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 3iss_1_A DATA FIRST_RESID 1 DATA SEQUENCE MDKFRVQGPT KLQGEVTISG AKNAALPILF AALLAEEPVE IQNVPKLKDV DATA SEQUENCE DTSMKLLSQL GAKVERDGSV HIDARDVNVF CAPYDLVKTM RASIWALGPL DATA SEQUENCE VARFGQGQVS LPGGCTIGAR PVDLHISGLE QLGATIKLEE GYVKASVDGR DATA SEQUENCE LKGAHIVMDK VSVGATVTIM CAATLAEGTT IIENAAREPE IVDTANFLIT DATA SEQUENCE LGAKISGQGT DRIVIEGVER LGGGVYRVLP DRIETGTFLV AAAISRGKII DATA SEQUENCE CRNAQPDTLD AVLAKLRDAG ADIEVGEDWI SLDMHGKRPK AVNVRTAPHP DATA SEQUENCE AFPTDMQAQF TLLNLVAEGT GFITETVFEN RFMHVPELSR MGAHAEIESN DATA SEQUENCE TVICHGVEKL SGAQVMATDL RASASLVLAG CIAEGTTVVD RIYHIDRGYE DATA SEQUENCE RIEDKLRALG ANIERVKG VARS RESID RESNAME ATOMNAME SS_SHIFT SHIFT RC_SHIFT HM_SHIFT EF_SHIFT SIGMA FORMAT %4d %4s %4s %9.3f %9.3f %9.3f %9.3f %9.3f %9.3f 1 M HA 0.000 4.480 4.480 0.000 0.000 0.227 1 M C 0.000 176.294 176.300 -0.011 0.000 1.140 1 M CA 0.000 55.298 55.300 -0.003 0.000 0.988 1 M CB 0.000 32.608 32.600 0.012 0.000 1.302 2 D N 2.726 123.110 120.400 -0.027 0.000 2.400 2 D HA 0.411 5.045 4.640 -0.009 0.000 0.238 2 D C 0.078 176.306 176.300 -0.120 0.000 1.157 2 D CA 0.662 54.616 54.000 -0.077 0.000 0.889 2 D CB 1.137 41.868 40.800 -0.115 0.000 1.199 2 D HN 0.314 8.684 8.370 0.000 0.000 0.436 3 K N 0.217 120.528 120.400 -0.147 0.000 2.512 3 K HA 0.454 4.769 4.320 -0.009 0.000 0.263 3 K C -1.127 175.384 176.600 -0.147 0.000 0.966 3 K CA -0.813 55.390 56.287 -0.140 0.000 0.851 3 K CB 1.609 34.093 32.500 -0.026 0.000 1.395 3 K HN 0.133 8.383 8.250 0.000 0.000 0.440 4 F N 1.594 121.552 119.950 0.013 0.000 2.427 4 F HA 0.398 4.916 4.527 -0.015 0.000 0.346 4 F C 0.405 176.208 175.800 0.005 0.000 1.120 4 F CA -0.818 57.186 58.000 0.007 0.000 1.033 4 F CB 1.373 40.371 39.000 -0.003 0.000 1.126 4 F HN 0.263 8.563 8.300 0.000 0.000 0.462 5 R N 3.362 123.996 120.500 0.223 0.000 2.294 5 R HA 0.743 5.078 4.340 -0.009 0.000 0.319 5 R C -1.897 174.448 176.300 0.076 0.000 0.984 5 R CA -0.329 55.840 56.100 0.115 0.000 0.861 5 R CB 1.040 31.387 30.300 0.079 0.000 1.104 5 R HN 0.514 8.784 8.270 0.000 0.000 0.451 6 V N 4.272 124.213 119.914 0.045 0.000 2.680 6 V HA 0.364 4.478 4.120 -0.009 0.000 0.309 6 V C -0.654 175.441 176.094 0.002 0.000 1.052 6 V CA -0.922 61.380 62.300 0.004 0.000 0.908 6 V CB 1.991 33.806 31.823 -0.014 0.000 1.001 6 V HN 0.743 8.933 8.190 0.000 0.000 0.431 7 Q N 2.351 122.146 119.800 -0.009 0.000 2.325 7 Q HA 0.703 5.038 4.340 -0.009 0.000 0.270 7 Q C -0.039 175.953 176.000 -0.013 0.000 1.020 7 Q CA -0.221 55.578 55.803 -0.006 0.000 0.785 7 Q CB 2.652 31.388 28.738 -0.004 0.000 1.259 7 Q HN 1.009 9.279 8.270 0.000 0.000 0.452 8 G N 2.398 111.191 108.800 -0.011 0.000 2.866 8 G HA2 0.712 4.667 3.960 -0.009 0.000 0.289 8 G HA3 0.712 4.667 3.960 -0.009 0.000 0.289 8 G C -2.883 172.011 174.900 -0.010 0.000 1.396 8 G CA -1.139 43.953 45.100 -0.013 0.000 0.848 8 G HN 0.281 8.571 8.290 0.000 0.000 0.515 9 P HA 0.410 4.830 4.420 0.000 0.000 0.276 9 P C -0.769 176.522 177.300 -0.014 0.000 1.244 9 P CA 0.045 63.137 63.100 -0.013 0.000 0.801 9 P CB 1.874 33.567 31.700 -0.011 0.000 1.006 10 T N 0.037 114.581 114.554 -0.017 0.000 2.993 10 T HA 0.308 4.652 4.350 -0.009 0.000 0.312 10 T C -1.173 173.516 174.700 -0.018 0.000 1.115 10 T CA -0.755 61.334 62.100 -0.018 0.000 1.027 10 T CB 0.939 69.794 68.868 -0.022 0.000 1.116 10 T HN 0.407 8.647 8.240 0.000 0.000 0.464 11 K N 5.385 125.776 120.400 -0.016 0.000 2.253 11 K HA 0.548 4.863 4.320 -0.009 0.000 0.277 11 K C -0.575 176.015 176.600 -0.016 0.000 1.053 11 K CA -0.610 55.668 56.287 -0.016 0.000 0.892 11 K CB 0.295 32.787 32.500 -0.013 0.000 1.102 11 K HN 0.513 8.763 8.250 0.000 0.000 0.469 12 L N 6.115 127.330 121.223 -0.014 0.000 2.315 12 L HA 0.227 4.562 4.340 -0.009 0.000 0.283 12 L C -0.038 176.826 176.870 -0.010 0.000 1.089 12 L CA -0.107 54.728 54.840 -0.008 0.000 0.833 12 L CB 0.450 42.513 42.059 0.008 0.000 1.170 12 L HN 0.762 8.992 8.230 0.000 0.000 0.442 13 Q N 2.647 122.436 119.800 -0.017 0.000 2.482 13 Q HA 0.850 5.185 4.340 -0.009 0.000 0.286 13 Q C -0.313 175.666 176.000 -0.034 0.000 1.007 13 Q CA -0.565 55.224 55.803 -0.024 0.000 0.801 13 Q CB 2.752 31.474 28.738 -0.025 0.000 1.455 13 Q HN 0.643 8.913 8.270 0.000 0.000 0.398 14 G N 0.865 109.641 108.800 -0.041 0.000 2.250 14 G HA2 0.052 4.007 3.960 -0.009 0.000 0.189 14 G HA3 0.052 4.007 3.960 -0.009 0.000 0.189 14 G C -1.521 173.342 174.900 -0.063 0.000 1.298 14 G CA -0.029 45.039 45.100 -0.052 0.000 1.246 14 G HN 1.098 9.388 8.290 0.000 0.000 0.513 15 E N -1.897 118.254 120.200 -0.081 0.000 2.433 15 E HA 0.767 5.111 4.350 -0.009 0.000 0.273 15 E C -1.553 174.961 176.600 -0.144 0.000 0.950 15 E CA -1.027 55.316 56.400 -0.094 0.000 0.796 15 E CB 2.712 32.363 29.700 -0.082 0.000 1.330 15 E HN 1.485 9.845 8.360 0.000 0.000 0.455 16 V N 0.508 120.321 119.914 -0.168 0.000 2.932 16 V HA 0.461 4.575 4.120 -0.009 0.000 0.307 16 V C -1.355 174.639 176.094 -0.167 0.000 1.147 16 V CA -0.298 61.845 62.300 -0.261 0.000 0.951 16 V CB 2.493 33.975 31.823 -0.568 0.000 1.031 16 V HN 0.890 9.080 8.190 0.000 0.000 0.426 17 T N 7.322 121.791 114.554 -0.142 0.000 2.767 17 T HA 0.530 4.875 4.350 -0.009 0.000 0.288 17 T C -0.183 174.489 174.700 -0.046 0.000 0.963 17 T CA -0.235 61.824 62.100 -0.067 0.000 1.019 17 T CB 0.652 69.494 68.868 -0.044 0.000 0.923 17 T HN 0.457 8.697 8.240 0.000 0.000 0.468 18 I N 3.188 123.760 120.570 0.003 0.000 2.496 18 I HA 0.194 4.358 4.170 -0.009 0.000 0.285 18 I C 1.133 177.278 176.117 0.046 0.000 1.080 18 I CA -0.111 61.219 61.300 0.050 0.000 1.404 18 I CB 0.503 38.547 38.000 0.072 0.000 1.403 18 I HN 0.567 8.777 8.210 0.000 0.000 0.539 19 S N 3.974 119.715 115.700 0.068 0.000 2.645 19 S HA 0.478 4.942 4.470 -0.009 0.000 0.266 19 S C 0.678 175.299 174.600 0.035 0.000 1.258 19 S CA -0.561 57.669 58.200 0.050 0.000 0.990 19 S CB 1.088 64.328 63.200 0.067 0.000 0.967 19 S HN 0.851 9.161 8.310 0.000 0.000 0.556 20 G N 0.190 109.001 108.800 0.018 0.000 2.491 20 G HA2 0.435 4.389 3.960 -0.009 0.000 0.238 20 G HA3 0.435 4.389 3.960 -0.009 0.000 0.238 20 G C -0.043 174.860 174.900 0.004 0.000 1.277 20 G CA -0.370 44.734 45.100 0.005 0.000 0.851 20 G HN 0.908 9.198 8.290 0.000 0.000 0.573 21 A N 1.671 124.492 122.820 0.000 0.000 2.515 21 A HA 0.222 4.537 4.320 -0.009 0.000 0.263 21 A C 1.673 179.252 177.584 -0.007 0.000 1.096 21 A CA 0.234 52.267 52.037 -0.006 0.000 0.769 21 A CB 0.216 19.212 19.000 -0.006 0.000 1.040 21 A HN 0.907 9.057 8.150 0.000 0.000 0.505 22 K N 2.422 122.811 120.400 -0.018 0.000 2.074 22 K HA -0.197 4.118 4.320 -0.009 0.000 0.209 22 K C 0.526 177.146 176.600 0.032 0.000 1.048 22 K CA 2.019 58.301 56.287 -0.008 0.000 0.926 22 K CB -0.069 32.403 32.500 -0.046 0.000 0.713 22 K HN 0.713 8.963 8.250 0.000 0.000 0.444 23 N N -0.144 118.577 118.700 0.035 0.000 2.383 23 N HA 0.050 4.785 4.740 -0.009 0.000 0.192 23 N C 0.704 176.257 175.510 0.072 0.000 1.141 23 N CA 0.640 53.748 53.050 0.097 0.000 0.851 23 N CB 0.748 39.292 38.487 0.095 0.000 0.976 23 N HN 0.329 8.709 8.380 0.000 0.000 0.465 24 A N 0.177 123.009 122.820 0.019 0.000 1.963 24 A HA 0.392 4.706 4.320 -0.009 0.000 0.207 24 A C 2.204 179.754 177.584 -0.058 0.000 1.243 24 A CA 0.842 52.865 52.037 -0.022 0.000 0.728 24 A CB -0.588 18.406 19.000 -0.009 0.000 0.895 24 A HN 0.172 8.322 8.150 0.000 0.000 0.467 25 A N 0.168 122.966 122.820 -0.037 0.000 1.884 25 A HA -0.157 4.157 4.320 -0.009 0.000 0.219 25 A C 2.049 179.598 177.584 -0.058 0.000 1.197 25 A CA 1.996 53.992 52.037 -0.067 0.000 0.637 25 A CB -0.758 18.219 19.000 -0.039 0.000 0.827 25 A HN 0.404 8.554 8.150 0.000 0.000 0.450 26 L N -0.073 121.185 121.223 0.058 0.000 1.989 26 L HA -0.102 4.233 4.340 -0.009 0.000 0.211 26 L C -0.408 176.602 176.870 0.233 0.000 1.071 26 L CA 2.658 57.630 54.840 0.219 0.000 0.749 26 L CB -1.347 40.976 42.059 0.440 0.000 0.890 26 L HN 0.235 8.465 8.230 0.000 0.000 0.431 27 P HA -0.119 4.301 4.420 0.000 0.000 0.217 27 P C 2.069 179.217 177.300 -0.254 0.000 1.150 27 P CA 1.410 64.215 63.100 -0.492 0.000 0.832 27 P CB 0.063 31.285 31.700 -0.796 0.000 0.787 28 I N -1.451 118.954 120.570 -0.275 0.000 2.202 28 I HA -0.223 3.941 4.170 -0.009 0.000 0.242 28 I C 2.042 177.922 176.117 -0.396 0.000 1.091 28 I CA 1.139 62.160 61.300 -0.466 0.000 1.368 28 I CB -0.705 36.884 38.000 -0.684 0.000 1.058 28 I HN -0.130 8.080 8.210 0.000 0.000 0.410 29 L N -0.089 120.953 121.223 -0.302 0.000 2.081 29 L HA -0.240 4.094 4.340 -0.009 0.000 0.212 29 L C 2.165 178.874 176.870 -0.267 0.000 1.080 29 L CA 2.134 56.792 54.840 -0.304 0.000 0.754 29 L CB -0.842 40.988 42.059 -0.381 0.000 0.893 29 L HN 0.116 8.346 8.230 0.000 0.000 0.433 30 F N -1.345 118.586 119.950 -0.031 0.000 2.367 30 F HA 0.020 4.532 4.527 -0.025 0.000 0.298 30 F C 2.348 178.168 175.800 0.032 0.000 1.094 30 F CA 0.740 58.760 58.000 0.034 0.000 1.409 30 F CB -0.872 38.182 39.000 0.090 0.000 1.064 30 F HN 0.020 8.320 8.300 0.000 0.000 0.528 31 A N 0.054 122.965 122.820 0.152 0.000 2.067 31 A HA 0.020 4.335 4.320 -0.009 0.000 0.219 31 A C 2.365 180.098 177.584 0.247 0.000 1.158 31 A CA 1.303 53.445 52.037 0.175 0.000 0.661 31 A CB -1.074 18.042 19.000 0.193 0.000 0.801 31 A HN 0.263 8.413 8.150 0.000 0.000 0.452 32 A N -0.087 122.869 122.820 0.226 0.000 2.070 32 A HA -0.025 4.289 4.320 -0.009 0.000 0.220 32 A C 1.949 179.635 177.584 0.169 0.000 1.159 32 A CA 1.219 53.396 52.037 0.233 0.000 0.656 32 A CB -0.584 18.500 19.000 0.140 0.000 0.800 32 A HN 0.496 8.646 8.150 0.000 0.000 0.453 33 L N -0.787 120.541 121.223 0.176 0.000 2.349 33 L HA -0.168 4.166 4.340 -0.009 0.000 0.220 33 L C 2.086 179.078 176.870 0.202 0.000 1.130 33 L CA 0.685 55.654 54.840 0.215 0.000 0.791 33 L CB -0.400 41.821 42.059 0.269 0.000 0.918 33 L HN 0.418 8.648 8.230 0.000 0.000 0.444 34 L N -0.626 120.679 121.223 0.137 0.000 2.341 34 L HA 0.090 4.425 4.340 -0.009 0.000 0.214 34 L C 1.405 178.288 176.870 0.020 0.000 1.115 34 L CA -0.300 54.574 54.840 0.057 0.000 0.820 34 L CB -0.319 41.757 42.059 0.028 0.000 0.944 34 L HN 0.127 8.357 8.230 0.000 0.000 0.452 35 A N 0.307 123.158 122.820 0.051 0.000 2.401 35 A HA 0.154 4.469 4.320 -0.009 0.000 0.259 35 A C 0.801 178.406 177.584 0.035 0.000 1.103 35 A CA -0.188 51.862 52.037 0.023 0.000 0.789 35 A CB 0.251 19.277 19.000 0.044 0.000 1.035 35 A HN 0.319 8.469 8.150 0.000 0.000 0.491 36 E N 0.884 121.089 120.200 0.008 0.000 2.498 36 E HA 0.093 4.438 4.350 -0.009 0.000 0.203 36 E C -0.237 176.377 176.600 0.024 0.000 1.013 36 E CA 0.263 56.673 56.400 0.017 0.000 0.927 36 E CB 0.560 30.255 29.700 -0.009 0.000 1.012 36 E HN 0.824 9.184 8.360 0.000 0.000 0.482 37 E N 0.444 120.657 120.200 0.022 0.000 2.410 37 E HA 0.311 4.656 4.350 -0.009 0.000 0.269 37 E C -2.690 173.938 176.600 0.047 0.000 0.937 37 E CA -2.362 54.056 56.400 0.031 0.000 0.793 37 E CB 2.182 31.893 29.700 0.019 0.000 1.314 37 E HN -0.158 8.202 8.360 0.000 0.000 0.447 38 P HA 0.124 4.544 4.420 0.000 0.000 0.278 38 P C -1.219 176.141 177.300 0.099 0.000 1.238 38 P CA -0.238 62.912 63.100 0.083 0.000 0.794 38 P CB 0.853 32.603 31.700 0.083 0.000 0.955 39 V N 1.775 121.763 119.914 0.124 0.000 2.769 39 V HA 0.395 4.509 4.120 -0.009 0.000 0.312 39 V C -0.680 175.483 176.094 0.116 0.000 1.061 39 V CA -0.817 61.571 62.300 0.146 0.000 0.931 39 V CB 1.845 33.802 31.823 0.224 0.000 1.010 39 V HN 0.550 8.740 8.190 0.000 0.000 0.433 40 E N 4.885 125.133 120.200 0.079 0.000 2.155 40 E HA 0.482 4.827 4.350 -0.009 0.000 0.264 40 E C -1.621 174.958 176.600 -0.034 0.000 0.886 40 E CA -0.720 55.629 56.400 -0.085 0.000 0.752 40 E CB 1.553 31.170 29.700 -0.137 0.000 1.133 40 E HN 0.626 8.986 8.360 0.000 0.000 0.414 41 I N 4.320 124.831 120.570 -0.099 0.000 2.312 41 I HA 0.136 4.300 4.170 -0.009 0.000 0.290 41 I C 0.257 176.320 176.117 -0.090 0.000 1.008 41 I CA -0.136 61.123 61.300 -0.067 0.000 1.226 41 I CB 1.433 39.350 38.000 -0.140 0.000 1.371 41 I HN 0.459 8.669 8.210 0.000 0.000 0.468 42 Q N 3.932 123.699 119.800 -0.054 0.000 2.193 42 Q HA 0.357 4.691 4.340 -0.009 0.000 0.246 42 Q C 0.359 176.327 176.000 -0.053 0.000 0.959 42 Q CA -0.756 55.009 55.803 -0.064 0.000 0.904 42 Q CB 0.662 29.364 28.738 -0.059 0.000 1.238 42 Q HN 0.548 8.818 8.270 0.000 0.000 0.469 43 N N -0.406 118.268 118.700 -0.044 0.000 2.758 43 N HA -0.160 4.575 4.740 -0.009 0.000 0.248 43 N C -1.762 173.732 175.510 -0.027 0.000 1.076 43 N CA 0.256 53.287 53.050 -0.032 0.000 0.696 43 N CB -0.942 37.524 38.487 -0.036 0.000 0.979 43 N HN 0.322 8.702 8.380 0.000 0.000 0.550 44 V N 1.839 121.734 119.914 -0.031 0.000 2.432 44 V HA 0.442 4.557 4.120 -0.009 0.000 0.275 44 V C -1.489 174.598 176.094 -0.012 0.000 1.043 44 V CA -1.123 61.160 62.300 -0.029 0.000 0.925 44 V CB 1.439 33.234 31.823 -0.047 0.000 0.985 44 V HN 0.197 8.387 8.190 0.000 0.000 0.466 45 P HA 0.173 4.593 4.420 0.000 0.000 0.271 45 P C -0.844 176.465 177.300 0.016 0.000 1.218 45 P CA -0.459 62.649 63.100 0.014 0.000 0.780 45 P CB 0.754 32.464 31.700 0.016 0.000 0.901 46 K N 2.789 123.207 120.400 0.030 0.000 2.183 46 K HA 0.400 4.714 4.320 -0.009 0.000 0.272 46 K C -0.175 176.452 176.600 0.044 0.000 1.113 46 K CA -0.138 56.168 56.287 0.032 0.000 0.949 46 K CB -0.051 32.470 32.500 0.035 0.000 1.365 46 K HN 0.423 8.673 8.250 0.000 0.000 0.420 47 L N 1.802 123.045 121.223 0.035 0.000 2.371 47 L HA 0.321 4.656 4.340 -0.009 0.000 0.262 47 L C 1.036 177.927 176.870 0.036 0.000 1.006 47 L CA -0.975 53.890 54.840 0.041 0.000 0.818 47 L CB 1.771 43.846 42.059 0.027 0.000 1.354 47 L HN 0.304 8.534 8.230 0.000 0.000 0.415 48 K N 0.564 120.990 120.400 0.045 0.000 2.147 48 K HA -0.140 4.174 4.320 -0.009 0.000 0.205 48 K C 1.163 177.785 176.600 0.036 0.000 1.049 48 K CA 1.524 57.835 56.287 0.039 0.000 0.936 48 K CB 0.086 32.615 32.500 0.048 0.000 0.722 48 K HN 0.532 8.782 8.250 0.000 0.000 0.446 49 D N -0.579 119.845 120.400 0.041 0.000 2.178 49 D HA -0.115 4.519 4.640 -0.009 0.000 0.201 49 D C 1.661 177.991 176.300 0.050 0.000 0.980 49 D CA 0.820 54.852 54.000 0.052 0.000 0.842 49 D CB 0.052 40.885 40.800 0.054 0.000 0.948 49 D HN -0.004 8.366 8.370 0.000 0.000 0.472 50 V N 1.084 121.014 119.914 0.026 0.000 2.358 50 V HA -0.191 3.924 4.120 -0.009 0.000 0.246 50 V C 1.753 177.840 176.094 -0.012 0.000 1.047 50 V CA 1.526 63.825 62.300 -0.001 0.000 1.035 50 V CB -0.327 31.489 31.823 -0.010 0.000 0.658 50 V HN 0.090 8.280 8.190 0.000 0.000 0.452 51 D N 0.159 120.561 120.400 0.003 0.000 2.092 51 D HA -0.156 4.479 4.640 -0.009 0.000 0.193 51 D C 2.285 178.587 176.300 0.002 0.000 0.994 51 D CA 2.021 56.021 54.000 0.001 0.000 0.828 51 D CB -0.628 40.177 40.800 0.008 0.000 0.963 51 D HN 0.372 8.742 8.370 0.000 0.000 0.450 52 T N 0.373 114.938 114.554 0.019 0.000 2.759 52 T HA -0.116 4.228 4.350 -0.009 0.000 0.269 52 T C 2.169 176.897 174.700 0.047 0.000 1.042 52 T CA 1.450 63.571 62.100 0.035 0.000 1.140 52 