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 3irm_1_C DATA FIRST_RESID 2 DATA SEQUENCE SLFKIRMPET VAEGTRLALR AFSLVVAVDE HGGIGDGRSI PWNVPEDMKF DATA SEQUENCE FRDLTTKLRG KNVKPSPAKR NAVVMGRKTW DSIPPKFRPL PGRLNVVLSS DATA SEQUENCE TLTTQHLLDG LPDEEKRNLH ADSIVAVNGG LEQALRLLAS PNYTPSIETV DATA SEQUENCE YCIGGGSVYA EALRPPCVHL LQAIYRTTIR ASESSCSVFF RVPESGTEAA DATA SEQUENCE AGIEWQRETI SEELTSANGN ETKYYFEKLI PRNREEEQYL SLVDRIIREG DATA SEQUENCE NVKHDRTGVG TLSIFGAQMR FSLRNNRLPL LTTKRVFWRG VCEELLWFLR DATA SEQUENCE GETYAKKLSD KGVHIWDDNG SRAFLDSRGL TEYEEMDLGP VYGFQWRHFG DATA SEQUENCE AAYTHHDANY DGQGVDQIKA IVETLKTNPD DRRMLFTAWN PSALPRMALP DATA SEQUENCE PCHLLAQFYV SNGELSCMLY QRSCDMGLGV PFNIASYALL TILIAKATGL DATA SEQUENCE RPGELVHTLG DAHVYSNHVE PCNEQLKRVP RAFPYLVFRR EREFLEDYEE DATA SEQUENCE GDMEVIDYAP YPPISM 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 S HA 0.000 4.470 4.470 -0.000 0.000 0.327 2 S C 0.000 174.451 174.600 -0.248 0.000 1.055 2 S CA 0.000 57.980 58.200 -0.366 0.000 1.107 2 S CB 0.000 63.049 63.200 -0.251 0.000 0.593 3 L N 1.673 122.737 121.223 -0.266 0.000 2.552 3 L HA 0.184 4.521 4.340 -0.005 0.000 0.227 3 L C 1.164 177.908 176.870 -0.211 0.000 1.146 3 L CA 0.785 55.488 54.840 -0.228 0.000 0.858 3 L CB -0.294 41.572 42.059 -0.323 0.000 0.969 3 L HN 0.358 8.588 8.230 -0.000 0.000 0.451 4 F N -0.223 119.694 119.950 -0.055 0.000 2.473 4 F HA 0.060 4.584 4.527 -0.005 0.000 0.294 4 F C 1.502 177.273 175.800 -0.049 0.000 1.103 4 F CA 0.211 58.190 58.000 -0.035 0.000 1.442 4 F CB -0.155 38.828 39.000 -0.028 0.000 1.097 4 F HN -0.122 8.178 8.300 -0.000 0.000 0.547 5 K N 0.414 120.843 120.400 0.048 0.000 2.127 5 K HA 0.350 4.667 4.320 -0.005 0.000 0.240 5 K C -0.428 176.258 176.600 0.142 0.000 1.024 5 K CA -0.660 55.630 56.287 0.006 0.000 0.918 5 K CB 1.003 33.316 32.500 -0.312 0.000 1.108 5 K HN -0.243 8.007 8.250 -0.000 0.000 0.485 6 I N 2.370 123.076 120.570 0.227 0.000 2.330 6 I HA 0.203 4.370 4.170 -0.005 0.000 0.286 6 I C 0.281 176.595 176.117 0.329 0.000 1.025 6 I CA -0.395 61.037 61.300 0.220 0.000 1.197 6 I CB 0.765 38.835 38.000 0.117 0.000 1.358 6 I HN 0.542 8.752 8.210 -0.000 0.000 0.467 7 R N 6.504 127.174 120.500 0.284 0.000 2.442 7 R HA 0.261 4.598 4.340 -0.005 0.000 0.291 7 R C -0.200 176.068 176.300 -0.053 0.000 1.069 7 R CA -0.554 55.545 56.100 -0.003 0.000 1.022 7 R CB 0.676 30.925 30.300 -0.086 0.000 0.976 7 R HN 0.384 8.654 8.270 -0.000 0.000 0.443 8 M N 6.405 125.939 119.600 -0.111 0.000 2.233 8 M HA 0.226 4.703 4.480 -0.005 0.000 0.350 8 M C -1.760 174.488 176.300 -0.088 0.000 1.176 8 M CA -2.388 52.879 55.300 -0.056 0.000 1.150 8 M CB 0.444 33.039 32.600 -0.008 0.000 1.530 8 M HN 0.553 8.843 8.290 -0.000 0.000 0.459 9 P HA 0.130 4.550 4.420 -0.000 0.000 0.277 9 P C 0.118 177.380 177.300 -0.064 0.000 1.276 9 P CA -0.133 62.928 63.100 -0.064 0.000 0.788 9 P CB 0.837 32.504 31.700 -0.055 0.000 1.114 10 E N -0.523 119.644 120.200 -0.056 0.000 2.427 10 E HA -0.044 4.303 4.350 -0.005 0.000 0.196 10 E C 1.460 178.035 176.600 -0.042 0.000 1.028 10 E CA 1.109 57.479 56.400 -0.050 0.000 0.864 10 E CB -0.755 28.919 29.700 -0.043 0.000 0.813 10 E HN 0.587 8.947 8.360 -0.000 0.000 0.514 11 T N -2.215 112.313 114.554 -0.043 0.000 3.144 11 T HA 0.096 4.443 4.350 -0.005 0.000 0.249 11 T C 1.803 176.474 174.700 -0.048 0.000 1.089 11 T CA 0.214 62.290 62.100 -0.039 0.000 0.989 11 T CB 0.111 68.957 68.868 -0.037 0.000 0.992 11 T HN -0.062 8.178 8.240 -0.000 0.000 0.540 12 V N 1.695 121.576 119.914 -0.054 0.000 2.313 12 V HA -0.217 3.900 4.120 -0.005 0.000 0.253 12 V C 2.698 178.740 176.094 -0.086 0.000 1.070 12 V CA 2.462 64.721 62.300 -0.068 0.000 1.057 12 V CB -1.124 30.675 31.823 -0.040 0.000 0.653 12 V HN 0.700 8.890 8.190 -0.000 0.000 0.450 13 A N -1.464 121.325 122.820 -0.051 0.000 1.943 13 A HA -0.041 4.276 4.320 -0.005 0.000 0.213 13 A C 2.195 179.765 177.584 -0.022 0.000 1.181 13 A CA 1.071 53.086 52.037 -0.036 0.000 0.653 13 A CB -0.531 18.469 19.000 0.000 0.000 0.833 13 A HN 0.669 8.819 8.150 -0.000 0.000 0.451 14 E N 0.150 120.338 120.200 -0.020 0.000 2.033 14 E HA -0.213 4.134 4.350 -0.005 0.000 0.199 14 E C 1.906 178.502 176.600 -0.008 0.000 1.011 14 E CA 1.473 57.867 56.400 -0.010 0.000 0.815 14 E CB -0.484 29.208 29.700 -0.013 0.000 0.755 14 E HN 0.469 8.829 8.360 -0.000 0.000 0.451 15 G N -0.507 108.281 108.800 -0.021 0.000 2.653 15 G HA2 -0.172 3.785 3.960 -0.005 0.000 0.212 15 G HA3 -0.172 3.785 3.960 -0.005 0.000 0.212 15 G C 1.110 176.007 174.900 -0.005 0.000 1.138 15 G CA 1.332 46.423 45.100 -0.015 0.000 0.782 15 G HN 0.442 8.732 8.290 -0.000 0.000 0.535 16 T N -3.360 111.191 114.554 -0.004 0.000 3.399 16 T HA 0.357 4.704 4.350 -0.005 0.000 0.305 16 T C 0.486 175.228 174.700 0.070 0.000 0.983 16 T CA -0.676 61.442 62.100 0.030 0.000 0.967 16 T CB 0.294 69.162 68.868 -0.001 0.000 1.186 16 T HN 0.149 8.389 8.240 -0.000 0.000 0.504 17 R N 1.606 122.137 120.500 0.052 0.000 2.401 17 R HA 0.331 4.668 4.340 -0.005 0.000 0.299 17 R C -0.289 176.050 176.300 0.064 0.000 1.064 17 R CA -0.701 55.436 56.100 0.061 0.000 1.000 17 R CB 0.225 30.549 30.300 0.041 0.000 0.973 17 R HN 0.288 8.558 8.270 -0.000 0.000 0.438 18 L N 5.306 126.572 121.223 0.070 0.000 2.562 18 L HA 0.046 4.383 4.340 -0.005 0.000 0.271 18 L C 0.820 177.710 176.870 0.033 0.000 1.167 18 L CA 0.741 55.612 54.840 0.052 0.000 0.917 18 L CB 0.820 42.901 42.059 0.037 0.000 1.187 18 L HN 0.851 9.081 8.230 -0.000 0.000 0.482 19 A N 6.164 129.004 122.820 0.033 0.000 1.840 19 A HA 0.182 4.499 4.320 -0.005 0.000 0.214 19 A C 0.693 178.283 177.584 0.010 0.000 1.198 19 A CA 0.910 52.963 52.037 0.027 0.000 0.608 19 A CB -0.225 18.799 19.000 0.039 0.000 0.839 19 A HN 0.606 8.756 8.150 -0.000 0.000 0.443 20 L N -0.720 120.503 121.223 0.001 0.000 2.386 20 L HA 0.521 4.858 4.340 -0.005 0.000 0.271 20 L C -0.228 176.603 176.870 -0.066 0.000 0.993 20 L CA -1.053 53.775 54.840 -0.020 0.000 0.819 20 L CB 1.959 44.025 42.059 0.012 0.000 1.294 20 L HN 0.247 8.477 8.230 -0.000 0.000 0.414 21 R N 2.168 122.627 120.500 -0.069 0.000 2.441 21 R HA 0.608 4.945 4.340 -0.005 0.000 0.284 21 R C -0.276 175.992 176.300 -0.053 0.000 1.070 21 R CA -0.004 56.036 56.100 -0.101 0.000 1.047 21 R CB 1.207 31.472 30.300 -0.058 0.000 1.016 21 R HN 0.695 8.965 8.270 -0.000 0.000 0.477 22 A N 4.026 126.749 122.820 -0.163 0.000 2.366 22 A HA 0.510 4.827 4.320 -0.005 0.000 0.249 22 A C -0.543 177.161 177.584 0.200 0.000 1.084 22 A CA 0.053 52.084 52.037 -0.010 0.000 0.794 22 A CB -0.188 18.711 19.000 -0.168 0.000 1.034 22 A HN 0.747 8.897 8.150 -0.000 0.000 0.491 23 F N -1.474 118.461 119.950 -0.025 0.000 2.779 23 F HA 0.768 5.292 4.527 -0.005 0.000 0.316 23 F C -0.401 175.408 175.800 0.015 0.000 1.164 23 F CA -0.797 57.175 58.000 -0.047 0.000 0.924 23 F CB 1.008 39.994 39.000 -0.024 0.000 1.348 23 F HN 0.419 8.719 8.300 -0.000 0.000 0.467 24 S N 1.150 116.758 115.700 -0.153 0.000 2.600 24 S HA 0.738 5.205 4.470 -0.005 0.000 0.300 24 S C -1.552 173.172 174.600 0.206 0.000 1.087 24 S CA -0.806 57.355 58.200 -0.066 0.000 0.965 24 S CB 1.988 65.245 63.200 0.095 0.000 1.089 24 S HN 0.793 9.103 8.310 -0.000 0.000 0.496 25 L N 2.395 123.781 121.223 0.272 0.000 2.346 25 L HA 0.788 5.125 4.340 -0.005 0.000 0.276 25 L C -1.680 175.444 176.870 0.423 0.000 1.006 25 L CA -0.591 54.485 54.840 0.393 0.000 0.817 25 L CB 1.307 43.557 42.059 0.318 0.000 1.272 25 L HN 0.455 8.685 8.230 -0.000 0.000 0.421 26 V N 5.331 125.502 119.914 0.429 0.000 2.531 26 V HA 0.695 4.812 4.120 -0.005 0.000 0.301 26 V C -0.576 175.683 176.094 0.275 0.000 1.034 26 V CA -0.642 61.880 62.300 0.369 0.000 0.865 26 V CB 1.658 33.681 31.823 0.333 0.000 0.995 26 V HN 0.554 8.744 8.190 -0.000 0.000 0.424 27 V N 3.268 123.216 119.914 0.056 0.000 3.147 27 V HA 0.968 5.085 4.120 -0.005 0.000 0.306 27 V C -0.938 175.119 176.094 -0.061 0.000 1.209 27 V CA -0.111 62.104 62.300 -0.142 0.000 1.023 27 V CB 2.516 33.757 31.823 -0.970 0.000 1.059 27 V HN 1.276 9.466 8.190 -0.000 0.000 0.435 28 A N 4.371 127.206 122.820 0.026 0.000 2.330 28 A HA 0.916 5.233 4.320 -0.005 0.000 0.313 28 A C -0.745 176.970 177.584 0.219 0.000 1.124 28 A CA -0.006 52.104 52.037 0.122 0.000 0.774 28 A CB 1.505 20.659 19.000 0.257 0.000 1.198 28 A HN 2.009 10.159 8.150 -0.000 0.000 0.465 29 V N 0.112 120.027 119.914 0.001 0.000 3.102 29 V HA 0.865 4.982 4.120 -0.005 0.000 0.312 29 V C -0.532 175.287 176.094 -0.457 0.000 1.135 29 V CA -0.787 61.502 62.300 -0.018 0.000 1.022 29 V CB 1.842 33.676 31.823 0.018 0.000 1.056 29 V HN 0.935 9.125 8.190 -0.000 0.000 0.436 30 D N -0.097 120.055 120.400 -0.413 0.000 2.506 30 D HA 0.264 4.901 4.640 -0.005 0.000 0.272 30 D C 0.802 176.945 176.300 -0.262 0.000 1.214 30 D CA -0.168 53.512 54.000 -0.534 0.000 1.067 30 D CB 0.777 41.390 40.800 -0.312 0.000 1.117 30 D HN 0.707 9.077 8.370 -0.000 0.000 0.578 31 E N -1.731 118.286 120.200 -0.305 0.000 2.209 31 E HA -0.217 4.130 4.350 -0.005 0.000 0.196 31 E C 1.269 177.728 176.600 -0.235 0.000 0.993 31 E CA 1.023 57.249 56.400 -0.289 0.000 0.819 31 E CB -0.008 29.462 29.700 -0.384 0.000 0.745 31 E HN 0.410 8.770 8.360 -0.000 0.000 0.477 32 H N -1.733 117.385 119.070 0.080 0.000 2.539 32 H HA 0.161 4.711 4.556 -0.010 0.000 0.267 32 H C 1.427 176.924 175.328 0.280 0.000 0.982 32 H CA 0.884 57.033 56.048 0.168 0.000 1.146 32 H CB 0.986 30.911 29.762 0.271 0.000 1.382 32 H HN 0.355 8.635 8.280 -0.000 0.000 0.577 33 G N 0.492 109.472 108.800 0.300 0.000 2.175 33 G HA2 -0.242 3.715 3.960 -0.005 0.000 0.244 33 G HA3 -0.242 3.715 3.960 -0.005 0.000 0.244 33 G C 0.887 176.040 174.900 0.423 0.000 0.982 33 G CA 0.079 45.385 45.100 0.344 0.000 0.641 33 G HN 0.720 9.010 8.290 -0.000 0.000 0.527 34 G N -0.504 108.527 108.800 0.384 0.000 2.441 34 G HA2 0.502 4.459 3.960 -0.005 0.000 0.243 34 G HA3 0.502 4.459 3.960 -0.005 0.000 0.243 34 G C 1.027 176.094 174.900 0.278 0.000 1.281 34 G CA 0.181 45.354 45.100 0.122 0.000 0.854 34 G HN 0.400 8.690 8.290 -0.000 0.000 0.560 35 I N 1.373 122.041 120.570 0.162 0.000 2.512 35 I HA 0.352 4.519 4.170 -0.005 0.000 0.247 35 I C 1.658 177.780 176.117 0.007 0.000 1.094 35 I CA 1.412 62.832 61.300 0.200 0.000 1.427 35 I CB 0.011 38.116 38.000 0.174 0.000 1.149 35 I HN 0.730 8.940 8.210 -0.000 0.000 0.438 36 G N 0.108 108.866 108.800 -0.070 0.000 2.393 36 G HA2 0.121 4.078 3.960 -0.005 0.000 0.264 36 G HA3 0.121 4.078 3.960 -0.005 0.000 0.264 36 G C -1.692 173.128 174.900 -0.133 0.000 1.221 36 G CA 0.037 45.021 45.100 -0.193 0.000 0.912 36 G HN 0.152 8.442 8.290 -0.000 0.000 0.483 37 D N -0.318 119.998 120.400 -0.140 0.000 2.938 37 D HA 0.367 5.004 4.640 -0.005 0.000 0.369 37 D C 1.277 177.527 176.300 -0.083 0.000 1.301 37 D CA 0.407 54.348 54.000 -0.099 0.000 0.805 37 D CB 0.321 41.066 40.800 -0.091 0.000 1.161 37 D HN 1.817 10.187 8.370 -0.000 0.000 0.474 38 G N 1.626 110.382 108.800 -0.074 0.000 2.249 38 G HA2 -0.424 3.533 3.960 -0.005 0.000 0.269 38 G HA3 -0.424 3.533 3.960 -0.005 0.000 0.269 38 G C 1.185 176.045 174.900 -0.067 0.000 0.979 38 G CA 1.095 46.160 45.100 -0.058 0.000 0.644 38 G HN 0.510 8.800 8.290 -0.000 0.000 0.546 39 R N -0.972 119.474 120.500 -0.089 0.000 2.716 39 R HA 0.297 4.634 4.340 -0.005 0.000 0.186 39 R C 0.621 176.846 176.300 -0.125 0.000 0.830 39 R CA 0.773 56.817 56.100 -0.093 0.000 1.059 39 R CB 0.496 30.748 30.300 -0.079 0.000 1.531 39 R HN 0.608 8.878 8.270 -0.000 0.000 0.633 40 S N 0.561 116.167 115.700 -0.156 0.000 2.536 40 S HA 0.558 5.025 4.470 -0.005 0.000 0.287 40 S C -0.237 174.168 174.600 -0.325 0.000 1.101 40 S CA -0.832 57.243 58.200 -0.207 0.000 0.950 40 S CB 1.862 64.955 63.200 -0.178 0.000 1.056 40 S HN 0.166 8.476 8.310 -0.000 0.000 0.481 41 I N 2.208 122.536 120.570 -0.403 0.000 2.578 41 I HA 0.297 4.464 4.170 -0.005 0.000 0.284 41 I C -2.028 173.669 176.117 -0.700 0.000 1.156 41 I CA -2.228 58.651 61.300 -0.702 0.000 1.165 41 I CB 0.493 38.182 38.000 -0.518 0.000 1.567 41 I HN 0.436 8.646 8.210 -0.000 0.000 0.546 42 P HA -0.207 4.213 4.420 -0.000 0.000 0.219 42 P C -0.182 177.003 177.300 -0.190 0.000 1.147 42 P CA 1.261 64.142 63.100 -0.365 0.000 0.821 42 P CB -0.082 31.462 31.700 -0.260 0.000 0.771 43 W N 0.463 121.734 121.300 -0.049 0.000 2.546 43 W HA 0.230 4.888 4.660 -0.004 0.000 0.323 43 W C 0.309 176.786 176.519 -0.071 0.000 1.272 43 W CA -0.834 56.475 57.345 -0.060 0.000 1.404 43 W CB -1.438 27.981 29.460 -0.069 0.000 1.411 43 W HN 0.009 8.189 8.180 -0.000 0.000 0.480 44 N N 2.540 121.306 118.700 0.109 0.000 3.301 44 N HA 0.217 4.954 4.740 -0.005 0.000 0.289 44 N C -1.145 174.373 175.510 0.013 0.000 1.343 44 N CA -0.090 52.982 53.050 0.037 0.000 1.136 44 N CB 0.297 38.792 38.487 0.012 0.000 1.402 44 N HN 0.069 8.449 8.380 -0.000 0.000 0.516 45 V N 4.249 124.157 119.914 -0.010 0.000 2.356 45 V HA 0.195 4.312 4.120 -0.005 0.000 0.258 45 V C -1.067 174.966 176.094 -0.101 0.000 1.065 45 V CA -1.287 60.939 62.300 -0.123 0.000 0.935 45 V CB 1.053 32.700 31.823 -0.293 0.000 1.061 45 V HN 0.525 8.715 8.190 -0.000 0.000 0.484 46 P HA -0.188 4.232 4.420 -0.000 0.000 0.218 46 P C 1.014 178.313 177.300 -0.001 0.000 1.146 46 P CA 1.207 64.295 63.100 -0.020 0.000 0.813 46 P CB 0.612 32.309 31.700 -0.006 0.000 0.778 47 E N -0.214 119.954 120.200 -0.054 0.000 2.208 47 E HA -0.146 4.201 4.350 -0.005 0.000 0.193 47 E C 1.813 178.518 176.600 0.175 0.000 0.988 47 E CA 1.143 57.568 56.400 0.043 0.000 0.828 47 E CB -0.734 28.968 29.700 0.004 0.000 0.763 47 E HN 0.321 8.681 8.360 -0.000 0.000 0.478 48 D N -0.575 119.857 120.400 0.053 0.000 2.162 48 D HA -0.108 4.529 4.640 -0.005 0.000 0.203 48 D C 1.729 178.200 176.300 0.284 0.000 0.967 48 D CA 0.744 54.897 54.000 0.254 0.000 0.840 48 D CB 0.113 40.967 40.800 0.090 0.000 0.972 48 D HN -0.015 8.355 8.370 -0.000 0.000 0.482 49 M N 0.451 120.136 119.600 0.141 0.000 2.080 49 M HA -0.105 4.372 4.480 -0.005 0.000 0.260 49 M C 2.040 178.433 176.300 0.155 0.000 1.068 49 M CA 1.549 56.917 55.300 0.114 0.000 1.109 49 M CB -0.249 32.372 32.600 0.035 0.000 1.342 49 M HN -0.092 8.198 8.290 -0.000 0.000 0.405 50 K N -1.103 119.373 120.400 0.126 0.000 2.026 50 K HA -0.216 4.101 4.320 -0.005 0.000 0.208 50 K C 1.991 178.641 176.600 0.083 0.000 1.048 50 K CA 1.714 58.053 56.287 0.087 0.000 0.929 50 K CB -0.433 32.118 32.500 0.084 0.000 0.713 50 K HN 0.281 8.531 8.250 -0.000 0.000 0.439 51 F N 0.998 120.962 119.950 0.024 0.000 2.095 51 F HA -0.227 4.298 4.527 -0.004 0.000 0.298 51 F C 1.881 177.621 175.800 -0.100 0.000 1.104 51 F CA 1.591 59.538 58.000 -0.088 0.000 1.232 51 F CB -0.640 38.265 39.000 -0.159 0.000 0.987 51 F HN 0.123 8.423 8.300 -0.000 0.000 0.475 52 F N 1.201 121.036 119.950 -0.192 0.000 2.134 52 F HA -0.150 4.373 4.527 -0.006 0.000 0.299 52 F C 2.677 178.253 175.800 -0.374 0.000 1.097 52 F CA 2.163 59.970 58.000 -0.322 0.000 1.264 52 F CB -0.678 38.270 39.000 -0.088 0.000 1.001 52 F HN -0.041 8.259 8.300 -0.000 0.000 0.479 53 R N 0.361 120.801 120.500 -0.099 0.000 2.070 53 R HA -0.167 4.170 4.340 -0.005 0.000 0.233 53 R C 1.961 178.048 176.300 -0.355 0.000 1.137 53 R CA 2.187 58.183 56.100 -0.172 0.000 0.945 53 R CB -0.554 29.727 30.300 -0.032 0.000 0.845 53 R HN 0.265 8.535 8.270 -0.000 0.000 0.430 54 D N 0.716 120.914 120.400 -0.337 0.000 2.097 54 D HA -0.180 4.457 4.640 -0.005 0.000 0.195 54 D C 1.913 177.915 176.300 -0.497 0.000 0.989 54 D CA 1.001 54.799 54.000 -0.337 0.000 0.827 54 D CB -0.435 40.217 40.800 -0.248 0.000 0.966 54 D HN 0.180 8.550 8.370 -0.000 0.000 0.456 55 L N 1.100 121.856 121.223 -0.779 0.000 1.971 55 L HA -0.203 4.134 4.340 -0.005 0.000 0.215 55 L C 2.396 178.669 176.870 -0.995 0.000 1.072 55 L CA 2.724 56.990 54.840 -0.957 0.000 0.758 55 L CB -1.304 39.887 42.059 -1.448 0.000 0.889 55 L HN 0.181 8.411 8.230 -0.000 0.000 0.433 56 T N -5.359 108.467 114.554 -1.213 0.000 2.951 56 T HA -0.088 4.259 4.350 -0.005 0.000 0.268 56 T C 1.587 175.970 174.700 -0.528 0.000 1.073 56 T CA 1.490 62.884 62.100 -1.177 0.000 1.134 56 T CB -0.813 67.325 68.868 -1.216 0.000 0.884 56 T HN 0.441 8.681 8.240 -0.000 0.000 0.479 57 T N 1.061 115.365 114.554 -0.418 0.000 2.939 57 T HA 0.164 4.511 4.350 -0.005 0.000 0.254 57 T C 0.783 175.393 174.700 -0.150 0.000 1.041 57 T CA 0.259 62.227 62.100 -0.219 0.000 1.142 57 T CB -0.037 68.722 68.868 -0.181 0.000 0.874 57 T HN 0.408 8.648 8.240 -0.000 0.000 0.452 58 K N 1.764 122.057 120.400 -0.179 0.000 2.451 58 K HA 0.285 4.602 4.320 -0.005 0.000 0.280 58 K C -0.368 176.193 176.600 -0.065 0.000 1.020 58 K CA -0.018 56.200 56.287 -0.115 0.000 1.008 58 K CB 0.445 32.866 32.500 -0.131 0.000 0.917 58 K HN 0.222 8.472 8.250 -0.000 0.000 0.478 59 L N 2.741 123.943 121.223 -0.035 0.000 2.431 59 L HA 0.385 4.722 4.340 -0.005 0.000 0.260 59 L C 0.862 177.724 176.870 -0.013 0.000 1.098 59 L CA -0.952 53.882 54.840 -0.009 0.000 0.800 59 L CB 0.674 42.732 42.059 -0.001 0.000 1.210 59 L HN 0.484 8.714 8.230 -0.000 0.000 0.465 60 R N 0.028 120.526 120.500 -0.003 0.000 2.679 60 R HA 0.368 4.705 4.340 -0.005 0.000 0.269 60 R C 0.564 176.859 176.300 -0.008 0.000 1.076 60 R CA 0.658 56.753 56.100 -0.009 0.000 1.160 60 R CB 0.365 30.661 30.300 -0.007 0.000 1.054 60 R HN 0.888 9.159 8.270 -0.000 0.000 0.507 61 G N 1.720 110.512 108.800 -0.013 0.000 2.547 61 G HA2 -0.388 3.569 3.960 -0.005 0.000 0.271 61 G HA3 -0.388 3.569 3.960 -0.005 0.000 0.271 61 G C -0.462 174.433 174.900 -0.008 0.000 1.209 61 G CA 0.304 45.399 45.100 -0.008 0.000 0.959 61 G HN 0.783 9.073 8.290 -0.000 0.000 0.563 62 K N 0.343 120.741 120.400 -0.003 0.000 2.336 62 K HA -0.050 4.267 4.320 -0.005 0.000 0.262 62 K C 0.268 176.863 176.600 -0.008 0.000 0.989 62 K CA 0.840 57.125 56.287 -0.004 0.000 0.853 62 K CB 0.031 32.532 32.500 0.001 0.000 0.989 62 K HN 0.462 8.712 8.250 -0.000 0.000 0.535 63 N N 0.802 119.498 118.700 -0.007 0.000 3.243 63 N HA 0.012 4.749 4.740 -0.005 0.000 0.310 63 N C -0.589 174.916 175.510 -0.008 0.000 1.313 63 N CA -0.020 53.023 53.050 -0.011 0.000 1.204 63 N CB 0.183 38.664 38.487 -0.009 0.000 1.483 63 N HN 0.373 8.753 8.380 -0.000 0.000 0.553 64 V N 1.032 120.942 119.914 -0.007 0.000 2.439 64 V HA 0.038 4.155 4.120 -0.005 0.000 0.271 64 V C 0.506 176.597 176.094 -0.006 0.000 1.040 64 V CA -0.503 61.796 62.300 -0.003 0.000 1.002 64 V CB 0.323 32.147 31.823 0.002 0.000 1.000 64 V HN 0.249 8.439 8.190 -0.000 0.000 0.477 65 K N 7.780 128.178 120.400 -0.003 0.000 2.322 65 K HA 0.415 4.732 4.320 -0.005 0.000 0.283 65 K C -2.360 174.241 176.600 0.001 0.000 1.042 65 K CA -1.413 54.871 56.287 -0.004 0.000 0.958 65 K CB 0.851 33.350 32.500 -0.001 0.000 0.984 65 K HN 0.546 8.796 8.250 -0.000 0.000 0.473 66 P HA -0.014 4.406 4.420 -0.000 0.000 0.267 66 P C -1.255 176.054 177.300 0.015 0.000 1.200 66 P CA -0.026 63.078 63.100 0.007 0.000 0.772 66 P CB 0.969 32.669 31.700 0.000 0.000 0.855 67 S N 1.307 117.020 115.700 0.021 0.000 2.615 67 S HA 0.498 4.965 4.470 -0.005 0.000 0.269 67 S C -2.511 172.107 174.600 0.031 0.000 1.161 67 S CA -1.383 56.832 58.200 0.025 0.000 0.817 67 S CB 1.333 64.544 63.200 0.020 0.000 1.131 67 S HN 0.040 8.350 8.310 -0.000 0.000 0.467 68 P HA 0.009 4.429 4.420 -0.000 0.000 0.218 68 P C 1.338 178.652 177.300 0.024 0.000 1.146 68 P CA 1.950 65.070 63.100 0.033 0.000 0.813 68 P CB -0.126 31.589 31.700 0.025 0.000 0.778 69 A N -2.017 120.813 122.820 0.018 0.000 2.021 69 A HA 0.021 4.338 4.320 -0.005 0.000 0.216 69 A C 1.178 178.775 177.584 0.021 0.000 1.163 69 A CA 1.067 53.111 52.037 0.013 0.000 0.676 69 A CB -0.376 18.630 19.000 0.010 0.000 0.818 69 A HN 0.038 8.188 8.150 -0.000 0.000 0.453 70 K N -0.089 120.327 120.400 0.026 0.000 2.695 70 K HA 0.410 4.727 4.320 -0.005 0.000 0.255 70 K C -0.788 175.830 176.600 0.030 0.000 1.016 70 K CA -0.339 55.965 56.287 0.028 0.000 0.928 70 K CB 0.589 33.103 32.500 0.023 0.000 1.235 70 K HN 0.593 8.843 8.250 -0.000 0.000 0.467 71 R N 1.318 121.841 120.500 0.040 0.000 2.741 71 R HA 0.535 4.872 4.340 -0.005 0.000 0.274 71 R C -1.011 175.321 176.300 0.052 0.000 1.029 71 R CA -1.079 55.044 56.100 0.039 0.000 0.880 71 R CB 0.564 30.889 30.300 0.042 0.000 1.264 71 R HN 0.299 8.569 8.270 -0.000 0.000 0.465 72 N N -0.556 118.178 118.700 0.056 0.000 2.476 72 N HA 0.646 5.383 4.740 -0.005 0.000 0.276 72 N C -1.022 174.541 175.510 0.087 0.000 1.204 72 N CA -0.269 52.834 53.050 0.088 0.000 0.974 72 N CB 1.801 40.378 38.487 0.151 0.000 1.204 72 N HN 0.687 9.067 8.380 -0.000 0.000 0.543 73 A N -0.112 122.770 122.820 0.104 0.000 2.401 73 A HA 0.662 4.979 4.320 -0.005 0.000 0.310 73 A C -0.685 176.978 177.584 0.133 0.000 1.075 73 A CA -0.667 51.417 52.037 0.079 0.000 0.746 73 A CB 0.958 19.970 19.000 0.020 0.000 1.277 73 A HN 0.381 8.531 8.150 -0.000 0.000 0.425 74 V N -0.132 119.849 119.914 0.112 0.000 2.540 74 V HA 0.798 4.915 4.120 -0.005 0.000 0.302 74 V C -0.576 175.577 176.094 0.099 0.000 1.035 74 V CA -0.756 61.638 62.300 0.156 0.000 0.873 74 V CB 1.046 32.977 31.823 0.179 0.000 0.992 74 V HN 0.625 8.815 8.190 -0.000 0.000 0.428 75 V N 6.662 126.631 119.914 0.092 0.000 2.417 75 V HA 0.721 4.838 4.120 -0.005 0.000 0.291 75 V C 0.085 176.194 176.094 0.026 0.000 1.024 75 V CA -0.295 62.013 62.300 0.013 0.000 0.861 75 V CB 1.411 33.204 31.823 -0.050 0.000 0.985 75 V HN 1.110 9.300 8.190 -0.000 0.000 0.436 76 M N 3.291 122.894 119.600 0.005 0.000 2.618 76 M HA 0.881 5.358 4.480 -0.005 0.000 0.281 76 M C 0.061 176.345 176.300 -0.027 0.000 1.267 76 M CA -0.573 54.727 55.300 0.000 0.000 0.845 76 M CB 2.154 34.801 32.600 0.078 0.000 1.732 76 M HN 0.581 8.871 8.290 -0.000 0.000 0.461 77 G N 0.547 109.320 108.800 -0.043 0.000 2.599 77 G HA2 0.262 4.219 3.960 -0.005 0.000 0.264 77 G HA3 0.262 4.219 3.960 -0.005 0.000 0.264 77 G C 0.329 175.239 174.900 0.017 0.000 1.200 77 G CA -0.556 44.522 45.100 -0.037 0.000 0.896 77 G HN 0.886 9.176 8.290 -0.000 0.000 0.536 78 R N 0.081 120.588 120.500 0.012 0.000 2.115 78 R HA -0.035 4.302 4.340 -0.005 0.000 0.230 78 R C 2.173 178.545 176.300 0.120 0.000 1.111 78 R CA 1.297 57.434 56.100 0.062 0.000 0.976 78 R CB -0.284 30.029 30.300 0.021 0.000 0.870 78 R HN 0.590 8.860 8.270 -0.000 0.000 0.445 79 K N -0.908 119.525 120.400 0.054 0.000 2.148 79 K HA -0.028 4.289 4.320 -0.005 0.000 0.204 79 K C 1.903 178.519 176.600 0.027 0.000 1.050 79 K CA 1.668 57.975 56.287 0.033 0.000 0.942 79 K CB 0.048 32.547 32.500 -0.003 0.000 0.724 79 K HN 0.122 8.372 8.250 -0.000 0.000 0.446 80 T N 0.434 115.008 114.554 0.032 0.000 2.904 80 T HA -0.142 4.205 4.350 -0.005 0.000 0.267 80 T C 1.120 175.858 174.700 0.064 0.000 1.059 80 T CA 0.658 62.764 62.100 0.010 0.000 1.137 80 T CB -0.105 68.756 68.868 -0.011 0.000 0.879 80 T HN 0.465 8.705 8.240 -0.000 0.000 0.467 81 W N 2.326 123.594 121.300 -0.054 0.000 2.381 81 W HA -0.113 4.544 4.660 -0.006 0.000 0.301 81 W C 1.014 177.511 176.519 -0.037 0.000 1.205 81 W CA 0.937 58.259 57.345 -0.038 0.000 1.285 81 W CB -0.220 29.224 29.460 -0.027 0.000 1.133 81 W HN 0.198 8.378 8.180 -0.000 0.000 0.521 82 D N 0.388 120.820 120.400 0.053 0.000 2.218 82 D HA -0.175 4.462 4.640 -0.005 0.000 0.204 82 D C 2.407 178.620 176.300 -0.144 0.000 0.976 82 D CA 2.063 56.026 54.000 -0.061 0.000 0.853 82 D CB -0.512 40.305 40.800 0.029 0.000 0.939 82 D HN 0.225 8.595 8.370 -0.000 0.000 0.481 83 S N -0.123 115.503 115.700 -0.124 0.000 2.481 83 S HA -0.035 4.432 4.470 -0.005 0.000 0.231 83 S C 1.064 175.559 174.600 -0.176 0.000 0.996 83 S CA -0.078 58.040 58.200 -0.136 0.000 0.942 83 S CB -0.349 62.781 63.200 -0.117 0.000 0.768 83 S HN 0.154 8.464 8.310 -0.000 0.000 0.520 84 I N 4.342 124.767 120.570 -0.243 0.000 2.396 84 I HA 0.240 4.407 4.170 -0.005 0.000 0.289 84 I C -2.198 173.752 176.117 -0.278 0.000 1.056 84 I CA -2.468 58.681 61.300 -0.252 0.000 1.365 84 I CB 0.584 38.377 38.000 -0.346 0.000 1.407 84 I HN 0.040 8.250 8.210 -0.000 0.000 0.509 85 P HA 0.061 4.481 4.420 -0.000 0.000 0.263 85 P C -2.237 174.866 177.300 -0.328 0.000 1.195 85 P CA -1.080 61.834 63.100 -0.309 0.000 0.762 85 P CB 0.345 31.789 31.700 -0.426 0.000 0.799 86 P HA -0.273 4.147 4.420 -0.000 0.000 0.222 86 P C 1.569 178.769 177.300 -0.167 0.000 1.157 86 P CA 2.543 65.515 63.100 -0.214 0.000 0.905 86 P CB -0.298 31.311 31.700 -0.151 0.000 0.792 87 K N -1.019 119.242 120.400 -0.231 0.000 2.160 87 K HA -0.147 4.170 4.320 -0.005 0.000 0.206 87 K C 1.562 178.216 176.600 0.089 0.000 1.047 87 K CA 1.646 57.849 56.287 -0.139 0.000 0.930 87 K CB -1.206 31.123 32.500 -0.286 0.000 0.720 87 K HN 0.220 8.470 8.250 -0.000 0.000 0.450 88 F N 1.034 120.920 119.950 -0.107 0.000 2.692 88 F HA 0.229 4.753 4.527 -0.005 0.000 0.303 88 F C 0.563 176.254 175.800 -0.183 0.000 1.114 88 F CA -1.002 56.926 58.000 -0.120 0.000 1.361 88 F CB 0.377 39.306 39.000 -0.118 0.000 1.063 88 F HN -0.158 8.142 8.300 -0.000 0.000 0.550 89 R N 2.013 122.477 120.500 -0.061 0.000 2.338 89 R HA 0.317 4.654 4.340 -0.005 0.000 0.317 89 R C -2.474 173.757 176.300 -0.116 0.000 0.968 89 R CA -1.685 54.272 56.100 -0.237 0.000 0.849 89 R CB 1.320 31.310 30.300 -0.517 0.000 1.128 89 R HN -0.126 8.144 8.270 -0.000 0.000 0.448 90 P HA 0.139 4.559 4.420 -0.000 0.000 0.280 90 P C -0.604 176.661 177.300 -0.058 0.000 1.272 90 P CA -0.547 62.554 63.100 0.001 0.000 0.819 90 P CB 0.891 32.707 31.700 0.193 0.000 1.122 91 L N 1.464 122.707 121.223 0.033 0.000 2.562 91 L HA 0.113 4.450 4.340 -0.005 0.000 0.271 91 L C -1.870 174.994 176.870 -0.009 0.000 1.167 91 L CA -1.494 53.359 54.840 0.021 0.000 0.917 91 L CB -0.837 41.279 42.059 0.095 0.000 1.187 91 L HN 0.206 8.436 8.230 -0.000 0.000 0.482 92 P HA -0.042 4.378 4.420 -0.000 0.000 0.263 92 P C 0.874 178.158 177.300 -0.026 0.000 1.175 92 P CA 0.733 63.809 63.100 -0.041 0.000 0.761 92 P CB 0.624 32.294 31.700 -0.051 0.000 0.794 93 G N 1.776 110.571 108.800 -0.009 0.000 2.175 93 G HA2 -0.299 3.658 3.960 -0.005 0.000 0.265 93 G HA3 -0.299 3.658 3.960 -0.005 0.000 0.265 93 G C 0.113 175.014 174.900 0.002 0.000 0.979 93 G CA 0.118 45.215 45.100 -0.004 0.000 0.663 93 G HN 0.595 8.885 8.290 -0.000 0.000 0.533 94 R N -1.029 119.479 120.500 0.013 0.000 2.795 94 R HA 0.655 4.992 4.340 -0.005 0.000 0.275 94 R C -0.112 176.219 176.300 0.052 0.000 0.981 94 R CA -1.039 55.079 56.100 0.030 0.000 0.917 94 R CB 1.644 31.956 30.300 0.020 0.000 1.202 94 R HN 0.123 8.393 8.270 -0.000 0.000 0.469 95 L N 2.607 123.866 121.223 0.061 0.000 2.360 95 L HA 0.240 4.577 4.340 -0.005 0.000 0.276 95 L C -0.729 176.170 176.870 0.048 0.000 1.121 95 L CA 0.129 55.007 54.840 0.062 0.000 0.845 95 L CB 0.431 42.533 42.059 0.072 0.000 1.143 95 L HN 0.669 8.899 8.230 -0.000 0.000 0.452 96 N N 4.768 123.496 118.700 0.047 0.000 2.439 96 N HA 0.231 4.968 4.740 -0.005 0.000 0.249 96 N C -0.968 174.505 175.510 -0.062 0.000 1.003 96 N CA -0.490 52.590 53.050 0.050 0.000 0.942 96 N CB 2.020 40.603 38.487 0.160 0.000 1.115 96 N HN 0.319 8.699 8.380 -0.000 0.000 0.505 97 V N 3.277 123.148 119.914 -0.072 0.000 2.347 97 V HA 0.296 4.413 4.120 -0.005 0.000 0.280 97 V C 0.183 176.188 176.094 -0.149 0.000 1.021 97 V CA -0.658 61.557 62.300 -0.142 0.000 0.847 97 V CB 1.530 33.261 31.823 -0.154 0.000 0.990 97 V HN 0.288 8.478 8.190 -0.000 0.000 0.444 98 V N 6.517 126.293 119.914 -0.231 0.000 2.448 98 V HA 0.451 4.568 4.120 -0.005 0.000 0.295 98 V C -0.099 175.883 176.094 -0.185 0.000 1.025 98 V CA -0.605 61.553 62.300 -0.237 0.000 0.859 98 V CB 1.776 33.309 31.823 -0.485 0.000 0.988 98 V HN 0.657 8.847 8.190 -0.000 0.000 0.431 99 L N 4.140 125.287 121.223 -0.127 0.000 2.290 99 L HA 0.702 5.039 4.340 -0.005 0.000 0.284 99 L C 0.271 177.090 176.870 -0.085 0.000 1.078 99 L CA 0.368 55.146 54.840 -0.103 0.000 0.815 99 L CB 1.224 43.232 42.059 -0.086 0.000 1.162 99 L HN 0.731 8.961 8.230 -0.000 0.000 0.435 100 S N 0.618 116.271 115.700 -0.078 0.000 2.542 100 S HA 0.275 4.742 4.470 -0.005 0.000 0.276 100 S C 0.167 174.743 174.600 -0.040 0.000 1.148 100 S CA -0.237 57.932 58.200 -0.053 0.000 0.886 100 S CB 1.735 64.900 63.200 -0.057 0.000 1.109 100 S HN 0.654 8.964 8.310 -0.000 0.000 0.458 101 S N 1.655 117.341 115.700 -0.022 0.000 2.557 101 S HA 0.164 4.631 4.470 -0.005 0.000 0.223 101 S C 1.092 175.693 174.600 0.001 0.000 0.969 101 S CA 0.711 58.902 58.200 -0.015 0.000 0.927 101 S CB -0.152 63.041 63.200 -0.012 0.000 0.806 101 S HN 0.999 9.309 8.310 -0.000 0.000 0.489 102 T N -1.091 113.471 114.554 0.013 0.000 2.966 102 T HA 0.440 4.787 4.350 -0.005 0.000 0.254 102 T C 0.191 174.957 174.700 0.109 0.000 0.961 102 T CA -0.343 61.782 62.100 0.042 0.000 0.915 102 T CB -0.262 68.622 68.868 0.027 0.000 1.186 102 T HN 0.290 8.530 8.240 -0.000 0.000 0.505 103 L N 3.542 124.823 121.223 0.096 0.000 2.296 103 L HA 0.599 4.936 4.340 -0.005 0.000 0.286 103 L C 0.618 177.508 176.870 0.034 0.000 1.023 103 L CA -1.012 53.951 54.840 0.206 0.000 0.812 103 L CB 1.869 43.996 42.059 0.112 0.000 1.223 103 L HN 0.284 8.514 8.230 -0.000 0.000 0.421 104 T N -1.958 112.529 114.554 -0.112 0.000 2.824 104 T HA 0.152 4.499 4.350 -0.005 0.000 0.277 104 T C 1.143 175.730 174.700 -0.188 0.000 0.975 104 T CA -0.429 61.521 62.100 -0.250 0.000 0.966 104 T CB 1.251 69.847 68.868 -0.453 0.000 1.054 104 T HN 0.555 8.795 8.240 -0.000 0.000 0.533 105 T N 0.523 114.979 114.554 -0.163 0.000 2.746 105 T HA -0.117 4.230 4.350 -0.005 0.000 0.267 105 T C 2.124 176.773 174.700 -0.085 0.000 1.039 105 T CA 1.079 63.103 62.100 -0.126 0.000 1.142 105 T CB -0.316 68.497 68.868 -0.093 0.000 0.866 105 T HN 0.501 8.741 8.240 -0.000 0.000 0.444 106 Q N 0.532 120.268 119.800 -0.106 0.000 2.124 106 Q HA -0.113 4.224 4.340 -0.005 0.000 0.202 106 Q C 2.077 178.107 176.000 0.051 0.000 0.977 106 Q CA 1.596 57.372 55.803 -0.044 0.000 0.850 106 Q CB -0.412 28.282 28.738 -0.074 0.000 0.901 106 Q HN 0.760 9.030 8.270 -0.000 0.000 0.429 107 H N -0.582 118.483 119.070 -0.008 0.000 2.319 107 H HA -0.161 4.392 4.556 -0.005 0.000 0.299 107 H C 2.034 177.381 175.328 0.032 0.000 1.092 107 H CA 0.912 56.964 56.048 0.008 0.000 1.302 107 H CB 0.228 29.986 29.762 -0.006 0.000 1.373 107 H HN 0.083 8.363 8.280 -0.000 0.000 0.497 108 L N 0.069 121.365 121.223 0.122 0.000 2.013 108 L HA -0.209 4.128 4.340 -0.005 0.000 0.212 108 L C 2.266 179.252 176.870 0.193 0.000 1.073 108 L CA 1.207 56.101 54.840 0.090 0.000 0.753 108 L CB -0.760 41.173 42.059 -0.211 0.000 0.890 108 L HN 0.228 8.458 8.230 -0.000 0.000 0.432 109 L N -0.569 120.729 121.223 0.126 0.000 2.046 109 L HA -0.217 4.120 4.340 -0.005 0.000 0.208 109 L C 2.095 179.051 176.870 0.144 0.000 1.077 109 L CA 1.615 56.542 54.840 0.146 0.000 0.747 109 L CB -1.017 41.098 42.059 0.093 0.000 0.896 109 L HN 0.309 8.539 8.230 -0.000 0.000 0.432 110 D N -0.889 119.588 120.400 0.128 0.000 2.310 110 D HA -0.087 4.550 4.640 -0.005 0.000 0.212 110 D C 2.103 178.467 176.300 0.107 0.000 0.965 110 D CA 1.133 55.196 54.000 0.106 0.000 0.879 110 D CB -0.201 40.661 40.800 0.103 0.000 0.921 110 D HN 0.408 8.778 8.370 -0.000 0.000 0.510 111 G N 0.151 109.041 108.800 0.150 0.000 2.534 111 G HA2 -0.077 3.880 3.960 -0.005 0.000 0.217 111 G HA3 -0.077 3.880 3.960 -0.005 0.000 0.217 111 G C 0.643 175.611 174.900 0.114 0.000 1.128 111 G CA -0.013 45.173 45.100 0.144 0.000 0.784 111 G HN 0.113 8.403 8.290 -0.000 0.000 0.542 112 L N 0.844 122.149 121.223 0.137 0.000 2.416 112 L HA 0.289 4.626 4.340 -0.005 0.000 0.272 112 L C -0.880 176.029 176.870 0.066 0.000 1.161 112 L CA -1.828 53.080 54.840 0.114 0.000 0.845 112 L CB 1.155 43.316 42.059 0.170 0.000 1.119 112 L HN -0.094 8.136 8.230 -0.000 0.000 0.464 113 P HA -0.129 4.291 4.420 -0.000 0.000 0.210 113 P C -0.340 176.971 177.300 0.018 0.000 1.185 113 P CA 1.342 64.453 63.100 0.018 0.000 0.924 113 P CB 0.101 31.803 31.700 0.003 0.000 0.786 114 D N -1.467 118.945 120.400 0.019 0.000 2.487 114 D HA 0.117 4.754 4.640 -0.005 0.000 0.262 114 D C 0.677 176.979 176.300 0.004 0.000 1.130 114 D CA -0.495 53.510 54.000 0.008 0.000 1.038 114 D CB 0.855 41.656 40.800 0.002 0.000 1.142 114 D HN 0.108 8.478 8.370 -0.000 0.000 0.575 115 E N -0.851 119.347 120.200 -0.004 0.000 2.190 115 E HA -0.098 4.249 4.350 -0.005 0.000 0.191 115 E C 1.238 177.820 176.600 -0.030 0.000 0.978 115 E CA 0.541 56.935 56.400 -0.010 0.000 0.839 115 E CB 0.091 29.788 29.700 -0.005 0.000 0.787 115 E HN 0.568 8.928 8.360 -0.000 0.000 0.473 116 E N 1.059 121.237 120.200 -0.036 0.000 2.511 116 E HA -0.073 4.274 4.350 -0.005 0.000 0.196 116 E C 1.587 178.122 176.600 -0.109 0.000 1.066 116 E CA 0.650 57.017 56.400 -0.054 0.000 0.871 116 E CB 0.141 29.819 29.700 -0.035 0.000 0.863 116 E HN 0.011 8.371 8.360 -0.000 0.000 0.520 117 K N 0.675 121.003 120.400 -0.120 0.000 2.190 117 K HA 0.160 4.477 4.320 -0.005 0.000 0.202 117 K C 2.102 178.502 176.600 -0.332 0.000 1.045 117 K CA 0.125 56.265 56.287 -0.245 0.000 0.976 117 K CB 0.172 32.635 32.500 -0.061 0.000 0.849 117 K HN -0.039 8.211 8.250 -0.000 0.000 0.468 118 R N 0.779 121.218 120.500 -0.101 0.000 2.120 118 R HA -0.049 4.288 4.340 -0.005 0.000 0.234 118 R C 1.843 178.120 176.300 -0.039 0.000 1.123 118 R CA 1.156 57.245 56.100 -0.018 0.000 0.975 118 R CB -0.236 30.080 30.300 0.028 0.000 0.866 118 R HN 0.261 8.531 8.270 -0.000 0.000 0.446 119 N N 1.187 119.844 118.700 -0.071 0.000 2.058 119 N HA -0.178 4.559 4.740 -0.005 0.000 0.191 119 N C 1.836 177.314 175.510 -0.053 0.000 1.037 119 N CA 1.001 54.023 53.050 -0.046 0.000 0.848 119 N CB -0.411 38.050 38.487 -0.044 0.000 1.021 119 N HN 0.104 8.484 8.380 -0.000 0.000 0.422 120 L N 1.424 122.568 121.223 -0.132 0.000 2.042 120 L HA -0.145 4.192 4.340 -0.005 0.000 0.210 120 L C 1.352 178.250 176.870 0.046 0.000 1.076 120 L CA 1.825 56.610 54.840 -0.091 0.000 0.749 120 L CB -0.684 41.267 42.059 -0.180 0.000 0.893 120 L HN 0.315 8.545 8.230 -0.000 0.000 0.432 121 H N -1.186 117.917 119.070 0.056 0.000 2.547 121 H HA 0.254 4.807 4.556 -0.005 0.000 0.274 121 H C 2.000 177.367 175.328 0.066 0.000 1.024 121 H CA 0.052 56.144 56.048 0.072 0.000 1.155 121 H CB 0.076 29.898 29.762 0.099 0.000 1.344 121 H HN 0.516 8.796 8.280 -0.000 0.000 0.598 122 A N 1.146 124.049 122.820 0.138 0.000 1.858 122 A HA -0.195 4.122 4.320 -0.005 0.000 0.216 122 A C 1.901 179.536 177.584 0.086 0.000 1.190 122 A CA 1.691 53.782 52.037 0.090 0.000 0.617 122 A CB -0.230 18.801 19.000 0.052 0.000 0.827 122 A HN 0.353 8.503 8.150 -0.000 0.000 0.443 123 D N -0.125 120.326 120.400 0.084 0.000 2.378 123 D HA -0.020 4.617 4.640 -0.005 0.000 0.222 123 D C 1.340 177.696 176.300 0.094 0.000 0.980 123 D CA 1.070 55.117 54.000 0.077 0.000 0.907 123 D CB 0.008 40.847 40.800 0.064 0.000 0.899 123 D HN 0.387 8.757 8.370 -0.000 0.000 0.527 124 S N -0.220 115.546 115.700 0.110 0.000 2.556 124 S HA 0.190 4.657 4.470 -0.005 0.000 0.216 124 S C 0.865 175.509 174.600 0.074 0.000 0.970 124 S CA -0.121 58.137 58.200 0.098 0.000 0.912 124 S CB 1.149 64.409 63.200 0.099 0.000 0.790 124 S HN 0.153 8.463 8.310 -0.000 0.000 0.504 125 I N 0.935 121.538 120.570 0.055 0.000 2.545 125 I HA 0.553 4.720 4.170 -0.005 0.000 0.292 125 I C -1.177 174.904 176.117 -0.059 0.000 1.040 125 I CA -0.792 60.490 61.300 -0.029 0.000 1.068 125 I CB 2.340 40.311 38.000 -0.049 0.000 1.251 125 I HN -0.181 8.029 8.210 -0.000 0.000 0.424 126 V N 5.132 124.970 119.914 -0.126 0.000 2.711 126 V HA 0.761 4.878 4.120 -0.005 0.000 0.304 126 V C -0.624 175.360 176.094 -0.184 0.000 1.097 126 V CA -0.210 62.022 62.300 -0.115 0.000 0.906 126 V CB 1.850 33.632 31.823 -0.068 0.000 1.015 126 V HN 0.851 9.041 8.190 -0.000 0.000 0.427 127 A N 5.757 128.473 122.820 -0.174 0.000 2.310 127 A HA 0.855 5.172 4.320 -0.005 0.000 0.299 127 A C -0.770 176.729 177.584 -0.142 0.000 1.147 127 A CA -0.439 51.484 52.037 -0.189 0.000 0.818 127 A CB 1.492 20.384 19.000 -0.180 0.000 1.096 127 A HN 1.089 9.239 8.150 -0.000 0.000 0.495 128 V N 2.507 122.339 119.914 -0.138 0.000 2.487 128 V HA 0.238 4.355 4.120 -0.005 0.000 0.298 128 V C -0.158 175.881 176.094 -0.090 0.000 1.028 128 V CA -0.744 61.489 62.300 -0.111 0.000 0.860 128 V CB 1.741 33.490 31.823 -0.124 0.000 0.991 128 V HN 0.932 9.122 8.190 -0.000 0.000 0.427 129 N N 3.896 122.554 118.700 -0.071 0.000 2.868 129 N HA 0.577 5.314 4.740 -0.005 0.000 0.252 129 N C 0.031 175.512 175.510 -0.048 0.000 1.130 129 N CA 0.880 53.898 53.050 -0.054 0.000 1.026 129 N CB 0.353 38.814 38.487 -0.044 0.000 1.335 129 N HN 1.015 9.395 8.380 -0.000 0.000 0.516 130 G N -0.499 108.269 108.800 -0.053 0.000 2.333 130 G HA2 0.396 4.353 3.960 -0.005 0.000 0.288 130 G HA3 0.396 4.353 3.960 -0.005 0.000 0.288 130 G C -0.489 174.377 174.900 -0.056 0.000 1.286 130 G CA -0.356 44.716 45.100 -0.047 0.000 0.865 130 G HN 0.536 8.825 8.290 -0.000 0.000 0.506 131 G N -1.401 107.367 108.800 -0.053 0.000 2.583 131 G HA2 0.592 