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 3fmu_1_A DATA FIRST_RESID 1 DATA SEQUENCE ATcDDGRTTA NAAccILFPI LDDIQENLFD GAQcGEEVHE SLRLTFHDAI DATA SEQUENCE GFSPTLGGGG ADGSIIAFDT IETNFPANAG IDEIVSAQKP FVAKHNISAG DATA SEQUENCE DFIQFAGAVG VSNcPGGVRI PFFLGRPDAV AASPDHLVPE PFDSVDSILA DATA SEQUENCE RMGDAGFSPV EVVSLLASHS IAAADKVDPS IPGTPFDSTP GVFDSQFFIE DATA SEQUENCE TQLKGRLFPG TADNKGEAQS PLQGEIRLQS DHLLARDPQT AcEWQSMVNN DATA SEQUENCE QPKIQNRFAA TMSKMALLGQ DKTKLIDcSD VIPTPPALVG AAHLPAGFSL DATA SEQUENCE SDVEQAcAAT PFPALTADP VARS RESID RESNAME ATOMNAME SS_SHIFT SHIFT RC_SHIFT HM_SHIFT EF_SHIFT SIGMA FORMAT %4d %4s %4s %9.3f %9.3f %9.3f %9.3f %9.3f %9.3f 1 A HA 0.000 4.339 4.320 0.032 0.000 0.244 1 A C 0.000 177.613 177.584 0.049 0.000 1.274 1 A CA 0.000 52.062 52.037 0.041 0.000 0.836 1 A CB 0.000 19.028 19.000 0.047 0.000 0.831 2 T N 3.895 118.471 114.554 0.037 0.000 2.770 2 T HA 0.483 4.972 4.350 0.024 -0.124 0.283 2 T C 0.123 174.842 174.700 0.032 0.000 0.988 2 T CA -0.508 61.607 62.100 0.025 0.000 0.957 2 T CB 0.944 69.815 68.868 0.006 0.000 0.930 2 T HN 0.046 8.305 8.240 0.031 0.000 0.443 3 c N 6.628 125.249 118.600 0.036 0.000 2.470 3 c HA 0.041 4.652 4.570 0.068 0.000 0.350 3 c C 1.364 175.459 174.090 0.009 0.000 1.341 3 c CA -0.968 55.391 56.329 0.051 0.000 2.440 3 c CB 0.163 42.742 42.510 0.115 0.000 2.295 3 c HN 0.732 8.975 8.230 0.022 0.000 0.645 4 D N 0.685 121.098 120.400 0.022 0.000 2.219 4 D HA -0.232 4.412 4.640 0.008 0.000 0.205 4 D C 0.216 176.509 176.300 -0.012 0.000 0.970 4 D CA 2.551 56.557 54.000 0.009 0.000 0.851 4 D CB -0.516 40.296 40.800 0.021 0.000 0.943 4 D HN 0.421 8.816 8.370 0.042 0.000 0.488 5 D N -4.731 115.648 120.400 -0.034 0.000 2.340 5 D HA -0.037 4.580 4.640 -0.038 0.000 0.217 5 D C 0.315 176.561 176.300 -0.089 0.000 1.081 5 D CA -0.720 53.246 54.000 -0.057 0.000 0.842 5 D CB -0.612 40.149 40.800 -0.064 0.000 0.934 5 D HN -0.131 8.193 8.370 -0.037 0.024 0.511 6 G N 0.559 109.306 108.800 -0.088 0.000 2.213 6 G HA2 -0.454 3.469 3.960 -0.062 0.000 0.236 6 G HA3 -0.454 3.458 3.960 -0.080 0.000 0.236 6 G C -0.229 174.588 174.900 -0.138 0.000 0.991 6 G CA -0.068 44.979 45.100 -0.089 0.000 0.629 6 G HN -0.242 7.834 8.290 -0.072 0.170 0.517 7 R N 0.475 120.820 120.500 -0.257 0.000 2.694 7 R HA 0.071 4.238 4.340 -0.288 0.000 0.268 7 R C -0.980 175.194 176.300 -0.210 0.000 1.061 7 R CA 0.744 56.608 56.100 -0.392 0.000 1.133 7 R CB 0.809 30.511 30.300 -0.996 0.000 1.020 7 R HN -0.220 8.130 8.270 -0.291 -0.255 0.475 8 T N -2.097 112.407 114.554 -0.083 0.000 2.912 8 T HA 0.889 5.437 4.350 0.065 -0.159 0.288 8 T C -0.401 174.419 174.700 0.200 0.000 1.030 8 T CA -1.890 60.246 62.100 0.060 0.000 1.020 8 T CB 2.417 71.303 68.868 0.031 0.000 1.056 8 T HN -0.132 8.052 8.240 -0.094 0.000 0.480 9 T N 1.860 116.520 114.554 0.176 0.000 2.885 9 T HA 0.116 4.677 4.350 0.143 -0.125 0.322 9 T C -0.933 173.813 174.700 0.077 0.000 1.387 9 T CA -1.400 60.792 62.100 0.154 0.000 1.041 9 T CB 2.988 71.964 68.868 0.180 0.000 1.287 9 T HN -0.141 8.179 8.240 0.133 0.000 0.491 10 A N 4.630 127.476 122.820 0.043 0.000 1.908 10 A HA -0.126 4.210 4.320 0.027 0.000 0.218 10 A C 0.150 177.746 177.584 0.020 0.000 1.181 10 A CA 2.103 54.155 52.037 0.024 0.000 0.627 10 A CB 0.240 19.245 19.000 0.007 0.000 0.818 10 A HN 0.155 8.602 8.150 0.036 -0.275 0.445 11 N N -1.575 117.133 118.700 0.012 0.000 2.407 11 N HA 0.171 4.918 4.740 0.012 0.000 0.277 11 N C -0.173 175.346 175.510 0.015 0.000 0.995 11 N CA -0.795 52.260 53.050 0.008 0.000 0.903 11 N CB 1.616 40.098 38.487 -0.009 0.000 1.218 11 N HN -0.509 7.876 8.380 0.008 0.000 0.487 12 A N 6.002 128.835 122.820 0.022 0.000 2.024 12 A HA -0.286 4.062 4.320 0.048 0.000 0.220 12 A C 1.446 179.043 177.584 0.022 0.000 1.164 12 A CA 2.860 54.916 52.037 0.032 0.000 0.643 12 A CB -0.232 18.785 19.000 0.029 0.000 0.806 12 A HN 0.742 8.904 8.150 0.020 0.000 0.451 13 A N -1.606 121.219 122.820 0.007 0.000 2.076 13 A HA -0.147 4.174 4.320 0.002 0.000 0.220 13 A C 2.138 179.708 177.584 -0.024 0.000 1.160 13 A CA 2.386 54.420 52.037 -0.004 0.000 0.653 13 A CB -0.906 18.090 19.000 -0.007 0.000 0.801 13 A HN 0.341 8.474 8.150 0.005 0.021 0.455 14 c N -3.483 115.095 118.600 -0.036 0.000 2.472 14 c HA -0.076 4.430 4.570 -0.107 0.000 0.278 14 c C 1.975 175.983 174.090 -0.136 0.000 1.447 14 c CA 1.271 57.542 56.329 -0.096 0.000 1.773 14 c CB -2.984 39.463 42.510 -0.105 0.000 1.793 14 c HN -0.294 7.884 8.230 -0.022 0.039 0.544 15 c N 1.039 119.634 118.600 -0.007 0.000 2.410 15 c HA -0.230 4.483 4.570 0.237 0.000 0.281 15 c C 2.152 176.279 174.090 0.062 0.000 1.318 15 c CA 4.064 60.462 56.329 0.115 0.000 1.776 15 c CB -1.960 40.642 42.510 0.154 0.000 1.942 15 c HN -0.259 7.942 8.230 0.021 0.042 0.508 16 I N -1.245 119.315 120.570 -0.017 0.000 2.567 16 I HA -0.348 3.834 4.170 0.020 0.000 0.257 16 I C 0.520 176.568 176.117 -0.114 0.000 1.184 16 I CA 2.616 63.899 61.300 -0.029 0.000 1.451 16 I CB -0.659 37.323 38.000 -0.031 0.000 1.089 16 I HN -0.839 7.331 8.210 -0.028 0.024 0.441 17 L N -0.849 120.219 121.223 -0.259 0.000 2.313 17 L HA -0.301 3.747 4.340 -0.487 0.000 0.214 17 L C 1.798 178.519 176.870 -0.248 0.000 1.119 17 L CA 2.265 56.840 54.840 -0.441 0.000 0.809 17 L CB -0.500 41.151 42.059 -0.681 0.000 0.933 17 L HN -0.418 7.500 8.230 -0.278 0.145 0.449 18 F N -0.870 119.062 119.950 -0.030 0.000 2.134 18 F HA -0.138 4.416 4.527 0.046 0.000 0.299 18 F C -0.980 174.828 175.800 0.014 0.000 1.097 18 F CA 5.489 63.498 58.000 0.016 0.000 1.264 18 F CB -3.389 35.621 39.000 0.016 0.000 1.001 18 F HN -0.535 7.736 8.300 -0.049 0.000 0.479 19 P HA -0.153 4.350 4.420 0.137 0.000 0.219 19 P C 1.221 178.531 177.300 0.016 0.000 1.150 19 P CA 2.698 65.866 63.100 0.113 0.000 0.814 19 P CB -0.484 31.292 31.700 0.126 0.000 0.787 20 I N -2.326 118.161 120.570 -0.138 0.000 2.202 20 I HA -0.452 3.370 4.170 -0.581 0.000 0.242 20 I C 1.631 177.774 176.117 0.044 0.000 1.091 20 I CA 3.796 64.929 61.300 -0.278 0.000 1.368 20 I CB -0.429 37.371 38.000 -0.334 0.000 1.058 20 I HN -0.841 7.280 8.210 -0.128 0.013 0.410 21 L N 0.201 121.531 121.223 0.179 0.000 1.990 21 L HA -0.517 3.886 4.340 0.105 0.000 0.213 21 L C 1.356 178.275 176.870 0.082 0.000 1.072 21 L CA 3.912 58.846 54.840 0.156 0.000 0.755 21 L CB -0.553 41.628 42.059 0.203 0.000 0.889 21 L HN 0.061 8.394 8.230 0.172 0.000 0.432 22 D N -2.209 118.259 120.400 0.112 0.000 2.117 22 D HA -0.347 4.344 4.640 0.086 0.000 0.197 22 D C 2.513 178.871 176.300 0.097 0.000 0.987 22 D CA 3.336 57.395 54.000 0.098 0.000 0.829 22 D CB -0.823 40.041 40.800 0.106 0.000 0.961 22 D HN -0.463 7.987 8.370 0.134 0.000 0.460 23 D N -0.115 120.364 120.400 0.132 0.000 2.097 23 D HA -0.174 4.591 4.640 0.208 0.000 0.195 23 D C 2.218 178.615 176.300 0.161 0.000 0.989 23 D CA 2.893 57.025 54.000 0.220 0.000 0.827 23 D CB 0.204 41.244 40.800 0.400 0.000 0.966 23 D HN -0.571 7.874 8.370 0.126 0.000 0.456 24 I N -3.208 117.354 120.570 -0.013 0.000 2.315 24 I HA -0.397 3.503 4.170 -0.451 0.000 0.248 24 I C 1.750 177.684 176.117 -0.305 0.000 1.117 24 I CA 3.309 64.398 61.300 -0.352 0.000 1.404 24 I CB -0.336 37.317 38.000 -0.579 0.000 1.071 24 I HN -0.339 7.871 8.210 0.001 0.000 0.419 25 Q N -0.424 119.332 119.800 -0.073 0.000 2.096 25 Q HA -0.379 4.062 4.340 0.168 0.000 0.204 25 Q C 3.026 179.056 176.000 0.050 0.000 0.982 25 Q CA 3.311 59.147 55.803 0.055 0.000 0.850 25 Q CB -0.576 28.202 28.738 0.067 0.000 0.901 25 Q HN -0.122 8.127 8.270 -0.034 0.000 0.422 26 E N -1.040 119.185 120.200 0.042 0.000 2.051 26 E HA -0.193 4.190 4.350 0.055 0.000 0.189 26 E C 2.079 178.714 176.600 0.059 0.000 0.979 26 E CA 2.539 58.973 56.400 0.056 0.000 0.803 26 E CB 0.101 29.840 29.700 0.067 0.000 0.761 26 E HN -0.641 7.747 8.360 0.046 0.000 0.451 27 N N -3.424 115.325 118.700 0.082 0.000 2.282 27 N HA 0.020 4.832 4.740 0.120 0.000 0.185 27 N C 0.739 176.343 175.510 0.156 0.000 1.099 27 N CA 1.533 54.681 53.050 0.164 0.000 0.878 27 N CB 1.161 39.819 38.487 0.286 0.000 0.993 27 N HN -0.148 8.281 8.380 0.081 0.000 0.481 28 L N -0.841 120.298 121.223 -0.140 0.000 2.445 28 L HA 0.032 4.280 4.340 -0.152 0.000 0.207 28 L C -0.796 175.923 176.870 -0.253 0.000 1.053 28 L CA 1.912 56.518 54.840 -0.390 0.000 0.841 28 L CB 1.303 42.741 42.059 -1.034 0.000 1.074 28 L HN -0.432 7.544 8.230 -0.243 0.108 0.479 29 F N -6.752 113.160 119.950 -0.063 0.000 2.647 29 F HA 0.245 4.717 4.527 -0.092 0.000 0.300 29 F C -1.304 174.463 175.800 -0.055 0.000 1.106 29 F CA -3.038 54.913 58.000 -0.082 0.000 1.313 29 F CB 0.031 38.962 39.000 -0.115 0.000 1.007 29 F HN -0.517 7.654 8.300 -0.216 0.000 0.536 30 D N -1.376 119.089 120.400 0.109 0.000 2.723 30 D HA -0.344 4.328 4.640 0.054 0.000 0.236 30 D C 0.662 176.997 176.300 0.057 0.000 1.138 30 D CA 1.068 55.107 54.000 0.066 0.000 0.676 30 D CB -1.950 38.879 40.800 0.048 0.000 1.069 30 D HN -0.396 7.968 8.370 0.077 0.053 0.430 31 G N -4.236 104.603 108.800 0.065 0.000 2.303 31 G HA2 -0.412 3.785 3.960 0.050 0.000 0.260 31 G HA3 -0.412 3.571 3.960 0.038 0.000 0.260 31 G C -0.438 174.490 174.900 0.048 0.000 1.106 31 G CA -0.033 45.097 45.100 0.050 0.000 0.900 31 G HN -0.309 8.025 8.290 0.073 0.000 0.495 32 A N -4.137 118.731 122.820 0.080 0.000 2.846 32 A HA -0.531 3.965 4.320 0.082 -0.127 0.287 32 A C -1.057 176.519 177.584 -0.012 0.000 1.469 32 A CA 1.330 53.395 52.037 0.047 0.000 0.757 32 A CB -1.229 17.784 19.000 0.021 0.000 1.033 32 A HN -0.046 8.178 8.150 0.124 0.000 0.516 33 Q N -3.519 116.275 119.800 -0.009 0.000 2.221 33 Q HA 0.141 4.448 4.340 -0.056 0.000 0.242 33 Q C -0.080 175.829 176.000 -0.150 0.000 0.940 33 Q CA -1.547 54.220 55.803 -0.059 0.000 0.896 33 Q CB 2.158 30.875 28.738 -0.034 0.000 1.226 33 Q HN -0.493 7.800 8.270 0.037 0.000 0.463 34 c N 4.707 123.219 118.600 -0.145 0.000 2.560 34 c HA 0.196 4.600 4.570 -0.277 0.000 0.506 34 c C -0.686 173.263 174.090 -0.235 0.000 1.116 34 c CA -1.341 54.875 56.329 -0.188 0.000 1.425 34 c CB -3.108 39.352 42.510 -0.084 0.000 1.543 34 c HN 0.600 8.770 8.230 -0.100 0.000 0.586 35 G N 2.048 110.632 108.800 -0.360 0.000 3.217 35 G HA2 0.282 3.996 3.960 -0.409 0.000 0.213 35 G HA3 0.282 4.094 3.960 -0.247 0.000 0.213 35 G C -1.030 173.433 174.900 -0.728 0.000 1.294 35 G CA -1.085 43.755 45.100 -0.434 0.000 0.987 35 G HN -0.840 7.219 8.290 -0.326 0.035 0.584 36 E N 1.777 121.753 120.200 -0.374 0.000 2.086 36 E HA -0.482 3.747 4.350 -0.201 0.000 0.200 36 E C 1.895 178.409 176.600 -0.144 0.000 1.012 36 E CA 3.606 59.873 56.400 -0.222 0.000 0.812 36 E CB 0.013 29.677 29.700 -0.059 0.000 0.743 36 E HN 0.631 8.856 8.360 -0.225 0.000 0.453 37 E N -2.167 118.008 120.200 -0.041 0.000 2.152 37 E HA -0.196 4.378 4.350 0.094 -0.168 0.192 37 E C 2.795 179.494 176.600 0.165 0.000 0.983 37 E CA 3.057 59.527 56.400 0.117 0.000 0.818 37 E CB -0.724 29.106 29.700 0.217 0.000 0.758 37 E HN 0.350 8.691 8.360 -0.032 0.000 0.467 38 V N 1.048 120.901 119.914 -0.103 0.000 2.295 38 V HA -0.588 3.286 4.120 -0.409 0.000 0.246 38 V C 1.603 177.660 176.094 -0.061 0.000 1.049 38 V CA 4.591 66.696 62.300 -0.324 0.000 1.024 38 V CB -0.096 31.397 31.823 -0.551 0.000 0.648 38 V HN -0.658 7.416 8.190 -0.193 0.000 0.447 39 H N -0.127 