T CB -0.257 68.642 68.868 0.051 0.000 0.864 52 T HN 0.045 8.285 8.240 0.000 0.000 0.455 53 S N 1.255 116.971 115.700 0.026 0.000 2.356 53 S HA -0.020 4.445 4.470 -0.009 0.000 0.223 53 S C 2.134 176.646 174.600 -0.148 0.000 1.032 53 S CA 1.160 59.311 58.200 -0.081 0.000 1.005 53 S CB -0.374 62.695 63.200 -0.219 0.000 0.867 53 S HN 0.434 8.744 8.310 0.000 0.000 0.449 54 M N 1.109 120.648 119.600 -0.102 0.000 2.117 54 M HA -0.161 4.314 4.480 -0.009 0.000 0.262 54 M C 2.268 178.543 176.300 -0.043 0.000 1.065 54 M CA 1.569 56.820 55.300 -0.081 0.000 1.114 54 M CB -0.480 32.089 32.600 -0.051 0.000 1.361 54 M HN 0.203 8.493 8.290 0.000 0.000 0.408 55 K N 0.988 121.377 120.400 -0.018 0.000 2.063 55 K HA -0.210 4.105 4.320 -0.009 0.000 0.208 55 K C 1.753 178.359 176.600 0.010 0.000 1.048 55 K CA 1.422 57.708 56.287 -0.002 0.000 0.928 55 K CB -0.405 32.100 32.500 0.007 0.000 0.713 55 K HN 0.185 8.435 8.250 0.000 0.000 0.442 56 L N 0.437 121.677 121.223 0.030 0.000 2.044 56 L HA -0.012 4.323 4.340 -0.009 0.000 0.205 56 L C 1.860 178.757 176.870 0.046 0.000 1.075 56 L CA 1.422 56.306 54.840 0.072 0.000 0.747 56 L CB -0.724 41.442 42.059 0.179 0.000 0.903 56 L HN 0.222 8.452 8.230 0.000 0.000 0.435 57 L N -0.341 120.879 121.223 -0.006 0.000 1.990 57 L HA -0.252 4.083 4.340 -0.009 0.000 0.213 57 L C 2.908 179.770 176.870 -0.013 0.000 1.072 57 L CA 2.213 57.040 54.840 -0.021 0.000 0.755 57 L CB -1.476 40.534 42.059 -0.083 0.000 0.889 57 L HN 0.526 8.756 8.230 0.000 0.000 0.432 58 S N -1.228 114.461 115.700 -0.019 0.000 2.365 58 S HA -0.336 4.129 4.470 -0.009 0.000 0.225 58 S C 2.089 176.674 174.600 -0.026 0.000 1.039 58 S CA 1.882 60.071 58.200 -0.019 0.000 1.033 58 S CB -0.321 62.870 63.200 -0.015 0.000 0.887 58 S HN 0.546 8.856 8.310 0.000 0.000 0.447 59 Q N -0.131 119.658 119.800 -0.018 0.000 2.181 59 Q HA -0.045 4.290 4.340 -0.009 0.000 0.205 59 Q C 2.009 177.976 176.000 -0.056 0.000 0.980 59 Q CA 1.548 57.336 55.803 -0.025 0.000 0.862 59 Q CB -0.203 28.534 28.738 -0.002 0.000 0.905 59 Q HN 0.626 8.896 8.270 0.000 0.000 0.429 60 L N -1.825 119.366 121.223 -0.054 0.000 2.478 60 L HA 0.085 4.420 4.340 -0.009 0.000 0.223 60 L C 1.280 178.051 176.870 -0.166 0.000 1.140 60 L CA 0.678 55.450 54.840 -0.114 0.000 0.842 60 L CB 0.189 42.216 42.059 -0.053 0.000 0.953 60 L HN 0.534 8.764 8.230 0.000 0.000 0.452 61 G N -0.820 107.919 108.800 -0.101 0.000 2.205 61 G HA2 -0.133 3.821 3.960 -0.009 0.000 0.180 61 G HA3 -0.133 3.821 3.960 -0.009 0.000 0.180 61 G C 0.264 175.139 174.900 -0.042 0.000 1.004 61 G CA -0.191 44.854 45.100 -0.093 0.000 0.670 61 G HN 0.399 8.689 8.290 0.000 0.000 0.496 62 A N -0.256 122.552 122.820 -0.020 0.000 2.304 62 A HA 0.778 5.093 4.320 -0.009 0.000 0.271 62 A C 0.191 177.778 177.584 0.005 0.000 1.091 62 A CA 0.101 52.144 52.037 0.009 0.000 0.812 62 A CB 0.606 19.619 19.000 0.021 0.000 1.056 62 A HN 0.234 8.384 8.150 0.000 0.000 0.489 63 K N 0.423 120.834 120.400 0.018 0.000 2.281 63 K HA 0.555 4.870 4.320 -0.009 0.000 0.272 63 K C -1.352 175.263 176.600 0.025 0.000 1.048 63 K CA 0.073 56.369 56.287 0.015 0.000 0.898 63 K CB 1.364 33.874 32.500 0.017 0.000 1.128 63 K HN 0.354 8.604 8.250 0.000 0.000 0.460 64 V N 4.218 124.142 119.914 0.017 0.000 2.577 64 V HA 0.496 4.610 4.120 -0.009 0.000 0.303 64 V C -0.476 175.635 176.094 0.028 0.000 1.042 64 V CA -0.810 61.504 62.300 0.024 0.000 0.872 64 V CB 1.596 33.418 31.823 -0.001 0.000 0.998 64 V HN 0.854 9.044 8.190 0.000 0.000 0.423 65 E N 4.965 125.201 120.200 0.060 0.000 2.456 65 E HA 0.886 5.231 4.350 -0.009 0.000 0.276 65 E C -1.101 175.556 176.600 0.095 0.000 0.981 65 E CA -1.308 55.127 56.400 0.059 0.000 0.814 65 E CB 3.447 33.170 29.700 0.038 0.000 1.382 65 E HN 0.710 9.070 8.360 0.000 0.000 0.459 66 R N -0.365 120.181 120.500 0.078 0.000 2.765 66 R HA 0.201 4.535 4.340 -0.009 0.000 0.277 66 R C -1.009 175.324 176.300 0.055 0.000 1.028 66 R CA -0.114 56.028 56.100 0.071 0.000 0.860 66 R CB 0.390 30.705 30.300 0.026 0.000 1.270 66 R HN 0.549 8.819 8.270 0.000 0.000 0.484 67 D N 0.962 121.390 120.400 0.047 0.000 2.041 67 D HA 0.087 4.722 4.640 -0.009 0.000 0.263 67 D C 1.392 177.707 176.300 0.024 0.000 1.038 67 D CA 1.050 55.071 54.000 0.036 0.000 0.903 67 D CB -0.767 40.050 40.800 0.030 0.000 1.013 67 D HN 0.606 8.976 8.370 0.000 0.000 0.408 68 G N -1.499 107.309 108.800 0.013 0.000 2.762 68 G HA2 0.246 4.200 3.960 -0.009 0.000 0.209 68 G HA3 0.246 4.200 3.960 -0.009 0.000 0.209 68 G C 0.371 175.257 174.900 -0.023 0.000 1.134 68 G CA 0.005 45.104 45.100 -0.002 0.000 0.781 68 G HN 0.336 8.626 8.290 0.000 0.000 0.528 69 S N -0.917 114.761 115.700 -0.036 0.000 2.600 69 S HA 0.664 5.128 4.470 -0.009 0.000 0.300 69 S C -0.706 173.825 174.600 -0.115 0.000 1.087 69 S CA -0.465 57.674 58.200 -0.101 0.000 0.965 69 S CB 2.573 65.671 63.200 -0.170 0.000 1.089 69 S HN -0.005 8.305 8.310 0.000 0.000 0.496 70 V N 2.563 122.383 119.914 -0.156 0.000 2.630 70 V HA 0.447 4.561 4.120 -0.009 0.000 0.305 70 V C -0.642 175.323 176.094 -0.214 0.000 1.046 70 V CA -0.646 61.583 62.300 -0.117 0.000 0.934 70 V CB 1.440 33.211 31.823 -0.086 0.000 1.003 70 V HN 0.792 8.982 8.190 0.000 0.000 0.451 71 H N 4.386 123.452 119.070 -0.006 0.000 2.505 71 H HA 0.599 5.151 4.556 -0.007 0.000 0.338 71 H C -0.949 174.381 175.328 0.004 0.000 1.057 71 H CA -0.286 55.767 56.048 0.007 0.000 1.202 71 H CB 1.960 31.727 29.762 0.009 0.000 1.466 71 H HN 0.450 8.730 8.280 0.000 0.000 0.499 72 I N 2.743 123.386 120.570 0.123 0.000 2.466 72 I HA 0.072 4.237 4.170 -0.009 0.000 0.289 72 I C -0.391 175.781 176.117 0.091 0.000 1.026 72 I CA -0.583 60.765 61.300 0.080 0.000 1.078 72 I CB 2.188 40.214 38.000 0.043 0.000 1.249 72 I HN 0.411 8.621 8.210 0.000 0.000 0.429 73 D N 5.585 126.028 120.400 0.073 0.000 2.461 73 D HA 0.491 5.126 4.640 -0.009 0.000 0.240 73 D C 0.050 176.390 176.300 0.067 0.000 1.094 73 D CA -0.329 53.712 54.000 0.068 0.000 0.868 73 D CB 1.930 42.761 40.800 0.052 0.000 1.062 73 D HN 0.625 8.995 8.370 0.000 0.000 0.530 74 A N 4.319 127.191 122.820 0.086 0.000 2.500 74 A HA 0.165 4.480 4.320 -0.009 0.000 0.267 74 A C 1.768 179.437 177.584 0.141 0.000 1.290 74 A CA -0.228 51.877 52.037 0.112 0.000 0.928 74 A CB 0.012 19.093 19.000 0.136 0.000 1.066 74 A HN 0.516 8.666 8.150 0.000 0.000 0.516 75 R N 0.222 120.786 120.500 0.107 0.000 2.075 75 R HA -0.076 4.258 4.340 -0.009 0.000 0.232 75 R C 0.089 176.470 176.300 0.136 0.000 1.126 75 R CA 1.419 57.587 56.100 0.113 0.000 0.963 75 R CB -0.056 30.289 30.300 0.074 0.000 0.858 75 R HN 0.287 8.557 8.270 0.000 0.000 0.435 76 D N 0.410 120.866 120.400 0.093 0.000 2.370 76 D HA 0.064 4.698 4.640 -0.009 0.000 0.230 76 D C -0.438 175.877 176.300 0.023 0.000 1.143 76 D CA 0.083 54.121 54.000 0.064 0.000 0.834 76 D CB 0.263 41.081 40.800 0.029 0.000 0.944 76 D HN -0.114 8.256 8.370 0.000 0.000 0.504 77 V N 2.914 122.860 119.914 0.053 0.000 2.557 77 V HA -0.027 4.088 4.120 -0.009 0.000 0.301 77 V C 1.229 177.138 176.094 -0.307 0.000 1.026 77 V CA 0.513 62.749 62.300 -0.105 0.000 1.137 77 V CB 0.458 32.265 31.823 -0.027 0.000 0.917 77 V HN 0.348 8.538 8.190 0.000 0.000 0.484 78 N N 3.380 121.781 118.700 -0.498 0.000 2.036 78 N HA 0.066 4.801 4.740 -0.009 0.000 0.228 78 N C -0.517 174.375 175.510 -1.030 0.000 1.368 78 N CA -0.011 52.688 53.050 -0.585 0.000 0.846 78 N CB 0.890 39.241 38.487 -0.226 0.000 1.145 78 N HN 0.427 8.807 8.380 0.000 0.000 0.502 79 V N 0.750 120.017 119.914 -1.078 0.000 2.680 79 V HA 0.640 4.754 4.120 -0.009 0.000 0.309 79 V C -1.200 174.263 176.094 -1.051 0.000 1.052 79 V CA -0.765 60.947 62.300 -0.979 0.000 0.908 79 V CB 1.433 33.012 31.823 -0.407 0.000 1.001 79 V HN 0.026 8.216 8.190 0.000 0.000 0.431 80 F N 4.355 124.236 119.950 -0.114 0.000 2.805 80 F HA 0.489 5.009 4.527 -0.010 0.000 0.317 80 F C 0.209 175.997 175.800 -0.020 0.000 1.146 80 F CA -0.388 57.560 58.000 -0.087 0.000 1.265 80 F CB 0.620 39.563 39.000 -0.096 0.000 0.992 80 F HN 0.483 8.783 8.300 0.000 0.000 0.511 81 C N 1.730 121.069 119.300 0.065 0.000 2.441 81 C HA 0.868 5.322 4.460 -0.009 0.000 0.318 81 C C 0.001 175.050 174.990 0.100 0.000 1.222 81 C CA -0.467 58.598 59.018 0.078 0.000 1.474 81 C CB -0.020 27.717 27.740 -0.005 0.000 2.125 81 C HN 0.454 8.684 8.230 0.000 0.000 0.479 82 A N 8.619 131.533 122.820 0.157 0.000 2.294 82 A HA 0.681 4.995 4.320 -0.009 0.000 0.316 82 A C -2.431 175.296 177.584 0.239 0.000 1.359 82 A CA -1.067 51.065 52.037 0.158 0.000 0.956 82 A CB 0.083 19.159 19.000 0.127 0.000 1.155 82 A HN 0.797 8.947 8.150 0.000 0.000 0.544 83 P HA 0.016 4.436 4.420 0.000 0.000 0.277 83 P C 0.435 177.880 177.300 0.242 0.000 1.240 83 P CA -0.172 63.130 63.100 0.336 0.000 0.798 83 P CB 0.688 32.510 31.700 0.203 0.000 0.979 84 Y N 2.264 122.644 120.300 0.133 0.000 2.096 84 Y HA -0.342 4.206 4.550 -0.004 0.000 0.278 84 Y C 1.865 177.762 175.900 -0.006 0.000 1.192 84 Y CA 2.365 60.443 58.100 -0.037 0.000 1.143 84 Y CB -0.710 37.714 38.460 -0.059 0.000 0.963 84 Y HN 0.289 8.569 8.280 0.000 0.000 0.505 85 D N -0.140 120.339 120.400 0.132 0.000 2.182 85 D HA -0.166 4.469 4.640 -0.009 0.000 0.201 85 D C 2.035 178.300 176.300 -0.057 0.000 0.986 85 D CA 1.393 55.415 54.000 0.036 0.000 0.847 85 D CB -0.195 40.662 40.800 0.095 0.000 0.942 85 D HN 0.391 8.761 8.370 0.000 0.000 0.467 86 L N -0.418 120.785 121.223 -0.032 0.000 2.130 86 L HA -0.060 4.275 4.340 -0.009 0.000 0.200 86 L C 2.463 179.284 176.870 -0.082 0.000 1.075 86 L CA 0.458 55.280 54.840 -0.030 0.000 0.768 86 L CB -0.307 41.768 42.059 0.028 0.000 0.933 86 L HN -0.139 8.091 8.230 0.000 0.000 0.451 87 V N 0.911 120.758 119.914 -0.111 0.000 2.324 87 V HA -0.375 3.739 4.120 -0.009 0.000 0.250 87 V C 2.518 178.475 176.094 -0.229 0.000 1.060 87 V CA 2.320 64.525 62.300 -0.160 0.000 1.042 87 V CB -1.099 30.616 31.823 -0.180 0.000 0.650 87 V HN 0.626 8.816 8.190 0.000 0.000 0.450 88 K N 1.343 121.527 120.400 -0.361 0.000 2.209 88 K HA -0.207 4.108 4.320 -0.009 0.000 0.204 88 K C 1.881 178.363 176.600 -0.197 0.000 1.048 88 K CA 1.976 58.039 56.287 -0.373 0.000 0.940 88 K CB -0.666 31.473 32.500 -0.602 0.000 0.729 88 K HN 0.615 8.865 8.250 0.000 0.000 0.451 89 T N -2.120 112.348 114.554 -0.143 0.000 3.081 89 T HA 0.117 4.462 4.350 -0.009 0.000 0.255 89 T C 0.737 175.409 174.700 -0.046 0.000 1.113 89 T CA -0.107 61.950 62.100 -0.073 0.000 1.082 89 T CB -0.000 68.836 68.868 -0.053 0.000 0.939 89 T HN 0.286 8.526 8.240 0.000 0.000 0.506 90 M N 2.025 121.585 119.600 -0.066 0.000 2.380 90 M HA 0.313 4.788 4.480 -0.009 0.000 0.202 90 M C 0.599 176.836 176.300 -0.106 0.000 0.975 90 M CA -0.640 54.628 55.300 -0.054 0.000 0.971 90 M CB 1.266 33.869 32.600 0.005 0.000 2.685 90 M HN 0.156 8.446 8.290 0.000 0.000 0.431 91 R N 1.746 122.156 120.500 -0.150 0.000 2.293 91 R HA 0.018 4.352 4.340 -0.009 0.000 0.219 91 R C 1.044 177.159 176.300 -0.308 0.000 1.091 91 R CA 1.466 57.438 56.100 -0.214 0.000 1.004 91 R CB -0.394 29.781 30.300 -0.209 0.000 0.865 91 R HN 0.639 8.909 8.270 0.000 0.000 0.469 92 A N 1.280 123.919 122.820 -0.302 0.000 2.121 92 A HA -0.053 4.262 4.320 -0.009 0.000 0.218 92 A C 2.078 179.382 177.584 -0.466 0.000 1.154 92 A CA 1.223 52.970 52.037 -0.483 0.000 0.679 92 A CB -0.348 18.471 19.000 -0.302 0.000 0.795 92 A HN 0.428 8.578 8.150 0.000 0.000 0.458 93 S N -0.149 115.385 115.700 -0.276 0.000 2.423 93 S HA -0.240 4.225 4.470 -0.009 0.000 0.238 93 S C 1.681 176.058 174.600 -0.371 0.000 1.028 93 S CA 1.512 59.546 58.200 -0.277 0.000 1.000 93 S CB -0.514 62.648 63.200 -0.063 0.000 0.797 93 S HN 0.622 8.932 8.310 0.000 0.000 0.487 94 I N 0.782 121.137 120.570 -0.357 0.000 2.502 94 I HA -0.158 4.007 4.170 -0.009 0.000 0.258 94 I C 1.499 177.492 176.117 -0.207 0.000 1.172 94 I CA 0.950 62.069 61.300 -0.301 0.000 1.430 94 I CB -0.373 37.368 38.000 -0.433 0.000 1.086 94 I HN 0.385 8.595 8.210 0.000 0.000 0.440 95 W N 0.549 121.574 121.300 -0.459 0.000 2.611 95 W HA 0.034 4.660 4.660 -0.058 0.000 0.251 95 W C 2.423 178.754 176.519 -0.313 0.000 1.265 95 W CA 0.860 57.963 57.345 -0.402 0.000 1.295 95 W CB -1.093 28.042 29.460 -0.542 0.000 1.129 95 W HN 0.308 8.488 8.180 0.000 0.000 0.630 96 A N -0.232 122.512 122.820 -0.126 0.000 1.969 96 A HA -0.140 4.175 4.320 -0.009 0.000 0.218 96 A C 1.960 179.642 177.584 0.163 0.000 1.169 96 A CA 1.191 53.307 52.037 0.131 0.000 0.635 96 A CB -0.715 18.396 19.000 0.186 0.000 0.810 96 A HN 0.147 8.297 8.150 0.000 0.000 0.445 97 L N 0.319 121.613 121.223 0.118 0.000 1.971 97 L HA -0.109 4.226 4.340 -0.009 0.000 0.215 97 L C 2.435 179.394 176.870 0.148 0.000 1.072 97 L CA 2.507 57.424 54.840 0.129 0.000 0.758 97 L CB -1.308 40.811 42.059 0.099 0.000 0.889 97 L HN 0.325 8.555 8.230 0.000 0.000 0.433 98 G N -0.569 108.326 108.800 0.158 0.000 2.628 98 G HA2 -0.277 3.678 3.960 -0.009 0.000 0.217 98 G HA3 -0.277 3.678 3.960 -0.009 0.000 0.217 98 G C -0.583 174.397 174.900 0.133 0.000 1.240 98 G CA 1.149 46.333 45.100 0.140 0.000 0.792 98 G HN 0.408 8.698 8.290 0.000 0.000 0.593 99 P HA -0.066 4.354 4.420 0.000 0.000 0.215 99 P C 2.174 179.605 177.300 0.217 0.000 1.153 99 P CA 0.810 64.008 63.100 0.163 0.000 0.853 99 P CB -0.171 31.650 31.700 0.201 0.000 0.788 100 L N -1.142 120.244 121.223 0.273 0.000 2.012 100 L HA -0.171 4.163 4.340 -0.009 0.000 0.210 100 L C 2.342 179.374 176.870 0.270 0.000 1.073 100 L CA 1.600 56.662 54.840 0.369 0.000 0.748 100 L CB -1.212 41.035 42.059 0.313 0.000 0.891 100 L HN -0.105 8.125 8.230 0.000 0.000 0.431 101 V N -0.132 119.876 119.914 0.157 0.000 2.427 101 V HA -0.216 3.899 4.120 -0.009 0.000 0.248 101 V C 2.719 178.847 176.094 0.055 0.000 1.051 101 V CA 1.574 63.927 62.300 0.087 0.000 1.048 101 V CB -0.851 31.014 31.823 0.070 0.000 0.666 101 V HN 0.459 8.649 8.190 0.000 0.000 0.456 102 A N 0.101 122.955 122.820 0.057 0.000 1.902 102 A HA -0.229 4.086 4.320 -0.009 0.000 0.217 102 A C 2.430 179.987 177.584 -0.044 0.000 1.181 102 A CA 2.150 54.194 52.037 0.011 0.000 0.623 102 A CB -0.413 18.598 19.000 0.018 0.000 0.818 102 A HN 0.493 8.643 8.150 0.000 0.000 0.443 103 R N -2.434 118.022 120.500 -0.072 0.000 2.105 103 R HA 0.141 4.476 4.340 -0.009 0.000 0.214 103 R C 0.885 176.910 176.300 -0.458 0.000 1.091 103 R CA 0.959 56.870 56.100 -0.315 0.000 1.007 103 R CB -0.020 29.989 30.300 -0.486 0.000 0.912 103 R HN 0.463 8.733 8.270 0.000 0.000 0.450 104 F N -0.915 119.009 119.950 -0.044 0.000 2.682 104 F HA 0.398 4.919 4.527 -0.011 0.000 0.308 104 F C 1.311 176.984 175.800 -0.212 0.000 1.093 104 F CA 0.369 58.280 58.000 -0.149 0.000 1.244 104 F CB 1.404 40.227 39.000 -0.294 0.000 1.052 104 F HN 0.278 8.578 8.300 0.000 0.000 0.573 105 G N 1.081 109.881 108.800 -0.000 0.000 2.184 105 G HA2 -0.268 3.687 3.960 -0.009 0.000 0.264 105 G HA3 -0.268 3.687 3.960 -0.009 0.000 0.264 105 G C 0.072 174.941 174.900 -0.052 0.000 0.975 105 G CA 0.507 45.589 45.100 -0.030 0.000 0.642 105 G