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 1oqy_7_A DATA FIRST_RESID 1 DATA SEQUENCE SAVTITLKTL QQQTFKIRME PDETVKVLKE KIEAEKGRDA FPVAGQKLIY DATA SEQUENCE AGKILSDDVP IRDYRIDEKN FVVVMVTKTK AGQGTSAPPE ASPTAAPESS DATA SEQUENCE TSFPPAPTSG MSHPPPAARE DKSPSEESAP TTSPESVSGS VPSSGSSGRE DATA SEQUENCE EDAASTLVTG SEYETMLTEI MSMGYERERV VAALRASYNN PHRAVEYLLT DATA SEQUENCE GIPGSPEPEH GSVQESQVSE QPATEAAGEN PLEFLRDQPQ FQNMRQVIQQ DATA SEQUENCE NPALLPALLQ QLGQENPQLL QQISRHQEQF IQMLNEPPGE LADISDVEGE DATA SEQUENCE VGAIGEEAPQ MNYIQVTPQE KEAIERLKAL GFPESLVIQA YFACEKNENL DATA SEQUENCE AANFLLSQNF DDE VARS RESID RESNAME ATOMNAME SS_SHIFT SHIFT RC_SHIFT HM_SHIFT EF_SHIFT SIGMA FORMAT %4d %4s %4s %9.3f %9.3f %9.3f %9.3f %9.3f %9.3f 1 S HA 0.000 4.468 4.470 -0.003 0.000 0.327 1 S C 0.000 174.597 174.600 -0.004 0.000 1.055 1 S CA 0.000 58.198 58.200 -0.004 0.000 1.107 1 S CB 0.000 63.197 63.200 -0.005 0.000 0.593 2 A N 2.172 124.990 122.820 -0.004 0.000 2.637 2 A HA 0.456 4.773 4.320 -0.005 0.000 0.258 2 A C -2.085 175.494 177.584 -0.008 0.000 1.250 2 A CA -0.934 51.100 52.037 -0.005 0.000 0.931 2 A CB 1.852 20.851 19.000 -0.002 0.000 1.488 2 A HN 0.224 8.372 8.150 -0.003 0.000 0.464 3 V N -1.927 117.981 119.914 -0.009 0.000 2.781 3 V HA 0.176 4.288 4.120 -0.013 0.000 0.289 3 V C -2.321 173.763 176.094 -0.017 0.000 1.275 3 V CA -0.517 61.774 62.300 -0.015 0.000 0.936 3 V CB 2.498 34.308 31.823 -0.022 0.000 1.074 3 V HN 0.376 8.562 8.190 -0.007 0.000 0.444 4 T N 10.189 124.734 114.554 -0.014 0.000 2.851 4 T HA 0.123 4.677 4.350 -0.008 -0.209 0.298 4 T C -1.031 173.651 174.700 -0.030 0.000 0.977 4 T CA 0.459 62.551 62.100 -0.013 0.000 1.126 4 T CB 0.377 69.243 68.868 -0.004 0.000 0.916 4 T HN 0.191 8.425 8.240 -0.011 0.000 0.529 5 I N 4.631 125.177 120.570 -0.039 0.000 2.354 5 I HA 0.128 4.249 4.170 -0.082 0.000 0.292 5 I C -0.374 175.692 176.117 -0.085 0.000 0.989 5 I CA -2.253 59.005 61.300 -0.070 0.000 1.188 5 I CB 2.655 40.612 38.000 -0.072 0.000 1.342 5 I HN 0.164 8.221 8.210 -0.026 0.137 0.457 6 T N 9.612 124.122 114.554 -0.073 0.000 2.743 6 T HA 0.014 4.456 4.350 -0.104 -0.154 0.290 6 T C -1.190 173.411 174.700 -0.165 0.000 0.908 6 T CA -0.276 61.779 62.100 -0.075 0.000 1.092 6 T CB -0.234 68.664 68.868 0.051 0.000 0.882 6 T HN 0.453 8.656 8.240 -0.062 0.000 0.531 7 L N 7.407 128.342 121.223 -0.479 0.000 2.275 7 L HA 0.272 4.415 4.340 -0.330 0.000 0.288 7 L C -1.969 174.344 176.870 -0.929 0.000 1.046 7 L CA -1.444 52.957 54.840 -0.732 0.000 0.805 7 L CB 1.860 43.255 42.059 -1.105 0.000 1.193 7 L HN -0.100 7.702 8.230 -0.558 0.093 0.426 8 K N 6.663 126.878 120.400 -0.308 0.000 2.259 8 K HA 0.444 4.797 4.320 -0.147 -0.121 0.249 8 K C -1.489 175.192 176.600 0.135 0.000 0.942 8 K CA -2.679 53.543 56.287 -0.108 0.000 0.816 8 K CB 3.665 36.111 32.500 -0.090 0.000 1.155 8 K HN 0.976 9.029 8.250 -0.115 0.128 0.428 9 T N 1.275 115.981 114.554 0.253 0.000 2.855 9 T HA 0.371 5.020 4.350 0.277 -0.133 0.281 9 T C 1.138 175.913 174.700 0.125 0.000 1.007 9 T CA -2.435 59.833 62.100 0.280 0.000 1.009 9 T CB 2.233 71.375 68.868 0.457 0.000 0.983 9 T HN 0.014 8.390 8.240 0.226 0.000 0.455 10 L N 4.838 126.107 121.223 0.076 0.000 2.211 10 L HA -0.464 3.894 4.340 0.030 0.000 0.216 10 L C 0.867 177.751 176.870 0.023 0.000 1.092 10 L CA 3.403 58.261 54.840 0.031 0.000 0.767 10 L CB 0.110 42.170 42.059 0.002 0.000 0.894 10 L HN -0.072 8.204 8.230 0.076 0.000 0.437 11 Q N -2.315 117.509 119.800 0.040 0.000 2.541 11 Q HA -0.215 4.134 4.340 0.015 0.000 0.215 11 Q C -0.207 175.807 176.000 0.025 0.000 0.977 11 Q CA 1.072 56.895 55.803 0.033 0.000 0.934 11 Q CB -0.140 28.632 28.738 0.057 0.000 0.988 11 Q HN -0.468 7.799 8.270 0.064 0.041 0.521 12 Q N -5.253 114.557 119.800 0.016 0.000 2.493 12 Q HA -0.387 3.909 4.340 -0.073 0.000 0.276 12 Q C -1.915 174.078 176.000 -0.012 0.000 1.041 12 Q CA 1.507 57.294 55.803 -0.028 0.000 0.988 12 Q CB -1.344 27.378 28.738 -0.027 0.000 1.287 12 Q HN 0.479 8.552 8.270 0.029 0.214 0.530 13 Q N -1.419 118.414 119.800 0.055 0.000 2.381 13 Q HA 0.266 4.640 4.340 0.056 0.000 0.263 13 Q C -0.938 175.199 176.000 0.228 0.000 1.030 13 Q CA -1.379 54.488 55.803 0.106 0.000 0.772 13 Q CB 1.954 30.763 28.738 0.118 0.000 1.232 13 Q HN -0.644 7.680 8.270 0.090 0.000 0.476 14 T N 5.355 119.988 114.554 0.131 0.000 2.929 14 T HA 0.778 5.311 4.350 0.023 -0.169 0.284 14 T C -0.837 174.041 174.700 0.296 0.000 1.014 14 T CA -0.592 61.564 62.100 0.093 0.000 1.051 14 T CB 1.494 70.278 68.868 -0.140 0.000 1.028 14 T HN 0.213 8.478 8.240 0.042 0.000 0.485 15 F N 0.426 120.372 119.950 -0.005 0.000 3.754 15 F HA 0.543 5.064 4.527 -0.009 0.000 0.316 15 F C -2.222 173.586 175.800 0.013 0.000 1.326 15 F CA -2.172 55.824 58.000 -0.007 0.000 0.958 15 F CB 1.963 40.944 39.000 -0.031 0.000 1.703 15 F HN 1.067 8.827 8.300 -0.716 0.111 0.497 16 K N -1.232 119.238 120.400 0.116 0.000 2.587 16 K HA 0.603 5.058 4.320 -0.129 -0.212 0.276 16 K C -2.289 174.356 176.600 0.075 0.000 0.956 16 K CA -0.524 55.760 56.287 -0.004 0.000 0.857 16 K CB 3.838 36.352 32.500 0.024 0.000 1.431 16 K HN -0.247 8.248 8.250 0.408 0.000 0.420 17 I N -2.861 117.721 120.570 0.021 0.000 4.162 17 I HA 0.504 4.862 4.170 0.072 -0.145 0.236 17 I C -0.843 175.284 176.117 0.017 0.000 1.052 17 I CA -2.573 58.753 61.300 0.044 0.000 1.457 17 I CB 2.798 40.824 38.000 0.043 0.000 1.329 17 I HN 0.676 8.747 8.210 -0.027 0.123 0.422 18 R N -1.659 118.849 120.500 0.013 0.000 4.335 18 R HA 0.016 4.467 4.340 -0.003 -0.113 0.050 18 R C -0.748 175.553 176.300 0.002 0.000 0.766 18 R CA 0.522 56.624 56.100 0.004 0.000 2.101 18 R CB 1.952 32.257 30.300 0.009 0.000 1.383 18 R HN 0.216 8.497 8.270 0.019 0.000 0.441 19 M N -3.531 116.074 119.600 0.008 0.000 7.319 19 M HA -0.345 4.141 4.480 0.009 0.000 0.081 19 M C -1.781 174.521 176.300 0.002 0.000 0.480 19 M CA 1.757 57.061 55.300 0.007 0.000 1.311 19 M CB -1.009 31.598 32.600 0.011 0.000 0.421 19 M HN -0.161 8.136 8.290 0.012 0.000 0.158 20 E N -1.673 118.528 120.200 0.002 0.000 2.299 20 E HA 0.468 4.816 4.350 -0.004 0.000 0.265 20 E C -1.564 175.032 176.600 -0.006 0.000 0.911 20 E CA -3.440 52.958 56.400 -0.002 0.000 0.789 20 E CB 2.119 31.818 29.700 -0.000 0.000 1.246 20 E HN 0.148 8.511 8.360 0.005 0.000 0.427 21 P HA 0.055 4.464 4.420 -0.018 0.000 0.258 21 P C -2.081 175.211 177.300 -0.013 0.000 1.559 21 P CA 0.037 63.128 63.100 -0.015 0.000 0.855 21 P CB -0.599 31.091 31.700 -0.018 0.000 1.594 22 D N -3.372 117.024 120.400 -0.007 0.000 3.244 22 D HA 0.093 4.872 4.640 -0.013 -0.146 0.292 22 D C -1.947 174.352 176.300 -0.001 0.000 1.652 22 D CA -0.015 53.980 54.000 -0.008 0.000 0.803 22 D CB 1.157 41.951 40.800 -0.010 0.000 1.390 22 D HN -0.409 7.830 8.370 -0.004 0.128 0.528 23 E N 0.280 120.483 120.200 0.006 0.000 2.175 23 E HA 0.213 4.569 4.350 0.010 0.000 0.278 23 E C 0.064 176.678 176.600 0.023 0.000 0.969 23 E CA -1.827 54.581 56.400 0.013 0.000 0.796 23 E CB 1.822 31.530 29.700 0.014 0.000 1.104 23 E HN -0.824 7.539 8.360 0.006 0.000 0.395 24 T N 4.265 118.832 114.554 0.023 0.000 2.849 24 T HA -0.353 4.018 4.350 0.035 0.000 0.289 24 T C 1.216 175.945 174.700 0.048 0.000 1.010 24 T CA 1.321 63.442 62.100 0.034 0.000 1.161 24 T CB -0.425 68.460 68.868 0.028 0.000 0.989 24 T HN 0.639 8.889 8.240 0.017 0.000 0.523 25 V N 6.502 126.459 119.914 0.072 0.000 2.794 25 V HA -0.498 3.664 4.120 0.070 0.000 0.260 25 V C 1.397 177.528 176.094 0.061 0.000 1.103 25 V CA 3.865 66.212 62.300 0.078 0.000 1.125 25 V CB -0.746 31.148 31.823 0.118 0.000 0.702 25 V HN 0.891 9.011 8.190 0.085 0.121 0.494 26 K N -0.228 120.204 120.400 0.054 0.000 2.063 26 K HA -0.321 4.028 4.320 0.048 0.000 0.208 26 K C 2.250 178.875 176.600 0.042 0.000 1.048 26 K CA 3.432 59.747 56.287 0.046 0.000 0.928 26 K CB -0.576 31.947 32.500 0.038 0.000 0.713 26 K HN -0.128 8.093 8.250 0.054 0.061 0.442 27 V N -0.854 119.083 119.914 0.038 0.000 2.453 27 V HA -0.352 3.787 4.120 0.032 0.000 0.247 27 V C 1.639 177.757 176.094 0.040 0.000 1.048 27 V CA 3.485 65.805 62.300 0.034 0.000 1.049 27 V CB -0.299 31.540 31.823 0.027 0.000 0.672 27 V HN -0.109 7.998 8.190 0.038 0.105 0.457 28 L N 0.579 121.829 121.223 0.044 0.000 2.093 28 L HA -0.403 3.964 4.340 0.046 0.000 0.208 28 L C 1.205 178.114 176.870 0.064 0.000 1.085 28 L CA 3.565 58.435 54.840 0.049 0.000 0.755 28 L CB -0.489 41.598 42.059 0.046 0.000 0.904 28 L HN -0.802 7.348 8.230 0.044 0.107 0.435 29 K N -1.080 119.359 120.400 0.064 0.000 2.032 29 K HA -0.480 3.896 4.320 0.093 0.000 0.209 29 K C 2.427 179.076 176.600 0.081 0.000 1.048 29 K CA 4.042 60.375 56.287 0.078 0.000 0.927 29 K CB -0.163 32.375 32.500 0.065 0.000 0.712 29 K HN 0.354 8.430 8.250 0.057 0.208 0.441 30 E N -1.721 118.516 120.200 0.061 0.000 2.106 30 E HA -0.368 4.016 4.350 0.057 0.000 0.192 30 E C 2.114 178.743 176.600 0.047 0.000 0.984 30 E CA 2.928 59.359 56.400 0.052 0.000 0.806 30 E CB -0.220 29.503 29.700 0.038 0.000 0.750 30 E HN -0.674 7.718 8.360 0.053 0.000 0.458 31 K N -1.129 119.300 120.400 0.049 0.000 2.103 31 K HA -0.275 4.063 4.320 0.030 0.000 0.207 31 K C 2.672 179.304 176.600 0.054 0.000 1.048 31 K CA 2.631 58.946 56.287 0.046 0.000 0.930 31 K CB -0.387 32.144 32.500 0.052 0.000 0.716 31 K HN -0.147 8.032 8.250 0.051 0.102 0.444 32 I N -0.582 120.043 120.570 0.091 0.000 2.394 32 I HA -0.408 3.844 4.170 0.137 0.000 0.251 32 I C 1.824 177.934 176.117 -0.012 0.000 1.136 32 I CA 4.053 65.418 61.300 0.109 0.000 1.425 32 I CB 0.020 38.156 38.000 0.226 0.000 1.079 32 I HN -0.147 8.022 8.210 0.099 0.100 0.425 33 E N -0.671 119.558 120.200 0.049 0.000 2.265 33 E HA -0.312 4.215 4.350 0.096 -0.120 0.196 33 E C 0.382 176.947 176.600 -0.059 0.000 0.996 33 E CA 2.815 59.236 56.400 0.034 0.000 0.832 33 E CB 0.027 29.766 29.700 0.064 0.000 0.756 33 E HN -0.564 7.727 8.360 0.078 0.116 0.491 34 A N -3.627 119.152 122.820 -0.068 0.000 2.259 34 A HA 0.160 4.425 4.320 -0.093 0.000 0.213 34 A C 1.196 178.700 177.584 -0.133 0.000 1.209 34 A CA 0.777 52.763 52.037 -0.087 0.000 0.910 34 A CB 0.243 19.220 19.000 -0.038 0.000 0.946 34 A HN -0.611 7.353 8.150 -0.036 0.165 0.497 35 E N -0.867 119.251 120.200 -0.138 0.000 2.021 35 E HA -0.186 4.112 4.350 -0.087 0.000 0.189 35 E C 1.513 177.849 176.600 -0.439 0.000 0.980 35 E CA 2.474 58.786 56.400 -0.146 0.000 0.803 35 E CB 0.182 29.918 29.700 0.060 0.000 0.766 35 E HN 0.085 8.179 8.360 -0.098 0.207 0.449 36 K N -2.001 117.949 120.400 -0.750 0.000 2.334 36 K HA 0.026 3.689 4.320 -1.094 0.000 0.195 36 K C 0.168 176.218 176.600 -0.918 0.000 1.045 36 K CA -0.970 54.617 56.287 -1.166 0.000 1.004 36 K CB 1.755 33.210 32.500 -1.743 0.000 0.837 36 K HN -0.573 7.308 8.250 -0.615 0.000 0.510 37 G N -2.165 106.186 108.800 -0.748 0.000 2.361 37 G HA2 -0.118 3.691 3.960 -0.252 0.000 0.305 37 G HA3 -0.118 3.638 3.960 -0.340 0.000 0.305 37 G C -2.855 171.934 174.900 -0.184 0.000 1.367 37 G CA -0.089 44.778 45.100 -0.388 0.000 0.951 37 G HN -0.800 7.082 8.290 -0.679 0.000 0.615 38 R N -3.787 116.709 120.500 -0.007 0.000 2.470 38 R HA 0.265 4.829 4.340 0.139 -0.140 0.210 38 R C 1.623 177.997 176.300 0.123 0.000 0.873 38 R CA 0.074 56.225 56.100 0.085 0.000 1.015 38 R CB 0.679 30.996 30.300 0.029 0.000 1.348 38 R HN 0.117 8.375 8.270 -0.019 0.000 0.650 39 D N 1.558 122.013 120.400 0.091 0.000 2.104 39 D HA -0.245 4.427 4.640 0.054 0.000 0.194 39 D C 0.260 176.621 176.300 0.101 0.000 0.994 39 D CA 2.660 56.706 54.000 0.076 0.000 0.830 39 D CB -0.535 40.297 40.800 0.052 0.000 0.959 39 D HN 0.292 8.698 8.370 0.060 0.000 0.452 40 A N -4.681 118.249 122.820 0.183 0.000 2.610 40 A HA 0.135 4.468 4.320 0.021 0.000 0.286 40 A C -1.117 176.490 177.584 0.037 0.000 1.306 40 A CA -0.218 51.887 52.037 0.113 0.000 0.942 40 A CB -0.222 18.858 19.000 0.132 0.000 1.112 40 A HN -0.300 7.997 8.150 0.244 0.000 0.527 41 F N -0.619 119.325 119.950 -0.011 0.000 2.931 41 F HA 0.380 4.911 4.527 0.007 0.000 0.375 41 F C -2.333 173.469 175.800 0.005 0.000 1.243 41 F CA -2.177 55.822 58.000 -0.001 0.000 1.206 41 F CB 2.776 41.770 39.000 -0.010 0.000 1.643 41 F HN -0.536 7.722 8.300 0.270 0.204 0.593 42 P HA 0.209 4.671 4.420 0.069 0.000 0.323 42 P C -1.261 176.074 177.300 0.059 0.000 1.309 42 P CA -0.953 62.179 63.100 0.054 0.000 0.739 42 P CB 1.228 32.935 31.700 0.012 0.000 1.454 43 V N -7.761 112.178 119.914 0.041 0.000 3.151 43 V HA 0.111 4.265 4.120 0.057 0.000 0.241 43 V C 1.425 177.534 176.094 0.025 0.000 1.173 43 V CA 1.579 63.904 62.300 0.042 0.000 1.154 43 V CB 0.022 31.868 31.823 0.040 0.000 0.898 43 V HN -0.002 8.206 8.190 0.031 0.000 0.473 44 A N 2.479 125.307 122.820 0.014 0.000 1.859 44 A HA -0.193 4.133 4.320 0.010 0.000 0.218 44 A C 1.778 179.362 177.584 0.000 0.000 1.209 44 A CA 2.813 54.853 52.037 0.006 0.000 