000 0.923 84 E CA -1.174 55.206 56.400 -0.033 0.000 0.796 84 E CB 1.173 30.837 29.700 -0.060 0.000 1.262 84 E HN 0.107 8.467 8.360 -0.000 0.000 0.428 85 Q N 0.829 120.601 119.800 -0.046 0.000 2.315 85 Q HA 0.021 4.360 4.340 -0.001 0.000 0.289 85 Q C 0.417 176.182 176.000 -0.391 0.000 1.044 85 Q CA 0.514 56.210 55.803 -0.178 0.000 0.920 85 Q CB 0.766 29.457 28.738 -0.080 0.000 1.214 85 Q HN 0.416 8.686 8.270 -0.000 0.000 0.392 86 R N 2.598 122.632 120.500 -0.777 0.000 2.153 86 R HA -0.040 4.299 4.340 -0.001 0.000 0.218 86 R C 2.080 178.069 176.300 -0.519 0.000 1.072 86 R CA 0.960 56.723 56.100 -0.563 0.000 0.990 86 R CB -0.333 29.588 30.300 -0.633 0.000 0.889 86 R HN 0.950 9.220 8.270 -0.000 0.000 0.452 87 G N 1.652 110.009 108.800 -0.737 0.000 2.422 87 G HA2 -0.251 3.709 3.960 -0.001 0.000 0.218 87 G HA3 -0.251 3.709 3.960 -0.001 0.000 0.218 87 G C 1.349 176.155 174.900 -0.157 0.000 1.146 87 G CA 0.448 45.326 45.100 -0.371 0.000 0.769 87 G HN 0.191 8.481 8.290 -0.000 0.000 0.547 88 L N 0.680 121.812 121.223 -0.152 0.000 2.068 88 L HA 0.138 4.477 4.340 -0.001 0.000 0.204 88 L C 2.846 179.721 176.870 0.008 0.000 1.076 88 L CA 1.280 56.090 54.840 -0.050 0.000 0.753 88 L CB -0.551 41.469 42.059 -0.065 0.000 0.910 88 L HN 0.045 8.275 8.230 -0.000 0.000 0.439 89 V N 0.708 120.604 119.914 -0.030 0.000 2.287 89 V HA -0.290 3.830 4.120 -0.001 0.000 0.248 89 V C 2.379 178.564 176.094 0.152 0.000 1.053 89 V CA 2.007 64.340 62.300 0.055 0.000 1.027 89 V CB -1.085 30.736 31.823 -0.003 0.000 0.646 89 V HN 0.503 8.693 8.190 -0.000 0.000 0.447 90 N N 0.276 119.004 118.700 0.047 0.000 2.289 90 N HA -0.082 4.657 4.740 -0.001 0.000 0.184 90 N C 1.741 177.292 175.510 0.069 0.000 1.016 90 N CA 1.503 54.574 53.050 0.034 0.000 0.872 90 N CB -0.400 38.054 38.487 -0.054 0.000 0.973 90 N HN 0.528 8.908 8.380 -0.000 0.000 0.433 91 A N 0.866 123.768 122.820 0.135 0.000 1.898 91 A HA 0.004 4.323 4.320 -0.001 0.000 0.214 91 A C 2.170 179.980 177.584 0.378 0.000 1.183 91 A CA 0.708 52.925 52.037 0.299 0.000 0.622 91 A CB -0.234 18.956 19.000 0.316 0.000 0.824 91 A HN 0.168 8.318 8.150 -0.000 0.000 0.444 92 R N -0.163 120.532 120.500 0.325 0.000 2.091 92 R HA -0.131 4.209 4.340 -0.001 0.000 0.238 92 R C 2.398 178.795 176.300 0.163 0.000 1.136 92 R CA 1.301 57.586 56.100 0.307 0.000 0.959 92 R CB -0.486 30.025 30.300 0.352 0.000 0.856 92 R HN 0.503 8.773 8.270 -0.000 0.000 0.437 93 A N 0.606 123.467 122.820 0.070 0.000 1.933 93 A HA -0.108 4.211 4.320 -0.001 0.000 0.218 93 A C 2.340 179.849 177.584 -0.126 0.000 1.175 93 A CA 1.330 53.220 52.037 -0.245 0.000 0.628 93 A CB -0.443 18.300 19.000 -0.428 0.000 0.814 93 A HN 0.129 8.279 8.150 -0.000 0.000 0.444 94 V N 0.264 120.156 119.914 -0.036 0.000 2.427 94 V HA -0.218 3.901 4.120 -0.001 0.000 0.248 94 V C 2.590 178.667 176.094 -0.028 0.000 1.051 94 V CA 2.167 64.420 62.300 -0.079 0.000 1.048 94 V CB -0.529 31.214 31.823 -0.134 0.000 0.666 94 V HN 0.531 8.720 8.190 -0.000 0.000 0.456 95 K N 0.442 120.873 120.400 0.051 0.000 2.025 95 K HA -0.119 4.201 4.320 -0.001 0.000 0.207 95 K C 2.225 178.757 176.600 -0.114 0.000 1.049 95 K CA 1.586 57.817 56.287 -0.093 0.000 0.933 95 K CB -0.764 31.390 32.500 -0.576 0.000 0.714 95 K HN 0.488 8.738 8.250 -0.000 0.000 0.438 96 G N 2.193 110.940 108.800 -0.089 0.000 2.469 96 G HA2 -0.283 3.677 3.960 -0.001 0.000 0.219 96 G HA3 -0.283 3.677 3.960 -0.001 0.000 0.219 96 G C 1.605 176.460 174.900 -0.075 0.000 1.150 96 G CA 1.007 46.070 45.100 -0.062 0.000 0.763 96 G HN 0.400 8.690 8.290 -0.000 0.000 0.561 97 L N -0.545 120.612 121.223 -0.110 0.000 2.093 97 L HA 0.075 4.414 4.340 -0.001 0.000 0.208 97 L C 2.851 179.631 176.870 -0.150 0.000 1.085 97 L CA 1.295 56.049 54.840 -0.144 0.000 0.755 97 L CB -0.156 41.775 42.059 -0.214 0.000 0.904 97 L HN 0.238 8.468 8.230 -0.000 0.000 0.435 98 M N -0.139 119.384 119.600 -0.129 0.000 2.117 98 M HA -0.224 4.255 4.480 -0.001 0.000 0.262 98 M C 1.761 178.016 176.300 -0.074 0.000 1.065 98 M CA 1.885 57.123 55.300 -0.104 0.000 1.114 98 M CB -0.468 32.093 32.600 -0.065 0.000 1.361 98 M HN 0.263 8.553 8.290 -0.000 0.000 0.408 99 D N 0.504 120.864 120.400 -0.066 0.000 2.087 99 D HA -0.117 4.522 4.640 -0.001 0.000 0.192 99 D C 1.996 178.278 176.300 -0.031 0.000 0.993 99 D CA 1.850 55.822 54.000 -0.045 0.000 0.828 99 D CB -0.313 40.461 40.800 -0.043 0.000 0.968 99 D HN 0.329 8.699 8.370 -0.000 0.000 0.448 100 A N 0.162 122.964 122.820 -0.030 0.000 1.978 100 A HA -0.113 4.206 4.320 -0.001 0.000 0.220 100 A C 2.136 179.711 177.584 -0.016 0.000 1.170 100 A CA 1.037 53.068 52.037 -0.011 0.000 0.636 100 A CB -0.528 18.472 19.000 -0.001 0.000 0.810 100 A HN 0.287 8.437 8.150 -0.000 0.000 0.448 101 L N -1.455 119.740 121.223 -0.046 0.000 2.640 101 L HA 0.119 4.458 4.340 -0.001 0.000 0.230 101 L C -0.277 176.572 176.870 -0.034 0.000 1.123 101 L CA 0.048 54.862 54.840 -0.044 0.000 0.900 101 L CB -0.057 41.942 42.059 -0.100 0.000 1.146 101 L HN 0.241 8.471 8.230 -0.000 0.000 0.484 102 D N 0.592 120.974 120.400 -0.030 0.000 2.947 102 D HA -0.146 4.494 4.640 -0.001 0.000 0.224 102 D C -0.122 176.162 176.300 -0.027 0.000 1.132 102 D CA 0.868 54.855 54.000 -0.021 0.000 0.801 102 D CB -1.303 39.491 40.800 -0.010 0.000 1.097 102 D HN 0.255 8.625 8.370 -0.000 0.000 0.431 103 I N 0.875 121.420 120.570 -0.041 0.000 2.321 103 I HA 0.123 4.292 4.170 -0.001 0.000 0.291 103 I C 1.348 177.445 176.117 -0.033 0.000 0.998 103 I CA -0.633 60.641 61.300 -0.044 0.000 1.227 103 I CB 1.325 39.283 38.000 -0.071 0.000 1.368 103 I HN -0.258 7.952 8.210 -0.000 0.000 0.466 104 D N 4.334 124.719 120.400 -0.025 0.000 2.183 104 D HA 0.029 4.668 4.640 -0.001 0.000 0.205 104 D C 0.823 177.123 176.300 0.001 0.000 0.962 104 D CA 1.182 55.175 54.000 -0.012 0.000 0.849 104 D CB 0.392 41.185 40.800 -0.012 0.000 0.978 104 D HN 0.292 8.662 8.370 -0.000 0.000 0.488 105 R N -0.025 120.463 120.500 -0.019 0.000 2.584 105 R HA 0.645 4.985 4.340 -0.001 0.000 0.276 105 R C -1.939 174.306 176.300 -0.092 0.000 1.046 105 R CA -0.502 55.584 56.100 -0.023 0.000 0.906 105 R CB 2.123 32.397 30.300 -0.044 0.000 1.215 105 R HN -0.029 8.241 8.270 -0.000 0.000 0.449 106 A N 3.628 126.384 122.820 -0.106 0.000 2.486 106 A HA 0.559 4.878 4.320 -0.001 0.000 0.300 106 A C -1.140 176.329 177.584 -0.192 0.000 1.048 106 A CA -0.748 51.175 52.037 -0.189 0.000 0.696 106 A CB 1.109 20.002 19.000 -0.178 0.000 1.278 106 A HN 0.757 8.907 8.150 -0.000 0.000 0.405 107 H N 1.213 120.265 119.070 -0.031 0.000 2.629 107 H HA 0.406 4.961 4.556 -0.001 0.000 0.357 107 H C -0.618 174.654 175.328 -0.093 0.000 1.121 107 H CA 0.248 56.280 56.048 -0.027 0.000 1.406 107 H CB 0.814 30.560 29.762 -0.027 0.000 1.456 107 H HN 0.452 8.732 8.280 -0.000 0.000 0.579 108 L N 2.790 124.048 121.223 0.059 0.000 2.333 108 L HA 0.319 4.659 4.340 -0.001 0.000 0.280 108 L C -0.353 176.501 176.870 -0.027 0.000 1.004 108 L CA -0.965 53.834 54.840 -0.068 0.000 0.820 108 L CB 1.977 43.967 42.059 -0.114 0.000 1.247 108 L HN 0.217 8.447 8.230 -0.000 0.000 0.416 109 V N 1.931 121.778 119.914 -0.111 0.000 2.384 109 V HA 0.660 4.779 4.120 -0.001 0.000 0.287 109 V C 0.416 176.462 176.094 -0.079 0.000 1.020 109 V CA -0.463 