HN 0.514 8.804 8.290 0.000 0.000 0.536 106 Q N -1.555 118.190 119.800 -0.091 0.000 2.462 106 Q HA 0.713 5.047 4.340 -0.009 0.000 0.285 106 Q C -0.403 175.580 176.000 -0.029 0.000 1.035 106 Q CA -0.726 55.019 55.803 -0.097 0.000 0.799 106 Q CB 2.113 30.740 28.738 -0.185 0.000 1.452 106 Q HN 1.488 9.758 8.270 0.000 0.000 0.404 107 G N 0.973 109.798 108.800 0.041 0.000 2.717 107 G HA2 0.458 4.412 3.960 -0.009 0.000 0.300 107 G HA3 0.458 4.412 3.960 -0.009 0.000 0.300 107 G C -2.004 172.964 174.900 0.114 0.000 1.424 107 G CA -0.600 44.571 45.100 0.117 0.000 1.033 107 G HN 0.360 8.650 8.290 0.000 0.000 0.577 108 Q N 0.362 120.245 119.800 0.138 0.000 2.320 108 Q HA 0.631 4.966 4.340 -0.009 0.000 0.268 108 Q C -0.494 175.634 176.000 0.214 0.000 1.023 108 Q CA -0.594 55.296 55.803 0.145 0.000 0.744 108 Q CB 2.757 31.532 28.738 0.061 0.000 1.246 108 Q HN 0.476 8.746 8.270 0.000 0.000 0.462 109 V N 1.132 121.179 119.914 0.222 0.000 2.604 109 V HA 0.506 4.620 4.120 -0.009 0.000 0.305 109 V C -0.106 176.078 176.094 0.150 0.000 1.043 109 V CA -0.929 61.486 62.300 0.191 0.000 0.888 109 V CB 2.195 34.061 31.823 0.072 0.000 0.995 109 V HN 0.764 8.954 8.190 0.000 0.000 0.429 110 S N 4.708 120.426 115.700 0.030 0.000 2.537 110 S HA 0.177 4.641 4.470 -0.009 0.000 0.286 110 S C -0.117 174.375 174.600 -0.181 0.000 1.299 110 S CA -0.430 57.580 58.200 -0.317 0.000 1.067 110 S CB 0.109 63.100 63.200 -0.348 0.000 0.864 110 S HN 0.606 8.916 8.310 0.000 0.000 0.494 111 L N 7.331 128.453 121.223 -0.168 0.000 2.500 111 L HA 0.342 4.677 4.340 -0.009 0.000 0.272 111 L C -2.024 174.777 176.870 -0.116 0.000 1.149 111 L CA -1.306 53.466 54.840 -0.113 0.000 0.897 111 L CB 0.211 42.225 42.059 -0.074 0.000 1.178 111 L HN 0.569 8.799 8.230 0.000 0.000 0.473 112 P HA 0.231 4.651 4.420 0.000 0.000 0.269 112 P C 0.095 177.340 177.300 -0.093 0.000 1.215 112 P CA -0.279 62.738 63.100 -0.139 0.000 0.780 112 P CB 0.793 32.394 31.700 -0.165 0.000 0.898 113 G N 0.577 109.328 108.800 -0.082 0.000 3.227 113 G HA2 0.526 4.481 3.960 -0.009 0.000 0.171 113 G HA3 0.526 4.481 3.960 -0.009 0.000 0.171 113 G C -0.065 174.807 174.900 -0.047 0.000 1.463 113 G CA -0.415 44.659 45.100 -0.044 0.000 1.016 113 G HN 0.641 8.931 8.290 0.000 0.000 0.594 114 G N -1.501 107.279 108.800 -0.033 0.000 2.432 114 G HA2 0.421 4.376 3.960 -0.009 0.000 0.257 114 G HA3 0.421 4.376 3.960 -0.009 0.000 0.257 114 G C -0.677 174.194 174.900 -0.049 0.000 1.238 114 G CA -0.032 45.049 45.100 -0.032 0.000 0.838 114 G HN 0.596 8.886 8.290 0.000 0.000 0.547 115 C N 1.755 121.018 119.300 -0.061 0.000 2.493 115 C HA 0.619 5.074 4.460 -0.009 0.000 0.326 115 C C 2.077 177.018 174.990 -0.082 0.000 1.200 115 C CA 0.132 59.097 59.018 -0.087 0.000 1.739 115 C CB 1.118 28.777 27.740 -0.135 0.000 2.300 115 C HN 0.971 9.201 8.230 0.000 0.000 0.500 116 T N 1.174 115.675 114.554 -0.088 0.000 3.007 116 T HA -0.148 4.197 4.350 -0.009 0.000 0.270 116 T C 1.348 175.990 174.700 -0.096 0.000 1.107 116 T CA 1.691 63.745 62.100 -0.077 0.000 1.118 116 T CB -0.364 68.459 68.868 -0.076 0.000 0.889 116 T HN 0.825 9.065 8.240 0.000 0.000 0.506 117 I N -1.549 118.924 120.570 -0.162 0.000 3.578 117 I HA 0.548 4.712 4.170 -0.009 0.000 0.295 117 I C 0.923 176.971 176.117 -0.115 0.000 1.280 117 I CA 0.069 61.252 61.300 -0.195 0.000 1.347 117 I CB -0.406 37.360 38.000 -0.390 0.000 1.051 117 I HN 0.443 8.653 8.210 0.000 0.000 0.460 118 G N 1.058 109.817 108.800 -0.069 0.000 2.357 118 G HA2 0.343 4.298 3.960 -0.009 0.000 0.289 118 G HA3 0.343 4.298 3.960 -0.009 0.000 0.289 118 G C -1.093 173.827 174.900 0.035 0.000 1.302 118 G CA -0.431 44.683 45.100 0.023 0.000 0.936 118 G HN 0.480 8.770 8.290 0.000 0.000 0.513 119 A N -0.019 122.842 122.820 0.069 0.000 2.492 119 A HA 0.624 4.939 4.320 -0.009 0.000 0.254 119 A C 0.782 178.419 177.584 0.089 0.000 1.091 119 A CA 0.405 52.477 52.037 0.059 0.000 0.768 119 A CB 0.016 19.047 19.000 0.053 0.000 1.028 119 A HN 0.628 8.778 8.150 0.000 0.000 0.498 120 R N 3.005 123.535 120.500 0.050 0.000 2.701 120 R HA 0.207 4.542 4.340 -0.009 0.000 0.281 120 R C -2.655 173.654 176.300 0.017 0.000 1.367 120 R CA -1.051 55.084 56.100 0.059 0.000 1.510 120 R CB 0.669 30.986 30.300 0.028 0.000 1.306 120 R HN 0.669 8.939 8.270 0.000 0.000 0.682 121 P HA 0.036 4.456 4.420 0.000 0.000 0.270 121 P C 0.710 178.024 177.300 0.024 0.000 1.223 121 P CA -0.031 63.076 63.100 0.012 0.000 0.785 121 P CB 1.143 32.857 31.700 0.023 0.000 0.923 122 V N -2.327 117.592 119.914 0.009 0.000 3.085 122 V HA 0.082 4.197 4.120 -0.009 0.000 0.345 122 V C 1.322 177.489 176.094 0.121 0.000 1.397 122 V CA 0.095 62.426 62.300 0.051 0.000 1.165 122 V CB -0.482 31.229 31.823 -0.185 0.000 1.153 122 V HN 0.516 8.706 8.190 0.000 0.000 0.495 123 D N 1.411 121.858 120.400 0.079 0.000 2.158 123 D HA -0.273 4.362 4.640 -0.009 0.000 0.197 123 D C 1.757 178.103 176.300 0.077 0.000 0.995 123 D CA 1.680 55.718 54.000 0.063 0.000 0.846 123 D CB -0.086 40.737 40.800 0.039 0.000 0.941 123 D HN 0.546 8.916 8.370 0.000 0.000 0.456 124 L N -0.073 121.202 121.223 0.087 0.000 2.141 124 L HA -0.111 4.223 4.340 -0.009 0.000 0.209 124 L C 2.820 179.707 176.870 0.028 0.000 1.094 124 L CA 0.896 55.755 54.840 0.033 0.000 0.763 124 L CB -0.596 41.455 42.059 -0.013 0.000 0.908 124 L HN 0.125 8.355 8.230 0.000 0.000 0.437 125 H N -0.031 119.050 119.070 0.019 0.000 2.293 125 H HA -0.135 4.412 4.556 -0.016 0.000 0.300 125 H C 2.446 177.791 175.328 0.029 0.000 1.082 125 H CA 1.769 57.836 56.048 0.032 0.000 1.308 125 H CB 0.077 29.854 29.762 0.024 0.000 1.375 125 H HN 0.315 8.595 8.280 0.000 0.000 0.495 126 I N 0.256 120.925 120.570 0.163 0.000 2.142 126 I HA -0.275 3.889 4.170 -0.009 0.000 0.240 126 I C 2.923 179.078 176.117 0.063 0.000 1.078 126 I CA 1.181 62.537 61.300 0.093 0.000 1.343 126 I CB -0.281 37.758 38.000 0.066 0.000 1.046 126 I HN 0.159 8.369 8.210 0.000 0.000 0.405 127 S N 0.891 116.622 115.700 0.051 0.000 2.370 127 S HA -0.162 4.302 4.470 -0.009 0.000 0.226 127 S C 2.152 176.765 174.600 0.021 0.000 1.033 127 S CA 1.723 59.941 58.200 0.029 0.000 1.011 127 S CB -0.774 62.437 63.200 0.019 0.000 0.852 127 S HN 0.553 8.863 8.310 0.000 0.000 0.457 128 G N 1.403 110.215 108.800 0.019 0.000 2.440 128 G HA2 -0.110 3.845 3.960 -0.009 0.000 0.218 128 G HA3 -0.110 3.845 3.960 -0.009 0.000 0.218 128 G C 1.467 176.380 174.900 0.022 0.000 1.154 128 G CA 0.950 46.056 45.100 0.009 0.000 0.767 128 G HN 0.529 8.819 8.290 0.000 0.000 0.552 129 L N -0.161 121.087 121.223 0.041 0.000 2.109 129 L HA 0.000 4.335 4.340 -0.009 0.000 0.207 129 L C 2.881 179.771 176.870 0.034 0.000 1.086 129 L CA 1.012 55.879 54.840 0.045 0.000 0.760 129 L CB -0.375 41.722 42.059 0.064 0.000 0.910 129 L HN 0.289 8.519 8.230 0.000 0.000 0.437 130 E N -0.246 119.973 120.200 0.032 0.000 2.110 130 E HA -0.285 4.060 4.350 -0.009 0.000 0.193 130 E C 2.157 178.768 176.600 0.019 0.000 0.988 130 E CA 1.004 57.419 56.400 0.025 0.000 0.804 130 E CB -0.019 29.695 29.700 0.023 0.000 0.745 130 E HN 0.455 8.815 8.360 0.000 0.000 0.458 131 Q N 0.172 119.982 119.800 0.016 0.000 2.291 131 Q HA -0.052 4.282 4.340 -0.009 0.000 0.205 131 Q C 1.639 177.648 176.000 0.015 0.000 0.970 131 Q CA 0.612 56.422 55.803 0.012 0.000 0.876 131 Q CB 0.199 28.939 28.738 0.004 0.000 0.935 131 Q HN 0.271 8.541 8.270 0.000 0.000 0.455 132 L N -1.176 120.058 121.223 0.017 0.000 2.612 132 L HA 0.158 4.493 4.340 -0.009 0.000 0.230 132 L C 0.937 177.816 176.870 0.015 0.000 1.140 132 L CA 0.507 55.356 54.840 0.017 0.000 0.896 132 L CB 0.192 42.262 42.059 0.018 0.000 1.065 132 L HN 0.468 8.698 8.230 0.000 0.000 0.447 133 G N -0.307 108.502 108.800 0.015 0.000 2.176 133 G HA2 -0.240 3.715 3.960 -0.009 0.000 0.232 133 G HA3 -0.240 3.715 3.960 -0.009 0.000 0.232 133 G C 0.400 175.309 174.900 0.014 0.000 0.986 133 G CA -0.045 45.063 45.100 0.013 0.000 0.643 133 G HN 0.462 8.752 8.290 0.000 0.000 0.522 134 A N 0.164 122.996 122.820 0.019 0.000 2.407 134 A HA 0.692 5.007 4.320 -0.009 0.000 0.248 134 A C 0.603 178.199 177.584 0.021 0.000 1.082 134 A CA 1.082 53.132 52.037 0.022 0.000 0.785 134 A CB 0.468 19.486 19.000 0.031 0.000 1.020 134 A HN 0.726 8.876 8.150 0.000 0.000 0.489 135 T N 2.562 117.128 114.554 0.020 0.000 2.767 135 T HA 0.558 4.903 4.350 -0.009 0.000 0.284 135 T C -0.269 174.447 174.700 0.026 0.000 0.973 135 T CA 0.161 62.273 62.100 0.020 0.000 0.996 135 T CB 0.217 69.094 68.868 0.015 0.000 0.927 135 T HN 0.414 8.654 8.240 0.000 0.000 0.456 136 I N 4.052 124.639 120.570 0.028 0.000 2.466 136 I HA 0.482 4.647 4.170 -0.009 0.000 0.289 136 I C -0.161 175.976 176.117 0.033 0.000 1.026 136 I CA -1.002 60.319 61.300 0.035 0.000 1.078 136 I CB 1.950 39.974 38.000 0.040 0.000 1.249 136 I HN 0.591 8.801 8.210 0.000 0.000 0.429 137 K N 5.604 126.027 120.400 0.038 0.000 2.444 137 K HA 0.779 5.094 4.320 -0.009 0.000 0.252 137 K C -1.748 174.882 176.600 0.049 0.000 0.993 137 K CA -0.970 55.340 56.287 0.038 0.000 0.847 137 K CB 2.750 35.270 32.500 0.033 0.000 1.340 137 K HN 0.380 8.630 8.250 0.000 0.000 0.446 138 L N 1.846 123.097 121.223 0.046 0.000 2.342 138 L HA 0.396 4.731 4.340 -0.009 0.000 0.276 138 L C -1.498 175.407 176.870 0.059 0.000 0.997 138 L CA 0.155 55.028 54.840 0.055 0.000 0.838 138 L CB 1.121 43.202 42.059 0.037 0.000 1.224 138 L HN 0.858 9.088 8.230 0.000 0.000 0.416 139 E N 2.961 123.214 120.200 0.088 0.000 2.292 139 E HA 0.428 4.773 4.350 -0.009 0.000 0.272 139 E C -0.726 175.958 176.600 0.140 0.000 0.881 139 E CA -0.734 55.717 56.400 0.085 0.000 0.754 139 E CB 1.315 31.052 29.700 0.062 0.000 1.201 139 E HN 0.596 8.956 8.360 0.000 0.000 0.425 140 E N 1.010 121.275 120.200 0.107 0.000 2.722 140 E HA -0.308 4.037 4.350 -0.009 0.000 0.265 140 E C 0.715 177.400 176.600 0.142 0.000 1.081 140 E CA 0.664 57.145 56.400 0.135 0.000 0.781 140 E CB -1.656 28.154 29.700 0.183 0.000 1.372 140 E HN 1.169 9.529 8.360 0.000 0.000 0.423 141 G N -1.138 107.695 108.800 0.056 0.000 2.179 141 G HA2 -0.366 3.589 3.960 -0.009 0.000 0.260 141 G HA3 -0.366 3.589 3.960 -0.009 0.000 0.260 141 G C -0.163 174.647 174.900 -0.151 0.000 0.977 141 G CA 0.568 45.632 45.100 -0.060 0.000 0.641 141 G HN 0.334 8.624 8.290 0.000 0.000 0.533 142 Y N -0.438 119.882 120.300 0.033 0.000 2.330 142 Y HA 0.503 5.048 4.550 -0.008 0.000 0.336 142 Y C 0.709 176.625 175.900 0.027 0.000 1.036 142 Y CA -0.393 57.728 58.100 0.036 0.000 1.125 142 Y CB 2.037 40.520 38.460 0.039 0.000 1.194 142 Y HN 0.334 8.614 8.280 0.000 0.000 0.469 143 V N 5.190 125.188 119.914 0.141 0.000 2.405 143 V HA 0.306 4.420 4.120 -0.009 0.000 0.264 143 V C -0.642 175.525 176.094 0.122 0.000 1.048 143 V CA -0.576 61.783 62.300 0.098 0.000 0.966 143 V CB -0.049 31.804 31.823 0.050 0.000 1.015 143 V HN 0.699 8.889 8.190 0.000 0.000 0.477 144 K N 6.381 126.842 120.400 0.102 0.000 2.263 144 K HA 0.745 5.060 4.320 -0.009 0.000 0.272 144 K C -0.255 176.382 176.600 0.060 0.000 1.033 144 K CA -0.205 56.132 56.287 0.083 0.000 0.884 144 K CB 1.878 34.419 32.500 0.069 0.000 1.107 144 K HN 0.878 9.128 8.250 0.000 0.000 0.460 145 A N 1.985 124.840 122.820 0.058 0.000 2.340 145 A HA 0.714 5.029 4.320 -0.009 0.000 0.331 145 A C -0.539 177.063 177.584 0.030 0.000 1.140 145 A CA -0.607 51.458 52.037 0.047 0.000 0.801 145 A CB 1.073 20.107 19.000 0.057 0.000 1.234 145 A HN 0.693 8.843 8.150 0.000 0.000 0.469 146 S N -0.149 115.564 115.700 0.020 0.000 2.550 146 S HA 0.732 5.197 4.470 -0.009 0.000 0.270 146 S C -1.313 173.290 174.600 0.005 0.000 1.145 146 S CA -0.619 57.584 58.200 0.005 0.000 0.852 146 S CB 1.317 64.517 63.200 -0.001 0.000 1.119 146 S HN 1.988 10.298 8.310 0.000 0.000 0.465 147 V N 1.130 121.042 119.914 -0.003 0.000 2.777 147 V HA 0.509 4.623 4.120 -0.009 0.000 0.306 147 V C -1.704 174.384 176.094 -0.009 0.000 1.112 147 V CA -0.558 61.740 62.300 -0.003 0.000 0.917 147 V CB 1.946 33.770 31.823 0.001 0.000 1.018 147 V HN 1.096 9.286 8.190 0.000 0.000 0.426 148 D N 4.971 125.367 120.400 -0.007 0.000 2.359 148 D HA 0.558 5.193 4.640 -0.009 0.000 0.250 148 D C 0.694 176.988 176.300 -0.010 0.000 1.264 148 D CA 2.195 56.191 54.000 -0.008 0.000 0.911 148 D CB 0.616 41.413 40.800 -0.005 0.000 1.056 148 D HN 1.309 9.679 8.370 0.000 0.000 0.499 149 G N 4.233 113.025 108.800 -0.014 0.000 2.520 149 G HA2 -0.198 3.757 3.960 -0.009 0.000 0.248 149 G HA3 -0.198 3.757 3.960 -0.009 0.000 0.248 149 G C -0.320 174.568 174.900 -0.021 0.000 1.161 149 G CA -0.034 45.056 45.100 -0.017 0.000 0.946 149 G HN 0.732 9.022 8.290 0.000 0.000 0.565 150 R N -0.325 120.163 120.500 -0.020 0.000 2.902 150 R HA 0.805 5.140 4.340 -0.009 0.000 0.258 150 R C 0.118 176.411 176.300 -0.012 0.000 1.071 150 R CA -1.071 55.016 56.100 -0.021 0.000 1.024 150 R CB 1.171 31.453 30.300 -0.029 0.000 1.184 150 R HN 0.509 8.779 8.270 0.000 0.000 0.492 151 L N 0.906 122.123 121.223 -0.009 0.000 2.472 151 L HA 0.266 4.600 4.340 -0.009 0.000 0.260 151 L C 0.333 177.201 176.870 -0.002 0.000 1.209 151 L CA -0.090 54.749 54.840 -0.001 0.000 0.817 151 L CB 0.243 42.305 42.059 0.004 0.000 1.106 151 L HN 0.431 8.661 8.230 0.000 0.000 0.479 152 K N 0.784 121.186 120.400 0.003 0.000 2.323 152 K HA 0.350 4.665 4.320 -0.009 0.000 0.259 152 K C -0.101 176.504 176.600 0.008 0.000 0.947 152 K CA -0.632 55.657 56.287 0.003 0.000 0.819 152 K CB 1.792 34.294 32.500 0.005 0.000 1.109 152 K HN 0.759 9.009 8.250 0.000 0.000 0.429 153 G N 1.429 110.233 108.800 0.007 0.000 2.368 153 G HA2 0.301 4.256 3.960 -0.009 0.000 0.233 153 G HA3 0.301 4.256 3.960 -0.009 0.000 0.233 153 G C -0.491 174.423 174.900 0.024 0.000 1.267 153 G CA -0.036 45.072 45.100 0.013 0.000 0.873 153 G HN 0.638 8.928 8.290 0.000 0.000 0.539 154 A N 1.554 124.397 122.820 0.038 0.000 2.609 154 A HA 0.645 4.960 4.320 -0.009 0.000 0.291 154 A C -0.808 176.841 177.584 0.108 0.000 1.096 154 A CA -0.707 51.365 52.037 0.059 0.000 0.684 154 A CB 1.150 20.174 19.000 0.041 0.000 1.282 154 A HN 0.924 9.074 8.150 0.000 0.000 0.412 155 H N 1.364 120.433 119.070 -0.003 0.000 2.690 155 H HA 0.554 5.105 4.556 -0.008 0.000 0.289 155 H C -1.100 174.227 175.328 -0.002 0.000 1.089 155 H CA -0.190 55.856 56.048 -0.003 0.000 1.299 155 H CB 0.172 29.932 29.762 -0.003 0.000 1.405 155 H HN 0.453 8.733 8.280 0.000 0.000 0.463 156 I N 6.376 126.860 120.570 -0.142 0.000 2.355 156 I HA 0.139 4.304 4.170 -0.009 0.000 0.288 156 I C -0.399 175.583 176.117 -0.225 0.000 0.999 156 I CA -0.928 60.281 61.300 -0.153 0.000 1.163 156 I CB 1.853 39.816 38.000 -0.061 0.000 1.316 156 I HN 0.265 8.475 8.210 0.000 0.000 0.454 157 V N 6.894 126.672 119.914 -0.226 0.000 2.350 157 V HA 0.341 4.456 4.120 -0.009 0.000 0.276 157 V C 0.472 176.507 176.094 -0.099 0.000 1.028 157 V CA -0.525 61.666 62.300 -0.181 0.000 0.860 157 V CB 1.291 33.003 31.823 -0.185 0.000 0.990 157 V HN 0.645 8.835 8.190 0.000 0.000 0.453 158 M N 3.023 122.578 119.600 -0.075 0.000 2.162 158 M HA 0.211 