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 3b97_1_D DATA FIRST_RESID 1 DATA SEQUENCE SILKIHAREI FDSRGNPTVE VDLFTSKGLF RAAVPSGAST GIYEALELRD DATA SEQUENCE NDKTRYMGKG VSKAVEHINK TIAPALVSKK LNVTEQEKID KLMIEMDGTE DATA SEQUENCE NKSKFGANAI LGVSLAVCKA GAVEKGVPLY RHIADLAGNS EVILPVPAFN DATA SEQUENCE VINGGSHAGN KLAMQEFMIL PVGAANFREA MRIGAEVYHN LKNVIKEKYG DATA SEQUENCE KDATNVGDEG GFAPNILENK EGLELLKTAI GKAGYTDKVV IGMDVAASEF DATA SEQUENCE FRSGKYDLDF KSPDDPSRYI SPDQLADLYK SFIKDYPVVS IEDPFDQDDW DATA SEQUENCE GAWQKFTASA GIQVVGDDLT VTNPKRIAKA VNEKSCNCLL LKVNQIGSVT DATA SEQUENCE ESLQACKLAQ ANGWGVMVSH RSGETEDTFI ADLVVGLCTG QIKTGAPCRS DATA SEQUENCE ERLAKYNQLL RIEEELGSKA KFAGRNFRNP L 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 S HA 0.000 4.470 4.470 -0.000 0.000 0.327 1 S C 0.000 174.631 174.600 0.052 0.000 1.055 1 S CA 0.000 58.219 58.200 0.031 0.000 1.107 1 S CB 0.000 63.210 63.200 0.017 0.000 0.593 2 I N 3.407 124.008 120.570 0.051 0.000 2.436 2 I HA 0.253 4.422 4.170 -0.002 0.000 0.289 2 I C 1.085 177.253 176.117 0.085 0.000 1.083 2 I CA -0.214 61.132 61.300 0.078 0.000 1.372 2 I CB 1.034 39.071 38.000 0.062 0.000 1.408 2 I HN 0.301 8.511 8.210 -0.000 0.000 0.516 3 L N 5.847 127.143 121.223 0.120 0.000 2.307 3 L HA 0.196 4.534 4.340 -0.002 0.000 0.211 3 L C 0.783 177.699 176.870 0.076 0.000 1.099 3 L CA 0.562 55.454 54.840 0.088 0.000 0.816 3 L CB -0.155 41.956 42.059 0.088 0.000 0.952 3 L HN 0.566 8.796 8.230 -0.000 0.000 0.455 4 K N 0.366 120.858 120.400 0.154 0.000 2.622 4 K HA 0.438 4.757 4.320 -0.002 0.000 0.273 4 K C -2.007 174.765 176.600 0.287 0.000 0.957 4 K CA -0.519 55.854 56.287 0.142 0.000 0.861 4 K CB 2.075 34.559 32.500 -0.026 0.000 1.405 4 K HN -0.101 8.149 8.250 -0.000 0.000 0.406 5 I N 3.466 124.159 120.570 0.205 0.000 2.499 5 I HA 0.330 4.499 4.170 -0.002 0.000 0.288 5 I C -1.023 175.221 176.117 0.210 0.000 1.048 5 I CA -0.774 60.648 61.300 0.203 0.000 1.062 5 I CB 1.924 39.981 38.000 0.095 0.000 1.238 5 I HN 0.548 8.758 8.210 -0.000 0.000 0.426 6 H N 5.673 124.825 119.070 0.138 0.000 2.782 6 H HA 0.740 5.294 4.556 -0.002 0.000 0.347 6 H C -1.691 173.671 175.328 0.056 0.000 1.038 6 H CA -0.457 55.645 56.048 0.090 0.000 1.255 6 H CB 2.142 31.978 29.762 0.124 0.000 1.623 6 H HN 0.745 9.025 8.280 -0.000 0.000 0.525 7 A N 4.786 127.287 122.820 -0.531 0.000 2.330 7 A HA 0.813 5.131 4.320 -0.002 0.000 0.329 7 A C -0.467 176.838 177.584 -0.464 0.000 1.135 7 A CA -0.772 51.052 52.037 -0.354 0.000 0.817 7 A CB 1.460 20.329 19.000 -0.219 0.000 1.269 7 A HN 0.891 9.041 8.150 -0.000 0.000 0.469 8 R N 0.200 120.572 120.500 -0.214 0.000 2.752 8 R HA 0.597 4.935 4.340 -0.002 0.000 0.271 8 R C -1.357 174.874 176.300 -0.115 0.000 1.026 8 R CA -0.780 55.243 56.100 -0.129 0.000 0.901 8 R CB 1.097 31.390 30.300 -0.011 0.000 1.243 8 R HN 0.570 8.840 8.270 -0.000 0.000 0.463 9 E N 1.528 121.657 120.200 -0.118 0.000 2.200 9 E HA 0.371 4.720 4.350 -0.002 0.000 0.283 9 E C -0.289 176.175 176.600 -0.227 0.000 1.015 9 E CA -0.616 55.666 56.400 -0.197 0.000 0.819 9 E CB 1.236 30.801 29.700 -0.225 0.000 1.081 9 E HN 0.448 8.808 8.360 -0.000 0.000 0.397 10 I N -1.209 119.190 120.570 -0.285 0.000 3.457 10 I HA 0.574 4.742 4.170 -0.002 0.000 0.307 10 I C -0.969 174.867 176.117 -0.469 0.000 1.138 10 I CA -1.160 59.998 61.300 -0.237 0.000 0.974 10 I CB 1.312 39.276 38.000 -0.060 0.000 1.324 10 I HN 0.214 8.424 8.210 -0.000 0.000 0.485 11 F N 1.466 121.377 119.950 -0.066 0.000 2.450 11 F HA 0.402 4.928 4.527 -0.002 0.000 0.332 11 F C 0.148 175.917 175.800 -0.052 0.000 1.093 11 F CA -0.329 57.626 58.000 -0.075 0.000 1.003 11 F CB 1.254 40.224 39.000 -0.050 0.000 1.151 11 F HN 0.595 8.895 8.300 -0.000 0.000 0.474 12 D N -0.446 120.003 120.400 0.081 0.000 2.506 12 D HA 0.134 4.772 4.640 -0.002 0.000 0.272 12 D C 1.072 177.412 176.300 0.067 0.000 1.214 12 D CA -0.368 53.657 54.000 0.042 0.000 1.067 12 D CB 0.192 40.986 40.800 -0.009 0.000 1.117 12 D HN 0.390 8.760 8.370 -0.000 0.000 0.578 13 S N -1.303 114.414 115.700 0.029 0.000 2.507 13 S HA -0.113 4.356 4.470 -0.002 0.000 0.235 13 S C 1.476 176.090 174.600 0.024 0.000 0.988 13 S CA 0.416 58.631 58.200 0.024 0.000 0.944 13 S CB -0.373 62.829 63.200 0.004 0.000 0.762 13 S HN 0.486 8.796 8.310 -0.000 0.000 0.526 14 R N 0.336 120.852 120.500 0.027 0.000 2.362 14 R HA 0.273 4.612 4.340 -0.002 0.000 0.227 14 R C 1.192 177.532 176.300 0.067 0.000 0.905 14 R CA 0.432 56.550 56.100 0.032 0.000 1.067 14 R CB 0.227 30.536 30.300 0.016 0.000 1.078 14 R HN 0.569 8.839 8.270 -0.000 0.000 0.516 15 G N 1.336 110.201 108.800 0.108 0.000 2.132 15 G HA2 -0.207 3.752 3.960 -0.002 0.000 0.228 15 G HA3 -0.207 3.752 3.960 -0.002 0.000 0.228 15 G C -0.491 174.595 174.900 0.311 0.000 1.000 15 G CA -0.384 44.826 45.100 0.183 0.000 0.693 15 G HN 0.234 8.524 8.290 -0.000 0.000 0.515 16 N N 0.665 119.472 118.700 0.178 0.000 2.417 16 N HA 0.541 5.280 4.740 -0.002 0.000 0.300 16 N C -2.851 172.555 175.510 -0.174 0.000 1.102 16 N CA -1.506 51.569 53.050 0.042 0.000 0.886 16 N CB 1.856 40.346 38.487 0.006 0.000 1.203 16 N HN -0.032 8.348 8.380 -0.000 0.000 0.496 17 P HA 0.100 4.520 4.420 -0.000 0.000 0.269 17 P C -0.196 176.892 177.300 -0.354 0.000 1.209 17 P CA 0.349 63.048 63.100 -0.667 0.000 0.776 17 P CB 0.694 31.942 31.700 -0.754 0.000 0.876 18 T N 0.918 115.279 114.554 -0.322 0.000 2.762 18 T HA 0.380 4.729 4.350 -0.002 0.000 0.301 18 T C -1.218 173.379 174.700 -0.171 0.000 1.299 18 T CA -0.568 61.419 62.100 -0.189 0.000 1.005 18 T CB 0.700 69.491 68.868 -0.128 0.000 1.377 18 T HN -0.053 8.187 8.240 -0.000 0.000 0.504 19 V N 2.584 122.426 119.914 -0.120 0.000 2.546 19 V HA 0.579 4.698 4.120 -0.002 0.000 0.284 19 V C 0.186 176.226 176.094 -0.090 0.000 1.050 19 V CA -0.238 61.999 62.300 -0.105 0.000 0.981 19 V CB 1.243 33.017 31.823 -0.083 0.000 0.990 19 V HN 0.857 9.047 8.190 -0.000 0.000 0.474 20 E N 3.489 123.638 120.200 -0.086 0.000 2.272 20 E HA 0.688 5.037 4.350 -0.002 0.000 0.269 20 E C -2.006 174.558 176.600 -0.061 0.000 0.877 20 E CA -0.549 55.814 56.400 -0.062 0.000 0.755 20 E CB 2.352 32.026 29.700 -0.044 0.000 1.192 20 E HN 0.414 8.774 8.360 -0.000 0.000 0.422 21 V N 3.371 123.256 119.914 -0.047 0.000 2.656 21 V HA 0.354 4.473 4.120 -0.002 0.000 0.307 21 V C -1.068 175.016 176.094 -0.017 0.000 1.051 21 V CA -0.894 61.383 62.300 -0.038 0.000 0.893 21 V CB 2.042 33.838 31.823 -0.045 0.000 0.999 21 V HN 0.736 8.926 8.190 -0.000 0.000 0.426 22 D N 3.752 124.161 120.400 0.016 0.000 2.256 22 D HA 0.624 5.262 4.640 -0.002 0.000 0.240 22 D C -0.721 175.562 176.300 -0.027 0.000 1.062 22 D CA -0.011 53.963 54.000 -0.044 0.000 0.832 22 D CB 2.167 43.001 40.800 0.056 0.000 1.135 22 D HN 0.449 8.819 8.370 -0.000 0.000 0.484 23 L N 2.831 123.960 121.223 -0.156 0.000 2.385 23 L HA 0.569 4.907 4.340 -0.002 0.000 0.273 23 L C -1.571 175.239 176.870 -0.099 0.000 0.990 23 L CA -0.701 54.150 54.840 0.019 0.000 0.821 23 L CB 0.959 43.072 42.059 0.090 0.000 1.279 23 L HN 0.144 8.374 8.230 -0.000 0.000 0.412 24 F N 2.182 122.208 119.950 0.127 0.000 2.480 24 F HA 0.760 5.286 4.527 -0.002 0.000 0.329 24 F C 0.606 176.492 175.800 0.143 0.000 1.091 24 F CA -0.392 57.676 58.000 0.114 0.000 0.972 24 F CB 2.248 41.272 39.000 0.041 0.000 1.150 24 F HN 0.500 8.800 8.300 -0.000 0.000 0.467 25 T N -2.999 111.765 114.554 0.349 0.000 2.838 25 T HA 0.309 4.658 4.350 -0.002 0.000 0.292 25 T C 0.771 175.593 174.700 0.204 0.000 1.113 25 T CA -0.158 62.091 62.100 0.250 0.000 1.008 25 T CB 1.225 70.241 68.868 0.247 0.000 1.259 25 T HN 0.552 8.792 8.240 -0.000 0.000 0.520 26 S N -0.050 115.732 115.700 0.137 0.000 2.493 26 S HA -0.072 4.397 4.470 -0.002 0.000 0.243 26 S C 1.336 175.999 174.600 0.105 0.000 0.991 26 S CA 0.344 58.604 58.200 0.100 0.000 0.957 26 S CB -0.560 62.680 63.200 0.066 0.000 0.756 26 S HN 0.626 8.936 8.310 -0.000 0.000 0.521 27 K N 1.360 121.856 120.400 0.159 0.000 2.426 27 K HA 0.349 4.668 4.320 -0.002 0.000 0.193 27 K C 1.306 177.958 176.600 0.086 0.000 1.028 27 K CA 0.683 57.071 56.287 0.169 0.000 1.047 27 K CB -0.097 32.571 32.500 0.280 0.000 0.821 27 K HN 0.594 8.844 8.250 -0.000 0.000 0.513 28 G N 1.044 109.859 108.800 0.025 0.000 2.298 28 G HA2 -0.091 3.868 3.960 -0.002 0.000 0.309 28 G HA3 -0.091 3.868 3.960 -0.002 0.000 0.309 28 G C -1.893 172.723 174.900 -0.473 0.000 1.279 28 G CA -0.638 44.346 45.100 -0.193 0.000 1.042 28 G HN 0.105 8.395 8.290 -0.000 0.000 0.480 29 L N -0.164 120.618 121.223 -0.735 0.000 2.322 29 L HA 0.925 5.264 4.340 -0.002 0.000 0.279 29 L C -1.139 175.002 176.870 -1.215 0.000 1.036 29 L CA -0.975 53.279 54.840 -0.978 0.000 0.807 29 L CB 0.982 42.595 42.059 -0.744 0.000 1.226 29 L HN 0.499 8.729 8.230 -0.000 0.000 0.433 30 F N 4.196 123.944 119.950 -0.337 0.000 2.529 30 F HA 0.643 5.169 4.527 -0.002 0.000 0.320 30 F C -0.061 175.631 175.800 -0.180 0.000 1.118 30 F CA -0.564 57.326 58.000 -0.184 0.000 0.915 30 F CB 1.656 40.581 39.000 -0.124 0.000 1.161 30 F HN 0.478 8.778 8.300 -0.000 0.000 0.445 31 R N 2.175 122.682 120.500 0.012 0.000 2.628 31 R HA 0.934 5.272 4.340 -0.002 0.000 0.288 31 R C -1.807 174.507 176.300 0.024 0.000 0.980 31 R CA -0.653 55.439 56.100 -0.014 0.000 0.891 31 R CB 1.856 32.126 30.300 -0.050 0.000 1.188 31 R HN 0.843 9.113 8.270 -0.000 0.000 0.450 32 A N 2.336 125.156 122.820 -0.000 0.000 2.549 32 A HA 0.844 5.163 4.320 -0.002 0.000 0.297 32 A C -1.665 175.899 177.584 -0.034 0.000 1.061 32 A CA -0.469 51.561 52.037 -0.011 0.000 0.690 32 A CB 1.956 20.926 19.000 -0.051 0.000 1.287 32 A HN 0.848 8.998 8.150 -0.000 0.000 0.402 33 A N 0.452 123.252 122.820 -0.033 0.000 2.423 33 A HA 0.786 5.105 4.320 -0.002 0.000 0.304 33 A C -0.912 176.641 177.584 -0.053 0.000 1.104 33 A CA -0.539 51.473 52.037 -0.042 0.000 0.757 33 A CB 1.361 20.346 19.000 -0.025 0.000 1.313 33 A HN 1.373 9.523 8.150 -0.000 0.000 0.423 34 V N 3.046 122.924 119.914 -0.059 0.000 2.472 34 V HA 0.490 4.609 4.120 -0.002 0.000 0.290 34 V C -1.957 174.109 176.094 -0.046 0.000 1.037 34 V CA -1.249 61.016 62.300 -0.059 0.000 0.908 34 V CB 1.407 33.192 31.823 -0.063 0.000 0.985 34 V HN 0.879 9.069 8.190 -0.000 0.000 0.454 35 P HA 0.363 4.783 4.420 -0.000 0.000 0.280 35 P C -0.868 176.410 177.300 -0.037 0.000 1.272 35 P CA -0.556 62.525 63.100 -0.031 0.000 0.819 35 P CB 1.765 33.456 31.700 -0.015 0.000 1.122 36 S N -0.522 115.152 115.700 -0.044 0.000 2.677 36 S HA 0.594 5.063 4.470 -0.002 0.000 0.283 36 S C -0.106 174.467 174.600 -0.044 0.000 1.159 36 S CA -0.627 57.550 58.200 -0.039 0.000 1.001 36 S CB 0.249 63.426 63.200 -0.039 0.000 1.032 36 S HN 0.642 8.952 8.310 -0.000 0.000 0.487 37 G N 2.121 110.906 108.800 -0.025 0.000 2.572 37 G HA2 0.576 4.535 3.960 -0.002 0.000 0.261 37 G HA3 0.576 4.535 3.960 -0.002 0.000 0.261 37 G C 0.802 175.711 174.900 0.015 0.000 1.197 37 G CA -0.018 45.075 45.100 -0.011 0.000 0.870 37 G HN 1.006 9.296 8.290 -0.000 0.000 0.548 38 A N -0.050 122.806 122.820 0.061 0.000 1.969 38 A HA 0.330 4.649 4.320 -0.002 0.000 0.205 38 A C 1.748 179.407 177.584 0.125 0.000 1.364 38 A CA 1.127 53.226 52.037 0.103 0.000 0.756 38 A CB -0.271 18.823 19.000 0.157 0.000 0.988 38 A HN 1.238 9.388 8.150 -0.000 0.000 0.490 39 S N 2.035 117.833 115.700 0.163 0.000 3.729 39 S HA 0.379 4.848 4.470 -0.002 0.000 0.235 39 S C 0.074 174.710 174.600 0.059 0.000 1.367 39 S CA 0.080 58.335 58.200 0.092 0.000 0.907 39 S CB -0.904 62.329 63.200 0.055 0.000 1.471 39 S HN 0.562 8.872 8.310 -0.000 0.000 0.476 40 T N 0.343 114.924 114.554 0.044 0.000 2.780 40 T HA 0.605 4.954 4.350 -0.002 0.000 0.294 40 T C 0.755 175.462 174.700 0.012 0.000 0.949 40 T CA -0.556 61.561 62.100 0.027 0.000 1.074 40 T CB 1.001 69.881 68.868 0.020 0.000 0.910 40 T HN 0.585 8.825 8.240 -0.000 0.000 0.501 41 G N 2.253 111.063 108.800 0.017 0.000 2.491 41 G HA2 0.356 4.315 3.960 -0.002 0.000 0.242 41 G HA3 0.356 4.315 3.960 -0.002 0.000 0.242 41 G C 1.167 176.051 174.900 -0.026 0.000 1.266 41 G CA -0.790 44.322 45.100 0.019 0.000 0.844 41 G HN 1.048 9.338 8.290 -0.000 0.000 0.571 42 I N -0.747 119.758 120.570 -0.108 0.000 2.700 42 I HA -0.064 4.105 4.170 -0.002 0.000 0.261 42 I C 0.980 176.835 176.117 -0.437 0.000 1.219 42 I CA 0.903 62.034 61.300 -0.282 0.000 1.463 42 I CB -0.215 37.553 38.000 -0.386 0.000 1.092 42 I HN 0.467 8.677 8.210 -0.000 0.000 0.452 43 Y N 1.920 122.217 120.300 -0.006 0.000 2.468 43 Y HA 0.323 4.872 4.550 -0.002 0.000 0.268 43 Y C 0.880 176.779 175.900 -0.002 0.000 1.177 43 Y CA -0.427 57.672 58.100 -0.001 0.000 1.265 43 Y CB -0.186 38.275 38.460 0.002 0.000 1.103 43 Y HN 0.233 8.513 8.280 -0.000 0.000 0.522 44 E N 0.868 121.106 120.200 0.064 0.000 2.390 44 E HA 0.369 4.718 4.350 -0.002 0.000 0.261 44 E C 0.207 176.824 176.600 0.027 0.000 1.076 44 E CA -0.382 56.047 56.400 0.048 0.000 0.905 44 E CB 0.853 30.569 29.700 0.027 0.000 0.984 44 E HN 0.280 8.640 8.360 -0.000 0.000 0.427 45 A N 2.129 124.965 122.820 0.025 0.000 2.492 45 A HA 0.038 4.357 4.320 -0.002 0.000 0.236 45 A C -0.153 177.433 177.584 0.003 0.000 1.078 45 A CA -0.316 51.728 52.037 0.012 0.000 0.773 45 A CB 0.148 19.153 19.000 0.009 0.000 1.023 45 A HN 0.515 8.665 8.150 -0.000 0.000 0.504 46 L N 0.776 121.997 121.223 -0.003 0.000 2.477 46 L HA 0.176 4.514 4.340 -0.002 0.000 0.272 46 L C 0.645 177.517 176.870 0.003 0.000 1.157 46 L CA 0.479 55.316 54.840 -0.004 0.000 0.889 46 L CB 0.269 42.323 42.059 -0.009 0.000 1.158 46 L HN 0.744 8.974 8.230 -0.000 0.000 0.473 47 E N 5.337 125.539 120.200 0.002 0.000 2.001 47 E HA 0.176 4.525 4.350 -0.002 0.000 0.279 47 E C -0.998 175.608 176.600 0.009 0.000 1.045 47 E CA -0.895 55.506 56.400 0.003 0.000 0.833 47 E CB 0.751 30.449 29.700 -0.003 0.000 1.077 47 E HN 0.625 8.985 8.360 -0.000 0.000 0.397 48 L N 5.710 126.947 121.223 0.022 0.000 2.433 48 L HA 0.206 4.545 4.340 -0.002 0.000 0.275 48 L C -0.641 176.245 176.870 0.027 0.000 1.128 48 L CA 0.268 55.131 54.840 0.038 0.000 0.875 48 L CB 0.184 42.291 42.059 0.079 0.000 1.171 48 L HN 0.472 8.702 8.230 -0.000 0.000 0.463 49 R N 3.340 123.854 120.500 0.024 0.000 2.664 49 R HA 0.259 4.598 4.340 -0.002 0.000 0.286 49 R C 0.394 176.711 176.300 0.027 0.000 0.967 49 R CA -0.727 55.383 56.100 0.017 0.000 0.933 49 R CB 1.339 31.649 30.300 0.016 0.000 1.146 49 R HN 0.587 8.857 8.270 -0.000 0.000 0.468 50 D N 1.474 121.889 120.400 0.025 0.000 2.144 50 D HA -0.124 4.515 4.640 -0.002 0.000 0.199 50 D C 0.068 176.389 176.300 0.034 0.000 0.984 50 D CA 0.916 54.933 54.000 0.029 0.000 0.834 50 D CB 0.161 40.981 40.800 0.034 0.000 0.955 50 D HN 0.483 8.853 8.370 -0.000 0.000 0.465 51 N N 0.636 119.359 118.700 0.038 0.000 2.782 51 N HA -0.178 4.561 4.740 -0.002 0.000 0.251 51 N C -0.697 174.835 175.510 0.036 0.000 1.101 51 N CA 0.811 53.883 53.050 0.037 0.000 0.764 51 N CB -1.448 37.057 38.487 0.030 0.000 1.122 51 N HN 0.304 8.684 8.380 -0.000 0.000 0.561 52 D N 1.186 121.611 120.400 0.042 0.000 2.468 52 D HA 0.173 4.812 4.640 -0.002 0.000 0.218 52 D C 1.012 177.336 176.300 0.039 0.000 1.155 52 D CA -0.221 53.800 54.000 0.036 0.000 0.924 52 D CB 0.378 41.199 40.800 0.035 0.000 1.029 52 D HN 0.150 8.520 8.370 -0.000 0.000 0.515 53 K N 0.967 121.386 120.400 0.032 0.000 2.442 53 K HA -0.135 4.184 4.320 -0.002 0.000 0.200 53 K C 1.704 178.315 176.600 0.019 0.000 1.045 53 K CA 1.418 57.723 56.287 0.031 0.000 0.937 53 K CB -0.001 32.514 32.500 0.026 0.000 0.757 53 K HN 0.474 8.724 8.250 -0.000 0.000 0.474 