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 1gk8_1_E DATA FIRST_RESID 11 DATA SEQUENCE AGFKAGVKDY RLTYYTPDYV VRDTDILAAF RMTPQPGVPP EECGAAVAAE DATA SEQUENCE SSTGTWTTVW TDGLTSLDRY KGRCYDIEPV PGEDNQYIAY VAYXIDLFEE DATA SEQUENCE GSVTNMFTSI VGNVFGFKAL RALRLEDLRI PPAYVKTFVG XPHGIQVERD DATA SEQUENCE KLNKYGRGLL GCTIKPKLGL SAKNYGRAVY ECLRGGLDFT XDDENVNSQP DATA SEQUENCE FMRWRDRFLF VAEAIYKAQA ETGEVKGHYL NATAGTCEEM MKRAVXAKEL DATA SEQUENCE GVPIIMHDYL TGGFTANTSL AIYCRDNGLL LHIHRAMHAV IDRQRNHGIH DATA SEQUENCE FRVLAKALRM SGGDHLHSGT VVGKLEGERE VTLGFVDLMR DDYVEKDRSR DATA SEQUENCE GIYFTQDWXS MPGVMPVASG GIHVWHMPAL VEIFGDDACL QFGGGTLGHP DATA SEQUENCE WGNAPGAAAN RVALEACTQA RNEGRDLARE GGDVIRSACK WSPELAAACE DATA SEQUENCE VWKEIKFEFD TIDKL 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 11 A HA 0.000 4.320 4.320 0.000 0.000 0.244 11 A C 0.000 177.623 177.584 0.065 0.000 1.274 11 A CA 0.000 52.061 52.037 0.039 0.000 0.836 11 A CB 0.000 19.022 19.000 0.037 0.000 0.831 12 G N 0.174 109.011 108.800 0.061 0.000 2.503 12 G HA2 0.478 4.438 3.960 0.001 0.000 0.257 12 G HA3 0.478 4.438 3.960 0.001 0.000 0.257 12 G C -0.149 174.842 174.900 0.151 0.000 1.214 12 G CA -0.412 44.741 45.100 0.089 0.000 0.839 12 G HN 1.086 9.376 8.290 0.000 0.000 0.559 13 F N 1.501 121.472 119.950 0.035 0.000 2.472 13 F HA 0.409 4.936 4.527 0.001 0.000 0.364 13 F C 0.484 176.300 175.800 0.026 0.000 1.090 13 F CA -0.792 57.240 58.000 0.053 0.000 1.188 13 F CB 0.856 39.916 39.000 0.099 0.000 1.105 13 F HN 0.265 8.565 8.300 0.000 0.000 0.536 14 K N 6.311 126.486 120.400 -0.376 0.000 2.483 14 K HA 0.652 4.972 4.320 0.001 0.000 0.256 14 K C -0.779 175.414 176.600 -0.677 0.000 0.961 14 K CA -0.740 55.237 56.287 -0.517 0.000 0.873 14 K CB 1.031 33.404 32.500 -0.212 0.000 1.107 14 K HN 0.812 9.062 8.250 0.000 0.000 0.432 15 A N 2.697 124.961 122.820 -0.928 0.000 2.483 15 A HA 0.594 4.915 4.320 0.001 0.000 0.238 15 A C 0.476 177.922 177.584 -0.230 0.000 1.070 15 A CA 0.904 52.631 52.037 -0.518 0.000 0.770 15 A CB 0.051 18.851 19.000 -0.334 0.000 1.008 15 A HN 1.018 9.168 8.150 0.000 0.000 0.497 16 G N -0.798 107.919 108.800 -0.139 0.000 2.381 16 G HA2 0.320 4.280 3.960 0.001 0.000 0.672 16 G HA3 0.320 4.280 3.960 0.001 0.000 0.672 16 G C -0.904 173.926 174.900 -0.116 0.000 1.324 16 G CA -0.456 44.581 45.100 -0.105 0.000 0.975 16 G HN 1.408 9.698 8.290 0.000 0.000 0.593 17 V N 1.598 121.469 119.914 -0.071 0.000 2.583 17 V HA 0.612 4.732 4.120 0.001 0.000 0.287 17 V C 0.735 176.794 176.094 -0.058 0.000 1.051 17 V CA 0.717 62.980 62.300 -0.062 0.000 1.010 17 V CB 1.063 32.920 31.823 0.056 0.000 0.988 17 V HN 1.048 9.238 8.190 0.000 0.000 0.478 18 K N 2.064 122.410 120.400 -0.090 0.000 2.466 18 K HA 0.610 4.930 4.320 0.001 0.000 0.260 18 K C -1.408 175.132 176.600 -0.100 0.000 1.011 18 K CA -1.099 55.148 56.287 -0.067 0.000 0.871 18 K CB 1.649 34.120 32.500 -0.047 0.000 1.404 18 K HN 0.322 8.572 8.250 0.000 0.000 0.450 19 D N 0.968 121.341 120.400 -0.045 0.000 2.455 19 D HA 0.028 4.668 4.640 0.001 0.000 0.241 19 D C 0.587 176.901 176.300 0.024 0.000 1.138 19 D CA 0.174 54.165 54.000 -0.016 0.000 0.877 19 D CB 0.230 41.051 40.800 0.035 0.000 1.187 19 D HN 0.447 8.817 8.370 0.000 0.000 0.451 20 Y N 1.358 121.714 120.300 0.094 0.000 2.256 20 Y HA -0.217 4.334 4.550 0.001 0.000 0.288 20 Y C 2.410 178.428 175.900 0.196 0.000 1.155 20 Y CA 1.179 59.375 58.100 0.159 0.000 1.203 20 Y CB -0.259 38.235 38.460 0.056 0.000 0.980 20 Y HN 0.456 8.736 8.280 0.000 0.000 0.530 21 R N 0.489 121.147 120.500 0.264 0.000 2.193 21 R HA -0.124 4.217 4.340 0.001 0.000 0.229 21 R C 1.625 178.036 176.300 0.186 0.000 1.110 21 R CA 1.430 57.664 56.100 0.223 0.000 0.988 21 R CB -1.047 29.330 30.300 0.129 0.000 0.871 21 R HN 0.373 8.643 8.270 0.000 0.000 0.458 22 L N 0.825 122.123 121.223 0.125 0.000 2.265 22 L HA -0.066 4.275 4.340 0.001 0.000 0.215 22 L C 1.442 178.314 176.870 0.004 0.000 1.117 22 L CA 1.412 56.288 54.840 0.060 0.000 0.782 22 L CB -0.226 41.853 42.059 0.034 0.000 0.914 22 L HN 0.303 8.533 8.230 0.000 0.000 0.441 23 T N -3.077 111.465 114.554 -0.019 0.000 2.999 23 T HA 0.051 4.401 4.350 0.001 0.000 0.247 23 T C 0.933 175.388 174.700 -0.408 0.000 1.012 23 T CA 0.285 62.210 62.100 -0.291 0.000 1.048 23 T CB 0.192 68.752 68.868 -0.514 0.000 1.020 23 T HN 0.127 8.367 8.240 0.000 0.000 0.478 24 Y N -0.407 119.935 120.300 0.069 0.000 2.500 24 Y HA 0.425 4.975 4.550 0.001 0.000 0.246 24 Y C -0.129 175.824 175.900 0.087 0.000 1.146 24 Y CA -1.273 56.850 58.100 0.038 0.000 1.230 24 Y CB 0.537 39.014 38.460 0.027 0.000 1.214 24 Y HN 0.160 8.440 8.280 0.000 0.000 0.526 25 Y N 2.370 122.715 120.300 0.076 0.000 2.434 25 Y HA 0.440 4.990 4.550 0.001 0.000 0.341 25 Y C -0.072 175.845 175.900 0.028 0.000 0.965 25 Y CA -1.446 56.679 58.100 0.042 0.000 1.205 25 Y CB 0.584 39.063 38.460 0.031 0.000 1.121 25 Y HN 0.040 8.320 8.280 0.000 0.000 0.507 26 T N 5.507 119.908 114.554 -0.256 0.000 3.226 26 T HA 0.308 4.658 4.350 0.001 0.000 0.378 26 T C -2.586 171.985 174.700 -0.214 0.000 1.380 26 T CA -1.832 60.132 62.100 -0.228 0.000 1.396 26 T CB 1.315 70.120 68.868 -0.104 0.000 1.044 26 T HN 0.442 8.682 8.240 0.000 0.000 0.586 27 P HA 0.109 4.529 4.420 0.000 0.000 0.249 27 P C 0.471 177.745 177.300 -0.042 0.000 1.229 27 P CA 0.475 63.426 63.100 -0.248 0.000 0.788 27 P CB 0.174 31.625 31.700 -0.415 0.000 1.072 28 D N -2.164 118.218 120.400 -0.030 0.000 2.363 28 D HA -0.070 4.571 4.640 0.001 0.000 0.214 28 D C 0.248 176.576 176.300 0.047 0.000 1.093 28 D CA -0.924 53.081 54.000 0.008 0.000 0.837 28 D CB -1.143 39.648 40.800 -0.015 0.000 0.948 28 D HN 0.063 8.433 8.370 0.000 0.000 0.507 29 Y N 1.584 121.859 120.300 -0.041 0.000 2.620 29 Y HA 0.246 4.797 4.550 0.001 0.000 0.330 29 Y C -0.287 175.558 175.900 -0.093 0.000 1.186 29 Y CA -0.490 57.573 58.100 -0.061 0.000 1.467 29 Y CB 0.780 39.209 38.460 -0.050 0.000 1.262 29 Y HN -0.219 8.061 8.280 0.000 0.000 0.550 30 V N 8.618 128.123 119.914 -0.681 0.000 2.385 30 V HA 0.191 4.312 4.120 0.001 0.000 0.269 30 V C -0.147 175.279 176.094 -1.112 0.000 1.043 30 V CA -0.726 61.176 62.300 -0.663 0.000 0.906 30 V CB 0.512 32.104 31.823 -0.386 0.000 0.995 30 V HN 0.738 8.928 8.190 0.000 0.000 0.467 31 V N 4.130 123.550 119.914 -0.823 0.000 2.843 31 V HA 0.384 4.504 4.120 0.001 0.000 0.305 31 V C 0.504 176.364 176.094 -0.390 0.000 1.065 31 V CA -0.558 61.356 62.300 -0.643 0.000 1.116 31 V CB 0.128 31.661 31.823 -0.484 0.000 0.968 31 V HN 0.832 9.022 8.190 0.000 0.000 0.487 32 R N 2.594 122.961 120.500 -0.222 0.000 2.500 32 R HA 0.298 4.639 4.340 0.001 0.000 0.275 32 R C 0.290 176.540 176.300 -0.083 0.000 1.051 32 R CA -0.543 55.486 56.100 -0.118 0.000 1.088 32 R CB 0.603 30.883 30.300 -0.035 0.000 1.063 32 R HN 0.766 9.036 8.270 0.000 0.000 0.511 33 D N 0.469 120.831 120.400 -0.062 0.000 2.348 33 D HA -0.087 4.554 4.640 0.001 0.000 0.216 33 D C 1.387 177.672 176.300 -0.026 0.000 0.970 33 D CA 1.302 55.276 54.000 -0.044 0.000 0.889 33 D CB 0.156 40.939 40.800 -0.029 0.000 0.912 33 D HN 0.627 8.997 8.370 0.000 0.000 0.524 34 T N -2.551 111.997 114.554 -0.009 0.000 3.086 34 T HA 0.038 4.388 4.350 0.001 0.000 0.250 34 T C 0.491 175.202 174.700 0.018 0.000 1.074 34 T CA -0.500 61.609 62.100 0.015 0.000 0.988 34 T CB 0.331 69.221 68.868 0.037 0.000 0.988 34 T HN -0.236 8.004 8.240 0.000 0.000 0.530 35 D N 1.778 122.184 120.400 0.012 0.000 2.382 35 D HA 0.323 4.963 4.640 0.001 0.000 0.245 35 D C -0.124 176.170 