4.685 4.480 -0.009 0.000 0.356 158 M C 1.123 177.399 176.300 -0.041 0.000 1.303 158 M CA -0.121 55.148 55.300 -0.052 0.000 1.116 158 M CB 0.706 33.278 32.600 -0.046 0.000 1.632 158 M HN 0.622 8.912 8.290 0.000 0.000 0.469 159 D N 3.137 123.518 120.400 -0.033 0.000 2.104 159 D HA -0.101 4.534 4.640 -0.009 0.000 0.194 159 D C 0.336 176.623 176.300 -0.022 0.000 0.994 159 D CA 1.540 55.525 54.000 -0.025 0.000 0.830 159 D CB 0.548 41.337 40.800 -0.017 0.000 0.959 159 D HN 0.625 8.995 8.370 0.000 0.000 0.452 160 K N -1.052 119.334 120.400 -0.023 0.000 2.409 160 K HA 0.502 4.816 4.320 -0.009 0.000 0.252 160 K C -0.794 175.790 176.600 -0.027 0.000 1.036 160 K CA -0.895 55.377 56.287 -0.024 0.000 0.871 160 K CB 1.921 34.407 32.500 -0.023 0.000 1.374 160 K HN -0.332 7.918 8.250 0.000 0.000 0.459 161 V N 1.428 121.326 119.914 -0.028 0.000 2.455 161 V HA 0.235 4.350 4.120 -0.009 0.000 0.273 161 V C -0.367 175.710 176.094 -0.029 0.000 1.045 161 V CA -0.001 62.285 62.300 -0.025 0.000 0.976 161 V CB 0.837 32.647 31.823 -0.021 0.000 0.993 161 V HN 0.795 8.985 8.190 0.000 0.000 0.475 162 S N 4.101 119.789 115.700 -0.020 0.000 2.677 162 S HA 0.365 4.830 4.470 -0.009 0.000 0.283 162 S C 0.428 175.039 174.600 0.017 0.000 1.159 162 S CA -0.594 57.599 58.200 -0.011 0.000 1.001 162 S CB 1.864 65.047 63.200 -0.028 0.000 1.032 162 S HN 0.303 8.613 8.310 0.000 0.000 0.487 163 V N 5.279 125.227 119.914 0.057 0.000 2.295 163 V HA -0.022 4.093 4.120 -0.009 0.000 0.246 163 V C 2.679 178.906 176.094 0.222 0.000 1.049 163 V CA 2.624 64.998 62.300 0.123 0.000 1.024 163 V CB -1.200 30.714 31.823 0.151 0.000 0.648 163 V HN 0.953 9.143 8.190 0.000 0.000 0.447 164 G N -0.531 108.407 108.800 0.229 0.000 2.421 164 G HA2 -0.186 3.769 3.960 -0.009 0.000 0.216 164 G HA3 -0.186 3.769 3.960 -0.009 0.000 0.216 164 G C 1.740 176.716 174.900 0.126 0.000 1.171 164 G CA 1.025 46.352 45.100 0.378 0.000 0.775 164 G HN 0.611 8.901 8.290 0.000 0.000 0.543 165 A N -0.029 122.558 122.820 -0.389 0.000 1.929 165 A HA 0.070 4.384 4.320 -0.009 0.000 0.216 165 A C 2.495 179.973 177.584 -0.177 0.000 1.176 165 A CA 2.248 53.904 52.037 -0.635 0.000 0.628 165 A CB -0.784 17.907 19.000 -0.513 0.000 0.816 165 A HN 0.279 8.429 8.150 0.000 0.000 0.444 166 T N -0.308 114.208 114.554 -0.063 0.000 2.720 166 T HA -0.130 4.215 4.350 -0.009 0.000 0.268 166 T C 1.875 176.576 174.700 0.001 0.000 1.037 166 T CA 1.668 63.757 62.100 -0.019 0.000 1.144 166 T CB -0.355 68.514 68.868 0.003 0.000 0.864 166 T HN 0.148 8.388 8.240 0.000 0.000 0.444 167 V N 1.261 121.206 119.914 0.052 0.000 2.307 167 V HA -0.185 3.930 4.120 -0.009 0.000 0.245 167 V C 2.781 178.866 176.094 -0.014 0.000 1.045 167 V CA 2.002 64.287 62.300 -0.026 0.000 1.024 167 V CB -1.062 30.666 31.823 -0.158 0.000 0.651 167 V HN 0.521 8.711 8.190 0.000 0.000 0.449 168 T N 0.421 115.054 114.554 0.132 0.000 2.635 168 T HA -0.202 4.143 4.350 -0.009 0.000 0.267 168 T C 1.774 176.513 174.700 0.065 0.000 1.040 168 T CA 2.176 64.375 62.100 0.166 0.000 1.156 168 T CB -0.313 68.724 68.868 0.282 0.000 0.863 168 T HN 0.357 8.597 8.240 0.000 0.000 0.430 169 I N 0.571 121.154 120.570 0.021 0.000 2.202 169 I HA -0.141 4.023 4.170 -0.009 0.000 0.242 169 I C 2.590 178.709 176.117 0.003 0.000 1.091 169 I CA 1.146 62.452 61.300 0.010 0.000 1.368 169 I CB -0.395 37.600 38.000 -0.009 0.000 1.058 169 I HN 0.244 8.454 8.210 0.000 0.000 0.410 170 M N 0.207 119.801 119.600 -0.009 0.000 2.082 170 M HA -0.295 4.179 4.480 -0.009 0.000 0.258 170 M C 2.486 178.775 176.300 -0.019 0.000 1.069 170 M CA 2.092 57.382 55.300 -0.017 0.000 1.102 170 M CB -0.240 32.343 32.600 -0.029 0.000 1.336 170 M HN 0.372 8.662 8.290 0.000 0.000 0.404 171 C N 0.304 119.592 119.300 -0.021 0.000 2.446 171 C HA -0.030 4.425 4.460 -0.009 0.000 0.277 171 C C 3.003 177.997 174.990 0.006 0.000 1.275 171 C CA 0.976 59.986 59.018 -0.014 0.000 1.727 171 C CB -1.509 26.219 27.740 -0.019 0.000 2.010 171 C HN 0.752 8.982 8.230 0.000 0.000 0.486 172 A N 0.423 123.256 122.820 0.022 0.000 1.972 172 A HA 0.077 4.392 4.320 -0.009 0.000 0.219 172 A C 2.303 179.892 177.584 0.009 0.000 1.169 172 A CA 1.942 53.995 52.037 0.027 0.000 0.635 172 A CB -0.721 18.305 19.000 0.042 0.000 0.810 172 A HN 0.583 8.733 8.150 0.000 0.000 0.446 173 A N -0.173 122.648 122.820 0.003 0.000 2.014 173 A HA -0.027 4.288 4.320 -0.009 0.000 0.218 173 A C 2.300 179.876 177.584 -0.013 0.000 1.163 173 A CA 2.082 54.117 52.037 -0.002 0.000 0.652 173 A CB -1.325 17.675 19.000 -0.000 0.000 0.808 173 A HN 0.795 8.945 8.150 0.000 0.000 0.449 174 T N -2.042 112.500 114.554 -0.020 0.000 2.946 174 T HA -0.026 4.318 4.350 -0.009 0.000 0.271 174 T C 1.064 175.742 174.700 -0.036 0.000 1.104 174 T CA 1.427 63.507 62.100 -0.033 0.000 1.114 174 T CB -0.361 68.479 68.868 -0.046 0.000 0.867 174 T HN 0.317 8.557 8.240 0.000 0.000 0.513 175 L N 0.390 121.594 121.223 -0.031 0.000 3.066 175 L HA 0.595 4.929 4.340 -0.009 0.000 0.265 175 L C 0.949 177.800 176.870 -0.031 0.000 1.232 175 L CA -0.644 54.173 54.840 -0.039 0.000 1.031 175 L CB -0.025 42.004 42.059 -0.051 0.000 1.379 175 L HN 0.281 8.511 8.230 0.000 0.000 0.563 176 A N -0.091 122.716 122.820 -0.022 0.000 2.256 176 A HA 0.462 4.777 4.320 -0.009 0.000 0.318 176 A C -0.058 177.517 177.584 -0.016 0.000 1.103 176 A CA -0.391 51.637 52.037 -0.015 0.000 0.860 176 A CB 0.555 19.551 19.000 -0.007 0.000 1.182 176 A HN 0.260 8.410 8.150 0.000 0.000 0.501 177 E N 0.154 120.346 120.200 -0.013 0.000 2.129 177 E HA 0.437 4.782 4.350 -0.009 0.000 0.283 177 E C 0.709 177.304 176.600 -0.008 0.000 1.080 177 E CA 0.988 57.381 56.400 -0.012 0.000 0.867 177 E CB 0.426 30.120 29.700 -0.010 0.000 1.056 177 E HN 1.242 9.602 8.360 0.000 0.000 0.404 178 G N 2.922 111.716 108.800 -0.010 0.000 2.545 178 G HA2 -0.218 3.737 3.960 -0.009 0.000 0.216 178 G HA3 -0.218 3.737 3.960 -0.009 0.000 0.216 178 G C -0.346 174.550 174.900 -0.007 0.000 1.314 178 G CA -0.631 44.464 45.100 -0.009 0.000 0.906 178 G HN 0.461 8.751 8.290 0.000 0.000 0.563 179 T N 1.454 116.005 114.554 -0.004 0.000 2.767 179 T HA 0.656 5.001 4.350 -0.009 0.000 0.284 179 T C 0.160 174.868 174.700 0.012 0.000 0.973 179 T CA 0.404 62.504 62.100 -0.001 0.000 0.996 179 T CB 1.368 70.232 68.868 -0.007 0.000 0.927 179 T HN 0.747 8.987 8.240 0.000 0.000 0.456 180 T N 3.986 118.550 114.554 0.017 0.000 2.859 180 T HA 0.632 4.976 4.350 -0.009 0.000 0.281 180 T C -0.146 174.584 174.700 0.050 0.000 1.005 180 T CA -0.509 61.612 62.100 0.034 0.000 1.025 180 T CB 0.623 69.504 68.868 0.022 0.000 0.977 180 T HN 0.412 8.652 8.240 0.000 0.000 0.458 181 I N 3.346 123.975 120.570 0.099 0.000 2.439 181 I HA 0.414 4.579 4.170 -0.009 0.000 0.285 181 I C -0.586 175.597 176.117 0.110 0.000 1.021 181 I CA -0.727 60.654 61.300 0.135 0.000 1.091 181 I CB 1.627 39.766 38.000 0.232 0.000 1.242 181 I HN 0.467 8.677 8.210 0.000 0.000 0.439 182 I N 6.044 126.643 120.570 0.048 0.000 2.304 182 I HA 0.270 4.435 4.170 -0.009 0.000 0.291 182 I C 0.069 176.185 176.117 -0.001 0.000 1.018 182 I CA -0.499 60.802 61.300 0.002 0.000 1.260 182 I CB 0.683 38.681 38.000 -0.005 0.000 1.390 182 I HN 0.450 8.660 8.210 0.000 0.000 0.475 183 E N 5.845 126.017 120.200 -0.045 0.000 2.204 183 E HA 0.170 4.515 4.350 -0.009 0.000 0.276 183 E C 0.066 176.644 176.600 -0.036 0.000 0.974 183 E CA -0.512 55.868 56.400 -0.033 0.000 0.815 183 E CB 1.561 31.215 29.700 -0.076 0.000 1.119 183 E HN 0.648 9.008 8.360 0.000 0.000 0.393 184 N N 0.450 119.140 118.700 -0.016 0.000 2.754 184 N HA -0.219 4.516 4.740 -0.009 0.000 0.248 184 N C -0.706 174.796 175.510 -0.014 0.000 1.093 184 N CA 0.181 53.222 53.050 -0.015 0.000 0.699 184 N CB -0.404 38.069 38.487 -0.024 0.000 1.016 184 N HN 0.546 8.926 8.380 0.000 0.000 0.552 185 A N 0.351 123.168 122.820 -0.006 0.000 2.366 185 A HA 0.648 4.963 4.320 -0.009 0.000 0.249 185 A C 0.815 178.403 177.584 0.007 0.000 1.084 185 A CA 0.384 52.419 52.037 -0.003 0.000 0.794 185 A CB 0.653 19.654 19.000 0.002 0.000 1.034 185 A HN 0.587 8.737 8.150 0.000 0.000 0.491 186 A N 0.776 123.603 122.820 0.011 0.000 2.425 186 A HA 0.502 4.816 4.320 -0.009 0.000 0.249 186 A C 0.737 178.345 177.584 0.039 0.000 1.084 186 A CA -0.265 51.788 52.037 0.027 0.000 0.781 186 A CB 0.070 19.089 19.000 0.031 0.000 1.019 186 A HN 0.781 8.931 8.150 0.000 0.000 0.490 187 R N 0.394 120.935 120.500 0.068 0.000 2.432 187 R HA 0.166 4.501 4.340 -0.009 0.000 0.260 187 R C -0.441 175.921 176.300 0.104 0.000 0.935 187 R CA -0.123 56.033 56.100 0.093 0.000 1.080 187 R CB 0.129 30.502 30.300 0.122 0.000 1.155 187 R HN 0.779 9.049 8.270 0.000 0.000 0.531 188 E N 1.348 121.572 120.200 0.040 0.000 2.568 188 E HA -0.081 4.263 4.350 -0.009 0.000 0.262 188 E C -1.602 174.894 176.600 -0.173 0.000 0.961 188 E CA -0.793 55.530 56.400 -0.128 0.000 0.945 188 E CB 0.404 30.069 29.700 -0.057 0.000 0.924 188 E HN -0.046 8.314 8.360 0.000 0.000 0.467 189 P HA -0.193 4.227 4.420 0.000 0.000 0.216 189 P C 0.362 177.610 177.300 -0.087 0.000 1.150 189 P CA 1.285 64.275 63.100 -0.182 0.000 0.843 189 P CB 0.271 31.839 31.700 -0.221 0.000 0.787 190 E N -1.035 119.115 120.200 -0.083 0.000 2.204 190 E HA -0.098 4.247 4.350 -0.009 0.000 0.194 190 E C 1.932 178.508 176.600 -0.040 0.000 0.989 190 E CA 0.745 57.121 56.400 -0.040 0.000 0.824 190 E CB -0.780 28.910 29.700 -0.016 0.000 0.756 190 E HN 0.305 8.665 8.360 0.000 0.000 0.477 191 I N -0.248 120.301 120.570 -0.036 0.000 2.500 191 I HA -0.172 3.993 4.170 -0.009 0.000 0.252 191 I C 1.808 177.909 176.117 -0.027 0.000 1.142 191 I CA 0.432 61.712 61.300 -0.033 0.000 1.451 191 I CB 0.011 38.005 38.000 -0.011 0.000 1.093 191 I HN 0.024 8.234 8.210 0.000 0.000 0.430 192 V N 0.703 120.608 119.914 -0.015 0.000 2.307 192 V HA -0.304 3.811 4.120 -0.009 0.000 0.245 192 V C 2.122 178.229 176.094 0.020 0.000 1.045 192 V CA 2.134 64.437 62.300 0.005 0.000 1.024 192 V CB -0.560 31.270 31.823 0.013 0.000 0.651 192 V HN 0.367 8.557 8.190 0.000 0.000 0.449 193 D N -0.169 120.249 120.400 0.030 0.000 2.117 193 D HA -0.147 4.487 4.640 -0.009 0.000 0.197 193 D C 2.274 178.562 176.300 -0.019 0.000 0.987 193 D CA 1.782 55.833 54.000 0.085 0.000 0.829 193 D CB -0.148 40.712 40.800 0.101 0.000 0.961 193 D HN 0.389 8.759 8.370 0.000 0.000 0.460 194 T N -0.356 114.163 114.554 -0.058 0.000 2.746 194 T HA -0.116 4.229 4.350 -0.009 0.000 0.267 194 T C 1.906 176.576 174.700 -0.051 0.000 1.039 194 T CA 1.398 63.447 62.100 -0.085 0.000 1.142 194 T CB -0.388 68.402 68.868 -0.130 0.000 0.866 194 T HN 0.213 8.453 8.240 0.000 0.000 0.444 195 A N 2.403 125.193 122.820 -0.049 0.000 1.902 195 A HA -0.142 4.173 4.320 -0.009 0.000 0.217 195 A C 2.242 179.787 177.584 -0.065 0.000 1.181 195 A CA 1.482 53.490 52.037 -0.047 0.000 0.623 195 A CB -0.619 18.364 19.000 -0.028 0.000 0.818 195 A HN 0.374 8.524 8.150 0.000 0.000 0.443 196 N N -0.910 117.762 118.700 -0.046 0.000 2.223 196 N HA -0.132 4.603 4.740 -0.009 0.000 0.185 196 N C 1.359 176.742 175.510 -0.211 0.000 1.016 196 N CA 1.450 54.485 53.050 -0.024 0.000 0.863 196 N CB -0.615 37.967 38.487 0.158 0.000 0.983 196 N HN 0.573 8.953 8.380 0.000 0.000 0.429 197 F N 1.605 121.121 119.950 -0.724 0.000 2.102 197 F HA -0.024 4.504 4.527 0.000 0.000 0.298 197 F C 1.998 177.585 175.800 -0.355 0.000 1.105 197 F CA 1.013 58.488 58.000 -0.875 0.000 1.239 197 F CB -0.437 38.022 39.000 -0.902 0.000 0.991 197 F HN -0.074 8.226 8.300 0.000 0.000 0.474 198 L N 0.045 121.046 121.223 -0.370 0.000 2.042 198 L HA -0.256 4.078 4.340 -0.009 0.000 0.210 198 L C 2.554 179.248 176.870 -0.294 0.000 1.076 198 L CA 1.596 56.219 54.840 -0.362 0.000 0.749 198 L CB -0.722 41.244 42.059 -0.155 0.000 0.893 198 L HN 0.216 8.446 8.230 0.000 0.000 0.432 199 I N -0.639 119.814 120.570 -0.195 0.000 2.226 199 I HA -0.297 3.867 4.170 -0.009 0.000 0.245 199 I C 2.462 178.495 176.117 -0.140 0.000 1.100 199 I CA 1.485 62.708 61.300 -0.128 0.000 1.374 199 I CB -0.403 37.558 38.000 -0.065 0.000 1.057 199 I HN 0.245 8.455 8.210 0.000 0.000 0.413 200 T N 1.153 115.606 114.554 -0.170 0.000 2.803 200 T HA -0.135 4.210 4.350 -0.009 0.000 0.269 200 T C 1.717 176.305 174.700 -0.187 0.000 1.052 200 T CA 1.173 63.197 62.100 -0.128 0.000 1.136 200 T CB -0.211 68.624 68.868 -0.054 0.000 0.864 200 T HN 0.289 8.529 8.240 0.000 0.000 0.467 201 L N -0.114 120.920 121.223 -0.316 0.000 2.554 201 L HA 0.254 4.589 4.340 -0.009 0.000 0.226 201 L C 1.855 178.625 176.870 -0.167 0.000 1.137 201 L CA 0.483 55.159 54.840 -0.273 0.000 0.863 201 L CB -0.158 41.663 42.059 -0.396 0.000 0.985 201 L HN 0.489 8.719 8.230 0.000 0.000 0.451 202 G N -0.387 108.328 108.800 -0.142 0.000 2.159 202 G HA2 -0.136 3.819 3.960 -0.009 0.000 0.170 202 G HA3 -0.136 3.819 3.960 -0.009 0.000 0.170 202 G C 0.250 175.096 174.900 -0.090 0.000 1.007 202 G CA -0.189 44.854 45.100 -0.096 0.000 0.672 202 G HN 0.407 8.697 8.290 0.000 0.000 0.507 203 A N -0.064 122.690 122.820 -0.110 0.000 2.287 203 A HA 0.751 5.065 4.320 -0.009 0.000 0.273 203 A C 0.405 177.949 177.584 -0.067 0.000 1.091 203 A CA 0.032 52.015 52.037 -0.089 0.000 0.817 203 A CB 0.535 19.473 19.000 -0.103 0.000 1.069 203 A HN 0.338 8.488 8.150 0.000 0.000 0.492 204 K N 1.048 121.418 120.400 -0.051 0.000 2.464 204 K HA 0.570 4.884 4.320 -0.009 0.000 0.252 204 K C -1.530 175.052 176.600 -0.031 0.000 1.000 204 K CA 0.310 56.575 56.287 -0.037 0.000 0.951 204 K CB 1.029 33.511 32.500 -0.030 0.000 1.183 204 K HN 0.578 8.828 8.250 0.000 0.000 0.445 205 I N 1.528 122.080 120.570 -0.029 0.000 2.647 205 I HA 0.309 4.474 4.170 -0.009 0.000 0.295 205 I C -0.413 175.696 176.117 -0.014 0.000 1.078 205 I CA -0.652 60.634 61.300 -0.023 0.000 1.048 205 I CB 2.334 40.317 38.000 -0.029 0.000 1.239 205 I HN 0.530 8.740 8.210 0.000 0.000 0.421 206 S N 2.371 118.066 115.700 -0.008 0.000 2.564 206 S HA 0.817 5.282 4.470 -0.009 0.000 0.274 206 S C 0.175 174.776 174.600 0.003 0.000 1.124 206 S CA -0.017 58.182 58.200 -0.002 0.000 0.869 206 S CB 2.032 65.230 63.200 -0.002 0.000 1.105 206 S HN 1.337 9.647 8.310 0.000 0.000 0.472 207 G N 0.933 109.737 108.800 0.006 0.000 2.176 207 G HA2 -0.234 3.721 3.960 -0.009 0.000 0.232 207 G HA3 -0.234 3.721 3.960 -0.009 0.000 0.232 207 G C 0.111 175.019 174.900 0.012 0.000 0.986 207 G CA 0.059 45.166 45.100 0.010 0.000 0.643 207 G HN 1.291 9.581 8.290 0.000 0.000 0.522 208 Q N 0.410 120.215 119.800 0.009 0.000 2.286 208 Q HA 0.372 4.707 4.340 -0.009 0.000 0.290 208 Q C 1.190 177.202 176.000 0.019 0.000 1.049 208 Q CA 1.135 56.944 55.803 0.010 0.000 0.923 208 Q CB 0.768 29.509 28.738 0.005 0.000 1.183 208 Q HN 1.872 10.142 8.270 0.000 0.000 0.383 209 G N 2.243 111.059 108.800 0.026 0.000 2.195 209 G HA2 -0.298 3.657 3.960 -0.009 0.000 0.246 209 G HA3 -0.298 3.657 3.960 -0.009 0.000 0.246 209 G C 0.231 175.158 174.900 0.045 0.000 0.984 209 G CA 0.443 45.569 45.100 0.043 0.000 0.633 209 G HN 1.186 9.476 8.290 0.000 0.000 0.525 