61.792 62.300 -0.075 0.000 0.850 109 V CB 1.508 33.235 31.823 -0.160 0.000 0.987 109 V HN 0.885 9.075 8.190 -0.000 0.000 0.436 110 G N 2.767 111.572 108.800 0.007 0.000 2.544 110 G HA2 0.502 4.461 3.960 -0.001 0.000 0.313 110 G HA3 0.502 4.461 3.960 -0.001 0.000 0.313 110 G C -0.965 173.968 174.900 0.055 0.000 1.316 110 G CA -0.617 44.497 45.100 0.024 0.000 0.944 110 G HN 0.612 8.902 8.290 -0.000 0.000 0.489 111 N N 1.673 120.421 118.700 0.079 0.000 2.424 111 N HA 0.467 5.207 4.740 -0.001 0.000 0.271 111 N C 0.752 176.326 175.510 0.107 0.000 0.985 111 N CA 0.749 53.816 53.050 0.030 0.000 0.921 111 N CB 1.499 39.951 38.487 -0.057 0.000 1.149 111 N HN 0.897 9.277 8.380 -0.000 0.000 0.492 112 S N 4.146 119.945 115.700 0.165 0.000 4.139 112 S HA -0.377 4.093 4.470 -0.001 0.000 0.603 112 S C 1.395 176.152 174.600 0.263 0.000 1.897 112 S CA 1.712 60.082 58.200 0.283 0.000 4.241 112 S CB -1.677 61.790 63.200 0.444 0.000 0.221 112 S HN 0.785 9.095 8.310 -0.000 0.000 0.488 113 M N 1.786 121.576 119.600 0.318 0.000 2.143 113 M HA -0.059 4.421 4.480 -0.001 0.000 0.258 113 M C 2.035 178.370 176.300 0.057 0.000 1.071 113 M CA 2.821 58.292 55.300 0.286 0.000 1.088 113 M CB -1.173 31.603 32.600 0.294 0.000 1.360 113 M HN 0.752 9.042 8.290 -0.000 0.000 0.404 114 G N -1.204 107.593 108.800 -0.004 0.000 2.448 114 G HA2 -0.060 3.899 3.960 -0.001 0.000 0.218 114 G HA3 -0.060 3.899 3.960 -0.001 0.000 0.218 114 G C 1.342 176.246 174.900 0.008 0.000 1.135 114 G CA 0.689 45.754 45.100 -0.058 0.000 0.784 114 G HN 0.623 8.913 8.290 -0.000 0.000 0.543 115 G N 1.130 109.967 108.800 0.061 0.000 2.394 115 G HA2 0.090 4.050 3.960 -0.001 0.000 0.215 115 G HA3 0.090 4.050 3.960 -0.001 0.000 0.215 115 G C 2.049 177.010 174.900 0.101 0.000 1.165 115 G CA 1.366 46.512 45.100 0.077 0.000 0.784 115 G HN 0.551 8.841 8.290 -0.000 0.000 0.535 116 A N 0.328 123.228 122.820 0.133 0.000 1.917 116 A HA -0.077 4.242 4.320 -0.001 0.000 0.219 116 A C 2.507 180.124 177.584 0.055 0.000 1.182 116 A CA 2.585 54.700 52.037 0.130 0.000 0.633 116 A CB -0.972 18.147 19.000 0.198 0.000 0.819 116 A HN 0.304 8.454 8.150 -0.000 0.000 0.448 117 T N -0.214 114.348 114.554 0.013 0.000 2.812 117 T HA 0.097 4.446 4.350 -0.001 0.000 0.264 117 T C 2.241 176.983 174.700 0.070 0.000 1.042 117 T CA 1.342 63.442 62.100 -0.000 0.000 1.140 117 T CB -0.380 68.453 68.868 -0.058 0.000 0.870 117 T HN 0.599 8.839 8.240 -0.000 0.000 0.445 118 A N 1.323 124.173 122.820 0.051 0.000 1.902 118 A HA -0.005 4.314 4.320 -0.001 0.000 0.217 118 A C 2.264 179.943 177.584 0.159 0.000 1.181 118 A CA 1.226 53.312 52.037 0.081 0.000 0.623 118 A CB -0.891 18.135 19.000 0.042 0.000 0.818 118 A HN 0.464 8.614 8.150 -0.000 0.000 0.443 119 L N -0.057 121.242 121.223 0.127 0.000 1.989 119 L HA -0.266 4.073 4.340 -0.001 0.000 0.211 119 L C 2.454 179.393 176.870 0.115 0.000 1.071 119 L CA 1.689 56.604 54.840 0.124 0.000 0.749 119 L CB -0.754 41.371 42.059 0.109 0.000 0.890 119 L HN 0.472 8.702 8.230 -0.000 0.000 0.431 120 N N -0.400 118.359 118.700 0.099 0.000 2.149 120 N HA -0.239 4.501 4.740 -0.001 0.000 0.188 120 N C 1.914 177.474 175.510 0.084 0.000 1.019 120 N CA 1.614 54.699 53.050 0.059 0.000 0.857 120 N CB -0.258 38.251 38.487 0.037 0.000 0.997 120 N HN 0.238 8.618 8.380 -0.000 0.000 0.426 121 F N 2.044 122.033 119.950 0.064 0.000 2.102 121 F HA -0.129 4.397 4.527 -0.001 0.000 0.298 121 F C 2.441 178.321 175.800 0.133 0.000 1.105 121 F CA 1.372 59.475 58.000 0.171 0.000 1.239 121 F CB -0.219 38.877 39.000 0.160 0.000 0.991 121 F HN -0.029 8.271 8.300 -0.000 0.000 0.474 122 A N 0.472 123.486 122.820 0.324 0.000 1.933 122 A HA -0.132 4.188 4.320 -0.001 0.000 0.218 122 A C 2.242 179.835 177.584 0.015 0.000 1.175 122 A CA 1.732 53.877 52.037 0.180 0.000 0.628 122 A CB -1.125 17.989 19.000 0.191 0.000 0.814 122 A HN 0.508 8.658 8.150 -0.000 0.000 0.444 123 L N -0.778 120.435 121.223 -0.017 0.000 2.056 123 L HA -0.142 4.198 4.340 -0.001 0.000 0.207 123 L C 2.550 179.290 176.870 -0.217 0.000 1.078 123 L CA 1.250 56.039 54.840 -0.085 0.000 0.749 123 L CB -0.410 41.610 42.059 -0.066 0.000 0.901 123 L HN 0.316 8.546 8.230 -0.000 0.000 0.433 124 E N -0.768 119.188 120.200 -0.406 0.000 2.170 124 E HA -0.042 4.308 4.350 -0.001 0.000 0.191 124 E C 0.049 176.078 176.600 -0.952 0.000 0.981 124 E CA 0.929 56.854 56.400 -0.791 0.000 0.830 124 E CB 0.211 29.151 29.700 -1.267 0.000 0.775 124 E HN 0.515 8.875 8.360 -0.000 0.000 0.470 125 Y N 0.174 120.249 120.300 -0.375 0.000 2.473 125 Y HA 0.239 4.789 4.550 -0.001 0.000 0.345 125 Y C -1.717 174.003 175.900 -0.300 0.000 0.932 125 Y CA -1.820 56.025 58.100 -0.424 0.000 1.124 125 Y CB 1.030 39.011 38.460 -0.799 0.000 1.162 125 Y HN -0.027 8.254 8.280 -0.000 0.000 0.629 126 P HA -0.205 4.215 4.420 -0.000 0.000 0.218 126 P C 0.672 177.997 177.300 0.042 0.000 1.146 126 P CA 1.641 64.746 63.100 0.007 0.000 0.813 126 P CB 0.533 32.230 31.700 -0.005 0.000 0.778 127 D N -1.086 119.333 120.400 0.032 0.000 2.355 127 D HA 0.007 4.647 4.640 -0.001 0.000 0.218 127 D C 1.559 177.895 176.300 0.060 0.000 1.004 127 D CA 0.388 54.413 54.000 0.042 0.000 0.880 127 D CB 0.215 41.031 40.800 0.028 0.000 0.911 127 D HN 0.120 8.490 8.370 -0.000 0.000 0.528 128 R N 0.157 120.709 120.500 0.087 0.000 2.362 128 R HA 0.279 4.619 4.340 -0.001 0.000 0.227 128 R C 0.705 177.193 176.300 0.312 0.000 0.905 128 R CA -0.253 55.941 56.100 0.157 0.000 1.067 128 R CB 0.966 31.340 30.300 0.123 0.000 1.078 128 R HN 0.214 8.484 8.270 -0.000 0.000 0.516 129 I N 0.006 120.755 120.570 0.298 0.000 2.460 129 I HA 0.360 4.529 4.170 -0.001 0.000 0.298 129 I C 0.669 176.875 176.117 0.147 0.000 0.989 129 I CA -0.428 61.052 61.300 0.300 0.000 1.173 129 I CB 1.801 40.042 38.000 0.402 0.000 1.338 129 I HN 0.086 8.296 8.210 -0.000 0.000 0.456 130 G N 6.457 115.311 108.800 0.090 0.000 2.964 130 G HA2 0.239 4.198 3.960 -0.001 0.000 0.191 130 G HA3 0.239 4.198 3.960 -0.001 0.000 0.191 130 G C -0.207 174.858 174.900 0.275 0.000 1.978 130 G CA -0.328 44.840 45.100 0.114 0.000 0.861 130 G HN 0.537 8.827 8.290 -0.000 0.000 0.584 131 K N -0.277 120.447 120.400 0.541 0.000 2.098 131 K HA 0.531 4.851 4.320 -0.001 0.000 0.257 131 K C -1.392 175.406 176.600 0.330 0.000 0.999 131 K CA -0.550 55.946 56.287 0.348 0.000 0.924 131 K CB 1.951 34.543 32.500 0.154 0.000 1.028 131 K HN 0.168 8.418 8.250 -0.000 0.000 0.466 132 L N 2.836 124.255 121.223 0.326 0.000 2.349 132 L HA 0.444 4.783 4.340 -0.001 0.000 0.278 132 L C -1.474 175.521 176.870 0.208 0.000 0.996 132 L CA -0.443 54.536 54.840 0.232 0.000 0.825 132 L CB 1.082 43.260 42.059 0.198 0.000 1.243 132 L HN 0.474 8.704 8.230 -0.000 0.000 0.412 133 I N 5.877 126.530 120.570 0.138 0.000 2.406 133 I HA 0.496 4.666 4.170 -0.001 0.000 0.290 133 I C -0.765 175.370 176.117 0.029 0.000 0.999 133 I CA -0.188 61.142 61.300 0.050 0.000 1.124 133 I CB 1.722 39.762 38.000 0.066 0.000 1.289 133 I HN 0.430 8.640 8.210 -0.000 0.000 0.441 134 L N 6.365 127.578 121.223 -0.017 0.000 2.365 134 L HA 0.672 5.011 4.340 -0.001 0.000 0.273 134 L C -0.627 176.228 176.870 -0.025 0.000 1.000 134 L CA -0.637 54.211 54.840 0.015 0.000 0.819 134 L CB 1.978 44.076 42.059 0.066 0.000 1.284 134 