176.300 -0.011 0.000 1.120 35 D CA -0.454 53.573 54.000 0.046 0.000 0.890 35 D CB 0.677 41.516 40.800 0.064 0.000 1.201 35 D HN 0.180 8.550 8.370 0.000 0.000 0.433 36 I N 2.118 122.704 120.570 0.027 0.000 2.416 36 I HA 0.124 4.294 4.170 0.001 0.000 0.288 36 I C 0.147 176.301 176.117 0.061 0.000 1.051 36 I CA -0.069 61.182 61.300 -0.081 0.000 1.375 36 I CB 0.397 38.202 38.000 -0.324 0.000 1.407 36 I HN 0.059 8.269 8.210 0.000 0.000 0.516 37 L N 6.002 127.134 121.223 -0.152 0.000 2.334 37 L HA 0.885 5.226 4.340 0.001 0.000 0.276 37 L C -0.059 176.714 176.870 -0.161 0.000 1.014 37 L CA -0.799 53.957 54.840 -0.140 0.000 0.815 37 L CB 1.591 43.345 42.059 -0.509 0.000 1.268 37 L HN 0.668 8.898 8.230 0.000 0.000 0.428 38 A N 1.914 124.840 122.820 0.177 0.000 2.386 38 A HA 0.885 5.205 4.320 0.001 0.000 0.311 38 A C -0.733 176.948 177.584 0.161 0.000 1.068 38 A CA -0.551 51.536 52.037 0.083 0.000 0.743 38 A CB 1.747 20.716 19.000 -0.052 0.000 1.258 38 A HN 0.753 8.903 8.150 0.000 0.000 0.429 39 A N 1.716 124.502 122.820 -0.057 0.000 2.267 39 A HA 0.722 5.042 4.320 0.001 0.000 0.315 39 A C -1.182 176.061 177.584 -0.568 0.000 1.297 39 A CA -0.285 51.490 52.037 -0.436 0.000 0.865 39 A CB -0.133 18.473 19.000 -0.656 0.000 1.165 39 A HN 0.618 8.768 8.150 0.000 0.000 0.513 40 F N 1.531 121.282 119.950 -0.332 0.000 2.427 40 F HA 0.470 4.997 4.527 0.001 0.000 0.346 40 F C 0.935 176.587 175.800 -0.246 0.000 1.120 40 F CA -0.355 57.490 58.000 -0.258 0.000 1.033 40 F CB 1.624 40.483 39.000 -0.234 0.000 1.126 40 F HN 0.602 8.902 8.300 0.000 0.000 0.462 41 R N 5.437 125.925 120.500 -0.019 0.000 2.210 41 R HA 0.421 4.762 4.340 0.001 0.000 0.338 41 R C -0.875 175.436 176.300 0.019 0.000 1.062 41 R CA -0.250 55.848 56.100 -0.003 0.000 0.902 41 R CB 0.507 30.807 30.300 0.000 0.000 1.050 41 R HN 0.855 9.125 8.270 0.000 0.000 0.461 42 M N 3.906 123.526 119.600 0.035 0.000 2.311 42 M HA 0.307 4.788 4.480 0.001 0.000 0.325 42 M C -1.323 175.027 176.300 0.083 0.000 1.061 42 M CA -0.288 55.021 55.300 0.014 0.000 0.957 42 M CB 2.253 34.836 32.600 -0.029 0.000 1.646 42 M HN 0.438 8.728 8.290 0.000 0.000 0.434 43 T N 6.222 120.810 114.554 0.056 0.000 2.963 43 T HA 0.474 4.825 4.350 0.001 0.000 0.343 43 T C -2.664 172.076 174.700 0.066 0.000 1.146 43 T CA -1.121 61.026 62.100 0.079 0.000 1.016 43 T CB 0.845 69.750 68.868 0.062 0.000 1.046 43 T HN 0.444 8.684 8.240 0.000 0.000 0.496 44 P HA 0.164 4.584 4.420 0.000 0.000 0.274 44 P C 0.106 177.434 177.300 0.045 0.000 1.231 44 P CA -0.629 62.496 63.100 0.042 0.000 0.790 44 P CB 0.570 32.286 31.700 0.027 0.000 0.951 45 Q N 2.359 122.177 119.800 0.031 0.000 2.421 45 Q HA 0.127 4.467 4.340 0.001 0.000 0.255 45 Q C -1.901 174.117 176.000 0.030 0.000 1.013 45 Q CA -1.272 54.549 55.803 0.030 0.000 0.895 45 Q CB -0.654 28.100 28.738 0.027 0.000 1.271 45 Q HN 0.363 8.633 8.270 0.000 0.000 0.460 46 P HA -0.071 4.349 4.420 0.000 0.000 0.262 46 P C 0.556 177.868 177.300 0.020 0.000 1.182 46 P CA 1.034 64.150 63.100 0.026 0.000 0.761 46 P CB 0.256 31.969 31.700 0.021 0.000 0.795 47 G N 1.531 110.342 108.800 0.018 0.000 2.199 47 G HA2 -0.204 3.757 3.960 0.001 0.000 0.254 47 G HA3 -0.204 3.757 3.960 0.001 0.000 0.254 47 G C -0.106 174.798 174.900 0.006 0.000 0.982 47 G CA -0.049 45.058 45.100 0.012 0.000 0.632 47 G HN 0.552 8.842 8.290 0.000 0.000 0.529 48 V N 3.357 123.273 119.914 0.003 0.000 2.333 48 V HA 0.456 4.577 4.120 0.001 0.000 0.274 48 V C -1.447 174.617 176.094 -0.050 0.000 1.028 48 V CA -1.578 60.714 62.300 -0.013 0.000 0.851 48 V CB 1.308 33.129 31.823 -0.004 0.000 1.000 48 V HN 0.198 8.388 8.190 0.000 0.000 0.456 49 P HA 0.157 4.577 4.420 0.000 0.000 0.269 49 P C -2.002 175.158 177.300 -0.233 0.000 1.209 49 P CA -1.442 61.579 63.100 -0.132 0.000 0.776 49 P CB 0.292 31.923 31.700 -0.116 0.000 0.876 50 P HA -0.168 4.252 4.420 0.000 0.000 0.217 50 P C 1.038 178.040 177.300 -0.497 0.000 1.150 50 P CA 1.564 64.307 63.100 -0.596 0.000 0.832 50 P CB 0.150 31.139 31.700 -1.184 0.000 0.787 51 E N 0.146 120.035 120.200 -0.518 0.000 2.077 51 E HA -0.208 4.142 4.350 0.001 0.000 0.193 51 E C 2.126 178.445 176.600 -0.468 0.000 0.989 51 E CA 1.295 57.245 56.400 -0.751 0.000 0.800 51 E CB -0.684 28.533 29.700 -0.806 0.000 0.746 51 E HN 0.270 8.630 8.360 0.000 0.000 0.452 52 E N 0.013 120.054 120.200 -0.265 0.000 2.107 52 E HA -0.110 4.240 4.350 0.001 0.000 0.191 52 E C 1.863 178.384 176.600 -0.132 0.000 0.982 52 E CA 0.837 57.170 56.400 -0.112 0.000 0.809 52 E CB -0.506 29.173 29.700 -0.036 0.000 0.756 52 E HN 0.292 8.652 8.360 0.000 0.000 0.459 53 C N -0.302 118.884 119.300 -0.190 0.000 2.432 53 C HA 0.037 4.497 4.460 0.001 0.000 0.277 53 C C 2.673 177.487 174.990 -0.294 0.000 1.249 53 C CA 1.403 60.291 59.018 -0.216 0.000 1.725 53 C CB -1.375 26.250 27.740 -0.192 0.000 2.028 53 C HN 0.646 8.876 8.230 0.000 0.000 0.477 54 G N -0.100 108.528 108.800 -0.286 0.000 2.418 54 G HA2 -0.080 3.880 3.960 0.001 0.000 0.217 54 G HA3 -0.080 3.880 3.960 0.001 0.000 0.217 54 G C 1.946 176.707 174.900 -0.231 0.000 1.158 54 G CA 1.109 46.054 45.100 -0.259 0.000 0.771 54 G HN 0.717 9.007 8.290 0.000 0.000 0.545 55 A N 1.078 123.799 122.820 -0.166 0.000 1.933 55 A HA 0.291 4.611 4.320 0.001 0.000 0.218 55 A C 2.800 180.194 177.584 -0.317 0.000 1.175 55 A CA 2.185 54.187 52.037 -0.059 0.000 0.628 55 A CB -0.704 18.364 19.000 0.114 0.000 0.814 55 A HN 0.763 8.913 8.150 0.000 0.000 0.444 56 A N -0.536 121.975 122.820 -0.515 0.000 1.898 56 A HA 0.020 4.340 4.320 0.001 0.000 0.216 56 A C 2.223 179.208 177.584 -0.999 0.000 1.181 56 A CA 1.706 53.066 52.037 -1.128 0.000 0.620 56 A CB -0.924 17.555 19.000 -0.868 0.000 0.819 56 A HN 0.368 8.518 8.150 0.000 0.000 0.442 57 V N -0.034 119.433 119.914 -0.744 0.000 2.287 57 V HA -0.282 3.838 4.120 0.001 0.000 0.248 57 V C 3.076 178.834 176.094 -0.562 0.000 1.053 57 V CA 2.070 63.926 62.300 -0.740 0.000 1.027 57 V CB -1.297 30.023 31.823 -0.838 0.000 0.646 57 V HN 0.622 8.812 8.190 0.000 0.000 0.447 58 A N -0.096 122.466 122.820 -0.429 0.000 1.877 58 A HA -0.142 4.178 4.320 0.001 0.000 0.216 58 A C 2.431 179.778 177.584 -0.395 0.000 1.186 58 A CA 2.292 54.157 52.037 -0.286 0.000 0.620 58 A CB -0.874 18.044 19.000 -0.136 0.000 0.822 58 A HN 0.583 8.733 8.150 0.000 0.000 0.443 59 A N -0.524 121.841 122.820 -0.757 0.000 1.877 59 A HA -0.140 4.180 4.320 0.001 0.000 0.216 59 A C 1.845 179.062 177.584 -0.610 0.000 1.186 59 A CA 1.570 52.866 52.037 -1.234 0.000 0.620 59 A CB -0.404 17.784 19.000 -1.353 0.000 0.822 59 A HN 0.492 8.642 8.150 0.000 0.000 0.443 60 E N 0.291 120.152 120.200 -0.565 0.000 2.502 60 E HA -0.014 4.336 4.350 0.001 0.000 0.194 60 E C 1.199 177.694 176.600 -0.174 0.000 1.062 60 E CA 0.784 56.989 56.400 -0.324 0.000 0.867 60 E CB -0.026 29.387 29.700 -0.478 0.000 0.888 60 E HN 0.705 9.065 8.360 0.000 0.000 0.510 61 S N -0.884 114.731 115.700 -0.140 0.000 2.568 61 S HA 0.143 4.613 4.470 0.001 0.000 0.232 61 S C 1.279 175.958 174.600 0.132 0.000 0.975 61 S CA 0.211 58.436 58.200 0.043 0.000 0.949 61 S CB 0.312 63.609 63.200 0.163 0.000 0.829 61 S HN 0.138 8.448 8.310 0.000 0.000 0.479 62 S N 1.314 117.041 115.700 0.046 0.000 4.640 62 S HA 0.177 4.647 4.470 0.001 0.000 0.157 62 S C 1.231 175.847 174.600 0.027 0.000 0.963 62 S CA 0.571 58.821 58.200 0.083 0.000 1.235 62 S CB -0.202 63.096 63.200 0.164 0.000 1.848 62 S HN 0.544 8.854 8.310 0.000 0.000 0.751 63 T N -0.941 113.641 114.554 0.047 0.000 3.041 63 T HA 0.511 4.861 4.350 