4.549 3.960 -0.005 0.000 0.280 131 G HA3 0.592 4.549 3.960 -0.005 0.000 0.280 131 G C 1.173 176.020 174.900 -0.088 0.000 1.376 131 G CA 0.253 45.317 45.100 -0.060 0.000 1.043 131 G HN 1.274 9.564 8.290 -0.000 0.000 0.538 132 L N -0.239 120.922 121.223 -0.103 0.000 2.013 132 L HA -0.131 4.206 4.340 -0.005 0.000 0.212 132 L C 2.586 179.350 176.870 -0.176 0.000 1.073 132 L CA 2.884 57.624 54.840 -0.167 0.000 0.753 132 L CB -0.601 41.342 42.059 -0.192 0.000 0.890 132 L HN 0.851 9.081 8.230 -0.000 0.000 0.432 133 E N -1.116 119.014 120.200 -0.117 0.000 2.070 133 E HA -0.331 4.016 4.350 -0.005 0.000 0.197 133 E C 2.100 178.649 176.600 -0.084 0.000 1.004 133 E CA 1.690 58.037 56.400 -0.088 0.000 0.805 133 E CB -0.081 29.596 29.700 -0.038 0.000 0.744 133 E HN 0.601 8.961 8.360 -0.000 0.000 0.451 134 Q N 0.002 119.756 119.800 -0.077 0.000 2.170 134 Q HA -0.057 4.280 4.340 -0.005 0.000 0.203 134 Q C 1.857 177.799 176.000 -0.098 0.000 0.976 134 Q CA 1.565 57.325 55.803 -0.071 0.000 0.858 134 Q CB -0.279 28.422 28.738 -0.062 0.000 0.907 134 Q HN 0.408 8.678 8.270 -0.000 0.000 0.433 135 A N 0.077 122.819 122.820 -0.130 0.000 1.897 135 A HA -0.092 4.225 4.320 -0.005 0.000 0.215 135 A C 1.963 179.441 177.584 -0.176 0.000 1.181 135 A CA 0.963 52.901 52.037 -0.165 0.000 0.620 135 A CB -0.570 18.322 19.000 -0.181 0.000 0.821 135 A HN 0.344 8.494 8.150 -0.000 0.000 0.443 136 L N -1.102 120.014 121.223 -0.180 0.000 2.141 136 L HA -0.130 4.207 4.340 -0.005 0.000 0.209 136 L C 2.757 179.569 176.870 -0.097 0.000 1.094 136 L CA 1.570 56.313 54.840 -0.162 0.000 0.763 136 L CB -0.463 41.484 42.059 -0.188 0.000 0.908 136 L HN 0.475 8.705 8.230 -0.000 0.000 0.437 137 R N 0.431 120.884 120.500 -0.077 0.000 2.075 137 R HA -0.151 4.186 4.340 -0.005 0.000 0.232 137 R C 2.391 178.674 176.300 -0.028 0.000 1.126 137 R CA 1.039 57.115 56.100 -0.040 0.000 0.963 137 R CB -0.153 30.130 30.300 -0.028 0.000 0.858 137 R HN 0.250 8.520 8.270 -0.000 0.000 0.435 138 L N 0.891 122.081 121.223 -0.055 0.000 2.017 138 L HA -0.147 4.190 4.340 -0.005 0.000 0.208 138 L C 1.807 178.662 176.870 -0.025 0.000 1.073 138 L CA 1.641 56.459 54.840 -0.036 0.000 0.745 138 L CB -0.734 41.262 42.059 -0.105 0.000 0.894 138 L HN 0.298 8.528 8.230 -0.000 0.000 0.432 139 L N 0.743 121.886 121.223 -0.133 0.000 2.261 139 L HA -0.089 4.248 4.340 -0.005 0.000 0.216 139 L C 2.708 179.601 176.870 0.039 0.000 1.114 139 L CA 1.675 56.449 54.840 -0.111 0.000 0.777 139 L CB -1.623 40.347 42.059 -0.149 0.000 0.910 139 L HN 0.350 8.580 8.230 -0.000 0.000 0.440 140 A N -2.038 120.796 122.820 0.023 0.000 2.208 140 A HA 0.059 4.376 4.320 -0.005 0.000 0.209 140 A C 1.480 179.105 177.584 0.069 0.000 1.161 140 A CA 0.133 52.189 52.037 0.031 0.000 0.782 140 A CB -0.343 18.660 19.000 0.005 0.000 0.816 140 A HN 0.335 8.485 8.150 -0.000 0.000 0.477 141 S N 0.834 116.604 115.700 0.117 0.000 2.573 141 S HA 0.207 4.674 4.470 -0.005 0.000 0.277 141 S C -1.522 173.128 174.600 0.084 0.000 1.346 141 S CA -0.645 57.623 58.200 0.112 0.000 1.034 141 S CB 0.652 63.950 63.200 0.162 0.000 0.879 141 S HN 0.172 8.482 8.310 -0.000 0.000 0.528 142 P HA -0.133 4.287 4.420 -0.000 0.000 0.218 142 P C 1.070 178.343 177.300 -0.045 0.000 1.148 142 P CA 0.894 63.999 63.100 0.009 0.000 0.822 142 P CB -0.053 31.651 31.700 0.007 0.000 0.784 143 N N -1.949 116.678 118.700 -0.121 0.000 2.494 143 N HA -0.129 4.608 4.740 -0.005 0.000 0.182 143 N C 0.771 175.989 175.510 -0.486 0.000 1.076 143 N CA 1.201 54.060 53.050 -0.318 0.000 0.908 143 N CB -0.668 37.550 38.487 -0.448 0.000 0.967 143 N HN 0.291 8.671 8.380 -0.000 0.000 0.449 144 Y N -0.001 120.298 120.300 -0.002 0.000 2.423 144 Y HA 0.323 4.870 4.550 -0.005 0.000 0.257 144 Y C 0.393 176.290 175.900 -0.004 0.000 1.087 144 Y CA -0.148 57.949 58.100 -0.004 0.000 1.258 144 Y CB 0.708 39.161 38.460 -0.011 0.000 1.237 144 Y HN -0.128 8.152 8.280 -0.000 0.000 0.517 145 T N 3.743 118.365 114.554 0.114 0.000 2.812 145 T HA 0.249 4.596 4.350 -0.005 0.000 0.282 145 T C -2.227 172.495 174.700 0.036 0.000 0.990 145 T CA -1.301 60.839 62.100 0.067 0.000 0.960 145 T CB 2.073 70.974 68.868 0.055 0.000 0.948 145 T HN -0.073 8.167 8.240 -0.000 0.000 0.438 146 P HA 0.099 4.519 4.420 -0.000 0.000 0.262 146 P C 1.350 178.671 177.300 0.035 0.000 1.304 146 P CA -0.048 63.070 63.100 0.029 0.000 0.859 146 P CB 0.120 31.829 31.700 0.016 0.000 1.310 147 S N 0.066 115.786 115.700 0.034 0.000 2.387 147 S HA -0.103 4.364 4.470 -0.005 0.000 0.230 147 S C 1.182 175.817 174.600 0.057 0.000 1.035 147 S CA 0.669 58.891 58.200 0.036 0.000 1.014 147 S CB -0.970 62.240 63.200 0.017 0.000 0.836 147 S HN 0.030 8.340 8.310 -0.000 0.000 0.466 148 I N 2.737 123.357 120.570 0.082 0.000 2.337 148 I HA 0.272 4.439 4.170 -0.005 0.000 0.291 148 I C 1.480 177.626 176.117 0.049 0.000 1.046 148 I CA -0.203 61.145 61.300 0.080 0.000 1.324 148 I CB 0.829 38.890 38.000 0.102 0.000 1.409 148 I HN 0.448 8.658 8.210 -0.000 0.000 0.494 149 E N 4.534 124.758 120.200 0.040 0.000 2.028 149 E HA -0.060 4.287 4.350 -0.005 0.000 0.190 149 E C -0.197 176.407 176.600 0.005 0.000 0.984 149 E CA 1.069 57.486 56.400 0.028 0.000 0.800 149 E CB 0.457 30.175 29.700 0.031 0.000 0.758 149 E HN 0.628 8.988 8.360 -0.000 0.000 0.448 150 T N 0.600 115.145 114.554 -0.016 0.000 2.916 150 T HA 0.429 4.776 4.350 -0.005 0.000 0.298 150 T C -1.136 173.460 174.700 -0.173 0.000 1.031 150 T CA -0.735 61.287 62.100 -0.131 0.000 0.993 150 T CB 2.168 70.902 68.868 -0.222 0.000 1.045 150 T HN -0.106 8.134 8.240 -0.000 0.000 0.454 151 V N 3.474 123.264 119.914 -0.206 0.000 2.427 151 V HA 0.481 4.598 4.120 -0.005 0.000 0.286 151 V C -1.216 174.761 176.094 -0.195 0.000 1.034 151 V CA -0.735 61.511 62.300 -0.092 0.000 0.893 151 V CB 0.640 32.479 31.823 0.028 0.000 0.982 151 V HN 0.806 8.996 8.190 -0.000 0.000 0.452 152 Y N 2.688 123.061 120.300 0.123 0.000 2.341 152 Y HA 0.454 5.000 4.550 -0.006 0.000 0.338 152 Y C 0.292 176.316 175.900 0.205 0.000 0.965 152 Y CA -0.510 57.684 58.100 0.156 0.000 1.108 152 Y CB 1.726 40.193 38.460 0.012 0.000 1.180 152 Y HN 0.690 8.970 8.280 -0.000 0.000 0.458 153 C N 6.962 126.543 119.300 0.469 0.000 2.394 153 C HA 0.504 4.961 4.460 -0.005 0.000 0.362 153 C C 1.224 176.444 174.990 0.383 0.000 1.268 153 C CA -0.563 58.671 59.018 0.359 0.000 1.828 153 C CB -1.857 26.166 27.740 0.472 0.000 2.442 153 C HN 0.931 9.161 8.230 -0.000 0.000 0.549 154 I N 4.307 125.033 120.570 0.261 0.000 4.009 154 I HA 0.614 4.781 4.170 -0.005 0.000 0.331 154 I C 0.501 176.678 176.117 0.100 0.000 1.462 154 I CA 0.225 61.710 61.300 0.309 0.000 1.117 154 I CB -0.238 38.010 38.000 0.413 0.000 1.091 154 I HN 0.830 9.040 8.210 -0.000 0.000 0.410 155 G N -0.207 108.434 108.800 -0.265 0.000 2.352 155 G HA2 0.450 4.407 3.960 -0.005 0.000 0.305 155 G HA3 0.450 4.407 3.960 -0.005 0.000 0.305 155 G C -0.453 174.124 174.900 -0.537 0.000 1.537 155 G CA -0.097 44.697 45.100 -0.510 0.000 0.959 155 G HN 1.006 9.296 8.290 -0.000 0.000 0.668 156 G N -1.216 107.301 108.800 -0.471 0.000 3.448 156 G HA2 0.445 4.402 3.960 -0.005 0.000 0.685 156 G HA3 0.445 4.402 3.960 -0.005 0.000 0.685 156 G C 1.184 175.946 174.900 -0.229 0.000 1.151 156 G CA 0.807 45.759 45.100 -0.247 0.000 1.023 156 G HN 2.193 10.483 8.290 -0.000 0.000 0.499 157 G N 1.411 110.226 108.800 0.024 0.000 2.469 157 G HA2 -0.039 3.918 3.960 -0.005 0.000 0.220 157 G HA3 -0.039 3.918 3.960 -0.005 0.000 0.220 157 G C 2.309 177.292 174.900 0.139 0.000 1.136 157 G CA 2.267 47.488 45.100 0.202 0.000 0.759 157 G HN 2.133 10.423 8.290 -0.000 0.000 0.562 158 S N 0.065 115.789 115.700 0.041 0.000 2.402 158 S HA -0.061 4.406 4.470 -0.005 0.000 0.229 158 S C 2.241 176.853 174.600 0.021 0.000 1.021 158 S CA 1.444 59.664 58.200 0.033 0.000 0.974 158 S CB -0.296 62.906 63.200 0.004 0.000 0.800 158 S HN 0.162 8.472 8.310 -0.000 0.000 0.484 159 V N 0.113 119.996 119.914 -0.051 0.000 2.488 159 V HA -0.026 4.091 4.120 -0.005 0.000 0.246 159 V C 2.276 178.404 176.094 0.058 0.000 1.046 159 V CA 1.175 63.435 62.300 -0.067 0.000 1.053 159 V CB -1.195 30.520 31.823 -0.181 0.000 0.679 159 V HN 0.387 8.577 8.190 -0.000 0.000 0.458 160 Y N 1.310 121.703 120.300 0.154 0.000 2.181 160 Y HA -0.081 4.467 4.550 -0.003 0.000 0.288 160 Y C 2.655 178.663 175.900 0.180 0.000 1.146 160 Y CA 0.864 59.109 58.100 0.242 0.000 1.164 160 Y CB -1.300 37.375 38.460 0.359 0.000 0.982 160 Y HN 0.182 8.462 8.280 -0.000 0.000 0.515 161 A N -0.132 122.860 122.820 0.286 0.000 1.940 161 A HA -0.260 4.057 4.320 -0.005 0.000 0.219 161 A C 2.233 179.892 177.584 0.125 0.000 1.176 161 A CA 1.970 54.105 52.037 0.163 0.000 0.631 161 A CB -0.714 18.359 19.000 0.121 0.000 0.814 161 A HN 0.541 8.691 8.150 -0.000 0.000 0.446 162 E N -0.389 119.881 120.200 0.117 0.000 2.107 162 E HA -0.039 4.308 4.350 -0.005 0.000 0.191 162 E C 2.101 178.776 176.600 0.125 0.000 0.982 162 E CA 0.768 57.219 56.400 0.085 0.000 0.809 162 E CB -0.216 29.506 29.700 0.038 0.000 0.756 162 E HN 0.548 8.908 8.360 -0.000 0.000 0.459 163 A N 0.711 123.652 122.820 0.201 0.000 2.019 163 A HA -0.093 4.224 4.320 -0.005 0.000 0.219 163 A C 1.868 179.630 177.584 0.296 0.000 1.164 163 A CA 0.848 53.097 52.037 0.353 0.000 0.644 163 A CB -0.304 19.019 19.000 0.538 0.000 0.805 163 A HN 0.288 8.438 8.150 -0.000 0.000 0.449 164 L N -0.416 120.912 121.223 0.175 0.000 2.653 164 L HA 0.186 4.523 4.340 -0.005 0.000 0.231 164 L C 0.727 177.631 176.870 0.058 0.000 1.153 164 L CA -0.224 54.659 54.840 0.072 0.000 0.933 164 L CB -0.325 41.701 42.059 -0.055 0.000 1.175 164 L HN 0.503 8.733 8.230 -0.000 0.000 0.473 165 R N -1.648 118.894 120.500 0.069 0.000 2.808 165 R HA 0.652 4.989 4.340 -0.005 0.000 0.272 165 R C -3.049 173.264 176.300 0.022 0.000 0.995 165 R CA -2.063 54.061 56.100 0.041 0.000 0.917 165 R CB 0.553 30.880 30.300 0.046 0.000 1.217 165 R HN -0.311 7.959 8.270 -0.000 0.000 0.471 166 P HA 0.065 4.485 4.420 -0.000 0.000 0.269 166 P C -1.827 175.515 177.300 0.071 0.000 1.215 166 P CA -1.003 62.110 63.100 0.021 0.000 0.780 166 P CB 0.489 32.257 31.700 0.113 0.000 0.898 167 P HA 0.023 4.443 4.420 -0.000 0.000 0.239 167 P C 0.562 177.954 177.300 0.152 0.000 1.188 167 P CA 0.529 63.725 63.100 0.161 0.000 0.794 167 P CB -0.078 31.709 31.700 0.144 0.000 0.937 168 C N 0.579 119.953 119.300 0.123 0.000 2.413 168 C HA -0.103 4.354 4.460 -0.005 0.000 0.276 168 C C 2.879 178.055 174.990 0.310 0.000 1.248 168 C CA 1.267 60.408 59.018 0.205 0.000 1.742 168 C CB -1.589 26.240 27.740 0.148 0.000 2.017 168 C HN 0.207 8.437 8.230 -0.000 0.000 0.481 169 V N -0.820 119.181 119.914 0.143 0.000 2.568 169 V HA -0.227 3.890 4.120 -0.005 0.000 0.253 169 V C 2.070 178.219 176.094 0.092 0.000 1.072 169 V CA 2.080 64.457 62.300 0.129 0.000 1.084 169 V CB -1.252 30.599 31.823 0.047 0.000 0.676 169 V HN 0.622 8.812 8.190 -0.000 0.000 0.469 170 H N -0.127 119.077 119.070 0.224 0.000 2.559 170 H HA 0.247 4.800 4.556 -0.005 0.000 0.273 170 H C 1.610 177.064 175.328 0.210 0.000 1.000 170 H CA 1.004 57.158 56.048 0.177 0.000 1.195 170 H CB 0.256 30.107 29.762 0.148 0.000 1.368 170 H HN 0.440 8.720 8.280 -0.000 0.000 0.592 171 L N 0.411 121.829 121.223 0.324 0.000 2.808 171 L HA 0.126 4.463 4.340 -0.005 0.000 0.246 171 L C 0.015 176.960 176.870 0.125 0.000 1.153 171 L CA -0.153 54.864 54.840 0.294 0.000 0.956 171 L CB 0.727 42.974 42.059 0.313 0.000 1.270 171 L HN -0.026 8.204 8.230 -0.000 0.000 0.528 172 L N 0.497 121.720 121.223 -0.000 0.000 2.295 172 L HA 0.192 4.529 4.340 -0.005 0.000 0.288 172 L C 1.217 178.093 176.870 0.010 0.000 1.079 172 L CA 0.577 55.211 54.840 -0.344 0.000 0.830 172 L CB 0.581 42.543 42.059 -0.161 0.000 1.200 172 L HN 0.125 8.355 8.230 -0.000 0.000 0.438 173 Q N 4.244 124.010 119.800 -0.057 0.000 2.212 173 Q HA 0.327 4.664 4.340 -0.005 0.000 0.199 173 Q C 0.174 176.234 176.000 0.101 0.000 0.950 173 Q CA 0.937 56.774 55.803 0.056 0.000 0.863 173 Q CB 0.265 29.040 28.738 0.063 0.000 0.944 173 Q HN 0.737 9.007 8.270 -0.000 0.000 0.465 174 A N 0.129 123.000 122.820 0.085 0.000 2.605 174 A HA 0.641 4.958 4.320 -0.005 0.000 0.294 174 A C -1.507 176.068 177.584 -0.015 0.000 1.062 174 A CA -0.672 51.396 52.037 0.052 0.000 0.682 174 A CB 1.007 19.942 19.000 -0.108 0.000 1.278 174 A HN 0.117 8.267 8.150 -0.000 0.000 0.410 175 I N 1.581 122.086 120.570 -0.109 0.000 2.410 175 I HA 0.341 4.508 4.170 -0.005 0.000 0.286 175 I C -1.493 174.546 176.117 -0.130 0.000 1.009 175 I CA -0.370 60.888 61.300 -0.069 0.000 1.111 175 I CB 1.418 39.339 38.000 -0.133 0.000 1.262 175 I HN 0.614 8.824 8.210 -0.000 0.000 0.443 176 Y N 5.995 126.384 120.300 0.148 0.000 2.434 176 Y HA 0.433 4.980 4.550 -0.004 0.000 0.341 176 Y C 0.319 176.313 175.900 0.156 0.000 0.965 176 Y CA -0.538 57.692 58.100 0.216 0.000 1.205 176 Y CB 0.711 39.376 38.460 0.341 0.000 1.121 176 Y HN 0.432 8.712 8.280 -0.000 0.000 0.507 177 R N 2.266 122.880 120.500 0.190 0.000 2.437 177 R HA 0.548 4.885 4.340 -0.005 0.000 0.310 177 R C -1.225 175.119 176.300 0.073 0.000 0.955 177 R CA -0.374 55.763 56.100 0.062 0.000 0.851 177 R CB 1.176 31.475 30.300 -0.002 0.000 1.161 177 R HN 0.587 8.857 8.270 -0.000 0.000 0.446 178 T N 2.909 117.480 114.554 0.028 0.000 2.794 178 T HA 0.316 4.663 4.350 -0.005 0.000 0.280 178 T C -0.615 173.906 174.700 -0.298 0.000 0.987 178 T CA -0.253 61.787 62.100 -0.100 0.000 0.993 178 T CB 1.652 70.536 68.868 0.026 0.000 0.939 178 T HN 0.473 8.713 8.240 -0.000 0.000 0.449 179 T N 3.908 118.102 114.554 -0.600 0.000 2.792 179 T HA 0.613 4.960 4.350 -0.005 0.000 0.280 179 T C -0.213 174.133 174.700 -0.589 0.000 0.990 179 T CA -0.469 61.231 62.100 -0.667 0.000 0.960 179 T CB 0.473 68.742 68.868 -0.998 0.000 0.939 179 T HN 0.409 8.649 8.240 -0.000 0.000 0.439 180 I N 2.366 122.619 120.570 -0.528 0.000 2.509 180 I HA 0.487 4.654 4.170 -0.005 0.000 0.293 180 I C 0.266 176.107 176.117 -0.461 0.000 1.020 180 I CA -1.021 59.994 61.300 -0.475 0.000 1.088 180 I CB 2.121 39.744 38.000 -0.629 0.000 1.267 180 I HN 0.316 8.526 8.210 -0.000 0.000 0.430 181 R N 4.752 125.084 120.500 -0.281 0.000 2.308 181 R HA 0.776 5.113 4.340 -0.005 0.000 0.305 181 R C -0.685 175.494 176.300 -0.202 0.000 1.053 181 R CA 0.103 56.072 56.100 -0.218 0.000 0.957 181 R CB 1.040 31.271 30.300 -0.115 0.000 1.022 181 R HN 0.899 9.169 8.270 -0.000 0.000 0.461 182 A N 1.898 124.616 122.820 -0.170 0.000 3.281 182 A HA 0.418 4.735 4.320 -0.005 0.000 0.302 182 A C -1.245 176.347 177.584 0.013 0.000 1.115 182 A CA -0.196 51.799 52.037 -0.070 0.000 0.595 182 A CB 0.928 19.884 19.000 -0.072 0.000 1.518 182 A HN 0.687 8.837 8.150 -0.000 0.000 0.674 183 S N -0.043 115.707 115.700 0.083 0.000 2.612 183 S HA 0.343 4.810 4.470 -0.005 0.000 0.203 183 S C -0.707 173.976 174.600 0.139 0.000 0.965 183 S CA -0.395 57.884 58.200 0.131 0.000 1.157 183 S CB 0.250 63.510 63.200 0.098 0.000 1.526 183 S HN 0.591 8.901 8.310 -0.000 0.000 0.423 184 E N 1.928 122.236 120.200 0.180 0.000 2.408 184 E HA 0.257 4.604 4.350 -0.005 0.000 0.259 184 E C 0.863 177.529 176.600 0.110 0.000 1.110 184 E CA 0.333 56.828 56.400 0.159 0.000 0.929 184 E CB 1.335 31.170 29.700 0.226 0.000 0.971 184 E HN 0.603 8.963 8.360 -0.000 0.000 0.438 185 S N -0.228 115.513 115.700 0.069 0.000 2.559 185 S HA 0.110 4.577 4.470 -0.005 0.000 0.226 185 S C 0.627 175.240 174.600 0.022 0.000 1.000 185 S CA -0.404 57.821 58.200 0.041 0.000 0.948 185 S CB 0.422 63.641 63.200 0.031 0.000 0.870 185 S HN 0.166 8.476 8.310 -0.000 0.000 0.497 186 S N 0.948 116.659 115.700 0.017 0.000 2.562 186 S HA 0.220 4.687 4.470 -0.005 0.000 0.246 186 S C 0.644 175.223 174.600 -0.035 0.000 1.056 186 S CA -0.442 57.749 58.200 -0.014 0.000 1.042 186 S CB -0.166 63.018 63.200 -0.027 0.000 0.822 186 S HN 0.680 8.990 8.310 -0.000 0.000 0.465 187 C N 2.206 121.491 119.300 -0.025 0.000 2.536 187 C HA 0.277 4.734 4.460 -0.005 0.000 0.285 187 C C 1.592 176.359 174.990 -0.371 0.000 1.371 187 C CA -0.170 58.796 59.018 -0.087 0.000 1.675 187 C CB -2.323 25.439 27.740 0.036 0.000 1.689 187 C HN 0.610 8.840 8.230 -0.000 0.000 0.589 188 S N -0.096 115.444 115.700 -0.268 0.000 2.598 188 S HA 0.331 4.798 4.470 -0.005 0.000 0.256 188 S C 0.116 174.417 174.600 -0.499 0.000 1.350 188 S CA 0.694 58.691 58.200 -0.338 0.000 0.984 188 S CB 0.444 63.585 63.200 -0.098 0.000 0.930 188 S HN 1.148 9.458 8.310 -0.000 0.000 0.577 189 V N 1.874 121.581 119.914 -0.345 0.000 3.865 189 V HA -0.190 3.927 4.120 -0.005 0.000 0.463 189 V C -0.709 175.213 176.094 -0.286 0.000 0.682 189 V CA 0.722 62.925 62.300 -0.163 0.000 1.913 189 V CB -2.242 29.543 31.823 -0.064 0.000 2.326 189 V HN 0.643 8.833 8.190 -0.000 0.000 0.496 190 F N 4.313 124.338 119.950 0.125 0.000 2.483 190 F HA 0.783 5.314 4.527 0.006 0.000 0.329 190 F C 0.039 175.941 175.800 0.169 0.000 1.064 190 F CA -1.082 57.006 58.000 0.147 0.000 0.986 190 F CB 1.432 40.493 39.000 0.102 0.000 1.218 190 F HN 0.388 8.688 8.300 -0.000 0.000 0.484 191 F N 3.842 123.917 119.950 0.209 0.000 2.361 191 F HA 0.527 5.051 4.527 -0.004 0.000 0.364 191 F C -0.480 175.351 175.800 0.052 0.000 1.120 191 F CA -0.700 57.336 58.000 0.060 0.000 1.102 191 F CB 0.199 39.156 39.000 -0.071 0.000 1.183 191 F HN 0.225 8.525 8.300 -0.000 0.000 0.476 192 R N 5.725 125.949 120.500 -0.461 0.000 2.393 192 R HA 0.436 4.773 4.340 -0.005 0.000 0.315 192 R C -1.319 174.641 176.300 -0.568 0.000 0.952 192 R CA -0.960 54.920 56.100 -0.367 0.000 0.842 192 R CB 1.497 31.700 30.300 -0.162 0.000 1.163 192 R HN 0.417 8.687 8.270 -0.000 0.000 0.450 193 V N 5.544 125.181 119.914 -0.462 0.000 2.408 193 V HA 0.190 4.307 4.120 -0.005 0.000 0.267 193 V C -1.807 174.165 176.094 -0.204 0.000 1.047 193 V CA -1.721 60.313 62.300 -0.443 0.000 0.937 193 V CB 0.997 32.606 31.823 -0.356 0.000 0.999 193 V HN 0.531 8.721 8.190 -0.000 0.000 0.472 194 P HA 0.030 4.450 4.420 -0.000 0.000 0.260 194 P C 0.055 177.417 177.300 0.103 0.000 1.172 194 P CA 0.337 63.446 63.100 0.015 0.000 0.760 194 P CB 0.422 32.174 31.700 0.086 0.000 0.773 195 E N 1.174 121.413 120.200 0.065 0.000 2.366 195 E HA 0.127 4.474 4.350 -0.005 0.000 0.266 195 E C 0.262 176.914 176.600 0.087 0.000 1.051 195 E CA -0.395 56.051 56.400 0.077 0.000 0.884 195 E CB 0.586 30.309 29.700 0.039 0.000 1.006 195 E HN 0.340 8.700 8.360 -0.000 0.000 0.417 196 S N 1.315 117.064 115.700 0.081 0.000 2.563 196 S HA 0.121 4.588 