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 3l4m_1_B DATA FIRST_RESID 6 DATA SEQUENCE ADDALAALGA QLFVDPALSR NATQSCATCH DPARAFTDPR EGKAGLAVSV DATA SEQUENCE GDDGQSHGDR NTPTLGYAAL VPAFHRDANG KYKGGQFWDG RADDLKQQAG DATA SEQUENCE QPMLNPVEMA MPDRAAVAAR LRDDPAYRTG FEALFGKGVL DDPERAFDAA DATA SEQUENCE AEALAAYQAT GEFSPFDSKY DRVMRGEEKF TPLEEFGYTV FITWNCRLCH DATA SEQUENCE MQRKQGVAER ETFTNFEYHN IGLPVNETAR EASGLGADHV DHGLLARPGI DATA SEQUENCE EDPAQSGRFK VPSLRNVAVT GPYMHNGVFT DLRTAILFYN KYTSRRPEAK DATA SEQUENCE INPETGAPWG EPEVARNLSL AELQSGLMLD DGRVDALVAF LETLTDRRYE DATA SEQUENCE PLLEE 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 6 A HA 0.000 4.320 4.320 -0.000 0.000 0.244 6 A C 0.000 177.533 177.584 -0.086 0.000 1.274 6 A CA 0.000 51.987 52.037 -0.084 0.000 0.836 6 A CB 0.000 18.947 19.000 -0.088 0.000 0.831 7 D N 1.031 121.394 120.400 -0.062 0.000 2.097 7 D HA -0.062 4.578 4.640 -0.002 0.000 0.197 7 D C 1.246 177.525 176.300 -0.036 0.000 0.984 7 D CA 1.628 55.598 54.000 -0.049 0.000 0.826 7 D CB -0.037 40.742 40.800 -0.036 0.000 0.973 7 D HN 0.421 8.790 8.370 -0.000 0.000 0.460 8 D N -0.230 120.154 120.400 -0.027 0.000 2.106 8 D HA -0.142 4.497 4.640 -0.002 0.000 0.191 8 D C 1.950 178.235 176.300 -0.025 0.000 0.997 8 D CA 1.493 55.484 54.000 -0.015 0.000 0.834 8 D CB -0.372 40.420 40.800 -0.012 0.000 0.956 8 D HN 0.180 8.550 8.370 -0.000 0.000 0.448 9 A N 0.102 122.895 122.820 -0.045 0.000 1.968 9 A HA -0.081 4.238 4.320 -0.002 0.000 0.217 9 A C 2.119 179.657 177.584 -0.076 0.000 1.169 9 A CA 0.795 52.797 52.037 -0.057 0.000 0.638 9 A CB -0.560 18.399 19.000 -0.068 0.000 0.812 9 A HN 0.257 8.407 8.150 -0.000 0.000 0.446 10 L N -0.158 121.011 121.223 -0.089 0.000 2.027 10 L HA -0.024 4.315 4.340 -0.002 0.000 0.206 10 L C 2.628 179.469 176.870 -0.049 0.000 1.074 10 L CA 2.198 56.982 54.840 -0.092 0.000 0.745 10 L CB -0.762 41.237 42.059 -0.099 0.000 0.898 10 L HN 0.313 8.543 8.230 -0.000 0.000 0.433 11 A N -0.553 122.258 122.820 -0.015 0.000 1.933 11 A HA -0.063 4.256 4.320 -0.002 0.000 0.218 11 A C 2.440 180.020 177.584 -0.007 0.000 1.175 11 A CA 1.656 53.721 52.037 0.047 0.000 0.628 11 A CB -1.106 17.952 19.000 0.097 0.000 0.814 11 A HN 0.577 8.727 8.150 -0.000 0.000 0.444 12 A N -0.317 122.485 122.820 -0.031 0.000 1.902 12 A HA -0.046 4.273 4.320 -0.002 0.000 0.217 12 A C 2.112 179.637 177.584 -0.098 0.000 1.181 12 A CA 1.741 53.740 52.037 -0.063 0.000 0.623 12 A CB -0.665 18.316 19.000 -0.032 0.000 0.818 12 A HN 0.691 8.841 8.150 -0.000 0.000 0.443 13 L N 0.341 121.514 121.223 -0.085 0.000 1.990 13 L HA -0.102 4.237 4.340 -0.002 0.000 0.213 13 L C 2.408 179.216 176.870 -0.103 0.000 1.072 13 L CA 2.571 57.356 54.840 -0.093 0.000 0.755 13 L CB -1.255 40.687 42.059 -0.196 0.000 0.889 13 L HN 0.310 8.540 8.230 -0.000 0.000 0.432 14 G N -1.312 107.415 108.800 -0.123 0.000 2.450 14 G HA2 -0.253 3.706 3.960 -0.002 0.000 0.220 14 G HA3 -0.253 3.706 3.960 -0.002 0.000 0.220 14 G C 1.589 176.286 174.900 -0.339 0.000 1.130 14 G CA 0.872 45.911 45.100 -0.101 0.000 0.760 14 G HN 0.694 8.984 8.290 -0.000 0.000 0.557 15 A N 0.159 122.544 122.820 -0.725 0.000 1.933 15 A HA -0.058 4.261 4.320 -0.002 0.000 0.218 15 A C 2.315 179.744 177.584 -0.258 0.000 1.175 15 A CA 1.875 53.267 52.037 -1.074 0.000 0.628 15 A CB -0.313 18.219 19.000 -0.779 0.000 0.814 15 A HN 0.465 8.615 8.150 -0.000 0.000 0.444 16 Q N -0.541 119.213 119.800 -0.076 0.000 2.049 16 Q HA -0.006 4.333 4.340 -0.002 0.000 0.198 16 Q C 2.081 178.213 176.000 0.220 0.000 0.971 16 Q CA 1.239 57.107 55.803 0.109 0.000 0.833 16 Q CB -0.283 28.570 28.738 0.191 0.000 0.896 16 Q HN 0.670 8.940 8.270 -0.000 0.000 0.434 17 L N -0.222 121.127 121.223 0.210 0.000 2.043 17 L HA -0.214 4.125 4.340 -0.002 0.000 0.212 17 L C 2.293 179.279 176.870 0.195 0.000 1.075 17 L CA 1.098 56.048 54.840 0.183 0.000 0.752 17 L CB -0.465 41.638 42.059 0.072 0.000 0.891 17 L HN 0.222 8.452 8.230 -0.000 0.000 0.432 18 F N 0.638 120.633 119.950 0.075 0.000 2.202 18 F HA -0.165 4.361 4.527 -0.002 0.000 0.301 18 F C 1.971 177.881 175.800 0.183 0.000 1.082 18 F CA 1.546 59.646 58.000 0.168 0.000 1.313 18 F CB 0.081 39.262 39.000 0.302 0.000 1.024 18 F HN -0.042 8.258 8.300 -0.000 0.000 0.495 19 V N -2.763 117.286 119.914 0.226 0.000 3.542 19 V HA 0.221 4.340 4.120 -0.002 0.000 0.296 19 V C -0.137 176.013 176.094 0.093 0.000 1.364 19 V CA -0.058 62.327 62.300 0.141 0.000 1.118 19 V CB -0.469 31.472 31.823 0.196 0.000 0.972 19 V HN 0.090 8.280 8.190 -0.000 0.000 0.430 20 D N 2.610 123.074 120.400 0.106 0.000 2.359 20 D HA 0.367 5.006 4.640 -0.002 0.000 0.230 20 D C -1.556 174.792 176.300 0.081 0.000 1.118 20 D CA -2.215 51.859 54.000 0.123 0.000 0.844 20 D CB 2.301 43.241 40.800 0.233 0.000 1.059 20 D HN 0.188 8.558 8.370 -0.000 0.000 0.493 21 P HA -0.000 4.420 4.420 -0.000 0.000 0.237 21 P C 0.818 178.150 177.300 0.053 0.000 1.178 21 P CA 0.232 63.357 63.100 0.042 0.000 0.766 21 P CB 0.232 31.951 31.700 0.031 0.000 0.876 22 A N 0.018 122.885 122.820 0.078 0.000 2.216 22 A HA -0.010 4.309 4.320 -0.002 0.000 0.214 22 A C 1.926 179.556 177.584 0.076 0.000 1.160 22 A CA 0.588 52.673 52.037 0.081 0.000 0.725 22 A CB -1.266 17.800 19.000 0.111 0.000 0.784 22 A HN 0.189 8.339 8.150 -0.000 0.000 0.472 23 L N 0.550 121.815 121.223 0.071 0.000 2.612 23 L HA 0.081 4.420 4.340 -0.002 0.000 0.230 23 L C 0.798 177.698 176.870 0.051 0.000 1.140 23 L CA 0.202 55.076 54.840 0.057 0.000 0.896 23 L CB -0.392 41.695 42.059 0.047 0.000 1.065 23 L HN 0.479 8.709 8.230 -0.000 0.000 0.447 24 S N -1.749 113.977 115.700 0.043 0.000 2.568 24 S HA 0.361 4.830 4.470 -0.002 0.000 0.302 24 S C 0.849 175.466 174.600 0.029 0.000 1.082 24 S CA -0.879 57.342 58.200 0.035 0.000 1.009 24 S CB 2.505 65.721 63.200 0.026 0.000 1.069 24 S HN 0.128 8.438 8.310 -0.000 0.000 0.500 25 R N 1.247 121.762 120.500 0.025 0.000 2.094 25 R HA -0.126 4.213 4.340 -0.002 0.000 0.239 25 R C 0.640 176.950 176.300 0.015 0.000 1.137 25 R CA 1.974 58.085 56.100 0.019 0.000 0.943 25 R CB -0.439 29.869 30.300 0.014 0.000 0.850 25 R HN 0.759 9.029 8.270 -0.000 0.000 0.433 26 N N -0.310 118.398 118.700 0.013 0.000 2.270 26 N HA 0.066 4.805 4.740 -0.002 0.000 0.198 26 N C 0.126 175.644 175.510 0.013 0.000 1.117 26 N CA 0.781 53.837 53.050 0.011 0.000 0.845 26 N CB 1.207 39.698 38.487 0.007 0.000 0.980 26 N HN 0.347 8.727 8.380 -0.000 0.000 0.486 27 A N 0.452 123.283 122.820 0.018 0.000 2.860 27 A HA -0.212 4.107 4.320 -0.002 0.000 0.267 27 A C 1.581 179.175 177.584 0.017 0.000 1.421 27 A CA 1.592 53.642 52.037 0.022 0.000 0.831 27 A CB -2.525 16.488 19.000 0.023 0.000 1.041 27 A HN 0.466 8.616 8.150 -0.000 0.000 0.623 28 T N -3.514 111.047 114.554 0.011 0.000 3.022 28 T HA 0.433 4.782 4.350 -0.002 0.000 0.250 28 T C 0.463 175.165 174.700 0.003 0.000 1.060 28 T CA 1.056 63.160 62.100 0.006 0.000 1.013 28 T CB 0.157 69.025 68.868 -0.000 0.000 0.982 28 T HN 1.084 9.324 8.240 -0.000 0.000 0.508 29 Q N 1.390 121.193 119.800 0.005 0.000 2.305 29 Q HA 0.560 4.899 4.340 -0.002 0.000 0.271 29 Q C -1.078 174.920 176.000 -0.003 0.000 1.046 29 Q CA -0.668 55.133 55.803 -0.003 0.000 0.798 29 Q CB 2.082 30.816 28.738 -0.006 0.000 1.286 29 Q HN 0.409 8.680 8.270 -0.000 0.000 0.435 30 S N 0.977 116.663 115.700 -0.023 0.000 2.726 30 S HA 0.399 4.868 4.470 -0.002 0.000 0.308 30 S C 0.962 175.492 174.600 -0.116 0.000 1.115 30 S CA -0.559 57.609 58.200 -0.053 0.000 0.965 30 S CB 0.864 64.032 63.200 -0.053 0.000 1.145 30 S HN 0.878 9.188 8.310 -0.000 0.000 0.532 31 C N 0.802 119.960 119.300 -0.236 0.000 2.391 31 C HA -0.054 4.405 4.460 -0.002 0.000 0.276 31 C C 3.063 177.842 174.990 -0.351 0.000 1.217 31 C CA 1.403 60.212 59.018 -0.349 0.000 1.766 31 C CB -2.084 25.164 27.740 -0.819 0.000 2.046 31 C HN 0.970 9.200 8.230 -0.000 0.000 0.475 32 A N -0.148 122.374 122.820 -0.497 0.000 2.168 32 A HA -0.058 4.261 4.320 -0.002 0.000 0.215 32 A C 2.065 179.659 177.584 0.015 0.000 1.152 32 A CA 1.897 53.862 52.037 -0.119 0.000 0.716 32 A CB -0.685 18.343 19.000 0.048 0.000 0.794 32 A HN 0.616 8.766 8.150 -0.000 0.000 0.465 33 T N -0.925 113.610 114.554 -0.033 0.000 2.701 33 T HA -0.160 4.189 4.350 -0.002 0.000 0.263 33 T C 1.807 176.487 174.700 -0.033 0.000 1.040 33 T CA 1.815 63.903 62.100 -0.020 0.000 1.147 33 T CB -0.454 68.397 68.868 -0.029 0.000 0.865 33 T HN 0.587 8.827 8.240 -0.000 0.000 0.426 34 C N 0.465 119.726 119.300 -0.065 0.000 2.533 34 C HA 0.110 4.569 4.460 -0.002 0.000 0.272 34 C C 1.082 175.937 174.990 -0.225 0.000 1.371 34 C CA -0.341 58.580 59.018 -0.161 0.000 1.758 34 C CB -0.803 26.798 27.740 -0.232 0.000 1.972 34 C HN 0.547 8.777 8.230 -0.000 0.000 0.522 35 H N 1.086 120.236 119.070 0.133 0.000 2.410 35 H HA 0.201 4.756 4.556 -0.001 0.000 0.232 35 H C -0.761 174.767 175.328 0.333 0.000 1.535 35 H CA -0.126 56.103 56.048 0.303 0.000 1.310 35 H CB -0.114 29.940 29.762 0.487 0.000 1.518 35 H HN 0.353 8.633 8.280 -0.000 0.000 0.545 36 D N 3.529 124.043 120.400 0.190 0.000 2.339 36 D HA 0.036 4.675 4.640 -0.002 0.000 0.256 36 D C -1.416 174.814 176.300 -0.117 0.000 1.214 36 D CA -1.957 52.086 54.000 0.072 0.000 0.877 36 D CB 1.862 42.664 40.800 0.004 0.000 1.111 36 D HN 0.184 8.554 8.370 -0.000 0.000 0.478 37 P HA -0.086 4.334 4.420 -0.000 0.000 0.225 37 P C 0.786 177.901 177.300 -0.308 0.000 1.148 37 P CA 0.486 63.172 63.100 -0.690 0.000 0.779 37 P CB 0.229 31.664 31.700 -0.442 0.000 0.780 38 A N -0.102 122.642 122.820 -0.127 0.000 2.167 38 A HA -0.023 4.296 4.320 -0.002 0.000 0.214 38 A C 1.944 179.482 177.584 -0.076 0.000 1.151 38 A CA 0.459 52.484 52.037 -0.021 0.000 0.735 38 A CB -0.796 18.197 19.000 -0.012 0.000 0.802 38 A HN 0.099 8.249 8.150 -0.000 0.000 0.467 39 R N -1.184 119.187 120.500 -0.215 0.000 2.834 39 R HA 0.438 4.777 4.340 -0.002 0.000 0.362 39 R C 0.322 176.351 176.300 -0.451 0.000 1.147 39 R CA 0.501 56.430 56.100 -0.286 0.000 1.125 39 R CB -0.277 29.936 30.300 -0.146 0.000 1.361 39 R HN 0.619 8.889 8.270 -0.000 0.000 0.598 40 A N 0.832 123.111 122.820 -0.903 0.000 2.783 40 A HA -0.233 4.086 4.320 -0.002 0.000 0.292 40 A C 0.132 177.664 177.584 -0.085 0.000 1.495 40 A CA 1.186 52.766 52.037 -0.763 0.000 0.787 40 A CB -2.259 16.317 19.000 -0.708 0.000 1.017 40 A HN 0.774 8.924 8.150 -0.000 0.000 0.516 41 F N -2.624 117.325 119.950 -0.002 0.000 3.071 41 F HA -0.214 4.312 4.527 -0.001 0.000 0.295 41 F C 0.997 176.935 175.800 0.229 0.000 0.919 41 F CA 1.931 60.045 58.000 0.189 0.000 1.050 41 F CB -2.357 36.782 39.000 0.231 0.000 1.040 41 F HN 1.339 9.639 8.300 -0.000 0.000 0.692 42 T N -4.403 110.251 114.554 0.166 0.000 2.831 42 T HA 0.611 4.960 4.350 -0.002 0.000 0.287 42 T C -0.981 173.718 174.700 -0.003 0.000 1.070 42 T CA -0.913 61.239 62.100 0.086 0.000 1.010 42 T CB 2.780 71.673 68.868 0.043 0.000 1.264 42 T HN -0.004 8.236 8.240 -0.000 0.000 0.532 43 D N 1.463 121.839 120.400 -0.039 0.000 2.373 43 D HA 0.405 5.044 4.640 -0.002 0.000 0.227 43 D C -1.519 174.751 176.300 -0.050 0.000 1.091 43 D CA -2.502 51.463 54.000 -0.057 0.000 0.840 43 D CB 1.692 42.444 40.800 -0.080 0.000 1.060 43 D HN 0.247 8.617 8.370 -0.000 0.000 0.502 44 P HA 0.070 4.490 4.420 -0.000 0.000 0.245 44 P C 0.017 177.295 177.300 -0.036 0.000 1.206 44 P CA 0.037 63.112 63.100 -0.042 0.000 0.781 44 P CB 0.483 32.161 31.700 -0.037 0.000 0.994 45 R N 1.184 121.660 120.500 -0.039 0.000 2.438 45 R HA 0.241 4.580 4.340 -0.002 0.000 0.287 45 R C 0.451 176.732 176.300 -0.032 0.000 1.077 45 R CA -0.282 55.797 56.100 -0.036 0.000 1.034 45 R CB 0.729 31.002 30.300 -0.045 0.000 0.993 45 R HN 0.125 8.395 8.270 -0.000 0.000 0.459 46 E N 1.261 121.449 120.200 -0.020 0.000 2.259 46 E HA 0.220 4.569 4.350 -0.002 0.000 0.281 46 E C 0.055 176.661 176.600 0.009 0.000 1.027 46 E CA -0.163 56.233 56.400 -0.005 0.000 0.838 46 E CB 1.952 31.652 29.700 0.000 0.000 1.066 46 E HN 0.764 9.124 8.360 -0.000 0.000 0.401 47 G N 1.436 110.262 108.800 0.044 0.000 3.217 47 G HA2 0.155 4.114 3.960 -0.002 0.000 0.213 47 G HA3 0.155 4.114 3.960 -0.002 0.000 0.213 47 G C 0.494 175.508 174.900 0.189 0.000 1.294 47 G CA -0.447 44.740 45.100 0.145 0.000 0.987 47 G HN 0.322 8.612 8.290 -0.000 0.000 0.584 48 K N -0.398 120.194 120.400 0.319 0.000 2.280 48 K HA 0.010 4.329 4.320 -0.002 0.000 0.202 48 K C 1.524 178.114 176.600 -0.016 0.000 1.047 48 K CA 1.216 57.515 56.287 0.020 0.000 0.942 48 K CB 0.026 32.394 32.500 -0.221 0.000 0.739 48 K HN 0.311 8.561 8.250 -0.000 0.000 0.457 49 A N 0.809 123.648 122.820 0.031 0.000 2.713 49 A HA 0.460 4.779 4.320 -0.002 0.000 0.296 49 A C 0.745 178.332 177.584 0.006 0.000 1.255 