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 2dwc_1_A DATA FIRST_RESID 2 DATA SEQUENCE VVMIKLRDEL GTATTDSAQK ILLLGSGELG KEIAIEAQRL GVEVVAVDRY DATA SEQUENCE ANAPAMQVAH RSYVGNMMDK DFLWSVVERE KPDAIIPEIE AINLDALFEF DATA SEQUENCE EKDGYFVVPN ARATWIAMHR ERLRETLVKE AKVPTSRYMY ATTLDELYEA DATA SEQUENCE CEKIGYPCHT KAIMXXXXXX SYFVKGPEDI PKAWEEXXXX XXXXXEKIIV DATA SEQUENCE EEHIDFDVEV TELAVRHFDE NGEIVTTFPK PVGHYQIDGD YHASWQPAEI DATA SEQUENCE SEKAEREVYR IAKRITDVLG GLGIFGVEMF VKGDKVWANE VSPRPHDTGM DATA SEQUENCE VTLASHPPGF SEFALHLRAV LGLPIPGEWV DGYRLFPMLI PAATHVIKAK DATA SEQUENCE VSGYSPRFRG LVKALSVPNA TVRLFGKPEA YVGRRLGIAL AWDKDVEVAK DATA SEQUENCE RKAEMVAHMI ELRTRSSDWH D VARS RESID RESNAME ATOMNAME SS_SHIFT SHIFT RC_SHIFT HM_SHIFT EF_SHIFT SIGMA FORMAT %4d %4s %4s %9.3f %9.3f %9.3f %9.3f %9.3f %9.3f 2 V HA 0.000 4.120 4.120 -0.000 0.000 0.244 2 V C 0.000 176.132 176.094 0.063 0.000 1.182 2 V CA 0.000 62.337 62.300 0.061 0.000 1.235 2 V CB 0.000 31.853 31.823 0.049 0.000 1.184 3 V N 2.026 121.970 119.914 0.050 0.000 2.521 3 V HA 0.170 4.290 4.120 0.001 0.000 0.286 3 V C 1.514 177.577 176.094 -0.052 0.000 1.034 3 V CA 0.586 62.881 62.300 -0.009 0.000 1.045 3 V CB 0.931 32.735 31.823 -0.031 0.000 0.974 3 V HN 0.913 9.103 8.190 -0.000 0.000 0.480 4 M N 4.775 124.302 119.600 -0.122 0.000 2.394 4 M HA 0.071 4.551 4.480 0.001 0.000 0.264 4 M C 0.672 176.882 176.300 -0.149 0.000 1.073 4 M CA 1.370 56.611 55.300 -0.098 0.000 1.111 4 M CB -0.019 32.564 32.600 -0.028 0.000 1.401 4 M HN 0.710 9.000 8.290 -0.000 0.000 0.448 5 I N -2.821 117.588 120.570 -0.267 0.000 3.076 5 I HA 0.462 4.632 4.170 0.001 0.000 0.313 5 I C -0.367 175.753 176.117 0.004 0.000 1.053 5 I CA -1.046 60.164 61.300 -0.150 0.000 1.048 5 I CB 1.280 39.145 38.000 -0.226 0.000 1.264 5 I HN -0.166 8.044 8.210 -0.000 0.000 0.498 6 K N 1.249 121.611 120.400 -0.063 0.000 2.352 6 K HA 0.487 4.807 4.320 0.001 0.000 0.240 6 K C -1.136 175.225 176.600 -0.399 0.000 1.017 6 K CA -1.074 55.026 56.287 -0.310 0.000 0.851 6 K CB 2.084 34.432 32.500 -0.254 0.000 1.261 6 K HN 0.541 8.791 8.250 -0.000 0.000 0.451 7 L N 1.987 122.694 121.223 -0.860 0.000 2.540 7 L HA 0.033 4.374 4.340 0.001 0.000 0.276 7 L C 0.003 176.784 176.870 -0.148 0.000 1.212 7 L CA 0.803 55.349 54.840 -0.489 0.000 0.893 7 L CB 0.133 41.913 42.059 -0.466 0.000 1.138 7 L HN 0.478 8.708 8.230 -0.000 0.000 0.491 8 R N 3.317 123.819 120.500 0.002 0.000 2.346 8 R HA 0.221 4.561 4.340 0.001 0.000 0.311 8 R C -0.216 176.091 176.300 0.013 0.000 0.983 8 R CA -0.385 55.722 56.100 0.011 0.000 0.880 8 R CB 0.914 31.244 30.300 0.049 0.000 1.100 8 R HN 0.845 9.115 8.270 -0.000 0.000 0.453 9 D N 1.504 121.902 120.400 -0.003 0.000 2.433 9 D HA 0.066 4.707 4.640 0.001 0.000 0.211 9 D C -0.746 175.556 176.300 0.003 0.000 1.114 9 D CA 0.183 54.184 54.000 0.002 0.000 0.837 9 D CB 0.646 41.441 40.800 -0.009 0.000 0.984 9 D HN 0.456 8.826 8.370 -0.000 0.000 0.505 10 E N 0.385 120.586 120.200 0.002 0.000 2.356 10 E HA 0.382 4.733 4.350 0.001 0.000 0.275 10 E C -1.665 174.936 176.600 0.002 0.000 0.904 10 E CA -0.654 55.746 56.400 0.000 0.000 0.757 10 E CB 1.453 31.150 29.700 -0.005 0.000 1.232 10 E HN 0.071 8.431 8.360 -0.000 0.000 0.442 11 L N 2.018 123.241 121.223 -0.000 0.000 2.422 11 L HA 0.626 4.966 4.340 0.001 0.000 0.264 11 L C 0.629 177.495 176.870 -0.006 0.000 0.984 11 L CA -0.802 54.037 54.840 -0.002 0.000 0.819 11 L CB 2.206 44.264 42.059 -0.002 0.000 1.330 11 L HN 0.729 8.959 8.230 -0.000 0.000 0.410 12 G N 0.575 109.370 108.800 -0.009 0.000 2.641 12 G HA2 0.579 4.539 3.960 0.001 0.000 0.239 12 G HA3 0.579 4.539 3.960 0.001 0.000 0.239 12 G C -0.815 174.076 174.900 -0.016 0.000 1.402 12 G CA -0.233 44.859 45.100 -0.013 0.000 1.046 12 G HN 0.421 8.711 8.290 -0.000 0.000 0.565 13 T N 0.480 115.021 114.554 -0.023 0.000 2.812 13 T HA 0.602 4.952 4.350 0.001 0.000 0.282 13 T C 0.407 175.076 174.700 -0.052 0.000 0.990 13 T CA 0.071 62.156 62.100 -0.025 0.000 0.960 13 T CB 1.308 70.166 68.868 -0.016 0.000 0.948 13 T HN 0.857 9.097 8.240 -0.000 0.000 0.438 14 A N 2.740 125.517 122.820 -0.072 0.000 2.555 14 A HA 0.448 4.768 4.320 0.001 0.000 0.233 14 A C 1.496 178.985 177.584 -0.159 0.000 1.060 14 A CA 0.921 52.849 52.037 -0.182 0.000 0.759 14 A CB -0.647 18.199 19.000 -0.256 0.000 0.995 14 A HN 2.011 10.161 8.150 -0.000 0.000 0.506 15 T N -1.955 112.471 114.554 -0.213 0.000 7.013 15 T HA -0.251 4.099 4.350 0.001 0.000 0.288 15 T C 0.493 175.154 174.700 -0.066 0.000 2.146 15 T CA 2.517 64.543 62.100 -0.123 0.000 3.498 15 T CB -2.821 66.014 68.868 -0.055 0.000 1.517 15 T HN 2.679 10.919 8.240 -0.000 0.000 1.113 16 T N -0.959 113.559 114.554 -0.061 0.000 2.938 16 T HA 0.603 4.954 4.350 0.001 0.000 0.285 16 T C 0.903 175.581 174.700 -0.036 0.000 1.028 16 T CA -0.010 62.068 62.100 -0.037 0.000 1.005 16 T CB 1.901 70.753 68.868 -0.027 0.000 1.157 16 T HN 0.335 8.575 8.240 -0.000 0.000 0.550 17 D N -0.069 120.317 120.400 -0.024 0.000 2.371 17 D HA -0.090 4.550 4.640 0.001 0.000 0.221 17 D C 1.535 177.824 176.300 -0.019 0.000 0.986 17 D CA 0.870 54.859 54.000 -0.019 0.000 0.899 17 D CB -0.185 40.608 40.800 -0.012 0.000 0.902 17 D HN 0.539 8.909 8.370 -0.000 0.000 0.530 18 S N -0.463 115.224 115.700 -0.021 0.000 2.575 18 S HA 0.389 4.860 4.470 0.001 0.000 0.215 18 S C 1.101 175.687 174.600 -0.023 0.000 0.966 18 S CA -0.278 57.911 58.200 -0.018 0.000 0.911 18 S CB -0.028 63.163 63.200 -0.015 0.000 0.780 18 S HN 0.425 8.735 8.310 -0.000 0.000 0.514 19 A N 1.356 124.155 122.820 -0.035 0.000 2.531 19 A HA 0.441 4.761 4.320 0.001 0.000 0.236 19 A C 0.263 177.828 177.584 -0.033 0.000 1.062 19 A CA -0.050 51.959 52.037 -0.047 0.000 0.760 19 A CB 0.051 19.002 19.000 -0.082 0.000 0.995 19 A HN 0.474 8.624 8.150 -0.000 0.000 0.501 20 Q N 0.326 120.109 119.800 -0.028 0.000 2.221 20 Q HA 0.601 4.941 4.340 0.001 0.000 0.242 20 Q C -0.164 175.821 176.000 -0.025 0.000 0.940 20 Q CA 0.105 55.900 55.803 -0.014 0.000 0.896 20 Q CB 1.218 29.955 28.738 -0.003 0.000 1.226 20 Q HN 0.673 8.943 8.270 -0.000 0.000 0.463 21 K N 1.640 122.032 120.400 -0.014 0.000 2.501 21 K HA 0.512 4.833 4.320 0.001 0.000 0.252 21 K C -1.377 175.212 176.600 -0.018 0.000 0.934 21 K CA -0.566 55.707 56.287 -0.023 0.000 0.797 21 K CB 1.028 33.510 32.500 -0.030 0.000 1.270 21 K HN 0.758 9.008 8.250 -0.000 0.000 0.431 22 I N 1.071 121.628 120.570 -0.021 0.000 2.648 22 I HA 0.564 4.734 4.170 0.001 0.000 0.304 22 I C -1.302 174.781 176.117 -0.057 0.000 1.009 22 I CA -1.299 59.977 61.300 -0.040 0.000 1.114 22 I CB 1.691 39.668 38.000 -0.039 0.000 1.293 22 I HN 0.460 8.670 8.210 -0.000 0.000 0.449 23 L N 6.128 127.291 121.223 -0.099 0.000 2.342 23 L HA 0.534 4.874 4.340 0.001 0.000 0.276 23 L C -1.119 175.679 176.870 -0.119 0.000 0.997 23 L CA -0.304 54.461 54.840 -0.125 0.000 0.838 23 L CB 1.310 43.238 42.059 -0.218 0.000 1.224 23 L HN 0.601 8.831 8.230 -0.000 0.000 0.416 24 L N 6.244 127.418 121.223 -0.082 0.000 2.265 24 L HA 0.379 4.719 4.340 0.001 0.000 0.288 24 L C -0.466 176.360 176.870 -0.073 0.000 1.058 24 L CA -0.308 54.489 54.840 -0.072 0.000 0.809 24 L CB 0.841 42.867 42.059 -0.056 0.000 1.179 24 L HN 0.512 8.742 8.230 -0.000 0.000 0.429 25 L N 4.570 125.748 121.223 -0.075 0.000 2.287 25 L HA 0.620 4.961 4.340 0.001 0.000 0.280 25 L C 0.396 177.248 176.870 -0.029 0.000 1.055 25 L CA -0.415 54.393 54.840 -0.053 0.000 0.863 25 L CB 0.767 42.790 42.059 -0.061 0.000 1.245 25 L HN 0.878 9.108 8.230 -0.000 0.000 0.432 26 G N 1.419 110.209 108.800 -0.018 0.000 3.400 26 G HA2 -0.120 3.841 3.960 0.001 0.000 0.679 26 G HA3 -0.120 3.841 3.960 0.001 0.000 0.679 26 G C -0.236 174.636 174.900 -0.047 0.000 1.239 26 G CA -0.800 44.291 45.100 -0.014 0.000 1.049 26 G HN 0.407 8.697 8.290 -0.000 0.000 0.539 27 S N 1.195 116.856 115.700 -0.065 0.000 2.624 27 S HA 0.531 5.001 4.470 0.001 0.000 0.246 27 S C 1.368 175.905 174.600 -0.105 0.000 1.072 27 S CA 0.263 58.400 58.200 -0.105 0.000 1.045 27 S CB 0.550 63.658 63.200 -0.153 0.000 0.851 27 S HN 1.349 9.659 8.310 -0.000 0.000 0.480 28 G N 2.058 110.810 108.800 -0.081 0.000 2.525 28 G HA2 0.166 4.126 3.960 0.001 0.000 0.276 28 G HA3 0.166 4.126 3.960 0.001 0.000 0.276 28 G C 0.991 175.744 174.900 -0.245 0.000 1.388 28 G CA -0.308 44.731 45.100 -0.102 0.000 1.050 28 G HN 0.394 8.684 8.290 -0.000 0.000 0.520 29 E N -0.522 119.426 120.200 -0.420 0.000 2.204 29 E HA -0.137 4.213 4.350 0.001 0.000 0.195 29 E C 2.307 178.533 176.600 -0.625 0.000 0.990 29 E CA 0.843 56.811 56.400 -0.719 0.000 0.821 29 E CB -0.301 28.391 29.700 -1.679 0.000 0.750 29 E HN 0.489 8.849 8.360 -0.000 0.000 0.477 30 L N 0.657 121.609 121.223 -0.451 0.000 2.072 30 L HA 0.032 4.373 4.340 0.001 0.000 0.205 30 L C 2.761 179.396 176.870 -0.393 0.000 1.079 30 L CA 1.162 55.749 54.840 -0.421 0.000 0.752 30 L CB -0.853 41.169 42.059 -0.061 0.000 0.906 30 L HN 0.239 8.469 8.230 -0.000 0.000 0.436 31 G N 0.129 108.785 108.800 -0.241 0.000 2.432 31 G HA2 -0.282 3.679 3.960 0.001 0.000 0.219 31 G HA3 -0.282 3.679 3.960 0.001 0.000 0.219 31 G C 1.697 176.467 174.900 -0.216 0.000 1.135 31 G CA 0.673 45.671 45.100 -0.171 0.000 0.767 31 G HN 0.266 8.556 8.290 -0.000 0.000 0.550 32 K N 0.169 120.401 120.400 -0.280 0.000 2.057 32 K HA -0.098 4.222 4.320 0.001 0.000 0.207 32 K C 2.311 178.739 176.600 -0.287 0.000 1.049 32 K CA 1.285 57.423 56.287 -0.249 0.000 0.931 32 K CB -0.051 32.300 32.500 -0.248 0.000 0.714 32 K HN 0.162 8.412 8.250 -0.000 0.000 0.440 33 E N 0.600 120.505 120.200 -0.491 0.000 2.152 33 E HA -0.118 4.232 4.350 0.001 0.000 0.192 33 E C 2.053 178.500 176.600 -0.255 0.000 0.983 33 E CA 0.765 56.861 56.400 -0.508 0.000 0.818 33 E CB -0.023 29.020 29.700 -1.095 0.000 0.758 33 E HN 0.428 8.788 8.360 -0.000 0.000 0.467 34 I N 1.049 121.499 120.570 -0.201 0.000 2.226 34 I HA -0.251 3.919 4.170 0.001 0.000 0.245 34 I C 2.478 178.569 176.117 -0.044 0.000 1.100 34 I CA 1.045 62.340 61.300 -0.007 0.000 1.374 34 I CB -0.314 37.712 38.000 0.043 0.000 1.057 34 I HN -0.006 8.204 8.210 -0.000 0.000 0.413 35 A N 0.938 123.707 122.820 -0.086 0.000 1.933 35 A HA -0.155 4.165 4.320 0.001 0.000 0.218 35 A C 2.283 179.825 177.584 -0.070 0.000 1.175 35 A CA 1.368 53.363 52.037 -0.070 0.000 0.628 35 A CB -0.732 18.214 19.000 -0.089 0.000 0.814 35 A HN 0.375 8.525 8.150 -0.000 0.000 0.444 36 I N -0.764 119.752 120.570 -0.089 0.000 2.226 36 I HA -0.227 3.944 4.170 0.001 0.000 0.245 36 I C 2.557 178.644 176.117 -0.050 0.000 1.100 36 I CA 1.757 63.013 61.300 -0.074 0.000 1.374 36 I CB -0.222 37.728 38.000 -0.082 0.000 1.057 36 I HN 0.369 8.579 8.210 -0.000 0.000 0.413 37 E N 1.388 121.564 120.200 -0.039 0.000 2.106 37 E HA -0.184 4.166 4.350 0.001 0.000 0.192 37 E C 2.091 178.672 176.600 -0.031 0.000 0.984 37 E CA 1.587 57.966 56.400 -0.035 0.000 0.806 37 E CB -0.160 29.527 29.700 -0.022 0.000 0.750 37 E HN 0.409 8.769 8.360 -0.000 0.000 0.458 38 A N 0.650 123.458 122.820 -0.020 0.000 1.883 38 A HA -0.233 4.087 4.320 0.001 0.000 0.217 38 A C 2.154 179.748 177.584 0.016 0.000 1.186 38 A CA 1.715 53.751 52.037 -0.002 0.000 0.624 38 A CB -0.636 18.371 19.000 0.011 0.000 0.822 38 A HN 0.276 8.426 8.150 -0.000 0.000 0.444 39 Q N -0.518 119.286 119.800 0.006 0.000 2.135 39 Q HA -0.165 4.175 4.340 0.001 0.000 0.204 39 Q C 2.096 178.098 176.000 0.003 0.000 0.981 39 Q CA 1.491 57.301 55.803 0.012 0.000 0.856 39 Q CB -0.283 28.423 28.738 -0.053 0.000 0.902 39 Q HN 0.671 8.941 8.270 -0.000 0.000 0.425 40 R N -0.031 120.458 120.500 -0.017 0.000 2.280 40 R HA 0.037 4.377 4.340 0.001 0.000 0.207 40 R C 1.615 177.902 176.300 -0.021 0.000 1.043 40 R CA 0.432 56.518 56.100 -0.023 0.000 1.006 40 R CB 0.124 30.401 30.300 -0.038 0.000 0.885 40 R HN 0.174 8.444 8.270 -0.000 0.000 0.467 41 L N -0.901 120.313 121.223 -0.015 0.000 2.728 41 L HA 0.280 4.621 4.340 0.001 0.000 0.238 41 L C 0.785 177.656 176.870 0.001 0.000 1.143 41 L CA -0.025 54.806 54.840 -0.015 0.000 0.937 41 L CB 0.864 42.907 42.059 -0.026 0.000 1.225 41 L HN 0.316 8.546 8.230 -0.000 0.000 0.507 42 G N 0.925 109.737 108.800 0.019 0.000 2.176 42 G HA2 -0.240 3.720 3.960 0.001 0.000 0.252 42 G HA3 -0.240 3.720 3.960 0.001 0.000 0.252 42 G C 0.057 174.971 174.900 0.024 0.000 1.024 42 G CA 0.167 45.286 45.100 0.031 0.000 0.755 42 G HN 0.134 8.424 8.290 -0.000 0.000 0.507 43 V N 0.099 120.035 119.914 0.037 0.000 2.481 43 V HA 0.464 4.585 4.120 0.001 0.000 0.286 43 V C 0.756 176.879 176.094 0.048 0.000 1.042 43 V CA -0.587 61.724 62.300 0.018 0.000 0.928 43 V CB 1.839 33.669 31.823 0.012 0.000 0.986 43 V HN 0.467 8.657 8.190 -0.000 0.000 0.462 44 E N 2.898 123.063 120.200 -0.058 0.000 2.338 44 E HA 0.455 4.805 4.350 0.001 0.000 0.272 44 E C -1.348 175.283 176.600 0.051 0.000 1.029 44 E CA -0.310 55.984 56.400 -0.176 0.000 0.872 44 E CB 1.361 30.897 29.700 -0.272 0.000 1.015 44 E HN 0.474 8.834 8.360 -0.000 0.000 0.417 45 V N 5.003 125.084 119.914 0.279 0.000 2.483 45 V HA 0.301 4.422 4.120 0.001 0.000 0.297 45 V C -0.646 175.525 176.094 0.128 0.000 1.027 45 V CA -0.847 61.550 62.300 0.161 0.000 0.855 45 V CB 1.775 33.673 31.823 0.124 0.000 0.995 45 V HN 0.472 8.662 8.190 -0.000 0.000 0.424 46 V N 3.986 123.936 119.914 0.059 0.000 2.409 46 V HA 0.818 4.938 4.120 0.001 0.000 0.291 46 V C 0.302 176.419 176.094 0.039 0.000 1.020 46 V CA -0.449 61.894 62.300 0.072 0.000 0.848 46 V CB 1.720 33.596 31.823 0.088 0.000 0.990 46 V HN 0.986 9.176 8.190 -0.000 0.000 0.430 47 A N 5.063 127.909 122.820 0.044 0.000 2.318 47 A HA 0.893 5.213 4.320 0.001 0.000 0.324 47 A C -0.798 176.814 177.584 0.047 0.000 1.170 47 A CA -0.513 51.528 52.037 0.008 0.000 0.810 47 A CB 1.464 20.444 19.000 -0.035 0.000 1.198 47 A HN 0.660 8.810 8.150 -0.000 0.000 0.484 48 V N 2.529 122.459 119.914 0.027 0.000 2.680 48 V HA 0.692 4.813 4.120 0.001 0.000 0.309 48 V C -0.511 175.608 176.094 0.043 0.000 1.052 48 V CA -0.488 61.863 62.300 0.085 0.000 0.908 48 V CB 1.859 33.707 31.823 0.043 0.000 1.001 48 V HN 1.037 9.227 8.190 -0.000 0.000 0.431 49 D N 1.198 121.635 120.400 0.061 0.000 2.713 49 D HA 0.267 4.907 4.640 0.001 0.000 0.306 49 D C 0.375 176.703 176.300 0.047 0.000 1.299 49 D CA -0.576 53.430 54.000 0.010 0.000 0.823 49 D CB 1.869 42.565 40.800 -0.172 0.000 1.353 49 D HN 0.536 8.906 8.370 -0.000 0.000 