4.470 -0.005 0.000 0.294 196 S C 1.113 175.735 174.600 0.036 0.000 1.279 196 S CA 0.997 59.229 58.200 0.054 0.000 1.069 196 S CB -0.133 63.090 63.200 0.037 0.000 0.828 196 S HN 0.798 9.108 8.310 -0.000 0.000 0.497 197 G N 3.136 111.953 108.800 0.030 0.000 2.205 197 G HA2 -0.276 3.681 3.960 -0.005 0.000 0.261 197 G HA3 -0.276 3.681 3.960 -0.005 0.000 0.261 197 G C 0.313 175.230 174.900 0.028 0.000 0.980 197 G CA 0.674 45.788 45.100 0.023 0.000 0.632 197 G HN 1.509 9.799 8.290 -0.000 0.000 0.533 198 T N -1.746 112.830 114.554 0.037 0.000 2.899 198 T HA 0.619 4.966 4.350 -0.005 0.000 0.284 198 T C 1.206 175.931 174.700 0.042 0.000 1.004 198 T CA 0.443 62.564 62.100 0.035 0.000 1.043 198 T CB 1.689 70.577 68.868 0.033 0.000 1.013 198 T HN 0.291 8.531 8.240 -0.000 0.000 0.518 199 E N 1.114 121.336 120.200 0.037 0.000 2.085 199 E HA -0.170 4.177 4.350 -0.005 0.000 0.194 199 E C 2.458 179.089 176.600 0.052 0.000 0.994 199 E CA 1.226 57.651 56.400 0.042 0.000 0.801 199 E CB -0.467 29.253 29.700 0.035 0.000 0.743 199 E HN 0.834 9.194 8.360 -0.000 0.000 0.453 200 A N 1.723 124.570 122.820 0.046 0.000 1.940 200 A HA -0.131 4.186 4.320 -0.005 0.000 0.219 200 A C 2.427 180.055 177.584 0.073 0.000 1.176 200 A CA 1.669 53.736 52.037 0.049 0.000 0.631 200 A CB -0.618 18.400 19.000 0.031 0.000 0.814 200 A HN 0.294 8.444 8.150 -0.000 0.000 0.446 201 A N -1.266 121.608 122.820 0.089 0.000 2.125 201 A HA 0.292 4.609 4.320 -0.005 0.000 0.219 201 A C 1.756 179.415 177.584 0.124 0.000 1.156 201 A CA 1.511 53.629 52.037 0.136 0.000 0.671 201 A CB -1.024 18.051 19.000 0.125 0.000 0.794 201 A HN 2.124 10.274 8.150 -0.000 0.000 0.459 202 A N -2.959 119.924 122.820 0.106 0.000 2.799 202 A HA 0.137 4.454 4.320 -0.005 0.000 0.287 202 A C 1.981 179.658 177.584 0.154 0.000 1.484 202 A CA 1.513 53.634 52.037 0.139 0.000 0.813 202 A CB -1.992 17.107 19.000 0.165 0.000 1.009 202 A HN 2.560 10.710 8.150 -0.000 0.000 0.545 203 G N -2.729 106.124 108.800 0.089 0.000 2.176 203 G HA2 -0.233 3.724 3.960 -0.005 0.000 0.253 203 G HA3 -0.233 3.724 3.960 -0.005 0.000 0.253 203 G C 0.140 175.046 174.900 0.010 0.000 0.979 203 G CA 0.405 45.536 45.100 0.051 0.000 0.641 203 G HN 1.439 9.729 8.290 -0.000 0.000 0.530 204 I N 0.792 121.361 120.570 -0.002 0.000 2.440 204 I HA 0.405 4.572 4.170 -0.005 0.000 0.294 204 I C 0.211 176.199 176.117 -0.214 0.000 0.995 204 I CA -0.452 60.749 61.300 -0.166 0.000 1.306 204 I CB 1.326 39.177 38.000 -0.249 0.000 1.407 204 I HN 0.069 8.279 8.210 -0.000 0.000 0.501 205 E N 5.345 125.359 120.200 -0.311 0.000 2.183 205 E HA 0.194 4.541 4.350 -0.005 0.000 0.250 205 E C -1.578 174.863 176.600 -0.265 0.000 0.901 205 E CA -0.505 55.780 56.400 -0.191 0.000 0.741 205 E CB 0.804 30.438 29.700 -0.111 0.000 1.182 205 E HN 0.372 8.732 8.360 -0.000 0.000 0.425 206 W N 3.246 124.545 121.300 -0.002 0.000 2.253 206 W HA 0.099 4.754 4.660 -0.008 0.000 0.322 206 W C 0.714 177.233 176.519 -0.000 0.000 1.342 206 W CA -0.071 57.272 57.345 -0.003 0.000 1.218 206 W CB 0.592 30.050 29.460 -0.003 0.000 1.205 206 W HN 0.409 8.589 8.180 -0.000 0.000 0.551 207 Q N 1.988 121.920 119.800 0.220 0.000 2.462 207 Q HA 0.580 4.917 4.340 -0.005 0.000 0.285 207 Q C -0.837 175.244 176.000 0.135 0.000 1.035 207 Q CA -1.369 54.514 55.803 0.133 0.000 0.799 207 Q CB 1.608 30.380 28.738 0.057 0.000 1.452 207 Q HN 0.448 8.718 8.270 -0.000 0.000 0.404 208 R N 0.976 121.535 120.500 0.099 0.000 2.389 208 R HA 0.065 4.402 4.340 -0.005 0.000 0.295 208 R C 0.474 176.819 176.300 0.075 0.000 1.075 208 R CA 0.009 56.161 56.100 0.087 0.000 1.005 208 R CB 0.904 31.247 30.300 0.071 0.000 0.987 208 R HN 0.833 9.103 8.270 -0.000 0.000 0.452 209 E N 1.680 121.925 120.200 0.075 0.000 2.099 209 E HA -0.045 4.302 4.350 -0.005 0.000 0.191 209 E C -0.122 176.529 176.600 0.085 0.000 0.962 209 E CA 0.893 57.345 56.400 0.087 0.000 0.826 209 E CB 0.585 30.336 29.700 0.085 0.000 0.788 209 E HN 0.667 9.027 8.360 -0.000 0.000 0.461 210 T N -1.306 113.294 114.554 0.076 0.000 2.900 210 T HA 0.605 4.952 4.350 -0.005 0.000 0.303 210 T C -0.674 174.076 174.700 0.083 0.000 1.142 210 T CA -0.886 61.260 62.100 0.078 0.000 1.007 210 T CB 1.903 70.823 68.868 0.086 0.000 1.156 210 T HN 0.142 8.382 8.240 -0.000 0.000 0.490 211 I N 2.260 122.875 120.570 0.074 0.000 2.610 211 I HA 0.507 4.674 4.170 -0.005 0.000 0.289 211 I C 0.038 176.191 176.117 0.060 0.000 1.163 211 I CA -0.507 60.843 61.300 0.083 0.000 1.044 211 I CB 2.052 40.074 38.000 0.037 0.000 1.251 211 I HN 1.088 9.298 8.210 -0.000 0.000 0.424 212 S N 5.691 121.454 115.700 0.104 0.000 2.634 212 S HA 0.432 4.899 4.470 -0.005 0.000 0.261 212 S C 0.107 174.694 174.600 -0.021 0.000 1.271 212 S CA -0.578 57.663 58.200 0.069 0.000 0.985 212 S CB 1.058 64.348 63.200 0.150 0.000 0.968 212 S HN 0.622 8.932 8.310 -0.000 0.000 0.568 213 E N 0.689 120.861 120.200 -0.046 0.000 2.376 213 E HA 0.170 4.517 4.350 -0.005 0.000 0.254 213 E C -0.024 176.490 176.600 -0.144 0.000 1.213 213 E CA -0.360 55.981 56.400 -0.097 0.000 0.945 213 E CB 0.314 29.970 29.700 -0.074 0.000 1.057 213 E HN 0.809 9.169 8.360 -0.000 0.000 0.479 214 E N 1.075 121.174 120.200 -0.168 0.000 2.324 214 E HA 0.133 4.480 4.350 -0.005 0.000 0.271 214 E C -0.641 175.820 176.600 -0.232 0.000 1.028 214 E CA -0.083 56.206 56.400 -0.184 0.000 0.890 214 E CB 0.330 29.942 29.700 -0.147 0.000 1.004 214 E HN 0.228 8.588 8.360 -0.000 0.000 0.431 215 L N 3.100 124.064 121.223 -0.432 0.000 2.334 215 L HA 0.464 4.801 4.340 -0.005 0.000 0.270 215 L C -0.134 176.501 176.870 -0.392 0.000 1.018 215 L CA -0.918 53.606 54.840 -0.527 0.000 0.811 215 L CB 2.149 43.627 42.059 -0.968 0.000 1.271 215 L HN 0.485 8.715 8.230 -0.000 0.000 0.443 216 T N 0.320 114.811 114.554 -0.104 0.000 2.815 216 T HA 0.193 4.540 4.350 -0.005 0.000 0.289 216 T C -0.097 174.745 174.700 0.235 0.000 1.000 216 T CA -0.352 61.792 62.100 0.074 0.000 0.958 216 T CB 1.487 70.373 68.868 0.029 0.000 0.944 216 T HN 0.580 8.820 8.240 -0.000 0.000 0.442 217 S N 1.913 117.811 115.700 0.330 0.000 2.566 217 S HA 0.292 4.759 4.470 -0.005 0.000 0.280 217 S C 1.496 176.160 174.600 0.107 0.000 1.343 217 S CA -0.116 58.205 58.200 0.202 0.000 1.036 217 S CB 0.274 63.492 63.200 0.029 0.000 0.866 217 S HN 0.834 9.144 8.310 -0.000 0.000 0.526 218 A N 3.680 126.545 122.820 0.076 0.000 2.238 218 A HA 0.138 4.455 4.320 -0.005 0.000 0.208 218 A C 0.843 178.447 177.584 0.034 0.000 1.177 218 A CA 0.238 52.307 52.037 0.054 0.000 0.804 218 A CB -1.144 17.887 19.000 0.052 0.000 0.823 218 A HN 0.974 9.124 8.150 -0.000 0.000 0.482 219 N N -1.196 117.519 118.700 0.024 0.000 2.235 219 N HA 0.223 4.960 4.740 -0.005 0.000 0.231 219 N C 1.228 176.751 175.510 0.021 0.000 1.330 219 N CA 0.076 53.136 53.050 0.016 0.000 0.898 219 N CB 0.279 38.771 38.487 0.007 0.000 1.151 219 N HN -0.051 8.329 8.380 -0.000 0.000 0.472 220 G N -0.429 108.381 108.800 0.018 0.000 2.443 220 G HA2 -0.227 3.730 3.960 -0.005 0.000 0.219 220 G HA3 -0.227 3.730 3.960 -0.005 0.000 0.219 220 G C 1.028 175.939 174.900 0.019 0.000 1.131 220 G CA 0.312 45.423 45.100 0.018 0.000 0.775 220 G HN 0.709 8.999 8.290 -0.000 0.000 0.547 221 N N 0.877 119.590 118.700 0.020 0.000 2.467 221 N HA 0.002 4.739 4.740 -0.005 0.000 0.184 221 N C 0.006 175.530 175.510 0.022 0.000 1.106 221 N CA 0.469 53.531 53.050 0.020 0.000 0.892 221 N CB 0.179 38.678 38.487 0.021 0.000 0.969 221 N HN 0.454 8.834 8.380 -0.000 0.000 0.454 222 E N 0.514 120.731 120.200 0.029 0.000 2.297 222 E HA -0.139 4.208 4.350 -0.005 0.000 0.228 222 E C -0.832 175.794 176.600 0.044 0.000 1.213 222 E CA 0.253 56.676 56.400 0.039 0.000 0.712 222 E CB -1.968 27.748 29.700 0.028 0.000 1.202 222 E HN 0.224 8.584 8.360 -0.000 0.000 0.376 223 T N 1.779 116.361 114.554 0.046 0.000 2.902 223 T HA 0.045 4.392 4.350 -0.005 0.000 0.301 223 T C 0.521 175.286 174.700 0.108 0.000 1.012 223 T CA -0.110 62.015 62.100 0.042 0.000 1.151 223 T CB 0.625 69.496 68.868 0.006 0.000 0.946 223 T HN 0.003 8.243 8.240 -0.000 0.000 0.542 224 K N 3.391 123.823 120.400 0.053 0.000 2.276 224 K HA 0.385 4.702 4.320 -0.005 0.000 0.283 224 K C -0.297 176.345 176.600 0.070 0.000 1.044 224 K CA -0.296 56.015 56.287 0.039 0.000 0.944 224 K CB 0.753 33.246 32.500 -0.012 0.000 1.012 224 K HN 0.826 9.076 8.250 -0.000 0.000 0.472 225 Y N 0.141 120.361 120.300 -0.134 0.000 2.656 225 Y HA 0.637 5.184 4.550 -0.005 0.000 0.334 225 Y C -1.404 174.370 175.900 -0.210 0.000 1.179 225 Y CA -1.626 56.318 58.100 -0.260 0.000 1.050 225 Y CB 1.174 39.417 38.460 -0.361 0.000 1.308 225 Y HN 0.580 8.860 8.280 -0.000 0.000 0.456 226 Y N -0.663 119.367 120.300 -0.449 0.000 2.624 226 Y HA 0.784 5.330 4.550 -0.007 0.000 0.334 226 Y C -2.312 173.316 175.900 -0.453 0.000 1.155 226 Y CA -2.499 55.289 58.100 -0.520 0.000 1.046 226 Y CB 1.069 39.350 38.460 -0.299 0.000 1.316 226 Y HN 0.619 8.899 8.280 -0.000 0.000 0.457 227 F N 1.142 121.120 119.950 0.046 0.000 2.470 227 F HA 0.670 5.194 4.527 -0.005 0.000 0.329 227 F C -0.089 175.749 175.800 0.063 0.000 1.072 227 F CA -0.677 57.285 58.000 -0.063 0.000 0.989 227 F CB 1.955 40.802 39.000 -0.255 0.000 1.193 227 F HN 0.496 8.796 8.300 -0.000 0.000 0.481 228 E N 1.321 121.671 120.200 0.250 0.000 2.308 228 E HA 0.252 4.599 4.350 -0.005 0.000 0.275 228 E C -1.359 175.314 176.600 0.123 0.000 0.890 228 E CA -1.106 55.405 56.400 0.184 0.000 0.754 228 E CB 2.808 32.614 29.700 0.177 0.000 1.207 228 E HN 0.384 8.744 8.360 -0.000 0.000 0.426 229 K N 4.483 124.921 120.400 0.063 0.000 2.394 229 K HA 0.424 4.741 4.320 -0.005 0.000 0.260 229 K C -1.254 175.326 176.600 -0.033 0.000 0.967 229 K CA -0.417 55.821 56.287 -0.081 0.000 0.855 229 K CB 0.658 33.105 32.500 -0.088 0.000 1.101 229 K HN 0.449 8.699 8.250 -0.000 0.000 0.433 230 L N 6.449 127.650 121.223 -0.036 0.000 2.325 230 L HA 0.628 4.965 4.340 -0.005 0.000 0.278 230 L C 0.025 177.014 176.870 0.198 0.000 1.023 230 L CA -1.127 53.781 54.840 0.114 0.000 0.811 230 L CB 1.361 43.505 42.059 0.141 0.000 1.249 230 L HN 0.600 8.830 8.230 -0.000 0.000 0.431 231 I N -0.039 120.693 120.570 0.270 0.000 2.865 231 I HA 0.586 4.753 4.170 -0.005 0.000 0.302 231 I C -2.765 173.343 176.117 -0.015 0.000 1.140 231 I CA -2.467 58.949 61.300 0.194 0.000 1.021 231 I CB 2.658 40.689 38.000 0.051 0.000 1.233 231 I HN 0.287 8.497 8.210 -0.000 0.000 0.427 232 P HA 0.143 4.563 4.420 -0.000 0.000 0.281 232 P C -0.625 176.454 177.300 -0.368 0.000 1.286 232 P CA -0.208 62.440 63.100 -0.754 0.000 0.772 232 P CB 0.886 32.078 31.700 -0.846 0.000 0.862 233 R N 4.026 124.347 120.500 -0.299 0.000 2.485 233 R HA -0.073 4.264 4.340 -0.005 0.000 0.304 233 R C 0.404 176.590 176.300 -0.191 0.000 0.934 233 R CA 0.291 56.282 56.100 -0.182 0.000 1.102 233 R CB -0.249 29.969 30.300 -0.138 0.000 0.906 233 R HN 0.370 8.640 8.270 -0.000 0.000 0.407 234 N N 3.877 122.470 118.700 -0.178 0.000 2.949 234 N HA 0.074 4.811 4.740 -0.005 0.000 0.243 234 N C 0.187 175.608 175.510 -0.147 0.000 1.113 234 N CA -0.164 52.747 53.050 -0.232 0.000 0.980 234 N CB 0.669 38.934 38.487 -0.370 0.000 1.256 234 N HN 0.530 8.910 8.380 -0.000 0.000 0.508 235 R N 1.038 121.474 120.500 -0.106 0.000 2.152 235 R HA -0.036 4.301 4.340 -0.005 0.000 0.232 235 R C 1.400 177.682 176.300 -0.030 0.000 1.117 235 R CA 1.298 57.360 56.100 -0.062 0.000 0.981 235 R CB 0.191 30.453 30.300 -0.063 0.000 0.870 235 R HN 0.591 8.861 8.270 -0.000 0.000 0.451 236 E N -0.316 119.879 120.200 -0.009 0.000 2.051 236 E HA -0.240 4.107 4.350 -0.005 0.000 0.192 236 E C 1.771 178.542 176.600 0.286 0.000 0.991 236 E CA 1.344 57.804 56.400 0.100 0.000 0.799 236 E CB -0.015 29.890 29.700 0.343 0.000 0.748 236 E HN 0.411 8.771 8.360 -0.000 0.000 0.449 237 E N 0.966 121.304 120.200 0.230 0.000 2.152 237 E HA -0.184 4.163 4.350 -0.005 0.000 0.192 237 E C 1.626 178.375 176.600 0.248 0.000 0.983 237 E CA 0.778 57.371 56.400 0.322 0.000 0.818 237 E CB 0.157 29.938 29.700 0.135 0.000 0.758 237 E HN 0.240 8.600 8.360 -0.000 0.000 0.467 238 E N 0.301 120.569 120.200 0.113 0.000 2.265 238 E HA -0.218 4.129 4.350 -0.005 0.000 0.196 238 E C 2.106 178.754 176.600 0.081 0.000 0.996 238 E CA 0.780 57.226 56.400 0.077 0.000 0.832 238 E CB -0.007 29.701 29.700 0.013 0.000 0.756 238 E HN 0.399 8.759 8.360 -0.000 0.000 0.491 239 Q N 0.032 119.884 119.800 0.088 0.000 2.030 239 Q HA -0.241 4.096 4.340 -0.005 0.000 0.204 239 Q C 2.007 178.071 176.000 0.106 0.000 0.986 239 Q CA 1.919 57.749 55.803 0.046 0.000 0.843 239 Q CB -0.370 28.357 28.738 -0.019 0.000 0.904 239 Q HN 0.409 8.679 8.270 -0.000 0.000 0.420 240 Y N 1.211 121.574 120.300 0.105 0.000 2.097 240 Y HA -0.254 4.293 4.550 -0.006 0.000 0.282 240 Y C 1.872 177.807 175.900 0.059 0.000 1.152 240 Y CA 1.540 59.709 58.100 0.115 0.000 1.136 240 Y CB -0.206 38.375 38.460 0.201 0.000 0.975 240 Y HN 0.015 8.295 8.280 -0.000 0.000 0.498 241 L N -0.665 120.598 121.223 0.067 0.000 2.046 241 L HA -0.249 4.088 4.340 -0.005 0.000 0.208 241 L C 2.530 179.329 176.870 -0.119 0.000 1.077 241 L CA 1.540 56.340 54.840 -0.068 0.000 0.747 241 L CB -0.737 41.357 42.059 0.059 0.000 0.896 241 L HN 0.189 8.419 8.230 -0.000 0.000 0.432 242 S N -0.048 115.612 115.700 -0.067 0.000 2.368 242 S HA -0.153 4.314 4.470 -0.005 0.000 0.225 242 S C 1.949 176.488 174.600 -0.102 0.000 1.030 242 S CA 1.044 59.203 58.200 -0.069 0.000 0.999 242 S CB -0.257 62.916 63.200 -0.046 0.000 0.844 242 S HN 0.309 8.619 8.310 -0.000 0.000 0.459 243 L N 1.403 122.548 121.223 -0.132 0.000 2.017 243 L HA -0.111 4.226 4.340 -0.005 0.000 0.208 243 L C 2.241 179.002 176.870 -0.182 0.000 1.073 243 L CA 1.297 56.048 54.840 -0.147 0.000 0.745 243 L CB -0.452 41.516 42.059 -0.153 0.000 0.894 243 L HN 0.210 8.440 8.230 -0.000 0.000 0.432 244 V N 0.017 119.760 119.914 -0.285 0.000 2.287 244 V HA -0.347 3.770 4.120 -0.005 0.000 0.248 244 V C 2.191 178.200 176.094 -0.142 0.000 1.053 244 V CA 2.221 64.368 62.300 -0.256 0.000 1.027 244 V CB -0.587 31.016 31.823 -0.366 0.000 0.646 244 V HN 0.543 8.733 8.190 -0.000 0.000 0.447 245 D N -0.188 120.138 120.400 -0.124 0.000 2.104 245 D HA -0.217 4.420 4.640 -0.005 0.000 0.194 245 D C 2.387 178.650 176.300 -0.062 0.000 0.994 245 D CA 1.557 55.511 54.000 -0.076 0.000 0.830 245 D CB -0.182 40.580 40.800 -0.063 0.000 0.959 245 D HN 0.212 8.582 8.370 -0.000 0.000 0.452 246 R N -0.238 120.221 120.500 -0.069 0.000 2.083 246 R HA -0.109 4.228 4.340 -0.005 0.000 0.237 246 R C 2.531 178.802 176.300 -0.048 0.000 1.137 246 R CA 1.327 57.395 56.100 -0.054 0.000 0.951 246 R CB -0.346 29.920 30.300 -0.058 0.000 0.851 246 R HN 0.321 8.591 8.270 -0.000 0.000 0.434 247 I N 0.410 120.943 120.570 -0.061 0.000 2.163 247 I HA -0.327 3.840 4.170 -0.005 0.000 0.243 247 I C 2.255 178.352 176.117 -0.033 0.000 1.085 247 I CA 1.389 62.660 61.300 -0.048 0.000 1.347 247 I CB -0.235 37.727 38.000 -0.063 0.000 1.044 247 I HN 0.230 8.440 8.210 -0.000 0.000 0.408 248 I N 0.298 120.847 120.570 -0.035 0.000 2.179 248 I HA -0.277 3.890 4.170 -0.005 0.000 0.242 248 I C 2.714 178.822 176.117 -0.014 0.000 1.088 248 I CA 1.468 62.757 61.300 -0.019 0.000 1.357 248 I CB -0.333 37.657 38.000 -0.017 0.000 1.051 248 I HN 0.149 8.359 8.210 -0.000 0.000 0.409 249 R N 0.372 120.860 120.500 -0.020 0.000 2.090 249 R HA -0.083 4.254 4.340 -0.005 0.000 0.228 249 R C 1.396 177.689 176.300 -0.012 0.000 1.110 249 R CA 1.184 57.275 56.100 -0.015 0.000 0.973 249 R CB 0.015 30.303 30.300 -0.019 0.000 0.869 249 R HN 0.423 8.693 8.270 -0.000 0.000 0.440 250 E N -0.849 119.342 120.200 -0.015 0.000 2.641 250 E HA 0.138 4.485 4.350 -0.005 0.000 0.224 250 E C 0.345 176.941 176.600 -0.008 0.000 0.951 250 E CA -0.286 56.108 56.400 -0.010 0.000 1.102 250 E CB 1.210 30.903 29.700 -0.012 0.000 1.091 250 E HN 0.221 8.581 8.360 -0.000 0.000 0.507 251 G N 1.440 110.233 108.800 -0.011 0.000 2.630 251 G HA2 -0.010 3.947 3.960 -0.005 0.000 0.236 251 G HA3 -0.010 3.947 3.960 -0.005 0.000 0.236 251 G C -0.013 174.885 174.900 -0.004 0.000 1.248 251 G CA -0.388 44.707 45.100 -0.007 0.000 0.844 251 G HN 0.033 8.323 8.290 -0.000 0.000 0.588 252 N N -0.231 118.467 118.700 -0.003 0.000 2.434 252 N HA 0.203 4.940 4.740 -0.005 0.000 0.272 252 N C -0.104 175.395 175.510 -0.018 0.000 1.040 252 N CA -0.350 52.696 53.050 -0.006 0.000 0.956 252 N CB 2.089 40.572 38.487 -0.006 0.000 1.108 252 N HN 0.138 8.518 8.380 -0.000 0.000 0.481 253 V N 2.915 122.823 119.914 -0.009 0.000 2.530 253 V HA 0.227 4.344 4.120 -0.005 0.000 0.282 253 V C 0.405 176.488 176.094 -0.019 0.000 1.048 253 V CA 0.021 62.308 62.300 -0.021 0.000 0.997 253 V CB 0.393 32.235 31.823 0.032 0.000 0.987 253 V HN 0.550 8.740 8.190 -0.000 0.000 0.477 254 K N 3.090 123.431 120.400 -0.099 0.000 2.502 254 K HA 0.624 4.941 4.320 -0.005 0.000 0.257 254 K C -1.638 174.838 176.600 -0.206 0.000 0.938 254 K CA -0.993 55.255 56.287 -0.064 0.000 0.819 254 K CB 2.330 34.786 32.500 -0.074 0.000 1.333 254 K HN 0.732 8.982 8.250 -0.000 0.000 0.434 255 H N 0.919 119.980 119.070 -0.015 0.000 2.727 255 H HA 0.108 4.661 4.556 -0.005 0.000 0.330 255 H C -0.588 174.737 175.328 -0.004 0.000 0.986 255 H CA -0.742 55.304 56.048 -0.004 0.000 1.251 255 H CB 1.167 30.930 29.762 0.001 0.000 1.493 255 H HN 0.669 8.949 8.280 -0.000 0.000 0.515 256 D N 1.204 121.646 120.400 0.071 0.000 2.325 256 D HA 0.002 4.639 4.640 -0.005 0.000 0.262 256 D C 1.293 177.630 176.300 0.061 0.000 1.263 256 D CA -0.476 53.553 54.000 0.050 0.000 1.020 256 D CB 0.840 41.660 40.800 0.033 0.000 1.117 256 D HN 0.225 8.595 8.370 -0.000 0.000 0.545 257 R N -1.554 118.972 120.500 0.044 0.000 2.096 257 R HA -0.019 4.318 4.340 -0.005 0.000 0.235 257 R C 2.038 178.362 176.300 0.039 0.000 1.127 257 R CA 1.978 58.100 56.100 0.036 0.000 0.968 257 R CB -0.997 29.319 30.300 0.028 0.000 0.861 257 R HN 0.774 9.044 8.270 -0.000 0.000 0.440 258 T N -4.210 110.371 114.554 0.046 0.000 3.107 258 T HA 0.267 4.614 4.350 -0.005 0.000 0.249 258 T C 1.205 175.937 174.700 0.054 0.000 1.096 258 T CA 0.377 62.503 62.100 0.043 0.000 1.012 258 T CB 0.573 69.466 68.868 0.042 0.000 0.977 258 T HN 0.338 8.578 8.240 -0.000 0.000 0.527 259 G N 0.727 109.575 108.800 0.080 0.000 2.157 259 G HA2 -0.212 3.745 3.960 -0.005 0.000 0.239 259 G HA3 -0.212 3.745 3.960 -0.005 0.000 0.239 259 G C -0.014 174.989 174.900 0.173 0.000 0.982 259 G CA -0.191 44.984 45.100 0.125 0.000 0.650 259 G HN 0.676 8.966 