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 3cc9_1_A DATA FIRST_RESID 36 DATA SEQUENCE FFRNMYDKYR DAFLSHLNEY SLEEEIKEHI SKYYKLLFDY NCLGGKNNRG DATA SEQUENCE ILVILIYEYV KNXXINSSEW EKAACLAWCI EILQAAFLVA DDIMDKGEMR DATA SEQUENCE RNKYCWYLLK DVETKNAVND VLLLYNSIYK LIEIYLRNES CYVDVIATFR DATA SEQUENCE DATLKTIIGQ HLDTNIFSDK YSDXXXEIDV NNINVPEQPV IDINMINFGV DATA SEQUENCE YKNIVIHKTA YYSFFLPIVC GMLLAGIAVD NLIYKKIEDI SMLMGEYFQI DATA SEQUENCE HDDYLDIFXX XXXXXXXXSD IQNNKLTWPL IKTFELCSEP DKIKIVKNYG DATA SEQUENCE KNNLACVKVI DSLYEQYKXR KHYESYEKAQ KAKILSAINE LHHEGIEYVL DATA SEQUENCE KYLLEILFTG 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 36 F HA 0.000 nan 4.527 nan 0.000 0.279 36 F C 0.000 175.869 175.800 0.115 0.000 0.967 36 F CA 0.000 58.010 58.000 0.017 0.000 1.383 36 F CB 0.000 38.940 39.000 -0.101 0.000 1.145 37 F N 3.170 122.781 119.950 -0.564 0.000 2.120 37 F HA -0.020 4.506 4.527 -0.001 0.000 0.300 37 F C 2.246 178.034 175.800 -0.020 0.000 1.095 37 F CA 2.149 59.842 58.000 -0.513 0.000 1.249 37 F CB -0.309 38.518 39.000 -0.289 0.000 0.995 37 F HN -0.108 8.192 8.300 -0.000 0.000 0.480 38 R N 0.815 121.222 120.500 -0.154 0.000 2.189 38 R HA -0.070 4.269 4.340 -0.001 0.000 0.218 38 R C 1.774 178.068 176.300 -0.010 0.000 1.074 38 R CA 0.872 56.954 56.100 -0.031 0.000 0.991 38 R CB -1.125 29.204 30.300 0.048 0.000 0.883 38 R HN 0.414 8.684 8.270 -0.000 0.000 0.457 39 N N 0.116 118.782 118.700 -0.057 0.000 2.309 39 N HA -0.069 4.670 4.740 -0.001 0.000 0.182 39 N C 1.385 176.837 175.510 -0.097 0.000 1.018 39 N CA 0.896 53.919 53.050 -0.045 0.000 0.876 39 N CB 0.062 38.555 38.487 0.010 0.000 0.972 39 N HN 0.126 8.506 8.380 -0.000 0.000 0.434 40 M N -0.545 118.968 119.600 -0.145 0.000 2.495 40 M HA 0.023 4.503 4.480 -0.001 0.000 0.237 40 M C 1.413 177.484 176.300 -0.382 0.000 1.131 40 M CA -0.034 55.127 55.300 -0.232 0.000 1.032 40 M CB -0.773 31.735 32.600 -0.153 0.000 1.513 40 M HN 0.097 8.387 8.290 -0.000 0.000 0.488 41 Y N 2.276 122.252 120.300 -0.539 0.000 2.081 41 Y HA -0.307 4.242 4.550 -0.001 0.000 0.280 41 Y C 1.593 177.087 175.900 -0.676 0.000 1.163 41 Y CA 2.261 59.716 58.100 -1.075 0.000 1.135 41 Y CB -0.296 37.458 38.460 -1.178 0.000 0.970 41 Y HN 0.215 8.495 8.280 -0.000 0.000 0.498 42 D N -0.336 119.746 120.400 -0.530 0.000 2.149 42 D HA -0.209 4.431 4.640 -0.001 0.000 0.198 42 D C 2.365 178.372 176.300 -0.489 0.000 0.990 42 D CA 1.842 55.561 54.000 -0.470 0.000 0.839 42 D CB -0.332 40.346 40.800 -0.203 0.000 0.948 42 D HN 0.230 8.600 8.370 -0.000 0.000 0.460 43 K N -0.505 119.589 120.400 -0.509 0.000 2.026 43 K HA -0.165 4.154 4.320 -0.001 0.000 0.208 43 K C 2.136 178.461 176.600 -0.458 0.000 1.048 43 K CA 1.024 57.018 56.287 -0.488 0.000 0.929 43 K CB -0.919 31.214 32.500 -0.612 0.000 0.713 43 K HN 0.339 8.589 8.250 -0.000 0.000 0.439 44 Y N 0.570 120.664 120.300 -0.343 0.000 2.220 44 Y HA 0.143 4.693 4.550 -0.001 0.000 0.291 44 Y C 2.630 178.303 175.900 -0.377 0.000 1.129 44 Y CA 1.552 59.484 58.100 -0.280 0.000 1.161 44 Y CB -0.648 37.616 38.460 -0.326 0.000 0.997 44 Y HN 0.166 8.446 8.280 -0.000 0.000 0.522 45 R N 0.665 120.831 120.500 -0.557 0.000 2.080 45 R HA -0.194 4.146 4.340 -0.001 0.000 0.236 45 R C 1.435 177.477 176.300 -0.431 0.000 1.137 45 R CA 2.281 57.958 56.100 -0.705 0.000 0.943 45 R CB -0.354 29.370 30.300 -0.960 0.000 0.846 45 R HN 0.258 8.528 8.270 -0.000 0.000 0.431 46 D N 0.171 120.370 120.400 -0.336 0.000 2.178 46 D HA -0.094 4.545 4.640 -0.001 0.000 0.202 46 D C 1.720 177.932 176.300 -0.147 0.000 0.974 46 D CA 1.324 55.196 54.000 -0.214 0.000 0.841 46 D CB -0.276 40.414 40.800 -0.184 0.000 0.953 46 D HN 0.392 8.762 8.370 -0.000 0.000 0.478 47 A N 0.461 123.224 122.820 -0.095 0.000 1.883 47 A HA -0.201 4.118 4.320 -0.001 0.000 0.217 47 A C 2.121 179.700 177.584 -0.008 0.000 1.186 47 A CA 1.238 53.267 52.037 -0.013 0.000 0.624 47 A CB -1.047 18.034 19.000 0.135 0.000 0.822 47 A HN 0.279 8.429 8.150 -0.000 0.000 0.444 48 F N 0.506 120.367 119.950 -0.149 0.000 2.113 48 F HA -0.076 4.450 4.527 -0.001 0.000 0.297 48 F C 1.892 177.608 175.800 -0.140 0.000 1.103 48 F CA 1.583 59.494 58.000 -0.148 0.000 1.248 48 F CB -0.334 38.526 39.000 -0.233 0.000 0.999 48 F HN 0.126 8.426 8.300 -0.000 0.000 0.475 49 L N -0.717 120.327 121.223 -0.298 0.000 2.127 49 L HA -0.229 4.111 4.340 -0.001 0.000 0.211 49 L C 2.713 179.405 176.870 -0.296 0.000 1.089 49 L CA 1.459 56.109 54.840 -0.317 0.000 0.757 49 L CB -0.966 40.994 42.059 -0.166 0.000 0.899 49 L HN 0.214 8.444 8.230 -0.000 0.000 0.434 50 S N -1.039 114.532 115.700 -0.215 0.000 2.402 50 S HA -0.244 4.225 4.470 -0.001 0.000 0.229 50 S C 2.001 176.491 174.600 -0.184 0.000 1.021 50 S CA 1.272 59.372 58.200 -0.166 0.000 0.974 50 S CB -0.210 62.926 63.200 -0.108 0.000 0.800 50 S HN 0.597 8.907 8.310 -0.000 0.000 0.484 51 H N 1.343 120.221 119.070 -0.319 0.000 2.321 51 H HA 0.048 4.603 4.556 -0.001 0.000 0.300 51 H C 1.887 176.930 175.328 -0.474 0.000 1.087 51 H CA 2.126 57.984 56.048 -0.317 0.000 1.319 51 H CB -0.489 29.086 29.762 -0.311 0.000 1.379 51 H HN 0.350 8.630 8.280 -0.000 0.000 0.501 52 L N 0.183 120.911 121.223 -0.825 0.000 2.079 52 L HA -0.196 4.144 4.340 -0.001 0.000 0.210 52 L C 2.470 178.859 176.870 -0.802 0.000 1.081 52 L CA 1.521 55.666 54.840 -1.157 0.000 0.752 52 L CB -0.581 40.984 42.059 -0.822 0.000 0.896 52 L HN 0.504 8.734 8.230 -0.000 0.000 0.433 53 N N -0.147 118.292 118.700 -0.436 0.000 2.453 53 N HA -0.147 4.592 4.740 -0.001 0.000 0.183 53 N C 1.280 176.694 175.510 -0.161 0.000 1.041 53 N CA 0.893 53.804 53.050 -0.233 0.000 0.900 53 N CB 0.305 38.697 38.487 -0.158 0.000 0.961 53 N HN 0.273 8.653 8.380 -0.000 0.000 0.443 54 E N -0.316 119.770 120.200 -0.190 0.000 2.481 54 E HA -0.017 4.333 4.350 -0.001 0.000 0.195 54 E C -0.214 176.424 176.600 0.065 0.000 1.047 54 E CA -0.032 56.329 56.400 -0.065 0.000 0.867 54 E CB -0.269 29.390 29.700 -0.068 0.000 0.858 54 E HN 0.307 8.667 8.360 -0.000 0.000 0.513 55 Y N 1.028 121.229 120.300 -0.165 0.000 2.426 55 Y HA 0.173 4.722 4.550 -0.001 0.000 0.344 55 Y C 1.228 177.084 175.900 -0.073 0.000 1.256 55 Y CA -1.218 56.807 58.100 -0.126 0.000 1.451 55 Y CB 0.375 38.764 38.460 -0.117 0.000 1.342 55 Y HN -0.089 8.191 8.280 -0.000 0.000 0.600 56 S N 3.875 119.614 115.700 0.065 0.000 3.530 56 S HA 0.394 4.864 4.470 -0.001 0.000 0.279 56 S C -0.291 174.334 174.600 0.041 0.000 1.280 56 S CA -0.265 57.951 58.200 0.025 0.000 0.946 56 S CB -0.991 62.199 63.200 -0.016 0.000 1.501 56 S HN 0.341 8.651 8.310 -0.000 0.000 0.498 57 L N 1.495 122.753 121.223 0.059 0.000 2.393 57 L HA 0.454 4.794 4.340 -0.001 0.000 0.260 57 L C 0.129 177.023 176.870 0.040 0.000 1.002 57 L CA -0.994 53.882 54.840 0.060 0.000 0.818 57 L CB 1.851 43.966 42.059 0.093 0.000 1.369 57 L HN 0.306 8.536 8.230 -0.000 0.000 0.412 58 E N 0.839 121.062 120.200 0.038 0.000 2.415 58 E HA -0.069 4.281 4.350 -0.001 0.000 0.262 58 E C 0.375 176.988 176.600 0.021 0.000 1.038 58 E CA 0.067 56.483 56.400 0.027 0.000 0.921 58 E CB 1.087 30.805 29.700 0.030 0.000 0.950 58 E HN 0.561 8.921 8.360 -0.000 0.000 0.438 59 E N 2.447 122.650 120.200 0.005 0.000 2.130 59 E HA -0.295 4.054 4.350 -0.001 0.000 0.196 59 E C 1.734 178.317 176.600 -0.028 0.000 0.998 59 E CA 1.483 57.876 56.400 -0.011 0.000 0.806 59 E CB 0.158 29.849 29.700 -0.016 0.000 0.738 59 E HN 0.577 8.937 8.360 -0.000 0.000 0.459 60 E N 0.086 120.270 120.200 -0.027 0.000 2.072 60 E HA -0.169 4.180 4.350 -0.001 0.000 0.191 60 E C 2.092 178.649 176.600 -0.072 0.000 0.985 60 E CA 1.007 57.362 56.400 -0.073 0.000 0.801 60 E CB -0.016 29.672 29.700 -0.020 0.000 0.750 60 E HN 0.339 8.699 8.360 -0.000 0.000 0.452 61 I N 0.746 121.352 120.570 0.060 0.000 2.315 61 I HA -0.241 3.929 4.170 -0.001 0.000 0.248 61 I C 2.369 178.549 176.117 0.105 0.000 1.117 61 I CA 0.951 62.344 61.300 0.155 0.000 1.404 61 I CB -0.197 37.878 38.000 0.126 0.000 1.071 61 I HN 0.070 8.280 8.210 -0.000 0.000 0.419 62 K N 0.794 121.221 120.400 0.046 0.000 2.063 62 K HA -0.227 4.092 4.320 -0.001 0.000 0.208 62 K C 1.955 178.565 176.600 0.016 0.000 1.048 62 K CA 1.604 57.907 56.287 0.026 0.000 0.928 62 K CB -0.140 32.357 32.500 -0.004 0.000 0.713 62 K HN 0.388 8.638 8.250 -0.000 0.000 0.442 63 E N -0.305 119.870 120.200 -0.043 0.000 2.077 63 E HA -0.186 4.164 4.350 -0.001 0.000 0.193 63 E C 1.923 178.499 176.600 -0.040 0.000 0.989 63 E CA 1.284 57.635 56.400 -0.081 0.000 0.800 63 E CB -0.132 29.463 29.700 -0.175 0.000 0.746 63 E HN 0.471 8.831 8.360 -0.000 0.000 0.452 64 H N 0.203 119.300 119.070 0.045 0.000 2.387 64 H HA -0.111 4.446 4.556 0.001 0.000 0.299 64 H C 2.357 177.733 175.328 0.080 0.000 1.090 64 H CA 1.507 57.585 56.048 0.051 0.000 1.332 64 H CB -0.142 29.636 29.762 0.027 0.000 1.386 64 H HN 0.299 8.579 8.280 -0.000 0.000 0.516 65 I N -0.950 119.749 120.570 0.216 0.000 2.406 65 I HA -0.118 4.051 4.170 -0.001 0.000 0.249 65 I C 2.401 178.697 176.117 0.299 0.000 1.122 65 I CA 1.318 62.762 61.300 0.240 0.000 1.431 65 I CB -0.191 37.980 38.000 0.286 0.000 1.087 65 I HN 0.161 8.371 8.210 -0.000 0.000 0.424 66 S N 1.551 117.365 115.700 0.191 0.000 2.402 66 S HA -0.082 4.388 4.470 -0.001 0.000 0.229 66 S C 2.297 176.997 174.600 0.166 0.000 1.021 66 S CA 1.264 59.561 58.200 0.161 0.000 0.974 66 S CB -0.750 62.486 63.200 0.060 0.000 0.800 66 S HN 0.630 8.940 8.310 -0.000 0.000 0.484 67 K N 1.031 121.520 120.400 0.148 0.000 2.002 67 K HA -0.043 4.277 4.320 -0.001 0.000 0.209 67 K C 1.975 178.677 176.600 0.169 0.000 1.048 67 K CA 1.552 57.923 56.287 0.140 0.000 0.930 67 K CB -1.879 30.700 32.500 0.131 0.000 0.714 67 K HN 0.638 8.888 8.250 -0.000 0.000 0.438 68 Y N -0.318 120.013 120.300 0.052 0.000 2.145 68 Y HA -0.213 4.336 4.550 -0.003 0.000 0.286 68 Y C 2.323 178.239 175.900 0.027 0.000 1.145 68 Y CA 2.050 60.137 58.100 -0.022 0.000 1.148 68 Y CB -0.106 38.224 38.460 -0.217 0.000 0.981 68 Y HN 0.364 8.644 8.280 -0.000 0.000 0.507 69 Y N 0.249 120.768 120.300 0.364 0.000 2.395 69 Y HA -0.061 4.488 4.550 -0.000 0.000 0.293 69 Y C 2.459 178.567 175.900 0.348 0.000 1.123 69 Y CA 1.187 59.507 58.100 0.366 0.000 1.227 69 Y CB -0.503 38.225 38.460 0.446 0.000 1.012 69 Y HN 0.078 8.358 8.280 -0.000 0.000 0.552 70 K N 0.283 120.888 120.400 0.341 0.000 2.057 70 K HA -0.212 4.107 4.320 -0.001 0.000 0.207 70 K C 2.037 178.767 176.600 0.217 0.000 1.049 70 K CA 1.460 57.889 56.287 0.238 0.000 0.931 70 K CB -0.425 32.156 32.500 0.135 0.000 0.714 70 K HN 0.275 8.525 8.250 -0.000 0.000 0.440 71 L N 1.341 122.642 121.223 0.129 0.000 2.056 71 L HA -0.119 4.220 4.340 -0.001 0.000 0.207 71 L C 2.115 178.946 176.870 -0.065 0.000 1.078 71 L CA 1.240 56.129 54.840 0.080 0.000 0.749 71 L CB -0.615 41.489 42.059 0.075 0.000 0.901 71 L HN 0.260 8.490 8.230 -0.000 0.000 0.433 72 L N -0.900 120.191 121.223 -0.220 0.000 2.013 72 L HA -0.245 4.094 4.340 -0.001 0.000 0.212 72 L C 2.225 178.848 176.870 -0.412 0.000 1.073 72 L CA 2.078 56.552 54.840 -0.609 0.000 0.753 72 L CB -0.869 41.018 42.059 -0.287 0.000 0.890 72 L HN 0.245 8.475 8.230 -0.000 0.000 0.432 73 F N 0.058 119.968 119.950 -0.066 0.000 2.084 73 F HA -0.192 4.336 4.527 0.001 0.000 0.296 73 F C 2.345 178.190 175.800 0.077 0.000 1.111 73 F CA 1.732 59.750 58.000 0.029 0.000 1.224 73 F CB -0.725 38.325 39.000 0.083 0.000 0.991 73 F HN 0.151 8.451 8.300 -0.000 0.000 0.471 74 D N -0.994 119.578 120.400 0.288 0.000 2.104 74 D HA -0.248 4.392 4.640 -0.001 0.000 0.194 74 D C 1.999 178.338 176.300 0.065 0.000 0.994 74 D CA 1.415 55.513 54.000 0.164 0.000 0.830 74 D CB -0.843 40.052 40.800 0.159 0.000 0.959 74 D HN 0.278 8.648 8.370 -0.000 0.000 0.452 75 Y N 1.173 121.432 120.300 -0.068 0.000 2.224 75 Y HA -0.136 4.414 4.550 0.000 0.000 0.289 75 Y C 1.729 177.583 175.900 -0.076 0.000 1.146 75 Y CA 1.413 59.479 58.100 -0.057 0.000 1.182 75 Y CB 0.155 38.585 38.460 -0.050 0.000 0.983 75 Y HN -0.026 8.254 8.280 -0.000 0.000 0.524 76 N N -2.247 116.432 118.700 -0.036 0.000 2.368 76 N HA -0.009 4.730 4.740 -0.001 0.000 0.178 76 N C 1.238 176.746 175.510 -0.003 0.000 1.076 76 N CA 0.950 53.966 53.050 -0.057 0.000 0.889 76 N CB -0.079 38.303 