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 2vpq_1_B DATA FIRST_RESID 2 DATA SEQUENCE KKVLIANRGE IAVRIIRACR DLGIQTVAIY SEGDKDALHT QIADEAYCVG DATA SEQUENCE PTLSKDSYLN IPNILSIATS TGCDGVHPGY GFLAENADFA ELCEACQLKF DATA SEQUENCE IGPSYQSIQK MGIKDVAKAE MIKANVPVVP GSDGLMKDVS EAKKIAKKIG DATA SEQUENCE YPVIIKATAG GGGKGIRVAR DEKELETGFR MTEQEAQTAF GNGGLYMEKF DATA SEQUENCE IENFRHIEIQ IVGDSYGNVI HLGERDCTIQ RRMQKLVEEA PSPILDDETR DATA SEQUENCE REMGNAAVRA AKAVNYENAG TIEFIYDLND NKFYFMEMNT RIQVEHPVTE DATA SEQUENCE MVTGIDLVKL QLQVAMGDVL PYKQEDIKLT GHAIEFRINA ENPYKNFMPS DATA SEQUENCE PGKIEQYLAP GGYGVRIESA CYTNYTIPPY YDSMVAKLII HEPTRDEAIM DATA SEQUENCE AGIRALSEFV VLGIDTTIPF HIKLLNNDIF RSGKFNTNFL EQNSIMND VARS RESID RESNAME ATOMNAME SS_SHIFT SHIFT RC_SHIFT HM_SHIFT EF_SHIFT SIGMA FORMAT %4d %4s %4s %9.3f %9.3f %9.3f %9.3f %9.3f %9.3f 2 K HA 0.000 4.320 4.320 0.000 0.000 0.191 2 K C 0.000 176.613 176.600 0.022 0.000 0.988 2 K CA 0.000 56.297 56.287 0.016 0.000 0.838 2 K CB 0.000 32.509 32.500 0.015 0.000 1.064 3 K N 1.202 121.616 120.400 0.024 0.000 2.468 3 K HA 0.608 4.907 4.320 -0.034 0.000 0.252 3 K C -1.570 175.052 176.600 0.037 0.000 0.932 3 K CA -0.814 55.493 56.287 0.033 0.000 0.794 3 K CB 2.278 34.800 32.500 0.036 0.000 1.241 3 K HN -0.045 8.205 8.250 0.000 0.000 0.428 4 V N 5.003 124.945 119.914 0.047 0.000 2.638 4 V HA 0.369 4.469 4.120 -0.034 0.000 0.306 4 V C -0.579 175.558 176.094 0.072 0.000 1.052 4 V CA -0.999 61.333 62.300 0.055 0.000 0.885 4 V CB 1.770 33.625 31.823 0.054 0.000 0.999 4 V HN 0.759 8.949 8.190 0.000 0.000 0.424 5 L N 5.556 126.829 121.223 0.083 0.000 2.305 5 L HA 0.605 4.925 4.340 -0.034 0.000 0.281 5 L C -0.744 176.188 176.870 0.102 0.000 1.085 5 L CA -0.189 54.712 54.840 0.102 0.000 0.813 5 L CB 1.016 43.140 42.059 0.109 0.000 1.157 5 L HN 0.556 8.786 8.230 0.000 0.000 0.436 6 I N 5.778 126.401 120.570 0.088 0.000 2.291 6 I HA 0.262 4.412 4.170 -0.034 0.000 0.290 6 I C 0.626 176.768 176.117 0.042 0.000 1.050 6 I CA 0.297 61.622 61.300 0.041 0.000 1.245 6 I CB 1.437 39.429 38.000 -0.014 0.000 1.405 6 I HN 0.672 8.882 8.210 0.000 0.000 0.478 7 A N 6.101 128.949 122.820 0.046 0.000 3.168 7 A HA 0.477 4.776 4.320 -0.034 0.000 0.260 7 A C 0.282 177.832 177.584 -0.057 0.000 1.598 7 A CA 0.035 52.093 52.037 0.034 0.000 1.285 7 A CB -0.745 18.302 19.000 0.078 0.000 1.149 7 A HN 0.713 8.863 8.150 0.000 0.000 0.630 8 N N 0.085 118.698 118.700 -0.145 0.000 3.378 8 N HA 0.414 5.134 4.740 -0.034 0.000 0.294 8 N C -0.928 174.238 175.510 -0.573 0.000 1.544 8 N CA -0.411 52.430 53.050 -0.348 0.000 0.872 8 N CB 1.286 39.616 38.487 -0.261 0.000 1.670 8 N HN 0.649 9.029 8.380 0.000 0.000 0.551 9 R N -0.812 119.271 120.500 -0.696 0.000 2.906 9 R HA 0.777 5.097 4.340 -0.034 0.000 0.258 9 R C 0.524 176.525 176.300 -0.499 0.000 1.156 9 R CA -0.053 55.564 56.100 -0.806 0.000 0.996 9 R CB 0.290 30.096 30.300 -0.823 0.000 1.259 9 R HN 0.684 8.954 8.270 0.000 0.000 0.462 10 G N 0.948 109.585 108.800 -0.271 0.000 2.539 10 G HA2 -0.427 3.513 3.960 -0.034 0.000 0.256 10 G HA3 -0.427 3.513 3.960 -0.034 0.000 0.256 10 G C 0.543 175.415 174.900 -0.047 0.000 1.233 10 G CA 0.817 45.889 45.100 -0.046 0.000 0.936 10 G HN 0.962 9.252 8.290 0.000 0.000 0.571 11 E N -0.362 119.846 120.200 0.013 0.000 2.208 11 E HA 0.158 4.487 4.350 -0.034 0.000 0.193 11 E C 2.398 178.989 176.600 -0.015 0.000 0.988 11 E CA 1.751 58.171 56.400 0.033 0.000 0.828 11 E CB -0.058 29.701 29.700 0.099 0.000 0.763 11 E HN 0.700 9.060 8.360 0.000 0.000 0.478 12 I N 0.799 121.313 120.570 -0.095 0.000 2.439 12 I HA 0.040 4.189 4.170 -0.034 0.000 0.251 12 I C 2.127 178.080 176.117 -0.274 0.000 1.139 12 I CA 0.947 62.109 61.300 -0.231 0.000 1.438 12 I CB -0.587 37.019 38.000 -0.658 0.000 1.085 12 I HN 0.232 8.442 8.210 0.000 0.000 0.427 13 A N -0.380 122.262 122.820 -0.297 0.000 1.873 13 A HA -0.133 4.167 4.320 -0.034 0.000 0.215 13 A C 2.379 179.885 177.584 -0.130 0.000 1.186 13 A CA 1.989 53.852 52.037 -0.289 0.000 0.616 13 A CB -1.213 17.448 19.000 -0.564 0.000 0.823 13 A HN 0.251 8.401 8.150 0.000 0.000 0.442 14 V N 0.372 120.247 119.914 -0.064 0.000 2.252 14 V HA -0.337 3.763 4.120 -0.034 0.000 0.249 14 V C 2.688 178.769 176.094 -0.022 0.000 1.056 14 V CA 2.652 64.948 62.300 -0.005 0.000 1.022 14 V CB -0.902 30.931 31.823 0.017 0.000 0.641 14 V HN 0.704 8.894 8.190 0.000 0.000 0.445 15 R N 0.321 120.804 120.500 -0.027 0.000 2.096 15 R HA -0.187 4.133 4.340 -0.034 0.000 0.240 15 R C 1.997 178.264 176.300 -0.056 0.000 1.139 15 R CA 2.152 58.248 56.100 -0.006 0.000 0.952 15 R CB -0.738 29.589 30.300 0.045 0.000 0.854 15 R HN 0.556 8.826 8.270 0.000 0.000 0.436 16 I N -0.191 120.292 120.570 -0.145 0.000 2.202 16 I HA -0.241 3.909 4.170 -0.034 0.000 0.242 16 I C 2.216 178.285 176.117 -0.080 0.000 1.091 16 I CA 1.335 62.520 61.300 -0.191 0.000 1.368 16 I CB -0.250 37.528 38.000 -0.369 0.000 1.058 16 I HN 0.168 8.378 8.210 0.000 0.000 0.410 17 I N 0.396 120.934 120.570 -0.054 0.000 2.264 17 I HA -0.303 3.847 4.170 -0.034 0.000 0.248 17 I C 2.698 178.813 176.117 -0.003 0.000 1.111 17 I CA 1.420 62.713 61.300 -0.011 0.000 1.382 17 I CB -0.394 37.611 38.000 0.008 0.000 1.060 17 I HN 0.171 8.381 8.210 0.000 0.000 0.418 18 R N 0.640 121.137 120.500 -0.004 0.000 2.081 18 R HA -0.124 4.196 4.340 -0.034 0.000 0.235 18 R C 2.461 178.768 176.300 0.012 0.000 1.131 18 R CA 1.484 57.588 56.100 0.007 0.000 0.960 18 R CB -0.479 29.829 30.300 0.013 0.000 0.856 18 R HN 0.361 8.631 8.270 0.000 0.000 0.436 19 A N 0.465 123.290 122.820 0.009 0.000 1.972 19 A HA -0.163 4.137 4.320 -0.034 0.000 0.219 19 A C 2.335 179.933 177.584 0.024 0.000 1.169 19 A CA 1.287 53.336 52.037 0.020 0.000 0.635 19 A CB -0.674 18.338 19.000 0.020 0.000 0.810 19 A HN 0.433 8.583 8.150 0.000 0.000 0.446 20 C N -0.953 118.359 119.300 0.019 0.000 2.453 20 C HA -0.040 4.400 4.460 -0.034 0.000 0.277 20 C C 2.841 177.843 174.990 0.020 0.000 1.262 20 C CA 0.993 60.026 59.018 0.024 0.000 1.718 20 C CB -1.224 26.531 27.740 0.025 0.000 2.031 20 C HN 0.617 8.847 8.230 0.000 0.000 0.480 21 R N 0.925 121.435 120.500 0.016 0.000 2.120 21 R HA -0.115 4.204 4.340 -0.034 0.000 0.234 21 R C 1.536 177.844 176.300 0.014 0.000 1.123 21 R CA 1.486 57.594 56.100 0.013 0.000 0.975 21 R CB -0.433 29.873 30.300 0.009 0.000 0.866 21 R HN 0.528 8.798 8.270 0.000 0.000 0.446 22 D N 0.744 121.154 120.400 0.017 0.000 2.178 22 D HA -0.119 4.501 4.640 -0.034 0.000 0.201 22 D C 1.553 177.864 176.300 0.018 0.000 0.980 22 D CA 1.079 55.090 54.000 0.018 0.000 0.842 22 D CB 0.047 40.861 40.800 0.024 0.000 0.948 22 D HN 0.214 8.584 8.370 0.000 0.000 0.472 23 L N -0.886 120.349 121.223 0.019 0.000 2.592 23 L HA 0.220 4.539 4.340 -0.034 0.000 0.227 23 L C 1.255 178.134 176.870 0.015 0.000 1.127 23 L CA 0.211 55.062 54.840 0.017 0.000 0.884 23 L CB 0.098 42.169 42.059 0.020 0.000 1.065 23 L HN 0.104 8.334 8.230 0.000 0.000 0.457 24 G N 1.221 110.029 108.800 0.014 0.000 2.147 24 G HA2 -0.279 3.661 3.960 -0.034 0.000 0.244 24 G HA3 -0.279 3.661 3.960 -0.034 0.000 0.244 24 G C 0.138 175.046 174.900 0.015 0.000 1.005 24 G CA -0.092 45.016 45.100 0.013 0.000 0.713 24 G HN 0.308 8.598 8.290 0.000 0.000 0.515 25 I N 0.221 120.802 120.570 0.018 0.000 2.385 25 I HA 0.361 4.511 4.170 -0.034 0.000 0.294 25 I C 0.631 176.762 176.117 0.024 0.000 0.988 25 I CA -0.936 60.377 61.300 0.021 0.000 1.265 25 I CB 1.338 39.353 38.000 0.024 0.000 1.388 25 I HN 0.003 8.213 8.210 0.000 0.000 0.480 26 Q N 3.428 123.244 119.800 0.027 0.000 2.354 26 Q HA 0.372 4.691 4.340 -0.034 0.000 0.244 26 Q C -0.236 175.789 176.000 0.041 0.000 0.969 26 Q CA -0.137 55.685 55.803 0.032 0.000 0.885 26 Q CB 1.268 30.026 28.738 0.033 0.000 1.241 26 Q HN 0.728 8.998 8.270 0.000 0.000 0.461 27 T N -2.219 112.363 114.554 0.046 0.000 2.861 27 T HA 0.709 5.039 4.350 -0.034 0.000 0.287 27 T C -0.903 173.845 174.700 0.081 0.000 1.003 27 T CA -0.867 61.267 62.100 0.057 0.000 0.977 27 T CB 0.980 69.874 68.868 0.043 0.000 0.996 27 T HN 0.220 8.460 8.240 0.000 0.000 0.448 28 V N 2.637 122.616 119.914 0.108 0.000 2.326 28 V HA 0.703 4.803 4.120 -0.034 0.000 0.281 28 V C 0.663 176.861 176.094 0.172 0.000 1.015 28 V CA -0.898 61.500 62.300 0.163 0.000 0.823 28 V CB 0.766 32.710 31.823 0.201 0.000 1.009 28 V HN 1.289 9.479 8.190 0.000 0.000 0.436 29 A N 6.638 129.565 122.820 0.177 0.000 2.371 29 A HA 0.832 5.131 4.320 -0.034 0.000 0.257 29 A C -0.129 177.624 177.584 0.283 0.000 1.089 29 A CA -0.305 51.879 52.037 0.245 0.000 0.794 29 A CB 0.379 19.512 19.000 0.222 0.000 1.029 29 A HN 0.959 9.109 8.150 0.000 0.000 0.488 30 I N -0.879 119.881 120.570 0.315 0.000 2.797 30 I HA 0.908 5.057 4.170 -0.034 0.000 0.307 30 I C -0.891 175.473 176.117 0.412 0.000 1.033 30 I CA -1.140 60.308 61.300 0.247 0.000 1.071 30 I CB 2.090 40.155 38.000 0.109 0.000 1.255 30 I HN 0.778 8.988 8.210 0.000 0.000 0.445 31 Y N 1.298 121.649 120.300 0.085 0.000 2.552 31 Y HA 0.674 5.202 4.550 -0.036 0.000 0.337 31 Y C -0.339 175.461 175.900 -0.167 0.000 1.094 31 Y CA -1.027 57.121 58.100 0.079 0.000 1.028 31 Y CB 0.718 39.209 38.460 0.052 0.000 1.321 31 Y HN 0.808 9.088 8.280 0.000 0.000 0.456 32 S N 0.655 116.252 115.700 -0.172 0.000 2.614 32 S HA 0.178 4.628 4.470 -0.034 0.000 0.265 32 S C 0.617 175.277 174.600 0.100 0.000 1.303 32 S CA 0.072 58.163 58.200 -0.181 0.000 1.000 32 S CB 1.255 64.400 63.200 -0.092 0.000 0.935 32 S HN 0.913 9.223 8.310 0.000 0.000 0.551 33 E N 1.441 121.659 120.200 0.029 0.000 2.147 33 E HA -0.138 4.192 4.350 -0.034 0.000 0.199 33 E C 2.037 178.719 176.600 0.138 0.000 1.005 33 E CA 1.369 57.825 56.400 0.095 0.000 0.810 33 E CB -0.763 28.947 29.700 0.015 0.000 0.736 33 E HN 0.908 9.268 8.360 0.000 0.000 0.460 34 G N 0.290 109.165 108.800 0.125 0.000 2.534 34 G HA2 -0.174 3.766 3.960 -0.034 0.000 0.217 34 G HA3 -0.174 3.766 3.960 -0.034 0.000 0.217 34 G C 0.703 175.764 174.900 0.269 0.000 1.128 34 G CA 0.451 45.646 45.100 0.159 0.000 0.784 34 G HN 0.085 8.375 8.290 0.000 0.000 0.542 35 D N -0.491 120.099 120.400 0.316 0.000 2.587 35 D HA 0.184 4.804 4.640 -0.034 0.000 0.233 35 D C 1.720 178.120 176.300 0.166 0.000 1.213 35 D CA -0.083 54.107 54.000 0.318 0.000 0.827 35 D CB 0.610 41.652 40.800 0.402 0.000 1.006 35 D HN 0.189 8.559 8.370 0.000 0.000 0.490 36 K N 0.128 120.591 120.400 0.107 0.000 2.147 36 K HA -0.083 4.216 4.320 -0.034 0.000 0.205 36 K C 0.749 177.270 176.600 -0.132 0.000 1.049 36 K CA 0.949 57.170 56.287 -0.109 0.000 0.936 36 K CB 0.362 32.861 32.500 -0.000 0.000 0.722 36 K HN -0.039 8.211 8.250 0.000 0.000 0.446 37 D N 0.338 120.775 120.400 0.062 0.000 2.340 37 D HA 0.044 4.664 4.640 -0.034 0.000 0.220 37 D C -0.277 176.118 176.300 0.158 0.000 1.039 37 D CA 0.186 54.280 54.000 0.156 0.000 0.866 37 D CB 0.150 41.146 40.800 0.327 0.000 0.913 37 D HN 0.189 8.559 8.370 0.000 0.000 0.523 38 A N 0.869 123.711 122.820 0.037 0.000 2.520 38 A HA 0.035 4.334 4.320 -0.034 0.000 0.245 38 A C 1.346 178.841 177.584 -0.149 0.000 1.072 38 A CA -0.298 51.732 52.037 -0.012 0.000 0.761 38 A CB 0.347 19.341 19.000 -0.009 0.000 1.004 38 A HN 0.153 8.303 8.150 0.000 0.000 0.499 39 L N 3.208 124.375 121.223 -0.094 0.000 2.079 39 L HA -0.214 4.106 4.340 -0.034 0.000 0.210 39 L C 2.558 179.368 176.870 -0.100 0.000 1.081 39 L CA 2.771 57.540 54.840 -0.117 0.000 0.752 39 L CB -0.735 41.272 42.059 -0.085 0.000 0.896 39 L HN 0.944 9.174 8.230 0.000 0.000 0.433 40 H N -2.018 117.009 119.070 -0.073 0.000 2.456 40 H HA -0.100 4.436 4.556 -0.034 0.000 0.296 40 H C 1.783 177.083 175.328 -0.046 0.000 1.079 40 H CA 1.626 57.643 56.048 -0.052 0.000 1.322 40 H CB -1.022 28.717 29.762 -0.037 0.000 1.388 40 H HN 0.514 8.794 8.280 0.000 0.000 0.538 41 T N -0.859 113.360 114.554 -0.558 0.000 2.995 41 T HA -0.096 4.234 4.350 -0.034 0.000 0.269 41 T C 1.769 176.321 174.700 -0.246 0.000 1.091 41 T CA 0.752 62.613 62.100 -0.398 0.000 1.128 41 T CB 0.031 68.562 68.868 -0.560 0.000 0.891 41 T HN 0.390 8.630 8.240 0.000 0.000 0.492 42 Q N 1.541 121.210 119.800 -0.218 0.000 2.062 42 Q HA 0.123 4.443 4.340 -0.034 0.000 0.196 42 Q C 2.606 178.534 176.000 -0.120 0.000 0.967 42 Q CA 1.375 57.075 55.803 -0.172 0.000 0.832 42 Q CB -0.511 28.109 28.738 -0.196 0.000 0.899 42 Q HN 0.818 9.088 8.270 0.000 0.000 0.442 43 I N -1.272 119.242 120.570 -0.094 0.000 2.876 43 I HA 0.242 4.392 4.170 -0.034 0.000 0.264 43 I C 1.164 177.262 176.117 -0.031 0.000 1.204 43 I CA -0.031 61.236 61.300 -0.056 0.000 1.485 43 I CB -0.241 37.735 38.000 -0.040 0.000 1.103 43 I HN -0.138 8.072 8.210 0.000 0.000 0.446 44 A N 1.902 124.708 122.820 -0.023 0.000 2.448 44 A HA 0.029 4.328 4.320 -0.034 0.000 0.239 44 A C 0.920 178.493 177.584 -0.018 0.000 1.080 44 A CA 0.268 52.305 52.037 -0.000 0.000 0.779 44 A CB 0.066 19.081 19.000 0.026 0.000 1.026 44 A HN 0.392 8.542 8.150 0.000 0.000 0.499 45 D N 0.047 120.448 120.400 0.001 0.000 2.194 45 D HA 0.007 4.627 4.640 -0.034 0.000 0.204 45 D C 0.338 176.626 176.300 -0.020 0.000 0.964 45 D CA 1.576 55.573 54.000 -0.004 0.000 0.846 45 D CB 0.238 41.048 40.800 0.016 0.000 0.962 45 D HN 0.829 9.199 8.370 0.000 0.000 0.490 46 E N -0.640 119.548 120.200 -0.020 0.000 2.390 46 E HA 0.702 5.032 4.350 -0.034 0.000 0.277 46 E C -1.481 175.032 176.600 -0.146 0.000 0.939 46 E CA -1.189 55.146 56.400 -0.109 0.000 0.769 46 E CB 2.371 32.030 29.700 -0.067 0.000 1.251 46 E HN -0.085 8.275 8.360 0.000 0.000 0.450 47 A N 1.611 124.229 122.820 -0.337 0.000 2.414 47 A HA 0.724 5.024 4.320 -0.034 0.000 0.306 47 A C -1.901 175.459 177.584 -0.373 0.000 1.054 47 A CA -0.619 51.321 52.037 -0.160 0.000 0.724 47 A CB 0.916 19.888 19.000 -0.046 0.000 1.267 47 A HN 0.541 8.691 8.150 0.000 0.000 0.418 48 Y N -0.174 120.233 120.300 0.178 0.000 2.492 48 Y HA 0.476 5.005 4.550 -0.035 0.000 0.346 48 Y C 0.290 175.872 175.900 -0.529 0.000 0.997 48 Y CA -0.706 57.367 58.100 -0.046 0.000 1.025 48 Y CB 1.849 40.277 38.460 -0.055 0.000 1.263 48 Y HN 0.799 9.079 8.280 0.000 0.000 0.454 49 C N 3.578 122.529 119.300 -0.582 0.000 2.576 49 C HA 0.349 4.789 4.460 -0.034 0.000 0.401 49 C C 1.520 176.267 174.990 -0.404 0.000 1.314 49 C CA -0.212 58.285 59.018 -0.867 0.000 1.855 49 C CB -1.118 26.306 27.740 -0.527 0.000 2.537 49 C HN 0.792 9.022 8.230 0.000 0.000 0.578 50 V N 4.564 124.229 119.914 -0.416 0.000 3.650 50 V HA 0.583 4.682 4.120 -0.034 0.000 0.271 50 V C 1.074 177.018 176.094 -0.250 0.000 1.281 50 V CA 0.841 62.971 62.300 -0.283 0.000 1.120 50 V CB -1.227 30.412 31.823 -0.306 0.000 0.856 50 V HN 1.460 9.650 8.190 0.000 0.000 0.443 51 G N -0.007 108.636 108.800 -0.263 0.000 2.340 51 G HA2 0.198 4.137 3.960 -0.034 0.000 0.282 51 G HA3 0.198 4.137 3.960 -0.034 0.000 0.282 51 G C -3.431 171.371 174.900 -0.162 0.000 1.312 51 G CA -0.369 44.622 45.100 -0.180 0.000 0.942 51 G HN 0.183 8.473 8.290 0.000 0.000 0.495 52 P HA 0.273 4.693 4.420 0.000 0.000 0.271 52 P C 1.155 178.402 177.300 -0.089 0.000 1.244 52 P CA 0.492 63.539 63.100 -0.088 0.000 0.793 52 P CB 0.315 31.974 31.700 -0.068 0.000 0.984 53 T N -0.183 114.306 114.554 -0.107 0.000 2.684 53 T HA -0.101 4.229 4.350 -0.034 0.000 0.267 53 T C 0.886 175.552 174.700 -0.055 0.000 1.036 53 T CA 1.011 63.034 62.100 -0.130 0.000 1.148 53 T CB -0.693 67.892 68.868 -0.471 0.000 0.863 53 T HN 0.253 8.493 8.240 0.000 0.000 0.436 54 L N 2.161 123.333 121.223 -0.085 0.000 2.540 54 L HA 0.037 4.356 4.340 -0.034 0.000 0.276 54 L C 1.692 178.643 176.870 0.134 0.000 1.212 54 L CA -0.341 54.514 54.840 0.025 0.000 0.893 54 L CB 0.453 42.526 42.059 0.023 0.000 1.138 54 L HN 0.176 8.406 8.230 0.000 0.000 0.491 55 S N 2.123 117.998 115.700 0.292 0.000 2.387 55 S HA -0.230 4.219 4.470 -0.034 0.000 0.230 55 S C 1.756 176.472 174.600 0.193 0.000 1.035 55 S CA 1.929 60.351 58.200 0.369 0.000 1.014 55 S CB -0.209 63.361 63.200 0.617 0.000 0.836 55 S HN 0.764 9.074 8.310 0.000 0.000 0.466 56 K N 1.127 121.616 120.400 0.148 0.000 2.218 56 K HA -0.130 4.170 4.320 -0.034 0.000 0.205 56 K