54 T N -1.853 112.706 114.554 0.009 0.000 3.081 54 T HA -0.006 4.343 4.350 -0.002 0.000 0.255 54 T C 0.749 175.425 174.700 -0.039 0.000 1.113 54 T CA -0.113 61.980 62.100 -0.011 0.000 1.082 54 T CB 0.140 69.001 68.868 -0.012 0.000 0.939 54 T HN 0.019 8.259 8.240 -0.000 0.000 0.506 55 R N -0.228 120.258 120.500 -0.024 0.000 2.409 55 R HA 0.379 4.718 4.340 -0.002 0.000 0.313 55 R C -0.902 175.414 176.300 0.026 0.000 0.953 55 R CA -0.829 55.221 56.100 -0.083 0.000 0.849 55 R CB 0.275 30.563 30.300 -0.020 0.000 1.171 55 R HN 0.369 8.639 8.270 -0.000 0.000 0.458 56 Y N 4.534 124.864 120.300 0.050 0.000 3.978 56 Y HA -0.354 4.194 4.550 -0.002 0.000 0.219 56 Y C 0.379 176.306 175.900 0.045 0.000 1.153 56 Y CA 1.042 59.179 58.100 0.062 0.000 1.718 56 Y CB -1.389 37.106 38.460 0.058 0.000 1.541 56 Y HN 0.806 9.086 8.280 -0.000 0.000 0.640 57 M N -1.409 118.262 119.600 0.119 0.000 2.461 57 M HA -0.304 4.174 4.480 -0.002 0.000 0.203 57 M C 1.208 177.562 176.300 0.090 0.000 0.428 57 M CA 1.475 56.827 55.300 0.088 0.000 0.509 57 M CB -1.904 30.749 32.600 0.088 0.000 1.851 57 M HN 1.129 9.419 8.290 -0.000 0.000 0.834 58 G N -0.222 108.635 108.800 0.096 0.000 2.159 58 G HA2 -0.298 3.661 3.960 -0.002 0.000 0.256 58 G HA3 -0.298 3.661 3.960 -0.002 0.000 0.256 58 G C 0.497 175.446 174.900 0.082 0.000 0.977 58 G CA 0.712 45.859 45.100 0.079 0.000 0.652 58 G HN 0.584 8.874 8.290 -0.000 0.000 0.531 59 K N 0.661 121.130 120.400 0.114 0.000 2.387 59 K HA 0.349 4.667 4.320 -0.002 0.000 0.198 59 K C 1.696 178.297 176.600 0.002 0.000 1.022 59 K CA 0.160 56.482 56.287 0.057 0.000 1.128 59 K CB 0.496 33.025 32.500 0.048 0.000 0.853 59 K HN 0.427 8.677 8.250 -0.000 0.000 0.523 60 G N 0.868 109.712 108.800 0.072 0.000 2.630 60 G HA2 0.126 4.085 3.960 -0.002 0.000 0.236 60 G HA3 0.126 4.085 3.960 -0.002 0.000 0.236 60 G C 0.549 175.422 174.900 -0.045 0.000 1.248 60 G CA -0.277 44.827 45.100 0.007 0.000 0.844 60 G HN 0.135 8.425 8.290 -0.000 0.000 0.588 61 V N -1.032 118.826 119.914 -0.092 0.000 2.991 61 V HA 0.232 4.351 4.120 -0.002 0.000 0.355 61 V C 1.694 177.749 176.094 -0.066 0.000 1.384 61 V CA 0.536 62.793 62.300 -0.072 0.000 1.171 61 V CB -0.197 31.566 31.823 -0.100 0.000 1.190 61 V HN 0.844 9.034 8.190 -0.000 0.000 0.540 62 S N 0.736 116.405 115.700 -0.052 0.000 2.400 62 S HA -0.210 4.259 4.470 -0.002 0.000 0.232 62 S C 1.773 176.327 174.600 -0.077 0.000 1.025 62 S CA 1.633 59.800 58.200 -0.055 0.000 0.993 62 S CB -0.466 62.719 63.200 -0.025 0.000 0.808 62 S HN 0.703 9.013 8.310 -0.000 0.000 0.478 63 K N 1.652 122.014 120.400 -0.064 0.000 2.026 63 K HA 0.079 4.398 4.320 -0.002 0.000 0.208 63 K C 2.638 179.169 176.600 -0.115 0.000 1.048 63 K CA 1.191 57.407 56.287 -0.117 0.000 0.929 63 K CB -0.607 31.870 32.500 -0.038 0.000 0.713 63 K HN 0.489 8.739 8.250 -0.000 0.000 0.439 64 A N 1.141 123.973 122.820 0.020 0.000 1.908 64 A HA -0.135 4.184 4.320 -0.002 0.000 0.218 64 A C 2.384 179.968 177.584 0.000 0.000 1.181 64 A CA 1.479 53.574 52.037 0.096 0.000 0.627 64 A CB -0.709 18.319 19.000 0.047 0.000 0.818 64 A HN 0.079 8.229 8.150 -0.000 0.000 0.445 65 V N -0.016 119.857 119.914 -0.068 0.000 2.343 65 V HA -0.268 3.850 4.120 -0.002 0.000 0.247 65 V C 2.519 178.536 176.094 -0.128 0.000 1.051 65 V CA 2.329 64.564 62.300 -0.110 0.000 1.036 65 V CB -0.661 31.088 31.823 -0.123 0.000 0.654 65 V HN 0.799 8.989 8.190 -0.000 0.000 0.451 66 E N -0.868 119.241 120.200 -0.152 0.000 2.106 66 E HA -0.245 4.104 4.350 -0.002 0.000 0.192 66 E C 2.231 178.725 176.600 -0.178 0.000 0.984 66 E CA 1.116 57.411 56.400 -0.174 0.000 0.806 66 E CB -0.087 29.486 29.700 -0.212 0.000 0.750 66 E HN 0.682 9.042 8.360 -0.000 0.000 0.458 67 H N 0.366 119.378 119.070 -0.097 0.000 2.387 67 H HA -0.126 4.428 4.556 -0.002 0.000 0.299 67 H C 2.251 177.395 175.328 -0.306 0.000 1.099 67 H CA 1.515 57.450 56.048 -0.189 0.000 1.315 67 H CB -0.129 29.533 29.762 -0.166 0.000 1.380 67 H HN 0.313 8.593 8.280 -0.000 0.000 0.513 68 I N 0.750 121.250 120.570 -0.116 0.000 2.162 68 I HA -0.239 3.930 4.170 -0.002 0.000 0.238 68 I C 2.135 178.180 176.117 -0.120 0.000 1.076 68 I CA 0.937 62.145 61.300 -0.152 0.000 1.353 68 I CB -0.238 37.688 38.000 -0.123 0.000 1.063 68 I HN 0.124 8.334 8.210 -0.000 0.000 0.408 69 N N 1.255 119.891 118.700 -0.108 0.000 2.120 69 N HA -0.151 4.588 4.740 -0.002 0.000 0.188 69 N C 1.749 177.234 175.510 -0.042 0.000 1.024 69 N CA 1.381 54.390 53.050 -0.068 0.000 0.852 69 N CB -0.197 38.245 38.487 -0.075 0.000 1.003 69 N HN 0.408 8.788 8.380 -0.000 0.000 0.424 70 K N -0.632 119.734 120.400 -0.056 0.000 2.211 70 K HA 0.141 4.459 4.320 -0.002 0.000 0.201 70 K C 1.397 177.978 176.600 -0.031 0.000 1.052 70 K CA 0.856 57.123 56.287 -0.033 0.000 0.973 70 K CB 0.327 32.810 32.500 -0.029 0.000 0.766 70 K HN 0.111 8.361 8.250 -0.000 0.000 0.466 71 T N 0.919 115.432 114.554 -0.068 0.000 3.111 71 T HA 0.171 4.520 4.350 -0.002 0.000 0.236 71 T C 1.942 176.562 174.700 -0.135 0.000 0.984 71 T CA 0.145 62.197 62.100 -0.080 0.000 1.195 71 T CB 0.085 68.906 68.868 -0.078 0.000 0.929 71 T HN -0.027 8.213 8.240 -0.000 0.000 0.431 72 I N 1.938 122.353 120.570 -0.259 0.000 2.163 72 I HA -0.130 4.039 4.170 -0.002 0.000 0.240 72 I C 3.007 179.069 176.117 -0.092 0.000 1.081 72 I CA 1.196 62.369 61.300 -0.212 0.000 1.353 72 I CB -0.539 37.289 38.000 -0.287 0.000 1.054 72 I HN 0.202 8.412 8.210 -0.000 0.000 0.407 73 A N 1.778 124.555 122.820 -0.071 0.000 1.873 73 A HA -0.153 4.165 4.320 -0.002 0.000 0.218 73 A C 0.234 177.815 177.584 -0.005 0.000 1.193 73 A CA 2.094 54.119 52.037 -0.020 0.000 0.629 73 A CB -2.114 16.887 19.000 0.002 0.000 0.826 73 A HN 0.312 8.462 8.150 -0.000 0.000 0.447 74 P HA -0.159 4.261 4.420 -0.000 0.000 0.215 74 P C 1.651 178.954 177.300 0.004 0.000 1.153 74 P CA 2.045 65.146 63.100 0.001 0.000 0.853 74 P CB -0.229 31.471 31.700 0.001 0.000 0.788 75 A N 0.371 123.191 122.820 -0.000 0.000 1.883 75 A HA -0.154 4.165 4.320 -0.002 0.000 0.217 75 A C 2.522 180.113 177.584 0.011 0.000 1.186 75 A CA 1.576 53.618 52.037 0.010 0.000 0.624 75 A CB -1.631 17.378 19.000 0.015 0.000 0.822 75 A HN 0.114 8.264 8.150 -0.000 0.000 0.444 76 L N -0.595 120.631 121.223 0.005 0.000 2.017 76 L HA -0.157 4.182 4.340 -0.002 0.000 0.208 76 L C 2.565 179.445 176.870 0.017 0.000 1.073 76 L CA 1.140 55.986 54.840 0.011 0.000 0.745 76 L CB -0.610 41.454 42.059 0.008 0.000 0.894 76 L HN 0.255 8.485 8.230 -0.000 0.000 0.432 77 V N -0.695 119.231 119.914 0.020 0.000 2.332 77 V HA -0.292 3.827 4.120 -0.002 0.000 0.248 77 V C 2.582 178.687 176.094 0.018 0.000 1.055 77 V CA 2.061 64.375 62.300 0.025 0.000 1.038 77 V CB -0.376 31.462 31.823 0.025 0.000 0.651 77 V HN 0.393 8.583 8.190 -0.000 0.000 0.450 78 S N -0.318 115.391 115.700 0.015 0.000 2.355 78 S HA -0.155 4.314 4.470 -0.002 0.000 0.222 78 S C 1.936 176.544 174.600 0.013 0.000 1.031 78 S CA 1.037 59.245 58.200 0.013 0.000 0.993 78 S CB -0.298 62.910 63.200 0.012 0.000 0.859 78 S HN 0.483 8.793 8.310 -0.000 0.000 0.453 79 K N 1.427 121.835 120.400 0.014 0.000 2.360 79 K HA -0.001 4.317 4.320 -0.002 0.000 0.201 79 K C 0.280 176.887 176.600 0.012 0.000 1.046 79 K CA 0.488 56.782 56.287 0.013 0.000 0.940 79 K CB -0.422 32.087 32.500 0.014 0.000 0.748 79 K HN 0.414 8.664 8.250 -0.000 0.000 0.465 80 K N 0.584 120.992 120.400 0.014 0.000 3.156 80 K HA -0.179 4.140 4.320 -0.002 0.000 0.266 80 K C -0.556 176.051 176.600 0.011 0.000 0.966 80 K CA 0.201 56.496 56.287 0.013 0.000 0.719 80 K CB -1.741 30.766 32.500 0.011 0.000 1.333 80 K HN 0.159 8.409 8.250 -0.000 0.000 0.468 81 L N 0.705 121.935 121.223 0.011 0.000 2.326 81 L HA 0.173 4.512 4.340 -0.002 0.000 0.278 81 L C 0.743 177.617 176.870 0.006 0.000 1.092 81 L CA -0.746 54.099 54.840 0.008 0.000 0.810 81 L CB 0.885 42.950 42.059 0.009 0.000 1.153 81 L HN 0.171 8.401 8.230 -0.000 0.000 0.439 82 N N 0.612 119.313 118.700 0.002 0.000 2.513 82 N HA 0.044 4.783 4.740 -0.002 0.000 0.268 82 N C 1.022 176.525 175.510 -0.013 0.000 1.180 82 N CA -0.297 52.750 53.050 -0.006 0.000 0.948 82 N CB 1.368 39.850 38.487 -0.007 0.000 1.083 82 N HN 0.433 8.813 8.380 -0.000 0.000 0.455 83 V N 0.669 120.564 119.914 -0.033 0.000 2.688 83 V HA -0.229 3.890 4.120 -0.002 0.000 0.256 83 V C 1.891 177.961 176.094 -0.040 0.000 1.084 83 V CA 2.116 64.384 62.300 -0.054 0.000 1.103 83 V CB -1.840 29.911 31.823 -0.119 0.000 0.688 83 V HN 0.876 9.066 8.190 -0.000 0.000 0.480 84 T N -1.503 113.030 114.554 -0.035 0.000 3.035 84 T HA -0.046 4.302 4.350 -0.002 0.000 0.268 84 T C 1.039 175.786 174.700 0.079 0.000 1.109 84 T CA 0.936 63.055 62.100 0.032 0.000 1.119 84 T CB -0.669 68.207 68.868 0.013 0.000 0.900 84 T HN 0.683 8.923 8.240 -0.000 0.000 0.503 85 E N 1.489 121.709 120.200 0.034 0.000 2.346 85 E HA 0.101 4.450 4.350 -0.002 0.000 0.317 85 E C 1.215 177.830 176.600 0.025 0.000 1.404 85 E CA -0.396 56.020 56.400 0.027 0.000 1.534 85 E CB 0.243 29.951 29.700 0.013 0.000 1.309 85 E HN 0.414 8.774 8.360 -0.000 0.000 0.499 86 Q N 1.561 121.385 119.800 0.040 0.000 2.029 86 Q HA -0.294 4.045 4.340 -0.002 0.000 0.209 86 Q C 1.840 177.845 176.000 0.008 0.000 0.999 86 Q CA 2.141 57.961 55.803 0.028 0.000 0.857 86 Q CB 0.033 28.784 28.738 0.022 0.000 0.926 86 Q HN 0.510 8.780 8.270 -0.000 0.000 0.415 87 E N -0.470 119.730 120.200 -0.000 0.000 2.058 87 E HA -0.231 4.118 4.350 -0.002 0.000 0.194 87 E C 1.822 178.422 176.600 -0.000 0.000 0.997 87 E CA 1.377 57.775 56.400 -0.004 0.000 0.801 87 E CB -0.021 29.673 29.700 -0.010 0.000 0.746 87 E HN 0.295 8.655 8.360 -0.000 0.000 0.450 88 K N 0.059 120.460 120.400 0.003 0.000 2.057 88 K HA -0.116 4.203 4.320 -0.002 0.000 0.207 88 K C 2.209 178.813 176.600 0.007 0.000 1.049 88 K CA 1.323 57.613 56.287 0.004 0.000 0.931 88 K CB -0.096 32.407 32.500 0.005 0.000 0.714 88 K HN 0.245 8.495 8.250 -0.000 0.000 0.440 89 I N 1.278 121.853 120.570 0.008 0.000 2.202 89 I HA -0.276 3.892 4.170 -0.002 0.000 0.242 89 I C 1.807 177.930 176.117 0.010 0.000 1.091 89 I CA 1.165 62.471 61.300 0.009 0.000 1.368 89 I CB -0.259 37.745 38.000 0.007 0.000 1.058 89 I HN 0.137 8.347 8.210 -0.000 0.000 0.410 90 D N 1.158 121.562 120.400 0.006 0.000 2.104 90 D HA -0.178 4.460 4.640 -0.002 0.000 0.194 90 D C 2.184 178.491 176.300 0.012 0.000 0.994 90 D CA 1.328 55.331 54.000 0.006 0.000 0.830 90 D CB -0.158 40.641 40.800 -0.001 0.000 0.959 90 D HN 0.300 8.670 8.370 -0.000 0.000 0.452 91 K N 0.385 120.789 120.400 0.008 0.000 2.097 91 K HA -0.072 4.246 4.320 -0.002 0.000 0.206 91 K C 2.309 178.920 176.600 0.018 0.000 1.049 91 K CA 0.266 56.558 56.287 0.008 0.000 0.933 91 K CB -0.204 32.297 32.500 0.002 0.000 0.717 91 K HN 0.131 8.381 8.250 -0.000 0.000 0.442 92 L N 0.899 122.135 121.223 0.021 0.000 2.013 92 L HA -0.259 4.080 4.340 -0.002 0.000 0.212 92 L C 2.399 179.304 176.870 0.058 0.000 1.073 92 L CA 1.487 56.346 54.840 0.032 0.000 0.753 92 L CB -0.108 41.968 42.059 0.027 0.000 0.890 92 L HN 0.310 8.540 8.230 -0.000 0.000 0.432 93 M N -1.020 118.618 119.600 0.064 0.000 2.132 93 M HA -0.221 4.258 4.480 -0.002 0.000 0.263 93 M C 2.193 178.569 176.300 0.127 0.000 1.065 93 M CA 1.647 57.019 55.300 0.120 0.000 1.122 93 M CB -0.318 32.334 32.600 0.088 0.000 1.365 93 M HN 0.244 8.534 8.290 -0.000 0.000 0.411 94 I N 0.223 120.828 120.570 0.058 0.000 2.226 94 I HA -0.281 3.888 4.170 -0.002 0.000 0.245 94 I C 2.226 178.340 176.117 -0.006 0.000 1.100 94 I CA 1.489 62.801 61.300 0.020 0.000 1.374 94 I CB -0.360 37.642 38.000 0.004 0.000 1.057 94 I HN 0.342 8.552 8.210 -0.000 0.000 0.413 95 E N 0.308 120.513 120.200 0.008 0.000 2.106 95 E HA -0.205 4.144 4.350 -0.002 0.000 0.192 95 E C 2.324 178.917 176.600 -0.012 0.000 0.984 95 E CA 1.200 57.596 56.400 -0.007 0.000 0.806 95 E CB -0.047 29.656 29.700 0.005 0.000 0.750 95 E HN 0.454 8.814 8.360 -0.000 0.000 0.458 96 M N 0.358 119.987 119.600 0.049 0.000 2.175 96 M HA -0.166 4.313 4.480 -0.002 0.000 0.264 96 M C 1.941 178.145 176.300 -0.159 0.000 1.063 96 M CA 1.425 56.779 55.300 0.090 0.000 1.119 96 M CB -0.122 32.671 32.600 0.322 0.000 1.377 96 M HN 0.043 8.333 8.290 -0.000 0.000 0.415 97 D N -0.497 119.729 120.400 -0.290 0.000 2.097 97 D HA -0.111 4.528 4.640 -0.002 0.000 0.197 97 D C 1.524 177.555 176.300 -0.447 0.000 0.984 97 D CA 2.133 55.665 54.000 -0.780 0.000 0.826 97 D CB -0.051 40.487 40.800 -0.438 0.000 0.973 97 D HN 0.443 8.813 8.370 -0.000 0.000 0.460 98 G N -0.450 108.212 108.800 -0.230 0.000 2.189 98 G HA2 -0.301 3.658 3.960 -0.002 0.000 0.267 98 G HA3 -0.301 3.658 3.960 -0.002 0.000 0.267 98 G C 0.577 175.397 174.900 -0.134 0.000 0.975 98 G CA 1.266 46.273 45.100 -0.155 0.000 0.644 98 G HN 0.781 9.071 8.290 -0.000 0.000 0.537 99 T N -2.630 111.832 114.554 -0.154 0.000 2.944 99 T HA 0.691 5.039 4.350 -0.002 0.000 0.284 99 T C 0.959 175.614 174.700 -0.075 0.000 1.010 99 T CA 0.474 62.508 62.100 -0.110 0.000 1.025 99 T CB 2.306 71.100 68.868 -0.123 0.000 1.079 99 T HN 0.109 8.349 8.240 -0.000 0.000 0.516 100 E N 1.204 121.374 120.200 -0.051 0.000 2.072 100 E HA -0.088 4.261 4.350 -0.002 0.000 0.191 100 E C 0.819 177.405 176.600 -0.023 0.000 0.985 100 E CA 1.580 57.962 56.400 -0.030 0.000 0.801 100 E CB -0.323 29.368 29.700 -0.015 0.000 0.750 100 E HN 0.750 9.110 8.360 -0.000 0.000 0.452 101 N N 0.100 118.784 118.700 -0.027 0.000 2.389 101 N HA 0.184 4.923 4.740 -0.002 0.000 0.260 101 N C -1.078 174.414 175.510 -0.031 0.000 1.191 101 N CA -0.053 52.987 53.050 -0.017 0.000 0.885 101 N CB 0.538 39.021 38.487 -0.006 0.000 1.162 101 N HN 0.043 8.423 8.380 -0.000 0.000 0.512 102 K N -0.437 119.931 120.400 -0.053 0.000 3.156 102 K HA -0.192 4.127 4.320 -0.002 0.000 0.266 102 K C 0.274 176.831 176.600 -0.072 0.000 0.966 102 K CA 0.797 57.043 56.287 -0.068 0.000 0.719 102 K CB -2.001 30.487 32.500 -0.020 0.000 1.333 102 K HN 0.433 8.683 8.250 -0.000 0.000 0.468 103 S N -1.044 114.602 115.700 -0.091 0.000 2.593 103 S HA -0.013 4.455 4.470 -0.002 0.000 0.217 103 S C 1.557 176.090 174.600 -0.112 0.000 0.966 103 S CA 0.384 58.540 58.200 -0.073 0.000 0.914 103 S CB 0.423 63.591 63.200 -0.053 0.000 0.776 103 S HN 0.478 8.788 8.310 -0.000 0.000 0.523 104 K N 0.959 121.223 120.400 -0.227 0.000 2.067 104 K HA 0.224 4.543 4.320 -0.002 0.000 0.203 104 K C 1.228 177.596 176.600 -0.387 0.000 1.048 104 K CA 0.941 57.030 56.287 -0.331 0.000 0.954 104 K CB -0.128 32.039 32.500 -0.555 0.000 0.737 104 K HN 0.476 8.726 8.250 -0.000 0.000 0.444 105 F N 0.274 119.998 119.950 -0.378 0.000 2.656 105 F HA 0.256 4.782 4.527 -0.002 0.000 0.291 105 F C 0.789 176.481 175.800 -0.180 0.000 1.122 105 F CA -0.121 57.575 58.000 -0.506 0.000 1.427 105 F CB 0.991 39.829 39.000 -0.271 0.000 1.125 105 F HN 0.235 8.535 8.300 -0.000 0.000 0.583 106 G N 0.678 109.517 108.800 0.065 0.000 2.895 106 G HA2 -0.010 3.949 3.960 -0.002 0.000 0.686 106 G HA3 -0.010 3.949 3.960 -0.002 0.000 0.686 106 G C 0.385 175.318 174.900 0.054 0.000 1.108 106 G CA -0.581 44.554 45.100 0.059 0.000 0.761 106 G HN 0.318 8.608 8.290 -0.000 0.000 0.611 107 A N 1.971 124.806 122.820 0.025 0.000 1.972 107 A HA -0.062 4.256 4.320 -0.002 0.000 0.219 107 A C 2.339 179.926 177.584 0.006 0.000 1.169 107 A CA 2.255 54.301 52.037 0.015 0.000 0.635 107 A CB -0.441 18.562 19.000 0.004 0.000 0.810 107 A HN 1.621 9.771 8.150 -0.000 0.000 0.446 108 N N 1.132 119.833 118.700 0.003 0.000 2.223 108 N HA -0.045 4.694 4.740 -0.002 0.000 0.185 108 N C 1.553 177.053 175.510 -0.017 0.000 