38.487 -0.176 0.000 1.040 76 N HN 0.295 8.675 8.380 -0.000 0.000 0.463 77 C N 0.798 120.125 119.300 0.045 0.000 2.634 77 C HA 0.371 4.830 4.460 -0.001 0.000 0.268 77 C C 0.962 176.034 174.990 0.136 0.000 1.322 77 C CA -0.374 58.749 59.018 0.175 0.000 1.737 77 C CB -0.598 27.358 27.740 0.359 0.000 1.976 77 C HN 0.168 8.398 8.230 -0.000 0.000 0.547 78 L N 0.705 121.904 121.223 -0.040 0.000 2.322 78 L HA 0.649 4.989 4.340 -0.001 0.000 0.281 78 L C 0.952 177.785 176.870 -0.061 0.000 1.014 78 L CA 0.478 55.260 54.840 -0.098 0.000 0.815 78 L CB 1.265 43.161 42.059 -0.272 0.000 1.247 78 L HN 0.342 8.572 8.230 -0.000 0.000 0.421 79 G N 1.856 110.647 108.800 -0.014 0.000 2.318 79 G HA2 -0.138 3.821 3.960 -0.001 0.000 0.172 79 G HA3 -0.138 3.821 3.960 -0.001 0.000 0.172 79 G C 0.331 175.242 174.900 0.018 0.000 1.002 79 G CA -0.335 44.754 45.100 -0.019 0.000 0.697 79 G HN 0.929 9.219 8.290 -0.000 0.000 0.483 80 G N -0.218 108.611 108.800 0.048 0.000 2.557 80 G HA2 0.519 4.479 3.960 -0.001 0.000 0.292 80 G HA3 0.519 4.479 3.960 -0.001 0.000 0.292 80 G C 0.821 175.761 174.900 0.068 0.000 1.237 80 G CA 0.177 45.318 45.100 0.068 0.000 0.978 80 G HN 0.226 8.516 8.290 -0.000 0.000 0.498 81 K N -0.500 119.945 120.400 0.074 0.000 2.288 81 K HA -0.038 4.282 4.320 -0.001 0.000 0.201 81 K C 0.620 177.239 176.600 0.032 0.000 1.048 81 K CA 0.894 57.218 56.287 0.063 0.000 0.956 81 K CB -0.115 32.434 32.500 0.083 0.000 0.746 81 K HN 0.643 8.893 8.250 -0.000 0.000 0.461 82 N N 0.104 118.813 118.700 0.015 0.000 2.741 82 N HA -0.194 4.545 4.740 -0.001 0.000 0.251 82 N C 0.181 175.597 175.510 -0.156 0.000 1.112 82 N CA 0.355 53.378 53.050 -0.046 0.000 0.750 82 N CB -0.993 37.523 38.487 0.049 0.000 1.119 82 N HN 0.215 8.595 8.380 -0.000 0.000 0.561 83 N N 0.599 119.223 118.700 -0.126 0.000 2.094 83 N HA -0.125 4.614 4.740 -0.001 0.000 0.191 83 N C 1.693 177.041 175.510 -0.270 0.000 1.023 83 N CA 1.402 54.345 53.050 -0.179 0.000 0.857 83 N CB -0.104 38.288 38.487 -0.159 0.000 1.013 83 N HN 0.505 8.885 8.380 -0.000 0.000 0.426 84 R N -0.164 120.156 120.500 -0.300 0.000 2.075 84 R HA 0.027 4.367 4.340 -0.001 0.000 0.232 84 R C 2.370 178.482 176.300 -0.314 0.000 1.126 84 R CA 1.252 57.155 56.100 -0.328 0.000 0.963 84 R CB -0.569 29.557 30.300 -0.290 0.000 0.858 84 R HN 0.242 8.512 8.270 -0.000 0.000 0.435 85 G N 0.487 109.055 108.800 -0.386 0.000 2.418 85 G HA2 -0.221 3.738 3.960 -0.001 0.000 0.217 85 G HA3 -0.221 3.738 3.960 -0.001 0.000 0.217 85 G C 1.511 175.910 174.900 -0.835 0.000 1.158 85 G CA 0.814 45.519 45.100 -0.658 0.000 0.771 85 G HN 0.132 8.422 8.290 -0.000 0.000 0.545 86 I N 0.404 120.547 120.570 -0.712 0.000 2.315 86 I HA -0.022 4.147 4.170 -0.001 0.000 0.248 86 I C 2.653 178.637 176.117 -0.221 0.000 1.117 86 I CA 0.820 61.838 61.300 -0.471 0.000 1.404 86 I CB -0.778 37.064 38.000 -0.264 0.000 1.071 86 I HN 0.302 8.512 8.210 -0.000 0.000 0.419 87 L N 0.636 121.738 121.223 -0.203 0.000 2.012 87 L HA -0.123 4.216 4.340 -0.001 0.000 0.210 87 L C 2.542 179.364 176.870 -0.080 0.000 1.073 87 L CA 1.971 56.741 54.840 -0.117 0.000 0.748 87 L CB -0.730 41.237 42.059 -0.154 0.000 0.891 87 L HN 0.166 8.396 8.230 -0.000 0.000 0.431 88 V N -0.089 119.749 119.914 -0.127 0.000 2.231 88 V HA -0.364 3.755 4.120 -0.001 0.000 0.248 88 V C 2.517 178.649 176.094 0.063 0.000 1.054 88 V CA 2.495 64.760 62.300 -0.058 0.000 1.015 88 V CB -0.593 31.171 31.823 -0.098 0.000 0.638 88 V HN 0.437 8.627 8.190 -0.000 0.000 0.444 89 I N -0.737 119.866 120.570 0.055 0.000 2.286 89 I HA -0.254 3.915 4.170 -0.001 0.000 0.248 89 I C 2.288 178.629 176.117 0.373 0.000 1.115 89 I CA 1.494 62.968 61.300 0.291 0.000 1.392 89 I CB -0.204 37.931 38.000 0.225 0.000 1.065 89 I HN 0.263 8.473 8.210 -0.000 0.000 0.418 90 L N -0.113 121.246 121.223 0.226 0.000 2.056 90 L HA -0.205 4.135 4.340 -0.001 0.000 0.207 90 L C 2.442 179.508 176.870 0.326 0.000 1.078 90 L CA 1.386 56.400 54.840 0.289 0.000 0.749 90 L CB -0.364 41.777 42.059 0.136 0.000 0.901 90 L HN 0.174 8.404 8.230 -0.000 0.000 0.433 91 I N -1.477 119.206 120.570 0.187 0.000 2.226 91 I HA -0.339 3.831 4.170 -0.001 0.000 0.245 91 I C 2.471 178.695 176.117 0.178 0.000 1.100 91 I CA 1.321 62.705 61.300 0.140 0.000 1.374 91 I CB -0.288 37.735 38.000 0.039 0.000 1.057 91 I HN 0.160 8.370 8.210 -0.000 0.000 0.413 92 Y N 1.385 121.730 120.300 0.074 0.000 2.165 92 Y HA -0.301 4.249 4.550 -0.000 0.000 0.286 92 Y C 2.532 178.422 175.900 -0.016 0.000 1.155 92 Y CA 2.022 60.130 58.100 0.013 0.000 1.164 92 Y CB -0.230 38.227 38.460 -0.006 0.000 0.978 92 Y HN 0.202 8.482 8.280 -0.000 0.000 0.513 93 E N -1.317 118.927 120.200 0.074 0.000 2.107 93 E HA -0.222 4.128 4.350 -0.001 0.000 0.191 93 E C 1.479 177.974 176.600 -0.175 0.000 0.982 93 E CA 1.216 57.574 56.400 -0.069 0.000 0.809 93 E CB -0.329 29.506 29.700 0.225 0.000 0.756 93 E HN 0.636 8.996 8.360 -0.000 0.000 0.459 94 Y N -0.468 119.845 120.300 0.021 0.000 2.511 94 Y HA -0.057 4.493 4.550 -0.001 0.000 0.279 94 Y C 1.989 177.924 175.900 0.058 0.000 1.157 94 Y CA 0.457 58.586 58.100 0.049 0.000 1.300 94 Y CB 0.588 39.122 38.460 0.123 0.000 1.052 94 Y HN 0.062 8.341 8.280 -0.000 0.000 0.529 95 V N -4.124 115.850 119.914 0.099 0.000 2.685 95 V HA -0.042 4.077 4.120 -0.001 0.000 0.244 95 V C 2.013 178.079 176.094 -0.047 0.000 1.054 95 V CA 1.146 63.500 62.300 0.090 0.000 1.076 95 V CB -0.602 31.230 31.823 0.015 0.000 0.725 95 V HN 0.039 8.229 8.190 -0.000 0.000 0.467 96 K N 1.393 121.661 120.400 -0.221 0.000 1.975 96 K HA 0.016 4.336 4.320 -0.001 0.000 0.210 96 K C 1.144 177.613 176.600 -0.218 0.000 1.041 96 K CA 1.018 57.122 56.287 -0.305 0.000 0.942 96 K CB -1.098 31.031 32.500 -0.618 0.000 0.729 96 K HN 0.999 9.249 8.250 -0.000 0.000 0.439 101 N N 2.640 121.313 118.700 -0.045 0.000 2.443 101 N HA 0.489 5.229 4.740 -0.001 0.000 0.294 101 N C 0.992 176.597 175.510 0.158 0.000 1.289 101 N CA 0.275 53.362 53.050 0.061 0.000 0.966 101 N CB 0.312 38.824 38.487 0.041 0.000 1.122 101 N HN 0.537 8.917 8.380 -0.000 0.000 0.569 102 S N -1.225 114.572 115.700 0.161 0.000 2.395 102 S HA -0.109 4.361 4.470 -0.001 0.000 0.225 102 S C 1.856 176.588 174.600 0.219 0.000 1.027 102 S CA 1.035 59.361 58.200 0.210 0.000 0.965 102 S CB -0.675 62.613 63.200 0.147 0.000 0.812 102 S HN 0.747 9.057 8.310 -0.000 0.000 0.482 103 S N 1.772 117.564 115.700 0.154 0.000 2.383 103 S HA -0.047 4.422 4.470 -0.001 0.000 0.227 103 S C 1.607 176.295 174.600 0.146 0.000 1.026 103 S CA 0.906 59.197 58.200 0.151 0.000 0.981 103 S CB -0.449 62.816 63.200 0.109 0.000 0.818 103 S HN 0.505 8.815 8.310 -0.000 0.000 0.472 104 E N 0.421 120.680 120.200 0.099 0.000 2.051 104 E HA -0.126 4.224 4.350 -0.001 0.000 0.192 104 E C 1.712 178.334 176.600 0.037 0.000 0.991 104 E CA 1.546 57.972 56.400 0.042 0.000 0.799 104 E CB -0.279 29.414 29.700 -0.013 0.000 0.748 104 E HN 0.742 9.102 8.360 -0.000 0.000 0.449 105 W N 1.292 122.703 121.300 0.186 0.000 2.402 105 W HA -0.114 4.546 4.660 -0.001 0.000 0.286 105 W C 2.317 179.003 176.519 0.278 0.000 1.221 105 W CA 0.422 57.913 57.345 0.244 0.000 1.257 105 W CB 0.106 29.684 29.460 0.197 0.000 1.120 105 W HN 0.147 8.327 8.180 -0.000 0.000 0.551 106 E N 0.857 121.327 120.200 0.449 0.000 2.153 106 E HA -0.237 4.112 4.350 -0.001 0.000 0.194 106 E C 1.773 178.490 176.600 0.195 0.000 0.988 106 E CA 1.252 57.855 56.400 0.339 0.000 0.811 106 E CB 0.021 29.886 29.700 0.275 0.000 0.746 106 E HN 0.297 8.657 8.360 -0.000 0.000 0.466 107 K N -0.256 120.219 120.400 0.124 0.000 2.116 107 K HA 0.010 4.329 4.320 -0.001 0.000 0.203 107 K C 2.100 178.646 176.600 -0.089 0.000 1.052 107 K CA 0.773 57.067 56.287 0.012 0.000 0.952 107 K CB 0.010 32.512 32.500 0.002 0.000 0.729 107 K HN 0.051 8.301 8.250 -0.000 0.000 0.446 108 A N 1.637 124.380 122.820 -0.128 0.000 1.877 108 A HA -0.112 4.208 4.320 -0.001 0.000 0.216 108 A C 2.377 179.999 177.584 0.062 0.000 1.186 108 A CA 1.898 53.832 52.037 -0.172 0.000 0.620 108 A CB -0.755 18.105 19.000 -0.233 0.000 0.822 108 A HN 0.311 8.461 8.150 -0.000 0.000 0.443 109 A N -1.219 121.748 122.820 0.245 0.000 1.969 109 A HA -0.160 4.159 4.320 -0.001 0.000 0.218 109 A C 2.339 179.870 177.584 -0.089 0.000 1.169 109 A CA 1.565 53.760 52.037 0.263 0.000 0.635 109 A CB -1.393 17.863 19.000 0.425 0.000 0.810 109 A HN 0.780 8.930 8.150 -0.000 0.000 0.445 110 C N -0.279 118.729 119.300 -0.486 0.000 2.413 110 C HA -0.111 4.349 4.460 -0.001 0.000 0.277 110 C C 2.581 177.349 174.990 -0.370 0.000 1.228 110 C CA 1.364 59.813 59.018 -0.947 0.000 1.731 110 C CB -1.441 25.885 27.740 -0.689 0.000 2.042 110 C HN 0.597 8.827 8.230 -0.000 0.000 0.468 111 L N 0.902 122.031 121.223 -0.157 0.000 2.141 111 L HA -0.055 4.285 4.340 -0.001 0.000 0.209 111 L C 2.989 179.888 176.870 0.049 0.000 1.094 111 L CA 1.475 56.318 54.840 0.005 0.000 0.763 111 L CB -0.938 41.148 42.059 0.043 0.000 0.908 111 L HN 0.494 8.724 8.230 -0.000 0.000 0.437 112 A N -0.287 122.526 122.820 -0.011 0.000 1.873 112 A HA -0.221 4.099 4.320 -0.001 0.000 0.215 112 A C 1.935 179.541 177.584 0.038 0.000 1.186 112 A CA 1.363 53.360 52.037 -0.068 0.000 0.616 112 A CB -0.912 17.981 19.000 -0.179 0.000 0.823 112 A HN 0.489 8.639 8.150 -0.000 0.000 0.442 113 W N -0.733 120.681 121.300 0.191 0.000 2.402 113 W HA -0.137 4.522 4.660 -0.002 0.000 0.286 113 W C 2.566 179.105 176.519 0.034 0.000 1.221 113 W CA 0.754 58.180 57.345 0.135 0.000 1.257 113 W CB -0.515 28.946 29.460 0.001 0.000 1.120 113 W HN 0.357 8.537 8.180 -0.000 0.000 0.551 114 C N -0.051 119.331 119.300 0.138 0.000 2.413 114 C HA -0.222 4.237 4.460 -0.001 0.000 0.276 114 C C 2.445 177.529 174.990 0.157 0.000 1.248 114 C CA 0.934 59.961 59.018 0.016 0.000 1.742 114 C CB -1.364 26.242 27.740 -0.224 0.000 2.017 114 C HN 0.306 8.536 8.230 -0.000 0.000 0.481 115 I N 0.335 121.049 120.570 0.240 0.000 2.439 115 I HA -0.107 4.063 4.170 -0.001 0.000 0.251 115 I C 2.452 178.659 176.117 0.151 0.000 1.139 115 I CA 1.074 62.501 61.300 0.212 0.000 1.438 115 I CB -0.525 37.523 38.000 0.080 0.000 1.085 115 I HN 0.297 8.507 8.210 -0.000 0.000 0.427 116 E N 0.948 121.246 120.200 0.164 0.000 2.150 116 E HA -0.115 4.235 4.350 -0.001 0.000 0.193 116 E C 2.293 179.032 176.600 0.232 0.000 0.985 116 E CA 1.154 57.678 56.400 0.207 0.000 0.814 116 E CB -0.099 29.762 29.700 0.268 0.000 0.752 116 E HN 0.534 8.894 8.360 -0.000 0.000 0.466 117 I N 0.598 121.305 120.570 0.229 0.000 2.315 117 I HA -0.244 3.925 4.170 -0.001 0.000 0.248 117 I C 2.408 178.513 176.117 -0.021 0.000 1.117 117 I CA 0.412 61.782 61.300 0.118 0.000 1.404 117 I CB -0.159 37.902 38.000 0.102 0.000 1.071 117 I HN 0.076 8.286 8.210 -0.000 0.000 0.419 118 L N 0.863 122.064 121.223 -0.038 0.000 2.017 118 L HA -0.260 4.080 4.340 -0.001 0.000 0.208 118 L C 2.546 179.178 176.870 -0.396 0.000 1.073 118 L CA 1.963 56.659 54.840 -0.240 0.000 0.745 118 L CB -0.756 41.230 42.059 -0.120 0.000 0.894 118 L HN 0.210 8.440 8.230 -0.000 0.000 0.432 119 Q N -0.268 119.511 119.800 -0.034 0.000 2.096 119 Q HA -0.179 4.161 4.340 -0.001 0.000 0.204 119 Q C 2.111 178.176 176.000 0.109 0.000 0.982 119 Q CA 2.246 58.150 55.803 0.168 0.000 0.850 119 Q CB -0.488 28.407 28.738 0.262 0.000 0.901 119 Q HN 0.592 8.862 8.270 -0.000 0.000 0.422 120 A N 0.312 123.162 122.820 0.051 0.000 1.877 120 A HA -0.054 4.266 4.320 -0.001 0.000 0.216 120 A C 2.327 179.904 177.584 -0.011 0.000 1.186 120 A CA 1.981 54.033 52.037 0.025 0.000 0.620 120 A CB -1.279 17.716 19.000 -0.010 0.000 0.822 120 A HN 0.562 8.712 8.150 -0.000 0.000 0.443 121 A N -1.033 121.735 122.820 -0.086 0.000 1.902 121 A HA 0.006 4.326 4.320 -0.001 0.000 0.217 121 A C 1.917 179.519 177.584 0.031 0.000 1.181 121 A CA 1.607 53.599 52.037 -0.076 0.000 0.623 121 A CB -0.733 18.189 19.000 -0.129 0.000 0.818 121 A HN 0.425 8.575 8.150 -0.000 0.000 0.443 122 F N -0.209 119.724 119.950 -0.028 0.000 2.134 122 F HA -0.134 4.391 4.527 -0.002 0.000 0.299 122 F C 2.157 177.955 175.800 -0.004 0.000 1.097 122 F CA 0.821 58.779 58.000 -0.070 0.000 1.264 122 F CB -1.041 37.846 39.000 -0.188 0.000 1.001 122 F HN 0.290 8.590 8.300 -0.000 0.000 0.479 123 L N -0.510 120.855 