C 0.521 177.145 176.600 0.039 0.000 1.046 56 K CA 1.793 58.136 56.287 0.092 0.000 0.933 56 K CB -0.131 32.413 32.500 0.073 0.000 0.728 56 K HN 0.252 8.502 8.250 0.000 0.000 0.454 57 D N -0.209 120.197 120.400 0.010 0.000 2.469 57 D HA 0.069 4.688 4.640 -0.034 0.000 0.213 57 D C 0.752 176.997 176.300 -0.093 0.000 1.135 57 D CA 0.477 54.457 54.000 -0.034 0.000 0.834 57 D CB 1.022 41.802 40.800 -0.035 0.000 1.009 57 D HN 0.399 8.769 8.370 0.000 0.000 0.507 58 S N -0.689 114.932 115.700 -0.131 0.000 3.386 58 S HA 0.048 4.498 4.470 -0.034 0.000 0.181 58 S C 1.695 176.072 174.600 -0.371 0.000 0.763 58 S CA -0.268 57.741 58.200 -0.319 0.000 0.847 58 S CB -0.508 62.410 63.200 -0.469 0.000 0.980 58 S HN 0.080 8.390 8.310 0.000 0.000 0.676 59 Y N 1.785 121.958 120.300 -0.212 0.000 2.561 59 Y HA 0.395 4.925 4.550 -0.034 0.000 0.291 59 Y C 1.643 177.366 175.900 -0.294 0.000 1.141 59 Y CA 0.402 58.245 58.100 -0.427 0.000 1.303 59 Y CB -0.126 37.706 38.460 -1.045 0.000 1.015 59 Y HN 0.192 8.472 8.280 0.000 0.000 0.547 60 L N -0.386 120.835 121.223 -0.003 0.000 2.808 60 L HA 0.125 4.445 4.340 -0.034 0.000 0.246 60 L C 0.458 177.318 176.870 -0.017 0.000 1.153 60 L CA -0.154 54.701 54.840 0.026 0.000 0.956 60 L CB 0.056 42.195 42.059 0.133 0.000 1.270 60 L HN 0.034 8.264 8.230 0.000 0.000 0.528 61 N N 1.699 120.369 118.700 -0.049 0.000 2.549 61 N HA 0.112 4.832 4.740 -0.034 0.000 0.267 61 N C 1.028 176.523 175.510 -0.024 0.000 1.182 61 N CA 0.208 53.234 53.050 -0.040 0.000 1.019 61 N CB 0.556 39.000 38.487 -0.071 0.000 1.380 61 N HN 0.269 8.649 8.380 0.000 0.000 0.505 62 I N 3.840 124.419 120.570 0.015 0.000 2.179 62 I HA -0.156 3.993 4.170 -0.034 0.000 0.242 62 I C -0.682 175.499 176.117 0.107 0.000 1.088 62 I CA 0.807 62.167 61.300 0.100 0.000 1.357 62 I CB -0.923 37.189 38.000 0.187 0.000 1.051 62 I HN 0.359 8.569 8.210 0.000 0.000 0.409 63 P HA -0.166 4.254 4.420 0.000 0.000 0.216 63 P C 1.274 178.583 177.300 0.015 0.000 1.153 63 P CA 1.523 64.643 63.100 0.033 0.000 0.858 63 P CB -0.119 31.589 31.700 0.012 0.000 0.789 64 N N -0.851 117.847 118.700 -0.004 0.000 2.250 64 N HA -0.013 4.707 4.740 -0.034 0.000 0.181 64 N C 1.738 177.235 175.510 -0.021 0.000 1.017 64 N CA 0.804 53.835 53.050 -0.032 0.000 0.866 64 N CB -0.352 38.097 38.487 -0.063 0.000 0.985 64 N HN 0.122 8.502 8.380 0.000 0.000 0.429 65 I N 1.136 121.715 120.570 0.015 0.000 2.179 65 I HA -0.252 3.897 4.170 -0.034 0.000 0.242 65 I C 2.137 178.313 176.117 0.099 0.000 1.088 65 I CA 0.817 62.154 61.300 0.061 0.000 1.357 65 I CB -0.193 37.867 38.000 0.100 0.000 1.051 65 I HN 0.075 8.285 8.210 0.000 0.000 0.409 66 L N -0.386 120.912 121.223 0.125 0.000 2.083 66 L HA -0.217 4.102 4.340 -0.034 0.000 0.209 66 L C 2.732 179.612 176.870 0.016 0.000 1.083 66 L CA 1.283 56.172 54.840 0.081 0.000 0.752 66 L CB -0.635 41.467 42.059 0.071 0.000 0.899 66 L HN 0.242 8.472 8.230 0.000 0.000 0.433 67 S N 0.286 115.982 115.700 -0.007 0.000 2.368 67 S HA -0.153 4.297 4.470 -0.034 0.000 0.225 67 S C 1.946 176.497 174.600 -0.082 0.000 1.030 67 S CA 1.287 59.462 58.200 -0.043 0.000 0.999 67 S CB -0.190 62.979 63.200 -0.051 0.000 0.844 67 S HN 0.289 8.599 8.310 0.000 0.000 0.459 68 I N 1.455 121.966 120.570 -0.099 0.000 2.252 68 I HA -0.094 4.056 4.170 -0.034 0.000 0.245 68 I C 2.746 178.791 176.117 -0.120 0.000 1.102 68 I CA 0.997 62.186 61.300 -0.186 0.000 1.385 68 I CB -0.485 37.395 38.000 -0.199 0.000 1.064 68 I HN 0.342 8.552 8.210 0.000 0.000 0.414 69 A N 0.823 123.622 122.820 -0.034 0.000 1.908 69 A HA -0.251 4.048 4.320 -0.034 0.000 0.218 69 A C 2.462 180.036 177.584 -0.018 0.000 1.181 69 A CA 2.653 54.691 52.037 0.000 0.000 0.627 69 A CB -1.176 17.850 19.000 0.044 0.000 0.818 69 A HN 0.533 8.683 8.150 0.000 0.000 0.445 70 T N -3.909 110.628 114.554 -0.029 0.000 2.894 70 T HA -0.065 4.265 4.350 -0.034 0.000 0.258 70 T C 2.093 176.766 174.700 -0.044 0.000 1.043 70 T CA 1.593 63.675 62.100 -0.030 0.000 1.141 70 T CB -0.614 68.237 68.868 -0.027 0.000 0.873 70 T HN 0.351 8.591 8.240 0.000 0.000 0.449 71 S N 2.112 117.769 115.700 -0.072 0.000 2.374 71 S HA -0.179 4.271 4.470 -0.034 0.000 0.227 71 S C 2.248 176.796 174.600 -0.087 0.000 1.037 71 S CA 2.400 60.545 58.200 -0.092 0.000 1.024 71 S CB -1.180 61.931 63.200 -0.148 0.000 0.861 71 S HN 0.875 9.185 8.310 0.000 0.000 0.456 72 T N -2.456 112.038 114.554 -0.099 0.000 3.100 72 T HA 0.391 4.720 4.350 -0.034 0.000 0.253 72 T C 1.338 176.036 174.700 -0.003 0.000 1.118 72 T CA 0.855 62.927 62.100 -0.047 0.000 1.058 72 T CB -0.250 68.596 68.868 -0.037 0.000 0.953 72 T HN 1.106 9.346 8.240 0.000 0.000 0.515 73 G N 0.812 109.605 108.800 -0.011 0.000 2.256 73 G HA2 -0.226 3.713 3.960 -0.034 0.000 0.272 73 G HA3 -0.226 3.713 3.960 -0.034 0.000 0.272 73 G C 0.129 175.036 174.900 0.011 0.000 1.076 73 G CA -0.336 44.765 45.100 0.001 0.000 0.882 73 G HN 0.736 9.026 8.290 0.000 0.000 0.497 74 C N -0.325 118.984 119.300 0.014 0.000 2.605 74 C HA 0.419 4.859 4.460 -0.034 0.000 0.404 74 C C 1.769 176.769 174.990 0.017 0.000 1.284 74 C CA 0.430 59.462 59.018 0.025 0.000 2.199 74 C CB 0.738 28.500 27.740 0.037 0.000 2.647 74 C HN 0.654 8.884 8.230 0.000 0.000 0.604 75 D N 0.072 120.483 120.400 0.018 0.000 2.216 75 D HA 0.234 4.853 4.640 -0.034 0.000 0.208 75 D C 1.012 177.318 176.300 0.010 0.000 0.960 75 D CA 0.984 54.990 54.000 0.011 0.000 0.861 75 D CB 0.119 40.924 40.800 0.009 0.000 0.985 75 D HN 0.764 9.134 8.370 0.000 0.000 0.493 76 G N -0.719 108.092 108.800 0.017 0.000 2.733 76 G HA2 0.572 4.511 3.960 -0.034 0.000 0.288 76 G HA3 0.572 4.511 3.960 -0.034 0.000 0.288 76 G C -1.610 173.313 174.900 0.039 0.000 1.373 76 G CA -0.508 44.601 45.100 0.015 0.000 0.895 76 G HN -0.043 8.247 8.290 0.000 0.000 0.479 77 V N 0.853 120.790 119.914 0.039 0.000 2.525 77 V HA 0.373 4.473 4.120 -0.034 0.000 0.299 77 V C -1.084 175.013 176.094 0.005 0.000 1.034 77 V CA -0.874 61.481 62.300 0.092 0.000 0.863 77 V CB 1.503 33.457 31.823 0.218 0.000 0.999 77 V HN 0.824 9.014 8.190 0.000 0.000 0.423 78 H N 8.221 127.253 119.070 -0.064 0.000 2.556 78 H HA 0.433 4.968 4.556 -0.034 0.000 0.310 78 H C -2.030 173.235 175.328 -0.106 0.000 1.057 78 H CA -2.183 53.776 56.048 -0.148 0.000 1.264 78 H CB 2.425 32.118 29.762 -0.115 0.000 1.404 78 H HN 0.341 8.621 8.280 0.000 0.000 0.462 79 P HA 0.114 4.534 4.420 0.000 0.000 0.255 79 P C 0.859 178.228 177.300 0.115 0.000 1.248 79 P CA 0.839 64.032 63.100 0.155 0.000 0.807 79 P CB 0.572 32.390 31.700 0.197 0.000 1.150 80 G N 1.166 110.032 108.800 0.110 0.000 2.611 80 G HA2 -0.262 3.678 3.960 -0.034 0.000 0.301 80 G HA3 -0.262 3.678 3.960 -0.034 0.000 0.301 80 G C -0.590 174.297 174.900 -0.020 0.000 1.233 80 G CA 0.662 45.656 45.100 -0.177 0.000 0.993 80 G HN 0.434 8.724 8.290 0.000 0.000 0.553 81 Y N -1.171 119.172 120.300 0.071 0.000 2.570 81 Y HA 0.702 5.232 4.550 -0.034 0.000 0.345 81 Y C 0.790 176.708 175.900 0.030 0.000 1.014 81 Y CA -0.746 57.394 58.100 0.067 0.000 1.063 81 Y CB 0.978 39.469 38.460 0.052 0.000 1.272 81 Y HN 2.579 10.858 8.280 0.000 0.000 0.477 82 G N 1.061 110.002 108.800 0.235 0.000 2.796 82 G HA2 -0.091 3.849 3.960 -0.034 0.000 0.226 82 G HA3 -0.091 3.849 3.960 -0.034 0.000 0.226 82 G C -0.242 174.689 174.900 0.053 0.000 1.381 82 G CA 0.162 45.260 45.100 -0.003 0.000 0.867 82 G HN 1.308 9.598 8.290 0.000 0.000 0.552 83 F N -2.267 117.736 119.950 0.088 0.000 2.377 83 F HA -0.292 4.219 4.527 -0.028 0.000 0.616 83 F C 2.257 178.082 175.800 0.042 0.000 0.956 83 F CA 2.423 60.455 58.000 0.053 0.000 1.368 83 F CB -1.526 37.477 39.000 0.003 0.000 1.317 83 F HN 0.579 8.879 8.300 0.000 0.000 0.248 84 L N -0.387 120.970 121.223 0.223 0.000 2.769 84 L HA 0.435 4.755 4.340 -0.034 0.000 0.240 84 L C 1.812 178.852 176.870 0.283 0.000 1.163 84 L CA 0.534 55.428 54.840 0.090 0.000 0.962 84 L CB -0.113 41.725 42.059 -0.369 0.000 1.258 84 L HN 0.519 8.749 8.230 0.000 0.000 0.513 85 A N 0.257 123.255 122.820 0.297 0.000 1.969 85 A HA -0.108 4.191 4.320 -0.034 0.000 0.218 85 A C 1.721 179.546 177.584 0.402 0.000 1.169 85 A CA 1.269 53.534 52.037 0.380 0.000 0.635 85 A CB -0.075 19.086 19.000 0.269 0.000 0.810 85 A HN 0.447 8.597 8.150 0.000 0.000 0.445 86 E N -0.211 120.149 120.200 0.266 0.000 2.585 86 E HA 0.065 4.395 4.350 -0.034 0.000 0.206 86 E C -0.528 176.164 176.600 0.153 0.000 1.007 86 E CA -0.379 56.141 56.400 0.200 0.000 1.028 86 E CB 0.152 29.936 29.700 0.140 0.000 1.087 86 E HN 0.361 8.721 8.360 0.000 0.000 0.455 87 N N 1.066 119.874 118.700 0.180 0.000 2.500 87 N HA 0.140 4.860 4.740 -0.034 0.000 0.236 87 N C 0.539 176.098 175.510 0.081 0.000 1.022 87 N CA -0.040 53.095 53.050 0.142 0.000 0.935 87 N CB 1.201 39.791 38.487 0.173 0.000 1.147 87 N HN 0.096 8.476 8.380 0.000 0.000 0.512 88 A N 3.398 126.246 122.820 0.047 0.000 1.940 88 A HA -0.147 4.152 4.320 -0.034 0.000 0.219 88 A C 1.543 179.089 177.584 -0.062 0.000 1.176 88 A CA 1.373 53.416 52.037 0.009 0.000 0.631 88 A CB -0.107 18.938 19.000 0.074 0.000 0.814 88 A HN 0.706 8.856 8.150 0.000 0.000 0.446 89 D N -1.431 118.955 120.400 -0.023 0.000 2.183 89 D HA -0.095 4.524 4.640 -0.034 0.000 0.203 89 D C 1.628 177.897 176.300 -0.053 0.000 0.969 89 D CA 1.173 55.134 54.000 -0.066 0.000 0.842 89 D CB -0.235 40.562 40.800 -0.005 0.000 0.957 89 D HN 0.531 8.901 8.370 0.000 0.000 0.484 90 F N 2.255 122.134 119.950 -0.118 0.000 2.163 90 F HA -0.016 4.493 4.527 -0.031 0.000 0.297 90 F C 2.312 177.990 175.800 -0.203 0.000 1.094 90 F CA 1.143 59.085 58.000 -0.096 0.000 1.290 90 F CB -0.273 38.728 39.000 0.002 0.000 1.017 90 F HN -0.113 8.187 8.300 0.000 0.000 0.483 91 A N 0.443 122.939 122.820 -0.540 0.000 1.892 91 A HA -0.266 4.033 4.320 -0.034 0.000 0.218 91 A C 2.130 179.428 177.584 -0.477 0.000 1.188 91 A CA 2.179 53.683 52.037 -0.889 0.000 0.631 91 A CB -1.049 17.337 19.000 -1.024 0.000 0.822 91 A HN 0.585 8.735 8.150 0.000 0.000 0.447 92 E N -0.332 119.611 120.200 -0.428 0.000 2.038 92 E HA -0.181 4.148 4.350 -0.034 0.000 0.195 92 E C 2.031 178.415 176.600 -0.360 0.000 1.000 92 E CA 1.291 57.366 56.400 -0.541 0.000 0.803 92 E CB -0.341 28.895 29.700 -0.773 0.000 0.750 92 E HN 0.618 8.978 8.360 0.000 0.000 0.448 93 L N 0.588 121.616 121.223 -0.324 0.000 2.012 93 L HA -0.278 4.042 4.340 -0.034 0.000 0.210 93 L C 2.707 179.419 176.870 -0.262 0.000 1.073 93 L CA 0.990 55.684 54.840 -0.244 0.000 0.748 93 L CB -0.464 41.496 42.059 -0.165 0.000 0.891 93 L HN 0.367 8.597 8.230 0.000 0.000 0.431 94 C N -0.399 118.657 119.300 -0.407 0.000 2.393 94 C HA -0.241 4.199 4.460 -0.034 0.000 0.276 94 C C 2.742 177.636 174.990 -0.160 0.000 1.215 94 C CA 1.245 60.079 59.018 -0.306 0.000 1.743 94 C CB -0.839 26.701 27.740 -0.335 0.000 2.044 94 C HN 0.547 8.777 8.230 0.000 0.000 0.464 95 E N 0.515 120.627 120.200 -0.146 0.000 2.085 95 E HA -0.216 4.113 4.350 -0.034 0.000 0.194 95 E C 2.153 178.711 176.600 -0.069 0.000 0.994 95 E CA 1.383 57.741 56.400 -0.070 0.000 0.801 95 E CB -0.179 29.505 29.700 -0.026 0.000 0.743 95 E HN 0.635 8.995 8.360 0.000 0.000 0.453 96 A N -0.185 122.574 122.820 -0.102 0.000 2.066 96 A HA -0.116 4.184 4.320 -0.034 0.000 0.218 96 A C 2.042 179.586 177.584 -0.066 0.000 1.157 96 A CA 0.939 52.927 52.037 -0.082 0.000 0.670 96 A CB -0.248 18.691 19.000 -0.101 0.000 0.804 96 A HN 0.451 8.601 8.150 0.000 0.000 0.453 97 C N -1.028 118.227 119.300 -0.074 0.000 2.673 97 C HA 0.304 4.744 4.460 -0.034 0.000 0.274 97 C C 0.643 175.609 174.990 -0.041 0.000 1.276 97 C CA -0.156 58.829 59.018 -0.055 0.000 1.701 97 C CB -1.382 26.322 27.740 -0.060 0.000 1.836 97 C HN 0.687 8.917 8.230 0.000 0.000 0.596 98 Q N -0.589 119.188 119.800 -0.039 0.000 2.478 98 Q HA -0.161 4.159 4.340 -0.034 0.000 0.286 98 Q C -0.729 175.258 176.000 -0.022 0.000 1.299 98 Q CA 0.877 56.665 55.803 -0.025 0.000 0.826 98 Q CB -1.861 26.866 28.738 -0.019 0.000 1.199 98 Q HN 0.692 8.962 8.270 0.000 0.000 0.451 99 L N -0.030 121.176 121.223 -0.029 0.000 2.333 99 L HA 0.469 4.789 4.340 -0.034 0.000 0.280 99 L C 0.329 177.197 176.870 -0.003 0.000 1.004 99 L CA -1.278 53.552 54.840 -0.017 0.000 0.820 99 L CB 1.467 43.510 42.059 -0.026 0.000 1.247 99 L HN -0.143 8.087 8.230 0.000 0.000 0.416 100 K N 3.406 123.811 120.400 0.007 0.000 2.336 100 K HA 0.092 4.392 4.320 -0.034 0.000 0.290 100 K C -0.654 175.973 176.600 0.045 0.000 1.067 100 K CA -0.001 56.297 56.287 0.018 0.000 0.962 100 K CB -0.081 32.415 32.500 -0.007 0.000 1.008 100 K HN 0.264 8.514 8.250 0.000 0.000 0.467 101 F N 6.678 126.577 119.950 -0.084 0.000 2.533 101 F HA 0.162 4.668 4.527 -0.036 0.000 0.378 101 F C 0.064 175.813 175.800 -0.086 0.000 1.070 101 F CA -0.555 57.400 58.000 -0.074 0.000 1.172 101 F CB 0.245 39.196 39.000 -0.081 0.000 1.085 101 F HN 0.394 8.694 8.300 0.000 0.000 0.552 102 I N 7.376 127.647 120.570 -0.498 0.000 2.357 102 I HA 0.332 4.482 4.170 -0.034 0.000 0.300 102 I C 0.734 176.441 176.117 -0.683 0.000 1.159 102 I CA 0.305 61.296 61.300 -0.514 0.000 1.339 102 I CB -1.301 36.352 38.000 -0.577 0.000 1.458 102 I HN 0.764 8.974 8.210 0.000 0.000 0.577 103 G N 8.522 117.117 108.800 -0.342 0.000 2.343 103 G HA2 0.216 4.156 3.960 -0.034 0.000 0.289 103 G HA3 0.216 4.156 3.960 -0.034 0.000 0.289 103 G C -3.305 171.585 174.900 -0.017 0.000 1.295 103 G CA -0.696 44.303 45.100 -0.170 0.000 0.869 103 G HN 0.247 8.537 8.290 0.000 0.000 0.522 104 P HA 0.353 4.773 4.420 0.000 0.000 0.274 104 P C 0.587 177.862 177.300 -0.042 0.000 1.260 104 P CA 0.213 63.159 63.100 -0.257 0.000 0.793 104 P CB 0.925 32.273 31.700 -0.586 0.000 1.048 105 S N 0.024 115.639 115.700 -0.141 0.000 2.593 105 S HA 0.021 4.470 4.470 -0.034 0.000 0.269 105 S C 1.428 175.956 174.600 -0.120 0.000 1.334 105 S CA -0.174 57.946 58.200 -0.133 0.000 1.015 105 S CB -0.338 62.721 63.200 -0.236 0.000 0.912 105 S HN 0.580 8.890 8.310 0.000 0.000 0.541 106 Y N 0.989 121.204 120.300 -0.142 0.000 2.207 106 Y HA -0.119 4.410 4.550 -0.035 0.000 0.287 106 Y C 2.179 178.036 175.900 -0.073 0.000 1.156 106 Y CA 1.430 59.442 58.100 -0.146 0.000 1.182 106 Y CB -1.087 37.270 38.460 -0.173 0.000 0.979 106 Y HN 0.630 8.910 8.280 0.000 0.000 0.521 107 Q N 1.160 120.623 119.800 -0.562 0.000 2.030 107 Q HA -0.169 4.150 4.340 -0.034 0.000 0.204 107 Q C 2.583 178.511 176.000 -0.119 0.000 0.986 107 Q CA 2.470 58.066 55.803 -0.346 0.000 0.843 107 Q CB -0.529 27.944 28.738 -0.443 0.000 0.904 107 Q HN 0.524 8.794 8.270 0.000 0.000 0.420 108 S N 0.200 115.839 115.700 -0.102 0.000 2.370 108 S HA -0.137 4.313 4.470 -0.034 0.000 0.226 108 S C 1.899 176.553 174.600 0.090 0.000 1.033 108 S CA 1.145 59.359 58.200 0.024 0.000 1.011 108 S CB -0.332 62.887 63.200 0.033 0.000 0.852 108 S HN 0.288 8.598 8.310 0.000 0.000 0.457 109 I N 1.255 121.868 120.570 0.072 0.000 2.286 109 I HA -0.252 3.897 4.170 -0.034 0.000 0.248 109 I C 2.698 178.865 176.117 0.083 0.000 1.115 109 I CA 1.222 62.586 61.300 0.106 0.000 1.392 109 I CB -0.372 37.680 38.000 0.087 0.000 1.065 109 I HN 0.329 8.539 8.210 0.000 0.000 0.418 110 Q N 0.728 120.570 119.800 0.069 0.000 2.050 110 Q HA -0.212 4.107 4.340 -0.034 0.000 0.202 110 Q C 2.278 178.300 176.000 0.036 0.000 0.980 110 Q CA 1.583 57.421 55.803 0.058 0.000 0.840 110 Q CB -0.003 28.778 28.738 0.071 0.000 0.898 110 Q HN 0.415 8.685 8.270 0.000 0.000 0.424 111 K N -0.243 120.174 120.400 0.028 0.000 2.002 111 K HA -0.098 4.202 4.320 -0.034 0.000 0.209 111 K C 1.793 178.404 176.600 0.018 0.000 1.048 111 K CA 1.158 57.452 56.287 0.013 0.000 0.930 111 K CB 0.024 32.527 32.500 0.005 0.000 0.714 111 K HN 0.215 8.465 8.250 0.000 0.000 0.438 112 M N -0.546 119.083 119.600 0.049 0.000 2.556 112 M HA 0.058 4.518 4.480 -0.034 0.000 0.245 112 M C 1.806 178.142 176.300 0.059 0.000 1.128 112 M CA 0.699 56.036 55.300 0.063 0.000 1.069 112 M CB 0.002 32.654 32.600 0.087 0.000 1.469 112 M HN 0.194 8.484 8.290 0.000 0.000 0.494 113 G N -0.151 108.677 108.800 0.046 0.000 2.986 113 G HA2 0.170 4.110 3.960 -0.034 0.000 0.213 113 G HA3 0.170 4.110 3.960 -0.034 0.000 0.213 113 G C 0.609 175.506 174.900 -0.005 0.000 1.156 113 G CA -0.069 45.047 45.100 0.026 0.000 0.763 113 G HN 0.221 8.511 8.290 0.000 0.000 0.547 114 I N 1.590 122.156 120.570 -0.007 0.000 2.307 114 I HA 0.275 4.425 4.170 -0.034 0.000 0.287 114 I C 0.775 176.854 176.117 -0.063 0.000 1.054 114 I CA -0.492 60.791 61.300 -0.029 0.000 1.218 114 I CB 1.122 39.111 38.000 -0.019 0.000 1.398 114 I HN 0.040 8.250 8.210 0.000 0.000 0.475 115 K N 3.123 123.474 120.400 -0.083 0.000 2.148 115 K HA -0.151 4.148 4.320 -0.034 0.000 0.204 115 K C 1.603 177.979 176.600 -0.372 0.000 1.050 115 K CA 1.274 57.483 56.287 -0.130 0.000 0.942 115 K CB 0.183 32.677 32.500 -0.011 0.000 0.724 115 K HN 0.665 8.915 8.250 0.000 0.000 0.446 116 D N 0.543 120.624 120.400 -0.531 0.000 2.149 116 D HA -0.127 4.493 4.640 -0.034 0.000 0.201 116 D C 1.806 177.955 176.300 -0.252 0.000 0.972 116 D CA 1.042 54.697 54.000 -0.575 0.000 0.835 116 D CB -0.184 40.356 40.800 -0.434 0.000 0.966 116 D HN -0.008 8.362 8.370 0.000 0.000 0.476 117 V N 1.929 121.749 119.914 -0.157 0.000 2.358 117 V HA -0.179 3.920 4.120 -0.034 0.000 0.246 117 V C 3.087 179.127 176.094 -0.090 0.000 1.047 117 V CA 1.600 63.844 62.300 -0.094 0.000 1.035 117 V CB -0.945 30.843 31.823 -0.058 0.000 0.658 117 V HN 0.355 8.545 8.190 0.000 0.000 0.452 118 A N -0.073 122.703 122.820 -0.074 0.000 1.884 118 A HA -0.350 3.950 4.320 -0.034 0.000 0.219 118 A C 2.311 179.819 177.584 -0.126 0.000 1.197 118 A CA 2.572 54.578 52.037 -0.051 0.000 0.637 118 A CB -0.615 18.427 19.000 0.071 0.000 0.827 118 A HN 0.521 8.671 8.150 0.000 0.000 0.450 119 K N -0.862 119.498 120.400 -0.067 0.000 2.020 119 K HA -0.179 4.121 4.320 -0.034 0.000 0.212 119 K C 2.352 178.880 176.600 -0.121 0.000 1.050 119 K CA 1.416 57.663 56.287 -0.068 0.000 0.929 119 K CB -0.386 32.089 32.500 -0.043 0.000 0.714 119 K HN 0.479 8.729 8.250 0.000 0.000 0.443 120 A N 1.045 123.804 122.820 -0.103 0.000 1.908 120 A HA -0.238 4.062 4.320 -0.034 0.000 0.218 120 A C 1.990 179.517 177.584 -0.095 0.000 1.181 120 A CA 1.960 53.948 52.037 -0.082 0.000 0.627 120 A CB -0.492 18.469 19.000 -0.066 0.000 0.818 120 A HN 0.373 8.523 8.150 0.000 0.000 0.445 121 E N -0.793 119.338 120.200 -0.115 0.000 2.153 121 E HA -0.167 4.162 4.350 -0.034 0.000 0.194 121 E C 1.944 178.447 176.600 -0.163 0.000 0.988 121 E CA 1.475 57.803 56.400 -0.120 0.000 0.811 121 E CB -0.182 29.449 29.700 -0.115 0.000 0.746 121 E HN 0.470 8.830 8.360 0.000 0.000 0.466 122 M N -0.305 119.142 119.600 -0.256 0.000 2.254 122 M HA -0.018 4.442 4.480 -0.034 0.000 0.265 122 M C 2.162 178.364 176.300 -0.163 0.000 1.066 122 M CA 1.033 56.144 55.300 -0.316 0.000 1.123 122 M CB -0.533 31.679 32.600 -0.645 0.000 1.388 122 M HN 0.221 8.511 8.290 0.000 0.000 0.425 123 I N -0.049 120.453 120.570 -0.114 0.000 2.252 123 I HA -0.291 3.859 4.170 -0.034 0.000 0.245 123 I C 2.335 178.421 176.117 -0.051 0.000 1.102 123 I CA 1.110 62.375 61.300 -0.059 0.000 1.385 123 I CB -0.398 37.579 38.000 -0.039 0.000 1.064 123 I HN 0.282 8.492 8.210 0.000 0.000 0.414 124 K N 1.016 121.382 120.400 -0.058 0.000 2.097 124 K HA -0.111 4.189 4.320 -0.034 0.000 0.206 124 K C 1.980 178.554 176.600 -0.043 0.000 1.049 124 K CA 1.484 57.744 56.287 -0.045 0.000 0.933 124 K CB -0.213 32.260 32.500 -0.045 0.000 0.717 124 K HN 0.305 8.555 8.250 0.000 0.000 0.442 125 A N 1.231 124.015 122.820 -0.060 0.000 2.235 125 A HA -0.062 4.237 4.320 -0.034 0.000 0.208 125 A C 0.416 177.982 177.584 -0.031 0.000 1.172 125 A CA 0.457 52.465 52.037 -0.048 0.000 0.786 125 A CB -0.477 18.480 19.000 -0.071 0.000 0.804 125 A HN 0.534 8.684 8.150 0.000 0.000 0.479 126 N N -1.843 116.838 118.700 -0.031 0.000 2.754 126 N HA -0.137 4.582 4.740 -0.034 0.000 0.248 126 N C -0.878 174.630 175.510 -0.003 0.000 1.093 126 N CA 0.832 53.871 53.050 -0.018 0.000 0.699 126 N CB -1.421 37.059 38.487 -0.011 0.000 1.016 126 N HN 0.171 8.551 8.380 0.000 0.000 0.552 127 V N 1.251 121.161 119.914 -0.007 0.000 2.435 127 V HA 0.543 4.642 4.120 -0.034 0.000 0.290 127 V C -1.746 174.380 176.094 0.053 0.000 1.030 127 V CA -1.340 60.989 62.300 0.049 0.000 0.881 127 V CB 1.755 33.598 31.823 0.034 0.000 0.983 127 V HN 0.088 8.278 8.190 0.000 0.000 0.445 128 P HA 0.252 4.672 4.420 0.000 0.000 0.271 128 P C -0.724 176.721 177.300 0.243 0.000 1.216 128 P CA 0.166 63.308 63.100 0.069 0.000 0.776 128 P CB 1.391 32.999 31.700 -0.152 0.000 0.881 129 V N 0.652 120.726 119.914 0.266 0.000 3.074 129 V HA 0.483 4.583 4.120 -0.034 0.000 0.314 129 V C -0.094 176.172 176.094 0.286 0.000 1.117 129 V CA -1.185 61.309 62.300 0.323 0.000 1.014 129 V CB 1.714 33.666 31.823 0.214 0.000 1.057 129 V HN 0.228 8.418 8.190 0.000 0.000 0.438 130 V N 2.945 122.959 119.914 0.166 0.000 2.585 130 V HA 0.234 4.333 4.120 -0.034 0.000 0.296 130 V C -1.945 174.117 176.094 -0.054 0.000 1.035 130 V CA -0.812 61.428 62.300 -0.100 0.000 1.084 130 V CB 0.326 32.074 31.823 -0.124 0.000 0.953 130 V HN 0.915 9.105 8.190 0.000 0.000 0.483 131 P HA 0.360 4.780 4.420 0.000 0.000 0.265 131 P C 0.360 177.644 177.300 -0.027 0.000 1.187 131 P CA 0.710 63.773 63.100 -0.063 0.000 0.766 131 P CB 0.591 32.231 31.700 -0.101 0.000 0.820 132 G N 0.743 109.548 108.800 0.008 0.000 2.364 132 G HA2 0.403 4.342 3.960 -0.034 0.000 0.286 132 G HA3 0.403 4.342 3.960 -0.034 0.000 0.286 132 G C -0.921 174.005 174.900 0.044 0.000 1.241 132 G CA -0.302 44.818 45.100 0.033 0.000 0.887 132 G HN 0.549 8.839 8.290 0.000 0.000 0.484 133 S N -0.381 115.364 115.700 0.075 0.000 2.592 133 S HA 0.475 4.925 4.470 -0.034 0.000 0.271 133 S C -0.588 174.051 174.600 0.065 0.000 1.326 133 S CA -0.211 58.031 58.200 0.070 0.000 1.024 133 S CB 1.777 65.034 63.200 0.095 0.000 0.921 133 S HN 0.528 8.838 8.310 0.000 0.000 0.527 134 D N 1.252 121.676 120.400 0.041 0.000 2.411 134 D HA 0.485 5.105 4.640 -0.034 0.000 0.225 134 D C 0.987 177.301 176.300 0.024 0.000 1.156 134 D CA 1.362 55.375 54.000 0.022 0.000 0.874 134 D CB 0.034 40.841 40.800 0.012 0.000 1.034 134 D HN 1.019 9.389 8.370 0.000 0.000 0.502 135 G N 2.754 111.560 108.800 0.010 0.000 2.584 135 G HA2 -0.220 3.720 3.960 -0.034 0.000 0.229 135 G HA3 -0.220 3.720 3.960 -0.034 0.000 0.229 135 G C -0.316 174.625 174.900 0.068 0.000 1.320 135 G CA -0.330 44.776 45.100 0.011 0.000 0.891 135 G HN 0.539 8.829 8.290 0.000 0.000 0.573 136 L N 0.109 121.377 121.223 0.075 0.000 2.439 136 L HA 0.565 4.885 4.340 -0.034 0.000 0.261 136 L C 1.032 177.978 176.870 0.126 0.000 1.153 136 L CA -0.482 54.428 54.840 0.116 0.000 0.808 136 L CB 1.018 43.135 42.059 0.096 0.000 1.126 136 L HN 0.549 8.779 8.230 0.000 0.000 0.460 137 M N 1.780 121.482 119.600 0.170 0.000 2.113 137 M HA 0.175 4.634 4.480 -0.034 0.000 0.352 137 M C 1.008 177.453 176.300 0.243 0.000 1.170 137 M CA -0.259 55.165 55.300 0.208 0.000 1.053 137 M CB 1.547 34.335 32.600 0.313 0.000 1.601 137 M HN 0.505 8.795 8.290 0.000 0.000 0.459 138 K N 2.003 122.496 120.400 0.155 0.000 2.044 138 K HA -0.143 4.157 4.320 -0.034 0.000 0.210 138 K C -0.024 176.675 176.600 0.164 0.000 1.049 138 K CA 1.606 57.972 56.287 0.132 0.000 0.927 138 K CB 0.369 32.910 32.500 0.068 0.000 0.713 138 K HN 0.645 8.895 8.250 0.000 0.000 0.443 139 D N -1.539 118.904 120.400 0.072 0.000 2.596 139 D HA -0.002 4.617 4.640 -0.034 0.000 0.234 139 D C 0.225 176.125 176.300 -0.667 0.000 1.181 139 D CA -0.287 53.604 54.000 -0.181 0.000 0.856 139 D CB 2.239 42.965 40.800 -0.123 0.000 1.498 139 D HN -0.094 8.276 8.370 0.000 0.000 0.446 140 V N 1.917 121.188 119.914 -1.072 0.000 2.380 140 V HA -0.238 3.861 4.120 -0.034 0.000 0.251 140 V C 1.804 177.651 176.094 -0.412 0.000 1.063 140 V CA 2.608 64.305 62.300 -1.004 0.000 1.055 140 V CB -0.139 31.309 31.823 -0.624 0.000 0.657 140 V HN 0.568 8.758 8.190 0.000 0.000 0.455 141 S N -0.426 115.116 115.700 -0.263 0.000 2.359 141 S HA -0.280 4.169 4.470 -0.034 0.000 0.224 141 S C 1.886 176.429 174.600 -0.095 0.000 1.035 141 S CA 2.048 60.168 58.200 -0.132 0.000 1.018 141 S CB -0.388 62.757 63.200 -0.091 0.000 0.876 141 S HN 0.851 9.161 8.310 0.000 0.000 0.448 142 E N 1.042 121.186 120.200 -0.094 0.000 2.106 142 E HA -0.088 4.241 4.350 -0.034 0.000 0.192 142 E C 2.042 178.640 176.600 -0.003 0.000 0.984 142 E CA 0.922 57.306 56.400 -0.027 0.000 0.806 142 E CB -0.261 29.446 29.700 0.011 0.000 0.750 142 E HN 0.466 8.826 8.360 0.000 0.000 0.458 143 A N 1.631 124.438 122.820 -0.021 0.000 1.877 143 A HA -0.233 4.067 4.320 -0.034 0.000 0.216 143 A C 2.135 179.729 177.584 0.017 0.000 1.186 143 A CA 1.797 53.870 52.037 0.060 0.000 0.620 143 A CB -0.592 18.500 19.000 0.154 0.000 0.822 143 A HN 0.264 8.414 8.150 0.000 0.000 0.443 144 K N -0.139 120.255 120.400 -0.009 0.000 2.032 144 K HA -0.273 4.027 4.320 -0.034 0.000 0.209 144 K C 2.121 178.728 176.600 0.013 0.000 1.048 144 K CA 2.077 58.380 56.287 0.028 0.000 0.927 144 K CB -0.156 32.350 32.500 0.011 0.000 0.712 144 K HN 0.287 8.537 8.250 0.000 0.000 0.441 145 K N 1.252 121.649 120.400 -0.005 0.000 2.025 145 K HA -0.069 4.230 4.320 -0.034 0.000 0.207 145 K C 1.873 178.462 176.600 -0.020 0.000 1.049 145 K CA 1.614 57.897 56.287 -0.006 0.000 0.933 145 K CB -0.320 32.176 32.500 -0.005 0.000 0.714 145 K HN 0.294 8.544 8.250 0.000 0.000 0.438 146 I N 0.777 121.335 120.570 -0.021 0.000 2.226 146 I HA -0.202 3.948 4.170 -0.034 0.000 0.245 146 I C 2.305 178.366 176.117 -0.094 0.000 1.100 146 I CA 1.264 62.544 61.300 -0.033 0.000 1.374 146 I CB -0.424 37.574 38.000 -0.004 0.000 1.057 146 I HN 0.258 8.468 8.210 0.000 0.000 0.413 147 A N 0.251 122.981 122.820 -0.149 0.000 2.019 147 A HA -0.216 4.084 4.320 -0.034 0.000 0.219 147 A C 2.368 179.700 177.584 -0.421 0.000 1.164 147 A CA 1.518 53.325 52.037 -0.384 0.000 0.644 147 A CB -0.433 18.252 19.000 -0.525 0.000 0.805 147 A HN 0.320 8.470 8.150 0.000 0.000 0.449 148 K N -0.471 119.829 120.400 -0.167 0.000 2.103 148 K HA -0.095 4.205 4.320 -0.034 0.000 0.204 148 K C 2.134 178.704 176.600 -0.050 0.000 1.052 148 K CA 1.482 57.740 56.287 -0.047 0.000 0.945 148 K CB -0.093 32.422 32.500 0.026 0.000 0.722 148 K HN 0.433 8.683 8.250 0.000 0.000 0.443 149 K N 0.805 121.172 120.400 -0.056 0.000 2.057 149 K HA -0.051 4.249 4.320 -0.034 0.000 0.206 149 K C 1.883 178.451 176.600 -0.053 0.000 1.050 149 K CA 1.140 57.403 56.287 -0.040 0.000 0.935 149 K CB 0.028 32.511 32.500 -0.029 0.000 0.715 149 K HN 0.063 8.313 8.250 0.000 0.000 0.439 150 I N 0.331 120.849 120.570 -0.087 0.000 2.439 150 I HA -0.026 4.123 4.170 -0.034 0.000 0.251 150 I C 0.718 176.782 176.117 -0.088 0.000 1.139 150 I CA 0.640 61.887 61.300 -0.088 0.000 1.438 150 I CB -0.320 37.615 38.000 -0.108 0.000 1.085 150 I HN 0.420 8.630 8.210 0.000 0.000 0.427 151 G N 0.342 109.069 108.800 -0.123 0.000 3.019 151 G HA2 -0.231 3.708 3.960 -0.034 0.000 0.686 151 G HA3 -0.231 3.708 3.960 -0.034 0.000 0.686 151 G C -0.630 174.211 174.900 -0.097 0.000 1.056 151 G CA -0.943 44.117 45.100 -0.066 0.000 0.774 151 G HN 0.091 8.381 8.290 0.000 0.000 0.583 152 Y N 2.569 122.886 120.300 0.029 0.000 2.480 152 Y HA 0.411 4.940 4.550 -0.036 0.000 0.338 152 Y C -0.653 175.281 175.900 0.056 0.000 1.220 152 Y CA -0.409 57.715 58.100 0.041 0.000 1.430 152 Y CB 0.498 38.977 38.460 0.031 0.000 1.311 152 Y HN 0.544 8.824 8.280 0.000 0.000 0.575 153 P HA 0.273 4.693 4.420 0.000 0.000 0.282 153 P C -1.038 176.385 177.300 0.205 0.000 1.249 153 P CA -0.342 62.933 63.100 0.292 0.000 0.806 153 P CB 1.549 33.437 31.700 0.313 0.000 0.984 154 V N 0.506 120.511 119.914 0.151 0.000 3.113 154 V HA 0.695 4.794 4.120 -0.034 0.000 0.316 154 V C -0.454 175.661 176.094 0.036 0.000 1.125 154 V CA -1.183 61.152 62.300 0.058 0.000 1.026 154 V CB 2.101 33.877 31.823 -0.079 0.000 1.080 154 V HN 0.533 8.723 8.190 0.000 0.000 0.444 155 I N 1.849 122.428 120.570 0.015 0.000 2.478 155 I HA 0.565 4.714 4.170 -0.034 0.000 0.287 155 I C -1.024 175.027 176.117 -0.110 0.000 1.042 155 I CA -0.885 60.384 61.300 -0.052 0.000 1.067 155 I CB 1.504 39.540 38.000 0.060 0.000 1.233 155 I HN 0.838 9.048 8.210 0.000 0.000 0.431 156 I N 8.280 128.774 120.570 -0.126 0.000 2.342 156 I HA 0.336 4.485 4.170 -0.034 0.000 0.291 156 I C -0.763 175.209 176.117 -0.241 0.000 1.010 156 I CA -0.196 60.999 61.300 -0.176 0.000 1.308 156 I CB 0.288 38.218 38.000 -0.117 0.000 1.400 156 I HN 0.538 8.748 8.210 0.000 0.000 0.488 157 K N 6.449 126.606 120.400 -0.404 0.000 2.397 157 K HA 0.599 4.899 4.320 -0.034 0.000 0.253 157 K C -0.726 175.706 176.600 -0.279 0.000 0.932 157 K CA -0.803 55.239 56.287 -0.408 0.000 0.795 157 K CB 1.994 34.085 32.500 -0.683 0.000 1.159 157 K HN 0.622 8.872 8.250 0.000 0.000 0.424 158 A N 1.603 124.383 122.820 -0.066 0.000 2.520 158 A HA 0.031 4.331 4.320 -0.034 0.000 0.245 158 A C 1.228 178.892 177.584 0.134 0.000 1.072 158 A CA 0.207 52.277 52.037 0.055 0.000 0.761 158 A CB 0.493 19.592 19.000 0.165 0.000 1.004 158 A HN 0.831 8.981 8.150 0.000 0.000 0.499 159 T N 1.710 116.379 114.554 0.191 0.000 2.904 159 T HA 0.045 4.374 4.350 -0.034 0.000 0.267 159 T C 1.503 176.211 174.700 0.013 0.000 1.059 159 T CA 1.737 63.950 62.100 0.189 0.000 1.137 159 T CB -0.253 68.685 68.868 0.117 0.000 0.879 159 T HN 0.898 9.138 8.240 0.000 0.000 0.467 160 A N 0.568 123.350 122.820 -0.063 0.000 2.327 160 A HA 0.557 4.857 4.320 -0.034 0.000 0.228 160 A C 1.161 178.342 177.584 -0.672 0.000 1.275 160 A CA 0.067 51.973 52.037 -0.219 0.000 0.875 160 A CB -0.601 18.344 19.000 -0.092 0.000 0.925 160 A HN 0.513 8.663 8.150 0.000 0.000 0.493 161 G N -0.564 107.904 108.800 -0.554 0.000 2.406 161 G HA2 0.486 4.425 3.960 -0.034 0.000 0.251 161 G HA3 0.486 4.425 3.960 -0.034 0.000 0.251 161 G C 0.179 174.779 174.900 -0.501 0.000 1.271 161 G CA 0.400 45.047 45.100 -0.754 0.000 0.859 161 G HN 0.766 9.056 8.290 0.000 0.000 0.540 162 G N -1.142 107.385 108.800 -0.456 0.000 2.708 162 G HA2 0.609 4.548 3.960 -0.034 0.000 0.289 162 G HA3 0.609 4.548 3.960 -0.034 0.000 0.289 162 G C 0.673 175.609 174.900 0.061 0.000 1.416 162 G CA 0.073 45.104 45.100 -0.115 0.000 0.829 162 G HN 1.822 10.112 8.290 0.000 0.000 0.480 163 G N -1.303 107.527 108.800 0.049 0.000 2.212 163 G HA2 0.177 4.117 3.960 -0.034 0.000 0.267 163 G HA3 0.177 4.117 3.960 -0.034 0.000 0.267 163 G C 1.675 176.615 174.900 0.067 0.000 1.002 163 G CA 1.561 46.696 45.100 0.058 0.000 0.729 163 G HN 2.693 10.983 8.290 0.000 0.000 0.517 164 G N -1.492 107.350 108.800 0.068 0.000 2.155 164 G HA2 -0.288 3.651 3.960 -0.034 0.000 0.257 164 G HA3 -0.288 3.651 3.960 -0.034 0.000 0.257 164 G C 0.335 175.287 174.900 0.086 0.000 0.983 164 G CA 1.195 46.333 45.100 0.063 0.000 0.676 164 G HN 1.060 9.350 8.290 0.000 0.000 0.528 165 K N -0.229 120.267 120.400 0.161 0.000 2.118 165 K HA 0.554 4.853 4.320 -0.034 0.000 0.267 165 K C 1.119 177.862 176.600 0.237 0.000 0.991 165 K CA -0.235 56.155 56.287 0.171 0.000 0.916 165 K CB 1.501 34.097 32.500 0.161 0.000 1.041 165 K HN 1.257 9.507 8.250 0.000 0.000 0.455 166 G N 1.962 110.839 108.800 0.128 0.000 2.204 166 G HA2 -0.212 3.727 3.960 -0.034 0.000 0.244 166 G HA3 -0.212 3.727 3.960 -0.034 0.000 0.244 166 G C -0.246 174.673 174.900 0.032 0.000 1.062 166 G CA -0.385 44.783 45.100 0.113 0.000 0.798 166 G HN 0.523 8.813 8.290 0.000 0.000 0.496 167 I N -0.060 120.511 120.570 0.002 0.000 2.512 167 I HA 0.609 4.759 4.170 -0.034 0.000 0.287 167 I C 0.121 176.205 176.117 -0.055 0.000 1.069 167 I CA -1.021 60.255 61.300 -0.040 0.000 1.056 167 I CB 1.992 39.984 38.000 -0.013 0.000 1.229 167 I HN 0.395 8.605 8.210 0.000 0.000 0.429 168 R N 4.249 124.697 120.500 -0.088 0.000 2.643 168 R HA 0.726 5.046 4.340 -0.034 0.000 0.269 168 R C -1.724 174.482 176.300 -0.157 0.000 1.037 168 R CA -0.936 55.098 56.100 -0.110 0.000 0.894 168 R CB 1.747 31.999 30.300 -0.079 0.000 1.238 168 R HN 0.194 8.464 8.270 0.000 0.000 0.459 169 V N 1.162 120.926 119.914 -0.251 0.000 2.649 169 V HA 0.583 4.682 4.120 -0.034 0.000 0.292 169 V C 0.223 176.219 176.094 -0.164 0.000 1.055 169 V CA -0.271 61.813 