L HN 0.494 8.724 8.230 -0.000 0.000 0.418 135 M N 2.815 122.379 119.600 -0.059 0.000 2.060 135 M HA 0.342 4.821 4.480 -0.001 0.000 0.275 135 M C 0.297 176.370 176.300 -0.380 0.000 0.919 135 M CA -0.664 54.544 55.300 -0.154 0.000 0.970 135 M CB 0.745 33.312 32.600 -0.055 0.000 1.670 135 M HN 0.726 9.016 8.290 -0.000 0.000 0.440 136 G N 6.642 114.931 108.800 -0.851 0.000 2.266 136 G HA2 -0.182 3.778 3.960 -0.001 0.000 0.269 136 G HA3 -0.182 3.778 3.960 -0.001 0.000 0.269 136 G C -2.532 172.126 174.900 -0.403 0.000 0.863 136 G CA -0.495 43.755 45.100 -1.417 0.000 1.268 136 G HN 0.497 8.787 8.290 -0.000 0.000 0.426 137 P HA 0.295 4.715 4.420 -0.000 0.000 0.269 137 P C 0.951 178.396 177.300 0.242 0.000 1.209 137 P CA 0.683 63.850 63.100 0.110 0.000 0.776 137 P CB 1.087 32.885 31.700 0.162 0.000 0.876 138 G N 0.217 109.180 108.800 0.273 0.000 2.606 138 G HA2 0.485 4.444 3.960 -0.001 0.000 0.262 138 G HA3 0.485 4.444 3.960 -0.001 0.000 0.262 138 G C 0.460 175.562 174.900 0.336 0.000 1.394 138 G CA -0.555 44.727 45.100 0.304 0.000 1.044 138 G HN 0.755 9.045 8.290 -0.000 0.000 0.553 139 G N -1.858 107.169 108.800 0.378 0.000 2.246 139 G HA2 -0.164 3.795 3.960 -0.001 0.000 0.273 139 G HA3 -0.164 3.795 3.960 -0.001 0.000 0.273 139 G C 0.355 175.365 174.900 0.184 0.000 1.055 139 G CA 0.606 45.912 45.100 0.343 0.000 0.851 139 G HN 0.837 9.127 8.290 -0.000 0.000 0.500 140 L N -1.005 120.288 121.223 0.117 0.000 3.410 140 L HA 0.510 4.849 4.340 -0.001 0.000 0.309 140 L C 1.488 178.248 176.870 -0.184 0.000 1.254 140 L CA 0.287 55.070 54.840 -0.095 0.000 1.048 140 L CB 0.334 42.265 42.059 -0.214 0.000 1.442 140 L HN 1.276 9.506 8.230 -0.000 0.000 0.615 141 G N 1.082 109.911 108.800 0.049 0.000 2.568 141 G HA2 -0.188 3.771 3.960 -0.001 0.000 0.222 141 G HA3 -0.188 3.771 3.960 -0.001 0.000 0.222 141 G C -2.793 172.229 174.900 0.203 0.000 1.321 141 G CA -0.750 44.396 45.100 0.078 0.000 0.893 141 G HN 0.009 8.299 8.290 -0.000 0.000 0.569 142 P HA 0.493 4.913 4.420 -0.000 0.000 0.274 142 P C -0.203 177.250 177.300 0.254 0.000 1.246 142 P CA 0.104 63.285 63.100 0.136 0.000 0.795 142 P CB 1.350 33.074 31.700 0.041 0.000 1.006 143 S N 0.495 116.227 115.700 0.054 0.000 2.565 143 S HA 0.343 4.812 4.470 -0.001 0.000 0.290 143 S C 1.065 175.604 174.600 -0.102 0.000 1.150 143 S CA -0.650 57.513 58.200 -0.062 0.000 1.058 143 S CB 0.075 63.178 63.200 -0.162 0.000 1.032 143 S HN 0.178 8.488 8.310 -0.000 0.000 0.510 144 M N 3.592 123.070 119.600 -0.204 0.000 2.618 144 M HA 0.198 4.677 4.480 -0.001 0.000 0.240 144 M C -0.190 175.504 176.300 -1.009 0.000 1.123 144 M CA 0.914 55.872 55.300 -0.569 0.000 1.060 144 M CB -1.071 31.094 32.600 -0.724 0.000 1.535 144 M HN 0.746 9.036 8.290 -0.000 0.000 0.507 145 F N -0.817 119.108 119.950 -0.041 0.000 2.675 145 F HA 0.383 4.909 4.527 -0.001 0.000 0.315 145 F C 1.063 176.840 175.800 -0.039 0.000 0.888 145 F CA -0.526 57.452 58.000 -0.038 0.000 1.100 145 F CB -0.142 38.833 39.000 -0.042 0.000 0.908 145 F HN -0.118 8.182 8.300 -0.000 0.000 0.657 146 A N 2.439 125.323 122.820 0.106 0.000 2.309 146 A HA 0.593 4.912 4.320 -0.001 0.000 0.290 146 A C -2.421 175.169 177.584 0.010 0.000 1.206 146 A CA -1.434 50.634 52.037 0.052 0.000 0.850 146 A CB -0.485 18.529 19.000 0.024 0.000 1.118 146 A HN -0.107 8.043 8.150 -0.000 0.000 0.523 147 P HA 0.230 4.649 4.420 -0.000 0.000 0.266 147 P C -0.427 176.868 177.300 -0.008 0.000 1.195 147 P CA 0.528 63.628 63.100 -0.000 0.000 0.768 147 P CB 0.403 32.108 31.700 0.007 0.000 0.838 148 M N 2.891 122.479 119.600 -0.019 0.000 2.602 148 M HA 0.420 4.900 4.480 -0.001 0.000 0.312 148 M C -2.047 174.235 176.300 -0.031 0.000 1.181 148 M CA -1.958 53.326 55.300 -0.027 0.000 0.910 148 M CB 1.667 34.247 32.600 -0.033 0.000 1.723 148 M HN 0.277 8.567 8.290 -0.000 0.000 0.459 149 P HA 0.205 4.625 4.420 -0.000 0.000 0.271 149 P C -0.943 176.351 177.300 -0.011 0.000 1.216 149 P CA 0.056 63.139 63.100 -0.028 0.000 0.776 149 P CB 0.550 32.240 31.700 -0.017 0.000 0.881 150 M N 1.085 120.670 119.600 -0.026 0.000 2.240 150 M HA -0.025 4.455 4.480 -0.001 0.000 0.317 150 M C 1.859 178.183 176.300 0.039 0.000 1.087 150 M CA 0.368 55.669 55.300 0.001 0.000 1.176 150 M CB 0.115 32.707 32.600 -0.013 0.000 1.439 150 M HN 0.505 8.795 8.290 -0.000 0.000 0.452 151 E N 1.501 121.740 120.200 0.065 0.000 2.086 151 E HA -0.252 4.097 4.350 -0.001 0.000 0.205 151 E C 1.757 178.438 176.600 0.135 0.000 1.027 151 E CA 1.919 58.369 56.400 0.084 0.000 0.830 151 E CB -0.284 29.466 29.700 0.083 0.000 0.751 151 E HN 1.015 9.375 8.360 -0.000 0.000 0.456 152 G N 1.161 110.096 108.800 0.225 0.000 2.440 152 G HA2 -0.244 3.716 3.960 -0.001 0.000 0.218 152 G HA3 -0.244 3.716 3.960 -0.001 0.000 0.218 152 G C 1.518 176.688 174.900 0.449 0.000 1.154 152 G CA 0.695 46.078 45.100 0.471 0.000 0.767 152 G HN 0.137 8.427 8.290 -0.000 0.000 0.552 153 I N 0.639 121.314 120.570 0.175 0.000 2.226 153 I HA -0.052 4.118 4.170 -0.001 0.000 0.245 153 I C 2.109 178.411 176.117 0.308 0.000 1.100 153 I CA 1.414 62.795 61.300 0.134 0.000 1.374 153 I CB -0.437 37.538 38.000 -0.040 0.000 1.057 153 I HN 0.243 8.453 8.210 -0.000 0.000 0.413 154 K N 0.616 121.142 120.400 0.209 0.000 2.646 154 K HA 0.222 4.542 4.320 -0.001 0.000 0.206 154 K C 1.452 178.168 176.600 0.193 0.000 1.069 154 K CA -0.081 56.361 56.287 0.259 0.000 1.067 154 K CB 0.424 33.006 32.500 0.137 0.000 0.807 154 K HN 0.112 8.362 8.250 -0.000 0.000 0.482 155 L N 0.725 122.029 121.223 0.136 0.000 2.056 155 L HA -0.167 4.172 4.340 -0.001 0.000 0.207 155 L C 2.208 179.128 176.870 0.084 0.000 1.078 155 L CA 1.083 55.962 54.840 0.064 0.000 0.749 155 L CB -0.353 41.688 42.059 -0.030 0.000 0.901 155 L HN 0.375 8.605 8.230 -0.000 0.000 0.433 156 L N -0.874 120.447 121.223 0.164 0.000 2.021 156 L HA -0.299 4.040 4.340 -0.001 0.000 0.215 156 L C 2.403 179.348 176.870 0.125 0.000 1.074 156 L CA 1.905 56.826 54.840 0.136 0.000 0.760 156 L CB -0.267 41.951 42.059 0.265 0.000 0.889 156 L HN 0.043 8.273 8.230 -0.000 0.000 0.433 157 F N -0.107 119.985 119.950 0.236 0.000 2.234 157 F HA -0.147 4.380 4.527 -0.001 0.000 0.296 157 F C 2.601 178.517 175.800 0.194 0.000 1.089 157 F CA 1.599 59.755 58.000 0.260 0.000 1.343 157 F CB -0.231 38.875 39.000 0.177 0.000 1.040 157 F HN 0.046 8.346 8.300 -0.000 0.000 0.498 158 K N 0.527 121.097 120.400 0.284 0.000 2.063 158 K HA -0.237 4.083 4.320 -0.001 0.000 0.208 158 K C 2.056 178.733 176.600 0.128 0.000 1.048 158 K CA 1.549 57.938 56.287 0.170 0.000 0.928 158 K CB -0.391 32.170 32.500 0.102 0.000 0.713 158 K HN 0.245 8.495 8.250 -0.000 0.000 0.442 159 L N 0.369 121.638 121.223 0.077 0.000 2.109 159 L HA -0.077 4.263 4.340 -0.001 0.000 0.207 159 L C 1.843 178.719 176.870 0.009 0.000 1.086 159 L CA 1.504 56.344 54.840 -0.000 0.000 0.760 159 L CB -0.486 41.512 42.059 -0.101 0.000 0.910 159 L HN 0.227 8.457 8.230 -0.000 0.000 0.437 160 Y N -0.652 119.672 120.300 0.040 0.000 2.181 160 Y HA -0.252 4.297 4.550 -0.001 0.000 0.288 160 Y C 2.495 178.460 175.900 0.109 0.000 1.146 160 Y CA 1.611 59.740 58.100 0.049 0.000 1.164 160 Y CB -0.336 38.150 38.460 0.043 0.000 0.982 160 Y HN 0.324 8.604 8.280 -0.000 0.000 0.515 161 A N 0.141 123.142 