0.001 0.000 0.276 63 T C 0.682 175.432 174.700 0.083 0.000 0.948 63 T CA 0.355 62.504 62.100 0.081 0.000 0.885 63 T CB 0.338 69.313 68.868 0.179 0.000 1.175 63 T HN 0.780 9.020 8.240 0.000 0.000 0.529 64 G N 0.154 108.953 108.800 -0.002 0.000 2.441 64 G HA2 0.591 4.551 3.960 0.001 0.000 0.334 64 G HA3 0.591 4.551 3.960 0.001 0.000 0.334 64 G C -0.951 174.004 174.900 0.091 0.000 1.161 64 G CA -0.356 44.777 45.100 0.056 0.000 0.935 64 G HN 0.238 8.528 8.290 0.000 0.000 0.488 65 T N -0.897 113.746 114.554 0.148 0.000 2.645 65 T HA 0.440 4.791 4.350 0.001 0.000 0.273 65 T C 0.584 175.419 174.700 0.225 0.000 0.960 65 T CA -0.487 61.749 62.100 0.226 0.000 1.051 65 T CB 0.797 69.752 68.868 0.146 0.000 1.366 65 T HN 0.675 8.915 8.240 0.000 0.000 0.536 66 W N 0.634 122.022 121.300 0.146 0.000 2.905 66 W HA 0.318 4.978 4.660 0.000 0.000 0.251 66 W C 0.293 176.777 176.519 -0.058 0.000 1.305 66 W CA 0.300 57.678 57.345 0.054 0.000 1.465 66 W CB -0.987 28.533 29.460 0.100 0.000 1.122 66 W HN 0.522 8.702 8.180 0.000 0.000 0.659 67 T N 0.989 115.050 114.554 -0.822 0.000 2.896 67 T HA 0.336 4.687 4.350 0.001 0.000 0.297 67 T C -0.469 173.991 174.700 -0.400 0.000 1.108 67 T CA -0.298 61.356 62.100 -0.743 0.000 1.004 67 T CB 1.886 69.914 68.868 -1.399 0.000 1.159 67 T HN -0.219 8.021 8.240 0.000 0.000 0.499 68 T N 2.729 117.166 114.554 -0.195 0.000 2.870 68 T HA 0.445 4.795 4.350 0.001 0.000 0.300 68 T C 0.229 174.989 174.700 0.098 0.000 0.989 68 T CA -0.352 61.741 62.100 -0.012 0.000 1.139 68 T CB 0.133 69.037 68.868 0.061 0.000 0.920 68 T HN 0.650 8.890 8.240 0.000 0.000 0.537 69 V N 2.961 122.890 119.914 0.024 0.000 2.581 69 V HA 0.495 4.616 4.120 0.001 0.000 0.303 69 V C 1.140 177.077 176.094 -0.262 0.000 1.041 69 V CA -1.147 61.080 62.300 -0.122 0.000 0.907 69 V CB 1.349 33.017 31.823 -0.260 0.000 0.994 69 V HN 1.050 9.240 8.190 0.000 0.000 0.442 70 W N 2.275 123.138 121.300 -0.728 0.000 2.467 70 W HA -0.064 4.597 4.660 0.000 0.000 0.275 70 W C 1.420 177.697 176.519 -0.404 0.000 1.239 70 W CA 1.252 57.995 57.345 -1.002 0.000 1.266 70 W CB -1.569 26.952 29.460 -1.565 0.000 1.112 70 W HN 0.742 8.922 8.180 0.000 0.000 0.576 71 T N -1.081 112.826 114.554 -1.078 0.000 3.007 71 T HA -0.190 4.160 4.350 0.001 0.000 0.270 71 T C 1.091 175.574 174.700 -0.362 0.000 1.107 71 T CA 1.472 63.022 62.100 -0.917 0.000 1.118 71 T CB -0.580 67.651 68.868 -1.061 0.000 0.889 71 T HN -0.092 8.148 8.240 0.000 0.000 0.506 72 D N 2.159 122.417 120.400 -0.237 0.000 2.158 72 D HA -0.062 4.578 4.640 0.001 0.000 0.197 72 D C 2.310 178.591 176.300 -0.031 0.000 0.995 72 D CA 1.466 55.410 54.000 -0.093 0.000 0.846 72 D CB -0.902 39.878 40.800 -0.034 0.000 0.941 72 D HN 0.609 8.979 8.370 0.000 0.000 0.456 73 G N 0.042 108.844 108.800 0.002 0.000 2.509 73 G HA2 -0.118 3.842 3.960 0.001 0.000 0.218 73 G HA3 -0.118 3.842 3.960 0.001 0.000 0.218 73 G C 1.601 176.533 174.900 0.053 0.000 1.124 73 G CA 0.003 45.135 45.100 0.053 0.000 0.776 73 G HN 0.275 8.565 8.290 0.000 0.000 0.547 74 L N -0.283 120.959 121.223 0.032 0.000 2.395 74 L HA 0.155 4.495 4.340 0.001 0.000 0.218 74 L C 1.729 178.614 176.870 0.025 0.000 1.130 74 L CA 0.493 55.354 54.840 0.035 0.000 0.826 74 L CB -0.016 42.053 42.059 0.016 0.000 0.941 74 L HN 0.215 8.445 8.230 0.000 0.000 0.451 75 T N -2.390 112.178 114.554 0.022 0.000 2.718 75 T HA 0.298 4.648 4.350 0.001 0.000 0.267 75 T C -0.450 174.305 174.700 0.091 0.000 0.957 75 T CA -0.463 61.679 62.100 0.069 0.000 1.025 75 T CB 1.935 70.833 68.868 0.050 0.000 1.355 75 T HN -0.121 8.119 8.240 0.000 0.000 0.572 76 S N 1.551 117.348 115.700 0.161 0.000 2.601 76 S HA 0.367 4.837 4.470 0.001 0.000 0.312 76 S C 0.803 175.466 174.600 0.104 0.000 1.107 76 S CA -0.691 57.557 58.200 0.080 0.000 1.129 76 S CB 0.310 63.512 63.200 0.003 0.000 0.982 76 S HN 0.560 8.870 8.310 0.000 0.000 0.469 77 L N 4.275 125.534 121.223 0.061 0.000 2.191 77 L HA 0.027 4.368 4.340 0.001 0.000 0.212 77 L C 1.754 178.604 176.870 -0.033 0.000 1.103 77 L CA 1.790 56.656 54.840 0.043 0.000 0.769 77 L CB -0.444 41.607 42.059 -0.013 0.000 0.908 77 L HN 0.601 8.831 8.230 0.000 0.000 0.438 78 D N -0.817 119.540 120.400 -0.073 0.000 2.123 78 D HA -0.243 4.397 4.640 0.001 0.000 0.196 78 D C 2.309 178.520 176.300 -0.148 0.000 0.992 78 D CA 1.164 55.099 54.000 -0.109 0.000 0.833 78 D CB -0.070 40.679 40.800 -0.086 0.000 0.954 78 D HN 0.280 8.650 8.370 0.000 0.000 0.455 79 R N -0.923 119.444 120.500 -0.221 0.000 2.092 79 R HA -0.130 4.211 4.340 0.001 0.000 0.231 79 R C 1.519 177.529 176.300 -0.483 0.000 1.119 79 R CA 1.152 56.995 56.100 -0.428 0.000 0.970 79 R CB -0.003 29.869 30.300 -0.713 0.000 0.864 79 R HN 0.247 8.517 8.270 0.000 0.000 0.440 80 Y N 0.407 120.687 120.300 -0.033 0.000 2.498 80 Y HA 0.144 4.694 4.550 0.001 0.000 0.259 80 Y C 0.184 176.076 175.900 -0.012 0.000 1.086 80 Y CA -0.229 57.856 58.100 -0.025 0.000 1.287 80 Y CB 0.179 38.623 38.460 -0.026 0.000 1.146 80 Y HN -0.054 8.226 8.280 0.000 0.000 0.523 81 K N 1.237 121.695 120.400 0.097 0.000 2.382 81 K HA 0.323 4.643 4.320 0.001 0.000 0.275 81 K C 0.603 177.237 176.600 0.057 0.000 1.009 81 K CA 0.053 56.416 56.287 0.127 0.000 0.970 81 K CB 0.611 33.117 32.500 0.009 0.000 0.934 81 K HN 0.134 8.384 8.250 0.000 0.000 0.479 82 G N 2.503 111.374 108.800 0.119 0.000 2.483 82 G HA2 0.196 4.157 3.960 0.001 0.000 0.248 82 G HA3 0.196 4.157 3.960 0.001 0.000 0.248 82 G C -0.770 174.103 174.900 -0.045 0.000 1.248 82 G CA -0.870 44.177 45.100 -0.088 0.000 0.838 82 G HN 0.645 8.935 8.290 0.000 0.000 0.566 83 R N 0.670 121.067 120.500 -0.172 0.000 2.483 83 R HA 0.259 4.599 4.340 0.001 0.000 0.303 83 R C -0.937 175.393 176.300 0.051 0.000 0.987 83 R CA -0.646 55.399 56.100 -0.092 0.000 0.881 83 R CB 1.701 31.798 30.300 -0.340 0.000 1.177 83 R HN 0.515 8.785 8.270 0.000 0.000 0.451 84 C N 5.158 124.518 119.300 0.100 0.000 2.610 84 C HA 0.149 4.609 4.460 0.001 0.000 0.382 84 C C 1.073 176.182 174.990 0.200 0.000 1.287 84 C CA -0.342 58.767 59.018 0.152 0.000 1.640 84 C CB -1.208 26.644 27.740 0.187 0.000 2.335 84 C HN 0.977 9.207 8.230 0.000 0.000 0.577 85 Y N 2.049 122.446 120.300 0.161 0.000 2.467 85 Y HA 0.536 5.087 4.550 0.001 0.000 0.250 85 Y C 0.177 176.158 175.900 0.134 0.000 1.155 85 Y CA -0.403 57.769 58.100 0.120 0.000 1.249 85 Y CB 0.007 38.596 38.460 0.216 0.000 1.146 85 Y HN 0.549 8.829 8.280 0.000 0.000 0.524 86 D N 0.372 120.719 120.400 -0.089 0.000 2.745 86 D HA 0.467 5.108 4.640 0.001 0.000 0.221 86 D C -1.753 174.664 176.300 0.195 0.000 1.237 86 D CA -0.346 53.680 54.000 0.042 0.000 0.781 86 D CB 1.727 42.461 40.800 -0.110 0.000 1.575 86 D HN 0.164 8.534 8.370 0.000 0.000 0.482 87 I N 2.479 123.184 120.570 0.226 0.000 2.534 87 I HA 0.344 4.515 4.170 0.001 0.000 0.288 87 I C -0.684 175.567 176.117 0.224 0.000 1.077 87 I CA -0.700 60.722 61.300 0.204 0.000 1.051 87 I CB 1.969 40.013 38.000 0.073 0.000 1.234 87 I HN 0.293 8.502 8.210 0.000 0.000 0.425 88 E N 7.187 127.548 120.200 0.269 0.000 2.222 88 E HA 0.566 4.916 4.350 0.001 0.000 0.267 88 E C -2.882 173.864 176.600 0.243 0.000 0.884 88 E CA -2.286 54.254 56.400 0.233 0.000 0.764 88 E CB 2.115 31.945 29.700 0.217 0.000 1.169 88 E HN 0.125 8.485 8.360 0.000 0.000 0.413 89 P HA -0.000 4.420 4.420 0.000 0.000 0.271 89 P C -0.213 177.069 177.300 -0.030 0.000 1.218 89 P CA -0.400 62.715 63.100 0.026 0.000 0.780 89 P CB 0.780 32.488 31.700 0.013 0.000 0.901 90 V N 5.156 124.995 119.914 -0.125 0.000 2.432 90 V HA 0.182 