62.300 -0.360 0.000 1.023 169 V CB 1.257 32.654 31.823 -0.709 0.000 0.992 169 V HN 0.915 9.105 8.190 0.000 0.000 0.480 170 A N 4.584 127.366 122.820 -0.065 0.000 2.311 170 A HA 0.599 4.898 4.320 -0.034 0.000 0.306 170 A C 0.624 178.294 177.584 0.144 0.000 1.189 170 A CA -0.641 51.432 52.037 0.060 0.000 0.791 170 A CB 0.859 19.962 19.000 0.171 0.000 1.172 170 A HN 0.852 9.002 8.150 0.000 0.000 0.481 171 R N 0.736 121.258 120.500 0.036 0.000 2.254 171 R HA 0.125 4.444 4.340 -0.034 0.000 0.195 171 R C -0.495 175.673 176.300 -0.219 0.000 0.957 171 R CA 1.028 57.143 56.100 0.025 0.000 1.024 171 R CB 0.293 30.590 30.300 -0.004 0.000 0.952 171 R HN 0.923 9.193 8.270 0.000 0.000 0.484 172 D N -2.068 118.091 120.400 -0.402 0.000 2.643 172 D HA -0.019 4.600 4.640 -0.034 0.000 0.283 172 D C 0.350 176.280 176.300 -0.617 0.000 1.242 172 D CA -0.749 52.766 54.000 -0.808 0.000 0.863 172 D CB 0.534 41.094 40.800 -0.400 0.000 1.382 172 D HN -0.225 8.145 8.370 0.000 0.000 0.444 173 E N 0.572 120.462 120.200 -0.518 0.000 2.048 173 E HA -0.305 4.024 4.350 -0.034 0.000 0.202 173 E C 1.640 178.211 176.600 -0.048 0.000 1.021 173 E CA 2.307 58.633 56.400 -0.123 0.000 0.825 173 E CB -0.004 29.656 29.700 -0.067 0.000 0.756 173 E HN 0.464 8.824 8.360 0.000 0.000 0.454 174 K N -0.049 120.306 120.400 -0.076 0.000 2.097 174 K HA -0.208 4.092 4.320 -0.034 0.000 0.206 174 K C 2.103 178.691 176.600 -0.019 0.000 1.049 174 K CA 1.702 57.966 56.287 -0.038 0.000 0.933 174 K CB -0.081 32.392 32.500 -0.044 0.000 0.717 174 K HN 0.255 8.505 8.250 0.000 0.000 0.442 175 E N 0.544 120.723 120.200 -0.036 0.000 2.051 175 E HA -0.224 4.106 4.350 -0.034 0.000 0.192 175 E C 2.046 178.670 176.600 0.041 0.000 0.991 175 E CA 1.094 57.489 56.400 -0.009 0.000 0.799 175 E CB -0.157 29.526 29.700 -0.028 0.000 0.748 175 E HN 0.187 8.547 8.360 0.000 0.000 0.449 176 L N 1.917 123.191 121.223 0.085 0.000 2.042 176 L HA -0.200 4.119 4.340 -0.034 0.000 0.210 176 L C 1.946 178.901 176.870 0.142 0.000 1.076 176 L CA 1.808 56.742 54.840 0.157 0.000 0.749 176 L CB -0.311 41.904 42.059 0.260 0.000 0.893 176 L HN 0.062 8.292 8.230 0.000 0.000 0.432 177 E N -1.199 119.050 120.200 0.083 0.000 2.085 177 E HA -0.209 4.120 4.350 -0.034 0.000 0.194 177 E C 1.868 178.517 176.600 0.082 0.000 0.994 177 E CA 1.904 58.336 56.400 0.054 0.000 0.801 177 E CB -0.316 29.392 29.700 0.014 0.000 0.743 177 E HN 0.593 8.953 8.360 0.000 0.000 0.453 178 T N 0.109 114.701 114.554 0.063 0.000 2.812 178 T HA -0.056 4.273 4.350 -0.034 0.000 0.264 178 T C 2.024 176.767 174.700 0.071 0.000 1.042 178 T CA 1.016 63.149 62.100 0.054 0.000 1.140 178 T CB -0.513 68.369 68.868 0.024 0.000 0.870 178 T HN 0.333 8.573 8.240 0.000 0.000 0.445 179 G N 0.602 109.446 108.800 0.073 0.000 2.422 179 G HA2 -0.165 3.774 3.960 -0.034 0.000 0.218 179 G HA3 -0.165 3.774 3.960 -0.034 0.000 0.218 179 G C 1.329 176.278 174.900 0.082 0.000 1.146 179 G CA 0.259 45.392 45.100 0.055 0.000 0.769 179 G HN 0.450 8.740 8.290 0.000 0.000 0.547 180 F N 1.746 121.698 119.950 0.002 0.000 2.095 180 F HA -0.076 4.432 4.527 -0.032 0.000 0.298 180 F C 2.966 178.771 175.800 0.008 0.000 1.104 180 F CA 1.770 59.774 58.000 0.006 0.000 1.232 180 F CB 0.084 39.092 39.000 0.014 0.000 0.987 180 F HN 0.021 8.321 8.300 0.000 0.000 0.475 181 R N -0.435 120.235 120.500 0.283 0.000 2.093 181 R HA -0.073 4.247 4.340 -0.034 0.000 0.224 181 R C 2.181 178.521 176.300 0.065 0.000 1.101 181 R CA 1.614 57.828 56.100 0.189 0.000 0.979 181 R CB -0.559 29.830 30.300 0.148 0.000 0.877 181 R HN 0.368 8.638 8.270 0.000 0.000 0.441 182 M N 0.397 120.020 119.600 0.039 0.000 2.175 182 M HA -0.085 4.374 4.480 -0.034 0.000 0.264 182 M C 1.913 178.196 176.300 -0.028 0.000 1.063 182 M CA 1.691 56.992 55.300 0.002 0.000 1.119 182 M CB -0.279 32.320 32.600 -0.001 0.000 1.377 182 M HN 0.092 8.382 8.290 0.000 0.000 0.415 183 T N -0.471 114.051 114.554 -0.054 0.000 2.942 183 T HA -0.127 4.202 4.350 -0.034 0.000 0.265 183 T C 1.610 176.250 174.700 -0.100 0.000 1.062 183 T CA 1.272 63.322 62.100 -0.085 0.000 1.139 183 T CB -0.175 68.617 68.868 -0.127 0.000 0.883 183 T HN 0.459 8.699 8.240 0.000 0.000 0.468 184 E N 1.172 121.288 120.200 -0.139 0.000 2.072 184 E HA -0.180 4.150 4.350 -0.034 0.000 0.191 184 E C 2.281 178.859 176.600 -0.037 0.000 0.985 184 E CA 1.073 57.408 56.400 -0.109 0.000 0.801 184 E CB -0.022 29.622 29.700 -0.095 0.000 0.750 184 E HN 0.491 8.851 8.360 0.000 0.000 0.452 185 Q N 0.263 120.048 119.800 -0.024 0.000 2.020 185 Q HA -0.230 4.089 4.340 -0.034 0.000 0.202 185 Q C 2.174 178.144 176.000 -0.051 0.000 0.982 185 Q CA 1.905 57.695 55.803 -0.022 0.000 0.838 185 Q CB -0.114 28.617 28.738 -0.012 0.000 0.899 185 Q HN 0.376 8.646 8.270 0.000 0.000 0.423 186 E N 0.076 120.238 120.200 -0.064 0.000 2.077 186 E HA -0.222 4.107 4.350 -0.034 0.000 0.193 186 E C 1.776 178.265 176.600 -0.185 0.000 0.989 186 E CA 1.162 57.497 56.400 -0.107 0.000 0.800 186 E CB -0.125 29.526 29.700 -0.081 0.000 0.746 186 E HN 0.344 8.704 8.360 0.000 0.000 0.452 187 A N 0.553 123.319 122.820 -0.090 0.000 1.929 187 A HA -0.187 4.112 4.320 -0.034 0.000 0.216 187 A C 2.142 179.714 177.584 -0.021 0.000 1.176 187 A CA 1.469 53.504 52.037 -0.004 0.000 0.628 187 A CB -0.545 18.590 19.000 0.224 0.000 0.816 187 A HN 0.362 8.512 8.150 0.000 0.000 0.444 188 Q N -0.047 119.742 119.800 -0.018 0.000 2.002 188 Q HA -0.138 4.182 4.340 -0.034 0.000 0.204 188 Q C 2.008 177.973 176.000 -0.060 0.000 0.988 188 Q CA 2.852 58.652 55.803 -0.005 0.000 0.843 188 Q CB -1.153 27.586 28.738 0.001 0.000 0.908 188 Q HN 0.487 8.757 8.270 0.000 0.000 0.420 189 T N 0.530 115.021 114.554 -0.105 0.000 2.607 189 T HA -0.205 4.125 4.350 -0.034 0.000 0.267 189 T C 1.706 176.285 174.700 -0.202 0.000 1.049 189 T CA 2.002 64.028 62.100 -0.122 0.000 1.162 189 T CB -0.838 67.960 68.868 -0.117 0.000 0.863 189 T HN 0.517 8.757 8.240 0.000 0.000 0.424 190 A N 0.161 122.726 122.820 -0.425 0.000 1.933 190 A HA 0.068 4.367 4.320 -0.034 0.000 0.218 190 A C 1.703 178.962 177.584 -0.542 0.000 1.175 190 A CA 1.359 52.977 52.037 -0.699 0.000 0.628 190 A CB -0.574 17.585 19.000 -1.402 0.000 0.814 190 A HN 0.635 8.785 8.150 0.000 0.000 0.444 191 F N -2.389 117.576 119.950 0.025 0.000 2.767 191 F HA 0.392 4.897 4.527 -0.037 0.000 0.323 191 F C 1.670 177.488 175.800 0.031 0.000 1.091 191 F CA 0.212 58.231 58.000 0.031 0.000 1.192 191 F CB 0.431 39.450 39.000 0.031 0.000 1.056 191 F HN 0.320 8.620 8.300 0.000 0.000 0.571 192 G N 1.797 110.674 108.800 0.128 0.000 2.168 192 G HA2 -0.341 3.599 3.960 -0.034 0.000 0.257 192 G HA3 -0.341 3.599 3.960 -0.034 0.000 0.257 192 G C -0.261 174.705 174.900 0.110 0.000 0.997 192 G CA 0.453 45.610 45.100 0.094 0.000 0.708 192 G HN 0.395 8.685 8.290 0.000 0.000 0.520 193 N N -0.327 118.469 118.700 0.160 0.000 2.519 193 N HA 0.495 5.215 4.740 -0.034 0.000 0.286 193 N C 0.991 176.587 175.510 0.142 0.000 1.079 193 N CA 0.288 53.420 53.050 0.137 0.000 0.878 193 N CB 0.989 39.555 38.487 0.132 0.000 1.375 193 N HN 0.249 8.629 8.380 0.000 0.000 0.514 194 G N 0.975 109.827 108.800 0.087 0.000 2.985 194 G HA2 0.132 4.072 3.960 -0.034 0.000 0.209 194 G HA3 0.132 4.072 3.960 -0.034 0.000 0.209 194 G C 0.648 175.566 174.900 0.030 0.000 1.165 194 G CA -0.056 45.078 45.100 0.056 0.000 0.776 194 G HN 0.554 8.844 8.290 0.000 0.000 0.541 195 G N 0.345 109.177 108.800 0.053 0.000 2.361 195 G HA2 0.463 4.402 3.960 -0.034 0.000 0.260 195 G HA3 0.463 4.402 3.960 -0.034 0.000 0.260 195 G C -0.370 174.552 174.900 0.036 0.000 1.261 195 G CA -0.237 44.890 45.100 0.046 0.000 0.897 195 G HN 0.263 8.553 8.290 0.000 0.000 0.499 196 L N 1.744 122.955 121.223 -0.020 0.000 2.334 196 L HA 0.620 4.939 4.340 -0.034 0.000 0.273 196 L C -0.230 176.700 176.870 0.099 0.000 1.013 196 L CA -1.277 53.533 54.840 -0.051 0.000 0.816 196 L CB 1.891 43.760 42.059 -0.317 0.000 1.278 196 L HN 0.728 8.958 8.230 0.000 0.000 0.431 197 Y N 0.433 120.714 120.300 -0.033 0.000 2.662 197 Y HA 0.846 5.377 4.550 -0.033 0.000 0.335 197 Y C -0.750 175.150 175.900 0.000 0.000 1.066 197 Y CA -1.639 56.461 58.100 -0.000 0.000 1.116 197 Y CB 1.741 40.206 38.460 0.008 0.000 1.308 197 Y HN 0.531 8.811 8.280 0.000 0.000 0.502 198 M N 1.588 121.215 119.600 0.045 0.000 2.457 198 M HA 0.516 4.976 4.480 -0.034 0.000 0.300 198 M C -2.003 174.307 176.300 0.018 0.000 1.141 198 M CA -0.217 55.054 55.300 -0.048 0.000 0.901 198 M CB 2.494 35.099 32.600 0.008 0.000 1.687 198 M HN 0.979 9.269 8.290 0.000 0.000 0.449 199 E N 1.788 121.966 120.200 -0.036 0.000 2.392 199 E HA 0.378 4.708 4.350 -0.034 0.000 0.269 199 E C -1.667 174.921 176.600 -0.020 0.000 0.924 199 E CA -1.177 55.220 56.400 -0.005 0.000 0.784 199 E CB 2.251 31.953 29.700 0.002 0.000 1.292 199 E HN 0.464 8.824 8.360 0.000 0.000 0.447 200 K N 1.126 121.498 120.400 -0.047 0.000 2.451 200 K HA 0.044 4.343 4.320 -0.034 0.000 0.280 200 K C -1.006 175.603 176.600 0.014 0.000 1.020 200 K CA 0.032 56.295 56.287 -0.038 0.000 1.008 200 K CB 0.135 32.572 32.500 -0.105 0.000 0.917 200 K HN 0.358 8.608 8.250 0.000 0.000 0.478 201 F N 7.196 127.106 119.950 -0.065 0.000 2.434 201 F HA 0.272 4.778 4.527 -0.035 0.000 0.358 201 F C -0.408 175.381 175.800 -0.019 0.000 1.136 201 F CA -1.072 56.907 58.000 -0.035 0.000 1.157 201 F CB 0.107 39.116 39.000 0.015 0.000 1.167 201 F HN 0.321 8.621 8.300 0.000 0.000 0.539 202 I N 6.882 127.135 120.570 -0.528 0.000 2.452 202 I HA 0.056 4.206 4.170 -0.034 0.000 0.287 202 I C 1.072 176.913 176.117 -0.460 0.000 1.079 202 I CA 0.307 61.346 61.300 -0.434 0.000 1.387 202 I CB 0.862 38.593 38.000 -0.449 0.000 1.404 202 I HN 0.690 8.900 8.210 0.000 0.000 0.522 203 E N 3.719 123.783 120.200 -0.226 0.000 2.307 203 E HA -0.020 4.310 4.350 -0.034 0.000 0.195 203 E C 0.266 176.890 176.600 0.041 0.000 0.975 203 E CA 0.347 56.665 56.400 -0.136 0.000 0.878 203 E CB 0.349 30.035 29.700 -0.024 0.000 0.845 203 E HN 0.455 8.815 8.360 0.000 0.000 0.488 204 N N 0.723 119.482 118.700 0.099 0.000 2.800 204 N HA 0.162 4.881 4.740 -0.034 0.000 0.240 204 N C -1.435 174.195 175.510 0.200 0.000 1.096 204 N CA -0.432 52.681 53.050 0.105 0.000 0.877 204 N CB 0.018 38.550 38.487 0.074 0.000 1.138 204 N HN -0.034 8.346 8.380 0.000 0.000 0.509 205 F N -0.200 119.768 119.950 0.030 0.000 2.692 205 F HA 0.704 5.209 4.527 -0.037 0.000 0.320 205 F C -0.893 174.983 175.800 0.127 0.000 1.123 205 F CA -1.367 56.676 58.000 0.072 0.000 0.961 205 F CB 1.227 40.255 39.000 0.046 0.000 1.383 205 F HN -0.016 8.284 8.300 0.000 0.000 0.483 206 R N 0.672 121.369 120.500 0.327 0.000 2.480 206 R HA 0.326 4.646 4.340 -0.034 0.000 0.306 206 R C -1.731 174.809 176.300 0.400 0.000 0.958 206 R CA -0.779 55.444 56.100 0.203 0.000 0.861 206 R CB 0.777 31.185 30.300 0.180 0.000 1.171 206 R HN 0.903 9.173 8.270 0.000 0.000 0.445 207 H N 5.191 124.390 119.070 0.215 0.000 3.089 207 H HA 0.228 4.765 4.556 -0.031 0.000 0.262 207 H C -0.502 174.928 175.328 0.169 0.000 1.160 207 H CA -0.131 56.082 56.048 0.275 0.000 1.482 207 H CB 0.289 30.177 29.762 0.209 0.000 1.511 207 H HN 0.285 8.565 8.280 0.000 0.000 0.483 208 I N 5.953 126.591 120.570 0.113 0.000 2.362 208 I HA 0.169 4.318 4.170 -0.034 0.000 0.289 208 I C -0.058 176.113 176.117 0.090 0.000 0.994 208 I CA -0.595 60.763 61.300 0.098 0.000 1.158 208 I CB 1.144 39.156 38.000 0.021 0.000 1.315 208 I HN 0.740 8.950 8.210 0.000 0.000 0.451 209 E N 7.136 127.408 120.200 0.121 0.000 2.266 209 E HA 0.627 4.957 4.350 -0.034 0.000 0.268 209 E C -1.550 175.104 176.600 0.090 0.000 0.879 209 E CA -0.793 55.663 56.400 0.093 0.000 0.762 209 E CB 2.889 32.672 29.700 0.137 0.000 1.199 209 E HN 0.248 8.608 8.360 0.000 0.000 0.422 210 I N 2.306 122.928 120.570 0.087 0.000 2.404 210 I HA 0.177 4.327 4.170 -0.034 0.000 0.293 210 I C -0.155 175.998 176.117 0.060 0.000 0.992 210 I CA -0.785 60.562 61.300 0.079 0.000 1.149 210 I CB 1.373 39.437 38.000 0.108 0.000 1.315 210 I HN 0.722 8.932 8.210 0.000 0.000 0.446 211 Q N 4.719 124.562 119.800 0.072 0.000 2.288 211 Q HA 0.436 4.755 4.340 -0.034 0.000 0.258 211 Q C -1.273 174.786 176.000 0.098 0.000 0.957 211 Q CA 0.123 55.969 55.803 0.073 0.000 0.919 211 Q CB 0.822 29.600 28.738 0.066 0.000 1.185 211 Q HN 0.430 8.700 8.270 0.000 0.000 0.408 212 I N 4.060 124.677 120.570 0.078 0.000 2.603 212 I HA 0.523 4.672 4.170 -0.034 0.000 0.300 212 I C -1.090 175.101 176.117 0.123 0.000 1.017 212 I CA -0.821 60.536 61.300 0.095 0.000 1.098 212 I CB 2.300 40.318 38.000 0.030 0.000 1.279 212 I HN 0.492 8.702 8.210 0.000 0.000 0.437 213 V N 4.390 124.387 119.914 0.139 0.000 2.668 213 V HA 0.821 4.920 4.120 -0.034 0.000 0.304 213 V C 0.027 176.215 176.094 0.157 0.000 1.071 213 V CA -0.663 61.730 62.300 0.156 0.000 0.894 213 V CB 1.555 33.450 31.823 0.121 0.000 1.008 213 V HN 0.856 9.046 8.190 0.000 0.000 0.425 214 G N 2.294 111.199 108.800 0.175 0.000 2.473 214 G HA2 0.752 4.691 3.960 -0.034 0.000 0.321 214 G HA3 0.752 4.691 3.960 -0.034 0.000 0.321 214 G C -1.293 173.643 174.900 0.060 0.000 1.200 214 G CA -0.455 44.720 45.100 0.126 0.000 0.963 214 G HN 0.743 9.033 8.290 0.000 0.000 0.483 215 D N -1.839 118.588 120.400 0.045 0.000 2.588 215 D HA 0.348 4.968 4.640 -0.034 0.000 0.268 215 D C 1.286 177.514 176.300 -0.120 0.000 1.176 215 D CA -0.046 53.950 54.000 -0.007 0.000 1.080 215 D CB 0.822 41.674 40.800 0.086 0.000 1.186 215 D HN 0.352 8.722 8.370 0.000 0.000 0.619 216 S N -1.963 113.543 115.700 -0.324 0.000 2.701 216 S HA 0.029 4.479 4.470 -0.034 0.000 0.220 216 S C 0.049 174.241 174.600 -0.680 0.000 0.954 216 S CA -0.157 57.732 58.200 -0.518 0.000 0.936 216 S CB -0.759 62.074 63.200 -0.611 0.000 0.777 216 S HN 0.480 8.790 8.310 0.000 0.000 0.518 217 Y N 0.691 120.988 120.300 -0.005 0.000 2.682 217 Y HA 0.516 5.045 4.550 -0.034 0.000 0.251 217 Y C 1.640 177.543 175.900 0.004 0.000 1.172 217 Y CA -0.748 57.350 58.100 -0.002 0.000 1.186 217 Y CB 0.372 38.830 38.460 -0.003 0.000 1.216 217 Y HN 0.319 8.599 8.280 0.000 0.000 0.540 218 G N 0.300 109.151 108.800 0.085 0.000 2.157 218 G HA2 -0.271 3.668 3.960 -0.034 0.000 0.248 218 G HA3 -0.271 3.668 3.960 -0.034 0.000 0.248 218 G C -0.173 174.777 174.900 0.083 0.000 0.979 218 G CA -0.291 44.852 45.100 0.071 0.000 0.650 218 G HN 0.295 8.585 8.290 0.000 0.000 0.529 219 N N 0.326 119.088 118.700 0.104 0.000 2.444 219 N HA 0.476 5.196 4.740 -0.034 0.000 0.271 219 N C -0.344 175.223 175.510 0.095 0.000 1.069 219 N CA 0.088 53.196 53.050 0.096 0.000 0.965 219 N CB 2.165 40.715 38.487 0.106 0.000 1.092 219 N HN 0.132 8.512 8.380 0.000 0.000 0.476 220 V N 3.825 123.795 119.914 0.093 0.000 2.531 220 V HA 0.486 4.586 4.120 -0.034 0.000 0.301 220 V C 0.416 176.570 176.094 0.100 0.000 1.034 220 V CA -0.896 61.468 62.300 0.107 0.000 0.865 220 V CB 1.568 33.460 31.823 0.115 0.000 0.995 220 V HN 0.529 8.719 8.190 0.000 0.000 0.424 221 I N 1.987 122.615 120.570 0.097 0.000 2.863 221 I HA 0.748 4.898 4.170 -0.034 0.000 0.311 221 I C -0.507 175.667 176.117 0.096 0.000 1.026 221 I CA -0.553 60.784 61.300 0.062 0.000 1.077 221 I CB 2.309 40.327 38.000 0.029 0.000 1.262 221 I HN 0.843 9.053 8.210 0.000 0.000 0.461 222 H N 4.203 123.293 119.070 0.032 0.000 2.572 222 H HA 0.482 5.018 4.556 -0.034 0.000 0.359 222 H C -1.426 173.900 175.328 -0.004 0.000 1.134 222 H CA -1.066 54.993 56.048 0.018 0.000 1.187 222 H CB 2.413 32.184 29.762 0.016 0.000 1.597 222 H HN 0.580 8.860 8.280 0.000 0.000 0.524 223 L N 3.138 124.397 121.223 0.061 0.000 3.034 223 L HA 0.293 4.612 4.340 -0.034 0.000 0.245 223 L C 1.306 178.204 176.870 0.047 0.000 1.295 223 L CA 0.823 55.652 54.840 -0.019 0.000 1.068 223 L CB 0.230 42.266 42.059 -0.038 0.000 1.426 223 L HN 1.212 9.442 8.230 0.000 0.000 0.531 224 G N 0.274 109.200 108.800 0.211 0.000 2.642 224 G HA2 -0.171 3.769 3.960 -0.034 0.000 0.231 224 G HA3 -0.171 3.769 3.960 -0.034 0.000 0.231 224 G C -0.326 174.611 174.900 0.061 0.000 1.338 224 G CA -0.089 45.101 45.100 0.150 0.000 0.883 224 G HN 0.396 8.686 8.290 