0.447 50 R N -0.019 120.540 120.500 0.098 0.000 2.310 50 R HA 0.119 4.459 4.340 0.001 0.000 0.202 50 R C 0.127 176.538 176.300 0.185 0.000 0.933 50 R CA 0.357 56.526 56.100 0.116 0.000 1.054 50 R CB -0.313 30.070 30.300 0.139 0.000 0.985 50 R HN 0.363 8.633 8.270 -0.000 0.000 0.489 51 Y N -2.575 117.743 120.300 0.031 0.000 2.581 51 Y HA 0.808 5.359 4.550 0.001 0.000 0.345 51 Y C -0.760 175.164 175.900 0.039 0.000 1.036 51 Y CA -1.758 56.363 58.100 0.034 0.000 1.042 51 Y CB 1.066 39.553 38.460 0.045 0.000 1.289 51 Y HN -0.048 8.232 8.280 -0.000 0.000 0.471 52 A N 1.839 124.712 122.820 0.088 0.000 2.286 52 A HA 0.451 4.771 4.320 0.001 0.000 0.286 52 A C 0.227 177.808 177.584 -0.004 0.000 1.097 52 A CA -0.372 51.659 52.037 -0.010 0.000 0.821 52 A CB -0.277 18.755 19.000 0.053 0.000 1.076 52 A HN 1.014 9.164 8.150 -0.000 0.000 0.490 53 N N -1.598 117.072 118.700 -0.051 0.000 2.725 53 N HA -0.174 4.566 4.740 0.001 0.000 0.249 53 N C 0.263 175.748 175.510 -0.042 0.000 1.103 53 N CA 1.038 54.077 53.050 -0.018 0.000 0.707 53 N CB -1.801 36.722 38.487 0.060 0.000 1.043 53 N HN 1.190 9.570 8.380 -0.000 0.000 0.553 54 A N 0.312 122.965 122.820 -0.278 0.000 2.448 54 A HA 0.307 4.628 4.320 0.001 0.000 0.239 54 A C -0.592 176.932 177.584 -0.101 0.000 1.080 54 A CA -0.489 51.353 52.037 -0.324 0.000 0.779 54 A CB 0.115 18.687 19.000 -0.714 0.000 1.026 54 A HN -0.001 8.149 8.150 -0.000 0.000 0.499 55 P HA -0.269 4.151 4.420 -0.000 0.000 0.217 55 P C 1.601 178.851 177.300 -0.083 0.000 1.162 55 P CA 2.901 65.980 63.100 -0.034 0.000 0.901 55 P CB 0.085 31.754 31.700 -0.051 0.000 0.793 56 A N -1.709 121.041 122.820 -0.116 0.000 2.014 56 A HA -0.135 4.185 4.320 0.001 0.000 0.218 56 A C 2.132 179.657 177.584 -0.099 0.000 1.163 56 A CA 1.477 53.444 52.037 -0.117 0.000 0.652 56 A CB -1.335 17.593 19.000 -0.121 0.000 0.808 56 A HN 0.124 8.274 8.150 -0.000 0.000 0.449 57 M N -0.806 118.731 119.600 -0.104 0.000 2.213 57 M HA -0.224 4.256 4.480 0.001 0.000 0.263 57 M C 2.284 178.539 176.300 -0.075 0.000 1.062 57 M CA 1.475 56.722 55.300 -0.088 0.000 1.105 57 M CB -0.392 32.144 32.600 -0.107 0.000 1.385 57 M HN 0.487 8.777 8.290 -0.000 0.000 0.417 58 Q N -0.597 119.162 119.800 -0.068 0.000 2.170 58 Q HA -0.125 4.215 4.340 0.001 0.000 0.203 58 Q C 2.018 177.974 176.000 -0.073 0.000 0.976 58 Q CA 1.205 56.975 55.803 -0.055 0.000 0.858 58 Q CB -0.014 28.704 28.738 -0.033 0.000 0.907 58 Q HN 0.386 8.656 8.270 -0.000 0.000 0.433 59 V N 0.344 120.204 119.914 -0.090 0.000 3.174 59 V HA 0.076 4.197 4.120 0.001 0.000 0.254 59 V C 0.932 176.927 176.094 -0.164 0.000 1.120 59 V CA 0.444 62.674 62.300 -0.116 0.000 1.114 59 V CB -0.143 31.615 31.823 -0.109 0.000 0.756 59 V HN 0.236 8.426 8.190 -0.000 0.000 0.467 60 A N -0.654 122.087 122.820 -0.130 0.000 2.386 60 A HA 0.178 4.498 4.320 0.001 0.000 0.246 60 A C 1.035 178.524 177.584 -0.158 0.000 1.089 60 A CA 0.212 52.175 52.037 -0.123 0.000 0.790 60 A CB -0.111 18.863 19.000 -0.042 0.000 1.042 60 A HN 0.555 8.705 8.150 -0.000 0.000 0.497 61 H N -0.147 118.905 119.070 -0.031 0.000 2.395 61 H HA 0.098 4.654 4.556 0.000 0.000 0.299 61 H C 0.743 176.049 175.328 -0.037 0.000 1.070 61 H CA 1.663 57.694 56.048 -0.029 0.000 1.356 61 H CB 0.119 29.868 29.762 -0.022 0.000 1.401 61 H HN 0.549 8.829 8.280 -0.000 0.000 0.524 62 R N -0.558 119.992 120.500 0.083 0.000 2.739 62 R HA 0.442 4.782 4.340 0.001 0.000 0.271 62 R C -1.108 175.182 176.300 -0.018 0.000 1.010 62 R CA -0.525 55.573 56.100 -0.003 0.000 0.897 62 R CB 2.455 32.743 30.300 -0.020 0.000 1.236 62 R HN 0.210 8.480 8.270 -0.000 0.000 0.466 63 S N 0.182 115.825 115.700 -0.095 0.000 2.627 63 S HA 0.681 5.151 4.470 0.001 0.000 0.283 63 S C -1.467 173.051 174.600 -0.137 0.000 1.127 63 S CA -0.797 57.380 58.200 -0.038 0.000 0.863 63 S CB 1.535 64.709 63.200 -0.043 0.000 1.121 63 S HN 0.480 8.790 8.310 -0.000 0.000 0.479 64 Y N -0.352 119.972 120.300 0.040 0.000 2.477 64 Y HA 0.657 5.207 4.550 0.001 0.000 0.347 64 Y C -0.635 175.372 175.900 0.178 0.000 0.981 64 Y CA -0.909 57.271 58.100 0.133 0.000 1.033 64 Y CB 2.356 40.918 38.460 0.170 0.000 1.245 64 Y HN 0.635 8.915 8.280 -0.000 0.000 0.455 65 V N 2.600 122.683 119.914 0.282 0.000 2.487 65 V HA 0.962 5.082 4.120 0.001 0.000 0.298 65 V C -0.013 175.989 176.094 -0.154 0.000 1.028 65 V CA -0.320 62.037 62.300 0.096 0.000 0.860 65 V CB 1.298 33.130 31.823 0.015 0.000 0.991 65 V HN 0.956 9.146 8.190 -0.000 0.000 0.427 66 G N 3.002 111.570 108.800 -0.386 0.000 2.441 66 G HA2 0.289 4.250 3.960 0.001 0.000 0.294 66 G HA3 0.289 4.250 3.960 0.001 0.000 0.294 66 G C -1.517 173.049 174.900 -0.557 0.000 1.393 66 G CA -0.856 43.569 45.100 -1.126 0.000 0.796 66 G HN 0.553 8.843 8.290 -0.000 0.000 0.494 67 N N 0.533 118.956 118.700 -0.460 0.000 2.405 67 N HA 0.179 4.919 4.740 0.001 0.000 0.260 67 N C 1.380 176.986 175.510 0.159 0.000 1.152 67 N CA -0.227 52.778 53.050 -0.075 0.000 0.948 67 N CB 0.603 39.060 38.487 -0.050 0.000 1.111 67 N HN 0.429 8.809 8.380 -0.000 0.000 0.485 68 M N 2.559 122.275 119.600 0.193 0.000 2.659 68 M HA 0.005 4.485 4.480 0.001 0.000 0.243 68 M C 0.763 177.157 176.300 0.157 0.000 1.111 68 M CA 0.525 55.972 55.300 0.245 0.000 1.070 68 M CB 0.081 32.793 32.600 0.186 0.000 1.525 68 M HN 0.509 8.799 8.290 -0.000 0.000 0.517 69 M N -0.582 119.094 119.600 0.125 0.000 2.502 69 M HA 0.089 4.570 4.480 0.001 0.000 0.243 69 M C 0.143 176.509 176.300 0.111 0.000 1.130 69 M CA 0.507 55.863 55.300 0.094 0.000 1.055 69 M CB -0.733 31.908 32.600 0.069 0.000 1.457 69 M HN -0.011 8.279 8.290 -0.000 0.000 0.488 70 D N 1.664 122.161 120.400 0.161 0.000 2.365 70 D HA 0.073 4.713 4.640 0.001 0.000 0.237 70 D C 1.032 177.457 176.300 0.208 0.000 1.190 70 D CA 0.163 54.270 54.000 0.178 0.000 0.867 70 D CB 1.052 41.968 40.800 0.193 0.000 1.050 70 D HN 0.129 8.499 8.370 -0.000 0.000 0.491 71 K N 3.030 123.524 120.400 0.157 0.000 2.103 71 K HA -0.193 4.127 4.320 0.001 0.000 0.207 71 K C 0.673 177.436 176.600 0.271 0.000 1.048 71 K CA 1.395 57.781 56.287 0.165 0.000 0.930 71 K CB 0.245 32.835 32.500 0.150 0.000 0.716 71 K HN 0.326 8.576 8.250 -0.000 0.000 0.444 72 D N -0.120 120.434 120.400 0.256 0.000 2.144 72 D HA -0.147 4.494 4.640 0.001 0.000 0.200 72 D C 1.531 177.991 176.300 0.267 0.000 0.978 72 D CA 0.778 54.935 54.000 0.262 0.000 0.833 72 D CB -0.221 40.691 40.800 0.187 0.000 0.961 72 D HN 0.233 8.603 8.370 -0.000 0.000 0.470 73 F N 1.378 121.401 119.950 0.122 0.000 2.075 73 F HA -0.092 4.435 4.527 0.000 0.000 0.297 73 F C 1.943 177.777 175.800 0.057 0.000 1.113 73 F CA 1.183 59.230 58.000 0.079 0.000 1.218 73 F CB -0.584 38.451 39.000 0.060 0.000 0.984 73 F HN -0.110 8.190 8.300 -0.000 0.000 0.472 74 L N -1.460 119.624 121.223 -0.232 0.000 2.046 74 L HA -0.237 4.103 4.340 0.001 0.000 0.208 74 L C 2.464 179.198 176.870 -0.227 0.000 1.077 74 L CA 1.694 56.314 54.840 -0.366 0.000 0.747 74 L CB -1.068 40.986 42.059 -0.008 0.000 0.896 74 L HN 0.280 8.510 8.230 -0.000 0.000 0.432 75 W N -0.162 121.145 121.300 0.011 0.000 2.363 75 W HA -0.232 4.428 4.660 0.000 0.000 0.296 75 W C 3.108 179.517 176.519 -0.182 0.000 1.212 75 W CA 1.375 58.724 57.345 0.007 0.000 1.260 75 W CB -0.074 29.457 29.460 0.118 0.000 1.131 75 W HN 0.085 8.265 8.180 -0.000 0.000 0.530 76 S N -0.219 115.535 115.700 0.090 0.000 2.368 76 S HA -0.189 4.281 4.470 0.001 0.000 0.225 76 S C 1.738 176.210 174.600 -0.213 0.000 1.030 76 S CA 1.773 59.966 58.200 -0.012 0.000 0.999 76 S CB -0.654 62.566 63.200 0.034 0.000 0.844 76 S HN 0.010 8.320 8.310 -0.000 0.000 0.459 77 V N 1.383 120.998 119.914 -0.497 0.000 2.295 77 V HA -0.110 4.011 4.120 0.001 0.000 0.246 77 V C 2.520 178.246 176.094 -0.613 0.000 1.049 77 V CA 1.796 63.611 62.300 -0.808 0.000 1.024 77 V CB -0.764 30.382 31.823 -1.129 0.000 0.648 77 V HN 0.427 8.617 8.190 -0.000 0.000 0.447 78 V N -0.099 119.426 119.914 -0.649 0.000 2.343 78 V HA -0.253 3.868 4.120 0.001 0.000 0.247 78 V C 2.565 178.368 176.094 -0.485 0.000 1.051 78 V CA 2.240 64.069 62.300 -0.784 0.000 1.036 78 V CB -0.579 30.401 31.823 -1.405 0.000 0.654 78 V HN 0.571 8.761 8.190 -0.000 0.000 0.451 79 E N 0.298 120.396 120.200 -0.169 0.000 2.110 79 E HA -0.181 4.170 4.350 0.001 0.000 0.193 79 E C 2.332 178.910 176.600 -0.036 0.000 0.988 79 E CA 1.345 57.744 56.400 -0.002 0.000 0.804 79 E CB -0.179 29.578 29.700 0.095 0.000 0.745 79 E HN 0.478 8.838 8.360 -0.000 0.000 0.458 80 R N -0.149 120.301 120.500 -0.083 0.000 2.075 80 R HA -0.038 4.302 4.340 0.001 0.000 0.232 80 R C 1.922 178.201 176.300 -0.035 0.000 1.126 80 R CA 1.379 57.460 56.100 -0.032 0.000 0.963 80 R CB -0.009 30.292 30.300 0.002 0.000 0.858 80 R HN 0.142 8.412 8.270 -0.000 0.000 0.435 81 E N 0.465 120.595 120.200 -0.117 0.000 2.276 81 E HA 0.015 4.365 4.350 0.001 0.000 0.193 81 E C -0.099 176.459 176.600 -0.070 0.000 0.983 81 E CA 0.131 56.478 56.400 -0.088 0.000 0.861 81 E CB 0.300 29.918 29.700 -0.137 0.000 0.817 81 E HN 0.145 8.505 8.360 -0.000 0.000 0.485 82 K N 1.832 122.174 120.400 -0.098 0.000 3.730 82 K HA -0.149 4.171 4.320 0.001 0.000 0.276 82 K C -2.350 174.295 176.600 0.075 0.000 0.904 82 K CA 0.241 56.575 56.287 0.079 0.000 0.741 82 K CB -1.267 31.340 32.500 0.178 0.000 1.542 82 K HN 0.234 8.484 8.250 -0.000 0.000 0.446 83 P HA 0.043 4.463 4.420 -0.000 0.000 0.274 83 P C 0.087 177.437 177.300 0.083 0.000 1.231 83 P CA -0.179 62.914 63.100 -0.012 0.000 0.790 83 P CB 0.709 32.342 31.700 -0.112 0.000 0.951 84 D N 0.205 120.643 120.400 0.063 0.000 2.224 84 D HA 0.067 4.707 4.640 0.001 0.000 0.205 84 D C 0.548 176.944 176.300 0.159 0.000 0.965 84 D CA 1.139 55.202 54.000 0.104 0.000 0.852 84 D CB 0.385 41.228 40.800 0.071 0.000 0.947 84 D HN 0.474 8.844 8.370 -0.000 0.000 0.494 85 A N 0.455 123.317 122.820 0.070 0.000 2.488 85 A HA 0.571 4.891 4.320 0.001 0.000 0.298 85 A C -1.028 176.478 177.584 -0.131 0.000 1.044 85 A CA -0.580 51.455 52.037 -0.004 0.000 0.693 85 A CB 1.400 20.384 19.000 -0.027 0.000 1.272 85 A HN -0.001 8.149 8.150 -0.000 0.000 0.402 86 I N 2.888 123.325 120.570 -0.221 0.000 2.330 86 I HA 0.346 4.516 4.170 0.001 0.000 0.289 86 I C -0.758 175.212 176.117 -0.245 0.000 1.001 86 I CA -0.184 60.976 61.300 -0.234 0.000 1.193 86 I CB 1.227 39.083 38.000 -0.241 0.000 1.345 86 I HN 0.487 8.697 8.210 -0.000 0.000 0.461 87 I N 8.867 129.328 120.570 -0.183 0.000 2.388 87 I HA 0.292 4.462 4.170 0.001 0.000 0.281 87 I C -2.373 173.689 176.117 -0.091 0.000 1.046 87 I CA -1.918 59.301 61.300 -0.134 0.000 1.187 87 I CB 0.950 38.899 38.000 -0.086 0.000 1.351 87 I HN 0.231 8.441 8.210 -0.000 0.000 0.472 88 P HA 0.164 4.584 4.420 -0.000 0.000 0.282 88 P C -0.005 177.258 177.300 -0.062 0.000 1.262 88 P CA -0.128 62.927 63.100 -0.075 0.000 0.773 88 P CB 1.065 32.714 31.700 -0.086 0.000 0.879 89 E N 2.375 122.546 120.200 -0.049 0.000 2.489 89 E HA 0.170 4.520 4.350 0.001 0.000 0.204 89 E C 0.855 177.431 176.600 -0.040 0.000 1.006 89 E CA 0.223 56.593 56.400 -0.050 0.000 0.936 89 E CB 0.444 30.115 29.700 -0.048 0.000 1.002 89 E HN 0.549 8.909 8.360 -0.000 0.000 0.488 90 I N -3.212 117.342 120.570 -0.027 0.000 3.074 90 I HA 0.378 4.548 4.170 0.001 0.000 0.310 90 I C 0.679 176.789 176.117 -0.011 0.000 1.153 90 I CA -0.847 60.447 61.300 -0.010 0.000 0.993 90 I CB 2.108 40.115 38.000 0.011 0.000 1.237 90 I HN -0.408 7.802 8.210 -0.000 0.000 0.443 91 E N 2.140 122.338 120.200 -0.003 0.000 2.299 91 E HA 0.089 4.439 4.350 0.001 0.000 0.193 91 E C 1.168 177.775 176.600 0.012 0.000 0.998 91 E CA 0.696 57.095 56.400 -0.001 0.000 0.851 91 E CB 0.340 30.038 29.700 -0.003 0.000 0.795 91 E HN 0.747 9.107 8.360 -0.000 0.000 0.492 92 A N 1.786 124.618 122.820 0.019 0.000 3.051 92 A HA 0.264 4.584 4.320 0.001 0.000 0.257 92 A C 0.261 177.868 177.584 0.038 0.000 1.785 92 A CA 0.187 52.242 52.037 0.030 0.000 1.420 92 A CB -0.971 18.049 19.000 0.033 0.000 1.063 92 A HN 0.040 8.190 8.150 -0.000 0.000 0.630 93 I N 0.170 120.759 120.570 0.031 0.000 2.730 93 I HA 0.190 4.360 4.170 0.001 0.000 0.298 93 I C 0.038 176.171 176.117 0.027 0.000 1.089 93 I CA -0.960 60.358 61.300 0.030 0.000 1.041 93 I CB 1.820 39.822 38.000 0.004 0.000 1.235 93 I HN 0.367 8.577 8.210 -0.000 0.000 0.423 94 N N 5.286 124.002 118.700 0.027 0.000 2.429 94 N HA 0.052 4.792 4.740 0.001 0.000 0.271 94 N C 0.724 176.220 175.510 -0.022 0.000 1.272 94 N CA 0.369 53.430 53.050 0.019 0.000 0.921 94 N CB 0.794 39.292 38.487 0.017 0.000 1.128 94 N HN 0.570 8.950 8.380 -0.000 0.000 0.481 95 L N 2.685 123.937 121.223 0.048 0.000 2.093 95 L HA -0.131 4.210 4.340 0.001 0.000 0.208 95 L C 1.574 178.510 176.870 0.109 0.000 1.085 95 L CA 0.773 55.663 54.840 0.083 0.000 0.755 95 L CB -0.254 41.974 42.059 0.281 0.000 0.904 95 L HN 0.439 8.669 8.230 -0.000 0.000 0.435 96 D N 0.552 121.020 120.400 0.113 0.000 2.123 96 D HA -0.167 4.473 4.640 0.001 0.000 0.196 96 D C 2.254 178.510 176.300 -0.073 0.000 0.992 96 D CA 1.517 55.578 54.000 0.101 0.000 0.833 96 D CB -0.012 40.821 40.800 0.055 0.000 0.954 96 D HN 0.295 8.665 8.370 -0.000 0.000 0.455 97 A N 0.785 123.450 122.820 -0.259 0.000 1.883 97 A HA -0.169 4.152 4.320 0.001 0.000 0.217 97 A C 2.423 179.210 177.584 -1.329 0.000 1.186 97 A CA 1.124 52.698 52.037 -0.772 0.000 0.624 97 A CB -0.868 17.742 19.000 -0.651 0.000 0.822 97 A HN 0.239 8.389 8.150 -0.000 0.000 0.444 98 L N -2.163 118.593 121.223 -0.779 0.000 2.042 98 L HA -0.197 4.143 4.340 0.001 0.000 0.210 98 L C 2.551 179.150 176.870 -0.452 0.000 1.076 98 L CA 1.524 55.994 54.840 -0.615 0.000 0.749 98 L CB -0.669 41.141 42.059 -0.415 0.000 0.893 98 L HN 0.407 8.637 8.230 -0.000 0.000 0.432 99 F N 0.290 120.080 119.950 -0.266 0.000 2.186 99 F HA -0.170 4.357 4.527 0.001 0.000 0.299 99 F C 2.558 178.295 175.800 -0.105 0.000 1.090 99 F CA 1.157 59.066 58.000 -0.151 0.000 1.307 99 F CB -0.200 38.709 39.000 -0.151 0.000 1.019 99 F HN 0.081 8.381 8.300 -0.000 0.000 0.489 100 E N -0.335 119.874 120.200 0.014 0.000 2.106 100 E HA -0.165 4.185 4.350 0.001 0.000 0.192 100 E C 2.032 178.797 176.600 0.275 0.000 0.984 100 E CA 0.989 57.491 56.400 0.171 0.000 0.806 100 E CB -0.259 29.632 29.700 0.318 0.000 0.750 100 E HN 0.302 8.662 8.360 -0.000 0.000 0.458 101 F N 1.485 121.393 119.950 -0.070 0.000 2.102 101 F HA -0.152 4.375 4.527 0.001 0.000 0.298 101 F C 