49 A CA 0.232 52.267 52.037 -0.003 0.000 0.955 49 A CB -0.245 18.745 19.000 -0.017 0.000 1.149 49 A HN 0.333 8.483 8.150 -0.000 0.000 0.538 50 G N -0.248 108.562 108.800 0.016 0.000 2.531 50 G HA2 -0.238 3.721 3.960 -0.002 0.000 0.274 50 G HA3 -0.238 3.721 3.960 -0.002 0.000 0.274 50 G C 0.344 175.244 174.900 -0.000 0.000 1.159 50 G CA 0.346 45.448 45.100 0.002 0.000 0.969 50 G HN 0.690 8.980 8.290 -0.000 0.000 0.554 51 L N 2.273 123.482 121.223 -0.023 0.000 2.628 51 L HA 0.579 4.918 4.340 -0.002 0.000 0.229 51 L C 2.825 179.666 176.870 -0.048 0.000 1.137 51 L CA 1.731 56.549 54.840 -0.037 0.000 0.909 51 L CB -0.020 42.007 42.059 -0.054 0.000 1.137 51 L HN 0.876 9.106 8.230 -0.000 0.000 0.470 52 A N -0.562 122.231 122.820 -0.045 0.000 1.902 52 A HA 0.067 4.386 4.320 -0.002 0.000 0.217 52 A C 0.973 178.531 177.584 -0.043 0.000 1.181 52 A CA 1.702 53.697 52.037 -0.071 0.000 0.623 52 A CB -0.262 18.686 19.000 -0.086 0.000 0.818 52 A HN 0.173 8.323 8.150 -0.000 0.000 0.443 53 V N -4.378 115.537 119.914 0.002 0.000 3.130 53 V HA 0.759 4.878 4.120 -0.002 0.000 0.310 53 V C -0.450 175.652 176.094 0.014 0.000 1.158 53 V CA -0.741 61.575 62.300 0.026 0.000 1.029 53 V CB 1.657 33.516 31.823 0.060 0.000 1.057 53 V HN 0.084 8.274 8.190 -0.000 0.000 0.436 54 S N 0.835 116.523 115.700 -0.020 0.000 2.608 54 S HA 0.756 5.226 4.470 -0.002 0.000 0.291 54 S C -0.347 174.139 174.600 -0.189 0.000 1.146 54 S CA -0.560 57.585 58.200 -0.090 0.000 1.043 54 S CB 1.728 64.887 63.200 -0.068 0.000 1.037 54 S HN 0.786 9.096 8.310 -0.000 0.000 0.520 55 V N 2.411 122.159 119.914 -0.277 0.000 2.509 55 V HA 0.509 4.628 4.120 -0.002 0.000 0.284 55 V C 1.109 177.104 176.094 -0.165 0.000 1.047 55 V CA -0.477 61.607 62.300 -0.359 0.000 0.952 55 V CB 1.083 32.665 31.823 -0.402 0.000 0.988 55 V HN 0.987 9.177 8.190 -0.000 0.000 0.469 56 G N 2.018 110.748 108.800 -0.116 0.000 2.653 56 G HA2 0.139 4.098 3.960 -0.002 0.000 0.265 56 G HA3 0.139 4.098 3.960 -0.002 0.000 0.265 56 G C 0.656 175.533 174.900 -0.039 0.000 1.237 56 G CA 0.201 45.271 45.100 -0.051 0.000 0.946 56 G HN 0.869 9.159 8.290 -0.000 0.000 0.522 57 D N -0.947 119.443 120.400 -0.016 0.000 2.263 57 D HA -0.155 4.484 4.640 -0.002 0.000 0.208 57 D C 1.781 178.077 176.300 -0.008 0.000 0.971 57 D CA 1.543 55.538 54.000 -0.009 0.000 0.867 57 D CB 0.002 40.804 40.800 0.004 0.000 0.929 57 D HN 0.388 8.758 8.370 -0.000 0.000 0.492 58 D N -1.121 119.275 120.400 -0.006 0.000 2.371 58 D HA 0.043 4.682 4.640 -0.002 0.000 0.221 58 D C 1.846 178.144 176.300 -0.004 0.000 0.986 58 D CA 0.938 54.937 54.000 -0.002 0.000 0.899 58 D CB -0.556 40.246 40.800 0.004 0.000 0.902 58 D HN 0.277 8.647 8.370 -0.000 0.000 0.530 59 G N -0.397 108.393 108.800 -0.017 0.000 2.184 59 G HA2 -0.357 3.602 3.960 -0.002 0.000 0.264 59 G HA3 -0.357 3.602 3.960 -0.002 0.000 0.264 59 G C 1.133 176.030 174.900 -0.006 0.000 0.975 59 G CA 0.697 45.785 45.100 -0.020 0.000 0.642 59 G HN 0.424 8.714 8.290 -0.000 0.000 0.536 60 Q N -0.511 119.297 119.800 0.015 0.000 2.534 60 Q HA 0.216 4.555 4.340 -0.002 0.000 0.252 60 Q C 1.027 177.117 176.000 0.150 0.000 0.850 60 Q CA 0.551 56.400 55.803 0.076 0.000 0.974 60 Q CB 0.289 29.061 28.738 0.057 0.000 1.205 60 Q HN 0.427 8.697 8.270 -0.000 0.000 0.593 61 S N 1.946 117.693 115.700 0.077 0.000 2.516 61 S HA 0.169 4.638 4.470 -0.002 0.000 0.282 61 S C -0.560 174.099 174.600 0.099 0.000 1.286 61 S CA -0.008 58.253 58.200 0.101 0.000 1.066 61 S CB 0.103 63.326 63.200 0.038 0.000 0.884 61 S HN 0.170 8.480 8.310 -0.000 0.000 0.491 62 H N 0.535 119.595 119.070 -0.016 0.000 2.499 62 H HA 0.582 5.137 4.556 -0.002 0.000 0.340 62 H C 0.907 176.225 175.328 -0.016 0.000 1.148 62 H CA -0.037 56.002 56.048 -0.016 0.000 1.215 62 H CB 0.851 30.600 29.762 -0.022 0.000 1.529 62 H HN 0.707 8.987 8.280 -0.000 0.000 0.510 63 G N 0.023 108.879 108.800 0.094 0.000 2.588 63 G HA2 0.086 4.045 3.960 -0.002 0.000 0.278 63 G HA3 0.086 4.045 3.960 -0.002 0.000 0.278 63 G C 0.097 175.031 174.900 0.056 0.000 1.307 63 G CA -0.173 44.963 45.100 0.060 0.000 1.016 63 G HN 0.737 9.027 8.290 -0.000 0.000 0.503 64 D N -2.030 118.392 120.400 0.037 0.000 2.441 64 D HA 0.123 4.762 4.640 -0.002 0.000 0.210 64 D C 0.817 177.129 176.300 0.019 0.000 1.102 64 D CA -0.015 54.000 54.000 0.024 0.000 0.840 64 D CB 0.335 41.148 40.800 0.021 0.000 0.990 64 D HN 0.215 8.585 8.370 -0.000 0.000 0.505 65 R N 0.514 121.038 120.500 0.040 0.000 2.740 65 R HA 0.307 4.647 4.340 -0.002 0.000 0.282 65 R C -0.375 175.953 176.300 0.046 0.000 0.969 65 R CA -0.832 55.272 56.100 0.008 0.000 0.918 65 R CB 1.436 31.805 30.300 0.115 0.000 1.175 65 R HN 0.051 8.321 8.270 -0.000 0.000 0.464 66 N N 0.863 119.549 118.700 -0.024 0.000 2.492 66 N HA -0.004 4.735 4.740 -0.002 0.000 0.260 66 N C -0.820 174.895 175.510 0.342 0.000 1.215 66 N CA 0.467 53.570 53.050 0.088 0.000 0.923 66 N CB 0.877 39.363 38.487 -0.002 0.000 1.092 66 N HN 0.350 8.730 8.380 -0.000 0.000 0.448 67 T N 5.464 120.147 114.554 0.215 0.000 2.769 67 T HA 0.198 4.547 4.350 -0.002 0.000 0.293 67 T C -2.063 172.811 174.700 0.291 0.000 0.931 67 T CA -0.732 61.495 62.100 0.212 0.000 1.139 67 T CB 1.031 69.888 68.868 -0.017 0.000 0.881 67 T HN 0.522 8.762 8.240 -0.000 0.000 0.532 68 P HA 0.222 4.642 4.420 -0.000 0.000 0.278 68 P C 0.115 177.598 177.300 0.306 0.000 1.258 68 P CA -0.553 62.708 63.100 0.268 0.000 0.811 68 P CB 0.602 32.295 31.700 -0.012 0.000 1.063 69 T N 0.414 115.106 114.554 0.230 0.000 2.900 69 T HA 0.150 4.499 4.350 -0.002 0.000 0.307 69 T C 1.270 176.094 174.700 0.207 0.000 1.065 69 T CA -0.188 62.078 62.100 0.277 0.000 1.105 69 T CB -0.338 68.664 68.868 0.224 0.000 0.979 69 T HN 0.222 8.462 8.240 -0.000 0.000 0.544 70 L N 2.995 124.343 121.223 0.208 0.000 2.554 70 L HA 0.318 4.657 4.340 -0.002 0.000 0.225 70 L C 1.794 178.667 176.870 0.004 0.000 1.104 70 L CA -0.286 54.544 54.840 -0.017 0.000 0.866 70 L CB -0.512 41.465 42.059 -0.137 0.000 1.047 70 L HN 0.762 8.992 8.230 -0.000 0.000 0.468 71 G N -0.993 107.884 108.800 0.128 0.000 2.225 71 G HA2 -0.034 3.925 3.960 -0.002 0.000 0.245 71 G HA3 -0.034 3.925 3.960 -0.002 0.000 0.245 71 G C -0.043 174.942 174.900 0.142 0.000 1.249 71 G CA 0.184 45.346 45.100 0.104 0.000 0.919 71 G HN 0.440 8.730 8.290 -0.000 0.000 0.486 72 Y N -0.662 119.635 120.300 -0.005 0.000 4.916 72 Y HA -0.379 4.170 4.550 -0.002 0.000 0.247 72 Y C 2.368 178.274 175.900 0.011 0.000 0.962 72 Y CA 1.104 59.196 58.100 -0.014 0.000 1.933 72 Y CB -1.643 36.804 38.460 -0.022 0.000 1.451 72 Y HN 0.768 9.048 8.280 -0.000 0.000 0.539 73 A N 0.325 123.167 122.820 0.035 0.000 2.076 73 A HA 0.037 4.356 4.320 -0.002 0.000 0.220 73 A C 2.250 179.791 177.584 -0.072 0.000 1.160 73 A CA 1.819 53.839 52.037 -0.027 0.000 0.653 73 A CB -0.819 18.110 19.000 -0.119 0.000 0.801 73 A HN 0.887 9.037 8.150 -0.000 0.000 0.455 74 A N -1.061 121.696 122.820 -0.105 0.000 2.209 74 A HA 0.204 4.523 4.320 -0.002 0.000 0.212 74 A C 1.652 179.213 177.584 -0.039 0.000 1.158 74 A CA 0.799 52.768 52.037 -0.114 0.000 0.742 74 A CB -0.208 18.697 19.000 -0.158 0.000 0.790 74 A HN 0.378 8.528 8.150 -0.000 0.000 0.472 75 L N -0.179 121.072 121.223 0.047 0.000 2.567 75 L HA 0.107 4.446 4.340 -0.002 0.000 0.225 75 L C 0.436 177.231 176.870 -0.125 0.000 1.119 75 L CA 0.629 55.522 54.840 0.087 0.000 0.871 75 L CB -0.554 41.693 42.059 0.312 0.000 1.036 75 L HN 0.098 8.328 8.230 -0.000 0.000 0.459 76 V N 2.806 122.597 119.914 -0.205 0.000 2.521 76 V HA 0.136 4.255 4.120 -0.002 0.000 0.286 76 V C -1.642 174.186 176.094 -0.442 0.000 1.034 76 V CA -1.181 60.780 62.300 -0.564 0.000 1.045 76 V CB 0.441 32.130 31.823 -0.224 0.000 0.974 76 V HN 0.160 8.350 8.190 -0.000 0.000 0.480 77 P HA 0.232 4.652 4.420 -0.000 0.000 0.269 77 P C -0.251 177.016 177.300 -0.055 0.000 1.215 77 P CA -0.234 62.729 63.100 -0.228 0.000 0.780 77 P CB 0.545 32.157 31.700 -0.147 0.000 0.898 78 A N 2.618 125.441 122.820 0.005 0.000 2.507 78 A HA 0.116 4.435 4.320 -0.002 0.000 0.235 78 A C 0.077 177.819 177.584 0.264 0.000 1.070 78 A CA -0.264 51.836 52.037 0.105 0.000 0.768 78 A CB -0.650 18.392 19.000 0.070 0.000 1.011 78 A HN 0.543 8.693 8.150 -0.000 0.000 0.502 79 F N 4.031 124.071 119.950 0.150 0.000 2.607 79 F HA 0.332 4.859 4.527 -0.000 0.000 0.374 79 F C 0.954 176.913 175.800 0.264 0.000 1.104 79 F CA 1.519 59.630 58.000 0.185 0.000 1.296 79 F CB 0.353 39.419 39.000 0.108 0.000 1.085 79 F HN 0.793 9.093 8.300 -0.000 0.000 0.584 80 H N 4.564 123.299 119.070 -0.558 0.000 2.967 80 H HA 0.334 4.889 4.556 -0.002 0.000 0.318 80 H C -1.621 173.488 175.328 -0.366 0.000 1.375 80 H CA -1.350 54.534 56.048 -0.273 0.000 1.132 80 H CB 0.949 30.651 29.762 -0.101 0.000 1.848 80 H HN 0.695 8.975 8.280 -0.000 0.000 0.524 81 R N 1.742 122.128 120.500 -0.190 0.000 2.295 81 R HA 0.173 4.512 4.340 -0.002 0.000 0.324 81 R C -0.862 175.322 176.300 -0.194 0.000 0.968 81 R CA -0.384 55.495 56.100 -0.369 0.000 0.837 81 R CB 0.775 30.854 30.300 -0.368 0.000 1.133 81 R HN 0.802 9.072 8.270 -0.000 0.000 0.450 82 D N 3.461 123.724 120.400 -0.227 0.000 2.433 82 D HA 0.095 4.734 4.640 -0.002 0.000 0.255 82 D C 0.849 177.104 176.300 -0.076 0.000 1.226 82 D CA -0.303 53.671 54.000 -0.043 0.000 1.015 82 D CB 0.566 41.365 40.800 -0.002 0.000 1.091 82 D HN 0.399 8.769 8.370 -0.000 0.000 0.527 83 A N -0.114 122.687 122.820 -0.031 0.000 2.067 83 A HA -0.167 4.152 4.320 -0.002 0.000 0.219 83 A C 1.450 179.001 177.584 -0.055 0.000 1.158 83 A CA 0.825 52.838 52.037 -0.039 0.000 0.661 83 A CB -0.778 18.212 19.000 -0.017 0.000 0.801 83 A HN 0.550 8.700 8.150 -0.000 0.000 0.452 84 N N -0.097 118.567 118.700 -0.061 0.000 2.571 84 N HA 0.071 4.810 4.740 -0.002 0.000 0.189 84 N C 1.168 176.620 175.510 -0.097 0.000 1.154 84 N CA 0.986 53.998 53.050 -0.062 0.000 0.907 84 N CB -0.186 38.273 38.487 -0.046 0.000 0.977 84 N HN 0.645 9.025 8.380 -0.000 0.000 0.449 85 G N 0.527 109.237 108.800 -0.149 0.000 2.160 85 G HA2 -0.278 3.681 3.960 -0.002 0.000 0.251 85 G HA3 -0.278 3.681 3.960 -0.002 0.000 0.251 85 G C -0.236 174.474 174.900 -0.317 0.000 1.008 85 G CA 0.101 45.061 45.100 -0.233 0.000 0.724 85 G HN 0.154 8.444 8.290 -0.000 0.000 0.514 86 K N 0.220 120.458 120.400 -0.270 0.000 2.234 86 K HA 0.429 4.748 4.320 -0.002 0.000 0.277 86 K C 0.191 176.582 176.600 -0.349 0.000 1.038 86 K CA -0.814 55.333 56.287 -0.233 0.000 0.888 86 K CB 0.673 33.109 32.500 -0.106 0.000 1.091 86 K HN 0.314 8.564 8.250 -0.000 0.000 0.467 87 Y N 1.590 121.796 120.300 -0.157 0.000 2.497 87 Y HA 0.073 4.623 4.550 0.001 0.000 0.334 87 Y C 1.040 176.818 175.900 -0.203 0.000 1.199 87 Y CA 0.665 58.572 58.100 -0.321 0.000 1.425 87 Y CB 0.753 39.047 38.460 -0.276 0.000 1.291 87 Y HN 0.192 8.472 8.280 -0.000 0.000 0.562 88 K N 1.321 121.513 120.400 -0.346 0.000 2.527 88 K HA 0.532 4.851 4.320 -0.002 0.000 0.260 88 K C -0.124 176.405 176.600 -0.119 0.000 0.937 88 K CA -0.102 56.098 56.287 -0.144 0.000 0.826 88 K CB 2.422 34.706 32.500 -0.359 0.000 1.359 88 K HN 0.877 9.127 8.250 -0.000 0.000 0.434 89 G N 0.844 109.769 108.800 0.208 0.000 2.632 89 G HA2 0.150 4.109 3.960 -0.002 0.000 0.224 89 G HA3 0.150 4.109 3.960 -0.002 0.000 0.224 89 G C 0.154 175.304 174.900 0.416 0.000 1.341 89 G CA -0.037 45.176 45.100 0.187 0.000 0.880 89 G HN 1.331 9.621 8.290 -0.000 0.000 0.566 90 G N -2.324 106.675 108.800 0.332 0.000 2.760 90 G HA2 0.403 4.362 3.960 -0.002 0.000 0.246 90 G HA3 0.403 4.362 3.960 -0.002 0.000 0.246 90 G C -0.515 174.509 174.900 0.207 0.000 1.359 90 G CA 0.780 46.093 45.100 0.356 0.000 0.861 90 G HN 1.586 9.876 8.290 -0.000 0.000 0.541 91 Q N -1.160 118.714 119.800 0.123 0.000 2.451 91 Q HA 0.818 5.158 4.340 -0.002 0.000 0.281 91 Q C -0.101 175.935 176.000 0.059 0.000 1.099 91 Q CA -0.450 55.334 55.803 -0.033 0.000 0.806 91 Q CB 1.917 30.507 28.738 -0.248 0.000 1.419 91 Q HN 1.220 9.490 8.270 -0.000 0.000 0.427 92 F N -1.815 118.186 119.950 0.086 0.000 2.183 92 F HA -0.220 4.306 4.527 -0.002 0.000 0.318 92 F C 0.361 176.297 175.800 0.227 0.000 1.290 92 F CA -0.217 57.869 58.000 0.142 0.000 0.912 92 F CB -0.689 38.418 39.000 0.178 0.000 4.135 92 F HN 0.756 9.056 8.300 -0.000 0.000 0.137 93 W N 0.446 122.046 121.300 0.499 0.000 2.392 93 W HA -0.094 4.565 4.660 -0.002 0.000 0.279 93 W C 1.916 178.742 176.519 0.512 0.000 1.225 93 W CA 1.419 59.048 57.345 0.474 0.000 1.233 93 W CB -0.170 29.586 29.460 0.494 0.000 1.122 93 W HN 0.559 8.739 8.180 -0.000 0.000 0.561 94 D N -1.817 118.944 120.400 0.601 0.000 2.402 94 D HA 0.190 4.829 4.640 -0.002 0.000 0.216 94 D C 1.644 178.094 176.300 0.250 0.000 1.128 94 D CA 0.317 