0.000 0.000 0.570 225 E N 0.411 120.610 120.200 -0.003 0.000 2.222 225 E HA 0.718 5.047 4.350 -0.034 0.000 0.267 225 E C -0.275 176.310 176.600 -0.025 0.000 0.963 225 E CA -0.850 55.539 56.400 -0.018 0.000 0.837 225 E CB 1.540 31.202 29.700 -0.062 0.000 1.183 225 E HN 0.702 9.062 8.360 0.000 0.000 0.403 226 R N 0.898 121.399 120.500 0.002 0.000 2.534 226 R HA 0.278 4.598 4.340 -0.034 0.000 0.301 226 R C -0.906 175.418 176.300 0.039 0.000 0.961 226 R CA -0.791 55.307 56.100 -0.003 0.000 0.871 226 R CB 1.420 31.725 30.300 0.008 0.000 1.170 226 R HN 0.523 8.793 8.270 0.000 0.000 0.446 227 D N 2.452 122.862 120.400 0.017 0.000 2.359 227 D HA 0.139 4.759 4.640 -0.034 0.000 0.230 227 D C -0.447 175.904 176.300 0.086 0.000 1.118 227 D CA -0.300 53.737 54.000 0.061 0.000 0.844 227 D CB 0.934 41.742 40.800 0.014 0.000 1.059 227 D HN 0.535 8.905 8.370 0.000 0.000 0.493 228 C N 3.559 122.934 119.300 0.125 0.000 2.422 228 C HA 0.191 4.631 4.460 -0.034 0.000 0.301 228 C C 1.887 176.899 174.990 0.036 0.000 1.444 228 C CA -0.451 58.571 59.018 0.007 0.000 1.771 228 C CB -1.061 26.551 27.740 -0.213 0.000 2.834 228 C HN 0.592 8.822 8.230 0.000 0.000 0.545 229 T N 0.928 115.579 114.554 0.161 0.000 2.942 229 T HA 0.058 4.388 4.350 -0.034 0.000 0.265 229 T C 0.971 175.794 174.700 0.205 0.000 1.062 229 T CA 0.875 63.091 62.100 0.194 0.000 1.139 229 T CB -0.025 68.983 68.868 0.234 0.000 0.883 229 T HN 0.342 8.582 8.240 0.000 0.000 0.468 230 I N 3.795 124.506 120.570 0.235 0.000 2.460 230 I HA 0.139 4.288 4.170 -0.034 0.000 0.297 230 I C 0.303 176.498 176.117 0.131 0.000 1.139 230 I CA 0.553 61.974 61.300 0.202 0.000 1.340 230 I CB -1.042 37.090 38.000 0.221 0.000 1.444 230 I HN 0.345 8.555 8.210 0.000 0.000 0.557 231 Q N 6.073 125.929 119.800 0.093 0.000 2.399 231 Q HA 0.687 5.006 4.340 -0.034 0.000 0.276 231 Q C -0.472 175.513 176.000 -0.026 0.000 1.098 231 Q CA -1.034 54.780 55.803 0.018 0.000 0.827 231 Q CB 3.301 32.042 28.738 0.006 0.000 1.386 231 Q HN 0.486 8.756 8.270 0.000 0.000 0.443 232 R N 0.862 121.298 120.500 -0.106 0.000 2.628 232 R HA 0.275 4.594 4.340 -0.034 0.000 0.288 232 R C -0.743 175.462 176.300 -0.157 0.000 0.980 232 R CA -0.630 55.353 56.100 -0.195 0.000 0.891 232 R CB 1.105 31.154 30.300 -0.419 0.000 1.188 232 R HN 0.703 8.973 8.270 0.000 0.000 0.450 233 R N 5.719 126.142 120.500 -0.128 0.000 2.544 233 R HA -0.295 4.024 4.340 -0.034 0.000 0.227 233 R C 0.222 176.498 176.300 -0.041 0.000 0.776 233 R CA 1.244 57.300 56.100 -0.074 0.000 0.538 233 R CB -1.463 28.785 30.300 -0.086 0.000 1.265 233 R HN 1.076 9.346 8.270 0.000 0.000 0.528 234 M N -2.572 117.024 119.600 -0.006 0.000 2.941 234 M HA -0.290 4.169 4.480 -0.034 0.000 0.191 234 M C -0.549 175.749 176.300 -0.003 0.000 0.625 234 M CA 2.132 57.447 55.300 0.025 0.000 0.732 234 M CB -0.372 32.246 32.600 0.030 0.000 2.629 234 M HN 0.658 8.948 8.290 0.000 0.000 0.283 235 Q N 1.774 121.551 119.800 -0.039 0.000 2.235 235 Q HA 0.451 4.770 4.340 -0.034 0.000 0.250 235 Q C -0.626 175.335 176.000 -0.064 0.000 0.909 235 Q CA 0.040 55.809 55.803 -0.055 0.000 0.910 235 Q CB 1.334 30.034 28.738 -0.064 0.000 1.223 235 Q HN 0.177 8.447 8.270 0.000 0.000 0.432 236 K N 2.002 122.357 120.400 -0.075 0.000 2.326 236 K HA 0.175 4.474 4.320 -0.034 0.000 0.275 236 K C 0.173 176.763 176.600 -0.017 0.000 1.018 236 K CA 0.068 56.313 56.287 -0.070 0.000 0.962 236 K CB 0.747 33.178 32.500 -0.115 0.000 0.953 236 K HN 0.544 8.794 8.250 0.000 0.000 0.475 237 L N 1.017 122.265 121.223 0.042 0.000 2.678 237 L HA 0.192 4.511 4.340 -0.034 0.000 0.211 237 L C -0.509 176.486 176.870 0.210 0.000 1.043 237 L CA 0.025 54.952 54.840 0.145 0.000 0.881 237 L CB 1.171 43.338 42.059 0.180 0.000 1.361 237 L HN 0.288 8.518 8.230 0.000 0.000 0.484 238 V N 0.790 120.803 119.914 0.165 0.000 2.531 238 V HA 0.367 4.467 4.120 -0.034 0.000 0.301 238 V C -1.271 174.839 176.094 0.027 0.000 1.034 238 V CA -0.601 61.746 62.300 0.079 0.000 0.865 238 V CB 1.878 33.801 31.823 0.167 0.000 0.995 238 V HN 0.140 8.330 8.190 0.000 0.000 0.424 239 E N 3.042 123.198 120.200 -0.072 0.000 2.256 239 E HA 0.734 5.064 4.350 -0.034 0.000 0.267 239 E C -0.900 175.646 176.600 -0.090 0.000 0.892 239 E CA -0.774 55.593 56.400 -0.055 0.000 0.775 239 E CB 2.240 31.895 29.700 -0.075 0.000 1.207 239 E HN 0.850 9.210 8.360 0.000 0.000 0.420 240 E N 0.301 120.469 120.200 -0.054 0.000 2.383 240 E HA 0.834 5.164 4.350 -0.034 0.000 0.275 240 E C -1.461 175.027 176.600 -0.186 0.000 0.918 240 E CA -1.559 54.769 56.400 -0.120 0.000 0.764 240 E CB 1.948 31.652 29.700 0.007 0.000 1.252 240 E HN 0.403 8.763 8.360 0.000 0.000 0.449 241 A N 2.352 124.973 122.820 -0.331 0.000 2.393 241 A HA 0.715 5.015 4.320 -0.034 0.000 0.306 241 A C -2.733 174.560 177.584 -0.485 0.000 1.050 241 A CA -1.715 50.142 52.037 -0.299 0.000 0.724 241 A CB 1.329 20.215 19.000 -0.191 0.000 1.248 241 A HN 0.473 8.623 8.150 0.000 0.000 0.424 242 P HA 0.212 4.632 4.420 0.000 0.000 0.275 242 P C 0.223 177.461 177.300 -0.103 0.000 1.266 242 P CA -0.357 62.659 63.100 -0.140 0.000 0.793 242 P CB 0.590 32.255 31.700 -0.058 0.000 1.074 243 S N 1.208 116.859 115.700 -0.082 0.000 2.525 243 S HA 0.106 4.556 4.470 -0.034 0.000 0.285 243 S C -1.214 173.355 174.600 -0.051 0.000 1.283 243 S CA -1.049 57.105 58.200 -0.076 0.000 1.072 243 S CB -0.560 62.557 63.200 -0.139 0.000 0.867 243 S HN 0.275 8.585 8.310 0.000 0.000 0.492 244 P HA -0.056 4.364 4.420 0.000 0.000 0.225 244 P C 0.755 177.983 177.300 -0.120 0.000 1.148 244 P CA 0.815 63.880 63.100 -0.058 0.000 0.779 244 P CB -0.288 31.336 31.700 -0.126 0.000 0.780 245 I N -4.743 115.729 120.570 -0.163 0.000 3.941 245 I HA 0.357 4.506 4.170 -0.034 0.000 0.335 245 I C 0.106 176.124 176.117 -0.164 0.000 1.402 245 I CA -0.628 60.574 61.300 -0.164 0.000 1.112 245 I CB -0.353 37.533 38.000 -0.190 0.000 1.043 245 I HN -0.292 7.918 8.210 0.000 0.000 0.395 246 L N 2.737 123.860 121.223 -0.167 0.000 2.356 246 L HA 0.570 4.890 4.340 -0.034 0.000 0.277 246 L C -0.715 176.087 176.870 -0.112 0.000 0.996 246 L CA -0.412 54.313 54.840 -0.192 0.000 0.822 246 L CB 1.274 43.176 42.059 -0.262 0.000 1.256 246 L HN 0.329 8.559 8.230 0.000 0.000 0.413 247 D N 0.881 121.231 120.400 -0.083 0.000 2.354 247 D HA 0.115 4.735 4.640 -0.034 0.000 0.247 247 D C 0.401 176.670 176.300 -0.052 0.000 1.138 247 D CA -0.395 53.575 54.000 -0.050 0.000 0.958 247 D CB 0.748 41.533 40.800 -0.026 0.000 1.144 247 D HN 0.617 8.987 8.370 0.000 0.000 0.458 248 D N -1.067 119.313 120.400 -0.034 0.000 2.348 248 D HA -0.133 4.487 4.640 -0.034 0.000 0.216 248 D C 1.417 177.701 176.300 -0.026 0.000 0.970 248 D CA 0.574 54.556 54.000 -0.029 0.000 0.889 248 D CB -0.130 40.662 40.800 -0.014 0.000 0.912 248 D HN 0.678 9.048 8.370 0.000 0.000 0.524 249 E N 0.530 120.718 120.200 -0.020 0.000 2.072 249 E HA -0.147 4.183 4.350 -0.034 0.000 0.190 249 E C 1.225 177.814 176.600 -0.019 0.000 0.982 249 E CA 1.233 57.626 56.400 -0.011 0.000 0.803 249 E CB -0.011 29.690 29.700 0.002 0.000 0.755 249 E HN 0.181 8.541 8.360 0.000 0.000 0.453 250 T N 0.714 115.251 114.554 -0.028 0.000 2.904 250 T HA -0.113 4.217 4.350 -0.034 0.000 0.267 250 T C 1.793 176.389 174.700 -0.173 0.000 1.059 250 T CA 1.147 63.217 62.100 -0.050 0.000 1.137 250 T CB -0.239 68.616 68.868 -0.021 0.000 0.879 250 T HN 0.188 8.428 8.240 0.000 0.000 0.467 251 R N 1.593 122.005 120.500 -0.148 0.000 2.091 251 R HA -0.164 4.156 4.340 -0.034 0.000 0.238 251 R C 2.576 178.777 176.300 -0.166 0.000 1.136 251 R CA 1.761 57.764 56.100 -0.161 0.000 0.959 251 R CB -0.108 30.142 30.300 -0.083 0.000 0.856 251 R HN 0.486 8.756 8.270 0.000 0.000 0.437 252 R N 0.003 120.447 120.500 -0.093 0.000 2.090 252 R HA -0.021 4.299 4.340 -0.034 0.000 0.228 252 R C 1.901 178.125 176.300 -0.126 0.000 1.110 252 R CA 1.566 57.628 56.100 -0.063 0.000 0.973 252 R CB -0.478 29.823 30.300 0.002 0.000 0.869 252 R HN 0.291 8.561 8.270 0.000 0.000 0.440 253 E N 0.692 120.821 120.200 -0.118 0.000 2.058 253 E HA -0.192 4.138 4.350 -0.034 0.000 0.194 253 E C 2.078 178.499 176.600 -0.297 0.000 0.997 253 E CA 2.078 58.428 56.400 -0.083 0.000 0.801 253 E CB -0.087 29.655 29.700 0.070 0.000 0.746 253 E HN 0.452 8.812 8.360 0.000 0.000 0.450 254 M N -0.526 118.680 119.600 -0.657 0.000 2.254 254 M HA -0.037 4.423 4.480 -0.034 0.000 0.265 254 M C 2.369 178.311 176.300 -0.598 0.000 1.066 254 M CA 1.219 55.874 55.300 -1.075 0.000 1.123 254 M CB -0.164 31.714 32.600 -1.203 0.000 1.388 254 M HN 0.143 8.433 8.290 0.000 0.000 0.425 255 G N 0.808 109.255 108.800 -0.588 0.000 2.418 255 G HA2 -0.210 3.729 3.960 -0.034 0.000 0.217 255 G HA3 -0.210 3.729 3.960 -0.034 0.000 0.217 255 G C 1.305 175.910 174.900 -0.492 0.000 1.158 255 G CA 0.873 45.387 45.100 -0.976 0.000 0.771 255 G HN 0.363 8.653 8.290 0.000 0.000 0.545 256 N N 1.350 119.904 118.700 -0.243 0.000 2.188 256 N HA -0.042 4.678 4.740 -0.034 0.000 0.184 256 N C 2.444 177.952 175.510 -0.003 0.000 1.018 256 N CA 1.189 54.211 53.050 -0.048 0.000 0.858 256 N CB -0.527 37.956 38.487 -0.006 0.000 0.989 256 N HN 0.319 8.699 8.380 0.000 0.000 0.426 257 A N 1.134 123.945 122.820 -0.015 0.000 1.877 257 A HA 0.019 4.319 4.320 -0.034 0.000 0.216 257 A C 2.386 180.089 177.584 0.198 0.000 1.186 257 A CA 1.951 54.061 52.037 0.121 0.000 0.620 257 A CB -0.892 18.214 19.000 0.176 0.000 0.822 257 A HN 0.306 8.456 8.150 0.000 0.000 0.443 258 A N -0.658 122.275 122.820 0.188 0.000 1.902 258 A HA -0.015 4.284 4.320 -0.034 0.000 0.217 258 A C 2.246 179.883 177.584 0.088 0.000 1.181 258 A CA 1.858 54.005 52.037 0.182 0.000 0.623 258 A CB -0.928 18.154 19.000 0.137 0.000 0.818 258 A HN 0.392 8.542 8.150 0.000 0.000 0.443 259 V N -0.086 119.872 119.914 0.073 0.000 2.358 259 V HA -0.245 3.855 4.120 -0.034 0.000 0.246 259 V C 2.629 178.762 176.094 0.066 0.000 1.047 259 V CA 2.095 64.449 62.300 0.089 0.000 1.035 259 V CB -0.788 31.111 31.823 0.127 0.000 0.658 259 V HN 0.512 8.702 8.190 0.000 0.000 0.452 260 R N 0.005 120.539 120.500 0.058 0.000 2.096 260 R HA -0.210 4.110 4.340 -0.034 0.000 0.240 260 R C 2.436 178.747 176.300 0.018 0.000 1.139 260 R CA 1.662 57.786 56.100 0.039 0.000 0.952 260 R CB -0.672 29.652 30.300 0.039 0.000 0.854 260 R HN 0.549 8.819 8.270 0.000 0.000 0.436 261 A N 1.137 123.966 122.820 0.015 0.000 1.883 261 A HA -0.163 4.137 4.320 -0.034 0.000 0.217 261 A C 2.382 179.944 177.584 -0.037 0.000 1.186 261 A CA 1.843 53.855 52.037 -0.043 0.000 0.624 261 A CB -0.689 18.283 19.000 -0.046 0.000 0.822 261 A HN 0.434 8.584 8.150 0.000 0.000 0.444 262 A N 0.960 123.773 122.820 -0.012 0.000 1.851 262 A HA -0.198 4.101 4.320 -0.034 0.000 0.216 262 A C 2.080 179.715 177.584 0.085 0.000 1.195 262 A CA 2.036 54.080 52.037 0.012 0.000 0.622 262 A CB -0.531 18.494 19.000 0.041 0.000 0.831 262 A HN 0.646 8.796 8.150 0.000 0.000 0.444 263 K N -0.238 120.202 120.400 0.068 0.000 2.432 263 K HA 0.234 4.534 4.320 -0.034 0.000 0.196 263 K C 1.812 178.434 176.600 0.036 0.000 1.038 263 K CA 0.996 57.320 56.287 0.063 0.000 0.986 263 K CB -0.379 32.154 32.500 0.056 0.000 0.782 263 K HN 0.299 8.549 8.250 0.000 0.000 0.485 264 A N 1.686 124.516 122.820 0.017 0.000 1.972 264 A HA -0.041 4.258 4.320 -0.034 0.000 0.219 264 A C 1.895 179.479 177.584 -0.001 0.000 1.169 264 A CA 1.182 53.216 52.037 -0.005 0.000 0.635 264 A CB -0.199 18.781 19.000 -0.034 0.000 0.810 264 A HN 0.146 8.296 8.150 0.000 0.000 0.446 265 V N 0.574 120.503 119.914 0.024 0.000 3.121 265 V HA 0.060 4.159 4.120 -0.034 0.000 0.344 265 V C -0.381 175.748 176.094 0.059 0.000 1.390 265 V CA -0.110 62.213 62.300 0.039 0.000 1.177 265 V CB -1.265 30.599 31.823 0.068 0.000 1.163 265 V HN 0.665 8.855 8.190 0.000 0.000 0.484 266 N N 0.567 119.296 118.700 0.048 0.000 2.689 266 N HA -0.269 4.450 4.740 -0.034 0.000 0.263 266 N C -0.495 175.046 175.510 0.052 0.000 0.987 266 N CA 0.753 53.824 53.050 0.034 0.000 0.782 266 N CB -1.356 37.123 38.487 -0.014 0.000 0.903 266 N HN 0.666 9.046 8.380 0.000 0.000 0.547 267 Y N 0.705 120.998 120.300 -0.012 0.000 2.359 267 Y HA 0.219 4.748 4.550 -0.035 0.000 0.334 267 Y C 0.838 176.738 175.900 -0.001 0.000 1.058 267 Y CA -0.324 57.774 58.100 -0.002 0.000 1.244 267 Y CB 0.633 39.102 38.460 0.016 0.000 1.187 267 Y HN 0.278 8.558 8.280 0.000 0.000 0.510 268 E N 6.205 126.131 120.200 -0.455 0.000 2.227 268 E HA 0.313 4.643 4.350 -0.034 0.000 0.268 268 E C -0.418 175.959 176.600 -0.372 0.000 0.907 268 E CA -0.530 55.696 56.400 -0.290 0.000 0.786 268 E CB 0.874 30.438 29.700 -0.228 0.000 1.191 268 E HN 0.910 9.270 8.360 0.000 0.000 0.411 269 N N 0.747 119.375 118.700 -0.120 0.000 4.095 269 N HA -0.227 4.493 4.740 -0.034 0.000 0.258 269 N C -1.524 174.067 175.510 0.135 0.000 0.898 269 N CA 0.914 53.938 53.050 -0.042 0.000 0.984 269 N CB -1.151 37.266 38.487 -0.117 0.000 0.928 269 N HN 0.661 9.041 8.380 0.000 0.000 0.560 270 A N 0.029 122.940 122.820 0.153 0.000 2.301 270 A HA 0.700 5.000 4.320 -0.034 0.000 0.298 270 A C 0.627 178.424 177.584 0.356 0.000 1.185 270 A CA 0.703 52.874 52.037 0.224 0.000 0.830 270 A CB 0.804 19.875 19.000 0.118 0.000 1.112 270 A HN 0.919 9.069 8.150 0.000 0.000 0.508 271 G N 0.070 109.030 108.800 0.267 0.000 2.694 271 G HA2 0.644 4.584 3.960 -0.034 0.000 0.290 271 G HA3 0.644 4.584 3.960 -0.034 0.000 0.290 271 G C -1.041 173.852 174.900 -0.011 0.000 1.386 271 G CA -0.448 44.694 45.100 0.069 0.000 0.872 271 G HN 0.721 9.011 8.290 0.000 0.000 0.475 272 T N 1.165 115.694 114.554 -0.040 0.000 2.881 272 T HA 0.486 4.815 4.350 -0.034 0.000 0.290 272 T C -0.433 174.209 174.700 -0.098 0.000 1.000 272 T CA -0.365 61.714 62.100 -0.034 0.000 0.978 272 T CB 1.378 70.254 68.868 0.014 0.000 0.997 272 T HN 0.325 8.565 8.240 0.000 0.000 0.443 273 I N 3.131 123.626 120.570 -0.125 0.000 2.321 273 I HA 0.293 4.442 4.170 -0.034 0.000 0.291 273 I C 0.485 176.367 176.117 -0.391 0.000 0.998 273 I CA -0.518 60.628 61.300 -0.257 0.000 1.227 273 I CB 1.225 39.086 38.000 -0.231 0.000 1.368 273 I HN 0.662 8.872 8.210 0.000 0.000 0.466 274 E N 6.190 126.094 120.200 -0.493 0.000 2.167 274 E HA 0.417 4.747 4.350 -0.034 0.000 0.284 274 E C -1.270 174.934 176.600 -0.660 0.000 1.016 274 E CA -0.348 55.785 56.400 -0.445 0.000 0.817 274 E CB 1.234 30.753 29.700 -0.301 0.000 1.080 274 E HN 0.246 8.606 8.360 0.000 0.000 0.397 275 F N 1.957 121.782 119.950 -0.209 0.000 2.458 275 F HA 0.402 4.909 4.527 -0.033 0.000 0.330 275 F C 0.461 176.199 175.800 -0.104 0.000 1.082 275 F CA -0.888 57.060 58.000 -0.087 0.000 0.995 275 F CB 0.972 39.992 39.000 0.032 0.000 1.170 275 F HN 0.283 8.583 8.300 0.000 0.000 0.478 276 I N 3.050 123.724 120.570 0.174 0.000 2.337 276 I HA 0.052 4.201 4.170 -0.034 0.000 0.291 276 I C -1.022 175.291 176.117 0.327 0.000 1.046 276 I CA -0.431 60.922 61.300 0.089 0.000 1.324 276 I CB 0.465 38.319 38.000 -0.244 0.000 1.409 276 I HN 0.506 8.716 8.210 0.000 0.000 0.494 277 Y N 6.727 127.185 120.300 0.263 0.000 2.518 277 Y HA 0.206 4.735 4.550 -0.035 0.000 0.344 277 Y C 0.039 176.091 175.900 0.254 0.000 0.982 277 Y CA -0.724 57.514 58.100 0.229 0.000 1.234 277 Y CB 0.428 38.980 38.460 0.153 0.000 1.114 277 Y HN 0.461 8.741 8.280 0.000 0.000 0.515 278 D N 5.507 125.872 120.400 -0.058 0.000 2.325 278 D HA 0.082 4.702 4.640 -0.034 0.000 0.251 278 D C 0.587 176.833 176.300 -0.091 0.000 1.196 278 D CA 0.226 54.243 54.000 0.029 0.000 0.866 278 D CB 0.994 41.847 40.800 0.088 0.000 1.101 278 D HN 0.775 9.145 8.370 0.000 0.000 0.476 279 L N 3.365 124.616 121.223 0.047 0.000 2.478 279 L HA 0.009 4.329 4.340 -0.034 0.000 0.223 279 L C 1.762 178.641 176.870 0.015 0.000 1.140 279 L CA 0.379 55.246 54.840 0.045 0.000 0.842 279 L CB -0.257 41.859 42.059 0.096 0.000 0.953 279 L HN 0.421 8.651 8.230 0.000 0.000 0.452 280 N N 0.362 119.068 118.700 0.010 0.000 2.171 280 N HA -0.151 4.569 4.740 -0.034 0.000 0.184 280 N C 0.656 176.158 175.510 -0.013 0.000 1.021 280 N CA 1.372 54.426 53.050 0.007 0.000 0.854 280 N CB 0.126 38.621 38.487 0.013 0.000 0.994 