121.223 0.236 0.000 1.994 123 L HA -0.196 4.144 4.340 -0.001 0.000 0.208 123 L C 2.242 179.217 176.870 0.174 0.000 1.071 123 L CA 1.255 56.207 54.840 0.187 0.000 0.745 123 L CB -0.546 41.614 42.059 0.168 0.000 0.892 123 L HN -0.070 8.160 8.230 -0.000 0.000 0.431 124 V N 0.660 120.672 119.914 0.163 0.000 2.255 124 V HA -0.315 3.805 4.120 -0.001 0.000 0.247 124 V C 2.925 179.114 176.094 0.159 0.000 1.051 124 V CA 1.868 64.291 62.300 0.204 0.000 1.018 124 V CB -1.317 30.610 31.823 0.174 0.000 0.641 124 V HN 0.640 8.830 8.190 -0.000 0.000 0.445 125 A N 0.004 122.898 122.820 0.124 0.000 1.902 125 A HA -0.308 4.011 4.320 -0.001 0.000 0.217 125 A C 2.048 179.653 177.584 0.034 0.000 1.181 125 A CA 2.238 54.322 52.037 0.078 0.000 0.623 125 A CB -0.757 18.299 19.000 0.093 0.000 0.818 125 A HN 0.609 8.759 8.150 -0.000 0.000 0.443 126 D N -0.377 120.060 120.400 0.061 0.000 2.144 126 D HA -0.141 4.498 4.640 -0.001 0.000 0.199 126 D C 1.288 177.592 176.300 0.008 0.000 0.984 126 D CA 1.476 55.495 54.000 0.031 0.000 0.834 126 D CB -0.103 40.732 40.800 0.058 0.000 0.955 126 D HN 0.375 8.745 8.370 -0.000 0.000 0.465 127 D N -0.471 119.952 120.400 0.038 0.000 2.183 127 D HA -0.054 4.586 4.640 -0.001 0.000 0.203 127 D C 2.251 178.360 176.300 -0.318 0.000 0.969 127 D CA 0.375 54.394 54.000 0.032 0.000 0.842 127 D CB -0.047 40.902 40.800 0.248 0.000 0.957 127 D HN 0.368 8.738 8.370 -0.000 0.000 0.484 128 I N 0.676 120.989 120.570 -0.428 0.000 2.127 128 I HA -0.287 3.882 4.170 -0.001 0.000 0.241 128 I C 2.583 178.474 176.117 -0.376 0.000 1.075 128 I CA 1.057 61.954 61.300 -0.671 0.000 1.334 128 I CB -0.216 37.606 38.000 -0.296 0.000 1.040 128 I HN -0.060 8.150 8.210 -0.000 0.000 0.405 129 M N -0.195 119.295 119.600 -0.184 0.000 2.086 129 M HA -0.220 4.260 4.480 -0.001 0.000 0.261 129 M C 1.277 177.523 176.300 -0.090 0.000 1.067 129 M CA 1.688 56.924 55.300 -0.108 0.000 1.116 129 M CB -0.429 32.132 32.600 -0.064 0.000 1.348 129 M HN 0.099 8.389 8.290 -0.000 0.000 0.407 130 D N 0.295 120.650 120.400 -0.076 0.000 2.328 130 D HA 0.061 4.701 4.640 -0.001 0.000 0.226 130 D C -0.261 176.032 176.300 -0.012 0.000 1.066 130 D CA 0.250 54.231 54.000 -0.033 0.000 0.861 130 D CB 0.000 40.798 40.800 -0.004 0.000 0.912 130 D HN 0.136 8.506 8.370 -0.000 0.000 0.521 131 K N -0.013 120.351 120.400 -0.060 0.000 3.451 131 K HA -0.153 4.166 4.320 -0.001 0.000 0.273 131 K C 0.623 177.335 176.600 0.187 0.000 0.944 131 K CA 0.339 56.655 56.287 0.049 0.000 0.734 131 K CB -1.466 31.075 32.500 0.068 0.000 1.437 131 K HN 0.231 8.481 8.250 -0.000 0.000 0.454 132 G N 0.534 109.476 108.800 0.236 0.000 2.634 132 G HA2 0.148 4.108 3.960 -0.001 0.000 0.255 132 G HA3 0.148 4.108 3.960 -0.001 0.000 0.255 132 G C 0.485 175.567 174.900 0.302 0.000 1.205 132 G CA -0.417 44.834 45.100 0.252 0.000 0.884 132 G HN 0.434 8.724 8.290 -0.000 0.000 0.549 133 E N -0.833 119.487 120.200 0.199 0.000 2.280 133 E HA 0.142 4.492 4.350 -0.001 0.000 0.197 133 E C 0.243 176.962 176.600 0.199 0.000 0.913 133 E CA 0.168 56.671 56.400 0.171 0.000 0.995 133 E CB 0.262 30.038 29.700 0.127 0.000 0.991 133 E HN 0.249 8.609 8.360 -0.000 0.000 0.484 134 M N 0.849 120.541 119.600 0.153 0.000 2.465 134 M HA 0.499 4.979 4.480 -0.001 0.000 0.316 134 M C -0.791 175.583 176.300 0.123 0.000 1.121 134 M CA -0.662 54.711 55.300 0.122 0.000 0.934 134 M CB 1.974 34.603 32.600 0.049 0.000 1.692 134 M HN -0.104 8.186 8.290 -0.000 0.000 0.444 135 R N 1.102 121.675 120.500 0.123 0.000 2.574 135 R HA 0.541 4.881 4.340 -0.001 0.000 0.288 135 R C -0.681 175.651 176.300 0.053 0.000 1.004 135 R CA -0.273 55.891 56.100 0.107 0.000 0.895 135 R CB 1.135 31.529 30.300 0.158 0.000 1.191 135 R HN 0.685 8.955 8.270 -0.000 0.000 0.444 136 R N 3.755 124.278 120.500 0.039 0.000 3.416 136 R HA -0.315 4.024 4.340 -0.001 0.000 0.263 136 R C -0.508 175.777 176.300 -0.025 0.000 1.053 136 R CA 0.861 56.966 56.100 0.007 0.000 0.705 136 R CB -1.607 28.688 30.300 -0.008 0.000 1.124 136 R HN 0.957 9.227 8.270 -0.000 0.000 0.444 137 N N -0.925 117.763 118.700 -0.019 0.000 2.782 137 N HA -0.178 4.562 4.740 -0.001 0.000 0.251 137 N C -0.478 174.980 175.510 -0.086 0.000 1.101 137 N CA 2.244 55.267 53.050 -0.046 0.000 0.764 137 N CB -0.388 38.075 38.487 -0.039 0.000 1.122 137 N HN 0.780 9.160 8.380 -0.000 0.000 0.561 138 K N -1.588 118.766 120.400 -0.075 0.000 2.548 138 K HA 0.344 4.663 4.320 -0.001 0.000 0.282 138 K C -0.725 175.893 176.600 0.030 0.000 1.006 138 K CA -0.813 55.415 56.287 -0.098 0.000 0.892 138 K CB 0.908 33.361 32.500 -0.078 0.000 1.499 138 K HN -0.068 8.182 8.250 -0.000 0.000 0.433 139 Y N 0.641 121.043 120.300 0.170 0.000 2.712 139 Y HA -0.040 4.513 4.550 0.005 0.000 0.333 139 Y C 0.653 176.713 175.900 0.267 0.000 1.225 139 Y CA -0.652 57.544 58.100 0.160 0.000 1.499 139 Y CB 0.418 38.939 38.460 0.103 0.000 1.288 139 Y HN 0.410 8.690 8.280 -0.000 0.000 0.575 140 C N 4.625 124.146 119.300 0.369 0.000 2.611 140 C HA -0.200 4.259 4.460 -0.001 0.000 0.416 140 C C 2.038 177.242 174.990 0.357 0.000 1.366 140 C CA -0.860 58.390 59.018 0.387 0.000 1.761 140 C CB -0.496 27.479 27.740 0.391 0.000 2.619 140 C HN 1.111 9.341 8.230 -0.000 0.000 0.606 141 W N 2.684 124.155 121.300 0.286 0.000 2.290 141 W HA -0.292 4.371 4.660 0.005 0.000 0.323 141 W C 2.133 178.685 176.519 0.055 0.000 1.260 141 W CA 2.456 59.871 57.345 0.116 0.000 1.266 141 W CB -0.529 29.036 29.460 0.175 0.000 1.149 141 W HN 1.013 9.193 8.180 -0.000 0.000 0.482 142 Y N -0.127 120.222 120.300 0.082 0.000 2.403 142 Y HA -0.120 4.424 4.550 -0.010 0.000 0.291 142 Y C 2.128 177.960 175.900 -0.114 0.000 1.143 142 Y CA 1.565 59.636 58.100 -0.049 0.000 1.257 142 Y CB -1.265 37.233 38.460 0.064 0.000 0.984 142 Y HN -0.099 8.181 8.280 -0.000 0.000 0.550 143 L N 0.172 120.908 121.223 -0.812 0.000 2.313 143 L HA -0.013 4.327 4.340 -0.001 0.000 0.214 143 L C 0.336 176.931 176.870 -0.459 0.000 1.119 143 L CA -0.121 54.290 54.840 -0.715 0.000 0.809 143 L CB -0.265 41.400 42.059 -0.656 0.000 0.933 143 L HN 0.168 8.398 8.230 -0.000 0.000 0.449 144 L N 0.946 121.907 121.223 -0.436 0.000 2.455 144 L HA -0.065 4.274 4.340 -0.001 0.000 0.272 144 L C 1.625 178.292 176.870 -0.337 0.000 1.174 144 L CA 0.688 55.284 54.840 -0.407 0.000 0.869 144 L CB 0.385 42.131 42.059 -0.521 0.000 1.130 144 L HN 0.093 8.323 8.230 -0.000 0.000 0.474 145 K N 2.346 122.587 120.400 -0.265 0.000 2.089 145 K HA -0.227 4.093 4.320 -0.001 0.000 0.210 145 K C 0.579 177.073 176.600 -0.177 0.000 1.048 145 K CA 2.050 58.221 56.287 -0.194 0.000 0.926 145 K CB 0.132 32.540 32.500 -0.153 0.000 0.714 145 K HN 0.660 8.910 8.250 -0.000 0.000 0.448 146 D N 0.181 120.463 120.400 -0.197 0.000 2.355 146 D HA -0.026 4.614 4.640 -0.001 0.000 0.218 146 D C 1.616 177.815 176.300 -0.168 0.000 1.004 146 D CA 0.452 54.360 54.000 -0.153 0.000 0.880 146 D CB 0.584 41.312 40.800 -0.120 0.000 0.911 146 D HN 0.119 8.489 8.370 -0.000 0.000 0.528 147 V N -0.109 119.627 119.914 -0.296 0.000 2.868 147 V HA 0.073 4.193 4.120 -0.001 0.000 0.227 147 V C 0.361 176.336 176.094 -0.198 0.000 1.136 147 V CA 0.051 62.148 62.300 -0.339 0.000 1.206 147 V CB 0.043 31.332 31.823 -0.890 0.000 0.997 147 V HN 0.102 8.292 8.190 -0.000 0.000 0.505 148 E N -0.619 119.456 120.200 -0.209 0.000 9.129 148 E HA -0.216 4.134 4.350 -0.001 0.000 0.468 148 E C 0.731 177.346 176.600 0.024 0.000 1.365 148 E CA 0.479 56.829 56.400 -0.084 0.000 2.372 148 E CB -0.850 28.813 29.700 -0.062 0.000 1.025 148 E HN 0.430 8.790 8.360 -0.000 0.000 0.292 149 T N 0.597 115.214 114.554 0.105 0.000 2.759 149 T HA -0.239 4.111 4.350 -0.001 0.000 0.269 149 T C 1.717 176.475 174.700 0.096 0.000 1.042 149 T CA 1.969 64.157 62.100 0.146 0.000 1.140 149 T CB -0.246 68.698 68.868 0.126 0.000 0.864 149 T HN 0.474 8.714 8.240 -0.000 0.000 0.455 150 K N 1.393 121.829 120.400 0.060 0.000 2.057 150 K HA -0.105 4.215 4.320 -0.001 0.000 0.207 150 K C 1.973 178.618 176.600 0.075 0.000 1.049 150 K CA 1.483 57.801 56.287 0.052 0.000 0.931 150 K CB -0.321 32.193 32.500 0.024 0.000 0.714 150 K HN 0.173 8.423 8.250 -0.000 0.000 0.440 151 N N 1.278 120.021 118.700 0.072 0.000 2.216 151 N HA -0.052 4.688 4.740 -0.001 0.000 0.183 151 N C 1.952 177.617 175.510 0.258 0.000 1.017 151 N CA 1.393 54.521 53.050 0.130 0.000 0.861 151 N CB -0.226 38.321 38.487 0.100 0.000 0.986 151 N HN 0.411 8.791 8.380 -0.000 0.000 0.428 152 A N 0.801 123.770 122.820 0.248 0.000 1.933 152 A HA -0.065 4.254 4.320 -0.001 0.000 0.218 152 A C 2.507 180.256 177.584 0.275 0.000 1.175 152 A CA 1.073 53.334 52.037 0.374 0.000 0.628 152 A CB -0.640 18.580 19.000 0.367 0.000 0.814 152 A HN 0.091 8.241 8.150 -0.000 0.000 0.444 153 V N 0.740 120.765 119.914 0.184 0.000 2.295 153 V HA -0.254 3.866 4.120 -0.001 0.000 0.246 153 V C 2.462 178.648 176.094 0.153 0.000 1.049 153 V CA 2.319 64.700 62.300 0.135 0.000 1.024 153 V CB -1.003 30.875 31.823 0.092 0.000 0.648 153 V HN 0.701 8.891 8.190 -0.000 0.000 0.447 154 N N 0.412 119.214 118.700 0.171 0.000 2.166 154 N HA -0.171 4.568 4.740 -0.001 0.000 0.186 154 N C 1.439 177.094 175.510 0.242 0.000 1.019 154 N CA 1.607 54.769 53.050 0.187 0.000 0.856 154 N CB -0.257 38.337 38.487 0.178 0.000 0.993 154 N HN 0.460 8.840 8.380 -0.000 0.000 0.426 155 D N -0.641 119.942 120.400 0.305 0.000 2.183 155 D HA -0.061 4.578 4.640 -0.001 0.000 0.203 155 D C 2.011 178.414 176.300 0.171 0.000 0.969 155 D CA 0.439 54.638 54.000 0.331 0.000 0.842 155 D CB -0.300 40.785 40.800 0.475 0.000 0.957 155 D HN 0.078 8.448 8.370 -0.000 0.000 0.484 156 V N 0.912 120.919 119.914 0.156 0.000 2.332 156 V HA -0.236 3.883 4.120 -0.001 0.000 0.248 156 V C 2.505 178.665 176.094 0.109 0.000 1.055 156 V CA 1.310 63.668 62.300 0.098 0.000 1.038 156 V CB -0.394 31.488 31.823 0.099 0.000 0.651 156 V HN 0.160 8.350 8.190 -0.000 0.000 0.450 157 L N -1.260 120.046 121.223 0.139 0.000 2.240 157 L HA -0.080 4.259 4.340 -0.001 0.000 0.211 157 L C 2.199 179.172 176.870 0.171 0.000 1.106 157 L CA 0.999 55.943 54.840 0.174 0.000 0.793 157 L CB -0.376 41.775 42.059 0.154 0.000 0.927 157 L HN 0.296 8.526 8.230 -0.000 0.000 0.446 158 L N -0.712 120.596 121.223 0.143 0.000 2.005 158 L HA -0.196 4.144 4.340 -0.001 0.000 0.207 158 L C 2.336 179.184 176.870 -0.036 0.000 1.072 158 L CA 1.605 56.504 54.840 0.099 0.000 0.744 158 L CB -0.223 41.910 42.059 0.124 0.000 0.895 158 L HN 0.094 8.324 8.230 -0.000 0.000 0.433 159 L N -1.545 119.614 121.223 -0.107 0.000 2.013 159 L HA -0.295 4.044 4.340 -0.001 0.000 0.212 159 L C 2.559 179.354 176.870 -0.125 0.000 1.073 159 L CA 1.788 56.480 54.840 -0.247 0.000 0.753 159 L CB -0.877 41.021 42.059 -0.268 0.000 0.890 159 L HN 0.359 8.589 8.230 -0.000 0.000 0.432 160 Y N 0.989 121.218 120.300 -0.119 0.000 2.165 160 Y HA -0.272 4.278 4.550 -0.000 0.000 0.286 160 Y C 2.506 178.421 175.900 0.025 0.000 1.155 160 Y CA 1.708 59.771 58.100 -0.061 0.000 1.164 160 Y CB -0.306 38.155 38.460 0.002 0.000 0.978 160 Y HN 0.223 8.503 8.280 -0.000 0.000 0.513 161 N N -0.479 118.203 118.700 -0.029 0.000 2.409 161 N HA -0.117 4.623 4.740 -0.001 0.000 0.179 161 N C 2.060 177.509 175.510 -0.102 0.000 1.032 161 N CA 1.129 54.166 53.050 -0.023 0.000 0.898 161 N CB -0.265 38.282 38.487 0.101 0.000 0.971 161 N HN 0.516 8.896 8.380 -0.000 0.000 0.441 162 S N 1.073 116.579 115.700 -0.325 0.000 2.399 162 S HA -0.075 4.394 4.470 -0.001 0.000 0.231 162 S C 2.064 176.394 174.600 -0.450 0.000 1.022 162 S CA 0.490 58.238 58.200 -0.753 0.000 0.983 162 S CB -0.531 61.917 63.200 -1.252 0.000 0.803 162 S HN 0.204 8.514 8.310 -0.000 0.000 0.480 163 I N 0.286 120.590 120.570 -0.444 0.000 2.118 163 I HA -0.237 3.932 4.170 -0.001 0.000 0.241 163 I C 2.310 178.035 176.117 -0.654 0.000 1.070 163 I CA 1.969 62.896 61.300 -0.621 0.000 1.327 163 I CB -0.503 36.936 38.000 -0.934 0.000 1.034 163 I HN 0.294 8.504 8.210 -0.000 0.000 0.405 164 Y N 0.148 120.221 120.300 -0.379 0.000 2.395 164 Y HA -0.157 4.392 4.550 -0.001 0.000 0.293 164 Y C 2.447 178.270 175.900 -0.127 0.000 1.123 164 Y CA 0.912 58.848 58.100 -0.274 0.000 1.227 164 Y CB -0.365 37.940 38.460 -0.259 0.000 1.012 164 Y HN 0.015 8.295 8.280 -0.000 0.000 