0.639 44 A CB -0.703 18.297 19.000 0.000 0.000 0.835 44 A HN 0.171 8.330 8.150 0.014 0.000 0.450 45 G N -2.467 106.325 108.800 -0.013 0.000 3.636 45 G HA2 -0.002 3.949 3.960 -0.016 0.000 0.260 45 G HA3 -0.002 4.074 3.960 -0.040 -0.141 0.260 45 G C -2.659 172.227 174.900 -0.022 0.000 1.014 45 G CA -0.506 44.580 45.100 -0.024 0.000 1.797 45 G HN -0.186 8.093 8.290 -0.018 0.000 0.637 46 Q N 1.358 121.161 119.800 0.004 0.000 2.607 46 Q HA 0.201 4.557 4.340 0.027 0.000 0.247 46 Q C -1.415 174.601 176.000 0.028 0.000 1.033 46 Q CA -1.197 54.623 55.803 0.029 0.000 0.769 46 Q CB 0.697 29.467 28.738 0.054 0.000 1.169 46 Q HN -0.585 7.622 8.270 0.009 0.069 0.508 47 K N 4.158 124.569 120.400 0.019 0.000 2.394 47 K HA 0.230 4.551 4.320 0.001 0.000 0.260 47 K C -1.487 175.118 176.600 0.009 0.000 0.967 47 K CA -1.396 54.895 56.287 0.006 0.000 0.855 47 K CB 1.899 34.397 32.500 -0.003 0.000 1.101 47 K HN -0.287 7.971 8.250 0.014 0.000 0.433 48 L N 5.101 126.319 121.223 -0.008 0.000 2.418 48 L HA 0.062 4.426 4.340 0.039 0.000 0.274 48 L C -1.627 175.230 176.870 -0.023 0.000 1.135 48 L CA -0.864 53.974 54.840 -0.004 0.000 0.870 48 L CB -0.361 41.678 42.059 -0.033 0.000 1.154 48 L HN -0.003 8.214 8.230 -0.022 0.000 0.462 49 I N 4.256 124.844 120.570 0.030 0.000 2.307 49 I HA 0.136 4.453 4.170 -0.010 -0.153 0.287 49 I C -0.757 175.418 176.117 0.097 0.000 1.054 49 I CA -1.451 59.869 61.300 0.033 0.000 1.218 49 I CB -1.497 36.530 38.000 0.045 0.000 1.398 49 I HN 0.326 8.541 8.210 0.058 0.030 0.475 50 Y N 9.298 129.544 120.300 -0.089 0.000 2.266 50 Y HA -0.036 4.462 4.550 -0.087 0.000 0.294 50 Y C -0.814 175.020 175.900 -0.111 0.000 1.127 50 Y CA 0.433 58.475 58.100 -0.097 0.000 1.140 50 Y CB 2.210 40.608 38.460 -0.103 0.000 1.071 50 Y HN -0.362 7.971 8.280 0.088 0.000 0.525 51 A N -1.768 120.821 122.820 -0.385 0.000 3.292 51 A HA 0.275 4.348 4.320 -0.413 0.000 0.231 51 A C -0.664 176.800 177.584 -0.199 0.000 0.952 51 A CA 0.245 52.017 52.037 -0.442 0.000 1.044 51 A CB 0.047 18.616 19.000 -0.717 0.000 1.236 51 A HN -0.229 7.829 8.150 -0.153 0.000 0.525 52 G N -1.790 106.941 108.800 -0.114 0.000 2.284 52 G HA2 -0.245 3.688 3.960 -0.045 0.000 0.230 52 G HA3 -0.245 3.677 3.960 -0.063 0.000 0.230 52 G C -0.551 174.325 174.900 -0.041 0.000 1.021 52 G CA -0.175 44.888 45.100 -0.062 0.000 0.619 52 G HN -0.049 8.181 8.290 -0.100 0.000 0.510 53 K N 1.961 122.334 120.400 -0.045 0.000 2.227 53 K HA 0.152 4.466 4.320 -0.010 0.000 0.280 53 K C -0.791 175.747 176.600 -0.103 0.000 1.041 53 K CA -1.206 55.060 56.287 -0.034 0.000 0.905 53 K CB 0.644 33.158 32.500 0.023 0.000 1.068 53 K HN -0.278 7.836 8.250 -0.064 0.098 0.470 54 I N 5.233 125.749 120.570 -0.089 0.000 2.455 54 I HA -0.205 4.027 4.170 -0.092 -0.118 0.303 54 I C -0.139 175.830 176.117 -0.246 0.000 1.180 54 I CA -0.536 60.697 61.300 -0.112 0.000 1.469 54 I CB -1.572 36.400 38.000 -0.047 0.000 1.480 54 I HN 0.602 8.786 8.210 -0.043 0.000 0.669 55 L N 8.682 129.654 121.223 -0.418 0.000 2.838 55 L HA -0.260 3.117 4.340 -1.607 0.000 0.287 55 L C -0.945 175.781 176.870 -0.239 0.000 1.124 55 L CA 0.939 55.346 54.840 -0.721 0.000 1.091 55 L CB -1.537 40.208 42.059 -0.525 0.000 1.448 55 L HN 0.854 8.832 8.230 -0.307 0.068 0.455 56 S N 3.262 118.909 115.700 -0.088 0.000 2.655 56 S HA 0.054 4.527 4.470 0.005 0.000 0.265 56 S C 0.230 174.880 174.600 0.084 0.000 1.240 56 S CA -1.552 56.666 58.200 0.029 0.000 0.986 56 S CB 1.763 65.002 63.200 0.065 0.000 0.985 56 S HN -0.340 7.925 8.310 -0.074 0.000 0.562 57 D N -1.247 119.194 120.400 0.069 0.000 2.413 57 D HA -0.060 4.577 4.640 0.079 0.051 0.237 57 D C -0.905 175.439 176.300 0.074 0.000 1.171 57 D CA 0.429 54.472 54.000 0.071 0.000 0.839 57 D CB -0.682 40.150 40.800 0.053 0.000 0.950 57 D HN 0.511 8.913 8.370 0.053 0.000 0.499 58 D N -2.402 118.054 120.400 0.093 0.000 2.469 58 D HA 0.158 4.831 4.640 0.055 0.000 0.215 58 D C -1.178 175.168 176.300 0.076 0.000 1.154 58 D CA -0.391 53.654 54.000 0.074 0.000 0.832 58 D CB 0.626 41.467 40.800 0.069 0.000 1.008 58 D HN 0.074 8.405 8.370 0.122 0.112 0.506 59 V N -0.902 119.080 119.914 0.113 0.000 2.876 59 V HA 0.502 4.626 4.120 0.007 0.000 0.312 59 V C -2.610 173.521 176.094 0.062 0.000 1.085 59 V CA -3.865 58.471 62.300 0.061 0.000 0.945 59 V CB 3.466 35.328 31.823 0.065 0.000 1.017 59 V HN -0.863 7.356 8.190 0.150 0.060 0.428 60 P HA 0.106 4.722 4.420 0.025 -0.180 0.271 60 P C -0.783 176.528 177.300 0.019 0.000 1.216 60 P CA -0.597 62.507 63.100 0.007 0.000 0.776 60 P CB 0.050 31.738 31.700 -0.020 0.000 0.881 61 I N 3.570 124.165 120.570 0.042 0.000 3.094 61 I HA -0.432 3.804 4.170 0.111 0.000 0.291 61 I C 1.391 177.516 176.117 0.013 0.000 1.250 61 I CA 1.777 63.108 61.300 0.052 0.000 1.401 61 I CB -0.195 37.822 38.000 0.028 0.000 1.343 61 I HN 0.696 8.771 8.210 0.036 0.157 0.599 62 R N 1.589 122.096 120.500 0.012 0.000 3.789 62 R HA -0.398 3.921 4.340 -0.034 0.000 0.414 62 R C 0.654 176.930 176.300 -0.040 0.000 0.593 62 R CA 2.544 58.631 56.100 -0.022 0.000 1.562 62 R CB -1.509 28.775 30.300 -0.027 0.000 2.091 62 R HN 0.393 8.681 8.270 0.030 0.000 0.382 63 D N -0.363 119.982 120.400 -0.091 0.000 2.182 63 D HA -0.233 4.312 4.640 -0.159 0.000 0.201 63 D C 0.401 176.538 176.300 -0.273 0.000 0.986 63 D CA 2.699 56.565 54.000 -0.224 0.000 0.847 63 D CB -0.441 40.141 40.800 -0.365 0.000 0.942 63 D HN -0.383 7.819 8.370 -0.066 0.128 0.467 64 Y N -3.983 116.314 120.300 -0.005 0.000 2.544 64 Y HA -0.051 4.533 4.550 0.056 0.000 0.286 64 Y C -0.564 175.357 175.900 0.035 0.000 1.141 64 Y CA 0.448 58.569 58.100 0.033 0.000 1.299 64 Y CB 0.593 39.077 38.460 0.039 0.000 1.030 64 Y HN -0.350 7.931 8.280 0.034 0.020 0.543 65 R N -1.567 118.980 120.500 0.078 0.000 3.055 65 R HA -0.291 4.073 4.340 -0.018 -0.035 0.265 65 R C -1.249 174.984 176.300 -0.111 0.000 0.947 65 R CA 0.434 56.547 56.100 0.022 0.000 0.652 65 R CB -2.108 28.246 30.300 0.091 0.000 1.367 65 R HN -0.303 7.786 8.270 0.039 0.205 0.441 66 I N -1.644 118.689 120.570 -0.394 0.000 3.211 66 I HA -0.172 2.446 4.170 -2.587 0.000 0.297 66 I C -1.188 174.656 176.117 -0.455 0.000 1.095 66 I CA 0.076 60.757 61.300 -1.033 0.000 1.239 66 I CB 0.642 38.208 38.000 -0.723 0.000 1.455 66 I HN -0.239 7.824 8.210 -0.246 0.000 0.630 67 D N 0.570 120.759 120.400 -0.352 0.000 2.896 67 D HA 0.166 4.772 4.640 -0.057 0.000 0.241 67 D C -0.032 176.245 176.300 -0.039 0.000 1.188 67 D CA -0.543 53.424 54.000 -0.054 0.000 0.879 67 D CB 2.842 43.706 40.800 0.107 0.000 1.553 67 D HN -0.069 7.955 8.370 -0.576 0.000 0.515 68 E N 4.460 124.643 120.200 -0.029 0.000 2.110 68 E HA -0.282 4.057 4.350 -0.019 0.000 0.193 68 E C 0.578 177.192 176.600 0.023 0.000 0.988 68 E CA 2.714 59.109 56.400 -0.009 0.000 0.804 68 E CB -0.016 29.680 29.700 -0.006 0.000 0.745 68 E HN 0.475 8.816 8.360 -0.030 0.000 0.458 69 K N -3.556 116.859 120.400 0.024 0.000 2.211 69 K HA -0.231 4.116 4.320 0.045 0.000 0.204 69 K C 0.324 176.948 176.600 0.041 0.000 1.047 69 K CA 1.710 58.019 56.287 0.036 0.000 0.935 69 K CB 0.069 32.583 32.500 0.024 0.000 0.728 69 K HN 0.333 8.583 8.250 0.016 0.010 0.452 70 N N -2.889 115.814 118.700 0.006 0.000 2.786 70 N HA 0.154 4.759 4.740 -0.226 0.000 0.315 70 N C -1.621 173.860 175.510 -0.047 0.000 1.359 70 N CA -0.888 52.067 53.050 -0.159 0.000 0.846 70 N CB 1.641 40.037 38.487 -0.152 0.000 1.117 70 N HN -0.663 7.580 8.380 0.024 0.152 0.541 71 F N -8.703 111.310 119.950 0.105 0.000 2.703 71 F HA 0.253 4.861 4.527 -0.025 -0.095 0.308 71 F C -1.478 174.372 175.800 0.083 0.000 1.126 71 F CA -1.256 56.761 58.000 0.028 0.000 0.959 71 F CB 1.925 40.908 39.000 -0.027 0.000 1.297 71 F HN -0.177 7.609 8.300 -0.856 0.000 0.441 72 V N 1.010 121.080 119.914 0.260 0.000 2.320 72 V HA 0.152 4.529 4.120 0.257 -0.103 0.265 72 V C 0.445 176.656 176.094 0.195 0.000 1.048 72 V CA -1.339 61.084 62.300 0.204 0.000 0.865 72 V CB -0.108 31.751 31.823 0.061 0.000 1.043 72 V HN 1.107 9.264 8.190 0.136 0.115 0.474 73 V N 9.430 129.504 119.914 0.267 0.000 2.304 73 V HA -0.279 3.961 4.120 0.149 -0.031 0.239 73 V C -0.476 175.689 176.094 0.119 0.000 1.201 73 V CA 0.391 62.799 62.300 0.181 0.000 1.254 73 V CB -1.232 30.709 31.823 0.196 0.000 1.335 73 V HN 0.408 8.790 8.190 0.319 0.000 0.491 74 V N 5.776 125.764 119.914 0.124 0.000 2.901 74 V HA -0.191 4.168 4.120 0.081 -0.191 0.307 74 V C -1.473 174.670 176.094 0.082 0.000 1.084 74 V CA -0.026 62.343 62.300 0.115 0.000 1.184 74 V CB 1.418 33.359 31.823 0.198 0.000 0.941 74 V HN 0.397 8.569 8.190 0.132 0.097 0.493 75 M N 7.661 127.285 119.600 0.039 0.000 2.103 75 M HA 0.275 4.752 4.480 -0.006 0.000 0.350 75 M C -1.659 174.612 176.300 -0.049 0.000 1.100 75 M CA -1.117 54.180 55.300 -0.004 0.000 1.042 75 M CB 0.684 33.282 32.600 -0.003 0.000 1.368 75 M HN 0.457 8.647 8.290 0.038 0.124 0.404 76 V N 9.973 129.810 119.914 -0.128 0.000 2.368 76 V HA 0.684 5.135 4.120 -0.167 -0.432 0.266 76 V C -0.299 175.681 176.094 -0.191 0.000 1.045 76 V CA -0.325 61.831 62.300 -0.240 0.000 0.899 76 V CB 0.578 32.026 31.823 -0.626 0.000 1.006 76 V HN 0.393 8.505 8.190 -0.129 0.000 0.470 77 T N 9.722 124.203 114.554 -0.123 0.000 2.841 77 T HA 0.331 4.620 4.350 -0.102 0.000 0.296 77 T C -1.939 172.721 174.700 -0.066 0.000 1.166 77 T CA -1.028 61.018 62.100 -0.089 0.000 1.007 77 T CB 2.943 71.776 68.868 -0.058 0.000 1.253 77 T HN 0.357 8.403 8.240 -0.099 0.135 0.511 78 K N -0.298 120.072 120.400 -0.050 0.000 2.499 78 K HA 0.269 4.572 4.320 -0.028 0.000 0.277 78 K C -1.541 175.045 176.600 -0.024 0.000 1.025 78 K CA -0.514 55.752 56.287 -0.034 0.000 0.900 78 K CB 3.461 35.939 32.500 -0.036 0.000 1.494 78 K HN -0.064 8.156 8.250 -0.050 0.000 0.442 79 T N 1.567 116.111 114.554 -0.016 0.000 3.542 79 T HA 0.284 4.625 4.350 -0.014 0.000 0.276 79 T C -0.292 174.402 174.700 -0.009 0.000 1.412 79 T CA -0.133 61.959 62.100 -0.012 0.000 1.664 79 T CB 0.278 69.141 68.868 -0.009 0.000 0.863 79 T HN 0.084 8.315 8.240 -0.014 0.000 0.661 80 K N 1.460 121.854 120.400 -0.010 0.000 1.992 80 K HA 0.062 4.379 4.320 -0.005 0.000 0.210 80 K C 0.354 176.951 176.600 -0.006 0.000 1.036 80 K CA 0.880 57.162 56.287 -0.007 0.000 0.946 80 K CB 0.265 32.760 32.500 -0.008 0.000 0.742 80 K HN 0.124 8.366 8.250 -0.013 0.000 0.442 81 A N 0.502 123.318 122.820 -0.007 0.000 2.252 81 A HA 0.218 4.535 4.320 -0.004 0.000 0.305 81 A C -0.553 177.028 177.584 -0.006 0.000 1.097 81 A CA -0.622 51.411 52.037 -0.005 0.000 0.849 81 A CB 0.844 19.841 19.000 -0.006 0.000 1.142 81 A HN -0.294 7.851 8.150 -0.008 0.000 0.499 82 G N -2.108 106.689 108.800 -0.005 0.000 2.335 82 G HA2 0.119 4.076 3.960 -0.005 0.000 0.316 82 G HA3 0.119 4.077 3.960 -0.004 0.000 0.316 82 G C -0.912 173.985 174.900 -0.005 0.000 1.129 82 G CA -0.047 45.050 45.100 -0.005 0.000 0.899 82 G HN -0.071 8.217 8.290 -0.004 0.000 0.448 83 Q N 3.121 122.917 119.800 -0.005 0.000 2.619 83 Q HA 0.111 4.448 4.340 -0.005 0.000 0.195 83 Q C 0.825 176.822 176.000 -0.005 0.000 0.910 83 Q CA 0.115 55.915 55.803 -0.005 0.000 0.862 83 Q CB 1.556 30.290 28.738 -0.007 0.000 1.123 83 Q HN 0.397 8.663 8.270 -0.006 0.000 0.636 84 G N 2.049 110.846 108.800 -0.005 0.000 4.519 84 G HA2 0.316 4.274 3.960 -0.003 0.000 0.336 84 G HA3 0.316 4.273 3.960 -0.004 0.000 0.336 84 G C -0.796 174.101 174.900 -0.004 0.000 1.491 84 G CA -0.178 44.920 45.100 -0.004 0.000 1.008 84 G HN 0.102 8.389 8.290 -0.006 0.000 0.515 85 T N 4.574 119.126 114.554 -0.003 0.000 3.326 85 T HA 0.067 4.415 4.350 -0.003 0.000 0.274 85 T C -0.953 173.746 174.700 -0.002 0.000 1.608 85 T CA -0.265 61.834 62.100 -0.003 0.000 1.433 85 T CB -0.246 68.621 68.868 -0.003 0.000 1.034 85 T HN -0.015 8.223 8.240 -0.003 0.000 0.694 86 S N 3.470 119.169 115.700 -0.002 0.000 2.605 86 S HA 0.205 4.675 4.470 -0.001 0.000 0.308 86 S C -1.286 173.314 174.600 -0.001 0.000 1.113 86 S CA -0.167 58.032 58.200 -0.001 0.000 1.049 86 S CB 1.476 64.675 63.200 -0.001 0.000 1.001 86 S HN -0.165 8.096 8.310 -0.002 0.048 0.480 87 A N 5.832 128.651 122.820 -0.001 0.000 2.354 87 A HA 0.572 4.892 4.320 -0.001 0.000 0.321 87 A C -2.164 175.420 177.584 -0.000 0.000 1.125 87 A CA -1.775 50.262 52.037 -0.000 0.000 0.799 87 A CB 0.377 19.377 19.000 -0.000 0.000 1.293 87 A HN 0.130 8.280 8.150 -0.001 0.000 0.452 88 P HA 0.438 4.858 4.420 -0.000 0.000 0.275 88 P C -2.499 174.801 177.300 0.000 0.000 1.227 88 P CA -0.724 62.376 63.100 -0.000 0.000 0.781 88 P CB -0.347 31.353 31.700 -0.000 0.000 0.906 89 P HA 0.109 4.529 4.420 0.000 0.000 0.274 89 P C -1.517 175.784 177.300 0.000 0.000 1.246 89 P CA -0.350 62.750 63.100 0.000 0.000 0.795 89 P CB 1.081 32.781 31.700 0.000 0.000 1.006 90 E N 0.175 120.375 120.200 0.000 0.000 2.378 90 E HA 0.083 4.433 4.350 0.000 0.000 0.282 90 E C -0.942 175.658 176.600 0.001 0.000 