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 2eyz_1_A DATA FIRST_RESID 1 DATA SEQUENCE MAGNFDSEER SSWYWGRLSR QEAVALLQGQ RHGVFLVRDS STSPGDYVLS DATA SEQUENCE VSENSRVSHY IINSSGPRPP VPPSPAQPPP GVSPSRLRIG DQEFDSLPAL DATA SEQUENCE LEFYKIHYLD TTTLIEPVSR SRQGSGVILR QEEAEYVRAL FDFNGNDEED DATA SEQUENCE LPFKKGDILR IRDKPEEQWW NAEDSEGKRG MIPVPYVEKY RPASASVSAL DATA SEQUENCE IGGNQEGSHP QPLGGPEPGP YAQPSVNTPL PNLQNGPIYA RVIQKRVPNA DATA SEQUENCE YDKTALALEV GELVKVTKIN VSGQWEGECN GKRGHFPFTH VRLLDQQNPE DATA SEQUENCE EDFS 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 1 M HA 0.000 4.506 4.480 0.043 0.000 0.227 1 M C 0.000 176.333 176.300 0.056 0.000 1.140 1 M CA 0.000 55.331 55.300 0.052 0.000 0.988 1 M CB 0.000 32.617 32.600 0.028 0.000 1.302 2 A N 1.326 124.174 122.820 0.047 0.000 2.296 2 A HA 0.158 4.497 4.320 0.032 0.000 0.276 2 A C 0.610 178.230 177.584 0.059 0.000 1.356 2 A CA -0.315 51.744 52.037 0.037 0.000 0.825 2 A CB 0.410 19.418 19.000 0.013 0.000 1.308 2 A HN -0.176 7.997 8.150 0.040 0.000 0.515 3 G N -1.198 107.624 108.800 0.035 0.000 3.197 3 G HA2 -0.050 3.964 3.960 0.091 0.000 0.257 3 G HA3 -0.050 3.925 3.960 0.027 0.000 0.257 3 G C -1.230 173.664 174.900 -0.010 0.000 0.835 3 G CA 0.138 45.264 45.100 0.043 0.000 2.001 3 G HN 0.386 8.687 8.290 0.019 0.000 0.625 4 N N 2.328 121.008 118.700 -0.034 0.000 2.297 4 N HA -0.098 4.413 4.740 -0.381 0.000 0.311 4 N C -0.549 174.551 175.510 -0.684 0.000 0.755 4 N CA 0.010 52.879 53.050 -0.302 0.000 0.725 4 N CB 0.594 38.960 38.487 -0.202 0.000 2.195 4 N HN 0.051 8.413 8.380 0.083 0.068 1.138 5 F N -1.179 118.759 119.950 -0.019 0.000 1.380 5 F HA -0.397 4.117 4.527 -0.022 0.000 0.071 5 F C -1.855 173.929 175.800 -0.026 0.000 0.134 5 F CA 0.160 58.147 58.000 -0.022 0.000 0.292 5 F CB -0.911 38.075 39.000 -0.022 0.000 0.773 5 F HN -0.537 7.785 8.300 0.037 0.000 0.663 6 D N -0.393 120.206 120.400 0.332 0.000 2.946 6 D HA 0.180 4.879 4.640 0.098 0.000 0.337 6 D C -0.867 175.549 176.300 0.193 0.000 1.332 6 D CA -0.321 53.780 54.000 0.169 0.000 0.935 6 D CB 2.118 42.934 40.800 0.027 0.000 1.440 6 D HN -0.120 8.493 8.370 0.405 0.000 0.540 7 S N -1.429 114.317 115.700 0.076 0.000 4.471 7 S HA 0.206 4.698 4.470 0.037 0.000 0.191 7 S C -0.609 173.978 174.600 -0.022 0.000 1.128 7 S CA 0.523 58.741 58.200 0.030 0.000 1.153 7 S CB 1.194 64.406 63.200 0.020 0.000 1.583 7 S HN 0.203 8.534 8.310 0.035 0.000 0.590 8 E N -0.233 119.933 120.200 -0.057 0.000 3.208 8 E HA 0.253 4.560 4.350 -0.072 0.000 0.217 8 E C 0.062 176.610 176.600 -0.086 0.000 1.211 8 E CA 0.083 56.427 56.400 -0.092 0.000 1.104 8 E CB 0.194 29.791 29.700 -0.170 0.000 2.792 8 E HN -0.354 7.974 8.360 -0.054 0.000 0.552 9 E N -0.818 119.317 120.200 -0.108 0.000 4.378 9 E HA -0.497 3.802 4.350 -0.085 0.000 0.197 9 E C 1.008 177.563 176.600 -0.075 0.000 1.332 9 E CA 2.298 58.648 56.400 -0.083 0.000 2.223 9 E CB -1.846 27.817 29.700 -0.063 0.000 1.908 9 E HN 0.377 8.647 8.360 -0.150 0.000 0.292 10 R N 1.710 122.173 120.500 -0.062 0.000 4.394 10 R HA 0.095 4.401 4.340 -0.057 0.000 0.257 10 R C -0.862 175.410 176.300 -0.048 0.000 1.727 10 R CA -0.148 55.920 56.100 -0.052 0.000 1.497 10 R CB -0.901 29.375 30.300 -0.041 0.000 1.406 10 R HN 0.268 8.467 8.270 -0.057 0.037 0.745 11 S N 0.602 116.266 115.700 -0.060 0.000 2.783 11 S HA -0.035 4.409 4.470 -0.043 0.000 0.205 11 S C -0.894 173.679 174.600 -0.045 0.000 0.910 11 S CA 0.403 58.569 58.200 -0.058 0.000 0.861 11 S CB 1.202 64.351 63.200 -0.084 0.000 0.830 11 S HN -0.161 8.018 8.310 -0.073 0.088 0.630 12 S N -1.911 113.745 115.700 -0.073 0.000 3.497 12 S HA 0.303 5.013 4.470 0.030 -0.222 0.319 12 S C -1.720 172.866 174.600 -0.024 0.000 1.195 12 S CA -1.290 56.886 58.200 -0.040 0.000 1.118 12 S CB 0.580 63.729 63.200 -0.085 0.000 1.495 12 S HN -0.452 7.800 8.310 -0.097 0.000 0.655 13 W N -0.520 120.853 121.300 0.122 0.000 2.216 13 W HA 0.140 4.775 4.660 -0.041 0.000 0.326 13 W C -1.648 175.030 176.519 0.266 0.000 1.319 13 W CA 0.568 57.985 57.345 0.120 0.000 1.213 13 W CB 0.041 29.624 29.460 0.205 0.000 1.171 13 W HN 0.049 8.253 8.180 0.040 0.000 0.557 14 Y N 2.655 123.181 120.300 0.377 0.000 2.782 14 Y HA -0.160 4.735 4.550 0.575 0.000 0.333 14 Y C -1.930 174.249 175.900 0.465 0.000 0.882 14 Y CA 0.591 58.905 58.100 0.356 0.000 0.873 14 Y CB 0.785 39.265 38.460 0.033 0.000 1.386 14 Y HN -0.212 8.308 8.280 0.398 0.000 0.541 15 W N -2.059 119.454 121.300 0.356 0.000 3.078 15 W HA -0.405 4.360 4.660 0.175 0.000 0.179 15 W C -0.855 175.797 176.519 0.221 0.000 0.633 15 W CA 0.845 58.331 57.345 0.235 0.000 0.459 15 W CB -0.094 29.490 29.460 0.206 0.000 2.859 15 W HN -0.500 7.758 8.180 0.131 0.000 0.416 16 G N -1.038 108.037 108.800 0.458 0.000 2.491 16 G HA2 0.096 4.202 3.960 0.243 0.000 0.327 16 G HA3 0.096 4.185 3.960 0.216 0.000 0.327 16 G C -1.243 173.805 174.900 0.247 0.000 1.189 16 G CA -1.153 44.116 45.100 0.281 0.000 0.956 16 G HN -0.049 8.588 8.290 0.578 0.000 0.491 17 R N -0.048 120.551 120.500 0.166 0.000 2.710 17 R HA -0.308 4.108 4.340 0.125 0.000 0.301 17 R C -0.736 175.623 176.300 0.098 0.000 1.331 17 R CA 0.404 56.575 56.100 0.119 0.000 0.996 17 R CB -0.674 29.676 30.300 0.082 0.000 1.075 17 R HN 0.219 8.575 8.270 0.143 0.000 0.500 18 L N 5.572 126.851 121.223 0.094 0.000 2.530 18 L HA -0.041 4.341 4.340 0.070 0.000 0.273 18 L C 0.542 177.426 176.870 0.023 0.000 1.141 18 L CA -1.649 53.222 54.840 0.052 0.000 0.905 18 L CB -1.343 40.714 42.059 -0.003 0.000 1.202 18 L HN 0.092 8.380 8.230 0.109 0.008 0.473 19 S N 5.303 121.017 115.700 0.024 0.000 2.414 19 S HA -0.354 4.124 4.470 0.014 0.000 0.238 19 S C 0.662 175.259 174.600 -0.005 0.000 1.055 19 S CA 3.425 61.632 58.200 0.011 0.000 1.174 19 S CB 0.538 63.745 63.200 0.012 0.000 1.087 19 S HN 0.437 8.969 8.310 0.035 -0.201 0.428 20 R N -6.699 113.794 120.500 -0.012 0.000 2.535 20 R HA 0.210 4.530 4.340 -0.034 0.000 0.050 20 R C 0.690 176.973 176.300 -0.028 0.000 0.816 20 R CA 0.813 56.898 56.100 -0.025 0.000 2.949 20 R CB -0.461 29.825 30.300 -0.022 0.000 1.256 20 R HN 0.102 8.847 8.270 -0.008 -0.479 0.520 21 Q N 0.060 119.848 119.800 -0.020 0.000 2.163 21 Q HA -0.169 4.157 4.340 -0.024 0.000 0.198 21 Q C 1.118 177.098 176.000 -0.033 0.000 0.954 21 Q CA 3.231 59.021 55.803 -0.022 0.000 0.851 21 Q CB -0.420 28.311 28.738 -0.012 0.000 0.928 21 Q HN 0.218 8.480 8.270 -0.013 0.000 0.459 22 E N 0.765 120.949 120.200 -0.027 0.000 2.055 22 E HA -0.419 3.919 4.350 -0.019 0.000 0.209 22 E C 1.831 178.361 176.600 -0.117 0.000 1.036 22 E CA 3.803 60.180 56.400 -0.038 0.000 0.849 22 E CB -1.195 28.505 29.700 -0.000 0.000 0.767 22 E HN 0.240 8.592 8.360 -0.013 0.000 0.461 23 A N -4.173 118.565 122.820 -0.135 0.000 2.125 23 A HA -0.097 3.999 4.320 -0.373 0.000 0.219 23 A C 0.894 178.385 177.584 -0.155 0.000 1.156 23 A CA 2.211 54.121 52.037 -0.211 0.000 0.671 23 A CB -0.806 18.105 19.000 -0.148 0.000 0.794 23 A HN 0.125 8.223 8.150 -0.087 0.000 0.459 24 V N -3.467 116.391 119.914 -0.092 0.000 2.690 24 V HA -0.134 3.952 4.120 -0.057 0.000 0.240 24 V C 0.753 176.809 176.094 -0.063 0.000 1.078 24 V CA 1.725 63.990 62.300 -0.059 0.000 1.102 24 V CB 1.389 33.198 31.823 -0.024 0.000 0.800 24 V HN -0.603 7.364 8.190 -0.079 0.175 0.479 25 A N -0.322 122.464 122.820 -0.055 0.000 1.877 25 A HA -0.188 4.109 4.320 -0.037 0.000 0.216 25 A C 2.348 179.902 177.584 -0.049 0.000 1.186 25 A CA 3.234 55.246 52.037 -0.043 0.000 0.620 25 A CB -0.479 18.505 19.000 -0.027 0.000 0.822 25 A HN 0.819 8.801 8.150 -0.052 0.136 0.443 26 L N -3.601 117.580 121.223 -0.070 0.000 2.201 26 L HA -0.174 4.155 4.340 -0.017 0.000 0.212 26 L C 0.468 177.287 176.870 -0.085 0.000 1.105 26 L CA 2.286 57.088 54.840 -0.063 0.000 0.775 26 L CB -0.071 41.935 42.059 -0.087 0.000 0.913 26 L HN -0.276 7.797 8.230 -0.086 0.106 0.440 27 L N -4.941 116.210 121.223 -0.119 0.000 2.640 27 L HA 0.127 4.415 4.340 -0.087 0.000 0.230 27 L C 1.232 178.063 176.870 -0.066 0.000 1.123 27 L CA -1.073 53.708 54.840 -0.100 0.000 0.900 27 L CB -0.493 41.492 42.059 -0.123 0.000 1.146 27 L HN -0.268 7.752 8.230 -0.128 0.133 0.484 28 Q N 0.826 120.590 119.800 -0.061 0.000 0.662 28 Q HA -0.301 4.006 4.340 -0.055 0.000 0.907 28 Q C 1.426 177.392 176.000 -0.057 0.000 0.852 28 Q CA 2.238 58.009 55.803 -0.054 0.000 0.879 28 Q CB -0.023 28.687 28.738 -0.047 0.000 1.239 28 Q HN -0.662 7.395 8.270 -0.063 0.175 0.143 29 G N -1.027 107.740 108.800 -0.056 0.000 2.990 29 G HA2 -0.215 3.698 3.960 -0.079 0.000 0.256 29 G HA3 -0.215 3.709 3.960 -0.061 0.000 0.256 29 G C -0.654 174.206 174.900 -0.067 0.000 0.798 29 G CA -0.105 44.955 45.100 -0.066 0.000 2.012 29 G HN 0.338 8.598 8.290 -0.050 0.000 0.598 30 Q N 0.359 120.118 119.800 -0.068 0.000 2.298 30 Q HA 0.116 4.420 4.340 -0.060 0.000 0.181 30 Q C 0.534 176.486 176.000 -0.080 0.000 1.004 30 Q CA -1.198 54.566 55.803 -0.065 0.000 1.050 30 Q CB 2.033 30.739 28.738 -0.053 0.000 1.254 30 Q HN 0.002 8.152 8.270 -0.067 0.080 0.531 31 R N -0.875 119.580 120.500 -0.074 0.000 2.971 31 R HA -0.208 4.090 4.340 -0.070 0.000 0.278 31 R C 0.804 177.085 176.300 -0.031 0.000 1.022 31 R CA 0.797 56.860 56.100 -0.061 0.000 1.187 31 R CB 0.281 30.536 30.300 -0.074 0.000 1.126 31 R HN 0.316 8.541 8.270 -0.076 0.000 0.510 32 H N -1.980 117.063 119.070 -0.044 0.000 2.518 32 H HA -0.198 4.347 4.556 -0.019 0.000 0.289 32 H C 0.187 175.526 175.328 0.019 0.000 1.051 32 H CA 2.661 58.699 56.048 -0.017 0.000 1.280 32 H CB 0.706 30.456 29.762 -0.022 0.000 1.380 32 H HN 0.332 8.675 8.280 0.105 0.000 0.566 33 G N -4.575 104.313 108.800 0.146 0.000 2.744 33 G HA2 0.346 4.408 3.960 0.170 0.000 0.286 33 G HA3 0.346 4.422 3.960 0.193 0.000 0.286 33 G C -2.904 172.054 174.900 0.097 0.000 1.497 33 G CA -0.163 45.030 45.100 0.156 0.000 1.070 33 G HN -0.582 7.710 8.290 0.098 0.057 0.539 34 V N -0.616 119.371 119.914 0.121 0.000 3.077 34 V HA 0.911 5.305 4.120 -0.005 -0.277 0.299 34 V C -2.375 173.827 176.094 0.180 0.000 1.276 34 V CA -2.368 59.966 62.300 0.057 0.000 0.993 34 V CB 3.605 35.406 31.823 -0.037 0.000 1.076 34 V HN -0.199 8.084 8.190 0.154 0.000 0.434 35 F N 0.288 120.311 119.950 0.123 0.000 2.626 35 F HA 1.266 6.109 4.527 0.095 -0.259 0.311 35 F C -2.832 173.036 175.800 0.113 0.000 1.088 35 F CA -2.691 55.387 58.000 0.130 0.000 0.949 35 F CB 4.339 43.471 39.000 0.220 0.000 1.322 35 F HN 0.444 8.465 8.300 -0.272 0.116 0.461 36 L N -4.948 116.467 121.223 0.320 0.000 2.518 36 L HA 0.554 5.064 4.340 0.283 0.000 0.257 36 L C -2.953 174.040 176.870 0.204 0.000 0.980 36 L CA -1.021 53.869 54.840 0.083 0.000 0.837 36 L CB 4.362 46.029 42.059 -0.654 0.000 1.410 36 L