4.302 4.120 0.001 0.000 0.271 90 V C -1.905 174.149 176.094 -0.066 0.000 1.046 90 V CA -1.701 60.561 62.300 -0.064 0.000 0.945 90 V CB 0.459 32.244 31.823 -0.062 0.000 0.992 90 V HN 0.537 8.727 8.190 0.000 0.000 0.471 91 P HA 0.239 4.659 4.420 0.000 0.000 0.264 91 P C 0.965 178.248 177.300 -0.027 0.000 1.193 91 P CA 1.088 64.172 63.100 -0.027 0.000 0.763 91 P CB 0.620 32.310 31.700 -0.016 0.000 0.810 92 G N 1.402 110.184 108.800 -0.029 0.000 2.194 92 G HA2 -0.161 3.799 3.960 0.001 0.000 0.236 92 G HA3 -0.161 3.799 3.960 0.001 0.000 0.236 92 G C -0.163 174.718 174.900 -0.032 0.000 0.987 92 G CA -0.328 44.759 45.100 -0.022 0.000 0.635 92 G HN 0.542 8.832 8.290 0.000 0.000 0.520 93 E N 0.286 120.451 120.200 -0.057 0.000 2.210 93 E HA 0.509 4.859 4.350 0.001 0.000 0.266 93 E C -0.425 176.103 176.600 -0.119 0.000 0.883 93 E CA -0.655 55.697 56.400 -0.080 0.000 0.761 93 E CB 1.648 31.290 29.700 -0.098 0.000 1.156 93 E HN 0.131 8.491 8.360 0.000 0.000 0.412 94 D N 0.785 121.127 120.400 -0.096 0.000 2.354 94 D HA -0.016 4.625 4.640 0.001 0.000 0.209 94 D C 0.608 176.829 176.300 -0.132 0.000 1.015 94 D CA 0.442 54.384 54.000 -0.097 0.000 0.867 94 D CB 0.316 41.091 40.800 -0.041 0.000 0.933 94 D HN 0.186 8.556 8.370 0.000 0.000 0.520 95 N N 0.087 118.698 118.700 -0.148 0.000 2.387 95 N HA 0.092 4.832 4.740 0.001 0.000 0.259 95 N C -1.128 174.286 175.510 -0.161 0.000 1.369 95 N CA -0.061 52.923 53.050 -0.110 0.000 0.867 95 N CB 0.431 38.922 38.487 0.007 0.000 1.341 95 N HN -0.079 8.301 8.380 0.000 0.000 0.495 96 Q N 0.249 119.845 119.800 -0.340 0.000 2.342 96 Q HA 0.420 4.761 4.340 0.001 0.000 0.267 96 Q C -1.419 174.262 176.000 -0.531 0.000 1.038 96 Q CA -0.679 54.970 55.803 -0.258 0.000 0.832 96 Q CB 1.984 30.651 28.738 -0.118 0.000 1.323 96 Q HN 0.230 8.500 8.270 0.000 0.000 0.448 97 Y N 0.822 121.118 120.300 -0.007 0.000 2.524 97 Y HA 0.423 4.973 4.550 0.001 0.000 0.347 97 Y C -0.386 175.501 175.900 -0.021 0.000 1.005 97 Y CA -1.139 56.957 58.100 -0.006 0.000 1.025 97 Y CB 1.422 39.869 38.460 -0.022 0.000 1.275 97 Y HN 0.411 8.691 8.280 0.000 0.000 0.460 98 I N 2.734 123.385 120.570 0.136 0.000 2.297 98 I HA 0.442 4.612 4.170 0.001 0.000 0.291 98 I C 0.097 176.179 176.117 -0.059 0.000 1.033 98 I CA -0.675 60.613 61.300 -0.020 0.000 1.253 98 I CB 0.397 38.368 38.000 -0.048 0.000 1.396 98 I HN 0.693 8.903 8.210 0.000 0.000 0.476 99 A N 7.491 130.247 122.820 -0.106 0.000 2.276 99 A HA 0.624 4.945 4.320 0.001 0.000 0.316 99 A C -1.165 176.322 177.584 -0.161 0.000 1.229 99 A CA -0.365 51.636 52.037 -0.059 0.000 0.851 99 A CB 0.276 19.249 19.000 -0.045 0.000 1.165 99 A HN 0.532 8.682 8.150 0.000 0.000 0.513 100 Y N 1.649 121.903 120.300 -0.077 0.000 2.328 100 Y HA 0.482 5.032 4.550 0.001 0.000 0.337 100 Y C 0.120 175.892 175.900 -0.213 0.000 1.008 100 Y CA -0.357 57.634 58.100 -0.182 0.000 1.129 100 Y CB 1.795 39.889 38.460 -0.609 0.000 1.185 100 Y HN 0.387 8.667 8.280 0.000 0.000 0.476 101 V N 3.154 123.210 119.914 0.237 0.000 2.540 101 V HA 0.786 4.906 4.120 0.001 0.000 0.302 101 V C -0.341 175.900 176.094 0.245 0.000 1.035 101 V CA -1.062 61.345 62.300 0.179 0.000 0.873 101 V CB 1.636 33.479 31.823 0.034 0.000 0.992 101 V HN 0.850 9.040 8.190 0.000 0.000 0.428 102 A N 4.340 127.274 122.820 0.191 0.000 2.304 102 A HA 0.889 5.210 4.320 0.001 0.000 0.323 102 A C -1.295 176.186 177.584 -0.172 0.000 1.195 102 A CA -0.308 51.784 52.037 0.092 0.000 0.826 102 A CB 0.585 19.659 19.000 0.124 0.000 1.184 102 A HN 0.729 8.879 8.150 0.000 0.000 0.496 106 D N 1.690 122.178 120.400 0.147 0.000 2.309 106 D HA -0.003 4.638 4.640 0.001 0.000 0.212 106 D C 2.046 178.379 176.300 0.054 0.000 0.968 106 D CA 1.126 55.210 54.000 0.140 0.000 0.882 106 D CB 0.052 40.988 40.800 0.226 0.000 0.918 106 D HN 0.427 8.797 8.370 0.000 0.000 0.503 107 L N -0.709 120.454 121.223 -0.100 0.000 2.376 107 L HA -0.014 4.326 4.340 0.001 0.000 0.219 107 L C 0.174 176.670 176.870 -0.623 0.000 1.133 107 L CA 0.428 55.009 54.840 -0.432 0.000 0.816 107 L CB -0.174 41.462 42.059 -0.705 0.000 0.933 107 L HN -0.094 8.136 8.230 0.000 0.000 0.449 108 F N -0.377 119.535 119.950 -0.063 0.000 2.469 108 F HA 0.294 4.821 4.527 0.000 0.000 0.332 108 F C 0.660 176.490 175.800 0.050 0.000 1.103 108 F CA -1.146 56.810 58.000 -0.074 0.000 0.979 108 F CB 1.025 39.789 39.000 -0.393 0.000 1.137 108 F HN -0.187 8.113 8.300 0.000 0.000 0.463 109 E N 2.051 122.405 120.200 0.257 0.000 2.299 109 E HA 0.093 4.444 4.350 0.001 0.000 0.272 109 E C -0.693 176.042 176.600 0.225 0.000 1.043 109 E CA -0.498 56.011 56.400 0.180 0.000 0.895 109 E CB 0.486 30.248 29.700 0.102 0.000 1.011 109 E HN 0.495 8.855 8.360 0.000 0.000 0.432 110 E N 2.630 122.907 120.200 0.129 0.000 2.529 110 E HA 0.110 4.461 4.350 0.001 0.000 0.259 110 E C 0.947 177.329 176.600 -0.363 0.000 0.966 110 E CA 1.397 57.767 56.400 -0.050 0.000 0.937 110 E CB 0.411 30.081 29.700 -0.049 0.000 0.923 110 E HN 0.808 9.168 8.360 0.000 0.000 0.468 111 G N 2.519 110.691 108.800 -1.047 0.000 2.155 111 G HA2 -0.328 3.632 3.960 0.001 0.000 0.257 111 G HA3 -0.328 3.632 3.960 0.001 0.000 0.257 111 G C 0.317 174.745 174.900 -0.786 0.000 0.983 111 G CA 0.449 44.695 45.100 -1.424 0.000 0.676 111 G HN 0.561 8.851 8.290 0.000 0.000 0.528 112 S N -0.420 115.076 115.700 -0.340 0.000 2.577 112 S HA 0.537 5.008 4.470 0.001 0.000 0.294 112 S C 1.530 176.269 174.600 0.231 0.000 1.161 112 S CA 0.117 58.340 58.200 0.038 0.000 1.143 112 S CB 1.222 64.457 63.200 0.058 0.000 0.991 112 S HN 0.568 8.878 8.310 0.000 0.000 0.475 113 V N 4.781 124.816 119.914 0.203 0.000 2.343 113 V HA -0.145 3.975 4.120 0.001 0.000 0.247 113 V C 2.614 178.567 176.094 -0.235 0.000 1.051 113 V CA 2.515 64.733 62.300 -0.137 0.000 1.036 113 V CB -1.148 30.288 31.823 -0.644 0.000 0.654 113 V HN 0.839 9.029 8.190 0.000 0.000 0.451 114 T N 0.171 114.650 114.554 -0.126 0.000 2.624 114 T HA -0.309 4.041 4.350 0.001 0.000 0.268 114 T C 1.916 176.679 174.700 0.104 0.000 1.041 114 T CA 2.153 64.259 62.100 0.011 0.000 1.159 114 T CB -0.552 68.368 68.868 0.087 0.000 0.863 114 T HN 0.593 8.833 8.240 0.000 0.000 0.434 115 N N 0.428 119.211 118.700 0.138 0.000 2.120 115 N HA -0.090 4.650 4.740 0.001 0.000 0.188 115 N C 2.130 177.800 175.510 0.266 0.000 1.024 115 N CA 1.286 54.443 53.050 0.179 0.000 0.852 115 N CB -0.238 38.357 38.487 0.181 0.000 1.003 115 N HN 0.412 8.792 8.380 0.000 0.000 0.424 116 M N -0.230 119.580 119.600 0.350 0.000 2.080 116 M HA -0.189 4.291 4.480 0.001 0.000 0.260 116 M C 1.522 178.021 176.300 0.331 0.000 1.068 116 M CA 1.614 57.149 55.300 0.392 0.000 1.109 116 M CB -0.177 32.582 32.600 0.265 0.000 1.342 116 M HN 0.041 8.331 8.290 0.000 0.000 0.405 117 F N 0.460 120.416 119.950 0.010 0.000 2.186 117 F HA -0.136 4.391 4.527 0.001 0.000 0.299 117 F C 2.536 178.363 175.800 0.044 0.000 1.090 117 F CA 1.647 59.648 58.000 0.000 0.000 1.307 117 F CB -1.350 37.631 39.000 -0.031 0.000 1.019 117 F HN 0.190 8.490 8.300 0.000 0.000 0.489 118 T N -1.036 113.661 114.554 0.239 0.000 2.746 118 T HA -0.170 4.180 4.350 0.001 0.000 0.267 118 T C 2.349 177.111 174.700 0.104 0.000 1.039 118 T CA 1.711 63.901 62.100 0.151 0.000 1.142 118 T CB -0.403 68.537 68.868 0.121 0.000 0.866 118 T HN 0.151 8.391 8.240 0.000 0.000 0.444 119 S N 0.952 116.700 115.700 0.080 0.000 2.335 119 S HA 0.058 4.528 4.470 0.001 0.000 0.216 119 S C 2.070 176.690 174.600 0.033 0.000 1.032 119 S CA 0.938 59.146 58.200 0.014 0.000 1.000 119 S CB -0.359 62.781 