280 N HN 0.448 8.828 8.380 0.000 0.000 0.426 281 D N -1.640 118.737 120.400 -0.040 0.000 2.500 281 D HA 0.100 4.720 4.640 -0.034 0.000 0.217 281 D C -0.523 175.706 176.300 -0.119 0.000 1.159 281 D CA -0.309 53.656 54.000 -0.058 0.000 0.828 281 D CB -0.140 40.636 40.800 -0.040 0.000 1.039 281 D HN -0.091 8.279 8.370 0.000 0.000 0.512 282 N N 1.065 119.644 118.700 -0.201 0.000 2.738 282 N HA -0.135 4.585 4.740 -0.034 0.000 0.249 282 N C -0.916 174.314 175.510 -0.467 0.000 1.047 282 N CA 0.708 53.543 53.050 -0.359 0.000 0.707 282 N CB -0.527 37.920 38.487 -0.068 0.000 0.937 282 N HN 0.374 8.754 8.380 0.000 0.000 0.545 283 K N 0.575 120.659 120.400 -0.526 0.000 2.259 283 K HA 0.494 4.794 4.320 -0.034 0.000 0.252 283 K C 0.165 176.429 176.600 -0.559 0.000 0.936 283 K CA -0.576 55.398 56.287 -0.523 0.000 0.810 283 K CB 1.273 33.508 32.500 -0.441 0.000 1.143 283 K HN 0.146 8.396 8.250 0.000 0.000 0.427 284 F N 0.181 119.798 119.950 -0.555 0.000 2.480 284 F HA 0.630 5.136 4.527 -0.035 0.000 0.329 284 F C -1.004 174.497 175.800 -0.500 0.000 1.091 284 F CA -1.067 56.724 58.000 -0.348 0.000 0.972 284 F CB 0.765 39.645 39.000 -0.199 0.000 1.150 284 F HN 0.297 8.597 8.300 0.000 0.000 0.467 285 Y N 3.104 123.600 120.300 0.328 0.000 2.406 285 Y HA 0.358 4.888 4.550 -0.034 0.000 0.340 285 Y C -0.688 175.515 175.900 0.504 0.000 0.975 285 Y CA -1.492 56.784 58.100 0.293 0.000 1.056 285 Y CB 1.700 40.208 38.460 0.080 0.000 1.210 285 Y HN 0.792 9.072 8.280 0.000 0.000 0.448 286 F N 4.943 125.185 119.950 0.485 0.000 2.543 286 F HA 0.136 4.645 4.527 -0.031 0.000 0.375 286 F C 0.861 176.687 175.800 0.043 0.000 1.075 286 F CA 0.318 58.389 58.000 0.118 0.000 1.225 286 F CB 0.755 39.784 39.000 0.048 0.000 1.099 286 F HN 0.753 9.053 8.300 0.000 0.000 0.561 287 M N 4.017 123.193 119.600 -0.706 0.000 2.718 287 M HA 0.236 4.696 4.480 -0.034 0.000 0.259 287 M C -0.712 175.086 176.300 -0.835 0.000 1.240 287 M CA 0.774 55.756 55.300 -0.530 0.000 1.210 287 M CB 0.247 32.646 32.600 -0.335 0.000 1.281 287 M HN 0.756 9.046 8.290 0.000 0.000 0.515 288 E N -0.149 119.292 120.200 -1.265 0.000 2.422 288 E HA 0.319 4.648 4.350 -0.034 0.000 0.280 288 E C -1.379 174.820 176.600 -0.668 0.000 1.091 288 E CA -0.920 54.935 56.400 -0.907 0.000 0.849 288 E CB 1.262 30.785 29.700 -0.294 0.000 1.353 288 E HN 0.310 8.670 8.360 0.000 0.000 0.449 289 M N 1.725 121.236 119.600 -0.150 0.000 2.336 289 M HA 0.468 4.928 4.480 -0.034 0.000 0.342 289 M C -1.665 174.612 176.300 -0.039 0.000 1.128 289 M CA -0.443 54.825 55.300 -0.053 0.000 1.016 289 M CB 1.228 33.855 32.600 0.044 0.000 1.665 289 M HN 0.573 8.863 8.290 0.000 0.000 0.445 290 N N 2.359 121.037 118.700 -0.037 0.000 2.462 290 N HA 0.214 4.933 4.740 -0.034 0.000 0.242 290 N C -0.574 174.979 175.510 0.071 0.000 1.010 290 N CA -0.411 52.654 53.050 0.025 0.000 0.939 290 N CB 1.041 39.546 38.487 0.030 0.000 1.127 290 N HN 0.628 9.008 8.380 0.000 0.000 0.509 291 T N 0.961 115.599 114.554 0.140 0.000 4.099 291 T HA 0.241 4.571 4.350 -0.034 0.000 0.223 291 T C 0.097 174.984 174.700 0.311 0.000 0.968 291 T CA -0.531 61.744 62.100 0.292 0.000 0.966 291 T CB -0.856 68.222 68.868 0.350 0.000 1.328 291 T HN 0.653 8.893 8.240 0.000 0.000 0.783 292 R N -1.017 119.632 120.500 0.248 0.000 2.774 292 R HA 0.566 4.886 4.340 -0.034 0.000 0.279 292 R C -1.441 174.969 176.300 0.183 0.000 1.022 292 R CA -1.235 54.994 56.100 0.215 0.000 0.855 292 R CB 0.193 30.627 30.300 0.222 0.000 1.279 292 R HN 0.120 8.390 8.270 0.000 0.000 0.485 293 I N 1.045 121.721 120.570 0.177 0.000 2.938 293 I HA 0.065 4.215 4.170 -0.034 0.000 0.285 293 I C -0.056 176.210 176.117 0.248 0.000 1.182 293 I CA 0.559 61.953 61.300 0.156 0.000 1.388 293 I CB 0.786 38.822 38.000 0.061 0.000 1.390 293 I HN 0.532 8.742 8.210 0.000 0.000 0.600 294 Q N 2.746 122.689 119.800 0.237 0.000 2.378 294 Q HA 0.362 4.682 4.340 -0.034 0.000 0.276 294 Q C 0.824 176.918 176.000 0.155 0.000 1.083 294 Q CA -0.892 54.993 55.803 0.136 0.000 0.856 294 Q CB 1.946 30.717 28.738 0.054 0.000 1.383 294 Q HN 0.507 8.777 8.270 0.000 0.000 0.458 295 V N 1.000 120.721 119.914 -0.323 0.000 2.332 295 V HA -0.251 3.848 4.120 -0.034 0.000 0.248 295 V C 1.752 177.810 176.094 -0.060 0.000 1.055 295 V CA 2.233 64.351 62.300 -0.303 0.000 1.038 295 V CB -0.575 30.997 31.823 -0.418 0.000 0.651 295 V HN 0.823 9.013 8.190 0.000 0.000 0.450 296 E N 1.089 121.250 120.200 -0.066 0.000 2.494 296 E HA -0.171 4.159 4.350 -0.034 0.000 0.193 296 E C 1.723 178.271 176.600 -0.087 0.000 1.074 296 E CA 0.506 56.852 56.400 -0.090 0.000 0.867 296 E CB -0.803 28.854 29.700 -0.073 0.000 0.924 296 E HN 0.905 9.265 8.360 0.000 0.000 0.502 297 H N 1.010 120.086 119.070 0.010 0.000 2.426 297 H HA 0.001 4.536 4.556 -0.035 0.000 0.298 297 H C -0.957 174.366 175.328 -0.008 0.000 1.107 297 H CA 1.043 57.100 56.048 0.016 0.000 1.298 297 H CB -1.779 28.016 29.762 0.055 0.000 1.377 297 H HN 0.196 8.476 8.280 0.000 0.000 0.519 298 P HA -0.110 4.310 4.420 0.000 0.000 0.220 298 P C 2.220 179.422 177.300 -0.164 0.000 1.148 298 P CA 1.582 64.519 63.100 -0.272 0.000 0.803 298 P CB -0.250 31.262 31.700 -0.313 0.000 0.782 299 V N -3.588 116.230 119.914 -0.160 0.000 2.515 299 V HA -0.182 3.917 4.120 -0.034 0.000 0.250 299 V C 1.876 177.873 176.094 -0.160 0.000 1.058 299 V CA 2.399 64.605 62.300 -0.157 0.000 1.064 299 V CB -2.099 29.632 31.823 -0.153 0.000 0.675 299 V HN 0.038 8.228 8.190 0.000 0.000 0.461 300 T N 0.432 114.920 114.554 -0.110 0.000 2.857 300 T HA -0.082 4.247 4.350 -0.034 0.000 0.266 300 T C 1.811 176.444 174.700 -0.111 0.000 1.048 300 T CA 1.879 63.924 62.100 -0.092 0.000 1.139 300 T CB -0.270 68.581 68.868 -0.029 0.000 0.874 300 T HN 0.689 8.929 8.240 0.000 0.000 0.455 301 E N 0.828 120.977 120.200 -0.085 0.000 2.110 301 E HA -0.058 4.272 4.350 -0.034 0.000 0.193 301 E C 2.208 178.716 176.600 -0.153 0.000 0.988 301 E CA 0.995 57.348 56.400 -0.080 0.000 0.804 301 E CB -0.178 29.515 29.700 -0.012 0.000 0.745 301 E HN 0.503 8.863 8.360 0.000 0.000 0.458 302 M N 0.575 120.037 119.600 -0.230 0.000 2.156 302 M HA -0.122 4.338 4.480 -0.034 0.000 0.264 302 M C 2.653 178.571 176.300 -0.636 0.000 1.067 302 M CA 1.128 56.183 55.300 -0.408 0.000 1.131 302 M CB -0.308 32.022 32.600 -0.451 0.000 1.368 302 M HN 0.114 8.404 8.290 0.000 0.000 0.416 303 V N -2.216 117.394 119.914 -0.507 0.000 2.667 303 V HA -0.120 3.980 4.120 -0.034 0.000 0.252 303 V C 2.112 178.107 176.094 -0.165 0.000 1.065 303 V CA 2.017 64.121 62.300 -0.326 0.000 1.083 303 V CB -1.705 30.008 31.823 -0.184 0.000 0.692 303 V HN 0.606 8.796 8.190 0.000 0.000 0.468 304 T N -3.663 110.789 114.554 -0.169 0.000 3.015 304 T HA 0.414 4.744 4.350 -0.034 0.000 0.250 304 T C 1.755 176.362 174.700 -0.156 0.000 1.057 304 T CA 0.986 62.996 62.100 -0.150 0.000 1.066 304 T CB 0.344 69.110 68.868 -0.170 0.000 0.959 304 T HN 1.616 9.856 8.240 0.000 0.000 0.488 305 G N 1.606 110.323 108.800 -0.138 0.000 2.148 305 G HA2 -0.191 3.749 3.960 -0.034 0.000 0.254 305 G HA3 -0.191 3.749 3.960 -0.034 0.000 0.254 305 G C -0.011 174.830 174.900 -0.098 0.000 0.981 305 G CA 0.227 45.270 45.100 -0.094 0.000 0.670 305 G HN 0.669 8.959 8.290 0.000 0.000 0.528 306 I N 0.934 121.416 120.570 -0.147 0.000 2.336 306 I HA 0.238 4.388 4.170 -0.034 0.000 0.292 306 I C -0.334 175.773 176.117 -0.017 0.000 0.991 306 I CA -0.755 60.460 61.300 -0.142 0.000 1.227 306 I CB 1.481 39.292 38.000 -0.315 0.000 1.366 306 I HN -0.027 8.183 8.210 0.000 0.000 0.466 307 D N 7.055 127.488 120.400 0.056 0.000 2.402 307 D HA 0.137 4.757 4.640 -0.034 0.000 0.235 307 D C 0.875 177.224 176.300 0.082 0.000 1.226 307 D CA 0.077 54.121 54.000 0.073 0.000 0.918 307 D CB 0.967 41.814 40.800 0.078 0.000 1.043 307 D HN 0.471 8.841 8.370 0.000 0.000 0.506 308 L N 3.203 124.472 121.223 0.076 0.000 2.093 308 L HA -0.141 4.178 4.340 -0.034 0.000 0.208 308 L C 2.320 179.209 176.870 0.032 0.000 1.085 308 L CA 0.594 55.469 54.840 0.058 0.000 0.755 308 L CB 0.042 42.136 42.059 0.060 0.000 0.904 308 L HN 0.316 8.546 8.230 0.000 0.000 0.435 309 V N -0.472 119.446 119.914 0.007 0.000 2.488 309 V HA -0.234 3.865 4.120 -0.034 0.000 0.246 309 V C 2.417 178.545 176.094 0.056 0.000 1.046 309 V CA 1.448 63.755 62.300 0.012 0.000 1.053 309 V CB -0.420 31.372 31.823 -0.052 0.000 0.679 309 V HN 0.387 8.577 8.190 0.000 0.000 0.458 310 K N -0.086 120.346 120.400 0.054 0.000 2.097 310 K HA -0.170 4.130 4.320 -0.034 0.000 0.205 310 K C 2.084 178.719 176.600 0.057 0.000 1.050 310 K CA 1.250 57.570 56.287 0.056 0.000 0.938 310 K CB -0.157 32.378 32.500 0.058 0.000 0.718 310 K HN 0.321 8.571 8.250 0.000 0.000 0.442 311 L N 1.644 122.910 121.223 0.071 0.000 2.141 311 L HA -0.143 4.177 4.340 -0.034 0.000 0.209 311 L C 1.991 178.887 176.870 0.044 0.000 1.094 311 L CA 1.571 56.457 54.840 0.078 0.000 0.763 311 L CB -0.312 41.818 42.059 0.118 0.000 0.908 311 L HN 0.231 8.461 8.230 0.000 0.000 0.437 312 Q N -0.845 118.972 119.800 0.029 0.000 2.084 312 Q HA -0.208 4.111 4.340 -0.034 0.000 0.202 312 Q C 2.250 178.221 176.000 -0.049 0.000 0.978 312 Q CA 1.910 57.699 55.803 -0.024 0.000 0.844 312 Q CB -0.278 28.431 28.738 -0.047 0.000 0.898 312 Q HN 0.510 8.780 8.270 0.000 0.000 0.426 313 L N 0.348 121.566 121.223 -0.009 0.000 2.027 313 L HA -0.222 4.097 4.340 -0.034 0.000 0.206 313 L C 2.517 179.385 176.870 -0.004 0.000 1.074 313 L CA 1.238 56.074 54.840 -0.007 0.000 0.745 313 L CB -0.408 41.668 42.059 0.029 0.000 0.898 313 L HN 0.242 8.472 8.230 0.000 0.000 0.433 314 Q N -0.485 119.322 119.800 0.012 0.000 2.045 314 Q HA -0.228 4.091 4.340 -0.034 0.000 0.206 314 Q C 2.355 178.363 176.000 0.013 0.000 0.991 314 Q CA 1.945 57.758 55.803 0.016 0.000 0.851 314 Q CB -0.395 28.357 28.738 0.025 0.000 0.911 314 Q HN 0.300 8.570 8.270 0.000 0.000 0.418 315 V N 0.826 120.744 119.914 0.007 0.000 2.324 315 V HA -0.320 3.780 4.120 -0.034 0.000 0.250 315 V C 2.171 178.240 176.094 -0.042 0.000 1.060 315 V CA 1.914 64.209 62.300 -0.008 0.000 1.042 315 V CB -0.920 30.894 31.823 -0.016 0.000 0.650 315 V HN 0.462 8.652 8.190 0.000 0.000 0.450 316 A N -1.022 121.766 122.820 -0.053 0.000 2.067 316 A HA -0.098 4.202 4.320 -0.034 0.000 0.219 316 A C 2.048 179.608 177.584 -0.040 0.000 1.158 316 A CA 1.526 53.524 52.037 -0.066 0.000 0.661 316 A CB -0.444 18.501 19.000 -0.092 0.000 0.801 316 A HN 0.549 8.699 8.150 0.000 0.000 0.452 317 M N -1.039 118.549 119.600 -0.019 0.000 2.563 317 M HA 0.195 4.655 4.480 -0.034 0.000 0.231 317 M C 1.170 177.479 176.300 0.014 0.000 1.136 317 M CA 0.749 56.048 55.300 -0.002 0.000 1.026 317 M CB 0.259 32.863 32.600 0.007 0.000 1.597 317 M HN 0.569 8.859 8.290 0.000 0.000 0.495 318 G N 0.786 109.592 108.800 0.009 0.000 2.132 318 G HA2 -0.183 3.757 3.960 -0.034 0.000 0.228 318 G HA3 -0.183 3.757 3.960 -0.034 0.000 0.228 318 G C -0.617 174.388 174.900 0.175 0.000 1.000 318 G CA -0.417 44.713 45.100 0.049 0.000 0.693 318 G HN 0.397 8.687 8.290 0.000 0.000 0.515 319 D N -0.047 120.424 120.400 0.120 0.000 2.382 319 D HA 0.432 5.051 4.640 -0.034 0.000 0.245 319 D C 1.005 177.442 176.300 0.229 0.000 1.120 319 D CA -0.165 53.914 54.000 0.131 0.000 0.890 319 D CB 1.583 42.415 40.800 0.054 0.000 1.201 319 D HN 0.143 8.513 8.370 0.000 0.000 0.433 320 V N 2.996 123.017 119.914 0.178 0.000 2.715 320 V HA 0.013 4.112 4.120 -0.034 0.000 0.299 320 V C 0.839 176.978 176.094 0.075 0.000 1.054 320 V CA -0.598 61.791 62.300 0.149 0.000 1.077 320 V CB 0.616 32.402 31.823 -0.062 0.000 0.972 320 V HN 0.388 8.578 8.190 0.000 0.000 0.484 321 L N 7.783 129.062 121.223 0.093 0.000 2.700 321 L HA 0.040 4.360 4.340 -0.034 0.000 0.276 321 L C -1.012 175.842 176.870 -0.028 0.000 1.200 321 L CA -0.715 54.160 54.840 0.058 0.000 0.951 321 L CB 0.365 42.481 42.059 0.096 0.000 1.226 321 L HN 0.604 8.834 8.230 0.000 0.000 0.489 322 P HA -0.019 4.401 4.420 0.000 0.000 0.245 322 P C -0.759 176.223 177.300 -0.531 0.000 1.212 322 P CA 0.683 63.574 63.100 -0.349 0.000 0.774 322 P CB 0.147 31.567 31.700 -0.466 0.000 0.999 323 Y N -0.385 119.919 120.300 0.007 0.000 2.409 323 Y HA 0.482 5.012 4.550 -0.034 0.000 0.343 323 Y C 0.895 176.792 175.900 -0.005 0.000 0.973 323 Y CA -1.128 56.970 58.100 -0.003 0.000 1.064 323 Y CB 1.484 39.939 38.460 -0.008 0.000 1.207 323 Y HN -0.394 7.886 8.280 0.000 0.000 0.452 324 K N 0.985 121.471 120.400 0.143 0.000 2.106 324 K HA 0.189 4.489 4.320 -0.034 0.000 0.246 324 K C 0.711 177.338 176.600 0.044 0.000 0.987 324 K CA -0.670 55.661 56.287 0.073 0.000 0.904 324 K CB 1.694 34.220 32.500 0.043 0.000 1.071 324 K HN 0.705 8.955 8.250 0.000 0.000 0.453 325 Q N 1.388 121.191 119.800 0.005 0.000 2.119 325 Q HA -0.164 4.156 4.340 -0.034 0.000 0.201 325 Q C 0.915 176.884 176.000 -0.051 0.000 0.972 325 Q CA 1.929 57.699 55.803 -0.056 0.000 0.847 325 Q CB 0.111 28.817 28.738 -0.054 0.000 0.903 325 Q HN 0.560 8.830 8.270 0.000 0.000 0.433 326 E N 0.154 120.346 120.200 -0.013 0.000 2.204 326 E HA -0.144 4.185 4.350 -0.034 0.000 0.195 326 E C 0.989 177.587 176.600 -0.004 0.000 0.990 326 E CA 1.371 57.767 56.400 -0.006 0.000 0.821 326 E CB -0.048 29.656 29.700 0.006 0.000 0.750 326 E HN 0.385 8.745 8.360 0.000 0.000 0.477 327 D N -0.092 120.314 120.400 0.011 0.000 2.340 327 D HA 0.082 4.702 4.640 -0.034 0.000 0.220 327 D C -0.009 176.289 176.300 -0.002 0.000 1.039 327 D CA 0.201 54.218 54.000 0.028 0.000 0.866 327 D CB 0.233 41.081 40.800 0.080 0.000 0.913 327 D HN 0.203 8.573 8.370 0.000 0.000 0.523 328 I N 1.237 121.777 120.570 -0.050 0.000 2.312 328 I HA 0.135 4.285 4.170 -0.034 0.000 0.291 328 I C 0.134 176.198 176.117 -0.088 0.000 1.031 328 I CA -0.296 60.938 61.300 -0.109 0.000 1.293 328 I CB 0.739 38.639 38.000 -0.167 0.000 1.403 328 I HN -0.477 7.733 8.210 0.000 0.000 0.484 329 K N 5.735 126.091 120.400 -0.074 0.000 2.345 329 K HA 0.555 4.854 4.320 -0.034 0.000 0.255 329 K C -1.220 175.350 176.600 -0.050 0.000 0.934 329 K CA -0.572 55.687 56.287 -0.047 0.000 0.801 329 K CB 1.608 34.095 32.500 -0.021 0.000 1.137 329 K HN 0.279 8.529 8.250 0.000 0.000 0.424 330 L N 2.548 123.749 121.223 -0.037 0.000 2.313 330 L HA 0.332 4.652 4.340 -0.034 0.000 0.282 330 L C -0.130 176.746 176.870 0.010 0.000 1.092 330 L CA 0.455 55.277 54.840 -0.030 0.000 0.831 330 L CB 0.919 42.959 42.059 -0.033 0.000 1.159 330 L HN 0.556 8.786 8.230 0.000 0.000 0.442 331 T N 2.827 117.407 114.554 0.044 0.000 2.786 331 T HA 0.707 5.037 4.350 -0.034 0.000 0.283 331 T C 0.518 175.352 174.700 0.224 0.000 0.992 331 T CA -0.002 62.159 62.100 0.101 0.000 0.954 331 T CB 1.434 70.358 68.868 0.094 0.000 0.934 331 T HN 1.006 9.246 8.240 0.000 0.000 0.440 332 G N 2.603 111.495 108.800 0.152 0.000 2.562 332 G HA2 -0.163 3.777 3.960 -0.034 0.000 0.250 332 G HA3 -0.163 3.777 3.960 -0.034 0.000 0.250 332 G C -0.645 174.394 174.900 0.231 0.000 1.269 332 G CA -0.048 45.143 45.100 0.153 0.000 0.919 332 G HN 1.068 9.358 8.290 0.000 0.000 0.574 333 H N -0.491 118.673 119.070 0.157 0.000 2.856 333 H HA 0.689 5.224 4.556 -0.035 0.000 0.355 333 H C -0.040 175.426 175.328 0.229 0.000 1.079 333 H CA 0.431 56.561 56.048 0.138 0.000 1.240 333 H CB 1.437 31.232 29.762 0.055 0.000 1.701 333 H HN 1.307 9.587 8.280 0.000 0.000 0.527 334 A N 5.134 127.919 122.820 -0.057 0.000 2.365 334 A HA 0.707 5.007 4.320 -0.034 0.000 0.318 334 A C -1.202 176.338 177.584 -0.072 0.000 1.091 334 A CA -0.665 51.384 52.037 0.020 0.000 0.763 334 A CB 0.889 19.837 19.000 -0.087 0.000 1.248 334 A HN 0.627 8.777 8.150 0.000 0.000 0.442 335 I N 1.314 121.861 120.570 -0.037 0.000 2.499 335 I HA 0.348 4.497 4.170 -0.034 0.000 0.288 335 I C -0.221 175.611 176.117 -0.474 0.000 1.048 335 I CA -0.273 60.887 61.300 -0.233 0.000 1.062 335 I CB 2.071 39.953 38.000 -0.196 0.000 1.238 335 I HN 0.846 9.056 8.210 0.000 0.000 0.426 336 E N 6.281 126.188 120.200 -0.488 0.000 2.191 336 E HA 0.528 4.858 4.350 -0.034 0.000 0.278 336 E C -1.719 174.513 176.600 -0.615 0.000 0.972 336 E CA -0.557 55.592 56.400 -0.418 0.000 0.804 336 E CB 