HN 0.185 8.648 8.230 0.388 0.000 0.410 37 V N 1.738 121.843 119.914 0.319 0.000 2.325 37 V HA 0.382 4.815 4.120 0.217 -0.183 0.280 37 V C -0.775 175.486 176.094 0.278 0.000 1.016 37 V CA -2.191 60.294 62.300 0.307 0.000 0.818 37 V CB 0.649 32.708 31.823 0.394 0.000 1.019 37 V HN 0.205 8.741 8.190 0.577 0.000 0.434 38 R N 7.117 127.704 120.500 0.145 0.000 2.691 38 R HA 0.200 4.689 4.340 0.250 0.000 0.259 38 R C -1.450 174.939 176.300 0.148 0.000 1.048 38 R CA -2.382 53.807 56.100 0.149 0.000 1.086 38 R CB 2.079 32.401 30.300 0.036 0.000 1.166 38 R HN -0.061 8.268 8.270 0.099 0.000 0.526 39 D N 1.040 121.527 120.400 0.144 0.000 2.485 39 D HA 0.190 4.876 4.640 0.078 0.000 0.229 39 D C -1.806 174.517 176.300 0.039 0.000 1.101 39 D CA 0.486 54.545 54.000 0.100 0.000 0.906 39 D CB -0.077 40.808 40.800 0.142 0.000 1.019 39 D HN 0.251 8.716 8.370 0.158 0.000 0.516 40 S N 0.438 116.138 115.700 0.001 0.000 2.751 40 S HA 0.127 4.586 4.470 -0.018 0.000 0.148 40 S C -1.507 173.072 174.600 -0.036 0.000 1.057 40 S CA -0.508 57.681 58.200 -0.017 0.000 1.103 40 S CB 0.387 63.580 63.200 -0.012 0.000 1.709 40 S HN -0.146 8.161 8.310 -0.005 0.000 0.484 41 S N 0.865 116.524 115.700 -0.068 0.000 2.685 41 S HA 0.388 4.844 4.470 -0.025 0.000 0.282 41 S C -0.005 174.553 174.600 -0.070 0.000 1.159 41 S CA -0.833 57.333 58.200 -0.057 0.000 0.833 41 S CB 2.120 65.298 63.200 -0.037 0.000 1.151 41 S HN 0.084 8.740 8.310 -0.100 -0.406 0.485 42 T N 2.098 116.647 114.554 -0.007 0.000 2.652 42 T HA 0.048 4.402 4.350 0.006 0.000 0.319 42 T C -0.764 173.953 174.700 0.029 0.000 1.029 42 T CA 0.863 62.975 62.100 0.020 0.000 0.990 42 T CB 0.557 69.460 68.868 0.057 0.000 1.098 42 T HN 0.055 8.309 8.240 0.024 0.000 0.520 43 S N -0.989 114.759 115.700 0.080 0.000 3.922 43 S HA -0.124 4.428 4.470 0.137 0.000 0.641 43 S C -1.620 173.035 174.600 0.091 0.000 1.746 43 S CA 0.735 59.020 58.200 0.142 0.000 1.907 43 S CB -1.925 61.483 63.200 0.347 0.000 0.326 43 S HN 0.089 8.441 8.310 0.070 0.000 1.786 44 P HA 0.036 4.509 4.420 0.087 0.000 0.220 44 P C -0.798 176.563 177.300 0.102 0.000 1.152 44 P CA 0.770 63.949 63.100 0.132 0.000 0.812 44 P CB 0.550 32.367 31.700 0.194 0.000 0.792 45 G N -0.985 107.870 108.800 0.091 0.000 2.453 45 G HA2 0.132 4.092 3.960 0.001 0.000 0.323 45 G HA3 0.132 4.198 3.960 0.177 0.000 0.323 45 G C -1.857 172.492 174.900 -0.917 0.000 1.198 45 G CA -1.402 43.634 45.100 -0.107 0.000 0.959 45 G HN -0.667 7.748 8.290 0.242 0.020 0.482 46 D N 1.357 121.402 120.400 -0.593 0.000 2.256 46 D HA 0.057 4.314 4.640 -0.639 0.000 0.250 46 D C -1.055 174.883 176.300 -0.603 0.000 1.093 46 D CA 0.336 53.990 54.000 -0.578 0.000 0.882 46 D CB 1.625 42.336 40.800 -0.148 0.000 1.185 46 D HN -0.012 8.228 8.370 -0.217 0.000 0.437 47 Y N -1.409 118.953 120.300 0.103 0.000 2.307 47 Y HA 0.139 4.748 4.550 0.097 0.000 0.323 47 Y C -2.097 173.860 175.900 0.095 0.000 1.100 47 Y CA -1.327 56.831 58.100 0.096 0.000 1.140 47 Y CB 1.282 39.794 38.460 0.087 0.000 1.159 47 Y HN 0.165 8.264 8.280 -0.303 0.000 0.436 48 V N 1.980 122.021 119.914 0.212 0.000 3.188 48 V HA 0.934 5.324 4.120 0.202 -0.149 0.305 48 V C -2.798 173.408 176.094 0.186 0.000 1.232 48 V CA -3.000 59.407 62.300 0.178 0.000 1.043 48 V CB 4.778 36.667 31.823 0.111 0.000 1.068 48 V HN 0.277 8.592 8.190 0.208 0.000 0.439 49 L N 3.901 125.253 121.223 0.215 0.000 2.611 49 L HA 0.670 5.391 4.340 0.215 -0.252 0.263 49 L C -2.025 175.001 176.870 0.259 0.000 0.969 49 L CA -0.621 54.362 54.840 0.238 0.000 0.894 49 L CB 1.909 44.103 42.059 0.224 0.000 1.229 49 L HN 0.020 8.390 8.230 0.234 0.000 0.416 50 S N 6.863 122.669 115.700 0.176 0.000 2.508 50 S HA 0.304 4.988 4.470 0.066 -0.174 0.284 50 S C -1.637 173.050 174.600 0.145 0.000 1.192 50 S CA -0.895 57.367 58.200 0.102 0.000 1.070 50 S CB 1.458 64.669 63.200 0.018 0.000 1.004 50 S HN 0.237 8.634 8.310 0.145 0.000 0.493 51 V N 6.666 126.644 119.914 0.107 0.000 2.656 51 V HA 0.714 5.173 4.120 0.191 -0.224 0.307 51 V C -0.593 175.532 176.094 0.052 0.000 1.051 51 V CA -2.263 60.127 62.300 0.150 0.000 0.893 51 V CB 3.983 35.954 31.823 0.246 0.000 0.999 51 V HN -0.077 8.057 8.190 0.010 0.063 0.426 52 S N 5.052 120.780 115.700 0.048 0.000 2.669 52 S HA 0.324 4.779 4.470 -0.024 0.000 0.270 52 S C -0.210 174.396 174.600 0.010 0.000 1.225 52 S CA -0.979 57.221 58.200 0.000 0.000 0.991 52 S CB 1.774 64.960 63.200 -0.022 0.000 0.987 52 S HN 0.183 8.539 8.310 0.077 0.000 0.552 53 E N -1.006 119.177 120.200 -0.029 0.000 2.476 53 E HA 0.134 4.479 4.350 -0.008 0.000 0.267 53 E C -0.295 176.254 176.600 -0.086 0.000 1.111 53 E CA 0.586 56.970 56.400 -0.027 0.000 1.903 53 E CB 0.972 30.677 29.700 0.009 0.000 3.037 53 E HN 0.530 8.860 8.360 -0.050 0.000 1.041 54 N N -1.367 117.290 118.700 -0.071 0.000 2.450 54 N HA 0.004 4.679 4.740 -0.108 0.000 0.317 54 N C -0.170 175.302 175.510 -0.064 0.000 0.651 54 N CA 0.478 53.480 53.050 -0.079 0.000 1.030 54 N CB 0.682 39.134 38.487 -0.058 0.000 2.010 54 N HN 0.027 8.373 8.380 -0.056 0.000 1.425 55 S N 2.854 118.521 115.700 -0.054 0.000 2.474 55 S HA 0.211 4.651 4.470 -0.050 0.000 0.320 55 S C -0.362 174.203 174.600 -0.060 0.000 1.067 55 S CA -0.318 57.851 58.200 -0.052 0.000 1.127 55 S CB -0.350 62.823 63.200 -0.046 0.000 0.971 55 S HN -0.144 8.136 8.310 -0.051 0.000 0.472 56 R N 2.092 122.558 120.500 -0.056 0.000 3.407 56 R HA -0.468 4.041 4.340 -0.051 -0.199 0.637 56 R C -1.736 174.521 176.300 -0.073 0.000 0.244 56 R CA 0.427 56.492 56.100 -0.058 0.000 1.958 56 R CB -1.403 28.864 30.300 -0.054 0.000 0.865 56 R HN 0.163 8.402 8.270 -0.052 0.000 0.624 57 V N -1.076 118.795 119.914 -0.071 0.000 3.133 57 V HA -0.069 4.120 4.120 -0.071 -0.111 0.305 57 V C 0.367 176.366 176.094 -0.157 0.000 1.084 57 V CA 0.111 62.362 62.300 -0.082 0.000 1.089 57 V CB 0.665 32.454 31.823 -0.056 0.000 1.073 57 V HN 0.054 8.211 8.190 -0.056 0.000 0.477 58 S N 2.736 118.317 115.700 -0.197 0.000 2.426 58 S HA 0.218 4.377 4.470 -0.518 0.000 0.236 58 S C -0.921 173.377 174.600 -0.503 0.000 1.368 58 S CA -1.464 56.482 58.200 -0.424 0.000 1.154 58 S CB -0.529 62.430 63.200 -0.402 0.000 1.037 58 S HN 0.262 8.452 8.310 -0.118 0.049 0.481 59 H N 5.653 124.559 119.070 -0.274 0.000 2.886 59 H HA -0.077 4.563 4.556 -0.093 -0.140 0.329 59 H C -1.760 173.407 175.328 -0.268 0.000 1.044 59 H CA -0.844 55.096 56.048 -0.181 0.000 1.456 59 H CB -0.637 29.070 29.762 -0.091 0.000 1.464 59 H HN 0.192 8.035 8.280 -0.728 0.000 0.573 60 Y N 3.111 123.513 120.300 0.170 0.000 2.446 60 Y HA 0.170 4.793 4.550 0.120 0.000 0.338 60 Y C -1.061 174.930 175.900 0.152 0.000 1.055 60 Y CA -0.759 57.421 58.100 0.132 0.000 1.101 60 Y CB 3.192 41.704 38.460 0.087 0.000 1.221 60 Y HN 0.577 8.860 8.280 0.251 0.147 0.460 61 I N 1.973 122.740 120.570 0.329 0.000 2.396 61 I HA 0.059 4.358 4.170 0.214 0.000 0.292 61 I C -2.064 174.182 176.117 0.216 0.000 0.999 61 I CA -0.308 61.132 61.300 0.233 0.000 1.310 61 I CB 1.356 39.466 38.000 0.183 0.000 1.404 61 I HN 0.358 8.789 8.210 0.368 0.000 0.496 62 I N 6.821 127.523 120.570 0.220 0.000 2.730 62 I HA 0.099 4.424 4.170 0.147 -0.066 0.298 62 I C -2.402 173.830 176.117 0.191 0.000 1.089 62 I CA -1.450 59.962 61.300 0.187 0.000 1.041 62 I CB 3.965 42.074 38.000 0.181 0.000 1.235 62 I HN -0.550 7.805 8.210 0.242 0.000 0.423 63 N N 2.047 120.758 118.700 0.020 0.000 2.362 63 N HA 0.206 4.975 4.740 0.047 0.000 0.299 63 N C -1.966 173.236 175.510 -0.512 0.000 1.170 63 N CA -1.037 51.945 53.050 -0.113 0.000 0.825 63 N CB 2.778 41.259 38.487 -0.011 0.000 1.299 63 N HN 0.114 8.616 8.380 0.016 -0.112 0.502 64 S N -0.352 114.870 115.700 -0.797 0.000 2.645 64 S HA 0.132 4.281 4.470 -0.382 0.092 0.268 64 S C -2.836 171.542 174.600 -0.369 0.000 1.110 64 S CA 0.012 57.775 58.200 -0.729 0.000 0.823 64 S CB 0.939 63.514 63.200 -1.041 0.000 1.091 64 S HN 0.049 8.032 8.310 -0.544 0.000 0.466 65 S N 0.904 116.492 115.700 -0.187 0.000 2.661 65 S HA 0.326 4.862 4.470 0.110 0.000 0.268 65 S C -0.189 174.310 174.600 -0.168 0.000 1.162 65 S CA -0.878 57.303 58.200 -0.031 0.000 0.817 65 S CB 2.911 66.121 63.200 0.017 0.000 1.141 65 S HN 0.154 8.329 8.310 -0.225 0.000 0.477 66 G N 1.200 109.930 108.800 -0.116 0.000 2.394 66 G HA2 0.089 3.401 3.960 -1.081 0.000 0.214 66 G HA3 0.089 4.084 3.960 0.058 0.000 0.214 66 G C -1.288 173.525 174.900 -0.146 0.000 1.176 66 G CA 0.414 45.307 45.100 -0.345 0.000 0.786 66 G HN 0.188 8.535 8.290 0.095 0.000 0.533 67 P HA -0.159 4.265 4.420 0.007 0.000 0.272 67 P C -1.031 176.237 177.300 -0.053 0.000 1.225 67 P CA -0.175 62.915 63.100 -0.017 0.000 0.800 67 P CB 0.360 32.059 31.700 -0.002 0.000 0.894 68 R N 0.267 120.740 120.500 -0.044 0.000 2.401 68 R HA -0.038 4.265 4.340 -0.062 0.000 0.299 68 R C -0.711 175.556 176.300 -0.056 0.000 1.064 68 R CA -0.752 55.313 56.100 -0.059 0.000 1.000 68 R CB 0.442 30.700 30.300 -0.070 0.000 0.973 68 R HN 0.122 8.373 8.270 -0.032 0.000 0.438 69 P HA 0.531 4.939 4.420 -0.019 0.000 0.262 69 P C -2.766 174.531 177.300 -0.004 0.000 1.651 69 P CA -1.740 61.352 63.100 -0.012 0.000 1.119 69 P CB -0.192 31.516 31.700 0.013 0.000 1.552 70 P HA -0.244 3.888 4.420 -0.480 0.000 0.211 70 P C -0.877 176.280 177.300 -0.238 0.000 1.181 70 P CA 1.658 64.568 63.100 -0.317 0.000 0.929 70 P CB 0.354 31.832 31.700 -0.369 0.000 0.789 71 V N -11.046 108.779 119.914 -0.148 0.000 2.823 71 V HA 0.416 4.519 4.120 -0.029 0.000 0.312 71 V C -2.478 173.601 176.094 -0.026 0.000 1.072 71 V CA -4.519 57.737 62.300 -0.074 0.000 0.937 71 V CB 2.365 34.132 31.823 -0.093 0.000 1.013 71 V HN -0.683 7.423 8.190 -0.140 0.000 0.430 72 P HA 0.250 4.670 4.420 0.001 0.000 0.269 72 P C -1.781 175.514 177.300 -0.009 0.000 1.263 72 P CA -0.926 62.174 63.100 -0.000 0.000 0.813 72 P CB -1.165 30.538 31.700 0.004 0.000 0.868 73 P HA 0.331 4.745 4.420 -0.010 0.000 0.325 73 P C -0.978 176.319 177.300 -0.006 0.000 1.298 73 P CA -1.243 61.851 63.100 -0.010 0.000 0.771 73 P CB 1.152 32.844 31.700 -0.014 0.000 1.389 74 S N -1.657 114.041 115.700 -0.004 0.000 2.474 74 S HA 0.223 4.693 4.470 -0.000 0.000 0.224 74 S C -1.730 172.871 174.600 0.001 0.000 1.209 74 S CA -1.014 57.185 58.200 -0.001 0.000 1.212 74 S CB -0.374 62.825 63.200 -0.000 0.000 1.137 74 S HN 0.272 8.579 8.310 -0.005 0.000 0.446 75 P HA 0.438 4.860 4.420 0.003 0.000 0.312 75 P C -1.092 176.213 177.300 0.008 0.000 1.308 75 P CA -0.625 62.478 63.100 0.004 0.000 0.743 75 P CB 1.184 32.886 31.700 0.004 0.000 1.364 76 A N -1.453 121.374 122.820 0.011 0.000 2.121 76 A HA 0.059 4.387 4.320 0.014 0.000 0.215 76 A C -0.721 176.876 177.584 0.021 0.000 1.861 76 A CA 0.829 52.874 52.037 0.015 