63.200 -0.099 0.000 0.928 119 S HN 0.405 8.715 8.310 0.000 0.000 0.434 120 I N 1.454 122.026 120.570 0.003 0.000 2.394 120 I HA -0.065 4.105 4.170 0.001 0.000 0.251 120 I C 1.605 177.861 176.117 0.231 0.000 1.136 120 I CA 0.989 62.313 61.300 0.040 0.000 1.425 120 I CB -0.107 37.821 38.000 -0.120 0.000 1.079 120 I HN 0.258 8.468 8.210 0.000 0.000 0.425 121 V N -3.167 116.826 119.914 0.132 0.000 3.253 121 V HA 0.470 4.590 4.120 0.001 0.000 0.320 121 V C 1.580 177.764 176.094 0.150 0.000 1.442 121 V CA 0.278 62.700 62.300 0.202 0.000 1.097 121 V CB -0.314 31.392 31.823 -0.194 0.000 1.008 121 V HN 0.210 8.400 8.190 0.000 0.000 0.463 122 G N 1.716 110.607 108.800 0.152 0.000 2.414 122 G HA2 -0.139 3.821 3.960 0.001 0.000 0.215 122 G HA3 -0.139 3.821 3.960 0.001 0.000 0.215 122 G C 1.181 176.179 174.900 0.163 0.000 1.188 122 G CA 1.330 46.510 45.100 0.132 0.000 0.783 122 G HN 0.547 8.837 8.290 0.000 0.000 0.537 123 N N -0.629 118.192 118.700 0.201 0.000 2.297 123 N HA 0.009 4.749 4.740 0.001 0.000 0.208 123 N C 2.193 177.911 175.510 0.346 0.000 1.176 123 N CA 0.824 54.024 53.050 0.250 0.000 0.882 123 N CB 0.502 39.143 38.487 0.256 0.000 1.134 123 N HN 0.268 8.648 8.380 0.000 0.000 0.489 124 V N -1.276 118.774 119.914 0.227 0.000 2.759 124 V HA -0.016 4.104 4.120 0.001 0.000 0.256 124 V C 1.596 177.732 176.094 0.070 0.000 1.080 124 V CA 1.219 63.513 62.300 -0.010 0.000 1.101 124 V CB -1.142 30.456 31.823 -0.375 0.000 0.698 124 V HN -0.076 8.114 8.190 0.000 0.000 0.477 125 F N 2.448 122.453 119.950 0.090 0.000 2.502 125 F HA 0.313 4.841 4.527 0.001 0.000 0.298 125 F C 2.328 178.253 175.800 0.210 0.000 1.111 125 F CA 1.051 59.128 58.000 0.128 0.000 1.445 125 F CB -0.650 38.411 39.000 0.101 0.000 1.081 125 F HN 0.330 8.630 8.300 0.000 0.000 0.558 126 G N -1.563 107.450 108.800 0.356 0.000 3.088 126 G HA2 0.027 3.988 3.960 0.001 0.000 0.217 126 G HA3 0.027 3.988 3.960 0.001 0.000 0.217 126 G C 0.201 175.189 174.900 0.147 0.000 1.159 126 G CA -0.210 45.020 45.100 0.217 0.000 0.760 126 G HN 0.008 8.298 8.290 0.000 0.000 0.550 127 F N 1.375 121.332 119.950 0.012 0.000 2.572 127 F HA 0.193 4.720 4.527 0.000 0.000 0.370 127 F C 1.753 177.545 175.800 -0.012 0.000 1.103 127 F CA 0.145 58.134 58.000 -0.018 0.000 1.286 127 F CB 1.101 40.060 39.000 -0.068 0.000 1.105 127 F HN -0.049 8.251 8.300 0.000 0.000 0.583 128 K N 2.555 122.955 120.400 -0.001 0.000 2.147 128 K HA -0.127 4.193 4.320 0.001 0.000 0.205 128 K C 1.943 178.580 176.600 0.062 0.000 1.049 128 K CA 1.189 57.483 56.287 0.011 0.000 0.936 128 K CB -0.149 32.327 32.500 -0.041 0.000 0.722 128 K HN 0.701 8.951 8.250 0.000 0.000 0.446 129 A N 1.278 124.172 122.820 0.123 0.000 2.172 129 A HA 0.002 4.322 4.320 0.001 0.000 0.216 129 A C 0.782 178.402 177.584 0.060 0.000 1.154 129 A CA 0.561 52.658 52.037 0.101 0.000 0.701 129 A CB -0.530 18.557 19.000 0.145 0.000 0.789 129 A HN 0.254 8.404 8.150 0.000 0.000 0.465 130 L N -5.922 115.340 121.223 0.066 0.000 2.333 130 L HA 0.687 5.028 4.340 0.001 0.000 0.269 130 L C 0.567 177.468 176.870 0.051 0.000 1.010 130 L CA -0.792 54.067 54.840 0.031 0.000 0.818 130 L CB 1.354 43.399 42.059 -0.023 0.000 1.306 130 L HN -0.032 8.198 8.230 0.000 0.000 0.430 131 R N 1.249 121.778 120.500 0.049 0.000 2.206 131 R HA 0.675 5.016 4.340 0.001 0.000 0.198 131 R C -0.061 176.290 176.300 0.084 0.000 0.986 131 R CA 0.615 56.746 56.100 0.052 0.000 1.029 131 R CB 0.492 30.817 30.300 0.041 0.000 0.966 131 R HN 0.850 9.120 8.270 0.000 0.000 0.487 132 A N 0.795 123.691 122.820 0.127 0.000 2.605 132 A HA 0.593 4.913 4.320 0.001 0.000 0.294 132 A C -2.107 175.574 177.584 0.162 0.000 1.062 132 A CA -0.627 51.576 52.037 0.277 0.000 0.682 132 A CB 1.665 20.795 19.000 0.216 0.000 1.278 132 A HN 0.038 8.188 8.150 0.000 0.000 0.410 133 L N 0.737 122.044 121.223 0.139 0.000 2.526 133 L HA 0.766 5.106 4.340 0.001 0.000 0.263 133 L C -0.693 176.077 176.870 -0.166 0.000 0.943 133 L CA -0.075 54.640 54.840 -0.207 0.000 0.859 133 L CB 1.929 43.590 42.059 -0.663 0.000 1.313 133 L HN 0.841 9.071 8.230 0.000 0.000 0.406 134 R N 4.241 124.738 120.500 -0.006 0.000 2.532 134 R HA 0.555 4.895 4.340 0.001 0.000 0.297 134 R C -1.730 174.632 176.300 0.103 0.000 0.984 134 R CA -0.904 55.267 56.100 0.118 0.000 0.884 134 R CB 1.645 31.993 30.300 0.080 0.000 1.182 134 R HN 0.666 8.936 8.270 0.000 0.000 0.442 135 L N 4.689 126.009 121.223 0.162 0.000 2.325 135 L HA 0.189 4.529 4.340 0.001 0.000 0.284 135 L C 0.764 177.536 176.870 -0.165 0.000 1.089 135 L CA 0.641 55.397 54.840 -0.140 0.000 0.836 135 L CB 0.979 42.953 42.059 -0.143 0.000 1.184 135 L HN 0.717 8.947 8.230 0.000 0.000 0.444 136 E N 2.279 122.285 120.200 -0.323 0.000 2.166 136 E HA 0.087 4.438 4.350 0.001 0.000 0.192 136 E C -0.206 176.200 176.600 -0.322 0.000 0.967 136 E CA 0.506 56.687 56.400 -0.366 0.000 0.840 136 E CB 0.414 29.613 29.700 -0.834 0.000 0.795 136 E HN 0.688 9.048 8.360 0.000 0.000 0.470 137 D N -1.129 119.084 120.400 -0.312 0.000 2.648 137 D HA 0.378 5.019 4.640 0.001 0.000 0.244 137 D C -1.533 174.830 176.300 0.104 0.000 1.244 137 D CA -0.457 53.519 54.000 -0.039 0.000 0.772 137 D CB 1.383 42.209 40.800 0.043 0.000 1.379 137 D HN -0.157 8.213 8.370 0.000 0.000 0.428 138 L N 1.430 122.724 121.223 0.118 0.000 2.410 138 L HA 0.502 4.842 4.340 0.001 0.000 0.270 138 L C -0.144 176.634 176.870 -0.153 0.000 0.983 138 L CA -0.927 53.882 54.840 -0.052 0.000 0.822 138 L CB 2.214 44.202 42.059 -0.119 0.000 1.285 138 L HN 0.180 8.410 8.230 0.000 0.000 0.409 139 R N 4.344 124.522 120.500 -0.536 0.000 2.205 139 R HA 0.349 4.689 4.340 0.001 0.000 0.342 139 R C -0.920 175.162 176.300 -0.363 0.000 1.058 139 R CA -0.598 55.199 56.100 -0.506 0.000 0.904 139 R CB 0.392 30.222 30.300 -0.782 0.000 1.089 139 R HN 0.431 8.701 8.270 0.000 0.000 0.471 140 I N 7.984 128.345 120.570 -0.348 0.000 2.291 140 I HA 0.255 4.425 4.170 0.001 0.000 0.292 140 I C -1.914 174.047 176.117 -0.261 0.000 1.064 140 I CA -2.902 58.224 61.300 -0.291 0.000 1.269 140 I CB 0.897 38.679 38.000 -0.363 0.000 1.418 140 I HN 0.265 8.475 8.210 0.000 0.000 0.485 141 P HA 0.216 4.636 4.420 0.000 0.000 0.272 141 P C -2.248 175.030 177.300 -0.036 0.000 1.223 141 P CA -1.412 61.634 63.100 -0.090 0.000 0.784 141 P CB 0.440 32.115 31.700 -0.041 0.000 0.923 142 P HA -0.215 4.205 4.420 0.000 0.000 0.216 142 P C 1.507 178.847 177.300 0.067 0.000 1.154 142 P CA 2.391 65.505 63.100 0.023 0.000 0.865 142 P CB -0.484 31.237 31.700 0.035 0.000 0.789 143 A N -2.298 120.569 122.820 0.078 0.000 2.019 143 A HA -0.213 4.107 4.320 0.001 0.000 0.219 143 A C 2.159 179.857 177.584 0.190 0.000 1.164 143 A CA 1.304 53.407 52.037 0.110 0.000 0.644 143 A CB -1.594 17.463 19.000 0.094 0.000 0.805 143 A HN 0.162 8.312 8.150 0.000 0.000 0.449 144 Y N -0.142 120.186 120.300 0.046 0.000 2.347 144 Y HA 0.009 4.559 4.550 0.001 0.000 0.294 144 Y C 2.322 178.360 175.900 0.231 0.000 1.117 144 Y CA 0.869 59.032 58.100 0.105 0.000 1.184 144 Y CB -0.204 38.274 38.460 0.029 0.000 1.047 144 Y HN 0.049 8.329 8.280 0.000 0.000 0.546 145 V N 0.777 120.760 119.914 0.115 0.000 2.324 145 V HA -0.337 3.783 4.120 0.001 0.000 0.250 145 V C 2.224 178.427 176.094 0.182 0.000 1.060 145 V CA 2.114 64.471 62.300 0.095 0.000 1.042 145 V CB -0.531 31.339 31.823 0.079 0.000 0.650 145 V HN 0.242 8.432 8.190 0.000 0.000 0.450 146 K N 0.537 121.013 120.400 0.126 0.000 2.442 146 K HA -0.081 4.239 4.320 0.001 0.000 0.198 146 K C 2.046 178.678 176.600 0.052 0.000 1.042 