122.820 0.302 0.000 1.898 161 A HA -0.104 4.215 4.320 -0.001 0.000 0.214 161 A C 0.916 178.593 177.584 0.155 0.000 1.183 161 A CA 1.327 53.496 52.037 0.220 0.000 0.622 161 A CB -0.398 18.723 19.000 0.201 0.000 0.824 161 A HN 0.504 8.654 8.150 -0.000 0.000 0.444 162 E N 0.858 121.138 120.200 0.133 0.000 2.916 162 E HA 0.303 4.652 4.350 -0.001 0.000 0.217 162 E C -2.919 173.748 176.600 0.112 0.000 1.100 162 E CA -2.227 54.238 56.400 0.107 0.000 0.891 162 E CB 0.670 30.420 29.700 0.083 0.000 1.311 162 E HN 0.235 8.595 8.360 -0.000 0.000 0.421 163 P HA -0.026 4.394 4.420 -0.000 0.000 0.267 163 P C -0.395 177.069 177.300 0.273 0.000 1.205 163 P CA 0.314 63.535 63.100 0.203 0.000 0.765 163 P CB 1.230 33.051 31.700 0.202 0.000 0.828 164 S N 2.238 118.045 115.700 0.179 0.000 2.556 164 S HA 0.219 4.689 4.470 -0.001 0.000 0.271 164 S C 0.433 174.758 174.600 -0.459 0.000 1.135 164 S CA -0.662 57.515 58.200 -0.039 0.000 0.858 164 S CB 1.048 64.222 63.200 -0.044 0.000 1.114 164 S HN 0.385 8.695 8.310 -0.000 0.000 0.468 165 Y N 1.454 121.130 120.300 -1.041 0.000 2.224 165 Y HA -0.024 4.525 4.550 -0.001 0.000 0.289 165 Y C 2.239 177.823 175.900 -0.525 0.000 1.146 165 Y CA 2.469 59.873 58.100 -1.161 0.000 1.182 165 Y CB -0.053 37.614 38.460 -1.322 0.000 0.983 165 Y HN 0.901 9.181 8.280 -0.000 0.000 0.524 166 E N -0.395 119.589 120.200 -0.359 0.000 2.072 166 E HA -0.116 4.234 4.350 -0.001 0.000 0.190 166 E C 2.072 178.500 176.600 -0.287 0.000 0.982 166 E CA 2.095 58.325 56.400 -0.283 0.000 0.803 166 E CB -0.592 29.029 29.700 -0.132 0.000 0.755 166 E HN 0.394 8.754 8.360 -0.000 0.000 0.453 167 T N 1.263 115.679 114.554 -0.230 0.000 2.867 167 T HA -0.098 4.252 4.350 -0.001 0.000 0.268 167 T C 1.727 176.278 174.700 -0.247 0.000 1.057 167 T CA 1.081 63.070 62.100 -0.185 0.000 1.136 167 T CB -0.307 68.496 68.868 -0.108 0.000 0.874 167 T HN 0.179 8.419 8.240 -0.000 0.000 0.466 168 L N 1.526 122.565 121.223 -0.306 0.000 1.976 168 L HA 0.009 4.348 4.340 -0.001 0.000 0.209 168 L C 2.342 178.964 176.870 -0.413 0.000 1.071 168 L CA 1.928 56.572 54.840 -0.328 0.000 0.746 168 L CB -0.538 41.352 42.059 -0.282 0.000 0.890 168 L HN -0.013 8.217 8.230 -0.000 0.000 0.432 169 K N -0.785 119.302 120.400 -0.521 0.000 2.089 169 K HA -0.273 4.046 4.320 -0.001 0.000 0.210 169 K C 2.128 178.523 176.600 -0.342 0.000 1.048 169 K CA 2.337 58.364 56.287 -0.432 0.000 0.926 169 K CB -0.171 32.060 32.500 -0.448 0.000 0.714 169 K HN 0.600 8.850 8.250 -0.000 0.000 0.448 170 Q N 0.032 119.650 119.800 -0.303 0.000 2.020 170 Q HA -0.191 4.149 4.340 -0.001 0.000 0.202 170 Q C 2.196 177.994 176.000 -0.336 0.000 0.982 170 Q CA 1.864 57.514 55.803 -0.255 0.000 0.838 170 Q CB -0.165 28.459 28.738 -0.190 0.000 0.899 170 Q HN 0.389 8.659 8.270 -0.000 0.000 0.423 171 M N 0.283 119.643 119.600 -0.399 0.000 2.082 171 M HA -0.234 4.246 4.480 -0.001 0.000 0.258 171 M C 1.709 177.386 176.300 -1.039 0.000 1.069 171 M CA 1.438 56.366 55.300 -0.619 0.000 1.102 171 M CB 0.010 32.271 32.600 -0.564 0.000 1.336 171 M HN 0.205 8.495 8.290 -0.000 0.000 0.404 172 L N 0.444 121.170 121.223 -0.829 0.000 2.141 172 L HA -0.148 4.191 4.340 -0.001 0.000 0.209 172 L C 2.350 178.851 176.870 -0.616 0.000 1.094 172 L CA 1.711 56.020 54.840 -0.886 0.000 0.763 172 L CB -0.892 40.876 42.059 -0.485 0.000 0.908 172 L HN 0.419 8.649 8.230 -0.000 0.000 0.437 173 Q N -1.400 118.149 119.800 -0.419 0.000 2.016 173 Q HA -0.163 4.176 4.340 -0.001 0.000 0.200 173 Q C 2.191 178.068 176.000 -0.205 0.000 0.978 173 Q CA 1.700 57.357 55.803 -0.244 0.000 0.833 173 Q CB -0.214 28.412 28.738 -0.187 0.000 0.895 173 Q HN 0.327 8.597 8.270 -0.000 0.000 0.427 174 V N 0.811 120.576 119.914 -0.248 0.000 2.453 174 V HA -0.259 3.861 4.120 -0.001 0.000 0.252 174 V C 1.853 177.944 176.094 -0.005 0.000 1.068 174 V CA 1.516 63.742 62.300 -0.124 0.000 1.070 174 V CB -0.716 31.034 31.823 -0.121 0.000 0.664 174 V HN 0.304 8.494 8.190 -0.000 0.000 0.461 175 F N -0.284 119.462 119.950 -0.340 0.000 2.408 175 F HA 0.101 4.627 4.527 -0.001 0.000 0.300 175 F C 1.069 176.703 175.800 -0.277 0.000 1.090 175 F CA 0.135 57.837 58.000 -0.496 0.000 1.427 175 F CB -0.832 37.473 39.000 -1.159 0.000 1.070 175 F HN 0.117 8.417 8.300 -0.000 0.000 0.549 176 L N -1.792 119.449 121.223 0.030 0.000 2.334 176 L HA 0.182 4.521 4.340 -0.001 0.000 0.273 176 L C 1.153 178.140 176.870 0.196 0.000 1.013 176 L CA -0.899 54.024 54.840 0.140 0.000 0.816 176 L CB 1.409 43.546 42.059 0.130 0.000 1.278 176 L HN -0.133 8.097 8.230 -0.000 0.000 0.431 177 Y N 1.222 121.612 120.300 0.149 0.000 2.130 177 Y HA -0.101 4.449 4.550 -0.001 0.000 0.287 177 Y C 1.213 177.178 175.900 0.109 0.000 1.124 177 Y CA 1.163 59.341 58.100 0.131 0.000 1.118 177 Y CB 0.208 38.766 38.460 0.163 0.000 0.994 177 Y HN 0.585 8.865 8.280 -0.000 0.000 0.497 178 D N 0.969 121.383 120.400 0.023 0.000 2.483 178 D HA 0.049 4.688 4.640 -0.001 0.000 0.220 178 D C 0.622 176.933 176.300 0.018 0.000 1.173 178 D CA 0.167 54.123 54.000 -0.074 0.000 0.964 178 D CB 0.546 41.368 40.800 0.037 0.000 1.046 178 D HN 0.495 8.865 8.370 -0.000 0.000 0.517 179 Q N 0.992 120.769 119.800 -0.038 0.000 2.308 179 Q HA -0.173 4.166 4.340 -0.001 0.000 0.209 179 Q C 1.758 177.772 176.000 0.024 0.000 0.985 179 Q CA 1.432 57.231 55.803 -0.007 0.000 0.881 179 Q CB 0.064 28.771 28.738 -0.052 0.000 0.917 179 Q HN 0.519 8.789 8.270 -0.000 0.000 0.443 180 S N 0.031 115.742 115.700 0.019 0.000 2.489 180 S HA -0.002 4.468 4.470 -0.001 0.000 0.228 180 S C 1.764 176.412 174.600 0.080 0.000 0.995 180 S CA 0.247 58.468 58.200 0.034 0.000 0.934 180 S CB -0.235 62.973 63.200 0.012 0.000 0.771 180 S HN 0.316 8.626 8.310 -0.000 0.000 0.522 181 L N 0.462 121.759 121.223 0.124 0.000 2.450 181 L HA 0.145 4.485 4.340 -0.001 0.000 0.224 181 L C 1.081 178.162 176.870 0.351 0.000 1.149 181 L CA 0.101 55.048 54.840 0.179 0.000 0.816 181 L CB -0.703 41.465 42.059 0.181 0.000 0.932 181 L HN 0.331 8.561 8.230 -0.000 0.000 0.449 182 I N 0.349 121.102 120.570 0.304 0.000 2.813 182 I HA -0.070 4.099 4.170 -0.001 0.000 0.287 182 I C 0.858 177.112 176.117 0.227 0.000 1.196 182 I CA 0.604 62.073 61.300 0.282 0.000 1.421 182 I CB 0.883 38.943 38.000 0.099 0.000 1.365 182 I HN 0.070 8.280 8.210 -0.000 0.000 0.591 183 T N 2.928 117.629 114.554 0.245 0.000 2.887 183 T HA 0.376 4.725 4.350 -0.001 0.000 0.288 183 T C 0.661 175.445 174.700 0.141 0.000 1.021 183 T CA -0.764 61.449 62.100 0.188 0.000 1.000 183 T CB 1.606 70.613 68.868 0.232 0.000 1.034 183 T HN 0.591 8.831 8.240 -0.000 0.000 0.467 184 E N 0.940 121.210 120.200 0.115 0.000 2.209 184 E HA -0.137 4.212 4.350 -0.001 0.000 0.196 184 E C 1.431 178.105 176.600 0.123 0.000 0.993 184 E CA 1.285 57.755 56.400 0.117 0.000 0.819 184 E CB 0.130 29.888 29.700 0.097 0.000 0.745 184 E HN 0.748 9.108 8.360 -0.000 0.000 0.477 185 E N 0.302 120.569 120.200 0.112 0.000 2.158 185 E HA -0.109 4.241 4.350 -0.001 0.000 0.191 185 E C 1.863 178.514 176.600 0.086 0.000 0.982 185 E CA 0.191 56.647 56.400 0.093 0.000 0.823 185 E CB -0.201 29.546 29.700 0.079 0.000 0.766 185 E HN 0.082 8.442 8.360 -0.000 0.000 0.468 186 L N 0.226 121.517 121.223 0.114 0.000 2.027 186 L HA -0.071 4.268 4.340 -0.001 