210 T N -1.940 112.632 114.554 0.030 0.000 2.938 210 T HA 0.559 4.904 4.350 -0.009 0.000 0.285 210 T C 1.028 175.741 174.700 0.022 0.000 1.028 210 T CA 0.651 62.766 62.100 0.025 0.000 1.005 210 T CB 1.761 70.640 68.868 0.019 0.000 1.157 210 T HN 0.205 8.445 8.240 0.000 0.000 0.550 211 D N -0.691 119.719 120.400 0.018 0.000 2.371 211 D HA -0.018 4.616 4.640 -0.009 0.000 0.221 211 D C 0.745 177.054 176.300 0.015 0.000 0.986 211 D CA 0.352 54.360 54.000 0.014 0.000 0.899 211 D CB -0.083 40.723 40.800 0.010 0.000 0.902 211 D HN 0.598 8.968 8.370 0.000 0.000 0.530 212 R N 0.415 120.927 120.500 0.019 0.000 2.409 212 R HA 0.516 4.851 4.340 -0.009 0.000 0.313 212 R C -1.219 175.094 176.300 0.022 0.000 0.953 212 R CA -0.577 55.539 56.100 0.026 0.000 0.849 212 R CB 0.714 31.035 30.300 0.035 0.000 1.171 212 R HN -0.024 8.246 8.270 0.000 0.000 0.458 213 I N 4.853 125.436 120.570 0.021 0.000 2.377 213 I HA 0.350 4.515 4.170 -0.009 0.000 0.293 213 I C -0.558 175.571 176.117 0.020 0.000 0.987 213 I CA -1.221 60.088 61.300 0.015 0.000 1.185 213 I CB 2.068 40.072 38.000 0.006 0.000 1.341 213 I HN 0.283 8.493 8.210 0.000 0.000 0.455 214 V N 7.443 127.365 119.914 0.013 0.000 2.384 214 V HA 0.448 4.563 4.120 -0.009 0.000 0.287 214 V C -0.269 175.826 176.094 0.001 0.000 1.020 214 V CA -0.448 61.859 62.300 0.011 0.000 0.850 214 V CB 1.733 33.560 31.823 0.007 0.000 0.987 214 V HN 0.433 8.623 8.190 0.000 0.000 0.436 215 I N 3.922 124.493 120.570 0.001 0.000 2.406 215 I HA 0.447 4.612 4.170 -0.009 0.000 0.290 215 I C -0.142 175.970 176.117 -0.009 0.000 0.999 215 I CA -0.423 60.873 61.300 -0.008 0.000 1.124 215 I CB 1.890 39.885 38.000 -0.009 0.000 1.289 215 I HN 0.630 8.840 8.210 0.000 0.000 0.441 216 E N 4.677 124.868 120.200 -0.015 0.000 2.081 216 E HA 0.553 4.898 4.350 -0.009 0.000 0.276 216 E C 0.209 176.796 176.600 -0.022 0.000 0.950 216 E CA -0.502 55.888 56.400 -0.017 0.000 0.776 216 E CB 1.012 30.701 29.700 -0.018 0.000 1.094 216 E HN 0.759 9.119 8.360 0.000 0.000 0.402 217 G N 2.904 111.692 108.800 -0.019 0.000 2.414 217 G HA2 0.338 4.293 3.960 -0.009 0.000 0.236 217 G HA3 0.338 4.293 3.960 -0.009 0.000 0.236 217 G C -0.031 174.852 174.900 -0.028 0.000 1.293 217 G CA 0.175 45.261 45.100 -0.024 0.000 0.869 217 G HN 0.582 8.872 8.290 0.000 0.000 0.556 218 V N -0.119 119.774 119.914 -0.035 0.000 3.158 218 V HA 0.613 4.728 4.120 -0.009 0.000 0.315 218 V C 0.963 177.032 176.094 -0.041 0.000 1.148 218 V CA -0.481 61.797 62.300 -0.037 0.000 1.042 218 V CB 2.059 33.856 31.823 -0.043 0.000 1.101 218 V HN 0.789 8.979 8.190 0.000 0.000 0.448 219 E N 0.947 121.123 120.200 -0.041 0.000 2.230 219 E HA 0.108 4.453 4.350 -0.009 0.000 0.192 219 E C 0.593 177.161 176.600 -0.055 0.000 0.987 219 E CA 0.367 56.740 56.400 -0.044 0.000 0.841 219 E CB 0.342 30.020 29.700 -0.037 0.000 0.783 219 E HN 0.783 9.143 8.360 0.000 0.000 0.481 220 R N -0.546 119.921 120.500 -0.055 0.000 2.664 220 R HA 0.387 4.722 4.340 -0.009 0.000 0.266 220 R C -1.704 174.558 176.300 -0.063 0.000 1.046 220 R CA -0.755 55.307 56.100 -0.063 0.000 0.885 220 R CB 0.584 30.850 30.300 -0.057 0.000 1.254 220 R HN -0.058 8.212 8.270 0.000 0.000 0.465 221 L N 1.112 122.293 121.223 -0.070 0.000 2.342 221 L HA 0.644 4.979 4.340 -0.009 0.000 0.271 221 L C 0.741 177.570 176.870 -0.068 0.000 1.008 221 L CA -0.601 54.191 54.840 -0.080 0.000 0.818 221 L CB 2.187 44.186 42.059 -0.099 0.000 1.296 221 L HN 0.984 9.214 8.230 0.000 0.000 0.427 222 G N 0.396 109.150 108.800 -0.076 0.000 2.882 222 G HA2 0.668 4.623 3.960 -0.009 0.000 0.164 222 G HA3 0.668 4.623 3.960 -0.009 0.000 0.164 222 G C -0.169 174.700 174.900 -0.052 0.000 1.429 222 G CA 0.125 45.193 45.100 -0.053 0.000 1.059 222 G HN 0.743 9.033 8.290 0.000 0.000 0.581 223 G N -2.836 105.944 108.800 -0.033 0.000 3.209 223 G HA2 0.745 4.700 3.960 -0.009 0.000 0.236 223 G HA3 0.745 4.700 3.960 -0.009 0.000 0.236 223 G C -0.177 174.715 174.900 -0.014 0.000 1.329 223 G CA 0.031 45.126 45.100 -0.008 0.000 1.015 223 G HN 1.851 10.141 8.290 0.000 0.000 0.571 224 G N -2.756 106.067 108.800 0.038 0.000 2.352 224 G HA2 0.480 4.434 3.960 -0.009 0.000 0.283 224 G HA3 0.480 4.434 3.960 -0.009 0.000 0.283 224 G C -1.998 172.970 174.900 0.114 0.000 1.308 224 G CA 0.088 45.221 45.100 0.055 0.000 0.892 224 G HN 1.321 9.611 8.290 0.000 0.000 0.504 225 V N 0.386 120.377 119.914 0.128 0.000 2.588 225 V HA 0.757 4.872 4.120 -0.009 0.000 0.304 225 V C -1.252 174.981 176.094 0.233 0.000 1.042 225 V CA -0.565 61.823 62.300 0.147 0.000 0.877 225 V CB 1.611 33.480 31.823 0.078 0.000 0.996 225 V HN 0.984 9.174 8.190 0.000 0.000 0.425 226 Y N 4.020 124.382 120.300 0.103 0.000 2.470 226 Y HA 0.588 5.129 4.550 -0.015 0.000 0.341 226 Y C -0.306 175.613 175.900 0.033 0.000 1.021 226 Y CA -0.788 57.380 58.100 0.113 0.000 1.025 226 Y CB 1.673 40.309 38.460 0.294 0.000 1.266 226 Y HN 0.620 8.900 8.280 0.000 0.000 0.448 227 R N 5.059 125.274 120.500 -0.475 0.000 2.294 227 R HA 0.618 4.953 4.340 -0.009 0.000 0.319 227 R C -1.453 174.666 176.300 -0.300 0.000 0.984 227 R CA -0.548 55.373 56.100 -0.298 0.000 0.861 227 R CB 0.976 31.131 30.300 -0.240 0.000 1.104 227 R HN 0.604 8.874 8.270 0.000 0.000 0.451 228 V N 6.496 126.375 119.914 -0.058 0.000 2.637 228 V HA 0.065 4.179 4.120 -0.009 0.000 0.296 228 V C 0.931 177.017 176.094 -0.014 0.000 1.046 228 V CA -0.333 61.984 62.300 0.028 0.000 1.066 228 V CB 0.879 32.711 31.823 0.015 0.000 0.968 228 V HN 0.695 8.885 8.190 0.000 0.000 0.483 229 L N 5.262 126.495 121.223 0.017 0.000 2.474 229 L HA 0.492 4.827 4.340 -0.009 0.000 0.259 229 L C -2.346 174.524 176.870 -0.001 0.000 1.232 229 L CA -1.425 53.414 54.840 -0.001 0.000 0.821 229 L CB -0.186 41.880 42.059 0.012 0.000 1.108 229 L HN 0.352 8.582 8.230 0.000 0.000 0.495 230 P HA 0.046 4.466 4.420 0.000 0.000 0.272 230 P C -1.247 176.060 177.300 0.013 0.000 1.223 230 P CA -0.098 63.009 63.100 0.012 0.000 0.784 230 P CB 0.391 32.102 31.700 0.018 0.000 0.923 231 D N 2.060 122.475 120.400 0.024 0.000 2.336 231 D HA 0.017 4.652 4.640 -0.009 0.000 0.249 231 D C 1.320 177.639 176.300 0.031 0.000 1.213 231 D CA -0.157 53.853 54.000 0.017 0.000 0.870 231 D CB 0.637 41.447 40.800 0.018 0.000 1.076 231 D HN 0.336 8.706 8.370 0.000 0.000 0.483 232 R N 3.845 124.349 120.500 0.007 0.000 2.115 232 R HA -0.098 4.236 4.340 -0.009 0.000 0.230 232 R C 1.435 177.747 176.300 0.020 0.000 1.111 232 R CA 0.499 56.606 56.100 0.012 0.000 0.976 232 R CB -0.138 30.151 30.300 -0.017 0.000 0.870 232 R HN 0.343 8.613 8.270 0.000 0.000 0.445 233 I N 1.903 122.475 120.570 0.003 0.000 2.252 233 I HA -0.143 4.022 4.170 -0.009 0.000 0.245 233 I C 2.505 178.668 176.117 0.078 0.000 1.102 233 I CA 1.257 62.564 61.300 0.011 0.000 1.385 233 I CB -1.204 36.775 38.000 -0.035 0.000 1.064 233 I HN 0.348 8.558 8.210 0.000 0.000 0.414 234 E N 0.878 121.138 120.200 0.100 0.000 2.077 234 E HA -0.188 4.157 4.350 -0.009 0.000 0.193 234 E C 2.057 178.813 176.600 0.259 0.000 0.989 234 E CA 1.957 58.493 56.400 0.228 0.000 0.800 234 E CB 0.166 30.033 29.700 0.278 0.000 0.746 234 E HN 0.407 8.767 8.360 0.000 0.000 0.452 235 T N -0.133 114.546 114.554 0.209 0.000 2.652 235 T HA -0.167 4.178 4.350 -0.009 0.000 0.267 235 T C 1.762 176.565 174.700 0.171 0.000 1.039 235 T CA 1.333 63.556 62.100 0.206 0.000 1.153 235 T CB -0.765 68.178 68.868 0.125 0.000 0.863 235 T HN 0.407 8.647 8.240 0.000 0.000 0.428 236 G N 1.084 109.952 108.800 0.112 0.000 2.440 236 G HA2 -0.232 3.723 3.960 -0.009 0.000 0.218 236 G HA3 -0.232 3.723 3.960 -0.009 0.000 0.218 236 G C 1.724 176.662 174.900 0.064 0.000 1.154 236 G CA 1.500 46.661 45.100 0.102 0.000 0.767 236 G HN 0.477 8.767 8.290 0.000 0.000 0.552 237 T N 1.007 115.565 114.554 0.006 0.000 2.746 237 T HA -0.076 4.268 4.350 -0.009 0.000 0.267 237 T C 2.031 176.589 174.700 -0.237 0.000 1.039 237 T CA 1.104 63.109 62.100 -0.157 0.000 1.142 237 T CB -0.292 68.421 68.868 -0.260 0.000 0.866 237 T HN 0.225 8.465 8.240 0.000 0.000 0.444 238 F N 0.877 120.836 119.950 0.015 0.000 2.234 238 F HA 0.210 4.733 4.527 -0.007 0.000 0.296 238 F C 2.085 177.877 175.800 -0.012 0.000 1.089 238 F CA 0.241 58.236 58.000 -0.008 0.000 1.343 238 F CB -0.749 38.256 39.000 0.008 0.000 1.040 238 F HN 0.060 8.360 8.300 0.000 0.000 0.498 239 L N -0.784 120.539 121.223 0.167 0.000 2.042 239 L HA -0.229 4.106 4.340 -0.009 0.000 0.210 239 L C 2.353 179.233 176.870 0.016 0.000 1.076 239 L CA 0.830 55.727 54.840 0.094 0.000 0.749 239 L CB -0.813 41.306 42.059 0.100 0.000 0.893 239 L HN -0.030 8.200 8.230 0.000 0.000 0.432 240 V N -0.196 119.693 119.914 -0.042 0.000 2.427 240 V HA -0.252 3.863 4.120 -0.009 0.000 0.248 240 V C 2.723 178.751 176.094 -0.110 0.000 1.051 240 V CA 1.575 63.783 62.300 -0.154 0.000 1.048 240 V CB -0.700 30.971 31.823 -0.253 0.000 0.666 240 V HN 0.477 8.667 8.190 0.000 0.000 0.456 241 A N 0.149 122.929 122.820 -0.066 0.000 1.917 241 A HA -0.213 4.102 4.320 -0.009 0.000 0.219 241 A C 2.418 179.993 177.584 -0.016 0.000 1.182 241 A CA 2.411 54.424 52.037 -0.039 0.000 0.633 241 A CB -0.782 18.231 19.000 0.022 0.000 0.819 241 A HN 0.578 8.728 8.150 0.000 0.000 0.448 242 A N -0.377 122.448 122.820 0.008 0.000 1.873 242 A HA 0.230 4.545 4.320 -0.009 0.000 0.215 242 A C 2.522 180.090 177.584 -0.027 0.000 1.186 242 A CA 1.973 54.008 52.037 -0.002 0.000 0.616 242 A CB -1.092 17.915 19.000 0.011 0.000 0.823 242 A HN 1.140 9.290 8.150 0.000 0.000 0.442 243 A N 0.509 123.304 122.820 -0.041 0.000 1.978 243 A HA -0.098 4.217 4.320 -0.009 0.000 0.220 243 A C 2.070 179.619 177.584 -0.058 0.000 1.170 243 A CA 1.583 53.589 52.037 -0.053 0.000 0.636 243 A CB -0.811 18.144 19.000 -0.075 0.000 0.810 243 A HN 0.979 9.129 8.150 0.000 0.000 0.448 244 I N -2.720 117.809 120.570 -0.069 0.000 3.030 244 I HA 0.024 4.189 4.170 -0.009 0.000 0.270 244 I C 1.695 177.788 176.117 -0.040 0.000 1.211 244 I CA 1.329 62.593 61.300 -0.060 0.000 1.479 244 I CB -0.076 37.879 38.000 -0.075 0.000 1.105 244 I HN 0.239 8.449 8.210 0.000 0.000 0.447 245 S N 0.730 116.409 115.700 -0.035 0.000 2.577 245 S HA 0.282 4.747 4.470 -0.009 0.000 0.219 245 S C 0.885 175.473 174.600 -0.020 0.000 0.962 245 S CA -0.537 57.648 58.200 -0.026 0.000 0.921 245 S CB -0.273 62.912 63.200 -0.024 0.000 0.789 245 S HN 0.571 8.881 8.310 0.000 0.000 0.497 246 R N 0.129 120.616 120.500 -0.021 0.000 3.531 246 R HA -0.123 4.212 4.340 -0.009 0.000 0.280 246 R C 0.653 176.941 176.300 -0.021 0.000 1.130 246 R CA 0.394 56.484 56.100 -0.016 0.000 0.757 246 R CB -2.376 27.921 30.300 -0.006 0.000 1.218 246 R HN 0.624 8.894 8.270 0.000 0.000 0.454 247 G N 0.498 109.281 108.800 -0.028 0.000 2.828 247 G HA2 0.675 4.629 3.960 -0.009 0.000 0.244 247 G HA3 0.675 4.629 3.960 -0.009 0.000 0.244 247 G C -0.596 174.276 174.900 -0.048 0.000 1.365 247 G CA -0.661 44.420 45.100 -0.031 0.000 1.041 247 G HN 0.146 8.436 8.290 0.000 0.000 0.560 248 K N -1.550 118.824 120.400 -0.043 0.000 2.527 248 K HA 0.766 5.081 4.320 -0.009 0.000 0.260 248 K C -1.508 175.075 176.600 -0.029 0.000 0.937 248 K CA -0.788 55.468 56.287 -0.052 0.000 0.826 248 K CB 2.750 35.206 32.500 -0.073 0.000 1.359 248 K HN 0.488 8.738 8.250 0.000 0.000 0.434 249 I N 1.824 122.385 120.570 -0.014 0.000 2.841 249 I HA 0.438 4.602 4.170 -0.009 0.000 0.298 249 I C -1.734 174.393 176.117 0.017 0.000 1.304 249 I CA -1.235 60.064 61.300 -0.002 0.000 1.019 249 I CB 1.870 39.882 38.000 0.019 0.000 1.282 249 I HN 0.647 8.857 8.210 0.000 0.000 0.432 250 I N 5.347 125.918 120.570 0.001 0.000 2.465 250 I HA 0.344 4.509 4.170 -0.009 0.000 0.291 250 I C -0.704 175.434 176.117 0.035 0.000 1.014 250 I CA -0.551 60.769 61.300 0.033 0.000 1.093 250 I CB 1.355 39.329 38.000 -0.042 0.000 1.267 250 I HN 0.471 8.681 8.210 0.000 0.000 0.431 251 C N 6.226 125.588 119.300 0.103 0.000 2.295 251 C HA 0.553 5.007 4.460 -0.009 0.000 0.331 251 C C 0.623 175.685 174.990 0.120 0.000 1.280 251 C CA -0.731 58.335 59.018 0.080 0.000 1.746 251 C CB 0.629 28.432 27.740 0.106 0.000 2.328 251 C HN 0.611 8.841 8.230 0.000 0.000 0.521 252 R N 2.594 123.131 120.500 0.062 0.000 2.598 252 R HA 0.338 4.673 4.340 -0.009 0.000 0.279 252 R C 0.037 176.376 176.300 0.064 0.000 0.984 252 R CA -0.470 55.677 56.100 0.079 0.000 0.999 252 R CB 0.532 30.846 30.300 0.023 0.000 1.114 252 R HN 0.798 9.068 8.270 0.000 0.000 0.493 253 N N -0.937 117.808 118.700 0.076 0.000 2.756 253 N HA -0.183 4.552 4.740 -0.009 0.000 0.248 253 N C -1.061 174.478 175.510 0.049 0.000 1.062 253 N CA 1.101 54.181 53.050 0.051 0.000 0.696 253 N CB -0.990 37.514 38.487 0.028 0.000 0.946 253 N HN 0.752 9.132 8.380 0.000 0.000 0.548 254 A N -0.112 122.745 122.820 0.063 0.000 2.269 254 A HA 0.725 5.040 4.320 -0.009 0.000 0.327 254 A C 0.231 177.824 177.584 0.015 0.000 1.112 254 A CA -0.431 51.633 52.037 0.046 0.000 0.865 254 A CB 1.225 20.262 19.000 0.061 0.000 1.227 254 A HN 0.226 8.376 8.150 0.000 0.000 0.498 255 Q N 0.451 120.254 119.800 0.004 0.000 2.771 255 Q HA 0.321 4.655 4.340 -0.009 0.000 0.247 255 Q C -2.292 173.697 176.000 -0.019 0.000 0.986 255 Q CA -1.766 54.029 55.803 -0.014 0.000 0.713 255 Q CB 1.283 30.016 28.738 -0.008 0.000 1.241 255 Q HN 0.423 8.693 8.270 0.000 0.000 0.488 256 P HA -0.200 4.220 4.420 0.000 0.000 0.216 256 P C 0.567 177.852 177.300 -0.025 0.000 1.150 256 P CA 1.524 64.594 63.100 -0.050 0.000 0.843 256 P CB 0.165 31.797 31.700 -0.113 0.000 0.787 257 D N -2.181 118.207 120.400 -0.021 0.000 2.403 257 D HA -0.099 4.536 4.640 -0.009 0.000 0.227 257 D C 1.218 177.542 176.300 0.040 0.000 0.995 257 D CA 1.114 55.115 54.000 0.002 0.000 0.928 257 D CB -1.428 39.372 40.800 0.000 0.000 0.887 257 D HN 0.077 8.447 8.370 0.000 0.000 0.529 258 T N -0.527 114.048 114.554 0.035 0.000 3.065 258 T HA 0.241 4.585 4.350 -0.009 0.000 0.252 258 T C 1.086 175.840 174.700 0.089 0.000 1.099 258 T CA 0.031 62.166 62.100 0.058 0.000 1.063 258 T CB 0.104 68.975 68.868 0.004 0.000 0.948 258 T HN 0.159 8.399 8.240 0.000 0.000 0.506 259 L N 0.424 121.679 121.223 0.053 0.000 3.289 259 L HA 0.277 4.612 4.340 -0.009 0.000 0.291 259 L C 0.891 177.772 176.870 0.020 0.000 1.279 259 L CA -0.190 54.669 54.840 0.033 0.000 1.025 259 L CB 0.598 42.672 42.059 0.025 0.000 1.413 259 L HN -0.037 8.193 8.230 0.000 0.000 0.593 260 D N 1.568 121.979 120.400 0.018 0.000 2.127 260 D HA -0.241 4.394 4.640 -0.009 0.000 0.190 260 D C 2.149 178.451 176.300 0.003 0.000 1.000 260 D CA 1.882 55.882 54.000 0.001 0.000 0.839 260 D CB 0.178 40.968 40.800 -0.018 0.000 0.955 260 D HN 0.393 8.763 8.370 0.000 0.000 0.446 261 A N 0.576 123.389 122.820 -0.012 0.000 1.908 261 A HA -0.155 4.159 4.320 -0.009 0.000 0.218 261 A C 2.604 180.218 177.584 0.050 0.000 1.181 261 A CA 1.521 53.567 52.037 0.014 0.000 0.627 261 A CB -0.806 18.201 19.000 0.012 0.000 0.818 261 A HN 0.169 8.319 8.150 0.000 0.000 0.445 262 V N 0.111 120.018 119.914 -0.011 0.000 2.358 262 V HA -0.236 3.879 4.120 -0.009 0.000 0.246 262 V C 2.556 178.742 176.094 0.154 0.000 1.047 262 V CA 1.896 64.209 62.300 0.022 0.000 1.035 262 V CB -0.672 31.132 31.823 -0.032 0.000 0.658 262 V HN 0.569 8.759 8.190 0.000 0.000 0.452 263 L N -0.050 121.233 121.223 0.100 0.000 2.093 263 L HA -0.118 4.216 4.340 -0.009 0.000 0.208 263 L C 2.739 179.669 176.870 0.100 0.000 1.085 263 L CA 1.470 56.371 54.840 0.103 0.000 0.755 263 L CB -0.852 41.241 42.059 0.056 0.000 0.904 263 L HN 0.362 8.592 8.230 0.000 0.000 0.435 264 A N 0.017 122.880 122.820 0.073 0.000 1.933 264 A HA -0.234 4.080 4.320 -0.009 0.000 0.218 264 A C 2.289 179.919 177.584 0.075 0.000 1.175 264 A CA 1.781 53.852 52.037 0.057 0.000 0.628 264 A CB -0.325 18.694 19.000 0.032 0.000 0.814 264 A HN 0.164 8.314 8.150 0.000 0.000 0.444 265 K N -0.309 120.152 120.400 0.101 0.000 2.103 265 K HA 0.127 4.441 4.320 -0.009 0.000 0.204 265 K C 1.742 178.488 176.600 0.243 0.000 1.052 265 K CA 0.861 57.217 56.287 0.114 0.000 0.945 265 K CB -0.436 32.067 32.500 0.004 0.000 0.722 265 K HN 0.499 8.749 8.250 0.000 0.000 0.443 266 L N 0.010 121.413 121.223 0.300 0.000 2.093 266 L HA -0.157 4.178 4.340 -0.009 0.000 0.208 266 L C 2.277 179.231 176.870 0.140 0.000 1.085 266 L CA 1.231 56.222 54.840 0.252 0.000 0.755 266 L CB -0.248 41.943 42.059 0.220 0.000 0.904 266 L HN 0.136 8.366 8.230 0.000 0.000 0.435 267 R N -0.012 120.555 120.500 0.112 0.000 2.083 267 R HA -0.172 4.162 4.340 -0.009 0.000 0.237 267 R C 1.852 178.194 176.300 0.069 0.000 1.137 267 R CA 1.654 57.802 56.100 0.079 0.000 0.951 267 R CB -0.496 29.842 30.300 0.064 0.000 0.851 267 R HN 0.353 8.623 8.270 0.000 0.000 0.434 268 D N 0.629 121.070 120.400 0.068 0.000 2.221 268 D HA -0.130 4.505 4.640 -0.009 0.000 0.204 268 D C 1.540 177.872 176.300 0.054 0.000 0.982 268 D CA 1.387 55.416 54.000 0.049 0.000 0.857 268 D CB -0.153 40.665 40.800 0.030 0.000 0.934 268 D HN 0.288 8.658 8.370 0.000 0.000 0.475 269 A N -0.426 122.443 122.820 0.081 0.000 2.206 269 A HA 0.382 4.697 4.320 -0.009 0.000 0.211 269 A C 1.760 179.375 177.584 0.051 0.000 1.158 269 A CA 1.181 53.259 52.037 0.068 0.000 0.761 269 A CB -0.090 18.962 19.000 0.087 0.000 0.801 269 A HN 0.279 8.429 8.150 0.000 0.000 0.473 270 G N -2.486 106.348 108.800 0.057 0.000 2.148 270 G HA2 0.193 4.148 3.960 -0.009 0.000 0.203 270 G HA3 0.193 4.148 3.960 -0.009 0.000 0.203 270 G C 0.276 175.216 174.900 0.066 0.000 0.993 270 G CA 0.103 45.237 45.100 0.057 0.000 0.661 270 G HN 1.437 9.727 8.290 0.000 0.000 0.518 271 A N -0.085 122.773 122.820 0.062 0.000 2.322 271 A HA 0.621 4.936 4.320 -0.009 0.000 0.269 271 A C 0.018 177.644 177.584 0.070 0.000 1.094 271 A CA 0.356 52.425 52.037 0.053 0.000 0.807 271 A CB 0.772 19.799 19.000 0.044 0.000 1.047 271 A HN 0.472 8.622 8.150 0.000 0.000 0.487 272 D N 1.453 121.890 120.400 0.061 0.000 2.412 272 D HA 0.495 5.129 4.640 -0.009 0.000 0.224 272 D C -0.804 175.539 176.300 0.071 0.000 1.093 272 D CA 0.072 54.130 54.000 0.097 0.000 0.850 272 D CB 0.102 41.016 40.800 0.191 0.000 1.046 272 D HN 0.339 8.709 8.370 0.000 0.000 0.507 273 I N 3.042 123.659 120.570 0.079 0.000 2.465 273 I HA 0.337 4.502 4.170 -0.009 0.000 0.291 273 I C 0.206 176.371 176.117 0.081 0.000 1.014 273 I CA -0.739 60.608 61.300 0.078 0.000 1.093 273 I CB 1.831 39.870 38.000 0.065 0.000 1.267 273 I HN 0.225 8.435 8.210 0.000 0.000 0.431 274 E N 5.109 125.377 120.200 0.115 0.000 2.312 274 E HA 0.637 4.982 4.350 -0.009 0.000 0.267 274 E C -1.317 175.235 176.600 -0.080 0.000 0.894 274 E CA -0.862 55.590 56.400 0.087 0.000 0.773 274 E CB 3.436 33.276 29.700 0.234 0.000 1.241 274 E HN 0.403 8.763 8.360 0.000 0.000 0.432 275 V N -1.209 118.489 119.914 -0.360 0.000 2.735 275 V HA 0.887 5.002 4.120 -0.009 0.000 0.310 275 V C 0.042 175.395 176.094 -1.235 0.000 1.061 275 V CA -0.455 61.398 62.300 -0.744 0.000 0.913 275 V CB 1.434 33.029 31.823 -0.380 0.000 1.005 275 V HN 0.747 8.937 8.190 0.000 0.000 0.428 276 G N 1.635 109.177 108.800 -2.096 0.000 2.857 276 G HA2 0.434 4.388 3.960 -0.009 0.000 0.217 276 G HA3 0.434 4.388 3.960 -0.009 0.000 0.217 276 G C 0.159 174.648 174.900 -0.686 0.000 1.357 276 G CA 0.204 44.409 45.100 -1.492 0.000 1.033 276 G HN 0.857 9.147 8.290 0.000 0.000 0.571 277 E N -0.652 119.352 120.200 -0.326 0.000 2.318 277 E HA -0.018 4.327 4.350 -0.009 0.000 0.193 277 E C 0.158 176.694 176.600 -0.107 0.000 0.998 277 E CA 0.980 57.288 56.400 -0.152 0.000 0.859 277 E CB 0.304 29.979 29.700 -0.042 0.000 0.812 277 E HN 0.511 8.871 8.360 0.000 0.000 0.492 278 D N -0.605 119.754 120.400 -0.069 0.000 2.822 278 D HA 0.005 4.640 4.640 -0.009 0.000 0.327 278 D C -0.384 176.007 176.300 0.151 0.000 1.577 278 D CA -0.480 53.539 54.000 0.032 0.000 0.785 278 D CB -0.906 39.939 40.800 0.075 0.000 1.199 278 D HN 0.162 8.532 8.370 0.000 0.000 0.443 279 W N 0.121 121.423 121.300 0.004 0.000 3.118 279 W HA 0.708 5.362 4.660 -0.010 0.000 0.328 279 W C -1.959 174.567 176.519 0.011 0.000 1.239 279 W CA -1.328 56.020 57.345 0.004 0.000 1.176 279 W CB 0.587 30.046 29.460 -0.002 0.000 1.433 279 W HN -0.296 7.884 8.180 0.000 0.000 0.562 280 I N 2.937 123.700 120.570 0.322 0.000 2.582 280 I HA 0.316 4.480 4.170 -0.009 0.000 0.292 280 I C -0.060 176.283 176.117 0.376 0.000 1.066 280 I CA -0.732 60.696 61.300 0.214 0.000 1.053 280 I CB 2.546 40.600 38.000 0.091 0.000 1.241 280 I HN 0.456 8.666 8.210 0.000 0.000 0.421 281 S N 6.788 122.727 115.700 0.399 0.000 2.532 281 S HA 0.848 5.313 4.470 -0.009 0.000 0.301 281 S C -0.995 173.698 174.600 0.155 0.000 1.083 281 S CA -0.728 57.638 58.200 0.276 0.000 1.025 281 S CB 2.314 65.705 63.200 0.317 0.000 1.056 281 S HN 0.628 8.938 8.310 0.000 0.000 0.494 282 L N 2.092 123.366 121.223 0.084 0.000 2.438 282 L HA 0.669 5.004 4.340 -0.009 0.000 0.270 282 L C -1.956 174.895 176.870 -0.033 0.000 0.972 282 L CA -0.263 54.599 54.840 0.036 0.000 0.831 282 L CB 1.931 44.014 42.059 0.041 0.000 1.273 282 L HN 0.829 9.059 8.230 0.000 0.000 0.405 283 D N 4.728 125.065 120.400 -0.104 0.000 2.757 283 D HA 0.322 4.957 4.640 -0.009 0.000 0.249 283 D C 0.263 176.366 176.300 -0.328 0.000 1.168 283 D CA -0.435 53.400 54.000 -0.275 0.000 0.870 283 D CB 1.897 42.412 40.800 -0.475 0.000 1.411 283 D HN 0.475 8.845 8.370 0.000 0.000 0.525 284 M N 1.582 121.044 119.600 -0.230 0.000 2.556 284 M HA 0.025 4.500 4.480 -0.009 0.000 0.245 284 M C 0.135 176.412 176.300 -0.037 0.000 1.128 284 M CA 0.194 55.431 55.300 -0.106 0.000 1.069 284 M CB -0.717 31.858 32.600 -0.042 0.000 1.469 284 M HN 0.471 8.761 8.290 0.000 0.000 0.494 285 H N 0.445 119.524 119.070 0.015 0.000 2.626 285 H HA -0.169 4.382 4.556 -0.008 0.000 0.317 285 H C 1.400 176.733 175.328 0.009 0.000 1.140 285 H CA 0.921 56.976 56.048 0.012 0.000 1.134 285 H CB -2.194 27.576 29.762 0.014 0.000 1.486 285 H HN 0.667 8.947 8.280 0.000 0.000 0.417 286 G N -0.724 108.117 108.800 0.067 0.000 2.196 286 G HA2 -0.358 3.597 3.960 -0.009 0.000 0.268 286 G HA3 -0.358 3.597 3.960 -0.009 0.000 0.268 286 G C 0.477 175.402 174.900 0.041 0.000 0.975 286 G CA 0.855 45.982 45.100 0.045 0.000 0.648 286 G HN 0.402 8.692 8.290 0.000 0.000 0.538 287 K N 0.375 120.807 120.400 0.053 0.000 2.185 287 K HA 0.365 4.680 4.320 -0.009 0.000 0.271 287 K C 0.749 177.363 176.600 0.024 0.000 1.013 287 K CA -0.725 55.588 56.287 0.044 0.000 0.943 287 K CB 1.057 33.593 32.500 0.061 0.000 0.998 287 K HN 0.479 8.729 8.250 0.000 0.000 0.468 288 R N 3.374 123.886 120.500 0.020 0.000 2.390 288 R HA 0.165 4.500 4.340 -0.009 0.000 0.291 288 R C -2.019 174.289 176.300 0.014 0.000 1.070 288 R CA -1.198 54.909 56.100 0.012 0.000 1.014 288 R CB 0.423 30.731 30.300 0.013 0.000 1.007 288 R HN 0.335 8.605 8.270 0.000 0.000 0.466 289 P HA 0.040 4.460 4.420 0.000 0.000 0.269 289 P C -1.199 176.110 177.300 0.015 0.000 1.215 289 P CA 0.061 63.166 63.100 0.008 0.000 0.780 289 P CB 0.691 32.384 31.700 -0.012 0.000 0.898 290 K N 1.139 121.553 120.400 0.023 0.000 2.172 290 K HA 0.469 4.784 4.320 -0.009 0.000 0.276 290 K C 0.290 176.903 176.600 0.021 0.000 1.013 290 K CA -0.618 55.683 56.287 0.023 0.000 0.913 290 K CB 1.558 34.073 32.500 0.025 0.000 1.055 290 K HN 0.544 8.794 8.250 0.000 0.000 0.461 291 A N 2.159 124.988 122.820 0.016 0.000 2.561 291 A HA 0.213 4.528 4.320 -0.009 0.000 0.234 291 A C 0.383 177.960 177.584 -0.012 0.000 1.055 291 A CA -0.198 51.841 52.037 0.005 0.000 0.756 291 A CB -0.089 18.912 19.000 0.001 0.000 0.986 291 A HN 0.545 8.695 8.150 0.000 0.000 0.505 292 V N 0.316 120.215 119.914 -0.026 0.000 3.074 292 V HA 0.659 4.774 4.120 -0.009 0.000 0.314 292 V C -0.439 175.529 176.094 -0.209 0.000 1.117 292 V CA -1.253 61.000 62.300 -0.078 0.000 1.014 292 V CB 1.924 33.739 31.823 -0.012 0.000 1.057 292 V HN 0.878 9.068 8.190 0.000 0.000 0.438 293 N N 0.212 118.712 118.700 -0.333 0.000 2.372 293 N HA 0.772 5.506 4.740 -0.009 0.000 0.291 293 N C -1.374 173.826 175.510 -0.517 0.000 1.024 293 N CA -0.561 52.113 53.050 -0.627 0.000 0.873 293 N CB 2.267 40.200 38.487 -0.923 0.000 1.206 293 N HN 0.623 9.003 8.380 0.000 0.000 0.486 294 V N 1.670 121.269 119.914 -0.526 0.000 2.789 294 V HA 0.502 4.617 4.120 -0.009 0.000 0.311 294 V C -0.438 175.468 176.094 -0.314 0.000 1.073 294 V CA -0.783 61.202 62.300 -0.524 0.000 0.921 294 V CB 2.122 33.435 31.823 -0.850 0.000 1.009 294 V HN 0.648 8.838 8.190 0.000 0.000 0.426 295 R N 2.223 122.576 120.500 -0.245 0.000 2.451 295 R HA 0.526 4.860 4.340 -0.009 0.000 0.307 295 R C -0.161 176.126 176.300 -0.021 0.000 0.965 295 R CA -0.273 55.786 56.100 -0.068 0.000 0.865 295 R CB 1.711 32.010 30.300 -0.002 0.000 1.174 295 R HN 0.939 9.209 8.270 0.000 0.000 0.455 296 T N 1.265 115.847 114.554 0.047 0.000 2.918 296 T HA 0.665 5.010 4.350 -0.009 0.000 0.302 296 T C 0.070 174.814 174.700 0.073 0.000 1.045 296 T CA -0.119 62.065 62.100 0.141 0.000 1.114 296 T CB 1.518 70.482 68.868 0.159 0.000 0.965 296 T HN 0.709 8.949 8.240 0.000 0.000 0.540 297 A N 3.132 125.993 122.820 0.068 0.000 2.566 297 A HA 0.734 5.049 4.320 -0.009 0.000 0.290 297 A C -3.144 174.447 177.584 0.012 0.000 1.071 297 A CA -1.684 50.363 52.037 0.016 0.000 0.658 297 A CB 0.241 19.249 19.000 0.013 0.000 1.285 297 A HN 0.658 8.808 8.150 0.000 0.000 0.427 298 P HA 0.241 4.661 4.420 0.000 0.000 0.268 298 P C -0.325 177.000 177.300 0.041 0.000 1.208 298 P CA 0.373 63.483 63.100 0.016 0.000 0.777 298 P CB 0.117 31.819 31.700 0.003 0.000 0.875 299 H N 3.969 123.028 119.070 -0.019 0.000 3.038 299 H HA -0.004 4.552 4.556 0.000 0.000 0.338 299 H C -1.347 173.975 175.328 -0.011 0.000 1.041 299 H CA -0.392 55.646 56.048 -0.017 0.000 1.394 299 H CB 0.220 29.972 29.762 -0.016 0.000 1.357 299 H HN 0.305 8.585 8.280 0.000 0.000 0.600 300 P HA 0.207 4.627 4.420 0.000 0.000 0.259 300 P C -0.574 176.482 177.300 -0.407 0.000 1.530 300 P CA -0.054 62.390 63.100 -1.094 0.000 1.022 300 P CB 0.043 31.248 31.700 -0.826 0.000 1.514 301 A N 0.403 123.115 122.820 -0.180 0.000 2.292 301 A HA 0.290 4.605 4.320 -0.009 0.000 0.265 301 A C -0.221 177.374 177.584 0.018 0.000 1.133 301 A CA -0.472 51.536 52.037 -0.047 0.000 0.807 301 A CB -0.417 18.580 19.000 -0.004 0.000 1.102 301 A HN 0.185 8.335 8.150 0.000 0.000 0.502 302 F N 1.155 121.052 119.950 -0.088 0.000 2.578 302 F HA 0.357 4.888 4.527 0.007 0.000 0.376 302 F C -1.972 173.798 175.800 -0.051 0.000 1.085 302 F CA -1.651 56.291 58.000 -0.097 0.000 1.260 302 F CB 0.557 39.460 39.000 -0.163 0.000 1.095 302 F HN 0.196 8.496 8.300 0.000 0.000 0.573 303 P HA 0.094 4.514 4.420 0.000 0.000 0.285 303 P C 0.373 177.672 177.300 -0.002 0.000 1.259 303 P CA -0.305 62.721 63.100 -0.122 0.000 0.794 303 P CB 1.480 33.067 31.700 -0.188 0.000 0.940 304 T N 0.679 115.287 114.554 0.089 0.000 2.803 304 T HA -0.163 4.182 4.350 -0.009 0.000 0.269 304 T C 0.951 175.725 174.700 0.123 0.000 1.052 304 T CA 1.708 63.896 62.100 0.147 0.000 1.136 304 T CB -0.798 68.164 68.868 0.156 0.000 0.864 304 T HN 0.291 8.531 8.240 0.000 0.000 0.467 305 D N 0.279 120.720 120.400 0.068 0.000 2.392 305 D HA 0.027 4.661 4.640 -0.009 0.000 0.228 305 D C 1.346 177.663 176.300 0.029 0.000 1.003 305 D CA 0.564 54.588 54.000 0.040 0.000 0.917 305 D CB 0.024 40.833 40.800 0.015 0.000 0.890 305 D HN 0.399 8.769 8.370 0.000 0.000 0.532 306 M N -0.324 119.287 119.600 0.018 0.000 2.313 306 M HA 0.050 4.525 4.480 -0.009 0.000 0.273 306 M C 1.608 178.118 176.300 0.350 0.000 1.049 306 M CA 0.116 55.465 55.300 0.083 0.000 1.004 306 M CB 0.486 32.967 32.600 -0.199 0.000 1.461 306 M HN -0.007 8.283 8.290 0.000 0.000 0.514 307 Q N 0.995 120.991 119.800 0.326 0.000 2.079 307 Q HA -0.088 4.246 4.340 -0.009 0.000 0.200 307 Q C 1.664 177.805 176.000 0.236 0.000 0.974 307 Q CA 2.036 58.065 55.803 0.377 0.000 0.840 307 Q CB 0.097 28.992 28.738 0.262 0.000 0.898 307 Q HN 0.441 8.711 8.270 0.000 0.000 0.430 308 A N 0.536 123.340 122.820 -0.027 0.000 1.930 308 A HA -0.212 4.103 4.320 -0.009 0.000 0.217 308 A C 1.993 179.553 177.584 -0.040 0.000 1.175 308 A CA 1.539 53.374 52.037 -0.337 0.000 0.627 308 A CB -0.410 18.074 19.000 -0.860 0.000 0.815 308 A HN 0.455 8.605 8.150 0.000 0.000 0.443 309 Q N -1.213 118.613 119.800 0.045 0.000 2.084 309 Q HA -0.059 4.276 4.340 -0.009 0.000 0.202 309 Q C 1.572 177.602 176.000 0.050 0.000 0.978 309 Q CA 1.621 57.444 55.803 0.033 0.000 0.844 309 Q CB -0.431 28.325 28.738 0.030 0.000 0.898 309 Q HN 0.700 8.970 8.270 0.000 0.000 0.426 310 F N -0.181 119.843 119.950 0.124 0.000 2.456 310 F HA -0.068 4.449 4.527 -0.017 0.000 0.298 310 F C 2.073 177.917 175.800 0.074 0.000 1.104 310 F CA 1.001 59.072 58.000 0.118 0.000 1.435 310 F CB -0.111 38.995 39.000 0.177 0.000 1.078 310 F HN 0.012 8.312 8.300 0.000 0.000 0.546 311 T N 0.497 115.204 114.554 0.255 0.000 2.746 311 T HA -0.190 4.154 4.350 -0.009 0.000 0.267 311 T C 2.004 176.783 174.700 0.132 0.000 1.039 311 T CA 1.296 63.526 62.100 0.216 0.000 1.142 311 T CB -0.486 68.592 68.868 0.349 0.000 0.866 311 T HN 0.141 8.381 8.240 0.000 0.000 0.444 312 L N 1.290 122.569 121.223 0.093 0.000 2.017 312 L HA 0.082 4.416 4.340 -0.009 0.000 0.208 312 L C 2.222 179.086 176.870 -0.010 0.000 1.073 312 L CA 1.467 56.328 54.840 0.034 0.000 0.745 312 L CB -0.956 41.102 42.059 -0.001 0.000 0.894 312 L HN 0.252 8.482 8.230 0.000 0.000 0.432 313 L N -0.159 121.028 121.223 -0.059 0.000 1.978 313 L HA -0.325 4.010 4.340 -0.009 0.000 0.218 313 L C 2.296 179.150 176.870 -0.026 0.000 1.075 313 L CA 2.127 56.910 54.840 -0.094 0.000 0.767 313 L CB -0.671 41.248 42.059 -0.233 0.000 0.890 313 L HN 0.399 8.629 8.230 0.000 0.000 0.434 314 N N -0.135 118.575 118.700 0.016 0.000 2.205 314 N HA -0.189 4.546 4.740 -0.009 0.000 0.186 314 N C 1.773 177.295 175.510 0.019 0.000 1.015 314 N CA 1.496 54.560 53.050 0.024 0.000 0.862 314 N CB -0.407 38.101 38.487 0.035 0.000 0.986 314 N HN 0.408 8.788 8.380 0.000 0.000 0.429 315 L N 0.142 121.378 121.223 0.022 0.000 2.465 315 L HA -0.011 4.324 4.340 -0.009 0.000 0.224 