0.000 0.850 76 A CB 0.974 19.982 19.000 0.014 0.000 1.346 76 A HN 0.138 8.294 8.150 0.011 0.000 0.597 77 Q N -0.120 119.694 119.800 0.024 0.000 2.313 77 Q HA 0.307 4.668 4.340 0.035 0.000 0.260 77 Q C -2.918 173.103 176.000 0.035 0.000 0.972 77 Q CA -2.066 53.756 55.803 0.032 0.000 0.886 77 Q CB 1.836 30.595 28.738 0.034 0.000 1.373 77 Q HN -0.214 8.068 8.270 0.021 0.000 0.416 78 P HA 0.126 4.571 4.420 0.041 0.000 0.267 78 P C -1.957 175.376 177.300 0.055 0.000 1.200 78 P CA -1.010 62.121 63.100 0.051 0.000 0.772 78 P CB -0.201 31.539 31.700 0.067 0.000 0.855 79 P HA -0.059 4.384 4.420 0.037 0.000 0.215 79 P C -0.793 176.540 177.300 0.055 0.000 1.157 79 P CA 2.050 65.177 63.100 0.045 0.000 0.868 79 P CB -0.603 31.119 31.700 0.038 0.000 0.788 80 P HA 0.055 4.509 4.420 0.056 0.000 0.218 80 P C 0.228 177.600 177.300 0.120 0.000 1.151 80 P CA 0.201 63.353 63.100 0.087 0.000 0.850 80 P CB 0.093 31.860 31.700 0.112 0.000 0.801 81 G N -1.378 107.516 108.800 0.156 0.000 2.525 81 G HA2 -0.102 3.988 3.960 0.216 0.000 0.276 81 G HA3 -0.102 3.964 3.960 0.177 0.000 0.276 81 G C -0.612 174.363 174.900 0.124 0.000 1.388 81 G CA -0.560 44.644 45.100 0.173 0.000 1.050 81 G HN -0.552 7.829 8.290 0.152 0.000 0.520 82 V N -1.485 118.508 119.914 0.131 0.000 3.621 82 V HA 0.091 4.262 4.120 0.084 0.000 0.263 82 V C -0.293 175.852 176.094 0.086 0.000 1.272 82 V CA 0.198 62.559 62.300 0.102 0.000 1.080 82 V CB 0.433 32.321 31.823 0.109 0.000 0.816 82 V HN 0.214 8.501 8.190 0.162 0.000 0.451 83 S N -0.934 114.818 115.700 0.087 0.000 2.707 83 S HA 0.087 4.589 4.470 0.053 0.000 0.270 83 S C -3.055 171.575 174.600 0.049 0.000 1.031 83 S CA -1.193 57.045 58.200 0.063 0.000 0.866 83 S CB 0.320 63.557 63.200 0.062 0.000 1.114 83 S HN -0.809 7.563 8.310 0.103 0.000 0.465 84 P HA -0.034 4.391 4.420 0.009 0.000 0.257 84 P C -1.280 176.017 177.300 -0.004 0.000 1.162 84 P CA 0.483 63.590 63.100 0.012 0.000 0.762 84 P CB 0.044 31.750 31.700 0.009 0.000 0.753 85 S N 3.794 119.478 115.700 -0.026 0.000 2.383 85 S HA -0.330 4.161 4.470 -0.103 -0.082 0.208 85 S C 0.302 174.856 174.600 -0.076 0.000 1.312 85 S CA 0.883 59.036 58.200 -0.078 0.000 2.096 85 S CB 0.666 63.809 63.200 -0.095 0.000 0.747 85 S HN -0.145 8.154 8.310 -0.020 0.000 0.362 86 R N -1.470 118.995 120.500 -0.059 0.000 1.113 86 R HA -0.401 3.942 4.340 0.005 0.000 0.421 86 R C -1.941 174.335 176.300 -0.040 0.000 1.359 86 R CA 0.593 56.679 56.100 -0.025 0.000 1.299 86 R CB 0.000 30.293 30.300 -0.012 0.000 3.643 86 R HN 0.158 8.394 8.270 -0.055 0.000 0.496 87 L N 1.791 123.027 121.223 0.021 0.000 2.416 87 L HA 0.351 4.891 4.340 -0.033 -0.219 0.262 87 L C 0.100 177.018 176.870 0.081 0.000 1.093 87 L CA -0.973 53.902 54.840 0.058 0.000 0.801 87 L CB 1.962 44.129 42.059 0.181 0.000 1.191 87 L HN 0.107 8.448 8.230 0.065 -0.072 0.459 88 R N -1.030 119.534 120.500 0.105 0.000 2.817 88 R HA 0.817 5.388 4.340 0.030 -0.213 0.268 88 R C -1.161 175.217 176.300 0.130 0.000 1.027 88 R CA -1.421 54.729 56.100 0.083 0.000 0.928 88 R CB 3.886 34.227 30.300 0.068 0.000 1.228 88 R HN 0.187 8.560 8.270 0.108 -0.037 0.469 89 I N -1.662 118.957 120.570 0.082 0.000 1.970 89 I HA -0.093 4.239 4.170 0.147 -0.074 0.317 89 I C -1.598 174.501 176.117 -0.030 0.000 2.715 89 I CA 0.331 61.670 61.300 0.064 0.000 1.019 89 I CB 1.966 39.983 38.000 0.027 0.000 2.152 89 I HN 0.021 8.257 8.210 0.044 0.000 0.650 90 G N 7.273 116.076 108.800 0.004 0.000 2.357 90 G HA2 -0.305 3.720 3.960 0.107 0.000 0.282 90 G HA3 -0.305 3.593 3.960 -0.103 0.000 0.282 90 G C -1.226 173.657 174.900 -0.028 0.000 0.910 90 G CA 0.910 46.008 45.100 -0.003 0.000 1.267 90 G HN 0.267 8.654 8.290 0.161 0.000 0.476 91 D N -7.338 113.061 120.400 -0.003 0.000 2.860 91 D HA -0.483 4.147 4.640 -0.016 0.000 0.229 91 D C -0.882 175.367 176.300 -0.084 0.000 1.169 91 D CA 0.775 54.758 54.000 -0.029 0.000 0.737 91 D CB -0.758 40.030 40.800 -0.020 0.000 1.080 91 D HN 0.183 8.573 8.370 0.033 0.000 0.424 92 Q N -0.906 118.820 119.800 -0.123 0.000 2.418 92 Q HA 0.144 4.331 4.340 -0.256 0.000 0.276 92 Q C -2.003 173.824 176.000 -0.288 0.000 1.081 92 Q CA -0.944 54.701 55.803 -0.263 0.000 0.864 92 Q CB 4.552 33.071 28.738 -0.365 0.000 1.384 92 Q HN -0.183 7.867 8.270 -0.083 0.170 0.467 93 E N -1.238 118.668 120.200 -0.490 0.000 2.367 93 E HA 0.255 4.603 4.350 -0.181 -0.107 0.292 93 E C -1.114 175.222 176.600 -0.439 0.000 0.900 93 E CA -0.188 56.016 56.400 -0.326 0.000 0.807 93 E CB 2.148 31.756 29.700 -0.153 0.000 1.337 93 E HN 0.043 7.998 8.360 -0.675 0.000 0.394 94 F N 4.292 124.221 119.950 -0.035 0.000 2.557 94 F HA 0.090 4.605 4.527 -0.020 0.000 0.203 94 F C -0.040 175.761 175.800 0.002 0.000 1.189 94 F CA 1.098 59.080 58.000 -0.030 0.000 0.935 94 F CB 0.795 39.755 39.000 -0.068 0.000 1.191 94 F HN 0.159 8.564 8.300 0.176 0.000 0.665 95 D N -4.810 115.738 120.400 0.247 0.000 1.689 95 D HA 0.101 4.800 4.640 0.098 0.000 0.643 95 D C -1.543 174.803 176.300 0.078 0.000 0.804 95 D CA 0.925 55.013 54.000 0.146 0.000 1.125 95 D CB 2.521 43.457 40.800 0.227 0.000 1.506 95 D HN -0.045 8.504 8.370 0.298 0.000 0.499 96 S N -3.688 112.047 115.700 0.058 0.000 2.570 96 S HA 0.238 4.703 4.470 -0.010 0.000 0.286 96 S C 0.497 175.058 174.600 -0.065 0.000 1.099 96 S CA -2.307 55.894 58.200 0.002 0.000 0.913 96 S CB 3.015 66.232 63.200 0.028 0.000 1.085 96 S HN -0.662 7.696 8.310 0.080 0.000 0.480 97 L N 2.511 123.723 121.223 -0.018 0.000 1.976 97 L HA -0.078 4.184 4.340 -0.129 0.000 0.209 97 L C 0.092 176.905 176.870 -0.095 0.000 1.071 97 L CA 4.764 59.593 54.840 -0.019 0.000 0.746 97 L CB -3.181 38.996 42.059 0.197 0.000 0.890 97 L HN 0.686 8.927 8.230 0.019 0.000 0.432 98 P HA -0.247 4.296 4.420 0.204 0.000 0.218 98 P C 1.193 178.384 177.300 -0.181 0.000 1.148 98 P CA 2.604 65.798 63.100 0.155 0.000 0.822 98 P CB -0.840 31.050 31.700 0.316 0.000 0.784 99 A N -3.357 119.339 122.820 -0.206 0.000 1.968 99 A HA -0.131 4.026 4.320 -0.272 0.000 0.217 99 A C 1.248 178.475 177.584 -0.595 0.000 1.169 99 A CA 2.151 54.006 52.037 -0.304 0.000 0.638 99 A CB -0.455 18.436 19.000 -0.183 0.000 0.812 99 A HN -0.052 7.908 8.150 -0.116 0.120 0.446 100 L N -1.701 119.041 121.223 -0.803 0.000 2.007 100 L HA -0.227 2.856 4.340 -2.095 0.000 0.205 100 L C 1.171 177.131 176.870 -1.518 0.000 1.073 100 L CA 2.589 56.604 54.840 -1.376 0.000 0.744 100 L CB 0.424 41.824 42.059 -1.098 0.000 0.898 100 L HN -0.531 7.210 8.230 -0.570 0.147 0.435 101 L N -6.105 114.230 121.223 -1.481 0.000 2.263 101 L HA -0.291 2.264 4.340 -2.974 0.000 0.216 101 L C 2.426 177.986 176.870 -2.182 0.000 1.111 101 L CA 2.338 55.906 54.840 -2.119 0.000 0.773 101 L CB -0.645 40.483 42.059 -1.551 0.000 0.906 101 L HN -0.477 7.103 8.230 -1.083 0.000 0.439 102 E N -1.363 118.048 120.200 -1.314 0.000 2.424 102 E HA -0.115 3.789 4.350 -0.743 0.000 0.237 102 E C -0.583 175.558 176.600 -0.766 0.000 1.381 102 E CA -0.398 55.496 56.400 -0.844 0.000 1.587 102 E CB -1.914 27.535 29.700 -0.418 0.000 1.398 102 E HN -0.418 7.148 8.360 -1.064 0.156 0.439 103 F N -2.597 116.862 119.950 -0.818 0.000 2.582 103 F HA 0.108 4.418 4.527 -0.362 0.000 0.290 103 F C 0.556 176.135 175.800 -0.367 0.000 1.115 103 F CA -1.280 56.409 58.000 -0.518 0.000 1.445 103 F CB -0.542 38.189 39.000 -0.447 0.000 1.126 103 F HN -0.363 6.400 8.300 -2.368 0.116 0.574 104 Y N -3.624 116.893 120.300 0.362 0.000 2.561 104 Y HA 0.062 4.853 4.550 0.160 -0.145 0.291 104 Y C 1.168 177.085 175.900 0.029 0.000 1.141 104 Y CA -1.285 56.942 58.100 0.211 0.000 1.303 104 Y CB -1.544 37.109 38.460 0.321 0.000 1.015 104 Y HN -0.819 6.832 8.280 -1.048 0.000 0.547 105 K N -2.918 117.618 120.400 0.226 0.000 2.362 105 K HA -0.216 4.146 4.320 0.070 0.000 0.200 105 K C -0.024 176.540 176.600 -0.060 0.000 1.046 105 K CA 1.885 58.214 56.287 0.069 0.000 0.952 105 K CB -0.333 32.184 32.500 0.028 0.000 0.753 105 K HN -0.012 8.238 8.250 0.098 0.059 0.466 106 I N -6.283 114.244 120.570 -0.073 0.000 3.196 106 I HA 0.116 4.192 4.170 -0.156 0.000 0.248 106 I C 0.440 176.391 176.117 -0.276 0.000 1.105 106 I CA 0.778 62.001 61.300 -0.129 0.000 1.482 106 I CB 1.520 39.492 38.000 -0.047 0.000 1.400 106 I HN -0.662 7.482 8.210 -0.031 0.047 0.464 107 H N 0.037 119.021 119.070 -0.142 0.000 3.298 107 H HA 0.187 4.746 4.556 0.006 0.000 0.328 107 H C -1.408 173.587 175.328 -0.554 0.000 1.278 107 H CA 0.336 56.268 56.048 -0.193 0.000 1.609 107 H CB 1.513 31.158 29.762 -0.195 0.000 2.082 107 H HN -0.687 7.531 8.280 -0.104 0.000 0.465 108 Y N -1.094 119.315 120.300 0.182 0.000 3.328 108 Y HA -0.481 4.261 4.550 0.178 -0.085 0.373 108 Y C -2.114 173.824 175.900 0.064 0.000 1.065 108 Y CA 0.517 58.702 58.100 0.143 0.000 1.265 108 Y CB -1.243 37.279 38.460 0.102 0.000 0.958 108 Y HN 0.295 8.725 8.280 0.250 0.000 0.567 109 L N -5.475 115.878 121.223 0.217 0.000 2.503 109 L HA 0.383 4.484 4.340 -0.398 0.000 0.248 109 L C -0.576 176.278 176.870 -0.026 0.000 1.126 109 L CA -2.620 52.098 54.840 -0.204 0.000 0.929 109 L CB 1.069 42.768 42.059 -0.599 0.000 1.544 109 L HN -0.550 7.930 8.230 0.417 0.000 0.404 110 D N -0.233 120.019 120.400 -0.247 0.000 2.204 110 D HA -0.251 4.359 4.640 -0.051 0.000 0.189 110 D C -0.304 176.018 176.300 0.038 0.000 1.006 110 D CA 3.091 57.035 54.000 -0.093 0.000 0.855 110 D CB 0.222 40.913 40.800 -0.182 0.000 0.946 110 D HN 0.361 8.392 8.370 -0.565 0.000 0.448 111 T N -5.824 108.764 114.554 0.057 0.000 2.937 111 T HA 0.222 4.611 4.350 0.065 0.000 0.297 111 T C -1.208 173.555 174.700 0.105 0.000 0.991 111 T CA -1.214 60.936 62.100 0.083 0.000 0.990 111 T CB 1.537 70.460 68.868 0.092 0.000 0.991 111 T HN -0.491 7.764 8.240 0.025 0.000 0.440 112 T N 0.742 115.361 114.554 0.107 0.000 1.830 112 T HA -0.263 4.171 4.350 0.141 0.000 0.565 112 T C -1.783 173.012 174.700 0.158 0.000 1.065 112 T CA 0.434 62.622 62.100 0.146 0.000 3.025 112 T CB -0.262 68.720 68.868 0.191 0.000 2.425 112 T HN 0.410 8.695 8.240 0.074 0.000 0.339 113 T N 2.977 117.630 114.554 0.166 0.000 2.833 113 T HA 0.238 4.751 4.350 0.271 0.000 0.297 113 T C -0.352 174.504 174.700 0.261 0.000 1.015 113 T CA -0.741 61.483 62.100 0.206 0.000 0.963 113 T CB 0.121 69.063 68.868 0.124 0.000 0.955 113 T HN 0.227 8.559 8.240 0.154 0.000 0.449 114 L N 2.480 123.912 121.223 0.348 0.000 3.052 114 L HA -0.333 4.339 4.340 0.553 0.000 0.652 114 L C -0.894 176.205 176.870 0.381 0.000 1.019 114 L CA 0.592 55.679 54.840 0.412 0.000 1.317 114 L CB -1.620 40.677 42.059 0.397 0.000 1.728 114 L HN 0.614 9.063 8.230 0.366 0.000 0.839 115 I N -5.237 115.651 120.570 0.530 0.000 3.062 115 I HA 0.214 4.611 4.170 0.293 -0.051 0.318 115 I C -1.918 