146 K CA 1.498 57.841 56.287 0.093 0.000 0.958 146 K CB -0.750 31.794 32.500 0.072 0.000 0.766 146 K HN 0.767 9.017 8.250 0.000 0.000 0.474 147 T N -2.096 112.463 114.554 0.009 0.000 3.148 147 T HA 0.089 4.439 4.350 0.001 0.000 0.253 147 T C 0.454 174.941 174.700 -0.356 0.000 1.134 147 T CA -0.162 61.831 62.100 -0.180 0.000 1.051 147 T CB -0.241 68.449 68.868 -0.297 0.000 0.959 147 T HN -0.165 8.075 8.240 0.000 0.000 0.525 148 F N 0.394 120.252 119.950 -0.152 0.000 2.422 148 F HA 0.541 5.069 4.527 0.001 0.000 0.333 148 F C 1.342 177.094 175.800 -0.079 0.000 1.095 148 F CA -1.411 56.511 58.000 -0.130 0.000 1.038 148 F CB 1.592 40.503 39.000 -0.148 0.000 1.156 148 F HN -0.263 8.037 8.300 0.000 0.000 0.483 149 V N 2.236 122.192 119.914 0.071 0.000 2.295 149 V HA -0.013 4.107 4.120 0.001 0.000 0.246 149 V C 1.369 177.484 176.094 0.034 0.000 1.049 149 V CA 1.669 63.986 62.300 0.027 0.000 1.024 149 V CB -1.317 30.502 31.823 -0.007 0.000 0.648 149 V HN 1.161 9.351 8.190 0.000 0.000 0.447 153 H N -0.690 118.353 119.070 -0.044 0.000 2.067 153 H HA 0.489 5.045 4.556 0.000 0.000 0.220 153 H C 1.016 176.330 175.328 -0.023 0.000 0.883 153 H CA 1.309 57.342 56.048 -0.026 0.000 1.042 153 H CB 0.349 30.100 29.762 -0.019 0.000 1.305 153 H HN 0.316 8.596 8.280 0.000 0.000 0.430 154 G N 1.097 109.948 108.800 0.085 0.000 2.746 154 G HA2 -0.210 3.750 3.960 0.001 0.000 0.685 154 G HA3 -0.210 3.750 3.960 0.001 0.000 0.685 154 G C 0.803 175.744 174.900 0.069 0.000 1.350 154 G CA -0.025 45.096 45.100 0.034 0.000 0.837 154 G HN 0.222 8.512 8.290 0.000 0.000 0.564 155 I N 0.392 120.990 120.570 0.047 0.000 2.163 155 I HA -0.265 3.906 4.170 0.001 0.000 0.243 155 I C 2.990 179.155 176.117 0.080 0.000 1.085 155 I CA 2.453 63.791 61.300 0.064 0.000 1.347 155 I CB -0.337 37.690 38.000 0.045 0.000 1.044 155 I HN 0.679 8.889 8.210 0.000 0.000 0.408 156 Q N 0.098 119.945 119.800 0.078 0.000 2.050 156 Q HA -0.158 4.183 4.340 0.001 0.000 0.202 156 Q C 2.317 178.382 176.000 0.108 0.000 0.980 156 Q CA 1.658 57.522 55.803 0.101 0.000 0.840 156 Q CB -0.454 28.336 28.738 0.086 0.000 0.898 156 Q HN 0.337 8.607 8.270 0.000 0.000 0.424 157 V N 0.878 120.851 119.914 0.098 0.000 2.343 157 V HA -0.291 3.829 4.120 0.001 0.000 0.247 157 V C 2.220 178.354 176.094 0.067 0.000 1.051 157 V CA 2.122 64.482 62.300 0.100 0.000 1.036 157 V CB -0.609 31.299 31.823 0.142 0.000 0.654 157 V HN 0.459 8.649 8.190 0.000 0.000 0.451 158 E N 0.340 120.583 120.200 0.072 0.000 2.058 158 E HA -0.264 4.086 4.350 0.001 0.000 0.194 158 E C 2.461 179.077 176.600 0.027 0.000 0.997 158 E CA 1.535 57.964 56.400 0.048 0.000 0.801 158 E CB -0.117 29.647 29.700 0.107 0.000 0.746 158 E HN 0.508 8.868 8.360 0.000 0.000 0.450 159 R N 0.297 120.810 120.500 0.021 0.000 2.105 159 R HA -0.138 4.202 4.340 0.001 0.000 0.239 159 R C 2.005 178.206 176.300 -0.166 0.000 1.135 159 R CA 1.544 57.576 56.100 -0.114 0.000 0.967 159 R CB -0.199 30.072 30.300 -0.048 0.000 0.861 159 R HN 0.297 8.567 8.270 0.000 0.000 0.442 160 D N 0.430 120.865 120.400 0.058 0.000 2.144 160 D HA -0.108 4.532 4.640 0.001 0.000 0.200 160 D C 1.685 178.016 176.300 0.053 0.000 0.978 160 D CA 1.208 55.294 54.000 0.142 0.000 0.833 160 D CB 0.012 40.908 40.800 0.161 0.000 0.961 160 D HN 0.198 8.568 8.370 0.000 0.000 0.470 161 K N 0.084 120.489 120.400 0.008 0.000 2.103 161 K HA 0.032 4.353 4.320 0.001 0.000 0.204 161 K C 2.148 178.738 176.600 -0.016 0.000 1.052 161 K CA 0.502 56.782 56.287 -0.012 0.000 0.945 161 K CB 0.018 32.481 32.500 -0.061 0.000 0.722 161 K HN 0.141 8.391 8.250 0.000 0.000 0.443 162 L N 0.438 121.636 121.223 -0.042 0.000 2.395 162 L HA -0.018 4.322 4.340 0.001 0.000 0.218 162 L C 0.624 177.425 176.870 -0.115 0.000 1.130 162 L CA 0.185 54.990 54.840 -0.060 0.000 0.826 162 L CB -0.488 41.535 42.059 -0.059 0.000 0.941 162 L HN 0.410 8.640 8.230 0.000 0.000 0.451 163 N N 1.149 119.749 118.700 -0.166 0.000 2.758 163 N HA -0.181 4.560 4.740 0.001 0.000 0.248 163 N C -0.566 174.715 175.510 -0.382 0.000 1.076 163 N CA 0.354 53.300 53.050 -0.174 0.000 0.696 163 N CB -0.399 38.092 38.487 0.006 0.000 0.979 163 N HN 0.367 8.747 8.380 0.000 0.000 0.550 164 K N 1.533 121.497 120.400 -0.727 0.000 2.502 164 K HA 0.384 4.705 4.320 0.001 0.000 0.254 164 K C -1.485 174.680 176.600 -0.725 0.000 0.947 164 K CA -0.358 55.612 56.287 -0.528 0.000 0.834 164 K CB 1.066 33.393 32.500 -0.288 0.000 1.112 164 K HN 0.107 8.357 8.250 0.000 0.000 0.427 165 Y N -0.559 119.746 120.300 0.008 0.000 2.553 165 Y HA 0.450 5.001 4.550 0.000 0.000 0.347 165 Y C 1.021 176.927 175.900 0.010 0.000 1.019 165 Y CA -0.778 57.330 58.100 0.013 0.000 1.032 165 Y CB 2.544 41.013 38.460 0.014 0.000 1.284 165 Y HN 0.755 9.035 8.280 0.000 0.000 0.466 166 G N 1.466 110.371 108.800 0.175 0.000 2.157 166 G HA2 -0.178 3.782 3.960 0.001 0.000 0.239 166 G HA3 -0.178 3.782 3.960 0.001 0.000 0.239 166 G C -0.244 174.695 174.900 0.066 0.000 0.982 166 G CA 0.100 45.264 45.100 0.106 0.000 0.650 166 G HN 0.903 9.193 8.290 0.000 0.000 0.527 167 R N -1.209 119.323 120.500 0.054 0.000 2.690 167 R HA 0.607 4.948 4.340 0.001 0.000 0.269 167 R C 0.369 176.688 176.300 0.031 0.000 1.037 167 R CA -0.530 55.593 56.100 0.038 0.000 0.877 167 R CB 0.189 30.503 30.300 0.024 0.000 1.255 167 R HN 1.036 9.306 8.270 0.000 0.000 0.467 168 G N 1.771 110.592 108.800 0.036 0.000 2.484 168 G HA2 0.262 4.222 3.960 0.001 0.000 0.235 168 G HA3 0.262 4.222 3.960 0.001 0.000 0.235 168 G C 0.030 174.936 174.900 0.011 0.000 1.282 168 G CA -0.634 44.482 45.100 0.025 0.000 0.857 168 G HN 0.392 8.682 8.290 0.000 0.000 0.571 169 L N 0.365 121.591 121.223 0.006 0.000 2.418 169 L HA 0.420 4.760 4.340 0.001 0.000 0.265 169 L C 0.262 177.157 176.870 0.042 0.000 1.143 169 L CA -0.436 54.408 54.840 0.007 0.000 0.809 169 L CB 0.882 42.992 42.059 0.085 0.000 1.124 169 L HN 0.243 8.473 8.230 0.000 0.000 0.456 170 L N 1.228 122.469 121.223 0.029 0.000 2.356 170 L HA 0.683 5.023 4.340 0.001 0.000 0.277 170 L C 0.222 177.162 176.870 0.118 0.000 0.996 170 L CA -0.257 54.639 54.840 0.093 0.000 0.822 170 L CB 1.829 43.927 42.059 0.065 0.000 1.256 170 L HN 0.721 8.951 8.230 0.000 0.000 0.413 171 G N 0.725 109.612 108.800 0.144 0.000 3.140 171 G HA2 0.662 4.622 3.960 0.001 0.000 0.271 171 G HA3 0.662 4.622 3.960 0.001 0.000 0.271 171 G C -1.786 173.136 174.900 0.037 0.000 1.370 171 G CA -0.561 44.595 45.100 0.093 0.000 1.014 171 G HN 0.677 8.967 8.290 0.000 0.000 0.541 172 C N -0.204 119.058 119.300 -0.062 0.000 3.198 172 C HA 0.570 5.030 4.460 0.001 0.000 0.438 172 C C -0.375 174.559 174.990 -0.093 0.000 0.952 172 C CA -0.522 58.477 59.018 -0.032 0.000 1.216 172 C CB 0.308 28.056 27.740 0.014 0.000 1.594 172 C HN 0.853 9.083 8.230 0.000 0.000 0.598 173 T N 7.236 121.761 114.554 -0.047 0.000 2.794 173 T HA 0.386 4.736 4.350 0.001 0.000 0.296 173 T C 0.629 175.318 174.700 -0.019 0.000 0.949 173 T CA -0.248 61.835 62.100 -0.027 0.000 1.101 173 T CB 0.314 69.202 68.868 0.033 0.000 0.905 173 T HN 0.577 8.817 8.240 0.000 0.000 0.516 174 I N 3.890 124.435 120.570 -0.042 0.000 2.752 174 I HA 0.177 4.347 4.170 0.001 0.000 0.287 174 I C 0.777 176.868 176.117 -0.043 0.000 1.188 174 I CA 0.183 61.402 61.300 -0.135 0.000 1.427 174 I CB -0.021 37.673 38.000 -0.510 0.000 1.365 174 I HN 0.479 8.689 8.210 0.000 0.000 0.585 175 K N 5.818 126.194 120.400 -0.041 0.000 2.378 175 K HA 0.538 4.858 4.320 0.001 0.000 0.244 175 K C -2.355 174.251 176.600 0.010 0.000 1.039 175 K CA -1.675 54.620 