118.906 119.070 -0.062 0.000 2.319 39 H HA -0.306 4.225 4.556 -0.042 0.000 0.299 39 H C 3.029 178.358 175.328 0.001 0.000 1.092 39 H CA 3.149 59.173 56.048 -0.041 0.000 1.302 39 H CB -0.025 29.696 29.762 -0.068 0.000 1.373 39 H HN -0.453 7.623 8.280 -0.340 0.000 0.497 40 E N -1.053 119.227 120.200 0.133 0.000 2.106 40 E HA -0.402 3.996 4.350 0.080 0.000 0.192 40 E C 2.259 178.921 176.600 0.103 0.000 0.984 40 E CA 3.120 59.576 56.400 0.094 0.000 0.806 40 E CB -0.209 29.533 29.700 0.071 0.000 0.750 40 E HN 0.011 8.434 8.360 0.106 0.000 0.458 41 S N 0.945 116.722 115.700 0.129 0.000 2.383 41 S HA -0.272 4.278 4.470 0.133 0.000 0.227 41 S C 1.907 176.578 174.600 0.118 0.000 1.026 41 S CA 3.459 61.742 58.200 0.138 0.000 0.981 41 S CB 0.015 63.344 63.200 0.215 0.000 0.818 41 S HN -0.211 8.183 8.310 0.141 0.000 0.472 42 L N 1.911 123.199 121.223 0.108 0.000 2.056 42 L HA -0.247 4.162 4.340 0.115 0.000 0.207 42 L C 1.083 178.067 176.870 0.190 0.000 1.078 42 L CA 2.630 57.548 54.840 0.130 0.000 0.749 42 L CB -0.320 41.815 42.059 0.127 0.000 0.901 42 L HN -0.185 8.104 8.230 0.098 0.000 0.433 43 R N -1.089 119.521 120.500 0.183 0.000 2.091 43 R HA -0.421 4.122 4.340 0.339 0.000 0.238 43 R C 2.201 178.645 176.300 0.241 0.000 1.136 43 R CA 3.608 59.846 56.100 0.231 0.000 0.959 43 R CB -0.182 30.182 30.300 0.106 0.000 0.856 43 R HN -0.407 7.955 8.270 0.153 0.000 0.437 44 L N -1.909 119.403 121.223 0.147 0.000 2.083 44 L HA -0.212 4.202 4.340 0.123 0.000 0.209 44 L C 1.291 178.289 176.870 0.213 0.000 1.083 44 L CA 3.156 58.086 54.840 0.150 0.000 0.752 44 L CB -0.331 41.801 42.059 0.122 0.000 0.899 44 L HN -0.123 8.100 8.230 0.125 0.081 0.433 45 T N -0.674 114.008 114.554 0.213 0.000 2.720 45 T HA -0.429 4.031 4.350 0.184 0.000 0.268 45 T C 1.589 176.459 174.700 0.282 0.000 1.037 45 T CA 4.492 66.719 62.100 0.211 0.000 1.144 45 T CB -0.401 68.566 68.868 0.165 0.000 0.864 45 T HN -0.322 8.035 8.240 0.195 0.000 0.444 46 F N 3.355 123.414 119.950 0.182 0.000 2.128 46 F HA -0.165 4.437 4.527 0.125 0.000 0.295 46 F C 1.219 177.143 175.800 0.207 0.000 1.100 46 F CA 1.690 59.797 58.000 0.179 0.000 1.260 46 F CB -0.062 39.056 39.000 0.196 0.000 1.009 46 F HN -0.813 7.772 8.300 0.486 0.007 0.476 47 H N -2.484 116.561 119.070 -0.041 0.000 2.457 47 H HA -0.297 4.059 4.556 -0.334 0.000 0.294 47 H C 1.439 176.746 175.328 -0.035 0.000 1.064 47 H CA 3.192 59.160 56.048 -0.134 0.000 1.330 47 H CB 0.439 30.202 29.762 0.003 0.000 1.395 47 H HN -0.452 8.150 8.280 0.536 0.000 0.541 48 D N -0.800 119.693 120.400 0.154 0.000 2.091 48 D HA -0.134 4.587 4.640 0.134 0.000 0.199 48 D C 1.680 178.043 176.300 0.104 0.000 0.980 48 D CA 2.541 56.620 54.000 0.133 0.000 0.831 48 D CB 0.373 41.262 40.800 0.149 0.000 0.987 48 D HN -0.401 8.077 8.370 0.193 0.007 0.460 49 A N -0.414 122.470 122.820 0.108 0.000 1.930 49 A HA -0.221 4.260 4.320 0.096 -0.103 0.217 49 A C 1.835 179.489 177.584 0.116 0.000 1.175 49 A CA 2.831 54.936 52.037 0.114 0.000 0.627 49 A CB -0.175 18.923 19.000 0.163 0.000 0.815 49 A HN -0.502 7.726 8.150 0.130 0.000 0.443 50 I N -3.087 117.494 120.570 0.018 0.000 3.291 50 I HA -0.139 4.148 4.170 0.195 0.000 0.279 50 I C -0.220 175.935 176.117 0.063 0.000 1.294 50 I CA -1.089 60.225 61.300 0.022 0.000 1.428 50 I CB 0.090 37.894 38.000 -0.327 0.000 1.070 50 I HN -0.185 7.965 8.210 -0.101 0.000 0.478 51 G N 0.635 109.481 108.800 0.078 0.000 3.102 51 G HA2 -0.104 3.909 3.960 0.088 0.000 0.264 51 G HA3 -0.104 3.933 3.960 0.129 0.000 0.264 51 G C -2.292 172.744 174.900 0.226 0.000 0.788 51 G CA 0.127 45.302 45.100 0.125 0.000 2.029 51 G HN -0.653 7.628 8.290 0.059 0.044 0.608 52 F N 4.291 124.258 119.950 0.028 0.000 2.722 52 F HA 0.403 5.121 4.527 0.025 -0.176 0.336 52 F C -2.991 172.821 175.800 0.020 0.000 1.216 52 F CA -0.792 57.224 58.000 0.028 0.000 1.065 52 F CB 2.861 41.883 39.000 0.036 0.000 1.325 52 F HN -0.272 8.122 8.300 0.214 0.034 0.524 53 S N 7.456 122.859 115.700 -0.495 0.000 2.668 53 S HA 0.666 5.000 4.470 -0.385 -0.095 0.277 53 S C -1.811 172.504 174.600 -0.475 0.000 1.170 53 S CA -4.228 53.729 58.200 -0.406 0.000 0.994 53 S CB 1.981 65.079 63.200 -0.171 0.000 1.051 53 S HN -0.153 7.869 8.310 -0.479 0.000 0.484 54 P HA -0.080 4.132 4.420 -0.346 0.000 0.216 54 P C 0.388 177.578 177.300 -0.183 0.000 1.153 54 P CA 1.836 64.754 63.100 -0.304 0.000 0.858 54 P CB 0.204 31.780 31.700 -0.207 0.000 0.789 55 T N -2.258 112.209 114.554 -0.146 0.000 2.770 55 T HA -0.151 4.149 4.350 -0.083 0.000 0.263 55 T C 0.508 175.154 174.700 -0.090 0.000 1.039 55 T CA 2.627 64.670 62.100 -0.096 0.000 1.142 55 T CB 0.233 69.057 68.868 -0.074 0.000 0.868 55 T HN -0.251 7.887 8.240 -0.152 0.011 0.435 56 L N -2.159 119.003 121.223 -0.102 0.000 2.513 56 L HA 0.052 4.355 4.340 -0.061 0.000 0.222 56 L C 0.356 177.182 176.870 -0.074 0.000 1.096 56 L CA 0.114 54.909 54.840 -0.075 0.000 0.857 56 L CB 1.271 43.293 42.059 -0.061 0.000 1.026 56 L HN -0.637 7.518 8.230 -0.125 0.000 0.469 57 G N -1.963 106.772 108.800 -0.108 0.000 2.582 57 G HA2 -0.243 3.659 3.960 -0.097 0.000 0.222 57 G HA3 -0.243 3.685 3.960 -0.054 0.000 0.222 57 G C -1.757 173.112 174.900 -0.052 0.000 1.311 57 G CA -0.636 44.415 45.100 -0.082 0.000 0.915 57 G HN -0.232 7.968 8.290 -0.151 0.000 0.528 58 G N -1.236 107.570 108.800 0.010 0.000 2.785 58 G HA2 -0.338 3.671 3.960 0.081 0.000 0.686 58 G HA3 -0.338 3.802 3.960 0.097 -0.121 0.686 58 G C 0.342 175.354 174.900 0.186 0.000 1.155 58 G CA -0.169 44.983 45.100 0.086 0.000 0.760 58 G HN -0.096 8.198 8.290 0.006 0.000 0.624 59 G N 0.236 109.160 108.800 0.207 0.000 3.284 59 G HA2 0.237 4.366 3.960 0.282 0.000 0.236 59 G HA3 0.237 4.404 3.960 0.179 -0.099 0.236 59 G C -0.413 174.623 174.900 0.227 0.000 1.158 59 G CA -1.355 43.887 45.100 0.237 0.000 0.774 59 G HN 0.342 8.736 8.290 0.173 0.000 0.545 60 G N 1.162 110.122 108.800 0.267 0.000 2.527 60 G HA2 -0.463 3.805 3.960 0.157 0.000 0.268 60 G HA3 -0.463 3.600 3.960 -0.079 -0.150 0.268 60 G C -0.980 173.966 174.900 0.077 0.000 1.175 60 G CA 0.016 45.178 45.100 0.103 0.000 0.962 60 G HN -0.356 8.075 8.290 0.318 0.050 0.560 61 A N 3.720 126.549 122.820 0.015 0.000 2.990 61 A HA -0.015 4.359 4.320 0.090 0.000 0.282 61 A C -1.579 176.048 177.584 0.071 0.000 1.688 61 A CA -0.573 51.498 52.037 0.058 0.000 1.391 61 A CB -0.651 18.373 19.000 0.040 0.000 1.112 61 A HN -0.121 7.995 8.150 -0.057 0.000 0.588 62 D N -0.383 120.078 120.400 0.101 0.000 2.520 62 D HA 0.036 4.731 4.640 0.091 0.000 0.223 62 D C 0.164 176.536 176.300 0.120 0.000 1.186 62 D CA -1.499 52.566 54.000 0.108 0.000 0.821 62 D CB 1.420 42.295 40.800 0.125 0.000 1.072 62 D HN -0.552 7.947 8.370 0.116 -0.060 0.518 63 G N -1.107 107.770 108.800 0.128 0.000 2.162 63 G HA2 -0.484 3.602 3.960 0.129 0.000 0.260 63 G HA3 -0.484 3.596 3.960 0.102 -0.059 0.260 63 G C 0.994 175.957 174.900 0.105 0.000 0.976 63 G CA 1.157 46.327 45.100 0.116 0.000 0.655 63 G HN 0.155 8.951 8.290 0.132 -0.426 0.533 64 S N 0.497 116.297 115.700 0.167 0.000 2.400 64 S HA -0.271 4.379 4.470 0.300 0.000 0.232 64 S C 1.275 175.997 174.600 0.204 0.000 1.025 64 S CA 3.592 61.956 58.200 0.274 0.000 0.993 64 S CB 0.046 63.457 63.200 0.351 0.000 0.808 64 S HN -0.194 8.551 8.310 0.175 -0.331 0.478 65 I N 0.473 121.127 120.570 0.139 0.000 2.614 65 I HA -0.311 3.999 4.170 0.078 -0.093 0.258 65 I C 0.394 176.541 176.117 0.052 0.000 1.189 65 I CA 2.499 63.854 61.300 0.091 0.000 1.462 65 I CB -0.050 38.010 38.000 0.101 0.000 1.092 65 I HN -0.950 7.507 8.210 0.140 -0.162 0.442 66 I N -1.343 119.251 120.570 0.041 0.000 2.385 66 I HA -0.354 3.816 4.170 -0.000 0.000 0.244 66 I C 1.746 177.812 176.117 -0.084 0.000 1.089 66 I CA 3.224 64.522 61.300 -0.005 0.000 1.410 66 I CB 0.091 38.099 38.000 0.014 0.000 1.117 66 I HN -0.673 7.555 8.210 0.057 0.016 0.429 67 A N 1.262 123.981 122.820 -0.168 0.000 1.933 67 A HA -0.172 3.939 4.320 -0.348 0.000 0.218 67 A C 1.059 178.274 177.584 -0.616 0.000 1.175 67 A CA 2.715 54.485 52.037 -0.445 0.000 0.628 67 A CB 0.140 18.753 19.000 -0.645 0.000 0.814 67 A HN -0.261 7.818 8.150 -0.118 0.000 0.444 68 F N -4.253 115.693 119.950 -0.006 0.000 2.928 68 F HA 0.311 4.826 4.527 -0.021 0.000 0.337 68 F C -0.633 175.128 175.800 -0.066 0.000 1.259 68 F CA -2.226 55.759 58.000 -0.026 0.000 1.267 68 F CB -0.456 38.536 39.000 -0.014 0.000 0.986 68 F HN -0.307 7.834 8.300 -0.064 0.121 0.507 69 D N 0.514 120.929 120.400 0.025 0.000 2.149 69 D HA -0.275 4.459 4.640 -0.028 -0.111 0.198 69 D C 1.853 178.130 176.300 -0.038 0.000 0.990 69 D CA 3.808 57.797 54.000 -0.017 0.000 0.839 69 D CB -0.494 40.292 40.800 -0.023 0.000 0.948 69 D HN -0.557 7.743 8.370 -0.020 0.058 0.460 70 T N 0.554 115.104 114.554 -0.007 0.000 2.759 70 T HA -0.312 4.026 4.350 -0.019 0.000 0.269 70 T C 1.033 175.707 174.700 -0.044 0.000 1.042 70 T CA 3.251 65.344 62.100 -0.011 0.000 1.140 70 T CB -0.121 68.757 68.868 0.018 0.000 0.864 70 T HN 0.000 8.248 8.240 0.013 0.000 0.455 71 I N -0.919 119.619 120.570 -0.054 0.000 2.270 71 I HA -0.126 3.995 4.170 -0.082 0.000 0.239 71 I C 1.798 177.603 176.117 -0.519 0.000 1.080 71 I CA 1.410 62.624 61.300 -0.143 0.000 1.383 71 I CB -0.219 37.754 38.000 -0.045 0.000 1.097 71 I HN -0.774 7.433 8.210 0.001 0.004 0.420 72 E N -0.921 118.936 120.200 -0.572 0.000 2.106 72 E HA -0.285 2.692 4.350 -2.288 0.000 0.192 72 E C 2.607 178.797 176.600 -0.682 0.000 0.984 72 E CA 3.055 58.827 56.400 -1.047 0.000 0.806 72 E CB 0.177 29.625 29.700 -0.421 0.000 0.750 72 E HN -0.207 7.971 8.360 -0.303 0.000 0.458 73 T N -3.734 110.641 114.554 -0.299 0.000 3.072 73 T HA -0.224 4.070 4.350 -0.093 0.000 0.266 73 T C 0.388 175.038 174.700 -0.084 0.000 1.127 73 T CA 2.978 65.000 62.100 -0.131 0.000 1.107 73 T CB -0.474 68.360 68.868 -0.057 0.000 0.910 73 T HN 0.013 8.112 8.240 -0.236 0.000 0.513 74 N N -0.544 118.079 118.700 -0.129 0.000 2.398 74 N HA 0.001 4.760 4.740 0.032 0.000 0.188 74 N C -0.159 175.443 175.510 0.154 0.000 1.122 74 N CA 0.294 53.349 53.050 0.007 0.000 0.866 74 N CB 0.371 38.868 38.487 0.016 0.000 0.970 74 N HN -0.787 7.420 8.380 -0.229 0.036 0.462 75 F N 0.618 120.579 119.950 0.019 0.000 2.529 75 F HA 0.094 4.598 4.527 -0.039 0.000 0.365 75 F C -0.457 175.355 175.800 0.020 0.000 1.102 75 F CA -2.815 55.178 58.000 -0.012 0.000 1.271 75 F CB -1.818 37.162 39.000 -0.033 0.000 1.120 75 F HN -0.733 7.379 8.300 -0.075 0.142 0.579 76 P HA -0.285 4.231 4.420 0.161 0.000 0.216 76 P C 0.350 177.764 177.300 0.190 0.000 1.150 76 P CA 2.494 65.696 63.100 0.169 0.000 0.837 76 P CB 0.023 31.815 31.700 0.153 0.000 0.786 77 A N -6.830 116.097 122.820 0.178 0.000 2.168 77 A HA -0.170 4.363 4.320 0.181 -0.105 0.215 77 A C -0.436 177.318 177.584 0.282 0.000 1.152 77 A CA 1.114 53.260 52.037 0.181 0.000 0.716 77 A CB -0.598 18.450 19.000 0.079 0.000 0.794 77 A HN 0.325 8.562 8.150 0.146 0.000 0.465 78 N N -2.857 116.010 118.700 0.279 0.000 2.276 78 N HA 0.015 4.969 4.740 0.356 0.000 0.212 78 N C -1.150 174.448 175.510 0.148 0.000 1.127 78 N CA -1.633 51.575 53.050 0.264 0.000 0.834 78 N CB 0.181 38.798 38.487 0.217 0.000 1.014 78 N HN -0.462 7.924 8.380 0.267 0.154 0.491 79 A N 0.265 123.176 122.820 0.152 0.000 2.546 79 A HA -0.025 4.351 4.320 0.093 0.000 