2.360 178.250 175.800 0.151 0.000 1.105 101 F CA 1.103 59.022 58.000 -0.134 0.000 1.239 101 F CB -0.912 37.862 39.000 -0.377 0.000 0.991 101 F HN 0.058 8.358 8.300 -0.000 0.000 0.474 102 E N 0.643 120.995 120.200 0.254 0.000 2.077 102 E HA -0.248 4.103 4.350 0.001 0.000 0.193 102 E C 2.311 179.031 176.600 0.200 0.000 0.989 102 E CA 1.232 57.757 56.400 0.208 0.000 0.800 102 E CB -0.128 29.649 29.700 0.129 0.000 0.746 102 E HN 0.341 8.701 8.360 -0.000 0.000 0.452 103 K N 0.444 120.968 120.400 0.207 0.000 2.147 103 K HA -0.198 4.122 4.320 0.001 0.000 0.205 103 K C 1.295 178.003 176.600 0.180 0.000 1.049 103 K CA 1.723 58.114 56.287 0.173 0.000 0.936 103 K CB -0.036 32.563 32.500 0.165 0.000 0.722 103 K HN -0.002 8.248 8.250 -0.000 0.000 0.446 104 D N -1.038 119.530 120.400 0.280 0.000 2.319 104 D HA 0.062 4.702 4.640 0.001 0.000 0.230 104 D C 0.574 176.918 176.300 0.073 0.000 1.094 104 D CA 0.870 55.030 54.000 0.266 0.000 0.856 104 D CB 0.287 41.429 40.800 0.570 0.000 0.915 104 D HN 0.476 8.846 8.370 -0.000 0.000 0.517 105 G N -0.592 108.236 108.800 0.046 0.000 2.175 105 G HA2 -0.282 3.678 3.960 0.001 0.000 0.244 105 G HA3 -0.282 3.678 3.960 0.001 0.000 0.244 105 G C -0.067 174.733 174.900 -0.167 0.000 0.982 105 G CA -0.050 44.996 45.100 -0.089 0.000 0.641 105 G HN 0.359 8.649 8.290 -0.000 0.000 0.527 106 Y N -0.443 119.934 120.300 0.128 0.000 2.310 106 Y HA 0.583 5.133 4.550 0.001 0.000 0.326 106 Y C 0.456 176.449 175.900 0.154 0.000 1.151 106 Y CA -1.160 56.994 58.100 0.090 0.000 1.195 106 Y CB 0.888 39.337 38.460 -0.018 0.000 1.210 106 Y HN 0.104 8.384 8.280 -0.000 0.000 0.483 107 F N 4.284 124.304 119.950 0.117 0.000 2.434 107 F HA 0.364 4.892 4.527 0.000 0.000 0.358 107 F C -0.616 175.201 175.800 0.028 0.000 1.136 107 F CA -1.146 56.886 58.000 0.053 0.000 1.157 107 F CB -0.250 38.764 39.000 0.024 0.000 1.167 107 F HN 0.106 8.406 8.300 -0.000 0.000 0.539 108 V N 7.358 127.146 119.914 -0.210 0.000 2.407 108 V HA 0.264 4.384 4.120 0.001 0.000 0.278 108 V C -0.125 175.590 176.094 -0.632 0.000 1.037 108 V CA -0.831 61.258 62.300 -0.353 0.000 0.900 108 V CB 1.351 33.088 31.823 -0.143 0.000 0.983 108 V HN 0.457 8.647 8.190 -0.000 0.000 0.459 109 V N 8.657 128.175 119.914 -0.659 0.000 2.461 109 V HA 0.234 4.355 4.120 0.001 0.000 0.275 109 V C -0.962 174.961 176.094 -0.286 0.000 1.047 109 V CA -0.867 61.087 62.300 -0.577 0.000 0.955 109 V CB 1.673 33.192 31.823 -0.506 0.000 0.988 109 V HN 0.807 8.997 8.190 -0.000 0.000 0.471 110 P HA 0.034 4.454 4.420 -0.000 0.000 0.226 110 P C -0.189 177.133 177.300 0.037 0.000 1.161 110 P CA 0.719 63.772 63.100 -0.078 0.000 0.804 110 P CB 0.438 32.121 31.700 -0.028 0.000 0.829 111 N N -2.826 115.866 118.700 -0.013 0.000 3.127 111 N HA 0.378 5.118 4.740 0.001 0.000 0.239 111 N C 0.337 175.789 175.510 -0.096 0.000 1.407 111 N CA -0.359 52.697 53.050 0.011 0.000 0.891 111 N CB -0.124 38.425 38.487 0.103 0.000 1.447 111 N HN -0.198 8.182 8.380 -0.000 0.000 0.507 112 A N 0.315 123.019 122.820 -0.194 0.000 1.898 112 A HA -0.115 4.205 4.320 0.001 0.000 0.216 112 A C 2.051 179.347 177.584 -0.480 0.000 1.181 112 A CA 1.954 53.687 52.037 -0.507 0.000 0.620 112 A CB -0.736 17.707 19.000 -0.929 0.000 0.819 112 A HN 0.748 8.898 8.150 -0.000 0.000 0.442 113 R N 0.307 120.714 120.500 -0.154 0.000 2.117 113 R HA -0.117 4.223 4.340 0.001 0.000 0.243 113 R C 2.048 178.509 176.300 0.269 0.000 1.143 113 R CA 1.989 58.226 56.100 0.227 0.000 0.968 113 R CB -0.692 29.782 30.300 0.290 0.000 0.863 113 R HN 0.393 8.663 8.270 -0.000 0.000 0.444 114 A N -0.885 122.023 122.820 0.146 0.000 1.933 114 A HA -0.127 4.194 4.320 0.001 0.000 0.218 114 A C 2.218 179.867 177.584 0.108 0.000 1.175 114 A CA 1.990 54.120 52.037 0.154 0.000 0.628 114 A CB -0.922 18.176 19.000 0.163 0.000 0.814 114 A HN 0.479 8.629 8.150 -0.000 0.000 0.444 115 T N -1.854 112.725 114.554 0.042 0.000 2.821 115 T HA -0.157 4.194 4.350 0.001 0.000 0.267 115 T C 1.457 176.216 174.700 0.099 0.000 1.046 115 T CA 1.381 63.493 62.100 0.019 0.000 1.139 115 T CB -0.297 68.539 68.868 -0.052 0.000 0.871 115 T HN 0.753 8.993 8.240 -0.000 0.000 0.454 116 W N 1.766 123.051 121.300 -0.026 0.000 2.358 116 W HA -0.039 4.621 4.660 0.000 0.000 0.303 116 W C 1.713 178.289 176.519 0.095 0.000 1.208 116 W CA 0.773 58.167 57.345 0.082 0.000 1.274 116 W CB -0.508 29.103 29.460 0.251 0.000 1.138 116 W HN 0.172 8.352 8.180 -0.000 0.000 0.515 117 I N 0.769 121.401 120.570 0.104 0.000 2.179 117 I HA -0.297 3.873 4.170 0.001 0.000 0.242 117 I C 2.522 178.564 176.117 -0.124 0.000 1.088 117 I CA 1.577 62.804 61.300 -0.123 0.000 1.357 117 I CB -1.057 36.998 38.000 0.092 0.000 1.051 117 I HN 0.098 8.308 8.210 -0.000 0.000 0.409 118 A N 0.041 122.840 122.820 -0.035 0.000 2.121 118 A HA -0.195 4.125 4.320 0.001 0.000 0.218 118 A C 2.179 179.729 177.584 -0.057 0.000 1.154 118 A CA 1.152 53.167 52.037 -0.037 0.000 0.679 118 A CB -0.490 18.503 19.000 -0.013 0.000 0.795 118 A HN 0.417 8.567 8.150 -0.000 0.000 0.458 119 M N -0.742 118.810 119.600 -0.080 0.000 2.229 119 M HA -0.026 4.454 4.480 0.001 0.000 0.264 119 M C 0.763 177.023 176.300 -0.066 0.000 1.063 119 M CA 1.379 56.637 55.300 -0.069 0.000 1.114 119 M CB -0.135 32.419 32.600 -0.075 0.000 1.387 119 M HN 0.433 8.723 8.290 -0.000 0.000 0.420 120 H N 0.413 119.347 119.070 -0.226 0.000 2.587 120 H HA 0.329 4.886 4.556 0.001 0.000 0.325 120 H C 0.456 175.697 175.328 -0.145 0.000 1.012 120 H CA -0.219 55.709 56.048 -0.201 0.000 1.213 120 H CB 0.789 30.365 29.762 -0.310 0.000 1.431 120 H HN 0.253 8.533 8.280 -0.000 0.000 0.492 121 R N 2.260 122.636 120.500 -0.207 0.000 2.117 121 R HA -0.191 4.150 4.340 0.001 0.000 0.243 121 R C 1.840 178.172 176.300 0.054 0.000 1.143 121 R CA 1.907 57.959 56.100 -0.079 0.000 0.968 121 R CB 0.167 30.417 30.300 -0.083 0.000 0.863 121 R HN 0.698 8.968 8.270 -0.000 0.000 0.444 122 E N 0.721 121.011 120.200 0.150 0.000 2.046 122 E HA -0.195 4.156 4.350 0.001 0.000 0.190 122 E C 2.101 178.795 176.600 0.156 0.000 0.982 122 E CA 0.878 57.405 56.400 0.211 0.000 0.800 122 E CB 0.075 29.801 29.700 0.043 0.000 0.756 122 E HN 0.117 8.477 8.360 -0.000 0.000 0.449 123 R N 0.005 120.608 120.500 0.172 0.000 2.083 123 R HA -0.177 4.163 4.340 0.001 0.000 0.237 123 R C 2.475 178.759 176.300 -0.027 0.000 1.137 123 R CA 1.532 57.583 56.100 -0.082 0.000 0.951 123 R CB -0.397 29.692 30.300 -0.353 0.000 0.851 123 R HN 0.255 8.525 8.270 -0.000 0.000 0.434 124 L N 0.631 121.848 121.223 -0.009 0.000 1.994 124 L HA -0.136 4.205 4.340 0.001 0.000 0.208 124 L C 2.259 179.119 176.870 -0.016 0.000 1.071 124 L CA 1.876 56.704 54.840 -0.020 0.000 0.745 124 L CB -0.640 41.399 42.059 -0.034 0.000 0.892 124 L HN 0.015 8.245 8.230 -0.000 0.000 0.431 125 R N 0.104 120.591 120.500 -0.022 0.000 2.081 125 R HA -0.139 4.201 4.340 0.001 0.000 0.235 125 R C 2.074 178.365 176.300 -0.016 0.000 1.131 125 R CA 1.630 57.675 56.100 -0.092 0.000 0.960 125 R CB -0.624 29.535 30.300 -0.235 0.000 0.856 125 R HN 0.438 8.708 8.270 -0.000 0.000 0.436 126 E N -0.477 119.768 120.200 0.075 0.000 2.204 126 E HA -0.094 4.257 4.350 0.001 0.000 0.194 126 E C 1.818 178.467 176.600 0.082 0.000 0.989 126 E CA 1.593 58.066 56.400 0.122 0.000 0.824 126 E CB -0.296 29.485 29.700 0.135 0.000 0.756 126 E HN 0.399 8.759 8.360 -0.000 0.000 0.477 127 T N 1.797 116.382 114.554 0.052 0.000 2.737 127 T HA -0.035 4.315 4.350 0.001 0.000 0.265 127 T C 2.106 176.830 174.700 0.041 0.000 1.038 127 T CA 0.634 62.764 62.100 0.050 0.000 1.144 127 T CB -0.149 68.745 68.868 0.044 0.000 0.866 127 T HN 0.096 8.336 8.240 -0.000 0.000 0.434 128 L N 0.720 121.956 121.223 0.022 0.000 2.046 128 L HA -0.085 4.255 4.340 0.001 0.000 0.208 128 L C 2.646 179.540 176.870 0.041 0.000 1.077 128 L CA 1.097 55.946 54.840 0.015 0.000 0.747 128 L CB -0.759 41.292 42.059 -0.014 0.000 0.896 128 L HN 0.171 8.401 8.230 -0.000 0.000 0.432 129 V N -0.466 119.488 119.914 0.067 0.000 2.323 129 V HA -0.175 3.945 4.120 0.001 0.000 0.244 129 V C 2.499 178.648 176.094 0.093 0.000 1.041 129 V CA 1.470 63.834 62.300 0.106 0.000 1.025 129 V CB -0.391 31.546 31.823 0.189 0.000 0.656 129 V HN 0.364 8.554 8.190 -0.000 0.000 0.451 130 K N 0.063 120.519 120.400 0.092 0.000 2.098 130 K HA 0.013 4.333 4.320 0.001 0.000 0.203 130 K C 1.955 178.592 176.600 0.061 0.000 1.051 130 K CA 1.071 57.405 56.287 0.079 0.000 0.957 130 K CB -0.060 32.491 32.500 0.085 0.000 0.738 130 K HN 0.576 8.826 8.250 -0.000 0.000 0.447 131 E N 0.483 120.717 120.200 0.057 0.000 2.110 131 E HA 0.103 4.453 4.350 0.001 0.000 0.193 131 E C 1.935 178.558 176.600 0.038 0.000 0.950 131 E CA 0.536 56.965 56.400 0.048 0.000 0.840 131 E CB 0.015 29.746 29.700 0.052 0.000 0.809 131 E HN 0.169 8.529 8.360 -0.000 0.000 0.465 132 A N 1.311 124.151 122.820 0.033 0.000 2.067 132 A HA -0.072 4.248 4.320 0.001 0.000 0.217 132 A C 0.504 178.103 177.584 0.026 0.000 1.156 132 A CA 0.442 52.492 52.037 0.022 0.000 0.683 132 A CB -0.329 18.676 19.000 0.009 0.000 0.808 132 A HN 0.142 8.292 8.150 -0.000 0.000 0.455 133 K N -0.909 119.511 120.400 0.035 0.000 3.419 133 K HA -0.123 4.197 4.320 0.001 0.000 0.272 133 K C -0.341 176.275 176.600 0.027 0.000 0.973 133 K CA 0.516 56.825 56.287 0.037 0.000 0.749 133 K CB -2.313 30.206 32.500 0.033 0.000 1.403 133 K HN 0.764 9.014 8.250 -0.000 0.000 0.456 134 V N -2.684 117.246 119.914 0.028 0.000 2.960 134 V HA 0.744 4.865 4.120 0.001 0.000 0.315 134 V C -2.149 173.964 176.094 0.032 0.000 1.087 134 V CA -2.325 59.983 62.300 0.014 0.000 0.982 134 V CB 1.744 33.567 31.823 -0.000 0.000 1.039 134 V HN 0.059 8.249 8.190 -0.000 0.000 0.437 135 P HA 0.360 4.780 4.420 -0.000 0.000 0.276 135 P C -0.305 177.079 177.300 0.139 0.000 1.230 135 P CA 0.427 63.556 63.100 0.047 0.000 0.776 135 P CB 1.053 32.707 31.700 -0.076 0.000 0.888 136 T N -1.431 113.270 114.554 0.245 0.000 2.838 136 T HA 0.495 4.845 4.350 0.001 0.000 0.292 136 T C 0.052 175.007 174.700 0.425 0.000 1.113 136 T CA -0.762 61.516 62.100 0.297 0.000 1.008 136 T CB 0.638 69.593 68.868 0.145 0.000 1.259 136 T HN 0.385 8.625 8.240 -0.000 0.000 0.520 137 S N 0.430 116.315 115.700 0.308 0.000 2.573 137 S HA 0.312 4.782 4.470 0.001 0.000 0.277 137 S C 0.229 175.001 174.600 0.286 0.000 1.346 137 S CA -0.775 57.551 58.200 0.209 0.000 1.034 137 S CB -0.177 63.100 63.200 0.128 0.000 0.879 137 S HN 0.803 9.113 8.310 -0.000 0.000 0.528 138 R N 1.432 122.061 120.500 0.214 0.000 2.643 138 R HA 0.428 4.768 4.340 0.001 0.000 0.270 138 R C -0.521 175.892 176.300 0.189 0.000 1.061 138 R CA -0.071 56.128 56.100 0.165 0.000 1.107 138 R CB 0.184 30.528 30.300 0.073 0.000 0.999 138 R HN 0.834 9.104 8.270 -0.000 0.000 0.460 139 Y N -1.076 119.204 120.300 -0.033 0.000 2.689 139 Y HA 0.643 5.193 4.550 0.001 0.000 0.333 139 Y C -1.178 174.619 175.900 -0.172 0.000 1.208 139 Y CA -1.615 56.423 58.100 -0.103 0.000 1.055 139 Y CB 1.379 39.749 38.460 -0.149 0.000 1.304 139 Y HN 0.436 8.716 8.280 -0.000 0.000 0.455 140 M N 0.799 120.272 119.600 -0.212 0.000 2.644 140 M HA 0.557 5.037 4.480 0.001 0.000 0.273 140 M C -2.177 173.996 176.300 -0.212 0.000 1.253 140 M CA -0.865 54.267 55.300 -0.279 0.000 0.852 140 M CB 2.601 35.118 32.600 -0.138 0.000 1.708 140 M HN 0.707 8.997 8.290 -0.000 0.000 0.471 141 Y N 0.260 120.645 120.300 0.140 0.000 2.453 141 Y HA 0.858 5.408 4.550 0.001 0.000 0.326 141 Y C 0.015 175.985 175.900 0.118 0.000 1.186 141 Y CA -0.807 57.382 58.100 0.150 0.000 1.200 141 Y CB 2.014 40.568 38.460 0.156 0.000 1.247 141 Y HN 0.832 9.112 8.280 -0.000 0.000 0.482 142 A N 0.388 123.392 122.820 0.306 0.000 2.408 142 A HA 0.562 4.882 4.320 0.001 0.000 0.295 142 A C -0.173 177.580 177.584 0.282 0.000 1.040 142 A CA -0.578 51.600 52.037 0.235 0.000 0.707 142 A CB 0.905 20.023 19.000 0.196 0.000 1.235 142 A HN 0.788 8.938 8.150 -0.000 0.000 0.418 143 T N 0.513 115.208 114.554 0.235 0.000 3.001 143 T HA 0.213 4.563 4.350 0.001 0.000 0.251 143 T C 0.845 175.750 174.700 0.343 0.000 1.040 143 T CA 1.183 63.442 62.100 0.265 0.000 0.985 143 T CB -0.030 68.942 68.868 0.173 0.000 1.011 143 T HN 1.087 9.327 8.240 -0.000 0.000 0.509 144 T N -0.810 113.835 114.554 0.151 0.000 2.901 144 T HA 0.573 4.923 4.350 0.001 0.000 0.293 144 T C 0.770 175.058 174.700 -0.687 0.000 1.084 144 T CA -0.868 61.155 62.100 -0.128 0.000 1.008 144 T CB 1.598 70.422 68.868 -0.073 0.000 1.170 144 T HN -0.152 8.088 8.240 -0.000 0.000 0.509 145 L N 0.937 121.453 121.223 -1.178 0.000 2.083 145 L HA 0.072 4.413 4.340 0.001 0.000 0.209 145 L C 2.028 178.690 176.870 -0.346 0.000 1.083 145 L CA 2.270 56.411 54.840 -1.164 0.000 0.752 145 L CB -1.021 40.422 42.059 -1.028 0.000 0.899 145 L HN 0.940 9.170 8.230 -0.000 0.000 0.433 146 D N -0.699 119.586 120.400 -0.192 0.000 2.144 146 D HA -0.197 4.444 4.640 0.001 0.000 0.200 146 D C 2.034 178.342 176.300 0.015 0.000 0.978 146 D CA 1.269 55.258 54.000 -0.019 0.000 0.833 146 D CB 0.062 40.831 40.800 -0.051 0.000 0.961 146 D HN 0.511 8.881 8.370 -0.000 0.000 0.470 147 E N -0.728 119.450 120.200 -0.036 0.000 2.153 147 E HA -0.143 4.207 4.350 0.001 0.000 0.194 147 E C 1.947 178.560 176.600 0.021 0.000 0.988 147 E CA 0.348 56.755 56.400 0.013 0.000 0.811 147 E CB -0.050 29.672 29.700 0.038 0.000 0.746 147 E HN 0.225 8.585 8.360 -0.000 0.000 0.466 148 L N -0.062 121.143 121.223 -0.031 0.000 2.046 148 L HA -0.181 4.159 4.340 0.001 0.000 0.208 148 L C 1.816 178.652 176.870 -0.058 0.000 1.077 148 L CA 1.727 56.548 54.840 -0.032 0.000 0.747 148 L CB -0.541 41.477 42.059 -0.069 0.000 0.896 148 L HN 0.134 8.364 8.230 -0.000 0.000 0.432 149 Y N -0.188 120.084 120.300 -0.048 0.000 2.181 149 Y HA -0.273 4.278 4.550 0.001 0.000 0.288 149 Y C 2.710 178.604 175.900 -0.010 0.000 1.146 149 Y CA 1.773 59.867 58.100 -0.011 0.000 1.164 149 Y CB -0.207 38.236 38.460 -0.029 0.000 0.982 149 Y HN 0.287 8.567 8.280 -0.000 0.000 0.515 150 E N 0.174 120.455 120.200 0.135 0.000 2.051 150 E HA -0.184 4.166 4.350 0.001 0.000 0.192 150 E C 2.263 178.873 176.600 0.017 0.000 0.991 150 E CA 1.322 57.762 56.400 0.066 0.000 0.799 150 E CB -0.450 29.277 29.700 0.044 0.000 0.748 150 E HN 0.344 8.704 8.360 -0.000 0.000 0.449 151 A N -0.051 122.772 122.820 0.005 0.000 1.865 151 A HA -0.239 4.081 4.320 0.001 0.000 0.217 151 A C 2.620 180.150 177.584 -0.090 