8.290 -0.000 0.000 0.527 260 V N 1.303 121.280 119.914 0.104 0.000 2.479 260 V HA 0.554 4.671 4.120 -0.005 0.000 0.281 260 V C 1.257 177.346 176.094 -0.007 0.000 1.031 260 V CA 0.515 62.858 62.300 0.071 0.000 1.038 260 V CB 1.132 32.999 31.823 0.074 0.000 0.981 260 V HN 0.739 8.929 8.190 -0.000 0.000 0.478 261 G N 3.601 112.338 108.800 -0.106 0.000 2.371 261 G HA2 0.708 4.665 3.960 -0.005 0.000 0.326 261 G HA3 0.708 4.665 3.960 -0.005 0.000 0.326 261 G C -0.226 174.534 174.900 -0.234 0.000 1.127 261 G CA -0.160 44.631 45.100 -0.514 0.000 0.885 261 G HN 0.827 9.117 8.290 -0.000 0.000 0.477 262 T N -1.034 113.342 114.554 -0.296 0.000 2.896 262 T HA 0.683 5.030 4.350 -0.005 0.000 0.297 262 T C -0.659 173.946 174.700 -0.159 0.000 1.108 262 T CA -0.885 61.080 62.100 -0.225 0.000 1.004 262 T CB 1.689 70.348 68.868 -0.348 0.000 1.159 262 T HN 0.348 8.588 8.240 -0.000 0.000 0.499 263 L N 2.467 123.633 121.223 -0.094 0.000 2.313 263 L HA 0.758 5.095 4.340 -0.005 0.000 0.283 263 L C 0.086 176.945 176.870 -0.019 0.000 1.013 263 L CA -0.775 54.036 54.840 -0.049 0.000 0.816 263 L CB 1.808 43.850 42.059 -0.028 0.000 1.236 263 L HN 1.087 9.317 8.230 -0.000 0.000 0.419 264 S N 2.725 118.421 115.700 -0.006 0.000 2.618 264 S HA 0.885 5.352 4.470 -0.005 0.000 0.277 264 S C -0.851 173.769 174.600 0.033 0.000 1.138 264 S CA -0.771 57.448 58.200 0.031 0.000 0.844 264 S CB 2.539 65.774 63.200 0.059 0.000 1.127 264 S HN 0.487 8.797 8.310 -0.000 0.000 0.474 265 I N -1.922 118.679 120.570 0.053 0.000 3.074 265 I HA 0.896 5.063 4.170 -0.005 0.000 0.310 265 I C -1.480 174.726 176.117 0.149 0.000 1.153 265 I CA -1.172 60.168 61.300 0.067 0.000 0.993 265 I CB 1.640 39.647 38.000 0.011 0.000 1.237 265 I HN 0.686 8.896 8.210 -0.000 0.000 0.443 266 F N 2.866 122.799 119.950 -0.029 0.000 2.477 266 F HA 0.802 5.326 4.527 -0.005 0.000 0.335 266 F C 0.317 176.098 175.800 -0.032 0.000 1.130 266 F CA -0.151 57.834 58.000 -0.026 0.000 0.948 266 F CB 1.373 40.365 39.000 -0.013 0.000 1.154 266 F HN 1.097 9.397 8.300 -0.000 0.000 0.439 267 G N 4.205 112.633 108.800 -0.620 0.000 3.405 267 G HA2 0.502 4.459 3.960 -0.005 0.000 0.676 267 G HA3 0.502 4.459 3.960 -0.005 0.000 0.676 267 G C -1.219 173.517 174.900 -0.272 0.000 1.039 267 G CA -0.293 44.491 45.100 -0.527 0.000 0.855 267 G HN 1.700 9.990 8.290 -0.000 0.000 0.443 268 A N 2.242 124.906 122.820 -0.259 0.000 2.599 268 A HA 1.000 5.317 4.320 -0.005 0.000 0.290 268 A C -0.508 176.960 177.584 -0.192 0.000 1.101 268 A CA 0.178 52.099 52.037 -0.192 0.000 0.674 268 A CB 1.971 20.865 19.000 -0.176 0.000 1.277 268 A HN 1.639 9.789 8.150 -0.000 0.000 0.419 269 Q N -0.021 119.686 119.800 -0.154 0.000 2.386 269 Q HA 0.716 5.053 4.340 -0.005 0.000 0.274 269 Q C -1.888 174.038 176.000 -0.123 0.000 1.011 269 Q CA -0.380 55.343 55.803 -0.134 0.000 0.867 269 Q CB 1.876 30.548 28.738 -0.110 0.000 1.409 269 Q HN 0.817 9.087 8.270 -0.000 0.000 0.395 270 M N 2.160 121.696 119.600 -0.108 0.000 2.550 270 M HA 0.628 5.105 4.480 -0.005 0.000 0.292 270 M C -1.126 175.008 176.300 -0.278 0.000 1.221 270 M CA -0.735 54.443 55.300 -0.204 0.000 0.873 270 M CB 2.839 35.349 32.600 -0.150 0.000 1.727 270 M HN 0.444 8.734 8.290 -0.000 0.000 0.459 271 R N 1.046 121.240 120.500 -0.510 0.000 2.670 271 R HA 0.804 5.141 4.340 -0.005 0.000 0.289 271 R C -1.811 174.076 176.300 -0.689 0.000 0.965 271 R CA -0.569 55.298 56.100 -0.389 0.000 0.899 271 R CB 2.051 32.227 30.300 -0.206 0.000 1.173 271 R HN 0.466 8.736 8.270 -0.000 0.000 0.456 272 F N -0.123 119.852 119.950 0.042 0.000 2.557 272 F HA 0.274 4.798 4.527 -0.005 0.000 0.316 272 F C 0.366 176.182 175.800 0.028 0.000 1.141 272 F CA -0.765 57.264 58.000 0.048 0.000 0.922 272 F CB 2.321 41.323 39.000 0.003 0.000 1.194 272 F HN 0.344 8.644 8.300 -0.000 0.000 0.443 273 S N 2.985 118.806 115.700 0.201 0.000 2.548 273 S HA 0.501 4.968 4.470 -0.005 0.000 0.277 273 S C 0.369 175.029 174.600 0.099 0.000 1.315 273 S CA -0.377 57.897 58.200 0.122 0.000 1.050 273 S CB 0.452 63.707 63.200 0.092 0.000 0.918 273 S HN 0.705 9.015 8.310 -0.000 0.000 0.497 274 L N 4.012 125.281 121.223 0.076 0.000 2.906 274 L HA 0.317 4.654 4.340 -0.005 0.000 0.255 274 L C 0.947 177.851 176.870 0.056 0.000 1.166 274 L CA -0.276 54.593 54.840 0.047 0.000 0.977 274 L CB 0.006 42.100 42.059 0.058 0.000 1.313 274 L HN 0.507 8.737 8.230 -0.000 0.000 0.549 275 R N 1.458 121.996 120.500 0.064 0.000 2.679 275 R HA 0.052 4.389 4.340 -0.005 0.000 0.268 275 R C 0.158 176.512 176.300 0.089 0.000 1.044 275 R CA -0.189 55.951 56.100 0.067 0.000 1.105 275 R CB 0.047 30.379 30.300 0.054 0.000 0.989 275 R HN 0.185 8.455 8.270 -0.000 0.000 0.447 276 N N 2.081 120.839 118.700 0.096 0.000 2.714 276 N HA -0.241 4.496 4.740 -0.005 0.000 0.252 276 N C -0.704 174.926 175.510 0.201 0.000 1.014 276 N CA 1.373 54.502 53.050 0.132 0.000 0.735 276 N CB -1.169 37.401 38.487 0.138 0.000 0.924 276 N HN 0.825 9.205 8.380 -0.000 0.000 0.540 277 N N -2.324 116.475 118.700 0.166 0.000 2.900 277 N HA -0.253 4.484 4.740 -0.005 0.000 0.240 277 N C 0.195 175.802 175.510 0.161 0.000 0.953 277 N CA 1.451 54.618 53.050 0.195 0.000 0.950 277 N CB -0.764 37.873 38.487 0.250 0.000 1.102 277 N HN 0.623 9.003 8.380 -0.000 0.000 0.593 278 R N 0.729 121.268 120.500 0.064 0.000 2.537 278 R HA 0.370 4.707 4.340 -0.005 0.000 0.280 278 R C -0.719 175.451 176.300 -0.217 0.000 1.058 278 R CA -0.163 55.806 56.100 -0.218 0.000 1.057 278 R CB 0.309 30.517 30.300 -0.154 0.000 0.973 278 R HN 0.195 8.465 8.270 -0.000 0.000 0.438 279 L N 7.397 128.400 121.223 -0.367 0.000 2.343 279 L HA 0.445 4.782 4.340 -0.005 0.000 0.278 279 L C -2.230 174.227 176.870 -0.687 0.000 0.996 279 L CA -2.197 52.383 54.840 -0.434 0.000 0.831 279 L CB 2.044 43.805 42.059 -0.498 0.000 1.232 279 L HN 0.577 8.807 8.230 -0.000 0.000 0.413 280 P HA 0.074 4.494 4.420 -0.000 0.000 0.235 280 P C -0.764 175.819 177.300 -1.194 0.000 1.765 280 P CA 0.163 62.313 63.100 -1.584 0.000 1.034 280 P CB -0.295 30.734 31.700 -1.117 0.000 1.984 281 L N 2.755 123.431 121.223 -0.911 0.000 2.255 281 L HA 0.281 4.618 4.340 -0.005 0.000 0.289 281 L C 1.082 177.903 176.870 -0.081 0.000 1.046 281 L CA -0.998 53.547 54.840 -0.492 0.000 0.816 281 L CB 0.834 42.463 42.059 -0.716 0.000 1.197 281 L HN 0.055 8.285 8.230 -0.000 0.000 0.427 282 L N 2.953 124.185 121.223 0.015 0.000 2.543 282 L HA -0.057 4.280 4.340 -0.005 0.000 0.285 282 L C 1.575 178.668 176.870 0.372 0.000 1.236 282 L CA 0.294 55.279 54.840 0.241 0.000 0.871 282 L CB 0.393 42.448 42.059 -0.006 0.000 1.121 282 L HN 0.738 8.968 8.230 -0.000 0.000 0.501 283 T N -4.140 110.631 114.554 0.362 0.000 3.037 283 T HA -0.072 4.275 4.350 -0.005 0.000 0.252 283 T C 1.557 176.435 174.700 0.297 0.000 1.073 283 T CA 0.505 62.791 62.100 0.311 0.000 1.091 283 T CB -0.150 68.887 68.868 0.280 0.000 0.935 283 T HN 0.759 8.999 8.240 -0.000 0.000 0.488 284 T N -0.801 113.881 114.554 0.213 0.000 3.072 284 T HA 0.141 4.488 4.350 -0.005 0.000 0.266 284 T C 0.491 175.251 174.700 0.099 0.000 1.127 284 T CA 0.379 62.533 62.100 0.090 0.000 1.107 284 T CB -0.330 68.532 68.868 -0.010 0.000 0.910 284 T HN 0.533 8.773 8.240 -0.000 0.000 0.513 285 K N 0.717 121.196 120.400 0.131 0.000 2.616 285 K HA 0.332 4.649 4.320 -0.005 0.000 0.255 285 K C -0.782 175.899 176.600 0.136 0.000 0.995 285 K CA -0.649 55.705 56.287 0.110 0.000 0.860 285 K CB 1.452 34.008 32.500 0.093 0.000 1.264 285 K HN 0.108 8.358 8.250 -0.000 0.000 0.451 286 R N 3.216 123.785 120.500 0.115 0.000 2.537 286 R HA 0.080 4.417 4.340 -0.005 0.000 0.281 286 R C -0.812 175.638 176.300 0.250 0.000 0.988 286 R CA 0.071 56.272 56.100 0.170 0.000 1.077 286 R CB 0.337 30.693 30.300 0.093 0.000 0.932 286 R HN 0.367 8.637 8.270 -0.000 0.000 0.409 287 V N 6.693 126.824 119.914 0.362 0.000 2.539 287 V HA 0.122 4.239 4.120 -0.005 0.000 0.292 287 V C 0.288 176.622 176.094 0.400 0.000 1.045 287 V CA -0.459 62.024 62.300 0.306 0.000 0.945 287 V CB 1.387 33.320 31.823 0.183 0.000 0.993 287 V HN 0.722 8.912 8.190 -0.000 0.000 0.464 288 F N 4.912 124.992 119.950 0.217 0.000 2.677 288 F HA 0.034 4.557 4.527 -0.005 0.000 0.358 288 F C 1.238 177.107 175.800 0.115 0.000 1.266 288 F CA -0.208 57.911 58.000 0.198 0.000 1.262 288 F CB -0.160 38.980 39.000 0.232 0.000 1.684 288 F HN 0.830 9.130 8.300 -0.000 0.000 0.671 289 W N 4.772 126.066 121.300 -0.009 0.000 2.318 289 W HA -0.262 4.396 4.660 -0.004 0.000 0.313 289 W C 1.972 178.265 176.519 -0.375 0.000 1.221 289 W CA 1.670 58.866 57.345 -0.248 0.000 1.266 289 W CB -0.288 29.061 29.460 -0.185 0.000 1.150 289 W HN 0.486 8.666 8.180 -0.000 0.000 0.496 290 R N 0.409 120.676 120.500 -0.388 0.000 2.091 290 R HA -0.133 4.204 4.340 -0.005 0.000 0.238 290 R C 2.561 178.327 176.300 -0.889 0.000 1.136 290 R CA 2.170 57.956 56.100 -0.524 0.000 0.959 290 R CB -1.031 29.195 30.300 -0.122 0.000 0.856 290 R HN 0.235 8.505 8.270 -0.000 0.000 0.437 291 G N -0.013 107.821 108.800 -1.610 0.000 2.421 291 G HA2 -0.220 3.737 3.960 -0.005 0.000 0.216 291 G HA3 -0.220 3.737 3.960 -0.005 0.000 0.216 291 G C 1.420 175.901 174.900 -0.698 0.000 1.171 291 G CA 0.875 45.202 45.100 -1.289 0.000 0.775 291 G HN 0.215 8.505 8.290 -0.000 0.000 0.543 292 V N 0.309 119.654 119.914 -0.949 0.000 2.250 292 V HA -0.291 3.826 4.120 -0.005 0.000 0.250 292 V C 2.987 178.527 176.094 -0.923 0.000 1.060 292 V CA 2.002 63.581 62.300 -1.203 0.000 1.030 292 V CB -0.962 30.055 31.823 -1.342 0.000 0.643 292 V HN 0.579 8.769 8.190 -0.000 0.000 0.445 293 C N 0.043 118.647 119.300 -1.160 0.000 2.413 293 C HA -0.159 4.298 4.460 -0.005 0.000 0.277 293 C C 2.869 177.566 174.990 -0.488 0.000 1.228 293 C CA 1.432 59.911 59.018 -0.898 0.000 1.731 293 C CB -1.104 26.030 27.740 -1.011 0.000 2.042 293 C HN 0.627 8.857 8.230 -0.000 0.000 0.468 294 E N 0.294 120.226 120.200 -0.446 0.000 2.058 294 E HA -0.236 4.111 4.350 -0.005 0.000 0.194 294 E C 2.088 178.535 176.600 -0.255 0.000 0.997 294 E CA 1.480 57.708 56.400 -0.287 0.000 0.801 294 E CB -0.710 28.815 29.700 -0.291 0.000 0.746 294 E HN 0.783 9.143 8.360 -0.000 0.000 0.450 295 E N 0.594 120.589 120.200 -0.341 0.000 2.077 295 E HA -0.156 4.191 4.350 -0.005 0.000 0.193 295 E C 2.177 178.515 176.600 -0.436 0.000 0.989 295 E CA 0.435 56.594 56.400 -0.401 0.000 0.800 295 E CB -0.003 29.486 29.700 -0.353 0.000 0.746 295 E HN 0.107 8.467 8.360 -0.000 0.000 0.452 296 L N 1.177 122.228 121.223 -0.288 0.000 2.017 296 L HA -0.170 4.167 4.340 -0.005 0.000 0.208 296 L C 2.264 179.171 176.870 0.062 0.000 1.073 296 L CA 1.466 56.277 54.840 -0.049 0.000 0.745 296 L CB -0.733 41.266 42.059 -0.100 0.000 0.894 296 L HN 0.310 8.540 8.230 -0.000 0.000 0.432 297 L N -1.824 119.402 121.223 0.004 0.000 2.131 297 L HA -0.248 4.089 4.340 -0.005 0.000 0.210 297 L C 2.432 179.378 176.870 0.126 0.000 1.092 297 L CA 1.435 56.323 54.840 0.080 0.000 0.759 297 L CB -0.710 41.386 42.059 0.062 0.000 0.903 297 L HN 0.418 8.648 8.230 -0.000 0.000 0.435 298 W N 0.626 121.839 121.300 -0.144 0.000 2.358 298 W HA -0.216 4.440 4.660 -0.005 0.000 0.303 298 W C 2.216 178.691 176.519 -0.072 0.000 1.208 298 W CA 1.262 58.516 57.345 -0.152 0.000 1.274 298 W CB -0.235 29.055 29.460 -0.284 0.000 1.138 298 W HN -0.027 8.152 8.180 -0.000 0.000 0.515 299 F N 0.410 120.350 119.950 -0.016 0.000 2.102 299 F HA -0.176 4.348 4.527 -0.005 0.000 0.298 299 F C 2.338 177.974 175.800 -0.272 0.000 1.105 299 F CA 1.410 59.177 58.000 -0.388 0.000 1.239 299 F CB -1.493 37.200 39.000 -0.511 0.000 0.991 299 F HN -0.170 8.130 8.300 -0.000 0.000 0.474 300 L N -0.572 120.778 121.223 0.212 0.000 2.131 300 L HA -0.198 4.139 4.340 -0.005 0.000 0.210 300 L C 2.358 179.280 176.870 0.086 0.000 1.092 300 L CA 1.219 56.187 54.840 0.213 0.000 0.759 300 L CB -0.471 41.707 42.059 0.199 0.000 0.903 300 L HN 0.064 8.294 8.230 -0.000 0.000 0.435 301 R N -0.178 120.339 120.500 0.028 0.000 2.307 301 R HA 0.033 4.370 4.340 -0.005 0.000 0.199 301 R C 1.171 177.438 176.300 -0.054 0.000 1.000 301 R CA 0.588 56.688 56.100 0.000 0.000 1.023 301 R CB 0.004 30.310 30.300 0.010 0.000 0.908 301 R HN 0.462 8.732 8.270 -0.000 0.000 0.473 302 G N 1.819 110.543 108.800 -0.127 0.000 2.160 302 G HA2 -0.235 3.722 3.960 -0.005 0.000 0.244 302 G HA3 -0.235 3.722 3.960 -0.005 0.000 0.244 302 G C -0.256 174.538 174.900 -0.177 0.000 1.022 302 G CA -0.102 44.913 45.100 -0.142 0.000 0.741 302 G HN 0.250 8.540 8.290 -0.000 0.000 0.508 303 E N -0.302 119.610 120.200 -0.480 0.000 2.392 303 E HA 0.454 4.801 4.350 -0.005 0.000 0.259 303 E C 1.402 177.559 176.600 -0.739 0.000 1.108 303 E CA 0.650 56.683 56.400 -0.613 0.000 0.916 303 E CB 0.925 29.992 29.700 -1.056 0.000 0.989 303 E HN 0.640 9.000 8.360 -0.000 0.000 0.432 304 T N -2.892 111.493 114.554 -0.281 0.000 3.046 304 T HA 0.014 4.361 4.350 -0.005 0.000 0.270 304 T C 0.040 174.822 174.700 0.136 0.000 0.920 304 T CA -0.323 61.677 62.100 -0.166 0.000 0.874 304 T CB -0.158 68.635 68.868 -0.124 0.000 1.214 304 T HN 0.323 8.563 8.240 -0.000 0.000 0.536 305 Y N 3.068 123.407 120.300 0.065 0.000 2.535 305 Y HA 0.727 5.274 4.550 -0.005 0.000 0.349 305 Y C 1.371 177.360 175.900 0.148 0.000 0.992 305 Y CA -2.029 56.034 58.100 -0.061 0.000 1.248 305 Y CB 0.507 38.741 38.460 -0.377 0.000 1.124 305 Y HN 0.256 8.536 8.280 -0.000 0.000 0.520 306 A N 4.921 127.699 122.820 -0.071 0.000 2.125 306 A HA -0.154 4.163 4.320 -0.005 0.000 0.219 306 A C 2.276 179.563 177.584 -0.495 0.000 1.156 306 A CA 1.385 53.200 52.037 -0.371 0.000 0.671 306 A CB -0.402 18.413 19.000 -0.307 0.000 0.794 306 A HN 0.796 8.946 8.150 -0.000 0.000 0.459 307 K N 0.295 120.223 120.400 -0.786 0.000 2.147 307 K HA -0.149 4.168 4.320 -0.005 0.000 0.205 307 K C 1.738 178.067 176.600 -0.451 0.000 1.049 307 K CA 1.514 57.374 56.287 -0.712 0.000 0.936 307 K CB -0.140 31.686 32.500 -1.122 0.000 0.722 307 K HN 0.488 8.738 8.250 -0.000 0.000 0.446 308 K N 0.303 120.490 120.400 -0.356 0.000 2.211 308 K HA -0.134 4.183 4.320 -0.005 0.000 0.204 308 K C 1.949 178.406 176.600 -0.239 0.000 1.047 308 K CA 1.133 57.336 56.287 -0.139 0.000 0.935 308 K CB -0.014 32.550 32.500 0.107 0.000 0.728 308 K HN 0.210 8.460 8.250 -0.000 0.000 0.452 309 L N -0.140 120.825 121.223 -0.430 0.000 2.102 309 L HA -0.074 4.263 4.340 -0.005 0.000 0.202 309 L C 2.417 179.055 176.870 -0.387 0.000 1.076 309 L CA 0.590 55.145 54.840 -0.474 0.000 0.761 309 L CB -0.345 41.297 42.059 -0.695 0.000 0.921 309 L HN 0.037 8.267 8.230 -0.000 0.000 0.444 310 S N 0.115 115.588 115.700 -0.378 0.000 2.359 310 S HA -0.224 4.243 4.470 -0.005 0.000 0.223 310 S C 1.484 175.914 174.600 -0.283 0.000 1.039 310 S CA 1.729 59.703 58.200 -0.375 0.000 1.042 310 S CB -0.335 62.747 63.200 -0.197 0.000 0.915 310 S HN 0.431 8.741 8.310 -0.000 0.000 0.439 311 D N 0.767 121.055 120.400 -0.186 0.000 2.309 311 D HA -0.047 4.590 4.640 -0.005 0.000 0.212 311 D C 1.240 177.484 176.300 -0.095 0.000 0.968 311 D CA 0.900 54.839 54.000 -0.102 0.000 0.882 311 D CB -0.101 40.654 40.800 -0.074 0.000 0.918 311 D HN 0.415 8.785 8.370 -0.000 0.000 0.503 312 K N -0.528 119.784 120.400 -0.147 0.000 2.410 312 K HA 0.242 4.559 4.320 -0.005 0.000 0.200 312 K C 0.916 177.451 176.600 -0.109 0.000 1.023 312 K CA 0.198 56.418 56.287 -0.111 0.000 1.149 312 K CB 0.956 33.382 32.500 -0.123 0.000 0.859 312 K HN 0.049 8.299 8.250 -0.000 0.000 0.514 313 G N 1.081 109.776 108.800 -0.174 0.000 2.143 313 G HA2 -0.221 3.736 3.960 -0.005 0.000 0.248 313 G HA3 -0.221 3.736 3.960 -0.005 0.000 0.248 313 G C -0.052 174.736 174.900 -0.186 0.000 0.991 313 G CA -0.047 44.978 45.100 -0.124 0.000 0.689 313 G HN 0.146 8.436 8.290 -0.000 0.000 0.522 314 V N 2.138 121.836 119.914 -0.360 0.000 2.293 314 V HA 0.375 4.492 4.120 -0.005 0.000 0.275 314 V C 0.635 176.503 176.094 -0.377 0.000 1.021 314 V CA -0.811 61.374 62.300 -0.191 0.000 0.815 314 V CB 0.988 32.686 31.823 -0.207 0.000 1.025 314 V HN 0.390 8.580 8.190 -0.000 0.000 0.448 315 H N 5.172 124.249 119.070 0.012 0.000 2.537 315 H HA 0.201 4.754 4.556 -0.005 0.000 0.295 315 H C 1.786 177.073 175.328 -0.069 0.000 1.054 315 H CA 0.152 56.178 56.048 -0.036 0.000 1.156 315 H CB 0.482 30.222 29.762 -0.038 0.000 1.468 315 H HN 0.788 9.068 8.280 -0.000 0.000 0.551 316 I N -3.440 117.100 120.570 -0.050 0.000 2.916 316 I HA -0.106 4.061 4.170 -0.005 0.000 0.267 316 I C 1.085 176.998 176.117 -0.340 0.000 1.263 316 I CA 1.123 62.291 61.300 -0.220 0.000 1.471 316 I CB -0.178 37.602 38.000 -0.368 0.000 1.089 316 I HN 0.033 8.243 8.210 -0.000 0.000 0.468 317 W N 1.301 122.497 121.300 -0.172 0.000 3.008 317 W HA 0.193 4.850 4.660 -0.005 0.000 0.355 317 W C 1.562 178.008 176.519 -0.122 0.000 1.095 317 W CA -0.398 56.852 57.345 -0.158 0.000 1.738 317 W CB 0.223 29.553 29.460 -0.217 0.000 1.091 317 W HN 0.036 8.216 8.180 -0.000 0.000 0.574 318 D N 0.781 121.237 120.400 0.092 0.000 2.116 318 D HA -0.222 4.415 4.640 -0.005 0.000 0.193 318 D C 1.471 177.786 176.300 0.026 0.000 0.998 318 D CA 1.826 55.867 54.000 0.068 0.000 0.836 318 D CB -0.395 40.449 40.800 0.072 0.000 0.951 318 D HN 0.083 8.453 8.370 -0.000 0.000 0.449 319 D N 0.042 120.416 120.400 -0.043 0.000 2.117 319 D HA -0.079 4.558 4.640 -0.005 0.000 0.197 319 D C 1.279 177.431 176.300 -0.246 0.000 0.987 319 D CA 0.749 54.689 54.000 -0.101 0.000 0.829 319 D CB -0.548 40.166 40.800 -0.143 0.000 0.961 319 D HN 0.341 8.711 8.370 -0.000 0.000 0.460 320 N N -0.564 117.939 118.700 -0.328 0.000 2.461 320 N HA 0.071 4.808 4.740 -0.005 0.000 0.188 320 N C 1.240 176.723 175.510 -0.045 0.000 1.134 320 N CA 0.205 52.885 53.050 -0.618 0.000 0.878 320 N CB 0.520 38.812 38.487 -0.323 0.000 0.972 320 N HN 0.078 8.458 8.380 -0.000 0.000 0.456 321 G N 0.118 108.983 108.800 0.109 0.000 3.441 321 G HA2 0.008 3.965 3.960 -0.005 0.000 0.263 321 G HA3 0.008 3.965 3.960 -0.005 0.000 0.263 321 G C 0.313 175.329 174.900 0.192 0.000 1.014 321 G CA -0.282 44.935 45.100 0.196 0.000 0.833 321 G HN 0.218 8.508 8.290 -0.000 0.000 0.514 322 S N -0.220 115.590 115.700 0.183 0.000 2.600 322 S HA 0.305 4.772 4.470 -0.005 0.000 0.265 322 S C 1.514 176.237 174.600 0.205 0.000 1.325 322 S CA -0.261 58.042 58.200 0.172 0.000 1.002 322 S CB 2.009 65.296 63.200 0.146 0.000 0.921 322 S HN 0.111 8.421 8.310 -0.000 0.000 0.554 323 R N 1.505 122.099 120.500 0.156 0.000 2.096 323 R HA -0.094 4.243 4.340 -0.005 0.000 0.240 323 R C 2.404 178.784 176.300 