0.243 79 A C 0.402 178.032 177.584 0.076 0.000 1.063 79 A CA 1.923 54.025 52.037 0.109 0.000 0.757 79 A CB 0.241 19.315 19.000 0.123 0.000 0.991 79 A HN -0.807 7.385 8.150 0.180 0.066 0.503 80 G N 2.644 111.475 108.800 0.051 0.000 2.225 80 G HA2 -0.377 3.602 3.960 0.031 0.000 0.254 80 G HA3 -0.377 3.602 3.960 0.032 0.000 0.254 80 G C 0.963 175.869 174.900 0.010 0.000 0.988 80 G CA 1.216 46.334 45.100 0.031 0.000 0.625 80 G HN 0.546 8.867 8.290 0.051 0.000 0.527 81 I N 2.005 122.574 120.570 -0.002 0.000 2.928 81 I HA -0.205 3.944 4.170 -0.035 0.000 0.266 81 I C -0.441 175.679 176.117 0.004 0.000 1.234 81 I CA 0.446 61.731 61.300 -0.024 0.000 1.483 81 I CB 0.078 38.040 38.000 -0.062 0.000 1.097 81 I HN -0.406 7.744 8.210 0.011 0.066 0.455 82 D N -0.117 120.290 120.400 0.010 0.000 2.182 82 D HA -0.416 4.228 4.640 0.008 0.000 0.201 82 D C 1.642 177.953 176.300 0.017 0.000 0.986 82 D CA 3.481 57.487 54.000 0.011 0.000 0.847 82 D CB -1.424 39.381 40.800 0.009 0.000 0.942 82 D HN 0.337 8.688 8.370 0.013 0.027 0.467 83 E N 0.067 120.279 120.200 0.020 0.000 2.051 83 E HA -0.348 4.016 4.350 0.024 0.000 0.192 83 E C 1.920 178.543 176.600 0.037 0.000 0.991 83 E CA 2.811 59.226 56.400 0.026 0.000 0.799 83 E CB 0.061 29.776 29.700 0.025 0.000 0.748 83 E HN -0.795 7.556 8.360 0.018 0.021 0.449 84 I N -0.650 119.945 120.570 0.041 0.000 2.439 84 I HA -0.287 3.924 4.170 0.069 0.000 0.251 84 I C 1.264 177.424 176.117 0.072 0.000 1.139 84 I CA 1.369 62.706 61.300 0.062 0.000 1.438 84 I CB -0.119 37.920 38.000 0.066 0.000 1.085 84 I HN -0.791 7.438 8.210 0.033 0.000 0.427 85 V N 0.294 120.240 119.914 0.055 0.000 2.295 85 V HA -0.714 3.448 4.120 0.071 0.000 0.246 85 V C 1.441 177.561 176.094 0.043 0.000 1.049 85 V CA 5.569 67.900 62.300 0.052 0.000 1.024 85 V CB -0.374 31.468 31.823 0.031 0.000 0.648 85 V HN -0.371 7.844 8.190 0.042 0.000 0.447 86 S N -1.141 114.578 115.700 0.032 0.000 2.382 86 S HA -0.375 4.100 4.470 0.008 0.000 0.228 86 S C 1.565 176.188 174.600 0.039 0.000 1.027 86 S CA 3.281 61.494 58.200 0.021 0.000 0.991 86 S CB -0.052 63.157 63.200 0.014 0.000 0.823 86 S HN -0.310 8.017 8.310 0.029 0.000 0.469 87 A N 0.679 123.542 122.820 0.071 0.000 1.930 87 A HA -0.136 4.246 4.320 0.104 0.000 0.217 87 A C 1.817 179.535 177.584 0.223 0.000 1.175 87 A CA 2.473 54.585 52.037 0.124 0.000 0.627 87 A CB -0.122 18.951 19.000 0.122 0.000 0.815 87 A HN -0.560 7.549 8.150 0.068 0.082 0.443 88 Q N -2.351 117.557 119.800 0.179 0.000 2.187 88 Q HA -0.227 4.309 4.340 0.327 0.000 0.199 88 Q C 2.414 178.443 176.000 0.048 0.000 0.957 88 Q CA 2.471 58.394 55.803 0.199 0.000 0.857 88 Q CB 0.130 28.999 28.738 0.218 0.000 0.929 88 Q HN -0.355 7.995 8.270 0.133 0.000 0.453 89 K N -0.276 120.129 120.400 0.008 0.000 2.059 89 K HA -0.283 3.984 4.320 -0.087 0.000 0.212 89 K C -0.393 176.138 176.600 -0.115 0.000 1.050 89 K CA 5.490 61.737 56.287 -0.066 0.000 0.927 89 K CB -1.577 30.894 32.500 -0.049 0.000 0.714 89 K HN -0.464 7.805 8.250 0.031 0.000 0.447 90 P HA -0.130 4.173 4.420 -0.195 0.000 0.220 90 P C 1.392 178.512 177.300 -0.300 0.000 1.148 90 P CA 2.526 65.489 63.100 -0.229 0.000 0.803 90 P CB -0.310 31.212 31.700 -0.297 0.000 0.782 91 F N -2.621 117.170 119.950 -0.264 0.000 2.146 91 F HA -0.299 4.144 4.527 -0.141 0.000 0.298 91 F C 2.341 177.905 175.800 -0.393 0.000 1.096 91 F CA 4.320 62.148 58.000 -0.286 0.000 1.275 91 F CB -0.508 38.274 39.000 -0.363 0.000 1.008 91 F HN -0.740 7.550 8.300 -0.017 0.000 0.480 92 V N -0.993 118.684 119.914 -0.395 0.000 2.343 92 V HA -0.537 3.405 4.120 -0.296 0.000 0.247 92 V C 1.304 177.318 176.094 -0.134 0.000 1.051 92 V CA 4.061 66.181 62.300 -0.299 0.000 1.036 92 V CB -0.159 31.510 31.823 -0.258 0.000 0.654 92 V HN -0.648 7.287 8.190 -0.425 0.000 0.451 93 A N -2.619 120.112 122.820 -0.148 0.000 1.930 93 A HA -0.240 4.021 4.320 -0.099 0.000 0.217 93 A C 0.759 178.259 177.584 -0.139 0.000 1.175 93 A CA 2.459 54.421 52.037 -0.125 0.000 0.627 93 A CB -0.291 18.630 19.000 -0.131 0.000 0.815 93 A HN -0.498 7.551 8.150 -0.168 0.000 0.443 94 K N -2.348 117.926 120.400 -0.210 0.000 2.116 94 K HA -0.177 3.993 4.320 -0.249 0.000 0.203 94 K C 0.694 177.099 176.600 -0.324 0.000 1.052 94 K CA 1.584 57.681 56.287 -0.316 0.000 0.952 94 K CB 0.678 32.883 32.500 -0.492 0.000 0.729 94 K HN -0.635 7.480 8.250 -0.225 0.000 0.446 95 H N -1.308 117.751 119.070 -0.019 0.000 2.530 95 H HA 0.144 4.712 4.556 0.021 0.000 0.342 95 H C -1.511 173.820 175.328 0.007 0.000 1.312 95 H CA -0.256 55.803 56.048 0.019 0.000 1.376 95 H CB 1.390 31.200 29.762 0.080 0.000 1.692 95 H HN -0.647 7.598 8.280 -0.057 0.000 0.622 96 N N -1.189 117.609 118.700 0.163 0.000 2.610 96 N HA 0.103 4.878 4.740 0.058 0.000 0.309 96 N C -0.805 174.747 175.510 0.070 0.000 1.536 96 N CA -0.072 53.026 53.050 0.079 0.000 0.954 96 N CB 0.118 38.637 38.487 0.054 0.000 1.310 96 N HN 0.131 8.628 8.380 0.195 0.000 0.502 97 I N -5.379 115.249 120.570 0.096 0.000 2.846 97 I HA 0.489 4.698 4.170 0.066 0.000 0.307 97 I C -1.589 174.591 176.117 0.105 0.000 1.053 97 I CA -2.282 59.073 61.300 0.091 0.000 1.050 97 I CB 3.509 41.561 38.000 0.088 0.000 1.239 97 I HN -0.654 7.580 8.210 0.128 0.053 0.439 98 S N 1.297 117.057 115.700 0.099 0.000 2.576 98 S HA -0.061 4.448 4.470 0.066 0.000 0.272 98 S C 1.692 176.379 174.600 0.145 0.000 1.352 98 S CA -0.508 57.748 58.200 0.093 0.000 1.021 98 S CB 1.771 65.018 63.200 0.079 0.000 0.887 98 S HN -0.017 8.348 8.310 0.091 0.000 0.542 99 A N 2.598 125.483 122.820 0.109 0.000 1.933 99 A HA -0.255 4.174 4.320 0.181 0.000 0.218 99 A C 1.712 179.417 177.584 0.200 0.000 1.175 99 A CA 3.143 55.267 52.037 0.145 0.000 0.628 99 A CB -0.294 18.745 19.000 0.065 0.000 0.814 99 A HN 0.930 9.120 8.150 0.067 0.000 0.444 100 G N -1.815 107.078 108.800 0.155 0.000 2.418 100 G HA2 -0.361 3.741 3.960 0.162 0.000 0.217 100 G HA3 -0.361 3.678 3.960 0.132 0.000 0.217 100 G C 1.222 176.246 174.900 0.207 0.000 1.158 100 G CA 2.023 47.219 45.100 0.161 0.000 0.771 100 G HN 0.289 8.654 8.290 0.124 0.000 0.545 101 D N 2.821 123.352 120.400 0.219 0.000 2.097 101 D HA -0.230 4.619 4.640 0.348 0.000 0.195 101 D C 1.891 178.396 176.300 0.341 0.000 0.989 101 D CA 3.200 57.385 54.000 0.309 0.000 0.827 101 D CB -0.283 40.671 40.800 0.257 0.000 0.966 101 D HN -0.654 7.827 8.370 0.185 0.000 0.456 102 F N 1.280 121.330 119.950 0.166 0.000 2.095 102 F HA -0.364 4.248 4.527 0.142 0.000 0.298 102 F C 1.501 177.393 175.800 0.152 0.000 1.104 102 F CA 3.778 61.863 58.000 0.142 0.000 1.232 102 F CB 0.307 39.368 39.000 0.103 0.000 0.987 102 F HN -0.329 8.212 8.300 0.401 0.000 0.475 103 I N -0.727 120.000 120.570 0.261 0.000 2.163 103 I HA -0.564 3.704 4.170 0.163 0.000 0.243 103 I C 2.172 178.335 176.117 0.077 0.000 1.085 103 I CA 3.915 65.316 61.300 0.168 0.000 1.347 103 I CB -0.199 37.925 38.000 0.206 0.000 1.044 103 I HN -0.165 8.248 8.210 0.337 0.000 0.408 104 Q N -1.871 118.030 119.800 0.168 0.000 2.119 104 Q HA -0.299 4.129 4.340 0.146 0.000 0.201 104 Q C 2.537 178.598 176.000 0.102 0.000 0.972 104 Q CA 2.291 58.218 55.803 0.207 0.000 0.847 104 Q CB -0.446 28.500 28.738 0.347 0.000 0.903 104 Q HN -0.627 7.777 8.270 0.224 0.000 0.433 105 F N 1.958 121.752 119.950 -0.260 0.000 2.102 105 F HA -0.451 3.397 4.527 -1.130 0.000 0.298 105 F C 0.961 176.432 175.800 -0.549 0.000 1.105 105 F CA 3.035 60.552 58.000 -0.805 0.000 1.239 105 F CB -0.156 38.248 39.000 -0.993 0.000 0.991 105 F HN 0.061 8.446 8.300 0.143 0.000 0.474 106 A N -1.949 120.538 122.820 -0.554 0.000 1.933 106 A HA -0.354 3.652 4.320 -0.522 0.000 0.218 106 A C 2.158 179.645 177.584 -0.161 0.000 1.175 106 A CA 3.349 55.111 52.037 -0.458 0.000 0.628 106 A CB -1.040 17.636 19.000 -0.540 0.000 0.814 106 A HN 0.379 8.196 8.150 -0.555 0.000 0.444 107 G N -2.485 106.237 108.800 -0.129 0.000 2.418 107 G HA2 -0.398 3.538 3.960 -0.040 0.000 0.217 107 G HA3 -0.398 3.547 3.960 -0.026 0.000 0.217 107 G C 0.691 175.497 174.900 -0.156 0.000 1.158 107 G CA 1.619 46.675 45.100 -0.073 0.000 0.771 107 G HN -0.332 7.884 8.290 -0.123 0.000 0.545 108 A N 2.117 124.813 122.820 -0.207 0.000 1.898 108 A HA -0.327 3.894 4.320 -0.166 0.000 0.216 108 A C 2.023 179.410 177.584 -0.329 0.000 1.181 108 A CA 2.820 54.720 52.037 -0.229 0.000 0.620 108 A CB -0.361 18.527 19.000 -0.187 0.000 0.819 108 A HN -0.382 7.640 8.150 -0.212 0.000 0.442 109 V N -1.033 118.589 119.914 -0.486 0.000 2.287 109 V HA -0.504 3.369 4.120 -0.412 0.000 0.248 109 V C 2.588 178.457 176.094 -0.376 0.000 1.053 109 V CA 3.980 66.016 62.300 -0.439 0.000 1.027 109 V CB -0.250 31.252 31.823 -0.535 0.000 0.646 109 V HN 0.082 7.900 8.190 -0.619 0.000 0.447 110 G N -0.955 107.552 108.800 -0.489 0.000 2.421 110 G HA2 -0.320 2.833 3.960 -1.345 0.000 0.216 110 G HA3 -0.320 3.006 3.960 -1.056 0.000 0.216 110 G C 1.636 176.231 174.900 -0.508 0.000 1.171 110 G CA 2.115 46.667 45.100 -0.914 0.000 0.775 110 G HN -0.157 7.914 8.290 -0.366 0.000 0.543 111 V N 3.045 122.764 119.914 -0.325 0.000 2.392 111 V HA -0.451 3.532 4.120 -0.228 0.000 0.249 111 V C 2.087 178.036 176.094 -0.241 0.000 1.059 111 V CA 3.287 65.441 62.300 -0.243 0.000 1.051 111 V CB -0.194 31.527 31.823 -0.170 0.000 0.658 111 V HN -0.192 7.824 8.190 -0.289 0.000 0.455 112 S N -0.306 115.254 115.700 -0.233 0.000 2.474 112 S HA -0.269 4.106 4.470 -0.159 0.000 0.235 112 S C 1.060 175.566 174.600 -0.158 0.000 0.997 112 S CA 3.270 61.362 58.200 -0.179 0.000 0.949 112 S CB -0.742 62.358 63.200 -0.165 0.000 0.766 112 S HN -0.313 7.835 8.310 -0.253 0.011 0.517 113 N N 0.348 118.927 118.700 -0.201 0.000 2.494 113 N HA -0.042 4.624 4.740 -0.122 0.000 0.182 113 N C -0.619 174.822 175.510 -0.115 0.000 1.076 113 N CA 1.280 54.233 53.050 -0.161 0.000 0.908 113 N CB 0.610 38.963 38.487 -0.222 0.000 0.967 113 N HN -0.592 7.481 8.380 -0.263 0.149 0.449 114 c N 1.246 119.779 118.600 -0.111 0.000 2.325 114 c HA 0.344 4.892 4.570 -0.036 0.000 0.347 114 c C -2.028 172.059 174.090 -0.005 0.000 1.263 114 c CA -2.088 54.214 56.329 -0.045 0.000 1.806 114 c CB -1.592 40.904 42.510 -0.023 0.000 2.405 114 c HN -0.494 7.603 8.230 -0.139 0.049 0.537 115 P HA -0.364 4.221 4.420 0.018 -0.154 0.264 115 P C 0.426 177.773 177.300 0.077 0.000 1.183 115 P CA 1.507 64.625 63.100 0.031 0.000 0.763 115 P CB 0.051 31.765 31.700 0.023 0.000 0.807 116 G N 3.776 112.624 108.800 0.080 0.000 2.205 116 G HA2 -0.429 3.595 3.960 0.106 0.000 0.261 116 G HA3 -0.429 3.784 3.960 0.158 -0.159 0.261 116 G C -0.167 174.872 174.900 0.231 0.000 0.980 116 G CA 0.166 45.351 45.100 0.142 0.000 0.632 116 G HN 0.301 8.573 8.290 0.055 0.051 0.533 117 G N -0.032 108.828 108.800 0.100 0.000 2.611 117 G HA2 0.199 3.983 3.960 -0.293 0.000 0.273 117 G HA3 0.199 4.114 3.960 -0.186 -0.067 0.273 117 G C -1.769 173.074 174.900 -0.095 0.000 1.305 117 G CA -0.798 44.233 45.100 -0.115 0.000 1.010 117 G HN -0.309 7.947 8.290 0.057 0.068 0.509 118 V N -6.375 113.425 119.914 -0.190 0.000 3.102 118 V HA 0.412 4.505 4.120 -0.044 0.000 0.312 118 V C -1.198 174.839 176.094 -0.096 0.000 1.135 118 V CA -2.783 59.465 62.300 -0.087 0.000 1.022 118 V CB 3.476 35.283 31.823 -0.027 0.000 1.056 118 V HN -0.223 7.783 8.190 -0.306 0.000 0.436 119 R N 1.334 121.799 120.500 -0.059 0.000 