56.287 0.014 0.000 0.863 175 K CB 0.461 32.981 32.500 0.034 0.000 1.326 175 K HN 0.333 8.583 8.250 0.000 0.000 0.460 176 P HA -0.168 4.252 4.420 0.000 0.000 0.269 176 P C 0.164 177.494 177.300 0.050 0.000 1.153 176 P CA 0.636 63.750 63.100 0.022 0.000 0.754 176 P CB 0.551 32.245 31.700 -0.010 0.000 0.758 177 K N 1.158 121.584 120.400 0.043 0.000 2.009 177 K HA -0.076 4.244 4.320 0.001 0.000 0.210 177 K C 0.968 177.623 176.600 0.092 0.000 1.049 177 K CA 1.177 57.509 56.287 0.075 0.000 0.929 177 K CB -0.209 32.320 32.500 0.048 0.000 0.714 177 K HN 0.425 8.675 8.250 0.000 0.000 0.440 178 L N -1.846 119.359 121.223 -0.029 0.000 2.323 178 L HA 0.421 4.761 4.340 0.001 0.000 0.265 178 L C 0.787 177.337 176.870 -0.533 0.000 1.012 178 L CA -0.358 54.338 54.840 -0.240 0.000 0.820 178 L CB 2.132 44.077 42.059 -0.191 0.000 1.334 178 L HN 0.490 8.720 8.230 0.000 0.000 0.427 179 G N 1.055 109.086 108.800 -1.283 0.000 2.201 179 G HA2 -0.184 3.777 3.960 0.001 0.000 0.212 179 G HA3 -0.184 3.777 3.960 0.001 0.000 0.212 179 G C -0.175 174.547 174.900 -0.296 0.000 0.994 179 G CA -0.550 44.039 45.100 -0.852 0.000 0.644 179 G HN 0.315 8.605 8.290 0.000 0.000 0.508 180 L N 2.382 123.572 121.223 -0.054 0.000 2.350 180 L HA 0.555 4.895 4.340 0.001 0.000 0.275 180 L C 1.521 178.582 176.870 0.318 0.000 1.099 180 L CA -0.063 54.883 54.840 0.176 0.000 0.808 180 L CB 1.423 43.661 42.059 0.298 0.000 1.149 180 L HN 0.457 8.687 8.230 0.000 0.000 0.442 181 S N 1.645 117.480 115.700 0.225 0.000 2.608 181 S HA 0.270 4.740 4.470 0.001 0.000 0.261 181 S C 1.078 175.796 174.600 0.197 0.000 1.314 181 S CA -0.131 58.188 58.200 0.199 0.000 0.992 181 S CB 1.483 64.744 63.200 0.102 0.000 0.935 181 S HN 0.704 9.014 8.310 0.000 0.000 0.564 182 A N 1.333 124.253 122.820 0.166 0.000 1.883 182 A HA -0.121 4.199 4.320 0.001 0.000 0.217 182 A C 2.183 179.813 177.584 0.076 0.000 1.186 182 A CA 1.918 54.090 52.037 0.225 0.000 0.624 182 A CB -0.984 18.236 19.000 0.366 0.000 0.822 182 A HN 0.954 9.104 8.150 0.000 0.000 0.444 183 K N -0.599 119.612 120.400 -0.315 0.000 2.097 183 K HA -0.141 4.179 4.320 0.001 0.000 0.205 183 K C 1.660 178.092 176.600 -0.279 0.000 1.050 183 K CA 1.396 57.199 56.287 -0.807 0.000 0.938 183 K CB -0.161 31.789 32.500 -0.915 0.000 0.718 183 K HN 0.402 8.652 8.250 0.000 0.000 0.442 184 N N -0.022 118.625 118.700 -0.088 0.000 2.223 184 N HA -0.170 4.570 4.740 0.001 0.000 0.185 184 N C 1.499 177.043 175.510 0.056 0.000 1.016 184 N CA 0.975 54.022 53.050 -0.005 0.000 0.863 184 N CB -0.327 38.179 38.487 0.031 0.000 0.983 184 N HN 0.243 8.623 8.380 0.000 0.000 0.429 185 Y N 1.314 121.617 120.300 0.005 0.000 2.128 185 Y HA -0.140 4.410 4.550 0.001 0.000 0.284 185 Y C 2.481 178.389 175.900 0.012 0.000 1.154 185 Y CA 1.891 60.016 58.100 0.041 0.000 1.149 185 Y CB -0.689 37.824 38.460 0.088 0.000 0.976 185 Y HN 0.075 8.355 8.280 0.000 0.000 0.505 186 G N -0.647 108.246 108.800 0.155 0.000 2.422 186 G HA2 -0.296 3.664 3.960 0.001 0.000 0.218 186 G HA3 -0.296 3.664 3.960 0.001 0.000 0.218 186 G C 1.752 176.697 174.900 0.074 0.000 1.146 186 G CA 0.866 46.028 45.100 0.103 0.000 0.769 186 G HN 0.349 8.639 8.290 0.000 0.000 0.547 187 R N 0.625 121.144 120.500 0.031 0.000 2.080 187 R HA -0.026 4.314 4.340 0.001 0.000 0.236 187 R C 2.816 179.153 176.300 0.062 0.000 1.137 187 R CA 1.730 57.869 56.100 0.066 0.000 0.943 187 R CB -0.498 29.809 30.300 0.012 0.000 0.846 187 R HN 0.257 8.527 8.270 0.000 0.000 0.431 188 A N 0.376 123.190 122.820 -0.011 0.000 1.902 188 A HA -0.109 4.212 4.320 0.001 0.000 0.217 188 A C 2.324 179.876 177.584 -0.053 0.000 1.181 188 A CA 1.696 53.699 52.037 -0.057 0.000 0.623 188 A CB -0.621 18.298 19.000 -0.134 0.000 0.818 188 A HN 0.255 8.405 8.150 0.000 0.000 0.443 189 V N -1.125 118.766 119.914 -0.038 0.000 2.295 189 V HA -0.288 3.832 4.120 0.001 0.000 0.246 189 V C 2.393 178.517 176.094 0.050 0.000 1.049 189 V CA 2.207 64.512 62.300 0.009 0.000 1.024 189 V CB -1.064 30.756 31.823 -0.006 0.000 0.648 189 V HN 0.746 8.936 8.190 0.000 0.000 0.447 190 Y N 1.524 121.815 120.300 -0.015 0.000 2.128 190 Y HA -0.233 4.317 4.550 0.001 0.000 0.284 190 Y C 2.545 178.442 175.900 -0.005 0.000 1.154 190 Y CA 1.998 60.097 58.100 -0.003 0.000 1.149 190 Y CB -0.391 38.072 38.460 0.006 0.000 0.976 190 Y HN 0.282 8.562 8.280 0.000 0.000 0.505 191 E N -0.504 119.479 120.200 -0.362 0.000 2.106 191 E HA -0.188 4.162 4.350 0.001 0.000 0.192 191 E C 2.479 178.918 176.600 -0.269 0.000 0.984 191 E CA 1.300 57.440 56.400 -0.434 0.000 0.806 191 E CB -0.831 28.747 29.700 -0.203 0.000 0.750 191 E HN 0.555 8.915 8.360 0.000 0.000 0.458 192 C N 0.652 119.860 119.300 -0.153 0.000 2.462 192 C HA -0.059 4.402 4.460 0.001 0.000 0.278 192 C C 2.868 177.798 174.990 -0.100 0.000 1.253 192 C CA 0.328 59.287 59.018 -0.098 0.000 1.713 192 C CB -1.127 26.583 27.740 -0.049 0.000 2.049 192 C HN 0.359 8.589 8.230 0.000 0.000 0.477 193 L N 1.251 122.425 121.223 -0.081 0.000 2.083 193 L HA -0.162 4.178 4.340 0.001 0.000 0.209 193 L C 2.893 179.715 176.870 -0.079 0.000 1.083 193 L CA 1.792 56.600 54.840 -0.052 0.000 0.752 193 L CB -0.718 41.346 42.059 0.007 0.000 0.899 193 L HN 0.490 8.720 8.230 0.000 0.000 0.433 194 R N 0.369 120.775 120.500 -0.156 0.000 2.189 194 R HA -0.049 4.292 4.340 0.001 0.000 0.218 194 R C 1.886 178.114 176.300 -0.121 0.000 1.074 194 R CA 1.224 57.236 56.100 -0.146 0.000 0.991 194 R CB -0.626 29.487 30.300 -0.311 0.000 0.883 194 R HN 0.241 8.511 8.270 0.000 0.000 0.457 195 G N -0.538 108.183 108.800 -0.133 0.000 2.813 195 G HA2 0.243 4.204 3.960 0.001 0.000 0.209 195 G HA3 0.243 4.204 3.960 0.001 0.000 0.209 195 G C 0.884 175.736 174.900 -0.080 0.000 1.150 195 G CA 0.283 45.319 45.100 -0.106 0.000 0.785 195 G HN 0.581 8.871 8.290 0.000 0.000 0.535 196 G N -0.764 107.993 108.800 -0.072 0.000 2.273 196 G HA2 -0.167 3.793 3.960 0.001 0.000 0.162 196 G HA3 -0.167 3.793 3.960 0.001 0.000 0.162 196 G C 0.272 175.131 174.900 -0.068 0.000 1.006 196 G CA -0.383 44.680 45.100 -0.061 0.000 0.704 196 G HN 0.314 8.604 8.290 0.000 0.000 0.487 197 L N 1.581 122.763 121.223 -0.068 0.000 2.426 197 L HA 0.297 4.637 4.340 0.001 0.000 0.271 197 L C 1.208 178.009 176.870 -0.116 0.000 1.169 197 L CA -0.515 54.286 54.840 -0.064 0.000 0.836 197 L CB 0.552 42.592 42.059 -0.032 0.000 1.112 197 L HN 0.036 8.266 8.230 0.000 0.000 0.465 198 D N 1.817 122.098 120.400 -0.198 0.000 2.149 198 D HA -0.016 4.625 4.640 0.001 0.000 0.201 198 D C -0.081 175.930 176.300 -0.481 0.000 0.972 198 D CA 1.634 55.375 54.000 -0.432 0.000 0.835 198 D CB 0.218 40.588 40.800 -0.716 0.000 0.966 198 D HN 0.151 8.521 8.370 0.000 0.000 0.476 199 F N -0.267 119.656 119.950 -0.044 0.000 2.599 199 F HA 0.303 4.831 4.527 0.000 0.000 0.311 199 F C 0.636 176.298 175.800 -0.230 0.000 1.076 199 F CA -1.077 56.843 58.000 -0.134 0.000 0.937 199 F CB 1.750 40.644 39.000 -0.176 0.000 1.282 199 F HN -0.339 7.961 8.300 0.000 0.000 0.460 203 D N 1.089 121.621 120.400 0.220 0.000 2.378 203 D HA -0.026 4.614 4.640 0.001 0.000 0.238 203 D C 1.544 177.839 176.300 -0.008 0.000 1.180 203 D CA 0.074 54.132 54.000 0.096 0.000 0.895 203 D CB 1.022 41.892 40.800 0.118 0.000 1.192 203 D HN 0.410 8.780 8.370 0.000 0.000 0.438 204 E N 2.248 122.327 120.200 -0.200 0.000 2.160 204 E HA -0.262 4.089 4.350 0.001 0.000 0.195 204 E C 0.753 177.248 176.600 -0.175 0.000 0.991 204 E CA 1.244 57.404 56.400 -0.399 0.000 0.810 204 E CB -0.424 28.636 29.700 -1.067 0.000 0.742 204 E HN 0.505 