0.133 0.000 1.139 323 R CA 2.293 58.477 56.100 0.140 0.000 0.952 323 R CB -1.537 28.826 30.300 0.104 0.000 0.854 323 R HN 0.864 9.134 8.270 -0.000 0.000 0.436 324 A N -0.567 122.331 122.820 0.130 0.000 1.858 324 A HA -0.141 4.176 4.320 -0.005 0.000 0.216 324 A C 2.247 179.903 177.584 0.121 0.000 1.190 324 A CA 1.490 53.592 52.037 0.108 0.000 0.617 324 A CB -0.959 18.102 19.000 0.102 0.000 0.827 324 A HN 0.465 8.615 8.150 -0.000 0.000 0.443 325 F N 0.044 120.033 119.950 0.065 0.000 2.069 325 F HA -0.175 4.349 4.527 -0.005 0.000 0.298 325 F C 1.947 177.794 175.800 0.078 0.000 1.113 325 F CA 1.657 59.700 58.000 0.072 0.000 1.214 325 F CB -0.259 38.797 39.000 0.092 0.000 0.978 325 F HN 0.148 8.448 8.300 -0.000 0.000 0.474 326 L N 0.623 122.024 121.223 0.296 0.000 2.043 326 L HA -0.279 4.058 4.340 -0.005 0.000 0.212 326 L C 2.147 179.039 176.870 0.037 0.000 1.075 326 L CA 1.876 56.839 54.840 0.206 0.000 0.752 326 L CB -1.314 40.901 42.059 0.260 0.000 0.891 326 L HN 0.194 8.424 8.230 -0.000 0.000 0.432 327 D N -1.288 119.129 120.400 0.027 0.000 2.144 327 D HA -0.119 4.518 4.640 -0.005 0.000 0.200 327 D C 2.246 178.501 176.300 -0.075 0.000 0.978 327 D CA 1.474 55.463 54.000 -0.018 0.000 0.833 327 D CB -0.012 40.792 40.800 0.006 0.000 0.961 327 D HN 0.449 8.819 8.370 -0.000 0.000 0.470 328 S N 0.280 115.906 115.700 -0.122 0.000 2.469 328 S HA -0.073 4.394 4.470 -0.005 0.000 0.238 328 S C 1.692 176.162 174.600 -0.217 0.000 0.998 328 S CA 0.538 58.632 58.200 -0.178 0.000 0.957 328 S CB 0.027 63.077 63.200 -0.249 0.000 0.764 328 S HN 0.032 8.342 8.310 -0.000 0.000 0.514 329 R N 0.675 121.037 120.500 -0.230 0.000 2.317 329 R HA 0.283 4.620 4.340 -0.005 0.000 0.208 329 R C 1.697 177.922 176.300 -0.127 0.000 0.914 329 R CA 0.528 56.517 56.100 -0.186 0.000 1.060 329 R CB -0.655 29.550 30.300 -0.159 0.000 1.015 329 R HN 0.648 8.918 8.270 -0.000 0.000 0.498 330 G N 0.928 109.659 108.800 -0.115 0.000 2.179 330 G HA2 -0.255 3.702 3.960 -0.005 0.000 0.260 330 G HA3 -0.255 3.702 3.960 -0.005 0.000 0.260 330 G C 0.318 175.128 174.900 -0.151 0.000 0.977 330 G CA 0.061 45.095 45.100 -0.111 0.000 0.641 330 G HN 0.318 8.608 8.290 -0.000 0.000 0.533 331 L N 2.522 123.643 121.223 -0.169 0.000 2.727 331 L HA 0.243 4.580 4.340 -0.005 0.000 0.237 331 L C 2.202 178.962 176.870 -0.184 0.000 1.370 331 L CA 0.447 55.098 54.840 -0.315 0.000 1.248 331 L CB -0.333 41.550 42.059 -0.293 0.000 1.556 331 L HN 0.384 8.614 8.230 -0.000 0.000 0.420 332 T N -4.545 109.934 114.554 -0.126 0.000 3.035 332 T HA -0.054 4.293 4.350 -0.005 0.000 0.268 332 T C 1.399 176.100 174.700 0.001 0.000 1.109 332 T CA 0.488 62.566 62.100 -0.037 0.000 1.119 332 T CB 0.087 68.936 68.868 -0.030 0.000 0.900 332 T HN 0.282 8.522 8.240 -0.000 0.000 0.503 333 E N 0.269 120.440 120.200 -0.049 0.000 2.442 333 E HA 0.109 4.456 4.350 -0.005 0.000 0.195 333 E C -0.323 176.453 176.600 0.293 0.000 1.030 333 E CA 0.146 56.594 56.400 0.080 0.000 0.869 333 E CB -0.103 29.619 29.700 0.035 0.000 0.857 333 E HN 0.566 8.926 8.360 -0.000 0.000 0.505 334 Y N 1.701 122.098 120.300 0.162 0.000 2.346 334 Y HA 0.132 4.679 4.550 -0.005 0.000 0.330 334 Y C 1.119 177.139 175.900 0.199 0.000 1.178 334 Y CA -1.421 56.811 58.100 0.219 0.000 1.331 334 Y CB 0.170 38.743 38.460 0.188 0.000 1.253 334 Y HN -0.068 8.212 8.280 -0.000 0.000 0.529 335 E N 2.285 122.718 120.200 0.389 0.000 2.366 335 E HA 0.045 4.392 4.350 -0.005 0.000 0.266 335 E C -0.384 176.393 176.600 0.296 0.000 1.051 335 E CA -0.528 56.032 56.400 0.267 0.000 0.884 335 E CB 0.638 30.466 29.700 0.213 0.000 1.006 335 E HN 0.719 9.079 8.360 -0.000 0.000 0.417 336 E N 3.040 123.386 120.200 0.243 0.000 2.481 336 E HA -0.157 4.190 4.350 -0.005 0.000 0.263 336 E C 0.170 176.923 176.600 0.256 0.000 0.992 336 E CA 0.301 56.836 56.400 0.225 0.000 0.938 336 E CB 0.282 30.081 29.700 0.166 0.000 0.933 336 E HN 0.630 8.990 8.360 -0.000 0.000 0.453 337 M N 0.885 120.601 119.600 0.195 0.000 2.949 337 M HA -0.229 4.248 4.480 -0.005 0.000 0.194 337 M C -0.369 176.049 176.300 0.196 0.000 0.618 337 M CA 0.893 56.261 55.300 0.113 0.000 0.742 337 M CB -2.012 30.531 32.600 -0.096 0.000 2.662 337 M HN 0.570 8.860 8.290 -0.000 0.000 0.291 338 D N 1.803 122.367 120.400 0.273 0.000 2.393 338 D HA 0.451 5.088 4.640 -0.005 0.000 0.232 338 D C 1.001 177.304 176.300 0.005 0.000 1.192 338 D CA -0.067 54.036 54.000 0.172 0.000 0.882 338 D CB 0.289 41.206 40.800 0.195 0.000 1.038 338 D HN 0.442 8.812 8.370 -0.000 0.000 0.499 339 L N 2.900 124.091 121.223 -0.053 0.000 2.610 339 L HA 0.208 4.545 4.340 -0.005 0.000 0.232 339 L C 1.562 178.295 176.870 -0.228 0.000 1.149 339 L CA 0.296 55.092 54.840 -0.072 0.000 0.872 339 L CB -0.816 41.140 42.059 -0.172 0.000 0.992 339 L HN 0.614 8.844 8.230 -0.000 0.000 0.447 340 G N 0.783 109.202 108.800 -0.635 0.000 2.660 340 G HA2 -0.191 3.766 3.960 -0.005 0.000 0.215 340 G HA3 -0.191 3.766 3.960 -0.005 0.000 0.215 340 G C -2.529 171.567 174.900 -1.341 0.000 1.345 340 G CA -0.413 44.071 45.100 -1.027 0.000 0.877 340 G HN 0.034 8.324 8.290 -0.000 0.000 0.549 341 P HA 0.327 4.747 4.420 -0.000 0.000 0.225 341 P C 0.800 177.767 177.300 -0.554 0.000 1.768 341 P CA 0.600 62.880 63.100 -1.368 0.000 0.943 341 P CB -0.416 30.500 31.700 -1.305 0.000 1.936 342 V N -2.103 117.550 119.914 -0.435 0.000 3.214 342 V HA 0.175 4.292 4.120 -0.005 0.000 0.306 342 V C 1.320 177.311 176.094 -0.172 0.000 1.078 342 V CA -0.475 61.665 62.300 -0.267 0.000 1.077 342 V CB -0.515 31.203 31.823 -0.176 0.000 1.121 342 V HN 0.164 8.354 8.190 -0.000 0.000 0.468 343 Y N 2.311 122.493 120.300 -0.197 0.000 1.384 343 Y HA -0.416 4.131 4.550 -0.005 0.000 0.095 343 Y C 2.516 177.926 175.900 -0.817 0.000 0.643 343 Y CA 3.153 60.958 58.100 -0.492 0.000 0.404 343 Y CB -2.051 35.966 38.460 -0.738 0.000 0.530 343 Y HN 0.851 9.131 8.280 -0.000 0.000 0.792 344 G N -1.413 106.920 108.800 -0.778 0.000 2.507 344 G HA2 -0.326 3.631 3.960 -0.005 0.000 0.221 344 G HA3 -0.326 3.631 3.960 -0.005 0.000 0.221 344 G C 1.466 176.234 174.900 -0.220 0.000 1.119 344 G CA 1.137 45.830 45.100 -0.679 0.000 0.751 344 G HN 0.504 8.794 8.290 -0.000 0.000 0.574 345 F N 0.991 120.778 119.950 -0.272 0.000 2.134 345 F HA -0.089 4.435 4.527 -0.005 0.000 0.299 345 F C 2.830 178.618 175.800 -0.020 0.000 1.097 345 F CA 1.837 59.764 58.000 -0.121 0.000 1.264 345 F CB 0.101 38.959 39.000 -0.237 0.000 1.001 345 F HN 0.088 8.388 8.300 -0.000 0.000 0.479 346 Q N -0.697 119.209 119.800 0.175 0.000 2.172 346 Q HA -0.162 4.175 4.340 -0.005 0.000 0.200 346 Q C 2.051 178.300 176.000 0.415 0.000 0.964 346 Q CA 1.219 57.176 55.803 0.257 0.000 0.855 346 Q CB -0.815 28.103 28.738 0.300 0.000 0.918 346 Q HN 0.526 8.796 8.270 -0.000 0.000 0.444 347 W N 1.324 122.691 121.300 0.112 0.000 2.358 347 W HA -0.094 4.563 4.660 -0.005 0.000 0.303 347 W C 1.938 178.397 176.519 -0.101 0.000 1.208 347 W CA 0.746 58.127 57.345 0.061 0.000 1.274 347 W CB -0.319 29.125 29.460 -0.026 0.000 1.138 347 W HN 0.138 8.318 8.180 -0.000 0.000 0.515 348 R N -1.390 119.088 120.500 -0.036 0.000 2.265 348 R HA 0.071 4.408 4.340 -0.005 0.000 0.194 348 R C 0.179 176.025 176.300 -0.757 0.000 0.931 348 R CA 0.710 56.557 56.100 -0.422 0.000 1.032 348 R CB -0.586 29.341 30.300 -0.623 0.000 0.980 348 R HN 0.283 8.553 8.270 -0.000 0.000 0.497 349 H N -0.904 118.019 119.070 -0.245 0.000 2.924 349 H HA 0.133 4.686 4.556 -0.005 0.000 0.229 349 H C -0.766 174.431 175.328 -0.218 0.000 1.345 349 H CA -1.086 54.729 56.048 -0.388 0.000 1.044 349 H CB -0.514 28.640 29.762 -1.013 0.000 2.221 349 H HN -0.061 8.219 8.280 -0.000 0.000 0.574 350 F N 2.214 122.151 119.950 -0.021 0.000 2.593 350 F HA 0.234 4.758 4.527 -0.005 0.000 0.393 350 F C 1.493 177.346 175.800 0.087 0.000 1.037 350 F CA 2.081 60.125 58.000 0.073 0.000 1.195 350 F CB 0.340 39.402 39.000 0.104 0.000 1.034 350 F HN 0.607 8.907 8.300 -0.000 0.000 0.552 351 G N 3.444 112.031 108.800 -0.355 0.000 2.253 351 G HA2 -0.196 3.761 3.960 -0.005 0.000 0.251 351 G HA3 -0.196 3.761 3.960 -0.005 0.000 0.251 351 G C 0.431 175.361 174.900 0.050 0.000 0.998 351 G CA 0.014 45.037 45.100 -0.129 0.000 0.621 351 G HN 1.417 9.707 8.290 -0.000 0.000 0.524 352 A N 0.583 123.473 122.820 0.117 0.000 2.520 352 A HA 0.663 4.980 4.320 -0.005 0.000 0.235 352 A C 1.100 178.841 177.584 0.261 0.000 1.065 352 A CA 1.238 53.385 52.037 0.184 0.000 0.764 352 A CB 0.183 19.262 19.000 0.133 0.000 1.002 352 A HN 2.170 10.320 8.150 -0.000 0.000 0.502 353 A N 1.186 124.136 122.820 0.217 0.000 2.425 353 A HA 0.499 4.816 4.320 -0.005 0.000 0.249 353 A C -0.446 177.310 177.584 0.286 0.000 1.084 353 A CA 0.049 52.195 52.037 0.183 0.000 0.781 353 A CB -0.023 19.047 19.000 0.118 0.000 1.019 353 A HN 1.037 9.187 8.150 -0.000 0.000 0.490 354 Y N 1.347 121.653 120.300 0.011 0.000 2.393 354 Y HA 0.451 4.998 4.550 -0.005 0.000 0.341 354 Y C 1.230 177.113 175.900 -0.029 0.000 0.988 354 Y CA 0.404 58.455 58.100 -0.081 0.000 1.078 354 Y CB 2.096 40.267 38.460 -0.482 0.000 1.203 354 Y HN 0.843 9.123 8.280 -0.000 0.000 0.453 355 T N 0.394 114.701 114.554 -0.412 0.000 3.330 355 T HA 0.344 4.691 4.350 -0.005 0.000 0.240 355 T C -0.266 173.924 174.700 -0.849 0.000 0.988 355 T CA 0.124 61.963 62.100 -0.435 0.000 1.253 355 T CB 0.093 68.801 68.868 -0.266 0.000 1.163 355 T HN 0.560 8.800 8.240 -0.000 0.000 0.382 356 H N 0.435 119.153 119.070 -0.587 0.000 2.961 356 H HA 0.353 4.906 4.556 -0.005 0.000 0.371 356 H C 0.734 175.709 175.328 -0.589 0.000 1.190 356 H CA -0.069 55.681 56.048 -0.496 0.000 1.138 356 H CB 1.651 31.218 29.762 -0.324 0.000 1.816 356 H HN 0.599 8.879 8.280 -0.000 0.000 0.551 357 H N 0.220 119.217 119.070 -0.122 0.000 2.457 357 H HA -0.149 4.404 4.556 -0.005 0.000 0.297 357 H C 0.669 175.991 175.328 -0.009 0.000 1.092 357 H CA 2.174 58.233 56.048 0.018 0.000 1.309 357 H CB -0.069 29.684 29.762 -0.014 0.000 1.382 357 H HN 0.601 8.881 8.280 -0.000 0.000 0.535 358 D N 0.764 120.718 120.400 -0.742 0.000 2.289 358 D HA 0.096 4.733 4.640 -0.005 0.000 0.207 358 D C 1.281 177.392 176.300 -0.316 0.000 0.966 358 D CA 0.502 54.211 54.000 -0.485 0.000 0.868 358 D CB -0.218 40.222 40.800 -0.599 0.000 0.943 358 D HN 0.653 9.023 8.370 -0.000 0.000 0.514 359 A N 0.391 122.979 122.820 -0.386 0.000 2.504 359 A HA -0.003 4.314 4.320 -0.005 0.000 0.242 359 A C 0.217 177.390 177.584 -0.685 0.000 1.100 359 A CA -0.041 51.653 52.037 -0.572 0.000 0.786 359 A CB -0.207 18.303 19.000 -0.817 0.000 1.050 359 A HN 0.384 8.534 8.150 -0.000 0.000 0.512 360 N N -0.343 117.958 118.700 -0.666 0.000 2.457 360 N HA 0.410 5.147 4.740 -0.005 0.000 0.250 360 N C -0.901 174.218 175.510 -0.651 0.000 0.982 360 N CA -0.307 52.439 53.050 -0.506 0.000 0.941 360 N CB 0.311 38.612 38.487 -0.310 0.000 1.120 360 N HN 0.595 8.975 8.380 -0.000 0.000 0.505 361 Y N 0.694 120.819 120.300 -0.292 0.000 2.458 361 Y HA 0.182 4.730 4.550 -0.005 0.000 0.256 361 Y C -0.042 175.519 175.900 -0.564 0.000 1.159 361 Y CA -0.568 57.257 58.100 -0.459 0.000 1.261 361 Y CB 0.124 38.190 38.460 -0.657 0.000 1.119 361 Y HN 0.456 8.736 8.280 -0.000 0.000 0.524 362 D N 0.652 120.806 120.400 -0.409 0.000 2.531 362 D HA 0.159 4.796 4.640 -0.005 0.000 0.239 362 D C 1.500 177.473 176.300 -0.544 0.000 1.144 362 D CA 1.808 55.361 54.000 -0.746 0.000 0.869 362 D CB 0.719 40.790 40.800 -1.216 0.000 1.160 362 D HN 0.538 8.908 8.370 -0.000 0.000 0.484 363 G N 2.101 110.713 108.800 -0.314 0.000 2.212 363 G HA2 -0.278 3.679 3.960 -0.005 0.000 0.266 363 G HA3 -0.278 3.679 3.960 -0.005 0.000 0.266 363 G C 0.230 175.190 174.900 0.099 0.000 0.978 363 G CA 0.012 45.183 45.100 0.118 0.000 0.632 363 G HN 0.476 8.766 8.290 -0.000 0.000 0.537 364 Q N 0.457 120.283 119.800 0.043 0.000 2.235 364 Q HA 0.574 4.911 4.340 -0.005 0.000 0.250 364 Q C 0.907 176.987 176.000 0.133 0.000 0.909 364 Q CA 0.522 56.364 55.803 0.066 0.000 0.910 364 Q CB 1.058 29.814 28.738 0.031 0.000 1.223 364 Q HN 1.729 9.999 8.270 -0.000 0.000 0.432 365 G N 0.393 109.266 108.800 0.121 0.000 2.796 365 G HA2 -0.206 3.751 3.960 -0.005 0.000 0.226 365 G HA3 -0.206 3.751 3.960 -0.005 0.000 0.226 365 G C -0.757 174.232 174.900 0.150 0.000 1.381 365 G CA -0.509 44.675 45.100 0.140 0.000 0.867 365 G HN 0.471 8.761 8.290 -0.000 0.000 0.552 366 V N 1.089 121.111 119.914 0.180 0.000 2.406 366 V HA 0.383 4.500 4.120 -0.005 0.000 0.272 366 V C 0.307 176.455 176.094 0.089 0.000 1.043 366 V CA 0.066 62.448 62.300 0.137 0.000 0.915 366 V CB 1.608 33.514 31.823 0.138 0.000 0.988 366 V HN 0.755 8.945 8.190 -0.000 0.000 0.466 367 D N 4.167 124.592 120.400 0.042 0.000 2.453 367 D HA 0.159 4.796 4.640 -0.005 0.000 0.223 367 D C 1.129 177.432 176.300 0.005 0.000 1.183 367 D CA 0.098 54.088 54.000 -0.017 0.000 0.933 367 D CB 1.074 41.863 40.800 -0.017 0.000 1.038 367 D HN 0.602 8.972 8.370 -0.000 0.000 0.513 368 Q N 2.588 122.404 119.800 0.026 0.000 2.119 368 Q HA -0.116 4.221 4.340 -0.005 0.000 0.201 368 Q C 1.706 177.688 176.000 -0.030 0.000 0.972 368 Q CA 0.803 56.626 55.803 0.034 0.000 0.847 368 Q CB 0.403 29.209 28.738 0.113 0.000 0.903 368 Q HN 0.583 8.853 8.270 -0.000 0.000 0.433 369 I N 1.202 121.706 120.570 -0.111 0.000 2.252 369 I HA -0.238 3.929 4.170 -0.005 0.000 0.245 369 I C 2.324 178.377 176.117 -0.106 0.000 1.102 369 I CA 1.422 62.612 61.300 -0.184 0.000 1.385 369 I CB -1.010 36.868 38.000 -0.203 0.000 1.064 369 I HN 0.226 8.436 8.210 -0.000 0.000 0.414 370 K N 1.419 121.785 120.400 -0.057 0.000 2.026 370 K HA -0.149 4.168 4.320 -0.005 0.000 0.208 370 K C 2.249 178.833 176.600 -0.028 0.000 1.048 370 K CA 1.602 57.872 56.287 -0.028 0.000 0.929 370 K CB -0.018 32.485 32.500 0.005 0.000 0.713 370 K HN 0.208 8.458 8.250 -0.000 0.000 0.439 371 A N 1.462 124.272 122.820 -0.016 0.000 1.883 371 A HA -0.163 4.154 4.320 -0.005 0.000 0.217 371 A C 2.128 179.701 177.584 -0.019 0.000 1.186 371 A CA 1.698 53.731 52.037 -0.007 0.000 0.624 371 A CB -0.651 18.355 19.000 0.009 0.000 0.822 371 A HN 0.380 8.530 8.150 -0.000 0.000 0.444 372 I N -0.563 119.992 120.570 -0.026 0.000 2.226 372 I HA -0.218 3.949 4.170 -0.005 0.000 0.245 372 I C 2.353 178.400 176.117 -0.116 0.000 1.100 372 I CA 1.050 62.323 61.300 -0.043 0.000 1.374 372 I CB -0.242 37.746 38.000 -0.020 0.000 1.057 372 I HN 0.164 8.374 8.210 -0.000 0.000 0.413 373 V N 0.433 120.267 119.914 -0.133 0.000 2.343 373 V HA -0.280 3.837 4.120 -0.005 0.000 0.247 373 V C 2.454 178.496 176.094 -0.088 0.000 1.051 373 V CA 1.852 64.070 62.300 -0.136 0.000 1.036 373 V CB -0.531 31.227 31.823 -0.108 0.000 0.654 373 V HN 0.357 8.547 8.190 -0.000 0.000 0.451 374 E N 0.112 120.278 120.200 -0.056 0.000 2.077 374 E HA -0.154 4.193 4.350 -0.005 0.000 0.193 374 E C 2.358 178.935 176.600 -0.038 0.000 0.989 374 E CA 1.802 58.179 56.400 -0.038 0.000 0.800 374 E CB -0.634 29.053 29.700 -0.021 0.000 0.746 374 E HN 0.589 8.949 8.360 -0.000 0.000 0.452 375 T N 0.873 115.404 114.554 -0.037 0.000 2.821 375 T HA -0.100 4.247 4.350 -0.005 0.000 0.267 375 T C 1.539 176.214 174.700 -0.042 0.000 1.046 375 T CA 0.549 62.632 62.100 -0.029 0.000 1.139 375 T CB -0.144 68.716 68.868 -0.012 0.000 0.871 375 T HN 0.016 8.256 8.240 -0.000 0.000 0.454 376 L N 1.181 122.364 121.223 -0.067 0.000 2.083 376 L HA 0.019 4.356 4.340 -0.005 0.000 0.209 376 L C 2.175 179.004 176.870 -0.067 0.000 1.083 376 L CA 1.754 56.546 54.840 -0.080 0.000 0.752 376 L CB -0.728 41.250 42.059 -0.136 0.000 0.899 376 L HN 0.207 8.437 8.230 -0.000 0.000 0.433 377 K N -1.614 118.748 120.400 -0.063 0.000 2.296 377 K HA -0.047 4.270 4.320 -0.005 0.000 0.200 377 K C 1.757 178.333 176.600 -0.040 0.000 1.048 377 K CA 1.480 57.736 56.287 -0.051 0.000 0.966 377 K CB 0.043 32.513 32.500 -0.049 0.000 0.754 377 K HN 0.523 8.773 8.250 -0.000 0.000 0.466 378 T N -3.107 111.425 114.554 -0.036 0.000 3.026 378 T HA 0.062 4.409 4.350 -0.005 0.000 0.245 378 T C 0.635 175.319 174.700 -0.027 0.000 1.004 378 T CA -0.047 62.036 62.100 -0.028 0.000 1.069 378 T CB 0.093 68.947 68.868 -0.022 0.000 1.005 378 T HN -0.064 8.176 8.240 -0.000 0.000 0.472 379 N N 2.309 120.991 118.700 -0.029 0.000 2.733 379 N HA 0.354 5.091 4.740 -0.005 0.000 0.271 379 N C -2.188 173.301 175.510 -0.035 0.000 1.720 379 N CA -2.074 50.959 53.050 -0.028 0.000 0.803 379 N CB 1.461 39.938 38.487 -0.018 0.000 1.208 379 N HN -0.006 8.374 8.380 -0.000 0.000 0.498 380 P HA -0.097 4.323 4.420 -0.000 0.000 0.220 380 P C -0.039 177.209 177.300 -0.087 0.000 1.144 380 P CA 1.109 64.170 63.100 -0.065 0.000 0.800 380 P CB 0.459 32.113 31.700 -0.076 0.000 0.772 381 D N -0.347 120.006 120.400 -0.078 0.000 2.349 381 D HA -0.013 4.624 4.640 -0.005 0.000 0.224 381 D C 0.467 176.743 176.300 -0.039 0.000 1.029 381 D CA 0.303 54.251 54.000 -0.087 0.000 0.879 381 D CB -0.770 39.990 40.800 -0.067 0.000 0.906 381 D HN 0.283 8.653 8.370 -0.000 0.000 0.528 382 D N 0.314 120.703 120.400 -0.019 0.000 2.506 382 D HA -0.059 4.578 4.640 -0.005 0.000 0.234 382 D C 0.707 177.026 176.300 0.032 0.000 1.143 382 D CA 0.296 54.301 54.000 0.007 0.000 0.871 382 D CB 0.668 41.475 40.800 0.011 0.000 1.190 382 D HN -0.109 8.261 8.370 -0.000 0.000 0.459 383 R N 2.677 123.201 120.500 0.039 0.000 2.552 383 R HA 0.216 4.553 4.340 -0.005 0.000 0.314 383 R C 0.372 176.702 176.300 0.050 0.000 1.041 383 R CA -0.050 56.085 56.100 0.058 0.000 1.076 383 R CB 0.470 30.801 30.300 0.052 0.000 1.290 383 R HN 0.339 8.609 8.270 -0.000 0.000 0.563 384 R N 0.201 120.731 120.500 0.049 0.000 2.629 384 R HA 0.297 4.634 4.340 -0.005 0.000 0.408 384 R C -0.047 176.293 176.300 0.066 0.000 1.057 384 R CA -0.158 55.967 56.100 0.041 0.000 1.119 384 R CB 0.668 30.982 30.300 0.024 0.000 1.403 384 R HN 0.004 8.274 8.270 -0.000 0.000 0.576 385 M N 2.982 122.645 119.600 0.106 0.000 3.213 385 M HA 0.260 4.737 4.480 -0.005 0.000 0.275 385 M C -0.712 175.738 176.300 0.250 0.000 1.424 385 M CA 0.285 55.694 55.300 0.182 0.000 1.561 385 M CB -0.109 32.620 32.600 0.215 0.000 1.109 385 M HN 0.121 8.411 8.290 -0.000 0.000 0.552 386 L N -0.467 120.858 121.223 0.171 0.000 2.424 386 L HA 0.895 5.232 4.340 -0.005 0.000 0.258 386 L C -1.092 175.867 176.870 0.148 0.000 0.995 386 L CA -1.213 53.686 54.840 0.099 0.000 0.821 386 L CB 1.805 43.831 42.059 -0.054 0.000 1.383 386 L HN 0.318 8.548 8.230 -0.000 0.000 0.410 387 F N -1.161 118.776 119.950 -0.023 0.000 2.577 387 F HA 0.938 5.462 4.527 -0.005 0.000 