174.412 176.117 0.355 0.000 1.026 115 I CA -1.922 59.658 61.300 0.466 0.000 1.096 115 I CB 2.080 40.448 38.000 0.613 0.000 1.348 115 I HN -0.275 8.431 8.210 0.827 0.000 0.543 116 E N -4.773 115.510 120.200 0.138 0.000 2.401 116 E HA 0.306 4.722 4.350 0.109 0.000 0.280 116 E C -2.592 173.559 176.600 -0.747 0.000 1.039 116 E CA -2.629 53.617 56.400 -0.258 0.000 0.814 116 E CB 1.669 30.885 29.700 -0.806 0.000 1.275 116 E HN -0.480 7.931 8.360 0.085 0.000 0.448 117 P HA 0.190 4.320 4.420 -0.972 -0.293 0.263 117 P C -0.041 177.106 177.300 -0.255 0.000 1.175 117 P CA -0.040 62.646 63.100 -0.691 0.000 0.761 117 P CB 0.326 31.875 31.700 -0.251 0.000 0.794 118 V N -0.706 119.267 119.914 0.098 0.000 3.441 118 V HA -0.143 3.967 4.120 -0.016 0.000 0.300 118 V C 0.841 177.093 176.094 0.263 0.000 1.091 118 V CA -0.760 61.659 62.300 0.198 0.000 1.099 118 V CB -0.039 31.929 31.823 0.241 0.000 1.138 118 V HN -0.392 7.947 8.190 0.247 0.000 0.471 119 S N 0.998 116.791 115.700 0.156 0.000 2.459 119 S HA -0.193 4.254 4.470 -0.037 0.000 0.231 119 S C 0.510 175.153 174.600 0.071 0.000 1.353 119 S CA 0.542 58.778 58.200 0.059 0.000 0.988 119 S CB 1.229 64.454 63.200 0.042 0.000 0.860 119 S HN -0.233 8.290 8.310 0.116 -0.143 0.494 120 R N 0.933 121.455 120.500 0.037 0.000 2.038 120 R HA 0.039 4.188 4.340 -0.318 0.000 0.214 120 R C 0.620 177.083 176.300 0.271 0.000 1.249 120 R CA -0.242 55.854 56.100 -0.007 0.000 1.025 120 R CB -0.276 29.991 30.300 -0.054 0.000 0.911 120 R HN 0.175 8.466 8.270 0.036 0.000 0.456 121 S N -0.092 115.706 115.700 0.164 0.000 2.991 121 S HA -0.238 4.288 4.470 0.094 0.000 0.630 121 S C -0.098 174.604 174.600 0.170 0.000 3.057 121 S CA 1.516 59.806 58.200 0.150 0.000 3.520 121 S CB -0.183 63.105 63.200 0.147 0.000 0.309 121 S HN -0.024 8.343 8.310 0.096 0.000 1.629 122 R N 0.107 120.682 120.500 0.126 0.000 3.826 122 R HA -0.282 4.096 4.340 0.063 0.000 0.295 122 R C -1.319 175.035 176.300 0.091 0.000 1.200 122 R CA 1.284 57.445 56.100 0.103 0.000 0.818 122 R CB -1.264 29.113 30.300 0.129 0.000 1.216 122 R HN 0.279 8.605 8.270 0.095 0.000 0.513 123 Q N -1.847 117.998 119.800 0.076 0.000 2.382 123 Q HA -0.184 4.183 4.340 0.045 0.000 0.345 123 Q C -1.514 174.523 176.000 0.061 0.000 1.350 123 Q CA 0.523 56.359 55.803 0.055 0.000 0.892 123 Q CB -0.224 28.539 28.738 0.041 0.000 1.058 123 Q HN 0.044 8.296 8.270 0.075 0.063 0.318 124 G N 2.457 111.289 108.800 0.053 0.000 2.437 124 G HA2 0.105 4.098 3.960 0.055 0.000 0.319 124 G HA3 0.105 4.084 3.960 0.032 0.000 0.319 124 G C -0.788 174.124 174.900 0.020 0.000 1.158 124 G CA -0.556 44.568 45.100 0.041 0.000 0.899 124 G HN 0.010 8.328 8.290 0.047 0.000 0.502 125 S N -0.416 115.291 115.700 0.012 0.000 2.523 125 S HA -0.037 4.434 4.470 0.002 0.000 0.217 125 S C 0.359 174.953 174.600 -0.010 0.000 0.996 125 S CA 0.063 58.263 58.200 0.001 0.000 0.921 125 S CB 0.688 63.888 63.200 -0.000 0.000 0.829 125 S HN 0.061 8.380 8.310 0.015 0.000 0.495 126 G N 2.854 111.646 108.800 -0.015 0.000 2.461 126 G HA2 0.184 4.130 3.960 -0.023 0.000 0.323 126 G HA3 0.184 4.126 3.960 -0.031 0.000 0.323 126 G C -1.414 173.471 174.900 -0.025 0.000 1.229 126 G CA -0.491 44.595 45.100 -0.024 0.000 0.941 126 G HN -0.439 7.844 8.290 -0.012 0.000 0.477 127 V N 1.674 121.575 119.914 -0.022 0.000 2.604 127 V HA 0.269 4.377 4.120 -0.021 0.000 0.305 127 V C -0.456 175.627 176.094 -0.018 0.000 1.043 127 V CA -2.316 59.973 62.300 -0.018 0.000 0.888 127 V CB 2.182 33.998 31.823 -0.011 0.000 0.995 127 V HN 0.033 8.210 8.190 -0.021 0.000 0.429 128 I N 4.189 124.749 120.570 -0.016 0.000 2.575 128 I HA 0.016 4.177 4.170 -0.014 0.000 0.285 128 I C -0.271 175.844 176.117 -0.003 0.000 1.085 128 I CA 0.302 61.596 61.300 -0.011 0.000 1.403 128 I CB 0.703 38.700 38.000 -0.006 0.000 1.409 128 I HN 0.100 8.299 8.210 -0.018 0.000 0.557 129 L N 3.526 124.747 121.223 -0.002 0.000 2.416 129 L HA 0.251 4.594 4.340 0.006 0.000 0.274 129 L C -1.549 175.322 176.870 0.002 0.000 1.435 129 L CA -0.438 54.403 54.840 0.002 0.000 0.668 129 L CB 0.129 42.187 42.059 -0.001 0.000 0.928 129 L HN -0.291 7.936 8.230 -0.005 0.000 0.519 130 R N 0.739 121.242 120.500 0.005 0.000 2.668 130 R HA 0.303 4.644 4.340 0.001 0.000 0.279 130 R C -0.760 175.546 176.300 0.010 0.000 0.976 130 R CA -1.016 55.086 56.100 0.004 0.000 0.978 130 R CB 1.036 31.337 30.300 0.001 0.000 1.133 130 R HN -0.442 7.833 8.270 0.009 0.000 0.484 131 Q N 0.591 120.396 119.800 0.008 0.000 2.302 131 Q HA 0.118 4.469 4.340 0.018 0.000 0.332 131 Q C -0.327 175.680 176.000 0.011 0.000 0.913 131 Q CA -0.576 55.234 55.803 0.012 0.000 1.098 131 Q CB 0.482 29.226 28.738 0.010 0.000 1.236 131 Q HN 0.226 8.498 8.270 0.003 0.000 0.436 132 E N 0.747 120.952 120.200 0.009 0.000 2.349 132 E HA 0.080 4.428 4.350 -0.003 0.000 0.265 132 E C -1.626 174.982 176.600 0.013 0.000 1.064 132 E CA -0.132 56.269 56.400 0.002 0.000 0.886 132 E CB 1.537 31.232 29.700 -0.009 0.000 1.036 132 E HN -0.091 8.206 8.360 0.010 0.069 0.413 133 E N -0.074 120.131 120.200 0.008 0.000 2.442 133 E HA 0.406 4.936 4.350 0.037 -0.159 0.271 133 E C -1.715 174.891 176.600 0.011 0.000 1.002 133 E CA -1.469 54.945 56.400 0.024 0.000 0.864 133 E CB 3.844 33.567 29.700 0.038 0.000 1.573 133 E HN 0.072 8.430 8.360 -0.003 0.000 0.456 134 A N -2.398 120.441 122.820 0.030 0.000 4.047 134 A HA 0.230 4.558 4.320 0.013 0.000 0.273 134 A C -1.980 175.625 177.584 0.036 0.000 1.016 134 A CA -0.290 51.757 52.037 0.017 0.000 0.565 134 A CB 1.173 20.160 19.000 -0.021 0.000 1.701 134 A HN 0.080 8.264 8.150 0.056 0.000 0.814 135 E N 0.110 120.316 120.200 0.009 0.000 2.349 135 E HA 0.087 4.396 4.350 -0.069 0.000 0.262 135 E C -0.998 175.618 176.600 0.028 0.000 1.088 135 E CA -0.496 55.872 56.400 -0.054 0.000 0.899 135 E CB 0.623 30.249 29.700 -0.123 0.000 1.044 135 E HN 0.146 8.505 8.360 -0.000 0.000 0.420 136 Y N -3.615 116.766 120.300 0.135 0.000 2.374 136 Y HA 0.255 4.929 4.550 0.142 -0.038 0.322 136 Y C -1.609 174.393 175.900 0.171 0.000 1.275 136 Y CA -2.226 55.956 58.100 0.137 0.000 1.307 136 Y CB 1.362 39.876 38.460 0.091 0.000 1.282 136 Y HN -0.085 7.854 8.280 -0.568 0.000 0.509 137 V N -1.709 118.453 119.914 0.412 0.000 3.046 137 V HA 0.457 4.771 4.120 0.324 0.000 0.316 137 V C -2.141 174.072 176.094 0.198 0.000 1.104 137 V CA -3.396 59.081 62.300 0.294 0.000 1.006 137 V CB 4.337 36.286 31.823 0.209 0.000 1.058 137 V HN 0.980 9.293 8.190 0.380 0.105 0.440 138 R N 3.238 123.805 120.500 0.110 0.000 2.670 138 R HA 0.614 5.122 4.340 0.016 -0.159 0.289 138 R C -1.807 174.500 176.300 0.011 0.000 0.965 138 R CA -2.547 53.566 56.100 0.022 0.000 0.899 138 R CB 4.205 34.466 30.300 -0.065 0.000 1.173 138 R HN -0.306 8.042 8.270 0.130 0.000 0.456 139 A N 3.545 126.377 122.820 0.020 0.000 2.401 139 A HA 0.065 4.352 4.320 -0.055 0.000 0.259 139 A C -1.806 175.788 177.584 0.017 0.000 1.103 139 A CA -0.286 51.767 52.037 0.025 0.000 0.789 139 A CB 1.155 20.255 19.000 0.166 0.000 1.035 139 A HN 0.983 9.036 8.150 0.028 0.114 0.491 140 L N 1.455 122.677 121.223 -0.002 0.000 2.728 140 L HA 0.139 4.445 4.340 -0.058 0.000 0.238 140 L C -1.933 174.903 176.870 -0.057 0.000 1.143 140 L CA 0.287 55.112 54.840 -0.025 0.000 0.937 140 L CB 0.931 42.978 42.059 -0.019 0.000 1.225 140 L HN -0.034 8.160 8.230 -0.060 0.000 0.507 141 F N -4.066 115.964 119.950 0.133 0.000 2.685 141 F HA 0.146 4.795 4.527 0.203 0.000 0.315 141 F C -1.741 174.310 175.800 0.419 0.000 1.126 141 F CA -1.567 56.599 58.000 0.277 0.000 0.950 141 F CB 4.060 43.278 39.000 0.364 0.000 1.360 141 F HN -0.766 7.633 8.300 0.267 0.061 0.469 142 D N -0.028 120.737 120.400 0.608 0.000 2.361 142 D HA -0.076 4.767 4.640 0.339 0.000 0.239 142 D C -0.941 175.536 176.300 0.295 0.000 1.200 142 D CA 0.921 55.166 54.000 0.408 0.000 0.915 142 D CB 0.673 41.665 40.800 0.320 0.000 1.170 142 D HN -0.146 8.660 8.370 0.727 0.000 0.444 143 F N -1.264 118.630 119.950 -0.094 0.000 2.385 143 F HA 0.315 4.450 4.527 -0.804 -0.091 0.336 143 F C -0.461 175.165 175.800 -0.290 0.000 1.100 143 F CA -1.829 55.960 58.000 -0.351 0.000 1.116 143 F CB 0.935 39.825 39.000 -0.184 0.000 1.166 143 F HN -0.087 8.624 8.300 0.686 0.000 0.511 144 N N 1.634 119.951 118.700 -0.639 0.000 5.084 144 N HA -0.038 4.258 4.740 -0.739 0.000 0.168 144 N C -1.555 173.728 175.510 -0.379 0.000 1.032 144 N CA 0.313 53.021 53.050 -0.571 0.000 1.105 144 N CB 1.954 40.204 38.487 -0.395 0.000 1.554 144 N HN 0.180 8.160 8.380 -0.668 0.000 0.789 145 G N 1.156 109.784 108.800 -0.285 0.000 2.696 145 G HA2 0.121 4.003 3.960 -0.129 0.000 0.151 145 G HA3 0.121 3.976 3.960 -0.174 0.000 0.151 145 G C -2.295 172.525 174.900 -0.134 0.000 1.197 145 G CA 1.102 46.097 45.100 -0.174 0.000 1.053 145 G HN 0.082 8.180 8.290 -0.319 0.000 0.546 146 N N -0.787 117.845 118.700 -0.113 0.000 2.143 146 N HA -0.006 4.676 4.740 -0.096 0.000 0.294 146 N C -1.304 174.159 175.510 -0.078 0.000 0.929 146 N CA 0.193 53.187 53.050 -0.093 0.000 0.723 146 N CB 2.015 40.450 38.487 -0.086 0.000 1.981 146 N HN 0.201 8.512 8.380 -0.116 0.000 0.854 147 D N 2.037 122.389 120.400 -0.081 0.000 2.390 147 D HA 0.073 4.685 4.640 -0.048 0.000 0.249 147 D C 0.067 176.336 176.300 -0.051 0.000 1.144 147 D CA 0.919 54.881 54.000 -0.063 0.000 0.880 147 D CB 0.857 41.610 40.800 -0.078 0.000 1.182 147 D HN -0.222 8.090 8.370 -0.097 0.000 0.451 148 E N 4.288 124.469 120.200 -0.031 0.000 2.216 148 E HA -0.134 4.205 4.350 -0.018 0.000 0.192 148 E C 0.960 177.555 176.600 -0.008 0.000 0.988 148 E CA 2.081 58.471 56.400 -0.016 0.000 0.834 148 E CB -0.099 29.596 29.700 -0.008 0.000 0.772 148 E HN 0.336 8.681 8.360 -0.026 0.000 0.479 149 E N -1.489 118.703 120.200 -0.013 0.000 2.085 149 E HA -0.302 4.049 4.350 0.001 0.000 0.194 149 E C -0.505 176.093 176.600 -0.003 0.000 0.994 149 E CA 2.376 58.770 56.400 -0.009 0.000 0.801 149 E CB 0.413 30.101 29.700 -0.020 0.000 0.743 149 E HN 0.262 8.587 8.360 -0.018 0.024 0.453 150 D N -6.156 114.229 120.400 -0.025 0.000 2.414 150 D HA -0.211 4.513 4.640 0.025 -0.069 0.251 150 D C -1.035 175.291 176.300 0.043 0.000 1.252 150 D CA -0.077 53.921 54.000 -0.004 0.000 0.999 150 D CB 0.597 41.345 40.800 -0.086 0.000 1.093 150 D HN -0.479 7.862 8.370 -0.048 0.000 0.515 151 L N -1.108 120.179 121.223 0.107 0.000 2.406 151 L HA 0.544 4.936 4.340 0.087 0.000 0.270 151 L C -2.627 174.331 176.870 0.147 0.000 0.982 151 L CA -3.323 51.592 54.840 0.124 0.000 0.843 151 L CB 1.603 43.753 42.059 0.150 0.000 1.225 151 L HN -0.184 8.164 8.230 0.156 -0.024 0.412 152 P HA -0.075 4.177 4.420 -0.279 0.000 0.267 152 P C -1.827 175.525 177.300 0.087 0.000 1.200 152 P CA 0.128 63.194 