0.552 165 K N 0.879 121.296 120.400 0.028 0.000 2.057 165 K HA -0.100 4.220 4.320 -0.001 0.000 0.206 165 K C 1.753 178.368 176.600 0.025 0.000 1.050 165 K CA 1.258 57.564 56.287 0.032 0.000 0.935 165 K CB -0.570 32.006 32.500 0.127 0.000 0.715 165 K HN 0.282 8.532 8.250 -0.000 0.000 0.439 166 L N -0.140 121.087 121.223 0.006 0.000 2.056 166 L HA -0.176 4.164 4.340 -0.001 0.000 0.207 166 L C 2.363 179.303 176.870 0.118 0.000 1.078 166 L CA 0.912 55.801 54.840 0.083 0.000 0.749 166 L CB -0.371 41.694 42.059 0.009 0.000 0.901 166 L HN 0.061 8.291 8.230 -0.000 0.000 0.433 167 I N -0.554 120.011 120.570 -0.009 0.000 2.226 167 I HA -0.258 3.912 4.170 -0.001 0.000 0.245 167 I C 2.574 178.829 176.117 0.229 0.000 1.100 167 I CA 1.448 62.789 61.300 0.069 0.000 1.374 167 I CB -1.010 36.949 38.000 -0.068 0.000 1.057 167 I HN 0.465 8.675 8.210 -0.000 0.000 0.413 168 E N 0.776 121.105 120.200 0.216 0.000 2.038 168 E HA -0.262 4.087 4.350 -0.001 0.000 0.195 168 E C 2.301 178.860 176.600 -0.068 0.000 1.000 168 E CA 1.963 58.432 56.400 0.115 0.000 0.803 168 E CB -0.227 29.537 29.700 0.106 0.000 0.750 168 E HN 0.635 8.995 8.360 -0.000 0.000 0.448 169 I N -0.267 120.257 120.570 -0.078 0.000 2.151 169 I HA -0.303 3.866 4.170 -0.001 0.000 0.243 169 I C 1.831 177.752 176.117 -0.327 0.000 1.080 169 I CA 1.504 62.651 61.300 -0.255 0.000 1.339 169 I CB -0.239 37.536 38.000 -0.375 0.000 1.039 169 I HN 0.225 8.435 8.210 -0.000 0.000 0.409 170 Y N -1.120 119.182 120.300 0.003 0.000 2.497 170 Y HA 0.170 4.719 4.550 -0.001 0.000 0.265 170 Y C 1.360 177.258 175.900 -0.003 0.000 1.111 170 Y CA 0.146 58.260 58.100 0.023 0.000 1.288 170 Y CB 0.398 38.900 38.460 0.070 0.000 1.082 170 Y HN 0.016 8.296 8.280 -0.000 0.000 0.536 171 L N -1.013 120.267 121.223 0.095 0.000 3.184 171 L HA 0.277 4.616 4.340 -0.001 0.000 0.283 171 L C 1.857 178.595 176.870 -0.221 0.000 1.218 171 L CA 0.167 55.041 54.840 0.057 0.000 1.028 171 L CB 0.013 42.193 42.059 0.202 0.000 1.400 171 L HN -0.046 8.184 8.230 -0.000 0.000 0.591 172 R N 0.703 120.927 120.500 -0.460 0.000 2.117 172 R HA -0.137 4.202 4.340 -0.001 0.000 0.243 172 R C 0.717 176.685 176.300 -0.553 0.000 1.143 172 R CA 1.927 57.496 56.100 -0.884 0.000 0.968 172 R CB 0.036 30.043 30.300 -0.488 0.000 0.863 172 R HN 0.491 8.761 8.270 -0.000 0.000 0.444 173 N N 0.019 118.568 118.700 -0.252 0.000 2.230 173 N HA 0.024 4.763 4.740 -0.001 0.000 0.202 173 N C -0.807 174.678 175.510 -0.042 0.000 1.119 173 N CA -0.253 52.725 53.050 -0.121 0.000 0.851 173 N CB 0.572 39.012 38.487 -0.079 0.000 0.990 173 N HN 0.071 8.451 8.380 -0.000 0.000 0.497 174 E N 0.344 120.534 120.200 -0.016 0.000 2.343 174 E HA 0.051 4.400 4.350 -0.001 0.000 0.269 174 E C 0.864 177.521 176.600 0.095 0.000 1.047 174 E CA -0.018 56.415 56.400 0.055 0.000 0.874 174 E CB 1.339 31.092 29.700 0.088 0.000 1.033 174 E HN 0.202 8.562 8.360 -0.000 0.000 0.409 175 S N 0.247 115.999 115.700 0.086 0.000 2.428 175 S HA -0.138 4.331 4.470 -0.001 0.000 0.230 175 S C 1.927 176.595 174.600 0.113 0.000 1.014 175 S CA 0.957 59.212 58.200 0.092 0.000 0.957 175 S CB -0.628 62.612 63.200 0.067 0.000 0.784 175 S HN 0.686 8.996 8.310 -0.000 0.000 0.499 176 C N -0.541 118.830 119.300 0.118 0.000 2.539 176 C HA 0.312 4.771 4.460 -0.001 0.000 0.271 176 C C 2.100 177.174 174.990 0.140 0.000 1.412 176 C CA -0.491 58.593 59.018 0.109 0.000 1.729 176 C CB -2.411 25.387 27.740 0.097 0.000 1.739 176 C HN 0.513 8.743 8.230 -0.000 0.000 0.570 177 Y N 2.677 123.003 120.300 0.043 0.000 2.069 177 Y HA -0.227 4.322 4.550 -0.001 0.000 0.278 177 Y C 2.339 178.273 175.900 0.057 0.000 1.175 177 Y CA 2.327 60.454 58.100 0.046 0.000 1.134 177 Y CB -0.749 37.733 38.460 0.036 0.000 0.965 177 Y HN 0.250 8.530 8.280 -0.000 0.000 0.498 178 V N 0.652 120.525 119.914 -0.068 0.000 2.307 178 V HA -0.286 3.834 4.120 -0.001 0.000 0.245 178 V C 2.140 178.185 176.094 -0.082 0.000 1.045 178 V CA 2.223 64.434 62.300 -0.148 0.000 1.024 178 V CB -0.700 31.108 31.823 -0.025 0.000 0.651 178 V HN 0.413 8.603 8.190 -0.000 0.000 0.449 179 D N -0.087 120.300 120.400 -0.023 0.000 2.144 179 D HA -0.133 4.507 4.640 -0.001 0.000 0.199 179 D C 2.162 178.465 176.300 0.005 0.000 0.984 179 D CA 1.213 55.204 54.000 -0.015 0.000 0.834 179 D CB -0.204 40.583 40.800 -0.023 0.000 0.955 179 D HN 0.337 8.707 8.370 -0.000 0.000 0.465 180 V N 2.224 122.153 119.914 0.026 0.000 2.307 180 V HA -0.209 3.911 4.120 -0.001 0.000 0.245 180 V C 2.580 178.794 176.094 0.200 0.000 1.045 180 V CA 1.387 63.750 62.300 0.105 0.000 1.024 180 V CB -0.510 31.390 31.823 0.129 0.000 0.651 180 V HN 0.268 8.458 8.190 -0.000 0.000 0.449 181 I N -0.483 120.121 120.570 0.056 0.000 2.394 181 I HA -0.066 4.104 4.170 -0.001 0.000 0.251 181 I C 2.451 178.700 176.117 0.221 0.000 1.136 181 I CA 1.658 63.046 61.300 0.147 0.000 1.425 181 I CB -0.875 37.110 38.000 -0.025 0.000 1.079 181 I HN 0.158 8.368 8.210 -0.000 0.000 0.425 182 A N 1.865 124.744 122.820 0.099 0.000 1.933 182 A HA -0.139 4.181 4.320 -0.001 0.000 0.218 182 A C 2.362 180.031 177.584 0.142 0.000 1.175 182 A CA 2.496 54.592 52.037 0.097 0.000 0.628 182 A CB -1.271 17.752 19.000 0.038 0.000 0.814 182 A HN 0.533 8.683 8.150 -0.000 0.000 0.444 183 T N -0.614 114.016 114.554 0.126 0.000 2.746 183 T HA -0.107 4.242 4.350 -0.001 0.000 0.267 183 T C 1.546 176.309 174.700 0.104 0.000 1.039 183 T CA 1.549 63.698 62.100 0.082 0.000 1.142 183 T CB -0.446 68.390 68.868 -0.054 0.000 0.866 183 T HN 0.404 8.644 8.240 -0.000 0.000 0.444 184 F N 1.226 121.244 119.950 0.113 0.000 2.102 184 F HA -0.030 4.497 4.527 -0.001 0.000 0.298 184 F C 2.745 178.712 175.800 0.278 0.000 1.105 184 F CA 1.160 59.252 58.000 0.154 0.000 1.239 184 F CB -0.265 38.744 39.000 0.015 0.000 0.991 184 F HN -0.085 8.215 8.300 -0.000 0.000 0.474 185 R N 0.556 121.344 120.500 0.482 0.000 2.083 185 R HA -0.162 4.178 4.340 -0.001 0.000 0.237 185 R C 1.858 178.307 176.300 0.249 0.000 1.137 185 R CA 1.993 58.311 56.100 0.363 0.000 0.951 185 R CB -0.596 29.831 30.300 0.211 0.000 0.851 185 R HN 0.155 8.425 8.270 -0.000 0.000 0.434 186 D N -0.449 120.065 120.400 0.189 0.000 2.144 186 D HA -0.070 4.570 4.640 -0.001 0.000 0.200 186 D C 1.670 178.035 176.300 0.108 0.000 0.978 186 D CA 1.489 55.559 54.000 0.116 0.000 0.833 186 D CB -0.312 40.545 40.800 0.095 0.000 0.961 186 D HN 0.317 8.687 8.370 -0.000 0.000 0.470 187 A N 0.262 123.199 122.820 0.194 0.000 1.930 187 A HA -0.139 4.181 4.320 -0.001 0.000 0.217 187 A C 2.325 180.072 177.584 0.271 0.000 1.175 187 A CA 1.850 54.036 52.037 0.250 0.000 0.627 187 A CB -0.807 18.376 19.000 0.305 0.000 0.815 187 A HN 0.193 8.343 8.150 -0.000 0.000 0.443 188 T N 0.427 115.167 114.554 0.310 0.000 2.737 188 T HA -0.072 4.278 4.350 -0.001 0.000 0.265 188 T C 1.819 176.628 174.700 0.180 0.000 1.038 188 T CA 1.419 63.719 62.100 0.334 0.000 1.144 188 T CB -0.379 68.728 68.868 0.397 0.000 0.866 188 T HN 0.356 8.596 8.240 -0.000 0.000 0.434 189 L N 0.420 121.721 121.223 0.131 0.000 2.042 189 L HA -0.146 4.194 4.340 -0.001 0.000 0.210 189 L C 2.662 179.554 176.870 0.037 0.000 1.076 189 L CA 1.491 56.366 54.840 0.059 0.000 0.749 189 L CB -0.393 41.691 42.059 0.042 0.000 0.893 189 L HN 0.206 8.436 8.230 -0.000 0.000 0.432 190 K N -0.829 119.590 120.400 0.031 0.000 2.057 190 K HA -0.135 4.185 4.320 -0.001 0.000 0.207 190 K C 2.049 178.711 176.600 0.104 0.000 1.049 190 K CA 1.816 58.133 56.287 0.050 0.000 0.931 190 K CB -0.196 32.208 32.500 -0.160 0.000 0.714 190 K HN 0.301 8.551 8.250 -0.000 0.000 0.440 191 T N 1.550 116.152 114.554 0.080 0.000 2.746 191 T HA -0.100 4.249 4.350 -0.001 0.000 0.267 191 T C 1.856 176.502 174.700 -0.090 0.000 1.039 191 T CA 1.136 63.213 62.100 -0.039 0.000 1.142 191 T CB -0.206 68.510 68.868 -0.253 0.000 0.866 191 T HN 0.131 8.371 8.240 -0.000 0.000 0.444 192 I N 0.866 121.413 120.570 -0.038 0.000 2.208 192 I HA -0.171 3.999 4.170 -0.001 0.000 0.245 192 I C 2.194 178.312 176.117 0.001 0.000 1.097 192 I CA 1.026 62.310 61.300 -0.026 0.000 1.363 192 I CB -0.416 37.577 38.000 -0.011 0.000 1.051 192 I HN 0.184 8.394 8.210 -0.000 0.000 0.413 193 I N 0.892 121.463 120.570 0.003 0.000 2.252 193 I HA -0.157 4.013 4.170 -0.001 0.000 0.245 193 I C 2.720 178.850 176.117 0.021 0.000 1.102 193 I CA 1.719 63.015 61.300 -0.007 0.000 1.385 193 I CB -2.075 35.883 38.000 -0.071 0.000 1.064 193 I HN 0.228 8.438 8.210 -0.000 0.000 0.414 194 G N 0.096 108.921 108.800 0.041 0.000 2.418 194 G HA2 -0.330 3.630 3.960 -0.001 0.000 0.217 194 G HA3 -0.330 3.630 3.960 -0.001 0.000 0.217 194 G C 1.592 176.484 174.900 -0.014 0.000 1.158 194 G CA 0.929 46.056 45.100 0.046 0.000 0.771 194 G HN 0.352 8.642 8.290 -0.000 0.000 0.545 195 Q N 0.129 119.908 119.800 -0.035 0.000 2.096 195 Q HA -0.179 4.161 4.340 -0.001 0.000 0.204 195 Q C 2.147 178.120 176.000 -0.045 0.000 0.982 195 Q CA 2.278 58.044 55.803 -0.062 0.000 0.850 195 Q CB -0.651 28.032 28.738 -0.091 0.000 0.901 195 Q HN 0.739 9.009 8.270 -0.000 0.000 0.422 196 H N -0.646 118.371 119.070 -0.088 0.000 2.319 196 H HA -0.079 4.476 4.556 -0.001 0.000 0.299 196 H C 1.664 176.900 175.328 -0.152 0.000 1.092 196 H CA 2.074 58.069 56.048 -0.088 0.000 1.302 196 H CB -0.167 29.567 29.762 -0.047 0.000 1.373 196 H HN 0.309 8.589 8.280 -0.000 0.000 0.497 197 L N -0.234 120.932 121.223 -0.095 0.000 2.083 197 L HA -0.138 4.202 4.340 -0.001 0.000 0.209 197 L C 2.210 178.893 176.870 -0.311 0.000 1.083 197 L CA 1.463 56.167 54.840 -0.226 0.000 0.752 197 L CB -0.418 41.585 42.059 -0.093 0.000 0.899 197 L HN 0.360 8.590 8.230 -0.000 0.000 0.433 198 D N -0.387 119.882 120.400 -0.218 0.000 2.144 198 D HA -0.141 4.498 4.640 -0.001 0.000 0.200 198 D C 2.057 178.213 176.300 -0.240 0.000 0.978 198 D CA 1.305 55.180 54.000 -0.207 0.000 0.833 198 D CB 0.192 40.917 40.800 -0.125 0.000 0.961 198 D HN 0.138 8.508 8.370 -0.000 0.000 0.470 199 T N -0.369 114.033 114.554 -0.252 0.000 2.942 199 T HA 0.004 4.354 4.350 -0.001 0.000 0.265 199 T C 1.251 175.769 174.700 -0.303 0.000 1.062 199 T CA 0.727 62.685 62.100 -0.236 0.000 1.139 199 T CB 0.052 68.796 68.868 -0.206 0.000 0.883 199 T HN 0.162 8.402 8.240 -0.000 0.000 0.468 200 N N 0.139 118.545 118.700 -0.489 0.000 2.171 200 N HA 0.157 4.897 4.740 -0.001 0.000 0.212 200 N C 1.421 176.496 175.510 -0.725 0.000 1.184 200 N CA 0.017 52.718 53.050 -0.581 0.000 0.888 200 N CB 0.307 38.323 38.487 -0.785 0.000 1.038 200 N HN 0.178 8.558 8.380 -0.000 0.000 0.517 201 I N 0.213 120.393 120.570 -0.652 0.000 2.567 201 I HA -0.069 4.100 4.170 -0.001 0.000 0.257 201 I C 0.967 176.957 176.117 -0.211 0.000 1.184 201 I CA 1.113 62.081 61.300 -0.554 0.000 1.451 201 I CB -0.910 36.772 38.000 -0.530 0.000 1.089 201 I HN 0.036 8.246 8.210 -0.000 0.000 0.441 202 F N 0.870 120.734 119.950 -0.144 0.000 2.721 202 F HA 0.369 4.894 4.527 -0.003 0.000 0.301 202 F C 1.719 177.500 175.800 -0.031 0.000 1.096 202 F CA -0.050 57.912 58.000 -0.063 0.000 1.308 202 F CB -1.006 37.970 39.000 -0.040 0.000 1.086 202 F HN 0.227 8.527 8.300 -0.000 0.000 0.587 203 S N -0.880 114.886 115.700 0.111 0.000 2.579 203 S HA -0.060 4.409 4.470 -0.001 0.000 0.275 203 S C 1.166 175.847 174.600 0.134 0.000 1.345 203 S CA 0.161 58.416 58.200 0.092 0.000 1.031 203 S CB 1.102 64.322 63.200 0.034 0.000 0.892 203 S HN 0.193 8.503 8.310 -0.000 0.000 0.529 204 D N 1.151 121.610 120.400 0.099 0.000 2.309 204 D HA -0.105 4.535 4.640 -0.001 0.000 0.212 204 D C 1.890 178.250 176.300 0.099 0.000 0.968 204 D CA 1.470 55.521 54.000 0.085 0.000 0.882 204 D CB -0.399 40.434 40.800 0.055 0.000 0.918 204 D HN 0.847 9.217 8.370 -0.000 0.000 0.503 205 K N -1.585 118.895 120.400 0.133 0.000 2.217 205 K HA -0.097 4.222 4.320 -0.001 0.000 0.202 205 K C 1.691 178.368 176.600 0.128 0.000 1.051 205 K CA 1.050 57.413 56.287 0.128 0.000 0.952 205 K CB -0.414 32.179 32.500 0.155 0.000 0.736 205 K HN 0.396 8.646 8.250 -0.000 0.000 0.453 206 Y N 1.810 122.126 120.300 0.026 0.000 2.523 206 Y HA 0.153 4.703 4.550 -0.001 0.000 0.279 206 Y C 0.345 176.264 175.900 0.032 0.000 1.139 206 Y CA -0.266 57.851 58.100 0.028 0.000 1.296 206 Y CB 0.784 39.258 38.460 0.023 0.000 1.045 206 Y HN -0.060 