0.318 387 F C -0.318 175.468 175.800 -0.023 0.000 1.065 387 F CA -0.714 57.254 58.000 -0.053 0.000 0.929 387 F CB 1.994 40.916 39.000 -0.130 0.000 1.237 387 F HN 0.673 8.973 8.300 -0.000 0.000 0.468 388 T N 0.255 114.929 114.554 0.200 0.000 2.900 388 T HA 0.683 5.030 4.350 -0.005 0.000 0.303 388 T C -0.246 174.784 174.700 0.550 0.000 1.142 388 T CA -0.038 62.215 62.100 0.255 0.000 1.007 388 T CB 1.652 70.636 68.868 0.193 0.000 1.156 388 T HN 1.135 9.375 8.240 -0.000 0.000 0.490 389 A N 2.426 125.586 122.820 0.567 0.000 2.431 389 A HA 0.288 4.605 4.320 -0.005 0.000 0.239 389 A C 0.455 178.252 177.584 0.355 0.000 1.230 389 A CA -0.525 51.815 52.037 0.506 0.000 0.928 389 A CB 0.109 19.371 19.000 0.437 0.000 1.006 389 A HN 0.788 8.938 8.150 -0.000 0.000 0.520 390 W N 2.348 123.795 121.300 0.245 0.000 2.430 390 W HA 0.305 4.963 4.660 -0.005 0.000 0.380 390 W C -0.771 175.893 176.519 0.242 0.000 1.045 390 W CA -0.324 57.126 57.345 0.174 0.000 1.547 390 W CB 0.251 29.791 29.460 0.133 0.000 1.554 390 W HN 0.274 8.454 8.180 -0.000 0.000 0.378 391 N N 6.894 125.510 118.700 -0.139 0.000 2.626 391 N HA 0.241 4.978 4.740 -0.005 0.000 0.242 391 N C -1.914 173.414 175.510 -0.303 0.000 1.005 391 N CA -2.179 50.802 53.050 -0.115 0.000 0.905 391 N CB 1.624 39.866 38.487 -0.408 0.000 1.128 391 N HN 0.031 8.411 8.380 -0.000 0.000 0.512 392 P HA -0.112 4.308 4.420 -0.000 0.000 0.216 392 P C 1.008 178.220 177.300 -0.147 0.000 1.150 392 P CA 1.235 64.220 63.100 -0.191 0.000 0.843 392 P CB 0.429 32.128 31.700 -0.001 0.000 0.787 393 S N -0.727 114.910 115.700 -0.106 0.000 2.382 393 S HA -0.113 4.354 4.470 -0.005 0.000 0.228 393 S C 1.938 176.459 174.600 -0.132 0.000 1.027 393 S CA 1.466 59.611 58.200 -0.091 0.000 0.991 393 S CB -0.797 62.366 63.200 -0.063 0.000 0.823 393 S HN 0.189 8.499 8.310 -0.000 0.000 0.469 394 A N 0.297 122.999 122.820 -0.196 0.000 2.267 394 A HA 0.326 4.643 4.320 -0.005 0.000 0.213 394 A C 1.705 179.153 177.584 -0.228 0.000 1.192 394 A CA 0.003 51.915 52.037 -0.208 0.000 0.851 394 A CB -0.240 18.610 19.000 -0.250 0.000 0.881 394 A HN 0.304 8.454 8.150 -0.000 0.000 0.494 395 L N 0.468 121.530 121.223 -0.269 0.000 2.021 395 L HA -0.123 4.214 4.340 -0.005 0.000 0.215 395 L C -0.585 176.178 176.870 -0.177 0.000 1.074 395 L CA 2.379 57.046 54.840 -0.288 0.000 0.760 395 L CB -1.517 40.321 42.059 -0.369 0.000 0.889 395 L HN 0.193 8.423 8.230 -0.000 0.000 0.433 396 P HA -0.112 4.308 4.420 -0.000 0.000 0.222 396 P C 1.083 178.328 177.300 -0.092 0.000 1.147 396 P CA 0.984 64.025 63.100 -0.098 0.000 0.790 396 P CB 0.068 31.717 31.700 -0.085 0.000 0.780 397 R N -1.595 118.845 120.500 -0.101 0.000 2.310 397 R HA 0.247 4.584 4.340 -0.005 0.000 0.202 397 R C 0.846 177.137 176.300 -0.015 0.000 0.933 397 R CA 0.125 56.187 56.100 -0.064 0.000 1.054 397 R CB -0.751 29.512 30.300 -0.060 0.000 0.985 397 R HN 0.359 8.629 8.270 -0.000 0.000 0.489 398 M N -0.678 118.881 119.600 -0.068 0.000 2.318 398 M HA 0.307 4.784 4.480 -0.005 0.000 0.347 398 M C 1.243 177.591 176.300 0.081 0.000 1.175 398 M CA -0.382 54.888 55.300 -0.051 0.000 1.075 398 M CB 1.806 34.328 32.600 -0.130 0.000 1.614 398 M HN -0.051 8.239 8.290 -0.000 0.000 0.456 399 A N 2.853 125.776 122.820 0.172 0.000 2.024 399 A HA 0.079 4.396 4.320 -0.005 0.000 0.220 399 A C 0.441 178.272 177.584 0.412 0.000 1.164 399 A CA 1.456 53.702 52.037 0.347 0.000 0.643 399 A CB 0.025 19.265 19.000 0.399 0.000 0.806 399 A HN 0.637 8.787 8.150 -0.000 0.000 0.451 400 L N -2.021 119.364 121.223 0.270 0.000 2.643 400 L HA 0.457 4.794 4.340 -0.005 0.000 0.257 400 L C -2.938 173.990 176.870 0.097 0.000 0.922 400 L CA -1.494 53.494 54.840 0.247 0.000 0.909 400 L CB 1.944 44.202 42.059 0.332 0.000 1.424 400 L HN -0.161 8.069 8.230 -0.000 0.000 0.422 401 P HA 0.305 4.725 4.420 -0.000 0.000 0.272 401 P C -2.661 174.642 177.300 0.004 0.000 1.230 401 P CA -0.917 62.141 63.100 -0.069 0.000 0.788 401 P CB -0.057 31.613 31.700 -0.049 0.000 0.949 402 P HA 0.032 4.452 4.420 -0.000 0.000 0.271 402 P C -0.020 177.403 177.300 0.204 0.000 1.216 402 P CA 0.034 62.971 63.100 -0.272 0.000 0.776 402 P CB 0.697 32.140 31.700 -0.429 0.000 0.881 403 C N 1.524 120.988 119.300 0.274 0.000 2.576 403 C HA -0.007 4.450 4.460 -0.005 0.000 0.281 403 C C 1.319 176.503 174.990 0.324 0.000 1.292 403 C CA 0.657 59.867 59.018 0.319 0.000 1.697 403 C CB -1.868 26.091 27.740 0.365 0.000 2.109 403 C HN 0.705 8.935 8.230 -0.000 0.000 0.497 404 H N 1.485 120.839 119.070 0.474 0.000 2.820 404 H HA 0.479 5.032 4.556 -0.005 0.000 0.278 404 H C 0.336 175.958 175.328 0.490 0.000 1.142 404 H CA -0.509 55.742 56.048 0.339 0.000 1.346 404 H CB -0.056 29.889 29.762 0.305 0.000 1.438 404 H HN 0.400 8.680 8.280 -0.000 0.000 0.473 405 L N 1.085 122.531 121.223 0.372 0.000 2.664 405 L HA 0.438 4.775 4.340 -0.005 0.000 0.233 405 L C -0.383 176.650 176.870 0.272 0.000 1.113 405 L CA -0.091 54.982 54.840 0.389 0.000 0.896 405 L CB 0.385 42.707 42.059 0.437 0.000 1.163 405 L HN 0.487 8.717 8.230 -0.000 0.000 0.497 406 L N 0.432 121.723 121.223 0.113 0.000 2.518 406 L HA 0.950 5.287 4.340 -0.005 0.000 0.257 406 L C -1.630 175.031 176.870 -0.348 0.000 0.980 406 L CA -0.304 54.462 54.840 -0.124 0.000 0.837 406 L CB 2.202 44.220 42.059 -0.068 0.000 1.410 406 L HN 0.054 8.284 8.230 -0.000 0.000 0.410 407 A N 3.286 125.704 122.820 -0.669 0.000 2.513 407 A HA 0.667 4.984 4.320 -0.005 0.000 0.296 407 A C -1.720 175.484 177.584 -0.634 0.000 1.052 407 A CA -0.446 51.160 52.037 -0.718 0.000 0.714 407 A CB 1.663 20.112 19.000 -0.919 0.000 1.279 407 A HN 0.694 8.844 8.150 -0.000 0.000 0.397 408 Q N 1.350 120.866 119.800 -0.473 0.000 2.345 408 Q HA 0.772 5.109 4.340 -0.005 0.000 0.268 408 Q C -1.769 173.991 176.000 -0.399 0.000 1.054 408 Q CA -0.552 55.069 55.803 -0.302 0.000 0.835 408 Q CB 1.408 30.064 28.738 -0.136 0.000 1.339 408 Q HN 0.626 8.896 8.270 -0.000 0.000 0.447 409 F N 1.868 121.868 119.950 0.083 0.000 2.507 409 F HA 0.521 5.045 4.527 -0.005 0.000 0.327 409 F C -0.748 175.154 175.800 0.171 0.000 1.068 409 F CA -0.645 57.426 58.000 0.118 0.000 0.965 409 F CB 1.432 40.492 39.000 0.099 0.000 1.192 409 F HN 0.508 8.808 8.300 -0.000 0.000 0.476 410 Y N 1.181 121.610 120.300 0.215 0.000 2.504 410 Y HA 0.718 5.265 4.550 -0.005 0.000 0.344 410 Y C -1.903 174.061 175.900 0.108 0.000 1.023 410 Y CA -1.012 57.159 58.100 0.117 0.000 1.020 410 Y CB 1.676 40.174 38.460 0.063 0.000 1.282 410 Y HN 0.346 8.626 8.280 -0.000 0.000 0.454 411 V N 4.183 123.832 119.914 -0.441 0.000 2.604 411 V HA 0.714 4.831 4.120 -0.005 0.000 0.305 411 V C -0.890 174.925 176.094 -0.465 0.000 1.043 411 V CA -0.622 61.502 62.300 -0.293 0.000 0.888 411 V CB 1.700 33.421 31.823 -0.169 0.000 0.995 411 V HN 0.719 8.909 8.190 -0.000 0.000 0.429 412 S N 3.779 119.382 115.700 -0.162 0.000 2.603 412 S HA 0.430 4.897 4.470 -0.005 0.000 0.274 412 S C -0.100 174.496 174.600 -0.006 0.000 1.168 412 S CA -0.569 57.585 58.200 -0.077 0.000 0.963 412 S CB 0.684 63.939 63.200 0.092 0.000 1.078 412 S HN 0.866 9.176 8.310 -0.000 0.000 0.477 413 N N 2.809 121.500 118.700 -0.015 0.000 2.727 413 N HA -0.193 4.544 4.740 -0.005 0.000 0.249 413 N C 0.783 176.292 175.510 -0.000 0.000 1.048 413 N CA 1.414 54.464 53.050 -0.000 0.000 0.714 413 N CB -1.413 37.085 38.487 0.018 0.000 0.959 413 N HN 1.609 9.989 8.380 -0.000 0.000 0.544 414 G N -0.547 108.245 108.800 -0.015 0.000 2.153 414 G HA2 -0.322 3.635 3.960 -0.005 0.000 0.252 414 G HA3 -0.322 3.635 3.960 -0.005 0.000 0.252 414 G C -0.196 174.706 174.900 0.002 0.000 0.994 414 G CA 0.826 45.919 45.100 -0.012 0.000 0.698 414 G HN 0.614 8.904 8.290 -0.000 0.000 0.521 415 E N -0.682 119.528 120.200 0.016 0.000 2.171 415 E HA 0.552 4.899 4.350 -0.005 0.000 0.271 415 E C -0.543 176.098 176.600 0.068 0.000 0.916 415 E CA -1.024 55.404 56.400 0.045 0.000 0.774 415 E CB 1.974 31.712 29.700 0.064 0.000 1.128 415 E HN 0.146 8.506 8.360 -0.000 0.000 0.403 416 L N 2.507 123.779 121.223 0.083 0.000 2.265 416 L HA 0.323 4.660 4.340 -0.005 0.000 0.288 416 L C -0.775 176.214 176.870 0.199 0.000 1.058 416 L CA 0.199 55.119 54.840 0.133 0.000 0.809 416 L CB 1.208 43.327 42.059 0.100 0.000 1.179 416 L HN 0.317 8.547 8.230 -0.000 0.000 0.429 417 S N 3.774 119.633 115.700 0.265 0.000 2.578 417 S HA 0.664 5.131 4.470 -0.005 0.000 0.301 417 S C -1.160 173.581 174.600 0.235 0.000 1.091 417 S CA -0.570 57.770 58.200 0.234 0.000 1.032 417 S CB 1.514 64.849 63.200 0.225 0.000 1.064 417 S HN 0.828 9.138 8.310 -0.000 0.000 0.508 418 C N 3.733 123.100 119.300 0.112 0.000 2.626 418 C HA 0.836 5.293 4.460 -0.005 0.000 0.310 418 C C -0.782 174.146 174.990 -0.102 0.000 1.191 418 C CA -0.732 58.239 59.018 -0.080 0.000 1.517 418 C CB 0.829 28.527 27.740 -0.069 0.000 2.102 418 C HN 0.950 9.180 8.230 -0.000 0.000 0.479 419 M N 6.096 125.574 119.600 -0.203 0.000 2.190 419 M HA 0.691 5.168 4.480 -0.005 0.000 0.312 419 M C -1.449 174.713 176.300 -0.229 0.000 0.990 419 M CA -0.376 54.831 55.300 -0.156 0.000 0.927 419 M CB 1.385 33.909 32.600 -0.127 0.000 1.571 419 M HN 0.719 9.009 8.290 -0.000 0.000 0.427 420 L N 5.709 126.794 121.223 -0.229 0.000 2.309 420 L HA 0.596 4.933 4.340 -0.005 0.000 0.282 420 L C -2.113 174.671 176.870 -0.143 0.000 1.036 420 L CA -0.253 54.364 54.840 -0.372 0.000 0.806 420 L CB 1.354 42.955 42.059 -0.763 0.000 1.220 420 L HN 0.765 8.995 8.230 -0.000 0.000 0.429 421 Y N 4.023 124.200 120.300 -0.205 0.000 2.328 421 Y HA 0.495 5.042 4.550 -0.005 0.000 0.333 421 Y C -0.639 175.246 175.900 -0.025 0.000 0.958 421 Y CA -0.278 57.763 58.100 -0.098 0.000 1.167 421 Y CB 1.095 39.481 38.460 -0.122 0.000 1.151 421 Y HN 0.747 9.027 8.280 -0.000 0.000 0.470 422 Q N 6.479 125.944 119.800 -0.559 0.000 2.333 422 Q HA 0.297 4.634 4.340 -0.005 0.000 0.268 422 Q C 0.741 176.472 176.000 -0.449 0.000 1.007 422 Q CA -0.717 54.942 55.803 -0.240 0.000 0.810 422 Q CB 1.146 29.920 28.738 0.060 0.000 1.264 422 Q HN 0.977 9.247 8.270 -0.000 0.000 0.452 423 R N 1.343 121.761 120.500 -0.136 0.000 2.090 423 R HA 0.081 4.418 4.340 -0.005 0.000 0.228 423 R C 0.449 176.784 176.300 0.059 0.000 1.110 423 R CA 0.750 56.845 56.100 -0.008 0.000 0.973 423 R CB 0.167 30.515 30.300 0.080 0.000 0.869 423 R HN 0.298 8.568 8.270 -0.000 0.000 0.440 424 S N -0.127 115.636 115.700 0.105 0.000 2.594 424 S HA 0.509 4.976 4.470 -0.005 0.000 0.296 424 S C -1.324 173.343 174.600 0.111 0.000 1.124 424 S CA -0.893 57.416 58.200 0.181 0.000 1.011 424 S CB 1.562 64.920 63.200 0.264 0.000 1.016 424 S HN 0.377 8.687 8.310 -0.000 0.000 0.485 425 C N 3.821 123.089 119.300 -0.053 0.000 2.381 425 C HA 0.512 4.969 4.460 -0.005 0.000 0.328 425 C C -0.463 174.215 174.990 -0.521 0.000 1.190 425 C CA -1.167 57.753 59.018 -0.163 0.000 1.369 425 C CB 0.550 28.213 27.740 -0.129 0.000 2.029 425 C HN 0.898 9.128 8.230 -0.000 0.000 0.448 426 D N 3.820 124.061 120.400 -0.264 0.000 2.402 426 D HA 0.165 4.802 4.640 -0.005 0.000 0.235 426 D C 1.220 177.504 176.300 -0.027 0.000 1.226 426 D CA -0.319 53.555 54.000 -0.210 0.000 0.918 426 D CB 0.583 41.480 40.800 0.162 0.000 1.043 426 D HN 0.371 8.741 8.370 -0.000 0.000 0.506 427 M N 2.660 122.209 119.600 -0.084 0.000 2.144 427 M HA -0.056 4.421 4.480 -0.005 0.000 0.260 427 M C 2.006 178.449 176.300 0.238 0.000 1.067 427 M CA 1.212 56.558 55.300 0.075 0.000 1.095 427 M CB -1.377 31.187 32.600 -0.060 0.000 1.365 427 M HN 0.503 8.793 8.290 -0.000 0.000 0.406 428 G N -0.171 108.757 108.800 0.214 0.000 2.453 428 G HA2 -0.120 3.837 3.960 -0.005 0.000 0.215 428 G HA3 -0.120 3.837 3.960 -0.005 0.000 0.215 428 G C 1.600 176.604 174.900 0.173 0.000 1.201 428 G CA 0.751 45.979 45.100 0.214 0.000 0.784 428 G HN 0.459 8.749 8.290 -0.000 0.000 0.545 429 L N -0.698 120.632 121.223 0.179 0.000 2.730 429 L HA 0.311 4.648 4.340 -0.005 0.000 0.236 429 L C 2.878 179.836 176.870 0.146 0.000 1.061 429 L CA 0.555 55.475 54.840 0.133 0.000 0.898 429 L CB 0.146 42.255 42.059 0.083 0.000 1.270 429 L HN 0.276 8.506 8.230 -0.000 0.000 0.500 430 G N 0.182 109.074 108.800 0.154 0.000 2.414 430 G HA2 -0.152 3.805 3.960 -0.005 0.000 0.215 430 G HA3 -0.152 3.805 3.960 -0.005 0.000 0.215 430 G C 1.496 176.532 174.900 0.225 0.000 1.188 430 G CA 0.950 46.142 45.100 0.153 0.000 0.783 430 G HN 0.063 8.353 8.290 -0.000 0.000 0.537 431 V N 2.136 122.181 119.914 0.219 0.000 2.287 431 V HA -0.119 3.998 4.120 -0.005 0.000 0.248 431 V C 0.339 176.534 176.094 0.167 0.000 1.053 431 V CA 2.328 64.781 62.300 0.255 0.000 1.027 431 V CB -1.050 30.953 31.823 0.299 0.000 0.646 431 V HN 0.292 8.482 8.190 -0.000 0.000 0.447 432 P HA -0.171 4.249 4.420 -0.000 0.000 0.216 432 P C 1.704 179.014 177.300 0.017 0.000 1.150 432 P CA 1.434 64.487 63.100 -0.078 0.000 0.837 432 P CB -0.113 31.530 31.700 -0.096 0.000 0.786 433 F N 0.727 120.668 119.950 -0.014 0.000 2.075 433 F HA -0.209 4.315 4.527 -0.005 0.000 0.297 433 F C 1.965 177.750 175.800 -0.025 0.000 1.113 433 F CA 1.613 59.608 58.000 -0.008 0.000 1.218 433 F CB -0.648 38.366 39.000 0.022 0.000 0.984 433 F HN -0.145 8.155 8.300 -0.000 0.000 0.472 434 N N 0.815 119.662 118.700 0.246 0.000 2.104 434 N HA -0.207 4.530 4.740 -0.005 0.000 0.190 434 N C 2.073 177.567 175.510 -0.026 0.000 1.024 434 N CA 1.942 55.068 53.050 0.127 0.000 0.853 434 N CB -0.592 37.977 38.487 0.138 0.000 1.008 434 N HN 0.367 8.747 8.380 -0.000 0.000 0.424 435 I N 1.331 121.839 120.570 -0.103 0.000 2.208 435 I HA -0.247 3.920 4.170 -0.005 0.000 0.245 435 I C 2.347 178.326 176.117 -0.230 0.000 1.097 435 I CA 1.114 62.271 61.300 -0.238 0.000 1.363 435 I CB -0.237 37.505 38.000 -0.430 0.000 1.051 435 I HN 0.079 8.289 8.210 -0.000 0.000 0.413 436 A N -0.272 122.414 122.820 -0.223 0.000 1.930 436 A HA -0.147 4.170 4.320 -0.005 0.000 0.217 436 A C 2.462 179.962 177.584 -0.140 0.000 1.175 436 A CA 1.864 53.799 52.037 -0.170 0.000 0.627 436 A CB -0.565 18.343 19.000 -0.153 0.000 0.815 436 A HN 0.375 8.525 8.150 -0.000 0.000 0.443 437 S N -1.249 114.324 115.700 -0.212 0.000 2.356 437 S HA -0.142 4.325 4.470 -0.005 0.000 0.223 437 S C 1.773 176.260 174.600 -0.189 0.000 1.032 437 S CA 1.536 59.598 58.200 -0.230 0.000 1.005 437 S CB -0.555 62.540 63.200 -0.176 0.000 0.867 437 S HN 0.688 8.998 8.310 -0.000 0.000 0.449 438 Y N 1.442 121.687 120.300 -0.090 0.000 2.457 438 Y HA 0.113 4.659 4.550 -0.005 0.000 0.292 438 Y C 2.498 178.395 175.900 -0.005 0.000 1.125 438 Y CA 0.425 58.506 58.100 -0.032 0.000 1.254 438 Y CB -0.421 37.977 38.460 -0.102 0.000 1.012 438 Y HN 0.266 8.546 8.280 -0.000 0.000 0.555 439 A N -0.107 122.746 122.820 0.055 0.000 1.873 439 A HA -0.181 4.136 4.320 -0.005 0.000 0.215 439 A C 2.107 179.729 177.584 0.062 0.000 1.186 439 A CA 1.579 53.636 52.037 0.033 0.000 0.616 439 A CB -0.974 17.987 19.000 -0.065 0.000 0.823 439 A HN 0.416 8.566 8.150 -0.000 0.000 0.442 440 L N -0.329 120.931 121.223 0.062 0.000 2.017 440 L HA -0.106 4.231 4.340 -0.005 0.000 0.208 440 L C 2.297 179.207 176.870 0.067 0.000 1.073 440 L CA 2.054 56.955 54.840 0.101 0.000 0.745 440 L CB -0.591 41.508 42.059 0.067 0.000 0.894 440 L HN 0.455 8.685 8.230 -0.000 0.000 0.432 441 L N -1.240 119.993 121.223 0.018 0.000 2.042 441 L HA -0.258 4.079 4.340 -0.005 0.000 0.210 441 L C 2.242 179.186 176.870 0.124 0.000 1.076 441 L CA 2.142 57.007 54.840 0.042 0.000 0.749 441 L CB -0.531 41.505 42.059 -0.039 0.000 0.893 441 L HN 0.369 8.599 8.230 -0.000 0.000 0.432 442 T N 0.256 114.915 114.554 0.176 0.000 2.746 442 T HA -0.175 4.172 4.350 -0.005 0.000 0.267 442 T C 1.846 176.620 174.700 0.123 0.000 1.039 442 T CA 1.838 64.080 62.100 0.237 0.000 1.142 442 T CB -0.295 68.710 68.868 0.229 0.000 0.866 442 T HN 0.314 8.554 8.240 -0.000 0.000 0.444 443 I N 0.647 121.272 120.570 0.093 0.000 2.226 443 I HA -0.127 4.040 4.170 -0.005 0.000 0.245 443 I C 2.252 178.354 176.117 -0.025 0.000 1.100 443 I CA 1.182 62.519 61.300 0.061 0.000 1.374 443 I CB -0.385 37.694 38.000 0.131 0.000 1.057 443 I HN 0.194 8.404 8.210 -0.000 0.000 0.413 444 L N 0.135 121.339 121.223 -0.031 0.000 2.093 444 L HA -0.192 4.145 4.340 -0.005 0.000 0.208 444 L C 2.452 179.234 176.870 -0.147 0.000 1.085 444 L CA 0.919 55.667 54.840 -0.153 0.000 0.755 444 L CB -0.360 41.625 42.059 -0.123 0.000 0.904 444 L HN 0.236 8.466 8.230 -0.000 0.000 0.435 445 I N 0.017 120.530 120.570 -0.095 0.000 2.439 445 I HA -0.175 3.992 4.170 -0.005 0.000 0.251 445 I C 2.769 178.794 176.117 -0.153 0.000 1.139 445 I CA 1.290 62.493 61.300 -0.160 0.000 1.438 445 I CB -1.433 36.405 38.000 -0.270 0.000 1.085 445 I HN 0.153 8.363 8.210 -0.000 0.000 0.427 446 A N 1.109 123.871 122.820 -0.097 0.000 1.898 446 A HA -0.192 4.125 4.320 -0.005 0.000 0.216 446 A C 2.326 179.848 177.584 -0.103 0.000 1.181 446 A CA 1.356 53.346 52.037 -0.078 0.000 0.620 446 A CB -0.458 18.525 19.000 -0.029 0.000 0.819 446 A HN 0.320 8.470 8.150 -0.000 0.000 0.442 447 K N -0.352 119.962 120.400 -0.143 0.000 2.209 447 K HA -0.002 4.315 4.320 -0.005 0.000 0.204 447 K C 1.802 178.323 176.600 -0.132 0.000 1.048 447 K CA 0.976 57.157 56.287 -0.176 0.000 0.940 447 K CB -0.196 32.110 32.500 -0.323 0.000 0.729 447 K HN 0.446 8.696 8.250 -0.000 0.000 0.451 448 A N 0.741 123.487 122.820 -0.123 0.000 2.238 448 A HA -0.012 4.305 4.320 -0.005 0.000 0.210 448 A C 1.563 179.095 177.584 -0.086 0.000 1.179 448 A CA 0.946 52.930 52.037 -0.087 0.000 0.827 448 A CB -0.054 18.898 19.000 -0.079 0.000 0.856 448 A HN 0.334 8.484 8.150 -0.000 0.000 0.488 449 T N -5.830 108.665 114.554 -0.097 0.000 3.170 449 T HA 0.435 4.782 4.350 -0.005 0.000 0.288 449 T C 1.126 175.783 174.700 -0.072 0.000 0.992 449 T CA 0.904 62.950 62.100 -0.090 0.000 0.909 449 T CB 0.110 68.907 68.868 -0.118 0.000 1.133 449 T HN 1.539 9.779 8.240 -0.000 0.000 0.530 450 G N 1.430 110.191 108.800 -0.067 0.000 2.160 450 G HA2 -0.211 3.746 3.960 -0.005 0.000 0.251 450 G HA3 -0.211 3.746 3.960 -0.005 0.000 0.251 450 G C -0.129 174.743 174.900 -0.045 0.000 1.008 450 G CA 0.591 45.659 45.100 -0.053 0.000 0.724 450 G HN 0.654 8.944 8.290 -0.000 0.000 0.514 451 L N -1.599 119.595 121.223 -0.048 0.000 2.341 451 L HA 0.826 5.163 4.340 -0.005 0.000 0.267 451 L C 0.943 177.800 176.870 -0.021 0.000 1.022 451 L CA -1.465 53.355 54.840 -0.032 0.000 0.844 451 L CB 1.088 43.127 42.059 -0.032 0.000 1.436 451 L HN 0.055 8.285 8.230 -0.000 0.000 0.483 452 R N -0.027 120.472 120.500 -0.001 0.000 2.740 