1.016 108 N CA 1.756 54.796 53.050 -0.016 0.000 0.863 108 N CB -0.820 37.655 38.487 -0.020 0.000 0.983 108 N HN 0.385 8.765 8.380 -0.000 0.000 0.429 109 A N 1.257 124.084 122.820 0.011 0.000 1.872 109 A HA 0.117 4.436 4.320 -0.002 0.000 0.214 109 A C 2.400 179.973 177.584 -0.018 0.000 1.187 109 A CA 0.791 52.828 52.037 0.001 0.000 0.614 109 A CB -0.610 18.417 19.000 0.046 0.000 0.826 109 A HN 0.246 8.396 8.150 -0.000 0.000 0.442 110 I N -0.760 119.820 120.570 0.016 0.000 2.202 110 I HA -0.189 3.980 4.170 -0.002 0.000 0.242 110 I C 2.407 178.508 176.117 -0.028 0.000 1.091 110 I CA 1.026 62.332 61.300 0.011 0.000 1.368 110 I CB -0.259 37.777 38.000 0.059 0.000 1.058 110 I HN 0.373 8.583 8.210 -0.000 0.000 0.410 111 L N 1.403 122.604 121.223 -0.038 0.000 2.042 111 L HA -0.118 4.221 4.340 -0.002 0.000 0.210 111 L C 2.325 179.131 176.870 -0.107 0.000 1.076 111 L CA 2.228 57.022 54.840 -0.077 0.000 0.749 111 L CB -1.308 40.706 42.059 -0.075 0.000 0.893 111 L HN 0.208 8.438 8.230 -0.000 0.000 0.432 112 G N -1.038 107.710 108.800 -0.086 0.000 2.476 112 G HA2 -0.239 3.720 3.960 -0.002 0.000 0.218 112 G HA3 -0.239 3.720 3.960 -0.002 0.000 0.218 112 G C 1.508 176.355 174.900 -0.088 0.000 1.164 112 G CA 1.264 46.310 45.100 -0.091 0.000 0.768 112 G HN 0.362 8.652 8.290 -0.000 0.000 0.560 113 V N 0.457 120.328 119.914 -0.072 0.000 2.453 113 V HA -0.132 3.987 4.120 -0.002 0.000 0.247 113 V C 2.966 179.022 176.094 -0.064 0.000 1.048 113 V CA 2.016 64.282 62.300 -0.057 0.000 1.049 113 V CB -0.264 31.530 31.823 -0.049 0.000 0.672 113 V HN 0.456 8.646 8.190 -0.000 0.000 0.457 114 S N -0.153 115.499 115.700 -0.079 0.000 2.359 114 S HA -0.158 4.311 4.470 -0.002 0.000 0.224 114 S C 1.933 176.446 174.600 -0.144 0.000 1.035 114 S CA 1.746 59.893 58.200 -0.089 0.000 1.018 114 S CB -0.307 62.839 63.200 -0.091 0.000 0.876 114 S HN 0.507 8.817 8.310 -0.000 0.000 0.448 115 L N 0.917 121.994 121.223 -0.242 0.000 2.017 115 L HA -0.076 4.263 4.340 -0.002 0.000 0.208 115 L C 2.937 179.711 176.870 -0.160 0.000 1.073 115 L CA 1.295 55.892 54.840 -0.406 0.000 0.745 115 L CB -0.772 40.986 42.059 -0.503 0.000 0.894 115 L HN 0.384 8.614 8.230 -0.000 0.000 0.432 116 A N -0.236 122.532 122.820 -0.087 0.000 1.902 116 A HA -0.151 4.168 4.320 -0.002 0.000 0.217 116 A C 2.361 179.932 177.584 -0.022 0.000 1.181 116 A CA 1.783 53.816 52.037 -0.007 0.000 0.623 116 A CB -0.873 18.129 19.000 0.004 0.000 0.818 116 A HN 0.186 8.336 8.150 -0.000 0.000 0.443 117 V N -1.086 118.805 119.914 -0.039 0.000 2.332 117 V HA -0.324 3.794 4.120 -0.002 0.000 0.248 117 V C 2.683 178.747 176.094 -0.051 0.000 1.055 117 V CA 2.020 64.290 62.300 -0.050 0.000 1.038 117 V CB -1.057 30.752 31.823 -0.024 0.000 0.651 117 V HN 0.797 8.987 8.190 -0.000 0.000 0.450 118 C N 0.197 119.513 119.300 0.027 0.000 2.429 118 C HA -0.165 4.294 4.460 -0.002 0.000 0.277 118 C C 2.851 177.901 174.990 0.099 0.000 1.262 118 C CA 1.389 60.505 59.018 0.163 0.000 1.733 118 C CB -1.012 26.904 27.740 0.293 0.000 2.010 118 C HN 0.567 8.797 8.230 -0.000 0.000 0.483 119 K N 0.694 121.132 120.400 0.063 0.000 2.097 119 K HA -0.092 4.227 4.320 -0.002 0.000 0.206 119 K C 2.242 178.559 176.600 -0.471 0.000 1.049 119 K CA 1.566 57.837 56.287 -0.026 0.000 0.933 119 K CB -0.347 32.234 32.500 0.135 0.000 0.717 119 K HN 0.564 8.814 8.250 -0.000 0.000 0.442 120 A N 1.385 123.741 122.820 -0.773 0.000 1.930 120 A HA -0.066 4.253 4.320 -0.002 0.000 0.217 120 A C 2.442 179.535 177.584 -0.819 0.000 1.175 120 A CA 1.769 52.894 52.037 -1.521 0.000 0.627 120 A CB -1.138 17.314 19.000 -0.914 0.000 0.815 120 A HN 0.414 8.564 8.150 -0.000 0.000 0.443 121 G N -0.269 108.219 108.800 -0.519 0.000 2.446 121 G HA2 -0.050 3.909 3.960 -0.002 0.000 0.217 121 G HA3 -0.050 3.909 3.960 -0.002 0.000 0.217 121 G C 1.767 176.171 174.900 -0.827 0.000 1.168 121 G CA 1.592 46.357 45.100 -0.559 0.000 0.771 121 G HN 0.793 9.083 8.290 -0.000 0.000 0.551 122 A N 0.074 122.397 122.820 -0.829 0.000 1.883 122 A HA 0.030 4.349 4.320 -0.002 0.000 0.217 122 A C 2.584 179.971 177.584 -0.328 0.000 1.186 122 A CA 2.005 53.708 52.037 -0.557 0.000 0.624 122 A CB -0.718 18.128 19.000 -0.258 0.000 0.822 122 A HN 0.303 8.453 8.150 -0.000 0.000 0.444 123 V N 0.034 119.777 119.914 -0.285 0.000 2.626 123 V HA -0.185 3.934 4.120 -0.002 0.000 0.252 123 V C 2.502 178.521 176.094 -0.124 0.000 1.067 123 V CA 2.182 64.408 62.300 -0.122 0.000 1.081 123 V CB -0.643 31.226 31.823 0.076 0.000 0.686 123 V HN 0.719 8.909 8.190 -0.000 0.000 0.468 124 E N 1.267 121.333 120.200 -0.224 0.000 2.077 124 E HA -0.211 4.137 4.350 -0.002 0.000 0.193 124 E C 2.026 178.555 176.600 -0.118 0.000 0.989 124 E CA 1.550 57.859 56.400 -0.152 0.000 0.800 124 E CB -0.176 29.407 29.700 -0.194 0.000 0.746 124 E HN 0.546 8.906 8.360 -0.000 0.000 0.452 125 K N -1.070 119.234 120.400 -0.161 0.000 2.444 125 K HA 0.169 4.488 4.320 -0.002 0.000 0.193 125 K C 0.795 177.347 176.600 -0.080 0.000 1.024 125 K CA 0.481 56.705 56.287 -0.106 0.000 1.077 125 K CB 0.332 32.767 32.500 -0.107 0.000 0.833 125 K HN 0.280 8.530 8.250 -0.000 0.000 0.517 126 G N 1.944 110.693 108.800 -0.085 0.000 2.221 126 G HA2 -0.243 3.715 3.960 -0.002 0.000 0.265 126 G HA3 -0.243 3.715 3.960 -0.002 0.000 0.265 126 G C -0.208 174.650 174.900 -0.070 0.000 1.041 126 G CA 0.383 45.448 45.100 -0.059 0.000 0.807 126 G HN 0.239 8.529 8.290 -0.000 0.000 0.502 127 V N -0.236 119.616 119.914 -0.103 0.000 2.864 127 V HA 0.780 4.899 4.120 -0.002 0.000 0.314 127 V C -1.970 174.012 176.094 -0.187 0.000 1.073 127 V CA -2.101 60.126 62.300 -0.121 0.000 0.956 127 V CB 2.182 33.949 31.823 -0.093 0.000 1.023 127 V HN 0.081 8.271 8.190 -0.000 0.000 0.435 128 P HA 0.052 4.472 4.420 -0.000 0.000 0.269 128 P C 0.507 177.540 177.300 -0.445 0.000 1.217 128 P CA -0.032 62.795 63.100 -0.456 0.000 0.783 128 P CB 0.493 31.658 31.700 -0.892 0.000 0.898 129 L N 3.426 124.455 121.223 -0.322 0.000 2.012 129 L HA -0.219 4.119 4.340 -0.002 0.000 0.210 129 L C 2.151 178.916 176.870 -0.174 0.000 1.073 129 L CA 1.949 56.685 54.840 -0.173 0.000 0.748 129 L CB -1.743 40.254 42.059 -0.105 0.000 0.891 129 L HN 0.499 8.729 8.230 -0.000 0.000 0.431 130 Y N -1.223 119.024 120.300 -0.087 0.000 2.333 130 Y HA -0.158 4.391 4.550 -0.002 0.000 0.290 130 Y C 2.561 178.426 175.900 -0.058 0.000 1.144 130 Y CA 1.339 59.376 58.100 -0.105 0.000 1.228 130 Y CB -1.115 37.281 38.460 -0.107 0.000 0.985 130 Y HN 0.158 8.438 8.280 -0.000 0.000 0.542 131 R N 0.123 120.462 120.500 -0.269 0.000 2.090 131 R HA -0.132 4.207 4.340 -0.002 0.000 0.228 131 R C 2.136 178.426 176.300 -0.017 0.000 1.110 131 R CA 1.788 57.840 56.100 -0.081 0.000 0.973 131 R CB -1.178 29.015 30.300 -0.178 0.000 0.869 131 R HN 0.568 8.838 8.270 -0.000 0.000 0.440 132 H N 0.206 119.193 119.070 -0.138 0.000 2.353 132 H HA -0.030 4.524 4.556 -0.002 0.000 0.300 132 H C 1.614 176.911 175.328 -0.052 0.000 1.090 132 H CA 2.137 58.131 56.048 -0.091 0.000 1.327 132 H CB -0.079 29.622 29.762 -0.103 0.000 1.383 132 H HN 0.129 8.409 8.280 -0.000 0.000 0.508 133 I N 0.812 121.308 120.570 -0.123 0.000 2.127 133 I HA -0.234 3.935 4.170 -0.002 0.000 0.241 133 I C 2.728 178.779 176.117 -0.110 0.000 1.075 133 I CA 1.395 62.604 61.300 -0.151 0.000 1.334 133 I CB -1.804 36.137 38.000 -0.098 0.000 1.040 133 I HN 0.423 8.633 8.210 -0.000 0.000 0.405 134 A N 0.826 123.619 122.820 -0.044 0.000 1.892 134 A HA -0.248 4.071 4.320 -0.002 0.000 0.218 134 A C 1.987 179.544 177.584 -0.044 0.000 1.188 134 A CA 2.218 54.242 52.037 -0.021 0.000 0.631 134 A CB -0.742 18.274 19.000 0.028 0.000 0.822 134 A HN 0.407 8.557 8.150 -0.000 0.000 0.447 135 D N -0.046 120.320 120.400 -0.057 0.000 2.144 135 D HA -0.116 4.523 4.640 -0.002 0.000 0.199 135 D C 1.899 178.144 176.300 -0.092 0.000 0.984 135 D CA 1.030 54.997 54.000 -0.055 0.000 0.834 135 D CB -0.367 40.418 40.800 -0.025 0.000 0.955 135 D HN 0.473 8.843 8.370 -0.000 0.000 0.465 136 L N 0.348 121.469 121.223 -0.170 0.000 2.141 136 L HA -0.056 4.283 4.340 -0.002 0.000 0.209 136 L C 2.250 179.065 176.870 -0.091 0.000 1.094 136 L CA 0.891 55.635 54.840 -0.161 0.000 0.763 136 L CB -0.211 41.700 42.059 -0.247 0.000 0.908 136 L HN -0.024 8.206 8.230 -0.000 0.000 0.437 137 A N -0.745 122.029 122.820 -0.076 0.000 2.178 137 A HA 0.272 4.590 4.320 -0.002 0.000 0.211 137 A C 1.667 179.228 177.584 -0.038 0.000 1.157 137 A CA 0.739 52.747 52.037 -0.048 0.000 0.780 137 A CB -0.240 18.738 19.000 -0.038 0.000 0.828 137 A HN 0.489 8.639 8.150 -0.000 0.000 0.476 138 G N -0.458 108.319 108.800 -0.038 0.000 2.137 138 G HA2 -0.240 3.719 3.960 -0.002 0.000 0.237 138 G HA3 -0.240 3.719 3.960 -0.002 0.000 0.237 138 G C -0.255 174.633 174.900 -0.020 0.000 1.002 138 G CA 0.139 45.222 45.100 -0.028 0.000 0.702 138 G HN 0.653 8.943 8.290 -0.000 0.000 0.515 139 N N -0.176 118.513 118.700 -0.018 0.000 2.443 139 N HA 0.536 5.275 4.740 -0.002 0.000 0.295 139 N C 1.236 176.745 175.510 -0.000 0.000 1.076 139 N CA -0.133 52.912 53.050 -0.009 0.000 0.919 139 N CB 1.353 39.836 38.487 -0.008 0.000 1.176 139 N HN 0.259 8.639 8.380 -0.000 0.000 0.487 140 S N 0.601 116.303 115.700 0.003 0.000 2.497 140 S HA 0.094 4.563 4.470 -0.002 0.000 0.221 140 S C 0.518 175.129 174.600 0.018 0.000 1.037 140 S CA -0.013 58.193 58.200 0.010 0.000 0.920 140 S CB 0.225 63.429 63.200 0.007 0.000 0.800 140 S HN 0.527 8.837 8.310 -0.000 0.000 0.505 141 E N 0.416 120.623 120.200 0.012 0.000 2.280 141 E HA 0.643 4.991 4.350 -0.002 0.000 0.261 141 E C -1.496 175.113 176.600 0.015 0.000 1.088 141 E CA -0.641 55.767 56.400 0.013 0.000 0.915 141 E CB 1.830 31.532 29.700 0.004 0.000 1.141 141 E HN 0.071 8.431 8.360 -0.000 0.000 0.433 142 V N 2.347 122.265 119.914 0.007 0.000 2.851 142 V HA 0.397 4.515 4.120 -0.002 0.000 0.307 142 V C -1.217 174.850 176.094 -0.046 0.000 1.129 142 V CA -0.645 61.646 62.300 -0.015 0.000 0.932 142 V CB 1.806 33.635 31.823 0.011 0.000 1.024 142 V HN 0.546 8.736 8.190 -0.000 0.000 0.426 143 I N 3.331 123.864 120.570 -0.062 0.000 2.722 143 I HA 0.614 4.783 4.170 -0.002 0.000 0.295 143 I C -1.395 174.690 176.117 -0.053 0.000 1.161 143 I CA -0.657 60.616 61.300 -0.045 0.000 1.032 143 I CB 1.821 39.806 38.000 -0.024 0.000 1.244 143 I HN 0.302 8.512 8.210 -0.000 0.000 0.421 144 L N 6.071 127.299 121.223 0.008 0.000 2.416 144 L HA 0.484 4.823 4.340 -0.002 0.000 0.272 144 L C -2.092 174.860 176.870 0.137 0.000 1.161 144 L CA -1.069 53.808 54.840 0.061 0.000 0.845 144 L CB 0.292 42.487 42.059 0.227 0.000 1.119 144 L HN 0.606 8.836 8.230 -0.000 0.000 0.464 145 P HA 0.196 4.616 4.420 -0.000 0.000 0.281 145 P C -0.611 176.843 177.300 0.257 0.000 1.264 145 P CA -0.562 62.599 63.100 0.102 0.000 0.824 145 P CB 1.630 33.368 31.700 0.063 0.000 1.092 146 V N 3.695 123.631 119.914 0.037 0.000 2.530 146 V HA 0.206 4.325 4.120 -0.002 0.000 0.282 146 V C -1.659 174.461 176.094 0.044 0.000 1.048 146 V CA -1.301 61.026 62.300 0.045 0.000 0.997 146 V CB 0.650 32.362 31.823 -0.184 0.000 0.987 146 V HN 0.615 8.805 8.190 -0.000 0.000 0.477 147 P HA 0.452 4.872 4.420 -0.000 0.000 0.292 147 P C -1.221 175.751 177.300 -0.546 0.000 1.283 147 P CA -0.685 62.250 63.100 -0.276 0.000 0.835 147 P CB 1.825 33.236 31.700 -0.482 0.000 1.017 148 A N 3.923 126.473 122.820 -0.451 0.000 2.277 148 A HA 0.577 4.896 4.320 -0.002 0.000 0.318 148 A C -0.773 176.627 177.584 -0.306 0.000 1.339 148 A CA -0.582 51.265 52.037 -0.316 0.000 0.875 148 A CB -0.419 18.499 19.000 -0.137 0.000 1.158 148 A HN 0.343 8.493 8.150 -0.000 0.000 0.514 149 F N 1.798 121.739 119.950 -0.015 0.000 2.404 149 F HA 0.230 4.756 4.527 -0.002 0.000 0.358 149 F C 1.070 176.893 175.800 0.038 0.000 1.120 149 F CA -0.360 57.633 58.000 -0.011 0.000 1.144 149 F CB 0.955 39.886 39.000 -0.116 0.000 1.133 149 F HN 0.695 8.995 8.300 -0.000 0.000 0.495 150 N N 3.466 122.309 118.700 0.240 0.000 2.605 150 N HA 0.160 4.899 4.740 -0.002 0.000 0.258 150 N C 0.837 176.474 175.510 0.212 0.000 1.156 150 N CA -0.294 52.887 53.050 0.218 0.000 1.008 150 N CB 0.606 39.230 38.487 0.229 0.000 1.354 150 N HN 0.603 8.983 8.380 -0.000 0.000 0.509 151 V N 1.458 121.511 119.914 0.231 0.000 3.608 151 V HA 0.324 4.443 4.120 -0.002 0.000 0.269 151 V C 0.588 176.823 176.094 0.236 0.000 1.245 151 V CA 0.432 62.882 62.300 0.250 0.000 1.138 151 V CB -0.379 31.632 31.823 0.314 0.000 0.841 151 V HN 0.454 8.643 8.190 -0.000 0.000 0.451 152 I N 1.441 122.143 120.570 0.219 0.000 2.512 152 I HA 0.429 4.598 4.170 -0.002 0.000 0.287 152 I C -0.926 175.320 176.117 0.215 0.000 1.069 152 I CA -0.371 61.017 61.300 0.147 0.000 1.056 152 I CB 2.063 40.024 38.000 -0.066 0.000 1.229 152 I HN 0.221 8.431 8.210 -0.000 0.000 0.429 153 N N 3.603 122.405 118.700 0.170 0.000 2.405 153 N HA 0.756 5.495 4.740 -0.002 0.000 0.299 153 N C -0.167 175.451 175.510 0.180 0.000 1.075 153 N CA -0.546 52.632 53.050 0.213 0.000 0.884 153 N CB 2.556 41.160 38.487 0.194 0.000 1.194 153 N HN 0.725 9.105 8.380 -0.000 0.000 0.491 154 G N -0.378 108.554 108.800 0.220 0.000 2.976 154 G HA2 0.688 4.647 3.960 -0.002 0.000 0.276 154 G HA3 0.688 4.647 3.960 -0.002 0.000 0.276 154 G C 0.055 175.053 174.900 0.163 0.000 1.207 154 G CA -0.103 45.105 45.100 0.180 0.000 0.803 154 G HN 0.806 9.096 8.290 -0.000 0.000 0.572 155 G N -0.391 108.532 108.800 0.205 0.000 2.582 155 G HA2 -0.183 3.776 3.960 -0.002 0.000 0.288 155 G HA3 -0.183 3.776 3.960 -0.002 0.000 0.288 155 G C 1.163 176.222 174.900 0.265 0.000 1.247 155 G CA 0.816 46.108 45.100 0.319 0.000 0.972 155 G HN 1.571 9.861 8.290 -0.000 0.000 0.557 156 S N 0.428 116.274 115.700 0.243 0.000 2.720 156 S HA 0.159 4.628 4.470 -0.002 0.000 0.222 156 S C 1.162 175.960 174.600 0.330 0.000 0.958 156 S CA 1.075 59.431 58.200 0.260 0.000 0.943 156 S CB -0.296 63.057 63.200 0.255 0.000 0.779 156 S HN 0.584 8.894 8.310 -0.000 0.000 0.526 157 H N -0.040 119.106 119.070 0.126 0.000 2.827 157 H HA 0.527 5.082 4.556 -0.002 0.000 0.269 157 H C 0.566 175.940 175.328 0.076 0.000 1.031 157 H CA -0.146 55.956 56.048 0.089 0.000 1.202 157 H CB 0.651 30.466 29.762 0.088 0.000 1.511 157 H HN 0.356 8.636 8.280 -0.000 0.000 0.517 158 A N 0.454 123.386 122.820 0.187 0.000 2.587 158 A HA 0.563 4.882 4.320 -0.002 0.000 0.293 158 A C -0.073 177.548 177.584 0.062 0.000 1.087 158 A CA -0.392 51.713 52.037 0.113 0.000 0.692 158 A CB 1.102 20.167 19.000 0.109 0.000 1.291 158 A HN 0.214 8.364 8.150 -0.000 0.000 0.407 159 G N 1.551 110.376 108.800 0.041 0.000 2.915 159 G HA2 0.476 4.435 3.960 -0.002 0.000 0.298 159 G HA3 0.476 4.435 3.960 -0.002 0.000 0.298 159 G C -0.412 174.482 174.900 -0.009 0.000 0.837 159 G CA 0.089 45.197 45.100 0.013 0.000 1.752 159 G HN 1.171 9.461 8.290 -0.000 0.000 0.526 160 N N -0.480 118.202 118.700 -0.031 0.000 3.261 160 N HA 0.158 4.897 4.740 -0.002 0.000 0.248 160 N C 0.397 175.855 175.510 -0.086 0.000 1.498 160 N CA -1.012 52.005 53.050 -0.055 0.000 0.884 160 N CB 0.899 39.351 38.487 -0.058 0.000 1.428 160 N HN 0.036 8.416 8.380 -0.000 0.000 0.517 161 K N -0.758 119.588 120.400 -0.091 0.000 2.186 161 K HA 0.154 4.472 4.320 -0.002 0.000 0.202 161 K C 0.250 176.788 176.600 -0.104 0.000 1.052 161 K CA -0.068 56.150 56.287 -0.115 0.000 0.965 161 K CB -0.199 32.252 32.500 -0.082 0.000 0.746 161 K HN 0.357 8.607 8.250 -0.000 0.000 0.457 162 L N 1.856 123.044 121.223 -0.057 0.000 2.848 162 L HA -0.212 4.127 4.340 -0.002 0.000 0.286 162 L C 1.025 177.934 176.870 0.065 0.000 1.150 162 L CA 0.220 55.066 