0.910 90 E CA 0.141 56.541 56.400 0.000 0.000 0.816 90 E CB 1.626 31.326 29.700 0.001 0.000 1.359 90 E HN 0.218 8.578 8.360 0.001 0.000 0.397 91 A N 4.319 127.140 122.820 0.000 0.000 2.535 91 A HA -0.022 4.298 4.320 0.000 0.000 0.290 91 A C -0.118 177.466 177.584 0.000 0.000 1.270 91 A CA 1.005 53.042 52.037 0.000 0.000 0.937 91 A CB -0.340 18.660 19.000 0.000 0.000 1.096 91 A HN 0.352 8.502 8.150 0.000 0.000 0.534 92 S N 2.015 117.716 115.700 0.001 0.000 2.327 92 S HA 0.284 4.754 4.470 0.000 0.000 0.203 92 S C -1.880 172.721 174.600 0.001 0.000 1.326 92 S CA -2.674 55.527 58.200 0.001 0.000 1.248 92 S CB 0.496 63.697 63.200 0.001 0.000 1.199 92 S HN 0.142 8.453 8.310 0.001 0.000 0.422 93 P HA 0.088 4.509 4.420 0.001 0.000 0.249 93 P C -1.226 176.074 177.300 0.001 0.000 1.737 93 P CA -0.419 62.682 63.100 0.001 0.000 1.128 93 P CB -1.612 30.088 31.700 0.001 0.000 1.942 94 T N -0.897 113.658 114.554 0.001 0.000 2.876 94 T HA 0.272 4.623 4.350 0.001 0.000 0.289 94 T C -0.629 174.072 174.700 0.002 0.000 1.014 94 T CA -1.385 60.716 62.100 0.001 0.000 0.986 94 T CB 2.010 70.879 68.868 0.001 0.000 1.021 94 T HN -0.214 7.999 8.240 0.002 0.027 0.458 95 A N 5.107 127.928 122.820 0.002 0.000 1.919 95 A HA 0.001 4.324 4.320 0.004 0.000 0.211 95 A C -1.101 176.486 177.584 0.004 0.000 1.310 95 A CA 0.857 52.897 52.037 0.004 0.000 0.651 95 A CB 0.139 19.141 19.000 0.003 0.000 0.996 95 A HN 0.629 8.780 8.150 0.002 0.000 0.479 96 A N -1.059 121.763 122.820 0.004 0.000 2.454 96 A HA 0.395 4.719 4.320 0.006 0.000 0.302 96 A C -2.001 175.585 177.584 0.003 0.000 1.079 96 A CA -1.465 50.575 52.037 0.005 0.000 0.731 96 A CB 0.848 19.852 19.000 0.007 0.000 1.299 96 A HN -0.196 7.956 8.150 0.003 0.000 0.413 97 P HA 0.039 4.459 4.420 -0.001 0.000 0.218 97 P C -0.599 176.700 177.300 -0.003 0.000 1.152 97 P CA 0.769 63.869 63.100 0.001 0.000 0.826 97 P CB 0.694 32.396 31.700 0.003 0.000 0.790 98 E N -2.421 117.778 120.200 -0.000 0.000 2.447 98 E HA 0.389 4.732 4.350 -0.012 0.000 0.251 98 E C -0.740 175.860 176.600 -0.001 0.000 0.910 98 E CA -0.900 55.497 56.400 -0.005 0.000 0.841 98 E CB 2.786 32.483 29.700 -0.005 0.000 1.403 98 E HN -0.296 8.067 8.360 0.004 0.000 0.400 99 S N -1.265 114.434 115.700 -0.002 0.000 4.193 99 S HA 0.088 4.562 4.470 0.006 0.000 0.211 99 S C -0.929 173.675 174.600 0.007 0.000 1.162 99 S CA 0.403 58.604 58.200 0.003 0.000 1.039 99 S CB 0.899 64.098 63.200 -0.002 0.000 1.371 99 S HN 0.215 8.519 8.310 -0.009 0.000 0.550 100 S N 2.113 117.813 115.700 -0.000 0.000 2.605 100 S HA 0.240 4.723 4.470 0.021 0.000 0.142 100 S C -1.131 173.462 174.600 -0.011 0.000 1.452 100 S CA -0.159 58.045 58.200 0.007 0.000 1.240 100 S CB 0.727 63.932 63.200 0.008 0.000 1.538 100 S HN -0.342 7.963 8.310 -0.009 0.000 0.394 101 T N -0.338 114.197 114.554 -0.032 0.000 2.913 101 T HA 0.246 4.543 4.350 -0.088 0.000 0.297 101 T C 0.149 174.791 174.700 -0.097 0.000 1.029 101 T CA -0.176 61.866 62.100 -0.098 0.000 1.104 101 T CB 0.918 69.683 68.868 -0.172 0.000 0.964 101 T HN -0.463 7.766 8.240 -0.019 0.000 0.532 102 S N 1.244 116.870 115.700 -0.122 0.000 2.546 102 S HA 0.228 4.723 4.470 0.041 0.000 0.265 102 S C -1.187 173.338 174.600 -0.125 0.000 1.190 102 S CA -0.121 58.051 58.200 -0.046 0.000 1.014 102 S CB 0.682 63.863 63.200 -0.031 0.000 1.087 102 S HN 0.286 8.516 8.310 -0.132 0.000 0.525 103 F N 0.054 120.005 119.950 0.002 0.000 3.102 103 F HA 0.093 4.621 4.527 0.002 0.000 0.359 103 F C -2.379 173.422 175.800 0.002 0.000 1.243 103 F CA -1.690 56.311 58.000 0.002 0.000 1.215 103 F CB 0.871 39.872 39.000 0.002 0.000 1.549 103 F HN -0.168 8.209 8.300 0.130 0.000 0.657 104 P HA 0.388 4.866 4.420 0.097 0.000 0.274 104 P C -2.311 175.069 177.300 0.134 0.000 1.231 104 P CA -1.366 61.811 63.100 0.128 0.000 0.790 104 P CB 0.188 31.934 31.700 0.077 0.000 0.951 105 P HA 0.013 4.462 4.420 0.048 0.000 0.275 105 P C -1.646 175.684 177.300 0.048 0.000 1.276 105 P CA 0.005 63.138 63.100 0.054 0.000 0.782 105 P CB -0.687 31.034 31.700 0.035 0.000 0.851 106 A N 6.108 128.956 122.820 0.048 0.000 2.398 106 A HA 0.332 4.673 4.320 0.036 0.000 0.301 106 A C -2.596 175.003 177.584 0.024 0.000 1.041 106 A CA -2.097 49.965 52.037 0.041 0.000 0.711 106 A CB 1.241 20.278 19.000 0.062 0.000 1.240 106 A HN 0.096 8.272 8.150 0.044 0.000 0.420 107 P HA 0.038 4.462 4.420 0.006 0.000 0.271 107 P C -0.658 176.650 177.300 0.014 0.000 1.380 107 P CA -0.212 62.895 63.100 0.012 0.000 0.992 107 P CB -0.683 31.025 31.700 0.014 0.000 1.230 108 T N 0.460 115.019 114.554 0.008 0.000 3.393 108 T HA 0.198 4.556 4.350 0.014 0.000 0.255 108 T C 0.320 175.021 174.700 0.001 0.000 1.008 108 T CA -0.987 61.118 62.100 0.009 0.000 1.053 108 T CB -0.049 68.826 68.868 0.012 0.000 1.120 108 T HN -0.046 8.195 8.240 0.000 0.000 0.538 109 S N 1.253 116.954 115.700 0.002 0.000 2.368 109 S HA -0.071 4.395 4.470 -0.006 0.000 0.224 109 S C 0.639 175.240 174.600 0.002 0.000 1.029 109 S CA 1.448 59.648 58.200 -0.001 0.000 0.988 109 S CB 0.185 63.386 63.200 0.002 0.000 0.838 109 S HN -0.221 8.035 8.310 0.005 0.057 0.462 110 G N -0.571 108.233 108.800 0.007 0.000 2.251 110 G HA2 -0.105 3.858 3.960 0.006 0.000 0.058 110 G HA3 -0.105 3.858 3.960 0.005 0.000 0.058 110 G C -1.519 173.387 174.900 0.010 0.000 0.922 110 G CA -0.607 44.497 45.100 0.007 0.000 1.133 110 G HN -0.143 8.153 8.290 0.010 0.000 0.410 111 M N 3.416 123.023 119.600 0.012 0.000 2.146 111 M HA 0.066 4.553 4.480 0.010 0.000 0.352 111 M C -0.648 175.673 176.300 0.036 0.000 1.343 111 M CA 0.066 55.376 55.300 0.017 0.000 1.115 111 M CB 0.572 33.179 32.600 0.013 0.000 1.657 111 M HN -0.022 8.274 8.290 0.010 0.000 0.471 112 S N 4.066 119.798 115.700 0.052 0.000 2.594 112 S HA 0.208 4.718 4.470 0.067 0.000 0.296 112 S C -1.467 173.234 174.600 0.167 0.000 1.124 112 S CA 0.354 58.601 58.200 0.078 0.000 1.011 112 S CB 1.005 64.237 63.200 0.054 0.000 1.016 112 S HN 0.285 8.621 8.310 0.042 0.000 0.485 113 H N 5.747 124.818 119.070 0.001 0.000 3.383 113 H HA 0.210 4.767 4.556 0.002 0.000 0.204 113 H C -2.497 172.831 175.328 0.001 0.000 1.262 113 H CA -0.516 55.533 56.048 0.001 0.000 1.350 113 H CB 0.372 30.134 29.762 0.001 0.000 2.400 113 H HN 0.133 8.489 8.280 0.125 0.000 0.547 114 P HA 0.249 4.624 4.420 -0.074 0.000 0.275 114 P C -2.527 174.665 177.300 -0.179 0.000 1.227 114 P CA -1.148 61.891 63.100 -0.102 0.000 0.781 114 P CB 0.358 32.029 31.700 -0.048 0.000 0.906 115 P HA 0.225 4.526 4.420 -0.199 0.000 0.275 115 P C -2.029 175.217 177.300 -0.089 0.000 1.228 115 P CA -1.753 61.264 63.100 -0.139 0.000 0.786 115 P CB -0.426 31.218 31.700 -0.092 0.000 0.927 116 P HA 0.047 4.439 4.420 -0.046 0.000 0.256 116 P C -1.775 175.503 177.300 -0.036 0.000 1.688 116 P CA -0.292 62.778 63.100 -0.050 0.000 1.162 116 P CB -1.384 30.290 31.700 -0.043 0.000 1.870 117 A N 3.934 126.735 122.820 -0.033 0.000 2.291 117 A HA 0.255 4.562 4.320 -0.021 0.000 0.311 117 A C -1.195 176.378 177.584 -0.018 0.000 1.224 117 A CA -0.792 51.231 52.037 -0.024 0.000 0.821 117 A CB 1.428 20.413 19.000 -0.024 0.000 1.172 117 A HN -0.293 7.812 8.150 -0.036 0.024 0.494 118 A N 3.093 125.905 122.820 -0.014 0.000 2.366 118 A HA 0.134 4.447 4.320 -0.012 0.000 0.272 118 A C -0.282 177.296 177.584 -0.010 0.000 1.135 118 A CA 0.283 52.314 52.037 -0.011 0.000 0.804 118 A CB 0.528 19.523 19.000 -0.010 0.000 1.064 118 A HN 0.243 8.384 8.150 -0.014 0.000 0.499 119 R N 0.927 121.421 120.500 -0.009 0.000 2.854 119 R HA 0.308 4.644 4.340 -0.007 0.000 0.271 119 R C -0.726 175.570 176.300 -0.006 0.000 0.996 119 R CA -0.567 55.529 56.100 -0.007 0.000 0.961 119 R CB 1.619 31.915 30.300 -0.008 0.000 1.182 119 R HN 0.293 8.558 8.270 -0.009 0.000 0.479 120 E N 0.531 120.728 120.200 -0.005 0.000 2.518 120 E HA 0.104 4.451 4.350 -0.004 0.000 0.241 120 E C -1.017 175.580 176.600 -0.004 0.000 0.899 120 E CA -0.257 56.141 56.400 -0.004 0.000 0.888 120 E CB 1.212 30.910 29.700 -0.004 0.000 1.426 120 E HN -0.059 8.298 8.360 -0.005 0.000 0.401 121 D N -0.752 119.646 120.400 -0.003 0.000 2.593 121 D HA 0.066 4.705 4.640 -0.003 0.000 0.241 121 D C -1.505 174.793 176.300 -0.002 0.000 1.257 121 D CA -0.143 53.855 54.000 -0.003 0.000 0.828 121 D CB 0.240 41.039 40.800 -0.002 0.000 1.049 121 D HN -0.238 8.131 8.370 -0.003 0.000 0.490 122 K N 0.480 120.879 120.400 -0.003 0.000 2.334 122 K HA 0.238 4.557 4.320 -0.002 0.000 0.265 122 K C -0.774 175.825 176.600 -0.002 0.000 1.039 122 K CA -0.572 55.713 56.287 -0.002 0.000 0.920 122 K CB 0.869 33.367 32.500 -0.002 0.000 1.160 122 K HN -0.402 7.776 8.250 -0.003 0.070 0.451 123 S N 7.184 122.882 115.700 -0.002 0.000 2.434 123 S HA 0.317 4.785 4.470 -0.002 0.000 0.318 123 S C -0.822 173.777 174.600 -0.002 0.000 1.062 123 S CA -2.353 55.846 58.200 -0.002 0.000 1.116 123 S CB 0.052 63.251 63.200 -0.002 0.000 0.977 123 S HN 0.140 8.449 8.310 -0.002 0.000 0.480 124 P HA 0.195 4.614 4.420 -0.001 0.000 0.293 124 P C -1.028 176.271 177.300 -0.001 0.000 1.298 124 P CA -0.432 62.667 63.100 -0.001 0.000 0.757 124 P CB 0.688 32.387 31.700 -0.002 0.000 1.262 125 S N -2.429 113.270 115.700 -0.001 0.000 2.715 125 S HA 0.446 4.915 4.470 -0.001 0.000 0.307 125 S C -1.038 173.561 174.600 -0.001 0.000 1.119 125 S CA -0.345 57.854 58.200 -0.001 0.000 0.937 125 S CB 2.056 65.255 63.200 -0.001 0.000 1.150 125 S HN 0.138 8.447 8.310 -0.001 0.000 0.521 126 E N 0.133 120.333 120.200 -0.001 0.000 2.433 126 E HA 0.202 4.552 4.350 -0.001 0.000 0.273 126 E C -1.810 174.790 176.600 -0.001 0.000 0.950 126 E CA -0.452 55.948 56.400 -0.001 0.000 0.796 126 E CB 2.234 31.933 29.700 -0.001 0.000 1.330 126 E HN 0.024 8.384 8.360 -0.001 0.000 0.455 127 E N 0.995 121.195 120.200 -0.000 0.000 3.388 127 E HA 0.227 4.577 4.350 -0.000 0.000 0.214 127 E C -1.984 174.616 176.600 -0.000 0.000 1.040 127 E CA -0.055 56.345 56.400 -0.000 0.000 1.327 127 E CB -0.046 29.653 29.700 -0.000 0.000 1.243 127 E HN 0.327 8.687 8.360 -0.000 0.000 0.444 128 S N -2.579 113.120 115.700 -0.000 0.000 2.703 128 S HA 0.326 4.796 4.470 0.000 0.000 0.273 128 S C -1.703 172.897 174.600 -0.000 0.000 1.178 128 S CA -0.344 57.856 58.200 -0.000 0.000 0.838 128 S CB 1.507 64.707 63.200 -0.000 0.000 1.178 128 S HN -0.131 8.179 8.310 -0.000 0.000 0.494 129 A N 1.123 123.943 122.820 -0.000 0.000 2.604 129 A HA 0.253 4.573 4.320 -0.000 0.000 0.295 129 A C -2.454 175.130 177.584 0.000 0.000 1.067 129 A CA -1.142 50.895 52.037 -0.000 0.000 0.683 129 A CB 0.328 19.328 19.000 0.000 0.000 1.281 129 A HN -0.003 8.148 8.150 0.000 0.000 0.407 130 P HA 0.294 4.715 4.420 0.000 0.000 0.275 130 P C -1.225 176.075 177.300 0.000 0.000 1.227 130 P CA -0.018 63.082 63.100 0.000 0.000 0.781 130 P CB 0.565 32.265 31.700 0.000 0.000 0.906 131 T N -1.314 113.240 114.554 0.000 0.000 3.507 131 T HA 0.005 4.355 4.350 0.001 0.000 0.280 131 T C 0.407 175.108 174.700 0.001 0.000 0.976 131 T CA 0.066 62.166 62.100 0.001 0.000 1.096 131 T CB 0.888 69.756 68.868 0.001 0.000 1.168 131 T HN 0.028 8.269 8.240 0.000 0.000 0.463 132 T N 5.491 120.045 114.554 0.001 0.000 2.834 132 T HA 0.055 4.406 4.350 0.001 0.000 0.298 132 T C -0.172 174.529 174.700 0.001 0.000 0.966 132 T CA 0.936 63.036 62.100 0.001 0.000 1.141 132 T CB 0.473 69.341 68.868 0.001 0.000 0.905 132 T HN -0.157 8.083 8.240 0.001 0.000 0.535 133 S N 6.809 122.509 115.700 0.001 0.000 2.565 133 S HA 0.429 4.899 4.470 0.001 0.000 0.290 133 S C -1.407 173.194 174.600 0.001 0.000 1.150 133 S CA -1.539 56.661 58.200 0.001 0.000 1.058 133 S CB 1.046 64.246 63.200 0.001 0.000 1.032 133 S HN 0.055 8.366 8.310 0.001 0.000 0.510 134 P HA 0.263 4.683 4.420 0.001 0.000 0.302 134 P C -1.005 176.295 177.300 0.001 0.000 1.301 134 P CA -0.128 62.973 63.100 0.001 0.000 0.745 134 P CB 1.333 33.033 31.700 0.001 0.000 1.331 135 E N -1.986 118.215 120.200 0.001 0.000 3.874 135 E HA 0.001 4.351 4.350 0.001 0.000 0.216 135 E C -0.719 175.881 176.600 0.000 0.000 1.307 135 E CA -0.018 56.382 56.400 0.001 0.000 1.536 135 E CB 0.918 30.618 29.700 0.001 0.000 1.996 135 E HN 0.100 8.461 8.360 0.001 0.000 0.602 136 S N 1.393 117.094 115.700 0.000 0.000 3.391 136 S HA -0.156 4.314 4.470 0.000 0.000 0.458 136 S C -0.588 174.012 174.600 0.000 0.000 0.812 136 S CA -0.302 57.898 58.200 0.000 0.000 1.366 136 S CB 0.159 63.359 63.200 0.001 0.000 0.943 136 S HN -0.174 8.136 8.310 0.001 0.000 0.680 137 V N 0.496 120.410 119.914 -0.000 0.000 2.493 137 V HA 0.005 4.125 4.120 -0.001 0.000 0.292 137 V C -0.092 176.001 176.094 -0.001 0.000 1.016 137 V CA 0.414 62.713 62.300 -0.001 0.000 1.097 137 V CB 0.623 32.445 31.823 -0.001 0.000 0.947 137 V HN -0.238 7.952 8.190 -0.000 0.000 0.479 138 S N 6.948 122.647 115.700 -0.001 0.000 2.545 138 S HA 0.167 4.636 4.470 -0.001 0.000 0.275 138 S C -0.063 174.536 174.600 -0.002 