452 R HA 0.442 4.779 4.340 -0.005 0.000 0.282 452 R C -2.612 173.708 176.300 0.033 0.000 0.969 452 R CA -1.946 54.162 56.100 0.013 0.000 0.918 452 R CB 1.495 31.807 30.300 0.020 0.000 1.175 452 R HN 0.221 8.491 8.270 -0.000 0.000 0.464 453 P HA -0.002 4.418 4.420 -0.000 0.000 0.265 453 P C -0.205 177.140 177.300 0.075 0.000 1.193 453 P CA 0.264 63.404 63.100 0.067 0.000 0.765 453 P CB 0.963 32.703 31.700 0.067 0.000 0.823 454 G N 2.587 111.444 108.800 0.095 0.000 2.583 454 G HA2 0.211 4.168 3.960 -0.005 0.000 0.214 454 G HA3 0.211 4.168 3.960 -0.005 0.000 0.214 454 G C -0.518 174.439 174.900 0.095 0.000 2.072 454 G CA -0.055 45.102 45.100 0.095 0.000 0.745 454 G HN 0.478 8.768 8.290 -0.000 0.000 0.762 455 E N -0.627 119.636 120.200 0.105 0.000 2.299 455 E HA 0.571 4.918 4.350 -0.005 0.000 0.265 455 E C -1.489 175.175 176.600 0.106 0.000 0.911 455 E CA -0.668 55.789 56.400 0.094 0.000 0.789 455 E CB 2.911 32.647 29.700 0.060 0.000 1.246 455 E HN 0.120 8.480 8.360 -0.000 0.000 0.427 456 L N 2.605 123.904 121.223 0.128 0.000 2.333 456 L HA 0.501 4.838 4.340 -0.005 0.000 0.280 456 L C -1.468 175.485 176.870 0.138 0.000 1.004 456 L CA -0.802 54.121 54.840 0.139 0.000 0.820 456 L CB 1.498 43.665 42.059 0.179 0.000 1.247 456 L HN 0.352 8.582 8.230 -0.000 0.000 0.416 457 V N 4.499 124.453 119.914 0.066 0.000 2.417 457 V HA 0.358 4.475 4.120 -0.005 0.000 0.291 457 V C -0.425 175.718 176.094 0.083 0.000 1.024 457 V CA -0.601 61.724 62.300 0.042 0.000 0.861 457 V CB 1.552 33.358 31.823 -0.029 0.000 0.985 457 V HN 0.710 8.900 8.190 -0.000 0.000 0.436 458 H N 2.752 121.824 119.070 0.004 0.000 2.551 458 H HA 0.485 5.038 4.556 -0.005 0.000 0.321 458 H C -0.645 174.635 175.328 -0.079 0.000 1.028 458 H CA -0.465 55.569 56.048 -0.024 0.000 1.215 458 H CB 1.161 30.983 29.762 0.101 0.000 1.414 458 H HN 0.671 8.951 8.280 -0.000 0.000 0.480 459 T N 6.802 121.392 114.554 0.060 0.000 2.767 459 T HA 0.309 4.656 4.350 -0.005 0.000 0.284 459 T C -0.117 174.379 174.700 -0.340 0.000 0.973 459 T CA -0.654 61.364 62.100 -0.136 0.000 0.996 459 T CB 0.618 69.463 68.868 -0.038 0.000 0.927 459 T HN 0.405 8.646 8.240 -0.000 0.000 0.456 460 L N 2.345 123.323 121.223 -0.408 0.000 2.334 460 L HA 0.643 4.980 4.340 -0.005 0.000 0.276 460 L C 1.198 177.799 176.870 -0.448 0.000 1.014 460 L CA -0.844 53.730 54.840 -0.444 0.000 0.815 460 L CB 1.642 43.470 42.059 -0.384 0.000 1.268 460 L HN 0.798 9.028 8.230 -0.000 0.000 0.428 461 G N 0.620 109.168 108.800 -0.420 0.000 2.756 461 G HA2 -0.055 3.902 3.960 -0.005 0.000 0.203 461 G HA3 -0.055 3.902 3.960 -0.005 0.000 0.203 461 G C -0.171 174.681 174.900 -0.080 0.000 2.015 461 G CA 0.019 44.911 45.100 -0.347 0.000 0.835 461 G HN 0.594 8.884 8.290 -0.000 0.000 0.648 462 D N 1.824 122.366 120.400 0.236 0.000 2.374 462 D HA 0.459 5.096 4.640 -0.005 0.000 0.240 462 D C -0.167 176.231 176.300 0.164 0.000 1.229 462 D CA -0.216 53.973 54.000 0.316 0.000 0.895 462 D CB 0.604 41.581 40.800 0.295 0.000 1.046 462 D HN 0.278 8.648 8.370 -0.000 0.000 0.498 463 A N 5.669 128.525 122.820 0.060 0.000 2.249 463 A HA 0.493 4.810 4.320 -0.005 0.000 0.314 463 A C -0.270 177.282 177.584 -0.053 0.000 1.290 463 A CA -0.671 51.310 52.037 -0.093 0.000 0.893 463 A CB 0.492 19.415 19.000 -0.128 0.000 1.165 463 A HN 0.731 8.881 8.150 -0.000 0.000 0.530 464 H N -0.142 118.870 119.070 -0.096 0.000 2.894 464 H HA 0.765 5.318 4.556 -0.005 0.000 0.368 464 H C -1.758 173.461 175.328 -0.182 0.000 1.181 464 H CA -1.264 54.690 56.048 -0.157 0.000 1.146 464 H CB 1.422 31.043 29.762 -0.235 0.000 1.839 464 H HN 0.266 8.546 8.280 -0.000 0.000 0.557 465 V N 2.398 122.281 119.914 -0.052 0.000 2.444 465 V HA 0.136 4.253 4.120 -0.005 0.000 0.294 465 V C -0.738 175.316 176.094 -0.068 0.000 1.022 465 V CA -0.734 61.548 62.300 -0.030 0.000 0.850 465 V CB 0.880 32.707 31.823 0.007 0.000 0.992 465 V HN 0.638 8.828 8.190 -0.000 0.000 0.426 466 Y N 2.529 122.860 120.300 0.052 0.000 2.597 466 Y HA -0.043 4.504 4.550 -0.005 0.000 0.336 466 Y C 2.001 177.836 175.900 -0.108 0.000 1.216 466 Y CA 0.661 58.683 58.100 -0.130 0.000 1.463 466 Y CB 0.879 39.054 38.460 -0.476 0.000 1.303 466 Y HN 0.723 9.003 8.280 -0.000 0.000 0.576 467 S N 1.337 117.070 115.700 0.054 0.000 2.400 467 S HA -0.202 4.265 4.470 -0.005 0.000 0.232 467 S C 1.292 175.925 174.600 0.055 0.000 1.025 467 S CA 1.281 59.502 58.200 0.036 0.000 0.993 467 S CB -0.190 63.018 63.200 0.013 0.000 0.808 467 S HN 0.678 8.988 8.310 -0.000 0.000 0.478 468 N N 0.809 119.517 118.700 0.014 0.000 2.515 468 N HA 0.019 4.756 4.740 -0.005 0.000 0.191 468 N C 0.521 176.140 175.510 0.182 0.000 1.182 468 N CA 0.508 53.577 53.050 0.032 0.000 0.879 468 N CB -0.155 38.306 38.487 -0.044 0.000 0.984 468 N HN 0.651 9.031 8.380 -0.000 0.000 0.453 469 H N -1.964 117.173 119.070 0.113 0.000 3.058 469 H HA 0.209 4.762 4.556 -0.005 0.000 0.266 469 H C 1.490 176.860 175.328 0.069 0.000 1.135 469 H CA -0.226 55.882 56.048 0.100 0.000 1.174 469 H CB 1.014 30.866 29.762 0.150 0.000 1.581 469 H HN -0.075 8.205 8.280 -0.000 0.000 0.553 470 V N 1.154 121.169 119.914 0.168 0.000 2.287 470 V HA -0.249 3.868 4.120 -0.005 0.000 0.248 470 V C 2.313 178.452 176.094 0.074 0.000 1.053 470 V CA 1.818 64.176 62.300 0.096 0.000 1.027 470 V CB -0.174 31.688 31.823 0.064 0.000 0.646 470 V HN 0.459 8.649 8.190 -0.000 0.000 0.447 471 E N -0.169 120.076 120.200 0.075 0.000 2.028 471 E HA -0.135 4.212 4.350 -0.005 0.000 0.191 471 E C 0.208 176.836 176.600 0.047 0.000 0.988 471 E CA 1.930 58.362 56.400 0.053 0.000 0.799 471 E CB -1.442 28.288 29.700 0.050 0.000 0.755 471 E HN 0.531 8.891 8.360 -0.000 0.000 0.447 472 P HA -0.062 4.358 4.420 -0.000 0.000 0.219 472 P C 1.508 178.825 177.300 0.028 0.000 1.150 472 P CA 0.934 64.054 63.100 0.034 0.000 0.814 472 P CB -0.073 31.640 31.700 0.023 0.000 0.787 473 C N -0.206 119.121 119.300 0.045 0.000 2.440 473 C HA 0.003 4.460 4.460 -0.005 0.000 0.278 473 C C 2.713 177.714 174.990 0.018 0.000 1.295 473 C CA 0.648 59.689 59.018 0.038 0.000 1.738 473 C CB -1.965 25.806 27.740 0.052 0.000 1.987 473 C HN 0.300 8.530 8.230 -0.000 0.000 0.492 474 N N 0.721 119.432 118.700 0.018 0.000 2.223 474 N HA -0.103 4.634 4.740 -0.005 0.000 0.185 474 N C 1.735 177.244 175.510 -0.002 0.000 1.016 474 N CA 1.078 54.131 53.050 0.005 0.000 0.863 474 N CB -0.267 38.226 38.487 0.010 0.000 0.983 474 N HN 0.564 8.944 8.380 -0.000 0.000 0.429 475 E N 0.969 121.171 120.200 0.003 0.000 2.047 475 E HA -0.172 4.175 4.350 -0.005 0.000 0.191 475 E C 1.841 178.427 176.600 -0.023 0.000 0.987 475 E CA 0.635 57.032 56.400 -0.005 0.000 0.799 475 E CB -0.368 29.334 29.700 0.004 0.000 0.752 475 E HN 0.489 8.849 8.360 -0.000 0.000 0.449 476 Q N 0.498 120.290 119.800 -0.013 0.000 2.181 476 Q HA -0.110 4.227 4.340 -0.005 0.000 0.205 476 Q C 2.209 178.181 176.000 -0.045 0.000 0.980 476 Q CA 0.803 56.590 55.803 -0.026 0.000 0.862 476 Q CB -0.081 28.674 28.738 0.028 0.000 0.905 476 Q HN 0.234 8.504 8.270 -0.000 0.000 0.429 477 L N 0.346 121.553 121.223 -0.027 0.000 2.362 477 L HA -0.150 4.187 4.340 -0.005 0.000 0.219 477 L C 2.014 178.854 176.870 -0.051 0.000 1.134 477 L CA 0.917 55.737 54.840 -0.034 0.000 0.807 477 L CB -0.177 41.864 42.059 -0.029 0.000 0.927 477 L HN 0.146 8.376 8.230 -0.000 0.000 0.447 478 K N 0.125 120.488 120.400 -0.062 0.000 2.296 478 K HA 0.014 4.331 4.320 -0.005 0.000 0.200 478 K C 0.469 177.005 176.600 -0.107 0.000 1.048 478 K CA 0.304 56.553 56.287 -0.063 0.000 0.966 478 K CB 0.066 32.539 32.500 -0.046 0.000 0.754 478 K HN 0.314 8.564 8.250 -0.000 0.000 0.466 479 R N 1.463 121.846 120.500 -0.195 0.000 2.390 479 R HA 0.182 4.519 4.340 -0.005 0.000 0.291 479 R C -0.466 175.677 176.300 -0.261 0.000 1.070 479 R CA -0.373 55.495 56.100 -0.386 0.000 1.014 479 R CB 1.178 31.002 30.300 -0.793 0.000 1.007 479 R HN -0.165 8.105 8.270 -0.000 0.000 0.466 480 V N 5.886 125.701 119.914 -0.164 0.000 2.408 480 V HA 0.154 4.271 4.120 -0.005 0.000 0.267 480 V C -1.923 174.201 176.094 0.050 0.000 1.047 480 V CA -2.044 60.243 62.300 -0.022 0.000 0.937 480 V CB 0.987 32.837 31.823 0.046 0.000 0.999 480 V HN 0.640 8.830 8.190 -0.000 0.000 0.472 481 P HA 0.127 4.547 4.420 -0.000 0.000 0.264 481 P C -0.103 177.235 177.300 0.062 0.000 1.183 481 P CA 0.291 63.427 63.100 0.060 0.000 0.763 481 P CB 0.547 32.238 31.700 -0.016 0.000 0.807 482 R N 1.730 122.291 120.500 0.102 0.000 2.606 482 R HA 0.711 5.048 4.340 -0.005 0.000 0.249 482 R C 0.126 176.368 176.300 -0.097 0.000 1.127 482 R CA -1.034 55.084 56.100 0.029 0.000 1.133 482 R CB 0.639 30.972 30.300 0.054 0.000 1.243 482 R HN 0.454 8.724 8.270 -0.000 0.000 0.558 483 A N 0.951 123.725 122.820 -0.077 0.000 2.445 483 A HA 0.249 4.566 4.320 -0.005 0.000 0.242 483 A C -0.553 177.014 177.584 -0.028 0.000 1.075 483 A CA -0.077 51.890 52.037 -0.117 0.000 0.777 483 A CB -0.025 18.961 19.000 -0.023 0.000 1.013 483 A HN 0.382 8.532 8.150 -0.000 0.000 0.493 484 F N 2.292 122.209 119.950 -0.054 0.000 2.440 484 F HA 0.350 4.875 4.527 -0.003 0.000 0.323 484 F C -1.108 174.548 175.800 -0.240 0.000 1.192 484 F CA -1.671 56.256 58.000 -0.121 0.000 1.252 484 F CB 0.139 39.024 39.000 -0.192 0.000 1.214 484 F HN 0.418 8.718 8.300 -0.000 0.000 0.578 485 P HA 0.267 4.687 4.420 -0.000 0.000 0.317 485 P C -1.609 175.407 177.300 -0.473 0.000 1.307 485 P CA -0.076 62.960 63.100 -0.106 0.000 0.749 485 P CB 1.124 32.765 31.700 -0.098 0.000 1.377 486 Y N -2.187 118.045 120.300 -0.112 0.000 2.605 486 Y HA 0.579 5.126 4.550 -0.006 0.000 0.343 486 Y C -0.194 175.578 175.900 -0.214 0.000 1.036 486 Y CA -1.016 57.014 58.100 -0.117 0.000 1.065 486 Y CB 1.414 39.853 38.460 -0.034 0.000 1.288 486 Y HN 0.072 8.352 8.280 -0.000 0.000 0.481 487 L N 3.086 124.291 121.223 -0.031 0.000 2.356 487 L HA 0.857 5.194 4.340 -0.005 0.000 0.277 487 L C -1.106 175.749 176.870 -0.025 0.000 0.996 487 L CA -0.774 53.972 54.840 -0.157 0.000 0.822 487 L CB 1.432 43.347 42.059 -0.240 0.000 1.256 487 L HN 0.490 8.720 8.230 -0.000 0.000 0.413 488 V N 1.099 120.965 119.914 -0.080 0.000 2.914 488 V HA 0.645 4.762 4.120 -0.005 0.000 0.314 488 V C -0.883 175.168 176.094 -0.071 0.000 1.084 488 V CA -0.760 61.562 62.300 0.037 0.000 0.963 488 V CB 1.884 33.735 31.823 0.047 0.000 1.025 488 V HN 0.583 8.773 8.190 -0.000 0.000 0.432 489 F N 2.550 122.532 119.950 0.054 0.000 2.388 489 F HA 0.596 5.120 4.527 -0.005 0.000 0.358 489 F C 1.481 177.324 175.800 0.073 0.000 1.122 489 F CA -0.702 57.348 58.000 0.084 0.000 1.056 489 F CB 2.088 41.154 39.000 0.109 0.000 1.155 489 F HN 0.740 9.040 8.300 -0.000 0.000 0.461 490 R N 2.551 123.151 120.500 0.168 0.000 2.200 490 R HA 0.148 4.485 4.340 -0.005 0.000 0.208 490 R C 0.205 176.585 176.300 0.133 0.000 1.033 490 R CA 0.451 56.622 56.100 0.117 0.000 1.000 490 R CB 0.224 30.563 30.300 0.065 0.000 0.906 490 R HN 0.604 8.874 8.270 -0.000 0.000 0.462 491 R N 0.087 120.703 120.500 0.194 0.000 2.680 491 R HA 0.317 4.654 4.340 -0.005 0.000 0.269 491 R C -1.452 174.975 176.300 0.212 0.000 1.026 491 R CA -0.816 55.373 56.100 0.149 0.000 0.889 491 R CB 1.504 31.852 30.300 0.080 0.000 1.241 491 R HN -0.110 8.160 8.270 -0.000 0.000 0.463 492 E N 1.593 121.854 120.200 0.100 0.000 2.259 492 E HA 0.533 4.880 4.350 -0.005 0.000 0.257 492 E C -0.724 175.748 176.600 -0.212 0.000 0.998 492 E CA -1.069 55.367 56.400 0.060 0.000 0.866 492 E CB 1.531 31.268 29.700 0.061 0.000 1.220 492 E HN 0.444 8.804 8.360 -0.000 0.000 0.415 493 R N 0.076 120.309 120.500 -0.445 0.000 2.837 493 R HA 0.181 4.518 4.340 -0.005 0.000 0.271 493 R C 0.789 176.932 176.300 -0.261 0.000 0.993 493 R CA -0.458 55.347 56.100 -0.491 0.000 0.931 493 R CB 1.190 30.893 30.300 -0.995 0.000 1.206 493 R HN 0.599 8.869 8.270 -0.000 0.000 0.474 494 E N 0.617 120.681 120.200 -0.225 0.000 2.152 494 E HA 0.004 4.351 4.350 -0.005 0.000 0.192 494 E C -0.608 175.646 176.600 -0.576 0.000 0.983 494 E CA 1.030 57.197 56.400 -0.388 0.000 0.818 494 E CB 0.254 29.707 29.700 -0.411 0.000 0.758 494 E HN 0.328 8.688 8.360 -0.000 0.000 0.467 495 F N -0.145 119.792 119.950 -0.021 0.000 2.565 495 F HA 0.183 4.707 4.527 -0.005 0.000 0.313 495 F C 0.724 176.596 175.800 0.119 0.000 1.091 495 F CA -0.962 57.063 58.000 0.041 0.000 0.915 495 F CB 1.420 40.442 39.000 0.037 0.000 1.208 495 F HN -0.176 8.124 8.300 -0.000 0.000 0.453 496 L N 1.594 123.035 121.223 0.364 0.000 2.081 496 L HA -0.190 4.147 4.340 -0.005 0.000 0.212 496 L C 1.541 178.634 176.870 0.373 0.000 1.080 496 L CA 2.228 57.297 54.840 0.381 0.000 0.754 496 L CB -0.447 41.727 42.059 0.193 0.000 0.893 496 L HN 0.724 8.954 8.230 -0.000 0.000 0.433 497 E N -0.077 120.283 120.200 0.266 0.000 2.409 497 E HA -0.142 4.205 4.350 -0.005 0.000 0.198 497 E C 1.395 178.103 176.600 0.180 0.000 1.024 497 E CA 0.811 57.324 56.400 0.189 0.000 0.861 497 E CB -0.121 29.646 29.700 0.111 0.000 0.788 497 E HN 0.498 8.858 8.360 -0.000 0.000 0.521 498 D N -0.890 119.625 120.400 0.192 0.000 2.349 498 D HA -0.026 4.611 4.640 -0.005 0.000 0.215 498 D C -0.283 176.035 176.300 0.031 0.000 1.016 498 D CA 0.136 54.191 54.000 0.091 0.000 0.870 498 D CB -0.010 40.829 40.800 0.065 0.000 0.917 498 D HN 0.199 8.569 8.370 -0.000 0.000 0.524 499 Y N 1.624 121.992 120.300 0.113 0.000 2.578 499 Y HA 0.118 4.665 4.550 -0.005 0.000 0.339 499 Y C 1.118 177.073 175.900 0.092 0.000 1.231 499 Y CA 0.442 58.614 58.100 0.120 0.000 1.461 499 Y CB 0.614 39.167 38.460 0.156 0.000 1.323 499 Y HN -0.215 8.065 8.280 -0.000 0.000 0.590 500 E N 0.838 121.177 120.200 0.232 0.000 2.343 500 E HA 0.087 4.434 4.350 -0.005 0.000 0.270 500 E C 0.400 177.068 176.600 0.114 0.000 0.895 500 E CA -0.815 55.663 56.400 0.129 0.000 0.767 500 E CB 1.748 31.492 29.700 0.075 0.000 1.248 500 E HN 0.605 8.965 8.360 -0.000 0.000 0.440 501 E N 1.891 122.112 120.200 0.036 0.000 2.171 501 E HA -0.173 4.174 4.350 -0.005 0.000 0.197 501 E C 1.495 178.119 176.600 0.040 0.000 0.997 501 E CA 1.623 58.019 56.400 -0.006 0.000 0.810 501 E CB -0.146 29.502 29.700 -0.085 0.000 0.738 501 E HN 0.807 9.167 8.360 -0.000 0.000 0.467 502 G N 0.406 109.233 108.800 0.046 0.000 2.598 502 G HA2 -0.181 3.776 3.960 -0.005 0.000 0.215 502 G HA3 -0.181 3.776 3.960 -0.005 0.000 0.215 502 G C 1.023 175.960 174.900 0.061 0.000 1.131 502 G CA 0.506 45.636 45.100 0.049 0.000 0.785 502 G HN 0.204 8.494 8.290 -0.000 0.000 0.539 503 D N 0.238 120.697 120.400 0.098 0.000 2.348 503 D HA 0.048 4.685 4.640 -0.005 0.000 0.216 503 D C 1.541 177.888 176.300 0.078 0.000 0.970 503 D CA 0.545 54.636 54.000 0.152 0.000 0.889 503 D CB 0.083 41.067 40.800 0.308 0.000 0.912 503 D HN 0.518 8.888 8.370 -0.000 0.000 0.524 504 M N -1.180 118.385 119.600 -0.058 0.000 2.658 504 M HA 0.674 5.151 4.480 -0.005 0.000 0.295 504 M C -1.117 175.107 176.300 -0.127 0.000 1.248 504 M CA -0.862 54.261 55.300 -0.295 0.000 0.843 504 M CB 3.280 35.444 32.600 -0.727 0.000 1.749 504 M HN -0.331 7.959 8.290 -0.000 0.000 0.464 505 E N 0.861 120.950 120.200 -0.184 0.000 2.321 505 E HA 0.554 4.901 4.350 -0.005 0.000 0.278 505 E C -2.027 174.429 176.600 -0.239 0.000 0.902 505 E CA -0.761 55.561 56.400 -0.130 0.000 0.758 505 E CB 2.824 32.488 29.700 -0.060 0.000 1.213 505 E HN 0.642 9.002 8.360 -0.000 0.000 0.426 506 V N 5.782 125.491 119.914 -0.342 0.000 2.461 506 V HA 0.371 4.488 4.120 -0.005 0.000 0.275 506 V C 0.350 176.339 176.094 -0.176 0.000 1.047 506 V CA -0.234 61.802 62.300 -0.441 0.000 0.955 506 V CB 0.388 31.751 31.823 -0.765 0.000 0.988 506 V HN 0.556 8.746 8.190 -0.000 0.000 0.471 507 I N 0.526 121.049 120.570 -0.078 0.000 2.846 507 I HA 0.659 4.826 4.170 -0.005 0.000 0.307 507 I C -0.190 175.999 176.117 0.120 0.000 1.053 507 I CA -0.847 60.469 61.300 0.027 0.000 1.050 507 I CB 2.042 40.060 38.000 0.029 0.000 1.239 507 I HN 0.540 8.750 8.210 -0.000 0.000 0.439 508 D N 1.935 122.411 120.400 0.125 0.000 2.723 508 D HA -0.283 4.354 4.640 -0.005 0.000 0.236 508 D C -0.921 175.515 176.300 0.227 0.000 1.138 508 D CA 1.098 55.198 54.000 0.166 0.000 0.676 508 D CB -1.180 39.754 40.800 0.222 0.000 1.069 508 D HN 0.752 9.122 8.370 -0.000 0.000 0.430 509 Y N -0.072 120.241 120.300 0.022 0.000 2.404 509 Y HA 0.415 4.961 4.550 -0.005 0.000 0.344 509 Y C 0.077 175.988 175.900 0.018 0.000 0.970 509 Y CA -0.697 57.407 58.100 0.008 0.000 1.180 509 Y CB 0.845 39.284 38.460 -0.034 0.000 1.138 509 Y HN 0.115 8.395 8.280 -0.000 0.000 0.510 510 A N 9.201 131.996 122.820 -0.040 0.000 3.105 510 A HA 0.389 4.706 4.320 -0.005 0.000 0.336 510 A C -2.816 174.611 177.584 -0.262 0.000 1.042 510 A CA -1.479 50.463 52.037 -0.159 0.000 0.851 510 A CB -0.234 18.734 19.000 -0.054 0.000 1.068 510 A HN 0.559 8.709 8.150 -0.000 0.000 0.477 511 P HA 0.243 4.663 4.420 -0.000 0.000 0.274 511 P C -0.611 176.599 177.300 -0.150 0.000 1.246 511 P CA -0.085 62.846 63.100 -0.281 0.000 0.795 511 P CB 0.697 32.116 31.700 -0.468 0.000 1.006 512 Y N 0.476 120.733 120.300 -0.071 0.000 2.330 512 Y HA 0.174 4.721 4.550 -0.006 0.000 0.341 512 Y C -0.983 174.897 175.900 -0.034 0.000 1.278 512 Y CA -1.368 56.714 58.100 -0.030 0.000 1.453 512 Y CB -0.925 37.534 38.460 -0.000 0.000 1.342 512 Y HN 0.346 8.626 8.280 -0.000 0.000 0.590 513 P HA 0.077 4.497 4.420 -0.000 0.000 0.271 513 P C -2.539 174.804 177.300 0.072 0.000 1.233 513 P CA -0.985 62.159 63.100 0.073 0.000 0.789 513 P CB -0.124 31.616 31.700 0.065 0.000 0.951 514 P HA 0.196 4.616 4.420 -0.000 0.000 0.270 514 P C -0.296 177.022 177.300 0.030 0.000 1.221 514 P CA 0.526 63.644 63.100 0.031 0.000 0.788 514 P CB 0.295 32.004 31.700 0.015 0.000 0.904 515 I N -0.117 120.465 120.570 0.020 0.000 2.656 515 I HA 0.098 4.265 4.170 -0.005 0.000 0.292 515 I C 0.259 176.377 176.117 0.003 0.000 1.144 515 I CA -0.702 60.606 61.300 0.014 0.000 1.038 515 I CB 2.184 40.192 38.000 0.013 0.000 1.244 515 I HN 0.234 8.444 8.210 -0.000 0.000 0.420 516 S N 5.552 121.255 115.700 0.005 0.000 3.305 516 S HA 0.144 4.611 4.470 -0.005 0.000 0.248 516 S C 0.228 174.828 174.600 -0.001 0.000 1.288 516 S CA -0.305 57.896 58.200 0.002 0.000 1.249 516 S CB -0.431 62.775 63.200 0.009 0.000 1.116 516 S HN 0.598 8.908 8.310 -0.000 0.000 0.465 517 M N 0.000 119.586 119.600 -0.023 0.000 2.572 517 M HA 0.000 4.477 4.480 -0.005 0.000 0.227 517 M CA 0.000 55.258 55.300 -0.071 0.000 0.988 517 M CB 0.000 32.532 32.600 -0.113 0.000 1.302 517 M HN 0.000 8.290 8.290 -0.000 0.000 0.411