54.840 0.009 0.000 0.958 162 L CB 0.227 42.290 42.059 0.007 0.000 1.322 162 L HN 0.162 8.392 8.230 -0.000 0.000 0.469 163 A N 6.197 129.064 122.820 0.078 0.000 1.929 163 A HA 0.025 4.344 4.320 -0.002 0.000 0.216 163 A C 1.225 178.975 177.584 0.277 0.000 1.176 163 A CA 0.791 52.940 52.037 0.187 0.000 0.628 163 A CB -0.238 18.705 19.000 -0.096 0.000 0.816 163 A HN 0.727 8.877 8.150 -0.000 0.000 0.444 164 M N 0.293 120.022 119.600 0.215 0.000 2.219 164 M HA 0.069 4.548 4.480 -0.002 0.000 0.353 164 M C 1.134 177.554 176.300 0.199 0.000 1.304 164 M CA -0.038 55.385 55.300 0.205 0.000 1.115 164 M CB 0.962 33.597 32.600 0.058 0.000 1.664 164 M HN 0.502 8.792 8.290 -0.000 0.000 0.459 165 Q N 2.474 122.328 119.800 0.090 0.000 1.993 165 Q HA -0.113 4.226 4.340 -0.002 0.000 0.202 165 Q C -0.390 175.650 176.000 0.066 0.000 0.984 165 Q CA 1.507 57.313 55.803 0.005 0.000 0.837 165 Q CB 0.450 29.091 28.738 -0.161 0.000 0.902 165 Q HN 0.683 8.953 8.270 -0.000 0.000 0.423 166 E N -0.772 119.417 120.200 -0.018 0.000 2.248 166 E HA 0.340 4.689 4.350 -0.002 0.000 0.267 166 E C -1.568 174.963 176.600 -0.115 0.000 0.877 166 E CA -0.476 55.968 56.400 0.073 0.000 0.759 166 E CB 1.564 31.320 29.700 0.092 0.000 1.182 166 E HN 0.035 8.395 8.360 -0.000 0.000 0.418 167 F N 2.461 122.434 119.950 0.039 0.000 2.366 167 F HA 0.397 4.923 4.527 -0.002 0.000 0.366 167 F C -0.081 175.742 175.800 0.040 0.000 1.096 167 F CA -0.517 57.488 58.000 0.008 0.000 1.060 167 F CB 0.808 39.797 39.000 -0.019 0.000 1.282 167 F HN 0.217 8.517 8.300 -0.000 0.000 0.450 168 M N 4.990 124.663 119.600 0.120 0.000 2.423 168 M HA 0.611 5.090 4.480 -0.002 0.000 0.335 168 M C -0.437 175.920 176.300 0.094 0.000 1.177 168 M CA -0.808 54.559 55.300 0.112 0.000 1.038 168 M CB 2.224 34.855 32.600 0.051 0.000 1.641 168 M HN 0.437 8.727 8.290 -0.000 0.000 0.455 169 I N 0.590 121.237 120.570 0.128 0.000 2.433 169 I HA 0.613 4.782 4.170 -0.002 0.000 0.292 169 I C -1.585 174.581 176.117 0.082 0.000 1.001 169 I CA -1.076 60.289 61.300 0.108 0.000 1.119 169 I CB 1.255 39.339 38.000 0.140 0.000 1.289 169 I HN 0.417 8.627 8.210 -0.000 0.000 0.438 170 L N 7.625 128.838 121.223 -0.017 0.000 2.319 170 L HA 0.519 4.858 4.340 -0.002 0.000 0.281 170 L C -2.373 174.434 176.870 -0.105 0.000 1.005 170 L CA -1.460 53.311 54.840 -0.116 0.000 0.828 170 L CB 1.470 43.371 42.059 -0.263 0.000 1.227 170 L HN 0.429 8.659 8.230 -0.000 0.000 0.415 171 P HA 0.073 4.493 4.420 -0.000 0.000 0.225 171 P C 1.174 178.461 177.300 -0.022 0.000 1.813 171 P CA -0.176 62.894 63.100 -0.050 0.000 1.013 171 P CB 0.267 31.928 31.700 -0.064 0.000 1.961 172 V N -0.741 119.103 119.914 -0.118 0.000 2.913 172 V HA -0.030 4.089 4.120 -0.002 0.000 0.260 172 V C 1.798 177.916 176.094 0.039 0.000 1.098 172 V CA 2.087 64.306 62.300 -0.135 0.000 1.121 172 V CB -1.425 30.218 31.823 -0.300 0.000 0.714 172 V HN 0.324 8.514 8.190 -0.000 0.000 0.487 173 G N -0.209 108.618 108.800 0.045 0.000 2.880 173 G HA2 0.404 4.363 3.960 -0.002 0.000 0.209 173 G HA3 0.404 4.363 3.960 -0.002 0.000 0.209 173 G C 0.781 175.735 174.900 0.091 0.000 1.157 173 G CA 0.355 45.500 45.100 0.074 0.000 0.779 173 G HN 0.938 9.228 8.290 -0.000 0.000 0.539 174 A N 0.222 123.100 122.820 0.096 0.000 2.531 174 A HA 0.526 4.845 4.320 -0.002 0.000 0.236 174 A C 1.764 179.370 177.584 0.037 0.000 1.062 174 A CA 0.593 52.611 52.037 -0.032 0.000 0.760 174 A CB 0.520 19.391 19.000 -0.215 0.000 0.995 174 A HN 0.773 8.922 8.150 -0.000 0.000 0.501 175 A N 2.371 125.142 122.820 -0.081 0.000 2.119 175 A HA 0.156 4.474 4.320 -0.002 0.000 0.216 175 A C 0.796 178.306 177.584 -0.123 0.000 1.152 175 A CA 1.069 53.096 52.037 -0.017 0.000 0.708 175 A CB -0.493 18.493 19.000 -0.023 0.000 0.805 175 A HN 1.047 9.197 8.150 -0.000 0.000 0.460 176 N N -4.144 114.248 118.700 -0.514 0.000 3.116 176 N HA 0.136 4.875 4.740 -0.002 0.000 0.244 176 N C 0.151 175.002 175.510 -1.098 0.000 1.485 176 N CA -0.493 52.131 53.050 -0.711 0.000 0.884 176 N CB 0.224 38.564 38.487 -0.244 0.000 1.415 176 N HN -0.122 8.258 8.380 -0.000 0.000 0.524 177 F N 1.812 121.258 119.950 -0.840 0.000 2.126 177 F HA -0.083 4.442 4.527 -0.002 0.000 0.299 177 F C 2.687 178.307 175.800 -0.300 0.000 1.096 177 F CA 1.841 59.538 58.000 -0.504 0.000 1.255 177 F CB 0.005 38.925 39.000 -0.134 0.000 0.997 177 F HN 0.573 8.873 8.300 -0.000 0.000 0.479 178 R N 0.126 120.525 120.500 -0.169 0.000 2.096 178 R HA -0.195 4.143 4.340 -0.002 0.000 0.235 178 R C 2.081 178.220 176.300 -0.268 0.000 1.127 178 R CA 1.752 57.759 56.100 -0.156 0.000 0.968 178 R CB -1.180 29.090 30.300 -0.050 0.000 0.861 178 R HN 0.461 8.731 8.270 -0.000 0.000 0.440 179 E N 1.475 121.486 120.200 -0.315 0.000 2.106 179 E HA -0.137 4.211 4.350 -0.002 0.000 0.192 179 E C 2.057 178.427 176.600 -0.383 0.000 0.984 179 E CA 0.995 57.215 56.400 -0.298 0.000 0.806 179 E CB -0.086 29.457 29.700 -0.261 0.000 0.750 179 E HN 0.443 8.803 8.360 -0.000 0.000 0.458 180 A N 0.990 123.506 122.820 -0.507 0.000 1.940 180 A HA -0.183 4.136 4.320 -0.002 0.000 0.219 180 A C 2.158 179.512 177.584 -0.383 0.000 1.176 180 A CA 1.519 53.292 52.037 -0.440 0.000 0.631 180 A CB -0.382 18.306 19.000 -0.519 0.000 0.814 180 A HN 0.298 8.448 8.150 -0.000 0.000 0.446 181 M N -0.957 118.349 119.600 -0.490 0.000 2.132 181 M HA -0.056 4.423 4.480 -0.002 0.000 0.263 181 M C 2.193 178.287 176.300 -0.343 0.000 1.065 181 M CA 1.641 56.709 55.300 -0.387 0.000 1.122 181 M CB -1.192 31.230 32.600 -0.297 0.000 1.365 181 M HN 0.607 8.897 8.290 -0.000 0.000 0.411 182 R N 0.539 120.874 120.500 -0.275 0.000 2.083 182 R HA -0.131 4.208 4.340 -0.002 0.000 0.237 182 R C 2.112 178.270 176.300 -0.237 0.000 1.137 182 R CA 1.544 57.526 56.100 -0.196 0.000 0.951 182 R CB -0.310 29.904 30.300 -0.143 0.000 0.851 182 R HN 0.297 8.567 8.270 -0.000 0.000 0.434 183 I N 0.222 120.560 120.570 -0.386 0.000 2.179 183 I HA -0.190 3.979 4.170 -0.002 0.000 0.242 183 I C 2.509 178.427 176.117 -0.332 0.000 1.088 183 I CA 1.526 62.509 61.300 -0.528 0.000 1.357 183 I CB -0.667 36.906 38.000 -0.712 0.000 1.051 183 I HN 0.448 8.658 8.210 -0.000 0.000 0.409 184 G N 0.406 108.940 108.800 -0.444 0.000 2.440 184 G HA2 -0.255 3.704 3.960 -0.002 0.000 0.218 184 G HA3 -0.255 3.704 3.960 -0.002 0.000 0.218 184 G C 1.841 176.337 174.900 -0.673 0.000 1.154 184 G CA 0.904 45.522 45.100 -0.804 0.000 0.767 184 G HN 0.501 8.791 8.290 -0.000 0.000 0.552 185 A N 0.715 123.214 122.820 -0.535 0.000 1.873 185 A HA 0.022 4.340 4.320 -0.002 0.000 0.215 185 A C 2.165 179.675 177.584 -0.124 0.000 1.186 185 A CA 1.898 53.729 52.037 -0.345 0.000 0.616 185 A CB -0.430 18.462 19.000 -0.181 0.000 0.823 185 A HN 0.428 8.578 8.150 -0.000 0.000 0.442 186 E N -0.439 119.764 120.200 0.005 0.000 2.077 186 E HA -0.127 4.222 4.350 -0.002 0.000 0.193 186 E C 1.975 178.649 176.600 0.123 0.000 0.989 186 E CA 1.326 57.814 56.400 0.145 0.000 0.800 186 E CB -0.216 29.615 29.700 0.219 0.000 0.746 186 E HN 0.380 8.740 8.360 -0.000 0.000 0.452 187 V N 0.563 120.528 119.914 0.085 0.000 2.427 187 V HA -0.256 3.862 4.120 -0.002 0.000 0.248 187 V C 1.981 178.117 176.094 0.070 0.000 1.051 187 V CA 1.735 64.089 62.300 0.090 0.000 1.048 187 V CB -0.532 31.340 31.823 0.083 0.000 0.666 187 V HN 0.333 8.523 8.190 -0.000 0.000 0.456 188 Y N 0.669 120.887 120.300 -0.137 0.000 2.181 188 Y HA -0.252 4.297 4.550 -0.002 0.000 0.288 188 Y C 2.724 178.623 175.900 -0.002 0.000 1.146 188 Y CA 2.019 60.047 58.100 -0.119 0.000 1.164 188 Y CB -0.326 37.917 38.460 -0.362 0.000 0.982 188 Y HN 0.361 8.641 8.280 -0.000 0.000 0.515 189 H N -0.455 118.688 119.070 0.123 0.000 2.423 189 H HA -0.093 4.462 4.556 -0.002 0.000 0.297 189 H C 1.856 177.154 175.328 -0.051 0.000 1.075 189 H CA 1.282 57.347 56.048 0.029 0.000 1.342 189 H CB -0.263 29.544 29.762 0.075 0.000 1.395 189 H HN 0.465 8.745 8.280 -0.000 0.000 0.530 190 N N 0.705 119.446 118.700 0.069 0.000 2.216 190 N HA -0.100 4.639 4.740 -0.002 0.000 0.183 190 N C 2.100 177.566 175.510 -0.073 0.000 1.017 190 N CA 0.289 53.340 53.050 0.003 0.000 0.861 190 N CB -0.110 38.388 38.487 0.018 0.000 0.986 190 N HN 0.198 8.578 8.380 -0.000 0.000 0.428 191 L N 2.270 123.440 121.223 -0.088 0.000 2.083 191 L HA -0.110 4.229 4.340 -0.002 0.000 0.209 191 L C 2.236 178.852 176.870 -0.424 0.000 1.083 191 L CA 1.720 56.466 54.840 -0.156 0.000 0.752 191 L CB -0.501 41.540 42.059 -0.029 0.000 0.899 191 L HN -0.003 8.227 8.230 -0.000 0.000 0.433 192 K N -0.672 119.366 120.400 -0.602 0.000 2.032 192 K HA -0.200 4.119 4.320 -0.002 0.000 0.209 192 K C 1.903 178.221 176.600 -0.469 0.000 1.048 192 K CA 1.671 57.392 56.287 -0.943 0.000 0.927 192 K CB -0.094 32.067 32.500 -0.566 0.000 0.712 192 K HN 0.438 8.688 8.250 -0.000 0.000 0.441 193 N N 0.505 119.052 118.700 -0.255 0.000 2.084 193 N HA -0.144 4.595 4.740 -0.002 0.000 0.190 193 N C 1.922 177.344 175.510 -0.147 0.000 1.030 193 N CA 1.250 54.205 53.050 -0.159 0.000 0.849 193 N CB -0.466 37.963 38.487 -0.095 0.000 1.012 193 N HN 0.006 8.386 8.380 -0.000 0.000 0.423 194 V N 2.240 122.068 119.914 -0.144 0.000 2.252 194 V HA -0.222 3.897 4.120 -0.002 0.000 0.249 194 V C 2.365 178.404 176.094 -0.093 0.000 1.056 194 V CA 1.415 63.654 62.300 -0.102 0.000 1.022 194 V CB -0.492 31.281 31.823 -0.084 0.000 0.641 194 V HN 0.222 8.412 8.190 -0.000 0.000 0.445 195 I N -0.366 120.113 120.570 -0.152 0.000 2.208 195 I HA -0.296 3.873 4.170 -0.002 0.000 0.245 195 I C 2.603 178.701 176.117 -0.031 0.000 1.097 195 I CA 1.986 63.241 61.300 -0.076 0.000 1.363 195 I CB -0.449 37.388 38.000 -0.271 0.000 1.051 195 I HN 0.298 8.508 8.210 -0.000 0.000 0.413 196 K N 1.039 121.359 120.400 -0.134 0.000 2.032 196 K HA -0.269 4.050 4.320 -0.002 0.000 0.209 196 K C 2.127 178.690 176.600 -0.063 0.000 1.048 196 K CA 1.834 58.066 56.287 -0.092 0.000 0.927 196 K CB -0.111 32.318 32.500 -0.119 0.000 0.712 196 K HN 0.277 8.527 8.250 -0.000 0.000 0.441 197 E N 0.306 120.459 120.200 -0.077 0.000 2.150 197 E HA -0.203 4.146 4.350 -0.002 0.000 0.193 197 E C 1.873 178.408 176.600 -0.108 0.000 0.985 197 E CA 1.077 57.429 56.400 -0.080 0.000 0.814 197 E CB 0.181 29.835 29.700 -0.077 0.000 0.752 197 E HN 0.220 8.580 8.360 -0.000 0.000 0.466 198 K N -0.955 119.369 120.400 -0.127 0.000 2.128 198 K HA -0.054 4.265 4.320 -0.002 0.000 0.202 198 K C 0.942 177.258 176.600 -0.473 0.000 1.050 198 K CA 0.759 56.867 56.287 -0.297 0.000 0.966 198 K CB 0.182 32.487 32.500 -0.324 0.000 0.759 198 K HN 0.111 8.361 8.250 -0.000 0.000 0.454 199 Y N -0.056 120.196 120.300 -0.079 0.000 2.481 199 Y HA 0.323 4.873 4.550 -0.002 0.000 0.247 199 Y C 0.465 176.328 175.900 -0.062 0.000 1.151 199 Y CA 0.082 58.141 58.100 -0.068 0.000 1.238 199 Y CB 1.355 39.771 38.460 -0.073 0.000 1.179 199 Y HN 0.243 8.523 8.280 -0.000 0.000 0.524 200 G N 1.427 110.249 108.800 0.037 0.000 2.733 200 G HA2 -0.274 3.684 3.960 -0.002 0.000 0.686 200 G HA3 -0.274 3.684 3.960 -0.002 0.000 0.686 200 G C 0.764 175.669 174.900 0.008 0.000 1.373 200 G CA -0.234 44.872 45.100 0.010 0.000 0.838 200 G HN 0.381 8.671 8.290 -0.000 0.000 0.588 201 K N -0.242 120.154 120.400 -0.008 0.000 2.127 201 K HA -0.190 4.129 4.320 -0.002 0.000 0.208 201 K C 1.388 177.991 176.600 0.004 0.000 1.047 201 K CA 2.164 58.445 56.287 -0.010 0.000 0.927 201 K CB -0.181 32.316 32.500 -0.006 0.000 0.716 201 K HN 0.514 8.764 8.250 -0.000 0.000 0.450 202 D N 1.185 121.593 120.400 0.014 0.000 2.311 202 D HA -0.125 4.513 4.640 -0.002 0.000 0.212 202 D C 1.501 177.811 176.300 0.018 0.000 0.972 202 D CA 1.429 55.441 54.000 0.019 0.000 0.887 202 D CB 0.075 40.887 40.800 0.020 0.000 0.915 202 D HN 0.540 8.910 8.370 -0.000 0.000 0.497 203 A N 0.644 123.470 122.820 0.011 0.000 2.308 203 A HA 0.042 4.361 4.320 -0.002 0.000 0.217 203 A C 1.785 179.357 177.584 -0.019 0.000 1.216 203 A CA 0.306 52.333 52.037 -0.017 0.000 0.864 203 A CB -0.112 18.868 19.000 -0.034 0.000 0.902 203 A HN 0.199 8.349 8.150 -0.000 0.000 0.499 204 T N -2.018 112.533 114.554 -0.005 0.000 3.206 204 T HA 0.162 4.511 4.350 -0.002 0.000 0.253 204 T C 0.280 175.116 174.700 0.227 0.000 1.042 204 T CA -0.574 61.534 62.100 0.012 0.000 0.931 204 T CB -0.411 68.403 68.868 -0.090 0.000 1.029 204 T HN 0.206 8.446 8.240 -0.000 0.000 0.564 205 N N 1.762 120.565 118.700 0.173 0.000 2.434 205 N HA 0.499 5.238 4.740 -0.002 0.000 0.266 205 N C -0.034 175.590 175.510 0.190 0.000 1.223 205 N CA -0.400 52.750 53.050 0.166 0.000 0.972 205 N CB 1.789 40.332 38.487 0.094 0.000 1.207 205 N HN 0.336 8.716 8.380 -0.000 0.000 0.525 206 V N -2.834 117.153 119.914 0.121 0.000 2.881 206 V HA 0.897 5.016 4.120 -0.002 0.000 0.316 206 V C 0.675 176.806 176.094 0.062 0.000 1.070 206 V CA -0.757 61.586 62.300 0.072 0.000 0.976 206 V CB 1.114 32.946 31.823 0.015 0.000 1.038 206 V HN 0.625 8.815 8.190 -0.000 0.000 0.446 207 G N 0.457 109.294 108.800 0.060 0.000 2.568 207 G HA2 0.379 4.337 3.960 -0.002 0.000 0.293 207 G HA3 0.379 4.337 3.960 -0.002 0.000 0.293 207 G C 0.076 175.004 174.900 0.047 0.000 1.347 207 G CA -0.064 45.080 45.100 0.073 0.000 1.039 207 G HN 0.748 9.038 8.290 -0.000 0.000 0.523 208 D N -0.243 120.179 120.400 0.035 0.000 2.190 208 D HA -0.087 4.552 4.640 -0.002 0.000 0.200 208 D C 1.731 178.000 176.300 -0.050 0.000 0.992 208 D CA 1.165 55.141 54.000 -0.040 0.000 0.854 208 D CB 0.235 40.944 40.800 -0.152 0.000 0.936 208 D HN 0.607 8.977 8.370 -0.000 0.000 0.462 209 E N -1.001 119.198 120.200 -0.001 0.000 2.451 209 E HA 0.314 4.662 4.350 -0.002 0.000 0.194 209 E C 1.115 177.747 176.600 0.055 0.000 1.027 209 E CA 0.223 56.651 56.400 0.048 0.000 0.914 209 E CB 0.861 30.640 29.700 0.130 0.000 1.054 209 E HN 0.246 8.606 8.360 -0.000 0.000 0.461 210 G N 1.321 110.127 108.800 0.011 0.000 2.217 210 G HA2 -0.265 3.693 3.960 -0.002 0.000 0.246 210 G HA3 -0.265 3.693 3.960 -0.002 0.000 0.246 210 G C 0.629 175.467 174.900 -0.105 0.000 0.990 210 G CA -0.190 44.878 45.100 -0.054 0.000 0.627 210 G HN 0.483 8.773 8.290 -0.000 0.000 0.522 211 G N -0.126 108.660 108.800 -0.023 0.000 2.503 211 G HA2 0.567 4.526 3.960 -0.002 0.000 0.257 211 G HA3 0.567 4.526 3.960 -0.002 0.000 0.257 211 G C 0.134 174.983 174.900 -0.084 0.000 1.214 211 G CA -0.560 44.526 45.100 -0.022 0.000 0.839 211 G HN 0.351 8.641 8.290 -0.000 0.000 0.559 212 F N 0.176 120.212 119.950 0.143 0.000 2.545 212 F HA 0.351 4.877 4.527 -0.002 0.000 0.348 212 F C 1.056 176.857 175.800 0.001 0.000 1.163 212 F CA 0.305 58.325 58.000 0.033 0.000 1.331 212 F CB 1.012 39.975 39.000 -0.062 0.000 1.138 212 F HN 0.461 8.761 8.300 -0.000 0.000 0.602 213 A N 3.928 126.852 122.820 0.173 0.000 2.923 213 A HA 0.425 4.744 4.320 -0.002 0.000 0.343 213 A C -2.529 175.052 177.584 -0.004 0.000 1.199 213 A CA -1.513 50.563 52.037 0.064 0.000 0.878 213 A CB -0.641 18.396 19.000 0.063 0.000 1.104 213 A HN 0.389 8.539 8.150 -0.000 0.000 0.483 214 P HA 0.124 4.544 4.420 -0.000 0.000 0.274 214 P C -0.661 176.492 177.300 -0.245 0.000 1.237 214 P CA -0.416 62.549 63.100 -0.225 0.000 0.793 214 P CB 0.801 32.257 31.700 -0.408 0.000 0.977 215 N N 3.025 121.574 118.700 -0.251 0.000 2.895 215 N HA 0.148 4.886 4.740 -0.002 0.000 0.277 215 N C 0.088 175.463 175.510 -0.225 0.000 1.185 215 N CA -0.181 52.768 53.050 -0.167 0.000 1.106 215 N CB -0.723 37.722 38.487 -0.068 0.000 1.422 215 N HN 0.436 8.816 8.380 -0.000 0.000 0.521 216 I N -3.200 117.231 120.570 -0.233 0.000 3.074 216 I HA 0.467 4.636 4.170 -0.002 0.000 0.310 216 I C -0.126 