0.000 1.191 151 A CA 1.729 53.750 52.037 -0.027 0.000 0.623 151 A CB -1.164 17.837 19.000 0.001 0.000 0.826 151 A HN 0.506 8.656 8.150 -0.000 0.000 0.444 152 C N -0.959 118.263 119.300 -0.130 0.000 2.413 152 C HA -0.087 4.373 4.460 0.001 0.000 0.276 152 C C 2.678 177.372 174.990 -0.493 0.000 1.248 152 C CA 1.261 60.077 59.018 -0.336 0.000 1.742 152 C CB -1.398 26.149 27.740 -0.322 0.000 2.017 152 C HN 0.710 8.940 8.230 -0.000 0.000 0.481 153 E N 0.589 120.661 120.200 -0.213 0.000 2.072 153 E HA -0.197 4.154 4.350 0.001 0.000 0.191 153 E C 2.256 178.801 176.600 -0.092 0.000 0.985 153 E CA 1.089 57.432 56.400 -0.095 0.000 0.801 153 E CB -0.103 29.638 29.700 0.069 0.000 0.750 153 E HN 0.565 8.925 8.360 -0.000 0.000 0.452 154 K N 0.394 120.750 120.400 -0.073 0.000 2.025 154 K HA -0.123 4.197 4.320 0.001 0.000 0.207 154 K C 1.949 178.505 176.600 -0.074 0.000 1.049 154 K CA 0.980 57.235 56.287 -0.053 0.000 0.933 154 K CB 0.060 32.536 32.500 -0.039 0.000 0.714 154 K HN 0.027 8.277 8.250 -0.000 0.000 0.438 155 I N 0.716 121.222 120.570 -0.106 0.000 2.226 155 I HA -0.071 4.099 4.170 0.001 0.000 0.245 155 I C 1.170 177.223 176.117 -0.106 0.000 1.100 155 I CA 1.682 62.926 61.300 -0.092 0.000 1.374 155 I CB -1.456 36.491 38.000 -0.089 0.000 1.057 155 I HN 0.496 8.706 8.210 -0.000 0.000 0.413 156 G N -0.292 108.381 108.800 -0.212 0.000 2.770 156 G HA2 -0.166 3.794 3.960 0.001 0.000 0.686 156 G HA3 -0.166 3.794 3.960 0.001 0.000 0.686 156 G C -0.953 173.792 174.900 -0.259 0.000 1.180 156 G CA -0.872 44.118 45.100 -0.184 0.000 0.767 156 G HN 0.099 8.389 8.290 -0.000 0.000 0.646 157 Y N 1.991 122.267 120.300 -0.040 0.000 2.301 157 Y HA 0.583 5.133 4.550 0.001 0.000 0.325 157 Y C -0.603 175.240 175.900 -0.096 0.000 1.203 157 Y CA -0.994 57.047 58.100 -0.097 0.000 1.255 157 Y CB 0.899 39.288 38.460 -0.119 0.000 1.232 157 Y HN 0.579 8.859 8.280 -0.000 0.000 0.501 158 P HA 0.358 4.778 4.420 -0.000 0.000 0.281 158 P C -1.083 176.137 177.300 -0.134 0.000 1.249 158 P CA -0.431 62.541 63.100 -0.212 0.000 0.810 158 P CB 1.157 32.519 31.700 -0.564 0.000 1.008 159 C N -0.349 118.823 119.300 -0.214 0.000 3.171 159 C HA 0.605 5.065 4.460 0.001 0.000 0.308 159 C C -0.416 174.547 174.990 -0.045 0.000 1.334 159 C CA -0.868 58.124 59.018 -0.043 0.000 1.473 159 C CB 1.399 29.095 27.740 -0.073 0.000 1.866 159 C HN 0.634 8.864 8.230 -0.000 0.000 0.465 160 H N 1.187 120.401 119.070 0.239 0.000 2.459 160 H HA 0.573 5.129 4.556 0.001 0.000 0.332 160 H C -0.131 175.304 175.328 0.178 0.000 1.094 160 H CA 0.236 56.440 56.048 0.260 0.000 1.224 160 H CB 1.988 31.887 29.762 0.229 0.000 1.449 160 H HN 0.928 9.208 8.280 -0.000 0.000 0.484 161 T N 1.179 115.897 114.554 0.273 0.000 2.823 161 T HA 0.603 4.953 4.350 0.001 0.000 0.279 161 T C -0.252 174.571 174.700 0.205 0.000 0.998 161 T CA -1.110 61.119 62.100 0.214 0.000 0.994 161 T CB 1.782 70.771 68.868 0.201 0.000 0.960 161 T HN 0.503 8.743 8.240 -0.000 0.000 0.448 162 K N 1.527 122.022 120.400 0.159 0.000 2.468 162 K HA 0.687 5.007 4.320 0.001 0.000 0.252 162 K C -0.622 176.024 176.600 0.077 0.000 0.932 162 K CA -1.024 55.333 56.287 0.117 0.000 0.794 162 K CB 2.561 35.123 32.500 0.103 0.000 1.241 162 K HN 0.827 9.077 8.250 -0.000 0.000 0.428 163 A N 2.565 125.406 122.820 0.035 0.000 2.425 163 A HA 0.194 4.514 4.320 0.001 0.000 0.249 163 A C 1.228 178.783 177.584 -0.049 0.000 1.084 163 A CA -0.381 51.649 52.037 -0.012 0.000 0.781 163 A CB -0.443 18.532 19.000 -0.041 0.000 1.019 163 A HN 0.970 9.120 8.150 -0.000 0.000 0.490 164 I N 0.032 120.545 120.570 -0.095 0.000 2.614 164 I HA -0.015 4.156 4.170 0.001 0.000 0.258 164 I C 0.702 176.613 176.117 -0.344 0.000 1.189 164 I CA 0.425 61.570 61.300 -0.258 0.000 1.462 164 I CB -0.783 36.975 38.000 -0.404 0.000 1.092 164 I HN 0.743 8.953 8.210 -0.000 0.000 0.442 173 Y N 1.213 121.597 120.300 0.139 0.000 2.581 173 Y HA 0.684 5.235 4.550 0.001 0.000 0.337 173 Y C -2.065 173.962 175.900 0.211 0.000 1.108 173 Y CA -1.079 57.108 58.100 0.144 0.000 1.033 173 Y CB 1.210 39.725 38.460 0.093 0.000 1.318 173 Y HN 0.668 8.948 8.280 -0.000 0.000 0.459 174 F N 6.087 125.735 119.950 -0.503 0.000 2.293 174 F HA 0.483 5.010 4.527 0.001 0.000 0.370 174 F C -1.087 174.537 175.800 -0.294 0.000 1.090 174 F CA -1.384 56.381 58.000 -0.392 0.000 1.133 174 F CB 0.494 39.253 39.000 -0.400 0.000 1.360 174 F HN 0.260 8.560 8.300 -0.000 0.000 0.489 175 V N 7.909 127.688 119.914 -0.226 0.000 2.389 175 V HA 0.279 4.399 4.120 0.001 0.000 0.264 175 V C 0.680 176.568 176.094 -0.343 0.000 1.049 175 V CA -0.060 62.180 62.300 -0.100 0.000 0.932 175 V CB 0.715 32.620 31.823 0.137 0.000 1.011 175 V HN 0.830 9.020 8.190 -0.000 0.000 0.475 176 K N 5.160 125.331 120.400 -0.381 0.000 2.379 176 K HA 0.404 4.725 4.320 0.001 0.000 0.194 176 K C 0.714 177.138 176.600 -0.294 0.000 1.031 176 K CA 0.671 56.715 56.287 -0.405 0.000 1.037 176 K CB 0.688 32.957 32.500 -0.386 0.000 0.824 176 K HN 0.864 9.114 8.250 -0.000 0.000 0.516 177 G N 0.280 108.868 108.800 -0.354 0.000 2.559 177 G HA2 0.173 4.133 3.960 0.001 0.000 0.291 177 G HA3 0.173 4.133 3.960 0.001 0.000 0.291 177 G C -2.766 171.797 174.900 -0.562 0.000 1.424 177 G CA -0.918 43.710 45.100 -0.786 0.000 0.786 177 G HN -0.354 7.936 8.290 -0.000 0.000 0.485 178 P HA -0.081 4.339 4.420 -0.000 0.000 0.218 178 P C 1.749 179.036 177.300 -0.022 0.000 1.148 178 P CA 1.544 64.582 63.100 -0.103 0.000 0.822 178 P CB 0.257 31.952 31.700 -0.008 0.000 0.784 179 E N -0.296 119.864 120.200 -0.067 0.000 2.265 179 E HA -0.205 4.145 4.350 0.001 0.000 0.196 179 E C 0.741 177.337 176.600 -0.007 0.000 0.996 179 E CA 1.311 57.699 56.400 -0.020 0.000 0.832 179 E CB -1.027 28.652 29.700 -0.035 0.000 0.756 179 E HN 0.279 8.639 8.360 -0.000 0.000 0.491 180 D N 0.626 121.023 120.400 -0.005 0.000 2.348 180 D HA 0.067 4.707 4.640 0.001 0.000 0.211 180 D C 1.960 178.245 176.300 -0.025 0.000 0.998 180 D CA -0.021 54.011 54.000 0.053 0.000 0.873 180 D CB 0.165 41.084 40.800 0.198 0.000 0.925 180 D HN 0.177 8.547 8.370 -0.000 0.000 0.524 181 I N 1.574 122.100 120.570 -0.074 0.000 2.163 181 I HA -0.198 3.973 4.170 0.001 0.000 0.243 181 I C -0.548 175.479 176.117 -0.149 0.000 1.085 181 I CA 1.474 62.647 61.300 -0.212 0.000 1.347 181 I CB -2.284 35.311 38.000 -0.675 0.000 1.044 181 I HN -0.022 8.188 8.210 -0.000 0.000 0.408 182 P HA -0.183 4.237 4.420 -0.000 0.000 0.215 182 P C 1.740 179.026 177.300 -0.022 0.000 1.153 182 P CA 1.553 64.661 63.100 0.013 0.000 0.853 182 P CB -0.001 31.721 31.700 0.038 0.000 0.788 183 K N 0.297 120.598 120.400 -0.166 0.000 2.026 183 K HA -0.079 4.242 4.320 0.001 0.000 0.208 183 K C 1.971 178.278 176.600 -0.489 0.000 1.048 183 K CA 1.764 57.833 56.287 -0.364 0.000 0.929 183 K CB -1.277 30.871 32.500 -0.587 0.000 0.713 183 K HN -0.065 8.185 8.250 -0.000 0.000 0.439 184 A N 0.607 123.135 122.820 -0.488 0.000 1.908 184 A HA -0.194 4.126 4.320 0.001 0.000 0.218 184 A C 2.207 179.783 177.584 -0.013 0.000 1.181 184 A CA 1.516 53.418 52.037 -0.226 0.000 0.627 184 A CB -1.256 17.764 19.000 0.033 0.000 0.818 184 A HN 0.729 8.879 8.150 -0.000 0.000 0.445 185 W N 0.759 121.971 121.300 -0.146 0.000 2.392 185 W HA -0.111 4.550 4.660 0.001 0.000 0.279 185 W C 1.217 177.697 176.519 -0.064 0.000 1.225 185 W CA 1.621 58.918 57.345 -0.080 0.000 1.233 185 W CB 0.097 29.514 29.460 -0.071 0.000 1.122 185 W HN 0.448 8.628 8.180 -0.000 0.000 0.561 186 E N 0.597 120.729 120.200 -0.114 0.000 2.447 186 E HA -0.059 4.291 4.350 0.001 0.000 0.195 186 E C 0.696 177.196 176.600 -0.167 0.000 1.028 186 E CA 0.843 57.136 56.400 -0.179 0.000 0.876 186 E CB 0.029 29.678 29.700 -0.085 0.000 0.885 186 E HN 0.424 8.784 8.360 -0.000 0.000 0.500 198 K N 4.652 125.068 120.400 0.028 0.000 2.324 198 K HA 0.691 5.011 4.320 0.001 0.000 0.253 198 K C -1.319 175.338 176.600 0.094 0.000 0.932 198 K CA -0.514 55.831 56.287 0.097 0.000 0.799 198 K CB 1.263 33.804 32.500 0.069 0.000 1.154 198 K HN 0.450 8.700 8.250 -0.000 0.000 0.425 199 I N 4.392 125.077 120.570 0.193 0.000 2.686 199 I HA 0.398 4.568 4.170 0.001 0.000 0.295 199 I C -0.870 175.414 176.117 0.278 0.000 1.114 199 I CA -1.063 60.353 61.300 0.193 0.000 1.038 199 I CB 2.131 40.252 38.000 0.201 0.000 1.238 199 I HN 0.608 8.818 8.210 -0.000 0.000 0.420 200 I N 6.071 126.781 120.570 0.233 0.000 2.377 200 I HA 0.502 4.672 4.170 0.001 0.000 0.293 200 I C -1.129 175.065 176.117 0.127 0.000 0.987 200 I CA -0.582 60.830 61.300 0.186 0.000 1.185 200 I CB 1.357 39.447 38.000 0.151 0.000 1.341 200 I HN 0.223 8.433 8.210 -0.000 0.000 0.455 201 V N 7.280 127.247 119.914 0.089 0.000 2.384 201 V HA 0.450 4.571 4.120 0.001 0.000 0.287 201 V C -0.403 175.757 176.094 0.111 0.000 1.020 201 V CA -0.544 61.815 62.300 0.098 0.000 0.850 201 V CB 1.386 33.241 31.823 0.053 0.000 0.987 201 V HN 0.723 8.913 8.190 -0.000 0.000 0.436 202 E N 2.632 122.929 120.200 0.162 0.000 2.256 202 E HA 0.385 4.735 4.350 0.001 0.000 0.267 202 E C -0.614 176.107 176.600 0.200 0.000 0.892 202 E CA -0.799 55.711 56.400 0.185 0.000 0.775 202 E CB 2.628 32.442 29.700 0.190 0.000 1.207 202 E HN 0.793 9.153 8.360 -0.000 0.000 0.420 203 E N 2.328 122.616 120.200 0.147 0.000 2.414 203 E HA -0.069 4.282 4.350 0.001 0.000 0.263 203 E C -0.814 175.890 176.600 0.173 0.000 1.000 203 E CA -0.257 56.216 56.400 0.122 0.000 0.914 203 E CB 0.533 30.272 29.700 0.065 0.000 0.948 203 E HN 0.468 8.828 8.360 -0.000 0.000 0.444 204 H N 4.785 123.933 119.070 0.130 0.000 2.819 204 H HA 0.158 4.715 4.556 0.001 0.000 0.303 204 H C -0.490 174.780 175.328 -0.098 0.000 1.058 204 H CA -0.422 55.718 56.048 0.153 0.000 1.471 204 H CB 0.267 30.160 29.762 0.218 0.000 1.480 204 H HN 0.334 8.614 8.280 -0.000 0.000 0.517 205 I N 4.977 125.038 120.570 -0.849 0.000 2.304 205 I HA 0.029 4.200 4.170 0.001 0.000 0.291 205 I C 0.301 175.774 176.117 -1.073 0.000 1.018 205 I CA -0.458 60.303 61.300 -0.898 0.000 1.260 205 I CB 0.760 38.166 38.000 -0.990 0.000 1.390 205 I HN 0.749 8.959 8.210 -0.000 0.000 0.475 206 D N 7.869 127.863 120.400 -0.676 0.000 2.619 206 D HA 0.158 4.798 4.640 0.001 0.000 0.224 206 D C 0.026 176.084 176.300 -0.402 0.000 1.133 206 D CA -0.342 53.345 54.000 -0.521 0.000 1.017 206 D CB -0.369 40.325 40.800 -0.177 0.000 1.077 206 D HN 0.259 8.629 8.370 -0.000 0.000 0.503 207 F N -0.462 119.297 119.950 -0.318 0.000 2.406 207 F HA 0.373 4.901 4.527 0.001 0.000 0.327 207 F C 1.127 176.908 175.800 -0.032 0.000 1.153 207 F CA -0.827 57.089 58.000 -0.140 0.000 1.218 207 F CB 0.643 39.551 39.000 -0.152 0.000 1.215 207 F HN -0.128 8.172 8.300 -0.000 0.000 0.570 208 D N 0.233 120.835 120.400 0.338 0.000 2.123 208 D HA 0.009 4.649 4.640 0.001 0.000 0.200 208 D C 0.130 176.656 176.300 0.378 0.000 0.976 208 D CA 1.326 55.480 54.000 0.256 0.000 0.831 208 D CB 0.323 41.245 40.800 0.203 0.000 0.974 208 D HN 0.314 8.684 8.370 -0.000 0.000 0.469 209 V N -0.417 119.753 119.914 0.428 0.000 3.204 209 V HA 0.235 4.356 4.120 0.001 0.000 0.298 209 V C -1.720 174.310 176.094 -0.107 0.000 1.328 209 V CA -0.785 61.686 62.300 0.285 0.000 1.035 209 V CB 2.601 34.579 31.823 0.259 0.000 1.095 209 V HN -0.160 8.030 8.190 -0.000 0.000 0.442 210 E N 1.961 121.934 120.200 -0.379 0.000 2.204 210 E HA 0.697 5.048 4.350 0.001 0.000 0.276 210 E C -1.140 175.134 176.600 -0.543 0.000 0.974 210 E CA -0.518 55.508 56.400 -0.622 0.000 0.815 210 E CB 2.152 31.372 29.700 -0.799 0.000 1.119 210 E HN 0.765 9.125 8.360 -0.000 0.000 0.393 211 V N -0.391 119.325 119.914 -0.331 0.000 2.962 211 V HA 0.652 4.772 4.120 0.001 0.000 0.313 211 V C -0.514 175.558 176.094 -0.037 0.000 1.099 211 V CA -0.719 61.474 62.300 -0.180 0.000 0.971 211 V CB 2.108 33.861 31.823 -0.117 0.000 1.028 211 V HN 0.556 8.746 8.190 -0.000 0.000 0.430 212 T N 2.502 117.070 114.554 0.023 0.000 2.786 212 T HA 0.547 4.898 4.350 0.001 0.000 0.283 212 T C -0.734 173.951 174.700 -0.025 0.000 0.992 212 T CA -0.045 62.043 62.100 -0.020 0.000 0.954 212 T CB 1.287 70.118 68.868 -0.061 0.000 0.934 212 T HN 0.981 9.221 8.240 -0.000 0.000 0.440 213 E N 3.121 123.317 120.200 -0.006 0.000 2.109 213 E HA 0.302 4.652 4.350 0.001 0.000 0.278 213 E C -0.590 176.037 176.600 0.046 0.000 0.954 213 E CA -0.597 55.847 56.400 0.073 0.000 0.779 213 E CB 0.360 30.149 29.700 0.147 0.000 1.093 213 E HN 0.516 8.876 8.360 -0.000 0.000 0.401 214 L N 3.944 125.183 121.223 0.026 0.000 2.583 214 L HA 0.385 4.725 4.340 0.001 0.000 0.239 214 L C 0.355 177.199 176.870 -0.043 0.000 1.347 214 L CA -0.640 54.179 54.840 -0.035 0.000 1.246 214 L CB -0.223 41.777 42.059 -0.098 0.000 1.496 214 L HN 0.521 8.751 8.230 -0.000 0.000 0.413 215 A N 1.052 123.854 122.820 -0.029 0.000 2.520 215 A HA 0.343 4.664 4.320 0.001 0.000 0.245 215 A C -0.164 177.359 177.584 -0.100 0.000 1.072 215 A CA 0.039 51.941 52.037 -0.226 0.000 0.761 215 A CB 0.733 19.592 19.000 -0.235 0.000 1.004 215 A HN 0.260 8.410 8.150 -0.000 0.000 0.499 216 V N 4.723 124.524 119.914 -0.188 0.000 2.487 216 V HA 0.532 4.653 4.120 0.001 0.000 0.298 216 V C -0.077 176.038 176.094 0.035 0.000 1.028 216 V CA -0.828 61.471 62.300 -0.002 0.000 0.860 216 V CB 1.412 33.207 31.823 -0.045 0.000 0.991 216 V HN 0.960 9.150 8.190 -0.000 0.000 0.427 217 R N 5.349 125.920 120.500 0.118 0.000 2.221 217 R HA 0.627 4.967 4.340 0.001 0.000 0.327 217 R C -0.771 175.541 176.300 0.021 0.000 1.033 217 R CA -0.287 55.825 56.100 0.021 0.000 0.887 217 R CB 0.928 31.279 30.300 0.084 0.000 1.057 217 R HN 1.031 9.301 8.270 -0.000 0.000 0.455 218 H N -0.051 118.933 119.070 -0.143 0.000 2.990 218 H HA 0.379 4.936 4.556 0.001 0.000 0.336 218 H C -1.227 174.008 175.328 -0.156 0.000 1.306 218 H CA -0.987 54.938 56.048 -0.205 0.000 1.118 218 H CB 0.466 30.172 29.762 -0.093 0.000 1.856 218 H HN 0.164 8.444 8.280 -0.000 0.000 0.538 219 F N 1.662 121.670 119.950 0.097 0.000 2.418 219 F HA 0.233 4.761 4.527 0.000 0.000 0.341 219 F C 0.685 176.532 175.800 0.078 0.000 1.120 219 F CA -0.074 57.944 58.000 0.030 0.000 1.232 219 F CB 0.610 39.635 39.000 0.042 0.000 1.175 219 F HN 0.768 9.068 8.300 -0.000 0.000 0.569 220 D N 0.117 120.675 120.400 0.263 0.000 2.549 220 D HA 0.168 4.809 4.640 0.001 0.000 0.270 220 D C 0.446 176.843 176.300 0.162 0.000 1.181 220 D CA -0.517 53.602 54.000 0.199 0.000 1.070 220 D CB 0.256 41.151 40.800 0.158 