54.514 54.000 0.329 0.000 0.833 94 D CB -0.462 40.387 40.800 0.081 0.000 0.971 94 D HN 0.056 8.426 8.370 -0.000 0.000 0.503 95 G N 2.199 111.261 108.800 0.436 0.000 2.203 95 G HA2 -0.448 3.511 3.960 -0.002 0.000 0.263 95 G HA3 -0.448 3.511 3.960 -0.002 0.000 0.263 95 G C 1.137 175.999 174.900 -0.063 0.000 1.012 95 G CA 0.691 45.971 45.100 0.300 0.000 0.749 95 G HN 0.627 8.917 8.290 -0.000 0.000 0.512 96 R N -0.509 120.029 120.500 0.064 0.000 2.235 96 R HA 0.461 4.800 4.340 -0.002 0.000 0.213 96 R C 1.188 177.517 176.300 0.049 0.000 1.059 96 R CA 1.069 57.148 56.100 -0.036 0.000 0.997 96 R CB 0.060 30.353 30.300 -0.012 0.000 0.884 96 R HN 0.991 9.261 8.270 -0.000 0.000 0.462 97 A N 1.334 124.274 122.820 0.201 0.000 2.301 97 A HA 0.244 4.563 4.320 -0.002 0.000 0.312 97 A C -0.268 177.337 177.584 0.034 0.000 1.182 97 A CA -0.798 51.304 52.037 0.108 0.000 0.826 97 A CB 1.095 20.111 19.000 0.026 0.000 1.134 97 A HN 0.130 8.280 8.150 -0.000 0.000 0.501 98 D N 0.731 121.149 120.400 0.030 0.000 2.144 98 D HA -0.011 4.628 4.640 -0.002 0.000 0.199 98 D C 0.151 176.509 176.300 0.097 0.000 0.984 98 D CA 2.307 56.363 54.000 0.094 0.000 0.834 98 D CB 0.133 40.987 40.800 0.090 0.000 0.955 98 D HN 0.842 9.212 8.370 -0.000 0.000 0.465 99 D N -2.680 117.733 120.400 0.021 0.000 2.792 99 D HA 0.077 4.716 4.640 -0.002 0.000 0.335 99 D C 0.731 176.983 176.300 -0.081 0.000 1.353 99 D CA -0.692 53.297 54.000 -0.019 0.000 0.839 99 D CB 0.321 41.115 40.800 -0.010 0.000 1.396 99 D HN -0.155 8.215 8.370 -0.000 0.000 0.479 100 L N -0.321 120.836 121.223 -0.110 0.000 2.083 100 L HA -0.090 4.249 4.340 -0.002 0.000 0.209 100 L C 2.467 179.258 176.870 -0.133 0.000 1.083 100 L CA 1.338 56.083 54.840 -0.158 0.000 0.752 100 L CB -0.340 41.610 42.059 -0.183 0.000 0.899 100 L HN 0.504 8.734 8.230 -0.000 0.000 0.433 101 K N -0.158 120.187 120.400 -0.092 0.000 2.057 101 K HA -0.217 4.102 4.320 -0.002 0.000 0.206 101 K C 2.165 178.731 176.600 -0.057 0.000 1.050 101 K CA 1.286 57.529 56.287 -0.073 0.000 0.935 101 K CB -0.024 32.450 32.500 -0.043 0.000 0.715 101 K HN 0.280 8.530 8.250 -0.000 0.000 0.439 102 Q N 0.287 120.067 119.800 -0.033 0.000 2.167 102 Q HA -0.183 4.156 4.340 -0.002 0.000 0.202 102 Q C 2.174 178.176 176.000 0.004 0.000 0.970 102 Q CA 1.199 57.005 55.803 0.004 0.000 0.855 102 Q CB 0.122 28.873 28.738 0.022 0.000 0.911 102 Q HN 0.357 8.627 8.270 -0.000 0.000 0.438 103 Q N 0.044 119.797 119.800 -0.078 0.000 2.084 103 Q HA -0.132 4.207 4.340 -0.002 0.000 0.202 103 Q C 1.768 177.723 176.000 -0.074 0.000 0.978 103 Q CA 1.526 57.233 55.803 -0.160 0.000 0.844 103 Q CB -0.162 28.316 28.738 -0.434 0.000 0.898 103 Q HN 0.401 8.671 8.270 -0.000 0.000 0.426 104 A N 0.149 122.911 122.820 -0.097 0.000 1.933 104 A HA -0.089 4.230 4.320 -0.002 0.000 0.218 104 A C 2.272 179.808 177.584 -0.081 0.000 1.175 104 A CA 1.666 53.648 52.037 -0.091 0.000 0.628 104 A CB -1.037 17.892 19.000 -0.120 0.000 0.814 104 A HN 0.536 8.686 8.150 -0.000 0.000 0.444 105 G N -1.003 107.728 108.800 -0.115 0.000 2.471 105 G HA2 -0.137 3.822 3.960 -0.002 0.000 0.219 105 G HA3 -0.137 3.822 3.960 -0.002 0.000 0.219 105 G C 1.533 176.592 174.900 0.265 0.000 1.125 105 G CA 0.836 45.868 45.100 -0.114 0.000 0.775 105 G HN 0.673 8.963 8.290 -0.000 0.000 0.548 106 Q N 0.265 120.209 119.800 0.239 0.000 2.083 106 Q HA -0.053 4.286 4.340 -0.002 0.000 0.198 106 Q C -0.148 176.002 176.000 0.250 0.000 0.969 106 Q CA 1.177 57.154 55.803 0.289 0.000 0.838 106 Q CB -0.610 28.355 28.738 0.378 0.000 0.900 106 Q HN 0.368 8.638 8.270 -0.000 0.000 0.436 107 P HA -0.147 4.273 4.420 -0.000 0.000 0.219 107 P C 1.075 178.464 177.300 0.149 0.000 1.146 107 P CA 1.352 64.570 63.100 0.196 0.000 0.808 107 P CB -0.045 31.773 31.700 0.197 0.000 0.779 108 M N -1.506 118.193 119.600 0.166 0.000 2.175 108 M HA -0.090 4.389 4.480 -0.002 0.000 0.264 108 M C 1.672 178.066 176.300 0.157 0.000 1.063 108 M CA 1.633 57.033 55.300 0.165 0.000 1.119 108 M CB -0.533 32.206 32.600 0.231 0.000 1.377 108 M HN -0.084 8.206 8.290 -0.000 0.000 0.415 109 L N -0.924 120.402 121.223 0.172 0.000 2.585 109 L HA 0.102 4.441 4.340 -0.002 0.000 0.226 109 L C 0.725 177.631 176.870 0.061 0.000 1.113 109 L CA -0.375 54.519 54.840 0.090 0.000 0.876 109 L CB -0.538 41.555 42.059 0.057 0.000 1.072 109 L HN 0.201 8.431 8.230 -0.000 0.000 0.468 110 N N 2.262 121.009 118.700 0.078 0.000 2.452 110 N HA 0.057 4.796 4.740 -0.002 0.000 0.266 110 N C -1.625 173.905 175.510 0.034 0.000 1.175 110 N CA -1.667 51.414 53.050 0.050 0.000 0.945 110 N CB 1.394 39.918 38.487 0.062 0.000 1.063 110 N HN -0.090 8.290 8.380 -0.000 0.000 0.472 111 P HA -0.109 4.311 4.420 -0.000 0.000 0.226 111 P C 1.148 178.455 177.300 0.012 0.000 1.153 111 P CA 0.699 63.806 63.100 0.012 0.000 0.777 111 P CB 0.171 31.872 31.700 0.003 0.000 0.794 112 V N -3.541 116.381 119.914 0.013 0.000 3.623 112 V HA 0.128 4.247 4.120 -0.002 0.000 0.271 112 V C 1.132 177.235 176.094 0.015 0.000 1.248 112 V CA 0.620 62.929 62.300 0.014 0.000 1.156 112 V CB -0.706 31.125 31.823 0.013 0.000 0.870 112 V HN -0.023 8.167 8.190 -0.000 0.000 0.453 113 E N -0.028 120.188 120.200 0.027 0.000 4.027 113 E HA 0.369 4.718 4.350 -0.002 0.000 0.301 113 E C 1.406 178.024 176.600 0.030 0.000 0.824 113 E CA -0.071 56.349 56.400 0.033 0.000 1.453 113 E CB 0.095 29.835 29.700 0.067 0.000 2.320 113 E HN 0.259 8.619 8.360 -0.000 0.000 0.484 114 M N 0.526 120.155 119.600 0.047 0.000 2.476 114 M HA 0.103 4.582 4.480 -0.002 0.000 0.262 114 M C 0.949 177.272 176.300 0.039 0.000 1.079 114 M CA 0.910 56.235 55.300 0.042 0.000 1.104 114 M CB 0.065 32.698 32.600 0.056 0.000 1.409 114 M HN 0.520 8.810 8.290 -0.000 0.000 0.467 115 A N 0.182 123.026 122.820 0.039 0.000 2.826 115 A HA -0.181 4.139 4.320 -0.002 0.000 0.274 115 A C 0.430 178.028 177.584 0.025 0.000 1.443 115 A CA 0.622 52.675 52.037 0.027 0.000 0.833 115 A CB -1.907 17.102 19.000 0.017 0.000 1.023 115 A HN 0.453 8.603 8.150 -0.000 0.000 0.600 116 M N -0.349 119.273 119.600 0.037 0.000 2.245 116 M HA 0.122 4.601 4.480 -0.002 0.000 0.344 116 M C -0.567 175.736 176.300 0.005 0.000 1.170 116 M CA -1.370 53.946 55.300 0.027 0.000 1.135 116 M CB -0.359 32.270 32.600 0.048 0.000 1.574 116 M HN 0.193 8.483 8.290 -0.000 0.000 0.452 117 P HA -0.063 4.357 4.420 -0.000 0.000 0.219 117 P C -0.442 176.829 177.300 -0.048 0.000 1.150 117 P CA 1.314 64.400 63.100 -0.024 0.000 0.814 117 P CB 0.192 31.879 31.700 -0.022 0.000 0.787 118 D N -3.767 116.593 120.400 -0.067 0.000 2.769 118 D HA 0.115 4.754 4.640 -0.002 0.000 0.309 118 D C 0.758 176.955 176.300 -0.171 0.000 1.315 118 D CA -0.811 53.114 54.000 -0.126 0.000 0.780 118 D CB 0.332 41.066 40.800 -0.110 0.000 1.312 118 D HN -0.317 8.053 8.370 -0.000 0.000 0.437 119 R N -0.214 120.112 120.500 -0.290 0.000 2.081 119 R HA 0.042 4.381 4.340 -0.002 0.000 0.235 119 R C 2.088 178.308 176.300 -0.132 0.000 1.131 119 R CA 1.932 57.825 56.100 -0.345 0.000 0.960 119 R CB -0.587 29.425 30.300 -0.480 0.000 0.856 119 R HN 0.537 8.807 8.270 -0.000 0.000 0.436 120 A N 1.296 124.051 122.820 -0.108 0.000 1.940 120 A HA -0.181 4.139 4.320 -0.002 0.000 0.219 120 A C 2.371 179.928 177.584 -0.044 0.000 1.176 120 A CA 1.848 53.846 52.037 -0.065 0.000 0.631 120 A CB -0.699 18.267 19.000 -0.057 0.000 0.814 120 A HN 0.425 8.575 8.150 -0.000 0.000 0.446 121 A N -0.694 122.102 122.820 -0.041 0.000 1.898 121 A HA 0.030 4.349 4.320 -0.002 0.000 0.216 121 A C 2.228 179.810 177.584 -0.003 0.000 1.181 121 A CA 1.714 53.739 52.037 -0.020 0.000 0.620 121 A CB -0.867 18.124 19.000 -0.016 0.000 0.819 121 A HN 0.392 8.542 8.150 -0.000 0.000 0.442 122 V N -0.071 119.851 119.914 0.013 0.000 2.295 122 V HA -0.249 3.870 4.120 -0.002 0.000 0.246 122 V C 3.067 179.156 176.094 -0.008 0.000 1.049 122 V CA 1.907 64.236 62.300 0.048 0.000 1.024 122 V CB -1.283 30.652 31.823 0.187 0.000 0.648 122 V HN 0.611 8.801 8.190 -0.000 0.000 0.447 123 A N 0.107 122.913 122.820 -0.025 0.000 1.908 123 A HA -0.177 4.142 4.320 -0.002 0.000 0.218 123 A C 2.427 179.968 177.584 -0.071 0.000 1.181 123 A CA 2.284 54.273 52.037 -0.080 0.000 0.627 123 A CB -0.831 18.127 19.000 -0.070 0.000 0.818 123 A HN 0.591 8.741 8.150 -0.000 0.000 0.445 124 A N -0.591 122.206 122.820 -0.038 0.000 1.933 124 A HA -0.149 4.170 4.320 -0.002 0.000 0.218 124 A C 2.214 179.795 177.584 -0.005 0.000 1.175 124 A CA 1.431 53.455 52.037 -0.021 0.000 0.628 124 A CB -0.424 18.568 19.000 -0.014 0.000 0.814 124 A HN 0.423 8.573 8.150 -0.000 0.000 0.444 125 R N -0.235 120.266 120.500 0.003 0.000 2.081 125 R HA -0.044 4.295 4.340 -0.002 0.000 0.235 125 R C 2.081 178.418 176.300 0.061 0.000 1.131 125 R CA 1.282 57.403 56.100 0.034 0.000 0.960 125 R CB -1.035 29.291 30.300 0.045 0.000 0.856 125 R HN 0.597 8.867 8.270 -0.000 0.000 0.436 126 L N 0.186 121.402 121.223 -0.012 0.000 2.017 126 L HA -0.103 4.237 4.340 -0.002 0.000 0.208 126 L C 2.843 179.745 176.870 0.053 0.000 1.073 126 L CA 1.295 56.117 54.840 -0.029 0.000 0.745 126 L CB -0.509 41.304 42.059 -0.409 0.000 0.894 126 L HN 0.155 8.385 8.230 -0.000 0.000 0.432 127 R N 0.277 120.764 120.500 -0.021 0.000 2.152 127 R HA -0.187 4.152 4.340 -0.002 0.000 0.232 127 R C 1.640 177.962 176.300 0.036 0.000 1.117 127 R CA 1.549 57.649 56.100 0.000 0.000 0.981 127 R CB -0.183 30.103 30.300 -0.024 0.000 0.870 127 R HN 0.352 8.622 8.270 -0.000 0.000 0.451 128 D N 0.559 120.986 120.400 0.045 0.000 2.263 128 D HA -0.120 4.519 4.640 -0.002 0.000 0.208 128 D C -0.059 176.266 176.300 0.041 0.000 0.971 128 D CA 0.990 55.014 54.000 0.040 0.000 0.867 128 D CB -0.106 40.717 40.800 0.039 0.000 0.929 128 D HN 0.198 8.568 8.370 -0.000 0.000 0.492 129 D N -0.709 119.734 120.400 0.072 0.000 2.392 129 D HA 0.118 4.757 4.640 -0.002 0.000 0.228 129 D C -1.833 174.479 176.300 0.021 0.000 1.074 129 D CA -2.187 51.819 54.000 0.010 0.000 0.838 129 D CB 2.143 42.896 40.800 -0.078 0.000 1.067 129 D HN -0.141 8.229 8.370 -0.000 0.000 0.511 130 P HA -0.083 4.337 4.420 -0.000 0.000 0.218 130 P C 0.958 178.274 177.300 0.028 0.000 1.148 130 P CA 0.889 64.001 63.100 0.021 0.000 0.822 130 P CB 0.309 32.012 31.700 0.004 0.000 0.784 131 A N -1.676 121.120 122.820 -0.040 0.000 1.969 131 A HA -0.179 4.140 4.320 -0.002 0.000 0.218 131 A C 2.101 179.744 177.584 0.099 0.000 1.169 131 A CA 1.188 53.203 52.037 -0.036 0.000 0.635 131 A CB -1.713 17.199 19.000 -0.148 0.000 0.810 131 A HN 0.203 8.353 8.150 -0.000 0.000 0.445 132 Y N -0.567 119.823 120.300 0.150 0.000 2.220 132 Y HA -0.154 4.395 4.550 -0.001 0.000 0.291 132 Y C 2.802 178.883 175.900 0.301 0.000 1.129 132 Y CA 0.871 59.148 58.100 0.296 0.000 1.161 132 Y CB -0.125 38.476 38.460 0.235 0.000 0.997 132 Y HN 0.226 8.506 8.280 -0.000 0.000 0.522 133 R N -0.231 120.449 120.500 0.301 0.000 2.094 133 R HA -0.174 4.165 4.340 -0.002 0.000 0.239 133 R C 2.167 178.594 176.300 0.210 0.000 1.137 133 R CA 2.162 58.384 56.100 0.203 0.000 0.943 133 R CB -0.875 29.494 30.300 0.116 0.000 0.850 133 R HN 0.259 8.529 8.270 -0.000 0.000 0.433 134 T N -0.230 114.426 114.554 0.170 0.000 2.643 134 T HA -0.115 4.234 4.350 -0.002 0.000 0.264 134 T C 1.917 176.709 174.700 0.152 0.000 1.045 134 T CA 1.537 63.716 62.100 0.132 0.000 1.155 134 T CB -0.625 68.295 68.868 0.087 0.000 0.863 134 T HN 0.555 8.795 8.240 -0.000 0.000 0.420 135 G N 0.206 109.115 108.800 0.182 0.000 2.418 135 G HA2 -0.121 3.838 3.960 -0.002 0.000 0.217 135 G HA3 -0.121 3.838 3.960 -0.002 0.000 0.217 135 G C 1.327 176.307 174.900 0.133 0.000 1.158 135 G CA 0.321 45.497 45.100 0.128 0.000 0.771 135 G HN 0.406 8.696 8.290 -0.000 0.000 0.545 136 F N 1.057 121.121 119.950 0.191 0.000 2.075 136 F HA 0.030 4.556 4.527 -0.002 0.000 0.297 136 F C 2.846 178.804 175.800 0.263 0.000 1.113 136 F CA 1.728 59.878 58.000 0.251 0.000 1.218 136 F CB -0.178 38.907 39.000 0.142 0.000 0.984 136 F HN 0.173 8.473 8.300 -0.000 0.000 0.472 137 E N -0.123 120.285 120.200 0.346 0.000 2.110 137 E HA -0.194 4.155 4.350 -0.002 0.000 0.193 137 E C 2.340 179.027 176.600 0.144 0.000 0.988 137 E CA 0.880 57.416 56.400 0.227 0.000 0.804 137 E CB -0.348 29.449 29.700 0.161 0.000 0.745 137 E HN 0.383 8.742 8.360 -0.000 0.000 0.458 138 A N 0.779 123.661 122.820 0.104 0.000 1.978 138 A HA -0.155 4.164 4.320 -0.002 0.000 0.220 138 A C 2.076 179.637 177.584 -0.038 0.000 1.170 138 A CA 1.167 53.222 52.037 0.030 0.000 0.636 138 A CB -0.308 18.701 19.000 0.016 0.000 0.810 138 A HN 0.144 8.294 8.150 -0.000 0.000 0.448 139 L N -3.424 117.754 121.223 -0.076 0.000 2.357 139 L HA 0.189 4.528 4.340 -0.002 0.000 0.211 139 L C 1.414 178.001 176.870 -0.471 0.000 1.075 