175.924 176.117 -0.112 0.000 1.153 216 I CA -1.168 60.016 61.300 -0.194 0.000 0.993 216 I CB 1.914 39.733 38.000 -0.303 0.000 1.237 216 I HN 0.055 8.265 8.210 -0.000 0.000 0.443 217 L N 1.643 122.828 121.223 -0.062 0.000 2.600 217 L HA 0.430 4.769 4.340 -0.002 0.000 0.213 217 L C 0.651 177.521 176.870 -0.001 0.000 1.045 217 L CA 0.838 55.659 54.840 -0.032 0.000 0.863 217 L CB 0.131 42.181 42.059 -0.014 0.000 1.189 217 L HN 0.635 8.865 8.230 -0.000 0.000 0.484 218 E N 1.161 121.367 120.200 0.009 0.000 2.292 218 E HA -0.025 4.324 4.350 -0.002 0.000 0.265 218 E C 0.170 176.802 176.600 0.052 0.000 1.093 218 E CA 0.170 56.602 56.400 0.052 0.000 0.922 218 E CB 0.295 30.031 29.700 0.060 0.000 1.001 218 E HN 0.409 8.769 8.360 -0.000 0.000 0.444 219 N N 2.891 121.686 118.700 0.158 0.000 2.364 219 N HA -0.185 4.554 4.740 -0.002 0.000 0.183 219 N C 1.595 177.143 175.510 0.064 0.000 1.022 219 N CA 0.782 53.987 53.050 0.258 0.000 0.883 219 N CB 0.104 38.839 38.487 0.413 0.000 0.965 219 N HN 0.345 8.725 8.380 -0.000 0.000 0.438 220 K N 1.222 121.660 120.400 0.063 0.000 2.097 220 K HA -0.166 4.153 4.320 -0.002 0.000 0.205 220 K C 1.788 178.296 176.600 -0.154 0.000 1.050 220 K CA 1.102 57.333 56.287 -0.093 0.000 0.938 220 K CB 0.098 32.741 32.500 0.240 0.000 0.718 220 K HN -0.003 8.247 8.250 -0.000 0.000 0.442 221 E N 0.223 120.377 120.200 -0.076 0.000 2.204 221 E HA -0.107 4.242 4.350 -0.002 0.000 0.195 221 E C 1.671 178.133 176.600 -0.229 0.000 0.990 221 E CA 1.633 57.978 56.400 -0.091 0.000 0.821 221 E CB -0.488 29.190 29.700 -0.037 0.000 0.750 221 E HN 0.439 8.799 8.360 -0.000 0.000 0.477 222 G N 0.672 109.237 108.800 -0.391 0.000 2.414 222 G HA2 -0.216 3.743 3.960 -0.002 0.000 0.215 222 G HA3 -0.216 3.743 3.960 -0.002 0.000 0.215 222 G C 1.575 176.218 174.900 -0.429 0.000 1.188 222 G CA 0.889 45.557 45.100 -0.720 0.000 0.783 222 G HN 0.316 8.606 8.290 -0.000 0.000 0.537 223 L N 0.155 121.161 121.223 -0.361 0.000 2.083 223 L HA -0.053 4.285 4.340 -0.002 0.000 0.209 223 L C 2.768 179.349 176.870 -0.481 0.000 1.083 223 L CA 1.382 55.918 54.840 -0.506 0.000 0.752 223 L CB -0.334 41.050 42.059 -1.126 0.000 0.899 223 L HN 0.240 8.470 8.230 -0.000 0.000 0.433 224 E N 0.902 120.878 120.200 -0.372 0.000 2.051 224 E HA -0.200 4.149 4.350 -0.002 0.000 0.192 224 E C 2.180 178.749 176.600 -0.052 0.000 0.991 224 E CA 1.395 57.738 56.400 -0.094 0.000 0.799 224 E CB -0.272 29.430 29.700 0.004 0.000 0.748 224 E HN 0.356 8.716 8.360 -0.000 0.000 0.449 225 L N -0.339 120.828 121.223 -0.093 0.000 2.046 225 L HA -0.192 4.147 4.340 -0.002 0.000 0.208 225 L C 2.338 179.182 176.870 -0.043 0.000 1.077 225 L CA 0.653 55.456 54.840 -0.062 0.000 0.747 225 L CB -0.438 41.561 42.059 -0.100 0.000 0.896 225 L HN 0.210 8.440 8.230 -0.000 0.000 0.432 226 L N 0.030 121.220 121.223 -0.055 0.000 2.017 226 L HA -0.241 4.098 4.340 -0.002 0.000 0.208 226 L C 2.599 179.484 176.870 0.024 0.000 1.073 226 L CA 1.735 56.575 54.840 -0.000 0.000 0.745 226 L CB -0.767 41.300 42.059 0.014 0.000 0.894 226 L HN 0.193 8.423 8.230 -0.000 0.000 0.432 227 K N -1.011 119.405 120.400 0.026 0.000 2.044 227 K HA -0.270 4.049 4.320 -0.002 0.000 0.210 227 K C 2.155 178.792 176.600 0.062 0.000 1.049 227 K CA 2.196 58.532 56.287 0.081 0.000 0.927 227 K CB -0.340 32.258 32.500 0.163 0.000 0.713 227 K HN 0.435 8.685 8.250 -0.000 0.000 0.443 228 T N -1.353 113.226 114.554 0.041 0.000 2.951 228 T HA 0.062 4.411 4.350 -0.002 0.000 0.268 228 T C 1.767 176.474 174.700 0.012 0.000 1.073 228 T CA 1.006 63.121 62.100 0.024 0.000 1.134 228 T CB -0.120 68.756 68.868 0.014 0.000 0.884 228 T HN 0.334 8.574 8.240 -0.000 0.000 0.479 229 A N 1.232 124.059 122.820 0.012 0.000 1.897 229 A HA 0.208 4.527 4.320 -0.002 0.000 0.215 229 A C 2.323 179.928 177.584 0.035 0.000 1.181 229 A CA 1.122 53.165 52.037 0.010 0.000 0.620 229 A CB -0.671 18.335 19.000 0.009 0.000 0.821 229 A HN 0.604 8.754 8.150 -0.000 0.000 0.443 230 I N -0.169 120.434 120.570 0.056 0.000 2.163 230 I HA -0.237 3.932 4.170 -0.002 0.000 0.243 230 I C 2.701 178.854 176.117 0.059 0.000 1.085 230 I CA 1.318 62.669 61.300 0.086 0.000 1.347 230 I CB -0.660 37.395 38.000 0.093 0.000 1.044 230 I HN 0.404 8.614 8.210 -0.000 0.000 0.408 231 G N 0.523 109.344 108.800 0.035 0.000 2.402 231 G HA2 -0.270 3.688 3.960 -0.002 0.000 0.216 231 G HA3 -0.270 3.688 3.960 -0.002 0.000 0.216 231 G C 1.701 176.586 174.900 -0.025 0.000 1.162 231 G CA 0.629 45.734 45.100 0.008 0.000 0.777 231 G HN 0.302 8.592 8.290 -0.000 0.000 0.539 232 K N 0.602 120.991 120.400 -0.019 0.000 2.209 232 K HA 0.071 4.390 4.320 -0.002 0.000 0.204 232 K C 2.437 179.000 176.600 -0.062 0.000 1.048 232 K CA 1.113 57.378 56.287 -0.036 0.000 0.940 232 K CB -0.191 32.292 32.500 -0.027 0.000 0.729 232 K HN 0.247 8.497 8.250 -0.000 0.000 0.451 233 A N -0.019 122.765 122.820 -0.060 0.000 2.178 233 A HA 0.204 4.523 4.320 -0.002 0.000 0.211 233 A C 1.209 178.559 177.584 -0.390 0.000 1.157 233 A CA 0.735 52.699 52.037 -0.122 0.000 0.780 233 A CB -0.160 18.864 19.000 0.040 0.000 0.828 233 A HN 0.480 8.630 8.150 -0.000 0.000 0.476 234 G N -2.013 106.610 108.800 -0.295 0.000 2.149 234 G HA2 -0.292 3.667 3.960 -0.002 0.000 0.235 234 G HA3 -0.292 3.667 3.960 -0.002 0.000 0.235 234 G C 0.077 174.705 174.900 -0.453 0.000 1.018 234 G CA 0.500 45.379 45.100 -0.368 0.000 0.728 234 G HN 0.623 8.913 8.290 -0.000 0.000 0.508 235 Y N -0.450 119.851 120.300 0.002 0.000 2.716 235 Y HA 0.237 4.786 4.550 -0.002 0.000 0.260 235 Y C 2.271 178.177 175.900 0.011 0.000 1.141 235 Y CA 0.238 58.340 58.100 0.003 0.000 1.168 235 Y CB 0.690 39.148 38.460 -0.003 0.000 1.189 235 Y HN 0.224 8.504 8.280 -0.000 0.000 0.549 236 T N 0.084 114.706 114.554 0.113 0.000 2.803 236 T HA -0.193 4.156 4.350 -0.002 0.000 0.269 236 T C 1.521 176.273 174.700 0.087 0.000 1.052 236 T CA 2.012 64.164 62.100 0.087 0.000 1.136 236 T CB -0.176 68.723 68.868 0.052 0.000 0.864 236 T HN 0.581 8.821 8.240 -0.000 0.000 0.467 237 D N 0.551 121.006 120.400 0.091 0.000 2.355 237 D HA -0.003 4.636 4.640 -0.002 0.000 0.218 237 D C 1.461 177.810 176.300 0.083 0.000 1.004 237 D CA 0.529 54.576 54.000 0.078 0.000 0.880 237 D CB -0.029 40.812 40.800 0.069 0.000 0.911 237 D HN 0.298 8.668 8.370 -0.000 0.000 0.528 238 K N -0.153 120.309 120.400 0.104 0.000 2.412 238 K HA 0.205 4.524 4.320 -0.002 0.000 0.202 238 K C -0.175 176.441 176.600 0.027 0.000 1.102 238 K CA -0.016 56.310 56.287 0.065 0.000 1.027 238 K CB 2.151 34.684 32.500 0.055 0.000 0.931 238 K HN -0.063 8.187 8.250 -0.000 0.000 0.557 239 V N 2.757 122.701 119.914 0.050 0.000 2.459 239 V HA 0.305 4.424 4.120 -0.002 0.000 0.295 239 V C -0.066 176.042 176.094 0.025 0.000 1.029 239 V CA -0.953 61.361 62.300 0.024 0.000 0.874 239 V CB 1.504 33.361 31.823 0.056 0.000 0.985 239 V HN -0.041 8.149 8.190 -0.000 0.000 0.438 240 V N 3.048 122.952 119.914 -0.015 0.000 3.103 240 V HA 0.713 4.832 4.120 -0.002 0.000 0.318 240 V C -0.402 175.691 176.094 -0.002 0.000 1.114 240 V CA -0.939 61.361 62.300 -0.000 0.000 1.020 240 V CB 2.159 33.969 31.823 -0.021 0.000 1.085 240 V HN 0.640 8.830 8.190 -0.000 0.000 0.446 241 I N 0.788 121.372 120.570 0.025 0.000 2.648 241 I HA 0.817 4.986 4.170 -0.002 0.000 0.304 241 I C 0.584 176.705 176.117 0.006 0.000 1.009 241 I CA -0.359 60.955 61.300 0.024 0.000 1.114 241 I CB 1.986 40.011 38.000 0.042 0.000 1.293 241 I HN 0.975 9.185 8.210 -0.000 0.000 0.449 242 G N 4.812 113.606 108.800 -0.010 0.000 2.605 242 G HA2 0.840 4.799 3.960 -0.002 0.000 0.296 242 G HA3 0.840 4.799 3.960 -0.002 0.000 0.296 242 G C -1.219 173.632 174.900 -0.083 0.000 1.304 242 G CA -0.649 44.432 45.100 -0.033 0.000 0.941 242 G HN 0.435 8.725 8.290 -0.000 0.000 0.475 243 M N 0.649 120.171 119.600 -0.130 0.000 2.531 243 M HA 0.371 4.849 4.480 -0.002 0.000 0.286 243 M C -1.991 174.185 176.300 -0.207 0.000 1.232 243 M CA -0.819 54.340 55.300 -0.236 0.000 0.877 243 M CB 3.129 35.537 32.600 -0.321 0.000 1.726 243 M HN 0.485 8.775 8.290 -0.000 0.000 0.463 244 D N 1.401 121.670 120.400 -0.218 0.000 2.440 244 D HA 0.390 5.029 4.640 -0.002 0.000 0.252 244 D C 0.054 176.243 176.300 -0.185 0.000 1.180 244 D CA -0.388 53.517 54.000 -0.158 0.000 0.894 244 D CB 1.733 42.493 40.800 -0.065 0.000 1.111 244 D HN 0.347 8.717 8.370 -0.000 0.000 0.544 245 V N 3.126 122.913 119.914 -0.212 0.000 2.488 245 V HA 0.056 4.174 4.120 -0.002 0.000 0.246 245 V C 1.544 177.605 176.094 -0.056 0.000 1.046 245 V CA 0.930 63.160 62.300 -0.117 0.000 1.053 245 V CB -1.106 30.609 31.823 -0.180 0.000 0.679 245 V HN 0.909 9.099 8.190 -0.000 0.000 0.458 246 A N 0.038 122.764 122.820 -0.157 0.000 2.667 246 A HA -0.188 4.131 4.320 -0.002 0.000 0.298 246 A C 1.614 178.981 177.584 -0.361 0.000 1.483 246 A CA 0.976 52.912 52.037 -0.168 0.000 0.738 246 A CB -1.656 17.281 19.000 -0.105 0.000 1.067 246 A HN 1.082 9.232 8.150 -0.000 0.000 0.451 247 A N 0.028 122.530 122.820 -0.531 0.000 1.940 247 A HA 0.004 4.323 4.320 -0.002 0.000 0.219 247 A C 2.404 179.574 177.584 -0.691 0.000 1.176 247 A CA 2.347 53.783 52.037 -1.000 0.000 0.631 247 A CB -0.800 17.789 19.000 -0.684 0.000 0.814 247 A HN 1.549 9.699 8.150 -0.000 0.000 0.446 248 S N -0.011 115.498 115.700 -0.318 0.000 2.420 248 S HA -0.167 4.302 4.470 -0.002 0.000 0.237 248 S C 1.704 176.193 174.600 -0.185 0.000 1.023 248 S CA 1.375 59.472 58.200 -0.172 0.000 0.991 248 S CB -0.289 62.850 63.200 -0.102 0.000 0.792 248 S HN 0.617 8.928 8.310 -0.000 0.000 0.488 249 E N 0.744 120.760 120.200 -0.306 0.000 2.204 249 E HA -0.070 4.279 4.350 -0.002 0.000 0.194 249 E C 0.972 177.308 176.600 -0.440 0.000 0.989 249 E CA 0.746 56.969 56.400 -0.295 0.000 0.824 249 E CB -0.115 29.429 29.700 -0.260 0.000 0.756 249 E HN 0.868 9.228 8.360 -0.000 0.000 0.477 250 F N -2.034 117.657 119.950 -0.432 0.000 2.764 250 F HA 0.346 4.872 4.527 -0.002 0.000 0.310 250 F C 0.048 175.771 175.800 -0.128 0.000 1.124 250 F CA -1.295 56.436 58.000 -0.449 0.000 1.252 250 F CB -0.425 38.212 39.000 -0.605 0.000 1.010 250 F HN -0.292 8.008 8.300 -0.000 0.000 0.518 251 F N 4.114 123.921 119.950 -0.238 0.000 2.467 251 F HA 0.539 5.065 4.527 -0.002 0.000 0.362 251 F C 0.016 175.647 175.800 -0.281 0.000 1.090 251 F CA -0.733 57.064 58.000 -0.339 0.000 1.202 251 F CB 0.549 39.398 39.000 -0.251 0.000 1.113 251 F HN -0.019 8.281 8.300 -0.000 0.000 0.541 252 R N 4.620 124.557 120.500 -0.939 0.000 2.407 252 R HA 0.193 4.532 4.340 -0.002 0.000 0.298 252 R C -0.114 175.728 176.300 -0.764 0.000 1.166 252 R CA -0.393 55.295 56.100 -0.687 0.000 1.006 252 R CB 0.719 30.665 30.300 -0.589 0.000 1.145 252 R HN 0.823 9.093 8.270 -0.000 0.000 0.538 253 S N 1.101 116.342 115.700 -0.766 0.000 3.425 253 S HA -0.255 4.214 4.470 -0.002 0.000 0.377 253 S C 1.155 175.465 174.600 -0.483 0.000 0.989 253 S CA 1.412 59.321 58.200 -0.484 0.000 1.183 253 S CB -1.032 62.059 63.200 -0.181 0.000 0.908 253 S HN 1.068 9.378 8.310 -0.000 0.000 0.472 254 G N -0.753 107.485 108.800 -0.936 0.000 2.278 254 G HA2 -0.209 3.750 3.960 -0.002 0.000 0.210 254 G HA3 -0.209 3.750 3.960 -0.002 0.000 0.210 254 G C -0.042 174.661 174.900 -0.327 0.000 1.000 254 G CA 0.236 45.150 45.100 -0.310 0.000 0.635 254 G HN 0.630 8.920 8.290 -0.000 0.000 0.495 255 K N -0.860 119.224 120.400 -0.525 0.000 2.354 255 K HA 0.743 5.062 4.320 -0.002 0.000 0.238 255 K C -1.242 174.957 176.600 -0.670 0.000 1.068 255 K CA -0.906 55.184 56.287 -0.328 0.000 0.925 255 K CB 1.309 33.813 32.500 0.007 0.000 1.286 255 K HN 0.081 8.331 8.250 -0.000 0.000 0.500 256 Y N 0.090 120.401 120.300 0.019 0.000 2.391 256 Y HA 0.164 4.712 4.550 -0.002 0.000 0.341 256 Y C -0.765 175.131 175.900 -0.008 0.000 0.965 256 Y CA -1.005 57.163 58.100 0.114 0.000 1.067 256 Y CB 1.730 40.376 38.460 0.311 0.000 1.199 256 Y HN 0.462 8.742 8.280 -0.000 0.000 0.450 257 D N 3.671 124.092 120.400 0.035 0.000 2.443 257 D HA 0.233 4.872 4.640 -0.002 0.000 0.221 257 D C -0.059 176.192 176.300 -0.081 0.000 1.097 257 D CA -0.098 53.841 54.000 -0.101 0.000 0.865 257 D CB 0.877 41.499 40.800 -0.298 0.000 1.034 257 D HN 0.656 9.026 8.370 -0.000 0.000 0.511 258 L N 2.790 123.943 121.223 -0.118 0.000 2.682 258 L HA 0.153 4.492 4.340 -0.002 0.000 0.240 258 L C 0.586 177.405 176.870 -0.085 0.000 1.178 258 L CA 0.321 55.005 54.840 -0.259 0.000 0.970 258 L CB 0.069 42.029 42.059 -0.165 0.000 1.179 258 L HN 0.304 8.534 8.230 -0.000 0.000 0.435 259 D N -1.111 119.300 120.400 0.018 0.000 2.822 259 D HA -0.020 4.619 4.640 -0.002 0.000 0.327 259 D C 1.224 177.537 176.300 0.021 0.000 1.577 259 D CA -0.392 53.608 54.000 0.000 0.000 0.785 259 D CB 0.137 40.948 40.800 0.019 0.000 1.199 259 D HN 0.166 8.536 8.370 -0.000 0.000 0.443 260 F N 0.560 120.478 119.950 -0.053 0.000 2.373 260 F HA 0.126 4.652 4.527 -0.002 0.000 0.300 260 F C 1.252 177.071 175.800 0.033 0.000 1.080 260 F CA 0.753 58.759 58.000 0.010 0.000 1.417 260 F CB -0.333 38.699 39.000 0.054 0.000 1.070 260 F HN -0.109 8.191 8.300 -0.000 0.000 0.546 261 K N 0.353 120.342 120.400 -0.686 0.000 2.417 261 K HA 0.207 4.525 4.320 -0.002 0.000 0.196 261 K C 0.107 176.584 176.600 -0.205 0.000 1.023 261 K CA -0.034 55.949 56.287 -0.506 0.000 1.122 261 K CB 0.155 32.286 32.500 -0.615 0.000 0.850 261 K HN 0.161 8.411 8.250 -0.000 0.000 0.521 262 S N 1.252 116.881 115.700 -0.119 0.000 2.621 262 S HA 0.377 4.845 4.470 -0.002 0.000 0.302 262 S C -2.610 171.994 174.600 0.006 0.000 1.093 262 S CA -1.407 56.766 58.200 -0.045 0.000 1.017 262 S CB 1.519 64.703 63.200 -0.028 0.000 1.077 262 S HN -0.097 8.213 8.310 -0.000 0.000 0.517 263 P HA 0.017 4.437 4.420 -0.000 0.000 0.258 263 P C -0.390 176.946 177.300 0.059 0.000 1.172 263 P CA 0.141 63.261 63.100 0.034 0.000 0.762 263 P CB 0.027 31.740 31.700 0.022 0.000 0.764 264 D N 2.785 123.236 120.400 0.085 0.000 2.567 264 D HA -0.012 4.626 4.640 -0.002 0.000 0.228 264 D C -0.142 176.213 176.300 0.092 0.000 1.185 264 D CA 1.367 55.444 54.000 0.130 0.000 0.874 264 D CB 0.245 41.124 40.800 0.132 0.000 1.219 264 D HN 0.281 8.651 8.370 -0.000 0.000 0.494 265 D N 1.769 122.234 120.400 0.108 0.000 2.227 265 D HA 0.098 4.737 4.640 -0.002 0.000 0.176 265 D C -2.465 173.712 176.300 -0.205 0.000 1.228 265 D CA -0.915 53.074 54.000 -0.019 0.000 1.043 265 D CB 0.866 41.673 40.800 0.012 0.000 1.758 265 D HN 0.055 8.425 8.370 -0.000 0.000 0.544 266 P HA -0.131 4.289 4.420 -0.000 0.000 0.222 266 P C 1.385 178.228 177.300 -0.762 0.000 1.142 266 P CA 1.262 63.559 63.100 -1.338 0.000 0.788 266 P CB 0.247 31.489 31.700 -0.762 0.000 0.767 267 S N 0.535 116.039 115.700 -0.327 0.000 2.402 267 S HA -0.179 4.290 4.470 -0.002 0.000 0.229 267 S C 1.909 176.481 174.600 -0.047 0.000 1.021 267 S CA 0.635 58.746 58.200 -0.148 0.000 0.974 267 S CB -0.916 62.234 63.200 -0.083 0.000 0.800 267 S HN 0.288 8.598 8.310 -0.000 0.000 0.484 268 R N -0.577 119.935 120.500 0.020 0.000 2.236 268 R HA 0.088 4.427 4.340 -0.002 0.000 0.208 268 R C -0.104 176.345 176.300 0.247 0.000 1.036 268 R CA -0.080 56.094 56.100 0.124 0.000 1.001 268 R CB -0.642 29.740 30.300 0.137 0.000 0.896 268 R HN 0.340 8.610 8.270 -0.000 0.000 0.464 269 Y N 2.572 122.890 120.300 0.029 0.000 2.757 269 Y HA 0.075 4.624 4.550 -0.002 0.000 0.344 269 Y C 1.139 177.068 175.900 0.049 0.000 1.263 269 Y CA -1.277 56.849 58.100 0.043 0.000 1.493 269 Y CB 0.121 38.586 38.460 0.010 0.000 1.342 269 Y HN 0.112 8.392 8.280 -0.000 0.000 0.627 270 I N -1.161 119.556 120.570 0.244 0.000 3.042 270 I HA 