0.000 0.206 186 L C 1.858 178.775 176.870 0.078 0.000 1.074 186 L CA 1.515 56.410 54.840 0.091 0.000 0.745 186 L CB -0.458 41.691 42.059 0.150 0.000 0.898 186 L HN 0.155 8.385 8.230 -0.000 0.000 0.433 187 L N -0.885 120.391 121.223 0.089 0.000 1.970 187 L HA -0.242 4.098 4.340 -0.001 0.000 0.212 187 L C 2.758 179.746 176.870 0.196 0.000 1.071 187 L CA 1.303 56.188 54.840 0.075 0.000 0.751 187 L CB -0.634 41.452 42.059 0.043 0.000 0.889 187 L HN 0.342 8.572 8.230 -0.000 0.000 0.432 188 Q N -0.364 119.581 119.800 0.240 0.000 2.135 188 Q HA -0.181 4.158 4.340 -0.001 0.000 0.204 188 Q C 2.179 178.299 176.000 0.199 0.000 0.981 188 Q CA 1.748 57.718 55.803 0.279 0.000 0.856 188 Q CB -0.710 28.142 28.738 0.190 0.000 0.902 188 Q HN 0.631 8.901 8.270 -0.000 0.000 0.425 189 G N 1.049 109.919 108.800 0.117 0.000 2.421 189 G HA2 -0.250 3.710 3.960 -0.001 0.000 0.216 189 G HA3 -0.250 3.710 3.960 -0.001 0.000 0.216 189 G C 1.549 176.495 174.900 0.077 0.000 1.171 189 G CA 0.286 45.425 45.100 0.065 0.000 0.775 189 G HN 0.176 8.466 8.290 -0.000 0.000 0.543 190 R N -0.387 120.174 120.500 0.101 0.000 2.096 190 R HA -0.062 4.277 4.340 -0.001 0.000 0.235 190 R C 2.168 178.564 176.300 0.160 0.000 1.127 190 R CA 0.857 57.019 56.100 0.103 0.000 0.968 190 R CB -0.903 29.454 30.300 0.094 0.000 0.861 190 R HN 0.697 8.967 8.270 -0.000 0.000 0.440 191 W N 2.069 123.382 121.300 0.022 0.000 2.379 191 W HA -0.185 4.474 4.660 -0.001 0.000 0.307 191 W C 1.357 177.895 176.519 0.033 0.000 1.200 191 W CA 1.144 58.521 57.345 0.054 0.000 1.297 191 W CB 0.079 29.649 29.460 0.183 0.000 1.140 191 W HN 0.197 8.377 8.180 -0.000 0.000 0.507 192 E N 0.450 120.601 120.200 -0.080 0.000 2.085 192 E HA -0.217 4.133 4.350 -0.001 0.000 0.194 192 E C 2.366 178.855 176.600 -0.185 0.000 0.994 192 E CA 1.580 57.870 56.400 -0.184 0.000 0.801 192 E CB -0.502 29.157 29.700 -0.069 0.000 0.743 192 E HN 0.245 8.605 8.360 -0.000 0.000 0.453 193 A N 1.017 123.781 122.820 -0.094 0.000 1.902 193 A HA -0.179 4.141 4.320 -0.001 0.000 0.217 193 A C 2.174 179.696 177.584 -0.104 0.000 1.181 193 A CA 1.124 53.122 52.037 -0.065 0.000 0.623 193 A CB -0.580 18.422 19.000 0.002 0.000 0.818 193 A HN 0.140 8.290 8.150 -0.000 0.000 0.443 194 I N -0.668 119.810 120.570 -0.155 0.000 2.142 194 I HA -0.326 3.843 4.170 -0.001 0.000 0.240 194 I C 2.832 178.744 176.117 -0.342 0.000 1.078 194 I CA 1.691 62.860 61.300 -0.218 0.000 1.343 194 I CB -0.452 37.426 38.000 -0.203 0.000 1.046 194 I HN 0.415 8.625 8.210 -0.000 0.000 0.405 195 Q N 0.333 119.792 119.800 -0.569 0.000 2.119 195 Q HA -0.156 4.183 4.340 -0.001 0.000 0.201 195 Q C 2.253 178.075 176.000 -0.297 0.000 0.972 195 Q CA 1.241 56.734 55.803 -0.516 0.000 0.847 195 Q CB -0.046 28.280 28.738 -0.687 0.000 0.903 195 Q HN 0.488 8.758 8.270 -0.000 0.000 0.433 196 R N -0.100 120.252 120.500 -0.247 0.000 2.275 196 R HA -0.013 4.326 4.340 -0.001 0.000 0.199 196 R C 0.171 176.371 176.300 -0.168 0.000 0.989 196 R CA 0.508 56.503 56.100 -0.176 0.000 1.016 196 R CB 0.353 30.567 30.300 -0.143 0.000 0.918 196 R HN 0.080 8.350 8.270 -0.000 0.000 0.473 197 Q N -0.592 119.101 119.800 -0.180 0.000 3.230 197 Q HA 0.157 4.496 4.340 -0.001 0.000 0.303 197 Q C -2.109 173.768 176.000 -0.204 0.000 0.884 197 Q CA -1.325 54.328 55.803 -0.250 0.000 0.859 197 Q CB 1.595 30.130 28.738 -0.339 0.000 1.432 197 Q HN -0.034 8.236 8.270 -0.000 0.000 0.403 198 P HA -0.228 4.192 4.420 -0.000 0.000 0.218 198 P C 0.993 178.272 177.300 -0.035 0.000 1.149 198 P CA 1.232 64.282 63.100 -0.082 0.000 0.817 198 P CB 0.416 32.070 31.700 -0.077 0.000 0.785 199 E N -0.103 120.046 120.200 -0.084 0.000 2.209 199 E HA -0.239 4.110 4.350 -0.001 0.000 0.196 199 E C 1.628 178.278 176.600 0.084 0.000 0.993 199 E CA 1.378 57.764 56.400 -0.022 0.000 0.819 199 E CB -1.334 28.335 29.700 -0.051 0.000 0.745 199 E HN 0.339 8.699 8.360 -0.000 0.000 0.477 200 H N 0.654 119.749 119.070 0.041 0.000 2.353 200 H HA 0.007 4.563 4.556 -0.001 0.000 0.300 200 H C 2.196 177.599 175.328 0.126 0.000 1.090 200 H CA 1.230 57.300 56.048 0.037 0.000 1.327 200 H CB -0.263 29.466 29.762 -0.054 0.000 1.383 200 H HN 0.128 8.408 8.280 -0.000 0.000 0.508 201 L N 0.543 121.945 121.223 0.299 0.000 2.046 201 L HA -0.134 4.206 4.340 -0.001 0.000 0.208 201 L C 2.466 179.538 176.870 0.336 0.000 1.077 201 L CA 1.560 56.671 54.840 0.451 0.000 0.747 201 L CB -0.422 41.812 42.059 0.291 0.000 0.896 201 L HN 0.087 8.317 8.230 -0.000 0.000 0.432 202 K N -0.532 119.999 120.400 0.218 0.000 2.116 202 K HA -0.056 4.263 4.320 -0.001 0.000 0.203 202 K C 1.894 178.586 176.600 0.154 0.000 1.052 202 K CA 0.978 57.365 56.287 0.168 0.000 0.952 202 K CB -0.055 32.514 32.500 0.115 0.000 0.729 202 K HN 0.178 8.428 8.250 -0.000 0.000 0.446 203 N N -0.078 118.722 118.700 0.166 0.000 2.244 203 N HA -0.122 4.618 4.740 -0.001 0.000 0.183 203 N C 1.447 177.033 175.510 0.127 0.000 1.016 203 N CA 0.857 53.994 53.050 0.145 0.000 0.866 203 N CB -0.303 38.292 38.487 0.180 0.000 0.980 203 N HN 0.173 8.553 8.380 -0.000 0.000 0.430 204 F N 1.573 121.508 119.950 -0.024 0.000 2.095 204 F HA -0.080 4.446 4.527 -0.001 0.000 0.298 204 F C 2.000 177.724 175.800 -0.125 0.000 1.104 204 F CA 1.186 59.092 58.000 -0.157 0.000 1.232 204 F CB -0.147 38.547 39.000 -0.511 0.000 0.987 204 F HN -0.060 8.240 8.300 -0.000 0.000 0.475 205 L N -0.276 121.019 121.223 0.121 0.000 2.093 205 L HA -0.215 4.125 4.340 -0.001 0.000 0.208 205 L C 2.391 179.298 176.870 0.062 0.000 1.085 205 L CA 1.152 56.072 54.840 0.133 0.000 0.755 205 L CB -0.650 41.524 42.059 0.191 0.000 0.904 205 L HN 0.183 8.413 8.230 -0.000 0.000 0.435 206 I N -0.731 119.871 120.570 0.053 0.000 2.179 206 I HA -0.288 3.882 4.170 -0.001 0.000 0.242 206 I C 2.627 178.743 176.117 -0.002 0.000 1.088 206 I CA 1.208 62.528 61.300 0.034 0.000 1.357 206 I CB -0.277 37.751 38.000 0.047 0.000 1.051 206 I HN 0.172 8.382 8.210 -0.000 0.000 0.409 207 S N 0.802 116.476 115.700 -0.043 0.000 2.356 207 S HA -0.189 4.281 4.470 -0.001 0.000 0.223 207 S C 2.263 176.819 174.600 -0.073 0.000 1.032 207 S CA 1.426 59.583 58.200 -0.072 0.000 1.005 207 S CB -0.432 62.687 63.200 -0.134 0.000 0.867 207 S HN 0.555 8.865 8.310 -0.000 0.000 0.449 208 A N 1.338 124.077 122.820 -0.136 0.000 1.933 208 A HA -0.129 4.190 4.320 -0.001 0.000 0.218 208 A C 2.145 179.728 177.584 -0.001 0.000 1.175 208 A CA 1.135 53.140 52.037 -0.053 0.000 0.628 208 A CB -0.527 18.473 19.000 -0.001 0.000 0.814 208 A HN 0.328 8.478 8.150 -0.000 0.000 0.444 209 Q N 0.111 119.912 119.800 0.002 0.000 2.096 209 Q HA -0.185 4.155 4.340 -0.001 0.000 0.204 209 Q C 1.871 177.874 176.000 0.004 0.000 0.982 209 Q CA 1.933 57.737 55.803 0.002 0.000 0.850 209 Q CB -0.319 28.425 28.738 0.010 0.000 0.901 209 Q HN 0.757 9.027 8.270 -0.000 0.000 0.422 210 K N -0.553 119.852 120.400 0.008 0.000 2.288 210 K HA 0.074 4.393 4.320 -0.001 0.000 0.201 210 K C 0.472 177.089 176.600 0.028 0.000 1.048 210 K CA 0.868 57.162 56.287 0.013 0.000 0.956 210 K CB 0.411 32.916 32.500 0.008 0.000 0.746 210 K HN 0.022 8.272 8.250 -0.000 0.000 0.461 211 A N 1.724 124.574 122.820 0.049 0.000 3.124 211 A HA 0.305 4.624 4.320 -0.001 0.000 0.295 211 A C -2.827 174.840 177.584 0.139 0.000 