2.205 119 R HA 0.146 4.435 4.340 -0.085 0.000 0.342 119 R C -0.394 175.878 176.300 -0.046 0.000 1.058 119 R CA -1.063 55.000 56.100 -0.061 0.000 0.904 119 R CB -0.427 29.848 30.300 -0.042 0.000 1.089 119 R HN 0.093 8.340 8.270 -0.038 0.000 0.471 120 I N 6.610 127.143 120.570 -0.061 0.000 2.533 120 I HA 0.000 4.137 4.170 -0.056 0.000 0.284 120 I C -1.432 174.694 176.117 0.015 0.000 1.109 120 I CA -1.931 59.341 61.300 -0.047 0.000 1.412 120 I CB -0.083 37.868 38.000 -0.083 0.000 1.396 120 I HN 0.140 8.301 8.210 -0.082 0.000 0.543 121 P HA -0.191 4.215 4.420 -0.024 0.000 0.263 121 P C -1.854 175.504 177.300 0.096 0.000 1.175 121 P CA 0.309 63.430 63.100 0.034 0.000 0.761 121 P CB 0.191 31.961 31.700 0.116 0.000 0.794 122 F N 3.894 123.731 119.950 -0.189 0.000 2.539 122 F HA 0.301 4.853 4.527 0.043 0.000 0.318 122 F C -2.615 172.977 175.800 -0.346 0.000 1.135 122 F CA -1.221 56.717 58.000 -0.103 0.000 0.915 122 F CB 3.698 42.690 39.000 -0.014 0.000 1.176 122 F HN -0.224 7.980 8.300 -0.161 0.000 0.440 123 F N 5.517 124.832 119.950 -1.058 0.000 2.495 123 F HA 0.613 4.996 4.527 -0.544 -0.182 0.327 123 F C -1.852 173.337 175.800 -1.019 0.000 1.103 123 F CA -1.843 55.697 58.000 -0.767 0.000 0.949 123 F CB 3.710 42.478 39.000 -0.388 0.000 1.142 123 F HN 0.160 7.974 8.300 -0.810 0.000 0.457 124 L N 1.317 122.295 121.223 -0.409 0.000 2.317 124 L HA 0.277 4.489 4.340 -0.213 0.000 0.281 124 L C -0.684 176.142 176.870 -0.072 0.000 1.024 124 L CA -0.992 53.725 54.840 -0.205 0.000 0.810 124 L CB 2.460 44.473 42.059 -0.078 0.000 1.240 124 L HN 0.447 8.523 8.230 -0.257 0.000 0.427 125 G N 4.027 112.810 108.800 -0.028 0.000 2.200 125 G HA2 -0.204 3.759 3.960 0.005 0.000 0.145 125 G HA3 -0.204 3.750 3.960 -0.010 0.000 0.145 125 G C -0.558 174.344 174.900 0.004 0.000 1.021 125 G CA -0.450 44.647 45.100 -0.005 0.000 0.720 125 G HN 0.436 9.230 8.290 -0.010 -0.510 0.494 126 R N 1.133 121.640 120.500 0.012 0.000 2.522 126 R HA -0.028 4.317 4.340 0.008 0.000 0.284 126 R C -2.037 174.284 176.300 0.035 0.000 1.032 126 R CA -1.213 54.900 56.100 0.022 0.000 1.049 126 R CB -0.194 30.132 30.300 0.042 0.000 0.956 126 R HN -0.323 8.379 8.270 0.015 -0.423 0.422 127 P HA -0.117 4.322 4.420 0.032 0.000 0.271 127 P C -0.911 176.418 177.300 0.048 0.000 1.233 127 P CA -0.428 62.694 63.100 0.037 0.000 0.789 127 P CB 0.480 32.200 31.700 0.034 0.000 0.951 128 D N -0.027 120.399 120.400 0.044 0.000 2.423 128 D HA -0.250 4.415 4.640 0.041 0.000 0.238 128 D C 0.469 176.813 176.300 0.073 0.000 1.142 128 D CA 0.516 54.542 54.000 0.043 0.000 0.884 128 D CB 0.133 40.944 40.800 0.019 0.000 1.199 128 D HN 0.002 8.394 8.370 0.037 0.000 0.438 129 A N 2.394 125.270 122.820 0.093 0.000 2.520 129 A HA -0.116 4.310 4.320 0.177 0.000 0.235 129 A C -0.165 177.580 177.584 0.268 0.000 1.065 129 A CA 0.899 53.052 52.037 0.192 0.000 0.764 129 A CB 0.661 19.821 19.000 0.267 0.000 1.002 129 A HN 0.538 8.727 8.150 0.065 0.000 0.502 130 V N -2.501 117.581 119.914 0.280 0.000 3.432 130 V HA 0.244 4.547 4.120 0.305 0.000 0.298 130 V C -0.724 175.468 176.094 0.164 0.000 1.464 130 V CA -0.049 62.399 62.300 0.247 0.000 1.046 130 V CB 0.466 32.368 31.823 0.131 0.000 0.887 130 V HN 0.579 8.909 8.190 0.234 0.000 0.441 131 A N 0.270 123.140 122.820 0.083 0.000 2.594 131 A HA 0.157 4.174 4.320 -0.504 0.000 0.295 131 A C -1.989 175.326 177.584 -0.449 0.000 1.071 131 A CA -0.518 51.346 52.037 -0.287 0.000 0.685 131 A CB 2.372 21.304 19.000 -0.114 0.000 1.285 131 A HN -0.619 7.660 8.150 0.215 0.000 0.405 132 A N 0.466 122.821 122.820 -0.775 0.000 2.371 132 A HA -0.014 4.222 4.320 -0.141 0.000 0.257 132 A C 0.535 178.100 177.584 -0.032 0.000 1.089 132 A CA -0.423 51.412 52.037 -0.336 0.000 0.794 132 A CB 0.889 19.705 19.000 -0.307 0.000 1.029 132 A HN 0.187 7.801 8.150 -0.894 0.000 0.488 133 S N 3.098 118.870 115.700 0.119 0.000 2.558 133 S HA -0.023 4.520 4.470 0.121 0.000 0.288 133 S C -1.278 173.450 174.600 0.213 0.000 1.318 133 S CA -0.883 57.421 58.200 0.173 0.000 1.056 133 S CB 0.057 63.406 63.200 0.248 0.000 0.853 133 S HN -0.109 8.627 8.310 0.153 -0.335 0.505 134 P HA -0.022 4.403 4.420 0.008 0.000 0.269 134 P C -1.436 175.730 177.300 -0.224 0.000 1.217 134 P CA -0.252 62.842 63.100 -0.009 0.000 0.783 134 P CB 0.580 32.259 31.700 -0.035 0.000 0.898 135 D N -1.245 118.757 120.400 -0.663 0.000 2.371 135 D HA -0.118 3.401 4.640 -1.868 0.000 0.242 135 D C -0.147 175.844 176.300 -0.514 0.000 1.218 135 D CA -0.507 52.732 54.000 -1.268 0.000 0.945 135 D CB 0.433 40.378 40.800 -1.425 0.000 1.137 135 D HN -0.027 8.043 8.370 -0.500 0.000 0.464 136 H N -4.020 114.834 119.070 -0.359 0.000 2.936 136 H HA -0.320 4.156 4.556 -0.134 0.000 0.276 136 H C -1.120 174.137 175.328 -0.119 0.000 1.216 136 H CA 1.199 57.143 56.048 -0.172 0.000 1.132 136 H CB -2.366 27.318 29.762 -0.130 0.000 1.303 136 H HN 0.449 8.254 8.280 -0.793 0.000 0.370 137 L N -4.894 116.292 121.223 -0.061 0.000 2.609 137 L HA 0.110 4.448 4.340 -0.003 0.000 0.230 137 L C -0.686 176.142 176.870 -0.070 0.000 1.087 137 L CA 0.180 55.000 54.840 -0.033 0.000 0.874 137 L CB 1.459 43.507 42.059 -0.018 0.000 1.114 137 L HN -0.118 8.008 8.230 -0.128 0.027 0.488 138 V N -0.369 119.473 119.914 -0.119 0.000 2.383 138 V HA 0.149 4.078 4.120 -0.318 0.000 0.275 138 V C -1.988 174.044 176.094 -0.104 0.000 1.036 138 V CA -2.060 60.103 62.300 -0.228 0.000 0.889 138 V CB 0.712 32.323 31.823 -0.354 0.000 0.985 138 V HN -0.307 7.821 8.190 -0.104 0.000 0.459 139 P HA -0.058 4.479 4.420 -0.013 -0.125 0.267 139 P C -1.099 176.179 177.300 -0.037 0.000 1.200 139 P CA 0.066 63.175 63.100 0.014 0.000 0.772 139 P CB 0.657 32.430 31.700 0.122 0.000 0.855 140 E N 0.263 120.354 120.200 -0.182 0.000 2.263 140 E HA 0.288 4.515 4.350 -0.204 0.000 0.264 140 E C -0.530 175.837 176.600 -0.389 0.000 0.923 140 E CA -2.746 53.422 56.400 -0.387 0.000 0.802 140 E CB 1.512 30.665 29.700 -0.913 0.000 1.228 140 E HN -0.120 8.446 8.360 -0.205 -0.329 0.417 141 P HA 0.078 4.489 4.420 -0.015 0.000 0.233 141 P C -0.832 176.467 177.300 -0.002 0.000 1.167 141 P CA 1.428 64.496 63.100 -0.054 0.000 0.770 141 P CB 0.238 31.986 31.700 0.081 0.000 0.837 142 F N -6.630 113.367 119.950 0.079 0.000 2.693 142 F HA 0.233 4.790 4.527 0.051 0.000 0.303 142 F C -0.973 174.859 175.800 0.054 0.000 1.097 142 F CA -2.171 55.864 58.000 0.058 0.000 1.330 142 F CB -0.596 38.436 39.000 0.053 0.000 1.067 142 F HN -0.511 7.267 8.300 -0.804 0.039 0.565 143 D N 2.485 122.826 120.400 -0.098 0.000 2.304 143 D HA 0.189 4.874 4.640 0.074 0.000 0.247 143 D C -0.454 175.869 176.300 0.038 0.000 1.089 143 D CA 0.143 54.139 54.000 -0.006 0.000 0.910 143 D CB 0.883 41.638 40.800 -0.075 0.000 1.199 143 D HN -0.472 7.588 8.370 -0.258 0.156 0.426 144 S N -1.460 114.272 115.700 0.053 0.000 2.589 144 S HA -0.003 4.495 4.470 0.046 0.000 0.265 144 S C 1.495 176.115 174.600 0.032 0.000 1.342 144 S CA -0.486 57.741 58.200 0.044 0.000 1.005 144 S CB 2.053 65.278 63.200 0.043 0.000 0.909 144 S HN -0.003 8.343 8.310 0.061 0.000 0.555 145 V N 2.096 122.025 119.914 0.026 0.000 2.332 145 V HA -0.447 3.688 4.120 0.025 0.000 0.248 145 V C 1.573 177.687 176.094 0.032 0.000 1.055 145 V CA 4.227 66.541 62.300 0.023 0.000 1.038 145 V CB -0.048 31.780 31.823 0.008 0.000 0.651 145 V HN 0.632 8.836 8.190 0.023 0.000 0.450 146 D N -1.318 119.099 120.400 0.030 0.000 2.104 146 D HA -0.367 4.292 4.640 0.033 0.000 0.194 146 D C 2.350 178.672 176.300 0.037 0.000 0.994 146 D CA 3.427 57.446 54.000 0.032 0.000 0.830 146 D CB -0.633 40.183 40.800 0.026 0.000 0.959 146 D HN -0.216 8.170 8.370 0.027 0.000 0.452 147 S N 0.616 116.337 115.700 0.036 0.000 2.356 147 S HA -0.193 4.298 4.470 0.035 0.000 0.223 147 S C 2.146 176.773 174.600 0.046 0.000 1.032 147 S CA 3.240 61.462 58.200 0.037 0.000 1.005 147 S CB -0.348 62.873 63.200 0.035 0.000 0.867 147 S HN -0.403 7.928 8.310 0.035 0.000 0.449 148 I N 2.228 122.826 120.570 0.047 0.000 2.179 148 I HA -0.534 3.676 4.170 0.068 0.000 0.242 148 I C 1.770 177.937 176.117 0.084 0.000 1.088 148 I CA 4.384 65.722 61.300 0.064 0.000 1.357 148 I CB -0.043 37.991 38.000 0.057 0.000 1.051 148 I HN -0.161 8.073 8.210 0.041 0.000 0.409 149 L N -1.687 119.580 121.223 0.075 0.000 2.093 149 L HA -0.405 3.997 4.340 0.103 0.000 0.208 149 L C 2.375 179.298 176.870 0.089 0.000 1.085 149 L CA 2.956 57.848 54.840 0.087 0.000 0.755 149 L CB -0.883 41.219 42.059 0.072 0.000 0.904 149 L HN 0.021 8.288 8.230 0.063 0.000 0.435 150 A N -0.912 121.949 122.820 0.069 0.000 1.898 150 A HA -0.285 4.070 4.320 0.059 0.000 0.216 150 A C 1.911 179.539 177.584 0.074 0.000 1.181 150 A CA 3.102 55.175 52.037 0.061 0.000 0.620 150 A CB -0.838 18.186 19.000 0.041 0.000 0.819 150 A HN 0.006 8.193 8.150 0.060 0.000 0.442 151 R N -0.647 119.902 120.500 0.083 0.000 2.062 151 R HA -0.224 4.161 4.340 0.075 0.000 0.231 151 R C 2.421 178.814 176.300 0.156 0.000 1.136 151 R CA 2.523 58.681 56.100 0.096 0.000 0.948 151 R CB -0.395 29.957 30.300 0.087 0.000 0.845 151 R HN -0.370 7.946 8.270 0.078 0.000 0.430 152 M N -2.353 117.365 119.600 0.197 0.000 2.159 152 M HA -0.281 4.437 4.480 0.397 0.000 0.263 152 M C 2.271 178.759 176.300 0.313 0.000 1.063 152 M CA 2.254 57.744 55.300 0.316 0.000 1.110 152 M CB -0.938 31.824 32.600 0.270 0.000 1.374 152 M HN 0.038 8.430 8.290 0.169 0.000 0.411 153 G N -1.028 107.888 108.800 0.193 0.000 2.422 153 G HA2 -0.389 3.846 3.960 0.144 0.000 0.218 153 G HA3 -0.389 3.634 3.960 0.105 0.000 0.218 153 G C 0.774 175.727 174.900 0.088 0.000 1.146 153 G CA 1.849 47.029 45.100 0.133 0.000 0.769 153 G HN 0.122 8.510 8.290 0.163 0.000 0.547 154 D N 2.065 122.515 120.400 0.084 0.000 2.149 154 D HA -0.300 4.351 4.640 0.019 0.000 0.198 154 D C 1.406 177.739 176.300 0.054 0.000 0.990 154 D CA 2.701 56.727 54.000 0.043 0.000 0.839 154 D CB -0.161 40.656 40.800 0.028 0.000 0.948 154 D HN -0.420 8.005 8.370 0.093 0.000 0.460 155 A N -4.907 117.995 122.820 0.137 0.000 2.167 155 A HA -0.010 4.498 4.320 0.314 0.000 0.214 155 A C -0.397 177.203 177.584 0.027 0.000 1.151 155 A CA 0.255 52.430 52.037 0.231 0.000 0.735 155 A CB 0.449 19.668 19.000 0.364 0.000 0.802 155 A HN -0.666 7.579 8.150 0.174 0.010 0.467 156 G N -5.144 103.604 108.800 -0.088 0.000 2.183 156 G HA2 -0.171 3.720 3.960 -0.114 0.000 0.168 156 G HA3 -0.171 3.588 3.960 -0.335 0.000 0.168 156 G C -1.427 173.266 174.900 -0.345 0.000 1.008 156 G CA -0.331 44.621 45.100 -0.246 0.000 0.677 156 G HN -0.542 7.582 8.290 0.007 0.170 0.498 157 F N 0.979 120.978 119.950 0.083 0.000 2.420 157 F HA 0.619 5.378 4.527 0.054 -0.199 0.342 157 F C 0.047 175.882 175.800 0.059 0.000 1.113 157 F CA -1.801 56.239 58.000 0.066 0.000 1.059 157 F CB 2.095 41.140 39.000 0.076 0.000 1.128 157 F HN -0.334 8.028 8.300 0.103 0.000 0.475 158 S N 3.577 119.414 115.700 0.229 0.000 2.624 158 S HA 0.325 4.870 4.470 0.125 0.000 0.263 158 S C -0.468 174.222 174.600 0.150 0.000 1.287 158 S CA -1.275 57.015 58.200 0.149 0.000 0.990 158 S CB -0.008 63.255 63.200 0.106 0.000 0.950 158 S HN 0.328 9.089 8.310 0.223 -0.317 0.561 159 P HA -0.101 4.386 4.420 0.112 0.000 0.216 159 P C 1.381 178.743 177.300 0.103 0.000 1.150 159 P CA 2.613 65.776 63.100 0.105 0.000 0.837 159 P CB -0.052 31.698 31.700 