0.000 1.154 220 D HN 0.577 8.947 8.370 -0.000 0.000 0.602 221 E N -1.050 119.225 120.200 0.124 0.000 2.338 221 E HA -0.100 4.250 4.350 0.001 0.000 0.197 221 E C 0.685 177.301 176.600 0.027 0.000 1.007 221 E CA 0.514 56.958 56.400 0.072 0.000 0.849 221 E CB -0.115 29.626 29.700 0.068 0.000 0.774 221 E HN 0.327 8.687 8.360 -0.000 0.000 0.506 222 N N -0.239 118.481 118.700 0.033 0.000 2.412 222 N HA -0.010 4.730 4.740 0.001 0.000 0.184 222 N C 1.076 176.564 175.510 -0.036 0.000 1.101 222 N CA 0.899 53.950 53.050 0.001 0.000 0.881 222 N CB 1.033 39.529 38.487 0.016 0.000 0.969 222 N HN 0.287 8.667 8.380 -0.000 0.000 0.459 223 G N 0.524 109.295 108.800 -0.049 0.000 2.157 223 G HA2 -0.253 3.708 3.960 0.001 0.000 0.248 223 G HA3 -0.253 3.708 3.960 0.001 0.000 0.248 223 G C -0.090 174.813 174.900 0.006 0.000 0.979 223 G CA -0.077 44.906 45.100 -0.196 0.000 0.650 223 G HN 0.386 8.676 8.290 -0.000 0.000 0.529 224 E N -0.534 119.744 120.200 0.130 0.000 2.283 224 E HA 0.575 4.925 4.350 0.001 0.000 0.267 224 E C 0.311 177.062 176.600 0.251 0.000 1.045 224 E CA -0.867 55.639 56.400 0.176 0.000 0.884 224 E CB 1.291 31.049 29.700 0.096 0.000 1.106 224 E HN 0.306 8.666 8.360 -0.000 0.000 0.408 225 I N 2.808 123.476 120.570 0.163 0.000 2.337 225 I HA 0.087 4.258 4.170 0.001 0.000 0.291 225 I C 0.196 176.281 176.117 -0.053 0.000 1.046 225 I CA -0.535 60.770 61.300 0.009 0.000 1.324 225 I CB 0.444 38.411 38.000 -0.054 0.000 1.409 225 I HN 0.209 8.419 8.210 -0.000 0.000 0.494 226 V N 2.399 122.202 119.914 -0.185 0.000 2.966 226 V HA 0.654 4.774 4.120 0.001 0.000 0.317 226 V C 0.045 175.949 176.094 -0.316 0.000 1.070 226 V CA -0.368 61.825 62.300 -0.178 0.000 1.008 226 V CB 1.735 33.470 31.823 -0.146 0.000 1.070 226 V HN 0.647 8.837 8.190 -0.000 0.000 0.457 227 T N 1.757 116.182 114.554 -0.216 0.000 2.792 227 T HA 0.598 4.949 4.350 0.001 0.000 0.280 227 T C -0.231 174.207 174.700 -0.436 0.000 0.990 227 T CA -0.193 61.721 62.100 -0.310 0.000 0.960 227 T CB 1.333 70.059 68.868 -0.237 0.000 0.939 227 T HN 0.957 9.197 8.240 -0.000 0.000 0.439 228 T N 3.183 117.460 114.554 -0.463 0.000 2.856 228 T HA 0.627 4.977 4.350 0.001 0.000 0.283 228 T C -0.961 173.370 174.700 -0.616 0.000 1.008 228 T CA -0.480 61.398 62.100 -0.370 0.000 0.997 228 T CB 0.536 69.409 68.868 0.008 0.000 0.992 228 T HN 0.363 8.603 8.240 -0.000 0.000 0.454 229 F N 3.482 123.315 119.950 -0.195 0.000 2.403 229 F HA 0.426 4.954 4.527 0.001 0.000 0.355 229 F C -2.270 173.425 175.800 -0.175 0.000 1.119 229 F CA -2.400 55.437 58.000 -0.273 0.000 1.007 229 F CB 1.422 39.974 39.000 -0.745 0.000 1.194 229 F HN 0.297 8.597 8.300 -0.000 0.000 0.443 230 P HA 0.108 4.528 4.420 -0.000 0.000 0.274 230 P C -0.447 177.008 177.300 0.258 0.000 1.256 230 P CA -0.672 62.572 63.100 0.240 0.000 0.795 230 P CB 0.681 32.565 31.700 0.307 0.000 1.038 231 K N 1.464 122.031 120.400 0.278 0.000 2.355 231 K HA 0.171 4.492 4.320 0.001 0.000 0.270 231 K C -2.208 174.523 176.600 0.218 0.000 1.003 231 K CA -1.243 55.205 56.287 0.269 0.000 0.957 231 K CB -0.719 31.907 32.500 0.211 0.000 0.939 231 K HN 0.316 8.566 8.250 -0.000 0.000 0.482 232 P HA -0.012 4.408 4.420 -0.000 0.000 0.266 232 P C -0.606 176.707 177.300 0.022 0.000 1.195 232 P CA -0.062 63.087 63.100 0.082 0.000 0.768 232 P CB 0.490 32.195 31.700 0.008 0.000 0.838 233 V N 4.005 123.894 119.914 -0.041 0.000 2.370 233 V HA 0.476 4.596 4.120 0.001 0.000 0.279 233 V C 0.985 176.909 176.094 -0.284 0.000 1.029 233 V CA -0.179 62.035 62.300 -0.143 0.000 0.870 233 V CB 1.017 32.755 31.823 -0.142 0.000 0.984 233 V HN 0.699 8.889 8.190 -0.000 0.000 0.451 234 G N 3.630 112.042 108.800 -0.646 0.000 2.448 234 G HA2 0.627 4.588 3.960 0.001 0.000 0.285 234 G HA3 0.627 4.588 3.960 0.001 0.000 0.285 234 G C -0.711 173.319 174.900 -1.451 0.000 1.176 234 G CA -0.151 44.351 45.100 -0.996 0.000 0.852 234 G HN 1.089 9.379 8.290 -0.000 0.000 0.530 235 H N -1.833 116.633 119.070 -1.006 0.000 2.981 235 H HA 0.647 5.204 4.556 0.001 0.000 0.327 235 H C -1.584 173.743 175.328 -0.003 0.000 1.342 235 H CA -1.380 54.272 56.048 -0.660 0.000 1.123 235 H CB 1.345 30.921 29.762 -0.310 0.000 1.851 235 H HN 0.829 9.109 8.280 -0.000 0.000 0.531 236 Y N -0.434 120.069 120.300 0.339 0.000 2.534 236 Y HA 0.618 5.168 4.550 0.001 0.000 0.345 236 Y C -1.551 174.556 175.900 0.345 0.000 1.031 236 Y CA -1.098 57.206 58.100 0.340 0.000 1.022 236 Y CB 1.819 40.515 38.460 0.393 0.000 1.292 236 Y HN 1.036 9.316 8.280 -0.000 0.000 0.459 237 Q N 2.608 122.711 119.800 0.504 0.000 2.456 237 Q HA 0.556 4.896 4.340 0.001 0.000 0.284 237 Q C -1.222 174.930 176.000 0.254 0.000 1.061 237 Q CA -1.155 54.853 55.803 0.341 0.000 0.799 237 Q CB 2.610 31.523 28.738 0.290 0.000 1.445 237 Q HN 0.668 8.938 8.270 -0.000 0.000 0.411 238 I N 1.562 122.213 120.570 0.135 0.000 3.184 238 I HA 0.135 4.305 4.170 0.001 0.000 0.311 238 I C -0.675 175.481 176.117 0.065 0.000 1.243 238 I CA -0.012 61.315 61.300 0.044 0.000 1.393 238 I CB -2.085 35.865 38.000 -0.084 0.000 1.471 238 I HN 0.688 8.898 8.210 -0.000 0.000 0.540 239 D N 3.011 123.468 120.400 0.095 0.000 5.070 239 D HA -0.160 4.480 4.640 0.001 0.000 0.239 239 D C 1.210 177.570 176.300 0.099 0.000 1.194 239 D CA 1.329 55.383 54.000 0.089 0.000 1.284 239 D CB -0.354 40.476 40.800 0.051 0.000 0.729 239 D HN 0.766 9.136 8.370 -0.000 0.000 0.365 240 G N 2.484 111.355 108.800 0.117 0.000 2.383 240 G HA2 -0.255 3.705 3.960 0.001 0.000 0.229 240 G HA3 -0.255 3.705 3.960 0.001 0.000 0.229 240 G C -0.200 174.774 174.900 0.124 0.000 1.089 240 G CA 0.454 45.621 45.100 0.111 0.000 0.640 240 G HN 0.608 8.898 8.290 -0.000 0.000 0.510 241 D N 0.326 120.807 120.400 0.136 0.000 2.492 241 D HA 0.491 5.132 4.640 0.001 0.000 0.248 241 D C 0.003 176.405 176.300 0.170 0.000 1.101 241 D CA -0.454 53.633 54.000 0.147 0.000 0.840 241 D CB 1.309 42.193 40.800 0.140 0.000 1.209 241 D HN 0.467 8.837 8.370 -0.000 0.000 0.524 242 Y N 1.020 121.335 120.300 0.025 0.000 2.480 242 Y HA 0.119 4.670 4.550 0.001 0.000 0.338 242 Y C 0.355 176.249 175.900 -0.009 0.000 1.220 242 Y CA 0.462 58.552 58.100 -0.017 0.000 1.430 242 Y CB 0.853 39.210 38.460 -0.172 0.000 1.311 242 Y HN 0.443 8.723 8.280 -0.000 0.000 0.575 243 H N 2.613 121.290 119.070 -0.655 0.000 2.657 243 H HA 0.600 5.156 4.556 0.001 0.000 0.262 243 H C -0.649 173.990 175.328 -1.148 0.000 0.965 243 H CA 0.596 56.146 56.048 -0.831 0.000 1.184 243 H CB 0.874 30.414 29.762 -0.369 0.000 1.443 243 H HN 0.819 9.099 8.280 -0.000 0.000 0.462 244 A N -0.205 122.100 122.820 -0.859 0.000 2.549 244 A HA 0.659 4.980 4.320 0.001 0.000 0.297 244 A C -0.946 176.723 177.584 0.142 0.000 1.061 244 A CA -0.040 51.766 52.037 -0.385 0.000 0.690 244 A CB 1.316 20.136 19.000 -0.300 0.000 1.287 244 A HN 0.300 8.450 8.150 -0.000 0.000 0.402 245 S N -0.339 115.574 115.700 0.355 0.000 2.618 245 S HA 0.933 5.403 4.470 0.001 0.000 0.277 245 S C -1.069 173.734 174.600 0.339 0.000 1.138 245 S CA -0.381 57.885 58.200 0.109 0.000 0.844 245 S CB 1.231 64.398 63.200 -0.056 0.000 1.127 245 S HN 2.056 10.366 8.310 -0.000 0.000 0.474 246 W N -0.227 121.147 121.300 0.123 0.000 3.153 246 W HA 0.758 5.418 4.660 0.000 0.000 0.316 246 W C -1.655 174.924 176.519 0.100 0.000 1.255 246 W CA -0.740 56.673 57.345 0.114 0.000 1.192 246 W CB 0.990 30.526 29.460 0.127 0.000 1.400 246 W HN 0.901 9.081 8.180 -0.000 0.000 0.568 247 Q N 2.859 122.836 119.800 0.294 0.000 2.289 247 Q HA 0.480 4.821 4.340 0.001 0.000 0.270 247 Q C -2.731 173.420 176.000 0.252 0.000 1.038 247 Q CA -2.098 53.824 55.803 0.198 0.000 0.812 247 Q CB 3.663 32.471 28.738 0.117 0.000 1.300 247 Q HN 0.295 8.565 8.270 -0.000 0.000 0.427 248 P HA 0.269 4.689 4.420 -0.000 0.000 0.282 248 P C -1.091 176.377 177.300 0.279 0.000 1.259 248 P CA -0.253 62.969 63.100 0.204 0.000 0.826 248 P CB 1.225 33.023 31.700 0.163 0.000 1.064 249 A N 2.093 125.028 122.820 0.190 0.000 2.462 249 A HA 0.094 4.414 4.320 0.001 0.000 0.243 249 A C 0.449 178.172 177.584 0.232 0.000 1.076 249 A CA -0.215 51.973 52.037 0.252 0.000 0.773 249 A CB -0.460 18.592 19.000 0.088 0.000 1.010 249 A HN 0.541 8.691 8.150 -0.000 0.000 0.493 250 E N 1.726 122.091 120.200 0.274 0.000 1.892 250 E HA 0.290 4.640 4.350 0.001 0.000 0.271 250 E C -0.205 176.471 176.600 0.126 0.000 1.146 250 E CA 0.061 56.562 56.400 0.169 0.000 1.096 250 E CB -0.337 29.451 29.700 0.147 0.000 1.155 250 E HN 0.628 8.988 8.360 -0.000 0.000 0.458 251 I N -2.039 118.584 120.570 0.088 0.000 2.910 251 I HA 0.499 4.669 4.170 0.001 0.000 0.310 251 I C 0.459 176.588 176.117 0.021 0.000 1.043 251 I CA -1.201 60.130 61.300 0.053 0.000 1.053 251 I CB 1.782 39.797 38.000 0.027 0.000 1.242 251 I HN 0.026 8.236 8.210 -0.000 0.000 0.452 252 S N 1.358 117.062 115.700 0.007 0.000 2.600 252 S HA 0.178 4.648 4.470 0.001 0.000 0.265 252 S C 0.680 175.257 174.600 -0.038 0.000 1.325 252 S CA -0.328 57.868 58.200 -0.007 0.000 1.002 252 S CB 0.989 64.185 63.200 -0.006 0.000 0.921 252 S HN 0.794 9.104 8.310 -0.000 0.000 0.554 253 E N 0.752 120.934 120.200 -0.030 0.000 2.153 253 E HA -0.192 4.158 4.350 0.001 0.000 0.194 253 E C 1.882 178.434 176.600 -0.079 0.000 0.988 253 E CA 1.140 57.511 56.400 -0.048 0.000 0.811 253 E CB -0.160 29.530 29.700 -0.016 0.000 0.746 253 E HN 0.770 9.130 8.360 -0.000 0.000 0.466 254 K N 1.004 121.367 120.400 -0.061 0.000 2.057 254 K HA -0.106 4.214 4.320 0.001 0.000 0.206 254 K C 2.179 178.710 176.600 -0.115 0.000 1.050 254 K CA 1.087 57.331 56.287 -0.072 0.000 0.935 254 K CB -0.071 32.400 32.500 -0.049 0.000 0.715 254 K HN 0.069 8.319 8.250 -0.000 0.000 0.439 255 A N 1.369 124.124 122.820 -0.109 0.000 1.902 255 A HA -0.217 4.104 4.320 0.001 0.000 0.217 255 A C 2.033 179.481 177.584 -0.226 0.000 1.181 255 A CA 1.776 53.735 52.037 -0.131 0.000 0.623 255 A CB -0.613 18.343 19.000 -0.074 0.000 0.818 255 A HN 0.598 8.748 8.150 -0.000 0.000 0.443 256 E N -0.365 119.678 120.200 -0.261 0.000 2.058 256 E HA -0.257 4.094 4.350 0.001 0.000 0.194 256 E C 2.254 178.378 176.600 -0.792 0.000 0.997 256 E CA 1.358 57.465 56.400 -0.488 0.000 0.801 256 E CB -0.124 29.354 29.700 -0.371 0.000 0.746 256 E HN 0.552 8.912 8.360 -0.000 0.000 0.450 257 R N 0.159 120.363 120.500 -0.493 0.000 2.096 257 R HA -0.168 4.173 4.340 0.001 0.000 0.235 257 R C 2.312 178.375 176.300 -0.395 0.000 1.127 257 R CA 1.671 57.515 56.100 -0.427 0.000 0.968 257 R CB -0.111 30.109 30.300 -0.134 0.000 0.861 257 R HN 0.129 8.399 8.270 -0.000 0.000 0.440 258 E N -0.131 119.896 120.200 -0.288 0.000 2.106 258 E HA -0.108 4.243 4.350 0.001 0.000 0.192 258 E C 1.685 178.137 176.600 -0.247 0.000 0.984 258 E CA 0.988 57.262 56.400 -0.210 0.000 0.806 258 E CB -0.019 29.580 29.700 -0.169 0.000 0.750 258 E HN 0.058 8.418 8.360 -0.000 0.000 0.458 259 V N 0.323 120.037 119.914 -0.332 0.000 2.332 259 V HA -0.290 3.831 4.120 0.001 0.000 0.248 259 V C 1.917 177.863 176.094 -0.246 0.000 1.055 259 V CA 2.132 64.267 62.300 -0.275 0.000 1.038 259 V CB -0.691 30.944 31.823 -0.313 0.000 0.651 259 V HN 0.426 8.616 8.190 -0.000 0.000 0.450 260 Y N -0.304 119.706 120.300 -0.483 0.000 2.181 260 Y HA -0.242 4.308 4.550 0.001 0.000 0.288 260 Y C 2.838 178.324 175.900 -0.690 0.000 1.146 260 Y CA 1.448 58.995 58.100 -0.922 0.000 1.164 260 Y CB -0.256 37.194 38.460 -1.684 0.000 0.982 260 Y HN 0.090 8.370 8.280 -0.000 0.000 0.515 261 R N 0.963 121.292 120.500 -0.287 0.000 2.083 261 R HA -0.202 4.138 4.340 0.001 0.000 0.237 261 R C 2.077 178.380 176.300 0.005 0.000 1.137 261 R CA 1.923 58.022 56.100 -0.002 0.000 0.951 261 R CB -0.473 29.848 30.300 0.035 0.000 0.851 261 R HN 0.355 8.625 8.270 -0.000 0.000 0.434 262 I N 0.471 121.015 120.570 -0.043 0.000 2.252 262 I HA -0.237 3.933 4.170 0.001 0.000 0.245 262 I C 2.575 178.698 176.117 0.009 0.000 1.102 262 I CA 1.214 62.500 61.300 -0.023 0.000 1.385 262 I CB -0.353 37.616 38.000 -0.052 0.000 1.064 262 I HN 0.304 8.514 8.210 -0.000 0.000 0.414 263 A N 0.786 123.629 122.820 0.038 0.000 1.902 263 A HA -0.287 4.034 4.320 0.001 0.000 0.217 263 A C 2.276 179.954 177.584 0.157 0.000 1.181 263 A CA 2.159 54.265 52.037 0.115 0.000 0.623 263 A CB -0.506 18.653 19.000 0.265 0.000 0.818 263 A HN 0.276 8.426 8.150 -0.000 0.000 0.443 264 K N 0.055 120.609 120.400 0.257 0.000 2.063 264 K HA -0.113 4.207 4.320 0.001 0.000 0.208 264 K C 2.130 178.794 176.600 0.108 0.000 1.048 264 K CA 1.725 58.186 56.287 0.290 0.000 0.928 264 K CB -0.292 32.433 32.500 0.375 0.000 0.713 264 K HN 0.466 8.716 8.250 -0.000 0.000 0.442 265 R N -0.094 120.449 120.500 0.073 0.000 2.096 265 R HA -0.064 4.277 4.340 0.001 0.000 0.235 265 R C 2.346 178.642 176.300 -0.007 0.000 1.127 265 R CA 1.709 57.829 56.100 0.032 0.000 0.968 265 R CB -0.392 29.924 30.300 0.026 0.000 0.861 265 R HN 0.281 8.551 8.270 -0.000 0.000 0.440 266 I N 0.231 120.784 120.570 -0.030 0.000 2.233 266 I HA -0.218 3.953 4.170 0.001 0.000 0.243 266 I C 2.505 178.517 176.117 -0.174 0.000 1.093 266 I CA 1.582 62.837 61.300 -0.075 0.000 1.380 266 I CB -0.454 37.504 38.000 -0.071 0.000 1.067 266 I HN 0.287 8.497 8.210 -0.000 0.000 0.413 267 T N -2.625 111.765 114.554 -0.273 0.000 2.951 267 T HA -0.121 4.229 4.350 0.001 0.000 0.268 267 T C 1.452 175.969 174.700 -0.306 0.000 1.073 267 T CA 1.055 62.822 62.100 -0.556 0.000 1.134 267 T CB -0.345 68.089 68.868 -0.723 0.000 0.884 267 T HN 0.156 8.396 8.240 -0.000 0.000 0.479 268 D N 1.055 121.376 120.400 -0.132 0.000 2.144 268 D HA -0.006 4.634 4.640 0.001 0.000 0.200 268 D C 2.216 178.493 176.300 -0.037 0.000 0.978 268 D CA 0.547 54.513 54.000 -0.057 0.000 0.833 268 D CB -0.302 40.495 40.800 -0.004 0.000 0.961 268 D HN 0.310 8.680 8.370 -0.000 0.000 0.470 269 V N 0.650 120.541 119.914 -0.038 0.000 2.379 269 V HA -0.139 3.981 4.120 0.001 0.000 0.245 269 V C 2.511 178.615 176.094 0.016 0.000 1.044 269 V CA 0.930 63.230 62.300 0.000 0.000 1.036 269 V CB -0.264 31.565 31.823 0.010 0.000 0.664 269 V HN 0.194 8.384 8.190 -0.000 0.000 0.453 270 L N -0.322 120.887 121.223 -0.023 0.000 2.109 270 L HA 0.211 4.552 4.340 0.001 0.000 0.207 270 L C 1.520 178.456 176.870 0.110 0.000 1.086 270 L CA 1.064 55.941 54.840 0.062 0.000 0.760 270 L CB -1.001 41.113 42.059 0.091 0.000 0.910 270 L HN 0.564 8.794 8.230 -0.000 0.000 0.437 271 G N -0.860 107.965 108.800 0.042 0.000 2.698 