315 L C 1.340 178.213 176.870 0.005 0.000 1.145 315 L CA 0.431 55.283 54.840 0.020 0.000 0.834 315 L CB 0.097 42.169 42.059 0.023 0.000 0.944 315 L HN 0.064 8.294 8.230 0.000 0.000 0.451 316 V N -4.829 115.084 119.914 -0.001 0.000 3.176 316 V HA 0.537 4.652 4.120 -0.009 0.000 0.332 316 V C 0.669 176.764 176.094 0.001 0.000 1.414 316 V CA -0.263 62.033 62.300 -0.007 0.000 1.133 316 V CB -0.290 31.522 31.823 -0.019 0.000 1.088 316 V HN 0.089 8.279 8.190 0.000 0.000 0.473 317 A N 0.157 122.983 122.820 0.009 0.000 2.248 317 A HA 0.679 4.994 4.320 -0.009 0.000 0.316 317 A C 0.018 177.618 177.584 0.027 0.000 1.101 317 A CA -0.627 51.418 52.037 0.013 0.000 0.875 317 A CB 0.722 19.729 19.000 0.011 0.000 1.207 317 A HN 0.481 8.631 8.150 0.000 0.000 0.504 318 E N -0.254 119.961 120.200 0.026 0.000 2.129 318 E HA 0.448 4.792 4.350 -0.009 0.000 0.283 318 E C 0.546 177.169 176.600 0.037 0.000 1.080 318 E CA 1.024 57.444 56.400 0.033 0.000 0.867 318 E CB 0.163 29.880 29.700 0.028 0.000 1.056 318 E HN 1.303 9.663 8.360 0.000 0.000 0.404 319 G N 2.758 111.589 108.800 0.053 0.000 2.447 319 G HA2 -0.172 3.782 3.960 -0.009 0.000 0.220 319 G HA3 -0.172 3.782 3.960 -0.009 0.000 0.220 319 G C -0.581 174.360 174.900 0.068 0.000 1.261 319 G CA -0.577 44.559 45.100 0.060 0.000 1.000 319 G HN 0.477 8.767 8.290 0.000 0.000 0.515 320 T N 0.484 115.074 114.554 0.060 0.000 2.829 320 T HA 0.746 5.091 4.350 -0.009 0.000 0.280 320 T C 0.388 175.085 174.700 -0.006 0.000 0.999 320 T CA 0.441 62.555 62.100 0.023 0.000 0.983 320 T CB 1.603 70.517 68.868 0.077 0.000 0.968 320 T HN 1.790 10.030 8.240 0.000 0.000 0.446 321 G N 2.080 110.854 108.800 -0.045 0.000 2.667 321 G HA2 0.705 4.660 3.960 -0.009 0.000 0.298 321 G HA3 0.705 4.660 3.960 -0.009 0.000 0.298 321 G C -1.315 173.575 174.900 -0.016 0.000 1.377 321 G CA -0.909 44.154 45.100 -0.063 0.000 0.964 321 G HN 0.658 8.948 8.290 0.000 0.000 0.493 322 F N 0.109 120.017 119.950 -0.069 0.000 2.538 322 F HA 0.869 5.390 4.527 -0.010 0.000 0.325 322 F C -0.677 175.091 175.800 -0.053 0.000 1.066 322 F CA -1.705 56.252 58.000 -0.071 0.000 0.946 322 F CB 1.779 40.736 39.000 -0.072 0.000 1.199 322 F HN 0.285 8.585 8.300 0.000 0.000 0.473 323 I N 2.337 123.026 120.570 0.199 0.000 2.447 323 I HA 0.308 4.473 4.170 -0.009 0.000 0.287 323 I C -0.925 175.348 176.117 0.259 0.000 1.023 323 I CA -0.516 60.861 61.300 0.129 0.000 1.083 323 I CB 2.261 40.340 38.000 0.132 0.000 1.245 323 I HN 0.706 8.916 8.210 0.000 0.000 0.434 324 T N 4.297 118.991 114.554 0.233 0.000 2.823 324 T HA 0.333 4.678 4.350 -0.009 0.000 0.279 324 T C -0.465 174.357 174.700 0.204 0.000 0.998 324 T CA -0.472 61.773 62.100 0.242 0.000 0.994 324 T CB 1.830 70.827 68.868 0.215 0.000 0.960 324 T HN 0.495 8.735 8.240 0.000 0.000 0.448 325 E N 1.433 121.786 120.200 0.255 0.000 2.129 325 E HA 0.415 4.760 4.350 -0.009 0.000 0.268 325 E C 0.705 177.369 176.600 0.107 0.000 0.900 325 E CA -0.646 55.855 56.400 0.169 0.000 0.755 325 E CB 0.878 30.653 29.700 0.124 0.000 1.117 325 E HN 0.644 9.004 8.360 0.000 0.000 0.410 326 T N 0.488 115.072 114.554 0.050 0.000 3.044 326 T HA 0.161 4.506 4.350 -0.009 0.000 0.260 326 T C 0.959 175.628 174.700 -0.052 0.000 1.019 326 T CA 0.428 62.537 62.100 0.015 0.000 0.921 326 T CB 0.182 69.057 68.868 0.013 0.000 1.053 326 T HN 0.199 8.439 8.240 0.000 0.000 0.533 327 V N -0.250 119.599 119.914 -0.109 0.000 2.521 327 V HA 0.420 4.535 4.120 -0.009 0.000 0.239 327 V C 0.069 175.887 176.094 -0.461 0.000 1.053 327 V CA 0.376 62.483 62.300 -0.322 0.000 1.073 327 V CB -0.194 31.381 31.823 -0.415 0.000 0.746 327 V HN 0.430 8.620 8.190 0.000 0.000 0.476 328 F N 0.746 120.680 119.950 -0.027 0.000 2.443 328 F HA 0.447 4.950 4.527 -0.040 0.000 0.369 328 F C 1.122 176.877 175.800 -0.076 0.000 1.090 328 F CA -1.070 56.899 58.000 -0.052 0.000 1.129 328 F CB 0.650 39.604 39.000 -0.076 0.000 1.367 328 F HN 0.051 8.351 8.300 0.000 0.000 0.465 329 E N 0.761 121.042 120.200 0.135 0.000 2.409 329 E HA -0.094 4.250 4.350 -0.009 0.000 0.198 329 E C 0.423 177.111 176.600 0.148 0.000 1.024 329 E CA 0.645 57.120 56.400 0.125 0.000 0.861 329 E CB 0.070 29.839 29.700 0.115 0.000 0.788 329 E HN 0.439 8.799 8.360 0.000 0.000 0.521 330 N N 0.742 119.494 118.700 0.086 0.000 2.338 330 N HA 0.036 4.770 4.740 -0.009 0.000 0.251 330 N C -0.249 175.239 175.510 -0.036 0.000 1.199 330 N CA 0.018 53.123 53.050 0.092 0.000 0.879 330 N CB 0.511 39.043 38.487 0.076 0.000 1.159 330 N HN -0.045 8.335 8.380 0.000 0.000 0.514 331 R N 0.685 121.011 120.500 -0.289 0.000 3.956 331 R HA 0.216 4.550 4.340 -0.009 0.000 0.237 331 R C -0.641 175.369 176.300 -0.483 0.000 1.552 331 R CA -0.034 55.882 56.100 -0.306 0.000 1.529 331 R CB -0.496 29.678 30.300 -0.210 0.000 1.376 331 R HN -0.059 8.211 8.270 0.000 0.000 0.733 332 F N 0.078 120.059 119.950 0.050 0.000 2.825 332 F HA 0.195 4.724 4.527 0.003 0.000 0.322 332 F C 1.370 176.981 175.800 -0.316 0.000 1.127 332 F CA -0.362 57.526 58.000 -0.188 0.000 1.164 332 F CB 0.333 39.255 39.000 -0.131 0.000 1.101 332 F HN 0.195 8.495 8.300 0.000 0.000 0.529 333 M N -0.183 119.436 119.600 0.032 0.000 2.267 333 M HA -0.237 4.237 4.480 -0.009 0.000 0.263 333 M C 2.217 178.522 176.300 0.008 0.000 1.063 333 M CA 2.014 57.324 55.300 0.016 0.000 1.090 333 M CB -0.844 31.769 32.600 0.022 0.000 1.392 333 M HN 0.451 8.741 8.290 0.000 0.000 0.422 334 H N -1.576 117.530 119.070 0.059 0.000 2.457 334 H HA -0.054 4.501 4.556 -0.002 0.000 0.297 334 H C 1.836 177.206 175.328 0.070 0.000 1.092 334 H CA 1.195 57.275 56.048 0.053 0.000 1.309 334 H CB -0.940 28.855 29.762 0.055 0.000 1.382 334 H HN 0.130 8.410 8.280 0.000 0.000 0.535 335 V N 1.676 121.418 119.914 -0.287 0.000 2.261 335 V HA -0.157 3.958 4.120 -0.009 0.000 0.246 335 V C -0.275 175.796 176.094 -0.038 0.000 1.047 335 V CA 2.014 64.232 62.300 -0.137 0.000 1.015 335 V CB -1.158 30.561 31.823 -0.173 0.000 0.642 335 V HN 0.452 8.642 8.190 0.000 0.000 0.446 336 P HA -0.119 4.301 4.420 0.000 0.000 0.216 336 P C 1.536 178.841 177.300 0.009 0.000 1.150 336 P CA 1.182 64.279 63.100 -0.006 0.000 0.837 336 P CB -0.047 31.651 31.700 -0.004 0.000 0.786 337 E N -0.139 120.071 120.200 0.018 0.000 2.051 337 E HA -0.111 4.234 4.350 -0.009 0.000 0.192 337 E C 2.155 178.772 176.600 0.028 0.000 0.991 337 E CA 1.003 57.419 56.400 0.027 0.000 0.799 337 E CB -1.021 28.703 29.700 0.041 0.000 0.748 337 E HN 0.326 8.686 8.360 0.000 0.000 0.449 338 L N 0.958 122.204 121.223 0.037 0.000 2.191 338 L HA -0.116 4.219 4.340 -0.009 0.000 0.212 338 L C 2.411 179.287 176.870 0.010 0.000 1.103 338 L CA 0.657 55.515 54.840 0.030 0.000 0.769 338 L CB -0.257 41.833 42.059 0.052 0.000 0.908 338 L HN 0.005 8.235 8.230 0.000 0.000 0.438 339 S N -0.418 115.290 115.700 0.013 0.000 2.423 339 S HA -0.086 4.379 4.470 -0.009 0.000 0.231 339 S C 1.965 176.571 174.600 0.010 0.000 1.014 339 S CA 0.837 59.045 58.200 0.013 0.000 0.965 339 S CB -0.116 63.100 63.200 0.026 0.000 0.785 339 S HN 0.400 8.710 8.310 0.000 0.000 0.495 340 R N 0.649 121.156 120.500 0.011 0.000 2.189 340 R HA 0.117 4.452 4.340 -0.009 0.000 0.223 340 R C 1.388 177.690 176.300 0.003 0.000 1.092 340 R CA 0.872 56.979 56.100 0.011 0.000 0.989 340 R CB -0.256 30.052 30.300 0.014 0.000 0.876 340 R HN 0.441 8.711 8.270 0.000 0.000 0.457 341 M N -0.554 119.043 119.600 -0.004 0.000 2.453 341 M HA 0.196 4.671 4.480 -0.009 0.000 0.239 341 M C 0.609 176.886 176.300 -0.039 0.000 1.151 341 M CA 0.319 55.610 55.300 -0.014 0.000 0.989 341 M CB 1.245 33.839 32.600 -0.010 0.000 1.548 341 M HN 0.387 8.677 8.290 0.000 0.000 0.479 342 G N 0.774 109.544 108.800 -0.050 0.000 2.157 342 G HA2 -0.186 3.769 3.960 -0.009 0.000 0.239 342 G HA3 -0.186 3.769 3.960 -0.009 0.000 0.239 342 G C 0.186 174.931 174.900 -0.258 0.000 0.982 342 G CA -0.031 45.003 45.100 -0.110 0.000 0.650 342 G HN 0.668 8.958 8.290 0.000 0.000 0.527 343 A N 0.469 123.190 122.820 -0.165 0.000 2.425 343 A HA 0.594 4.909 4.320 -0.009 0.000 0.242 343 A C 0.130 177.632 177.584 -0.137 0.000 1.077 343 A CA 0.010 51.942 52.037 -0.174 0.000 0.781 343 A CB 0.185 19.157 19.000 -0.046 0.000 1.020 343 A HN 0.497 8.647 8.150 0.000 0.000 0.494 344 H N 0.478 119.586 119.070 0.063 0.000 2.638 344 H HA 0.646 5.197 4.556 -0.009 0.000 0.303 344 H C -0.090 175.314 175.328 0.127 0.000 1.034 344 H CA 0.214 56.317 56.048 0.092 0.000 1.225 344 H CB 0.988 30.819 29.762 0.115 0.000 1.394 344 H HN 0.870 9.150 8.280 0.000 0.000 0.477 345 A N 3.328 126.271 122.820 0.205 0.000 2.572 345 A HA 0.617 4.931 4.320 -0.009 0.000 0.295 345 A C -0.749 176.876 177.584 0.068 0.000 1.072 345 A CA -0.922 51.181 52.037 0.110 0.000 0.691 345 A CB 2.242 21.261 19.000 0.032 0.000 1.291 345 A HN 0.618 8.768 8.150 0.000 0.000 0.404 346 E N 1.252 121.466 120.200 0.024 0.000 2.312 346 E HA 0.661 5.006 4.350 -0.009 0.000 0.267 346 E C -1.440 175.096 176.600 -0.107 0.000 0.894 346 E CA -0.674 55.713 56.400 -0.021 0.000 0.773 346 E CB 1.989 31.697 29.700 0.013 0.000 1.241 346 E HN 0.487 8.847 8.360 0.000 0.000 0.432 347 I N 1.511 121.997 120.570 -0.139 0.000 2.354 347 I HA 0.188 4.352 4.170 -0.009 0.000 0.286 347 I C -0.309 175.712 176.117 -0.160 0.000 1.007 347 I CA -0.677 60.482 61.300 -0.236 0.000 1.167 347 I CB 1.319 39.140 38.000 -0.298 0.000 1.320 347 I HN 0.235 8.445 8.210 0.000 0.000 0.458 348 E N 5.087 125.192 120.200 -0.159 0.000 2.102 348 E HA 0.348 4.693 4.350 -0.009 0.000 0.263 348 E C 0.202 176.746 176.600 -0.093 0.000 0.894 348 E CA -0.050 56.286 56.400 -0.106 0.000 0.746 348 E CB 1.673 31.314 29.700 -0.099 0.000 1.129 348 E HN 0.753 9.113 8.360 0.000 0.000 0.416 349 S N 3.962 119.628 115.700 -0.057 0.000 4.151 349 S HA -0.351 4.113 4.470 -0.009 0.000 0.603 349 S C 0.655 175.265 174.600 0.018 0.000 1.878 349 S CA 2.147 60.339 58.200 -0.013 0.000 4.246 349 S CB -1.123 62.070 63.200 -0.012 0.000 0.211 349 S HN 0.820 9.130 8.310 0.000 0.000 0.469 350 N N 0.383 119.118 118.700 0.059 0.000 2.328 350 N HA 0.391 5.126 4.740 -0.009 0.000 0.247 350 N C -0.650 174.963 175.510 0.171 0.000 1.165 350 N CA 0.072 53.243 53.050 0.202 0.000 0.873 350 N CB 1.017 39.634 38.487 0.217 0.000 1.125 350 N HN 0.309 8.689 8.380 0.000 0.000 0.513 351 T N 0.356 114.884 114.554 -0.043 0.000 2.848 351 T HA 0.287 4.631 4.350 -0.009 0.000 0.285 351 T C -0.976 173.565 174.700 -0.265 0.000 0.995 351 T CA -0.662 61.401 62.100 -0.062 0.000 0.970 351 T CB 2.338 71.164 68.868 -0.069 0.000 0.976 351 T HN 0.031 8.271 8.240 0.000 0.000 0.441 352 V N 5.501 125.256 119.914 -0.266 0.000 2.439 352 V HA 0.588 4.703 4.120 -0.009 0.000 0.282 352 V C -0.653 175.401 176.094 -0.067 0.000 1.039 352 V CA -0.785 61.355 62.300 -0.265 0.000 0.913 352 V CB 0.443 32.093 31.823 -0.289 0.000 0.983 352 V HN 0.799 8.989 8.190 0.000 0.000 0.460 353 I N 7.032 127.548 120.570 -0.090 0.000 2.312 353 I HA 0.401 4.566 4.170 -0.009 0.000 0.290 353 I C -0.361 175.633 176.117 -0.205 0.000 1.008 353 I CA -0.295 60.949 61.300 -0.093 0.000 1.226 353 I CB 1.030 38.976 38.000 -0.089 0.000 1.371 353 I HN 0.506 8.716 8.210 0.000 0.000 0.468 354 C N 5.266 124.423 119.300 -0.238 0.000 2.329 354 C HA 0.462 4.917 4.460 -0.009 0.000 0.329 354 C C -0.017 174.736 174.990 -0.394 0.000 1.275 354 C CA -0.660 58.229 59.018 -0.215 0.000 1.726 354 C CB 0.302 28.008 27.740 -0.057 0.000 2.291 354 C HN 0.626 8.856 8.230 0.000 0.000 0.514 355 H N 1.383 120.505 119.070 0.088 0.000 2.718 355 H HA 0.308 4.859 4.556 -0.008 0.000 0.295 355 H C 0.539 175.929 175.328 0.103 0.000 1.051 355 H CA -0.049 56.055 56.048 0.093 0.000 1.260 355 H CB 1.169 30.989 29.762 0.096 0.000 1.403 355 H HN 0.954 9.234 8.280 0.000 0.000 0.488 356 G N 2.457 111.341 108.800 0.139 0.000 2.305 356 G HA2 0.246 4.201 3.960 -0.009 0.000 0.243 356 G HA3 0.246 4.201 3.960 -0.009 0.000 0.243 356 G C 0.618 175.577 174.900 0.098 0.000 1.288 356 G CA -0.182 44.971 45.100 0.089 0.000 0.901 356 G HN 0.465 8.755 8.290 0.000 0.000 0.516 357 V N 0.463 120.404 119.914 0.046 0.000 2.975 357 V HA 0.546 4.660 4.120 -0.009 0.000 0.318 357 V C 1.056 177.155 176.094 0.008 0.000 1.077 357 V CA -0.705 61.610 62.300 0.025 0.000 1.000 357 V CB 2.106 33.892 31.823 -0.062 0.000 1.066 357 V HN 0.649 8.839 8.190 0.000 0.000 0.452 358 E N 1.446 121.653 120.200 0.012 0.000 2.072 358 E HA -0.022 4.323 4.350 -0.009 0.000 0.190 358 E C 0.380 176.977 176.600 -0.004 0.000 0.982 358 E CA 1.496 57.901 56.400 0.009 0.000 0.803 358 E CB 0.212 29.920 29.700 0.014 0.000 0.755 358 E HN 0.880 9.240 8.360 0.000 0.000 0.453 359 K N -0.785 119.607 120.400 -0.013 0.000 2.562 359 K HA 0.385 4.700 4.320 -0.009 0.000 0.267 359 K C -0.726 175.854 176.600 -0.033 0.000 0.938 359 K CA -0.640 55.635 56.287 -0.020 0.000 0.840 359 K CB 1.083 33.576 32.500 -0.012 0.000 1.390 359 K HN -0.158 8.092 8.250 0.000 0.000 0.428 360 L N 1.039 122.242 121.223 -0.034 0.000 2.431 360 L HA 0.459 4.794 4.340 -0.009 0.000 0.260 360 L C -0.161 176.693 176.870 -0.026 0.000 1.098 360 L CA -0.937 53.879 54.840 -0.040 0.000 0.800 360 L CB 1.714 43.751 42.059 -0.036 0.000 1.210 360 L HN 0.706 8.936 8.230 0.000 0.000 0.465 361 S N -0.479 115.206 115.700 -0.024 0.000 2.473 361 S HA 0.508 4.972 4.470 -0.009 0.000 0.307 361 S C 0.141 174.736 174.600 -0.008 0.000 1.094 361 S CA -0.769 57.423 58.200 -0.013 0.000 1.070 361 S CB 1.634 64.828 63.200 -0.010 0.000 1.019 361 S HN 0.805 9.115 8.310 0.000 0.000 0.480 362 G N 1.335 110.133 108.800 -0.003 0.000 2.391 362 G HA2 0.470 4.425 3.960 -0.009 0.000 0.234 362 G HA3 0.470 4.425 3.960 -0.009 0.000 0.234 362 G C -0.126 174.778 174.900 0.006 0.000 1.284 362 G CA 0.257 45.358 45.100 0.002 0.000 0.873 362 G HN 1.098 9.388 8.290 0.000 0.000 0.549 363 A N 1.813 124.640 122.820 0.010 0.000 2.540 363 A HA 0.668 4.983 4.320 -0.009 0.000 0.291 363 A C -0.669 176.926 177.584 0.019 0.000 1.083 363 A CA -0.789 51.256 52.037 0.013 0.000 0.650 363 A CB 0.819 19.826 19.000 0.011 0.000 1.292 363 A HN 0.671 8.822 8.150 0.000 0.000 0.435 364 Q N 0.406 120.218 119.800 0.019 0.000 2.294 364 Q HA 0.516 4.851 4.340 -0.009 0.000 0.257 364 Q C -0.242 175.772 176.000 0.023 0.000 0.955 364 Q CA -0.547 55.270 55.803 0.023 0.000 0.936 364 Q CB 1.515 30.266 28.738 0.022 0.000 1.188 364 Q HN 0.961 9.231 8.270 0.000 0.000 0.420 365 V N -0.305 119.625 119.914 0.027 0.000 3.040 365 V HA 0.677 4.792 4.120 -0.009 0.000 0.312 365 V C -0.766 175.343 176.094 0.026 0.000 1.115 365 V CA -1.247 61.069 62.300 0.026 0.000 0.998 365 V CB 2.257 34.097 31.823 0.028 0.000 1.042 365 V HN 0.843 9.033 8.190 0.000 0.000 0.433 366 M N 3.006 122.618 119.600 0.021 0.000 2.181 366 M HA 0.786 5.261 4.480 -0.009 0.000 0.323 366 M C -0.031 176.268 176.300 -0.001 0.000 1.004 366 M CA -0.560 54.749 55.300 0.016 0.000 0.941 366 M CB 1.367 33.978 32.600 0.019 0.000 1.579 366 M HN 1.209 9.499 8.290 0.000 0.000 0.427 367 A N 2.974 125.788 122.820 -0.009 0.000 2.407 367 A HA 0.541 4.855 4.320 -0.009 0.000 