0.085 0.000 0.786 160 V N -2.935 117.031 119.914 0.088 0.000 2.332 160 V HA -0.571 3.591 4.120 0.069 0.000 0.248 160 V C 1.711 177.848 176.094 0.073 0.000 1.055 160 V CA 4.109 66.452 62.300 0.072 0.000 1.038 160 V CB -0.294 31.561 31.823 0.053 0.000 0.651 160 V HN -0.088 8.152 8.190 0.082 0.000 0.450 161 E N -0.358 119.902 120.200 0.101 0.000 2.106 161 E HA -0.287 4.113 4.350 0.083 0.000 0.192 161 E C 2.767 179.378 176.600 0.018 0.000 0.984 161 E CA 2.898 59.360 56.400 0.104 0.000 0.806 161 E CB -0.084 29.765 29.700 0.248 0.000 0.750 161 E HN -0.736 7.696 8.360 0.120 0.000 0.458 162 V N 0.329 120.264 119.914 0.035 0.000 2.295 162 V HA -0.571 3.462 4.120 -0.144 0.000 0.246 162 V C 1.695 177.803 176.094 0.024 0.000 1.049 162 V CA 4.398 66.684 62.300 -0.023 0.000 1.024 162 V CB -0.174 31.678 31.823 0.049 0.000 0.648 162 V HN -0.464 7.694 8.190 0.087 0.083 0.447 163 V N -0.505 119.472 119.914 0.105 0.000 2.332 163 V HA -0.623 3.639 4.120 0.235 0.000 0.248 163 V C 1.657 177.784 176.094 0.055 0.000 1.055 163 V CA 4.380 66.767 62.300 0.144 0.000 1.038 163 V CB -0.320 31.602 31.823 0.166 0.000 0.651 163 V HN -0.609 7.648 8.190 0.113 0.000 0.450 164 S N -0.500 115.219 115.700 0.031 0.000 2.359 164 S HA -0.346 4.147 4.470 0.038 0.000 0.224 164 S C 2.519 177.226 174.600 0.179 0.000 1.035 164 S CA 3.712 61.954 58.200 0.070 0.000 1.018 164 S CB 0.060 63.300 63.200 0.066 0.000 0.876 164 S HN -0.678 7.650 8.310 0.030 0.000 0.448 165 L N 1.566 122.824 121.223 0.058 0.000 2.131 165 L HA -0.260 4.202 4.340 0.203 0.000 0.210 165 L C 1.731 178.617 176.870 0.027 0.000 1.092 165 L CA 2.718 57.582 54.840 0.040 0.000 0.759 165 L CB -0.039 41.853 42.059 -0.279 0.000 0.903 165 L HN -0.290 7.926 8.230 -0.024 0.000 0.435 166 L N -3.055 118.113 121.223 -0.090 0.000 2.622 166 L HA -0.120 3.918 4.340 -0.503 0.000 0.233 166 L C 1.912 178.578 176.870 -0.340 0.000 1.156 166 L CA 0.946 55.605 54.840 -0.301 0.000 0.866 166 L CB -0.970 40.970 42.059 -0.198 0.000 0.980 166 L HN -0.383 7.715 8.230 -0.045 0.105 0.448 167 A N 0.330 123.124 122.820 -0.044 0.000 2.076 167 A HA -0.334 3.845 4.320 -0.234 0.000 0.220 167 A C 1.625 178.944 177.584 -0.442 0.000 1.160 167 A CA 2.732 54.643 52.037 -0.209 0.000 0.653 167 A CB -0.733 18.184 19.000 -0.138 0.000 0.801 167 A HN -0.382 7.803 8.150 0.122 0.038 0.455 168 S N -0.365 115.149 115.700 -0.310 0.000 2.402 168 S HA -0.372 4.003 4.470 -0.158 0.000 0.233 168 S C 2.062 176.569 174.600 -0.155 0.000 1.030 168 S CA 3.530 61.645 58.200 -0.142 0.000 1.003 168 S CB -0.502 62.759 63.200 0.102 0.000 0.813 168 S HN -0.354 7.850 8.310 -0.143 0.021 0.477 169 H N 1.369 120.061 119.070 -0.629 0.000 2.559 169 H HA -0.068 4.305 4.556 -0.306 0.000 0.273 169 H C 1.030 175.896 175.328 -0.770 0.000 1.000 169 H CA 0.678 56.260 56.048 -0.776 0.000 1.195 169 H CB -0.312 28.590 29.762 -1.433 0.000 1.368 169 H HN -0.338 7.463 8.280 -0.588 0.127 0.592 170 S N -1.881 113.490 115.700 -0.549 0.000 2.481 170 S HA -0.177 4.318 4.470 -0.215 -0.155 0.231 170 S C -0.161 174.315 174.600 -0.207 0.000 0.996 170 S CA 1.996 60.008 58.200 -0.313 0.000 0.942 170 S CB 0.616 63.580 63.200 -0.394 0.000 0.768 170 S HN -0.453 7.347 8.310 -0.589 0.157 0.520 171 I N -7.575 112.862 120.570 -0.222 0.000 2.925 171 I HA 0.559 4.711 4.170 -0.310 -0.168 0.296 171 I C -2.531 173.178 176.117 -0.681 0.000 1.413 171 I CA -1.234 59.888 61.300 -0.296 0.000 0.932 171 I CB 0.308 38.296 38.000 -0.019 0.000 1.873 171 I HN -0.713 7.321 8.210 -0.221 0.044 0.619 172 A N 1.361 123.721 122.820 -0.767 0.000 2.594 172 A HA 0.394 4.293 4.320 -0.703 0.000 0.296 172 A C -2.716 174.376 177.584 -0.819 0.000 1.061 172 A CA 0.131 51.758 52.037 -0.684 0.000 0.689 172 A CB 2.887 21.685 19.000 -0.337 0.000 1.280 172 A HN -0.277 7.483 8.150 -0.650 0.000 0.406 173 A N -0.003 122.347 122.820 -0.782 0.000 2.564 173 A HA 0.695 4.448 4.320 -1.103 -0.095 0.288 173 A C -2.044 175.110 177.584 -0.716 0.000 1.164 173 A CA -1.133 50.418 52.037 -0.810 0.000 0.712 173 A CB 3.587 22.374 19.000 -0.355 0.000 1.303 173 A HN 0.240 8.046 8.150 -0.574 0.000 0.418 174 A N -1.386 121.139 122.820 -0.491 0.000 2.343 174 A HA 0.413 4.663 4.320 -0.117 0.000 0.316 174 A C -1.332 176.215 177.584 -0.061 0.000 1.104 174 A CA -1.068 50.870 52.037 -0.165 0.000 0.768 174 A CB 2.106 21.124 19.000 0.029 0.000 1.213 174 A HN 0.051 7.935 8.150 -0.443 0.000 0.456 175 D N 2.642 123.037 120.400 -0.009 0.000 2.422 175 D HA 0.053 4.695 4.640 0.004 0.000 0.218 175 D C 0.573 176.897 176.300 0.040 0.000 1.047 175 D CA 2.208 56.215 54.000 0.012 0.000 0.885 175 D CB 1.583 42.389 40.800 0.011 0.000 1.035 175 D HN 0.353 8.725 8.370 0.004 0.000 0.502 176 K N -0.672 119.766 120.400 0.064 0.000 2.370 176 K HA 0.188 4.547 4.320 0.065 0.000 0.194 176 K C 1.413 178.072 176.600 0.098 0.000 1.070 176 K CA 0.578 56.913 56.287 0.078 0.000 0.998 176 K CB -0.213 32.341 32.500 0.090 0.000 0.911 176 K HN -0.021 8.272 8.250 0.072 0.000 0.533 177 V N -1.129 118.857 119.914 0.120 0.000 2.295 177 V HA -0.310 3.900 4.120 0.151 0.000 0.246 177 V C 0.043 176.200 176.094 0.105 0.000 1.049 177 V CA 2.514 64.898 62.300 0.140 0.000 1.024 177 V CB 0.130 32.063 31.823 0.183 0.000 0.648 177 V HN -0.440 7.824 8.190 0.123 0.000 0.447 178 D N -3.839 116.615 120.400 0.090 0.000 2.389 178 D HA 0.378 5.049 4.640 0.052 0.000 0.256 178 D C -1.214 175.116 176.300 0.050 0.000 1.239 178 D CA -2.890 51.149 54.000 0.064 0.000 0.925 178 D CB 0.871 41.714 40.800 0.072 0.000 1.145 178 D HN -0.427 7.999 8.370 0.092 0.000 0.542 179 P HA 0.118 4.732 4.420 0.036 -0.172 0.234 179 P C 0.264 177.581 177.300 0.027 0.000 1.167 179 P CA 0.432 63.552 63.100 0.034 0.000 0.763 179 P CB 0.477 32.197 31.700 0.032 0.000 0.835 180 S N -0.184 115.533 115.700 0.027 0.000 2.489 180 S HA -0.073 4.410 4.470 0.021 0.000 0.228 180 S C 1.196 175.813 174.600 0.027 0.000 0.995 180 S CA 1.561 59.776 58.200 0.024 0.000 0.934 180 S CB 1.008 64.221 63.200 0.021 0.000 0.771 180 S HN -0.215 8.349 8.310 0.028 -0.237 0.522 181 I N -3.764 116.825 120.570 0.032 0.000 2.953 181 I HA 0.552 4.738 4.170 0.026 0.000 0.325 181 I C -2.576 173.554 176.117 0.022 0.000 1.421 181 I CA -3.148 58.170 61.300 0.031 0.000 0.845 181 I CB 0.424 38.450 38.000 0.043 0.000 2.186 181 I HN -0.493 7.699 8.210 0.035 0.039 0.604 182 P HA -0.049 4.375 4.420 0.008 0.000 0.269 182 P C 0.948 178.244 177.300 -0.006 0.000 1.209 182 P CA 0.861 63.965 63.100 0.007 0.000 0.776 182 P CB -0.008 31.699 31.700 0.011 0.000 0.876 183 G N 2.272 111.056 108.800 -0.028 0.000 2.136 183 G HA2 -0.417 3.572 3.960 -0.054 0.000 0.242 183 G HA3 -0.417 3.530 3.960 -0.022 0.000 0.242 183 G C -0.220 174.642 174.900 -0.064 0.000 0.989 183 G CA -0.024 45.050 45.100 -0.042 0.000 0.682 183 G HN 0.076 8.500 8.290 -0.035 -0.154 0.522 184 T N 3.890 118.401 114.554 -0.071 0.000 2.794 184 T HA 0.368 4.690 4.350 -0.047 0.000 0.296 184 T C -1.756 172.843 174.700 -0.168 0.000 0.949 184 T CA -1.141 60.919 62.100 -0.067 0.000 1.101 184 T CB 0.385 69.249 68.868 -0.007 0.000 0.905 184 T HN -0.600 7.574 8.240 -0.059 0.030 0.516 185 P HA 0.382 4.676 4.420 -0.454 -0.146 0.276 185 P C 0.029 177.249 177.300 -0.134 0.000 1.252 185 P CA -0.824 62.119 63.100 -0.261 0.000 0.802 185 P CB 1.237 32.847 31.700 -0.150 0.000 1.035 186 F N -3.511 116.391 119.950 -0.080 0.000 2.664 186 F HA 0.339 5.086 4.527 0.039 -0.197 0.296 186 F C 0.257 176.112 175.800 0.093 0.000 1.125 186 F CA 0.144 58.150 58.000 0.010 0.000 1.444 186 F CB 0.500 39.472 39.000 -0.047 0.000 1.114 186 F HN 0.047 8.147 8.300 -0.334 0.000 0.576 187 D N -5.771 114.728 120.400 0.164 0.000 2.592 187 D HA 0.283 5.272 4.640 0.094 -0.292 0.263 187 D C 0.090 176.398 176.300 0.013 0.000 1.132 187 D CA -2.494 51.561 54.000 0.092 0.000 0.996 187 D CB 2.559 43.419 40.800 0.100 0.000 1.442 187 D HN -0.746 7.665 8.370 0.068 0.000 0.486 188 S N -2.999 112.694 115.700 -0.012 0.000 2.561 188 S HA -0.039 4.428 4.470 -0.005 0.000 0.225 188 S C 0.403 175.007 174.600 0.005 0.000 0.977 188 S CA 1.859 60.053 58.200 -0.009 0.000 0.926 188 S CB 0.421 63.609 63.200 -0.020 0.000 0.769 188 S HN 0.014 8.521 8.310 -0.030 -0.215 0.533 189 T N -0.635 113.917 114.554 -0.004 0.000 3.585 189 T HA 0.543 4.902 4.350 0.015 0.000 0.252 189 T C -1.391 173.299 174.700 -0.017 0.000 1.382 189 T CA -3.003 59.100 62.100 0.004 0.000 1.584 189 T CB 0.267 69.145 68.868 0.018 0.000 0.892 189 T HN -0.292 8.163 8.240 -0.013 -0.223 0.671 190 P HA 0.270 4.753 4.420 -0.153 -0.155 0.234 190 P C 0.276 177.603 177.300 0.045 0.000 1.167 190 P CA 1.189 64.240 63.100 -0.083 0.000 0.763 190 P CB -0.010 31.622 31.700 -0.114 0.000 0.835 191 G N -3.270 105.573 108.800 0.072 0.000 3.284 191 G HA2 0.102 4.284 3.960 0.151 0.000 0.236 191 G HA3 0.102 4.101 3.960 0.064 0.000 0.236 191 G C -1.645 173.290 174.900 0.059 0.000 1.158 191 G CA -0.383 44.771 45.100 0.090 0.000 0.774 191 G HN -0.038 8.243 8.290 0.046 0.036 0.545 192 V N -0.796 119.147 119.914 0.047 0.000 2.577 192 V HA 0.234 4.496 4.120 0.064 -0.103 0.303 192 V C -1.982 174.146 176.094 0.056 0.000 1.042 192 V CA -1.425 60.905 62.300 0.050 0.000 0.872 192 V CB 2.747 34.588 31.823 0.030 0.000 0.998 192 V HN -0.525 7.624 8.190 0.032 0.060 0.423 193 F N 9.935 129.844 119.950 -0.069 0.000 2.464 193 F HA 0.003 4.445 4.527 -0.142 0.000 0.353 193 F C -2.370 173.386 175.800 -0.074 0.000 1.191 193 F CA -0.718 57.217 58.000 -0.109 0.000 1.147 193 F CB -0.161 38.760 39.000 -0.131 0.000 1.294 193 F HN 0.405 8.833 8.300 0.215 0.000 0.583 194 D N 4.049 124.215 120.400 -0.391 0.000 2.664 194 D HA 0.455 5.159 4.640 -0.243 -0.211 0.292 194 D C 0.134 176.293 176.300 -0.235 0.000 1.214 194 D CA -1.760 52.090 54.000 -0.250 0.000 0.932 194 D CB 2.640 43.387 40.800 -0.088 0.000 1.420 194 D HN -0.249 7.875 8.370 -0.411 0.000 0.471 195 S N -3.363 112.274 115.700 -0.104 0.000 2.631 195 S HA -0.109 4.440 4.470 0.131 0.000 0.217 195 S C 1.482 176.094 174.600 0.019 0.000 0.958 195 S CA 0.523 58.734 58.200 0.019 0.000 0.920 195 S CB -1.117 62.077 63.200 -0.011 0.000 0.776 195 S HN 0.410 8.667 8.310 -0.088 0.000 0.517 196 Q N 3.075 122.846 119.800 -0.048 0.000 2.135 196 Q HA -0.304 3.970 4.340 -0.111 0.000 0.204 196 Q C 1.703 177.663 176.000 -0.065 0.000 0.981 196 Q CA 2.972 58.726 55.803 -0.082 0.000 0.856 196 Q CB -0.951 27.726 28.738 -0.101 0.000 0.902 196 Q HN -0.722 7.630 8.270 -0.064 -0.121 0.425 197 F N 1.029 120.833 119.950 -0.243 0.000 2.126 197 F HA -0.301 4.101 4.527 -0.207 0.000 0.299 197 F C 1.437 177.036 175.800 -0.335 0.000 1.096 197 F CA 3.190 60.988 58.000 -0.336 0.000 1.255 197 F CB -0.375 38.291 39.000 -0.556 0.000 0.997 197 F HN -0.578 7.815 8.300 0.016 -0.083 0.479 198 F N -3.330 116.425 119.950 -0.326 0.000 2.325 198 F HA -0.246 3.924 4.527 -0.594 0.000 0.299 198 F C 2.136 177.895 175.800 -0.069 0.000 1.090 198 F CA 3.173 60.932 58.000 -0.402 0.000 1.392 198 F CB -0.059 38.660 39.000 -0.468 0.000 1.053 198 F HN -0.785 7.372 8.300 -0.240 0.000 0.521 199 I N -0.972 119.653 120.570 0.093 0.000 2.193 199 I HA -0.494 3.879 4.170 0.338 0.000 0.240 199 I C 2.152 178.271 176.117 0.003 0.000 1.084 199 I CA 3.888 65.274 61.300 0.143 0.000 1.365 199 I CB -0.123 37.914 38.000 0.062 0.000 1.064 199 I HN -0.585 7.650 8.210 