271 G HA2 0.084 4.044 3.960 0.001 0.000 0.233 271 G HA3 0.084 4.044 3.960 0.001 0.000 0.233 271 G C 0.358 175.378 174.900 0.200 0.000 1.352 271 G CA -0.323 44.830 45.100 0.088 0.000 0.879 271 G HN 0.921 9.211 8.290 -0.000 0.000 0.567 272 G N -2.099 106.795 108.800 0.155 0.000 2.593 272 G HA2 0.217 4.177 3.960 0.001 0.000 0.237 272 G HA3 0.217 4.177 3.960 0.001 0.000 0.237 272 G C -0.203 174.786 174.900 0.149 0.000 1.312 272 G CA 0.301 45.514 45.100 0.188 0.000 0.896 272 G HN 1.730 10.020 8.290 -0.000 0.000 0.574 273 L N 0.513 121.850 121.223 0.189 0.000 2.370 273 L HA 0.802 5.143 4.340 0.001 0.000 0.266 273 L C 0.727 177.639 176.870 0.070 0.000 1.002 273 L CA -0.064 54.829 54.840 0.088 0.000 0.818 273 L CB 1.876 43.935 42.059 -0.000 0.000 1.325 273 L HN 2.350 10.580 8.230 -0.000 0.000 0.418 274 G N 1.774 110.606 108.800 0.052 0.000 2.347 274 G HA2 0.069 4.030 3.960 0.001 0.000 0.477 274 G HA3 0.069 4.030 3.960 0.001 0.000 0.477 274 G C -1.926 173.024 174.900 0.082 0.000 1.349 274 G CA -0.888 44.231 45.100 0.032 0.000 1.000 274 G HN 0.570 8.860 8.290 -0.000 0.000 0.605 275 I N -0.371 120.285 120.570 0.143 0.000 2.499 275 I HA 0.770 4.940 4.170 0.001 0.000 0.296 275 I C -0.578 175.340 176.117 -0.331 0.000 0.992 275 I CA -0.895 60.372 61.300 -0.055 0.000 1.297 275 I CB 0.651 38.573 38.000 -0.129 0.000 1.410 275 I HN 0.374 8.584 8.210 -0.000 0.000 0.507 276 F N 3.475 123.341 119.950 -0.140 0.000 2.563 276 F HA 0.556 5.083 4.527 0.001 0.000 0.316 276 F C 0.556 176.255 175.800 -0.169 0.000 1.076 276 F CA -0.862 57.053 58.000 -0.141 0.000 0.921 276 F CB 1.965 40.906 39.000 -0.099 0.000 1.209 276 F HN 0.353 8.653 8.300 -0.000 0.000 0.462 277 G N 1.889 110.659 108.800 -0.050 0.000 2.800 277 G HA2 0.510 4.470 3.960 0.001 0.000 0.340 277 G HA3 0.510 4.470 3.960 0.001 0.000 0.340 277 G C -1.251 173.548 174.900 -0.167 0.000 1.089 277 G CA -0.455 44.546 45.100 -0.165 0.000 1.144 277 G HN 0.431 8.721 8.290 -0.000 0.000 0.461 278 V N 3.170 123.038 119.914 -0.077 0.000 2.408 278 V HA 0.206 4.327 4.120 0.001 0.000 0.267 278 V C -0.148 175.868 176.094 -0.131 0.000 1.047 278 V CA -0.614 61.636 62.300 -0.083 0.000 0.937 278 V CB 1.079 32.887 31.823 -0.025 0.000 0.999 278 V HN 0.550 8.740 8.190 -0.000 0.000 0.472 279 E N 5.890 125.976 120.200 -0.189 0.000 2.174 279 E HA 0.627 4.977 4.350 0.001 0.000 0.282 279 E C -0.526 175.886 176.600 -0.313 0.000 0.992 279 E CA -0.131 56.136 56.400 -0.222 0.000 0.803 279 E CB 1.915 31.465 29.700 -0.249 0.000 1.090 279 E HN 0.597 8.957 8.360 -0.000 0.000 0.396 280 M N 1.805 121.213 119.600 -0.321 0.000 2.631 280 M HA 0.468 4.948 4.480 0.001 0.000 0.288 280 M C -1.070 175.013 176.300 -0.363 0.000 1.260 280 M CA -0.859 54.227 55.300 -0.357 0.000 0.842 280 M CB 1.679 34.187 32.600 -0.154 0.000 1.743 280 M HN 0.223 8.513 8.290 -0.000 0.000 0.461 281 F N 0.720 120.625 119.950 -0.076 0.000 2.469 281 F HA 0.721 5.248 4.527 0.001 0.000 0.332 281 F C -0.262 175.637 175.800 0.165 0.000 1.103 281 F CA -1.206 56.691 58.000 -0.173 0.000 0.979 281 F CB 1.510 40.431 39.000 -0.131 0.000 1.137 281 F HN 0.089 8.389 8.300 -0.000 0.000 0.463 282 V N 2.869 122.973 119.914 0.316 0.000 2.588 282 V HA 0.494 4.614 4.120 0.001 0.000 0.304 282 V C -0.649 175.679 176.094 0.391 0.000 1.042 282 V CA -1.135 61.354 62.300 0.314 0.000 0.877 282 V CB 2.052 33.957 31.823 0.137 0.000 0.996 282 V HN 0.685 8.875 8.190 -0.000 0.000 0.425 283 K N 3.207 123.868 120.400 0.434 0.000 2.640 283 K HA 0.586 4.907 4.320 0.001 0.000 0.245 283 K C 0.598 177.323 176.600 0.208 0.000 0.962 283 K CA 0.444 56.942 56.287 0.351 0.000 0.896 283 K CB 1.329 34.117 32.500 0.480 0.000 1.147 283 K HN 1.051 9.301 8.250 -0.000 0.000 0.445 284 G N 3.696 112.578 108.800 0.138 0.000 2.591 284 G HA2 -0.330 3.630 3.960 0.001 0.000 0.298 284 G HA3 -0.330 3.630 3.960 0.001 0.000 0.298 284 G C 0.224 175.149 174.900 0.042 0.000 1.195 284 G CA 0.518 45.665 45.100 0.078 0.000 0.989 284 G HN 0.712 9.002 8.290 -0.000 0.000 0.551 285 D N 1.160 121.563 120.400 0.004 0.000 2.339 285 D HA 0.178 4.818 4.640 0.001 0.000 0.217 285 D C 1.131 177.375 176.300 -0.094 0.000 1.050 285 D CA 0.658 54.634 54.000 -0.040 0.000 0.856 285 D CB 0.356 41.130 40.800 -0.043 0.000 0.922 285 D HN 0.363 8.733 8.370 -0.000 0.000 0.518 286 K N 0.877 121.208 120.400 -0.115 0.000 2.205 286 K HA 0.347 4.667 4.320 0.001 0.000 0.279 286 K C -0.955 175.430 176.600 -0.358 0.000 1.027 286 K CA -0.299 55.786 56.287 -0.335 0.000 0.932 286 K CB 1.144 33.347 32.500 -0.495 0.000 1.032 286 K HN -0.322 7.928 8.250 -0.000 0.000 0.466 287 V N 4.772 124.403 119.914 -0.472 0.000 2.638 287 V HA 0.492 4.613 4.120 0.001 0.000 0.306 287 V C -1.005 174.940 176.094 -0.248 0.000 1.052 287 V CA -0.927 61.253 62.300 -0.201 0.000 0.885 287 V CB 1.467 33.215 31.823 -0.124 0.000 0.999 287 V HN 0.711 8.901 8.190 -0.000 0.000 0.424 288 W N 2.148 123.460 121.300 0.020 0.000 2.632 288 W HA 0.744 5.404 4.660 0.001 0.000 0.328 288 W C 0.127 176.567 176.519 -0.132 0.000 1.044 288 W CA -0.852 56.498 57.345 0.008 0.000 1.225 288 W CB 2.240 31.781 29.460 0.135 0.000 1.396 288 W HN 0.664 8.844 8.180 -0.000 0.000 0.499 289 A N 2.219 125.081 122.820 0.069 0.000 2.401 289 A HA 0.134 4.454 4.320 0.001 0.000 0.259 289 A C 0.564 178.037 177.584 -0.185 0.000 1.103 289 A CA 0.174 52.159 52.037 -0.086 0.000 0.789 289 A CB 0.610 19.578 19.000 -0.053 0.000 1.035 289 A HN 0.699 8.849 8.150 -0.000 0.000 0.491 290 N N 0.802 119.275 118.700 -0.378 0.000 2.724 290 N HA 0.102 4.842 4.740 0.001 0.000 0.226 290 N C 0.376 175.734 175.510 -0.254 0.000 1.030 290 N CA 1.269 54.043 53.050 -0.460 0.000 1.038 290 N CB 0.328 38.229 38.487 -0.977 0.000 1.475 290 N HN 0.851 9.231 8.380 -0.000 0.000 0.472 291 E N -1.691 118.368 120.200 -0.236 0.000 2.377 291 E HA 0.483 4.833 4.350 0.001 0.000 0.266 291 E C -1.669 174.841 176.600 -0.151 0.000 1.111 291 E CA -1.063 55.243 56.400 -0.157 0.000 0.889 291 E CB 1.759 31.378 29.700 -0.134 0.000 1.644 291 E HN -0.087 8.273 8.360 -0.000 0.000 0.464 292 V N 0.719 120.562 119.914 -0.118 0.000 2.924 292 V HA 0.545 4.665 4.120 0.001 0.000 0.300 292 V C -1.820 174.222 176.094 -0.086 0.000 1.227 292 V CA 0.123 62.363 62.300 -0.100 0.000 0.954 292 V CB 2.188 33.997 31.823 -0.022 0.000 1.055 292 V HN 0.919 9.109 8.190 -0.000 0.000 0.429 293 S N 6.698 122.317 115.700 -0.133 0.000 2.449 293 S HA 0.673 5.143 4.470 0.001 0.000 0.310 293 S C -2.561 171.981 174.600 -0.096 0.000 1.096 293 S CA -1.528 56.601 58.200 -0.119 0.000 1.095 293 S CB 1.878 64.980 63.200 -0.164 0.000 1.007 293 S HN 0.763 9.073 8.310 -0.000 0.000 0.474 294 P HA 0.213 4.633 4.420 -0.000 0.000 0.220 294 P C -0.466 176.553 177.300 -0.468 0.000 1.778 294 P CA -0.167 62.750 63.100 -0.306 0.000 0.912 294 P CB -0.799 30.817 31.700 -0.139 0.000 1.861 295 R N -1.915 118.328 120.500 -0.429 0.000 2.780 295 R HA 0.525 4.865 4.340 0.001 0.000 0.280 295 R C -3.465 172.565 176.300 -0.451 0.000 1.016 295 R CA -2.158 53.638 56.100 -0.506 0.000 0.854 295 R CB -0.724 29.390 30.300 -0.310 0.000 1.293 295 R HN -0.276 7.994 8.270 -0.000 0.000 0.483 296 P HA 0.031 4.451 4.420 -0.000 0.000 0.267 296 P C -1.153 176.052 177.300 -0.159 0.000 1.200 296 P CA 0.285 63.163 63.100 -0.370 0.000 0.772 296 P CB 0.284 31.807 31.700 -0.295 0.000 0.855 297 H N 0.901 119.798 119.070 -0.288 0.000 2.622 297 H HA 0.183 4.739 4.556 0.001 0.000 0.363 297 H C 0.757 175.919 175.328 -0.276 0.000 1.151 297 H CA -0.598 55.295 56.048 -0.257 0.000 1.184 297 H CB 1.060 30.653 29.762 -0.282 0.000 1.643 297 H HN 0.334 8.614 8.280 -0.000 0.000 0.531 298 D N 0.981 120.943 120.400 -0.730 0.000 2.123 298 D HA -0.235 4.405 4.640 0.001 0.000 0.196 298 D C 1.653 177.419 176.300 -0.890 0.000 0.992 298 D CA 2.137 55.764 54.000 -0.622 0.000 0.833 298 D CB -1.087 39.418 40.800 -0.493 0.000 0.954 298 D HN 0.668 9.038 8.370 -0.000 0.000 0.455 299 T N -2.613 111.253 114.554 -1.148 0.000 2.849 299 T HA -0.056 4.294 4.350 0.001 0.000 0.270 299 T C 2.132 176.514 174.700 -0.530 0.000 1.066 299 T CA 1.261 62.732 62.100 -1.048 0.000 1.130 299 T CB -1.174 67.214 68.868 -0.800 0.000 0.864 299 T HN 0.312 8.552 8.240 -0.000 0.000 0.481 300 G N 0.492 109.050 108.800 -0.404 0.000 2.776 300 G HA2 0.093 4.054 3.960 0.001 0.000 0.209 300 G HA3 0.093 4.054 3.960 0.001 0.000 0.209 300 G C 1.359 176.092 174.900 -0.278 0.000 1.145 300 G CA 0.031 44.932 45.100 -0.331 0.000 0.791 300 G HN 0.488 8.778 8.290 -0.000 0.000 0.530 301 M N 0.041 119.552 119.600 -0.149 0.000 2.446 301 M HA -0.045 4.435 4.480 0.001 0.000 0.263 301 M C 2.521 178.852 176.300 0.053 0.000 1.066 301 M CA 0.566 55.914 55.300 0.079 0.000 1.087 301 M CB -0.076 32.620 32.600 0.160 0.000 1.406 301 M HN 0.189 8.479 8.290 -0.000 0.000 0.459 302 V N 0.734 120.638 119.914 -0.018 0.000 2.568 302 V HA -0.237 3.884 4.120 0.001 0.000 0.253 302 V C 2.279 178.366 176.094 -0.011 0.000 1.072 302 V CA 2.509 64.831 62.300 0.038 0.000 1.084 302 V CB -0.701 31.146 31.823 0.040 0.000 0.676 302 V HN 0.686 8.876 8.190 -0.000 0.000 0.469 303 T N -2.207 112.253 114.554 -0.158 0.000 3.051 303 T HA -0.074 4.277 4.350 0.001 0.000 0.269 303 T C 1.722 176.377 174.700 -0.076 0.000 1.127 303 T CA 1.343 63.266 62.100 -0.295 0.000 1.107 303 T CB -0.542 67.901 68.868 -0.709 0.000 0.898 303 T HN 0.501 8.741 8.240 -0.000 0.000 0.517 304 L N -0.119 121.122 121.223 0.031 0.000 2.265 304 L HA 0.108 4.449 4.340 0.001 0.000 0.215 304 L C 2.855 179.753 176.870 0.047 0.000 1.117 304 L CA 1.214 56.111 54.840 0.094 0.000 0.782 304 L CB -0.391 41.758 42.059 0.149 0.000 0.914 304 L HN 0.492 8.722 8.230 -0.000 0.000 0.441 305 A N -1.422 121.429 122.820 0.052 0.000 2.141 305 A HA 0.030 4.350 4.320 0.001 0.000 0.201 305 A C 2.194 179.797 177.584 0.032 0.000 1.344 305 A CA 0.561 52.592 52.037 -0.011 0.000 0.971 305 A CB -0.046 19.036 19.000 0.136 0.000 1.035 305 A HN 0.311 8.461 8.150 -0.000 0.000 0.480 306 S N -0.614 115.146 115.700 0.100 0.000 2.496 306 S HA 0.109 4.579 4.470 0.001 0.000 0.224 306 S C 0.644 175.410 174.600 0.276 0.000 0.996 306 S CA -0.024 58.273 58.200 0.161 0.000 0.927 306 S CB -0.507 62.790 63.200 0.163 0.000 0.774 306 S HN 0.656 8.966 8.310 -0.000 0.000 0.524 307 H N 2.225 121.355 119.070 0.101 0.000 2.525 307 H HA 0.437 4.993 4.556 0.001 0.000 0.340 307 H C -2.419 172.998 175.328 0.147 0.000 1.168 307 H CA -2.636 53.514 56.048 0.171 0.000 1.247 307 H CB 1.222 31.128 29.762 0.239 0.000 1.568 307 H HN 0.227 8.507 8.280 -0.000 0.000 0.536 308 P HA 0.044 4.464 4.420 -0.000 0.000 0.273 308 P C -2.635 174.833 177.300 0.281 0.000 1.250 308 P CA -1.488 61.745 63.100 0.222 0.000 0.793 308 P CB -0.143 31.660 31.700 0.172 0.000 1.011 309 P HA -0.017 4.403 4.420 -0.000 0.000 0.265 309 P C 0.870 178.204 177.300 0.057 0.000 1.193 309 P CA 1.053 64.211 63.100 0.096 0.000 0.765 309 P CB -0.202 31.522 31.700 0.040 0.000 0.823 310 G N 1.712 110.473 108.800 -0.064 0.000 2.162 310 G HA2 -0.283 3.677 3.960 0.001 0.000 0.260 310 G HA3 -0.283 3.677 3.960 0.001 0.000 0.260 310 G C 0.182 174.722 174.900 -0.599 0.000 0.976 310 G CA -0.094 44.814 45.100 -0.320 0.000 0.655 310 G HN 0.496 8.786 8.290 -0.000 0.000 0.533 311 F N 1.513 121.505 119.950 0.069 0.000 2.815 311 F HA 0.343 4.870 4.527 0.001 0.000 0.323 311 F C 1.466 177.311 175.800 0.075 0.000 1.151 311 F CA 0.032 58.059 58.000 0.046 0.000 1.191 311 F CB 0.471 39.600 39.000 0.214 0.000 1.069 311 F HN 0.314 8.614 8.300 -0.000 0.000 0.514 312 S N -0.101 115.696 115.700 0.162 0.000 2.606 312 S HA -0.014 4.456 4.470 0.001 0.000 0.257 312 S C 1.503 176.013 174.600 -0.150 0.000 1.327 312 S CA 0.038 58.256 58.200 0.029 0.000 0.984 312 S CB 0.632 63.877 63.200 0.075 0.000 0.941 312 S HN 0.567 8.877 8.310 -0.000 0.000 0.576 313 E N 0.224 120.149 120.200 -0.457 0.000 2.209 313 E HA -0.184 4.166 4.350 0.001 0.000 0.196 313 E C 1.228 177.504 176.600 -0.540 0.000 0.993 313 E CA 1.253 57.317 56.400 -0.561 0.000 0.819 313 E CB -0.670 28.582 29.700 -0.746 0.000 0.745 313 E HN 0.686 9.046 8.360 -0.000 0.000 0.477 314 F N 1.717 121.615 119.950 -0.087 0.000 2.163 314 F HA 0.106 4.633 4.527 0.001 0.000 0.297 314 F C 2.640 178.414 175.800 -0.043 0.000 1.094 314 F CA 0.876 58.839 58.000 -0.063 0.000 1.290 314 F CB -0.714 38.239 39.000 -0.079 0.000 1.017 314 F HN 0.141 8.441 8.300 -0.000 0.000 0.483 315 A N 0.213 123.068 122.820 0.057 0.000 1.929 315 A HA -0.022 4.298 4.320 0.001 0.000 0.216 315 A C 2.219 179.752 177.584 -0.085 0.000 1.176 315 A CA 1.021 53.033 52.037 -0.041 0.000 0.628 315 A CB -1.010 17.915 19.000 -0.125 0.000 0.816 315 A HN 0.375 8.525 8.150 -0.000 0.000 0.444 316 L N -1.581 119.583 121.223 -0.098 0.000 2.046 316 L HA -0.192 4.148 4.340 0.001 0.000 0.208 316 L C 2.659 179.490 176.870 -0.064 0.000 1.077 316 L CA 1.729 56.490 54.840 -0.133 0.000 0.747 316 L CB -0.662 41.265 42.059 -0.220 0.000 0.896 316 L HN 0.546 8.776 8.230 -0.000 0.000 0.432 317 H N 0.066 119.048 119.070 -0.148 0.000 2.321 317 H HA -0.213 4.344 4.556 0.001 0.000 0.300 317 H C 1.931 177.213 175.328 -0.078 0.000 1.087 317 H CA 1.943 57.917 56.048 -0.122 0.000 1.319 317 H CB -0.128 29.561 29.762 -0.121 0.000 1.379 317 H HN 0.113 8.393 8.280 -0.000 0.000 0.501 318 L N 0.608 121.814 121.223 -0.028 0.000 2.012 318 L HA -0.132 4.208 4.340 0.001 0.000 0.210 318 L C 2.387 179.207 176.870 -0.084 0.000 1.073 318 L CA 1.736 56.528 54.840 -0.082 0.000 0.748 318 L CB -0.535 41.506 42.059 -0.029 0.000 0.891 318 L HN 0.140 8.370 8.230 -0.000 0.000 0.431 319 R N -0.555 119.899 120.500 -0.076 0.000 2.091 319 R HA -0.146 4.194 4.340 0.001 0.000 0.238 319 R C 2.293 178.570 176.300 -0.038 0.000 1.136 319 R CA 1.407 57.472 56.100 -0.058 0.000 0.959 319 R CB -0.743 29.511 30.300 -0.078 0.000 0.856 319 R HN 0.568 8.838 8.270 -0.000 0.000 0.437 320 A N 0.832 123.612 122.820 -0.066 0.000 1.883 320 A HA -0.160 4.161 4.320 0.001 0.000 0.217 320 A C 2.302 179.859 177.584 -0.045 0.000 1.186 320 A CA 1.976 53.987 52.037 -0.042 0.000 0.624 320 A CB -0.794 18.184 19.000 -0.037 0.000 0.822 320 A HN 0.292 8.442 8.150 -0.000 0.000 0.444 321 V N -2.617 117.246 119.914 -0.085 0.000 3.217 321 V HA 0.079 4.199 4.120 0.001 0.000 0.264 321 V C 1.801 177.977 176.094 0.137 0.000 1.135 321 V CA 1.469 63.799 62.300 0.050 0.000 1.142 321 V CB -0.616 31.108 31.823 -0.166 0.000 