1.199 211 A CA -1.260 50.839 52.037 0.103 0.000 0.845 211 A CB 0.315 19.392 19.000 0.129 0.000 1.381 211 A HN -0.120 8.030 8.150 -0.000 0.000 0.537 212 P HA 0.014 4.434 4.420 -0.000 0.000 0.271 212 P C 1.261 178.494 177.300 -0.112 0.000 1.238 212 P CA -0.358 62.722 63.100 -0.034 0.000 0.794 212 P CB 0.669 32.339 31.700 -0.051 0.000 0.959 213 L N 0.781 121.805 121.223 -0.331 0.000 2.187 213 L HA -0.154 4.185 4.340 -0.001 0.000 0.213 213 L C 2.129 178.808 176.870 -0.317 0.000 1.100 213 L CA 2.433 56.841 54.840 -0.720 0.000 0.765 213 L CB -1.527 40.201 42.059 -0.552 0.000 0.904 213 L HN 0.459 8.689 8.230 -0.000 0.000 0.437 214 S N -1.311 114.320 115.700 -0.115 0.000 2.423 214 S HA -0.148 4.321 4.470 -0.001 0.000 0.231 214 S C 1.857 176.504 174.600 0.079 0.000 1.014 214 S CA 1.352 59.547 58.200 -0.008 0.000 0.965 214 S CB -0.810 62.381 63.200 -0.014 0.000 0.785 214 S HN 0.590 8.900 8.310 -0.000 0.000 0.495 215 T N -3.227 111.407 114.554 0.133 0.000 3.072 215 T HA 0.013 4.362 4.350 -0.001 0.000 0.266 215 T C 0.987 175.886 174.700 0.332 0.000 1.127 215 T CA 0.268 62.490 62.100 0.205 0.000 1.107 215 T CB -0.626 68.364 68.868 0.204 0.000 0.910 215 T HN 0.538 8.778 8.240 -0.000 0.000 0.513 216 W N 2.058 123.378 121.300 0.033 0.000 2.937 216 W HA 0.382 5.042 4.660 -0.001 0.000 0.245 216 W C 0.436 176.980 176.519 0.041 0.000 1.306 216 W CA -1.448 55.924 57.345 0.044 0.000 1.470 216 W CB -0.812 28.688 29.460 0.067 0.000 1.132 216 W HN 0.238 8.418 8.180 -0.000 0.000 0.675 217 D N 0.680 121.224 120.400 0.241 0.000 2.338 217 D HA 0.104 4.743 4.640 -0.001 0.000 0.255 217 D C 0.799 177.158 176.300 0.098 0.000 1.237 217 D CA 0.167 54.251 54.000 0.140 0.000 0.883 217 D CB 1.124 41.975 40.800 0.086 0.000 1.087 217 D HN 0.012 8.382 8.370 -0.000 0.000 0.485 218 V N 1.319 121.285 119.914 0.086 0.000 3.121 218 V HA 0.144 4.264 4.120 -0.001 0.000 0.344 218 V C 1.692 177.811 176.094 0.043 0.000 1.390 218 V CA -0.283 62.053 62.300 0.059 0.000 1.177 218 V CB -0.236 31.622 31.823 0.060 0.000 1.163 218 V HN 0.392 8.582 8.190 -0.000 0.000 0.484 219 T N 2.078 116.651 114.554 0.031 0.000 2.699 219 T HA -0.217 4.132 4.350 -0.001 0.000 0.268 219 T C 2.076 176.789 174.700 0.023 0.000 1.036 219 T CA 2.498 64.609 62.100 0.018 0.000 1.147 219 T CB -0.294 68.570 68.868 -0.006 0.000 0.862 219 T HN 0.824 9.064 8.240 -0.000 0.000 0.446 220 A N 1.011 123.843 122.820 0.019 0.000 2.178 220 A HA -0.065 4.255 4.320 -0.001 0.000 0.218 220 A C 2.163 179.758 177.584 0.018 0.000 1.157 220 A CA 1.123 53.169 52.037 0.016 0.000 0.689 220 A CB -0.309 18.698 19.000 0.011 0.000 0.787 220 A HN 0.479 8.629 8.150 -0.000 0.000 0.465 221 R N -1.113 119.400 120.500 0.021 0.000 2.437 221 R HA 0.357 4.697 4.340 -0.001 0.000 0.257 221 R C 1.164 177.481 176.300 0.028 0.000 0.927 221 R CA -0.191 55.920 56.100 0.018 0.000 1.078 221 R CB -0.018 30.285 30.300 0.006 0.000 1.161 221 R HN 0.409 8.679 8.270 -0.000 0.000 0.529 222 L N 0.057 121.303 121.223 0.040 0.000 2.127 222 L HA -0.094 4.245 4.340 -0.001 0.000 0.211 222 L C 2.285 179.188 176.870 0.056 0.000 1.089 222 L CA 1.498 56.371 54.840 0.054 0.000 0.757 222 L CB -0.559 41.538 42.059 0.065 0.000 0.899 222 L HN 0.352 8.582 8.230 -0.000 0.000 0.434 223 G N -0.221 108.609 108.800 0.049 0.000 2.501 223 G HA2 -0.217 3.743 3.960 -0.001 0.000 0.220 223 G HA3 -0.217 3.743 3.960 -0.001 0.000 0.220 223 G C 1.335 176.259 174.900 0.039 0.000 1.114 223 G CA 0.470 45.599 45.100 0.048 0.000 0.757 223 G HN 0.495 8.785 8.290 -0.000 0.000 0.559 224 E N -0.311 119.907 120.200 0.031 0.000 2.299 224 E HA 0.113 4.463 4.350 -0.001 0.000 0.193 224 E C 0.523 177.142 176.600 0.031 0.000 0.998 224 E CA -0.368 56.045 56.400 0.022 0.000 0.851 224 E CB 0.203 29.905 29.700 0.005 0.000 0.795 224 E HN 0.391 8.751 8.360 -0.000 0.000 0.492 225 I N 2.872 123.469 120.570 0.045 0.000 2.769 225 I HA -0.135 4.035 4.170 -0.001 0.000 0.285 225 I C 1.192 177.349 176.117 0.067 0.000 1.173 225 I CA 0.713 62.051 61.300 0.063 0.000 1.389 225 I CB 0.386 38.435 38.000 0.081 0.000 1.404 225 I HN -0.008 8.202 8.210 -0.000 0.000 0.544 226 K N 5.473 125.913 120.400 0.067 0.000 2.358 226 K HA 0.266 4.586 4.320 -0.001 0.000 0.197 226 K C 0.647 177.300 176.600 0.087 0.000 1.025 226 K CA -0.106 56.222 56.287 0.068 0.000 1.104 226 K CB 0.461 32.992 32.500 0.052 0.000 0.855 226 K HN 0.674 8.924 8.250 -0.000 0.000 0.531 227 A N 2.420 125.306 122.820 0.110 0.000 2.425 227 A HA 0.080 4.400 4.320 -0.001 0.000 0.249 227 A C 0.020 177.696 177.584 0.153 0.000 1.084 227 A CA -0.185 51.935 52.037 0.139 0.000 0.781 227 A CB 0.161 19.265 19.000 0.172 0.000 1.019 227 A HN 0.191 8.341 8.150 -0.000 0.000 0.490 228 K N 1.599 122.098 120.400 0.165 0.000 2.416 228 K HA 0.253 4.572 4.320 -0.001 0.000 0.283 228 K C -0.672 176.143 176.600 0.358 0.000 1.037 228 K CA 0.499 56.913 56.287 0.211 0.000 0.995 228 K CB 0.178 32.762 32.500 0.139 0.000 0.938 228 K HN 0.633 8.883 8.250 -0.000 0.000 0.475 229 T N 4.779 119.513 114.554 0.301 0.000 2.841 229 T HA 0.357 4.706 4.350 -0.001 0.000 0.283 229 T C -1.489 173.260 174.700 0.081 0.000 1.000 229 T CA -0.514 61.713 62.100 0.213 0.000 0.977 229 T CB 0.583 69.541 68.868 0.149 0.000 0.979 229 T HN 0.410 8.650 8.240 -0.000 0.000 0.446 230 F N 4.356 124.090 119.950 -0.360 0.000 2.434 230 F HA 0.620 5.147 4.527 -0.001 0.000 0.355 230 F C -1.176 174.476 175.800 -0.245 0.000 1.115 230 F CA -2.141 55.484 58.000 -0.625 0.000 1.010 230 F CB 0.150 38.226 39.000 -1.541 0.000 1.234 230 F HN 0.433 8.733 8.300 -0.000 0.000 0.439 231 I N 4.893 125.443 120.570 -0.033 0.000 2.412 231 I HA 0.456 4.626 4.170 -0.001 0.000 0.296 231 I C -0.105 175.948 176.117 -0.106 0.000 0.987 231 I CA -0.563 60.719 61.300 -0.030 0.000 1.180 231 I CB 2.198 40.281 38.000 0.138 0.000 1.340 231 I HN 0.629 8.839 8.210 -0.000 0.000 0.455 232 T N 1.706 116.238 114.554 -0.037 0.000 2.893 232 T HA 0.503 4.852 4.350 -0.001 0.000 0.293 232 T C -1.253 173.625 174.700 0.297 0.000 1.027 232 T CA -0.736 61.433 62.100 0.115 0.000 0.988 232 T CB 2.036 70.985 68.868 0.135 0.000 1.043 232 T HN 0.571 8.811 8.240 -0.000 0.000 0.461 233 W N 1.238 122.665 121.300 0.212 0.000 3.138 233 W HA 0.581 5.241 4.660 -0.001 0.000 0.331 233 W C 0.073 176.753 176.519 0.270 0.000 1.166 233 W CA -0.998 56.464 57.345 0.195 0.000 1.212 233 W CB 2.335 31.871 29.460 0.126 0.000 1.399 233 W HN 1.221 9.401 8.180 -0.000 0.000 0.514 234 G N 3.079 112.084 108.800 0.341 0.000 2.364 234 G HA2 0.113 4.072 3.960 -0.001 0.000 0.267 234 G HA3 0.113 4.072 3.960 -0.001 0.000 0.267 234 G C 0.792 175.906 174.900 0.357 0.000 1.233 234 G CA -0.333 44.953 45.100 0.310 0.000 0.885 234 G HN 0.708 8.998 8.290 -0.000 0.000 0.490 235 R N 1.541 122.166 120.500 0.208 0.000 2.117 235 R HA -0.102 4.237 4.340 -0.001 0.000 0.243 235 R C 0.327 176.700 176.300 0.121 0.000 1.143 235 R CA 1.599 57.767 56.100 0.113 0.000 0.968 235 R CB 0.126 30.424 30.300 -0.002 0.000 0.863 235 R HN 0.546 8.816 8.270 -0.000 0.000 0.444 236 D N 0.836 121.315 120.400 0.131 0.000 2.738 236 D HA 0.007 4.646 4.640 -0.001 0.000 0.246 236 D C -0.748 175.686 176.300 0.224 0.000 1.270 236 D CA -0.041 54.049 54.000 0.149 0.000 0.833 236 D CB 0.160 41.033 40.800 0.120 