1.242 30.820 29.700 -0.205 0.000 1.110 336 E HN 0.383 8.743 8.360 0.000 0.000 0.394 337 F N 3.023 122.902 119.950 -0.119 0.000 2.427 337 F HA 0.386 4.890 4.527 -0.038 0.000 0.348 337 F C 0.524 176.203 175.800 -0.201 0.000 1.125 337 F CA -0.966 56.829 58.000 -0.343 0.000 0.989 337 F CB 1.363 39.963 39.000 -0.667 0.000 1.165 337 F HN 0.284 8.584 8.300 0.000 0.000 0.442 338 R N 4.472 125.024 120.500 0.086 0.000 2.248 338 R HA 0.424 4.744 4.340 -0.034 0.000 0.337 338 R C -0.812 175.666 176.300 0.297 0.000 1.085 338 R CA -0.191 56.006 56.100 0.163 0.000 0.934 338 R CB 0.146 30.527 30.300 0.134 0.000 1.034 338 R HN 0.703 8.973 8.270 0.000 0.000 0.465 339 I N 5.130 125.837 120.570 0.228 0.000 2.297 339 I HA 0.152 4.302 4.170 -0.034 0.000 0.291 339 I C -0.049 176.152 176.117 0.140 0.000 1.033 339 I CA -0.406 61.025 61.300 0.218 0.000 1.253 339 I CB 0.874 38.932 38.000 0.096 0.000 1.396 339 I HN 0.520 8.730 8.210 0.000 0.000 0.476 340 N N 4.382 123.156 118.700 0.124 0.000 2.459 340 N HA 0.454 5.174 4.740 -0.034 0.000 0.288 340 N C -0.167 175.364 175.510 0.034 0.000 1.186 340 N CA -0.643 52.455 53.050 0.080 0.000 0.917 340 N CB 2.003 40.541 38.487 0.085 0.000 1.219 340 N HN 0.550 8.930 8.380 0.000 0.000 0.525 341 A N 0.931 123.768 122.820 0.028 0.000 3.063 341 A HA 0.233 4.533 4.320 -0.034 0.000 0.263 341 A C -0.108 177.468 177.584 -0.013 0.000 1.736 341 A CA 0.091 52.127 52.037 -0.000 0.000 1.408 341 A CB -0.679 18.322 19.000 0.002 0.000 1.108 341 A HN 0.598 8.748 8.150 0.000 0.000 0.621 342 E N 0.313 120.492 120.200 -0.035 0.000 2.340 342 E HA 0.233 4.563 4.350 -0.034 0.000 0.273 342 E C -1.057 175.448 176.600 -0.159 0.000 0.891 342 E CA -0.979 55.387 56.400 -0.056 0.000 0.757 342 E CB 1.420 31.134 29.700 0.024 0.000 1.231 342 E HN 0.357 8.717 8.360 0.000 0.000 0.439 343 N N 2.994 121.595 118.700 -0.165 0.000 2.437 343 N HA 0.162 4.882 4.740 -0.034 0.000 0.243 343 N C -1.889 173.364 175.510 -0.428 0.000 1.041 343 N CA -2.214 50.710 53.050 -0.210 0.000 0.940 343 N CB 1.005 39.443 38.487 -0.082 0.000 1.133 343 N HN 0.249 8.629 8.380 0.000 0.000 0.506 344 P HA -0.091 4.329 4.420 0.000 0.000 0.223 344 P C 0.417 177.326 177.300 -0.651 0.000 1.151 344 P CA 1.016 63.399 63.100 -1.194 0.000 0.787 344 P CB 0.081 31.098 31.700 -1.139 0.000 0.788 345 Y N 0.517 120.665 120.300 -0.253 0.000 2.546 345 Y HA 0.109 4.640 4.550 -0.031 0.000 0.287 345 Y C 1.502 177.344 175.900 -0.098 0.000 1.158 345 Y CA 0.613 58.634 58.100 -0.133 0.000 1.307 345 Y CB -0.247 38.152 38.460 -0.102 0.000 1.036 345 Y HN -0.076 8.204 8.280 0.000 0.000 0.532 346 K N 0.490 120.887 120.400 -0.005 0.000 3.045 346 K HA 0.123 4.422 4.320 -0.034 0.000 0.211 346 K C -0.169 176.436 176.600 0.007 0.000 1.141 346 K CA -0.308 55.982 56.287 0.005 0.000 1.036 346 K CB 0.050 32.549 32.500 -0.001 0.000 0.851 346 K HN -0.054 8.196 8.250 0.000 0.000 0.462 347 N N 1.263 119.983 118.700 0.034 0.000 2.721 347 N HA -0.244 4.475 4.740 -0.034 0.000 0.249 347 N C -0.737 174.943 175.510 0.283 0.000 1.072 347 N CA 0.694 53.840 53.050 0.161 0.000 0.710 347 N CB -1.617 36.924 38.487 0.090 0.000 0.993 347 N HN 0.572 8.952 8.380 0.000 0.000 0.547 348 F N -3.719 116.163 119.950 -0.114 0.000 3.018 348 F HA -0.338 4.167 4.527 -0.037 0.000 0.287 348 F C 1.256 177.002 175.800 -0.090 0.000 0.813 348 F CA 0.803 58.725 58.000 -0.130 0.000 1.209 348 F CB -1.765 37.128 39.000 -0.177 0.000 1.321 348 F HN 0.378 8.678 8.300 0.000 0.000 0.477 349 M N 2.603 122.224 119.600 0.035 0.000 2.255 349 M HA 0.078 4.538 4.480 -0.034 0.000 0.356 349 M C -1.937 174.358 176.300 -0.008 0.000 1.338 349 M CA -0.732 54.573 55.300 0.008 0.000 0.962 349 M CB 0.533 33.127 32.600 -0.009 0.000 1.877 349 M HN -0.226 8.064 8.290 0.000 0.000 0.463 350 P HA 0.026 4.446 4.420 0.000 0.000 0.268 350 P C -1.350 175.930 177.300 -0.033 0.000 1.205 350 P CA -0.066 63.022 63.100 -0.020 0.000 0.771 350 P CB 0.796 32.478 31.700 -0.030 0.000 0.858 351 S N 3.169 118.847 115.700 -0.035 0.000 2.269 351 S HA 0.378 4.828 4.470 -0.034 0.000 0.194 351 S C -2.414 172.160 174.600 -0.044 0.000 1.547 351 S CA -1.779 56.397 58.200 -0.039 0.000 1.186 351 S CB -0.322 62.855 63.200 -0.038 0.000 1.069 351 S HN 0.228 8.538 8.310 0.000 0.000 0.473 352 P HA 0.586 5.006 4.420 0.000 0.000 0.272 352 P C 0.272 177.536 177.300 -0.060 0.000 1.223 352 P CA 0.221 63.282 63.100 -0.066 0.000 0.784 352 P CB 1.064 32.718 31.700 -0.077 0.000 0.923 353 G N 0.294 109.050 108.800 -0.073 0.000 2.356 353 G HA2 0.099 4.038 3.960 -0.034 0.000 0.300 353 G HA3 0.099 4.038 3.960 -0.034 0.000 0.300 353 G C -1.683 173.164 174.900 -0.088 0.000 1.331 353 G CA -0.847 44.213 45.100 -0.066 0.000 0.905 353 G HN 0.607 8.897 8.290 0.000 0.000 0.587 354 K N 0.390 120.749 120.400 -0.068 0.000 2.297 354 K HA 0.460 4.759 4.320 -0.034 0.000 0.286 354 K C 0.363 176.939 176.600 -0.041 0.000 1.053 354 K CA -0.524 55.721 56.287 -0.071 0.000 0.940 354 K CB 0.352 32.829 32.500 -0.039 0.000 1.019 354 K HN 0.367 8.617 8.250 0.000 0.000 0.475 355 I N 5.308 125.852 120.570 -0.043 0.000 2.452 355 I HA -0.036 4.113 4.170 -0.034 0.000 0.287 355 I C 1.244 177.389 176.117 0.047 0.000 1.079 355 I CA 0.234 61.545 61.300 0.018 0.000 1.387 355 I CB 0.774 38.801 38.000 0.046 0.000 1.404 355 I HN 0.718 8.928 8.210 0.000 0.000 0.522 356 E N 4.914 125.150 120.200 0.059 0.000 2.364 356 E HA 0.071 4.400 4.350 -0.034 0.000 0.196 356 E C 0.298 176.953 176.600 0.093 0.000 0.990 356 E CA 0.289 56.727 56.400 0.064 0.000 0.886 356 E CB 0.693 30.419 29.700 0.043 0.000 0.866 356 E HN 0.622 8.982 8.360 0.000 0.000 0.493 357 Q N -0.128 119.741 119.800 0.117 0.000 2.284 357 Q HA 0.314 4.633 4.340 -0.034 0.000 0.269 357 Q C -2.136 173.995 176.000 0.218 0.000 1.026 357 Q CA -0.593 55.295 55.803 0.143 0.000 0.831 357 Q CB 2.263 31.058 28.738 0.094 0.000 1.322 357 Q HN 0.101 8.371 8.270 0.000 0.000 0.419 358 Y N 4.210 124.581 120.300 0.119 0.000 2.322 358 Y HA 0.547 5.076 4.550 -0.036 0.000 0.324 358 Y C -2.137 173.868 175.900 0.176 0.000 1.027 358 Y CA -0.855 57.347 58.100 0.170 0.000 1.179 358 Y CB 1.065 39.633 38.460 0.180 0.000 1.136 358 Y HN 0.547 8.827 8.280 0.000 0.000 0.449 359 L N 6.324 127.419 121.223 -0.213 0.000 2.415 359 L HA 0.753 5.073 4.340 -0.034 0.000 0.268 359 L C -0.674 175.977 176.870 -0.365 0.000 0.984 359 L CA -0.762 53.969 54.840 -0.183 0.000 0.853 359 L CB 1.095 43.129 42.059 -0.041 0.000 1.215 359 L HN 0.776 9.006 8.230 0.000 0.000 0.419 360 A N 7.345 129.858 122.820 -0.512 0.000 2.409 360 A HA 0.690 4.989 4.320 -0.034 0.000 0.267 360 A C -2.206 175.086 177.584 -0.487 0.000 1.127 360 A CA -0.859 50.734 52.037 -0.740 0.000 0.795 360 A CB -0.545 18.226 19.000 -0.382 0.000 1.061 360 A HN 0.559 8.709 8.150 0.000 0.000 0.502 361 P HA 0.435 4.855 4.420 0.000 0.000 0.274 361 P C 0.364 177.544 177.300 -0.199 0.000 1.246 361 P CA 0.165 63.095 63.100 -0.284 0.000 0.795 361 P CB 1.340 32.899 31.700 -0.236 0.000 1.006 362 G N -1.616 107.120 108.800 -0.106 0.000 3.247 362 G HA2 0.690 4.629 3.960 -0.034 0.000 0.199 362 G HA3 0.690 4.629 3.960 -0.034 0.000 0.199 362 G C -0.179 174.709 174.900 -0.020 0.000 1.172 362 G CA -0.295 44.769 45.100 -0.061 0.000 0.844 362 G HN 0.839 9.129 8.290 0.000 0.000 0.619 363 G N -1.857 106.945 108.800 0.004 0.000 2.610 363 G HA2 0.149 4.088 3.960 -0.034 0.000 0.304 363 G HA3 0.149 4.088 3.960 -0.034 0.000 0.304 363 G C -0.420 174.525 174.900 0.074 0.000 1.309 363 G CA -0.066 45.064 45.100 0.049 0.000 0.906 363 G HN 1.529 9.819 8.290 0.000 0.000 0.521 364 Y N 1.580 121.881 120.300 0.002 0.000 2.620 364 Y HA 0.331 4.860 4.550 -0.034 0.000 0.330 364 Y C 1.722 177.633 175.900 0.018 0.000 1.186 364 Y CA 2.020 60.124 58.100 0.008 0.000 1.467 364 Y CB 0.535 38.996 38.460 0.001 0.000 1.262 364 Y HN 2.436 10.716 8.280 0.000 0.000 0.550 365 G N 3.340 111.864 108.800 -0.459 0.000 2.184 365 G HA2 -0.270 3.669 3.960 -0.034 0.000 0.264 365 G HA3 -0.270 3.669 3.960 -0.034 0.000 0.264 365 G C -0.393 174.490 174.900 -0.029 0.000 0.975 365 G CA 0.214 45.173 45.100 -0.235 0.000 0.642 365 G HN 0.719 9.009 8.290 0.000 0.000 0.536 366 V N 0.672 120.574 119.914 -0.020 0.000 2.539 366 V HA 0.751 4.850 4.120 -0.034 0.000 0.292 366 V C 0.561 176.648 176.094 -0.012 0.000 1.045 366 V CA -0.141 62.164 62.300 0.009 0.000 0.945 366 V CB 1.686 33.509 31.823 0.001 0.000 0.993 366 V HN 0.560 8.750 8.190 0.000 0.000 0.464 367 R N 4.476 124.978 120.500 0.003 0.000 2.515 367 R HA 0.532 4.852 4.340 -0.034 0.000 0.291 367 R C -1.832 174.475 176.300 0.012 0.000 1.046 367 R CA -0.596 55.502 56.100 -0.003 0.000 0.914 367 R CB 1.228 31.523 30.300 -0.007 0.000 1.191 367 R HN 0.577 8.847 8.270 0.000 0.000 0.435 368 I N 3.690 124.263 120.570 0.006 0.000 2.359 368 I HA 0.341 4.491 4.170 -0.034 0.000 0.294 368 I C -0.294 175.868 176.117 0.075 0.000 0.987 368 I CA -0.634 60.689 61.300 0.038 0.000 1.225 368 I CB 1.801 39.793 38.000 -0.014 0.000 1.366 368 I HN 0.642 8.852 8.210 0.000 0.000 0.466 369 E N 4.489 124.756 120.200 0.111 0.000 2.141 369 E HA 0.494 4.824 4.350 -0.034 0.000 0.259 369 E C -0.856 175.837 176.600 0.155 0.000 0.883 369 E CA -0.335 56.130 56.400 0.107 0.000 0.744 369 E CB 2.369 32.114 29.700 0.075 0.000 1.150 369 E HN 0.513 8.873 8.360 0.000 0.000 0.420 370 S N 0.887 116.675 115.700 0.145 0.000 2.547 370 S HA 0.620 5.069 4.470 -0.034 0.000 0.270 370 S C -0.800 173.840 174.600 0.067 0.000 1.150 370 S CA -0.078 58.211 58.200 0.149 0.000 0.850 370 S CB 1.465 64.819 63.200 0.257 0.000 1.118 370 S HN 0.393 8.703 8.310 0.000 0.000 0.461 371 A N 1.699 124.534 122.820 0.024 0.000 2.503 371 A HA 0.442 4.742 4.320 -0.034 0.000 0.263 371 A C 0.384 177.846 177.584 -0.203 0.000 1.258 371 A CA -0.131 51.876 52.037 -0.049 0.000 0.936 371 A CB -0.599 18.389 19.000 -0.019 0.000 1.070 371 A HN 0.707 8.857 8.150 0.000 0.000 0.522 372 C N 0.081 119.248 119.300 -0.221 0.000 2.382 372 C HA 0.791 5.230 4.460 -0.034 0.000 0.363 372 C C -0.293 174.363 174.990 -0.557 0.000 1.213 372 C CA -0.177 58.610 59.018 -0.385 0.000 2.363 372 C CB -0.038 27.563 27.740 -0.233 0.000 2.397 372 C HN 0.652 8.882 8.230 0.000 0.000 0.573 373 Y N -1.959 118.085 120.300 -0.428 0.000 2.713 373 Y HA 0.473 5.004 4.550 -0.031 0.000 0.335 373 Y C -0.291 175.602 175.900 -0.011 0.000 1.222 373 Y CA -1.057 56.866 58.100 -0.296 0.000 1.061 373 Y CB -0.190 38.162 38.460 -0.180 0.000 1.314 373 Y HN 0.420 8.700 8.280 0.000 0.000 0.453 374 T N 3.092 117.811 114.554 0.274 0.000 2.831 374 T HA 0.140 4.470 4.350 -0.034 0.000 0.291 374 T C 0.142 174.970 174.700 0.214 0.000 0.981 374 T CA 1.392 63.630 62.100 0.230 0.000 1.174 374 T CB -0.799 68.208 68.868 0.231 0.000 0.929 374 T HN 0.881 9.121 8.240 0.000 0.000 0.532 375 N N -0.639 118.123 118.700 0.103 0.000 2.984 375 N HA -0.197 4.523 4.740 -0.034 0.000 0.227 375 N C -0.476 175.034 175.510 0.001 0.000 0.903 375 N CA 0.307 53.402 53.050 0.075 0.000 0.995 375 N CB -1.213 37.354 38.487 0.134 0.000 1.065 375 N HN 0.651 9.031 8.380 0.000 0.000 0.585 376 Y N 2.327 122.397 120.300 -0.384 0.000 2.411 376 Y HA 0.300 4.830 4.550 -0.034 0.000 0.333 376 Y C 0.110 175.853 175.900 -0.261 0.000 1.186 376 Y CA 0.365 58.113 58.100 -0.586 0.000 1.381 376 Y CB 0.876 38.612 38.460 -1.206 0.000 1.273 376 Y HN -0.078 8.202 8.280 0.000 0.000 0.546 377 T N 7.958 122.025 114.554 -0.811 0.000 2.815 377 T HA 0.417 4.746 4.350 -0.034 0.000 0.289 377 T C -0.236 173.901 174.700 -0.938 0.000 1.000 377 T CA -0.539 61.182 62.100 -0.632 0.000 0.958 377 T CB 0.126 68.818 68.868 -0.293 0.000 0.944 377 T HN 0.489 8.729 8.240 0.000 0.000 0.442 378 I N 5.703 125.880 120.570 -0.655 0.000 2.505 378 I HA 0.168 4.317 4.170 -0.034 0.000 0.287 378 I C -1.888 174.159 176.117 -0.118 0.000 1.104 378 I CA -1.768 59.326 61.300 -0.344 0.000 1.387 378 I CB 0.229 38.175 38.000 -0.089 0.000 1.404 378 I HN 0.314 8.524 8.210 0.000 0.000 0.528 379 P HA 0.090 4.510 4.420 0.000 0.000 0.268 379 P C -2.115 175.233 177.300 0.080 0.000 1.204 379 P CA -1.122 62.076 63.100 0.162 0.000 0.768 379 P CB 0.004 31.959 31.700 0.425 0.000 0.842 380 P HA 0.066 4.486 4.420 0.000 0.000 0.249 380 P C -0.406 176.617 177.300 -0.461 0.000 1.593 380 P CA 0.394 63.322 63.100 -0.286 0.000 0.896 380 P CB -0.218 31.264 31.700 -0.364 0.000 1.581 381 Y N -1.769 118.394 120.300 -0.228 0.000 2.445 381 Y HA 0.235 4.769 4.550 -0.026 0.000 0.247 381 Y C 0.668 176.260 175.900 -0.513 0.000 1.129 381 Y CA -0.062 57.752 58.100 -0.477 0.000 1.251 381 Y CB 0.328 38.304 38.460 -0.806 0.000 1.176 381 Y HN -0.093 8.187 8.280 0.000 0.000 0.522 382 Y N -1.622 118.818 120.300 0.233 0.000 2.876 382 Y HA 0.352 4.882 4.550 -0.033 0.000 0.317 382 Y C -0.400 175.571 175.900 0.119 0.000 1.369 382 Y CA -2.404 55.819 58.100 0.205 0.000 1.101 382 Y CB 0.038 38.657 38.460 0.265 0.000 1.346 382 Y HN -0.396 7.884 8.280 0.000 0.000 0.505 383 D N 0.802 121.369 120.400 0.277 0.000 2.412 383 D HA 0.093 4.712 4.640 -0.034 0.000 0.257 383 D C 0.220 176.614 176.300 0.156 0.000 1.217 383 D CA 0.301 54.394 54.000 0.154 0.000 0.897 383 D CB 0.492 41.359 40.800 0.111 0.000 1.132 383 D HN 0.522 8.892 8.370 0.000 0.000 0.493 384 S N 3.714 119.480 115.700 0.111 0.000 3.324 384 S HA 0.132 4.582 4.470 -0.034 0.000 0.229 384 S C 0.503 175.163 174.600 0.100 0.000 1.417 384 S CA -0.786 57.475 58.200 0.101 0.000 1.211 384 S CB -0.400 62.835 63.200 0.059 0.000 1.157 384 S HN 0.480 8.790 8.310 0.000 0.000 0.491 385 M N 1.558 121.233 119.600 0.124 0.000 2.249 385 M HA 0.297 4.756 4.480 -0.034 0.000 0.351 385 M C 0.528 176.910 176.300 0.138 0.000 1.180 385 M CA -0.280 55.096 55.300 0.126 0.000 1.127 385 M CB 1.378 34.059 32.600 0.136 0.000 1.546 385 M HN 0.278 8.568 8.290 0.000 0.000 0.461 386 V N 2.801 122.795 119.914 0.133 0.000 2.490 386 V HA 0.417 4.517 4.120 -0.034 0.000 0.238 386 V C 0.336 176.557 176.094 0.213 0.000 1.056 386 V CA 1.035 63.426 62.300 0.152 0.000 1.075 386 V CB 0.374 32.259 31.823 0.103 0.000 0.746 386 V HN 0.902 9.092 8.190 0.000 0.000 0.479 387 A N -0.429 122.525 122.820 0.223 0.000 2.604 387 A HA 0.646 4.946 4.320 -0.034 0.000 0.295 387 A C -1.238 176.487 177.584 0.235 0.000 1.067 387 A CA -0.734 51.478 52.037 0.293 0.000 0.683 387 A CB 1.281 20.602 19.000 0.535 0.000 1.281 387 A HN 0.208 8.358 8.150 0.000 0.000 0.407 388 K N 0.813 121.335 120.400 0.203 0.000 2.185 388 K HA 0.597 4.897 4.320 -0.034 0.000 0.269 388 K C -1.152 175.562 176.600 0.190 0.000 0.987 388 K CA -0.333 56.048 56.287 0.157 0.000 0.865 388 K CB 2.132 34.679 32.500 0.079 0.000 1.090 388 K HN 0.560 8.810 8.250 0.000 0.000 0.450 389 L N 4.312 125.668 121.223 0.221 0.000 2.305 389 L HA 0.457 4.777 4.340 -0.034 0.000 0.284 389 L C -1.469 175.525 176.870 0.205 0.000 1.013 389 L CA -0.876 54.108 54.840 0.241 0.000 0.819 389 L CB 0.727 42.987 42.059 0.335 0.000 1.227 389 L HN 0.499 8.729 8.230 0.000 0.000 0.417 390 I N 6.096 126.735 120.570 0.116 0.000 2.433 390 I HA 0.414 4.564 4.170 -0.034 0.000 0.292 390 I C -0.517 175.666 176.117 0.110 0.000 1.001 390 I CA -0.311 61.024 61.300 0.059 0.000 1.119 390 I CB 1.743 39.733 38.000 -0.018 0.000 1.289 390 I HN 0.445 8.655 8.210 0.000 0.000 0.438 391 I N 5.919 126.579 120.570 0.150 0.000 2.378 391 I HA 0.369 4.518 4.170 -0.034 0.000 0.291 391 I C -0.878 175.356 176.117 0.195 0.000 0.992 391 I CA -0.031 61.379 61.300 0.184 0.000 1.154 391 I CB 0.775 38.935 38.000 0.266 0.000 1.315 391 I HN 0.615 8.825 8.210 0.000 0.000 0.448 392 H N 7.457 126.555 119.070 0.048 0.000 2.646 392 H HA 0.501 5.036 4.556 -0.034 0.000 0.328 392 H C -1.176 174.207 175.328 0.091 0.000 0.998 392 H CA -0.664 55.407 56.048 0.039 0.000 1.225 392 H CB 1.081 30.829 29.762 -0.025 0.000 1.457 392 H HN 0.584 8.864 8.280 0.000 0.000 0.505 393 E N 4.221 124.381 120.200 -0.067 0.000 2.393 393 E HA 0.198 4.528 4.350 -0.034 0.000 0.265 393 E C -2.021 174.508 176.600 -0.118 0.000 0.941 393 E CA -2.025 54.350 56.400 -0.042 0.000 0.801 393 E CB 2.173 31.922 29.700 0.081 0.000 1.313 393 E HN 0.462 8.822 8.360 0.000 0.000 