63.100 -0.056 0.000 0.772 152 P CB 0.241 31.929 31.700 -0.020 0.000 0.855 153 F N -2.491 117.595 119.950 0.226 0.000 2.458 153 F HA 0.302 4.913 4.527 0.140 0.000 0.336 153 F C -1.148 174.774 175.800 0.203 0.000 1.114 153 F CA -2.412 55.692 58.000 0.173 0.000 0.987 153 F CB 2.266 41.336 39.000 0.116 0.000 1.130 153 F HN -0.080 7.451 8.300 -1.283 0.000 0.458 154 K N 2.271 122.825 120.400 0.257 0.000 2.265 154 K HA 0.261 4.773 4.320 0.191 -0.078 0.267 154 K C -0.114 176.567 176.600 0.136 0.000 0.994 154 K CA -1.651 54.703 56.287 0.111 0.000 0.860 154 K CB 2.084 34.468 32.500 -0.193 0.000 1.099 154 K HN 0.507 8.875 8.250 0.198 0.000 0.448 155 K N 4.356 124.853 120.400 0.163 0.000 2.578 155 K HA -0.536 3.998 4.320 0.110 -0.148 0.279 155 K C 1.143 177.753 176.600 0.018 0.000 0.983 155 K CA 2.354 58.694 56.287 0.088 0.000 1.078 155 K CB -0.091 32.435 32.500 0.044 0.000 0.852 155 K HN 0.798 9.134 8.250 0.212 0.042 0.490 156 G N 5.266 114.064 108.800 -0.005 0.000 2.189 156 G HA2 -0.531 3.401 3.960 -0.047 0.000 0.267 156 G HA3 -0.531 3.405 3.960 -0.041 0.000 0.267 156 G C -0.721 174.151 174.900 -0.046 0.000 0.975 156 G CA 0.137 45.215 45.100 -0.036 0.000 0.644 156 G HN 0.593 8.883 8.290 -0.001 0.000 0.537 157 D N 1.197 121.585 120.400 -0.020 0.000 2.264 157 D HA 0.179 4.784 4.640 -0.059 0.000 0.250 157 D C -0.740 175.543 176.300 -0.029 0.000 1.113 157 D CA -0.199 53.782 54.000 -0.031 0.000 0.871 157 D CB 1.296 42.089 40.800 -0.011 0.000 1.167 157 D HN -0.050 8.238 8.370 0.014 0.091 0.447 158 I N 3.610 124.135 120.570 -0.075 0.000 2.342 158 I HA 0.214 4.486 4.170 -0.053 -0.134 0.291 158 I C -0.401 175.695 176.117 -0.035 0.000 1.010 158 I CA -1.732 59.513 61.300 -0.093 0.000 1.308 158 I CB -0.487 37.363 38.000 -0.251 0.000 1.400 158 I HN 0.301 8.453 8.210 -0.095 0.000 0.488 159 L N 6.481 127.733 121.223 0.048 0.000 2.346 159 L HA 0.471 4.981 4.340 0.065 -0.131 0.276 159 L C -1.458 175.513 176.870 0.168 0.000 1.006 159 L CA -1.422 53.477 54.840 0.098 0.000 0.817 159 L CB 3.756 45.894 42.059 0.131 0.000 1.272 159 L HN 1.182 9.338 8.230 0.079 0.122 0.421 160 R N 2.314 122.907 120.500 0.155 0.000 2.368 160 R HA 0.320 4.837 4.340 0.295 0.000 0.302 160 R C -1.223 175.194 176.300 0.194 0.000 1.002 160 R CA -1.429 54.794 56.100 0.204 0.000 0.929 160 R CB 1.794 32.187 30.300 0.155 0.000 1.073 160 R HN 0.263 8.601 8.270 0.113 0.000 0.464 161 I N 3.729 124.426 120.570 0.212 0.000 2.696 161 I HA 0.045 4.520 4.170 0.238 -0.163 0.284 161 I C 0.746 176.940 176.117 0.128 0.000 1.129 161 I CA 0.109 61.526 61.300 0.194 0.000 1.410 161 I CB -0.718 37.387 38.000 0.174 0.000 1.399 161 I HN 0.062 8.411 8.210 0.231 0.000 0.579 162 R N 1.182 121.752 120.500 0.117 0.000 2.582 162 R HA 0.436 4.999 4.340 0.065 -0.185 0.285 162 R C -1.370 174.964 176.300 0.056 0.000 0.940 162 R CA -1.046 55.102 56.100 0.079 0.000 1.072 162 R CB 3.471 33.821 30.300 0.083 0.000 1.527 162 R HN 0.583 8.943 8.270 0.150 0.000 0.538 163 D N -5.328 115.111 120.400 0.065 0.000 2.983 163 D HA 0.052 4.689 4.640 -0.004 0.000 0.269 163 D C -2.504 173.831 176.300 0.058 0.000 1.121 163 D CA 0.420 54.442 54.000 0.036 0.000 0.724 163 D CB 3.339 44.164 40.800 0.042 0.000 1.381 163 D HN -0.738 7.693 8.370 0.101 0.000 0.442 164 K N 1.879 122.285 120.400 0.010 0.000 2.419 164 K HA 0.494 4.903 4.320 0.149 0.000 0.244 164 K C -1.639 175.029 176.600 0.113 0.000 1.045 164 K CA -2.767 53.547 56.287 0.045 0.000 1.004 164 K CB -0.283 32.144 32.500 -0.123 0.000 1.376 164 K HN 0.154 8.395 8.250 -0.015 0.000 0.460 165 P HA 0.212 4.681 4.420 0.083 0.000 0.245 165 P C -0.709 176.715 177.300 0.207 0.000 1.203 165 P CA 0.495 63.680 63.100 0.141 0.000 0.792 165 P CB 1.252 33.023 31.700 0.119 0.000 0.997 166 E N -1.067 119.333 120.200 0.334 0.000 2.459 166 E HA 0.183 4.813 4.350 0.467 0.000 0.275 166 E C -1.559 175.343 176.600 0.504 0.000 0.987 166 E CA -1.013 55.662 56.400 0.460 0.000 0.828 166 E CB 2.837 32.838 29.700 0.503 0.000 1.428 166 E HN -0.826 7.716 8.360 0.376 0.043 0.457 167 E N -2.638 117.910 120.200 0.579 0.000 2.447 167 E HA -0.036 4.573 4.350 0.432 0.000 0.195 167 E C 0.398 177.257 176.600 0.433 0.000 1.028 167 E CA 2.487 59.181 56.400 0.491 0.000 0.876 167 E CB 0.949 30.958 29.700 0.515 0.000 0.885 167 E HN 0.462 9.245 8.360 0.706 0.000 0.500 168 Q N -5.042 115.012 119.800 0.422 0.000 2.127 168 Q HA 0.202 4.549 4.340 0.012 0.000 0.222 168 Q C -2.257 173.555 176.000 -0.314 0.000 0.794 168 Q CA -0.591 55.264 55.803 0.087 0.000 1.010 168 Q CB 0.689 29.480 28.738 0.089 0.000 1.170 168 Q HN 0.128 8.691 8.270 0.562 0.044 0.479 169 W N -1.571 119.795 121.300 0.110 0.000 3.132 169 W HA 0.568 5.343 4.660 -0.144 -0.201 0.337 169 W C -2.020 174.702 176.519 0.337 0.000 1.082 169 W CA -0.734 56.645 57.345 0.056 0.000 1.242 169 W CB 2.894 32.392 29.460 0.063 0.000 1.354 169 W HN -0.473 8.038 8.180 0.552 0.000 0.461 170 W N -0.197 121.246 121.300 0.238 0.000 2.578 170 W HA 0.339 5.101 4.660 0.170 0.000 0.353 170 W C -1.016 175.611 176.519 0.180 0.000 1.088 170 W CA -3.728 53.721 57.345 0.174 0.000 1.235 170 W CB 1.823 31.352 29.460 0.114 0.000 1.362 170 W HN 0.722 8.937 8.180 0.058 0.000 0.592 171 N N 0.720 119.641 118.700 0.369 0.000 2.444 171 N HA 0.545 5.618 4.740 0.246 -0.185 0.271 171 N C -1.552 174.095 175.510 0.228 0.000 1.069 171 N CA 0.001 53.200 53.050 0.249 0.000 0.965 171 N CB 1.534 40.122 38.487 0.169 0.000 1.092 171 N HN 0.694 9.172 8.380 0.341 0.107 0.476 172 A N 2.131 125.073 122.820 0.203 0.000 2.587 172 A HA 0.851 5.447 4.320 0.164 -0.177 0.293 172 A C -2.363 175.304 177.584 0.139 0.000 1.087 172 A CA -1.552 50.592 52.037 0.177 0.000 0.692 172 A CB 4.173 23.294 19.000 0.202 0.000 1.291 172 A HN 0.861 9.028 8.150 0.201 0.104 0.407 173 E N -0.445 119.822 120.200 0.112 0.000 2.248 173 E HA 0.483 5.026 4.350 0.086 -0.141 0.272 173 E C -1.374 175.271 176.600 0.075 0.000 1.008 173 E CA -1.611 54.840 56.400 0.085 0.000 0.856 173 E CB 3.154 32.892 29.700 0.063 0.000 1.120 173 E HN -0.112 8.316 8.360 0.113 0.000 0.397 174 D N 1.586 122.024 120.400 0.063 0.000 2.437 174 D HA 0.253 4.925 4.640 0.053 0.000 0.259 174 D C 1.202 177.510 176.300 0.014 0.000 1.118 174 D CA -0.579 53.449 54.000 0.046 0.000 1.017 174 D CB 2.432 43.263 40.800 0.052 0.000 1.120 174 D HN 0.238 8.645 8.370 0.062 0.000 0.541 175 S N -0.401 115.293 115.700 -0.011 0.000 2.603 175 S HA -0.112 4.342 4.470 -0.027 0.000 0.229 175 S C 0.174 174.759 174.600 -0.025 0.000 0.972 175 S CA 2.138 60.321 58.200 -0.029 0.000 0.935 175 S CB -0.226 62.944 63.200 -0.050 0.000 0.769 175 S HN 0.228 8.671 8.310 -0.015 -0.142 0.536 176 E N -1.575 118.618 120.200 -0.013 0.000 2.473 176 E HA 0.051 4.393 4.350 -0.015 0.000 0.204 176 E C 0.033 176.637 176.600 0.005 0.000 0.994 176 E CA -0.013 56.382 56.400 -0.007 0.000 0.945 176 E CB 0.582 30.279 29.700 -0.005 0.000 0.990 176 E HN -0.332 7.919 8.360 -0.003 0.108 0.493 177 G N -0.567 108.240 108.800 0.012 0.000 2.278 177 G HA2 -0.352 3.811 3.960 0.017 0.000 0.210 177 G HA3 -0.352 3.617 3.960 0.015 0.000 0.210 177 G C -1.361 173.556 174.900 0.028 0.000 1.000 177 G CA -0.028 45.082 45.100 0.018 0.000 0.635 177 G HN -0.299 7.884 8.290 0.013 0.115 0.495 178 K N 0.976 121.396 120.400 0.034 0.000 2.414 178 K HA -0.116 4.227 4.320 0.037 0.000 0.272 178 K C -0.678 175.954 176.600 0.054 0.000 0.993 178 K CA 0.581 56.894 56.287 0.043 0.000 0.964 178 K CB 0.568 33.099 32.500 0.051 0.000 0.925 178 K HN -0.149 8.044 8.250 0.031 0.075 0.487 179 R N -0.176 120.356 120.500 0.053 0.000 2.787 179 R HA 0.285 4.670 4.340 0.075 0.000 0.271 179 R C 0.147 176.490 176.300 0.071 0.000 0.993 179 R CA -1.451 54.688 56.100 0.065 0.000 0.993 179 R CB 2.533 32.865 30.300 0.055 0.000 1.155 179 R HN 0.084 8.381 8.270 0.045 0.000 0.486 180 G N -0.458 108.398 108.800 0.093 0.000 2.360 180 G HA2 0.135 4.257 3.960 0.076 0.000 0.276 180 G HA3 0.135 4.268 3.960 0.093 -0.117 0.276 180 G C -2.916 172.072 174.900 0.148 0.000 1.256 180 G CA 0.192 45.352 45.100 0.099 0.000 0.890 180 G HN -0.174 8.178 8.290 0.103 0.000 0.486 181 M N -1.410 118.295 119.600 0.176 0.000 2.465 181 M HA 0.929 5.741 4.480 0.279 -0.165 0.316 181 M C -1.612 174.934 176.300 0.411 0.000 1.121 181 M CA -0.757 54.710 55.300 0.278 0.000 0.934 181 M CB 3.901 36.661 32.600 0.268 0.000 1.692 181 M HN -0.193 8.139 8.290 0.137 0.040 0.444 182 I N -3.621 117.198 120.570 0.414 0.000 2.750 182 I HA 0.843 5.357 4.170 0.573 0.000 0.308 182 I C -2.305 173.850 176.117 0.063 0.000 1.016 182 I CA -3.724 57.796 61.300 0.366 0.000 1.098 182 I CB 2.364 40.473 38.000 0.181 0.000 1.279 182 I HN 1.269 9.579 8.210 0.351 0.110 0.454 183 P HA 0.294 3.356 4.420 -2.524 -0.157 0.277 183 P C -0.668 176.044 177.300 -0.981 0.000 1.240 183 P CA -0.701 61.506 63.100 -1.488 0.000 0.798 183 P CB 0.951 31.799 31.700 -1.421 0.000 0.979 184 V N 0.574 119.873 119.914 -1.024 0.000 2.379 184 V HA -0.018 3.405 4.120 -1.161 0.000 0.243 184 V C -0.748 175.014 176.094 -0.554 0.000 1.035 184 V CA 3.480 65.256 62.300 -0.873 0.000 1.035 184 V CB -1.867 29.563 31.823 -0.655 0.000 0.673 184 V HN 0.622 8.019 8.190 -1.198 0.075 0.457 185 P HA 0.085 4.328 4.420 -0.294 0.000 0.249 185 P C -1.614 175.421 177.300 -0.441 0.000 1.544 185 P CA 0.058 62.943 63.100 -0.357 0.000 0.932 185 P CB -0.971 30.552 31.700 -0.295 0.000 1.524 186 Y N -3.089 116.954 120.300 -0.428 0.000 2.476 186 Y HA 0.093 4.507 4.550 -0.227 0.000 0.261 186 Y C -1.255 174.429 175.900 -0.359 0.000 1.077 186 Y CA -0.317 57.545 58.100 -0.396 0.000 1.240 186 Y CB 2.554 40.632 38.460 -0.636 0.000 1.317 186 Y HN -0.227 7.723 8.280 -0.372 0.107 0.540 187 V N -6.257 113.513 119.914 -0.239 0.000 3.166 187 V HA 0.372 4.414 4.120 -0.129 0.000 0.317 187 V C -1.781 174.245 176.094 -0.113 0.000 1.136 187 V CA -2.700 59.492 62.300 -0.179 0.000 1.035 187 V CB 2.560 34.255 31.823 -0.213 0.000 1.110 187 V HN -1.026 6.976 8.190 -0.314 0.000 0.450 188 E N 1.200 121.384 120.200 -0.028 0.000 2.151 188 E HA 0.293 4.641 4.350 -0.003 0.000 0.275 188 E C -0.587 176.078 176.600 0.108 0.000 0.936 188 E CA -2.094 54.328 56.400 0.037 0.000 0.777 188 E CB 2.807 32.562 29.700 0.092 0.000 1.108 188 E HN -0.167 8.186 8.360 -0.012 0.000 0.401 189 K N 5.727 126.176 120.400 0.083 0.000 2.402 189 K HA -0.008 4.414 4.320 0.170 0.000 0.285 189 K C -0.633 176.049 176.600 0.137 0.000 1.054 189 K CA 0.652 57.015 56.287 0.126 0.000 1.001 189 K CB 0.012 32.572 32.500 0.101 0.000 0.946 189 K HN 0.473 8.745 8.250 0.037 0.000 0.473 190 Y N 5.167 125.479 120.300 0.020 0.000 2.364 190 Y HA -0.022 4.516 4.550 -0.020 0.000 0.340 190 Y C -1.129 174.663 175.900 -0.179 0.000 0.975 190 Y