0.248 367 A C 0.697 178.184 177.584 -0.161 0.000 1.082 367 A CA 0.274 52.281 52.037 -0.050 0.000 0.785 367 A CB 0.081 19.065 19.000 -0.026 0.000 1.020 367 A HN 0.962 9.112 8.150 0.000 0.000 0.489 368 T N -2.453 111.884 114.554 -0.361 0.000 3.191 368 T HA 0.207 4.552 4.350 -0.009 0.000 0.285 368 T C -0.460 173.762 174.700 -0.797 0.000 0.887 368 T CA 0.351 62.015 62.100 -0.727 0.000 0.881 368 T CB 0.057 68.731 68.868 -0.324 0.000 1.217 368 T HN 0.573 8.813 8.240 0.000 0.000 0.591 369 D N 0.776 120.912 120.400 -0.439 0.000 2.620 369 D HA 0.388 5.023 4.640 -0.009 0.000 0.252 369 D C 1.169 177.409 176.300 -0.100 0.000 1.207 369 D CA -0.675 53.181 54.000 -0.240 0.000 0.884 369 D CB 1.960 42.674 40.800 -0.144 0.000 1.262 369 D HN 0.066 8.436 8.370 0.000 0.000 0.552 370 L N 3.485 124.678 121.223 -0.049 0.000 2.143 370 L HA -0.324 4.011 4.340 -0.009 0.000 0.231 370 L C 1.910 178.822 176.870 0.069 0.000 1.106 370 L CA 1.833 56.688 54.840 0.025 0.000 0.827 370 L CB 0.139 42.189 42.059 -0.016 0.000 0.915 370 L HN 0.389 8.619 8.230 0.000 0.000 0.448 371 R N -2.214 118.309 120.500 0.038 0.000 2.194 371 R HA 0.235 4.569 4.340 -0.009 0.000 0.194 371 R C 2.013 178.387 176.300 0.122 0.000 0.985 371 R CA 0.951 57.127 56.100 0.126 0.000 1.104 371 R CB -0.649 29.662 30.300 0.018 0.000 1.092 371 R HN 0.402 8.672 8.270 0.000 0.000 0.555 372 A N 1.014 123.831 122.820 -0.004 0.000 1.933 372 A HA -0.091 4.224 4.320 -0.009 0.000 0.218 372 A C 2.054 179.588 177.584 -0.084 0.000 1.175 372 A CA 1.735 53.714 52.037 -0.096 0.000 0.628 372 A CB -0.422 18.484 19.000 -0.157 0.000 0.814 372 A HN 0.210 8.360 8.150 0.000 0.000 0.444 373 S N -0.118 115.561 115.700 -0.034 0.000 2.507 373 S HA 0.080 4.544 4.470 -0.009 0.000 0.235 373 S C 2.014 176.593 174.600 -0.034 0.000 0.988 373 S CA 0.699 58.885 58.200 -0.023 0.000 0.944 373 S CB -0.314 62.867 63.200 -0.031 0.000 0.762 373 S HN 0.773 9.083 8.310 0.000 0.000 0.526 374 A N 1.868 124.648 122.820 -0.066 0.000 2.076 374 A HA -0.121 4.194 4.320 -0.009 0.000 0.220 374 A C 2.289 179.768 177.584 -0.175 0.000 1.160 374 A CA 1.728 53.635 52.037 -0.216 0.000 0.653 374 A CB -0.786 17.921 19.000 -0.488 0.000 0.801 374 A HN 0.631 8.781 8.150 0.000 0.000 0.455 375 S N -0.060 115.573 115.700 -0.112 0.000 2.423 375 S HA -0.049 4.416 4.470 -0.009 0.000 0.231 375 S C 1.792 176.363 174.600 -0.048 0.000 1.014 375 S CA 1.199 59.347 58.200 -0.087 0.000 0.965 375 S CB -0.665 62.493 63.200 -0.070 0.000 0.785 375 S HN 0.495 8.805 8.310 0.000 0.000 0.495 376 L N 1.056 122.265 121.223 -0.023 0.000 2.093 376 L HA -0.030 4.305 4.340 -0.009 0.000 0.208 376 L C 2.676 179.540 176.870 -0.010 0.000 1.085 376 L CA 0.895 55.736 54.840 0.003 0.000 0.755 376 L CB -0.835 41.239 42.059 0.025 0.000 0.904 376 L HN 0.239 8.469 8.230 0.000 0.000 0.435 377 V N -0.203 119.693 119.914 -0.030 0.000 2.307 377 V HA -0.270 3.844 4.120 -0.009 0.000 0.245 377 V C 2.464 178.501 176.094 -0.095 0.000 1.045 377 V CA 1.398 63.664 62.300 -0.056 0.000 1.024 377 V CB -0.441 31.319 31.823 -0.106 0.000 0.651 377 V HN 0.223 8.413 8.190 0.000 0.000 0.449 378 L N 0.622 121.773 121.223 -0.120 0.000 2.012 378 L HA -0.168 4.166 4.340 -0.009 0.000 0.210 378 L C 2.649 179.476 176.870 -0.071 0.000 1.073 378 L CA 2.334 57.106 54.840 -0.112 0.000 0.748 378 L CB -1.282 40.696 42.059 -0.135 0.000 0.891 378 L HN 0.299 8.529 8.230 0.000 0.000 0.431 379 A N -0.520 122.269 122.820 -0.052 0.000 1.883 379 A HA -0.181 4.134 4.320 -0.009 0.000 0.217 379 A C 2.449 180.015 177.584 -0.029 0.000 1.186 379 A CA 1.875 53.893 52.037 -0.032 0.000 0.624 379 A CB -1.495 17.497 19.000 -0.014 0.000 0.822 379 A HN 0.460 8.610 8.150 0.000 0.000 0.444 380 G N -0.921 107.864 108.800 -0.027 0.000 2.469 380 G HA2 -0.319 3.635 3.960 -0.009 0.000 0.220 380 G HA3 -0.319 3.635 3.960 -0.009 0.000 0.220 380 G C 1.556 176.437 174.900 -0.031 0.000 1.136 380 G CA 1.368 46.455 45.100 -0.021 0.000 0.759 380 G HN 0.551 8.841 8.290 0.000 0.000 0.562 381 C N 0.610 119.883 119.300 -0.046 0.000 2.422 381 C HA 0.057 4.512 4.460 -0.009 0.000 0.279 381 C C 2.604 177.574 174.990 -0.034 0.000 1.305 381 C CA 0.855 59.846 59.018 -0.045 0.000 1.757 381 C CB -0.924 26.782 27.740 -0.056 0.000 1.962 381 C HN 0.669 8.899 8.230 0.000 0.000 0.499 382 I N -1.335 119.215 120.570 -0.032 0.000 4.057 382 I HA 0.394 4.559 4.170 -0.009 0.000 0.334 382 I C 1.051 177.155 176.117 -0.022 0.000 1.308 382 I CA -0.126 61.158 61.300 -0.027 0.000 1.125 382 I CB -0.372 37.610 38.000 -0.030 0.000 1.034 382 I HN 0.058 8.268 8.210 0.000 0.000 0.401 383 A N 1.753 124.560 122.820 -0.021 0.000 2.313 383 A HA 0.306 4.621 4.320 -0.009 0.000 0.261 383 A C -0.062 177.515 177.584 -0.013 0.000 1.090 383 A CA -0.169 51.858 52.037 -0.017 0.000 0.807 383 A CB 0.293 19.285 19.000 -0.014 0.000 1.055 383 A HN 0.418 8.568 8.150 0.000 0.000 0.492 384 E N -0.025 120.169 120.200 -0.011 0.000 2.105 384 E HA 0.478 4.822 4.350 -0.009 0.000 0.285 384 E C 0.696 177.294 176.600 -0.004 0.000 1.055 384 E CA 1.283 57.679 56.400 -0.007 0.000 0.843 384 E CB -0.177 29.519 29.700 -0.006 0.000 1.067 384 E HN 1.514 9.874 8.360 0.000 0.000 0.398 385 G N 3.223 112.022 108.800 -0.003 0.000 2.516 385 G HA2 -0.176 3.778 3.960 -0.009 0.000 0.220 385 G HA3 -0.176 3.778 3.960 -0.009 0.000 0.220 385 G C -0.529 174.372 174.900 0.002 0.000 1.165 385 G CA -0.308 44.792 45.100 0.000 0.000 1.013 385 G HN 0.589 8.879 8.290 0.000 0.000 0.590 386 T N 1.515 116.072 114.554 0.006 0.000 2.770 386 T HA 0.673 5.017 4.350 -0.009 0.000 0.283 386 T C -0.322 174.386 174.700 0.014 0.000 0.988 386 T CA 0.261 62.368 62.100 0.011 0.000 0.957 386 T CB 1.539 70.415 68.868 0.014 0.000 0.930 386 T HN 0.714 8.954 8.240 0.000 0.000 0.443 387 T N 2.860 117.424 114.554 0.018 0.000 2.807 387 T HA 0.527 4.872 4.350 -0.009 0.000 0.279 387 T C -0.334 174.391 174.700 0.042 0.000 0.993 387 T CA -0.526 61.589 62.100 0.025 0.000 0.970 387 T CB 1.270 70.150 68.868 0.019 0.000 0.950 387 T HN 0.308 8.548 8.240 0.000 0.000 0.441 388 V N 4.052 123.993 119.914 0.044 0.000 2.357 388 V HA 0.351 4.465 4.120 -0.009 0.000 0.284 388 V C -0.126 176.005 176.094 0.060 0.000 1.018 388 V CA -0.752 61.582 62.300 0.058 0.000 0.841 388 V CB 1.596 33.444 31.823 0.043 0.000 0.991 388 V HN 0.718 8.908 8.190 0.000 0.000 0.437 389 V N 4.260 124.228 119.914 0.091 0.000 2.334 389 V HA 0.288 4.403 4.120 -0.009 0.000 0.267 389 V C 0.100 176.212 176.094 0.030 0.000 1.040 389 V CA -0.407 61.940 62.300 0.078 0.000 0.866 389 V CB 1.296 33.202 31.823 0.137 0.000 1.019 389 V HN 0.852 9.042 8.190 0.000 0.000 0.468 390 D N 3.904 124.314 120.400 0.016 0.000 2.304 390 D HA 0.307 4.941 4.640 -0.009 0.000 0.247 390 D C 0.818 177.109 176.300 -0.014 0.000 1.089 390 D CA -0.249 53.753 54.000 0.003 0.000 0.910 390 D CB 0.557 41.371 40.800 0.022 0.000 1.199 390 D HN 0.546 8.916 8.370 0.000 0.000 0.426 391 R N 2.077 122.569 120.500 -0.013 0.000 3.407 391 R HA -0.141 4.194 4.340 -0.009 0.000 0.277 391 R C 0.879 177.050 176.300 -0.215 0.000 1.119 391 R CA 0.709 56.801 56.100 -0.014 0.000 0.750 391 R CB -2.062 28.260 30.300 0.037 0.000 1.258 391 R HN 0.643 8.913 8.270 0.000 0.000 0.432 392 I N -1.234 119.221 120.570 -0.190 0.000 3.444 392 I HA -0.093 4.071 4.170 -0.009 0.000 0.287 392 I C 1.707 177.708 176.117 -0.193 0.000 1.302 392 I CA 0.438 61.594 61.300 -0.241 0.000 1.368 392 I CB -0.538 37.163 38.000 -0.499 0.000 1.048 392 I HN 0.366 8.576 8.210 0.000 0.000 0.487 393 Y N 0.477 120.686 120.300 -0.153 0.000 2.315 393 Y HA -0.225 4.319 4.550 -0.009 0.000 0.288 393 Y C 2.402 178.231 175.900 -0.120 0.000 1.154 393 Y CA 1.241 59.248 58.100 -0.155 0.000 1.229 393 Y CB -1.477 36.859 38.460 -0.207 0.000 0.980 393 Y HN 0.172 8.452 8.280 0.000 0.000 0.540 394 H N 0.814 119.552 119.070 -0.553 0.000 2.290 394 H HA -0.141 4.406 4.556 -0.014 0.000 0.298 394 H C 2.338 177.626 175.328 -0.067 0.000 1.087 394 H CA 2.182 58.057 56.048 -0.289 0.000 1.291 394 H CB -0.367 29.178 29.762 -0.362 0.000 1.369 394 H HN 0.461 8.741 8.280 0.000 0.000 0.492 395 I N 0.999 121.623 120.570 0.091 0.000 2.286 395 I HA -0.229 3.936 4.170 -0.009 0.000 0.248 395 I C 1.899 178.144 176.117 0.213 0.000 1.115 395 I CA 1.078 62.489 61.300 0.185 0.000 1.392 395 I CB -0.180 37.925 38.000 0.175 0.000 1.065 395 I HN 0.079 8.289 8.210 0.000 0.000 0.418 396 D N 0.829 121.309 120.400 0.133 0.000 2.218 396 D HA -0.146 4.488 4.640 -0.009 0.000 0.204 396 D C 2.261 178.629 176.300 0.112 0.000 0.976 396 D CA 0.973 55.051 54.000 0.129 0.000 0.853 396 D CB -0.197 40.658 40.800 0.091 0.000 0.939 396 D HN 0.346 8.716 8.370 0.000 0.000 0.481 397 R N -0.220 120.341 120.500 0.101 0.000 2.148 397 R HA 0.015 4.350 4.340 -0.009 0.000 0.227 397 R C 2.112 178.434 176.300 0.038 0.000 1.103 397 R CA 1.184 57.328 56.100 0.072 0.000 0.983 397 R CB -0.054 30.292 30.300 0.076 0.000 0.874 397 R HN 0.151 8.421 8.270 0.000 0.000 0.451 398 G N -1.302 107.523 108.800 0.042 0.000 2.743 398 G HA2 0.053 4.008 3.960 -0.009 0.000 0.206 398 G HA3 0.053 4.008 3.960 -0.009 0.000 0.206 398 G C -0.145 174.550 174.900 -0.342 0.000 1.115 398 G CA -0.095 44.922 45.100 -0.138 0.000 0.782 398 G HN 0.087 8.377 8.290 0.000 0.000 0.524 399 Y N -0.079 120.255 120.300 0.056 0.000 2.425 399 Y HA 0.451 5.041 4.550 0.068 0.000 0.344 399 Y C -0.210 175.743 175.900 0.089 0.000 0.969 399 Y CA -1.165 56.977 58.100 0.070 0.000 1.052 399 Y CB 2.010 40.506 38.460 0.061 0.000 1.215 399 Y HN -0.042 8.238 8.280 0.000 0.000 0.451 400 E N 4.222 124.556 120.200 0.223 0.000 2.070 400 E HA 0.205 4.550 4.350 -0.009 0.000 0.282 400 E C -0.495 176.216 176.600 0.184 0.000 1.104 400 E CA -0.289 56.209 56.400 0.165 0.000 0.876 400 E CB 0.132 29.901 29.700 0.115 0.000 1.055 400 E HN 0.652 9.012 8.360 0.000 0.000 0.401 401 R N 3.629 124.233 120.500 0.173 0.000 3.127 401 R HA -0.219 4.116 4.340 -0.009 0.000 0.247 401 R C 0.964 177.359 176.300 0.160 0.000 0.896 401 R CA 0.388 56.582 56.100 0.156 0.000 0.624 401 R CB -1.802 28.563 30.300 0.108 0.000 1.154 401 R HN 0.762 9.032 8.270 0.000 0.000 0.474 402 I N 1.291 121.970 120.570 0.182 0.000 2.493 402 I HA -0.243 3.921 4.170 -0.009 0.000 0.254 402 I C 2.547 178.672 176.117 0.013 0.000 1.160 402 I CA 1.760 63.137 61.300 0.129 0.000 1.445 402 I CB -0.007 37.997 38.000 0.006 0.000 1.086 402 I HN 0.473 8.683 8.210 0.000 0.000 0.433 403 E N 0.356 120.517 120.200 -0.065 0.000 2.152 403 E HA -0.247 4.098 4.350 -0.009 0.000 0.192 403 E C 1.157 177.719 176.600 -0.064 0.000 0.983 403 E CA 1.258 57.545 56.400 -0.190 0.000 0.818 403 E CB -0.438 29.108 29.700 -0.255 0.000 0.758 403 E HN 0.481 8.841 8.360 0.000 0.000 0.467 404 D N 1.834 122.235 120.400 0.002 0.000 2.097 404 D HA -0.086 4.549 4.640 -0.009 0.000 0.197 404 D C 1.911 178.201 176.300 -0.016 0.000 0.984 404 D CA 1.254 55.255 54.000 0.001 0.000 0.826 404 D CB -0.115 40.697 40.800 0.020 0.000 0.973 404 D HN 0.291 8.661 8.370 0.000 0.000 0.460 405 K N 0.331 120.731 120.400 0.001 0.000 2.097 405 K HA -0.012 4.303 4.320 -0.009 0.000 0.205 405 K C 2.350 178.925 176.600 -0.042 0.000 1.050 405 K CA 0.492 56.738 56.287 -0.069 0.000 0.938 405 K CB -0.083 32.340 32.500 -0.129 0.000 0.718 405 K HN 0.135 8.385 8.250 0.000 0.000 0.442 406 L N 0.520 121.775 121.223 0.053 0.000 2.056 406 L HA -0.141 4.194 4.340 -0.009 0.000 0.207 406 L C 2.727 179.584 176.870 -0.023 0.000 1.078 406 L CA 1.062 55.929 54.840 0.045 0.000 0.749 406 L CB -0.295 41.760 42.059 -0.008 0.000 0.901 406 L HN 0.153 8.383 8.230 0.000 0.000 0.433 407 R N 0.327 120.801 120.500 -0.043 0.000 2.096 407 R HA -0.139 4.196 4.340 -0.009 0.000 0.235 407 R C 2.158 178.434 176.300 -0.039 0.000 1.127 407 R CA 1.339 57.413 56.100 -0.043 0.000 0.968 407 R CB -0.230 30.045 30.300 -0.041 0.000 0.861 407 R HN 0.328 8.598 8.270 0.000 0.000 0.440 408 A N -0.010 122.782 122.820 -0.047 0.000 2.216 408 A HA -0.011 4.304 4.320 -0.009 0.000 0.214 408 A C 1.617 179.166 177.584 -0.058 0.000 1.160 408 A CA 0.768 52.772 52.037 -0.054 0.000 0.725 408 A CB -0.152 18.806 19.000 -0.069 0.000 0.784 408 A HN 0.349 8.499 8.150 0.000 0.000 0.472 409 L N -2.271 118.922 121.223 -0.050 0.000 2.693 409 L HA 0.313 4.648 4.340 -0.009 0.000 0.235 409 L C 1.482 178.335 176.870 -0.028 0.000 1.127 409 L CA 0.591 55.406 54.840 -0.040 0.000 0.914 409 L CB 0.429 42.473 42.059 -0.025 0.000 1.193 409 L HN 0.504 8.734 8.230 0.000 0.000 0.502 410 G N -0.047 108.736 108.800 -0.029 0.000 2.192 410 G HA2 -0.175 3.780 3.960 -0.009 0.000 0.193 410 G HA3 -0.175 3.780 3.960 -0.009 0.000 0.193 410 G C 0.357 175.241 174.900 -0.027 0.000 0.999 410 G CA -0.190 44.895 45.100 -0.026 0.000 0.659 410 G HN 0.356 8.646 8.290 0.000 0.000 0.503 411 A N 0.234 123.034 122.820 -0.032 0.000 2.462 411 A HA 0.552 4.866 4.320 -0.009 0.000 0.243 411 A C 0.513 178.071 177.584 -0.044 0.000 1.076 411 A CA 0.293 52.304 52.037 -0.042 0.000 0.773 411 A CB 0.321 19.285 19.000 -0.059 0.000 1.010 411 A HN 0.518 8.668 8.150 0.000 0.000 0.493 412 N N 2.160 120.836 118.700 -0.040 0.000 2.645 412 N HA 0.354 5.089 4.740 -0.009 0.000 0.233 412 N C -1.241 174.243 175.510 -0.043 0.000 1.058 412 N CA 0.037 53.068 53.050 -0.033 0.000 0.942 412 N CB 0.169 38.644 38.487 -0.020 0.000 1.210 412 N HN 0.648 9.028 8.380 0.000 0.000 0.512 413 I N 1.039 121.576 120.570 -0.055 0.000 2.686 413 I HA 0.405 4.570 4.170 -0.009 0.000 0.295 413 I C -1.233 174.865 176.117 -0.032 0.000 1.114 413 I CA -0.630 60.621 61.300 -0.082 0.000 1.038 413 I CB 2.113 39.990 38.000 -0.205 0.000 1.238 413 I HN 0.340 8.550 8.210 0.000 0.000 0.420 414 E N 6.671 126.893 120.200 0.037 0.000 2.308 414 E HA 0.337 4.681 4.350 -0.009 0.000 0.275 414 E C -1.484 175.261 176.600 0.241 0.000 0.890 414 E CA -0.925 55.536 56.400 0.102 0.000 0.754 414 E CB 2.251 31.994 29.700 0.071 0.000 1.207 414 E HN 0.592 8.952 8.360 0.000 0.000 0.426 415 R N 3.746 124.396 120.500 0.251 0.000 2.198 415 R HA 0.337 4.671 4.340 -0.009 0.000 0.339 415 R C -0.486 175.879 176.300 0.108 0.000 1.020 415 R CA -0.377 55.876 56.100 0.256 0.000 0.864 415 R CB 0.735 31.194 30.300 0.264 0.000 1.105 415 R HN 0.330 8.600 8.270 0.000 0.000 0.463 416 V N 1.961 121.915 119.914 0.067 0.000 2.994 416 V HA 0.550 4.664 4.120 -0.009 0.000 0.318 416 V C -0.412 175.685 176.094 0.006 0.000 1.085 416 V CA -0.808 61.513 62.300 0.035 0.000 0.998 416 V CB 2.152 33.998 31.823 0.038 0.000 1.063 416 V HN 0.699 8.889 8.190 0.000 0.000 0.447 417 K N 2.860 123.264 120.400 0.006 0.000 2.832 417 K HA 0.364 4.679 4.320 -0.009 0.000 0.211 417 K C 0.655 177.254 176.600 -0.002 0.000 1.112 417 K CA 0.296 56.581 56.287 -0.004 0.000 1.108 417 K CB 0.408 32.907 32.500 -0.001 0.000 0.899 417 K HN 0.999 9.249 8.250 0.000 0.000 0.464 418 G N 0.000 108.800 108.800 0.001 0.000 5.446 418 G HA2 0.000 3.955 3.960 -0.009 0.000 0.244 418 G HA3 0.000 3.955 3.960 -0.009 0.000 0.244 418 G CA 0.000 45.102 45.100 0.003 0.000 0.502 418 G HN 0.000 8.290 8.290 0.000 0.000 0.925