0.435 394 P HA -0.070 4.350 4.420 0.000 0.000 0.222 394 P C 0.225 177.535 177.300 0.017 0.000 1.147 394 P CA 1.378 64.463 63.100 -0.025 0.000 0.790 394 P CB 0.264 31.957 31.700 -0.011 0.000 0.780 395 T N -5.823 108.743 114.554 0.021 0.000 2.864 395 T HA 0.414 4.744 4.350 -0.034 0.000 0.299 395 T C 0.721 175.392 174.700 -0.048 0.000 1.166 395 T CA -0.962 61.137 62.100 -0.003 0.000 1.007 395 T CB 2.158 71.009 68.868 -0.028 0.000 1.219 395 T HN -0.235 8.005 8.240 0.000 0.000 0.506 396 R N 0.138 120.506 120.500 -0.220 0.000 2.066 396 R HA -0.088 4.231 4.340 -0.034 0.000 0.232 396 R C 1.333 177.527 176.300 -0.177 0.000 1.131 396 R CA 1.922 57.747 56.100 -0.459 0.000 0.955 396 R CB -0.527 29.334 30.300 -0.732 0.000 0.851 396 R HN 0.711 8.981 8.270 0.000 0.000 0.432 397 D N 0.548 120.878 120.400 -0.117 0.000 2.133 397 D HA -0.186 4.434 4.640 -0.034 0.000 0.195 397 D C 1.708 178.006 176.300 -0.004 0.000 0.997 397 D CA 1.435 55.407 54.000 -0.045 0.000 0.840 397 D CB -0.176 40.600 40.800 -0.039 0.000 0.947 397 D HN 0.430 8.800 8.370 0.000 0.000 0.452 398 E N 0.350 120.547 120.200 -0.005 0.000 2.077 398 E HA -0.122 4.207 4.350 -0.034 0.000 0.193 398 E C 2.107 178.745 176.600 0.064 0.000 0.989 398 E CA 0.961 57.373 56.400 0.021 0.000 0.800 398 E CB -0.039 29.667 29.700 0.011 0.000 0.746 398 E HN 0.212 8.572 8.360 0.000 0.000 0.452 399 A N 1.122 123.992 122.820 0.083 0.000 1.902 399 A HA -0.178 4.121 4.320 -0.034 0.000 0.217 399 A C 2.158 179.858 177.584 0.193 0.000 1.181 399 A CA 1.044 53.175 52.037 0.157 0.000 0.623 399 A CB -0.560 18.570 19.000 0.217 0.000 0.818 399 A HN 0.145 8.295 8.150 0.000 0.000 0.443 400 I N -0.708 119.961 120.570 0.166 0.000 2.163 400 I HA -0.300 3.849 4.170 -0.034 0.000 0.243 400 I C 2.695 178.894 176.117 0.137 0.000 1.085 400 I CA 1.336 62.757 61.300 0.203 0.000 1.347 400 I CB -0.268 37.840 38.000 0.181 0.000 1.044 400 I HN 0.290 8.500 8.210 0.000 0.000 0.408 401 M N 0.135 119.789 119.600 0.090 0.000 2.086 401 M HA -0.172 4.288 4.480 -0.034 0.000 0.261 401 M C 2.570 178.907 176.300 0.062 0.000 1.067 401 M CA 2.026 57.361 55.300 0.059 0.000 1.116 401 M CB -1.346 31.276 32.600 0.037 0.000 1.348 401 M HN 0.304 8.594 8.290 0.000 0.000 0.407 402 A N -0.053 122.818 122.820 0.086 0.000 1.969 402 A HA 0.044 4.344 4.320 -0.034 0.000 0.218 402 A C 2.402 180.046 177.584 0.100 0.000 1.169 402 A CA 1.771 53.865 52.037 0.095 0.000 0.635 402 A CB -1.276 17.800 19.000 0.128 0.000 0.810 402 A HN 0.527 8.677 8.150 0.000 0.000 0.445 403 G N 0.018 108.898 108.800 0.135 0.000 2.408 403 G HA2 -0.131 3.809 3.960 -0.034 0.000 0.217 403 G HA3 -0.131 3.809 3.960 -0.034 0.000 0.217 403 G C 1.499 176.363 174.900 -0.059 0.000 1.150 403 G CA 1.007 46.165 45.100 0.097 0.000 0.776 403 G HN 0.467 8.757 8.290 0.000 0.000 0.542 404 I N 0.178 120.730 120.570 -0.029 0.000 2.179 404 I HA -0.172 3.977 4.170 -0.034 0.000 0.242 404 I C 2.893 178.995 176.117 -0.025 0.000 1.088 404 I CA 1.038 62.307 61.300 -0.051 0.000 1.357 404 I CB -0.238 37.749 38.000 -0.021 0.000 1.051 404 I HN 0.086 8.296 8.210 0.000 0.000 0.409 405 R N 1.718 122.219 120.500 0.003 0.000 2.094 405 R HA -0.229 4.090 4.340 -0.034 0.000 0.239 405 R C 2.226 178.531 176.300 0.008 0.000 1.137 405 R CA 2.295 58.401 56.100 0.010 0.000 0.943 405 R CB -0.566 29.748 30.300 0.023 0.000 0.850 405 R HN 0.374 8.644 8.270 0.000 0.000 0.433 406 A N 1.142 123.970 122.820 0.013 0.000 1.873 406 A HA -0.088 4.211 4.320 -0.034 0.000 0.215 406 A C 2.536 180.135 177.584 0.025 0.000 1.186 406 A CA 1.270 53.313 52.037 0.010 0.000 0.616 406 A CB -0.598 18.419 19.000 0.029 0.000 0.823 406 A HN 0.364 8.514 8.150 0.000 0.000 0.442 407 L N -0.268 120.954 121.223 -0.001 0.000 2.131 407 L HA -0.146 4.173 4.340 -0.034 0.000 0.210 407 L C 2.650 179.547 176.870 0.046 0.000 1.092 407 L CA 1.351 56.204 54.840 0.022 0.000 0.759 407 L CB -0.252 41.725 42.059 -0.137 0.000 0.903 407 L HN 0.295 8.525 8.230 0.000 0.000 0.435 408 S N -0.388 115.320 115.700 0.013 0.000 2.453 408 S HA -0.139 4.311 4.470 -0.034 0.000 0.231 408 S C 1.512 176.131 174.600 0.032 0.000 1.005 408 S CA 1.225 59.433 58.200 0.014 0.000 0.949 408 S CB -0.158 63.042 63.200 -0.000 0.000 0.774 408 S HN 0.632 8.942 8.310 0.000 0.000 0.510 409 E N -0.153 120.074 120.200 0.044 0.000 2.498 409 E HA 0.172 4.501 4.350 -0.034 0.000 0.203 409 E C 0.134 176.787 176.600 0.087 0.000 1.013 409 E CA -0.387 56.038 56.400 0.042 0.000 0.927 409 E CB -0.168 29.537 29.700 0.008 0.000 1.012 409 E HN 0.449 8.809 8.360 0.000 0.000 0.482 410 F N 2.646 122.558 119.950 -0.063 0.000 2.487 410 F HA 0.145 4.654 4.527 -0.030 0.000 0.364 410 F C -0.479 175.268 175.800 -0.088 0.000 1.126 410 F CA -0.853 57.091 58.000 -0.093 0.000 1.135 410 F CB 0.607 39.561 39.000 -0.077 0.000 1.127 410 F HN -0.175 8.125 8.300 0.000 0.000 0.559 411 V N 7.300 127.375 119.914 0.269 0.000 2.383 411 V HA 0.268 4.368 4.120 -0.034 0.000 0.275 411 V C -0.261 175.868 176.094 0.058 0.000 1.036 411 V CA -0.527 61.832 62.300 0.099 0.000 0.889 411 V CB 1.303 33.163 31.823 0.061 0.000 0.985 411 V HN 0.451 8.641 8.190 0.000 0.000 0.459 412 V N 7.012 126.924 119.914 -0.003 0.000 2.439 412 V HA 0.419 4.518 4.120 -0.034 0.000 0.277 412 V C -0.351 175.760 176.094 0.029 0.000 1.008 412 V CA -0.272 62.045 62.300 0.028 0.000 0.846 412 V CB 1.406 33.191 31.823 -0.063 0.000 1.031 412 V HN 0.647 8.837 8.190 0.000 0.000 0.441 413 L N 3.309 124.567 121.223 0.058 0.000 2.334 413 L HA 0.866 5.186 4.340 -0.034 0.000 0.275 413 L C 1.296 178.188 176.870 0.035 0.000 1.036 413 L CA 0.293 55.155 54.840 0.037 0.000 0.807 413 L CB 1.713 43.795 42.059 0.038 0.000 1.231 413 L HN 0.786 9.016 8.230 0.000 0.000 0.438 414 G N 2.546 111.355 108.800 0.016 0.000 2.284 414 G HA2 -0.216 3.724 3.960 -0.034 0.000 0.216 414 G HA3 -0.216 3.724 3.960 -0.034 0.000 0.216 414 G C -0.118 174.778 174.900 -0.006 0.000 1.009 414 G CA 0.124 45.228 45.100 0.007 0.000 0.625 414 G HN 0.633 8.923 8.290 0.000 0.000 0.501 415 I N -1.365 119.202 120.570 -0.006 0.000 2.785 415 I HA 0.719 4.869 4.170 -0.034 0.000 0.302 415 I C -1.085 175.021 176.117 -0.019 0.000 1.069 415 I CA -1.401 59.889 61.300 -0.018 0.000 1.045 415 I CB 1.899 39.886 38.000 -0.023 0.000 1.236 415 I HN -0.144 8.066 8.210 0.000 0.000 0.429 416 D N 3.296 123.680 120.400 -0.026 0.000 2.341 416 D HA 0.355 4.974 4.640 -0.034 0.000 0.245 416 D C 0.185 176.454 176.300 -0.052 0.000 1.106 416 D CA 0.239 54.219 54.000 -0.033 0.000 0.905 416 D CB 1.811 42.591 40.800 -0.033 0.000 1.202 416 D HN 0.838 9.208 8.370 0.000 0.000 0.426 417 T N -3.195 111.318 114.554 -0.070 0.000 2.858 417 T HA 0.410 4.740 4.350 -0.034 0.000 0.285 417 T C 0.903 175.529 174.700 -0.123 0.000 1.052 417 T CA -0.673 61.377 62.100 -0.084 0.000 1.009 417 T CB 1.369 70.177 68.868 -0.099 0.000 1.241 417 T HN 0.277 8.517 8.240 0.000 0.000 0.542 418 T N -1.045 113.452 114.554 -0.095 0.000 3.144 418 T HA 0.254 4.584 4.350 -0.034 0.000 0.249 418 T C 1.858 176.531 174.700 -0.045 0.000 1.089 418 T CA -0.116 61.899 62.100 -0.141 0.000 0.989 418 T CB -0.879 67.935 68.868 -0.089 0.000 0.992 418 T HN 0.545 8.785 8.240 0.000 0.000 0.540 419 I N 2.163 122.732 120.570 -0.002 0.000 2.113 419 I HA -0.155 3.995 4.170 -0.034 0.000 0.242 419 I C -0.585 175.514 176.117 -0.030 0.000 1.057 419 I CA 1.612 62.927 61.300 0.025 0.000 1.314 419 I CB -1.067 36.891 38.000 -0.071 0.000 1.022 419 I HN 0.241 8.451 8.210 0.000 0.000 0.408 420 P HA -0.213 4.207 4.420 0.000 0.000 0.219 420 P C 1.632 178.830 177.300 -0.171 0.000 1.146 420 P CA 1.418 64.456 63.100 -0.105 0.000 0.808 420 P CB -0.172 31.464 31.700 -0.107 0.000 0.779 421 F N -0.089 119.642 119.950 -0.365 0.000 2.146 421 F HA -0.177 4.343 4.527 -0.012 0.000 0.298 421 F C 2.115 177.745 175.800 -0.283 0.000 1.096 421 F CA 1.689 59.475 58.000 -0.356 0.000 1.275 421 F CB -0.779 37.986 39.000 -0.392 0.000 1.008 421 F HN -0.005 8.295 8.300 0.000 0.000 0.480 422 H N -0.147 118.802 119.070 -0.203 0.000 2.395 422 H HA -0.033 4.503 4.556 -0.034 0.000 0.299 422 H C 2.293 177.369 175.328 -0.421 0.000 1.070 422 H CA 1.789 57.627 56.048 -0.350 0.000 1.356 422 H CB -0.127 29.493 29.762 -0.237 0.000 1.401 422 H HN 0.292 8.572 8.280 0.000 0.000 0.524 423 I N 0.860 121.310 120.570 -0.200 0.000 2.226 423 I HA -0.256 3.893 4.170 -0.034 0.000 0.245 423 I C 2.017 178.020 176.117 -0.191 0.000 1.100 423 I CA 1.351 62.544 61.300 -0.179 0.000 1.374 423 I CB -0.149 37.785 38.000 -0.109 0.000 1.057 423 I HN 0.222 8.432 8.210 0.000 0.000 0.413 424 K N 0.276 120.536 120.400 -0.233 0.000 2.097 424 K HA -0.190 4.109 4.320 -0.034 0.000 0.206 424 K C 2.102 178.529 176.600 -0.287 0.000 1.049 424 K CA 1.150 57.307 56.287 -0.217 0.000 0.933 424 K CB -0.298 32.086 32.500 -0.194 0.000 0.717 424 K HN 0.151 8.401 8.250 0.000 0.000 0.442 425 L N 1.539 122.457 121.223 -0.508 0.000 2.012 425 L HA -0.156 4.164 4.340 -0.034 0.000 0.210 425 L C 1.896 178.480 176.870 -0.476 0.000 1.073 425 L CA 1.578 56.064 54.840 -0.590 0.000 0.748 425 L CB -0.299 41.238 42.059 -0.869 0.000 0.891 425 L HN 0.123 8.353 8.230 0.000 0.000 0.431 426 L N -0.806 120.219 121.223 -0.329 0.000 2.291 426 L HA -0.131 4.189 4.340 -0.034 0.000 0.214 426 L C 1.290 178.178 176.870 0.030 0.000 1.120 426 L CA 0.991 55.781 54.840 -0.083 0.000 0.799 426 L CB -0.520 41.518 42.059 -0.035 0.000 0.925 426 L HN 0.389 8.618 8.230 0.000 0.000 0.446 427 N N -0.602 118.081 118.700 -0.028 0.000 2.322 427 N HA -0.020 4.700 4.740 -0.034 0.000 0.194 427 N C 0.361 175.895 175.510 0.040 0.000 1.126 427 N CA -0.133 52.924 53.050 0.012 0.000 0.845 427 N CB 0.127 38.606 38.487 -0.012 0.000 0.976 427 N HN 0.190 8.570 8.380 0.000 0.000 0.475 428 N N 0.994 119.731 118.700 0.061 0.000 2.472 428 N HA 0.009 4.729 4.740 -0.034 0.000 0.277 428 N C -0.208 175.398 175.510 0.160 0.000 1.081 428 N CA -0.034 53.084 53.050 0.114 0.000 0.973 428 N CB 0.966 39.545 38.487 0.154 0.000 1.105 428 N HN 0.015 8.395 8.380 0.000 0.000 0.470 429 D N 3.883 124.363 120.400 0.133 0.000 2.144 429 D HA -0.060 4.560 4.640 -0.034 0.000 0.200 429 D C 1.780 178.158 176.300 0.130 0.000 0.978 429 D CA 0.936 55.004 54.000 0.113 0.000 0.833 429 D CB 0.337 41.189 40.800 0.087 0.000 0.961 429 D HN 0.610 8.980 8.370 0.000 0.000 0.470 430 I N 0.321 121.000 120.570 0.180 0.000 2.142 430 I HA -0.251 3.898 4.170 -0.034 0.000 0.240 430 I C 2.272 178.465 176.117 0.126 0.000 1.078 430 I CA 0.744 62.164 61.300 0.201 0.000 1.343 430 I CB -0.264 37.956 38.000 0.367 0.000 1.046 430 I HN -0.109 8.101 8.210 0.000 0.000 0.405 431 F N 1.954 121.794 119.950 -0.182 0.000 2.120 431 F HA -0.251 4.257 4.527 -0.032 0.000 0.300 431 F C 2.681 178.494 175.800 0.021 0.000 1.095 431 F CA 1.713 59.518 58.000 -0.325 0.000 1.249 431 F CB -0.287 38.474 39.000 -0.399 0.000 0.995 431 F HN -0.136 8.164 8.300 0.000 0.000 0.480 432 R N 0.029 120.566 120.500 0.063 0.000 2.096 432 R HA -0.152 4.167 4.340 -0.034 0.000 0.235 432 R C 2.584 178.844 176.300 -0.066 0.000 1.127 432 R CA 1.529 57.620 56.100 -0.015 0.000 0.968 432 R CB -0.767 29.578 30.300 0.076 0.000 0.861 432 R HN 0.486 8.756 8.270 0.000 0.000 0.440 433 S N -0.522 115.173 115.700 -0.008 0.000 2.419 433 S HA -0.091 4.358 4.470 -0.034 0.000 0.235 433 S C 1.676 176.229 174.600 -0.078 0.000 1.019 433 S CA 1.222 59.411 58.200 -0.018 0.000 0.982 433 S CB -0.215 63.004 63.200 0.031 0.000 0.789 433 S HN 0.566 8.876 8.310 0.000 0.000 0.490 434 G N 0.535 109.276 108.800 -0.098 0.000 2.179 434 G HA2 -0.277 3.663 3.960 -0.034 0.000 0.260 434 G HA3 -0.277 3.663 3.960 -0.034 0.000 0.260 434 G C -0.032 174.603 174.900 -0.442 0.000 0.977 434 G CA 0.462 45.419 45.100 -0.238 0.000 0.641 434 G HN 0.635 8.925 8.290 0.000 0.000 0.533 435 K N 0.303 120.579 120.400 -0.207 0.000 2.334 435 K HA 0.653 4.953 4.320 -0.034 0.000 0.265 435 K C -0.312 176.265 176.600 -0.038 0.000 1.039 435 K CA -0.533 55.623 56.287 -0.219 0.000 0.920 435 K CB 0.509 32.974 32.500 -0.059 0.000 1.160 435 K HN 0.515 8.765 8.250 0.000 0.000 0.451 436 F N -0.515 119.411 119.950 -0.041 0.000 2.858 436 F HA 0.439 4.946 4.527 -0.033 0.000 0.319 436 F C -1.131 174.680 175.800 0.019 0.000 1.166 436 F CA -1.518 56.491 58.000 0.016 0.000 0.899 436 F CB 0.648 39.615 39.000 -0.055 0.000 1.332 436 F HN 0.356 8.656 8.300 0.000 0.000 0.461 437 N N -1.970 116.910 118.700 0.300 0.000 3.091 437 N HA 0.393 5.113 4.740 -0.034 0.000 0.329 437 N C 0.381 175.980 175.510 0.148 0.000 1.430 437 N CA -0.115 53.004 53.050 0.116 0.000 0.755 437 N CB 0.171 38.670 38.487 0.020 0.000 1.626 437 N HN 0.801 9.181 8.380 0.000 0.000 0.614 438 T N -3.058 111.412 114.554 -0.140 0.000 2.977 438 T HA -0.103 4.226 4.350 -0.034 0.000 0.271 438 T C 0.328 175.036 174.700 0.015 0.000 1.105 438 T CA 1.253 63.272 62.100 -0.136 0.000 1.116 438 T CB -1.015 67.552 68.868 -0.502 0.000 0.878 438 T HN 0.656 8.896 8.240 0.000 0.000 0.509 439 N N 0.294 119.023 118.700 0.048 0.000 2.322 439 N HA 0.271 4.991 4.740 -0.034 0.000 0.216 439 N C 0.748 176.328 175.510 0.116 0.000 1.144 439 N CA -0.346 52.752 53.050 0.079 0.000 0.830 439 N CB -0.223 38.306 38.487 0.070 0.000 1.034 439 N HN 0.298 8.678 8.380 0.000 0.000 0.484 440 F N 1.633 121.613 119.950 0.049 0.000 2.069 440 F HA -0.094 4.412 4.527 -0.036 0.000 0.298 440 F C 1.427 177.232 175.800 0.010 0.000 1.113 440 F CA 1.456 59.476 58.000 0.034 0.000 1.214 440 F CB -0.105 38.873 39.000 -0.037 0.000 0.978 440 F HN 0.018 8.318 8.300 0.000 0.000 0.474 441 L N -0.218 120.943 121.223 -0.105 0.000 2.551 441 L HA -0.069 4.250 4.340 -0.034 0.000 0.228 441 L C 1.952 178.727 176.870 -0.157 0.000 1.153 441 L CA 0.861 55.588 54.840 -0.188 0.000 0.851 441 L CB -0.627 41.442 42.059 0.017 0.000 0.959 441 L HN 0.260 8.490 8.230 0.000 0.000 0.451 442 E N -0.328 119.809 120.200 -0.105 0.000 2.276 442 E HA -0.088 4.241 4.350 -0.034 0.000 0.193 442 E C 1.829 178.385 176.600 -0.074 0.000 0.983 442 E CA 0.340 56.700 56.400 -0.067 0.000 0.861 442 E CB 0.268 29.958 29.700 -0.016 0.000 0.817 442 E HN 0.539 8.899 8.360 0.000 0.000 0.485 443 Q N -0.036 119.705 119.800 -0.098 0.000 2.408 443 Q HA 0.125 4.445 4.340 -0.034 0.000 0.205 443 Q C 0.182 176.094 176.000 -0.147 0.000 0.919 443 Q CA 0.268 56.021 55.803 -0.083 0.000 0.932 443 Q CB 0.527 29.246 28.738 -0.031 0.000 1.058 443 Q HN 0.111 8.381 8.270 0.000 0.000 0.517 444 N N -0.039 118.490 118.700 -0.285 0.000 2.362 444 N HA 0.321 5.040 4.740 -0.034 0.000 0.299 444 N C -1.112 174.257 175.510 -0.234 0.000 1.170 444 N CA -0.328 52.524 53.050 -0.330 0.000 0.825 444 N CB 2.094 40.165 38.487 -0.694 0.000 1.299 444 N HN -0.188 8.192 8.380 0.000 0.000 0.502 445 S N 1.640 117.254 115.700 -0.144 0.000 2.252 445 S HA 0.233 4.683 4.470 -0.034 0.000 0.187 445 S C 1.479 176.059 174.600 -0.034 0.000 1.587 445 S CA -0.515 57.647 58.200 -0.063 0.000 1.215 445 S CB 0.078 63.261 63.200 -0.028 0.000 1.085 445 S HN 0.421 8.731 8.310 0.000 0.000 0.466 446 I N 1.806 122.362 120.570 -0.023 0.000 2.248 446 I HA -0.157 3.993 4.170 -0.034 0.000 0.248 446 I C 2.108 178.226 176.117 0.001 0.000 1.107 446 I CA 1.630 62.919 61.300 -0.018 0.000 1.373 446 I CB -0.730 37.254 38.000 -0.027 0.000 1.055 446 I HN 0.525 8.735 8.210 0.000 0.000 0.418 447 M N 0.130 119.757 119.600 0.046 0.000 2.394 447 M HA -0.097 4.363 4.480 -0.034 0.000 0.264 447 M C 1.557 177.895 176.300 0.063 0.000 1.073 447 M CA 0.982 56.298 55.300 0.027 0.000 1.111 447 M CB -1.373 31.231 32.600 0.006 0.000 1.401 447 M HN 0.261 8.551 8.290 0.000 0.000 0.448 448 N N 0.749 119.476 118.700 0.045 0.000 2.409 448 N HA -0.041 4.679 4.740 -0.034 0.000 0.179 448 N C 0.273 175.802 175.510 0.032 0.000 1.032 448 N CA 0.424 53.499 53.050 0.042 0.000 0.898 448 N CB -0.145 38.357 38.487 0.025 0.000 0.971 448 N HN 0.307 8.687 8.380 0.000 0.000 0.441 449 D N 0.000 120.412 120.400 0.020 0.000 6.856 449 D HA 0.000 4.620 4.640 -0.034 0.000 0.175 449 D CA 0.000 54.008 54.000 0.013 0.000 0.868 449 D CB 0.000 40.800 40.800 0.000 0.000 0.688 449 D HN 0.000 8.370 8.370 0.000 0.000 0.683