0.000 1.040 236 D HN 0.177 8.547 8.370 -0.000 0.000 0.487 237 D N 1.029 121.599 120.400 0.285 0.000 2.339 237 D HA 0.048 4.688 4.640 -0.001 0.000 0.256 237 D C 0.742 177.210 176.300 0.280 0.000 1.214 237 D CA -0.140 54.057 54.000 0.329 0.000 0.877 237 D CB 0.648 41.742 40.800 0.490 0.000 1.111 237 D HN 0.004 8.374 8.370 -0.000 0.000 0.478 238 R N 3.113 123.763 120.500 0.250 0.000 2.426 238 R HA 0.108 4.447 4.340 -0.001 0.000 0.263 238 R C 0.472 176.922 176.300 0.251 0.000 0.961 238 R CA -0.159 56.070 56.100 0.215 0.000 1.086 238 R CB 0.267 30.673 30.300 0.176 0.000 1.186 238 R HN 0.404 8.674 8.270 -0.000 0.000 0.537 239 F N 0.121 120.093 119.950 0.036 0.000 2.577 239 F HA 0.165 4.691 4.527 -0.001 0.000 0.276 239 F C 0.153 175.920 175.800 -0.055 0.000 1.032 239 F CA -0.102 57.847 58.000 -0.084 0.000 1.297 239 F CB 1.004 39.749 39.000 -0.424 0.000 1.061 239 F HN -0.262 8.038 8.300 -0.000 0.000 0.680 240 V N -0.379 119.604 119.914 0.116 0.000 2.876 240 V HA 0.639 4.759 4.120 -0.001 0.000 0.312 240 V C -2.953 173.399 176.094 0.429 0.000 1.085 240 V CA -2.415 59.998 62.300 0.189 0.000 0.945 240 V CB 1.457 33.442 31.823 0.271 0.000 1.017 240 V HN -0.014 8.176 8.190 -0.000 0.000 0.428 241 P HA 0.259 4.679 4.420 -0.000 0.000 0.284 241 P C 0.571 177.751 177.300 -0.199 0.000 1.253 241 P CA -0.382 62.729 63.100 0.019 0.000 0.800 241 P CB 2.087 33.653 31.700 -0.224 0.000 0.961 242 L N 3.526 124.575 121.223 -0.291 0.000 2.129 242 L HA -0.192 4.147 4.340 -0.001 0.000 0.212 242 L C 1.791 178.227 176.870 -0.723 0.000 1.087 242 L CA 2.156 56.515 54.840 -0.802 0.000 0.757 242 L CB -1.290 40.569 42.059 -0.334 0.000 0.896 242 L HN 0.426 8.656 8.230 -0.000 0.000 0.434 243 D N -2.508 117.697 120.400 -0.324 0.000 2.264 243 D HA -0.255 4.385 4.640 -0.001 0.000 0.208 243 D C 1.720 177.979 176.300 -0.068 0.000 0.966 243 D CA 1.326 55.267 54.000 -0.098 0.000 0.864 243 D CB -0.746 40.167 40.800 0.188 0.000 0.933 243 D HN 0.617 8.987 8.370 -0.000 0.000 0.499 244 H N 0.370 119.245 119.070 -0.324 0.000 2.489 244 H HA 0.021 4.576 4.556 -0.001 0.000 0.293 244 H C 2.264 177.359 175.328 -0.388 0.000 1.066 244 H CA 0.598 56.507 56.048 -0.232 0.000 1.305 244 H CB 0.130 29.901 29.762 0.015 0.000 1.386 244 H HN 0.317 8.597 8.280 -0.000 0.000 0.551 245 G N 0.436 108.776 108.800 -0.767 0.000 2.448 245 G HA2 -0.142 3.817 3.960 -0.001 0.000 0.218 245 G HA3 -0.142 3.817 3.960 -0.001 0.000 0.218 245 G C 1.584 176.449 174.900 -0.059 0.000 1.135 245 G CA 0.161 45.073 45.100 -0.313 0.000 0.784 245 G HN 0.237 8.527 8.290 -0.000 0.000 0.543 246 L N -0.082 121.116 121.223 -0.042 0.000 2.072 246 L HA 0.037 4.376 4.340 -0.001 0.000 0.205 246 L C 2.719 179.731 176.870 0.237 0.000 1.079 246 L CA 1.187 56.089 54.840 0.104 0.000 0.752 246 L CB -0.361 41.820 42.059 0.202 0.000 0.906 246 L HN 0.178 8.408 8.230 -0.000 0.000 0.436 247 K N 0.840 121.355 120.400 0.192 0.000 2.059 247 K HA -0.231 4.088 4.320 -0.001 0.000 0.212 247 K C 2.080 178.782 176.600 0.171 0.000 1.050 247 K CA 1.677 58.073 56.287 0.181 0.000 0.927 247 K CB -0.134 32.417 32.500 0.085 0.000 0.714 247 K HN 0.206 8.456 8.250 -0.000 0.000 0.447 248 L N 0.334 121.641 121.223 0.140 0.000 2.072 248 L HA -0.139 4.200 4.340 -0.001 0.000 0.205 248 L C 2.408 179.340 176.870 0.103 0.000 1.079 248 L CA 0.360 55.281 54.840 0.135 0.000 0.752 248 L CB -0.439 41.723 42.059 0.172 0.000 0.906 248 L HN 0.202 8.432 8.230 -0.000 0.000 0.436 249 L N -0.813 120.441 121.223 0.052 0.000 2.043 249 L HA -0.215 4.125 4.340 -0.001 0.000 0.212 249 L C 2.083 178.888 176.870 -0.109 0.000 1.075 249 L CA 2.017 56.811 54.840 -0.076 0.000 0.752 249 L CB -0.559 41.377 42.059 -0.205 0.000 0.891 249 L HN 0.210 8.440 8.230 -0.000 0.000 0.432 250 W N -0.827 120.496 121.300 0.037 0.000 2.518 250 W HA -0.035 4.624 4.660 -0.001 0.000 0.273 250 W C 2.242 178.780 176.519 0.032 0.000 1.247 250 W CA 0.606 57.969 57.345 0.030 0.000 1.288 250 W CB -0.062 29.412 29.460 0.023 0.000 1.107 250 W HN 0.171 8.351 8.180 -0.000 0.000 0.586 251 N N -0.332 118.508 118.700 0.233 0.000 2.282 251 N HA 0.163 4.902 4.740 -0.001 0.000 0.185 251 N C -0.081 175.499 175.510 0.116 0.000 1.099 251 N CA 0.428 53.575 53.050 0.161 0.000 0.878 251 N CB 0.662 39.226 38.487 0.128 0.000 0.993 251 N HN 0.039 8.419 8.380 -0.000 0.000 0.481 252 I N 0.536 121.170 120.570 0.106 0.000 2.392 252 I HA 0.050 4.219 4.170 -0.001 0.000 0.295 252 I C 1.367 177.531 176.117 0.078 0.000 0.985 252 I CA -0.401 60.953 61.300 0.089 0.000 1.221 252 I CB 2.014 40.070 38.000 0.093 0.000 1.366 252 I HN -0.143 8.067 8.210 -0.000 0.000 0.467 253 D N 3.051 123.495 120.400 0.074 0.000 2.106 253 D HA -0.232 4.407 4.640 -0.001 0.000 0.191 253 D C 0.542 176.876 176.300 0.057 0.000 0.997 253 D CA 1.643 55.681 54.000 0.064 0.000 0.834 253 D CB 0.274 41.110 40.800 0.060 0.000 0.956 253 D HN 0.509 8.879 8.370 -0.000 0.000 0.448 254 D N -0.479 119.962 120.400 0.068 0.000 2.412 254 D HA 0.507 5.146 4.640 -0.001 0.000 0.276 254 D C -1.414 174.940 176.300 0.091 0.000 1.196 254 D CA -0.451 53.591 54.000 0.070 0.000 0.905 254 D CB 0.606 41.452 40.800 0.076 0.000 1.081 254 D HN 0.198 8.568 8.370 -0.000 0.000 0.502 255 A N 2.677 125.535 122.820 0.063 0.000 2.386 255 A HA 0.970 5.289 4.320 -0.001 0.000 0.308 255 A C -0.487 177.122 177.584 0.042 0.000 1.128 255 A CA -0.805 51.273 52.037 0.068 0.000 0.789 255 A CB 1.779 20.812 19.000 0.055 0.000 1.325 255 A HN 0.456 8.606 8.150 -0.000 0.000 0.437 256 R N 0.219 120.759 120.500 0.067 0.000 2.739 256 R HA 0.760 5.100 4.340 -0.001 0.000 0.271 256 R C -2.372 173.998 176.300 0.117 0.000 1.010 256 R CA -0.680 55.454 56.100 0.058 0.000 0.897 256 R CB 0.904 31.236 30.300 0.053 0.000 1.236 256 R HN 0.988 9.258 8.270 -0.000 0.000 0.466 257 L N 0.454 121.725 121.223 0.080 0.000 2.386 257 L HA 0.578 4.918 4.340 -0.001 0.000 0.271 257 L C -1.580 175.340 176.870 0.084 0.000 0.993 257 L CA -0.451 54.440 54.840 0.085 0.000 0.819 257 L CB 2.029 44.097 42.059 0.014 0.000 1.294 257 L HN 0.871 9.101 8.230 -0.000 0.000 0.414 258 H N 3.065 122.117 119.070 -0.030 0.000 2.744 258 H HA 0.744 5.299 4.556 -0.001 0.000 0.339 258 H C -1.641 173.538 175.328 -0.249 0.000 1.004 258 H CA -0.577 55.374 56.048 -0.161 0.000 1.257 258 H CB 1.722 31.375 29.762 -0.182 0.000 1.552 258 H HN 0.505 8.785 8.280 -0.000 0.000 0.522 259 V N 6.244 125.898 119.914 -0.432 0.000 2.459 259 V HA 0.314 4.433 4.120 -0.001 0.000 0.295 259 V C -0.653 175.233 176.094 -0.346 0.000 1.029 259 V CA -0.605 61.586 62.300 -0.181 0.000 0.874 259 V CB 0.849 32.626 31.823 -0.076 0.000 0.985 259 V HN 0.574 8.764 8.190 -0.000 0.000 0.438 260 F N 1.945 121.904 119.950 0.015 0.000 2.421 260 F HA 0.540 5.067 4.527 -0.001 0.000 0.337 260 F C 0.823 176.517 175.800 -0.177 0.000 1.105 260 F CA -0.250 57.687 58.000 -0.106 0.000 1.049 260 F CB 1.777 40.610 39.000 -0.280 0.000 1.139 260 F HN 0.443 8.743 8.300 -0.000 0.000 0.479 261 S N 2.137 117.825 115.700 -0.019 0.000 2.601 261 S HA 0.304 4.773 4.470 -0.001 0.000 0.271 261 S C -0.147 174.384 174.600 -0.117 0.000 1.305 261 S CA -0.576 57.579 58.200 -0.075 0.000 1.022 261 S CB 0.182 63.353 63.200 -0.048 0.000 0.940 261 S HN 0.658 8.968 8.310 -0.000 0.000 0.525 262 K N 0.602 