CA 0.043 58.120 58.100 -0.038 0.000 1.089 190 Y CB 2.745 41.237 38.460 0.055 0.000 1.192 190 Y HN -0.282 8.155 8.280 0.261 0.000 0.454 191 R N 6.725 127.089 120.500 -0.227 0.000 2.320 191 R HA 0.316 4.527 4.340 -0.215 0.000 0.319 191 R C -1.198 174.987 176.300 -0.191 0.000 0.969 191 R CA -2.729 53.247 56.100 -0.207 0.000 0.857 191 R CB 0.876 31.080 30.300 -0.160 0.000 1.160 191 R HN 0.266 8.282 8.270 -0.424 0.000 0.491 192 P HA -0.022 4.422 4.420 0.040 0.000 0.206 192 P C -0.869 176.416 177.300 -0.026 0.000 1.212 192 P CA 0.945 63.998 63.100 -0.077 0.000 0.919 192 P CB 0.612 32.257 31.700 -0.092 0.000 0.755 193 A N -3.280 119.527 122.820 -0.022 0.000 1.475 193 A HA -0.027 4.284 4.320 -0.015 0.000 0.201 193 A C -1.224 176.365 177.584 0.009 0.000 1.981 193 A CA 0.091 52.127 52.037 -0.001 0.000 1.612 193 A CB -0.699 18.314 19.000 0.022 0.000 1.532 193 A HN -0.304 7.823 8.150 -0.038 0.000 0.294 194 S N 0.740 116.455 115.700 0.025 0.000 3.869 194 S HA 0.162 4.650 4.470 0.029 0.000 0.241 194 S C -0.373 174.243 174.600 0.027 0.000 1.363 194 S CA -0.064 58.156 58.200 0.033 0.000 0.894 194 S CB -0.630 62.601 63.200 0.051 0.000 1.519 194 S HN 0.082 8.416 8.310 0.039 0.000 0.470 195 A N 4.144 126.976 122.820 0.020 0.000 1.857 195 A HA 0.247 4.582 4.320 0.024 0.000 0.198 195 A C -0.109 177.505 177.584 0.050 0.000 1.775 195 A CA 0.199 52.250 52.037 0.023 0.000 1.281 195 A CB 1.580 20.578 19.000 -0.003 0.000 1.355 195 A HN -0.239 7.891 8.150 0.022 0.033 0.417 196 S N -0.033 115.709 115.700 0.071 0.000 2.475 196 S HA 0.206 4.754 4.470 0.130 0.000 0.249 196 S C -0.555 174.092 174.600 0.078 0.000 1.298 196 S CA 0.712 58.990 58.200 0.130 0.000 1.125 196 S CB -0.766 62.580 63.200 0.242 0.000 1.054 196 S HN 0.016 8.356 8.310 0.051 0.000 0.484 197 V N 3.600 123.536 119.914 0.037 0.000 3.219 197 V HA 0.133 4.269 4.120 0.027 0.000 0.214 197 V C -0.596 175.496 176.094 -0.005 0.000 1.433 197 V CA -0.475 61.837 62.300 0.019 0.000 1.301 197 V CB 1.281 33.115 31.823 0.019 0.000 1.160 197 V HN 0.185 8.390 8.190 0.025 0.000 0.505 198 S N -0.728 114.964 115.700 -0.014 0.000 3.381 198 S HA -0.301 4.153 4.470 -0.028 0.000 0.636 198 S C -0.345 174.243 174.600 -0.019 0.000 2.614 198 S CA 0.286 58.468 58.200 -0.029 0.000 2.810 198 S CB 0.245 63.410 63.200 -0.058 0.000 0.331 198 S HN -0.271 8.036 8.310 -0.006 0.000 1.788 199 A N 0.577 123.383 122.820 -0.024 0.000 1.908 199 A HA 0.046 4.360 4.320 -0.011 0.000 0.217 199 A C -1.024 176.550 177.584 -0.017 0.000 1.378 199 A CA 1.452 53.479 52.037 -0.017 0.000 0.613 199 A CB -0.120 18.870 19.000 -0.017 0.000 1.053 199 A HN 0.498 8.629 8.150 -0.032 0.000 0.484 200 L N -4.563 116.647 121.223 -0.022 0.000 1.276 200 L HA -0.070 4.258 4.340 -0.020 0.000 0.093 200 L C 0.331 177.185 176.870 -0.025 0.000 1.433 200 L CA 0.662 55.490 54.840 -0.020 0.000 1.166 200 L CB 0.283 42.334 42.059 -0.013 0.000 2.405 200 L HN -0.318 7.896 8.230 -0.027 0.000 0.460 201 I N -2.235 118.321 120.570 -0.024 0.000 4.701 201 I HA -0.445 3.711 4.170 -0.024 0.000 0.046 201 I C 0.387 176.490 176.117 -0.022 0.000 0.626 201 I CA 1.094 62.378 61.300 -0.026 0.000 0.723 201 I CB -0.815 37.164 38.000 -0.035 0.000 0.675 201 I HN -0.004 8.193 8.210 -0.021 0.000 0.157 202 G N 0.485 109.272 108.800 -0.023 0.000 2.741 202 G HA2 -0.244 3.705 3.960 -0.017 0.000 0.222 202 G HA3 -0.244 3.707 3.960 -0.015 0.000 0.222 202 G C -0.947 173.941 174.900 -0.021 0.000 1.364 202 G CA -0.546 44.543 45.100 -0.019 0.000 0.866 202 G HN -0.047 8.174 8.290 -0.027 0.053 0.555 203 G N -2.077 106.713 108.800 -0.017 0.000 3.140 203 G HA2 0.186 4.134 3.960 -0.021 0.000 0.271 203 G HA3 0.186 4.136 3.960 -0.017 0.000 0.271 203 G C -1.270 173.622 174.900 -0.013 0.000 1.370 203 G CA -0.199 44.891 45.100 -0.017 0.000 1.014 203 G HN 0.095 8.377 8.290 -0.013 0.000 0.541 204 N N -2.096 116.597 118.700 -0.013 0.000 2.591 204 N HA 0.026 4.761 4.740 -0.008 0.000 0.275 204 N C -0.880 174.625 175.510 -0.008 0.000 0.863 204 N CA 0.493 53.538 53.050 -0.010 0.000 1.019 204 N CB 1.177 39.657 38.487 -0.011 0.000 1.674 204 N HN 0.438 8.809 8.380 -0.015 0.000 1.001 205 Q N 1.308 121.102 119.800 -0.009 0.000 2.695 205 Q HA 0.329 4.666 4.340 -0.005 0.000 0.246 205 Q C -1.578 174.417 176.000 -0.008 0.000 0.961 205 Q CA -0.383 55.416 55.803 -0.007 0.000 0.708 205 Q CB -0.076 28.658 28.738 -0.007 0.000 1.282 205 Q HN 0.070 8.333 8.270 -0.012 0.000 0.482 206 E N 2.167 122.363 120.200 -0.006 0.000 2.428 206 E HA 0.217 4.562 4.350 -0.009 0.000 0.259 206 E C -0.820 175.781 176.600 0.002 0.000 0.930 206 E CA -1.359 55.037 56.400 -0.006 0.000 0.823 206 E CB 1.195 30.888 29.700 -0.011 0.000 1.403 206 E HN -0.272 8.085 8.360 -0.004 0.000 0.415 207 G N -0.399 108.406 108.800 0.008 0.000 4.167 207 G HA2 0.004 3.974 3.960 0.016 0.000 0.201 207 G HA3 0.004 3.972 3.960 0.013 0.000 0.201 207 G C -0.680 174.238 174.900 0.030 0.000 1.186 207 G CA 0.475 45.585 45.100 0.016 0.000 0.979 207 G HN 0.545 8.839 8.290 0.005 0.000 0.460 208 S N -0.394 115.326 115.700 0.033 0.000 2.689 208 S HA 0.204 4.718 4.470 0.073 0.000 0.306 208 S C -0.912 173.737 174.600 0.082 0.000 1.104 208 S CA -0.836 57.400 58.200 0.061 0.000 0.973 208 S CB 2.107 65.336 63.200 0.049 0.000 1.121 208 S HN -0.545 7.778 8.310 0.020 0.000 0.523 209 H N 3.963 123.036 119.070 0.006 0.000 3.017 209 H HA 0.195 4.755 4.556 0.007 0.000 0.276 209 H C -0.945 174.388 175.328 0.009 0.000 1.062 209 H CA -1.279 54.773 56.048 0.008 0.000 1.486 209 H CB 0.448 30.215 29.762 0.010 0.000 1.507 209 H HN 0.243 8.647 8.280 0.207 0.000 0.508 210 P HA 0.105 4.513 4.420 -0.020 0.000 0.274 210 P C -0.836 176.443 177.300 -0.035 0.000 1.260 210 P CA -0.537 62.522 63.100 -0.068 0.000 0.793 210 P CB 0.824 32.465 31.700 -0.099 0.000 1.048 211 Q N -1.291 118.507 119.800 -0.003 0.000 2.221 211 Q HA 0.347 4.718 4.340 0.053 0.000 0.242 211 Q C -1.328 174.682 176.000 0.016 0.000 0.940 211 Q CA -1.719 54.099 55.803 0.026 0.000 0.896 211 Q CB -0.334 28.422 28.738 0.031 0.000 1.226 211 Q HN 0.134 8.400 8.270 -0.007 0.000 0.463 212 P HA 0.058 4.493 4.420 0.026 0.000 0.235 212 P C -1.353 175.970 177.300 0.038 0.000 1.720 212 P CA 0.075 63.202 63.100 0.045 0.000 1.003 212 P CB -1.102 30.651 31.700 0.088 0.000 1.968 213 L N 1.421 122.654 121.223 0.017 0.000 2.387 213 L HA 0.160 4.513 4.340 0.022 0.000 0.266 213 L C 2.497 179.370 176.870 0.005 0.000 1.059 213 L CA 0.019 54.867 54.840 0.013 0.000 0.801 213 L CB 0.310 42.372 42.059 0.005 0.000 1.223 213 L HN 0.225 8.393 8.230 0.004 0.065 0.456 214 G N 1.039 109.842 108.800 0.005 0.000 3.444 214 G HA2 -0.258 3.701 3.960 -0.002 0.000 0.222 214 G HA3 -0.258 3.697 3.960 -0.008 0.000 0.222 214 G C -0.491 174.411 174.900 0.003 0.000 1.358 214 G CA -0.143 44.957 45.100 -0.001 0.000 0.880 214 G HN 0.628 8.923 8.290 0.008 0.000 0.555 215 G N 1.219 110.023 108.800 0.007 0.000 3.014 215 G HA2 -0.166 3.812 3.960 0.030 0.000 0.683 215 G HA3 -0.166 3.802 3.960 0.013 0.000 0.683 215 G C -2.979 171.918 174.900 -0.004 0.000 1.271 215 G CA -0.789 44.319 45.100 0.013 0.000 0.843 215 G HN -0.399 7.815 8.290 0.004 0.078 0.612 216 P HA 0.168 4.558 4.420 -0.051 0.000 0.272 216 P C -1.146 176.131 177.300 -0.038 0.000 1.230 216 P CA -0.919 62.165 63.100 -0.026 0.000 0.788 216 P CB 0.917 32.618 31.700 0.002 0.000 0.949 217 E N 0.726 120.882 120.200 -0.073 0.000 2.383 217 E HA 0.037 4.352 4.350 -0.059 0.000 0.264 217 E C -1.455 175.106 176.600 -0.065 0.000 1.050 217 E CA -1.268 55.088 56.400 -0.073 0.000 0.896 217 E CB -0.435 29.206 29.700 -0.097 0.000 0.982 217 E HN 0.088 8.384 8.360 -0.107 0.000 0.424 218 P HA -0.067 4.444 4.420 -0.109 -0.157 0.268 218 P C -0.864 176.364 177.300 -0.121 0.000 1.204 218 P CA -0.034 62.998 63.100 -0.115 0.000 0.768 218 P CB 0.464 32.076 31.700 -0.145 0.000 0.842 219 G N 2.262 110.980 108.800 -0.138 0.000 2.398 219 G HA2 0.057 3.912 3.960 -0.175 0.000 0.251 219 G HA3 0.057 4.007 3.960 -0.016 0.000 0.251 219 G C -1.946 172.929 174.900 -0.041 0.000 1.277 219 G CA 0.513 45.556 45.100 -0.095 0.000 0.927 219 G HN -0.493 7.703 8.290 -0.157 0.000 0.477 220 P HA 0.035 4.556 4.420 -0.033 -0.121 0.220 220 P C -0.237 177.044 177.300 -0.032 0.000 1.148 220 P CA 0.819 63.912 63.100 -0.012 0.000 0.803 220 P CB 0.367 32.040 31.700 -0.044 0.000 0.782 221 Y N -2.780 117.487 120.300 -0.055 0.000 2.373 221 Y HA -0.184 4.342 4.550 -0.039 0.000 0.293 221 Y C -0.475 175.400 175.900 -0.041 0.000 1.129 221 Y CA 0.702 58.776 58.100 -0.044 0.000 1.226 221 Y CB 0.163 38.599 38.460 -0.040 0.000 1.000 221 Y HN -0.231 8.286 8.280 0.441 0.028 0.549 222 A N -3.299 119.580 122.820 0.100 0.000 2.579 222 A HA 0.310 4.657 4.320 0.044 0.000 0.288 222 A C -2.601 174.976 177.584 -0.013 0.000 1.079 222 A CA -0.093 51.972 52.037 0.046 0.000 0.889 222 A CB 1.017 20.051 19.000 0.058 0.000 1.439 222 A HN -0.724 7.354 8.150 0.098 0.131 0.399 223 Q N 3.561 123.358 119.800 -0.004 0.000 2.306 223 Q HA 0.457 4.678 4.340 -0.200 0.000 0.265 223 Q C -2.403 173.660 176.000 0.105 0.000 1.022 223 Q CA -3.249 52.525 55.803 -0.050 0.000 0.853 223 Q CB 0.916 29.638 28.738 -0.027 0.000 1.327 223 Q HN 0.017 8.306 8.270 0.032 0.000 0.449 224 P HA -0.118 4.528 4.420 0.216 -0.097 0.282 224 P C 0.053 177.533 177.300 0.300 0.000 1.273 224 P CA -0.105 63.173 63.100 0.296 0.000 0.809 224 P CB 0.571 32.567 31.700 0.493 0.000 1.246 225 S N 1.070 116.926 115.700 0.260 0.000 3.007 225 S HA -0.256 4.298 4.470 0.139 0.000 0.312 225 S C 1.214 175.893 174.600 0.131 0.000 1.068 225 S CA 1.276 59.578 58.200 0.170 0.000 1.597 225 S CB -1.282 62.008 63.200 0.150 0.000 1.495 225 S HN -0.139 8.342 8.310 0.284 0.000 0.612 226 V N -2.999 116.997 119.914 0.136 0.000 3.048 226 V HA 0.149 4.276 4.120 0.013 0.000 0.241 226 V C 0.414 176.525 176.094 0.028 0.000 1.129 226 V CA 1.042 63.392 62.300 0.083 0.000 1.128 226 V CB 0.607 32.534 31.823 0.172 0.000 0.849 226 V HN -0.067 8.202 8.190 0.150 0.011 0.475 227 N N -2.147 116.579 118.700 0.043 0.000 2.160 227 N HA 0.109 4.848 4.740 -0.003 0.000 0.226 227 N C -0.989 174.532 175.510 0.019 0.000 1.256 227 N CA -0.016 53.045 53.050 0.019 0.000 0.890 227 N CB 1.054 39.556 38.487 0.024 0.000 1.116 227 N HN 0.170 8.593 8.380 0.071 0.000 0.517 228 T N 0.590 115.162 114.554 0.030 0.000 2.801 228 T HA 0.492 4.848 4.350 0.010 0.000 0.306 228 T C -1.710 172.983 174.700 -0.012 0.000 1.020 228 T CA -2.992 59.118 62.100 0.017 0.000 0.948 228 T CB 0.988 69.883 68.868 0.044 0.000 0.962 228 T HN -0.537 7.731 8.240 0.045 0.000 0.465 229 P HA 0.036 4.423 4.420 -0.054 0.000 0.217 229 P C -1.293 175.942 177.300 -0.107 0.000 1.151 229 P CA 1.640 64.700 63.100 -0.065 0.000 