139 L CA 0.544 55.172 54.840 -0.354 0.000 0.830 139 L CB 0.116 41.818 42.059 -0.594 0.000 0.996 139 L HN 0.392 8.622 8.230 -0.000 0.000 0.467 140 F N -0.543 119.430 119.950 0.039 0.000 2.706 140 F HA 0.489 5.015 4.527 -0.002 0.000 0.313 140 F C 0.984 176.818 175.800 0.057 0.000 1.096 140 F CA 0.029 58.062 58.000 0.055 0.000 1.219 140 F CB 0.778 39.837 39.000 0.098 0.000 1.051 140 F HN -0.020 8.280 8.300 -0.000 0.000 0.568 141 G N 1.188 110.102 108.800 0.190 0.000 2.650 141 G HA2 -0.115 3.844 3.960 -0.002 0.000 0.686 141 G HA3 -0.115 3.844 3.960 -0.002 0.000 0.686 141 G C -0.793 174.188 174.900 0.134 0.000 1.205 141 G CA -1.295 43.883 45.100 0.131 0.000 0.781 141 G HN -0.095 8.195 8.290 -0.000 0.000 0.648 142 K N 0.422 120.878 120.400 0.092 0.000 2.469 142 K HA 0.408 4.727 4.320 -0.002 0.000 0.274 142 K C 1.685 178.327 176.600 0.071 0.000 0.983 142 K CA 1.343 57.677 56.287 0.078 0.000 0.974 142 K CB 0.695 33.229 32.500 0.056 0.000 0.913 142 K HN 2.272 10.522 8.250 -0.000 0.000 0.493 143 G N 1.012 109.848 108.800 0.060 0.000 2.189 143 G HA2 -0.315 3.644 3.960 -0.002 0.000 0.267 143 G HA3 -0.315 3.644 3.960 -0.002 0.000 0.267 143 G C 0.888 175.810 174.900 0.037 0.000 0.975 143 G CA 0.516 45.641 45.100 0.041 0.000 0.644 143 G HN 0.472 8.762 8.290 -0.000 0.000 0.537 144 V N 0.618 120.572 119.914 0.066 0.000 2.380 144 V HA -0.089 4.030 4.120 -0.002 0.000 0.251 144 V C 2.501 178.573 176.094 -0.037 0.000 1.063 144 V CA 2.726 65.055 62.300 0.048 0.000 1.055 144 V CB -0.160 31.745 31.823 0.136 0.000 0.657 144 V HN 0.545 8.735 8.190 -0.000 0.000 0.455 145 L N -0.526 120.663 121.223 -0.057 0.000 2.558 145 L HA 0.072 4.411 4.340 -0.002 0.000 0.225 145 L C 1.750 178.569 176.870 -0.086 0.000 1.128 145 L CA 0.584 55.338 54.840 -0.143 0.000 0.868 145 L CB -0.407 41.549 42.059 -0.172 0.000 1.006 145 L HN 0.331 8.561 8.230 -0.000 0.000 0.454 146 D N -0.479 119.896 120.400 -0.042 0.000 2.347 146 D HA -0.057 4.582 4.640 -0.002 0.000 0.213 146 D C 0.530 176.813 176.300 -0.027 0.000 0.985 146 D CA 0.760 54.743 54.000 -0.028 0.000 0.879 146 D CB 0.242 41.036 40.800 -0.010 0.000 0.919 146 D HN 0.124 8.494 8.370 -0.000 0.000 0.526 147 D N 0.278 120.660 120.400 -0.030 0.000 2.473 147 D HA 0.133 4.772 4.640 -0.002 0.000 0.226 147 D C -1.842 174.438 176.300 -0.033 0.000 1.089 147 D CA -2.336 51.650 54.000 -0.024 0.000 0.883 147 D CB 1.904 42.698 40.800 -0.009 0.000 1.029 147 D HN -0.193 8.177 8.370 -0.000 0.000 0.517 148 P HA -0.173 4.247 4.420 -0.000 0.000 0.217 148 P C 1.054 178.346 177.300 -0.013 0.000 1.151 148 P CA 1.080 64.157 63.100 -0.039 0.000 0.849 148 P CB 0.505 32.169 31.700 -0.059 0.000 0.787 149 E N -0.763 119.428 120.200 -0.014 0.000 2.072 149 E HA -0.081 4.268 4.350 -0.002 0.000 0.190 149 E C 2.164 178.787 176.600 0.038 0.000 0.982 149 E CA 0.879 57.289 56.400 0.016 0.000 0.803 149 E CB -0.424 29.276 29.700 0.000 0.000 0.755 149 E HN 0.301 8.661 8.360 -0.000 0.000 0.453 150 R N 0.576 121.078 120.500 0.003 0.000 2.096 150 R HA -0.039 4.300 4.340 -0.002 0.000 0.235 150 R C 2.321 178.575 176.300 -0.078 0.000 1.127 150 R CA 1.181 57.266 56.100 -0.024 0.000 0.968 150 R CB -0.250 30.042 30.300 -0.013 0.000 0.861 150 R HN 0.083 8.353 8.270 -0.000 0.000 0.440 151 A N 0.521 123.296 122.820 -0.076 0.000 1.898 151 A HA -0.176 4.143 4.320 -0.002 0.000 0.216 151 A C 1.932 179.456 177.584 -0.100 0.000 1.181 151 A CA 1.008 52.945 52.037 -0.167 0.000 0.620 151 A CB -0.572 18.312 19.000 -0.194 0.000 0.819 151 A HN 0.323 8.473 8.150 -0.000 0.000 0.442 152 F N 0.775 120.636 119.950 -0.148 0.000 2.113 152 F HA -0.144 4.382 4.527 -0.002 0.000 0.297 152 F C 1.910 177.659 175.800 -0.086 0.000 1.103 152 F CA 2.068 60.007 58.000 -0.102 0.000 1.248 152 F CB -0.330 38.626 39.000 -0.072 0.000 0.999 152 F HN 0.385 8.685 8.300 -0.000 0.000 0.475 153 D N -0.264 120.152 120.400 0.026 0.000 2.117 153 D HA -0.157 4.482 4.640 -0.002 0.000 0.198 153 D C 2.236 178.426 176.300 -0.185 0.000 0.982 153 D CA 1.300 55.266 54.000 -0.056 0.000 0.828 153 D CB -0.193 40.608 40.800 0.001 0.000 0.967 153 D HN 0.292 8.662 8.370 -0.000 0.000 0.464 154 A N 0.559 123.187 122.820 -0.321 0.000 1.877 154 A HA -0.020 4.299 4.320 -0.002 0.000 0.216 154 A C 2.374 179.786 177.584 -0.288 0.000 1.186 154 A CA 2.106 53.716 52.037 -0.712 0.000 0.620 154 A CB -1.167 17.117 19.000 -1.194 0.000 0.822 154 A HN 0.321 8.471 8.150 -0.000 0.000 0.443 155 A N -0.126 122.666 122.820 -0.048 0.000 1.908 155 A HA 0.087 4.406 4.320 -0.002 0.000 0.218 155 A C 2.509 180.008 177.584 -0.141 0.000 1.181 155 A CA 2.348 54.379 52.037 -0.011 0.000 0.627 155 A CB -1.041 17.913 19.000 -0.077 0.000 0.818 155 A HN 1.112 9.262 8.150 -0.000 0.000 0.445 156 A N -0.539 122.134 122.820 -0.245 0.000 1.898 156 A HA -0.127 4.192 4.320 -0.002 0.000 0.216 156 A C 1.959 179.478 177.584 -0.108 0.000 1.181 156 A CA 2.004 53.913 52.037 -0.214 0.000 0.620 156 A CB -0.492 18.354 19.000 -0.255 0.000 0.819 156 A HN 0.602 8.752 8.150 -0.000 0.000 0.442 157 E N 0.132 120.292 120.200 -0.066 0.000 2.058 157 E HA -0.115 4.234 4.350 -0.002 0.000 0.194 157 E C 2.069 178.690 176.600 0.035 0.000 0.997 157 E CA 1.629 58.043 56.400 0.024 0.000 0.801 157 E CB -0.380 29.416 29.700 0.161 0.000 0.746 157 E HN 0.497 8.857 8.360 -0.000 0.000 0.450 158 A N 0.317 123.157 122.820 0.033 0.000 1.877 158 A HA -0.147 4.172 4.320 -0.002 0.000 0.216 158 A C 2.272 179.856 177.584 -0.002 0.000 1.186 158 A CA 1.446 53.486 52.037 0.004 0.000 0.620 158 A CB -0.774 18.172 19.000 -0.091 0.000 0.822 158 A HN 0.334 8.484 8.150 -0.000 0.000 0.443 159 L N -0.799 120.420 121.223 -0.007 0.000 2.083 159 L HA -0.186 4.153 4.340 -0.002 0.000 0.209 159 L C 3.051 179.888 176.870 -0.054 0.000 1.083 159 L CA 1.070 55.929 54.840 0.031 0.000 0.752 159 L CB -0.429 41.652 42.059 0.037 0.000 0.899 159 L HN 0.436 8.666 8.230 -0.000 0.000 0.433 160 A N -0.263 122.503 122.820 -0.090 0.000 1.969 160 A HA -0.098 4.221 4.320 -0.002 0.000 0.218 160 A C 2.510 179.996 177.584 -0.163 0.000 1.169 160 A CA 1.472 53.418 52.037 -0.151 0.000 0.635 160 A CB -0.597 18.333 19.000 -0.116 0.000 0.810 160 A HN 0.388 8.538 8.150 -0.000 0.000 0.445 161 A N -1.305 121.464 122.820 -0.086 0.000 1.902 161 A HA -0.103 4.216 4.320 -0.002 0.000 0.217 161 A C 2.132 179.677 177.584 -0.065 0.000 1.181 161 A CA 1.657 53.655 52.037 -0.066 0.000 0.623 161 A CB -0.781 18.205 19.000 -0.023 0.000 0.818 161 A HN 0.704 8.854 8.150 -0.000 0.000 0.443 162 Y N 0.794 120.966 120.300 -0.213 0.000 2.181 162 Y HA -0.183 4.366 4.550 -0.001 0.000 0.288 162 Y C 2.261 177.833 175.900 -0.547 0.000 1.146 162 Y CA 2.070 60.021 58.100 -0.248 0.000 1.164 162 Y CB -0.596 37.750 38.460 -0.191 0.000 0.982 162 Y HN 0.464 8.744 8.280 -0.000 0.000 0.515 163 Q N -0.541 118.684 119.800 -0.959 0.000 2.437 163 Q HA 0.007 4.346 4.340 -0.002 0.000 0.210 163 Q C 1.932 177.424 176.000 -0.847 0.000 0.972 163 Q CA 0.741 55.565 55.803 -1.631 0.000 0.903 163 Q CB -0.131 27.869 28.738 -1.230 0.000 0.967 163 Q HN 0.545 8.815 8.270 -0.000 0.000 0.486 164 A N 0.902 123.445 122.820 -0.462 0.000 2.251 164 A HA 0.038 4.357 4.320 -0.002 0.000 0.209 164 A C 1.073 178.567 177.584 -0.151 0.000 1.187 164 A CA 0.245 52.136 52.037 -0.243 0.000 0.823 164 A CB -0.249 18.657 19.000 -0.157 0.000 0.846 164 A HN 0.346 8.496 8.150 -0.000 0.000 0.486 165 T N -4.491 109.971 114.554 -0.153 0.000 2.824 165 T HA 0.470 4.819 4.350 -0.002 0.000 0.277 165 T C 1.379 176.072 174.700 -0.011 0.000 0.975 165 T CA 0.050 62.128 62.100 -0.037 0.000 0.966 165 T CB 1.338 70.221 68.868 0.024 0.000 1.054 165 T HN 0.227 8.467 8.240 -0.000 0.000 0.533 166 G N -0.453 108.354 108.800 0.013 0.000 2.471 166 G HA2 -0.129 3.830 3.960 -0.002 0.000 0.219 166 G HA3 -0.129 3.830 3.960 -0.002 0.000 0.219 166 G C 1.243 176.127 174.900 -0.027 0.000 1.125 166 G CA 0.823 45.932 45.100 0.015 0.000 0.775 166 G HN 0.927 9.217 8.290 -0.000 0.000 0.548 167 E N 0.070 120.257 120.200 -0.022 0.000 2.118 167 E HA -0.152 4.197 4.350 -0.002 0.000 0.195 167 E C 1.696 178.172 176.600 -0.208 0.000 0.992 167 E CA 1.117 57.462 56.400 -0.091 0.000 0.804 167 E CB -0.412 29.238 29.700 -0.084 0.000 0.741 167 E HN 0.439 8.799 8.360 -0.000 0.000 0.458 168 F N -0.172 119.574 119.950 -0.341 0.000 2.569 168 F HA 0.271 4.798 4.527 -0.001 0.000 0.295 168 F C 0.748 176.177 175.800 -0.618 0.000 1.115 168 F CA 0.433 58.142 58.000 -0.485 0.000 1.450 168 F CB 0.626 39.216 39.000 -0.683 0.000 1.107 168 F HN -0.178 8.123 8.300 -0.000 0.000 0.563 169 S N 1.037 116.469 115.700 -0.447 0.000 2.204 169 S HA 0.209 4.679 4.470 -0.002 0.000 0.147 169 S C -1.977 172.387 174.600 -0.393 0.000 1.711 169 S CA -0.768 56.865 58.200 -0.944 0.000 1.274 169 S CB 0.801 63.647 63.200 -0.591 0.000 1.257 169 S HN -0.017 8.293 8.310 -0.000 0.000 0.404 170 P HA 0.140 4.560 4.420 -0.000 0.000 0.231 170 P C 0.116 177.583 177.300 0.279 0.000 1.168 170 P CA 0.184 63.317 63.100 0.054 0.000 0.779 170 P CB -0.377 31.328 31.700 0.008 0.000 0.844 171 F N 1.253 121.402 119.950 0.331 0.000 3.027 171 F HA -0.188 4.338 4.527 -0.002 0.000 0.276 171 F C 0.031 175.932 175.800 0.169 0.000 0.967 171 F CA 1.063 59.238 58.000 0.292 0.000 0.929 171 F CB -2.489 36.655 39.000 0.240 0.000 0.873 171 F HN 0.150 8.450 8.300 -0.000 0.000 0.787 172 D N -1.395 119.150 120.400 0.240 0.000 2.650 172 D HA 0.223 4.862 4.640 -0.002 0.000 0.265 172 D C 0.496 176.863 176.300 0.111 0.000 1.339 172 D CA 0.430 54.517 54.000 0.145 0.000 0.816 172 D CB -0.263 40.587 40.800 0.084 0.000 1.091 172 D HN 0.234 8.604 8.370 -0.000 0.000 0.483 173 S N -0.588 115.199 115.700 0.146 0.000 2.617 173 S HA 0.136 4.605 4.470 -0.002 0.000 0.259 173 S C 1.276 175.937 174.600 0.101 0.000 1.301 173 S CA -0.618 57.651 58.200 0.114 0.000 0.984 173 S CB 2.209 65.479 63.200 0.117 0.000 0.954 173 S HN 0.141 8.451 8.310 -0.000 0.000 0.572 174 K N -0.198 120.254 120.400 0.086 0.000 2.063 174 K HA -0.207 4.112 4.320 -0.002 0.000 0.208 174 K C 2.018 178.662 176.600 0.073 0.000 1.048 174 K CA 1.553 57.882 56.287 0.070 0.000 0.928 174 K CB -0.562 31.997 32.500 0.098 0.000 0.713 174 K HN 0.751 9.001 8.250 -0.000 0.000 0.442 175 Y N 2.210 122.547 120.300 0.062 0.000 2.114 175 Y HA -0.308 4.241 4.550 -0.002 0.000 0.282 175 Y C 1.686 177.612 175.900 0.043 0.000 1.165 175 Y CA 2.230 60.395 58.100 0.108 0.000 1.148 175 Y CB -0.284 38.247 38.460 0.118 0.000 0.972 175 Y HN 0.219 8.499 8.280 -0.000 0.000 0.504 176 D N 0.028 120.440 120.400 0.020 0.000 2.117 176 D HA -0.176 4.463 4.640 -0.002 0.000 0.197 176 D C 2.176 178.396 176.300 -0.134 0.000 0.987 176 D CA 1.599 55.571 54.000 -0.047 0.000 0.829 176 D CB -0.262 40.657 40.800 0.197 0.000 0.961 176 D HN 0.515 8.885 8.370 -0.000 0.000 0.460 177 R N 0.616 121.060 120.500 -0.095 0.000 2.081 177 R HA -0.060 4.279 4.340 -0.002 0.000 0.235 177 R C 2.529 178.708 176.300 -0.203 0.000 1.131 177 R CA 0.626 56.660 56.100 -0.111 0.000 0.960 177 R CB -0.464 29.797 30.300 -0.067 0.000 0.856 177 R HN 0.070 8.340 8.270 -0.000 0.000 0.436 178 V N 1.188 120.906 119.914 -0.327 0.000 2.358 178 V HA -0.226 3.893 4.120 -0.002 0.000 0.246 178 V C 2.352 178.193 176.094 -0.422 0.000 1.047 178 V CA 1.483 63.496 62.300 -0.479 0.000 1.035 178 V CB -0.313 30.935 31.823 -0.957 0.000 0.658 178 V HN 0.268 8.458 8.190 -0.000 0.000 0.452 179 M N -0.308 119.008 119.600 -0.474 0.000 2.279 179 M HA -0.109 4.370 4.480 -0.002 0.000 0.264 179 M C 2.058 178.238 176.300 -0.201 0.000 1.062 179 M CA 1.526 56.615 55.300 -0.351 0.000 1.099 179 M CB -1.183 31.163 32.600 -0.423 0.000 1.394 179 M HN 0.314 8.604 8.290 -0.000 0.000 0.426 180 R N -0.397 120.000 120.500 -0.172 0.000 2.313 180 R HA 0.208 4.547 4.340 -0.002 0.000 0.199 180 R C 1.169 177.411 176.300 -0.097 0.000 0.958 180 R CA 0.523 56.559 56.100 -0.106 0.000 1.047 180 R CB -0.161 30.093 30.300 -0.076 0.000 0.955 180 R HN 0.546 8.816 8.270 -0.000 0.000 0.481 181 G N 1.450 110.175 108.800 -0.125 0.000 2.143 181 G HA2 -0.320 3.639 3.960 -0.002 0.000 0.248 181 G HA3 -0.320 3.639 3.960 -0.002 0.000 0.248 181 G C 0.498 175.345 174.900 -0.089 0.000 0.991 181 G CA 0.509 45.547 45.100 -0.103 0.000 0.689 181 G HN 0.456 8.746 8.290 -0.000 0.000 0.522 182 E N 0.083 120.225 120.200 -0.097 0.000 2.299 182 E HA 0.195 4.544 4.350 -0.002 0.000 0.193 182 E C 1.246 177.800 176.600 -0.077 0.000 0.998 182 E CA 1.224 57.580 56.400 -0.073 0.000 0.851 182 E CB 0.129 29.792 29.700 -0.061 0.000 0.795 182 E HN 0.909 9.269 8.360 -0.000 0.000 0.492 183 E N -0.823 119.310 120.200 -0.112 0.000 2.435 183 E HA 0.440 4.789 4.350 -0.002 0.000 0.272 183 E C -0.993 175.507 176.600 -0.166 0.000 1.031 183 E