0.041 0.000 0.410 200 E N -1.234 118.905 120.200 -0.102 0.000 2.208 200 E HA -0.287 3.967 4.350 -0.159 0.000 0.193 200 E C 2.473 178.998 176.600 -0.125 0.000 0.988 200 E CA 3.071 59.388 56.400 -0.139 0.000 0.828 200 E CB 0.062 29.676 29.700 -0.142 0.000 0.763 200 E HN 0.055 8.343 8.360 -0.121 0.000 0.478 201 T N -2.538 111.916 114.554 -0.165 0.000 3.007 201 T HA -0.290 3.981 4.350 -0.132 0.000 0.270 201 T C 1.170 175.789 174.700 -0.135 0.000 1.107 201 T CA 3.484 65.490 62.100 -0.156 0.000 1.118 201 T CB -0.432 68.295 68.868 -0.236 0.000 0.889 201 T HN -0.329 7.769 8.240 -0.236 0.000 0.506 202 Q N 1.167 120.922 119.800 -0.074 0.000 2.424 202 Q HA 0.024 4.261 4.340 -0.172 0.000 0.204 202 Q C -0.500 175.394 176.000 -0.178 0.000 0.933 202 Q CA 0.056 55.786 55.803 -0.123 0.000 0.929 202 Q CB 0.235 28.952 28.738 -0.035 0.000 1.037 202 Q HN -0.596 7.508 8.270 -0.027 0.150 0.511 203 L N -0.357 120.786 121.223 -0.133 0.000 2.452 203 L HA -0.012 4.427 4.340 -0.097 -0.157 0.267 203 L C 0.627 177.467 176.870 -0.049 0.000 1.188 203 L CA 0.070 54.864 54.840 -0.076 0.000 0.821 203 L CB 0.299 42.353 42.059 -0.009 0.000 1.102 203 L HN -0.774 7.349 8.230 -0.116 0.037 0.470 204 K N 0.808 121.195 120.400 -0.021 0.000 2.484 204 K HA -0.065 4.547 4.320 -0.032 -0.311 0.280 204 K C 0.853 177.459 176.600 0.011 0.000 1.013 204 K CA 0.804 57.081 56.287 -0.016 0.000 1.029 204 K CB 0.068 32.553 32.500 -0.026 0.000 0.902 204 K HN -0.084 8.157 8.250 -0.015 0.000 0.481 205 G N 1.515 110.316 108.800 0.001 0.000 2.491 205 G HA2 -0.076 3.871 3.960 -0.022 0.000 0.242 205 G HA3 -0.076 3.852 3.960 -0.053 0.000 0.242 205 G C -0.848 174.016 174.900 -0.060 0.000 1.266 205 G CA -0.164 44.917 45.100 -0.032 0.000 0.844 205 G HN 0.396 8.696 8.290 0.017 0.000 0.571 206 R N 1.605 122.058 120.500 -0.078 0.000 2.470 206 R HA 0.257 4.556 4.340 -0.069 0.000 0.210 206 R C -0.659 175.573 176.300 -0.114 0.000 0.873 206 R CA 0.285 56.343 56.100 -0.071 0.000 1.015 206 R CB 2.167 32.460 30.300 -0.012 0.000 1.348 206 R HN 0.376 8.485 8.270 -0.083 0.111 0.650 207 L N -6.581 114.534 121.223 -0.179 0.000 2.671 207 L HA 0.373 4.634 4.340 -0.131 0.000 0.259 207 L C -2.257 174.437 176.870 -0.292 0.000 1.021 207 L CA -0.596 54.152 54.840 -0.153 0.000 0.871 207 L CB 2.657 44.703 42.059 -0.021 0.000 1.472 207 L HN -0.620 7.486 8.230 -0.207 0.000 0.410 208 F N -0.404 119.567 119.950 0.035 0.000 2.415 208 F HA 0.502 5.056 4.527 0.044 0.000 0.348 208 F C -0.367 175.456 175.800 0.039 0.000 1.119 208 F CA -2.502 55.521 58.000 0.038 0.000 1.069 208 F CB 0.712 39.730 39.000 0.030 0.000 1.124 208 F HN 0.158 8.552 8.300 0.157 0.000 0.472 209 P HA -0.054 4.429 4.420 0.106 0.000 0.225 209 P C -0.857 176.514 177.300 0.119 0.000 1.156 209 P CA 0.396 63.574 63.100 0.130 0.000 0.787 209 P CB 0.834 32.599 31.700 0.108 0.000 0.802 210 G N -0.536 108.347 108.800 0.139 0.000 3.267 210 G HA2 0.462 4.467 3.960 0.074 0.000 0.200 210 G HA3 0.462 4.646 3.960 0.077 -0.178 0.200 210 G C -1.319 173.628 174.900 0.077 0.000 1.603 210 G CA -0.687 44.467 45.100 0.090 0.000 0.753 210 G HN -0.236 8.136 8.290 0.181 0.027 0.755 211 T N -1.401 113.168 114.554 0.026 0.000 2.847 211 T HA 0.184 4.519 4.350 -0.024 0.000 0.279 211 T C 0.090 174.674 174.700 -0.193 0.000 0.984 211 T CA -1.277 60.797 62.100 -0.044 0.000 0.988 211 T CB 2.102 70.937 68.868 -0.055 0.000 1.040 211 T HN -0.272 8.233 8.240 0.023 -0.252 0.528 212 A N -1.426 121.199 122.820 -0.325 0.000 2.348 212 A HA 0.221 3.655 4.320 -1.476 0.000 0.224 212 A C -0.581 176.520 177.584 -0.805 0.000 1.227 212 A CA 0.728 52.279 52.037 -0.810 0.000 0.885 212 A CB 0.101 18.856 19.000 -0.408 0.000 0.933 212 A HN 0.399 8.416 8.150 -0.222 0.000 0.506 213 D N -2.296 117.851 120.400 -0.422 0.000 2.804 213 D HA 0.140 4.595 4.640 -0.309 0.000 0.308 213 D C -1.564 174.631 176.300 -0.175 0.000 1.371 213 D CA -0.525 53.311 54.000 -0.273 0.000 0.823 213 D CB 0.346 41.045 40.800 -0.168 0.000 1.126 213 D HN -0.068 8.110 8.370 -0.319 0.000 0.467 214 N N 0.576 119.173 118.700 -0.172 0.000 2.472 214 N HA 0.045 4.755 4.740 -0.051 0.000 0.277 214 N C -0.637 174.867 175.510 -0.012 0.000 1.081 214 N CA -0.007 53.007 53.050 -0.060 0.000 0.973 214 N CB 0.984 39.464 38.487 -0.013 0.000 1.105 214 N HN -0.103 8.128 8.380 -0.249 0.000 0.470 215 K N 4.595 124.993 120.400 -0.002 0.000 2.451 215 K HA -0.272 4.049 4.320 0.000 0.000 0.280 215 K C 0.802 177.496 176.600 0.156 0.000 1.020 215 K CA 1.498 57.794 56.287 0.015 0.000 1.008 215 K CB 0.527 32.964 32.500 -0.105 0.000 0.917 215 K HN 0.514 8.754 8.250 -0.017 0.000 0.478 216 G N 3.732 112.661 108.800 0.215 0.000 2.159 216 G HA2 -0.323 3.813 3.960 0.293 0.000 0.256 216 G HA3 -0.323 3.853 3.960 0.360 0.000 0.256 216 G C -1.421 173.594 174.900 0.191 0.000 0.977 216 G CA 0.161 45.428 45.100 0.279 0.000 0.652 216 G HN 0.442 8.836 8.290 0.173 0.000 0.531 217 E N 0.932 121.232 120.200 0.168 0.000 2.195 217 E HA 0.581 5.174 4.350 0.189 -0.130 0.271 217 E C -2.138 174.604 176.600 0.236 0.000 0.923 217 E CA -1.694 54.825 56.400 0.199 0.000 0.790 217 E CB 2.915 32.742 29.700 0.211 0.000 1.155 217 E HN -0.849 7.553 8.360 0.146 0.047 0.402 218 A N 4.610 127.553 122.820 0.204 0.000 2.322 218 A HA 0.342 4.744 4.320 0.136 0.000 0.327 218 A C -1.416 176.184 177.584 0.027 0.000 1.134 218 A CA -1.702 50.404 52.037 0.116 0.000 0.831 218 A CB 2.583 21.578 19.000 -0.009 0.000 1.288 218 A HN 0.639 8.895 8.150 0.178 0.000 0.472 219 Q N -1.482 118.131 119.800 -0.311 0.000 2.361 219 Q HA -0.213 3.615 4.340 -1.030 -0.107 0.276 219 Q C -0.188 175.688 176.000 -0.207 0.000 1.022 219 Q CA 1.125 56.563 55.803 -0.608 0.000 0.898 219 Q CB 0.454 28.834 28.738 -0.597 0.000 1.246 219 Q HN 0.122 8.225 8.270 -0.278 0.000 0.410 220 S N 2.613 118.214 115.700 -0.165 0.000 2.654 220 S HA 0.439 4.907 4.470 -0.003 0.000 0.283 220 S C -0.848 173.738 174.600 -0.024 0.000 1.180 220 S CA -3.081 55.098 58.200 -0.035 0.000 1.021 220 S CB 1.020 64.230 63.200 0.017 0.000 1.018 220 S HN 0.134 8.306 8.310 -0.230 0.000 0.532 221 P HA 0.147 4.637 4.420 0.116 0.000 0.240 221 P C -1.516 175.867 177.300 0.139 0.000 1.190 221 P CA 0.420 63.580 63.100 0.099 0.000 0.781 221 P CB 0.616 32.367 31.700 0.084 0.000 0.931 222 L N -2.921 118.340 121.223 0.063 0.000 2.455 222 L HA 0.381 4.782 4.340 0.102 0.000 0.264 222 L C 0.465 177.367 176.870 0.053 0.000 0.968 222 L CA -1.376 53.501 54.840 0.061 0.000 0.827 222 L CB 3.224 45.283 42.059 0.000 0.000 1.317 222 L HN -0.858 7.345 8.230 0.039 0.051 0.407 223 Q N 2.532 122.367 119.800 0.059 0.000 2.181 223 Q HA -0.234 4.141 4.340 0.057 0.000 0.205 223 Q C 0.835 176.864 176.000 0.048 0.000 0.980 223 Q CA 2.792 58.627 55.803 0.054 0.000 0.862 223 Q CB -0.176 28.593 28.738 0.052 0.000 0.905 223 Q HN 0.497 8.808 8.270 0.067 0.000 0.429 224 G N -3.580 105.244 108.800 0.039 0.000 3.262 224 G HA2 -0.055 3.923 3.960 0.031 0.000 0.228 224 G HA3 -0.055 3.920 3.960 0.025 0.000 0.228 224 G C -1.572 173.346 174.900 0.029 0.000 1.197 224 G CA -0.515 44.603 45.100 0.030 0.000 0.819 224 G HN -0.150 8.148 8.290 0.037 0.015 0.531 225 E N -0.836 119.391 120.200 0.045 0.000 2.356 225 E HA 0.431 4.990 4.350 0.055 -0.176 0.275 225 E C -2.075 174.586 176.600 0.101 0.000 0.904 225 E CA -1.879 54.560 56.400 0.064 0.000 0.757 225 E CB 3.502 33.234 29.700 0.053 0.000 1.232 225 E HN -0.841 7.477 8.360 0.051 0.072 0.442 226 I N 2.450 123.116 120.570 0.160 0.000 2.562 226 I HA 0.253 4.529 4.170 0.177 0.000 0.301 226 I C -2.577 173.711 176.117 0.285 0.000 1.003 226 I CA -1.775 59.655 61.300 0.217 0.000 1.127 226 I CB 4.006 42.141 38.000 0.225 0.000 1.304 226 I HN 0.164 8.478 8.210 0.173 0.000 0.446 227 R N 5.867 126.490 120.500 0.205 0.000 2.437 227 R HA 0.321 4.748 4.340 0.145 0.000 0.310 227 R C -1.940 174.435 176.300 0.126 0.000 0.955 227 R CA -1.698 54.490 56.100 0.147 0.000 0.851 227 R CB 2.869 33.228 30.300 0.099 0.000 1.161 227 R HN 0.397 8.779 8.270 0.187 0.000 0.446 228 L N 5.206 126.449 121.223 0.034 0.000 2.417 228 L HA 0.231 4.762 4.340 0.093 -0.135 0.268 228 L C 0.671 177.589 176.870 0.080 0.000 1.158 228 L CA -0.125 54.740 54.840 0.042 0.000 0.819 228 L CB 0.424 42.447 42.059 -0.060 0.000 1.112 228 L HN 0.631 8.828 8.230 -0.055 0.000 0.458 229 Q N 3.453 123.310 119.800 0.094 0.000 2.124 229 Q HA -0.339 4.041 4.340 0.066 0.000 0.202 229 Q C 1.722 177.770 176.000 0.080 0.000 0.977 229 Q CA 3.115 58.965 55.803 0.078 0.000 0.850 229 Q CB -0.022 28.759 28.738 0.072 0.000 0.901 229 Q HN 0.444 8.666 8.270 0.110 0.114 0.429 230 S N -0.921 114.818 115.700 0.065 0.000 2.370 230 S HA -0.328 4.163 4.470 0.034 0.000 0.226 230 S C 1.612 176.221 174.600 0.015 0.000 1.033 230 S CA 3.840 62.065 58.200 0.043 0.000 1.011 230 S CB -0.870 62.357 63.200 0.045 0.000 0.852 230 S HN -0.563 7.788 8.310 0.068 0.000 0.457 231 D N 3.078 123.506 120.400 0.048 0.000 2.144 231 D HA -0.287 4.356 4.640 0.004 0.000 0.200 231 D C 2.024 178.206 176.300 -0.197 0.000 0.978 231 D CA 3.168 57.177 54.000 0.015 0.000 0.833 231 D CB -0.595 40.339 40.800 0.223 0.000 0.961 231 D HN -0.320 8.090 8.370 0.067 0.000 0.470 232 H N 2.182 121.157 119.070 -0.159 0.000 2.289 232 H HA -0.333 4.098 4.556 -0.209 0.000 0.296 232 H C 2.548 177.726 175.328 -0.249 0.000 1.091 232 H CA 3.469 59.405 56.048 -0.185 0.000 1.274 232 H CB 0.213 29.920 29.762 -0.093 0.000 1.364 232 H HN -0.372 7.969 8.280 0.102 0.000 0.490 233 L N -2.107 119.112 121.223 -0.008 0.000 2.056 233 L HA -0.377 3.959 4.340 -0.007 0.000 0.207 233 L C 1.736 178.460 176.870 -0.243 0.000 1.078 233 L CA 2.951 57.757 54.840 -0.057 0.000 0.749 233 L CB -0.052 42.014 42.059 0.013 0.000 0.901 233 L HN -0.270 7.996 8.230 0.061 0.000 0.433 234 L N -1.873 119.145 121.223 -0.342 0.000 2.131 234 L HA -0.281 3.911 4.340 -0.247 0.000 0.210 234 L C 2.628 178.987 176.870 -0.852 0.000 1.092 234 L CA 2.806 57.377 54.840 -0.447 0.000 0.759 234 L CB -0.376 41.488 42.059 -0.325 0.000 0.903 234 L HN -0.012 8.040 8.230 -0.297 0.000 0.435 235 A N -3.634 118.390 122.820 -1.327 0.000 2.067 235 A HA -0.208 2.857 4.320 -2.091 0.000 0.219 235 A C 0.768 177.974 177.584 -0.631 0.000 1.158 235 A CA 2.469 53.619 52.037 -1.479 0.000 0.661 235 A CB -0.337 17.879 19.000 -1.307 0.000 0.801 235 A HN -0.283 7.139 8.150 -1.193 0.012 0.452 236 R N -5.306 114.919 120.500 -0.458 0.000 2.316 236 R HA 0.101 4.298 4.340 -0.239 0.000 0.201 236 R C -0.123 176.079 176.300 -0.162 0.000 0.888 236 R CA 0.229 56.163 56.100 -0.275 0.000 1.041 236 R CB 2.003 32.127 30.300 -0.293 0.000 1.115 236 R HN -0.700 7.126 8.270 -0.472 0.161 0.559 237 D N 1.578 121.887 120.400 -0.151 0.000 2.389 237 D HA 0.155 4.759 4.640 -0.060 0.000 0.247 237 D C -1.077 175.194 176.300 -0.049 0.000 1.128 237 D CA -1.375 52.578 54.000 -0.077 0.000 0.884 237 D CB 2.400 43.162 40.800 -0.062 0.000 1.194 237 D HN -0.585 7.667 8.370 -0.197 0.000 0.441 238 P HA -0.128 4.286 4.420 -0.011 0.000 0.219 238 P C 0.697 177.999 177.300 0.003 0.000 1.146 238 P CA 1.771 64.865 63.100 -0.010 0.000 0.808 238 P CB 0.374 32.071 31.700 -0.005 0.000 0.779 239 Q N -4.421 115.383 119.800 0.006 0.000 2.297 239 Q HA -0.104 4.250 4.340 0.023 0.000 0.204 239 Q C 1.085 177.108 176.000 0.038 0.000 0.962 239 Q CA 2.025 57.841 55.803 0.022 0.000 0.879 