0.000 1.299 138 S CA 0.065 58.264 58.200 -0.001 0.000 1.048 138 S CB 0.501 63.701 63.200 -0.001 0.000 0.938 138 S HN 0.017 8.327 8.310 -0.001 0.000 0.496 139 G N 2.881 111.679 108.800 -0.002 0.000 3.243 139 G HA2 0.129 4.087 3.960 -0.003 0.000 0.248 139 G HA3 0.129 4.087 3.960 -0.003 0.000 0.248 139 G C -1.493 173.405 174.900 -0.003 0.000 1.267 139 G CA -0.169 44.929 45.100 -0.003 0.000 0.906 139 G HN 0.152 8.441 8.290 -0.002 0.000 0.592 140 S N 0.941 116.639 115.700 -0.004 0.000 2.252 140 S HA 0.249 4.717 4.470 -0.004 0.000 0.187 140 S C -0.761 173.836 174.600 -0.005 0.000 1.587 140 S CA -0.022 58.176 58.200 -0.004 0.000 1.215 140 S CB -0.107 63.090 63.200 -0.005 0.000 1.085 140 S HN 0.024 8.331 8.310 -0.005 0.000 0.466 141 V N 6.630 126.542 119.914 -0.004 0.000 2.266 141 V HA 0.291 4.408 4.120 -0.005 0.000 0.271 141 V C -1.005 175.087 176.094 -0.003 0.000 1.032 141 V CA -2.270 60.028 62.300 -0.004 0.000 0.806 141 V CB 0.998 32.819 31.823 -0.004 0.000 1.052 141 V HN 0.165 8.354 8.190 -0.003 0.000 0.449 142 P HA -0.025 4.394 4.420 -0.002 0.000 0.220 142 P C -0.289 177.010 177.300 -0.001 0.000 1.152 142 P CA 0.184 63.283 63.100 -0.002 0.000 0.812 142 P CB 0.667 32.365 31.700 -0.003 0.000 0.792 143 S N 0.071 115.770 115.700 -0.002 0.000 2.560 143 S HA -0.117 4.353 4.470 0.000 0.000 0.323 143 S C 0.247 174.847 174.600 -0.000 0.000 1.191 143 S CA 0.888 59.087 58.200 -0.001 0.000 1.231 143 S CB -0.507 62.692 63.200 -0.002 0.000 1.224 143 S HN -0.198 8.090 8.310 -0.003 0.020 0.545 144 S N 4.144 119.845 115.700 0.001 0.000 2.425 144 S HA -0.011 4.460 4.470 0.001 0.000 0.225 144 S C 0.379 174.980 174.600 0.002 0.000 1.024 144 S CA 1.455 59.656 58.200 0.001 0.000 0.951 144 S CB 0.436 63.637 63.200 0.002 0.000 0.796 144 S HN 0.203 8.513 8.310 0.001 0.000 0.498 145 G N 0.002 108.803 108.800 0.002 0.000 2.614 145 G HA2 -0.159 3.802 3.960 0.003 0.000 0.223 145 G HA3 -0.159 3.802 3.960 0.003 0.000 0.223 145 G C -0.606 174.296 174.900 0.004 0.000 1.171 145 G CA -0.466 44.636 45.100 0.003 0.000 0.938 145 G HN -0.284 8.007 8.290 0.002 0.000 0.561 146 S N -0.632 115.070 115.700 0.004 0.000 2.766 146 S HA 0.635 5.107 4.470 0.004 0.000 0.307 146 S C 0.018 174.621 174.600 0.006 0.000 1.121 146 S CA -0.498 57.705 58.200 0.005 0.000 0.980 146 S CB 1.455 64.657 63.200 0.004 0.000 1.159 146 S HN 0.075 8.388 8.310 0.004 0.000 0.546 147 S N -0.302 115.401 115.700 0.006 0.000 2.738 147 S HA 0.202 4.677 4.470 0.008 0.000 0.284 147 S C 0.236 174.841 174.600 0.008 0.000 1.146 147 S CA -0.562 57.642 58.200 0.007 0.000 0.997 147 S CB 1.226 64.430 63.200 0.006 0.000 1.081 147 S HN 0.105 8.418 8.310 0.005 0.000 0.553 148 G N 1.123 109.929 108.800 0.010 0.000 2.010 148 G HA2 -0.133 3.832 3.960 0.010 0.000 0.088 148 G HA3 -0.133 3.834 3.960 0.012 0.000 0.088 148 G C 0.308 175.216 174.900 0.014 0.000 1.216 148 G CA 0.175 45.282 45.100 0.011 0.000 1.074 148 G HN 0.152 8.448 8.290 0.010 0.000 0.300 149 R N 0.947 121.458 120.500 0.018 0.000 2.046 149 R HA -0.032 4.321 4.340 0.021 0.000 0.223 149 R C 0.299 176.612 176.300 0.022 0.000 1.179 149 R CA 0.093 56.207 56.100 0.023 0.000 0.952 149 R CB 0.045 30.365 30.300 0.033 0.000 0.843 149 R HN -0.046 8.236 8.270 0.019 0.000 0.439 150 E N -3.764 116.450 120.200 0.024 0.000 2.360 150 E HA -0.230 4.133 4.350 0.022 0.000 0.238 150 E C -0.623 175.993 176.600 0.025 0.000 1.186 150 E CA 0.992 57.405 56.400 0.022 0.000 0.719 150 E CB -0.743 28.967 29.700 0.016 0.000 1.236 150 E HN 0.151 8.526 8.360 0.025 0.000 0.386 151 E N -2.258 117.963 120.200 0.035 0.000 2.330 151 E HA -0.027 4.339 4.350 0.027 0.000 0.200 151 E C 0.755 177.386 176.600 0.052 0.000 0.922 151 E CA 0.847 57.270 56.400 0.037 0.000 0.935 151 E CB 0.304 30.027 29.700 0.038 0.000 0.917 151 E HN 0.086 8.466 8.360 0.042 0.005 0.491 152 D N -0.510 119.931 120.400 0.067 0.000 2.182 152 D HA -0.234 4.475 4.640 0.115 0.000 0.201 152 D C 0.370 176.699 176.300 0.049 0.000 0.986 152 D CA 2.374 56.420 54.000 0.077 0.000 0.847 152 D CB -0.498 40.339 40.800 0.061 0.000 0.942 152 D HN 0.140 8.548 8.370 0.064 0.000 0.467 153 A N -2.408 120.433 122.820 0.034 0.000 2.684 153 A HA 0.119 4.453 4.320 0.023 0.000 0.288 153 A C -1.408 176.188 177.584 0.021 0.000 1.337 153 A CA -0.352 51.699 52.037 0.024 0.000 0.946 153 A CB -0.680 18.330 19.000 0.017 0.000 1.093 153 A HN -0.177 7.974 8.150 0.033 0.019 0.543 154 A N -1.055 121.780 122.820 0.024 0.000 3.224 154 A HA 0.093 4.421 4.320 0.014 0.000 0.198 154 A C -1.090 176.504 177.584 0.017 0.000 1.080 154 A CA 0.446 52.493 52.037 0.017 0.000 1.184 154 A CB 0.422 19.431 19.000 0.015 0.000 1.277 154 A HN -0.277 7.735 8.150 0.031 0.157 0.680 155 S N 2.230 117.942 115.700 0.020 0.000 3.455 155 S HA -0.121 4.356 4.470 0.011 0.000 0.288 155 S C -0.070 174.532 174.600 0.004 0.000 1.231 155 S CA 1.388 59.596 58.200 0.014 0.000 1.031 155 S CB -1.176 62.037 63.200 0.022 0.000 1.570 155 S HN 0.131 8.455 8.310 0.023 0.000 0.519 156 T N 2.576 117.131 114.554 0.003 0.000 3.399 156 T HA 0.225 4.573 4.350 -0.004 0.000 0.305 156 T C -0.713 173.989 174.700 0.003 0.000 0.983 156 T CA -0.049 62.051 62.100 0.000 0.000 0.967 156 T CB 0.614 69.483 68.868 0.002 0.000 1.186 156 T HN 0.178 8.401 8.240 0.005 0.020 0.504 157 L N 0.780 122.006 121.223 0.004 0.000 3.333 157 L HA 0.338 4.687 4.340 0.016 0.000 0.299 157 L C -0.125 176.761 176.870 0.027 0.000 1.256 157 L CA -0.016 54.831 54.840 0.013 0.000 1.037 157 L CB 1.394 43.457 42.059 0.007 0.000 1.423 157 L HN -0.284 7.946 8.230 0.000 0.000 0.605 158 V N -3.884 116.041 119.914 0.019 0.000 2.525 158 V HA 0.076 4.248 4.120 0.087 0.000 0.326 158 V C -1.540 174.584 176.094 0.049 0.000 1.477 158 V CA 0.084 62.410 62.300 0.044 0.000 1.579 158 V CB -1.615 30.198 31.823 -0.017 0.000 1.489 158 V HN -0.432 7.759 8.190 0.000 0.000 0.541 159 T N 0.320 114.956 114.554 0.137 0.000 3.523 159 T HA 0.030 4.418 4.350 0.064 0.000 0.288 159 T C 0.816 175.664 174.700 0.247 0.000 0.849 159 T CA 1.575 63.758 62.100 0.138 0.000 0.961 159 T CB 1.419 70.268 68.868 -0.032 0.000 1.179 159 T HN -0.639 7.621 8.240 0.139 0.064 0.598 160 G N 0.769 109.647 108.800 0.128 0.000 2.433 160 G HA2 -0.131 3.876 3.960 0.078 0.000 0.216 160 G HA3 -0.131 3.860 3.960 0.052 0.000 0.216 160 G C 0.327 175.272 174.900 0.075 0.000 1.186 160 G CA 1.412 46.563 45.100 0.084 0.000 0.779 160 G HN 0.091 8.435 8.290 0.090 0.000 0.543 161 S N -2.278 113.455 115.700 0.055 0.000 2.961 161 S HA 0.013 4.444 4.470 -0.064 0.000 0.253 161 S C 0.553 175.122 174.600 -0.051 0.000 1.029 161 S CA 1.145 59.331 58.200 -0.024 0.000 1.087 161 S CB 0.649 63.835 63.200 -0.023 0.000 0.932 161 S HN -0.379 7.973 8.310 0.070 0.000 0.418 162 E N 3.376 123.573 120.200 -0.004 0.000 2.219 162 E HA -0.392 3.935 4.350 -0.038 0.000 0.198 162 E C 1.636 178.235 176.600 -0.002 0.000 0.998 162 E CA 3.150 59.541 56.400 -0.014 0.000 0.818 162 E CB -0.277 29.424 29.700 0.003 0.000 0.741 162 E HN 0.585 8.954 8.360 0.015 0.000 0.477 163 Y N -2.118 118.150 120.300 -0.054 0.000 2.286 163 Y HA -0.174 4.329 4.550 -0.080 0.000 0.293 163 Y C 1.300 177.167 175.900 -0.056 0.000 1.124 163 Y CA 2.113 60.175 58.100 -0.063 0.000 1.178 163 Y CB -0.732 37.694 38.460 -0.057 0.000 1.010 163 Y HN 0.052 8.387 8.280 0.160 0.041 0.536 164 E N 0.188 119.836 120.200 -0.920 0.000 2.046 164 E HA -0.331 3.321 4.350 -1.163 0.000 0.190 164 E C 2.172 178.548 176.600 -0.373 0.000 0.982 164 E CA 3.005 58.893 56.400 -0.854 0.000 0.800 164 E CB -0.315 29.023 29.700 -0.604 0.000 0.756 164 E HN -0.290 7.621 8.360 -0.582 0.099 0.449 165 T N 1.238 115.650 114.554 -0.237 0.000 2.778 165 T HA -0.309 3.966 4.350 -0.125 0.000 0.269 165 T C 1.698 176.327 174.700 -0.119 0.000 1.050 165 T CA 4.779 66.796 62.100 -0.139 0.000 1.137 165 T CB -0.361 68.450 68.868 -0.097 0.000 0.860 165 T HN 0.387 8.490 8.240 -0.228 0.000 0.468 166 M N 1.118 120.644 119.600 -0.124 0.000 2.357 166 M HA -0.065 4.513 4.480 -0.074 -0.143 0.266 166 M C 1.053 177.302 176.300 -0.084 0.000 1.095 166 M CA 2.246 57.495 55.300 -0.085 0.000 1.156 166 M CB -0.082 32.481 32.600 -0.062 0.000 1.365 166 M HN -0.697 7.384 8.290 -0.147 0.121 0.447 167 L N 0.755 121.898 121.223 -0.133 0.000 2.129 167 L HA -0.391 3.933 4.340 -0.026 0.000 0.212 167 L C 1.722 178.550 176.870 -0.069 0.000 1.087 167 L CA 3.576 58.357 54.840 -0.097 0.000 0.757 167 L CB -0.561 41.358 42.059 -0.233 0.000 0.896 167 L HN 0.656 8.541 8.230 -0.222 0.213 0.434 168 T N 0.306 114.807 114.554 -0.088 0.000 2.937 168 T HA -0.270 4.060 4.350 -0.033 0.000 0.260 168 T C 1.613 176.293 174.700 -0.032 0.000 1.051 168 T CA 4.891 66.960 62.100 -0.051 0.000 1.141 168 T CB -0.223 68.605 68.868 -0.066 0.000 0.879 168 T HN -0.057 8.084 8.240 -0.123 0.025 0.459 169 E N 1.839 122.012 120.200 -0.045 0.000 2.097 169 E HA -0.226 4.104 4.350 -0.034 0.000 0.196 169 E C 1.460 178.050 176.600 -0.017 0.000 1.000 169 E CA 3.074 59.452 56.400 -0.037 0.000 0.804 169 E CB -0.440 29.229 29.700 -0.051 0.000 0.740 169 E HN -0.693 7.518 8.360 -0.062 0.111 0.454 170 I N -1.909 118.655 120.570 -0.010 0.000 2.628 170 I HA -0.130 4.058 4.170 0.031 0.000 0.255 170 I C 1.664 177.839 176.117 0.098 0.000 1.119 170 I CA 0.778 62.093 61.300 0.026 0.000 1.448 170 I CB 0.181 38.168 38.000 -0.022 0.000 1.133 170 I HN -0.026 8.162 8.210 -0.025 0.008 0.438 171 M N 1.333 120.981 119.600 0.079 0.000 2.152 171 M HA -0.661 3.944 4.480 0.208 0.000 0.251 171 M C 2.148 178.518 176.300 0.117 0.000 1.080 171 M CA 4.946 60.322 55.300 0.127 0.000 1.079 171 M CB -0.723 31.909 32.600 0.054 0.000 1.317 171 M HN 0.112 8.319 8.290 0.031 0.101 0.404 172 S N -0.576 115.161 115.700 0.062 0.000 2.421 172 S HA -0.390 4.090 4.470 0.018 0.000 0.239 172 S C 1.696 176.318 174.600 0.036 0.000 1.054 172 S CA 3.302 61.522 58.200 0.034 0.000 1.035 172 S CB -0.162 63.049 63.200 0.018 0.000 0.840 172 S HN -0.527 7.803 8.310 0.042 0.006 0.475 173 M N -1.882 117.772 119.600 0.090 0.000 2.346 173 M HA -0.299 4.197 4.480 0.027 0.000 0.263 173 M C 0.801 177.030 176.300 -0.119 0.000 1.064 173 M CA 2.391 57.721 55.300 0.050 0.000 1.083 173 M CB 0.662 33.419 32.600 0.261 0.000 1.399 173 M HN 0.023 8.246 8.290 0.142 0.153 0.435 174 G N -4.386 104.349 108.800 -0.108 0.000 2.147 174 G HA2 -0.205 3.699 3.960 -0.093 0.000 0.128 174 G HA3 -0.205 3.610 3.960 -0.241 0.000 0.128 174 G C -0.532 174.208 174.900 -0.266 0.000 1.026 174 G CA -0.386 44.600 45.100 -0.189 0.000 0.693 174 G HN 0.275 8.411 8.290 0.024 0.169 0.499 175 Y N 0.040 120.346 120.300 0.010 0.000 2.421 175 Y HA 0.121 4.682 4.550 0.019 0.000 0.366 175 Y C 0.405 176.313 175.900 0.012 0.000 1.360 175 Y CA -0.387 57.722 58.100 0.016 0.000 1.663 175 Y CB 1.116 39.588 38.460 0.020 0.000 1.677 175 Y HN -0.533 7.830 8.280 0.138 0.000 0.584 176 E N -1.108 119.227 120.200 0.224 0.000 2.118 176 E HA 0.066 4.466 4.350 0.084 0.000 0.203 176 E C -0.569 176.088 176.600 0.096 0.000 0.958 176 E CA 0.936 57.406 56.400 0.116 0.000 0.957 176 E CB 1.375 31.134 29.700 0.098 0.000 1.205 176 E HN 0.207 8.747 8.360 0.299 0.000 0.494 177 R N -3.581 116.971 120.500 0.087 0.000 3.647 177 R HA 0.005 4.385 4.340 0.066 0.000 0.041 177 R C -0.133 176.211 176.300 0.074 0.000 0.794 177 R CA 1.770 57.913 56.100 0.071 0.000 2.582 177 R CB 0.706 31.042 30.300 0.059 0.000 1.295 177 R HN -0.178 8.147 8.270 0.092 0.000 0.481 178 E N 0.749 120.987 120.200 0.064 0.000 2.153 178 E HA -0.276 4.105 4.350 0.052 0.000 0.194 178 E C 2.207 178.822 176.600 0.024 0.000 0.988 178 E CA 3.960 60.388 56.400 0.046 0.000 0.811 178 E CB -0.552 29.172 29.700 0.040 0.000 0.746 178 E HN 0.473 8.870 8.360 0.062 0.000 0.466 179 R N -1.924 118.593 120.500 0.029 0.000 2.153 179 R HA -0.156 4.188 4.340 0.006 0.000 0.218 179 R C 1.799 178.044 176.300 -0.091 0.000 1.072 179 R CA 2.973 59.071 56.100 -0.004 0.000 0.990 179 R CB -0.377 29.948 30.300 0.043 0.000 0.889 179 R HN 0.193 8.474 8.270 0.052 0.020 0.452 180 V N 0.828 120.695 119.914 -0.078 0.000 2.283 180 V HA -0.278 3.682 4.120 -0.266 0.000 0.243 180 V C 1.966 178.005 176.094 -0.092 0.000 1.039 180 V CA 3.030 65.250 62.300 -0.133 0.000 1.016 180 V CB -0.798 30.998 31.823 -0.044 0.000 0.650 180 V HN -0.867 7.188 8.190 -0.009 0.130 0.449 181 V N 0.342 120.263 119.914 0.011 0.000 2.392 181 V HA -0.475 3.683 4.120 0.062 0.000 0.249 181 V C 0.825 176.840 176.094 -0.131 0.000 1.059 181 V CA 3.089 65.388 62.300 -0.001 0.000 1.051 181 V CB -0.643 31.194 31.823 0.024 0.000 0.658 181 V HN -0.215 8.009 8.190 0.057 0.000 0.455 182 A N -2.219 120.532 122.820 -0.114 0.000 1.865 182 A HA -0.288 3.975 4.320 -0.095 0.000 0.217 182 A C 1.764 179.193 177.584 -0.259 0.000 1.191 182 A CA 2.925 54.894 52.037 -0.113 0.000 0.623 182 A CB -0.304 18.677 19.000 -0.031 0.000 0.826 182 A HN -0.652 7.445 8.150 -0.073 0.009 