0.711 4.880 4.170 -0.002 0.000 0.310 270 I C -0.219 176.022 176.117 0.207 0.000 1.117 270 I CA -1.206 60.198 61.300 0.173 0.000 1.003 270 I CB 2.311 40.382 38.000 0.117 0.000 1.228 270 I HN 0.474 8.684 8.210 -0.000 0.000 0.443 271 S N 2.324 118.118 115.700 0.157 0.000 2.632 271 S HA 0.469 4.938 4.470 -0.002 0.000 0.267 271 S C -1.626 173.109 174.600 0.225 0.000 1.276 271 S CA -0.993 57.310 58.200 0.172 0.000 0.998 271 S CB 0.875 64.134 63.200 0.099 0.000 0.953 271 S HN 0.694 9.004 8.310 -0.000 0.000 0.547 272 P HA -0.105 4.315 4.420 -0.000 0.000 0.217 272 P C 0.611 177.937 177.300 0.044 0.000 1.150 272 P CA 1.208 64.417 63.100 0.183 0.000 0.832 272 P CB -0.084 31.648 31.700 0.053 0.000 0.787 273 D N 0.235 120.653 120.400 0.031 0.000 2.104 273 D HA -0.159 4.479 4.640 -0.002 0.000 0.194 273 D C 2.246 178.550 176.300 0.008 0.000 0.994 273 D CA 1.201 55.212 54.000 0.020 0.000 0.830 273 D CB -0.552 40.263 40.800 0.024 0.000 0.959 273 D HN 0.309 8.679 8.370 -0.000 0.000 0.452 274 Q N -0.357 119.446 119.800 0.005 0.000 2.224 274 Q HA -0.096 4.243 4.340 -0.002 0.000 0.203 274 Q C 2.038 177.956 176.000 -0.136 0.000 0.970 274 Q CA 0.363 56.144 55.803 -0.037 0.000 0.865 274 Q CB 0.043 28.777 28.738 -0.006 0.000 0.922 274 Q HN 0.158 8.428 8.270 -0.000 0.000 0.445 275 L N 0.439 121.568 121.223 -0.156 0.000 2.044 275 L HA -0.037 4.302 4.340 -0.002 0.000 0.205 275 L C 2.146 178.581 176.870 -0.724 0.000 1.075 275 L CA 1.909 56.473 54.840 -0.460 0.000 0.747 275 L CB -0.920 40.913 42.059 -0.376 0.000 0.903 275 L HN 0.111 8.341 8.230 -0.000 0.000 0.435 276 A N -0.735 121.944 122.820 -0.236 0.000 1.908 276 A HA -0.231 4.087 4.320 -0.002 0.000 0.218 276 A C 1.962 179.579 177.584 0.055 0.000 1.181 276 A CA 1.989 54.034 52.037 0.015 0.000 0.627 276 A CB -0.816 18.386 19.000 0.336 0.000 0.818 276 A HN 0.527 8.677 8.150 -0.000 0.000 0.445 277 D N -0.596 119.785 120.400 -0.031 0.000 2.178 277 D HA -0.096 4.543 4.640 -0.002 0.000 0.202 277 D C 1.793 178.011 176.300 -0.137 0.000 0.974 277 D CA 1.054 55.039 54.000 -0.026 0.000 0.841 277 D CB -0.314 40.469 40.800 -0.028 0.000 0.953 277 D HN 0.386 8.756 8.370 -0.000 0.000 0.478 278 L N 0.113 121.144 121.223 -0.320 0.000 2.056 278 L HA -0.179 4.160 4.340 -0.002 0.000 0.207 278 L C 1.960 178.435 176.870 -0.659 0.000 1.078 278 L CA 1.547 56.065 54.840 -0.537 0.000 0.749 278 L CB -0.679 40.995 42.059 -0.642 0.000 0.901 278 L HN -0.067 8.163 8.230 -0.000 0.000 0.433 279 Y N 0.570 120.652 120.300 -0.364 0.000 2.089 279 Y HA -0.215 4.334 4.550 -0.002 0.000 0.282 279 Y C 2.546 178.475 175.900 0.048 0.000 1.139 279 Y CA 1.505 59.508 58.100 -0.162 0.000 1.123 279 Y CB -1.076 37.349 38.460 -0.058 0.000 0.980 279 Y HN 0.181 8.461 8.280 -0.000 0.000 0.493 280 K N 0.127 120.699 120.400 0.288 0.000 2.218 280 K HA -0.180 4.138 4.320 -0.002 0.000 0.205 280 K C 2.230 178.908 176.600 0.130 0.000 1.046 280 K CA 1.689 58.093 56.287 0.195 0.000 0.933 280 K CB -0.338 32.253 32.500 0.152 0.000 0.728 280 K HN 0.414 8.664 8.250 -0.000 0.000 0.454 281 S N 0.239 115.976 115.700 0.062 0.000 2.414 281 S HA -0.050 4.418 4.470 -0.002 0.000 0.227 281 S C 1.910 176.677 174.600 0.279 0.000 1.022 281 S CA 0.464 58.717 58.200 0.088 0.000 0.958 281 S CB -0.563 62.640 63.200 0.005 0.000 0.797 281 S HN 0.269 8.579 8.310 -0.000 0.000 0.493 282 F N 1.563 121.647 119.950 0.223 0.000 2.146 282 F HA 0.072 4.598 4.527 -0.002 0.000 0.298 282 F C 2.331 178.297 175.800 0.276 0.000 1.096 282 F CA 0.730 58.931 58.000 0.334 0.000 1.275 282 F CB -0.282 38.892 39.000 0.290 0.000 1.008 282 F HN 0.189 8.489 8.300 -0.000 0.000 0.480 283 I N 0.356 121.159 120.570 0.388 0.000 2.454 283 I HA -0.302 3.867 4.170 -0.002 0.000 0.254 283 I C 2.443 178.652 176.117 0.155 0.000 1.156 283 I CA 1.321 62.761 61.300 0.234 0.000 1.433 283 I CB -0.405 37.693 38.000 0.164 0.000 1.082 283 I HN 0.129 8.339 8.210 -0.000 0.000 0.432 284 K N 0.804 121.283 120.400 0.132 0.000 2.098 284 K HA -0.131 4.188 4.320 -0.002 0.000 0.203 284 K C 1.155 177.753 176.600 -0.003 0.000 1.051 284 K CA 1.371 57.693 56.287 0.058 0.000 0.957 284 K CB 0.165 32.692 32.500 0.045 0.000 0.738 284 K HN 0.176 8.426 8.250 -0.000 0.000 0.447 285 D N -0.781 119.587 120.400 -0.053 0.000 2.348 285 D HA 0.037 4.676 4.640 -0.002 0.000 0.211 285 D C -0.358 175.564 176.300 -0.630 0.000 0.998 285 D CA 0.624 54.412 54.000 -0.352 0.000 0.873 285 D CB 0.234 40.736 40.800 -0.497 0.000 0.925 285 D HN 0.114 8.484 8.370 -0.000 0.000 0.524 286 Y N -0.814 119.547 120.300 0.101 0.000 2.581 286 Y HA 0.316 4.864 4.550 -0.002 0.000 0.345 286 Y C -1.970 173.971 175.900 0.068 0.000 1.036 286 Y CA -2.531 55.611 58.100 0.070 0.000 1.042 286 Y CB 1.514 40.004 38.460 0.049 0.000 1.289 286 Y HN -0.295 7.985 8.280 -0.000 0.000 0.471 287 P HA 0.033 4.453 4.420 -0.000 0.000 0.261 287 P C -0.433 176.943 177.300 0.125 0.000 1.650 287 P CA 0.352 63.535 63.100 0.137 0.000 0.846 287 P CB -0.407 31.359 31.700 0.109 0.000 1.758 288 V N 1.767 121.773 119.914 0.155 0.000 2.479 288 V HA -0.015 4.104 4.120 -0.002 0.000 0.281 288 V C 1.883 178.035 176.094 0.095 0.000 1.031 288 V CA 0.365 62.735 62.300 0.116 0.000 1.038 288 V CB 1.267 33.181 31.823 0.151 0.000 0.981 288 V HN 0.169 8.359 8.190 -0.000 0.000 0.478 289 V N 1.571 121.531 119.914 0.077 0.000 3.604 289 V HA 0.458 4.577 4.120 -0.002 0.000 0.277 289 V C 0.508 176.650 176.094 0.081 0.000 1.399 289 V CA 0.386 62.742 62.300 0.095 0.000 1.034 289 V CB 0.717 32.634 31.823 0.157 0.000 0.824 289 V HN 0.670 8.860 8.190 -0.000 0.000 0.439 290 S N -0.017 115.711 115.700 0.046 0.000 2.546 290 S HA 0.798 5.267 4.470 -0.002 0.000 0.272 290 S C -1.305 173.265 174.600 -0.050 0.000 1.140 290 S CA -0.488 57.721 58.200 0.014 0.000 0.920 290 S CB 1.744 64.973 63.200 0.049 0.000 1.083 290 S HN 0.341 8.651 8.310 -0.000 0.000 0.476 291 I N 3.316 123.829 120.570 -0.095 0.000 2.478 291 I HA 0.398 4.567 4.170 -0.002 0.000 0.287 291 I C -0.293 175.683 176.117 -0.236 0.000 1.042 291 I CA -0.481 60.688 61.300 -0.219 0.000 1.067 291 I CB 1.970 39.765 38.000 -0.342 0.000 1.233 291 I HN 0.630 8.840 8.210 -0.000 0.000 0.431 292 E N 5.686 125.750 120.200 -0.228 0.000 2.231 292 E HA 0.150 4.499 4.350 -0.002 0.000 0.277 292 E C -0.753 175.700 176.600 -0.245 0.000 0.999 292 E CA -0.460 55.848 56.400 -0.154 0.000 0.827 292 E CB 0.926 30.581 29.700 -0.074 0.000 1.101 292 E HN 0.482 8.842 8.360 -0.000 0.000 0.393 293 D N 4.191 124.519 120.400 -0.119 0.000 2.755 293 D HA -0.151 4.487 4.640 -0.002 0.000 0.227 293 D C -1.791 174.135 176.300 -0.624 0.000 1.211 293 D CA 0.445 54.346 54.000 -0.164 0.000 0.663 293 D CB -0.337 40.446 40.800 -0.028 0.000 0.983 293 D HN 0.458 8.828 8.370 -0.000 0.000 0.407 294 P HA -0.095 4.325 4.420 -0.000 0.000 0.226 294 P C 0.189 176.460 177.300 -1.715 0.000 1.153 294 P CA 0.905 63.089 63.100 -1.527 0.000 0.777 294 P CB 0.275 30.744 31.700 -2.051 0.000 0.794 295 F N -0.992 118.410 119.950 -0.914 0.000 2.692 295 F HA 0.360 4.886 4.527 -0.002 0.000 0.320 295 F C 0.406 176.098 175.800 -0.179 0.000 1.123 295 F CA -1.561 56.051 58.000 -0.646 0.000 0.961 295 F CB -0.244 38.351 39.000 -0.674 0.000 1.383 295 F HN -0.359 7.941 8.300 -0.000 0.000 0.483 296 D N 0.671 121.186 120.400 0.192 0.000 2.419 296 D HA 0.043 4.682 4.640 -0.002 0.000 0.236 296 D C 1.175 177.488 176.300 0.021 0.000 1.165 296 D CA 0.202 54.151 54.000 -0.086 0.000 0.882 296 D CB 0.840 41.132 40.800 -0.847 0.000 1.201 296 D HN 0.612 8.982 8.370 -0.000 0.000 0.443 297 Q N 1.486 121.229 119.800 -0.096 0.000 2.308 297 Q HA -0.202 4.137 4.340 -0.002 0.000 0.209 297 Q C -0.100 175.673 176.000 -0.380 0.000 0.985 297 Q CA 1.321 57.019 55.803 -0.175 0.000 0.881 297 Q CB 0.121 28.850 28.738 -0.016 0.000 0.917 297 Q HN 0.523 8.793 8.270 -0.000 0.000 0.443 298 D N 0.369 120.606 120.400 -0.272 0.000 2.563 298 D HA 0.037 4.676 4.640 -0.002 0.000 0.237 298 D C -0.550 175.706 176.300 -0.073 0.000 1.282 298 D CA -0.036 53.841 54.000 -0.205 0.000 0.816 298 D CB 0.358 41.224 40.800 0.110 0.000 1.066 298 D HN 0.148 8.518 8.370 -0.000 0.000 0.501 299 D N -0.076 120.256 120.400 -0.114 0.000 3.085 299 D HA -0.001 4.638 4.640 -0.002 0.000 0.243 299 D C 1.037 177.469 176.300 0.220 0.000 1.232 299 D CA -0.514 53.526 54.000 0.066 0.000 0.913 299 D CB -0.395 40.447 40.800 0.070 0.000 1.108 299 D HN 0.100 8.470 8.370 -0.000 0.000 0.468 300 W N 0.960 122.325 121.300 0.108 0.000 2.313 300 W HA -0.144 4.515 4.660 -0.002 0.000 0.293 300 W C 2.435 179.035 176.519 0.134 0.000 1.216 300 W CA 1.265 58.662 57.345 0.087 0.000 1.223 300 W CB -0.437 29.015 29.460 -0.014 0.000 1.138 300 W HN 0.323 8.503 8.180 -0.000 0.000 0.535 301 G N -0.067 108.910 108.800 0.296 0.000 2.433 301 G HA2 -0.197 3.761 3.960 -0.002 0.000 0.216 301 G HA3 -0.197 3.761 3.960 -0.002 0.000 0.216 301 G C 1.682 176.632 174.900 0.083 0.000 1.186 301 G CA 1.595 46.796 45.100 0.169 0.000 0.779 301 G HN 0.328 8.618 8.290 -0.000 0.000 0.543 302 A N 0.009 122.787 122.820 -0.070 0.000 1.940 302 A HA -0.050 4.269 4.320 -0.002 0.000 0.219 302 A C 2.164 179.572 177.584 -0.293 0.000 1.176 302 A CA 1.561 53.315 52.037 -0.472 0.000 0.631 302 A CB -0.657 17.636 19.000 -1.178 0.000 0.814 302 A HN 0.507 8.657 8.150 -0.000 0.000 0.446 303 W N -0.327 120.927 121.300 -0.076 0.000 2.353 303 W HA -0.188 4.471 4.660 -0.002 0.000 0.319 303 W C 2.682 179.311 176.519 0.183 0.000 1.207 303 W CA 1.773 59.228 57.345 0.183 0.000 1.291 303 W CB -0.691 28.817 29.460 0.079 0.000 1.159 303 W HN 0.485 8.665 8.180 -0.000 0.000 0.478 304 Q N 0.915 120.954 119.800 0.398 0.000 2.077 304 Q HA -0.326 4.013 4.340 -0.002 0.000 0.206 304 Q C 2.270 178.387 176.000 0.196 0.000 0.989 304 Q CA 2.394 58.359 55.803 0.269 0.000 0.853 304 Q CB -0.374 28.497 28.738 0.223 0.000 0.907 304 Q HN 0.287 8.557 8.270 -0.000 0.000 0.418 305 K N -0.704 119.795 120.400 0.166 0.000 2.025 305 K HA -0.170 4.148 4.320 -0.002 0.000 0.207 305 K C 1.947 178.654 176.600 0.178 0.000 1.049 305 K CA 1.317 57.681 56.287 0.128 0.000 0.933 305 K CB -0.312 32.235 32.500 0.079 0.000 0.714 305 K HN 0.215 8.465 8.250 -0.000 0.000 0.438 306 F N 1.704 121.708 119.950 0.090 0.000 2.146 306 F HA -0.152 4.374 4.527 -0.002 0.000 0.298 306 F C 2.064 177.919 175.800 0.092 0.000 1.096 306 F CA 1.748 59.833 58.000 0.141 0.000 1.275 306 F CB -0.578 38.623 39.000 0.335 0.000 1.008 306 F HN -0.009 8.291 8.300 -0.000 0.000 0.480 307 T N 0.303 114.944 114.554 0.145 0.000 2.788 307 T HA -0.147 4.202 4.350 -0.002 0.000 0.268 307 T C 2.060 176.719 174.700 -0.068 0.000 1.044 307 T CA 1.344 63.444 62.100 0.001 0.000 1.139 307 T CB -0.671 68.268 68.868 0.118 0.000 0.867 307 T HN 0.337 8.577 8.240 -0.000 0.000 0.454 308 A N 1.046 123.861 122.820 -0.008 0.000 2.167 308 A HA 0.102 4.420 4.320 -0.002 0.000 0.214 308 A C 2.285 179.836 177.584 -0.055 0.000 1.151 308 A CA 1.382 53.409 52.037 -0.016 0.000 0.735 308 A CB -0.256 18.760 19.000 0.026 0.000 0.802 308 A HN 0.557 8.707 8.150 -0.000 0.000 0.467 309 S N -2.451 113.185 115.700 -0.107 0.000 2.604 309 S HA 0.465 4.934 4.470 -0.002 0.000 0.235 309 S C 1.707 176.176 174.600 -0.219 0.000 1.043 309 S CA 0.700 58.830 58.200 -0.117 0.000 0.997 309 S CB -0.020 63.149 63.200 -0.051 0.000 0.956 309 S HN 0.613 8.923 8.310 -0.000 0.000 0.535 310 A N 1.879 124.436 122.820 -0.437 0.000 1.968 310 A HA 0.510 4.828 4.320 -0.002 0.000 0.217 310 A C 1.982 179.396 177.584 -0.283 0.000 1.169 310 A CA 1.003 52.698 52.037 -0.570 0.000 0.638 310 A CB -1.368 16.880 19.000 -1.253 0.000 0.812 310 A HN 1.632 9.782 8.150 -0.000 0.000 0.446 311 G N -0.868 107.804 108.800 -0.213 0.000 2.147 311 G HA2 -0.228 3.731 3.960 -0.002 0.000 0.244 311 G HA3 -0.228 3.731 3.960 -0.002 0.000 0.244 311 G C 0.209 175.049 174.900 -0.100 0.000 1.005 311 G CA 0.778 45.806 45.100 -0.121 0.000 0.713 311 G HN 1.557 9.847 8.290 -0.000 0.000 0.515 312 I N -4.685 115.808 120.570 -0.130 0.000 3.466 312 I HA 0.771 4.940 4.170 -0.002 0.000 0.311 312 I C -0.107 175.959 176.117 -0.084 0.000 1.155 312 I CA -1.597 59.656 61.300 -0.077 0.000 0.959 312 I CB 1.495 39.467 38.000 -0.046 0.000 1.332 312 I HN 0.057 8.267 8.210 -0.000 0.000 0.483 313 Q N 1.570 121.341 119.800 -0.049 0.000 2.288 313 Q HA 0.504 4.842 4.340 -0.002 0.000 0.258 313 Q C -1.671 174.293 176.000 -0.059 0.000 0.957 313 Q CA -0.493 55.272 55.803 -0.063 0.000 0.919 313 Q CB 1.369 30.092 28.738 -0.024 0.000 1.185 313 Q HN 0.584 8.854 8.270 -0.000 0.000 0.408 314 V N 5.301 125.167 119.914 -0.079 0.000 2.378 314 V HA 0.313 4.432 4.120 -0.002 0.000 0.288 314 V C -0.500 175.573 176.094 -0.035 0.000 1.016 314 V CA -0.800 61.480 62.300 -0.034 0.000 0.840 314 V CB 1.645 33.492 31.823 0.039 0.000 0.994 314 V HN 0.629 8.819 8.190 -0.000 0.000 0.431 315 V N 3.827 123.739 119.914 -0.004 0.000 2.407 315 V HA 0.633 4.751 4.120 -0.002 0.000 0.278 315 V C 0.924 177.113 176.094 0.158 0.000 1.037 315 V CA -0.354 61.958 62.300 0.019 0.000 0.900 315 V CB 1.519 33.344 31.823 0.004 0.000 0.983 315 V HN 0.917 9.107 8.190 -0.000 0.000 0.459 316 G N 2.066 110.896 108.800 0.050 0.000 2.353 316 G HA2 0.451 4.409 3.960 -0.002 0.000 0.284 316 G HA3 0.451 4.409 3.960 -0.002 0.000 0.284 316 G C -0.128 174.776 174.900 0.008 0.000 1.172 316 G CA -0.009 45.068 45.100 -0.037 0.000 0.854 316 G HN 0.776 9.066 8.290 -0.000 0.000 0.485 317 D N 0.370 120.780 120.400 0.017 0.000 3.045 317 D HA -0.012 4.626 4.640 -0.002 0.000 0.196 317 D C 1.316 177.612 176.300 -0.006 0.000 1.520 317 D CA 0.049 54.063 54.000 0.025 0.000 1.466 317 D CB 0.097 40.925 40.800 0.047 0.000 1.152 317 D HN 0.173 8.543 8.370 -0.000 0.000 0.254 318 D N 0.346 120.747 120.400 0.001 0.000 2.310 318 D HA -0.053 4.585 4.640 -0.002 0.000 0.212 318 D C 2.014 178.264 176.300 -0.082 0.000 0.965 318 D CA 0.230 54.227 54.000 -0.003 0.000 0.879 318 D CB 0.115 40.920 40.800 0.008 0.000 0.921 318 D HN 0.191 8.561 8.370 -0.000 0.000 0.510 319 L N 0.724 121.807 121.223 -0.233 0.000 2.027 319 L HA -0.118 4.220 4.340 -0.002 0.000 0.206 319 L C 2.116 178.728 176.870 -0.430 0.000 1.074 319 L CA 1.960 56.445 54.840 -0.592 0.000 0.745 319 L CB -0.661 40.648 42.059 -1.250 0.000 0.898 319 L HN 0.061 8.291 8.230 -0.000 0.000 0.433 320 T N -3.955 110.460 114.554 -0.232 0.000 2.990 320 T HA 0.119 4.468 4.350 -0.002 0.000 0.249 320 T C 1.013 175.706 174.700 -0.013 0.000 1.039 320 T CA 0.426 62.478 62.100 -0.080 0.000 1.036 320 T CB -0.580 68.305 68.868 0.028 0.000 0.994 320 T HN 0.672 8.912 8.240 -0.000 0.000 0.489 321 V N 0.500 120.415 119.914 0.001 0.000 5.043 321 V HA -0.285 3.833 4.120 -0.002 0.000 0.267 321 V C 0.482 176.599 176.094 0.039 0.000 0.597 321 V CA 0.920 63.243 62.300 0.038 0.000 0.703 321 V CB -3.545 28.326 31.823 0.079 0.000 0.558 321 V HN 0.741 8.931 8.190 -0.000 0.000 1.038 322 T N -1.392 113.186 114.554 0.039 0.000 3.978 322 T HA -0.280 4.069 4.350 -0.002 0.000 0.339 322 T C 0.285 174.999 174.700 0.023 0.000 0.764 322 T CA 1.600 63.723 62.100 0.039 0.000 1.874 322 T CB -1.581 67.311 68.868 0.040 0.000 1.901 322 T HN 1.313 9.553 8.240 -0.000 0.000 0.814 323 N N 0.918 119.629 118.700 0.018 0.000 2.469 323 N HA 0.290 5.029 4.740 -0.002 0.000 0.253 323 N C -1.874 173.627 175.510 -0.014 0.000 0.970 323 N CA -2.326 50.728 53.050 0.007 0.000 0.940 323 N CB 1.997 40.496 38.487 0.019 0.000 1.128 323 N HN -0.059 8.321 8.380 -0.000 0.000 0.503 324 P HA -0.127 4.293 4.420 -0.000 0.000 0.220 324 P C 0.599 177.862 177.300 -0.063 0.000 1.144 324 P CA 1.418 64.482 