239 Q CB 0.775 29.528 28.738 0.026 0.000 0.947 239 Q HN -0.038 8.547 8.270 0.000 -0.314 0.462 240 T N -7.563 107.012 114.554 0.035 0.000 2.969 240 T HA 0.227 4.638 4.350 0.102 0.000 0.258 240 T C 0.132 174.894 174.700 0.105 0.000 0.962 240 T CA 0.157 62.307 62.100 0.083 0.000 0.903 240 T CB 2.383 71.309 68.868 0.097 0.000 1.177 240 T HN -0.426 7.788 8.240 0.011 0.032 0.511 241 A N 2.828 125.669 122.820 0.035 0.000 1.933 241 A HA -0.224 4.108 4.320 0.020 0.000 0.218 241 A C 1.050 178.700 177.584 0.109 0.000 1.175 241 A CA 3.692 55.751 52.037 0.037 0.000 0.628 241 A CB -0.611 18.374 19.000 -0.025 0.000 0.814 241 A HN -0.001 8.153 8.150 0.006 0.000 0.444 242 c N -2.893 115.751 118.600 0.074 0.000 2.446 242 c HA -0.333 4.273 4.570 0.061 0.000 0.277 242 c C 2.084 176.210 174.090 0.059 0.000 1.275 242 c CA 4.328 60.693 56.329 0.059 0.000 1.727 242 c CB -1.764 40.765 42.510 0.032 0.000 2.010 242 c HN 0.437 8.701 8.230 0.056 0.000 0.486 243 E N 0.532 120.776 120.200 0.075 0.000 2.072 243 E HA -0.289 4.056 4.350 -0.009 0.000 0.191 243 E C 1.842 178.460 176.600 0.030 0.000 0.985 243 E CA 2.866 59.289 56.400 0.039 0.000 0.801 243 E CB -0.426 29.308 29.700 0.057 0.000 0.750 243 E HN -0.365 8.046 8.360 0.086 0.000 0.452 244 W N 0.218 121.475 121.300 -0.071 0.000 2.333 244 W HA -0.422 4.175 4.660 -0.105 0.000 0.316 244 W C 2.289 178.736 176.519 -0.120 0.000 1.215 244 W CA 4.613 61.924 57.345 -0.057 0.000 1.278 244 W CB 0.063 29.558 29.460 0.060 0.000 1.154 244 W HN 0.002 8.399 8.180 0.362 0.000 0.486 245 Q N -1.004 118.924 119.800 0.214 0.000 2.170 245 Q HA -0.361 4.069 4.340 0.149 0.000 0.203 245 Q C 2.547 178.476 176.000 -0.117 0.000 0.976 245 Q CA 3.292 59.146 55.803 0.085 0.000 0.858 245 Q CB -0.091 28.715 28.738 0.114 0.000 0.907 245 Q HN -0.273 8.147 8.270 0.250 0.000 0.433 246 S N -0.413 115.211 115.700 -0.127 0.000 2.469 246 S HA -0.189 4.188 4.470 -0.155 0.000 0.238 246 S C 0.990 175.432 174.600 -0.263 0.000 0.998 246 S CA 2.959 61.057 58.200 -0.171 0.000 0.957 246 S CB -0.323 62.802 63.200 -0.126 0.000 0.764 246 S HN -0.354 7.800 8.310 -0.080 0.108 0.514 247 M N -1.341 118.004 119.600 -0.425 0.000 2.419 247 M HA -0.055 4.145 4.480 -0.468 0.000 0.264 247 M C 0.086 176.167 176.300 -0.365 0.000 1.082 247 M CA -0.065 54.889 55.300 -0.577 0.000 1.119 247 M CB 0.525 32.284 32.600 -1.402 0.000 1.398 247 M HN -0.790 7.180 8.290 -0.469 0.039 0.453 248 V N 0.326 120.072 119.914 -0.281 0.000 2.540 248 V HA -0.406 3.644 4.120 -0.117 0.000 0.297 248 V C -0.428 175.550 176.094 -0.194 0.000 1.024 248 V CA 1.426 63.607 62.300 -0.199 0.000 1.105 248 V CB -0.359 31.284 31.823 -0.299 0.000 0.938 248 V HN -0.573 7.304 8.190 -0.286 0.142 0.482 249 N N 5.484 124.107 118.700 -0.129 0.000 2.727 249 N HA -0.399 4.296 4.740 -0.074 0.000 0.249 249 N C -1.300 174.145 175.510 -0.108 0.000 1.048 249 N CA 1.472 54.461 53.050 -0.102 0.000 0.714 249 N CB -0.687 37.740 38.487 -0.100 0.000 0.959 249 N HN 0.035 8.355 8.380 -0.098 0.000 0.544 250 N N -2.287 116.339 118.700 -0.123 0.000 2.733 250 N HA 0.201 4.887 4.740 -0.090 0.000 0.271 250 N C -0.905 174.545 175.510 -0.101 0.000 1.720 250 N CA -0.867 52.115 53.050 -0.114 0.000 0.803 250 N CB 0.367 38.769 38.487 -0.142 0.000 1.208 250 N HN -0.691 7.595 8.380 -0.136 0.012 0.498 251 Q N 3.846 123.604 119.800 -0.069 0.000 2.096 251 Q HA -0.206 4.093 4.340 -0.069 0.000 0.204 251 Q C -0.620 175.372 176.000 -0.012 0.000 0.982 251 Q CA 5.204 60.980 55.803 -0.046 0.000 0.850 251 Q CB -1.284 27.440 28.738 -0.023 0.000 0.901 251 Q HN 0.582 8.815 8.270 -0.061 0.000 0.422 252 P HA -0.228 4.206 4.420 0.024 0.000 0.217 252 P C 1.300 178.604 177.300 0.007 0.000 1.150 252 P CA 2.608 65.712 63.100 0.006 0.000 0.832 252 P CB -0.436 31.261 31.700 -0.004 0.000 0.787 253 K N -1.414 118.971 120.400 -0.026 0.000 2.025 253 K HA -0.249 4.061 4.320 -0.016 0.000 0.207 253 K C 2.277 178.867 176.600 -0.017 0.000 1.049 253 K CA 3.224 59.490 56.287 -0.035 0.000 0.933 253 K CB -0.107 32.343 32.500 -0.083 0.000 0.714 253 K HN -0.822 7.613 8.250 -0.045 -0.212 0.438 254 I N -0.626 119.916 120.570 -0.047 0.000 2.163 254 I HA -0.506 3.642 4.170 -0.036 0.000 0.243 254 I C 2.438 178.673 176.117 0.198 0.000 1.085 254 I CA 4.148 65.442 61.300 -0.010 0.000 1.347 254 I CB -0.139 37.775 38.000 -0.143 0.000 1.044 254 I HN -0.373 7.789 8.210 -0.080 0.000 0.408 255 Q N -1.761 118.159 119.800 0.201 0.000 2.020 255 Q HA -0.489 4.098 4.340 0.411 0.000 0.202 255 Q C 2.295 178.413 176.000 0.196 0.000 0.982 255 Q CA 3.644 59.606 55.803 0.265 0.000 0.838 255 Q CB -0.217 28.622 28.738 0.169 0.000 0.899 255 Q HN -0.089 8.257 8.270 0.127 0.000 0.423 256 N N -1.017 117.754 118.700 0.117 0.000 2.084 256 N HA -0.316 4.469 4.740 0.074 0.000 0.190 256 N C 2.331 177.896 175.510 0.092 0.000 1.030 256 N CA 3.305 56.405 53.050 0.082 0.000 0.849 256 N CB 0.253 38.768 38.487 0.048 0.000 1.012 256 N HN -0.370 8.066 8.380 0.093 0.000 0.423 257 R N -1.952 118.609 120.500 0.102 0.000 2.090 257 R HA -0.170 4.211 4.340 0.069 0.000 0.228 257 R C 2.269 178.661 176.300 0.152 0.000 1.110 257 R CA 1.683 57.840 56.100 0.096 0.000 0.973 257 R CB -0.893 29.443 30.300 0.060 0.000 0.869 257 R HN -0.191 8.136 8.270 0.096 0.000 0.440 258 F N 1.996 121.988 119.950 0.071 0.000 2.113 258 F HA -0.142 4.420 4.527 0.059 0.000 0.297 258 F C 1.328 177.146 175.800 0.030 0.000 1.103 258 F CA 2.934 60.983 58.000 0.082 0.000 1.248 258 F CB -0.025 39.111 39.000 0.227 0.000 0.999 258 F HN -0.212 8.314 8.300 0.377 0.000 0.475 259 A N -1.473 121.381 122.820 0.055 0.000 1.902 259 A HA -0.433 3.785 4.320 -0.170 0.000 0.217 259 A C 1.705 179.243 177.584 -0.075 0.000 1.181 259 A CA 3.257 55.253 52.037 -0.068 0.000 0.623 259 A CB -1.107 17.900 19.000 0.011 0.000 0.818 259 A HN -0.219 8.037 8.150 0.176 0.000 0.443 260 A N -2.597 120.215 122.820 -0.013 0.000 1.898 260 A HA -0.273 4.055 4.320 0.014 0.000 0.216 260 A C 2.038 179.622 177.584 0.000 0.000 1.181 260 A CA 3.178 55.220 52.037 0.007 0.000 0.620 260 A CB -0.508 18.510 19.000 0.031 0.000 0.819 260 A HN -0.384 7.777 8.150 0.018 0.000 0.442 261 T N -2.496 112.047 114.554 -0.018 0.000 2.857 261 T HA -0.309 4.106 4.350 0.108 0.000 0.266 261 T C 1.947 176.613 174.700 -0.057 0.000 1.048 261 T CA 3.259 65.367 62.100 0.014 0.000 1.139 261 T CB 0.119 68.986 68.868 -0.003 0.000 0.874 261 T HN -0.248 7.977 8.240 -0.025 0.000 0.455 262 M N 0.616 120.059 119.600 -0.261 0.000 2.159 262 M HA -0.256 4.072 4.480 -0.254 0.000 0.263 262 M C 2.102 178.347 176.300 -0.092 0.000 1.063 262 M CA 1.899 57.023 55.300 -0.294 0.000 1.110 262 M CB -1.493 30.743 32.600 -0.607 0.000 1.374 262 M HN 0.045 8.116 8.290 -0.365 0.000 0.411 263 S N 0.688 116.359 115.700 -0.047 0.000 2.368 263 S HA -0.302 4.202 4.470 0.058 0.000 0.225 263 S C 2.017 176.637 174.600 0.034 0.000 1.030 263 S CA 3.499 61.720 58.200 0.034 0.000 0.999 263 S CB -0.555 62.687 63.200 0.069 0.000 0.844 263 S HN -0.225 8.043 8.310 -0.069 0.000 0.459 264 K N 1.180 121.610 120.400 0.049 0.000 2.032 264 K HA -0.329 3.983 4.320 -0.014 0.000 0.209 264 K C 2.679 179.343 176.600 0.106 0.000 1.048 264 K CA 2.871 59.192 56.287 0.057 0.000 0.927 264 K CB -0.144 32.426 32.500 0.118 0.000 0.712 264 K HN -0.645 7.637 8.250 0.053 0.000 0.441 265 M N 0.394 120.138 119.600 0.241 0.000 2.080 265 M HA -0.377 4.401 4.480 0.497 0.000 0.260 265 M C 1.661 178.038 176.300 0.128 0.000 1.068 265 M CA 2.758 58.238 55.300 0.300 0.000 1.109 265 M CB -0.092 32.628 32.600 0.201 0.000 1.342 265 M HN -0.229 8.195 8.290 0.222 0.000 0.405 266 A N -2.607 120.261 122.820 0.080 0.000 2.125 266 A HA -0.170 4.204 4.320 0.091 0.000 0.219 266 A C 0.873 178.465 177.584 0.013 0.000 1.156 266 A CA 2.447 54.526 52.037 0.071 0.000 0.671 266 A CB -0.509 18.550 19.000 0.098 0.000 0.794 266 A HN 0.175 8.367 8.150 0.070 0.000 0.459 267 L N -4.555 116.641 121.223 -0.044 0.000 2.728 267 L HA 0.186 4.455 4.340 -0.119 0.000 0.238 267 L C -1.084 175.664 176.870 -0.202 0.000 1.143 267 L CA -1.631 53.132 54.840 -0.129 0.000 0.937 267 L CB 0.073 42.022 42.059 -0.184 0.000 1.225 267 L HN -0.713 7.341 8.230 -0.031 0.158 0.507 268 L N -0.295 120.789 121.223 -0.232 0.000 2.540 268 L HA -0.332 3.628 4.340 -0.634 0.000 0.276 268 L C 1.070 177.609 176.870 -0.552 0.000 1.212 268 L CA 1.769 56.291 54.840 -0.531 0.000 0.893 268 L CB -0.282 41.462 42.059 -0.524 0.000 1.138 268 L HN -0.706 7.335 8.230 -0.142 0.104 0.491 269 G N 0.213 108.568 108.800 -0.741 0.000 2.184 269 G HA2 -0.331 3.555 3.960 -0.122 0.000 0.264 269 G HA3 -0.331 3.726 3.960 -0.175 -0.203 0.264 269 G C -0.644 174.188 174.900 -0.114 0.000 0.975 269 G CA 0.281 45.215 45.100 -0.276 0.000 0.642 269 G HN 0.613 8.314 8.290 -0.981 0.000 0.536 270 Q N -1.189 118.516 119.800 -0.158 0.000 2.496 270 Q HA 0.216 4.510 4.340 -0.076 0.000 0.286 270 Q C -1.697 174.222 176.000 -0.135 0.000 1.103 270 Q CA -1.508 54.226 55.803 -0.115 0.000 0.813 270 Q CB 2.684 31.351 28.738 -0.119 0.000 1.444 270 Q HN -0.316 7.774 8.270 -0.218 0.049 0.443 271 D N 0.893 121.216 120.400 -0.127 0.000 2.440 271 D HA 0.147 4.696 4.640 -0.150 0.000 0.252 271 D C 0.061 176.248 176.300 -0.189 0.000 1.180 271 D CA -1.169 52.748 54.000 -0.139 0.000 0.894 271 D CB 0.732 41.480 40.800 -0.087 0.000 1.111 271 D HN 0.072 8.376 8.370 -0.111 0.000 0.544 272 K N 5.764 125.986 120.400 -0.297 0.000 2.160 272 K HA -0.329 3.635 4.320 -0.594 0.000 0.206 272 K C 1.651 178.083 176.600 -0.280 0.000 1.047 272 K CA 2.859 58.856 56.287 -0.484 0.000 0.930 272 K CB 0.019 32.115 32.500 -0.673 0.000 0.720 272 K HN 0.625 8.697 8.250 -0.297 0.000 0.450 273 T N -3.448 111.004 114.554 -0.170 0.000 3.072 273 T HA -0.085 4.221 4.350 -0.072 0.000 0.266 273 T C 1.010 175.677 174.700 -0.054 0.000 1.127 273 T CA 2.534 64.582 62.100 -0.088 0.000 1.107 273 T CB -0.527 68.302 68.868 -0.065 0.000 0.910 273 T HN -0.281 8.085 8.240 -0.165 -0.225 0.513 274 K N -0.170 120.191 120.400 -0.065 0.000 2.358 274 K HA 0.206 4.511 4.320 -0.025 0.000 0.197 274 K C -0.610 175.974 176.600 -0.026 0.000 1.025 274 K CA -0.190 56.074 56.287 -0.038 0.000 1.104 274 K CB 0.744 33.221 32.500 -0.038 0.000 0.855 274 K HN -0.316 7.728 8.250 -0.091 0.152 0.531 275 L N -2.487 118.720 121.223 -0.026 0.000 2.298 275 L HA 0.409 4.820 4.340 0.004 -0.069 0.268 275 L C -0.330 176.596 176.870 0.092 0.000 1.010 275 L CA -1.745 53.106 54.840 0.017 0.000 0.812 275 L CB 3.209 45.270 42.059 0.004 0.000 1.331 275 L HN -0.671 7.364 8.230 -0.048 0.166 0.450 276 I N 0.145 120.767 120.570 0.087 0.000 2.404 276 I HA 0.169 4.387 4.170 0.081 0.000 0.293 276 I C -1.565 174.548 176.117 -0.006 0.000 0.992 276 I CA -1.280 60.055 61.300 0.057 0.000 1.149 276 I CB 2.977 40.976 38.000 -0.003 0.000 1.315 276 I HN 0.171 8.408 8.210 0.045 0.000 0.446 277 D N 7.374 127.733 120.400 -0.067 0.000 2.358 277 D HA -0.073 3.958 4.640 -1.015 0.000 0.258 277 D C -0.945 175.170 176.300 -0.307 0.000 1.223 277 D CA 0.594 54.317 54.000 -0.462 0.000 0.886 277 D CB -0.345 40.259 40.800 -0.326 0.000 1.120 277 D HN 0.312 8.692 8.370 0.017 0.000 0.482 278 c N 4.976 123.376 118.600 -0.334 0.000 2.849 278 c HA 0.338 4.850 4.570 -0.097 0.000 0.271 278 c C 1.358 175.439 174.090 -0.014 0.000 1.519 278 c CA -2.104 54.168 56.329 -0.095 0.000 