120.826 120.400 -0.293 0.000 3.393 262 K HA -0.177 4.143 4.320 -0.001 0.000 0.272 262 K C -0.931 175.725 176.600 0.093 0.000 1.004 262 K CA 0.452 56.433 56.287 -0.510 0.000 0.764 262 K CB -2.244 30.177 32.500 -0.133 0.000 1.373 262 K HN 0.520 8.770 8.250 -0.000 0.000 0.458 263 C N 0.120 119.445 119.300 0.041 0.000 2.705 263 C HA 0.526 4.986 4.460 -0.001 0.000 0.369 263 C C 1.272 176.397 174.990 0.224 0.000 1.069 263 C CA -0.034 59.116 59.018 0.220 0.000 1.260 263 C CB 0.687 28.398 27.740 -0.049 0.000 1.764 263 C HN 0.737 8.967 8.230 -0.000 0.000 0.469 264 G N 2.513 111.490 108.800 0.295 0.000 2.447 264 G HA2 0.123 4.083 3.960 -0.001 0.000 0.269 264 G HA3 0.123 4.083 3.960 -0.001 0.000 0.269 264 G C 0.864 175.860 174.900 0.161 0.000 1.455 264 G CA 0.786 46.025 45.100 0.233 0.000 1.061 264 G HN 1.012 9.302 8.290 -0.000 0.000 0.545 265 H N -1.154 117.903 119.070 -0.021 0.000 2.353 265 H HA -0.053 4.502 4.556 -0.001 0.000 0.300 265 H C 0.603 175.868 175.328 -0.104 0.000 1.090 265 H CA 0.891 56.849 56.048 -0.150 0.000 1.327 265 H CB -0.049 29.436 29.762 -0.461 0.000 1.383 265 H HN 0.314 8.594 8.280 -0.000 0.000 0.508 266 W N 1.365 122.445 121.300 -0.366 0.000 1.836 266 W HA 0.422 5.081 4.660 -0.001 0.000 0.449 266 W C 1.156 177.488 176.519 -0.311 0.000 0.787 266 W CA -0.090 56.991 57.345 -0.441 0.000 1.729 266 W CB -1.237 28.062 29.460 -0.269 0.000 1.802 266 W HN 0.368 8.548 8.180 -0.000 0.000 0.257 267 A N 2.027 124.705 122.820 -0.237 0.000 1.972 267 A HA -0.238 4.082 4.320 -0.001 0.000 0.219 267 A C 2.156 179.391 177.584 -0.582 0.000 1.169 267 A CA 1.621 53.428 52.037 -0.383 0.000 0.635 267 A CB -0.196 18.509 19.000 -0.492 0.000 0.810 267 A HN 0.462 8.612 8.150 -0.000 0.000 0.446 268 Q N -1.739 117.521 119.800 -0.899 0.000 2.297 268 Q HA -0.175 4.164 4.340 -0.001 0.000 0.204 268 Q C 1.703 177.366 176.000 -0.561 0.000 0.962 268 Q CA 1.603 56.655 55.803 -1.252 0.000 0.879 268 Q CB -0.560 27.274 28.738 -1.506 0.000 0.947 268 Q HN 0.837 9.107 8.270 -0.000 0.000 0.462 269 W N 1.142 122.101 121.300 -0.569 0.000 2.699 269 W HA 0.207 4.866 4.660 -0.001 0.000 0.267 269 W C 2.030 178.406 176.519 -0.239 0.000 1.182 269 W CA 0.726 57.799 57.345 -0.454 0.000 1.453 269 W CB 0.548 29.680 29.460 -0.546 0.000 1.054 269 W HN 0.211 8.391 8.180 -0.000 0.000 0.595 270 E N -1.236 119.080 120.200 0.193 0.000 2.158 270 E HA -0.131 4.218 4.350 -0.001 0.000 0.191 270 E C 0.401 176.864 176.600 -0.229 0.000 0.982 270 E CA 0.868 57.330 56.400 0.103 0.000 0.823 270 E CB -0.158 29.793 29.700 0.418 0.000 0.766 270 E HN 0.232 8.592 8.360 -0.000 0.000 0.468 271 H N -0.722 118.226 119.070 -0.203 0.000 2.500 271 H HA 0.310 4.865 4.556 -0.001 0.000 0.243 271 H C 0.635 175.840 175.328 -0.206 0.000 1.318 271 H CA 0.200 56.118 56.048 -0.217 0.000 1.077 271 H CB 1.166 30.741 29.762 -0.311 0.000 1.748 271 H HN 0.178 8.458 8.280 -0.000 0.000 0.556 272 A N 1.125 123.838 122.820 -0.179 0.000 1.883 272 A HA -0.219 4.101 4.320 -0.001 0.000 0.217 272 A C 1.722 179.334 177.584 0.047 0.000 1.186 272 A CA 2.034 53.997 52.037 -0.123 0.000 0.624 272 A CB -0.142 18.703 19.000 -0.258 0.000 0.822 272 A HN 0.406 8.556 8.150 -0.000 0.000 0.444 273 D N -0.752 119.647 120.400 -0.002 0.000 2.123 273 D HA -0.054 4.585 4.640 -0.001 0.000 0.200 273 D C 1.946 178.310 176.300 0.107 0.000 0.976 273 D CA 1.350 55.371 54.000 0.036 0.000 0.831 273 D CB -0.164 40.627 40.800 -0.016 0.000 0.974 273 D HN 0.641 9.011 8.370 -0.000 0.000 0.469 274 E N -0.241 120.058 120.200 0.164 0.000 2.028 274 E HA -0.137 4.213 4.350 -0.001 0.000 0.191 274 E C 1.696 178.470 176.600 0.290 0.000 0.988 274 E CA 0.438 56.993 56.400 0.259 0.000 0.799 274 E CB -0.166 29.804 29.700 0.450 0.000 0.755 274 E HN 0.216 8.576 8.360 -0.000 0.000 0.447 275 F N 2.320 122.328 119.950 0.096 0.000 2.063 275 F HA -0.340 4.187 4.527 -0.001 0.000 0.298 275 F C 1.908 177.791 175.800 0.138 0.000 1.109 275 F CA 1.763 59.809 58.000 0.076 0.000 1.212 275 F CB -0.192 38.719 39.000 -0.149 0.000 0.973 275 F HN -0.007 8.293 8.300 -0.000 0.000 0.480 276 N N 0.434 119.329 118.700 0.326 0.000 2.069 276 N HA -0.236 4.504 4.740 -0.001 0.000 0.191 276 N C 2.019 177.475 175.510 -0.090 0.000 1.031 276 N CA 1.747 54.917 53.050 0.200 0.000 0.852 276 N CB -0.698 37.914 38.487 0.207 0.000 1.018 276 N HN 0.406 8.786 8.380 -0.000 0.000 0.423 277 R N 0.850 121.339 120.500 -0.019 0.000 2.081 277 R HA 0.002 4.342 4.340 -0.001 0.000 0.235 277 R C 2.078 178.338 176.300 -0.066 0.000 1.131 277 R CA 0.948 57.018 56.100 -0.049 0.000 0.960 277 R CB -0.243 30.063 30.300 0.009 0.000 0.856 277 R HN 0.175 8.445 8.270 -0.000 0.000 0.436 278 L N 0.142 121.342 121.223 -0.039 0.000 2.072 278 L HA -0.075 4.265 4.340 -0.001 0.000 0.205 278 L C 2.354 179.229 176.870 0.008 0.000 1.079 278 L CA 0.611 55.436 54.840 -0.026 0.000 0.752 278 L CB -0.170 41.871 42.059 -0.030 0.000 0.906 278 L HN 0.060 8.290 8.230 -0.000 0.000 0.436 279 V N -0.161 119.710 119.914 -0.070 0.000 2.548 279 V HA -0.203 3.916 4.120 -0.001 0.000 0.249 279 V C 2.246 178.262 176.094 -0.130 0.000 1.055 279 V CA 1.354 63.658 62.300 0.006 0.000 1.065 279 V CB -0.167 31.518 31.823 -0.230 0.000 0.681 279 V HN 0.293 8.483 8.190 -0.000 0.000 0.462 280 I N 0.286 120.648 120.570 -0.346 0.000 2.252 280 I HA -0.218 3.952 4.170 -0.001 0.000 0.245 280 I C 2.300 178.277 176.117 -0.233 0.000 1.102 280 I CA 1.745 62.797 61.300 -0.413 0.000 1.385 280 I CB -0.310 37.416 38.000 -0.457 0.000 1.064 280 I HN 0.296 8.506 8.210 -0.000 0.000 0.414 281 D N 0.472 120.783 120.400 -0.149 0.000 2.123 281 D HA -0.261 4.379 4.640 -0.001 0.000 0.196 281 D C 1.996 178.211 176.300 -0.141 0.000 0.992 281 D CA 1.277 55.223 54.000 -0.090 0.000 0.833 281 D CB -0.128 40.676 40.800 0.007 0.000 0.954 281 D HN 0.313 8.683 8.370 -0.000 0.000 0.455 282 F N 0.607 120.377 119.950 -0.299 0.000 2.102 282 F HA -0.119 4.407 4.527 -0.001 0.000 0.298 282 F C 1.908 177.525 175.800 -0.305 0.000 1.105 282 F CA 1.211 58.984 58.000 -0.378 0.000 1.239 282 F CB -0.236 38.363 39.000 -0.669 0.000 0.991 282 F HN -0.045 8.255 8.300 -0.000 0.000 0.474 283 L N 0.102 121.068 121.223 -0.429 0.000 2.017 283 L HA -0.213 4.126 4.340 -0.001 0.000 0.208 283 L C 2.729 179.331 176.870 -0.447 0.000 1.073 283 L CA 1.615 56.118 54.840 -0.561 0.000 0.745 283 L CB -0.691 41.041 42.059 -0.546 0.000 0.894 283 L HN 0.094 8.324 8.230 -0.000 0.000 0.432 284 R N -1.094 119.156 120.500 -0.416 0.000 2.075 284 R HA -0.117 4.223 4.340 -0.001 0.000 0.232 284 R C 1.753 177.695 176.300 -0.596 0.000 1.126 284 R CA 1.583 57.359 56.100 -0.540 0.000 0.963 284 R CB -0.091 29.667 30.300 -0.904 0.000 0.858 284 R HN 0.527 8.797 8.270 -0.000 0.000 0.435 285 H N -1.816 117.133 119.070 -0.202 0.000 3.255 285 H HA 0.356 4.912 4.556 -0.001 0.000 0.256 285 H C 0.282 175.484 175.328 -0.210 0.000 1.049 285 H CA -0.072 55.875 56.048 -0.169 0.000 1.202 285 H CB 0.647 30.336 29.762 -0.122 0.000 1.497 285 H HN 0.141 8.421 8.280 -0.000 0.000 0.503 286 A N 0.000 122.655 122.820 -0.275 0.000 2.254 286 A HA 0.000 4.319 4.320 -0.001 0.000 0.244 286 A CA 0.000 51.870 52.037 -0.278 0.000 0.836 286 A CB 0.000 18.716 19.000 -0.474 0.000 0.831 286 A HN 0.000 8.150 8.150 -0.000 0.000 0.486