0.444 183 A N -2.399 120.163 122.820 -0.429 0.000 1.968 183 A HA -0.130 2.802 4.320 -2.312 0.000 0.217 183 A C 1.889 179.043 177.584 -0.716 0.000 1.169 183 A CA 2.546 53.896 52.037 -1.146 0.000 0.638 183 A CB -0.312 18.188 19.000 -0.833 0.000 0.812 183 A HN -0.588 7.390 8.150 -0.286 0.000 0.446 184 L N -4.569 116.435 121.223 -0.364 0.000 2.650 184 L HA -0.072 4.141 4.340 -0.211 0.000 0.235 184 L C 0.498 177.260 176.870 -0.180 0.000 1.149 184 L CA 1.297 56.010 54.840 -0.212 0.000 0.887 184 L CB -0.997 41.011 42.059 -0.084 0.000 1.021 184 L HN 0.347 8.181 8.230 -0.296 0.219 0.441 185 R N -2.164 118.209 120.500 -0.211 0.000 2.257 185 R HA -0.007 4.260 4.340 -0.121 0.000 0.195 185 R C 0.851 177.104 176.300 -0.078 0.000 0.921 185 R CA 1.151 57.170 56.100 -0.135 0.000 1.069 185 R CB 1.590 31.809 30.300 -0.134 0.000 1.115 185 R HN -0.450 7.426 8.270 -0.292 0.219 0.571 186 A N -2.174 120.583 122.820 -0.105 0.000 2.382 186 A HA 0.261 4.625 4.320 0.074 0.000 0.228 186 A C 0.590 178.233 177.584 0.098 0.000 1.217 186 A CA 0.678 52.752 52.037 0.061 0.000 0.923 186 A CB 1.032 20.178 19.000 0.244 0.000 0.979 186 A HN -0.548 7.451 8.150 -0.253 0.000 0.515 187 S N -0.231 115.390 115.700 -0.132 0.000 2.506 187 S HA 0.232 4.852 4.470 0.251 0.000 0.245 187 S C -1.444 173.248 174.600 0.152 0.000 1.088 187 S CA -1.593 56.622 58.200 0.025 0.000 1.099 187 S CB -0.248 62.778 63.200 -0.290 0.000 0.805 187 S HN -0.071 7.961 8.310 -0.314 0.090 0.461 188 Y N -1.410 118.877 120.300 -0.022 0.000 4.490 188 Y HA -0.333 4.215 4.550 -0.003 0.000 0.233 188 Y C -1.089 174.800 175.900 -0.017 0.000 1.101 188 Y CA 0.123 58.219 58.100 -0.006 0.000 2.010 188 Y CB -1.680 36.791 38.460 0.019 0.000 1.622 188 Y HN 0.247 8.532 8.280 0.159 0.090 0.675 189 N N -5.075 113.546 118.700 -0.132 0.000 2.685 189 N HA -0.459 4.207 4.740 -0.142 -0.011 0.251 189 N C -1.423 173.929 175.510 -0.264 0.000 1.020 189 N CA 1.656 54.595 53.050 -0.185 0.000 0.762 189 N CB -1.815 36.576 38.487 -0.160 0.000 0.958 189 N HN 0.281 8.581 8.380 -0.073 0.036 0.539 190 N N -2.638 115.918 118.700 -0.241 0.000 2.381 190 N HA 0.412 5.015 4.740 -0.227 0.000 0.294 190 N C -1.967 173.519 175.510 -0.041 0.000 1.216 190 N CA -1.953 50.982 53.050 -0.192 0.000 0.803 190 N CB 2.709 41.067 38.487 -0.215 0.000 1.372 190 N HN -0.821 7.449 8.380 -0.135 0.029 0.500 191 P HA 0.020 4.412 4.420 -0.046 0.000 0.249 191 P C -1.242 176.026 177.300 -0.054 0.000 1.241 191 P CA 0.978 64.046 63.100 -0.054 0.000 0.781 191 P CB 0.084 31.727 31.700 -0.095 0.000 1.088 192 H N -0.284 118.826 119.070 0.066 0.000 2.332 192 H HA 0.058 4.658 4.556 0.074 0.000 0.316 192 H C 1.668 177.058 175.328 0.103 0.000 1.069 192 H CA 2.608 58.712 56.048 0.093 0.000 1.484 192 H CB 0.694 30.536 29.762 0.133 0.000 1.496 192 H HN -0.028 8.273 8.280 0.206 0.102 0.623 193 R N -0.506 120.178 120.500 0.308 0.000 2.081 193 R HA -0.276 4.186 4.340 0.203 0.000 0.235 193 R C 1.915 178.320 176.300 0.176 0.000 1.131 193 R CA 3.045 59.280 56.100 0.225 0.000 0.960 193 R CB -0.555 29.896 30.300 0.252 0.000 0.856 193 R HN 0.353 8.857 8.270 0.390 0.000 0.436 194 A N -0.581 122.288 122.820 0.082 0.000 1.873 194 A HA -0.299 3.949 4.320 -0.121 0.000 0.218 194 A C 1.913 179.528 177.584 0.050 0.000 1.193 194 A CA 3.362 55.383 52.037 -0.027 0.000 0.629 194 A CB -1.185 17.754 19.000 -0.103 0.000 0.826 194 A HN -0.625 7.574 8.150 0.081 0.000 0.447 195 V N -2.640 117.316 119.914 0.070 0.000 2.380 195 V HA -0.513 3.671 4.120 0.107 0.000 0.251 195 V C 2.400 178.576 176.094 0.136 0.000 1.063 195 V CA 4.037 66.398 62.300 0.102 0.000 1.055 195 V CB -0.189 31.688 31.823 0.090 0.000 0.657 195 V HN 0.142 8.370 8.190 0.064 0.000 0.455 196 E N -0.795 119.496 120.200 0.152 0.000 2.021 196 E HA -0.268 4.156 4.350 0.124 0.000 0.189 196 E C 2.203 178.909 176.600 0.176 0.000 0.980 196 E CA 2.807 59.295 56.400 0.147 0.000 0.803 196 E CB -0.159 29.625 29.700 0.140 0.000 0.766 196 E HN -0.884 7.466 8.360 0.160 0.105 0.449 197 Y N 1.572 121.893 120.300 0.035 0.000 2.283 197 Y HA -0.421 4.205 4.550 0.021 -0.063 0.285 197 Y C 1.869 177.766 175.900 -0.006 0.000 1.176 197 Y CA 2.732 60.841 58.100 0.015 0.000 1.229 197 Y CB -0.259 38.209 38.460 0.013 0.000 0.975 197 Y HN 0.693 9.033 8.280 0.302 0.121 0.537 198 L N -3.910 117.503 121.223 0.316 0.000 2.179 198 L HA -0.334 4.118 4.340 0.187 0.000 0.208 198 L C 1.381 178.354 176.870 0.172 0.000 1.096 198 L CA 2.292 57.229 54.840 0.160 0.000 0.779 198 L CB 0.124 42.147 42.059 -0.060 0.000 0.922 198 L HN 0.481 8.719 8.230 0.248 0.141 0.443 199 L N -4.642 116.675 121.223 0.156 0.000 2.262 199 L HA 0.169 4.597 4.340 0.148 0.000 0.197 199 L C 0.859 177.771 176.870 0.070 0.000 1.073 199 L CA 1.595 56.511 54.840 0.127 0.000 0.800 199 L CB 0.939 43.071 42.059 0.122 0.000 0.987 199 L HN -0.179 8.001 8.230 0.155 0.144 0.470 200 T N -4.728 109.858 114.554 0.054 0.000 4.645 200 T HA 0.060 4.429 4.350 -0.015 -0.028 0.311 200 T C -0.570 174.133 174.700 0.004 0.000 0.904 200 T CA 0.256 62.363 62.100 0.012 0.000 0.907 200 T CB -0.813 68.068 68.868 0.023 0.000 0.959 200 T HN 0.274 8.448 8.240 0.077 0.112 0.417 201 G N 0.412 109.219 108.800 0.011 0.000 2.595 201 G HA2 0.123 4.105 3.960 0.037 0.000 0.213 201 G HA3 0.123 4.168 3.960 0.103 -0.023 0.213 201 G C -0.728 174.138 174.900 -0.057 0.000 1.141 201 G CA 0.726 45.844 45.100 0.031 0.000 0.806 201 G HN 0.341 8.526 8.290 0.025 0.120 0.530 202 I N -2.071 118.353 120.570 -0.242 0.000 3.639 202 I HA 0.484 4.769 4.170 -0.187 -0.227 0.265 202 I C -1.107 174.779 176.117 -0.385 0.000 1.087 202 I CA 0.594 61.674 61.300 -0.367 0.000 1.427 202 I CB -0.384 37.228 38.000 -0.647 0.000 1.824 202 I HN -0.800 7.243 8.210 -0.278 0.000 0.391 203 P HA -0.047 4.228 4.420 -0.242 0.000 0.217 203 P C 0.635 177.839 177.300 -0.160 0.000 1.154 203 P CA 1.930 64.842 63.100 -0.313 0.000 0.841 203 P CB 0.396 31.908 31.700 -0.313 0.000 0.788 204 G N -1.809 106.912 108.800 -0.132 0.000 2.679 204 G HA2 -0.106 3.834 3.960 -0.033 0.000 0.212 204 G HA3 -0.106 4.083 3.960 -0.021 -0.241 0.212 204 G C -0.320 174.553 174.900 -0.046 0.000 1.137 204 G CA 0.104 45.174 45.100 -0.050 0.000 0.787 204 G HN -0.357 7.826 8.290 -0.179 0.000 0.534 205 S N -1.123 114.534 115.700 -0.071 0.000 2.608 205 S HA 0.500 4.955 4.470 -0.026 0.000 0.291 205 S C -1.675 172.898 174.600 -0.045 0.000 1.146 205 S CA -3.344 54.830 58.200 -0.044 0.000 1.043 205 S CB 1.887 65.061 63.200 -0.043 0.000 1.037 205 S HN -0.501 7.546 8.310 -0.118 0.193 0.520 206 P HA -0.006 4.397 4.420 -0.029 0.000 0.218 206 P C -0.927 176.360 177.300 -0.023 0.000 1.152 206 P CA 0.472 63.556 63.100 -0.026 0.000 0.826 206 P CB 0.497 32.183 31.700 -0.023 0.000 0.790 207 E N -1.575 118.619 120.200 -0.011 0.000 2.240 207 E HA -0.243 4.129 4.350 0.037 0.000 0.194 207 E C -1.716 174.889 176.600 0.009 0.000 1.385 207 E CA -0.803 55.603 56.400 0.010 0.000 0.686 207 E CB -0.016 29.679 29.700 -0.008 0.000 1.125 207 E HN 0.303 8.658 8.360 -0.008 0.000 0.359 208 P HA 0.087 4.490 4.420 -0.028 0.000 0.302 208 P C -0.400 176.885 177.300 -0.025 0.000 1.301 208 P CA -0.331 62.746 63.100 -0.038 0.000 0.745 208 P CB 0.665 32.315 31.700 -0.083 0.000 1.331 209 E N -1.853 118.314 120.200 -0.055 0.000 2.312 209 E HA 0.003 4.382 4.350 0.048 0.000 0.259 209 E C -0.168 176.370 176.600 -0.104 0.000 1.122 209 E CA -0.112 56.278 56.400 -0.017 0.000 0.922 209 E CB 0.851 30.541 29.700 -0.017 0.000 1.109 209 E HN 0.032 8.350 8.360 -0.070 0.000 0.442 210 H N -0.253 118.813 119.070 -0.008 0.000 2.176 210 H HA 0.043 4.594 4.556 -0.008 0.000 0.228 210 H C 0.734 176.058 175.328 -0.006 0.000 0.879 210 H CA 0.251 56.294 56.048 -0.008 0.000 1.027 210 H CB 1.256 31.012 29.762 -0.009 0.000 1.356 210 H HN 0.350 8.713 8.280 0.139 0.000 0.425 211 G N 1.127 110.007 108.800 0.134 0.000 2.741 211 G HA2 0.108 4.107 3.960 0.066 0.000 0.301 211 G HA3 0.108 4.102 3.960 0.057 0.000 0.301 211 G C -0.957 173.964 174.900 0.036 0.000 0.834 211 G CA -0.223 44.917 45.100 0.068 0.000 1.683 211 G HN -0.018 8.363 8.290 0.151 0.000 0.506 212 S N 2.601 118.315 115.700 0.022 0.000 2.472 212 S HA 0.271 4.746 4.470 0.009 0.000 0.303 212 S C -0.450 174.155 174.600 0.008 0.000 1.099 212 S CA -0.642 57.563 58.200 0.008 0.000 1.077 212 S CB 1.207 64.403 63.200 -0.007 0.000 1.031 212 S HN -0.353 7.972 8.310 0.024 0.000 0.487 213 V N 2.975 122.893 119.914 0.007 0.000 4.415 213 V HA 0.075 4.199 4.120 0.006 0.000 0.719 213 V C -1.328 174.771 176.094 0.007 0.000 2.114 213 V CA 1.223 63.527 62.300 0.007 0.000 3.163 213 V CB 0.273 32.102 31.823 0.010 0.000 1.047 213 V HN 0.277 8.471 8.190 0.007 0.000 0.650 214 Q N 1.308 121.112 119.800 0.006 0.000 2.563 214 Q HA 0.221 4.566 4.340 0.010 0.000 0.367 214 Q C -0.942 175.063 176.000 0.008 0.000 0.845 214 Q CA -0.142 55.666 55.803 0.009 0.000 1.077 214 Q CB 0.532 29.275 28.738 0.009 0.000 1.409 214 Q HN -0.324 7.949 8.270 0.004 0.000 0.396 215 E N 0.053 120.257 120.200 0.007 0.000 2.291 215 E HA -0.164 4.189 4.350 0.005 0.000 0.181 215 E C -1.397 175.205 176.600 0.003 0.000 1.480 215 E CA 0.449 56.854 56.400 0.007 0.000 0.674 215 E CB -0.258 29.451 29.700 0.014 0.000 1.108 215 E HN 0.029 8.393 8.360 0.006 0.000 0.357 216 S N -0.179 115.519 115.700 -0.003 0.000 2.665 216 S HA 0.090 4.555 4.470 -0.008 0.000 0.235 216 S C -0.850 173.740 174.600 -0.018 0.000 1.084 216 S CA 0.130 58.324 58.200 -0.010 0.000 1.151 216 S CB 0.266 63.461 63.200 -0.009 0.000 1.151 216 S HN -0.078 8.230 8.310 -0.004 0.000 0.461 217 Q N 2.511 122.300 119.800 -0.018 0.000 2.824 217 Q HA 0.201 4.524 4.340 -0.027 0.000 0.371 217 Q C -1.389 174.593 176.000 -0.030 0.000 1.071 217 Q CA -0.685 55.103 55.803 -0.024 0.000 1.064 217 Q CB -0.066 28.661 28.738 -0.019 0.000 1.332 217 Q HN 0.013 8.275 8.270 -0.013 0.000 0.445 218 V N 0.549 120.442 119.914 -0.035 0.000 2.628 218 V HA 0.210 4.300 4.120 -0.050 0.000 0.306 218 V C -0.159 175.906 176.094 -0.048 0.000 1.045 218 V CA -0.571 61.701 62.300 -0.047 0.000 0.905 218 V CB 1.512 33.303 31.823 -0.054 0.000 0.997 218 V HN -0.049 8.121 8.190 -0.033 0.000 0.436 219 S N 5.022 120.691 115.700 -0.051 0.000 2.690 219 S HA 0.135 4.579 4.470 -0.042 0.000 0.285 219 S C 0.097 174.666 174.600 -0.051 0.000 1.135 219 S CA -0.535 57.637 58.200 -0.047 0.000 1.020 219 S CB 1.100 64.275 63.200 -0.043 0.000 1.159 219 S HN 0.196 8.472 8.310 -0.056 0.000 0.534 220 E N -0.661 119.512 120.200 -0.045 0.000 2.389 220 E HA 0.071 4.390 4.350 -0.051 0.000 0.199 220 E C 0.017 176.589 176.600 -0.047 0.000 0.978 220 E CA 0.178 56.550 56.400 -0.046 0.000 0.912 220 E CB 0.540 30.218 29.700 -0.037 0.000 0.907 220 E HN 0.174 8.510 8.360 -0.040 0.000 0.494 221 Q N 0.025 119.799 119.800 -0.043 0.000 2.386 221 Q HA 0.059 4.377 4.340 -0.036 0.000 0.282 221 Q C -1.019 174.951 176.000 -0.051 0.000 1.050 221 Q CA -1.513 54.266 55.803 -0.041 0.000 0.918 221 Q CB -0.572 28.145 28.738 -0.036 0.000 1.266 221 Q HN -0.640 7.606 8.270 -0.041 0.000 0.423 222 P HA -0.043 4.335 4.420 -0.069 0.000 0.231 222 P C -1.474 175.793 177.300 -0.055 0.000 1.756 222 P CA -0.402 62.664 63.100 -0.056 0.000 0.990 222 P CB -1.909 29.764 31.700 -0.045 0.000 1.973 223 A N -0.620 122.164 122.820 -0.060 0.000 2.060 223 A HA -0.239 4.049 4.320 -0.053 0.000 0.267 223 A C -0.841 176.721 177.584 -0.038 0.000 1.378 223 A CA 0.988 52.994 52.037 -0.053 0.000 0.733 223 A CB -1.146 17.817 19.000 -0.061 0.000 1.188 223 A HN 0.153 8.193 8.150 -0.065 0.071 0.311 224 T N -3.000 111.534 114.554 -0.033 0.000 2.964 224 T HA -0.010 4.327 4.350 -0.023 0.000 0.249 224 T C 0.422 175.110 174.700 -0.021 0.000 1.000 224 T CA -0.382 61.703 62.100 -0.025 0.000 0.992 224 T CB 0.913 69.767 68.868 -0.023 0.000 1.087 224 T HN -0.215 8.004 8.240 -0.035 0.000 0.489 225 E N 2.002 122.189 120.200 -0.023 0.000 2.973 225 E HA -0.050 4.290 4.350 -0.017 0.000 0.279 225 E C 0.241 176.831 176.600 -0.016 0.000 1.473 225 E CA -0.143 56.246 56.400 -0.019 0.000 1.251 225 E CB 0.254 29.942 29.700 -0.021 0.000 1.063 225 E HN -0.271 8.073 8.360 -0.027 0.000 0.685 226 A N -0.067 122.745 122.820 -0.014 0.000 2.238 226 A HA -0.130 4.184 4.320 -0.010 0.000 0.276 226 A C -0.638 176.939 177.584 -0.012 0.000 1.464 226 A CA 0.426 52.456 52.037 -0.011 0.000 0.835 226 A CB 0.030 19.024 19.000 -0.010 0.000 1.277 226 A HN 0.030 8.172 8.150 -0.014 0.000 0.534 227 A N -4.080 118.735 122.820 -0.009 0.000 6.131 227 A HA -0.144 4.173 4.320 -0.006 0.000 0.421 227 A C -0.798 176.781 177.584 -0.008 0.000 1.585 227 A CA -0.007 52.025 52.037 -0.008 0.000 0.641 227 A CB -0.052 18.941 19.000 -0.011 0.000 2.282 227 A HN -0.169 7.977 8.150 -0.008 0.000 0.449 228 G N 0.033 108.829 108.800 -0.005 0.000 4.370 228 G HA2 0.098 4.054 3.960 -0.008 0.000 0.295 228 G HA3 0.098 4.059 3.960 0.000 0.000 0.295 228 G