CA -1.018 55.317 56.400 -0.109 0.000 0.872 183 E CB 1.316 30.967 29.700 -0.081 0.000 1.588 183 E HN -0.240 8.120 8.360 -0.000 0.000 0.460 184 K N 0.453 120.777 120.400 -0.128 0.000 2.385 184 K HA 0.430 4.749 4.320 -0.002 0.000 0.248 184 K C -0.900 175.657 176.600 -0.070 0.000 0.955 184 K CA -0.792 55.411 56.287 -0.140 0.000 0.816 184 K CB 1.774 34.251 32.500 -0.037 0.000 1.250 184 K HN 0.336 8.586 8.250 -0.000 0.000 0.434 185 F N 1.365 121.331 119.950 0.027 0.000 2.496 185 F HA -0.032 4.494 4.527 -0.002 0.000 0.344 185 F C 1.831 177.664 175.800 0.055 0.000 1.155 185 F CA -0.175 57.856 58.000 0.053 0.000 1.302 185 F CB 0.655 39.706 39.000 0.086 0.000 1.159 185 F HN 0.543 8.843 8.300 -0.000 0.000 0.595 186 T N 0.216 114.940 114.554 0.282 0.000 2.795 186 T HA 0.059 4.409 4.350 -0.002 0.000 0.314 186 T C -1.873 172.927 174.700 0.167 0.000 1.069 186 T CA -1.339 60.864 62.100 0.171 0.000 1.071 186 T CB 0.891 69.832 68.868 0.122 0.000 0.988 186 T HN 0.294 8.534 8.240 -0.000 0.000 0.543 187 P HA -0.038 4.382 4.420 -0.000 0.000 0.218 187 P C 1.593 178.973 177.300 0.134 0.000 1.148 187 P CA 0.330 63.495 63.100 0.109 0.000 0.822 187 P CB -0.043 31.693 31.700 0.061 0.000 0.784 188 L N -0.012 121.284 121.223 0.122 0.000 2.044 188 L HA -0.108 4.231 4.340 -0.002 0.000 0.205 188 L C 2.078 179.006 176.870 0.096 0.000 1.075 188 L CA 1.903 56.828 54.840 0.142 0.000 0.747 188 L CB -1.186 40.931 42.059 0.096 0.000 0.903 188 L HN -0.098 8.132 8.230 -0.000 0.000 0.435 189 E N -0.566 119.661 120.200 0.045 0.000 2.058 189 E HA -0.306 4.043 4.350 -0.002 0.000 0.194 189 E C 2.061 178.507 176.600 -0.257 0.000 0.997 189 E CA 1.527 57.872 56.400 -0.092 0.000 0.801 189 E CB -0.116 29.551 29.700 -0.054 0.000 0.746 189 E HN 0.588 8.948 8.360 -0.000 0.000 0.450 190 E N 0.035 120.195 120.200 -0.067 0.000 2.110 190 E HA -0.216 4.133 4.350 -0.002 0.000 0.193 190 E C 1.765 178.445 176.600 0.133 0.000 0.988 190 E CA 0.955 57.390 56.400 0.058 0.000 0.804 190 E CB -0.121 29.732 29.700 0.254 0.000 0.745 190 E HN 0.191 8.551 8.360 -0.000 0.000 0.458 191 F N 0.733 120.661 119.950 -0.036 0.000 2.146 191 F HA 0.062 4.588 4.527 -0.002 0.000 0.298 191 F C 1.981 177.717 175.800 -0.107 0.000 1.096 191 F CA 1.762 59.733 58.000 -0.048 0.000 1.275 191 F CB -0.957 38.022 39.000 -0.035 0.000 1.008 191 F HN 0.073 8.373 8.300 -0.000 0.000 0.480 192 G N -0.965 107.737 108.800 -0.162 0.000 2.440 192 G HA2 -0.368 3.591 3.960 -0.002 0.000 0.218 192 G HA3 -0.368 3.591 3.960 -0.002 0.000 0.218 192 G C 1.663 176.324 174.900 -0.399 0.000 1.154 192 G CA 1.020 45.951 45.100 -0.281 0.000 0.767 192 G HN 0.482 8.772 8.290 -0.000 0.000 0.552 193 Y N 2.131 122.010 120.300 -0.701 0.000 2.224 193 Y HA -0.118 4.431 4.550 -0.002 0.000 0.289 193 Y C 2.990 178.646 175.900 -0.407 0.000 1.146 193 Y CA 1.927 59.408 58.100 -1.031 0.000 1.182 193 Y CB -0.545 37.458 38.460 -0.762 0.000 0.983 193 Y HN 0.196 8.476 8.280 -0.000 0.000 0.524 194 T N -0.440 113.959 114.554 -0.258 0.000 2.777 194 T HA -0.147 4.202 4.350 -0.002 0.000 0.266 194 T C 2.148 176.761 174.700 -0.145 0.000 1.040 194 T CA 1.597 63.593 62.100 -0.174 0.000 1.141 194 T CB -0.750 68.159 68.868 0.069 0.000 0.868 194 T HN 0.183 8.423 8.240 -0.000 0.000 0.444 195 V N 1.132 120.910 119.914 -0.226 0.000 2.261 195 V HA -0.136 3.983 4.120 -0.002 0.000 0.246 195 V C 2.008 177.995 176.094 -0.178 0.000 1.047 195 V CA 1.673 63.786 62.300 -0.312 0.000 1.015 195 V CB -0.748 30.639 31.823 -0.726 0.000 0.642 195 V HN 0.418 8.608 8.190 -0.000 0.000 0.446 196 F N 1.342 121.067 119.950 -0.374 0.000 2.120 196 F HA -0.217 4.309 4.527 -0.001 0.000 0.300 196 F C 2.013 177.715 175.800 -0.162 0.000 1.095 196 F CA 2.276 60.118 58.000 -0.262 0.000 1.249 196 F CB -0.150 38.623 39.000 -0.379 0.000 0.995 196 F HN 0.282 8.582 8.300 -0.000 0.000 0.480 197 I N -2.450 118.038 120.570 -0.137 0.000 3.578 197 I HA 0.071 4.240 4.170 -0.002 0.000 0.295 197 I C 1.463 177.517 176.117 -0.106 0.000 1.280 197 I CA 1.150 62.356 61.300 -0.155 0.000 1.347 197 I CB -0.731 37.118 38.000 -0.251 0.000 1.051 197 I HN 0.172 8.382 8.210 -0.000 0.000 0.460 198 T N -4.137 110.407 114.554 -0.016 0.000 2.969 198 T HA 0.170 4.519 4.350 -0.002 0.000 0.250 198 T C 0.345 175.069 174.700 0.040 0.000 1.021 198 T CA -0.303 61.818 62.100 0.035 0.000 1.003 198 T CB -0.175 68.753 68.868 0.100 0.000 1.040 198 T HN 0.351 8.591 8.240 -0.000 0.000 0.492 199 W N 3.368 124.552 121.300 -0.194 0.000 2.169 199 W HA 0.450 5.110 4.660 -0.001 0.000 0.447 199 W C 1.629 178.005 176.519 -0.237 0.000 1.829 199 W CA -0.818 56.414 57.345 -0.188 0.000 2.025 199 W CB 0.314 29.662 29.460 -0.185 0.000 1.542 199 W HN 0.084 8.264 8.180 -0.000 0.000 0.727 200 N N -0.321 118.378 118.700 -0.001 0.000 2.459 200 N HA -0.131 4.608 4.740 -0.002 0.000 0.181 200 N C 1.132 176.507 175.510 -0.225 0.000 1.046 200 N CA 1.315 54.292 53.050 -0.122 0.000 0.904 200 N CB -1.316 37.110 38.487 -0.102 0.000 0.964 200 N HN 0.328 8.708 8.380 -0.000 0.000 0.444 201 C N 1.302 120.412 119.300 -0.316 0.000 2.403 201 C HA -0.079 4.380 4.460 -0.002 0.000 0.279 201 C C 2.629 177.283 174.990 -0.559 0.000 1.269 201 C CA 0.931 59.654 59.018 -0.492 0.000 1.774 201 C CB -1.202 26.026 27.740 -0.852 0.000 1.993 201 C HN 0.634 8.864 8.230 -0.000 0.000 0.496 202 R N 1.573 121.741 120.500 -0.553 0.000 2.237 202 R HA -0.010 4.329 4.340 -0.002 0.000 0.219 202 R C 1.647 177.829 176.300 -0.197 0.000 1.080 202 R CA 1.300 57.182 56.100 -0.363 0.000 0.995 202 R CB -0.575 29.580 30.300 -0.241 0.000 0.875 202 R HN 0.477 8.747 8.270 -0.000 0.000 0.462 203 L N -0.087 121.015 121.223 -0.203 0.000 2.376 203 L HA -0.041 4.298 4.340 -0.002 0.000 0.219 203 L C 1.625 178.386 176.870 -0.182 0.000 1.133 203 L CA 0.544 55.287 54.840 -0.162 0.000 0.816 203 L CB -0.004 41.962 42.059 -0.154 0.000 0.933 203 L HN 0.309 8.539 8.230 -0.000 0.000 0.449 204 C N -3.005 116.147 119.300 -0.247 0.000 3.276 204 C HA 0.154 4.613 4.460 -0.002 0.000 0.512 204 C C 1.709 176.513 174.990 -0.309 0.000 1.376 204 C CA -0.394 58.433 59.018 -0.319 0.000 2.319 204 C CB -0.105 27.323 27.740 -0.521 0.000 3.330 204 C HN 0.389 8.619 8.230 -0.000 0.000 0.596 205 H N 0.461 119.502 119.070 -0.048 0.000 2.605 205 H HA 0.386 4.942 4.556 -0.001 0.000 0.308 205 H C 0.038 175.512 175.328 0.243 0.000 1.080 205 H CA 0.628 56.759 56.048 0.139 0.000 1.119 205 H CB 0.009 29.975 29.762 0.341 0.000 1.479 205 H HN 0.371 8.651 8.280 -0.000 0.000 0.537 206 M N 0.125 119.795 119.600 0.116 0.000 2.457 206 M HA 0.140 4.619 4.480 -0.002 0.000 0.300 206 M C 1.461 177.700 176.300 -0.103 0.000 1.141 206 M CA -0.479 54.844 55.300 0.038 0.000 0.901 206 M CB 2.920 35.562 32.600 0.070 0.000 1.687 206 M HN 0.100 8.390 8.290 -0.000 0.000 0.449 207 Q N 1.986 121.689 119.800 -0.162 0.000 2.062 207 Q HA -0.114 4.225 4.340 -0.002 0.000 0.209 207 Q C -0.064 175.891 176.000 -0.074 0.000 0.996 207 Q CA 1.896 57.590 55.803 -0.182 0.000 0.859 207 Q CB 0.456 29.150 28.738 -0.074 0.000 0.920 207 Q HN 0.534 8.804 8.270 -0.000 0.000 0.415 208 R N -0.665 119.819 120.500 -0.026 0.000 2.787 208 R HA 0.262 4.601 4.340 -0.002 0.000 0.271 208 R C 0.864 177.164 176.300 -0.001 0.000 0.993 208 R CA -0.764 55.340 56.100 0.006 0.000 0.993 208 R CB 0.791 31.104 30.300 0.022 0.000 1.155 208 R HN -0.064 8.206 8.270 -0.000 0.000 0.486 209 K N 1.043 121.447 120.400 0.006 0.000 2.167 209 K HA -0.067 4.252 4.320 -0.002 0.000 0.203 209 K C 0.553 177.153 176.600 -0.000 0.000 1.052 209 K CA 1.234 57.520 56.287 -0.002 0.000 0.956 209 K CB 0.199 32.700 32.500 0.003 0.000 0.735 209 K HN 0.677 8.927 8.250 -0.000 0.000 0.451 210 Q N -2.004 117.802 119.800 0.009 0.000 2.687 210 Q HA 0.467 4.806 4.340 -0.002 0.000 0.295 210 Q C -0.289 175.723 176.000 0.020 0.000 0.920 210 Q CA -0.530 55.280 55.803 0.012 0.000 0.766 210 Q CB 1.548 30.290 28.738 0.007 0.000 1.467 210 Q HN 0.078 8.348 8.270 -0.000 0.000 0.415 211 G N -0.536 108.278 108.800 0.024 0.000 2.660 211 G HA2 -0.048 3.911 3.960 -0.002 0.000 0.215 211 G HA3 -0.048 3.911 3.960 -0.002 0.000 0.215 211 G C -1.213 173.711 174.900 0.039 0.000 1.345 211 G CA -0.412 44.705 45.100 0.028 0.000 0.877 211 G HN 1.040 9.330 8.290 -0.000 0.000 0.549 212 V N 0.567 120.505 119.914 0.039 0.000 2.540 212 V HA 0.750 4.869 4.120 -0.002 0.000 0.302 212 V C 0.896 177.013 176.094 0.038 0.000 1.035 212 V CA -0.070 62.260 62.300 0.050 0.000 0.873 212 V CB 1.238 33.091 31.823 0.051 0.000 0.992 212 V HN 2.097 10.287 8.190 -0.000 0.000 0.428 213 A N 2.524 125.367 122.820 0.039 0.000 2.388 213 A HA 0.372 4.692 4.320 -0.002 0.000 0.257 213 A C 1.111 178.705 177.584 0.016 0.000 1.095 213 A CA -0.119 51.935 52.037 0.028 0.000 0.791 213 A CB 0.362 19.371 19.000 0.016 0.000 1.029 213 A HN 0.987 9.137 8.150 -0.000 0.000 0.489 214 E N 1.252 121.453 120.200 0.001 0.000 2.051 214 E HA -0.112 4.237 4.350 -0.002 0.000 0.192 214 E C 0.133 176.675 176.600 -0.096 0.000 0.991 214 E CA 0.953 57.330 56.400 -0.039 0.000 0.799 214 E CB 0.070 29.744 29.700 -0.042 0.000 0.748 214 E HN 0.641 9.001 8.360 -0.000 0.000 0.449 215 R N 1.442 121.899 120.500 -0.071 0.000 2.585 215 R HA 0.153 4.492 4.340 -0.002 0.000 0.278 215 R C -1.161 175.224 176.300 0.142 0.000 1.663 215 R CA -0.343 55.667 56.100 -0.149 0.000 1.592 215 R CB 1.116 31.273 30.300 -0.238 0.000 1.200 215 R HN -0.044 8.226 8.270 -0.000 0.000 0.611 216 E N 1.548 121.815 120.200 0.112 0.000 2.417 216 E HA -0.026 4.324 4.350 -0.002 0.000 0.261 216 E C 0.605 177.187 176.600 -0.031 0.000 1.000 216 E CA 0.556 56.917 56.400 -0.064 0.000 0.919 216 E CB 0.824 30.364 29.700 -0.267 0.000 0.955 216 E HN 0.492 8.852 8.360 -0.000 0.000 0.455 217 T N 1.953 116.453 114.554 -0.090 0.000 3.145 217 T HA 0.199 4.548 4.350 -0.002 0.000 0.281 217 T C 0.136 174.865 174.700 0.048 0.000 1.003 217 T CA -0.293 61.803 62.100 -0.007 0.000 0.901 217 T CB -0.687 68.275 68.868 0.155 0.000 1.112 217 T HN 0.511 8.751 8.240 -0.000 0.000 0.535 218 F N 0.717 120.671 119.950 0.006 0.000 3.071 218 F HA -0.153 4.373 4.527 -0.001 0.000 0.295 218 F C 0.477 176.351 175.800 0.124 0.000 0.919 218 F CA 0.797 58.847 58.000 0.083 0.000 1.050 218 F CB -2.366 36.628 39.000 -0.010 0.000 1.040 218 F HN 0.556 8.856 8.300 -0.000 0.000 0.692 219 T N -0.604 113.934 114.554 -0.027 0.000 2.942 219 T HA 0.466 4.815 4.350 -0.002 0.000 0.327 219 T C 0.338 174.669 174.700 -0.616 0.000 1.360 219 T CA -0.166 61.822 62.100 -0.187 0.000 1.055 219 T CB 1.025 69.821 68.868 -0.119 0.000 1.261 219 T HN 0.167 8.407 8.240 -0.000 0.000 0.485 220 N N 2.640 121.070 118.700 -0.449 0.000 2.336 220 N HA 0.148 4.887 4.740 -0.002 0.000 0.189 220 N C 0.713 176.032 175.510 -0.318 0.000 1.113 220 N CA -0.085 52.706 53.050 -0.430 0.000 0.858 220 N CB -0.960 37.440 38.487 -0.145 0.000 0.970 220 N HN 0.828 9.208 8.380 -0.000 0.000 0.471 221 F N -1.393 118.569 119.950 0.020 0.000 2.871 221 F HA -0.283 4.243 4.527 -0.002 0.000 0.326 221 F C 0.385 176.142 175.800 -0.073 0.000 0.675 221 F CA 0.601 58.595 58.000 -0.010 0.000 1.188 221 F CB -1.994 37.032 39.000 0.043 0.000 1.567 221 F HN 0.063 8.363 8.300 -0.000 0.000 0.325 222 E N -0.775 119.451 120.200 0.043 0.000 2.385 222 E HA 0.419 4.768 4.350 -0.002 0.000 0.254 222 E C -0.805 175.666 176.600 -0.216 0.000 1.228 222 E CA -0.593 55.821 56.400 0.023 0.000 0.956 222 E CB 0.605 30.352 29.700 0.078 0.000 1.116 222 E HN 0.179 8.539 8.360 -0.000 0.000 0.507 223 Y N 0.175 120.457 120.300 -0.030 0.000 2.341 223 Y HA 0.322 4.870 4.550 -0.002 0.000 0.338 223 Y C -0.154 175.605 175.900 -0.235 0.000 0.965 223 Y CA -0.461 57.642 58.100 0.006 0.000 1.108 223 Y CB 1.264 39.749 38.460 0.043 0.000 1.180 223 Y HN 0.330 8.610 8.280 -0.000 0.000 0.458 224 H N 1.740 120.952 119.070 0.236 0.000 2.894 224 H HA 0.192 4.747 4.556 -0.002 0.000 0.367 224 H C -1.281 174.204 175.328 0.262 0.000 1.144 224 H CA -0.942 55.227 56.048 0.200 0.000 1.180 224 H CB 2.352 32.196 29.762 0.137 0.000 1.758 224 H HN 0.482 8.762 8.280 -0.000 0.000 0.541 225 N N 3.024 121.922 118.700 0.330 0.000 2.420 225 N HA 0.091 4.830 4.740 -0.002 0.000 0.249 225 N C 0.789 176.469 175.510 0.282 0.000 1.033 225 N CA -0.362 52.879 53.050 0.318 0.000 0.944 225 N CB 0.240 38.866 38.487 0.231 0.000 1.113 225 N HN 0.659 9.039 8.380 -0.000 0.000 0.502 226 I N 0.246 121.003 120.570 0.312 0.000 3.875 226 I HA 0.428 4.597 4.170 -0.002 0.000 0.329 226 I C 0.939 177.318 176.117 0.436 0.000 1.295 226 I CA -0.269 61.213 61.300 0.303 0.000 1.129 226 I CB -0.159 38.060 38.000 0.365 0.000 1.008 226 I HN 0.503 8.713 8.210 -0.000 0.000 0.413 227 G N 2.199 111.218 108.800 0.364 0.000 2.171 227 G HA2 -0.211 3.748 3.960 -0.002 