63.100 -0.059 0.000 0.800 324 P CB 0.465 32.132 31.700 -0.056 0.000 0.772 325 K N -0.964 119.410 120.400 -0.043 0.000 2.098 325 K HA 0.032 4.350 4.320 -0.002 0.000 0.203 325 K C 2.171 178.745 176.600 -0.043 0.000 1.051 325 K CA 0.760 57.019 56.287 -0.048 0.000 0.957 325 K CB -0.087 32.391 32.500 -0.037 0.000 0.738 325 K HN 0.031 8.281 8.250 -0.000 0.000 0.447 326 R N 0.906 121.397 120.500 -0.016 0.000 2.090 326 R HA 0.017 4.355 4.340 -0.002 0.000 0.228 326 R C 2.297 178.649 176.300 0.087 0.000 1.110 326 R CA 0.961 57.085 56.100 0.039 0.000 0.973 326 R CB -0.520 29.789 30.300 0.014 0.000 0.869 326 R HN 0.233 8.503 8.270 -0.000 0.000 0.440 327 I N 1.118 121.696 120.570 0.015 0.000 2.127 327 I HA -0.277 3.891 4.170 -0.002 0.000 0.241 327 I C 2.661 178.710 176.117 -0.114 0.000 1.075 327 I CA 1.457 62.732 61.300 -0.042 0.000 1.334 327 I CB -0.612 37.294 38.000 -0.157 0.000 1.040 327 I HN 0.093 8.303 8.210 -0.000 0.000 0.405 328 A N 0.816 123.561 122.820 -0.126 0.000 1.927 328 A HA -0.318 4.001 4.320 -0.002 0.000 0.220 328 A C 2.407 179.939 177.584 -0.086 0.000 1.185 328 A CA 2.353 54.310 52.037 -0.133 0.000 0.639 328 A CB -0.668 18.264 19.000 -0.113 0.000 0.820 328 A HN 0.433 8.583 8.150 -0.000 0.000 0.451 329 K N -0.521 119.838 120.400 -0.068 0.000 2.097 329 K HA -0.019 4.300 4.320 -0.002 0.000 0.205 329 K C 2.097 178.709 176.600 0.019 0.000 1.050 329 K CA 1.129 57.338 56.287 -0.130 0.000 0.938 329 K CB -0.315 31.986 32.500 -0.332 0.000 0.718 329 K HN 0.369 8.619 8.250 -0.000 0.000 0.442 330 A N 1.009 123.984 122.820 0.257 0.000 1.969 330 A HA -0.096 4.223 4.320 -0.002 0.000 0.218 330 A C 2.200 180.079 177.584 0.492 0.000 1.169 330 A CA 1.597 53.936 52.037 0.504 0.000 0.635 330 A CB -0.684 18.680 19.000 0.607 0.000 0.810 330 A HN 0.303 8.453 8.150 -0.000 0.000 0.445 331 V N -1.455 118.619 119.914 0.268 0.000 2.379 331 V HA -0.188 3.931 4.120 -0.002 0.000 0.245 331 V C 1.830 178.017 176.094 0.155 0.000 1.044 331 V CA 2.127 64.552 62.300 0.208 0.000 1.036 331 V CB -1.082 30.616 31.823 -0.208 0.000 0.664 331 V HN 0.457 8.647 8.190 -0.000 0.000 0.453 332 N N 1.181 119.920 118.700 0.065 0.000 2.120 332 N HA -0.134 4.605 4.740 -0.002 0.000 0.188 332 N C 1.775 177.323 175.510 0.063 0.000 1.024 332 N CA 2.010 55.079 53.050 0.032 0.000 0.852 332 N CB -0.324 38.146 38.487 -0.028 0.000 1.003 332 N HN 0.702 9.082 8.380 -0.000 0.000 0.424 333 E N 0.789 121.046 120.200 0.094 0.000 2.479 333 E HA 0.076 4.425 4.350 -0.002 0.000 0.193 333 E C -0.339 176.368 176.600 0.179 0.000 1.049 333 E CA -0.101 56.368 56.400 0.115 0.000 0.870 333 E CB 0.127 29.896 29.700 0.115 0.000 0.944 333 E HN 0.243 8.603 8.360 -0.000 0.000 0.492 334 K N 0.258 120.789 120.400 0.218 0.000 3.071 334 K HA -0.209 4.110 4.320 -0.002 0.000 0.262 334 K C 0.805 177.535 176.600 0.217 0.000 0.977 334 K CA 0.316 56.738 56.287 0.225 0.000 0.721 334 K CB -1.647 30.945 32.500 0.153 0.000 1.293 334 K HN 0.057 8.307 8.250 -0.000 0.000 0.475 335 S N -0.825 115.043 115.700 0.280 0.000 2.382 335 S HA -0.120 4.349 4.470 -0.002 0.000 0.228 335 S C 1.271 176.036 174.600 0.276 0.000 1.027 335 S CA 1.040 59.421 58.200 0.302 0.000 0.991 335 S CB -0.460 62.900 63.200 0.266 0.000 0.823 335 S HN 0.716 9.026 8.310 -0.000 0.000 0.469 336 C N 0.713 120.030 119.300 0.028 0.000 3.332 336 C HA 0.646 5.104 4.460 -0.002 0.000 0.329 336 C C -0.033 174.543 174.990 -0.691 0.000 1.434 336 C CA -0.868 58.051 59.018 -0.165 0.000 1.314 336 C CB 1.054 28.690 27.740 -0.174 0.000 1.664 336 C HN 0.536 8.766 8.230 -0.000 0.000 0.457 337 N N -1.150 117.114 118.700 -0.726 0.000 2.194 337 N HA 0.342 5.081 4.740 -0.002 0.000 0.231 337 N C -0.505 174.540 175.510 -0.775 0.000 1.247 337 N CA -0.093 52.407 53.050 -0.916 0.000 0.884 337 N CB 1.045 39.314 38.487 -0.364 0.000 1.146 337 N HN 0.848 9.228 8.380 -0.000 0.000 0.516 338 C N 1.150 120.017 119.300 -0.722 0.000 2.891 338 C HA 0.570 5.029 4.460 -0.002 0.000 0.342 338 C C -1.415 173.513 174.990 -0.104 0.000 1.126 338 C CA -0.910 57.967 59.018 -0.235 0.000 1.322 338 C CB 1.102 28.775 27.740 -0.111 0.000 1.763 338 C HN 0.416 8.646 8.230 -0.000 0.000 0.491 339 L N 5.381 126.720 121.223 0.194 0.000 2.295 339 L HA 0.752 5.091 4.340 -0.002 0.000 0.285 339 L C -0.721 176.228 176.870 0.131 0.000 1.035 339 L CA -0.190 54.797 54.840 0.245 0.000 0.806 339 L CB 1.350 43.633 42.059 0.374 0.000 1.214 339 L HN 0.726 8.956 8.230 -0.000 0.000 0.426 340 L N 5.370 126.651 121.223 0.098 0.000 2.265 340 L HA 0.422 4.761 4.340 -0.002 0.000 0.288 340 L C -0.839 176.080 176.870 0.082 0.000 1.058 340 L CA -0.047 54.841 54.840 0.079 0.000 0.809 340 L CB 1.075 43.175 42.059 0.068 0.000 1.179 340 L HN 0.684 8.914 8.230 -0.000 0.000 0.429 341 L N 6.180 127.450 121.223 0.078 0.000 2.259 341 L HA 0.387 4.725 4.340 -0.002 0.000 0.288 341 L C -0.523 176.392 176.870 0.074 0.000 1.051 341 L CA 0.220 55.104 54.840 0.073 0.000 0.824 341 L CB 0.100 42.200 42.059 0.069 0.000 1.206 341 L HN 0.528 8.758 8.230 -0.000 0.000 0.429 342 K N 3.967 124.408 120.400 0.067 0.000 2.464 342 K HA 0.218 4.536 4.320 -0.002 0.000 0.252 342 K C 1.074 177.704 176.600 0.050 0.000 1.000 342 K CA -0.339 55.986 56.287 0.065 0.000 0.951 342 K CB 1.626 34.161 32.500 0.059 0.000 1.183 342 K HN 0.552 8.802 8.250 -0.000 0.000 0.445 343 V N 0.227 120.172 119.914 0.052 0.000 2.546 343 V HA -0.285 3.834 4.120 -0.002 0.000 0.254 343 V C 1.483 177.579 176.094 0.002 0.000 1.076 343 V CA 1.988 64.305 62.300 0.027 0.000 1.087 343 V CB -0.576 31.256 31.823 0.015 0.000 0.674 343 V HN 0.839 9.029 8.190 -0.000 0.000 0.470 344 N N 0.026 118.728 118.700 0.004 0.000 2.336 344 N HA -0.037 4.701 4.740 -0.002 0.000 0.189 344 N C 1.568 177.081 175.510 0.006 0.000 1.113 344 N CA 0.660 53.707 53.050 -0.006 0.000 0.858 344 N CB -0.002 38.477 38.487 -0.014 0.000 0.970 344 N HN 0.699 9.079 8.380 -0.000 0.000 0.471 345 Q N -0.371 119.439 119.800 0.018 0.000 2.389 345 Q HA 0.124 4.462 4.340 -0.002 0.000 0.204 345 Q C 1.009 177.024 176.000 0.024 0.000 0.944 345 Q CA 0.547 56.366 55.803 0.025 0.000 0.908 345 Q CB 0.354 29.113 28.738 0.036 0.000 1.002 345 Q HN 0.295 8.565 8.270 -0.000 0.000 0.493 346 I N -1.880 118.700 120.570 0.017 0.000 3.883 346 I HA 0.227 4.396 4.170 -0.002 0.000 0.305 346 I C 1.075 177.194 176.117 0.004 0.000 1.247 346 I CA 1.177 62.485 61.300 0.013 0.000 1.350 346 I CB 0.977 38.984 38.000 0.012 0.000 1.194 346 I HN 0.176 8.386 8.210 -0.000 0.000 0.441 347 G N 0.545 109.343 108.800 -0.003 0.000 2.179 347 G HA2 -0.168 3.791 3.960 -0.002 0.000 0.220 347 G HA3 -0.168 3.791 3.960 -0.002 0.000 0.220 347 G C 0.340 175.227 174.900 -0.021 0.000 0.990 347 G CA 0.335 45.428 45.100 -0.011 0.000 0.646 347 G HN 0.955 9.245 8.290 -0.000 0.000 0.517 348 S N -1.738 113.948 115.700 -0.022 0.000 2.570 348 S HA 0.685 5.154 4.470 -0.002 0.000 0.270 348 S C 0.786 175.368 174.600 -0.029 0.000 1.149 348 S CA 0.134 58.315 58.200 -0.032 0.000 0.837 348 S CB 1.864 65.055 63.200 -0.016 0.000 1.124 348 S HN 0.822 9.132 8.310 -0.000 0.000 0.465 349 V N 1.643 121.534 119.914 -0.038 0.000 2.307 349 V HA -0.133 3.985 4.120 -0.002 0.000 0.245 349 V C 2.727 178.830 176.094 0.015 0.000 1.045 349 V CA 2.634 64.934 62.300 -0.001 0.000 1.024 349 V CB -1.380 30.453 31.823 0.015 0.000 0.651 349 V HN 1.033 9.223 8.190 -0.000 0.000 0.449 350 T N -0.182 114.372 114.554 0.000 0.000 2.720 350 T HA -0.233 4.116 4.350 -0.002 0.000 0.268 350 T C 1.783 176.479 174.700 -0.006 0.000 1.037 350 T CA 1.866 63.963 62.100 -0.005 0.000 1.144 350 T CB -0.264 68.598 68.868 -0.009 0.000 0.864 350 T HN 0.602 8.842 8.240 -0.000 0.000 0.444 351 E N 0.641 120.838 120.200 -0.006 0.000 2.208 351 E HA -0.017 4.332 4.350 -0.002 0.000 0.193 351 E C 2.487 179.086 176.600 -0.002 0.000 0.988 351 E CA 0.717 57.113 56.400 -0.007 0.000 0.828 351 E CB -0.017 29.679 29.700 -0.007 0.000 0.763 351 E HN 0.300 8.660 8.360 -0.000 0.000 0.478 352 S N 0.795 116.501 115.700 0.010 0.000 2.387 352 S HA -0.042 4.427 4.470 -0.002 0.000 0.226 352 S C 1.917 176.529 174.600 0.020 0.000 1.026 352 S CA 0.601 58.815 58.200 0.024 0.000 0.972 352 S CB -0.020 63.208 63.200 0.046 0.000 0.814 352 S HN 0.213 8.523 8.310 -0.000 0.000 0.477 353 L N 1.303 122.535 121.223 0.014 0.000 2.056 353 L HA -0.136 4.203 4.340 -0.002 0.000 0.207 353 L C 2.652 179.513 176.870 -0.014 0.000 1.078 353 L CA 1.267 56.108 54.840 0.002 0.000 0.749 353 L CB -0.771 41.284 42.059 -0.007 0.000 0.901 353 L HN 0.399 8.629 8.230 -0.000 0.000 0.433 354 Q N -0.063 119.725 119.800 -0.020 0.000 2.084 354 Q HA -0.190 4.149 4.340 -0.002 0.000 0.202 354 Q C 2.437 178.410 176.000 -0.044 0.000 0.978 354 Q CA 1.670 57.453 55.803 -0.034 0.000 0.844 354 Q CB -0.254 28.464 28.738 -0.034 0.000 0.898 354 Q HN 0.538 8.808 8.270 -0.000 0.000 0.426 355 A N 0.503 123.304 122.820 -0.032 0.000 1.877 355 A HA -0.241 4.078 4.320 -0.002 0.000 0.216 355 A C 2.339 179.900 177.584 -0.039 0.000 1.186 355 A CA 1.505 53.519 52.037 -0.038 0.000 0.620 355 A CB -1.284 17.711 19.000 -0.009 0.000 0.822 355 A HN 0.588 8.738 8.150 -0.000 0.000 0.443 356 C N -0.381 118.911 119.300 -0.012 0.000 2.436 356 C HA -0.088 4.371 4.460 -0.002 0.000 0.277 356 C C 2.713 177.686 174.990 -0.028 0.000 1.241 356 C CA 1.626 60.644 59.018 -0.001 0.000 1.721 356 C CB -0.953 26.794 27.740 0.011 0.000 2.043 356 C HN 0.528 8.758 8.230 -0.000 0.000 0.472 357 K N 0.657 121.034 120.400 -0.039 0.000 2.074 357 K HA -0.147 4.172 4.320 -0.002 0.000 0.209 357 K C 1.798 178.347 176.600 -0.085 0.000 1.048 357 K CA 1.192 57.448 56.287 -0.051 0.000 0.926 357 K CB -1.243 31.229 32.500 -0.048 0.000 0.713 357 K HN 0.532 8.782 8.250 -0.000 0.000 0.444 358 L N 1.085 122.240 121.223 -0.114 0.000 2.012 358 L HA -0.126 4.213 4.340 -0.002 0.000 0.210 358 L C 2.214 178.919 176.870 -0.276 0.000 1.073 358 L CA 2.106 56.837 54.840 -0.180 0.000 0.748 358 L CB -1.025 40.919 42.059 -0.192 0.000 0.891 358 L HN 0.179 8.409 8.230 -0.000 0.000 0.431 359 A N -1.124 121.532 122.820 -0.273 0.000 1.851 359 A HA -0.291 4.028 4.320 -0.002 0.000 0.216 359 A C 2.202 179.699 177.584 -0.145 0.000 1.195 359 A CA 1.983 53.814 52.037 -0.343 0.000 0.622 359 A CB -0.751 18.243 19.000 -0.009 0.000 0.831 359 A HN 0.639 8.789 8.150 -0.000 0.000 0.444 360 Q N -0.823 118.952 119.800 -0.042 0.000 2.096 360 Q HA -0.163 4.176 4.340 -0.002 0.000 0.204 360 Q C 2.337 178.317 176.000 -0.034 0.000 0.982 360 Q CA 1.517 57.317 55.803 -0.004 0.000 0.850 360 Q CB -0.430 28.304 28.738 -0.006 0.000 0.901 360 Q HN 0.698 8.968 8.270 -0.000 0.000 0.422 361 A N 1.065 123.840 122.820 -0.075 0.000 2.076 361 A HA -0.144 4.174 4.320 -0.002 0.000 0.220 361 A C 1.301 178.838 177.584 -0.078 0.000 1.160 361 A CA 1.144 53.137 52.037 -0.073 0.000 0.653 361 A CB -0.131 18.816 19.000 -0.088 0.000 0.801 361 A HN 0.304 8.454 8.150 -0.000 0.000 0.455 362 N N -0.994 117.634 118.700 -0.120 0.000 2.273 362 N HA 0.225 4.964 4.740 -0.002 0.000 0.231 362 N C 0.952 176.492 175.510 0.049 0.000 1.134 362 N CA 0.739 53.730 53.050 -0.099 0.000 0.856 362 N CB 0.681 39.005 38.487 -0.272 0.000 1.068 362 N HN 0.552 8.931 8.380 -0.000 0.000 0.510 363 G N 0.339 109.181 108.800 0.071 0.000 2.189 363 G HA2 -0.255 3.704 3.960 -0.002 0.000 0.267 363 G HA3 -0.255 3.704 3.960 -0.002 0.000 0.267 363 G C -0.144 174.905 174.900 0.248 0.000 0.975 363 G CA -0.025 45.152 45.100 0.130 0.000 0.644 363 G HN 0.261 8.551 8.290 -0.000 0.000 0.537 364 W N 0.677 121.963 121.300 -0.023 0.000 2.161 364 W HA 0.606 5.265 4.660 -0.002 0.000 0.344 364 W C 1.062 177.561 176.519 -0.033 0.000 1.262 364 W CA 0.147 57.480 57.345 -0.020 0.000 1.270 364 W CB 0.353 29.808 29.460 -0.009 0.000 1.126 364 W HN 0.416 8.596 8.180 -0.000 0.000 0.598 365 G N -0.024 108.874 108.800 0.164 0.000 2.522 365 G HA2 0.603 4.562 3.960 -0.002 0.000 0.304 365 G HA3 0.603 4.562 3.960 -0.002 0.000 0.304 365 G C -1.661 173.312 174.900 0.122 0.000 1.210 365 G CA -0.659 44.481 45.100 0.068 0.000 0.960 365 G HN 0.280 8.570 8.290 -0.000 0.000 0.497 366 V N 0.672 120.634 119.914 0.081 0.000 2.733 366 V HA 0.469 4.588 4.120 -0.002 0.000 0.306 366 V C -0.407 175.726 176.094 0.066 0.000 1.084 366 V CA -0.524 61.831 62.300 0.093 0.000 0.905 366 V CB 1.856 33.730 31.823 0.084 0.000 1.010 366 V HN 0.822 9.012 8.190 -0.000 0.000 0.424 367 M N 5.498 125.139 119.600 0.068 0.000 2.043 367 M HA 0.559 5.038 4.480 -0.002 0.000 0.322 367 M C -1.042 175.287 176.300 0.049 0.000 0.962 367 M CA -0.453 54.880 55.300 0.055 0.000 0.927 367 M CB 1.308 33.941 32.600 0.055 0.000 1.466 367 M HN 0.487 8.777 8.290 -0.000 0.000 0.412 368 V N 3.408 123.343 119.914 0.036 0.000 2.763 368 V HA 0.249 4.368 4.120 -0.002 0.000 0.306 368 V C 0.259 176.371 176.094 0.030 0.000 1.059 368 V CA 0.197 62.518 62.300 0.035 0.000 1.138 368 V CB 1.241 33.073 31.823 0.016 0.000 0.940 368 V HN 0.909 9.099 8.190 -0.000 0.000 0.489 369 S N 2.122 117.859 115.700 0.061 0.000 2.564 369 S HA 0.556 5.025 4.470 -0.002 0.000 0.274 369 S C -0.556 174.149 174.600 0.175 0.000 1.124 369 S CA -0.812 57.450 58.200 0.103 0.000 0.869 369 S CB 1.262 64.549 63.200 0.146 0.000 1.105 369 S HN 0.985 9.295 8.310 -0.000 0.000 0.472 370 H N 1.499 120.572 119.070 0.005 0.000 2.417 370 H HA 0.758 5.313 4.556 -0.002 0.000 0.325 370 H C -0.162 175.173 175.328 0.011 0.000 1.549 370 H CA -1.182 54.864 56.048 -0.002 0.000 1.476 370 H CB 0.460 30.206 29.762 -0.028 0.000 1.732 370 H HN 0.288 8.568 8.280 -0.000 0.000 0.695 371 R N -0.339 120.079 120.500 -0.137 0.000 2.892 371 R HA 0.141 4.480 4.340 -0.002 0.000 0.265 371 R C 0.991 177.010 176.300 -0.468 0.000 1.025 371 R CA -0.369 55.594 56.100 -0.230 0.000 0.982 371 R CB 1.462 31.703 30.300 -0.097 0.000 1.185 371 R HN 0.910 9.180 8.270 -0.000 0.000 0.484 372 S N -1.033 114.429 115.700 -0.397 0.000 2.474 372 S HA -0.011 4.458 4.470 -0.002 0.000 0.235 372 S C 1.006 175.428 174.600 -0.298 0.000 0.997 372 S CA 0.562 58.464 58.200 -0.495 0.000 0.949 372 S CB 0.022 62.726 63.200 -0.827 0.000 0.766 372 S HN 0.662 8.972 8.310 -0.000 0.000 0.517 373 G N 1.400 110.084 108.800 -0.194 0.000 2.655 373 G HA2 0.540 4.499 3.960 -0.002 0.000 0.334 373 G HA3 0.540 4.499 3.960 -0.002 0.000 0.334 373 G C -0.487 174.364 174.900 -0.081 0.000 1.099 373 G CA -0.441 44.593 45.100 -0.109 0.000 1.075 373 G HN 0.096 8.386 8.290 -0.000 0.000 0.463 374 E N 0.490 120.654 120.200 -0.060 0.000 2.281 374 E HA 0.670 5.019 4.350 -0.002 0.000 0.257 374 E C 0.372 176.971 176.600 -0.002 0.000 0.971 374 E CA -0.403 55.984 56.400 -0.022 0.000 0.839 374 E CB 2.199 31.902 29.700 0.005 0.000 1.238 374 E HN 0.550 8.910 8.360 -0.000 0.000 0.412 375 T N -2.836 111.724 114.554 0.009 0.000 2.773 375 T HA 0.230 4.579 4.350 -0.002 0.000 0.278 375 T C 0.806 175.520 174.700 0.024 0.000 1.011 375 T CA -0.661 61.449 62.100 0.016 0.000 1.014 375 T CB 0.900 69.772 68.868 0.008 0.000 1.293 375 T HN 0.400 8.640 8.240 -0.000 0.000 0.554 376 E N 0.248 120.465 120.200 0.027 0.000 2.516 376 E HA -0.065 4.284 4.350 -0.002 0.000 0.199 376 E C 0.220 176.839 176.600 0.032 0.000 1.069 376 E CA 0.070 56.487 56.400 0.029 0.000 0.876 376 E CB -0.339 29.379 29.700 0.031 0.000 0.843 376 E HN 0.726 9.086 8.360 -0.000 0.000 0.530 377 D N 1.996 122.417 120.400 0.035 0.000 2.423 377 D HA -0.037 4.601 4.640 -0.002 0.000 0.238 377 D C 0.337 176.674 176.300 0.062 0.000 1.142 377 D CA 1.004 55.036 54.000 0.054 0.000 0.884 377 D CB 1.036 41.868 40.800 0.053 0.000 1.199 377 D HN 0.144 8.514 8.370 -0.000 0.000 