8.220 8.280 -0.000 0.000 0.538 207 S N 1.853 117.642 115.700 0.149 0.000 2.416 207 S HA 0.390 4.859 4.470 -0.001 0.000 0.302 207 S C 0.260 174.885 174.600 0.041 0.000 1.120 207 S CA 0.303 58.555 58.200 0.088 0.000 1.067 207 S CB -1.031 62.213 63.200 0.074 0.000 1.057 207 S HN 0.593 8.903 8.310 -0.000 0.000 0.518 213 I N 1.648 122.223 120.570 0.008 0.000 2.588 213 I HA 0.004 4.173 4.170 -0.001 0.000 0.283 213 I C 0.579 176.705 176.117 0.016 0.000 1.119 213 I CA 0.327 61.639 61.300 0.020 0.000 1.419 213 I CB 0.160 38.178 38.000 0.029 0.000 1.394 213 I HN 0.215 8.425 8.210 -0.000 0.000 0.562 214 D N 5.635 126.046 120.400 0.019 0.000 2.411 214 D HA 0.138 4.778 4.640 -0.001 0.000 0.225 214 D C 0.817 177.127 176.300 0.015 0.000 1.156 214 D CA -0.277 53.732 54.000 0.015 0.000 0.874 214 D CB 1.118 41.927 40.800 0.015 0.000 1.034 214 D HN 0.329 8.699 8.370 -0.000 0.000 0.502 215 V N 1.591 121.512 119.914 0.013 0.000 3.573 215 V HA 0.131 4.250 4.120 -0.001 0.000 0.270 215 V C 0.825 176.925 176.094 0.010 0.000 1.221 215 V CA 0.378 62.685 62.300 0.012 0.000 1.163 215 V CB -0.397 31.432 31.823 0.010 0.000 0.847 215 V HN 0.353 8.543 8.190 -0.000 0.000 0.468 216 N N 1.006 119.712 118.700 0.010 0.000 2.220 216 N HA 0.104 4.843 4.740 -0.001 0.000 0.195 216 N C 0.269 175.784 175.510 0.009 0.000 1.123 216 N CA 0.179 53.234 53.050 0.008 0.000 0.874 216 N CB 0.097 38.588 38.487 0.007 0.000 0.995 216 N HN 0.521 8.901 8.380 -0.000 0.000 0.498 217 N N 1.717 120.424 118.700 0.011 0.000 2.500 217 N HA 0.160 4.900 4.740 -0.001 0.000 0.236 217 N C 0.471 175.988 175.510 0.012 0.000 1.022 217 N CA -0.274 52.783 53.050 0.011 0.000 0.935 217 N CB 0.309 38.804 38.487 0.013 0.000 1.147 217 N HN 0.171 8.551 8.380 -0.000 0.000 0.512 218 I N -0.299 120.277 120.570 0.010 0.000 4.081 218 I HA 0.501 4.671 4.170 -0.001 0.000 0.333 218 I C 0.589 176.712 176.117 0.009 0.000 1.413 218 I CA -0.172 61.135 61.300 0.010 0.000 1.110 218 I CB 0.273 38.279 38.000 0.009 0.000 1.082 218 I HN 0.174 8.384 8.210 -0.000 0.000 0.402 219 N N 0.522 119.227 118.700 0.008 0.000 2.419 219 N HA 0.197 4.937 4.740 -0.001 0.000 0.216 219 N C -0.012 175.503 175.510 0.007 0.000 1.118 219 N CA 0.454 53.508 53.050 0.007 0.000 0.850 219 N CB 1.040 39.531 38.487 0.006 0.000 1.292 219 N HN 0.130 8.510 8.380 -0.000 0.000 0.467 220 V N 4.055 123.974 119.914 0.008 0.000 2.304 220 V HA 0.425 4.545 4.120 -0.001 0.000 0.269 220 V C -2.208 173.892 176.094 0.010 0.000 1.036 220 V CA -1.367 60.938 62.300 0.008 0.000 0.840 220 V CB 0.711 32.539 31.823 0.008 0.000 1.036 220 V HN 0.146 8.336 8.190 -0.000 0.000 0.466 221 P HA 0.248 4.668 4.420 -0.000 0.000 0.281 221 P C -0.215 177.093 177.300 0.012 0.000 1.252 221 P CA -0.373 62.733 63.100 0.011 0.000 0.778 221 P CB 0.822 32.527 31.700 0.009 0.000 0.895 222 E N 0.625 120.835 120.200 0.015 0.000 2.316 222 E HA 0.380 4.730 4.350 -0.001 0.000 0.275 222 E C 0.105 176.715 176.600 0.017 0.000 1.029 222 E CA -0.779 55.632 56.400 0.018 0.000 0.871 222 E CB 0.085 29.800 29.700 0.025 0.000 1.022 222 E HN 0.524 8.884 8.360 -0.000 0.000 0.418 223 Q N 3.767 123.576 119.800 0.015 0.000 2.304 223 Q HA 0.260 4.600 4.340 -0.001 0.000 0.260 223 Q C -2.343 173.668 176.000 0.019 0.000 0.965 223 Q CA -1.827 53.983 55.803 0.012 0.000 0.898 223 Q CB -0.468 28.274 28.738 0.007 0.000 1.196 223 Q HN 0.546 8.816 8.270 -0.000 0.000 0.402 224 P HA 0.385 4.805 4.420 -0.000 0.000 0.267 224 P C -0.945 176.373 177.300 0.029 0.000 1.209 224 P CA -0.124 62.999 63.100 0.039 0.000 0.763 224 P CB 0.993 32.717 31.700 0.039 0.000 0.816 225 V N 4.129 124.057 119.914 0.023 0.000 3.114 225 V HA 0.430 4.549 4.120 -0.001 0.000 0.308 225 V C -0.465 175.515 176.094 -0.191 0.000 1.168 225 V CA -0.926 61.346 62.300 -0.046 0.000 1.015 225 V CB 2.641 34.438 31.823 -0.043 0.000 1.050 225 V HN 0.224 8.414 8.190 -0.000 0.000 0.433 226 I N 2.913 123.268 120.570 -0.358 0.000 2.519 226 I HA 0.391 4.560 4.170 -0.001 0.000 0.287 226 I C -0.134 175.593 176.117 -0.651 0.000 1.047 226 I CA -0.448 60.317 61.300 -0.892 0.000 1.381 226 I CB 1.330 38.918 38.000 -0.686 0.000 1.417 226 I HN 0.867 9.077 8.210 -0.000 0.000 0.540 227 D N 3.567 123.487 120.400 -0.800 0.000 2.441 227 D HA 0.278 4.917 4.640 -0.001 0.000 0.231 227 D C 0.968 177.130 176.300 -0.231 0.000 1.073 227 D CA -0.517 53.331 54.000 -0.253 0.000 0.850 227 D CB 1.440 42.269 40.800 0.048 0.000 1.062 227 D HN 0.393 8.763 8.370 -0.000 0.000 0.524 228 I N 1.348 121.780 120.570 -0.229 0.000 2.454 228 I HA -0.091 4.079 4.170 -0.001 0.000 0.254 228 I C 1.312 177.323 176.117 -0.177 0.000 1.156 228 I CA 0.741 61.863 61.300 -0.296 0.000 1.433 228 I CB -1.210 36.720 38.000 -0.117 0.000 1.082 228 I HN 0.336 8.546 8.210 -0.000 0.000 0.432 229 N N 0.458 119.122 118.700 -0.061 0.000 2.453 229 N HA 0.016 4.756 4.740 -0.001 0.000 0.183 229 N C 1.479 176.996 175.510 0.012 0.000 1.041 229 N CA 1.254 54.298 53.050 -0.010 0.000 0.900 229 N CB -0.265 38.233 38.487 0.018 0.000 0.961 229 N HN 0.457 8.837 8.380 -0.000 0.000 0.443 230 M N -0.025 119.602 119.600 0.044 0.000 2.465 230 M HA 0.173 4.653 4.480 -0.001 0.000 0.249 230 M C 0.370 176.702 176.300 0.053 0.000 1.130 230 M CA 0.048 55.405 55.300 0.096 0.000 1.067 230 M CB -0.199 32.528 32.600 0.211 0.000 1.394 230 M HN -0.194 8.096 8.290 -0.000 0.000 0.483 231 I N 3.019 123.551 120.570 -0.064 0.000 2.268 231 I HA 0.127 4.296 4.170 -0.001 0.000 0.298 231 I C -0.134 175.891 176.117 -0.153 0.000 1.185 231 I CA -0.642 60.544 61.300 -0.191 0.000 1.548 231 I CB -2.252 35.385 38.000 -0.606 0.000 1.492 231 I HN 0.494 8.704 8.210 -0.000 0.000 0.711 232 N N 0.391 119.057 118.700 -0.056 0.000 2.598 232 N HA 0.510 5.250 4.740 -0.001 0.000 0.263 232 N C 0.438 175.969 175.510 0.035 0.000 1.254 232 N CA -0.354 52.681 53.050 -0.025 0.000 0.863 232 N CB 0.764 39.251 38.487 0.000 0.000 1.586 232 N HN 0.045 8.425 8.380 -0.000 0.000 0.491 233 F N -0.073 119.900 119.950 0.039 0.000 2.269 233 F HA 0.173 4.700 4.527 -0.001 0.000 0.301 233 F C 2.022 177.933 175.800 0.184 0.000 1.082 233 F CA 1.499 59.578 58.000 0.131 0.000 1.360 233 F CB -1.270 37.801 39.000 0.117 0.000 1.041 233 F HN 0.720 9.020 8.300 -0.000 0.000 0.512 234 G N -0.207 108.665 108.800 0.120 0.000 2.421 234 G HA2 -0.112 3.848 3.960 -0.001 0.000 0.216 234 G HA3 -0.112 3.848 3.960 -0.001 0.000 0.216 234 G C 1.832 176.798 174.900 0.110 0.000 1.171 234 G CA 1.476 46.641 45.100 0.108 0.000 0.775 234 G HN 0.425 8.715 8.290 -0.000 0.000 0.543 235 V N -0.144 119.831 119.914 0.101 0.000 2.358 235 V HA -0.170 3.949 4.120 -0.001 0.000 0.246 235 V C 2.284 178.436 176.094 0.097 0.000 1.047 235 V CA 1.708 64.057 62.300 0.081 0.000 1.035 235 V CB -0.755 31.102 31.823 0.056 0.000 0.658 235 V HN 0.464 8.654 8.190 -0.000 0.000 0.452 236 Y N 1.236 121.545 120.300 0.014 0.000 2.165 236 Y HA -0.272 4.277 4.550 -0.001 0.000 0.286 236 Y C 2.519 178.461 175.900 0.070 0.000 1.155 236 Y CA 1.966 60.082 58.100 0.028 0.000 1.164 236 Y CB -0.181 38.305 38.460 0.043 0.000 0.978 236 Y HN 0.151 8.431 8.280 -0.000 0.000 0.513 237 K N 0.084 120.559 120.400 0.125 0.000 2.057 237 K HA -0.182 4.137 4.320 -0.001 0.000 0.206 237 K C 1.963 178.593 176.600 0.050 0.000 1.050 237 K CA 1.446 57.773 56.287 0.067 0.000 0.935 237 K CB -0.341 32.246 32.500 0.146 0.000 0.715 237 K HN 0.503 8.753 8.250 -0.000 0.000 0.439 238 N N 0.400 119.152 118.700 0.086 0.000 2.021 238 N HA -0.233 4.507 4.740 -0.001 0.000 0.198 238 N C 1.916 177.518 175.510 0.153 0.000 1.041 238 N CA 1.883 55.015 53.050 0.137 0.000 0.862 238 N CB -0.203 38.328 38.487 0.073 0.000 1.048 238 N HN -0.030 8.350 8.380 -0.000 0.000 0.427 239 I N 0.329 120.902 120.570 0.004 0.000 2.113 239 I HA -0.149 4.020 4.170 -0.001 0.000 0.238 239 I C 2.462 178.558 176.117 -0.036 0.000 1.070 239 I CA 0.804 62.078 61.300 -0.044 0.000 1.332 239 I CB -1.133 36.780 38.000 -0.144 0.000 1.044 239 I HN 0.110 8.320 8.210 -0.000 0.000 0.402 240 V N 0.226 120.030 119.914 -0.184 0.000 2.343 240 V HA -0.263 3.856 4.120 -0.001 0.000 0.247 240 V C 2.380 178.478 176.094 0.006 0.000 1.051 240 V CA 2.260 64.463 62.300 -0.162 0.000 1.036 240 V CB -0.555 31.039 31.823 -0.381 0.000 0.654 240 V HN 0.459 8.649 8.190 -0.000 0.000 0.451 241 I N -0.744 119.843 120.570 0.028 0.000 2.226 241 I HA -0.277 3.892 4.170 -0.001 0.000 0.245 241 I C 2.412 178.572 176.117 0.072 0.000 1.100 241 I CA 1.803 63.115 61.300 0.020 0.000 1.374 241 I CB -0.412 37.579 38.000 -0.015 0.000 1.057 241 I HN 0.400 8.610 8.210 -0.000 0.000 0.413 242 H N -0.042 119.115 119.070 0.146 0.000 2.372 242 H HA -0.103 4.452 4.556 -0.001 0.000 0.301 242 H C 2.195 177.603 175.328 0.134 0.000 1.065 242 H CA 1.284 57.429 56.048 0.161 0.000 1.364 242 H CB -0.014 29.783 29.762 0.059 0.000 1.406 242 H HN 0.134 8.414 8.280 -0.000 0.000 0.521 243 K N -0.226 120.281 120.400 0.179 0.000 2.097 243 K HA -0.091 4.229 4.320 -0.001 0.000 0.205 243 K C 1.013 177.731 176.600 0.197 0.000 1.050 243 K CA 1.869 58.216 56.287 0.100 0.000 0.938 243 K CB 0.284 32.804 32.500 0.034 0.000 0.718 243 K HN 0.250 8.500 8.250 -0.000 0.000 0.442 244 T N -0.847 113.831 114.554 0.206 0.000 3.138 244 T HA 0.212 4.561 4.350 -0.001 0.000 0.245 244 T C 1.737 176.482 174.700 0.074 0.000 0.982 244 T CA 0.300 62.509 62.100 0.182 0.000 1.134 244 T CB -0.006 68.991 68.868 0.214 0.000 1.032 244 T HN 0.233 8.473 8.240 -0.000 0.000 0.442 245 A N 0.640 123.528 122.820 0.113 0.000 1.940 245 A HA -0.078 4.242 4.320 -0.001 0.000 0.219 245 A C 1.981 179.557 177.584 -0.013 0.000 1.176 245 A CA 1.540 53.611 52.037 0.056 0.000 0.631 245 A CB -0.985 17.940 19.000 -0.125 0.000 0.814 245 A HN 0.560 8.710 8.150 -0.000 0.000 0.446 246 Y N -1.446 118.909 120.300 0.091 0.000 2.206 246 Y HA -0.156 4.393 4.550 -0.001 0.000 0.292 246 Y C 2.421 178.439 175.900 0.196 0.000 1.123 246 Y CA 1.870 60.062 58.100 0.154 0.000 1.142 246 Y CB -0.585 37.935 38.460 0.099 0.000 1.006 246 Y HN 0.620 8.899 8.280 -0.000 0.000 0.518 247 Y N -2.257 118.171 120.300 0.213 0.000 2.420 247 Y HA 0.063 4.613 4.550 0.000 0.000 0.292 247 Y C 1.998 177.874 175.900 -0.040 0.000 1.119 247 Y CA 0.947 59.129 58.100 0.137 0.000 1.229 247 Y CB -0.674 37.967 38.460 0.303 0.000 1.026 247 Y HN -0.129 8.151 8.280 -0.000 0.000 0.554 248 S N -0.294 114.921 115.700 -0.809 0.000 2.439 248 S HA 0.126 4.595 4.470 -0.001 0.000 0.224 248 S C 0.939 174.862 174.600 -1.129 0.000 1.029 248 S CA 1.026 58.522 58.200 -1.172 0.000 0.946 248 S CB -0.222 62.113 63.200 -1.442 0.000 0.797 248 S HN 0.499 8.809 8.310 -0.000 0.000 0.504 249 F N -1.188 118.602 119.950 -0.267 0.000 2.495 249 F HA 0.372 4.898 4.527 -0.001 0.000 0.272 249 F C 1.587 177.331 175.800 -0.093 0.000 0.919 249 F CA -0.652 57.236 58.000 -0.187 0.000 1.178 249 F CB -0.700 38.191 39.000 -0.181 0.000 1.030 249 F HN 0.066 8.366 8.300 -0.000 0.000 0.777 250 F N 1.379 121.315 119.950 -0.023 0.000 2.046 250 F HA -0.214 4.312 4.527 -0.001 0.000 0.297 250 F C 2.288 178.075 175.800 -0.023 0.000 1.123 250 F CA 1.522 59.501 58.000 -0.034 0.000 1.199 250 F CB -0.719 38.243 39.000 -0.064 0.000 0.972 250 F HN -0.035 8.265 8.300 -0.000 0.000 0.474 251 L N 1.705 122.902 121.223 -0.044 0.000 1.971 251 L HA -0.144 4.196 4.340 -0.001 0.000 0.215 251 L C -0.706 175.978 176.870 -0.310 0.000 1.072 251 L CA 2.440 57.138 54.840 -0.237 0.000 0.758 251 L CB -2.136 39.809 42.059 -0.189 0.000 0.889 251 L HN 0.049 8.279 8.230 -0.000 0.000 0.433 252 P HA -0.192 4.228 4.420 -0.000 0.000 0.215 252 P C 2.136 179.338 177.300 -0.163 0.000 1.153 252 P CA 1.994 64.968 63.100 -0.210 0.000 0.853 252 P CB -0.151 31.416 31.700 -0.222 0.000 0.788 253 I N -0.804 119.673 120.570 -0.154 0.000 2.179 253 I HA -0.188 3.982 4.170 -0.001 0.000 0.242 253 I C 2.545 178.577 176.117 -0.141 0.000 1.088 253 I CA 1.230 62.455 61.300 -0.125 0.000 1.357 253 I CB -0.903 37.037 38.000 -0.099 0.000 1.051 253 I HN -0.204 8.006 8.210 -0.000 0.000 0.409 254 V N 0.164 119.929 119.914 -0.248 0.000 2.343 254 V HA -0.310 3.809 4.120 -0.001 0.000 0.247 254 V C 2.638 178.686 176.094 -0.076 0.000 1.051 254 V CA 1.763 63.954 62.300 -0.181 0.000 1.036 254 V CB -0.626 30.890 31.823 -0.512 0.000 0.654 254 