C -1.289 173.610 174.900 -0.000 0.000 1.312 228 G CA -0.100 44.997 45.100 -0.004 0.000 0.845 228 G HN 0.106 8.394 8.290 -0.003 0.000 0.531 229 E N 1.030 121.226 120.200 -0.007 0.000 2.354 229 E HA 0.046 4.404 4.350 0.012 0.000 0.269 229 E C -0.584 176.018 176.600 0.004 0.000 1.036 229 E CA 0.273 56.673 56.400 0.001 0.000 0.876 229 E CB 0.740 30.432 29.700 -0.013 0.000 1.009 229 E HN -0.054 8.297 8.360 -0.015 0.000 0.416 230 N N 2.889 121.607 118.700 0.030 0.000 2.370 230 N HA 0.241 4.984 4.740 0.004 0.000 0.303 230 N C -1.926 173.638 175.510 0.090 0.000 1.103 230 N CA -2.218 50.851 53.050 0.030 0.000 0.848 230 N CB 0.650 39.158 38.487 0.034 0.000 1.235 230 N HN -0.086 8.319 8.380 0.043 0.000 0.496 231 P HA 0.082 4.758 4.420 0.427 0.000 0.263 231 P C -1.876 175.572 177.300 0.246 0.000 1.601 231 P CA 0.144 63.406 63.100 0.270 0.000 1.161 231 P CB -1.057 30.692 31.700 0.082 0.000 1.730 232 L N 1.412 122.768 121.223 0.221 0.000 2.203 232 L HA 0.015 4.238 4.340 -0.195 0.000 0.254 232 L C 0.682 177.432 176.870 -0.201 0.000 1.162 232 L CA 2.275 57.063 54.840 -0.087 0.000 1.407 232 L CB 1.170 43.223 42.059 -0.009 0.000 2.645 232 L HN -0.107 8.382 8.230 0.460 0.018 0.525 233 E N 0.770 120.946 120.200 -0.039 0.000 2.112 233 E HA -0.240 4.018 4.350 -0.154 0.000 0.190 233 E C 2.012 178.553 176.600 -0.100 0.000 0.979 233 E CA 3.312 59.665 56.400 -0.078 0.000 0.814 233 E CB 0.449 30.159 29.700 0.016 0.000 0.762 233 E HN -0.655 7.761 8.360 0.092 0.000 0.460 234 F N -2.453 117.464 119.950 -0.055 0.000 2.186 234 F HA -0.291 4.215 4.527 -0.035 0.000 0.299 234 F C 1.127 176.913 175.800 -0.023 0.000 1.090 234 F CA 3.131 61.108 58.000 -0.037 0.000 1.307 234 F CB -0.668 38.315 39.000 -0.029 0.000 1.019 234 F HN -0.436 8.121 8.300 0.428 0.000 0.489 235 L N -1.049 119.282 121.223 -1.487 0.000 2.127 235 L HA -0.152 4.032 4.340 -0.551 -0.175 0.203 235 L C 1.703 178.335 176.870 -0.397 0.000 1.080 235 L CA 2.172 56.486 54.840 -0.876 0.000 0.768 235 L CB 0.159 41.602 42.059 -1.026 0.000 0.924 235 L HN -0.608 6.353 8.230 -2.093 0.013 0.444 236 R N -2.561 117.576 120.500 -0.604 0.000 2.200 236 R HA -0.344 2.712 4.340 -2.140 0.000 0.234 236 R C 0.817 176.835 176.300 -0.470 0.000 1.127 236 R CA 2.682 58.184 56.100 -0.997 0.000 0.989 236 R CB -0.138 29.668 30.300 -0.822 0.000 0.869 236 R HN -0.333 7.569 8.270 -0.613 0.000 0.459 237 D N -4.361 115.885 120.400 -0.256 0.000 2.355 237 D HA 0.124 4.733 4.640 -0.104 -0.031 0.206 237 D C -0.283 175.997 176.300 -0.033 0.000 1.010 237 D CA 0.912 54.846 54.000 -0.109 0.000 0.875 237 D CB 0.777 41.535 40.800 -0.069 0.000 0.966 237 D HN -0.631 7.428 8.370 -0.277 0.145 0.512 238 Q N -0.676 119.108 119.800 -0.026 0.000 2.471 238 Q HA 0.106 4.473 4.340 0.046 0.000 0.223 238 Q C -0.327 175.716 176.000 0.072 0.000 1.045 238 Q CA -0.887 54.939 55.803 0.038 0.000 0.956 238 Q CB 0.483 29.250 28.738 0.047 0.000 1.249 238 Q HN -0.889 7.193 8.270 -0.096 0.130 0.549 239 P HA -0.137 4.325 4.420 0.069 0.000 0.222 239 P C 1.252 178.601 177.300 0.082 0.000 1.153 239 P CA 2.489 65.631 63.100 0.069 0.000 0.798 239 P CB 0.331 32.062 31.700 0.051 0.000 0.796 240 Q N -0.839 119.016 119.800 0.090 0.000 2.030 240 Q HA -0.315 4.059 4.340 0.057 0.000 0.204 240 Q C 2.171 178.234 176.000 0.106 0.000 0.986 240 Q CA 3.829 59.683 55.803 0.085 0.000 0.843 240 Q CB -0.884 27.909 28.738 0.091 0.000 0.904 240 Q HN -0.067 8.228 8.270 0.088 0.028 0.420 241 F N 0.435 120.386 119.950 0.003 0.000 2.146 241 F HA -0.246 4.307 4.527 0.045 0.000 0.298 241 F C 1.552 177.344 175.800 -0.013 0.000 1.096 241 F CA 2.652 60.658 58.000 0.010 0.000 1.275 241 F CB -0.008 38.988 39.000 -0.007 0.000 1.008 241 F HN -0.389 8.070 8.300 0.266 0.000 0.480 242 Q N -2.140 117.843 119.800 0.305 0.000 2.135 242 Q HA -0.471 4.023 4.340 0.257 0.000 0.204 242 Q C 2.481 178.515 176.000 0.057 0.000 0.981 242 Q CA 3.564 59.478 55.803 0.185 0.000 0.856 242 Q CB -0.544 28.265 28.738 0.120 0.000 0.902 242 Q HN -0.428 8.009 8.270 0.279 0.000 0.425 243 N N -0.088 118.627 118.700 0.024 0.000 2.244 243 N HA -0.212 4.524 4.740 -0.007 0.000 0.183 243 N C 1.973 177.438 175.510 -0.075 0.000 1.016 243 N CA 2.928 55.968 53.050 -0.016 0.000 0.866 243 N CB 0.007 38.490 38.487 -0.006 0.000 0.980 243 N HN -0.255 8.144 8.380 0.049 0.010 0.430 244 M N -1.533 117.976 119.600 -0.152 0.000 2.476 244 M HA -0.183 4.187 4.480 -0.183 0.000 0.262 244 M C 1.400 177.524 176.300 -0.293 0.000 1.079 244 M CA 2.909 58.052 55.300 -0.262 0.000 1.104 244 M CB 0.079 32.420 32.600 -0.432 0.000 1.409 244 M HN -0.798 7.285 8.290 -0.141 0.122 0.467 245 R N -2.803 117.562 120.500 -0.225 0.000 2.265 245 R HA 0.050 4.287 4.340 -0.172 0.000 0.194 245 R C 1.054 177.322 176.300 -0.053 0.000 0.931 245 R CA 1.530 57.556 56.100 -0.123 0.000 1.032 245 R CB 0.431 30.751 30.300 0.035 0.000 0.980 245 R HN -0.511 7.490 8.270 -0.164 0.171 0.497 246 Q N -2.364 117.410 119.800 -0.044 0.000 2.390 246 Q HA 0.070 4.400 4.340 -0.016 0.000 0.216 246 Q C 1.998 177.977 176.000 -0.034 0.000 0.916 246 Q CA 2.319 58.108 55.803 -0.024 0.000 0.911 246 Q CB 1.727 30.461 28.738 -0.007 0.000 1.035 246 Q HN -0.419 7.657 8.270 -0.055 0.162 0.541 247 V N -2.933 116.953 119.914 -0.047 0.000 2.719 247 V HA -0.221 3.880 4.120 -0.031 0.000 0.252 247 V C 1.539 177.601 176.094 -0.052 0.000 1.065 247 V CA 2.122 64.396 62.300 -0.044 0.000 1.086 247 V CB -0.587 31.208 31.823 -0.046 0.000 0.700 247 V HN 0.266 8.306 8.190 -0.057 0.116 0.467 248 I N -1.116 119.410 120.570 -0.073 0.000 2.617 248 I HA -0.120 4.251 4.170 -0.068 -0.242 0.256 248 I C 2.054 178.137 176.117 -0.056 0.000 1.167 248 I CA 0.638 61.892 61.300 -0.076 0.000 1.469 248 I CB -0.365 37.566 38.000 -0.116 0.000 1.098 248 I HN -0.678 7.453 8.210 -0.088 0.026 0.436 249 Q N -1.449 118.322 119.800 -0.048 0.000 2.297 249 Q HA -0.257 4.062 4.340 -0.034 0.000 0.208 249 Q C 0.674 176.658 176.000 -0.026 0.000 0.981 249 Q CA 2.574 58.357 55.803 -0.033 0.000 0.876 249 Q CB -0.296 28.428 28.738 -0.024 0.000 0.921 249 Q HN 0.321 8.447 8.270 -0.051 0.113 0.446 250 Q N -3.737 116.047 119.800 -0.027 0.000 2.350 250 Q HA 0.030 4.359 4.340 -0.018 0.000 0.225 250 Q C -0.851 175.136 176.000 -0.023 0.000 0.878 250 Q CA 0.006 55.796 55.803 -0.021 0.000 0.935 250 Q CB 1.711 30.439 28.738 -0.018 0.000 1.099 250 Q HN -0.528 7.675 8.270 -0.032 0.048 0.527 251 N N -1.834 116.848 118.700 -0.029 0.000 2.542 251 N HA 0.352 5.077 4.740 -0.024 0.000 0.288 251 N C -2.231 173.257 175.510 -0.037 0.000 1.115 251 N CA -2.397 50.636 53.050 -0.029 0.000 0.924 251 N CB 1.668 40.140 38.487 -0.026 0.000 1.526 251 N HN -0.906 7.323 8.380 -0.035 0.130 0.515 252 P HA 0.167 4.557 4.420 -0.050 0.000 0.237 252 P C -0.736 176.542 177.300 -0.037 0.000 1.178 252 P CA 1.149 64.225 63.100 -0.040 0.000 0.766 252 P CB 0.178 31.859 31.700 -0.032 0.000 0.876 253 A N -3.003 119.799 122.820 -0.031 0.000 2.178 253 A HA 0.014 4.320 4.320 -0.024 0.000 0.211 253 A C 1.050 178.616 177.584 -0.029 0.000 1.157 253 A CA 1.407 53.429 52.037 -0.026 0.000 0.780 253 A CB 0.223 19.212 19.000 -0.019 0.000 0.828 253 A HN -0.493 7.770 8.150 -0.029 -0.131 0.476 254 L N -0.722 120.478 121.223 -0.037 0.000 2.179 254 L HA -0.217 4.105 4.340 -0.031 0.000 0.208 254 L C 1.166 178.005 176.870 -0.053 0.000 1.096 254 L CA 2.354 57.170 54.840 -0.041 0.000 0.779 254 L CB -0.088 41.944 42.059 -0.045 0.000 0.922 254 L HN -0.589 7.466 8.230 -0.039 0.151 0.443 255 L N -0.076 121.106 121.223 -0.069 0.000 1.990 255 L HA -0.315 3.950 4.340 -0.125 0.000 0.213 255 L C -0.871 175.968 176.870 -0.051 0.000 1.072 255 L CA 6.327 61.112 54.840 -0.091 0.000 0.755 255 L CB -2.436 39.561 42.059 -0.105 0.000 0.889 255 L HN -0.023 8.167 8.230 -0.067 0.000 0.432 256 P HA -0.130 4.293 4.420 0.005 0.000 0.216 256 P C 1.152 178.449 177.300 -0.004 0.000 1.153 256 P CA 2.669 65.764 63.100 -0.008 0.000 0.844 256 P CB -0.821 30.874 31.700 -0.008 0.000 0.787 257 A N -2.347 120.466 122.820 -0.012 0.000 1.972 257 A HA -0.221 4.097 4.320 -0.003 0.000 0.219 257 A C 2.271 179.852 177.584 -0.006 0.000 1.169 257 A CA 2.739 54.772 52.037 -0.008 0.000 0.635 257 A CB -0.568 18.424 19.000 -0.013 0.000 0.810 257 A HN -0.584 7.555 8.150 -0.019 0.000 0.446 258 L N -2.818 118.397 121.223 -0.013 0.000 2.168 258 L HA -0.074 4.262 4.340 -0.006 0.000 0.203 258 L C 2.360 179.238 176.870 0.013 0.000 1.078 258 L CA 2.322 57.156 54.840 -0.009 0.000 0.780 258 L CB 0.166 42.203 42.059 -0.036 0.000 0.939 258 L HN 0.118 8.119 8.230 -0.023 0.215 0.451 259 L N -0.483 120.756 121.223 0.025 0.000 2.263 259 L HA -0.362 4.047 4.340 0.114 0.000 0.216 259 L C 0.882 177.782 176.870 0.050 0.000 1.111 259 L CA 2.306 57.190 54.840 0.073 0.000 0.773 259 L CB -0.008 42.104 42.059 0.088 0.000 0.906 259 L HN 0.321 8.442 8.230 0.006 0.113 0.439 260 Q N -6.844 112.974 119.800 0.029 0.000 2.402 260 Q HA -0.070 4.536 4.340 0.024 -0.251 0.206 260 Q C 0.475 176.486 176.000 0.018 0.000 0.919 260 Q CA 1.113 56.929 55.803 0.022 0.000 0.923 260 Q CB 0.860 29.608 28.738 0.016 0.000 1.048 260 Q HN -0.573 7.665 8.270 0.022 0.045 0.515 261 Q N -3.816 115.994 119.800 0.017 0.000 2.612 261 Q HA -0.066 4.283 4.340 0.014 0.000 0.193 261 Q C 0.858 176.869 176.000 0.019 0.000 0.828 261 Q CA 1.071 56.882 55.803 0.014 0.000 0.851 261 Q CB 1.226 29.969 28.738 0.009 0.000 1.178 261 Q HN -0.154 7.941 8.270 0.017 0.185 0.634 262 L N 0.040 121.273 121.223 0.017 0.000 1.970 262 L HA -0.085 4.413 4.340 0.024 -0.144 0.212 262 L C 2.423 179.316 176.870 0.038 0.000 1.071 262 L CA 3.010 57.864 54.840 0.023 0.000 0.751 262 L CB -0.309 41.755 42.059 0.009 0.000 0.889 262 L HN 0.017 8.254 8.230 0.011 0.000 0.432 263 G N -4.945 103.886 108.800 0.050 0.000 2.559 263 G HA2 -0.288 3.720 3.960 0.081 0.000 0.216 263 G HA3 -0.288 3.744 3.960 0.120 0.000 0.216 263 G C 0.488 175.409 174.900 0.035 0.000 1.126 263 G CA 1.269 46.413 45.100 0.073 0.000 0.778 263 G HN -0.318 7.877 8.290 0.043 0.121 0.543 264 Q N -1.505 118.313 119.800 0.031 0.000 2.212 264 Q HA 0.060 4.407 4.340 0.012 0.000 0.213 264 Q C -0.075 175.937 176.000 0.020 0.000 0.874 264 Q CA 0.002 55.816 55.803 0.019 0.000 0.965 264 Q CB -0.294 28.456 28.738 0.019 0.000 1.074 264 Q HN -0.383 7.719 8.270 0.033 0.187 0.473 265 E N -0.546 119.670 120.200 0.028 0.000 2.431 265 E HA 0.028 4.392 4.350 0.024 0.000 0.200 265 E C -0.548 176.075 176.600 0.038 0.000 0.995 265 E CA 0.432 56.850 56.400 0.030 0.000 0.915 265 E CB 1.085 30.806 29.700 0.035 0.000 0.930 265 E HN -0.489 7.797 8.360 0.033 0.094 0.496 266 N N -0.233 118.496 118.700 0.048 0.000 2.479 266 N HA 0.435 5.210 4.740 0.058 0.000 0.261 266 N C -1.451 174.086 175.510 0.045 0.000 0.979 266 N CA -2.517 50.573 53.050 0.067 0.000 0.930 266 N CB 0.633 39.202 38.487 0.135 0.000 1.172 266 N HN -0.584 7.821 8.380 0.043 0.000 0.499 267 P HA -0.043 4.375 4.420 -0.002 0.000 0.225 267 P C 1.072 178.370 177.300 -0.003 0.000 1.156 267 P CA 1.679 64.780 63.100 0.002 0.000 0.787 267 P CB 0.594 32.290 31.700 -0.007 0.000 0.802 268 Q N -2.044 117.759 119.800 0.006 0.000 2.135 268 Q HA -0.194 4.102 4.340 -0.072 0.000 0.204 268 Q C 1.328 177.356 176.000 0.047 0.000 0.981 268 Q CA 2.986 58.771 55.803 -0.030 0.000 0.856 268 Q CB -0.782 27.878 28.738 -0.129 0.000 0.902 268 Q HN 0.444 8.686 8.270 0.019 0.040 0.425 269 L N -1.637 119.663 121.223 0.129 0.000 2.316 269 L HA -0.007 4.366 4.340 0.054 0.000 0.207 269 L C 1.106 177.913 176.870 -0.105 0.000 1.070 269 L CA 1.601 56.461 54.840 0.034 0.000 0.820 269 L CB 0.764 42.821 42.059 -0.004 0.000 0.992 269 L HN -0.615 7.691 8.230 0.146 0.012 0.466 270 L N 0.594 121.773 121.223 -0.073 0.000 2.021 270 L HA -0.496 3.779 4.340 -0.108 0.000 0.215 270 L C 1.808 178.643 176.870 -0.058 0.000 1.074 270 L CA 3.736 58.531 54.840 -0.075 0.000 0.760 270 L CB -0.895 41.144 42.059 -0.032 0.000 0.889 270 L HN -0.315 7.898 8.230 -0.028 0.000 0.433 271 Q N -5.039 114.735 119.800 -0.043 0.000 2.308 271 Q HA -0.453 3.876 4.340 -0.018 0.000 0.209 271 Q C 1.924 177.904 176.000 -0.034 0.000 0.985 271 Q CA 2.626 58.410 55.803 -0.031 0.000 0.881 271 Q CB -0.588 28.132 28.738 -0.031 0.000 0.917 271 Q HN -0.436 7.812 8.270 -0.037 0.000 0.443 272 Q N -1.915 117.838 119.800 -0.078 0.000 2.442 272 Q HA 0.017 4.341 4.340 -0.027 0.000 0.228 272 Q C 2.281 178.256 176.000 -0.041 0.000 0.902 272 Q CA 1.191 56.930 55.803 -0.107 0.000 0.933 272 Q CB 0.810 29.370 28.738 -0.297 0.000 1.071 272 Q HN -0.085 7.940 8.270 -0.098 0.187 0.562 273 I N 1.851 122.339 120.570 -0.136 0.000 2.248 273 I HA -0.669 3.440 4.170 -0.102 0.000 0.248 273 I C 1.611 177.761 176.117 0.054 0.000 1.107 273 I CA 4.694 65.922 61.300 -0.120 0.000 1.373 273 I CB -0.233 37.578 38.000 -0.316 0.000 1.055 273 I HN 0.615 8.593 8.210 -0.193 0.116 0.418 274 S N -2.119 113.602 115.700 