0.438 378 T N 0.735 115.339 114.554 0.083 0.000 3.231 378 T HA 0.037 4.385 4.350 -0.002 0.000 0.292 378 T C 1.486 176.235 174.700 0.081 0.000 1.001 378 T CA -0.585 61.548 62.100 0.055 0.000 0.920 378 T CB -0.538 68.344 68.868 0.024 0.000 1.140 378 T HN 0.377 8.617 8.240 -0.000 0.000 0.525 379 F N 3.360 123.309 119.950 -0.002 0.000 2.115 379 F HA -0.101 4.425 4.527 -0.002 0.000 0.300 379 F C 1.844 177.643 175.800 -0.001 0.000 1.092 379 F CA 2.028 60.032 58.000 0.006 0.000 1.245 379 F CB -0.244 38.761 39.000 0.008 0.000 0.995 379 F HN 0.376 8.676 8.300 -0.000 0.000 0.481 380 I N -1.336 119.325 120.570 0.152 0.000 2.567 380 I HA -0.092 4.076 4.170 -0.002 0.000 0.257 380 I C 2.260 178.325 176.117 -0.087 0.000 1.184 380 I CA 1.217 62.543 61.300 0.044 0.000 1.451 380 I CB -1.233 36.814 38.000 0.079 0.000 1.089 380 I HN 0.131 8.341 8.210 -0.000 0.000 0.441 381 A N 1.953 124.708 122.820 -0.108 0.000 1.873 381 A HA -0.219 4.100 4.320 -0.002 0.000 0.215 381 A C 1.805 179.293 177.584 -0.160 0.000 1.186 381 A CA 2.291 54.243 52.037 -0.141 0.000 0.616 381 A CB -0.897 18.028 19.000 -0.125 0.000 0.823 381 A HN 0.499 8.649 8.150 -0.000 0.000 0.442 382 D N -0.812 119.480 120.400 -0.181 0.000 2.183 382 D HA -0.061 4.578 4.640 -0.002 0.000 0.203 382 D C 1.762 177.934 176.300 -0.213 0.000 0.969 382 D CA 0.837 54.747 54.000 -0.150 0.000 0.842 382 D CB -0.099 40.595 40.800 -0.177 0.000 0.957 382 D HN 0.334 8.704 8.370 -0.000 0.000 0.484 383 L N 0.357 121.375 121.223 -0.341 0.000 1.994 383 L HA -0.107 4.231 4.340 -0.002 0.000 0.208 383 L C 2.156 178.963 176.870 -0.106 0.000 1.071 383 L CA 1.399 56.091 54.840 -0.246 0.000 0.745 383 L CB -0.770 41.197 42.059 -0.153 0.000 0.892 383 L HN 0.021 8.251 8.230 -0.000 0.000 0.431 384 V N -1.097 118.764 119.914 -0.089 0.000 2.392 384 V HA -0.241 3.878 4.120 -0.002 0.000 0.249 384 V C 2.414 178.465 176.094 -0.071 0.000 1.059 384 V CA 1.949 64.212 62.300 -0.060 0.000 1.051 384 V CB -0.059 31.730 31.823 -0.056 0.000 0.658 384 V HN 0.362 8.552 8.190 -0.000 0.000 0.455 385 V N 0.643 120.493 119.914 -0.106 0.000 2.358 385 V HA -0.096 4.023 4.120 -0.002 0.000 0.246 385 V C 2.664 178.721 176.094 -0.061 0.000 1.047 385 V CA 2.065 64.288 62.300 -0.128 0.000 1.035 385 V CB -1.265 30.404 31.823 -0.257 0.000 0.658 385 V HN 0.634 8.824 8.190 -0.000 0.000 0.452 386 G N -0.768 108.024 108.800 -0.014 0.000 2.484 386 G HA2 -0.090 3.868 3.960 -0.002 0.000 0.218 386 G HA3 -0.090 3.868 3.960 -0.002 0.000 0.218 386 G C 1.392 176.286 174.900 -0.010 0.000 1.130 386 G CA 0.322 45.433 45.100 0.019 0.000 0.784 386 G HN 0.494 8.784 8.290 -0.000 0.000 0.543 387 L N -0.221 120.988 121.223 -0.022 0.000 2.592 387 L HA 0.171 4.510 4.340 -0.002 0.000 0.227 387 L C 0.994 177.856 176.870 -0.014 0.000 1.127 387 L CA -0.501 54.330 54.840 -0.016 0.000 0.884 387 L CB -0.005 42.049 42.059 -0.009 0.000 1.065 387 L HN 0.127 8.357 8.230 -0.000 0.000 0.457 388 C N 1.111 120.398 119.300 -0.021 0.000 4.114 388 C HA -0.187 4.272 4.460 -0.002 0.000 0.300 388 C C 2.241 177.221 174.990 -0.017 0.000 1.423 388 C CA 0.987 59.991 59.018 -0.022 0.000 2.034 388 C CB -2.843 24.886 27.740 -0.018 0.000 1.299 388 C HN 0.734 8.964 8.230 -0.000 0.000 0.727 389 T N -2.955 111.593 114.554 -0.010 0.000 3.067 389 T HA 0.321 4.669 4.350 -0.002 0.000 0.261 389 T C 1.805 176.506 174.700 0.003 0.000 1.110 389 T CA 1.687 63.788 62.100 0.002 0.000 1.113 389 T CB 0.040 68.919 68.868 0.018 0.000 0.917 389 T HN 2.217 10.457 8.240 -0.000 0.000 0.499 390 G N 1.452 110.249 108.800 -0.005 0.000 2.184 390 G HA2 -0.248 3.711 3.960 -0.002 0.000 0.264 390 G HA3 -0.248 3.711 3.960 -0.002 0.000 0.264 390 G C -0.128 174.801 174.900 0.047 0.000 0.975 390 G CA 0.435 45.534 45.100 -0.002 0.000 0.642 390 G HN 1.068 9.358 8.290 -0.000 0.000 0.536 391 Q N -1.127 118.706 119.800 0.054 0.000 2.320 391 Q HA 0.794 5.132 4.340 -0.002 0.000 0.272 391 Q C -1.135 174.885 176.000 0.034 0.000 1.023 391 Q CA -1.138 54.706 55.803 0.069 0.000 0.855 391 Q CB 2.493 31.318 28.738 0.146 0.000 1.367 391 Q HN 0.733 9.003 8.270 -0.000 0.000 0.406 392 I N 1.534 122.111 120.570 0.012 0.000 2.692 392 I HA 0.477 4.645 4.170 -0.002 0.000 0.293 392 I C -1.918 174.156 176.117 -0.072 0.000 1.200 392 I CA -0.756 60.531 61.300 -0.022 0.000 1.036 392 I CB 2.347 40.331 38.000 -0.026 0.000 1.258 392 I HN 0.811 9.021 8.210 -0.000 0.000 0.421 393 K N 4.155 124.488 120.400 -0.111 0.000 2.358 393 K HA 0.515 4.834 4.320 -0.002 0.000 0.260 393 K C -0.795 175.514 176.600 -0.484 0.000 0.956 393 K CA -0.545 55.631 56.287 -0.184 0.000 0.834 393 K CB 1.946 34.401 32.500 -0.075 0.000 1.102 393 K HN 0.489 8.739 8.250 -0.000 0.000 0.431 394 T N 1.917 116.122 114.554 -0.582 0.000 3.714 394 T HA 0.375 4.724 4.350 -0.002 0.000 0.309 394 T C -0.107 174.267 174.700 -0.543 0.000 0.958 394 T CA 0.370 61.855 62.100 -1.025 0.000 1.010 394 T CB -0.392 68.082 68.868 -0.656 0.000 1.202 394 T HN 1.185 9.425 8.240 -0.000 0.000 0.476 395 G N 1.066 109.751 108.800 -0.190 0.000 2.612 395 G HA2 0.379 4.337 3.960 -0.002 0.000 0.686 395 G HA3 0.379 4.337 3.960 -0.002 0.000 0.686 395 G C -0.080 175.034 174.900 0.357 0.000 1.274 395 G CA -0.405 44.837 45.100 0.238 0.000 0.849 395 G HN 0.885 9.175 8.290 -0.000 0.000 0.595 396 A N 0.682 123.620 122.820 0.197 0.000 2.366 396 A HA 0.730 5.049 4.320 -0.002 0.000 0.250 396 A C -1.083 176.463 177.584 -0.064 0.000 1.099 396 A CA -0.228 51.817 52.037 0.013 0.000 0.794 396 A CB 0.214 19.080 19.000 -0.223 0.000 1.056 396 A HN 0.890 9.040 8.150 -0.000 0.000 0.499 397 P HA 0.232 4.652 4.420 -0.000 0.000 0.218 397 P C -0.717 176.302 177.300 -0.469 0.000 1.793 397 P CA 0.182 63.030 63.100 -0.419 0.000 0.941 397 P CB -0.547 30.703 31.700 -0.750 0.000 1.919 398 C N 2.139 121.249 119.300 -0.317 0.000 2.985 398 C HA 0.590 5.049 4.460 -0.002 0.000 0.332 398 C C -0.895 174.053 174.990 -0.071 0.000 1.164 398 C CA -0.238 58.638 59.018 -0.236 0.000 1.347 398 C CB 0.620 28.132 27.740 -0.381 0.000 1.764 398 C HN 0.578 8.808 8.230 -0.000 0.000 0.489 399 R N 3.908 124.397 120.500 -0.017 0.000 1.124 399 R HA -0.097 4.242 4.340 -0.002 0.000 0.425 399 R C 0.712 177.029 176.300 0.030 0.000 1.336 399 R CA 0.600 56.708 56.100 0.013 0.000 0.984 399 R CB -1.347 28.960 30.300 0.011 0.000 3.079 399 R HN 0.914 9.184 8.270 -0.000 0.000 0.509 400 S N 1.696 117.416 115.700 0.034 0.000 2.469 400 S HA -0.161 4.308 4.470 -0.002 0.000 0.238 400 S C 1.639 176.261 174.600 0.036 0.000 0.998 400 S CA 1.379 59.603 58.200 0.041 0.000 0.957 400 S CB -0.081 63.142 63.200 0.039 0.000 0.764 400 S HN 0.725 9.035 8.310 -0.000 0.000 0.514 401 E N 1.303 121.522 120.200 0.031 0.000 2.472 401 E HA -0.120 4.229 4.350 -0.002 0.000 0.200 401 E C 1.344 177.957 176.600 0.022 0.000 1.046 401 E CA 0.584 57.000 56.400 0.027 0.000 0.871 401 E CB -0.028 29.688 29.700 0.026 0.000 0.806 401 E HN 0.355 8.715 8.360 -0.000 0.000 0.533 402 R N 0.374 120.892 120.500 0.030 0.000 2.102 402 R HA 0.253 4.592 4.340 -0.002 0.000 0.208 402 R C 2.660 178.941 176.300 -0.033 0.000 1.131 402 R CA 0.319 56.417 56.100 -0.002 0.000 1.054 402 R CB -0.854 29.510 30.300 0.107 0.000 0.954 402 R HN 0.183 8.453 8.270 -0.000 0.000 0.465 403 L N 1.357 122.647 121.223 0.111 0.000 2.265 403 L HA -0.031 4.308 4.340 -0.002 0.000 0.215 403 L C 2.518 179.451 176.870 0.104 0.000 1.117 403 L CA 1.195 56.151 54.840 0.194 0.000 0.782 403 L CB -0.622 41.526 42.059 0.149 0.000 0.914 403 L HN 0.132 8.362 8.230 -0.000 0.000 0.441 404 A N 0.116 122.959 122.820 0.037 0.000 1.908 404 A HA -0.234 4.085 4.320 -0.002 0.000 0.218 404 A C 2.309 179.891 177.584 -0.005 0.000 1.181 404 A CA 1.811 53.862 52.037 0.025 0.000 0.627 404 A CB -0.284 18.726 19.000 0.016 0.000 0.818 404 A HN 0.227 8.377 8.150 -0.000 0.000 0.445 405 K N -1.082 119.264 120.400 -0.090 0.000 2.031 405 K HA -0.029 4.289 4.320 -0.002 0.000 0.205 405 K C 1.715 178.252 176.600 -0.106 0.000 1.049 405 K CA 1.451 57.641 56.287 -0.161 0.000 0.939 405 K CB -0.594 31.715 32.500 -0.318 0.000 0.717 405 K HN 0.553 8.803 8.250 -0.000 0.000 0.438 406 Y N 1.560 121.923 120.300 0.104 0.000 2.181 406 Y HA -0.163 4.386 4.550 -0.002 0.000 0.288 406 Y C 1.885 177.898 175.900 0.188 0.000 1.146 406 Y CA 0.993 59.226 58.100 0.222 0.000 1.164 406 Y CB -0.648 37.978 38.460 0.276 0.000 0.982 406 Y HN 0.130 8.410 8.280 -0.000 0.000 0.515 407 N N -0.006 118.847 118.700 0.256 0.000 2.120 407 N HA -0.189 4.550 4.740 -0.002 0.000 0.188 407 N C 1.891 177.457 175.510 0.094 0.000 1.024 407 N CA 1.373 54.522 53.050 0.165 0.000 0.852 407 N CB -0.487 38.068 38.487 0.114 0.000 1.003 407 N HN 0.359 8.739 8.380 -0.000 0.000 0.424 408 Q N 0.920 120.747 119.800 0.046 0.000 2.124 408 Q HA 0.057 4.396 4.340 -0.002 0.000 0.202 408 Q C 1.966 177.924 176.000 -0.069 0.000 0.977 408 Q CA 1.064 56.865 55.803 -0.003 0.000 0.850 408 Q CB -0.320 28.406 28.738 -0.019 0.000 0.901 408 Q HN 0.380 8.650 8.270 -0.000 0.000 0.429 409 L N -0.521 120.617 121.223 -0.143 0.000 2.093 409 L HA -0.133 4.205 4.340 -0.002 0.000 0.208 409 L C 2.226 178.890 176.870 -0.344 0.000 1.085 409 L CA 0.726 55.304 54.840 -0.437 0.000 0.755 409 L CB -0.374 41.108 42.059 -0.962 0.000 0.904 409 L HN 0.258 8.488 8.230 -0.000 0.000 0.435 410 L N -0.672 120.534 121.223 -0.028 0.000 2.046 410 L HA -0.197 4.142 4.340 -0.002 0.000 0.208 410 L C 2.832 179.718 176.870 0.027 0.000 1.077 410 L CA 1.283 56.190 54.840 0.112 0.000 0.747 410 L CB -0.453 41.718 42.059 0.186 0.000 0.896 410 L HN 0.202 8.432 8.230 -0.000 0.000 0.432 411 R N -0.041 120.466 120.500 0.011 0.000 2.075 411 R HA -0.106 4.233 4.340 -0.002 0.000 0.232 411 R C 2.279 178.578 176.300 -0.001 0.000 1.126 411 R CA 1.271 57.381 56.100 0.017 0.000 0.963 411 R CB -0.419 29.898 30.300 0.029 0.000 0.858 411 R HN 0.337 8.607 8.270 -0.000 0.000 0.435 412 I N 0.826 121.362 120.570 -0.057 0.000 2.226 412 I HA -0.272 3.897 4.170 -0.002 0.000 0.245 412 I C 2.643 178.670 176.117 -0.150 0.000 1.100 412 I CA 1.368 62.597 61.300 -0.119 0.000 1.374 412 I CB -0.300 37.525 38.000 -0.291 0.000 1.057 412 I HN 0.277 8.487 8.210 -0.000 0.000 0.413 413 E N 1.138 121.257 120.200 -0.135 0.000 2.051 413 E HA -0.309 4.040 4.350 -0.002 0.000 0.192 413 E C 2.138 178.725 176.600 -0.022 0.000 0.991 413 E CA 1.613 57.970 56.400 -0.072 0.000 0.799 413 E CB -0.067 29.629 29.700 -0.006 0.000 0.748 413 E HN 0.433 8.793 8.360 -0.000 0.000 0.449 414 E N 0.501 120.701 120.200 0.000 0.000 2.070 414 E HA -0.300 4.048 4.350 -0.002 0.000 0.197 414 E C 2.077 178.690 176.600 0.022 0.000 1.004 414 E CA 1.618 58.028 56.400 0.017 0.000 0.805 414 E CB -0.124 29.591 29.700 0.025 0.000 0.744 414 E HN 0.337 8.697 8.360 -0.000 0.000 0.451 415 E N 0.115 120.334 120.200 0.031 0.000 2.153 415 E HA -0.177 4.172 4.350 -0.002 0.000 0.194 415 E C 2.151 178.788 176.600 0.062 0.000 0.988 415 E CA 0.787 57.223 56.400 0.061 0.000 0.811 415 E CB -0.041 29.726 29.700 0.113 0.000 0.746 415 E HN 0.349 8.709 8.360 -0.000 0.000 0.466 416 L N 0.106 121.346 121.223 0.028 0.000 2.465 416 L HA 0.059 4.398 4.340 -0.002 0.000 0.224 416 L C 1.490 178.374 176.870 0.024 0.000 1.145 416 L CA 0.310 55.164 54.840 0.023 0.000 0.834 416 L CB -0.697 41.337 42.059 -0.040 0.000 0.944 416 L HN 0.365 8.595 8.230 -0.000 0.000 0.451 417 G N 0.518 109.332 108.800 0.022 0.000 2.574 417 G HA2 -0.428 3.530 3.960 -0.002 0.000 0.282 417 G HA3 -0.428 3.530 3.960 -0.002 0.000 0.282 417 G C 0.905 175.817 174.900 0.020 0.000 1.257 417 G CA 0.532 45.645 45.100 0.022 0.000 0.956 417 G HN 0.409 8.699 8.290 -0.000 0.000 0.560 418 S N -0.365 115.348 115.700 0.021 0.000 2.500 418 S HA -0.015 4.454 4.470 -0.002 0.000 0.239 418 S C 1.640 176.254 174.600 0.024 0.000 0.989 418 S CA 1.885 60.098 58.200 0.021 0.000 0.951 418 S CB 0.022 63.234 63.200 0.020 0.000 0.759 418 S HN 0.608 8.918 8.310 -0.000 0.000 0.523 419 K N 1.634 122.049 120.400 0.024 0.000 2.417 419 K HA 0.440 4.759 4.320 -0.002 0.000 0.196 419 K C 0.581 177.195 176.600 0.024 0.000 1.023 419 K CA 0.284 56.586 56.287 0.025 0.000 1.122 419 K CB -0.255 32.261 32.500 0.026 0.000 0.850 419 K HN 0.497 8.747 8.250 -0.000 0.000 0.521 420 A N 1.812 124.645 122.820 0.022 0.000 2.477 420 A HA 0.166 4.485 4.320 -0.002 0.000 0.246 420 A C -0.194 177.420 177.584 0.049 0.000 1.078 420 A CA 0.249 52.298 52.037 0.019 0.000 0.770 420 A CB 0.135 19.143 19.000 0.015 0.000 1.011 420 A HN 0.125 8.275 8.150 -0.000 0.000 0.494 421 K N 0.911 121.344 120.400 0.055 0.000 2.259 421 K HA 0.538 4.857 4.320 -0.002 0.000 0.252 421 K C -1.420 175.283 176.600 0.172 0.000 0.936 421 K CA -0.319 56.023 56.287 0.093 0.000 0.810 421 K CB 2.097 34.626 32.500 0.049 0.000 1.143 421 K HN 0.573 8.823 8.250 -0.000 0.000 0.427 422 F N 1.639 121.607 119.950 0.030 0.000 2.467 422 F HA 0.399 4.925 4.527 -0.002 0.000 0.336 422 F C 0.831 176.665 175.800 0.058 0.000 1.123 422 F CA -0.795 57.239 58.000 0.056 0.000 0.964 422 F CB 1.326 40.367 39.000 0.068 0.000 1.136 422 F HN 0.708 9.008 8.300 -0.000 0.000 0.447 423 A N 4.952 127.472 122.820 -0.500 0.000 1.917 423 A HA 0.150 4.468 4.320 -0.002 0.000 0.219 423 A C 2.060 179.367 177.584 -0.461 0.000 1.182 423 A CA 1.796 53.596 52.037 -0.394 0.000 0.633 423 A CB -1.609 17.230 19.000 -0.270 0.000 0.819 423 A HN 1.750 9.900 8.150 -0.000 0.000 0.448 424 G N 0.106 108.280 108.800 -1.044 0.000 2.685 424 G HA2 -0.507 3.452 3.960 -0.002 0.000 0.329 424 G HA3 -0.507 3.452 3.960 -0.002 0.000 0.329 424 G C 1.172 176.043 174.900 -0.050 0.000 1.271 424 G CA 2.326 47.163 45.100 -0.440 0.000 1.003 424 G HN 1.245 9.535 8.290 -0.000 0.000 0.549 425 R N 0.505 121.040 120.500 0.057 0.000 2.152 425 R HA 0.014 4.353 4.340 -0.002 0.000 0.232 425 R C 1.285 177.679 176.300 0.157 0.000 1.117 425 R CA 1.881 58.076 56.100 0.158 0.000 0.981 425 R CB -0.391 29.966 30.300 0.095 0.000 0.870 425 R HN 0.425 8.695 8.270 -0.000 0.000 0.451 426 N N 1.393 120.119 118.700 0.043 0.000 2.346 426 N HA -0.001 4.738 4.740 -0.002 0.000 0.225 426 N C 0.593 176.043 175.510 -0.100 0.000 1.144 426 N CA 0.019 53.034 53.050 -0.057 0.000 0.837 426 N CB 0.130 38.584 38.487 -0.055 0.000 1.069 426 N HN 0.377 8.757 8.380 -0.000 0.000 0.487 427 F N 0.805 120.678 119.950 -0.129 0.000 2.202 427 F HA -0.000 4.526 4.527 -0.002 0.000 0.301 427 F C 1.966 177.720 175.800 -0.077 0.000 1.082 427 F CA 0.771 58.692 58.000 -0.131 0.000 1.313 427 F CB -0.399 38.517 39.000 -0.139 0.000 1.024 427 F HN -0.105 8.195 8.300 -0.000 0.000 0.495 428 R N 0.439 120.352 120.500 -0.978 0.000 2.148 428 R HA -0.079 4.260 4.340 -0.002 0.000 0.227 428 R C -0.032 176.110 176.300 -0.264 0.000 1.103 428 R CA 1.331 57.061 56.100 -0.617 0.000 0.983 428 R CB -0.485 29.411 30.300 -0.674 0.000 0.874 428 R HN 0.424 8.694 8.270 -0.000 0.000 0.451 429 N N -0.829 117.742 118.700 -0.215 0.000 3.151 429 N HA 0.066 4.805 4.740 -0.002 0.000 0.219 429 N C -2.450 173.006 175.510 -0.089 0.000 1.434 429 N CA -0.858 52.127 53.050 -0.110 0.000 0.767 429 N CB 1.231 39.667 38.487 -0.084 0.000 1.564 429 N HN -0.228 8.152 8.380 -0.000 0.000 0.612 430 P HA -0.001 4.419 4.420 -0.000 0.000 0.239 430 P C -0.069 177.208 177.300 -0.038 0.000 1.184 430 P CA 0.406 63.473 63.100 -0.056 0.000 0.760 430 P CB 0.440 32.108 31.700 -0.054 0.000 0.884 431 L N 0.000 121.202 121.223 -0.035 0.000 2.949 431 L HA 0.000 4.339 4.340 -0.002 0.000 0.249 431 L CA 0.000 54.826 54.840 -0.024 0.000 0.813 431 L CB 0.000 42.047 42.059 -0.020 0.000 0.961 431 L HN 0.000 8.230 8.230 -0.000 0.000 0.502