V HN 0.577 8.767 8.190 -0.000 0.000 0.451 255 C N 0.747 119.969 119.300 -0.130 0.000 2.393 255 C HA -0.147 4.312 4.460 -0.001 0.000 0.276 255 C C 2.969 177.964 174.990 0.009 0.000 1.215 255 C CA 1.097 60.082 59.018 -0.056 0.000 1.743 255 C CB -1.700 25.992 27.740 -0.080 0.000 2.044 255 C HN 0.690 8.920 8.230 -0.000 0.000 0.464 256 G N -0.026 108.783 108.800 0.016 0.000 2.446 256 G HA2 -0.254 3.705 3.960 -0.001 0.000 0.217 256 G HA3 -0.254 3.705 3.960 -0.001 0.000 0.217 256 G C 1.576 176.574 174.900 0.164 0.000 1.168 256 G CA 1.077 46.247 45.100 0.117 0.000 0.771 256 G HN 0.533 8.823 8.290 -0.000 0.000 0.551 257 M N -0.594 119.052 119.600 0.077 0.000 2.200 257 M HA 0.092 4.572 4.480 -0.001 0.000 0.265 257 M C 2.424 178.817 176.300 0.156 0.000 1.066 257 M CA 0.589 55.927 55.300 0.064 0.000 1.127 257 M CB -0.300 32.265 32.600 -0.057 0.000 1.379 257 M HN 0.153 8.443 8.290 -0.000 0.000 0.420 258 L N 0.393 121.722 121.223 0.177 0.000 1.989 258 L HA -0.181 4.159 4.340 -0.001 0.000 0.211 258 L C 2.288 179.241 176.870 0.138 0.000 1.071 258 L CA 1.723 56.656 54.840 0.155 0.000 0.749 258 L CB -1.033 41.075 42.059 0.081 0.000 0.890 258 L HN 0.225 8.455 8.230 -0.000 0.000 0.431 259 L N -0.532 120.771 121.223 0.134 0.000 2.131 259 L HA -0.119 4.220 4.340 -0.001 0.000 0.210 259 L C 2.449 179.499 176.870 0.301 0.000 1.092 259 L CA 1.945 56.873 54.840 0.148 0.000 0.759 259 L CB -1.044 41.004 42.059 -0.018 0.000 0.903 259 L HN 0.277 8.507 8.230 -0.000 0.000 0.435 260 A N -1.016 121.997 122.820 0.320 0.000 1.969 260 A HA 0.226 4.546 4.320 -0.001 0.000 0.218 260 A C 1.748 179.384 177.584 0.087 0.000 1.169 260 A CA 1.239 53.369 52.037 0.156 0.000 0.635 260 A CB -0.790 18.232 19.000 0.037 0.000 0.810 260 A HN 0.882 9.032 8.150 -0.000 0.000 0.445 261 G N -2.548 106.317 108.800 0.109 0.000 2.155 261 G HA2 -0.100 3.859 3.960 -0.001 0.000 0.135 261 G HA3 -0.100 3.859 3.960 -0.001 0.000 0.135 261 G C -0.039 174.918 174.900 0.094 0.000 1.023 261 G CA -0.143 45.011 45.100 0.090 0.000 0.688 261 G HN 0.707 8.997 8.290 -0.000 0.000 0.499 262 I N 1.533 122.175 120.570 0.120 0.000 2.363 262 I HA 0.668 4.838 4.170 -0.001 0.000 0.292 262 I C 1.260 177.534 176.117 0.263 0.000 1.075 262 I CA -0.771 60.612 61.300 0.139 0.000 1.333 262 I CB -0.004 38.017 38.000 0.034 0.000 1.415 262 I HN 1.013 9.223 8.210 -0.000 0.000 0.502 263 A N 5.062 128.004 122.820 0.203 0.000 2.511 263 A HA 0.352 4.672 4.320 -0.001 0.000 0.242 263 A C 1.372 179.118 177.584 0.269 0.000 1.069 263 A CA -0.337 51.809 52.037 0.182 0.000 0.763 263 A CB 0.231 19.301 19.000 0.116 0.000 1.001 263 A HN 0.985 9.135 8.150 -0.000 0.000 0.498 264 V N 1.903 121.869 119.914 0.087 0.000 3.026 264 V HA -0.151 3.969 4.120 -0.001 0.000 0.265 264 V C 2.270 178.385 176.094 0.035 0.000 1.121 264 V CA 2.363 64.581 62.300 -0.138 0.000 1.142 264 V CB -1.930 29.754 31.823 -0.231 0.000 0.730 264 V HN 0.975 9.165 8.190 -0.000 0.000 0.503 265 D N -0.320 120.142 120.400 0.105 0.000 2.363 265 D HA -0.032 4.608 4.640 -0.001 0.000 0.220 265 D C 1.083 177.478 176.300 0.158 0.000 0.994 265 D CA 0.186 54.251 54.000 0.108 0.000 0.890 265 D CB -0.296 40.549 40.800 0.076 0.000 0.906 265 D HN 0.447 8.817 8.370 -0.000 0.000 0.530 266 N N 0.180 119.026 118.700 0.242 0.000 2.492 266 N HA 0.091 4.831 4.740 -0.001 0.000 0.260 266 N C 0.911 176.538 175.510 0.196 0.000 1.215 266 N CA -0.301 52.867 53.050 0.197 0.000 0.923 266 N CB 1.569 40.149 38.487 0.155 0.000 1.092 266 N HN 0.170 8.550 8.380 -0.000 0.000 0.448 267 L N 4.572 125.862 121.223 0.112 0.000 2.275 267 L HA -0.128 4.212 4.340 -0.001 0.000 0.215 267 L C 2.452 179.365 176.870 0.072 0.000 1.119 267 L CA 0.805 55.703 54.840 0.096 0.000 0.790 267 L CB -0.324 41.777 42.059 0.071 0.000 0.919 267 L HN 0.694 8.924 8.230 -0.000 0.000 0.443 268 I N -4.373 116.201 120.570 0.007 0.000 2.335 268 I HA -0.303 3.867 4.170 -0.001 0.000 0.251 268 I C 2.391 178.468 176.117 -0.067 0.000 1.129 268 I CA 1.143 62.394 61.300 -0.081 0.000 1.402 268 I CB -2.313 35.565 38.000 -0.203 0.000 1.069 268 I HN 0.299 8.509 8.210 -0.000 0.000 0.424 269 Y N 1.548 121.883 120.300 0.058 0.000 2.165 269 Y HA -0.161 4.389 4.550 -0.001 0.000 0.286 269 Y C 2.615 178.617 175.900 0.170 0.000 1.155 269 Y CA 2.380 60.546 58.100 0.111 0.000 1.164 269 Y CB -0.738 37.791 38.460 0.116 0.000 0.978 269 Y HN 0.242 8.522 8.280 -0.000 0.000 0.513 270 K N 0.950 121.500 120.400 0.250 0.000 2.097 270 K HA -0.108 4.211 4.320 -0.001 0.000 0.205 270 K C 2.312 178.963 176.600 0.085 0.000 1.050 270 K CA 1.914 58.291 56.287 0.150 0.000 0.938 270 K CB -0.388 32.174 32.500 0.103 0.000 0.718 270 K HN 0.149 8.399 8.250 -0.000 0.000 0.442 271 K N 0.711 121.145 120.400 0.056 0.000 2.057 271 K HA -0.044 4.275 4.320 -0.001 0.000 0.207 271 K C 2.229 178.828 176.600 -0.001 0.000 1.049 271 K CA 1.795 58.083 56.287 0.002 0.000 0.931 271 K CB -0.972 31.509 32.500 -0.031 0.000 0.714 271 K HN 0.265 8.515 8.250 -0.000 0.000 0.440 272 I N 0.920 121.512 120.570 0.036 0.000 2.286 272 I HA -0.214 3.955 4.170 -0.001 0.000 0.248 272 I C 2.749 178.960 176.117 0.156 0.000 1.115 272 I CA 1.567 62.905 61.300 0.063 0.000 1.392 272 I CB 0.026 38.054 38.000 0.047 0.000 1.065 272 I HN 0.565 8.775 8.210 -0.000 0.000 0.418 273 E N 0.673 121.001 120.200 0.212 0.000 2.077 273 E HA -0.265 4.084 4.350 -0.001 0.000 0.193 273 E C 1.557 178.065 176.600 -0.154 0.000 0.989 273 E CA 1.603 57.981 56.400 -0.036 0.000 0.800 273 E CB 0.086 29.665 29.700 -0.202 0.000 0.746 273 E HN 0.431 8.791 8.360 -0.000 0.000 0.452 274 D N 0.221 120.572 120.400 -0.082 0.000 2.117 274 D HA -0.113 4.527 4.640 -0.001 0.000 0.198 274 D C 2.006 178.238 176.300 -0.115 0.000 0.982 274 D CA 0.797 54.739 54.000 -0.096 0.000 0.828 274 D CB -0.139 40.626 40.800 -0.058 0.000 0.967 274 D HN 0.290 8.660 8.370 -0.000 0.000 0.464 275 I N 0.763 121.270 120.570 -0.104 0.000 2.226 275 I HA -0.239 3.930 4.170 -0.001 0.000 0.245 275 I C 2.277 178.279 176.117 -0.192 0.000 1.100 275 I CA 0.799 62.013 61.300 -0.143 0.000 1.374 275 I CB -0.125 37.795 38.000 -0.132 0.000 1.057 275 I HN -0.116 8.094 8.210 -0.000 0.000 0.413 276 S N 0.545 116.157 115.700 -0.147 0.000 2.383 276 S HA -0.210 4.259 4.470 -0.001 0.000 0.229 276 S C 2.011 176.463 174.600 -0.247 0.000 1.030 276 S CA 1.527 59.631 58.200 -0.160 0.000 1.002 276 S CB -0.295 62.900 63.200 -0.008 0.000 0.829 276 S HN 0.352 8.662 8.310 -0.000 0.000 0.467 277 M N 0.686 120.129 119.600 -0.261 0.000 2.117 277 M HA -0.068 4.411 4.480 -0.001 0.000 0.262 277 M C 1.917 178.135 176.300 -0.137 0.000 1.065 277 M CA 1.365 56.533 55.300 -0.220 0.000 1.114 277 M CB -0.568 31.914 32.600 -0.196 0.000 1.361 277 M HN 0.260 8.550 8.290 -0.000 0.000 0.408 278 L N -0.694 120.440 121.223 -0.149 0.000 2.056 278 L HA -0.189 4.150 4.340 -0.001 0.000 0.207 278 L C 2.541 179.324 176.870 -0.146 0.000 1.078 278 L CA 1.123 55.895 54.840 -0.113 0.000 0.749 278 L CB -0.565 41.410 42.059 -0.140 0.000 0.901 278 L HN 0.377 8.607 8.230 -0.000 0.000 0.433 279 M N -0.518 118.875 119.600 -0.345 0.000 2.175 279 M HA -0.081 4.398 4.480 -0.001 0.000 0.264 279 M C 2.388 178.425 176.300 -0.438 0.000 1.063 279 M CA 1.717 56.665 55.300 -0.587 0.000 1.119 279 M CB -0.910 30.966 32.600 -1.206 0.000 1.377 279 M HN 0.361 8.651 8.290 -0.000 0.000 0.415 280 G N 0.300 108.925 108.800 -0.292 0.000 2.446 280 G HA2 -0.259 3.701 3.960 -0.001 0.000 0.217 280 G HA3 -0.259 3.701 3.960 -0.001 0.000 0.217 280 G C 1.358 176.394 174.900 0.227 0.000 1.168 280 G CA 1.108 46.288 45.100 0.133 0.000 0.771 280 G HN 0.552 8.842 8.290 -0.000 0.000 0.551 281 E N -0.641 119.650 120.200 0.151 0.000 2.051 281 E HA -0.224 4.125 4.350 -0.001 0.000 0.192 281 E C 2.081 178.876 176.600 0.324 0.000 0.991 281 E CA 1.022 57.552 56.400 0.216 0.000 0.799 281 E CB -0.358 29.467 29.700 0.208 0.000 0.748 281 E HN 0.534 8.894 8.360 -0.000 0.000 0.449 282 Y N 0.058 120.478 120.300 0.200 0.000 2.114 282 Y HA -0.307 4.243 4.550 -0.000 0.000 0.282 282 Y C 2.073 178.183 175.900 0.351 0.000 1.165 282 Y CA 2.303 60.557 58.100 0.257 0.000 1.148 282 Y CB -0.472 38.035 38.460 0.079 0.000 0.972 282 Y HN 0.201 8.481 8.280 -0.000 0.000 0.504 283 F N 0.687 120.831 119.950 0.324 0.000 2.146 283 F HA -0.184 4.342 4.527 -0.001 0.000 0.298 283 F C 2.434 178.395 175.800 0.269 0.000 1.096 283 F CA 1.973 60.186 58.000 0.354 0.000 1.275 283 F CB -0.511 38.774 39.000 0.475 0.000 1.008 283 F HN 0.131 8.431 8.300 -0.000 0.000 0.480 284 Q N 0.858 120.858 119.800 0.333 0.000 2.123 284 Q HA -0.087 4.253 4.340 -0.001 0.000 0.199 284 Q C 2.040 178.105 176.000 0.108 0.000 0.966 284 Q CA 1.882 57.796 55.803 0.187 0.000 0.845 284 Q CB -0.497 28.369 28.738 0.213 0.000 0.907 284 Q HN 0.622 8.892 8.270 -0.000 0.000 0.439 285 I N -0.372 120.267 120.570 0.114 0.000 2.226 285 I HA -0.291 3.878 4.170 -0.001 0.000 0.245 285 I C 2.181 178.210 176.117 -0.146 0.000 1.100 285 I CA 1.552 62.828 61.300 -0.040 0.000 1.374 285 I CB -0.339 37.425 38.000 -0.393 0.000 1.057 285 I HN 0.373 8.583 8.210 -0.000 0.000 0.413 286 H N 0.754 119.680 119.070 -0.241 0.000 2.353 286 H HA -0.243 4.312 4.556 -0.000 0.000 0.300 286 H C 1.860 176.963 175.328 -0.374 0.000 1.090 286 H CA 2.268 58.047 56.048 -0.449 0.000 1.327 286 H CB -0.149 29.264 29.762 -0.581 0.000 1.383 286 H HN 0.314 8.594 8.280 -0.000 0.000 0.508 287 D N -0.562 119.624 120.400 -0.358 0.000 2.149 287 D HA -0.153 4.487 4.640 -0.001 0.000 0.198 287 D C 1.522 177.681 176.300 -0.235 0.000 0.990 287 D CA 1.592 55.394 54.000 -0.330 0.000 0.839 287 D CB -0.171 40.475 40.800 -0.256 0.000 0.948 287 D HN 0.428 8.798 8.370 -0.000 0.000 0.460 288 D N -1.026 119.289 120.400 -0.140 0.000 2.144 288 D HA -0.175 4.464 4.640 -0.001 0.000 0.200 288 D C 1.657 177.858 176.300 -0.166 0.000 0.978 288 D CA 0.706 54.659 54.000 -0.078 0.000 0.833 288 D CB -0.537 40.298 40.800 0.058 0.000 0.961 288 D HN 0.413 8.783 8.370 -0.000 0.000 0.470 289 Y N 1.376 121.427 120.300 -0.415 0.000 2.181 289 Y HA -0.138 4.412 4.550 -0.000 0.000 0.288 289 Y C 2.031 177.695 175.900 -0.393 0.000 1.146 289 Y CA 1.322 59.134 58.100 -0.480 0.000 1.164 289 Y CB -0.411 37.418 38.460 -1.050 0.000 0.982 289 Y HN -0.093 8.187 8.280 -0.000 0.000 0.515 290 L N 0.262 121.115 121.223 -0.616 0.000 2.141 290 L HA -0.201 4.138 4.340 -0.001 0.000 0.209 290 L C 2.431 179.067 176.870 -0.389 0.000 1.094 290 L CA 1.581 56.085 54.840 -0.559 0.000 0.763 290 L CB -0.672 41.121 42.059 -0.443 0.000 0.908 290 L HN 0.362 8.592 8.230 -0.000 0.000 0.437 291 D N 0.085 120.295 120.400 -0.317 0.000 2.144 291 D HA -0.213 4.427 4.640 -0.001 0.000 0.199 291 D C 2.146 178.287 176.300 -0.266 0.000 0.984 291 D CA 1.612 55.478 54.000 -0.223 0.000 0.834 291 D CB 0.376 41.087 40.800 -0.149 0.000 0.955 291 D HN 0.229 8.599 8.370 -0.000 0.000 0.465 292 I N -0.855 119.461 120.570 -0.424 0.000 2.927 292 I HA 0.151 4.321 4.170 -0.001 0.000 0.268 292 I C 0.215 175.897 176.117 -0.725 0.000 1.153 292 I CA 0.191 61.139 61.300 -0.587 0.000 1.459 292 I CB -0.326 37.237 38.000 -0.728 0.000 1.149 292 I HN -0.108 8.102 8.210 -0.000 0.000 0.443 305 D N 2.570 122.951 120.400 -0.031 0.000 2.144 305 D HA 0.071 4.711 4.640 -0.001 0.000 0.199 305 D C 1.774 178.042 176.300 -0.053 0.000 0.984 305 D CA 1.382 55.386 54.000 0.008 0.000 0.834 305 D CB -0.255 40.582 40.800 0.062 0.000 0.955 305 D HN 0.532 8.902 8.370 -0.000 0.000 0.465 306 I N 0.945 121.424 120.570 -0.152 0.000 2.113 306 I HA -0.329 3.840 4.170 -0.001 0.000 0.238 306 I C 3.050 178.830 176.117 -0.562 0.000 1.070 306 I CA 1.924 62.908 61.300 -0.526 0.000 1.332 306 I CB -0.743 37.065 38.000 -0.321 0.000 1.044 306 I HN 0.034 8.244 8.210 -0.000 0.000 0.402 307 Q N 0.432 120.065 119.800 -0.278 0.000 2.170 307 Q HA -0.188 4.152 4.340 -0.001 0.000 0.203 307 Q C 1.737 177.657 176.000 -0.134 0.000 0.976 307 Q CA 1.904 57.594 55.803 -0.189 0.000 0.858 307 Q CB -1.025 27.648 28.738 -0.109 0.000 0.907 307 Q HN 0.526 8.796 8.270 -0.000 0.000 0.433 308 N N 0.730 119.370 118.700 -0.099 0.000 2.383 308 N HA 0.012 4.752 4.740 -0.001 0.000 0.192 308 N C -0.034 175.486 175.510 0.017 0.000 1.141 308 N CA 0.505 53.535 53.050 -0.033 0.000 0.851 308 N CB 