0.000 0.238 227 G HA3 -0.211 3.748 3.960 -0.002 0.000 0.238 227 G C -0.091 175.046 174.900 0.395 0.000 1.039 227 G CA -0.135 45.197 45.100 0.387 0.000 0.759 227 G HN 0.393 8.683 8.290 -0.000 0.000 0.501 228 L N 1.475 122.815 121.223 0.195 0.000 2.461 228 L HA 0.369 4.708 4.340 -0.002 0.000 0.272 228 L C -0.854 176.014 176.870 -0.004 0.000 1.197 228 L CA -1.659 53.138 54.840 -0.071 0.000 0.836 228 L CB 0.554 42.409 42.059 -0.339 0.000 1.105 228 L HN 0.093 8.323 8.230 -0.000 0.000 0.477 229 P HA 0.114 4.534 4.420 -0.000 0.000 0.276 229 P C -0.596 176.649 177.300 -0.091 0.000 1.261 229 P CA -0.457 62.644 63.100 0.002 0.000 0.800 229 P CB 0.859 32.598 31.700 0.065 0.000 1.066 230 V N 1.865 121.752 119.914 -0.045 0.000 2.763 230 V HA -0.042 4.077 4.120 -0.002 0.000 0.306 230 V C 1.213 177.241 176.094 -0.111 0.000 1.059 230 V CA 0.309 62.570 62.300 -0.066 0.000 1.138 230 V CB -0.658 31.151 31.823 -0.023 0.000 0.940 230 V HN 0.618 8.808 8.190 -0.000 0.000 0.489 231 N N 3.943 122.550 118.700 -0.154 0.000 2.469 231 N HA 0.093 4.832 4.740 -0.002 0.000 0.239 231 N C 0.939 176.395 175.510 -0.091 0.000 1.053 231 N CA -0.216 52.742 53.050 -0.153 0.000 0.937 231 N CB 1.017 39.377 38.487 -0.212 0.000 1.163 231 N HN 0.585 8.965 8.380 -0.000 0.000 0.509 232 E N 1.457 121.619 120.200 -0.063 0.000 2.106 232 E HA -0.131 4.218 4.350 -0.002 0.000 0.192 232 E C 1.439 178.009 176.600 -0.050 0.000 0.984 232 E CA 1.541 57.914 56.400 -0.044 0.000 0.806 232 E CB -0.318 29.364 29.700 -0.030 0.000 0.750 232 E HN 0.814 9.174 8.360 -0.000 0.000 0.458 233 T N -1.044 113.477 114.554 -0.055 0.000 2.904 233 T HA 0.106 4.455 4.350 -0.002 0.000 0.267 233 T C 2.095 176.751 174.700 -0.074 0.000 1.059 233 T CA 1.090 63.154 62.100 -0.061 0.000 1.137 233 T CB -0.077 68.760 68.868 -0.053 0.000 0.879 233 T HN 0.111 8.351 8.240 -0.000 0.000 0.467 234 A N 2.196 124.973 122.820 -0.072 0.000 1.898 234 A HA 0.042 4.361 4.320 -0.002 0.000 0.216 234 A C 2.462 180.010 177.584 -0.060 0.000 1.181 234 A CA 1.783 53.781 52.037 -0.066 0.000 0.620 234 A CB -0.708 18.246 19.000 -0.077 0.000 0.819 234 A HN 0.478 8.628 8.150 -0.000 0.000 0.442 235 R N 0.461 120.929 120.500 -0.053 0.000 2.092 235 R HA -0.116 4.224 4.340 -0.002 0.000 0.231 235 R C 1.988 178.261 176.300 -0.045 0.000 1.119 235 R CA 2.067 58.148 56.100 -0.032 0.000 0.970 235 R CB -0.618 29.676 30.300 -0.010 0.000 0.864 235 R HN 0.680 8.950 8.270 -0.000 0.000 0.440 236 E N -0.392 119.774 120.200 -0.056 0.000 2.051 236 E HA -0.187 4.162 4.350 -0.002 0.000 0.192 236 E C 1.712 178.248 176.600 -0.106 0.000 0.991 236 E CA 1.305 57.665 56.400 -0.068 0.000 0.799 236 E CB -0.229 29.433 29.700 -0.064 0.000 0.748 236 E HN 0.451 8.811 8.360 -0.000 0.000 0.449 237 A N 0.881 123.610 122.820 -0.151 0.000 1.972 237 A HA -0.190 4.129 4.320 -0.002 0.000 0.219 237 A C 2.306 179.784 177.584 -0.177 0.000 1.169 237 A CA 2.015 53.885 52.037 -0.279 0.000 0.635 237 A CB -0.670 18.075 19.000 -0.425 0.000 0.810 237 A HN 0.453 8.603 8.150 -0.000 0.000 0.446 238 S N -1.692 113.961 115.700 -0.078 0.000 2.489 238 S HA 0.294 4.763 4.470 -0.002 0.000 0.228 238 S C 1.591 176.162 174.600 -0.049 0.000 0.995 238 S CA 1.187 59.371 58.200 -0.027 0.000 0.934 238 S CB -0.621 62.562 63.200 -0.027 0.000 0.771 238 S HN 1.950 10.260 8.310 -0.000 0.000 0.522 239 G N 1.249 110.010 108.800 -0.064 0.000 2.168 239 G HA2 -0.261 3.698 3.960 -0.002 0.000 0.257 239 G HA3 -0.261 3.698 3.960 -0.002 0.000 0.257 239 G C 0.534 175.388 174.900 -0.076 0.000 0.997 239 G CA 0.588 45.652 45.100 -0.060 0.000 0.708 239 G HN 0.556 8.846 8.290 -0.000 0.000 0.520 240 L N -0.010 121.147 121.223 -0.111 0.000 2.291 240 L HA 0.368 4.707 4.340 -0.002 0.000 0.214 240 L C 1.665 178.482 176.870 -0.088 0.000 1.120 240 L CA 1.018 55.741 54.840 -0.196 0.000 0.799 240 L CB -0.442 41.335 42.059 -0.469 0.000 0.925 240 L HN 1.225 9.455 8.230 -0.000 0.000 0.446 241 G N -1.927 106.859 108.800 -0.023 0.000 2.576 241 G HA2 0.042 4.002 3.960 -0.002 0.000 0.686 241 G HA3 0.042 4.002 3.960 -0.002 0.000 0.686 241 G C 0.296 175.225 174.900 0.048 0.000 1.242 241 G CA -0.435 44.675 45.100 0.016 0.000 0.819 241 G HN 0.028 8.318 8.290 -0.000 0.000 0.655 242 A N 0.142 122.981 122.820 0.031 0.000 2.070 242 A HA 0.101 4.420 4.320 -0.002 0.000 0.220 242 A C 1.957 179.566 177.584 0.042 0.000 1.159 242 A CA 2.465 54.520 52.037 0.030 0.000 0.656 242 A CB -0.301 18.708 19.000 0.015 0.000 0.800 242 A HN 1.255 9.405 8.150 -0.000 0.000 0.453 243 D N -1.890 118.543 120.400 0.054 0.000 2.350 243 D HA 0.020 4.659 4.640 -0.002 0.000 0.213 243 D C 0.638 176.981 176.300 0.072 0.000 1.031 243 D CA -0.119 53.911 54.000 0.050 0.000 0.861 243 D CB -0.843 39.983 40.800 0.045 0.000 0.926 243 D HN 0.507 8.877 8.370 -0.000 0.000 0.520 244 H N 0.323 119.392 119.070 -0.001 0.000 2.897 244 H HA 0.324 4.879 4.556 -0.001 0.000 0.347 244 H C -0.821 174.494 175.328 -0.023 0.000 1.068 244 H CA -0.013 56.034 56.048 -0.001 0.000 1.426 244 H CB 0.743 30.504 29.762 -0.001 0.000 1.410 244 H HN -0.232 8.048 8.280 -0.000 0.000 0.597 245 V N 5.411 124.915 119.914 -0.684 0.000 2.487 245 V HA 0.103 4.222 4.120 -0.002 0.000 0.298 245 V C -0.273 175.330 176.094 -0.819 0.000 1.028 245 V CA -0.962 60.979 62.300 -0.599 0.000 0.860 245 V CB 1.667 33.157 31.823 -0.555 0.000 0.991 245 V HN 0.841 9.031 8.190 -0.000 0.000 0.427 246 D N 2.829 122.985 120.400 -0.407 0.000 2.365 246 D HA 0.141 4.780 4.640 -0.002 0.000 0.237 246 D C 0.895 177.101 176.300 -0.156 0.000 1.190 246 D CA 0.005 53.925 54.000 -0.133 0.000 0.867 246 D CB 0.489 41.370 40.800 0.135 0.000 1.050 246 D HN 0.561 8.931 8.370 -0.000 0.000 0.491 247 H N 3.224 122.231 119.070 -0.105 0.000 2.547 247 H HA 0.136 4.691 4.556 -0.002 0.000 0.266 247 H C 1.572 176.715 175.328 -0.308 0.000 0.988 247 H CA 0.576 56.534 56.048 -0.149 0.000 1.147 247 H CB 0.338 30.020 29.762 -0.134 0.000 1.365 247 H HN 0.699 8.979 8.280 -0.000 0.000 0.589 248 G N 1.437 109.998 108.800 -0.398 0.000 2.596 248 G HA2 -0.385 3.574 3.960 -0.002 0.000 0.295 248 G HA3 -0.385 3.574 3.960 -0.002 0.000 0.295 248 G C 1.071 175.715 174.900 -0.427 0.000 1.240 248 G CA 0.410 44.933 45.100 -0.961 0.000 0.985 248 G HN 0.360 8.650 8.290 -0.000 0.000 0.555 249 L N -0.081 120.908 121.223 -0.390 0.000 2.129 249 L HA -0.007 4.332 4.340 -0.002 0.000 0.212 249 L C 2.673 179.368 176.870 -0.292 0.000 1.087 249 L CA 2.968 57.608 54.840 -0.335 0.000 0.757 249 L CB -0.734 41.078 42.059 -0.413 0.000 0.896 249 L HN 0.771 9.001 8.230 -0.000 0.000 0.434 250 L N -0.285 120.808 121.223 -0.217 0.000 2.191 250 L HA -0.074 4.265 4.340 -0.002 0.000 0.212 250 L C 2.374 179.137 176.870 -0.180 0.000 1.103 250 L CA 1.858 56.585 54.840 -0.188 0.000 0.769 250 L CB -1.035 40.934 42.059 -0.150 0.000 0.908 250 L HN 0.290 8.520 8.230 -0.000 0.000 0.438 251 A N -0.517 122.220 122.820 -0.140 0.000 2.121 251 A HA -0.125 4.194 4.320 -0.002 0.000 0.218 251 A C 1.586 179.089 177.584 -0.136 0.000 1.154 251 A CA 0.226 52.200 52.037 -0.105 0.000 0.679 251 A CB -0.650 18.324 19.000 -0.043 0.000 0.795 251 A HN 0.463 8.613 8.150 -0.000 0.000 0.458 252 R N 0.955 121.337 120.500 -0.197 0.000 2.484 252 R HA 0.112 4.451 4.340 -0.002 0.000 0.293 252 R C -2.731 173.444 176.300 -0.208 0.000 1.023 252 R CA -1.325 54.633 56.100 -0.237 0.000 1.037 252 R CB 0.047 30.112 30.300 -0.393 0.000 0.951 252 R HN 0.029 8.299 8.270 -0.000 0.000 0.418 253 P HA 0.004 4.424 4.420 -0.000 0.000 0.261 253 P C 0.229 177.446 177.300 -0.139 0.000 1.183 253 P CA 1.198 64.223 63.100 -0.125 0.000 0.761 253 P CB 0.836 32.481 31.700 -0.093 0.000 0.785 254 G N 3.217 111.949 108.800 -0.113 0.000 2.254 254 G HA2 -0.184 3.775 3.960 -0.002 0.000 0.225 254 G HA3 -0.184 3.775 3.960 -0.002 0.000 0.225 254 G C 0.096 174.933 174.900 -0.106 0.000 1.003 254 G CA -0.550 44.496 45.100 -0.091 0.000 0.622 254 G HN 0.453 8.743 8.290 -0.000 0.000 0.507 255 I N 1.915 122.377 120.570 -0.179 0.000 2.416 255 I HA 0.363 4.532 4.170 -0.002 0.000 0.288 255 I C 0.730 176.765 176.117 -0.135 0.000 1.051 255 I CA 0.057 61.236 61.300 -0.201 0.000 1.375 255 I CB 1.263 39.057 38.000 -0.344 0.000 1.407 255 I HN 0.135 8.345 8.210 -0.000 0.000 0.516 256 E N 2.431 122.583 120.200 -0.079 0.000 2.601 256 E HA 0.036 4.385 4.350 -0.002 0.000 0.219 256 E C -0.071 176.500 176.600 -0.049 0.000 0.964 256 E CA -0.073 56.287 56.400 -0.067 0.000 1.050 256 E CB 0.528 30.204 29.700 -0.041 0.000 1.068 256 E HN 0.539 8.899 8.360 -0.000 0.000 0.496 257 D N 3.057 123.442 120.400 -0.025 0.000 2.358 257 D HA 0.014 4.653 4.640 -0.002 0.000 0.258 257 D C -1.391 174.902 176.300 -0.012 0.000 1.223 257 D CA -1.879 52.126 54.000 0.008 0.000 0.886 257 D CB 1.353 42.197 40.800 0.073 0.000 1.120 257 D HN -0.119 8.251 8.370 -0.000 0.000 0.482 258 P HA -0.062 4.358 4.420 -0.000 0.000 0.226 258 P C 0.928 178.234 177.300 0.010 0.000 1.153 258 P CA 0.478 63.569 63.100 -0.015 0.000 0.777 258 P CB 0.122 31.817 31.700 -0.009 0.000 0.794 259 A N 0.111 122.945 122.820 0.023 0.000 2.125 259 A HA -0.164 4.155 4.320 -0.002 0.000 0.219 259 A C 2.089 179.697 177.584 0.039 0.000 1.156 259 A CA 1.234 53.293 52.037 0.037 0.000 0.671 259 A CB -0.792 18.233 19.000 0.042 0.000 0.794 259 A HN 0.101 8.251 8.150 -0.000 0.000 0.459 260 Q N -0.046 119.766 119.800 0.019 0.000 2.424 260 Q HA 0.083 4.422 4.340 -0.002 0.000 0.204 260 Q C 0.891 176.872 176.000 -0.032 0.000 0.933 260 Q CA 0.371 56.169 55.803 -0.009 0.000 0.929 260 Q CB -0.553 28.141 28.738 -0.072 0.000 1.037 260 Q HN 0.510 8.780 8.270 -0.000 0.000 0.511 261 S N 0.011 115.713 115.700 0.004 0.000 2.544 261 S HA 0.249 4.718 4.470 -0.002 0.000 0.290 261 S C 1.191 175.814 174.600 0.038 0.000 1.276 261 S CA 1.027 59.264 58.200 0.061 0.000 1.075 261 S CB -0.029 63.272 63.200 0.168 0.000 0.849 261 S HN 0.642 8.952 8.310 -0.000 0.000 0.494 262 G N 4.646 113.427 108.800 -0.033 0.000 2.176 262 G HA2 -0.224 3.735 3.960 -0.002 0.000 0.253 262 G HA3 -0.224 3.735 3.960 -0.002 0.000 0.253 262 G C 0.091 175.010 174.900 0.032 0.000 0.979 262 G CA 0.071 45.187 45.100 0.026 0.000 0.641 262 G HN 0.756 9.046 8.290 -0.000 0.000 0.530 263 R N -0.446 119.986 120.500 -0.112 0.000 2.308 263 R HA 0.637 4.976 4.340 -0.002 0.000 0.305 263 R C -0.627 175.590 176.300 -0.138 0.000 1.053 263 R CA -0.100 56.018 56.100 0.031 0.000 0.957 263 R CB 0.497 30.860 30.300 0.104 0.000 1.022 263 R HN 0.131 8.401 8.270 -0.000 0.000 0.461 264 F N 0.722 120.866 119.950 0.323 0.000 2.593 264 F HA 0.341 4.867 4.527 -0.001 0.000 0.320 264 F C 0.521 176.466 175.800 0.243 0.000 1.060 264 F CA -1.071 57.164 58.000 0.392 0.000 0.940 264 F CB 1.276 40.465 39.000 0.315 0.000 1.268 264 F HN 0.226 8.526 8.300 -0.000 0.000 0.475 265 K N 1.268 121.819 120.400 0.253 0.000 2.401 265 K HA 0.324 4.644 4.320 -0.002 0.000 0.278 265 K C -0.894 175.749 176.600 0.071 0.000 1.018 265 K CA -0.254 55.821 56.287 -0.355 0.000 0.981 265 K CB 0.616 32.997 32.500 -0.198 0.000 0.933 265 K HN 0.482 8.732 8.250 -0.000 0.000 0.477 266 V N 7.961 127.873 119.914 -0.003 0.000 2.485 266 V HA 0.089 4.208 4.120 -0.002 0.000 0.287 266 V C -1.718 174.454 176.094 0.130 0.000 1.022 266 V CA -1.146 61.218 62.300 0.107 0.000 1.067 266 V CB 0.399 32.200 31.823 -0.036 0.000 0.967 266 V HN 0.878 9.068 8.190 -0.000 0.000 0.479 267 P HA 0.137 4.557 4.420 -0.000 0.000 0.277 267 P C -0.234 177.202 177.300 0.226 0.000 1.240 267 P CA -0.271 62.918 63.100 0.148 0.000 0.798 267 P CB 0.984 32.799 31.700 0.193 0.000 0.979 268 S N 1.454 117.254 115.700 0.166 0.000 2.549 268 S HA 0.053 4.522 4.470 -0.002 0.000 0.283 268 S C 1.151 175.842 174.600 0.153 0.000 1.320 268 S CA -0.481 57.827 58.200 0.179 0.000 1.058 268 S CB -0.487 62.808 63.200 0.159 0.000 0.882 268 S HN 0.231 8.541 8.310 -0.000 0.000 0.498 269 L N 4.406 125.710 121.223 0.135 0.000 2.599 269 L HA 0.266 4.605 4.340 -0.002 0.000 0.230 269 L C 1.419 178.200 176.870 -0.148 0.000 1.141 269 L CA 0.786 55.598 54.840 -0.046 0.000 0.877 269 L CB -1.207 40.726 42.059 -0.210 0.000 1.009 269 L HN 0.638 8.868 8.230 -0.000 0.000 0.447 270 R N 0.998 121.440 120.500 -0.095 0.000 2.537 270 R HA 0.031 4.370 4.340 -0.002 0.000 0.280 270 R C 0.653 176.921 176.300 -0.053 0.000 1.058 270 R CA -0.116 55.868 56.100 -0.193 0.000 1.057 270 R CB 0.144 30.178 30.300 -0.443 0.000 0.973 270 R HN 0.191 8.461 8.270 -0.000 0.000 0.438 271 N N 0.027 118.697 118.700 -0.050 0.000 2.815 271 N HA -0.212 4.527 4.740 -0.002 0.000 0.247 271 N C 0.994 176.513 175.510 0.014 0.000 1.030 271 N CA 1.004 54.065 53.050 0.018 0.000 0.881 271 N CB -1.038 37.500 38.487 0.085 0.000 1.134 271 N HN 0.466 8.846 8.380 -0.000 0.000 