0.828 229 P CB 0.450 32.110 31.700 -0.066 0.000 0.788 230 L N -7.452 113.693 121.223 -0.130 0.000 2.862 230 L HA 0.443 4.658 4.340 -0.208 0.000 0.169 230 L C -1.909 174.851 176.870 -0.183 0.000 1.164 230 L CA -2.375 52.346 54.840 -0.198 0.000 0.858 230 L CB -1.690 40.205 42.059 -0.273 0.000 1.329 230 L HN -0.335 7.829 8.230 -0.110 0.000 0.514 231 P HA -0.153 4.183 4.420 -0.142 0.000 0.263 231 P C -1.403 175.890 177.300 -0.012 0.000 1.175 231 P CA 0.663 63.707 63.100 -0.094 0.000 0.761 231 P CB 0.099 31.790 31.700 -0.015 0.000 0.794 232 N N -0.219 118.494 118.700 0.021 0.000 2.413 232 N HA 0.057 4.978 4.740 0.080 -0.134 0.266 232 N C 0.111 175.684 175.510 0.105 0.000 1.238 232 N CA -0.646 52.448 53.050 0.073 0.000 0.972 232 N CB 2.558 41.097 38.487 0.086 0.000 1.210 232 N HN 0.020 8.406 8.380 0.010 0.000 0.547 233 L N -5.717 115.582 121.223 0.127 0.000 2.859 233 L HA 0.370 4.792 4.340 0.138 0.000 0.334 233 L C 0.281 177.228 176.870 0.128 0.000 1.283 233 L CA 0.113 55.036 54.840 0.137 0.000 0.728 233 L CB -0.428 41.722 42.059 0.152 0.000 1.110 233 L HN -0.385 8.098 8.230 0.139 -0.169 0.550 234 Q N 0.415 120.287 119.800 0.119 0.000 2.077 234 Q HA -0.363 4.337 4.340 0.128 -0.283 0.206 234 Q C -0.601 175.440 176.000 0.069 0.000 0.989 234 Q CA 2.848 58.711 55.803 0.101 0.000 0.853 234 Q CB -0.175 28.606 28.738 0.071 0.000 0.907 234 Q HN 0.033 8.358 8.270 0.119 0.016 0.418 235 N N -4.267 114.473 118.700 0.067 0.000 2.218 235 N HA -0.003 4.761 4.740 0.041 0.000 0.224 235 N C -1.215 174.345 175.510 0.083 0.000 1.248 235 N CA -0.235 52.848 53.050 0.054 0.000 0.875 235 N CB 1.742 40.250 38.487 0.035 0.000 1.165 235 N HN -0.320 8.105 8.380 0.075 0.000 0.485 236 G N -0.509 108.360 108.800 0.114 0.000 2.661 236 G HA2 -0.119 3.979 3.960 0.229 0.000 0.262 236 G HA3 -0.119 3.949 3.960 0.180 0.000 0.262 236 G C -2.472 172.527 174.900 0.165 0.000 1.310 236 G CA -0.797 44.412 45.100 0.181 0.000 1.160 236 G HN -0.486 7.866 8.290 0.103 0.000 0.598 237 P HA -0.057 4.356 4.420 -0.012 0.000 0.287 237 P C -0.712 176.509 177.300 -0.132 0.000 1.282 237 P CA -0.761 62.314 63.100 -0.042 0.000 0.804 237 P CB 0.836 32.439 31.700 -0.163 0.000 1.323 238 I N -0.688 119.722 120.570 -0.266 0.000 2.347 238 I HA -0.064 4.063 4.170 -0.072 0.000 0.294 238 I C -0.847 175.058 176.117 -0.354 0.000 1.090 238 I CA -0.815 60.364 61.300 -0.202 0.000 1.314 238 I CB -2.274 35.642 38.000 -0.140 0.000 1.423 238 I HN 0.161 8.209 8.210 -0.270 0.000 0.503 239 Y N 7.702 128.035 120.300 0.054 0.000 2.426 239 Y HA 0.071 4.662 4.550 0.068 0.000 0.325 239 Y C -1.557 174.375 175.900 0.052 0.000 0.989 239 Y CA -0.276 57.860 58.100 0.060 0.000 1.284 239 Y CB 0.928 39.426 38.460 0.064 0.000 1.104 239 Y HN 0.163 8.512 8.280 0.114 0.000 0.481 240 A N 4.155 127.082 122.820 0.179 0.000 1.568 240 A HA 0.104 4.503 4.320 0.131 0.000 0.147 240 A C -2.261 175.379 177.584 0.094 0.000 1.552 240 A CA 0.588 52.698 52.037 0.121 0.000 2.807 240 A CB 1.298 20.348 19.000 0.083 0.000 2.976 240 A HN 0.157 8.402 8.150 0.159 0.000 1.316 241 R N 0.713 121.252 120.500 0.064 0.000 2.574 241 R HA 0.255 4.910 4.340 0.056 -0.281 0.288 241 R C -0.644 175.680 176.300 0.040 0.000 1.004 241 R CA -1.511 54.619 56.100 0.050 0.000 0.895 241 R CB 2.633 32.956 30.300 0.038 0.000 1.191 241 R HN -0.209 8.094 8.270 0.054 0.000 0.444 242 V N 6.419 126.358 119.914 0.041 0.000 2.843 242 V HA -0.169 3.979 4.120 0.048 0.000 0.305 242 V C -0.391 175.723 176.094 0.032 0.000 1.120 242 V CA 1.544 63.869 62.300 0.042 0.000 1.254 242 V CB 0.598 32.444 31.823 0.039 0.000 0.901 242 V HN 0.881 8.984 8.190 0.041 0.111 0.503 243 I N 0.769 121.355 120.570 0.027 0.000 2.852 243 I HA -0.037 4.139 4.170 0.011 0.000 0.264 243 I C -0.565 175.563 176.117 0.018 0.000 1.179 243 I CA 0.152 61.459 61.300 0.012 0.000 1.480 243 I CB 0.505 38.499 38.000 -0.009 0.000 1.111 243 I HN 0.063 8.290 8.210 0.029 0.000 0.441 244 Q N 0.218 120.049 119.800 0.051 0.000 2.421 244 Q HA 0.141 4.508 4.340 0.044 0.000 0.280 244 Q C -2.019 174.080 176.000 0.165 0.000 1.085 244 Q CA -1.398 54.451 55.803 0.077 0.000 0.807 244 Q CB 3.769 32.500 28.738 -0.012 0.000 1.405 244 Q HN -0.384 7.930 8.270 0.073 0.000 0.419 245 K N 2.158 122.660 120.400 0.170 0.000 2.262 245 K HA -0.028 4.396 4.320 0.069 -0.062 0.282 245 K C -0.932 175.752 176.600 0.141 0.000 1.066 245 K CA -0.187 56.173 56.287 0.121 0.000 0.901 245 K CB 0.421 32.958 32.500 0.062 0.000 1.089 245 K HN 0.263 8.597 8.250 0.140 0.000 0.476 246 R N 7.785 128.257 120.500 -0.046 0.000 2.468 246 R HA 0.268 4.435 4.340 -0.288 0.000 0.302 246 R C -1.795 174.400 176.300 -0.175 0.000 1.041 246 R CA -2.580 53.345 56.100 -0.293 0.000 0.899 246 R CB 1.912 31.776 30.300 -0.727 0.000 1.167 246 R HN 0.657 8.786 8.270 -0.034 0.120 0.483 247 V N 1.429 121.267 119.914 -0.128 0.000 3.036 247 V HA 0.422 4.475 4.120 -0.111 0.000 0.308 247 V C -1.484 174.549 176.094 -0.102 0.000 1.070 247 V CA -4.080 58.158 62.300 -0.103 0.000 1.056 247 V CB -0.730 31.048 31.823 -0.075 0.000 1.084 247 V HN 0.051 8.174 8.190 -0.112 0.000 0.471 248 P HA 0.123 4.491 4.420 -0.088 0.000 0.282 248 P C -1.224 175.975 177.300 -0.169 0.000 1.259 248 P CA -0.976 62.057 63.100 -0.110 0.000 0.826 248 P CB 1.377 33.018 31.700 -0.098 0.000 1.064 249 N N 0.659 119.188 118.700 -0.284 0.000 2.453 249 N HA -0.105 4.455 4.740 -0.299 0.000 0.253 249 N C 1.975 177.219 175.510 -0.443 0.000 1.252 249 N CA 0.596 53.351 53.050 -0.491 0.000 0.917 249 N CB 0.987 38.763 38.487 -1.185 0.000 1.117 249 N HN -0.033 8.302 8.380 -0.269 -0.116 0.442 250 A N 1.514 124.158 122.820 -0.293 0.000 1.969 250 A HA -0.188 4.068 4.320 -0.106 0.000 0.218 250 A C 0.026 177.558 177.584 -0.088 0.000 1.169 250 A CA 2.309 54.273 52.037 -0.122 0.000 0.635 250 A CB -0.223 18.773 19.000 -0.007 0.000 0.810 250 A HN 0.531 8.547 8.150 -0.223 0.000 0.445 251 Y N -6.708 113.598 120.300 0.011 0.000 2.578 251 Y HA -0.027 4.529 4.550 0.010 0.000 0.297 251 Y C -0.818 175.094 175.900 0.020 0.000 1.176 251 Y CA -1.271 56.837 58.100 0.013 0.000 1.315 251 Y CB -1.079 37.388 38.460 0.011 0.000 1.031 251 Y HN -0.519 7.484 8.280 -0.429 0.019 0.524 252 D N 1.248 121.497 120.400 -0.251 0.000 2.398 252 D HA 0.015 4.666 4.640 0.019 0.000 0.247 252 D C -0.251 176.033 176.300 -0.027 0.000 1.227 252 D CA 0.290 54.226 54.000 -0.107 0.000 0.980 252 D CB 1.864 42.555 40.800 -0.181 0.000 1.106 252 D HN -0.611 7.277 8.370 -0.465 0.203 0.493 253 K N -0.646 119.755 120.400 0.001 0.000 2.755 253 K HA 0.143 4.455 4.320 -0.013 0.000 0.214 253 K C 0.434 177.015 176.600 -0.030 0.000 1.572 253 K CA 0.511 56.796 56.287 -0.004 0.000 1.020 253 K CB 0.562 33.075 32.500 0.021 0.000 1.905 253 K HN -0.074 8.191 8.250 0.024 0.000 0.467 254 T N 2.941 117.475 114.554 -0.034 0.000 3.312 254 T HA 0.104 4.408 4.350 -0.077 0.000 0.251 254 T C -1.347 173.224 174.700 -0.216 0.000 1.012 254 T CA -0.892 61.152 62.100 -0.093 0.000 0.925 254 T CB 0.264 69.089 68.868 -0.072 0.000 1.049 254 T HN -0.044 8.198 8.240 0.004 0.000 0.583 255 A N 0.039 122.764 122.820 -0.158 0.000 2.304 255 A HA -0.004 4.068 4.320 -0.413 0.000 0.271 255 A C -1.714 175.796 177.584 -0.123 0.000 1.091 255 A CA -0.843 51.087 52.037 -0.178 0.000 0.812 255 A CB 1.197 20.175 19.000 -0.037 0.000 1.056 255 A HN -0.356 7.627 8.150 -0.087 0.114 0.489 256 L N 0.086 121.271 121.223 -0.063 0.000 2.322 256 L HA 0.197 4.479 4.340 -0.096 0.000 0.279 256 L C -0.891 175.899 176.870 -0.134 0.000 1.036 256 L CA -1.035 53.761 54.840 -0.074 0.000 0.807 256 L CB 2.244 44.306 42.059 0.005 0.000 1.226 256 L HN 0.144 8.371 8.230 -0.005 0.000 0.433 257 A N 3.620 126.336 122.820 -0.174 0.000 2.294 257 A HA 0.092 4.322 4.320 -0.149 0.000 0.316 257 A C -1.668 175.764 177.584 -0.253 0.000 1.359 257 A CA -0.877 51.056 52.037 -0.173 0.000 0.956 257 A CB 0.212 19.140 19.000 -0.120 0.000 1.155 257 A HN 0.168 8.224 8.150 -0.158 0.000 0.544 258 L N 4.132 125.175 121.223 -0.300 0.000 2.282 258 L HA 0.307 4.422 4.340 -0.375 0.000 0.288 258 L C -1.651 175.130 176.870 -0.149 0.000 1.033 258 L CA -0.770 53.871 54.840 -0.331 0.000 0.807 258 L CB 1.894 43.683 42.059 -0.451 0.000 1.209 258 L HN -0.032 8.050 8.230 -0.247 0.000 0.423 259 E N 3.919 124.058 120.200 -0.101 0.000 2.278 259 E HA 0.149 4.489 4.350 -0.017 0.000 0.272 259 E C -1.994 174.600 176.600 -0.010 0.000 0.890 259 E CA -2.274 54.103 56.400 -0.038 0.000 0.770 259 E CB 3.140 32.816 29.700 -0.040 0.000 1.212 259 E HN 0.239 8.526 8.360 -0.121 0.000 0.415 260 V N 5.111 125.038 119.914 0.021 0.000 2.539 260 V HA -0.421 3.730 4.120 0.030 -0.013 0.294 260 V C -0.338 175.764 176.094 0.013 0.000 0.994 260 V CA 2.492 64.807 62.300 0.025 0.000 1.169 260 V CB -0.897 30.945 31.823 0.032 0.000 0.898 260 V HN 0.680 8.920 8.190 0.036 -0.029 0.471 261 G N 8.012 116.821 108.800 0.014 0.000 4.220 261 G HA2 -0.154 3.815 3.960 0.016 0.000 0.197 261 G HA3 -0.154 3.809 3.960 0.006 0.000 0.197 261 G C -0.742 174.168 174.900 0.016 0.000 1.518 261 G CA -0.240 44.868 45.100 0.012 0.000 0.955 261 G HN -0.432 7.956 8.290 0.019 -0.086 0.353 262 E N 1.461 121.665 120.200 0.007 0.000 2.435 262 E HA 0.005 4.364 4.350 0.015 0.000 0.254 262 E C -1.610 175.012 176.600 0.038 0.000 1.289 262 E CA 0.414 56.821 56.400 0.012 0.000 0.983 262 E CB 1.048 30.741 29.700 -0.012 0.000 1.010 262 E HN -0.609 7.749 8.360 -0.004 0.000 0.509 263 L N -0.244 121.014 121.223 0.059 0.000 2.333 263 L HA 0.459 4.869 4.340 0.117 0.000 0.280 263 L C -2.085 174.871 176.870 0.143 0.000 1.004 263 L CA -0.521 54.387 54.840 0.115 0.000 0.820 263 L CB 1.669 43.812 42.059 0.139 0.000 1.247 263 L HN 0.258 8.514 8.230 0.045 0.000 0.416 264 V N 5.836 125.867 119.914 0.194 0.000 2.735 264 V HA 0.706 5.236 4.120 0.220 -0.277 0.310 264 V C -1.525 174.790 176.094 0.368 0.000 1.061 264 V CA -3.156 59.299 62.300 0.259 0.000 0.913 264 V CB 3.216 35.198 31.823 0.265 0.000 1.005 264 V HN 0.333 8.633 8.190 0.183 0.000 0.428 265 K N 7.037 127.691 120.400 0.422 0.000 2.118 265 K HA 0.227 4.830 4.320 0.471 0.000 0.254 265 K C -1.180 175.675 176.600 0.425 0.000 0.961 265 K CA -1.885 54.700 56.287 0.498 0.000 0.876 265 K CB 1.666 34.487 32.500 0.535 0.000 1.077 265 K HN -0.308 8.151 8.250 0.349 0.000 0.440 266 V N 2.208 122.356 119.914 0.390 0.000 2.276 266 V HA -0.040 4.509 4.120 0.575 -0.084 0.249 266 V C -0.280 175.971 176.094 0.261 0.000 1.160 266 V CA -0.174 62.392 62.300 0.443 0.000 1.042 266 V CB -2.089 30.035 31.823 0.500 0.000 1.224 266 V HN 0.579 8.957 8.190 0.314 0.000 0.496 267 T N 7.099 121.773 114.554 0.200 0.000 2.762 267 T HA -0.021 4.391 4.350 0.103 0.000 0.303 267 T C -1.352 173.380 174.700 0.053 0.000 