0.035 0.000 2.399 274 S HA -0.252 4.254 4.470 0.060 0.000 0.231 274 S C 1.572 176.223 174.600 0.085 0.000 1.022 274 S CA 3.176 61.411 58.200 0.057 0.000 0.983 274 S CB -0.038 63.183 63.200 0.034 0.000 0.803 274 S HN -0.531 7.764 8.310 -0.002 0.014 0.480 275 R N -1.903 118.671 120.500 0.125 0.000 2.365 275 R HA 0.154 4.542 4.340 0.080 0.000 0.223 275 R C 0.857 177.252 176.300 0.158 0.000 0.899 275 R CA 0.030 56.211 56.100 0.136 0.000 1.059 275 R CB 1.264 31.660 30.300 0.160 0.000 1.086 275 R HN -0.373 7.830 8.270 0.129 0.144 0.522 276 H N -1.700 117.403 119.070 0.055 0.000 2.486 276 H HA 0.318 4.924 4.556 0.083 0.000 0.284 276 H C 0.513 175.942 175.328 0.169 0.000 1.103 276 H CA -0.390 55.716 56.048 0.097 0.000 1.089 276 H CB 0.644 30.457 29.762 0.085 0.000 1.603 276 H HN 0.171 8.364 8.280 0.288 0.260 0.557 277 Q N -0.303 119.626 119.800 0.215 0.000 2.268 277 Q HA -0.451 4.077 4.340 0.313 0.000 0.210 277 Q C 1.792 177.886 176.000 0.156 0.000 0.988 277 Q CA 4.467 60.397 55.803 0.211 0.000 0.883 277 Q CB -0.367 28.446 28.738 0.124 0.000 0.911 277 Q HN 0.008 8.308 8.270 0.164 0.068 0.430 278 E N -1.415 118.843 120.200 0.097 0.000 2.024 278 E HA -0.238 4.137 4.350 0.042 0.000 0.190 278 E C 2.289 178.937 176.600 0.081 0.000 0.974 278 E CA 3.092 59.524 56.400 0.053 0.000 0.810 278 E CB -0.893 28.811 29.700 0.006 0.000 0.775 278 E HN 0.159 8.528 8.360 0.072 0.034 0.453 279 Q N 0.100 119.957 119.800 0.094 0.000 2.050 279 Q HA -0.269 4.128 4.340 0.094 0.000 0.202 279 Q C 2.695 178.849 176.000 0.257 0.000 0.980 279 Q CA 3.220 59.113 55.803 0.149 0.000 0.840 279 Q CB -0.161 28.680 28.738 0.172 0.000 0.898 279 Q HN -0.153 8.138 8.270 0.034 0.000 0.424 280 F N 0.507 120.556 119.950 0.165 0.000 2.046 280 F HA -0.282 4.371 4.527 0.210 0.000 0.297 280 F C 1.534 177.434 175.800 0.167 0.000 1.123 280 F CA 2.528 60.639 58.000 0.186 0.000 1.199 280 F CB -0.157 38.945 39.000 0.169 0.000 0.972 280 F HN 0.429 8.906 8.300 0.473 0.107 0.474 281 I N -1.997 118.506 120.570 -0.111 0.000 2.286 281 I HA -0.620 3.247 4.170 -0.506 0.000 0.248 281 I C 2.017 178.067 176.117 -0.111 0.000 1.115 281 I CA 3.496 64.646 61.300 -0.250 0.000 1.392 281 I CB -0.338 37.602 38.000 -0.101 0.000 1.065 281 I HN -0.791 7.498 8.210 0.132 0.000 0.418 282 Q N -1.604 118.188 119.800 -0.013 0.000 2.096 282 Q HA -0.404 3.931 4.340 -0.007 0.000 0.204 282 Q C 2.548 178.563 176.000 0.025 0.000 0.982 282 Q CA 3.358 59.166 55.803 0.008 0.000 0.850 282 Q CB -0.223 28.534 28.738 0.033 0.000 0.901 282 Q HN 0.269 8.365 8.270 0.029 0.192 0.422 283 M N -0.447 119.194 119.600 0.067 0.000 2.288 283 M HA -0.227 4.483 4.480 0.058 -0.196 0.266 283 M C 2.311 178.745 176.300 0.223 0.000 1.072 283 M CA 3.690 59.056 55.300 0.110 0.000 1.132 283 M CB 0.342 33.004 32.600 0.103 0.000 1.386 283 M HN -0.324 7.920 8.290 0.083 0.096 0.432 284 L N -1.545 119.785 121.223 0.178 0.000 2.201 284 L HA -0.374 4.062 4.340 0.161 0.000 0.212 284 L C 1.213 178.055 176.870 -0.047 0.000 1.105 284 L CA 3.141 57.968 54.840 -0.021 0.000 0.775 284 L CB 0.001 41.759 42.059 -0.502 0.000 0.913 284 L HN -0.377 7.777 8.230 0.028 0.093 0.440 285 N N -4.384 114.291 118.700 -0.041 0.000 2.415 285 N HA 0.047 4.759 4.740 -0.047 0.000 0.174 285 N C -0.292 175.215 175.510 -0.005 0.000 1.048 285 N CA 1.247 54.275 53.050 -0.036 0.000 0.895 285 N CB 1.971 40.430 38.487 -0.047 0.000 1.036 285 N HN -0.473 7.761 8.380 -0.038 0.124 0.449 286 E N -0.942 119.264 120.200 0.011 0.000 2.397 286 E HA 0.338 4.695 4.350 0.011 0.000 0.293 286 E C -2.720 173.891 176.600 0.017 0.000 0.930 286 E CA -2.851 53.556 56.400 0.012 0.000 0.793 286 E CB 2.772 32.473 29.700 0.002 0.000 1.259 286 E HN -0.089 8.100 8.360 0.018 0.181 0.406 287 P HA 0.347 4.765 4.420 -0.005 0.000 0.274 287 P C -1.405 175.892 177.300 -0.004 0.000 1.256 287 P CA -1.652 61.447 63.100 -0.002 0.000 0.795 287 P CB -0.094 31.601 31.700 -0.010 0.000 1.038 288 P HA -0.050 4.369 4.420 -0.002 0.000 0.215 288 P C -0.295 176.999 177.300 -0.010 0.000 1.157 288 P CA 0.468 63.564 63.100 -0.007 0.000 0.856 288 P CB 0.500 32.195 31.700 -0.008 0.000 0.786 289 G N -2.175 106.617 108.800 -0.013 0.000 2.308 289 G HA2 -0.078 3.874 3.960 -0.013 0.000 0.288 289 G HA3 -0.078 3.874 3.960 -0.013 0.000 0.288 289 G C -1.898 172.993 174.900 -0.016 0.000 1.722 289 G CA -0.428 44.664 45.100 -0.014 0.000 0.924 289 G HN -0.656 7.623 8.290 -0.017 0.000 0.732 290 E N 0.082 120.272 120.200 -0.016 0.000 2.399 290 E HA 0.196 4.535 4.350 -0.018 0.000 0.205 290 E C 0.941 177.531 176.600 -0.017 0.000 0.906 290 E CA 0.319 56.709 56.400 -0.017 0.000 0.998 290 E CB 0.686 30.377 29.700 -0.015 0.000 1.002 290 E HN 0.171 8.523 8.360 -0.015 0.000 0.501 291 L N -5.244 115.968 121.223 -0.018 0.000 2.463 291 L HA 0.301 4.628 4.340 -0.022 0.000 0.219 291 L C -1.195 175.661 176.870 -0.024 0.000 1.088 291 L CA 1.029 55.856 54.840 -0.022 0.000 0.849 291 L CB 0.268 42.312 42.059 -0.025 0.000 1.012 291 L HN -0.535 7.684 8.230 -0.017 0.000 0.468 292 A N -3.433 119.374 122.820 -0.022 0.000 3.218 292 A HA 0.337 4.768 4.320 -0.023 -0.124 0.321 292 A C -0.942 176.632 177.584 -0.017 0.000 1.012 292 A CA -0.499 51.526 52.037 -0.021 0.000 0.948 292 A CB -0.949 18.038 19.000 -0.022 0.000 1.050 292 A HN -0.429 7.710 8.150 -0.020 0.000 0.492 293 D N -0.055 120.335 120.400 -0.017 0.000 1.664 293 D HA 0.002 4.634 4.640 -0.013 0.000 0.621 293 D C 0.179 176.472 176.300 -0.013 0.000 0.872 293 D CA 1.105 55.097 54.000 -0.014 0.000 1.120 293 D CB 1.035 41.827 40.800 -0.013 0.000 1.606 293 D HN 0.077 8.436 8.370 -0.018 0.000 0.511 294 I N 0.043 120.604 120.570 -0.014 0.000 2.810 294 I HA 0.052 4.215 4.170 -0.012 0.000 0.262 294 I C 0.228 176.336 176.117 -0.014 0.000 1.131 294 I CA 0.802 62.094 61.300 -0.013 0.000 1.453 294 I CB 1.172 39.164 38.000 -0.014 0.000 1.161 294 I HN -0.276 7.925 8.210 -0.016 0.000 0.444 295 S N -0.233 115.457 115.700 -0.017 0.000 2.571 295 S HA 0.114 4.574 4.470 -0.017 0.000 0.238 295 S C -1.522 173.065 174.600 -0.022 0.000 1.153 295 S CA -0.370 57.819 58.200 -0.018 0.000 1.141 295 S CB 0.987 64.176 63.200 -0.018 0.000 1.133 295 S HN -0.167 8.133 8.310 -0.018 0.000 0.464 296 D N 7.020 127.406 120.400 -0.022 0.000 2.896 296 D HA 0.125 4.747 4.640 -0.029 0.000 0.240 296 D C -1.268 175.015 176.300 -0.029 0.000 1.193 296 D CA -0.762 53.222 54.000 -0.027 0.000 0.983 296 D CB -0.774 40.012 40.800 -0.024 0.000 1.074 296 D HN 0.255 8.613 8.370 -0.020 0.000 0.496 297 V N -0.223 119.672 119.914 -0.031 0.000 2.670 297 V HA 0.220 4.320 4.120 -0.033 0.000 0.258 297 V C -1.516 174.555 176.094 -0.038 0.000 0.906 297 V CA -0.276 62.005 62.300 -0.032 0.000 0.887 297 V CB 0.808 32.615 31.823 -0.026 0.000 1.059 297 V HN -0.678 7.436 8.190 -0.031 0.058 0.484 298 E N 5.445 125.616 120.200 -0.049 0.000 2.466 298 E HA 0.191 4.510 4.350 -0.051 0.000 0.308 298 E C 0.029 176.579 176.600 -0.084 0.000 0.933 298 E CA 0.525 56.889 56.400 -0.059 0.000 0.800 298 E CB 1.605 31.271 29.700 -0.058 0.000 1.434 298 E HN 0.070 8.399 8.360 -0.051 0.000 0.389 299 G N 2.951 111.701 108.800 -0.083 0.000 2.164 299 G HA2 -0.270 3.827 3.960 -0.106 0.000 0.212 299 G HA3 -0.270 3.658 3.960 -0.154 -0.060 0.212 299 G C -1.188 173.659 174.900 -0.088 0.000 1.031 299 G CA 0.385 45.419 45.100 -0.111 0.000 0.730 299 G HN 0.234 8.486 8.290 -0.065 0.000 0.501 300 E N -2.875 117.287 120.200 -0.064 0.000 3.875 300 E HA 0.143 4.460 4.350 -0.055 0.000 0.239 300 E C -1.581 174.996 176.600 -0.039 0.000 1.293 300 E CA 0.127 56.495 56.400 -0.052 0.000 1.646 300 E CB 1.813 31.483 29.700 -0.049 0.000 1.954 300 E HN -0.381 7.945 8.360 -0.057 0.000 0.686 301 V N 0.454 120.347 119.914 -0.034 0.000 2.546 301 V HA 0.217 4.322 4.120 -0.025 0.000 0.260 301 V C -0.537 175.543 176.094 -0.024 0.000 0.933 301 V CA 0.553 62.837 62.300 -0.027 0.000 0.994 301 V CB -0.450 31.358 31.823 -0.024 0.000 1.160 301 V HN -0.027 8.141 8.190 -0.036 0.000 0.523 302 G N 2.856 111.642 108.800 -0.024 0.000 3.584 302 G HA2 -0.049 3.900 3.960 -0.018 0.000 0.152 302 G HA3 -0.049 3.897 3.960 -0.023 0.000 0.152 302 G C -0.835 174.054 174.900 -0.019 0.000 1.298 302 G CA 0.142 45.230 45.100 -0.021 0.000 0.935 302 G HN -0.157 8.117 8.290 -0.027 0.000 0.516 303 A N -0.274 122.534 122.820 -0.021 0.000 6.204 303 A HA -0.216 4.093 4.320 -0.017 0.000 0.272 303 A C -1.385 176.191 177.584 -0.013 0.000 2.040 303 A CA 0.769 52.797 52.037 -0.016 0.000 0.717 303 A CB -0.055 18.937 19.000 -0.013 0.000 1.126 303 A HN -0.138 7.996 8.150 -0.026 0.000 0.378 304 I N 0.188 120.752 120.570 -0.009 0.000 2.741 304 I HA 0.091 4.255 4.170 -0.009 0.000 0.288 304 I C -0.894 175.220 176.117 -0.004 0.000 1.482 304 I CA 0.002 61.297 61.300 -0.008 0.000 1.050 304 I CB 1.183 39.176 38.000 -0.011 0.000 1.388 304 I HN 0.148 8.354 8.210 -0.007 0.000 0.428 305 G N 6.795 115.593 108.800 -0.003 0.000 2.374 305 G HA2 0.007 3.968 3.960 0.000 0.000 0.067 305 G HA3 0.007 3.969 3.960 0.002 0.000 0.067 305 G C -1.111 173.790 174.900 0.000 0.000 1.023 305 G CA -0.128 44.972 45.100 -0.000 0.000 1.131 305 G HN 0.073 8.360 8.290 -0.004 0.000 0.436 306 E N 0.696 120.897 120.200 0.002 0.000 3.702 306 E HA -0.182 4.169 4.350 0.002 0.000 0.159 306 E C -1.016 175.585 176.600 0.001 0.000 1.963 306 E CA 0.506 56.907 56.400 0.001 0.000 0.824 306 E CB -0.436 29.264 29.700 -0.001 0.000 1.065 306 E HN 0.203 8.565 8.360 0.003 0.000 0.346 307 E N 0.720 120.922 120.200 0.003 0.000 2.940 307 E HA 0.050 4.401 4.350 0.002 0.000 0.203 307 E C -1.172 175.430 176.600 0.003 0.000 0.995 307 E CA 0.175 56.577 56.400 0.003 0.000 1.396 307 E CB 0.965 30.668 29.700 0.004 0.000 1.310 307 E HN -0.051 8.312 8.360 0.004 0.000 0.613 308 A N 0.602 123.425 122.820 0.004 0.000 2.515 308 A HA 0.319 4.641 4.320 0.003 0.000 0.298 308 A C -2.511 175.076 177.584 0.005 0.000 1.059 308 A CA -1.389 50.651 52.037 0.004 0.000 0.698 308 A CB 0.374 19.378 19.000 0.005 0.000 1.289 308 A HN -0.530 7.623 8.150 0.005 0.000 0.404 309 P HA 0.216 4.638 4.420 0.002 0.000 0.274 309 P C -1.419 175.884 177.300 0.004 0.000 1.237 309 P CA -0.336 62.766 63.100 0.002 0.000 0.793 309 P CB 0.885 32.585 31.700 -0.001 0.000 0.977 310 Q N -1.142 118.661 119.800 0.004 0.000 2.626 310 Q HA 0.259 4.604 4.340 0.008 0.000 0.300 310 Q C -1.522 174.480 176.000 0.003 0.000 0.988 310 Q CA -0.754 55.054 55.803 0.007 0.000 0.761 310 Q CB 2.987 31.733 28.738 0.013 0.000 1.494 310 Q HN 0.111 8.382 8.270 0.002 0.000 0.439 311 M N 1.264 120.868 119.600 0.007 0.000 2.578 311 M HA 0.370 4.840 4.480 -0.017 0.000 0.321 311 M C -1.560 174.749 176.300 0.014 0.000 1.182 311 M CA -0.268 55.032 55.300 0.000 0.000 0.965 311 M CB 1.047 33.651 32.600 0.007 0.000 1.694 311 M HN 0.137 8.435 8.290 0.014 0.000 0.461 312 N N 0.516 119.215 118.700 -0.002 0.000 3.116 312 N HA 0.054 4.842 4.740 0.081 0.000 0.244 312 N C -2.121 173.401 175.510 0.021 0.000 1.485 312 N CA 0.437 53.512 53.050 0.041 0.000 0.884 312 N CB 1.442 39.951 38.487 0.036 0.000 1.415 312 N HN -0.011 8.341 8.380 -0.046 0.000 0.524 313 Y N 0.825 121.135 120.300 0.017 0.000 3.116 313 Y HA 0.047 4.607 4.550 0.016 0.000 0.220 313 Y C -0.403 175.509 175.900 0.020 0.000 0.965 313 Y CA 0.444 58.553 58.100 0.015 0.000 1.476 313 Y CB 1.051 39.516 38.460 0.008 0.000 1.493 313 Y HN 0.285 8.681 8.280 0.194 0.000 0.423 314 I N 0.685 121.406 120.570 0.251 0.000 2.377 314 I HA 0.116 4.381 4.170 0.158 0.000 0.293 314 I C -1.104 175.080 176.117 0.111 0.000 0.987 314 I CA -0.284 61.105 61.300 0.148 0.000 1.185 314 I CB -0.058 37.992 38.000 0.083 0.000 1.341 314 I HN 0.016 8.372 8.210 0.243 0.000 0.455 315 Q N 5.278 125.156 119.800 0.130 0.000 2.038 315 Q HA 0.135 4.574 4.340 0.165 0.000 0.153 315 Q C -1.675 174.466 176.000 0.236 0.000 0.647 315 Q CA 0.416 56.319 55.803 0.166 0.000 0.898 315 Q CB 1.388 30.203 28.738 0.129 0.000 1.111 315 Q HN 0.375 8.727 8.270 0.136 0.000 0.303 316 V N -2.993 117.027 119.914 0.176 0.000 3.160 316 V HA 0.234 4.496 4.120 0.237 0.000 0.310 316 V C -1.879 174.295 176.094 0.134 0.000 1.181 316 V CA -1.117 61.286 62.300 0.173 0.000 1.047 316 V CB 2.958 34.853 31.823 0.120 0.000 1.068 316 V HN -0.125 8.146 8.190 0.135 0.000 0.441 317 T N -1.221 113.406 114.554 0.121 0.000 2.731 317 T HA 0.386 4.782 4.350 0.078 0.000 0.300 317 T C -1.895 172.845 174.700 0.066 0.000 1.283 317 T CA -2.166 59.990 62.100 0.092 0.000 1.005 317 T CB 0.808 69.743 68.868 0.111 0.000 1.420 317 T HN -0.392 7.924 8.240 0.128 0.000 0.503 318 P HA -0.010 4.425 4.420 0.026 0.000 0.237 318 P C -0.365 176.956 177.300 0.035 0.000 1.178 318 P CA 1.508 64.629 63.100 0.035 0.000 0.766 318 P CB 0.183 31.901 31.700 0.030 0.000 0.876 319 Q N -3.424 116.410 119.800 0.056 0.000 2.274 319 Q HA 0.023 4.569 4.340 0.041 -0.182 0.198 319 Q C 2.069 178.105 176.000 0.060 0.000 0.955 