0.582 272 V N 0.686 120.599 119.914 -0.002 0.000 2.380 272 V HA -0.243 3.876 4.120 -0.002 0.000 0.251 272 V C 2.322 178.512 176.094 0.161 0.000 1.063 272 V CA 2.780 65.141 62.300 0.100 0.000 1.055 272 V CB -0.539 31.285 31.823 0.002 0.000 0.657 272 V HN 0.530 8.720 8.190 -0.000 0.000 0.455 273 A N -0.290 122.545 122.820 0.025 0.000 2.070 273 A HA -0.078 4.241 4.320 -0.002 0.000 0.220 273 A C 2.041 179.681 177.584 0.094 0.000 1.159 273 A CA 2.010 54.075 52.037 0.048 0.000 0.656 273 A CB -0.513 18.467 19.000 -0.033 0.000 0.800 273 A HN 1.248 9.398 8.150 -0.000 0.000 0.453 274 V N -3.317 116.625 119.914 0.047 0.000 3.376 274 V HA 0.216 4.335 4.120 -0.002 0.000 0.313 274 V C 0.902 176.971 176.094 -0.043 0.000 1.393 274 V CA 1.030 63.325 62.300 -0.009 0.000 1.125 274 V CB -0.631 31.146 31.823 -0.077 0.000 1.037 274 V HN 0.528 8.718 8.190 -0.000 0.000 0.440 275 T N -2.364 112.196 114.554 0.010 0.000 3.296 275 T HA 0.478 4.827 4.350 -0.002 0.000 0.285 275 T C 0.896 175.452 174.700 -0.241 0.000 1.014 275 T CA 0.355 62.422 62.100 -0.054 0.000 0.920 275 T CB -0.049 68.836 68.868 0.029 0.000 1.143 275 T HN 0.680 8.920 8.240 -0.000 0.000 0.522 276 G N 3.110 111.648 108.800 -0.437 0.000 2.664 276 G HA2 0.479 4.438 3.960 -0.002 0.000 0.242 276 G HA3 0.479 4.438 3.960 -0.002 0.000 0.242 276 G C -2.041 172.589 174.900 -0.450 0.000 1.225 276 G CA -1.009 43.502 45.100 -0.981 0.000 0.849 276 G HN 0.314 8.604 8.290 -0.000 0.000 0.581 277 P HA 0.220 4.640 4.420 -0.000 0.000 0.277 277 P C -1.182 175.744 177.300 -0.624 0.000 1.276 277 P CA -0.179 62.625 63.100 -0.494 0.000 0.788 277 P CB 0.692 32.282 31.700 -0.182 0.000 1.114 278 Y N -1.473 118.842 120.300 0.026 0.000 2.549 278 Y HA 0.539 5.088 4.550 -0.002 0.000 0.339 278 Y C 0.873 176.691 175.900 -0.136 0.000 1.053 278 Y CA -0.647 57.479 58.100 0.045 0.000 1.105 278 Y CB 0.974 39.523 38.460 0.149 0.000 1.258 278 Y HN 0.241 8.521 8.280 -0.000 0.000 0.478 279 M N 0.360 119.998 119.600 0.063 0.000 7.319 279 M HA -0.236 4.244 4.480 -0.002 0.000 0.157 279 M C 1.070 176.895 176.300 -0.792 0.000 0.480 279 M CA 0.549 55.654 55.300 -0.326 0.000 1.311 279 M CB -0.930 31.318 32.600 -0.586 0.000 0.421 279 M HN 1.103 9.393 8.290 -0.000 0.000 0.192 280 H N 1.212 119.472 119.070 -1.351 0.000 2.489 280 H HA -0.072 4.483 4.556 -0.001 0.000 0.295 280 H C 0.870 175.557 175.328 -1.069 0.000 1.082 280 H CA 2.028 56.838 56.048 -2.062 0.000 1.295 280 H CB -0.192 28.413 29.762 -1.929 0.000 1.380 280 H HN 0.716 8.996 8.280 -0.000 0.000 0.548 281 N N -0.565 117.486 118.700 -1.082 0.000 2.200 281 N HA 0.130 4.870 4.740 -0.002 0.000 0.224 281 N C 1.189 176.429 175.510 -0.450 0.000 1.179 281 N CA 0.209 52.889 53.050 -0.617 0.000 0.877 281 N CB 0.290 38.429 38.487 -0.580 0.000 1.072 281 N HN 0.424 8.804 8.380 -0.000 0.000 0.519 282 G N 0.135 108.675 108.800 -0.434 0.000 2.225 282 G HA2 -0.307 3.652 3.960 -0.002 0.000 0.267 282 G HA3 -0.307 3.652 3.960 -0.002 0.000 0.267 282 G C 0.661 175.386 174.900 -0.291 0.000 1.024 282 G CA 0.552 45.481 45.100 -0.285 0.000 0.784 282 G HN 0.426 8.716 8.290 -0.000 0.000 0.507 283 V N -1.083 118.545 119.914 -0.476 0.000 2.667 283 V HA 0.356 4.475 4.120 -0.002 0.000 0.252 283 V C 0.806 176.697 176.094 -0.339 0.000 1.065 283 V CA 1.231 63.225 62.300 -0.510 0.000 1.083 283 V CB -0.301 31.037 31.823 -0.809 0.000 0.692 283 V HN 0.303 8.493 8.190 -0.000 0.000 0.468 284 F N 0.125 120.064 119.950 -0.018 0.000 2.427 284 F HA 0.471 4.997 4.527 -0.002 0.000 0.346 284 F C 1.354 177.237 175.800 0.139 0.000 1.120 284 F CA -0.804 57.254 58.000 0.095 0.000 1.033 284 F CB 1.076 40.165 39.000 0.148 0.000 1.126 284 F HN -0.256 8.044 8.300 -0.000 0.000 0.462 285 T N 0.382 115.118 114.554 0.304 0.000 2.812 285 T HA -0.058 4.291 4.350 -0.002 0.000 0.264 285 T C 0.088 174.966 174.700 0.296 0.000 1.042 285 T CA 1.149 63.363 62.100 0.191 0.000 1.140 285 T CB -0.175 68.764 68.868 0.117 0.000 0.870 285 T HN 0.367 8.607 8.240 -0.000 0.000 0.445 286 D N 0.443 121.031 120.400 0.314 0.000 2.163 286 D HA 0.314 4.953 4.640 -0.002 0.000 0.248 286 D C 0.824 177.243 176.300 0.198 0.000 1.035 286 D CA -0.584 53.572 54.000 0.260 0.000 0.872 286 D CB 1.631 42.506 40.800 0.125 0.000 1.183 286 D HN -0.096 8.274 8.370 -0.000 0.000 0.445 287 L N 2.775 124.028 121.223 0.051 0.000 2.046 287 L HA -0.100 4.239 4.340 -0.002 0.000 0.208 287 L C 2.144 178.904 176.870 -0.183 0.000 1.077 287 L CA 1.767 56.398 54.840 -0.347 0.000 0.747 287 L CB -0.260 41.623 42.059 -0.293 0.000 0.896 287 L HN 0.411 8.641 8.230 -0.000 0.000 0.432 288 R N -1.124 119.332 120.500 -0.074 0.000 2.119 288 R HA -0.212 4.127 4.340 -0.002 0.000 0.246 288 R C 2.027 178.311 176.300 -0.026 0.000 1.146 288 R CA 2.319 58.394 56.100 -0.043 0.000 0.962 288 R CB -0.509 29.782 30.300 -0.014 0.000 0.863 288 R HN 0.491 8.761 8.270 -0.000 0.000 0.442 289 T N 0.329 114.873 114.554 -0.016 0.000 2.746 289 T HA -0.109 4.240 4.350 -0.002 0.000 0.267 289 T C 1.814 176.383 174.700 -0.219 0.000 1.039 289 T CA 1.254 63.329 62.100 -0.040 0.000 1.142 289 T CB -0.321 68.537 68.868 -0.016 0.000 0.866 289 T HN 0.453 8.693 8.240 -0.000 0.000 0.444 290 A N 1.370 124.087 122.820 -0.172 0.000 1.892 290 A HA -0.120 4.199 4.320 -0.002 0.000 0.218 290 A C 2.285 179.884 177.584 0.025 0.000 1.188 290 A CA 1.579 53.565 52.037 -0.085 0.000 0.631 290 A CB -0.907 18.074 19.000 -0.032 0.000 0.822 290 A HN 0.544 8.694 8.150 -0.000 0.000 0.447 291 I N -0.638 119.957 120.570 0.040 0.000 2.179 291 I HA -0.251 3.919 4.170 -0.002 0.000 0.242 291 I C 2.328 178.531 176.117 0.144 0.000 1.088 291 I CA 1.150 62.541 61.300 0.150 0.000 1.357 291 I CB -0.367 37.647 38.000 0.022 0.000 1.051 291 I HN 0.266 8.476 8.210 -0.000 0.000 0.409 292 L N -0.250 121.006 121.223 0.055 0.000 2.187 292 L HA -0.241 4.099 4.340 -0.002 0.000 0.213 292 L C 2.510 179.346 176.870 -0.057 0.000 1.100 292 L CA 1.159 56.051 54.840 0.088 0.000 0.765 292 L CB -0.609 41.569 42.059 0.199 0.000 0.904 292 L HN 0.213 8.443 8.230 -0.000 0.000 0.437 293 F N 0.131 119.730 119.950 -0.586 0.000 2.120 293 F HA -0.319 4.207 4.527 -0.002 0.000 0.300 293 F C 2.215 177.585 175.800 -0.717 0.000 1.095 293 F CA 1.614 58.847 58.000 -1.278 0.000 1.249 293 F CB -0.492 37.758 39.000 -1.249 0.000 0.995 293 F HN -0.000 8.300 8.300 -0.000 0.000 0.480 294 Y N 0.210 120.370 120.300 -0.234 0.000 2.274 294 Y HA -0.231 4.318 4.550 -0.002 0.000 0.290 294 Y C 2.224 178.056 175.900 -0.113 0.000 1.145 294 Y CA 1.369 59.406 58.100 -0.104 0.000 1.203 294 Y CB -0.930 37.561 38.460 0.053 0.000 0.984 294 Y HN 0.071 8.351 8.280 -0.000 0.000 0.533 295 N N 0.692 119.390 118.700 -0.004 0.000 2.519 295 N HA -0.149 4.590 4.740 -0.002 0.000 0.186 295 N C 1.695 177.139 175.510 -0.110 0.000 1.062 295 N CA 1.044 54.100 53.050 0.010 0.000 0.910 295 N CB -0.310 38.210 38.487 0.055 0.000 0.958 295 N HN 0.545 8.925 8.380 -0.000 0.000 0.445 296 K N -0.382 119.786 120.400 -0.388 0.000 2.280 296 K HA -0.149 4.170 4.320 -0.002 0.000 0.202 296 K C 0.704 176.996 176.600 -0.513 0.000 1.047 296 K CA 1.133 57.123 56.287 -0.495 0.000 0.942 296 K CB -0.273 31.687 32.500 -0.900 0.000 0.739 296 K HN 0.263 8.514 8.250 -0.000 0.000 0.457 297 Y N 1.326 121.515 120.300 -0.185 0.000 2.462 297 Y HA 0.030 4.579 4.550 -0.001 0.000 0.261 297 Y C 2.085 177.960 175.900 -0.042 0.000 1.146 297 Y CA 0.889 58.925 58.100 -0.107 0.000 1.283 297 Y CB 0.937 39.341 38.460 -0.093 0.000 1.090 297 Y HN 0.401 8.681 8.280 -0.000 0.000 0.526 298 T N -5.837 108.763 114.554 0.078 0.000 3.105 298 T HA 0.129 4.478 4.350 -0.002 0.000 0.257 298 T C 0.770 175.502 174.700 0.052 0.000 0.949 298 T CA 0.081 62.228 62.100 0.078 0.000 0.959 298 T CB -0.374 68.559 68.868 0.109 0.000 1.205 298 T HN -0.020 8.220 8.240 -0.000 0.000 0.496 299 S N 0.545 116.271 115.700 0.043 0.000 2.580 299 S HA 0.427 4.896 4.470 -0.002 0.000 0.274 299 S C 0.812 175.428 174.600 0.027 0.000 1.329 299 S CA -0.614 57.612 58.200 0.043 0.000 1.036 299 S CB 1.069 64.298 63.200 0.049 0.000 0.919 299 S HN 0.425 8.735 8.310 -0.000 0.000 0.515 300 R N 1.237 121.754 120.500 0.027 0.000 2.308 300 R HA 0.217 4.556 4.340 -0.002 0.000 0.202 300 R C 0.390 176.701 176.300 0.018 0.000 0.898 300 R CA -0.067 56.044 56.100 0.019 0.000 1.046 300 R CB 0.188 30.498 30.300 0.018 0.000 1.026 300 R HN 0.562 8.832 8.270 -0.000 0.000 0.512 301 R N 1.224 121.737 120.500 0.022 0.000 2.698 301 R HA -0.021 4.318 4.340 -0.002 0.000 0.266 301 R C -1.753 174.555 176.300 0.013 0.000 1.026 301 R CA -1.010 55.101 56.100 0.018 0.000 1.102 301 R CB 0.042 30.355 30.300 0.022 0.000 0.978 301 R HN -0.077 8.193 8.270 -0.000 0.000 0.436 302 P HA -0.236 4.184 4.420 -0.000 0.000 0.216 302 P C 0.816 178.109 177.300 -0.013 0.000 1.150 302 P CA 1.292 64.389 63.100 -0.005 0.000 0.837 302 P CB 0.034 31.727 31.700 -0.012 0.000 0.786 303 E N 0.258 120.451 120.200 -0.011 0.000 2.204 303 E HA -0.165 4.184 4.350 -0.002 0.000 0.195 303 E C 1.703 178.302 176.600 -0.001 0.000 0.990 303 E CA 1.264 57.649 56.400 -0.025 0.000 0.821 303 E CB -0.880 28.811 29.700 -0.016 0.000 0.750 303 E HN 0.131 8.491 8.360 -0.000 0.000 0.477 304 A N 1.215 124.064 122.820 0.047 0.000 2.168 304 A HA -0.060 4.260 4.320 -0.002 0.000 0.215 304 A C 1.765 179.496 177.584 0.246 0.000 1.152 304 A CA 0.891 53.006 52.037 0.129 0.000 0.716 304 A CB -0.152 18.896 19.000 0.080 0.000 0.794 304 A HN 0.165 8.315 8.150 -0.000 0.000 0.465 305 K N -0.738 119.726 120.400 0.107 0.000 2.393 305 K HA 0.241 4.560 4.320 -0.002 0.000 0.193 305 K C -0.385 176.109 176.600 -0.176 0.000 1.026 305 K CA 0.120 56.476 56.287 0.114 0.000 1.064 305 K CB 0.519 33.038 32.500 0.031 0.000 0.833 305 K HN 0.265 8.515 8.250 -0.000 0.000 0.521 306 I N 1.664 122.001 120.570 -0.389 0.000 2.404 306 I HA 0.110 4.279 4.170 -0.002 0.000 0.293 306 I C -0.391 175.053 176.117 -1.123 0.000 0.992 306 I CA -1.211 59.731 61.300 -0.596 0.000 1.149 306 I CB 1.287 39.102 38.000 -0.307 0.000 1.315 306 I HN 0.025 8.235 8.210 -0.000 0.000 0.446 307 N N 9.343 127.241 118.700 -1.337 0.000 2.405 307 N HA 0.158 4.897 4.740 -0.002 0.000 0.260 307 N C -1.651 173.491 175.510 -0.613 0.000 1.152 307 N CA -1.613 50.595 53.050 -1.403 0.000 0.948 307 N CB 1.303 39.335 38.487 -0.757 0.000 1.111 307 N HN 0.314 8.694 8.380 -0.000 0.000 0.485 308 P HA -0.080 4.340 4.420 -0.000 0.000 0.226 308 P C 0.247 177.467 177.300 -0.133 0.000 1.153 308 P CA 1.081 64.051 63.100 -0.216 0.000 0.777 308 P CB 0.472 32.096 31.700 -0.128 0.000 0.794 309 E N -0.261 119.874 120.200 -0.108 0.000 2.285 309 E HA -0.061 4.288 4.350 -0.002 0.000 0.194 309 E C 1.723 178.297 176.600 -0.043 0.000 0.997 309 E CA 1.671 58.051 56.400 -0.033 0.000 0.845 309 E CB -0.246 29.479 29.700 0.042 0.000 0.782 309 E HN 0.420 8.780 8.360 -0.000 0.000 0.491 310 T N -4.335 110.168 114.554 -0.085 0.000 2.969 310 T HA 0.282 4.631 4.350 -0.002 0.000 0.250 310 T C 1.650 176.295 174.700 -0.092 0.000 1.021 310 T CA 0.373 62.430 62.100 -0.071 0.000 1.003 310 T CB 0.777 69.609 68.868 -0.060 0.000 1.040 310 T HN 0.203 8.443 8.240 -0.000 0.000 0.492 311 G N 1.569 110.287 108.800 -0.136 0.000 2.168 311 G HA2 0.018 3.977 3.960 -0.002 0.000 0.263 311 G HA3 0.018 3.977 3.960 -0.002 0.000 0.263 311 G C 0.242 175.061 174.900 -0.135 0.000 0.977 311 G CA 0.113 45.136 45.100 -0.129 0.000 0.659 311 G HN 1.265 9.555 8.290 -0.000 0.000 0.533 312 A N -0.351 122.376 122.820 -0.154 0.000 2.350 312 A HA 0.950 5.269 4.320 -0.002 0.000 0.318 312 A C -2.439 175.036 177.584 -0.182 0.000 1.132 312 A CA -1.575 50.388 52.037 -0.124 0.000 0.811 312 A CB 1.379 20.336 19.000 -0.072 0.000 1.313 312 A HN 0.076 8.226 8.150 -0.000 0.000 0.454 313 P HA 0.040 4.460 4.420 -0.000 0.000 0.270 313 P C -0.067 177.206 177.300 -0.045 0.000 1.223 313 P CA 0.015 63.047 63.100 -0.112 0.000 0.785 313 P CB 0.284 31.977 31.700 -0.012 0.000 0.923 314 W N 1.962 123.301 121.300 0.064 0.000 2.321 314 W HA 0.013 4.672 4.660 -0.001 0.000 0.306 314 W C 1.242 177.846 176.519 0.141 0.000 1.217 314 W CA 1.990 59.427 57.345 0.154 0.000 1.257 314 W CB -0.646 28.950 29.460 0.227 0.000 1.145 314 W HN 0.629 8.809 8.180 -0.000 0.000 0.509 315 G N -0.280 108.711 108.800 0.319 0.000 2.459 315 G HA2 -0.053 3.906 3.960 -0.002 0.000 0.685 315 G HA3 -0.053 3.906 3.960 -0.002 0.000 0.685 315 G C -1.416 173.594 174.900 0.183 0.000 1.303 315 G CA -1.060 44.158 45.100 0.196 0.000 0.907 315 G HN -0.054 8.236 8.290 -0.000 0.000 0.632 316 E N 0.969 121.242 120.200 0.121 0.000 2.344 316 E HA 0.525 4.874 4.350 -0.002 0.000 0.270 316 E C -1.785 174.885 176.600 0.117 0.000 1.021 316 E CA -1.102 55.361 56.400 0.106 0.000 0.887 316 E CB 0.539 