0.977 267 T CA -0.932 61.236 62.100 0.113 0.000 0.961 267 T CB 0.041 68.973 68.868 0.106 0.000 0.944 267 T HN 0.154 8.470 8.240 0.226 0.060 0.481 268 K N 5.567 125.975 120.400 0.013 0.000 5.407 268 K HA -0.273 4.012 4.320 -0.058 0.000 0.880 268 K C -2.200 174.353 176.600 -0.079 0.000 1.791 268 K CA 0.915 57.182 56.287 -0.034 0.000 1.529 268 K CB -0.131 32.364 32.500 -0.008 0.000 2.555 268 K HN 0.265 8.523 8.250 0.013 0.000 0.247 269 I N 2.492 122.913 120.570 -0.248 0.000 2.328 269 I HA 0.031 3.875 4.170 -0.542 0.000 0.287 269 I C -1.141 174.675 176.117 -0.502 0.000 1.012 269 I CA -1.354 59.545 61.300 -0.667 0.000 1.195 269 I CB 0.610 37.883 38.000 -1.212 0.000 1.350 269 I HN 0.016 8.088 8.210 -0.229 0.000 0.464 270 N N 7.095 125.665 118.700 -0.217 0.000 2.379 270 N HA 0.014 4.719 4.740 -0.059 0.000 0.260 270 N C 0.522 176.055 175.510 0.038 0.000 1.254 270 N CA 0.612 53.657 53.050 -0.010 0.000 0.958 270 N CB 1.685 40.243 38.487 0.117 0.000 1.208 270 N HN -0.320 8.077 8.380 0.029 0.000 0.532 271 V N -0.091 119.854 119.914 0.053 0.000 2.323 271 V HA -0.202 3.957 4.120 0.064 0.000 0.244 271 V C 0.578 176.755 176.094 0.139 0.000 1.041 271 V CA 2.769 65.108 62.300 0.065 0.000 1.025 271 V CB -0.019 31.797 31.823 -0.013 0.000 0.656 271 V HN 0.134 8.340 8.190 0.027 0.000 0.451 272 S N -1.849 113.920 115.700 0.115 0.000 2.942 272 S HA -0.098 4.414 4.470 0.070 0.000 0.244 272 S C 0.064 174.743 174.600 0.132 0.000 1.011 272 S CA 0.025 58.282 58.200 0.093 0.000 1.102 272 S CB -1.359 61.863 63.200 0.036 0.000 0.812 272 S HN 0.033 8.393 8.310 0.083 0.000 0.486 273 G N -0.397 108.585 108.800 0.303 0.000 2.336 273 G HA2 -0.380 3.842 3.960 0.150 0.000 0.233 273 G HA3 -0.380 3.567 3.960 -0.023 0.000 0.233 273 G C -0.916 173.894 174.900 -0.150 0.000 1.053 273 G CA 0.090 45.254 45.100 0.106 0.000 0.625 273 G HN -0.779 7.700 8.290 0.481 0.100 0.511 274 Q N 3.561 123.402 119.800 0.068 0.000 2.348 274 Q HA -0.027 4.202 4.340 -0.185 0.000 0.251 274 Q C -0.671 175.464 176.000 0.226 0.000 1.113 274 Q CA -0.038 55.757 55.803 -0.013 0.000 0.902 274 Q CB 0.086 28.794 28.738 -0.049 0.000 1.333 274 Q HN 0.032 8.283 8.270 0.106 0.082 0.457 275 W N 4.877 125.978 121.300 -0.332 0.000 2.671 275 W HA 0.402 5.003 4.660 -0.220 -0.073 0.360 275 W C -0.399 175.670 176.519 -0.750 0.000 1.128 275 W CA -3.658 53.436 57.345 -0.418 0.000 1.184 275 W CB 2.135 31.465 29.460 -0.218 0.000 1.415 275 W HN -0.304 7.623 8.180 -0.421 0.000 0.604 276 E N -2.516 117.532 120.200 -0.254 0.000 2.227 276 E HA 0.663 4.884 4.350 -0.438 -0.135 0.268 276 E C -0.924 175.598 176.600 -0.130 0.000 0.907 276 E CA -2.090 54.155 56.400 -0.258 0.000 0.786 276 E CB 2.563 32.239 29.700 -0.040 0.000 1.191 276 E HN 0.684 8.901 8.360 -0.053 0.112 0.411 277 G N -1.334 107.543 108.800 0.128 0.000 2.818 277 G HA2 0.402 4.759 3.960 0.285 0.000 0.286 277 G HA3 0.402 4.750 3.960 0.668 0.013 0.286 277 G C -2.637 172.449 174.900 0.310 0.000 1.364 277 G CA -1.304 44.021 45.100 0.375 0.000 0.938 277 G HN 0.196 8.675 8.290 0.315 0.000 0.490 278 E N 0.266 120.622 120.200 0.259 0.000 2.114 278 E HA 0.777 5.449 4.350 0.113 -0.254 0.266 278 E C -1.565 175.102 176.600 0.113 0.000 0.896 278 E CA -1.542 54.948 56.400 0.150 0.000 0.750 278 E CB 2.939 32.712 29.700 0.123 0.000 1.121 278 E HN -0.144 8.485 8.360 0.315 -0.080 0.413 279 C N 6.569 125.891 119.300 0.037 0.000 2.346 279 C HA 0.414 4.884 4.460 0.018 0.000 0.326 279 C C -0.715 174.260 174.990 -0.024 0.000 1.224 279 C CA -0.809 58.200 59.018 -0.015 0.000 1.408 279 C CB 2.817 30.485 27.740 -0.120 0.000 2.089 279 C HN 1.005 9.147 8.230 0.026 0.104 0.456 280 N N 7.480 126.174 118.700 -0.010 0.000 2.747 280 N HA -0.386 4.347 4.740 -0.010 0.000 0.249 280 N C -0.468 175.035 175.510 -0.012 0.000 1.107 280 N CA 1.242 54.283 53.050 -0.015 0.000 0.707 280 N CB -0.678 37.791 38.487 -0.029 0.000 1.054 280 N HN 1.337 9.718 8.380 0.003 0.000 0.555 281 G N -6.947 101.853 108.800 -0.000 0.000 2.184 281 G HA2 -0.509 3.669 3.960 0.008 0.000 0.264 281 G HA3 -0.509 3.447 3.960 -0.005 0.000 0.264 281 G C -0.737 174.162 174.900 -0.001 0.000 0.975 281 G CA 0.223 45.324 45.100 0.001 0.000 0.642 281 G HN 0.386 8.665 8.290 0.009 0.017 0.536 282 K N 1.353 121.749 120.400 -0.007 0.000 2.130 282 K HA 0.122 4.433 4.320 -0.015 0.000 0.268 282 K C -1.118 175.485 176.600 0.005 0.000 0.983 282 K CA -0.729 55.550 56.287 -0.015 0.000 0.893 282 K CB 1.225 33.703 32.500 -0.037 0.000 1.066 282 K HN -0.164 7.857 8.250 -0.011 0.222 0.450 283 R N 2.289 122.790 120.500 0.002 0.000 2.360 283 R HA 0.900 5.564 4.340 0.067 -0.284 0.318 283 R C -0.380 175.910 176.300 -0.017 0.000 0.950 283 R CA -1.069 55.045 56.100 0.023 0.000 0.837 283 R CB 1.942 32.255 30.300 0.022 0.000 1.165 283 R HN 0.324 8.586 8.270 -0.013 0.000 0.458 284 G N 2.681 111.491 108.800 0.018 0.000 2.649 284 G HA2 0.475 4.291 3.960 -0.241 0.000 0.290 284 G HA3 0.475 4.429 3.960 -0.136 -0.075 0.290 284 G C -2.743 172.163 174.900 0.010 0.000 1.426 284 G CA -0.152 44.883 45.100 -0.107 0.000 0.794 284 G HN -0.148 8.215 8.290 0.122 0.000 0.483 285 H N -0.802 118.307 119.070 0.065 0.000 2.594 285 H HA 0.748 5.282 4.556 -0.290 -0.152 0.304 285 H C -0.156 175.187 175.328 0.024 0.000 1.068 285 H CA -2.794 53.206 56.048 -0.080 0.000 1.308 285 H CB -0.440 29.263 29.762 -0.099 0.000 1.409 285 H HN 0.128 7.813 8.280 -0.992 0.000 0.460 286 F N 2.705 122.616 119.950 -0.065 0.000 2.523 286 F HA 0.484 5.013 4.527 0.003 0.000 0.329 286 F C -1.606 174.170 175.800 -0.041 0.000 1.061 286 F CA -4.584 53.391 58.000 -0.041 0.000 0.967 286 F CB -0.580 38.401 39.000 -0.032 0.000 1.218 286 F HN -0.705 7.074 8.300 -0.869 0.000 0.480 287 P HA -0.300 4.121 4.420 0.002 0.000 0.218 287 P C -0.459 176.904 177.300 0.104 0.000 1.150 287 P CA 1.551 64.685 63.100 0.058 0.000 0.841 287 P CB -0.183 31.558 31.700 0.068 0.000 0.784 288 F N -7.250 112.679 119.950 -0.035 0.000 2.825 288 F HA -0.288 4.277 4.527 0.064 0.000 0.358 288 F C 0.812 176.589 175.800 -0.040 0.000 0.639 288 F CA 0.196 58.123 58.000 -0.121 0.000 1.153 288 F CB -1.468 37.242 39.000 -0.483 0.000 1.610 288 F HN 0.071 8.572 8.300 0.397 0.037 0.305 289 T N -6.454 108.236 114.554 0.227 0.000 3.113 289 T HA -0.147 4.202 4.350 -0.002 0.000 0.256 289 T C -0.427 174.382 174.700 0.181 0.000 1.131 289 T CA 0.963 63.154 62.100 0.151 0.000 1.074 289 T CB 0.228 69.196 68.868 0.167 0.000 0.944 289 T HN -0.130 8.191 8.240 0.280 0.087 0.516 290 H N -0.935 118.173 119.070 0.064 0.000 2.594 290 H HA 0.288 4.856 4.556 0.019 0.000 0.279 290 H C -1.723 173.632 175.328 0.044 0.000 1.042 290 H CA -1.433 54.647 56.048 0.053 0.000 1.177 290 H CB -0.402 29.405 29.762 0.076 0.000 1.524 290 H HN -0.019 8.501 8.280 0.501 0.061 0.537 291 V N -5.579 114.404 119.914 0.116 0.000 3.001 291 V HA 0.452 4.596 4.120 0.040 0.000 0.314 291 V C -1.739 174.258 176.094 -0.162 0.000 1.099 291 V CA -2.942 59.364 62.300 0.010 0.000 0.989 291 V CB 3.702 35.588 31.823 0.104 0.000 1.040 291 V HN -0.918 7.256 8.190 0.095 0.073 0.434 292 R N 3.256 123.667 120.500 -0.148 0.000 2.272 292 R HA 0.139 4.378 4.340 -0.167 0.000 0.334 292 R C -0.203 175.940 176.300 -0.262 0.000 1.117 292 R CA -1.213 54.784 56.100 -0.172 0.000 0.966 292 R CB -2.496 27.742 30.300 -0.103 0.000 1.049 292 R HN 0.143 8.359 8.270 -0.089 0.000 0.477 293 L N 1.058 122.080 121.223 -0.335 0.000 2.456 293 L HA -0.004 4.007 4.340 -0.548 0.000 0.266 293 L C -1.051 175.750 176.870 -0.115 0.000 1.258 293 L CA 0.350 54.984 54.840 -0.343 0.000 0.823 293 L CB -0.239 41.611 42.059 -0.349 0.000 1.100 293 L HN -0.149 7.894 8.230 -0.312 0.000 0.531 294 L N -7.027 114.227 121.223 0.052 0.000 2.376 294 L HA 0.456 4.801 4.340 0.008 0.000 0.258 294 L C -0.911 176.039 176.870 0.132 0.000 1.013 294 L CA -1.261 53.616 54.840 0.062 0.000 0.822 294 L CB 2.649 44.723 42.059 0.025 0.000 1.388 294 L HN -0.194 8.168 8.230 0.220 0.000 0.413 295 D N -1.539 118.907 120.400 0.076 0.000 1.858 295 D HA -0.023 4.651 4.640 0.057 0.000 0.069 295 D C -1.800 174.538 176.300 0.063 0.000 1.447 295 D CA 1.459 55.502 54.000 0.071 0.000 0.518 295 D CB 1.014 41.872 40.800 0.096 0.000 3.280 295 D HN 0.165 8.565 8.370 0.051 0.000 0.191 296 Q N -1.776 118.052 119.800 0.047 0.000 2.632 296 Q HA 0.146 4.519 4.340 0.055 0.000 0.352 296 Q C -1.764 174.243 176.000 0.012 0.000 0.821 296 Q CA -0.459 55.370 55.803 0.043 0.000 1.060 296 Q CB 0.421 29.194 28.738 0.060 0.000 1.429 296 Q HN -0.173 8.120 8.270 0.037 0.000 0.391 297 Q N -1.762 118.045 119.800 0.012 0.000 2.357 297 Q HA 0.140 4.471 4.340 -0.015 0.000 0.266 297 Q C -1.217 174.804 176.000 0.036 0.000 1.021 297 Q CA -1.129 54.677 55.803 0.005 0.000 0.784 297 Q CB 0.990 29.721 28.738 -0.010 0.000 1.243 297 Q HN -0.350 7.933 8.270 0.021 0.000 0.465 298 N N 5.681 124.422 118.700 0.070 0.000 2.346 298 N HA 0.401 5.171 4.740 0.050 0.000 0.289 298 N C -0.663 174.905 175.510 0.096 0.000 1.027 298 N CA -2.554 50.539 53.050 0.072 0.000 0.864 298 N CB 2.218 40.745 38.487 0.067 0.000 1.370 298 N HN -0.076 8.359 8.380 0.093 0.000 0.481 299 P HA -0.277 4.183 4.420 0.067 0.000 0.217 299 P C 0.225 177.557 177.300 0.054 0.000 1.162 299 P CA 2.008 65.143 63.100 0.057 0.000 0.901 299 P CB 0.403 32.121 31.700 0.030 0.000 0.793 300 E N -4.513 115.709 120.200 0.036 0.000 2.394 300 E HA 0.037 4.385 4.350 -0.003 0.000 0.191 300 E C 0.070 176.688 176.600 0.030 0.000 1.044 300 E CA -0.472 55.936 56.400 0.013 0.000 0.939 300 E CB -1.280 28.416 29.700 -0.007 0.000 1.089 300 E HN -0.265 8.322 8.360 0.033 -0.208 0.456 301 E N 0.830 121.087 120.200 0.095 0.000 2.065 301 E HA -0.310 4.101 4.350 0.101 0.000 0.201 301 E C 0.113 176.772 176.600 0.100 0.000 1.016 301 E CA 2.423 58.916 56.400 0.155 0.000 0.818 301 E CB 0.118 30.034 29.700 0.359 0.000 0.749 301 E HN -0.144 8.084 8.360 0.118 0.203 0.453 302 D N -5.462 114.942 120.400 0.006 0.000 3.041 302 D HA -0.311 4.178 4.640 -0.251 0.000 0.220 302 D C 0.087 176.305 176.300 -0.137 0.000 1.157 302 D CA 1.215 55.133 54.000 -0.136 0.000 0.876 302 D CB -0.803 39.953 40.800 -0.073 0.000 1.107 302 D HN 0.250 8.625 8.370 0.009 0.000 0.422 303 F N -5.561 114.417 119.950 0.046 0.000 2.154 303 F HA -0.278 4.304 4.527 0.091 0.000 0.301 303 F C -0.803 175.046 175.800 0.082 0.000 1.087 303 F CA 1.230 59.284 58.000 0.090 0.000 1.274 303 F CB -0.691 38.392 39.000 0.138 0.000 1.009 303 F HN 0.083 8.470 8.300 0.208 0.038 0.485 304 S N 0.000 115.315 115.700 -0.641 0.000 2.498 304 S HA 0.000 4.422 4.470 -0.079 0.000 0.327 304 S CA 0.000 58.014 58.200 -0.310 0.000 1.107 304 S CB 0.000 63.124 63.200 -0.126 0.000 0.593 304 S HN 0.000 7.330 8.310 -1.613 0.012 0.517