0.340 38.820 38.487 -0.012 0.000 0.976 308 N HN 0.624 9.004 8.380 -0.000 0.000 0.465 309 N N 0.748 119.448 118.700 -0.000 0.000 2.735 309 N HA -0.176 4.564 4.740 -0.001 0.000 0.248 309 N C -1.111 174.663 175.510 0.441 0.000 1.083 309 N CA 0.587 53.784 53.050 0.245 0.000 0.703 309 N CB -0.706 37.924 38.487 0.239 0.000 1.005 309 N HN 0.083 8.463 8.380 -0.000 0.000 0.550 310 K N 0.441 121.049 120.400 0.346 0.000 2.218 310 K HA 0.241 4.561 4.320 -0.001 0.000 0.276 310 K C 0.280 177.050 176.600 0.283 0.000 1.022 310 K CA -0.755 55.662 56.287 0.216 0.000 0.946 310 K CB 0.841 33.420 32.500 0.133 0.000 1.000 310 K HN 0.268 8.518 8.250 -0.000 0.000 0.468 311 L N 3.108 124.326 121.223 -0.009 0.000 2.407 311 L HA 0.099 4.438 4.340 -0.001 0.000 0.282 311 L C 0.049 177.015 176.870 0.161 0.000 1.110 311 L CA 0.477 55.318 54.840 0.001 0.000 0.863 311 L CB -0.082 41.831 42.059 -0.242 0.000 1.207 311 L HN 0.730 8.960 8.230 -0.000 0.000 0.454 312 T N 0.220 114.852 114.554 0.130 0.000 2.932 312 T HA 0.203 4.552 4.350 -0.001 0.000 0.289 312 T C 0.532 175.137 174.700 -0.157 0.000 1.039 312 T CA -0.600 61.573 62.100 0.122 0.000 1.024 312 T CB 0.763 69.704 68.868 0.122 0.000 1.090 312 T HN 0.724 8.964 8.240 -0.000 0.000 0.496 313 W N 1.845 122.849 121.300 -0.492 0.000 2.335 313 W HA 0.062 4.721 4.660 -0.002 0.000 0.311 313 W C -1.452 174.855 176.519 -0.355 0.000 1.213 313 W CA 1.513 58.478 57.345 -0.632 0.000 1.274 313 W CB -1.284 27.841 29.460 -0.558 0.000 1.148 313 W HN 0.636 8.816 8.180 -0.000 0.000 0.498 314 P HA -0.232 4.188 4.420 -0.000 0.000 0.216 314 P C 1.764 178.814 177.300 -0.418 0.000 1.150 314 P CA 1.722 64.585 63.100 -0.395 0.000 0.837 314 P CB -0.391 30.951 31.700 -0.596 0.000 0.786 315 L N -0.862 120.240 121.223 -0.200 0.000 2.046 315 L HA -0.123 4.217 4.340 -0.001 0.000 0.208 315 L C 2.167 178.933 176.870 -0.173 0.000 1.077 315 L CA 1.805 56.604 54.840 -0.069 0.000 0.747 315 L CB -1.124 40.856 42.059 -0.132 0.000 0.896 315 L HN -0.139 8.091 8.230 -0.000 0.000 0.432 316 I N -1.027 119.346 120.570 -0.329 0.000 2.202 316 I HA -0.278 3.892 4.170 -0.001 0.000 0.242 316 I C 2.719 178.596 176.117 -0.400 0.000 1.091 316 I CA 1.334 62.426 61.300 -0.348 0.000 1.368 316 I CB -0.572 37.170 38.000 -0.431 0.000 1.058 316 I HN 0.130 8.340 8.210 -0.000 0.000 0.410 317 K N 0.451 120.426 120.400 -0.708 0.000 2.032 317 K HA -0.184 4.135 4.320 -0.001 0.000 0.209 317 K C 2.201 178.534 176.600 -0.444 0.000 1.048 317 K CA 2.262 58.106 56.287 -0.739 0.000 0.927 317 K CB -0.976 30.784 32.500 -1.234 0.000 0.712 317 K HN 0.457 8.707 8.250 -0.000 0.000 0.441 318 T N 0.079 114.450 114.554 -0.306 0.000 2.684 318 T HA -0.075 4.275 4.350 -0.001 0.000 0.267 318 T C 1.516 176.058 174.700 -0.264 0.000 1.036 318 T CA 1.800 63.783 62.100 -0.195 0.000 1.148 318 T CB -0.506 68.436 68.868 0.123 0.000 0.863 318 T HN 0.425 8.665 8.240 -0.000 0.000 0.436 319 F N 1.618 121.397 119.950 -0.286 0.000 2.171 319 F HA -0.076 4.450 4.527 -0.001 0.000 0.300 319 F C 2.511 178.156 175.800 -0.258 0.000 1.090 319 F CA 1.507 59.355 58.000 -0.254 0.000 1.293 319 F CB -0.101 38.772 39.000 -0.211 0.000 1.013 319 F HN 0.205 8.505 8.300 -0.000 0.000 0.486 320 E N -0.371 119.769 120.200 -0.099 0.000 2.106 320 E HA -0.196 4.153 4.350 -0.001 0.000 0.192 320 E C 1.817 178.277 176.600 -0.234 0.000 0.984 320 E CA 1.116 57.427 56.400 -0.148 0.000 0.806 320 E CB -0.054 29.544 29.700 -0.169 0.000 0.750 320 E HN 0.303 8.663 8.360 -0.000 0.000 0.458 321 L N 0.797 121.814 121.223 -0.343 0.000 2.416 321 L HA 0.101 4.440 4.340 -0.001 0.000 0.216 321 L C 1.224 177.788 176.870 -0.511 0.000 1.098 321 L CA 0.347 54.966 54.840 -0.368 0.000 0.840 321 L CB -0.454 41.372 42.059 -0.389 0.000 0.981 321 L HN 0.365 8.595 8.230 -0.000 0.000 0.462 322 C N -0.935 117.927 119.300 -0.729 0.000 2.443 322 C HA 0.674 5.134 4.460 -0.001 0.000 0.369 322 C C 1.400 176.179 174.990 -0.350 0.000 1.241 322 C CA -1.190 57.333 59.018 -0.824 0.000 2.413 322 C CB 0.676 27.868 27.740 -0.915 0.000 2.451 322 C HN 0.523 8.753 8.230 -0.000 0.000 0.595 323 S N 0.659 116.281 115.700 -0.130 0.000 2.589 323 S HA 0.135 4.604 4.470 -0.001 0.000 0.265 323 S C 0.857 175.365 174.600 -0.153 0.000 1.342 323 S CA 0.571 58.721 58.200 -0.084 0.000 1.005 323 S CB 0.587 63.794 63.200 0.011 0.000 0.909 323 S HN 0.930 9.240 8.310 -0.000 0.000 0.555 324 E N 1.521 121.646 120.200 -0.126 0.000 2.051 324 E HA 0.013 4.363 4.350 -0.001 0.000 0.192 324 E C -0.906 175.629 176.600 -0.108 0.000 0.991 324 E CA 1.544 57.862 56.400 -0.136 0.000 0.799 324 E CB -1.624 28.020 29.700 -0.093 0.000 0.748 324 E HN 0.631 8.991 8.360 -0.000 0.000 0.449 325 P HA -0.118 4.302 4.420 -0.000 0.000 0.217 325 P C 0.488 177.760 177.300 -0.046 0.000 1.148 325 P CA 1.534 64.607 63.100 -0.044 0.000 0.828 325 P CB 0.007 31.694 31.700 -0.021 0.000 0.783 326 D N -1.121 119.247 120.400 -0.053 0.000 2.277 326 D HA -0.054 4.585 4.640 -0.001 0.000 0.208 326 D C 1.752 177.983 176.300 -0.116 0.000 0.962 326 D CA 0.785 54.760 54.000 -0.042 0.000 0.865 326 D CB -0.174 40.646 40.800 0.033 0.000 0.939 326 D HN 0.230 8.600 8.370 -0.000 0.000 0.510 327 K N 0.416 120.684 120.400 -0.219 0.000 2.057 327 K HA -0.065 4.255 4.320 -0.001 0.000 0.206 327 K C 2.242 178.791 176.600 -0.084 0.000 1.050 327 K CA 0.776 56.884 56.287 -0.298 0.000 0.935 327 K CB -0.064 32.140 32.500 -0.494 0.000 0.715 327 K HN 0.074 8.324 8.250 -0.000 0.000 0.439 328 I N 1.349 121.879 120.570 -0.067 0.000 2.226 328 I HA -0.211 3.959 4.170 -0.001 0.000 0.245 328 I C 2.397 178.508 176.117 -0.010 0.000 1.100 328 I CA 1.397 62.682 61.300 -0.024 0.000 1.374 328 I CB -0.783 37.201 38.000 -0.027 0.000 1.057 328 I HN 0.230 8.440 8.210 -0.000 0.000 0.413 329 K N 1.182 121.572 120.400 -0.016 0.000 2.057 329 K HA -0.136 4.184 4.320 -0.001 0.000 0.207 329 K C 2.106 178.713 176.600 0.012 0.000 1.049 329 K CA 2.111 58.396 56.287 -0.004 0.000 0.931 329 K CB -0.743 31.755 32.500 -0.003 0.000 0.714 329 K HN 0.490 8.740 8.250 -0.000 0.000 0.440 330 I N -0.675 119.905 120.570 0.017 0.000 2.202 330 I HA -0.143 4.027 4.170 -0.001 0.000 0.242 330 I C 2.290 178.449 176.117 0.070 0.000 1.091 330 I CA 1.969 63.300 61.300 0.052 0.000 1.368 330 I CB -1.157 36.883 38.000 0.068 0.000 1.058 330 I HN 0.092 8.302 8.210 -0.000 0.000 0.410 331 V N 1.468 121.412 119.914 0.051 0.000 2.407 331 V HA -0.226 3.894 4.120 -0.001 0.000 0.248 331 V C 3.125 179.232 176.094 0.021 0.000 1.055 331 V CA 2.610 64.923 62.300 0.020 0.000 1.049 331 V CB -1.486 30.346 31.823 0.014 0.000 0.662 331 V HN 0.869 9.059 8.190 -0.000 0.000 0.455 332 K N -0.050 120.362 120.400 0.020 0.000 2.155 332 K HA -0.087 4.232 4.320 -0.001 0.000 0.203 332 K C 1.679 178.290 176.600 0.017 0.000 1.052 332 K CA 1.597 57.891 56.287 0.012 0.000 0.948 332 K CB -0.538 31.964 32.500 0.003 0.000 0.728 332 K HN 0.623 8.873 8.250 -0.000 0.000 0.448 333 N N -1.584 117.136 118.700 0.034 0.000 2.250 333 N HA 0.083 4.822 4.740 -0.001 0.000 0.190 333 N C -0.421 175.111 175.510 0.037 0.000 1.116 333 N CA -0.182 52.880 53.050 0.021 0.000 0.881 333 N CB 0.353 38.843 38.487 0.004 0.000 1.006 333 N HN 0.489 8.869 8.380 -0.000 0.000 0.491 334 Y N 1.067 121.339 120.300 -0.047 0.000 2.301 334 Y HA 0.358 4.908 4.550 0.001 0.000 0.328 334 Y C 1.438 177.320 175.900 -0.031 0.000 1.242 334 Y CA 0.784 58.860 58.100 -0.040 0.000 1.323 334 Y CB 0.897 39.334 38.460 -0.038 0.000 1.266 334 Y HN 0.296 8.576 8.280 -0.000 0.000 0.527 335 G N 3.032 111.614 108.800 -0.363 0.000 2.176 335 G HA2 -0.280 3.680 3.960 -0.001 0.000 0.252 335 G HA3 -0.280 3.680 3.960 -0.001 0.000 0.252 335 G C -0.346 174.499 174.900 -0.093 0.000 1.024 335 G CA 0.190 45.199 45.100 -0.151 0.000 0.755 335 G HN 0.522 8.812 8.290 -0.000 0.000 0.507 336 K N -0.088 120.238 120.400 -0.122 0.000 2.378 336 K HA 0.320 4.640 4.320 -0.001 0.000 0.252 336 K C -0.145 176.407 176.600 -0.081 0.000 0.931 336 K CA -0.900 55.343 56.287 -0.073 0.000 0.794 336 K CB 0.979 33.449 32.500 -0.050 0.000 1.181 336 K HN 0.053 8.303 8.250 -0.000 0.000 0.425 337 N N 2.890 121.557 118.700 -0.054 0.000 3.178 337 N HA 0.004 4.744 4.740 -0.001 0.000 0.300 337 N C -1.048 174.439 175.510 -0.038 0.000 1.242 337 N CA 0.227 53.249 53.050 -0.046 0.000 1.192 337 N CB -0.108 38.362 38.487 -0.030 0.000 1.463 337 N HN 0.434 8.814 8.380 -0.000 0.000 0.539 338 N N 0.152 118.825 118.700 -0.046 0.000 2.352 338 N HA 0.251 4.990 4.740 -0.001 0.000 0.291 338 N C 0.960 176.445 175.510 -0.042 0.000 1.040 338 N CA -0.415 52.612 53.050 -0.037 0.000 0.864 338 N CB 1.325 39.792 38.487 -0.033 0.000 1.440 338 N HN -0.003 8.377 8.380 -0.000 0.000 0.483 339 L N 2.469 123.672 121.223 -0.033 0.000 2.012 339 L HA 0.009 4.348 4.340 -0.001 0.000 0.210 339 L C 2.314 179.164 176.870 -0.034 0.000 1.073 339 L CA 2.749 57.569 54.840 -0.032 0.000 0.748 339 L CB -2.056 39.989 42.059 -0.023 0.000 0.891 339 L HN 0.774 9.004 8.230 -0.000 0.000 0.431 340 A N -1.825 120.978 122.820 -0.029 0.000 1.933 340 A HA -0.200 4.119 4.320 -0.001 0.000 0.218 340 A C 2.560 180.123 177.584 -0.034 0.000 1.175 340 A CA 1.727 53.748 52.037 -0.027 0.000 0.628 340 A CB -1.147 17.840 19.000 -0.021 0.000 0.814 340 A HN 0.749 8.899 8.150 -0.000 0.000 0.444 341 C N -1.303 117.973 119.300 -0.040 0.000 2.446 341 C HA -0.041 4.419 4.460 -0.001 0.000 0.277 341 C C 2.736 177.685 174.990 -0.069 0.000 1.275 341 C CA 0.998 59.987 59.018 -0.048 0.000 1.727 341 C CB -1.169 26.541 27.740 -0.049 0.000 2.010 341 C HN 0.465 8.695 8.230 -0.000 0.000 0.486 342 V N 1.499 121.364 119.914 -0.082 0.000 2.343 342 V HA -0.164 3.955 4.120 -0.001 0.000 0.247 342 V C 2.864 178.903 176.094 -0.091 0.000 1.051 342 V CA 2.549 64.787 62.300 -0.104 0.000 1.036 342 V CB -1.252 30.512 31.823 -0.097 0.000 0.654 342 V HN 0.691 8.881 8.190 -0.000 0.000 0.451 343 K N -0.179 120.183 120.400 -0.063 0.000 2.097 343 K HA -0.166 4.154 4.320 -0.001 0.000 0.206 343 K C 2.196 178.764 176.600 -0.053 0.000 1.049 343 K CA 1.888 58.146 56.287 -0.048 0.000 0.933 343 K CB -1.221 31.261 32.500 -0.031 0.000 0.717 343 K HN 0.369 8.619 8.250 -0.000 0.000 0.442 344 V N 0.961 120.842 119.914 -0.055 0.000 2.343 344 V HA -0.252 3.868 4.120 -0.001 0.000 0.247 344 V C 2.562 178.602 176.094 -0.089 0.000 1.051 344 V CA 1.945 64.214 62.300 -0.051 0.000 1.036 344 V CB -0.460 31.342 31.823 -0.036 0.000 0.654 344 V HN 0.546 8.736 8.190 -0.000 0.000 0.451 345 I N -0.155 120.335 120.570 -0.133 0.000 2.315 345 I HA -0.170 4.000 4.170 -0.001 0.000 0.248 345 I C 2.304 178.148 176.117 -0.456 0.000 1.117 345 I CA 1.348 62.481 61.300 -0.279 0.000 1.404 345 I CB -1.191 36.687 38.000 -0.202 0.000 1.071 345 I HN 0.481 8.691 8.210 -0.000 0.000 0.419 346 D N 0.500 120.759 120.400 -0.234 0.000 2.123 346 D HA -0.136 4.504 4.640 -0.001 0.000 0.196 346 D C 2.443 178.743 176.300 0.000 0.000 0.992 346 D CA 1.748 55.687 54.000 -0.100 0.000 0.833 346 D CB -0.303 40.476 40.800 -0.034 0.000 0.954 346 D HN 0.369 8.739 8.370 -0.000 0.000 0.455 347 S N -0.079 115.607 115.700 -0.023 0.000 2.402 347 S HA -0.019 4.451 4.470 -0.001 0.000 0.229 347 S C 2.136 176.761 174.600 0.042 0.000 1.021 347 S CA 0.348 58.559 58.200 0.019 0.000 0.974 347 S CB -0.032 63.166 63.200 -0.004 0.000 0.800 347 S HN 0.247 8.557 8.310 -0.000 0.000 0.484 348 L N -0.094 121.135 121.223 0.010 0.000 2.109 348 L HA -0.078 4.262 4.340 -0.001 0.000 0.207 348 L C 2.163 179.223 176.870 0.317 0.000 1.086 348 L CA 1.035 55.949 54.840 0.123 0.000 0.760 348 L CB -0.533 41.570 42.059 0.074 0.000 0.910 348 L HN 0.290 8.520 8.230 -0.000 0.000 0.437 349 Y N 0.533 120.970 120.300 0.228 0.000 2.293 349 Y HA -0.191 4.359 4.550 -0.001 0.000 0.291 349 Y C 2.529 178.625 175.900 0.327 0.000 1.137 349 Y CA 0.613 58.899 58.100 0.311 0.000 1.202 349 Y CB -0.667 37.992 38.460 0.332 0.000 0.990 349 Y HN 0.293 8.573 8.280 -0.000 0.000 0.537 350 E N -0.335 120.098 120.200 0.389 0.000 2.107 350 E HA -0.217 4.133 4.350 -0.001 0.000 0.191 350 E C 2.147 178.815 176.600 0.114 0.000 0.982 350 E CA 0.837 57.370 56.400 0.221 0.000 0.809 350 E CB -0.154 29.640 29.700 0.157 0.000 0.756 350 E HN 0.509 8.869 8.360 -0.000 0.000 0.459 351 Q N 0.234 120.069 119.800 0.058 