30.283 29.700 0.073 0.000 0.997 316 E HN 0.354 8.714 8.360 -0.000 0.000 0.429 317 P HA -0.070 4.350 4.420 -0.000 0.000 0.264 317 P C 0.102 177.457 177.300 0.092 0.000 1.183 317 P CA 0.342 63.527 63.100 0.141 0.000 0.763 317 P CB 0.664 32.461 31.700 0.163 0.000 0.807 318 E N 2.206 122.452 120.200 0.075 0.000 2.130 318 E HA -0.129 4.220 4.350 -0.002 0.000 0.196 318 E C -0.263 176.351 176.600 0.022 0.000 0.998 318 E CA 1.052 57.474 56.400 0.038 0.000 0.806 318 E CB 0.174 29.898 29.700 0.042 0.000 0.738 318 E HN 0.187 8.547 8.360 -0.000 0.000 0.459 319 V N 0.799 120.751 119.914 0.064 0.000 2.376 319 V HA 0.408 4.527 4.120 -0.002 0.000 0.287 319 V C -0.013 176.137 176.094 0.095 0.000 1.015 319 V CA -0.029 62.305 62.300 0.057 0.000 0.834 319 V CB 1.358 33.212 31.823 0.052 0.000 1.001 319 V HN 0.221 8.411 8.190 -0.000 0.000 0.428 320 A N 5.839 128.707 122.820 0.080 0.000 2.577 320 A HA 0.455 4.774 4.320 -0.002 0.000 0.280 320 A C 0.710 178.346 177.584 0.088 0.000 1.331 320 A CA -0.266 51.827 52.037 0.093 0.000 0.935 320 A CB -0.132 18.915 19.000 0.077 0.000 1.082 320 A HN 0.813 8.963 8.150 -0.000 0.000 0.525 321 R N -1.596 118.956 120.500 0.087 0.000 2.855 321 R HA 0.440 4.779 4.340 -0.002 0.000 0.266 321 R C -0.705 175.647 176.300 0.087 0.000 1.034 321 R CA -0.509 55.638 56.100 0.079 0.000 0.944 321 R CB 0.374 30.714 30.300 0.066 0.000 1.219 321 R HN -0.001 8.269 8.270 -0.000 0.000 0.474 322 N N -0.617 118.129 118.700 0.076 0.000 2.708 322 N HA -0.179 4.560 4.740 -0.002 0.000 0.251 322 N C -0.648 174.921 175.510 0.099 0.000 1.123 322 N CA 0.812 53.910 53.050 0.080 0.000 0.739 322 N CB -1.393 37.140 38.487 0.077 0.000 1.113 322 N HN 0.470 8.850 8.380 -0.000 0.000 0.561 323 L N 0.916 122.198 121.223 0.098 0.000 2.485 323 L HA 0.047 4.386 4.340 -0.002 0.000 0.275 323 L C 1.011 177.919 176.870 0.064 0.000 1.207 323 L CA 0.719 55.616 54.840 0.095 0.000 0.855 323 L CB 0.561 42.674 42.059 0.089 0.000 1.114 323 L HN 0.026 8.256 8.230 -0.000 0.000 0.485 324 S N 3.939 119.677 115.700 0.063 0.000 4.183 324 S HA 0.170 4.639 4.470 -0.002 0.000 0.195 324 S C 1.517 176.079 174.600 -0.064 0.000 1.421 324 S CA -0.254 57.983 58.200 0.061 0.000 0.920 324 S CB -0.451 62.840 63.200 0.152 0.000 1.525 324 S HN 0.458 8.768 8.310 -0.000 0.000 0.447 325 L N 0.883 122.071 121.223 -0.059 0.000 2.141 325 L HA -0.109 4.230 4.340 -0.002 0.000 0.209 325 L C 2.729 179.557 176.870 -0.069 0.000 1.094 325 L CA 1.006 55.788 54.840 -0.097 0.000 0.763 325 L CB -0.680 41.363 42.059 -0.026 0.000 0.908 325 L HN 0.579 8.809 8.230 -0.000 0.000 0.437 326 A N 0.422 123.222 122.820 -0.034 0.000 1.917 326 A HA -0.247 4.072 4.320 -0.002 0.000 0.219 326 A C 2.117 179.668 177.584 -0.055 0.000 1.182 326 A CA 2.089 54.107 52.037 -0.031 0.000 0.633 326 A CB -0.329 18.664 19.000 -0.012 0.000 0.819 326 A HN 0.392 8.542 8.150 -0.000 0.000 0.448 327 E N -0.386 119.770 120.200 -0.073 0.000 2.140 327 E HA 0.108 4.457 4.350 -0.002 0.000 0.191 327 E C 1.914 178.447 176.600 -0.111 0.000 0.973 327 E CA 0.522 56.862 56.400 -0.101 0.000 0.829 327 E CB -0.219 29.397 29.700 -0.140 0.000 0.781 327 E HN 0.592 8.952 8.360 -0.000 0.000 0.466 328 L N 0.506 121.637 121.223 -0.153 0.000 2.109 328 L HA -0.089 4.250 4.340 -0.002 0.000 0.207 328 L C 0.887 177.712 176.870 -0.074 0.000 1.086 328 L CA 0.881 55.604 54.840 -0.195 0.000 0.760 328 L CB -0.156 41.518 42.059 -0.642 0.000 0.910 328 L HN 0.051 8.281 8.230 -0.000 0.000 0.437 329 Q N 0.135 119.899 119.800 -0.059 0.000 3.027 329 Q HA 0.040 4.379 4.340 -0.002 0.000 0.260 329 Q C 1.234 177.226 176.000 -0.014 0.000 1.379 329 Q CA -0.048 55.763 55.803 0.013 0.000 1.038 329 Q CB 0.440 29.191 28.738 0.023 0.000 1.578 329 Q HN 0.341 8.611 8.270 -0.000 0.000 0.571 330 S N -0.439 115.252 115.700 -0.016 0.000 2.496 330 S HA 0.059 4.528 4.470 -0.002 0.000 0.224 330 S C 1.528 176.070 174.600 -0.096 0.000 0.996 330 S CA 0.541 58.697 58.200 -0.073 0.000 0.927 330 S CB 0.157 63.311 63.200 -0.078 0.000 0.774 330 S HN 0.748 9.058 8.310 -0.000 0.000 0.524 331 G N 0.529 109.299 108.800 -0.049 0.000 2.176 331 G HA2 -0.201 3.758 3.960 -0.002 0.000 0.253 331 G HA3 -0.201 3.758 3.960 -0.002 0.000 0.253 331 G C -0.152 174.704 174.900 -0.073 0.000 0.979 331 G CA 0.366 45.431 45.100 -0.058 0.000 0.641 331 G HN 0.577 8.867 8.290 -0.000 0.000 0.530 332 L N 0.443 121.611 121.223 -0.092 0.000 2.409 332 L HA 0.645 4.984 4.340 -0.002 0.000 0.272 332 L C 0.250 177.216 176.870 0.159 0.000 0.980 332 L CA -0.791 53.992 54.840 -0.095 0.000 0.826 332 L CB 2.045 43.776 42.059 -0.546 0.000 1.268 332 L HN 0.245 8.475 8.230 -0.000 0.000 0.407 333 M N 3.958 123.696 119.600 0.230 0.000 2.233 333 M HA 0.424 4.903 4.480 -0.002 0.000 0.355 333 M C -0.989 175.523 176.300 0.353 0.000 1.191 333 M CA -0.600 54.853 55.300 0.256 0.000 1.101 333 M CB 1.135 33.822 32.600 0.144 0.000 1.592 333 M HN 0.518 8.808 8.290 -0.000 0.000 0.461 334 L N 5.998 127.335 121.223 0.190 0.000 2.385 334 L HA 0.128 4.467 4.340 -0.002 0.000 0.281 334 L C 0.589 177.446 176.870 -0.021 0.000 1.106 334 L CA -0.501 54.293 54.840 -0.076 0.000 0.856 334 L CB -0.076 41.856 42.059 -0.212 0.000 1.186 334 L HN 0.711 8.941 8.230 -0.000 0.000 0.453 335 D N 1.663 122.061 120.400 -0.003 0.000 2.369 335 D HA -0.068 4.571 4.640 -0.002 0.000 0.241 335 D C 0.209 176.495 176.300 -0.023 0.000 1.271 335 D CA -0.562 53.447 54.000 0.016 0.000 0.942 335 D CB 1.230 42.061 40.800 0.052 0.000 1.129 335 D HN 0.387 8.757 8.370 -0.000 0.000 0.476 336 D N 0.549 120.950 120.400 0.000 0.000 2.123 336 D HA -0.100 4.539 4.640 -0.002 0.000 0.196 336 D C 2.132 178.424 176.300 -0.013 0.000 0.992 336 D CA 1.630 55.625 54.000 -0.008 0.000 0.833 336 D CB -0.746 40.058 40.800 0.006 0.000 0.954 336 D HN 0.731 9.101 8.370 -0.000 0.000 0.455 337 G N 0.399 109.213 108.800 0.022 0.000 2.442 337 G HA2 -0.289 3.670 3.960 -0.002 0.000 0.219 337 G HA3 -0.289 3.670 3.960 -0.002 0.000 0.219 337 G C 1.778 176.670 174.900 -0.014 0.000 1.141 337 G CA 0.470 45.612 45.100 0.071 0.000 0.763 337 G HN 0.252 8.542 8.290 -0.000 0.000 0.554 338 R N -0.591 119.820 120.500 -0.147 0.000 2.161 338 R HA 0.128 4.467 4.340 -0.002 0.000 0.213 338 R C 2.651 178.724 176.300 -0.378 0.000 1.055 338 R CA 0.476 56.303 56.100 -0.454 0.000 0.996 338 R CB -0.153 29.798 30.300 -0.582 0.000 0.901 338 R HN 0.295 8.565 8.270 -0.000 0.000 0.456 339 V N 1.485 121.264 119.914 -0.226 0.000 2.295 339 V HA -0.248 3.871 4.120 -0.002 0.000 0.246 339 V C 1.492 177.510 176.094 -0.127 0.000 1.049 339 V CA 1.910 64.116 62.300 -0.156 0.000 1.024 339 V CB -0.400 31.372 31.823 -0.085 0.000 0.648 339 V HN 0.234 8.424 8.190 -0.000 0.000 0.447 340 D N 0.597 120.941 120.400 -0.093 0.000 2.116 340 D HA -0.190 4.449 4.640 -0.002 0.000 0.193 340 D C 2.197 178.451 176.300 -0.077 0.000 0.998 340 D CA 1.893 55.859 54.000 -0.057 0.000 0.836 340 D CB -0.385 40.409 40.800 -0.011 0.000 0.951 340 D HN 0.456 8.826 8.370 -0.000 0.000 0.449 341 A N 0.322 123.058 122.820 -0.139 0.000 1.898 341 A HA -0.078 4.241 4.320 -0.002 0.000 0.216 341 A C 2.423 179.911 177.584 -0.160 0.000 1.181 341 A CA 0.776 52.711 52.037 -0.171 0.000 0.620 341 A CB -0.742 17.997 19.000 -0.435 0.000 0.819 341 A HN 0.206 8.356 8.150 -0.000 0.000 0.442 342 L N -0.513 120.590 121.223 -0.200 0.000 2.083 342 L HA -0.172 4.167 4.340 -0.002 0.000 0.209 342 L C 2.546 179.370 176.870 -0.077 0.000 1.083 342 L CA 1.026 55.804 54.840 -0.103 0.000 0.752 342 L CB -0.513 41.469 42.059 -0.129 0.000 0.899 342 L HN 0.252 8.482 8.230 -0.000 0.000 0.433 343 V N 0.021 119.876 119.914 -0.099 0.000 2.287 343 V HA -0.337 3.782 4.120 -0.002 0.000 0.248 343 V C 2.758 178.787 176.094 -0.108 0.000 1.053 343 V CA 1.915 64.153 62.300 -0.104 0.000 1.027 343 V CB -0.895 30.882 31.823 -0.078 0.000 0.646 343 V HN 0.507 8.697 8.190 -0.000 0.000 0.447 344 A N -0.311 122.465 122.820 -0.073 0.000 1.883 344 A HA -0.285 4.035 4.320 -0.002 0.000 0.217 344 A C 2.133 179.660 177.584 -0.094 0.000 1.186 344 A CA 2.311 54.313 52.037 -0.059 0.000 0.624 344 A CB -0.809 18.180 19.000 -0.018 0.000 0.822 344 A HN 0.543 8.693 8.150 -0.000 0.000 0.444 345 F N 0.738 120.546 119.950 -0.237 0.000 2.069 345 F HA -0.150 4.376 4.527 -0.002 0.000 0.298 345 F C 1.905 177.493 175.800 -0.354 0.000 1.113 345 F CA 1.791 59.590 58.000 -0.334 0.000 1.214 345 F CB -0.520 38.264 39.000 -0.361 0.000 0.978 345 F HN 0.138 8.438 8.300 -0.000 0.000 0.474 346 L N 0.046 120.878 121.223 -0.651 0.000 2.131 346 L HA -0.199 4.141 4.340 -0.002 0.000 0.210 346 L C 2.290 178.838 176.870 -0.536 0.000 1.092 346 L CA 1.524 55.910 54.840 -0.758 0.000 0.759 346 L CB -0.825 40.965 42.059 -0.449 0.000 0.903 346 L HN 0.229 8.459 8.230 -0.000 0.000 0.435 347 E N -0.330 119.665 120.200 -0.342 0.000 2.204 347 E HA -0.189 4.161 4.350 -0.002 0.000 0.195 347 E C 2.020 178.502 176.600 -0.198 0.000 0.990 347 E CA 1.617 57.893 56.400 -0.205 0.000 0.821 347 E CB -0.060 29.572 29.700 -0.114 0.000 0.750 347 E HN 0.564 8.924 8.360 -0.000 0.000 0.477 348 T N -1.178 113.212 114.554 -0.273 0.000 3.113 348 T HA -0.004 4.345 4.350 -0.002 0.000 0.263 348 T C 1.541 176.128 174.700 -0.189 0.000 1.143 348 T CA 0.357 62.376 62.100 -0.135 0.000 1.090 348 T CB -0.120 68.784 68.868 0.060 0.000 0.922 348 T HN 0.085 8.325 8.240 -0.000 0.000 0.521 349 L N 1.279 122.256 121.223 -0.410 0.000 2.611 349 L HA 0.204 4.543 4.340 -0.002 0.000 0.229 349 L C 0.470 177.232 176.870 -0.180 0.000 1.137 349 L CA -0.129 54.466 54.840 -0.407 0.000 0.901 349 L CB -0.513 41.096 42.059 -0.750 0.000 1.098 349 L HN 0.192 8.422 8.230 -0.000 0.000 0.456 350 T N 0.263 114.760 114.554 -0.095 0.000 2.794 350 T HA 0.105 4.454 4.350 -0.002 0.000 0.296 350 T C 0.113 174.866 174.700 0.088 0.000 0.949 350 T CA -0.540 61.574 62.100 0.022 0.000 1.101 350 T CB 0.836 69.723 68.868 0.031 0.000 0.905 350 T HN 0.007 8.247 8.240 -0.000 0.000 0.516 351 D N 1.795 122.303 120.400 0.180 0.000 2.449 351 D HA -0.006 4.633 4.640 -0.002 0.000 0.236 351 D C 1.363 177.680 176.300 0.029 0.000 1.149 351 D CA -0.104 53.974 54.000 0.131 0.000 0.878 351 D CB 0.670 41.558 40.800 0.146 0.000 1.198 351 D HN 0.482 8.852 8.370 -0.000 0.000 0.446 352 R N 1.986 122.477 120.500 -0.015 0.000 2.096 352 R HA -0.211 4.128 4.340 -0.002 0.000 0.240 352 R C 2.052 178.284 176.300 -0.113 0.000 1.139 352 R CA 1.556 57.630 56.100 -0.042 0.000 0.952 352 R CB 0.015 30.295 30.300 -0.034 0.000 0.854 352 R HN 0.499 8.769 8.270 -0.000 0.000 0.436 353 R N -0.955 119.389 120.500 -0.260 0.000 2.285 353 R HA -0.144 4.195 4.340 -0.002 0.000 0.213 353 R C 0.805 176.879 176.300 -0.377 0.000 1.068 353 R CA 1.476 57.356 56.100 -0.366 0.000 1.004 353 R CB -0.272 29.724 30.300 -0.507 0.000 0.873 353 R HN 0.440 8.710 8.270 -0.000 0.000 0.467 354 Y N 0.873 121.161 120.300 -0.020 0.000 2.458 354 Y HA 0.228 4.777 4.550 -0.002 0.000 0.256 354 Y C 1.555 177.446 175.900 -0.015 0.000 1.159 354 Y CA -0.485 57.601 58.100 -0.024 0.000 1.261 354 Y CB 0.444 38.892 38.460 -0.020 0.000 1.119 354 Y HN 0.099 8.379 8.280 -0.000 0.000 0.524 355 E N 1.000 121.255 120.200 0.091 0.000 2.130 355 E HA -0.209 4.140 4.350 -0.002 0.000 0.196 355 E C -0.855 175.776 176.600 0.051 0.000 0.998 355 E CA 1.381 57.817 56.400 0.060 0.000 0.806 355 E CB -0.973 28.744 29.700 0.028 0.000 0.738 355 E HN 0.455 8.815 8.360 -0.000 0.000 0.459 356 P HA -0.124 4.296 4.420 -0.000 0.000 0.220 356 P C 1.077 178.404 177.300 0.044 0.000 1.148 356 P CA 0.725 63.846 63.100 0.036 0.000 0.803 356 P CB 0.108 31.823 31.700 0.026 0.000 0.782 357 L N -1.415 119.849 121.223 0.069 0.000 2.265 357 L HA -0.121 4.218 4.340 -0.002 0.000 0.215 357 L C 1.999 178.890 176.870 0.036 0.000 1.117 357 L CA 1.343 56.214 54.840 0.053 0.000 0.782 357 L CB -1.461 40.637 42.059 0.066 0.000 0.914 357 L HN -0.030 8.200 8.230 -0.000 0.000 0.441 358 L N -0.649 120.598 121.223 0.039 0.000 2.131 358 L HA -0.192 4.147 4.340 -0.002 0.000 0.210 358 L C 2.394 179.276 176.870 0.020 0.000 1.092 358 L CA 1.477 56.333 54.840 0.026 0.000 0.759 358 L CB -0.801 41.272 42.059 0.023 0.000 0.903 358 L HN 0.410 8.640 8.230 -0.000 0.000 0.435 359 E N -0.445 119.767 120.200 0.020 0.000 2.028 359 E HA -0.145 4.205 4.350 -0.002 0.000 0.191 359 E C 0.899 177.508 176.600 0.015 0.000 0.988 359 E CA 0.731 57.141 56.400 0.016 0.000 0.799 359 E CB -0.191 29.518 29.700 0.015 0.000 0.755 359 E HN 0.617 8.977 8.360 -0.000 0.000 0.447 360 E N 0.000 120.209 120.200 0.015 0.000 2.725 360 E HA 0.000 4.349 4.350 -0.002 0.000 0.291 360 E CA 0.000 56.408 56.400 0.013 0.000 0.976 360 E CB 0.000 29.706 29.700 0.010 0.000 0.812 360 E HN 0.000 8.360 8.360 -0.000 0.000 0.440