319 Q CA 2.454 58.293 55.803 0.059 0.000 0.859 319 Q CB 0.819 29.607 28.738 0.083 0.000 0.956 319 Q HN 0.145 8.387 8.270 0.072 0.071 0.516 320 E N 0.627 120.891 120.200 0.107 0.000 2.150 320 E HA -0.283 4.128 4.350 0.103 0.000 0.193 320 E C 1.614 178.167 176.600 -0.078 0.000 0.985 320 E CA 2.393 58.853 56.400 0.099 0.000 0.814 320 E CB -0.450 29.427 29.700 0.296 0.000 0.752 320 E HN -0.028 8.411 8.360 0.132 0.000 0.466 321 K N -0.652 119.738 120.400 -0.018 0.000 2.286 321 K HA -0.374 3.918 4.320 -0.047 0.000 0.203 321 K C 1.868 178.418 176.600 -0.083 0.000 1.045 321 K CA 3.094 59.355 56.287 -0.043 0.000 0.935 321 K CB -0.143 32.354 32.500 -0.006 0.000 0.737 321 K HN -0.128 8.122 8.250 0.030 0.018 0.460 322 E N -1.298 118.851 120.200 -0.085 0.000 2.051 322 E HA -0.301 4.331 4.350 -0.063 -0.320 0.192 322 E C 2.122 178.635 176.600 -0.145 0.000 0.991 322 E CA 2.904 59.251 56.400 -0.088 0.000 0.799 322 E CB -0.380 29.283 29.700 -0.062 0.000 0.748 322 E HN -0.578 7.703 8.360 -0.062 0.042 0.449 323 A N -1.178 121.484 122.820 -0.264 0.000 2.014 323 A HA -0.147 4.034 4.320 -0.232 0.000 0.218 323 A C 1.739 179.144 177.584 -0.298 0.000 1.163 323 A CA 2.665 54.487 52.037 -0.359 0.000 0.652 323 A CB -0.363 18.170 19.000 -0.779 0.000 0.808 323 A HN -0.419 7.553 8.150 -0.297 0.000 0.449 324 I N -1.682 118.726 120.570 -0.270 0.000 2.296 324 I HA -0.347 3.742 4.170 -0.135 0.000 0.242 324 I C 1.532 177.605 176.117 -0.073 0.000 1.087 324 I CA 1.437 62.648 61.300 -0.148 0.000 1.393 324 I CB -1.103 36.826 38.000 -0.118 0.000 1.093 324 I HN -0.555 7.363 8.210 -0.284 0.121 0.421 325 E N 0.308 120.466 120.200 -0.070 0.000 2.130 325 E HA -0.474 3.856 4.350 -0.035 0.000 0.196 325 E C 2.505 179.078 176.600 -0.046 0.000 0.998 325 E CA 3.177 59.549 56.400 -0.046 0.000 0.806 325 E CB -0.683 28.991 29.700 -0.043 0.000 0.738 325 E HN 0.507 8.700 8.360 -0.085 0.115 0.459 326 R N -1.603 118.865 120.500 -0.053 0.000 2.062 326 R HA -0.182 4.128 4.340 -0.049 0.000 0.229 326 R C 2.406 178.690 176.300 -0.026 0.000 1.128 326 R CA 1.958 58.031 56.100 -0.044 0.000 0.960 326 R CB -0.350 29.923 30.300 -0.045 0.000 0.855 326 R HN -0.725 7.491 8.270 -0.070 0.012 0.432 327 L N 0.487 121.724 121.223 0.023 0.000 1.994 327 L HA -0.337 4.164 4.340 0.269 0.000 0.208 327 L C 2.057 178.984 176.870 0.094 0.000 1.071 327 L CA 3.458 58.409 54.840 0.186 0.000 0.745 327 L CB -0.415 41.770 42.059 0.210 0.000 0.892 327 L HN -0.533 7.689 8.230 -0.013 0.000 0.431 328 K N -1.671 118.759 120.400 0.051 0.000 2.281 328 K HA -0.356 4.377 4.320 0.051 -0.383 0.203 328 K C 1.769 178.332 176.600 -0.062 0.000 1.046 328 K CA 3.016 59.310 56.287 0.012 0.000 0.938 328 K CB 0.002 32.505 32.500 0.004 0.000 0.737 328 K HN 0.256 8.420 8.250 0.034 0.107 0.458 329 A N -2.434 120.336 122.820 -0.084 0.000 2.044 329 A HA 0.035 4.392 4.320 -0.095 -0.095 0.213 329 A C 2.375 179.848 177.584 -0.185 0.000 1.169 329 A CA 2.086 54.058 52.037 -0.109 0.000 0.724 329 A CB -0.503 18.450 19.000 -0.078 0.000 0.840 329 A HN -0.825 7.108 8.150 -0.061 0.180 0.463 330 L N -2.987 118.076 121.223 -0.266 0.000 2.275 330 L HA -0.326 3.846 4.340 -0.281 0.000 0.215 330 L C 1.135 177.635 176.870 -0.617 0.000 1.119 330 L CA 2.371 56.956 54.840 -0.425 0.000 0.790 330 L CB 0.376 42.130 42.059 -0.509 0.000 0.919 330 L HN 0.188 8.080 8.230 -0.207 0.213 0.443 331 G N -4.008 104.413 108.800 -0.632 0.000 2.935 331 G HA2 -0.213 3.580 3.960 -0.278 0.000 0.213 331 G HA3 -0.213 3.433 3.960 -0.523 0.000 0.213 331 G C -0.112 174.569 174.900 -0.364 0.000 0.984 331 G CA -0.467 44.342 45.100 -0.485 0.000 0.790 331 G HN -0.650 7.303 8.290 -0.506 0.033 0.538 332 F N 1.891 121.813 119.950 -0.046 0.000 2.403 332 F HA 0.337 4.833 4.527 -0.053 0.000 0.320 332 F C -0.962 174.812 175.800 -0.043 0.000 1.176 332 F CA -3.344 54.627 58.000 -0.049 0.000 1.206 332 F CB -1.358 37.610 39.000 -0.054 0.000 1.235 332 F HN -0.721 6.973 8.300 -1.010 0.000 0.565 333 P HA 0.083 4.529 4.420 0.043 0.000 0.312 333 P C -0.824 176.517 177.300 0.070 0.000 1.307 333 P CA -0.439 62.704 63.100 0.072 0.000 0.738 333 P CB 1.197 32.923 31.700 0.045 0.000 1.422 334 E N 0.165 120.391 120.200 0.044 0.000 2.307 334 E HA -0.180 4.195 4.350 0.042 0.000 0.192 334 E C 1.431 178.058 176.600 0.046 0.000 0.967 334 E CA 2.437 58.861 56.400 0.040 0.000 1.042 334 E CB 0.376 30.092 29.700 0.027 0.000 1.126 334 E HN 0.433 8.813 8.360 0.034 0.000 0.484 335 S N 1.645 117.371 115.700 0.045 0.000 2.392 335 S HA -0.287 4.221 4.470 0.064 0.000 0.232 335 S C 2.227 176.866 174.600 0.065 0.000 1.041 335 S CA 3.850 62.084 58.200 0.056 0.000 1.026 335 S CB -0.185 63.042 63.200 0.046 0.000 0.845 335 S HN 0.157 8.488 8.310 0.036 0.000 0.465 336 L N -1.875 119.380 121.223 0.052 0.000 2.313 336 L HA -0.175 4.207 4.340 0.069 0.000 0.214 336 L C 1.321 178.219 176.870 0.048 0.000 1.119 336 L CA 2.343 57.214 54.840 0.052 0.000 0.809 336 L CB 0.017 42.091 42.059 0.026 0.000 0.933 336 L HN 0.006 8.249 8.230 0.044 0.014 0.449 337 V N -0.028 119.914 119.914 0.046 0.000 2.403 337 V HA -0.358 3.764 4.120 0.004 0.000 0.239 337 V C 1.421 177.539 176.094 0.040 0.000 1.041 337 V CA 4.019 66.338 62.300 0.030 0.000 1.051 337 V CB 0.388 32.240 31.823 0.048 0.000 0.704 337 V HN -0.077 7.970 8.190 0.051 0.174 0.472 338 I N -0.792 119.806 120.570 0.046 0.000 2.248 338 I HA -0.477 3.705 4.170 0.020 0.000 0.248 338 I C 1.173 177.363 176.117 0.122 0.000 1.107 338 I CA 2.939 64.278 61.300 0.064 0.000 1.373 338 I CB -0.581 37.467 38.000 0.081 0.000 1.055 338 I HN 0.147 8.281 8.210 0.046 0.104 0.418 339 Q N -1.287 118.602 119.800 0.148 0.000 1.984 339 Q HA -0.329 4.214 4.340 0.338 0.000 0.196 339 Q C 2.221 178.349 176.000 0.214 0.000 0.975 339 Q CA 2.680 58.618 55.803 0.225 0.000 0.827 339 Q CB 0.245 29.085 28.738 0.170 0.000 0.894 339 Q HN -0.662 7.664 8.270 0.118 0.015 0.438 340 A N -0.692 122.230 122.820 0.170 0.000 2.042 340 A HA -0.297 4.157 4.320 0.223 0.000 0.222 340 A C 1.303 178.992 177.584 0.176 0.000 1.167 340 A CA 2.344 54.502 52.037 0.201 0.000 0.649 340 A CB -0.858 18.259 19.000 0.194 0.000 0.809 340 A HN -0.473 7.763 8.150 0.143 0.000 0.457 341 Y N -1.232 119.003 120.300 -0.109 0.000 2.139 341 Y HA -0.385 4.069 4.550 -0.159 0.000 0.282 341 Y C 1.326 177.053 175.900 -0.289 0.000 1.179 341 Y CA 1.355 59.289 58.100 -0.278 0.000 1.161 341 Y CB 0.108 38.252 38.460 -0.527 0.000 0.970 341 Y HN -0.506 7.813 8.280 0.136 0.043 0.511 342 F N -2.913 116.967 119.950 -0.118 0.000 2.626 342 F HA -0.133 4.146 4.527 -0.413 0.000 0.374 342 F C -0.157 175.582 175.800 -0.101 0.000 1.184 342 F CA 0.016 57.878 58.000 -0.229 0.000 1.339 342 F CB -2.503 36.405 39.000 -0.154 0.000 1.730 342 F HN -0.513 7.603 8.300 -0.301 0.004 0.650 343 A N 1.774 124.617 122.820 0.038 0.000 1.849 343 A HA -0.088 4.227 4.320 -0.007 0.000 0.214 343 A C -0.177 177.396 177.584 -0.017 0.000 1.269 343 A CA 1.940 53.986 52.037 0.016 0.000 0.605 343 A CB 0.792 19.833 19.000 0.069 0.000 0.937 343 A HN 0.745 8.811 8.150 -0.015 0.074 0.461 344 C N -3.791 115.505 119.300 -0.006 0.000 2.605 344 C HA 0.213 4.658 4.460 -0.025 0.000 0.364 344 C C 0.253 175.241 174.990 -0.004 0.000 1.656 344 C CA 0.234 59.244 59.018 -0.013 0.000 2.400 344 C CB 1.294 29.027 27.740 -0.011 0.000 2.132 344 C HN 0.183 8.421 8.230 0.013 0.000 0.668 345 E N -0.385 119.818 120.200 0.005 0.000 2.685 345 E HA 0.075 4.426 4.350 0.003 0.000 0.208 345 E C -1.282 175.317 176.600 -0.001 0.000 0.996 345 E CA -0.555 55.849 56.400 0.007 0.000 1.054 345 E CB 0.167 29.879 29.700 0.019 0.000 1.075 345 E HN -0.257 8.113 8.360 0.016 0.000 0.460 346 K N -2.201 118.165 120.400 -0.057 0.000 3.160 346 K HA -0.417 3.542 4.320 -0.602 0.000 0.280 346 K C -1.673 174.989 176.600 0.104 0.000 1.154 346 K CA 0.901 57.058 56.287 -0.216 0.000 0.822 346 K CB -1.277 31.127 32.500 -0.160 0.000 1.239 346 K HN 0.130 8.282 8.250 -0.052 0.067 0.489 347 N N -3.135 115.644 118.700 0.131 0.000 2.385 347 N HA -0.035 4.799 4.740 0.157 0.000 0.291 347 N C -0.592 175.049 175.510 0.219 0.000 1.298 347 N CA 0.602 53.751 53.050 0.164 0.000 0.955 347 N CB 1.177 39.720 38.487 0.093 0.000 1.096 347 N HN -0.170 8.220 8.380 0.071 0.032 0.543 348 E N -3.079 117.193 120.200 0.120 0.000 2.583 348 E HA 0.149 4.541 4.350 0.070 0.000 0.213 348 E C -0.494 176.143 176.600 0.062 0.000 0.989 348 E CA 0.328 56.771 56.400 0.072 0.000 0.991 348 E CB 0.688 30.404 29.700 0.027 0.000 1.040 348 E HN 0.465 8.881 8.360 0.093 0.000 0.481 349 N N -1.659 117.087 118.700 0.077 0.000 2.677 349 N HA 0.027 4.841 4.740 0.047 -0.047 0.242 349 N C 0.787 176.359 175.510 0.104 0.000 1.044 349 N CA 0.646 53.736 53.050 0.067 0.000 0.934 349 N CB 0.392 38.912 38.487 0.055 0.000 1.595 349 N HN -0.365 8.014 8.380 0.090 0.055 0.459 350 L N -0.344 120.944 121.223 0.107 0.000 2.034 350 L HA -0.377 4.031 4.340 0.114 0.000 0.217 350 L C 2.085 179.105 176.870 0.250 0.000 1.077 350 L CA 3.491 58.406 54.840 0.126 0.000 0.769 350 L CB -1.002 41.100 42.059 0.072 0.000 0.890 350 L HN 0.012 8.295 8.230 0.089 0.000 0.435 351 A N -2.517 120.448 122.820 0.243 0.000 1.874 351 A HA -0.281 4.392 4.320 0.588 0.000 0.214 351 A C 1.381 179.098 177.584 0.222 0.000 1.189 351 A CA 2.813 55.074 52.037 0.372 0.000 0.615 351 A CB -0.849 18.295 19.000 0.241 0.000 0.830 351 A HN 0.413 8.672 8.150 0.177 -0.003 0.443 352 A N -2.126 120.721 122.820 0.044 0.000 1.843 352 A HA -0.240 3.882 4.320 -0.331 0.000 0.213 352 A C 1.698 179.187 177.584 -0.159 0.000 1.202 352 A CA 2.535 54.476 52.037 -0.161 0.000 0.607 352 A CB -0.814 18.127 19.000 -0.098 0.000 0.847 352 A HN -0.105 8.048 8.150 0.083 0.047 0.445 353 N N 0.026 118.713 118.700 -0.021 0.000 2.049 353 N HA -0.325 4.405 4.740 -0.017 0.000 0.198 353 N C 1.865 177.378 175.510 0.005 0.000 1.030 353 N CA 3.010 56.063 53.050 0.005 0.000 0.870 353 N CB -0.388 38.137 38.487 0.062 0.000 1.045 353 N HN -0.058 8.212 8.380 0.024 0.125 0.434 354 F N -2.094 117.835 119.950 -0.036 0.000 2.293 354 F HA -0.022 4.493 4.527 -0.020 0.000 0.300 354 F C 1.770 177.543 175.800 -0.045 0.000 1.086 354 F CA 2.138 60.121 58.000 -0.029 0.000 1.375 354 F CB -0.181 38.808 39.000 -0.018 0.000 1.045 354 F HN -0.636 7.839 8.300 0.292 0.000 0.516 355 L N -0.696 119.831 121.223 -1.159 0.000 2.341 355 L HA -0.204 3.328 4.340 -1.347 0.000 0.214 355 L C 0.399 176.941 176.870 -0.547 0.000 1.115 355 L CA 2.277 56.455 54.840 -1.103 0.000 0.820 355 L CB 0.122 41.619 42.059 -0.937 0.000 0.944 355 L HN -0.424 7.230 8.230 -0.722 0.143 0.452 356 L N -2.695 118.302 121.223 -0.377 0.000 2.354 356 L HA -0.175 4.049 4.340 -0.194 0.000 0.212 356 L C 1.523 178.332 176.870 -0.103 0.000 1.091 356 L CA 2.198 56.919 54.840 -0.198 0.000 0.828 356 L CB 0.194 42.179 42.059 -0.124 0.000 0.973 356 L HN 0.461 8.249 8.230 -0.351 0.231 0.461 357 S N -1.572 114.071 115.700 -0.096 0.000 2.470 357 S HA -0.071 4.389 4.470 -0.016 0.000 0.222 357 S C 1.523 176.107 174.600 -0.026 0.000 1.024 357 S CA 1.868 60.050 58.200 -0.031 0.000 0.931 357 S CB 0.430 63.632 63.200 0.003 0.000 0.791 357 S HN -0.393 7.836 8.310 -0.134 0.000 0.513 358 Q N -1.116 118.647 119.800 -0.062 0.000 2.226 358 Q HA 0.010 4.355 4.340 0.009 0.000 0.199 358 Q C 0.284 176.272 176.000 -0.019 0.000 0.945 358 Q CA 1.248 57.038 55.803 -0.021 0.000 0.861 358 Q CB 1.199 29.943 28.738 0.011 0.000 0.953 358 Q HN -0.644 7.542 8.270 -0.140 0.000 0.490 359 N N -1.793 116.865 118.700 -0.070 0.000 3.600 359 N HA -0.425 4.369 4.740 -0.050 -0.083 0.201 359 N C -0.558 175.050 175.510 0.165 0.000 0.245 359 N CA 2.906 55.961 53.050 0.008 0.000 2.387 359 N CB -0.728 37.786 38.487 0.045 0.000 1.323 359 N HN -0.509 7.769 8.380 -0.170 0.000 0.383 360 F N 1.552 121.482 119.950 -0.033 0.000 3.397 360 F HA 0.239 4.762 4.527 -0.008 0.000 0.406 360 F C -1.812 173.990 175.800 0.002 0.000 1.166 360 F CA -0.193 57.800 58.000 -0.011 0.000 1.322 360 F CB 1.227 40.222 39.000 -0.007 0.000 2.322 360 F HN -0.371 8.012 8.300 0.153 0.009 0.709 361 D N 2.154 122.402 120.400 -0.254 0.000 2.539 361 D HA 0.151 4.673 4.640 -0.197 0.000 0.276 361 D C -1.112 174.964 176.300 -0.374 0.000 1.206 361 D CA -0.507 53.345 54.000 -0.247 0.000 1.081 361 D CB 1.429 42.165 40.800 -0.106 0.000 1.142 361 D HN -0.046 8.237 8.370 -0.146 0.000 0.595 362 D N -0.913 119.348 120.400 -0.232 0.000 2.947 362 D HA 0.239 4.737 4.640 -0.237 0.000 0.224 362 D C -1.792 174.443 176.300 -0.109 0.000 1.230 362 D CA -0.045 53.833 54.000 -0.204 0.000 0.871 362 D CB 2.120 42.800 40.800 -0.201 0.000 1.671 362 D HN 0.100 8.375 8.370 -0.159 0.000 0.507 363 E N 0.000 120.150 120.200 -0.084 0.000 2.725 363 E HA 0.000 4.323 4.350 -0.046 0.000 0.291 363 E CA 0.000 56.370 56.400 -0.050 0.000 0.976 363 E CB 0.000 29.676 29.700 -0.040 0.000 0.812 363 E HN 0.000 8.305 8.360 -0.092 0.000 0.440