0.000 2.050 351 Q HA -0.157 4.182 4.340 -0.001 0.000 0.202 351 Q C 0.656 176.512 176.000 -0.240 0.000 0.980 351 Q CA 1.319 57.029 55.803 -0.155 0.000 0.840 351 Q CB 0.066 28.623 28.738 -0.303 0.000 0.898 351 Q HN 0.377 8.647 8.270 -0.000 0.000 0.424 352 Y N 0.912 121.299 120.300 0.145 0.000 2.718 352 Y HA 0.212 4.762 4.550 -0.001 0.000 0.322 352 Y C 0.743 176.801 175.900 0.264 0.000 1.122 352 Y CA 0.173 58.367 58.100 0.157 0.000 1.348 352 Y CB -0.417 38.096 38.460 0.088 0.000 1.174 352 Y HN 0.121 8.401 8.280 -0.000 0.000 0.523 356 K N 0.913 121.348 120.400 0.058 0.000 2.167 356 K HA -0.029 4.291 4.320 -0.001 0.000 0.203 356 K C 1.493 178.076 176.600 -0.028 0.000 1.052 356 K CA 1.815 58.078 56.287 -0.040 0.000 0.956 356 K CB -0.726 31.685 32.500 -0.148 0.000 0.735 356 K HN 0.360 8.610 8.250 -0.000 0.000 0.451 357 H N -1.819 117.376 119.070 0.209 0.000 2.428 357 H HA 0.035 4.591 4.556 -0.001 0.000 0.296 357 H C 1.996 177.583 175.328 0.431 0.000 1.062 357 H CA 1.652 57.882 56.048 0.302 0.000 1.350 357 H CB -0.102 29.843 29.762 0.306 0.000 1.403 357 H HN 0.624 8.904 8.280 -0.000 0.000 0.533 358 Y N 1.896 122.418 120.300 0.370 0.000 2.133 358 Y HA -0.247 4.303 4.550 0.000 0.000 0.287 358 Y C 2.364 178.207 175.900 -0.096 0.000 1.134 358 Y CA 1.655 59.742 58.100 -0.021 0.000 1.133 358 Y CB -0.418 37.944 38.460 -0.163 0.000 0.987 358 Y HN 0.003 8.283 8.280 -0.000 0.000 0.502 359 E N -0.615 119.405 120.200 -0.300 0.000 2.130 359 E HA -0.258 4.091 4.350 -0.001 0.000 0.196 359 E C 2.472 178.919 176.600 -0.254 0.000 0.998 359 E CA 1.153 57.339 56.400 -0.357 0.000 0.806 359 E CB -1.039 28.575 29.700 -0.142 0.000 0.738 359 E HN 0.601 8.961 8.360 -0.000 0.000 0.459 360 S N -0.922 114.716 115.700 -0.102 0.000 2.368 360 S HA -0.161 4.309 4.470 -0.001 0.000 0.224 360 S C 1.802 176.386 174.600 -0.027 0.000 1.029 360 S CA 1.438 59.620 58.200 -0.030 0.000 0.988 360 S CB -0.428 62.809 63.200 0.062 0.000 0.838 360 S HN 0.636 8.946 8.310 -0.000 0.000 0.462 361 Y N 2.070 122.289 120.300 -0.135 0.000 2.163 361 Y HA -0.010 4.540 4.550 -0.000 0.000 0.288 361 Y C 2.452 178.199 175.900 -0.255 0.000 1.136 361 Y CA 2.143 60.145 58.100 -0.164 0.000 1.147 361 Y CB -0.585 37.717 38.460 -0.263 0.000 0.987 361 Y HN 0.215 8.495 8.280 -0.000 0.000 0.509 362 E N 1.135 121.011 120.200 -0.540 0.000 2.130 362 E HA -0.284 4.065 4.350 -0.001 0.000 0.196 362 E C 2.279 178.716 176.600 -0.271 0.000 0.998 362 E CA 2.269 58.355 56.400 -0.523 0.000 0.806 362 E CB -0.099 29.140 29.700 -0.769 0.000 0.738 362 E HN 0.605 8.965 8.360 -0.000 0.000 0.459 363 K N 0.373 120.621 120.400 -0.252 0.000 2.103 363 K HA 0.111 4.430 4.320 -0.001 0.000 0.204 363 K C 2.158 178.654 176.600 -0.173 0.000 1.052 363 K CA 1.363 57.553 56.287 -0.162 0.000 0.945 363 K CB -0.766 31.659 32.500 -0.125 0.000 0.722 363 K HN 0.289 8.539 8.250 -0.000 0.000 0.443 364 A N 0.378 123.067 122.820 -0.217 0.000 1.898 364 A HA -0.079 4.240 4.320 -0.001 0.000 0.214 364 A C 2.385 179.821 177.584 -0.245 0.000 1.183 364 A CA 1.897 53.820 52.037 -0.189 0.000 0.622 364 A CB -0.284 18.636 19.000 -0.133 0.000 0.824 364 A HN 0.580 8.730 8.150 -0.000 0.000 0.444 365 Q N 0.307 119.855 119.800 -0.420 0.000 2.079 365 Q HA -0.141 4.198 4.340 -0.001 0.000 0.200 365 Q C 2.007 177.830 176.000 -0.294 0.000 0.974 365 Q CA 2.201 57.777 55.803 -0.379 0.000 0.840 365 Q CB -0.309 28.058 28.738 -0.619 0.000 0.898 365 Q HN 0.625 8.895 8.270 -0.000 0.000 0.430 366 K N -0.742 119.493 120.400 -0.276 0.000 2.103 366 K HA -0.180 4.140 4.320 -0.001 0.000 0.207 366 K C 1.835 178.277 176.600 -0.263 0.000 1.048 366 K CA 1.326 57.404 56.287 -0.349 0.000 0.930 366 K CB -0.299 32.078 32.500 -0.205 0.000 0.716 366 K HN 0.298 8.548 8.250 -0.000 0.000 0.444 367 A N 1.185 123.889 122.820 -0.193 0.000 1.898 367 A HA -0.173 4.146 4.320 -0.001 0.000 0.216 367 A C 2.006 179.504 177.584 -0.144 0.000 1.181 367 A CA 1.647 53.595 52.037 -0.148 0.000 0.620 367 A CB -0.387 18.545 19.000 -0.114 0.000 0.819 367 A HN 0.331 8.481 8.150 -0.000 0.000 0.442 368 K N -0.456 119.853 120.400 -0.152 0.000 2.148 368 K HA -0.087 4.233 4.320 -0.001 0.000 0.204 368 K C 2.009 178.519 176.600 -0.151 0.000 1.050 368 K CA 1.374 57.585 56.287 -0.128 0.000 0.942 368 K CB -0.513 31.922 32.500 -0.108 0.000 0.724 368 K HN 0.411 8.661 8.250 -0.000 0.000 0.446 369 I N 0.408 120.852 120.570 -0.210 0.000 2.233 369 I HA -0.093 4.076 4.170 -0.001 0.000 0.243 369 I C 2.161 178.152 176.117 -0.210 0.000 1.093 369 I CA 1.391 62.545 61.300 -0.242 0.000 1.380 369 I CB -1.010 36.771 38.000 -0.365 0.000 1.067 369 I HN 0.157 8.367 8.210 -0.000 0.000 0.413 370 L N 0.101 121.203 121.223 -0.201 0.000 2.191 370 L HA -0.196 4.143 4.340 -0.001 0.000 0.212 370 L C 2.885 179.682 176.870 -0.123 0.000 1.103 370 L CA 1.734 56.479 54.840 -0.159 0.000 0.769 370 L CB -0.411 41.562 42.059 -0.143 0.000 0.908 370 L HN 0.590 8.820 8.230 -0.000 0.000 0.438 371 S N -0.468 115.163 115.700 -0.115 0.000 2.371 371 S HA -0.082 4.387 4.470 -0.001 0.000 0.224 371 S C 2.123 176.664 174.600 -0.098 0.000 1.029 371 S CA 1.049 59.195 58.200 -0.090 0.000 0.978 371 S CB 0.038 63.192 63.200 -0.077 0.000 0.833 371 S HN 0.437 8.747 8.310 -0.000 0.000 0.466 372 A N 1.017 123.768 122.820 -0.114 0.000 1.898 372 A HA 0.006 4.325 4.320 -0.001 0.000 0.216 372 A C 2.310 179.813 177.584 -0.135 0.000 1.181 372 A CA 1.540 53.506 52.037 -0.118 0.000 0.620 372 A CB -0.953 17.974 19.000 -0.121 0.000 0.819 372 A HN 0.483 8.633 8.150 -0.000 0.000 0.442 373 I N 0.870 121.355 120.570 -0.141 0.000 2.208 373 I HA -0.230 3.939 4.170 -0.001 0.000 0.245 373 I C 2.268 178.306 176.117 -0.131 0.000 1.097 373 I CA 1.846 63.064 61.300 -0.137 0.000 1.363 373 I CB -1.770 36.146 38.000 -0.140 0.000 1.051 373 I HN 0.522 8.732 8.210 -0.000 0.000 0.413 374 N N 0.073 118.702 118.700 -0.118 0.000 2.381 374 N HA -0.117 4.623 4.740 -0.001 0.000 0.182 374 N C 1.530 176.925 175.510 -0.191 0.000 1.025 374 N CA 0.802 53.790 53.050 -0.103 0.000 0.888 374 N CB -0.302 38.150 38.487 -0.059 0.000 0.965 374 N HN 0.511 8.891 8.380 -0.000 0.000 0.438 375 E N -0.016 120.028 120.200 -0.261 0.000 2.476 375 E HA 0.083 4.432 4.350 -0.001 0.000 0.191 375 E C 1.589 177.742 176.600 -0.744 0.000 1.064 375 E CA -0.106 56.003 56.400 -0.486 0.000 0.866 375 E CB 0.144 29.719 29.700 -0.209 0.000 0.952 375 E HN 0.425 8.785 8.360 -0.000 0.000 0.492 376 L N -0.363 120.581 121.223 -0.466 0.000 2.109 376 L HA -0.111 4.229 4.340 -0.001 0.000 0.207 376 L C 0.068 176.799 176.870 -0.231 0.000 1.086 376 L CA 0.846 55.517 54.840 -0.282 0.000 0.760 376 L CB -0.552 41.429 42.059 -0.131 0.000 0.910 376 L HN 0.341 8.571 8.230 -0.000 0.000 0.437 377 H N -1.913 117.174 119.070 0.029 0.000 2.756 377 H HA -0.204 4.352 4.556 -0.001 0.000 0.315 377 H C -0.100 175.264 175.328 0.060 0.000 1.210 377 H CA 0.297 56.361 56.048 0.027 0.000 1.150 377 H CB -2.026 27.741 29.762 0.009 0.000 1.463 377 H HN 0.324 8.604 8.280 -0.000 0.000 0.427 378 H N -0.304 118.784 119.070 0.030 0.000 3.239 378 H HA 0.318 4.873 4.556 -0.000 0.000 0.320 378 H C 0.827 176.163 175.328 0.015 0.000 1.074 378 H CA 0.582 56.638 56.048 0.014 0.000 1.553 378 H CB 0.577 30.328 29.762 -0.019 0.000 1.752 378 H HN 0.563 8.843 8.280 -0.000 0.000 0.513 379 E N 3.184 123.410 120.200 0.043 0.000 2.070 379 E HA -0.160 4.189 4.350 -0.001 0.000 0.197 379 E C 1.977 178.693 176.600 0.193 0.000 1.004 379 E CA 1.562 58.013 56.400 0.085 0.000 0.805 379 E CB -0.926 28.784 29.700 0.015 0.000 0.744 379 E HN 0.799 9.159 8.360 -0.000 0.000 0.451 380 G N 0.548 109.520 108.800 0.286 0.000 2.459 380 G HA2 -0.190 3.770 3.960 -0.001 0.000 0.217 380 G HA3 -0.190 3.770 3.960 -0.001 0.000 0.217 380 G C 1.894 176.961 174.900 0.279 0.000 1.183 380 G CA 1.253 46.586 45.100 0.389 0.000 0.776 380 G HN 0.520 8.810 8.290 -0.000 0.000 0.552 381 I N 0.298 121.011 120.570 0.238 0.000 2.315 381 I HA -0.079 4.090 4.170 -0.001 0.000 0.248 381 I C 2.721 178.820 176.117 -0.030 0.000 1.117 381 I CA 0.938 62.221 61.300 -0.028 0.000 1.404 381 I CB -0.252 37.590 38.000 -0.262 0.000 1.071 381 I HN 0.241 8.451 8.210 -0.000 0.000 0.419 382 E N 0.283 120.507 120.200 0.040 0.000 2.058 382 E HA -0.290 4.059 4.350 -0.001 0.000 0.194 382 E C 2.092 178.680 176.600 -0.020 0.000 0.997 382 E CA 1.762 58.161 56.400 -0.001 0.000 0.801 382 E CB -0.266 29.454 29.700 0.033 0.000 0.746 382 E HN 0.518 8.878 8.360 -0.000 0.000 0.450 383 Y N 1.181 121.423 120.300 -0.098 0.000 2.145 383 Y HA -0.254 4.296 4.550 -0.000 0.000 0.286 383 Y C 2.090 177.880 175.900 -0.183 0.000 1.145 383 Y CA 1.275 59.283 58.100 -0.154 0.000 1.148 383 Y CB -0.554 37.773 38.460 -0.222 0.000 0.981 383 Y HN -0.186 8.094 8.280 -0.000 0.000 0.507 384 V N 1.166 120.758 119.914 -0.537 0.000 2.282 384 V HA -0.359 3.760 4.120 -0.001 0.000 0.249 384 V C 2.570 178.486 176.094 -0.297 0.000 1.057 384 V CA 2.278 64.264 62.300 -0.523 0.000 1.032 384 V CB -0.872 30.793 31.823 -0.265 0.000 0.645 384 V HN 0.518 8.708 8.190 -0.000 0.000 0.447 385 L N -0.083 121.009 121.223 -0.220 0.000 2.141 385 L HA -0.142 4.197 4.340 -0.001 0.000 0.209 385 L C 2.914 179.653 176.870 -0.219 0.000 1.094 385 L CA 1.793 56.521 54.840 -0.186 0.000 0.763 385 L CB -0.905 41.057 42.059 -0.162 0.000 0.908 385 L HN 0.457 8.687 8.230 -0.000 0.000 0.437 386 K N -0.140 120.127 120.400 -0.222 0.000 2.103 386 K HA -0.223 4.097 4.320 -0.001 0.000 0.204 386 K C 1.891 178.359 176.600 -0.221 0.000 1.052 386 K CA 1.397 57.564 56.287 -0.200 0.000 0.945 386 K CB -1.254 31.171 32.500 -0.126 0.000 0.722 386 K HN 0.408 8.658 8.250 -0.000 0.000 0.443 387 Y N 0.857 120.883 120.300 -0.457 0.000 2.133 387 Y HA -0.117 4.433 4.550 -0.001 0.000 0.287 387 Y C 2.143 177.862 175.900 -0.302 0.000 1.134 387 Y CA 1.799 59.637 58.100 -0.437 0.000 1.133 387 Y CB -0.358 37.649 38.460 -0.754 0.000 0.987 387 Y HN 0.141 8.421 8.280 -0.000 0.000 0.502 388 L N 0.342 121.342 121.223 -0.371 0.000 2.013 388 L HA -0.213 4.127 4.340 -0.001 0.000 0.212 388 L C 2.218 178.878 176.870 -0.350 0.000 1.073 388 L CA 2.058 56.685 54.840 -0.355 0.000 0.753 388 L CB -1.234 40.741 42.059 -0.140 0.000 0.890 388 L HN 0.427 8.657 8.230 -0.000 0.000 0.432 389 L N -0.362 120.669 121.223 -0.320 0.000 2.127 389 L HA -0.170 4.170 4.340 -0.001 0.000 0.211 389 L C 2.437 179.084 176.870 -0.371 0.000 1.089 389 L CA 1.689 56.322 54.840 -0.346 0.000 0.757 389 L CB -0.772 41.067 42.059 -0.367 0.000 0.899 389 L HN 0.379 8.609 8.230 -0.000 0.000 0.434 390 E N -0.675 119.307 120.200 -0.363 0.000 2.107 390 E HA -0.038 4.312 4.350 -0.001 0.000 0.191 390 E C 1.894 178.268 176.600 -0.378 0.000 0.982 390 E CA 1.441 57.647 56.400 -0.324 0.000 0.809 390 E CB -0.053 29.497 29.700 -0.250 0.000 0.756 390 E HN 0.444 8.804 8.360 -0.000 0.000 0.459 391 I N 1.057 121.346 120.570 -0.469 0.000 3.904 391 I HA 0.111 4.280 4.170 -0.001 0.000 0.333 391 I C 2.130 178.060 176.117 -0.312 0.000 1.361 391 I CA -0.084 60.978 61.300 -0.397 0.000 1.116 391 I CB -1.108 36.572 38.000 -0.533 0.000 1.028 391 I HN 0.102 8.312 8.210 -0.000 0.000 0.398 392 L N 0.033 121.017 121.223 -0.399 0.000 1.989 392 L HA -0.169 4.170 4.340 -0.001 0.000 0.211 392 L C 2.497 179.333 176.870 -0.057 0.000 1.071 392 L CA 2.285 56.977 54.840 -0.247 0.000 0.749 392 L CB -0.450 41.420 42.059 -0.315 0.000 0.890 392 L HN 0.330 8.560 8.230 -0.000 0.000 0.431 393 F N -1.136 118.805 119.950 -0.015 0.000 2.367 393 F HA -0.124 4.403 4.527 -0.001 0.000 0.298 393 F C 2.653 178.485 175.800 0.053 0.000 1.094 393 F CA 0.858 58.844 58.000 -0.023 0.000 1.409 393 F CB -0.619 38.273 39.000 -0.181 0.000 1.064 393 F HN 0.191 8.491 8.300 -0.000 0.000 0.528 394 T N -2.388 112.249 114.554 0.138 0.000 2.976 394 T HA 0.514 4.863 4.350 -0.001 0.000 0.257 394 T C 1.167 175.908 174.700 0.069 0.000 1.051 394 T CA 0.459 62.618 62.100 0.098 0.000 1.141 394 T CB -0.099 68.799 68.868 0.052 0.000 0.881 394 T HN 0.455 8.695 8.240 -0.000 0.000 0.461 395 G N 0.000 108.817 108.800 0.028 0.000 5.446 395 G HA2 0.000 3.960 3.960 -0.001 0.000 0.244 395 G HA3 0.000 3.960 3.960 -0.001 0.000 0.244 395 G CA 0.000 45.112 45.100 0.019 0.000 0.502 395 G HN 0.000 8.290 8.290 -0.000 0.000 0.925