0.754 321 V HN 0.410 8.600 8.190 -0.000 0.000 0.484 322 L N 1.191 122.446 121.223 0.053 0.000 2.591 322 L HA 0.457 4.798 4.340 0.001 0.000 0.228 322 L C 1.913 178.846 176.870 0.104 0.000 1.133 322 L CA 0.771 55.654 54.840 0.072 0.000 0.880 322 L CB -0.347 41.732 42.059 0.033 0.000 1.033 322 L HN 0.612 8.842 8.230 -0.000 0.000 0.450 323 G N 0.432 109.312 108.800 0.134 0.000 2.141 323 G HA2 -0.253 3.707 3.960 0.001 0.000 0.242 323 G HA3 -0.253 3.707 3.960 0.001 0.000 0.242 323 G C 0.126 175.206 174.900 0.301 0.000 0.982 323 G CA -0.190 45.102 45.100 0.320 0.000 0.662 323 G HN 0.204 8.494 8.290 -0.000 0.000 0.527 324 L N 1.510 122.831 121.223 0.163 0.000 2.421 324 L HA 0.526 4.866 4.340 0.001 0.000 0.263 324 L C -1.188 175.776 176.870 0.157 0.000 1.122 324 L CA -2.247 52.671 54.840 0.129 0.000 0.804 324 L CB 0.907 43.001 42.059 0.057 0.000 1.150 324 L HN -0.022 8.208 8.230 -0.000 0.000 0.457 325 P HA 0.331 4.751 4.420 -0.000 0.000 0.276 325 P C -1.015 176.331 177.300 0.076 0.000 1.261 325 P CA -0.215 62.996 63.100 0.185 0.000 0.800 325 P CB 1.325 33.129 31.700 0.173 0.000 1.066 326 I N 0.753 121.315 120.570 -0.013 0.000 2.548 326 I HA 0.274 4.445 4.170 0.001 0.000 0.287 326 I C -2.477 173.666 176.117 0.044 0.000 1.103 326 I CA -2.565 58.690 61.300 -0.076 0.000 1.049 326 I CB 2.293 39.948 38.000 -0.575 0.000 1.232 326 I HN 0.121 8.331 8.210 -0.000 0.000 0.429 327 P HA 0.387 4.807 4.420 -0.000 0.000 0.271 327 P C -0.186 177.105 177.300 -0.015 0.000 1.218 327 P CA -0.125 62.995 63.100 0.032 0.000 0.780 327 P CB 0.950 32.624 31.700 -0.043 0.000 0.901 328 G N 0.410 109.178 108.800 -0.053 0.000 2.645 328 G HA2 0.518 4.479 3.960 0.001 0.000 0.292 328 G HA3 0.518 4.479 3.960 0.001 0.000 0.292 328 G C -1.863 172.948 174.900 -0.149 0.000 1.415 328 G CA -0.648 44.372 45.100 -0.134 0.000 0.785 328 G HN 0.422 8.712 8.290 -0.000 0.000 0.483 329 E N -0.359 119.732 120.200 -0.183 0.000 2.224 329 E HA 0.284 4.634 4.350 0.001 0.000 0.265 329 E C -1.420 175.140 176.600 -0.065 0.000 0.878 329 E CA -0.532 55.822 56.400 -0.077 0.000 0.759 329 E CB 2.351 32.008 29.700 -0.072 0.000 1.164 329 E HN 0.453 8.813 8.360 -0.000 0.000 0.414 330 W N 2.346 123.661 121.300 0.024 0.000 2.304 330 W HA 0.311 4.971 4.660 0.001 0.000 0.313 330 W C -0.342 176.201 176.519 0.040 0.000 1.323 330 W CA -0.233 57.136 57.345 0.041 0.000 1.223 330 W CB 0.875 30.350 29.460 0.025 0.000 1.237 330 W HN 0.173 8.353 8.180 -0.000 0.000 0.535 331 V N 4.846 124.932 119.914 0.287 0.000 2.488 331 V HA 0.099 4.220 4.120 0.001 0.000 0.293 331 V C -0.638 175.599 176.094 0.238 0.000 1.027 331 V CA -1.094 61.333 62.300 0.210 0.000 0.862 331 V CB 1.381 33.295 31.823 0.152 0.000 1.008 331 V HN 0.625 8.815 8.190 -0.000 0.000 0.428 332 D N 4.187 124.695 120.400 0.180 0.000 2.708 332 D HA -0.175 4.465 4.640 0.001 0.000 0.236 332 D C 1.331 177.685 176.300 0.090 0.000 1.146 332 D CA 2.029 56.111 54.000 0.137 0.000 0.662 332 D CB -1.129 39.768 40.800 0.161 0.000 1.059 332 D HN 1.477 9.847 8.370 -0.000 0.000 0.428 333 G N -1.547 107.322 108.800 0.114 0.000 2.176 333 G HA2 -0.354 3.607 3.960 0.001 0.000 0.253 333 G HA3 -0.354 3.607 3.960 0.001 0.000 0.253 333 G C 0.031 174.935 174.900 0.007 0.000 0.979 333 G CA 0.348 45.458 45.100 0.016 0.000 0.641 333 G HN 0.491 8.781 8.290 -0.000 0.000 0.530 334 Y N -0.175 120.304 120.300 0.298 0.000 2.364 334 Y HA 0.629 5.179 4.550 0.001 0.000 0.340 334 Y C 0.706 176.535 175.900 -0.119 0.000 0.975 334 Y CA -1.037 57.116 58.100 0.088 0.000 1.089 334 Y CB 1.428 39.829 38.460 -0.100 0.000 1.192 334 Y HN 0.104 8.384 8.280 -0.000 0.000 0.454 335 R N 4.750 125.020 120.500 -0.385 0.000 2.210 335 R HA 0.437 4.777 4.340 0.001 0.000 0.338 335 R C -1.376 174.761 176.300 -0.271 0.000 1.062 335 R CA -0.136 55.449 56.100 -0.859 0.000 0.902 335 R CB 0.068 29.500 30.300 -1.445 0.000 1.050 335 R HN 0.712 8.982 8.270 -0.000 0.000 0.461 336 L N 4.266 125.370 121.223 -0.199 0.000 2.344 336 L HA 0.463 4.804 4.340 0.001 0.000 0.272 336 L C -0.442 176.365 176.870 -0.106 0.000 1.035 336 L CA -0.912 53.857 54.840 -0.118 0.000 0.807 336 L CB 1.110 43.112 42.059 -0.095 0.000 1.237 336 L HN 0.514 8.744 8.230 -0.000 0.000 0.442 337 F N 3.283 123.118 119.950 -0.192 0.000 2.347 337 F HA 0.478 5.006 4.527 0.000 0.000 0.366 337 F C -2.143 173.507 175.800 -0.250 0.000 1.107 337 F CA -2.486 55.360 58.000 -0.256 0.000 1.058 337 F CB 1.065 39.895 39.000 -0.284 0.000 1.236 337 F HN 0.183 8.483 8.300 -0.000 0.000 0.456 338 P HA 0.023 4.443 4.420 -0.000 0.000 0.265 338 P C -0.266 176.760 177.300 -0.457 0.000 1.193 338 P CA 0.077 62.886 63.100 -0.485 0.000 0.765 338 P CB 0.567 31.987 31.700 -0.467 0.000 0.823 339 M N 3.858 123.365 119.600 -0.155 0.000 2.255 339 M HA 0.124 4.604 4.480 0.001 0.000 0.336 339 M C 0.639 176.927 176.300 -0.020 0.000 1.135 339 M CA -0.387 54.917 55.300 0.007 0.000 1.145 339 M CB 0.756 33.432 32.600 0.126 0.000 1.473 339 M HN 0.240 8.530 8.290 -0.000 0.000 0.462 340 L N 4.889 126.139 121.223 0.046 0.000 2.145 340 L HA 0.476 4.816 4.340 0.001 0.000 0.201 340 L C -0.046 176.854 176.870 0.049 0.000 1.075 340 L CA 1.312 56.164 54.840 0.020 0.000 0.773 340 L CB 0.410 42.487 42.059 0.030 0.000 0.936 340 L HN 0.689 8.919 8.230 -0.000 0.000 0.451 341 I N -1.113 119.512 120.570 0.092 0.000 2.842 341 I HA 0.384 4.554 4.170 0.001 0.000 0.297 341 I C -2.628 173.589 176.117 0.167 0.000 1.380 341 I CA -2.077 59.294 61.300 0.119 0.000 1.018 341 I CB 2.215 40.287 38.000 0.121 0.000 1.311 341 I HN -0.124 8.085 8.210 -0.000 0.000 0.439 342 P HA 0.361 4.781 4.420 -0.000 0.000 0.269 342 P C -1.271 176.177 177.300 0.246 0.000 1.209 342 P CA -0.006 63.212 63.100 0.197 0.000 0.776 342 P CB 0.873 32.675 31.700 0.170 0.000 0.876 343 A N 1.420 124.395 122.820 0.258 0.000 2.588 343 A HA 0.898 5.219 4.320 0.001 0.000 0.290 343 A C -1.650 176.110 177.584 0.292 0.000 1.136 343 A CA -0.295 51.919 52.037 0.294 0.000 0.681 343 A CB 1.432 20.617 19.000 0.309 0.000 1.282 343 A HN 0.537 8.687 8.150 -0.000 0.000 0.421 344 A N -0.510 122.480 122.820 0.282 0.000 2.606 344 A HA 0.946 5.267 4.320 0.001 0.000 0.293 344 A C -0.363 177.373 177.584 0.254 0.000 1.082 344 A CA 0.167 52.389 52.037 0.308 0.000 0.685 344 A CB 1.184 20.359 19.000 0.291 0.000 1.284 344 A HN 2.318 10.468 8.150 -0.000 0.000 0.408 345 T N -1.339 113.374 114.554 0.265 0.000 2.916 345 T HA 0.776 5.126 4.350 0.001 0.000 0.292 345 T C -1.017 173.795 174.700 0.187 0.000 1.055 345 T CA -0.528 61.704 62.100 0.220 0.000 1.009 345 T CB 1.755 70.770 68.868 0.245 0.000 1.118 345 T HN 0.988 9.228 8.240 -0.000 0.000 0.497 346 H N 1.009 120.086 119.070 0.011 0.000 2.856 346 H HA 0.502 5.058 4.556 0.001 0.000 0.355 346 H C -0.375 174.833 175.328 -0.201 0.000 1.079 346 H CA -0.458 55.514 56.048 -0.126 0.000 1.240 346 H CB 2.019 31.700 29.762 -0.135 0.000 1.701 346 H HN 0.865 9.145 8.280 -0.000 0.000 0.527 347 V N 3.149 122.764 119.914 -0.497 0.000 3.051 347 V HA 0.362 4.482 4.120 0.001 0.000 0.306 347 V C 0.470 176.499 176.094 -0.109 0.000 1.083 347 V CA -0.377 61.725 62.300 -0.329 0.000 1.104 347 V CB 0.647 32.142 31.823 -0.548 0.000 1.027 347 V HN 0.582 8.772 8.190 -0.000 0.000 0.483 348 I N 3.468 123.977 120.570 -0.102 0.000 2.405 348 I HA 0.447 4.618 4.170 0.001 0.000 0.280 348 I C 0.097 176.200 176.117 -0.023 0.000 1.027 348 I CA -0.348 60.934 61.300 -0.031 0.000 1.161 348 I CB 0.998 38.956 38.000 -0.070 0.000 1.300 348 I HN 0.712 8.922 8.210 -0.000 0.000 0.463 349 K N 4.868 125.273 120.400 0.010 0.000 2.156 349 K HA 0.751 5.071 4.320 0.001 0.000 0.254 349 K C -0.353 176.261 176.600 0.024 0.000 0.950 349 K CA -0.793 55.500 56.287 0.010 0.000 0.849 349 K CB 2.518 35.038 32.500 0.032 0.000 1.100 349 K HN 0.548 8.798 8.250 -0.000 0.000 0.434 350 A N 2.050 124.852 122.820 -0.029 0.000 2.401 350 A HA 0.127 4.447 4.320 0.001 0.000 0.259 350 A C 0.410 177.972 177.584 -0.037 0.000 1.103 350 A CA -0.082 51.920 52.037 -0.058 0.000 0.789 350 A CB 0.220 19.137 19.000 -0.138 0.000 1.035 350 A HN 0.808 8.958 8.150 -0.000 0.000 0.491 351 K N 0.819 121.187 120.400 -0.054 0.000 2.358 351 K HA 0.238 4.558 4.320 0.001 0.000 0.197 351 K C 0.068 176.546 176.600 -0.204 0.000 1.025 351 K CA 0.459 56.703 56.287 -0.070 0.000 1.104 351 K CB 0.334 32.828 32.500 -0.010 0.000 0.855 351 K HN 0.727 8.977 8.250 -0.000 0.000 0.531 352 V N -2.754 117.026 119.914 -0.224 0.000 3.167 352 V HA 0.618 4.738 4.120 0.001 0.000 0.310 352 V C -0.436 175.571 176.094 -0.145 0.000 1.207 352 V CA -1.061 61.090 62.300 -0.249 0.000 1.059 352 V CB 1.716 33.315 31.823 -0.375 0.000 1.079 352 V HN 0.041 8.231 8.190 -0.000 0.000 0.446 353 S N -0.612 115.021 115.700 -0.111 0.000 2.715 353 S HA 1.056 5.526 4.470 0.001 0.000 0.307 353 S C 0.067 174.624 174.600 -0.072 0.000 1.119 353 S CA -0.143 58.020 58.200 -0.061 0.000 0.937 353 S CB 1.307 64.507 63.200 0.000 0.000 1.150 353 S HN 2.951 11.261 8.310 -0.000 0.000 0.521 354 G N -0.483 108.292 108.800 -0.041 0.000 2.357 354 G HA2 0.182 4.142 3.960 0.001 0.000 0.643 354 G HA3 0.182 4.142 3.960 0.001 0.000 0.643 354 G C -1.624 173.269 174.900 -0.012 0.000 1.358 354 G CA -0.996 44.097 45.100 -0.011 0.000 0.986 354 G HN 0.857 9.147 8.290 -0.000 0.000 0.620 355 Y N 0.746 120.999 120.300 -0.078 0.000 2.300 355 Y HA 0.434 4.985 4.550 0.000 0.000 0.328 355 Y C 1.481 177.329 175.900 -0.086 0.000 1.270 355 Y CA 1.350 59.410 58.100 -0.066 0.000 1.352 355 Y CB 1.289 39.722 38.460 -0.045 0.000 1.286 355 Y HN 1.411 9.691 8.280 -0.000 0.000 0.536 356 S N 1.835 117.458 115.700 -0.128 0.000 3.697 356 S HA -0.139 4.331 4.470 0.001 0.000 0.388 356 S C -2.608 171.907 174.600 -0.141 0.000 0.941 356 S CA -0.374 57.792 58.200 -0.057 0.000 1.247 356 S CB -1.893 61.349 63.200 0.070 0.000 0.904 356 S HN 0.469 8.779 8.310 -0.000 0.000 0.518 357 P HA 0.319 4.739 4.420 -0.000 0.000 0.267 357 P C 0.360 177.422 177.300 -0.396 0.000 1.200 357 P CA 0.166 63.052 63.100 -0.357 0.000 0.772 357 P CB 0.526 32.001 31.700 -0.375 0.000 0.855 358 R N 1.396 121.546 120.500 -0.584 0.000 2.744 358 R HA 0.645 4.986 4.340 0.001 0.000 0.279 358 R C -1.056 174.956 176.300 -0.479 0.000 0.977 358 R CA -0.605 55.289 56.100 -0.343 0.000 0.906 358 R CB 1.495 31.710 30.300 -0.142 0.000 1.197 358 R HN 0.350 8.620 8.270 -0.000 0.000 0.463 359 F N 1.630 121.736 119.950 0.260 0.000 2.529 359 F HA 0.529 5.057 4.527 0.000 0.000 0.320 359 F C 0.321 176.243 175.800 0.204 0.000 1.118 359 F CA -0.875 57.277 58.000 0.254 0.000 0.915 359 F CB 1.645 40.697 39.000 0.086 0.000 1.161 359 F HN 0.399 8.699 8.300 -0.000 0.000 0.445 360 R N 0.264 120.891 120.500 0.211 0.000 2.950 360 R HA 0.896 5.236 4.340 0.001 0.000 0.253 360 R C 0.312 176.571 176.300 -0.069 0.000 1.168 360 R CA -0.670 55.379 56.100 -0.086 0.000 1.014 360 R CB 1.606 31.562 30.300 -0.573 0.000 1.228 360 R HN 0.914 9.184 8.270 -0.000 0.000 0.487 361 G N -0.125 108.607 108.800 -0.113 0.000 2.141 361 G HA2 -0.218 3.742 3.960 0.001 0.000 0.231 361 G HA3 -0.218 3.742 3.960 0.001 0.000 0.231 361 G C 0.463 175.340 174.900 -0.038 0.000 0.984 361 G CA 0.261 45.316 45.100 -0.076 0.000 0.660 361 G HN 0.433 8.723 8.290 -0.000 0.000 0.525 362 L N 0.030 121.239 121.223 -0.023 0.000 2.201 362 L HA -0.021 4.320 4.340 0.001 0.000 0.212 362 L C 2.861 179.717 176.870 -0.022 0.000 1.105 362 L CA 1.113 55.945 54.840 -0.013 0.000 0.775 362 L CB -0.577 41.485 42.059 0.004 0.000 0.913 362 L HN 0.237 8.467 8.230 -0.000 0.000 0.440 363 V N 0.267 120.163 119.914 -0.030 0.000 2.287 363 V HA -0.304 3.816 4.120 0.001 0.000 0.248 363 V C 2.517 178.593 176.094 -0.030 0.000 1.053 363 V CA 1.878 64.162 62.300 -0.028 0.000 1.027 363 V CB -0.462 31.341 31.823 -0.032 0.000 0.646 363 V HN 0.435 8.625 8.190 -0.000 0.000 0.447 364 K N -0.079 120.299 120.400 -0.036 0.000 2.031 364 K HA -0.018 4.303 4.320 0.001 0.000 0.205 364 K C 2.348 178.925 176.600 -0.037 0.000 1.049 364 K CA 1.282 57.547 56.287 -0.036 0.000 0.939 364 K CB -0.417 32.061 32.500 -0.038 0.000 0.717 364 K HN 0.440 8.690 8.250 -0.000 0.000 0.438 365 A N 1.466 124.265 122.820 -0.035 0.000 1.908 365 A HA -0.123 4.197 4.320 0.001 0.000 0.218 365 A C 1.909 179.467 177.584 -0.044 0.000 1.181 365 A CA 1.334 53.347 52.037 -0.040 0.000 0.627 365 A CB -0.578 18.402 19.000 -0.032 0.000 0.818 365 A HN 0.189 8.339 8.150 -0.000 0.000 0.445 366 L N -0.308 120.895 121.223 -0.034 0.000 2.612 366 L HA 0.083 4.424 4.340 0.001 0.000 0.230 366 L C 1.635 178.490 176.870 -0.026 0.000 1.140 366 L CA 0.251 55.074 54.840 -0.028 0.000 0.896 366 L CB 0.058 42.107 42.059 -0.016 0.000 1.065 366 L HN 0.237 8.467 8.230 -0.000 0.000 0.447 367 S N -0.828 114.853 115.700 -0.032 0.000 2.535 367 S HA 0.088 4.558 4.470 0.001 0.000 0.214 367 S C 0.793 175.366 174.600 -0.044 0.000 0.980 367 S CA -0.218 57.964 58.200 -0.030 0.000 0.907 367 S CB 0.366 63.550 63.200 -0.027 0.000 0.790 367 S HN 0.040 8.350 8.310 -0.000 0.000 0.510 368 V N 4.666 124.543 119.914 -0.062 0.000 2.479 368 V HA 0.155 4.276 4.120 0.001 0.000 0.281 368 V C -2.187 173.839 176.094 -0.114 0.000 1.031 368 V CA -1.574 60.673 62.300 -0.087 0.000 1.038 368 V CB 0.068 31.828 31.823 -0.105 0.000 0.981 368 V HN 0.169 8.359 8.190 -0.000 0.000 0.478 369 P HA 0.207 4.627 4.420 -0.000 0.000 0.272 369 P C 0.176 177.320 177.300 -0.259 0.000 1.223 369 P CA -0.154 62.874 63.100 -0.119 0.000 0.784 369 P CB 0.205 31.861 31.700 -0.074 0.000 0.923 370 N N -1.556 116.959 118.700 -0.308 0.000 2.735 370 N HA -0.156 4.584 4.740 0.001 0.000 0.248 370 N C -0.407 174.133 175.510 -1.616 0.000 1.083 370 N CA 1.542 54.076 53.050 -0.859 0.000 0.703 370 N CB -1.743 36.322 38.487 -0.704 0.000 1.005 370 N HN 0.636 9.016 8.380 -0.000 0.000 0.550 371 A N -2.018 120.192 122.820 -1.017 0.000 2.610 371 A HA 0.869 5.189 4.320 0.001 0.000 0.291 371 A C -0.116 177.334 177.584 -0.223 0.000 1.086 371 A CA 0.250 51.823 52.037 -0.773 0.000 0.677 371 A CB 2.222 20.980 19.000 -0.402 0.000 1.278 371 A HN 0.240 8.390 8.150 -0.000 0.000 0.414 372 T N -1.405 113.143 114.554 -0.011 0.000 2.661 372 T HA 0.653 5.003 4.350 0.001 0.000 0.305 372 T C -1.584 173.145 174.700 0.049 0.000 1.441 372 T CA 0.369 62.518 62.100 0.081 0.000 0.999 372 T CB 1.047 70.041 68.868 0.210 0.000 1.650 372 T HN 2.220 10.460 8.240 -0.000 0.000 0.489 373 V N 0.187 120.109 119.914 0.012 