1.783 278 c CB -1.380 41.156 42.510 0.044 0.000 2.869 278 c HN 0.356 8.285 8.230 -0.502 0.000 0.527 279 S N 3.213 118.826 115.700 -0.144 0.000 2.400 279 S HA -0.322 4.150 4.470 0.004 0.000 0.232 279 S C 0.920 175.508 174.600 -0.020 0.000 1.025 279 S CA 4.093 62.249 58.200 -0.072 0.000 0.993 279 S CB 0.141 63.251 63.200 -0.149 0.000 0.808 279 S HN -0.336 8.080 8.310 -0.270 -0.268 0.478 280 D N -1.188 119.198 120.400 -0.023 0.000 2.363 280 D HA -0.140 4.505 4.640 0.008 0.000 0.226 280 D C 0.937 177.260 176.300 0.038 0.000 1.020 280 D CA 1.099 55.105 54.000 0.011 0.000 0.892 280 D CB -1.386 39.427 40.800 0.022 0.000 0.900 280 D HN 0.160 8.484 8.370 -0.041 0.022 0.531 281 V N -0.418 119.495 119.914 -0.003 0.000 2.719 281 V HA -0.235 3.889 4.120 0.006 0.000 0.252 281 V C 0.194 176.292 176.094 0.006 0.000 1.065 281 V CA 1.438 63.707 62.300 -0.052 0.000 1.086 281 V CB 0.506 32.176 31.823 -0.254 0.000 0.700 281 V HN -0.723 7.410 8.190 -0.011 0.050 0.467 282 I N 0.425 120.982 120.570 -0.022 0.000 2.648 282 I HA -0.012 4.055 4.170 -0.172 0.000 0.284 282 I C -2.047 174.040 176.117 -0.050 0.000 1.153 282 I CA -3.658 57.584 61.300 -0.096 0.000 1.426 282 I CB -1.758 36.175 38.000 -0.112 0.000 1.381 282 I HN -0.889 7.317 8.210 -0.007 0.000 0.571 283 P HA 0.021 4.443 4.420 0.003 0.000 0.270 283 P C -1.487 175.790 177.300 -0.038 0.000 1.223 283 P CA -0.146 62.935 63.100 -0.032 0.000 0.785 283 P CB 0.548 32.220 31.700 -0.047 0.000 0.923 284 T N 2.619 117.161 114.554 -0.020 0.000 2.779 284 T HA 0.041 4.378 4.350 -0.022 0.000 0.296 284 T C -1.479 173.203 174.700 -0.031 0.000 0.938 284 T CA -1.262 60.826 62.100 -0.020 0.000 1.119 284 T CB 0.074 68.938 68.868 -0.007 0.000 0.891 284 T HN -0.097 8.138 8.240 -0.008 0.000 0.526 285 P HA 0.250 4.881 4.420 -0.056 -0.245 0.274 285 P C -2.210 175.077 177.300 -0.022 0.000 1.237 285 P CA -1.704 61.370 63.100 -0.044 0.000 0.793 285 P CB -0.037 31.632 31.700 -0.052 0.000 0.977 286 P HA 0.021 4.438 4.420 -0.006 0.000 0.272 286 P C -0.772 176.531 177.300 0.006 0.000 1.230 286 P CA -0.726 62.370 63.100 -0.007 0.000 0.788 286 P CB 0.518 32.214 31.700 -0.008 0.000 0.949 287 A N 0.222 123.048 122.820 0.009 0.000 2.406 287 A HA -0.153 4.180 4.320 0.023 0.000 0.243 287 A C 0.314 177.912 177.584 0.022 0.000 1.082 287 A CA -0.294 51.754 52.037 0.017 0.000 0.786 287 A CB 0.519 19.526 19.000 0.012 0.000 1.029 287 A HN -0.068 8.085 8.150 0.006 0.000 0.495 288 L N 0.286 121.527 121.223 0.030 0.000 2.514 288 L HA -0.118 4.304 4.340 0.040 -0.058 0.280 288 L C -0.850 176.032 176.870 0.020 0.000 1.223 288 L CA 1.005 55.864 54.840 0.031 0.000 0.864 288 L CB 0.752 42.828 42.059 0.029 0.000 1.118 288 L HN -0.083 8.166 8.230 0.032 0.000 0.494 289 V N 1.091 121.017 119.914 0.020 0.000 2.459 289 V HA 0.302 4.427 4.120 0.009 0.000 0.295 289 V C -0.187 175.916 176.094 0.016 0.000 1.029 289 V CA -0.952 61.356 62.300 0.013 0.000 0.874 289 V CB 1.384 33.213 31.823 0.011 0.000 0.985 289 V HN 0.046 8.251 8.190 0.025 0.000 0.438 290 G N 2.948 111.752 108.800 0.007 0.000 2.756 290 G HA2 -0.186 3.765 3.960 -0.015 0.000 0.678 290 G HA3 -0.186 3.787 3.960 0.021 0.000 0.678 290 G C -1.751 173.165 174.900 0.026 0.000 1.349 290 G CA -0.644 44.461 45.100 0.008 0.000 0.847 290 G HN 0.036 8.326 8.290 0.001 0.000 0.548 291 A N -0.132 122.715 122.820 0.045 0.000 2.532 291 A HA 0.157 4.506 4.320 0.047 0.000 0.290 291 A C -1.872 175.805 177.584 0.155 0.000 1.143 291 A CA -1.169 50.906 52.037 0.064 0.000 0.728 291 A CB 2.670 21.689 19.000 0.032 0.000 1.317 291 A HN -0.088 8.080 8.150 0.030 0.000 0.414 292 A N 1.314 124.193 122.820 0.098 0.000 2.546 292 A HA 0.385 4.961 4.320 0.067 -0.216 0.243 292 A C -0.651 177.028 177.584 0.159 0.000 1.063 292 A CA 0.265 52.354 52.037 0.086 0.000 0.757 292 A CB 0.255 19.263 19.000 0.013 0.000 0.991 292 A HN 0.565 8.747 8.150 0.054 0.000 0.503 293 H N -0.050 119.023 119.070 0.006 0.000 3.064 293 H HA 0.455 5.146 4.556 0.025 -0.120 0.352 293 H C -2.026 173.306 175.328 0.006 0.000 1.260 293 H CA -1.518 54.538 56.048 0.012 0.000 1.160 293 H CB 1.429 31.191 29.762 0.001 0.000 1.879 293 H HN -0.264 8.150 8.280 -0.143 -0.220 0.544 294 L N 0.631 121.883 121.223 0.049 0.000 2.453 294 L HA 0.407 4.654 4.340 -0.155 0.000 0.261 294 L C -1.345 175.520 176.870 -0.009 0.000 1.179 294 L CA -2.235 52.579 54.840 -0.043 0.000 0.813 294 L CB -0.080 42.020 42.059 0.069 0.000 1.110 294 L HN 0.413 8.723 8.230 0.133 0.000 0.466 295 P HA -0.057 4.364 4.420 0.002 0.000 0.270 295 P C -0.766 176.598 177.300 0.107 0.000 1.223 295 P CA -0.538 62.471 63.100 -0.151 0.000 0.785 295 P CB 0.399 31.727 31.700 -0.621 0.000 0.923 296 A N 1.322 124.232 122.820 0.151 0.000 2.567 296 A HA -0.423 4.181 4.320 0.152 -0.193 0.240 296 A C 1.387 179.135 177.584 0.274 0.000 1.053 296 A CA 1.054 53.194 52.037 0.173 0.000 0.755 296 A CB -0.068 19.001 19.000 0.115 0.000 0.978 296 A HN 0.346 8.569 8.150 0.121 0.000 0.507 297 G N 3.359 112.284 108.800 0.208 0.000 2.176 297 G HA2 -0.402 3.610 3.960 0.087 0.000 0.253 297 G HA3 -0.402 3.633 3.960 0.126 0.000 0.253 297 G C -0.885 174.094 174.900 0.132 0.000 0.979 297 G CA -0.164 45.025 45.100 0.147 0.000 0.641 297 G HN 0.714 9.102 8.290 0.163 0.000 0.530 298 F N -0.117 119.840 119.950 0.012 0.000 2.408 298 F HA 0.438 5.089 4.527 -0.010 -0.129 0.325 298 F C -0.569 175.233 175.800 0.002 0.000 1.082 298 F CA -1.083 56.916 58.000 -0.001 0.000 1.032 298 F CB 2.501 41.496 39.000 -0.009 0.000 1.259 298 F HN -0.583 7.962 8.300 0.514 0.064 0.503 299 S N -0.472 115.323 115.700 0.159 0.000 2.720 299 S HA 0.250 4.786 4.470 0.111 0.000 0.287 299 S C 0.306 174.946 174.600 0.067 0.000 1.168 299 S CA -1.621 56.635 58.200 0.094 0.000 0.832 299 S CB 2.806 66.031 63.200 0.041 0.000 1.166 299 S HN 0.141 8.822 8.310 0.123 -0.297 0.493 300 L N 1.180 122.431 121.223 0.047 0.000 2.187 300 L HA -0.187 4.152 4.340 -0.002 0.000 0.213 300 L C 1.580 178.430 176.870 -0.033 0.000 1.100 300 L CA 2.689 57.538 54.840 0.015 0.000 0.765 300 L CB 0.040 42.130 42.059 0.053 0.000 0.904 300 L HN 0.498 8.761 8.230 0.054 0.000 0.437 301 S N -2.442 113.246 115.700 -0.021 0.000 2.474 301 S HA -0.262 4.183 4.470 -0.042 0.000 0.235 301 S C 1.324 175.890 174.600 -0.057 0.000 0.997 301 S CA 2.276 60.452 58.200 -0.040 0.000 0.949 301 S CB -0.822 62.357 63.200 -0.035 0.000 0.766 301 S HN -0.381 7.905 8.310 -0.007 0.020 0.517 302 D N 1.178 121.553 120.400 -0.042 0.000 2.355 302 D HA 0.047 4.656 4.640 -0.052 0.000 0.218 302 D C -0.728 175.537 176.300 -0.058 0.000 1.004 302 D CA 0.700 54.685 54.000 -0.025 0.000 0.880 302 D CB 0.436 41.284 40.800 0.079 0.000 0.911 302 D HN -0.294 7.922 8.370 -0.018 0.144 0.528 303 V N 0.081 119.901 119.914 -0.157 0.000 2.461 303 V HA -0.134 3.805 4.120 -0.302 0.000 0.275 303 V C -0.739 175.209 176.094 -0.243 0.000 1.047 303 V CA 0.053 62.161 62.300 -0.319 0.000 0.955 303 V CB 0.530 31.936 31.823 -0.695 0.000 0.988 303 V HN -0.525 7.414 8.190 -0.150 0.161 0.471 304 E N 9.243 129.313 120.200 -0.217 0.000 1.856 304 E HA -0.045 4.230 4.350 -0.124 0.000 0.263 304 E C -1.022 175.490 176.600 -0.147 0.000 1.137 304 E CA -0.846 55.460 56.400 -0.157 0.000 1.007 304 E CB -0.534 29.071 29.700 -0.157 0.000 1.117 304 E HN 0.041 8.266 8.360 -0.225 0.000 0.438 305 Q N 2.156 121.889 119.800 -0.111 0.000 2.311 305 Q HA -0.211 4.120 4.340 -0.015 0.000 0.272 305 Q C 0.027 176.016 176.000 -0.019 0.000 1.012 305 Q CA 1.129 56.911 55.803 -0.035 0.000 0.891 305 Q CB 0.319 29.065 28.738 0.013 0.000 1.201 305 Q HN -0.220 7.987 8.270 -0.106 0.000 0.391 306 A N 2.300 125.125 122.820 0.008 0.000 2.551 306 A HA 0.184 4.488 4.320 -0.027 0.000 0.252 306 A C -1.676 175.913 177.584 0.009 0.000 1.199 306 A CA -0.724 51.303 52.037 -0.017 0.000 0.972 306 A CB 1.411 20.371 19.000 -0.067 0.000 1.153 306 A HN 0.626 8.806 8.150 0.049 0.000 0.559 307 c N 0.626 119.250 118.600 0.041 0.000 2.239 307 c HA 0.309 4.896 4.570 0.027 0.000 0.323 307 c C 0.958 175.066 174.090 0.030 0.000 1.205 307 c CA -1.612 54.740 56.329 0.038 0.000 1.584 307 c CB -1.602 40.940 42.510 0.054 0.000 2.201 307 c HN 0.059 8.326 8.230 0.062 0.000 0.475 308 A N 7.850 130.681 122.820 0.018 0.000 1.972 308 A HA -0.189 4.140 4.320 0.015 0.000 0.219 308 A C 0.699 178.292 177.584 0.015 0.000 1.169 308 A CA 2.638 54.684 52.037 0.014 0.000 0.635 308 A CB -0.224 18.781 19.000 0.008 0.000 0.810 308 A HN 0.858 9.016 8.150 0.014 0.000 0.446 309 A N -2.636 120.193 122.820 0.014 0.000 2.014 309 A HA -0.068 4.257 4.320 0.008 0.000 0.218 309 A C 0.095 177.684 177.584 0.010 0.000 1.163 309 A CA 1.117 53.160 52.037 0.010 0.000 0.652 309 A CB 0.674 19.678 19.000 0.007 0.000 0.808 309 A HN 0.425 8.560 8.150 0.015 0.025 0.449 310 T N 0.167 114.730 114.554 0.015 0.000 3.031 310 T HA 0.238 4.592 4.350 0.007 0.000 0.305 310 T C -3.044 171.675 174.700 0.031 0.000 0.985 310 T CA -2.510 59.597 62.100 0.011 0.000 1.008 310 T CB 1.816 70.682 68.868 -0.004 0.000 1.005 310 T HN -0.753 7.468 8.240 0.021 0.032 0.444 311 P HA -0.003 4.470 4.420 0.088 0.000 0.272 311 P C -1.156 176.203 177.300 0.097 0.000 1.223 311 P CA -0.651 62.493 63.100 0.072 0.000 0.784 311 P CB 0.705 32.439 31.700 0.058 0.000 0.923 312 F N 3.601 123.551 119.950 0.000 0.000 2.572 312 F HA -0.089 4.516 4.527 0.003 -0.077 0.370 312 F C -1.524 174.277 175.800 0.001 0.000 1.103 312 F CA -0.980 57.021 58.000 0.002 0.000 1.286 312 F CB 1.055 40.057 39.000 0.005 0.000 1.105 312 F HN -0.207 8.597 8.300 0.298 -0.325 0.583 313 P HA 0.016 4.386 4.420 -0.083 0.000 0.272 313 P C -1.955 175.356 177.300 0.017 0.000 1.223 313 P CA -0.844 62.152 63.100 -0.173 0.000 0.784 313 P CB 0.670 32.196 31.700 -0.291 0.000 0.923 314 A N 1.545 124.387 122.820 0.038 0.000 2.444 314 A HA -0.002 4.394 4.320 0.126 0.000 0.273 314 A C -0.413 177.211 177.584 0.067 0.000 1.136 314 A CA -0.028 52.056 52.037 0.078 0.000 0.799 314 A CB 0.030 19.061 19.000 0.051 0.000 1.081 314 A HN 0.093 8.250 8.150 0.011 0.000 0.509 315 L N 3.574 124.867 121.223 0.115 0.000 2.334 315 L HA 0.277 4.661 4.340 0.072 0.000 0.273 315 L C 0.121 177.052 176.870 0.101 0.000 1.013 315 L CA -1.045 53.857 54.840 0.104 0.000 0.816 315 L CB 1.759 43.906 42.059 0.148 0.000 1.278 315 L HN 0.149 8.473 8.230 0.157 0.000 0.431 316 T N 3.464 118.072 114.554 0.091 0.000 2.849 316 T HA 0.162 4.560 4.350 0.079 0.000 0.284 316 T C -1.100 173.674 174.700 0.124 0.000 1.004 316 T CA -0.026 62.127 62.100 0.088 0.000 1.021 316 T CB 1.596 70.502 68.868 0.062 0.000 1.013 316 T HN 0.211 8.501 8.240 0.083 0.000 0.527 317 A N 1.596 124.483 122.820 0.112 0.000 2.320 317 A HA 0.378 5.006 4.320 0.182 -0.199 0.334 317 A C -0.606 177.041 177.584 0.104 0.000 1.147 317 A CA -1.603 50.519 52.037 0.141 0.000 0.820 317 A CB 2.146 21.229 19.000 0.138 0.000 1.218 317 A HN 0.141 8.346 8.150 0.091 0.000 0.482 318 D N 2.118 122.594 120.400 0.125 0.000 2.515 318 D HA -0.009 4.585 4.640 -0.075 0.000 0.232 318 D C -0.578 175.742 176.300 0.033 0.000 1.157 318 D CA 0.608 54.618 54.000 0.017 0.000 0.871 318 D CB 0.258 41.084 40.800 0.044 0.000 1.200 318 D HN -0.206 8.304 8.370 0.234 0.000 0.466 319 P HA 0.000 4.431 4.420 0.019 0.000 0.216 319 P CA 0.000 63.109 63.100 0.015 0.000 0.800 319 P CB 0.000 31.700 31.700 -0.001 0.000 0.726