0.000 3.040 373 V HA 0.906 5.026 4.120 0.001 0.000 0.312 373 V C -1.288 174.769 176.094 -0.062 0.000 1.115 373 V CA -1.067 61.205 62.300 -0.047 0.000 0.998 373 V CB 2.090 33.837 31.823 -0.126 0.000 1.042 373 V HN 0.897 9.087 8.190 -0.000 0.000 0.433 374 R N 2.618 123.051 120.500 -0.111 0.000 2.513 374 R HA 0.689 5.030 4.340 0.001 0.000 0.301 374 R C -1.531 174.560 176.300 -0.348 0.000 0.968 374 R CA -0.582 55.454 56.100 -0.107 0.000 0.872 374 R CB 2.130 32.465 30.300 0.058 0.000 1.177 374 R HN 0.786 9.056 8.270 -0.000 0.000 0.444 375 L N 3.392 124.410 121.223 -0.341 0.000 2.313 375 L HA 0.391 4.732 4.340 0.001 0.000 0.283 375 L C 0.551 177.296 176.870 -0.209 0.000 1.013 375 L CA -0.614 53.898 54.840 -0.547 0.000 0.816 375 L CB 1.000 42.670 42.059 -0.648 0.000 1.236 375 L HN 0.500 8.730 8.230 -0.000 0.000 0.419 376 F N 1.372 121.245 119.950 -0.128 0.000 2.502 376 F HA 0.094 4.621 4.527 0.000 0.000 0.298 376 F C 1.917 177.692 175.800 -0.040 0.000 1.111 376 F CA 0.421 58.377 58.000 -0.074 0.000 1.445 376 F CB -0.616 38.352 39.000 -0.053 0.000 1.081 376 F HN 0.788 9.088 8.300 -0.000 0.000 0.558 377 G N 0.295 109.180 108.800 0.141 0.000 2.143 377 G HA2 -0.316 3.645 3.960 0.001 0.000 0.249 377 G HA3 -0.316 3.645 3.960 0.001 0.000 0.249 377 G C 0.392 175.357 174.900 0.108 0.000 0.981 377 G CA -0.227 44.937 45.100 0.105 0.000 0.665 377 G HN 0.347 8.637 8.290 -0.000 0.000 0.528 378 K N 0.871 121.352 120.400 0.135 0.000 2.416 378 K HA 0.259 4.579 4.320 0.001 0.000 0.283 378 K C -0.925 175.661 176.600 -0.024 0.000 1.037 378 K CA -0.711 55.631 56.287 0.092 0.000 0.995 378 K CB 1.334 33.878 32.500 0.073 0.000 0.938 378 K HN 0.102 8.352 8.250 -0.000 0.000 0.475 379 P HA -0.111 4.309 4.420 -0.000 0.000 0.233 379 P C -0.365 176.522 177.300 -0.688 0.000 1.167 379 P CA 1.061 63.965 63.100 -0.326 0.000 0.770 379 P CB 0.423 31.981 31.700 -0.237 0.000 0.837 380 E N -0.627 119.296 120.200 -0.460 0.000 2.356 380 E HA 0.604 4.955 4.350 0.001 0.000 0.275 380 E C -1.612 174.835 176.600 -0.255 0.000 0.904 380 E CA -1.042 55.107 56.400 -0.419 0.000 0.757 380 E CB 2.202 31.710 29.700 -0.320 0.000 1.232 380 E HN -0.104 8.256 8.360 -0.000 0.000 0.442 381 A N 2.383 125.076 122.820 -0.211 0.000 2.337 381 A HA 0.740 5.060 4.320 0.001 0.000 0.331 381 A C -1.593 175.909 177.584 -0.137 0.000 1.137 381 A CA -0.522 51.374 52.037 -0.236 0.000 0.807 381 A CB 0.594 19.463 19.000 -0.217 0.000 1.250 381 A HN 0.572 8.722 8.150 -0.000 0.000 0.468 382 Y N -1.037 119.217 120.300 -0.077 0.000 2.553 382 Y HA 0.617 5.168 4.550 0.001 0.000 0.347 382 Y C -0.596 175.275 175.900 -0.050 0.000 1.019 382 Y CA -1.991 56.070 58.100 -0.065 0.000 1.032 382 Y CB 0.231 38.655 38.460 -0.061 0.000 1.284 382 Y HN 0.392 8.672 8.280 -0.000 0.000 0.466 383 V N 3.245 123.301 119.914 0.237 0.000 2.509 383 V HA 0.308 4.429 4.120 0.001 0.000 0.297 383 V C 1.216 177.460 176.094 0.250 0.000 1.014 383 V CA 1.896 64.281 62.300 0.141 0.000 1.127 383 V CB -0.009 31.864 31.823 0.084 0.000 0.925 383 V HN 1.500 9.690 8.190 -0.000 0.000 0.480 384 G N 4.065 112.938 108.800 0.120 0.000 2.195 384 G HA2 -0.270 3.691 3.960 0.001 0.000 0.246 384 G HA3 -0.270 3.691 3.960 0.001 0.000 0.246 384 G C 0.474 175.419 174.900 0.076 0.000 0.984 384 G CA 0.243 45.432 45.100 0.147 0.000 0.633 384 G HN 0.726 9.016 8.290 -0.000 0.000 0.525 385 R N 1.013 121.368 120.500 -0.241 0.000 2.489 385 R HA 0.372 4.712 4.340 0.001 0.000 0.287 385 R C 0.738 176.920 176.300 -0.198 0.000 1.053 385 R CA -0.441 55.310 56.100 -0.582 0.000 1.036 385 R CB 0.254 29.750 30.300 -1.340 0.000 0.966 385 R HN 0.313 8.583 8.270 -0.000 0.000 0.432 386 R N 5.127 125.595 120.500 -0.054 0.000 2.296 386 R HA 0.065 4.405 4.340 0.001 0.000 0.323 386 R C 0.447 176.819 176.300 0.120 0.000 1.067 386 R CA -0.045 56.090 56.100 0.057 0.000 0.946 386 R CB 0.455 30.853 30.300 0.164 0.000 0.991 386 R HN 0.714 8.984 8.270 -0.000 0.000 0.448 387 L N 3.229 124.461 121.223 0.015 0.000 2.556 387 L HA 0.360 4.700 4.340 0.001 0.000 0.226 387 L C 1.004 177.559 176.870 -0.525 0.000 1.089 387 L CA 0.243 55.079 54.840 -0.007 0.000 0.864 387 L CB 0.714 42.882 42.059 0.181 0.000 1.067 387 L HN 0.855 9.085 8.230 -0.000 0.000 0.477 388 G N 0.542 108.846 108.800 -0.828 0.000 2.428 388 G HA2 0.530 4.490 3.960 0.001 0.000 0.304 388 G HA3 0.530 4.490 3.960 0.001 0.000 0.304 388 G C -1.837 172.624 174.900 -0.731 0.000 1.303 388 G CA -0.465 43.774 45.100 -1.435 0.000 0.825 388 G HN -0.008 8.282 8.290 -0.000 0.000 0.484 389 I N -2.966 117.325 120.570 -0.464 0.000 2.894 389 I HA 0.869 5.040 4.170 0.001 0.000 0.302 389 I C -0.124 175.949 176.117 -0.073 0.000 1.188 389 I CA -1.488 59.743 61.300 -0.115 0.000 1.014 389 I CB 2.193 40.253 38.000 0.100 0.000 1.242 389 I HN 0.933 9.143 8.210 -0.000 0.000 0.430 390 A N 5.260 128.075 122.820 -0.008 0.000 2.312 390 A HA 0.873 5.194 4.320 0.001 0.000 0.326 390 A C -0.915 176.714 177.584 0.076 0.000 1.172 390 A CA -0.558 51.482 52.037 0.005 0.000 0.821 390 A CB 1.083 20.071 19.000 -0.020 0.000 1.166 390 A HN 0.749 8.899 8.150 -0.000 0.000 0.493 391 L N 1.477 122.763 121.223 0.104 0.000 2.385 391 L HA 0.764 5.105 4.340 0.001 0.000 0.273 391 L C 0.030 176.989 176.870 0.148 0.000 0.990 391 L CA -0.323 54.639 54.840 0.205 0.000 0.821 391 L CB 2.070 44.314 42.059 0.308 0.000 1.279 391 L HN 0.889 9.119 8.230 -0.000 0.000 0.412 392 A N 2.896 125.802 122.820 0.144 0.000 2.515 392 A HA 0.831 5.151 4.320 0.001 0.000 0.298 392 A C -2.135 175.524 177.584 0.125 0.000 1.059 392 A CA -0.465 51.480 52.037 -0.155 0.000 0.698 392 A CB 1.271 20.164 19.000 -0.179 0.000 1.289 392 A HN 0.722 8.872 8.150 -0.000 0.000 0.404 393 W N 0.374 121.709 121.300 0.058 0.000 2.950 393 W HA 0.837 5.497 4.660 0.000 0.000 0.340 393 W C -1.049 175.501 176.519 0.052 0.000 1.139 393 W CA -0.567 56.817 57.345 0.065 0.000 1.188 393 W CB 1.296 30.796 29.460 0.066 0.000 1.426 393 W HN 0.833 9.013 8.180 -0.000 0.000 0.531 394 D N -0.060 120.475 120.400 0.224 0.000 2.683 394 D HA 0.174 4.815 4.640 0.001 0.000 0.246 394 D C 0.406 176.788 176.300 0.136 0.000 1.238 394 D CA -0.722 53.352 54.000 0.123 0.000 0.759 394 D CB 1.874 42.695 40.800 0.035 0.000 1.349 394 D HN 0.453 8.823 8.370 -0.000 0.000 0.426 395 K N -0.061 120.402 120.400 0.105 0.000 2.209 395 K HA -0.062 4.258 4.320 0.001 0.000 0.204 395 K C 0.039 176.685 176.600 0.077 0.000 1.048 395 K CA 0.830 57.171 56.287 0.090 0.000 0.940 395 K CB 0.062 32.603 32.500 0.068 0.000 0.729 395 K HN 0.286 8.536 8.250 -0.000 0.000 0.451 396 D N 0.322 120.759 120.400 0.062 0.000 2.392 396 D HA 0.006 4.647 4.640 0.001 0.000 0.228 396 D C 0.636 176.965 176.300 0.050 0.000 1.074 396 D CA -0.218 53.810 54.000 0.046 0.000 0.838 396 D CB 1.817 42.631 40.800 0.023 0.000 1.067 396 D HN -0.231 8.139 8.370 -0.000 0.000 0.511 397 V N 4.516 124.469 119.914 0.065 0.000 2.568 397 V HA -0.199 3.921 4.120 0.001 0.000 0.253 397 V C 1.690 177.776 176.094 -0.012 0.000 1.072 397 V CA 1.973 64.318 62.300 0.075 0.000 1.084 397 V CB -0.163 31.741 31.823 0.135 0.000 0.676 397 V HN 0.562 8.752 8.190 -0.000 0.000 0.469 398 E N -0.724 119.448 120.200 -0.047 0.000 2.152 398 E HA -0.124 4.226 4.350 0.001 0.000 0.192 398 E C 2.192 178.750 176.600 -0.069 0.000 0.983 398 E CA 1.233 57.572 56.400 -0.102 0.000 0.818 398 E CB -0.064 29.582 29.700 -0.089 0.000 0.758 398 E HN 0.552 8.912 8.360 -0.000 0.000 0.467 399 V N 1.447 121.340 119.914 -0.035 0.000 2.358 399 V HA -0.221 3.899 4.120 0.001 0.000 0.246 399 V C 2.328 178.401 176.094 -0.036 0.000 1.047 399 V CA 1.761 64.040 62.300 -0.035 0.000 1.035 399 V CB -0.522 31.287 31.823 -0.023 0.000 0.658 399 V HN 0.293 8.483 8.190 -0.000 0.000 0.452 400 A N -0.165 122.651 122.820 -0.007 0.000 1.902 400 A HA -0.238 4.082 4.320 0.001 0.000 0.217 400 A C 2.269 179.866 177.584 0.021 0.000 1.181 400 A CA 1.971 54.016 52.037 0.014 0.000 0.623 400 A CB -0.415 18.643 19.000 0.097 0.000 0.818 400 A HN 0.533 8.683 8.150 -0.000 0.000 0.443 401 K N -0.565 119.838 120.400 0.004 0.000 2.009 401 K HA -0.152 4.168 4.320 0.001 0.000 0.210 401 K C 2.337 178.938 176.600 0.001 0.000 1.049 401 K CA 1.744 58.031 56.287 0.001 0.000 0.929 401 K CB -0.225 32.167 32.500 -0.181 0.000 0.714 401 K HN 0.380 8.630 8.250 -0.000 0.000 0.440 402 R N 0.880 121.357 120.500 -0.039 0.000 2.081 402 R HA -0.140 4.201 4.340 0.001 0.000 0.235 402 R C 2.360 178.625 176.300 -0.058 0.000 1.131 402 R CA 1.464 57.540 56.100 -0.041 0.000 0.960 402 R CB -0.147 30.125 30.300 -0.047 0.000 0.856 402 R HN 0.140 8.410 8.270 -0.000 0.000 0.436 403 K N 0.538 120.899 120.400 -0.064 0.000 2.057 403 K HA -0.117 4.204 4.320 0.001 0.000 0.207 403 K C 2.036 178.577 176.600 -0.098 0.000 1.049 403 K CA 1.417 57.648 56.287 -0.093 0.000 0.931 403 K CB -0.080 32.347 32.500 -0.123 0.000 0.714 403 K HN 0.157 8.407 8.250 -0.000 0.000 0.440 404 A N 1.187 123.975 122.820 -0.054 0.000 1.902 404 A HA -0.215 4.106 4.320 0.001 0.000 0.217 404 A C 2.015 179.541 177.584 -0.097 0.000 1.181 404 A CA 1.794 53.817 52.037 -0.025 0.000 0.623 404 A CB -0.577 18.473 19.000 0.084 0.000 0.818 404 A HN 0.603 8.752 8.150 -0.000 0.000 0.443 405 E N -0.664 119.452 120.200 -0.141 0.000 2.077 405 E HA -0.237 4.114 4.350 0.001 0.000 0.193 405 E C 2.023 178.285 176.600 -0.564 0.000 0.989 405 E CA 1.455 57.552 56.400 -0.505 0.000 0.800 405 E CB -0.229 29.307 29.700 -0.274 0.000 0.746 405 E HN 0.651 9.011 8.360 -0.000 0.000 0.452 406 M N 0.234 119.680 119.600 -0.257 0.000 2.086 406 M HA -0.166 4.314 4.480 0.001 0.000 0.261 406 M C 2.114 178.337 176.300 -0.129 0.000 1.067 406 M CA 1.462 56.673 55.300 -0.148 0.000 1.116 406 M CB 0.023 32.572 32.600 -0.086 0.000 1.348 406 M HN 0.096 8.386 8.290 -0.000 0.000 0.407 407 V N 0.876 120.709 119.914 -0.135 0.000 2.343 407 V HA -0.255 3.866 4.120 0.001 0.000 0.247 407 V C 2.695 178.731 176.094 -0.097 0.000 1.051 407 V CA 1.950 64.190 62.300 -0.100 0.000 1.036 407 V CB -1.411 30.353 31.823 -0.098 0.000 0.654 407 V HN 0.671 8.861 8.190 -0.000 0.000 0.451 408 A N -1.002 121.719 122.820 -0.165 0.000 1.902 408 A HA -0.272 4.048 4.320 0.001 0.000 0.217 408 A C 1.979 179.538 177.584 -0.042 0.000 1.181 408 A CA 2.016 53.972 52.037 -0.134 0.000 0.623 408 A CB -0.928 17.946 19.000 -0.210 0.000 0.818 408 A HN 0.745 8.895 8.150 -0.000 0.000 0.443 409 H N -1.471 117.513 119.070 -0.143 0.000 2.521 409 H HA 0.091 4.648 4.556 0.001 0.000 0.286 409 H C 1.728 177.028 175.328 -0.046 0.000 1.034 409 H CA 0.847 56.843 56.048 -0.086 0.000 1.278 409 H CB -0.107 29.595 29.762 -0.099 0.000 1.386 409 H HN 0.444 8.724 8.280 -0.000 0.000 0.567 410 M N 0.543 120.180 119.600 0.062 0.000 2.595 410 M HA 0.070 4.551 4.480 0.001 0.000 0.248 410 M C 0.028 176.342 176.300 0.022 0.000 1.119 410 M CA 0.616 55.930 55.300 0.022 0.000 1.079 410 M CB 0.569 33.164 32.600 -0.009 0.000 1.472 410 M HN 0.109 8.399 8.290 -0.000 0.000 0.501 411 I N 0.729 121.331 120.570 0.053 0.000 2.353 411 I HA 0.167 4.337 4.170 0.001 0.000 0.293 411 I C -0.052 176.141 176.117 0.127 0.000 0.992 411 I CA -0.324 61.028 61.300 0.087 0.000 1.268 411 I CB 1.177 39.241 38.000 0.106 0.000 1.387 411 I HN 0.087 8.297 8.210 -0.000 0.000 0.478 412 E N 6.524 126.805 120.200 0.134 0.000 2.221 412 E HA 0.692 5.043 4.350 0.001 0.000 0.268 412 E C -1.222 175.604 176.600 0.377 0.000 0.933 412 E CA -0.809 55.715 56.400 0.207 0.000 0.809 412 E CB 2.658 32.432 29.700 0.124 0.000 1.190 412 E HN 0.401 8.761 8.360 -0.000 0.000 0.406 413 L N 1.264 122.703 121.223 0.359 0.000 2.354 413 L HA 0.692 5.032 4.340 0.001 0.000 0.264 413 L C -0.133 176.720 176.870 -0.029 0.000 1.008 413 L CA -1.024 53.892 54.840 0.127 0.000 0.819 413 L CB 1.863 43.875 42.059 -0.077 0.000 1.339 413 L HN 0.336 8.566 8.230 -0.000 0.000 0.420 414 R N 0.171 120.368 120.500 -0.505 0.000 2.764 414 R HA 0.693 5.033 4.340 0.001 0.000 0.270 414 R C -1.275 174.681 176.300 -0.574 0.000 1.014 414 R CA -0.188 55.478 56.100 -0.724 0.000 0.904 414 R CB 2.772 32.016 30.300 -1.760 0.000 1.236 414 R HN 0.920 9.190 8.270 -0.000 0.000 0.466 415 T N -1.932 112.368 114.554 -0.423 0.000 2.773 415 T HA 0.420 4.770 4.350 0.001 0.000 0.278 415 T C 1.108 175.662 174.700 -0.243 0.000 1.011 415 T CA -0.840 61.083 62.100 -0.295 0.000 1.014 415 T CB 1.535 70.284 68.868 -0.199 0.000 1.293 415 T HN 0.589 8.829 8.240 -0.000 0.000 0.554 416 R N 0.422 120.842 120.500 -0.133 0.000 2.105 416 R HA -0.043 4.297 4.340 0.001 0.000 0.239 416 R C 1.286 177.531 176.300 -0.092 0.000 1.135 416 R CA 1.773 57.820 56.100 -0.088 0.000 0.967 416 R CB -0.319 29.974 30.300 -0.012 0.000 0.861 416 R HN 0.785 9.055 8.270 -0.000 0.000 0.442 417 S N -0.776 114.872 115.700 -0.086 0.000 2.661 417 S HA 0.212 4.682 4.470 0.001 0.000 0.245 417 S C -0.208 174.341 174.600 -0.084 0.000 1.117 417 S CA -0.613 57.544 58.200 -0.071 0.000 1.091 417 S CB 0.726 63.900 63.200 -0.042 0.000 0.887 417 S HN 0.188 8.498 8.310 -0.000 0.000 0.491 418 S N -0.008 115.613 115.700 -0.130 0.000 2.685 418 S HA 0.698 5.168 4.470 0.001 0.000 0.282 418 S C -1.674 172.842 174.600 -0.140 0.000 1.159 418 S CA -0.752 57.380 58.200 -0.114 0.000 0.833 418 S CB 1.504 64.615 63.200 -0.149 0.000 1.151 418 S HN 0.152 8.462 8.310 -0.000 0.000 0.485 419 D N -0.243 120.146 120.400 -0.018 0.000 2.440 419 D HA 0.360 5.000 4.640 0.001 0.000 0.258 419 D C -0.830 175.500 176.300 0.050 0.000 1.092 419 D CA -0.297 53.694 54.000 -0.014 0.000 1.016 419 D CB 0.514 41.356 40.800 0.070 0.000 1.141 419 D HN 0.626 8.996 8.370 -0.000 0.000 0.552 420 W N 0.181 121.517 121.300 0.060 0.000 2.216 420 W HA 0.211 4.871 4.660 0.000 0.000 0.326 420 W C 0.438 176.963 176.519 0.009 0.000 1.319 420 W CA 0.261 57.638 57.345 0.053 0.000 1.213 420 W CB 0.351 29.802 29.460 -0.014 0.000 1.171 420 W HN 0.184 8.364 8.180 -0.000 0.000 0.557 421 H N 0.453 119.659 119.070 0.226 0.000 2.851 421 H HA 0.218 4.774 4.556 0.001 0.000 0.372 421 H C -0.320 175.084 175.328 0.125 0.000 1.158 421 H CA -0.928 55.196 56.048 0.126 0.000 1.159 421 H CB 1.364 31.163 29.762 0.062 0.000 1.757 421 H HN 0.318 8.598 8.280 -0.000 0.000 0.546 422 D N 0.000 120.500 120.400 0.167 0.000 6.856 422 D HA 0.000 4.640 4.640 0.001 0.000 0.175 422 D CA 0.000 54.067 54.000 0.112 0.000 0.868 422 D CB 0.000 40.822 40.800 0.037 0.000 0.688 422 D HN 0.000 8.370 8.370 -0.000 0.000 0.683