8.865 8.360 0.000 0.000 0.466 205 N N 1.043 119.693 118.700 -0.083 0.000 2.336 205 N HA 0.000 4.741 4.740 0.001 0.000 0.189 205 N C 0.076 175.622 175.510 0.060 0.000 1.113 205 N CA -0.043 53.001 53.050 -0.011 0.000 0.858 205 N CB 0.067 38.558 38.487 0.007 0.000 0.970 205 N HN -0.043 8.337 8.380 0.000 0.000 0.471 206 V N 1.918 121.881 119.914 0.082 0.000 2.387 206 V HA 0.170 4.291 4.120 0.001 0.000 0.260 206 V C 0.281 176.421 176.094 0.077 0.000 1.054 206 V CA -0.145 62.223 62.300 0.115 0.000 0.967 206 V CB -0.413 31.485 31.823 0.125 0.000 1.036 206 V HN 0.316 8.506 8.190 0.000 0.000 0.481 207 N N 2.634 121.365 118.700 0.053 0.000 3.039 207 N HA 0.256 4.996 4.740 0.001 0.000 0.188 207 N C -0.209 175.332 175.510 0.051 0.000 1.310 207 N CA -0.342 52.732 53.050 0.041 0.000 1.111 207 N CB 0.618 39.106 38.487 0.002 0.000 1.311 207 N HN 0.505 8.885 8.380 0.000 0.000 0.490 208 S N 0.123 115.828 115.700 0.008 0.000 2.619 208 S HA 0.480 4.950 4.470 0.001 0.000 0.280 208 S C -1.829 172.695 174.600 -0.126 0.000 1.150 208 S CA -0.403 57.799 58.200 0.004 0.000 0.978 208 S CB 1.322 64.644 63.200 0.203 0.000 1.041 208 S HN 0.274 8.584 8.310 0.000 0.000 0.485 209 Q N 3.151 122.758 119.800 -0.322 0.000 2.565 209 Q HA 0.468 4.808 4.340 0.001 0.000 0.294 209 Q C -2.161 173.558 176.000 -0.468 0.000 1.005 209 Q CA -1.678 53.861 55.803 -0.438 0.000 0.771 209 Q CB 1.666 29.961 28.738 -0.739 0.000 1.486 209 Q HN 0.276 8.546 8.270 0.000 0.000 0.422 210 P HA -0.163 4.257 4.420 0.000 0.000 0.216 210 P C 0.571 177.805 177.300 -0.111 0.000 1.150 210 P CA 1.342 64.365 63.100 -0.129 0.000 0.837 210 P CB 0.054 31.753 31.700 -0.002 0.000 0.786 211 F N -2.621 117.341 119.950 0.021 0.000 2.558 211 F HA 0.290 4.818 4.527 0.001 0.000 0.298 211 F C 0.936 176.752 175.800 0.027 0.000 1.119 211 F CA 0.106 58.121 58.000 0.026 0.000 1.451 211 F CB -0.553 38.467 39.000 0.034 0.000 1.091 211 F HN -0.188 8.112 8.300 0.000 0.000 0.563 212 M N 1.401 120.762 119.600 -0.399 0.000 2.387 212 M HA 0.311 4.792 4.480 0.001 0.000 0.215 212 M C -1.471 174.669 176.300 -0.267 0.000 0.973 212 M CA -0.485 54.698 55.300 -0.195 0.000 0.924 212 M CB 0.936 33.533 32.600 -0.004 0.000 2.471 212 M HN -0.187 8.103 8.290 0.000 0.000 0.445 213 R N 3.698 124.096 120.500 -0.170 0.000 2.490 213 R HA 0.261 4.601 4.340 0.001 0.000 0.278 213 R C 1.087 177.282 176.300 -0.174 0.000 1.069 213 R CA -0.182 55.809 56.100 -0.181 0.000 1.080 213 R CB 0.585 30.752 30.300 -0.221 0.000 1.030 213 R HN 0.943 9.213 8.270 0.000 0.000 0.491 214 W N 4.217 125.404 121.300 -0.189 0.000 2.358 214 W HA -0.154 4.506 4.660 0.000 0.000 0.303 214 W C 1.148 177.473 176.519 -0.323 0.000 1.208 214 W CA 0.741 57.947 57.345 -0.233 0.000 1.274 214 W CB -0.447 28.806 29.460 -0.345 0.000 1.138 214 W HN 0.563 8.743 8.180 0.000 0.000 0.515 215 R N 1.036 120.698 120.500 -1.396 0.000 2.090 215 R HA -0.127 4.213 4.340 0.001 0.000 0.228 215 R C 1.850 177.858 176.300 -0.487 0.000 1.110 215 R CA 1.891 57.220 56.100 -1.284 0.000 0.973 215 R CB -0.366 28.962 30.300 -1.620 0.000 0.869 215 R HN -0.042 8.228 8.270 0.000 0.000 0.440 216 D N 0.179 120.358 120.400 -0.368 0.000 2.104 216 D HA -0.222 4.418 4.640 0.001 0.000 0.194 216 D C 1.853 178.168 176.300 0.024 0.000 0.994 216 D CA 1.187 55.083 54.000 -0.173 0.000 0.830 216 D CB -0.248 40.520 40.800 -0.054 0.000 0.959 216 D HN 0.249 8.619 8.370 0.000 0.000 0.452 217 R N -0.264 120.309 120.500 0.122 0.000 2.083 217 R HA -0.156 4.184 4.340 0.001 0.000 0.237 217 R C 2.285 178.779 176.300 0.322 0.000 1.137 217 R CA 1.086 57.334 56.100 0.247 0.000 0.951 217 R CB -0.337 30.069 30.300 0.177 0.000 0.851 217 R HN 0.046 8.316 8.270 0.000 0.000 0.434 218 F N 0.841 120.823 119.950 0.052 0.000 2.126 218 F HA -0.201 4.326 4.527 0.001 0.000 0.299 218 F C 2.232 178.039 175.800 0.011 0.000 1.096 218 F CA 0.860 58.909 58.000 0.081 0.000 1.255 218 F CB -0.628 38.478 39.000 0.176 0.000 0.997 218 F HN 0.065 8.365 8.300 0.000 0.000 0.479 219 L N -1.633 119.654 121.223 0.107 0.000 2.027 219 L HA -0.201 4.139 4.340 0.001 0.000 0.206 219 L C 2.456 179.288 176.870 -0.062 0.000 1.074 219 L CA 1.740 56.545 54.840 -0.058 0.000 0.745 219 L CB -1.389 40.519 42.059 -0.251 0.000 0.898 219 L HN 0.080 8.310 8.230 0.000 0.000 0.433 220 F N -0.475 119.507 119.950 0.054 0.000 2.186 220 F HA -0.129 4.399 4.527 0.001 0.000 0.299 220 F C 2.555 178.365 175.800 0.016 0.000 1.090 220 F CA 0.677 58.701 58.000 0.039 0.000 1.307 220 F CB -1.109 37.922 39.000 0.051 0.000 1.019 220 F HN -0.194 8.106 8.300 0.000 0.000 0.489 221 V N -0.099 119.913 119.914 0.164 0.000 2.343 221 V HA -0.298 3.823 4.120 0.001 0.000 0.247 221 V C 2.600 178.665 176.094 -0.048 0.000 1.051 221 V CA 1.652 63.942 62.300 -0.016 0.000 1.036 221 V CB -1.319 30.382 31.823 -0.204 0.000 0.654 221 V HN 0.346 8.536 8.190 0.000 0.000 0.451 222 A N -0.399 122.404 122.820 -0.028 0.000 1.883 222 A HA -0.319 4.002 4.320 0.001 0.000 0.217 222 A C 2.288 179.849 177.584 -0.039 0.000 1.186 222 A CA 2.225 54.202 52.037 -0.099 0.000 0.624 222 A CB -0.596 18.429 19.000 0.042 0.000 0.822 222 A HN 0.626 8.776 8.150 0.000 0.000 0.444 223 E N -0.283 119.970 120.200 0.087 0.000 2.058 223 E HA -0.181 4.170 4.350 0.001 0.000 0.194 223 E C 2.181 178.826 176.600 0.075 0.000 0.997 223 E CA 1.208 57.684 56.400 0.125 0.000 0.801 223 E CB -0.271 29.512 29.700 0.139 0.000 0.746 223 E HN 0.551 8.911 8.360 0.000 0.000 0.450 224 A N 0.988 123.845 122.820 0.061 0.000 1.877 224 A HA -0.161 4.159 4.320 0.001 0.000 0.216 224 A C 2.174 179.808 177.584 0.083 0.000 1.186 224 A CA 1.337 53.427 52.037 0.089 0.000 0.620 224 A CB -0.638 18.434 19.000 0.120 0.000 0.822 224 A HN 0.326 8.476 8.150 0.000 0.000 0.443 225 I N -1.703 118.845 120.570 -0.037 0.000 2.127 225 I HA -0.314 3.857 4.170 0.001 0.000 0.241 225 I C 2.373 178.465 176.117 -0.043 0.000 1.075 225 I CA 1.627 62.866 61.300 -0.102 0.000 1.334 225 I CB -0.455 37.356 38.000 -0.316 0.000 1.040 225 I HN 0.394 8.604 8.210 0.000 0.000 0.405 226 Y N 0.633 120.973 120.300 0.067 0.000 2.314 226 Y HA -0.179 4.372 4.550 0.001 0.000 0.293 226 Y C 2.509 178.434 175.900 0.041 0.000 1.129 226 Y CA 0.994 59.123 58.100 0.048 0.000 1.201 226 Y CB -0.678 37.802 38.460 0.034 0.000 0.999 226 Y HN 0.114 8.394 8.280 0.000 0.000 0.541 227 K N 0.219 120.714 120.400 0.159 0.000 2.025 227 K HA -0.122 4.199 4.320 0.001 0.000 0.207 227 K C 2.302 179.007 176.600 0.175 0.000 1.049 227 K CA 1.168 57.495 56.287 0.066 0.000 0.933 227 K CB -0.242 32.151 32.500 -0.179 0.000 0.714 227 K HN 0.199 8.449 8.250 0.000 0.000 0.438 228 A N 1.006 123.985 122.820 0.266 0.000 1.930 228 A HA -0.215 4.105 4.320 0.001 0.000 0.217 228 A C 2.079 179.749 177.584 0.144 0.000 1.175 228 A CA 1.600 53.791 52.037 0.256 0.000 0.627 228 A CB -0.586 18.535 19.000 0.200 0.000 0.815 228 A HN 0.567 8.717 8.150 0.000 0.000 0.443 229 Q N -0.474 119.404 119.800 0.131 0.000 2.084 229 Q HA -0.109 4.231 4.340 0.001 0.000 0.202 229 Q C 2.141 178.201 176.000 0.100 0.000 0.978 229 Q CA 1.627 57.495 55.803 0.108 0.000 0.844 229 Q CB -0.347 28.478 28.738 0.144 0.000 0.898 229 Q HN 0.589 8.859 8.270 0.000 0.000 0.426 230 A N 0.619 123.507 122.820 0.113 0.000 1.930 230 A HA -0.221 4.099 4.320 0.001 0.000 0.217 230 A C 1.884 179.513 177.584 0.074 0.000 1.175 230 A CA 1.575 53.661 52.037 0.082 0.000 0.627 230 A CB -0.603 18.440 19.000 0.072 0.000 0.815 230 A HN 0.618 8.768 8.150 0.000 0.000 0.443 231 E N -0.451 119.807 120.200 0.097 0.000 2.072 231 E HA -0.156 4.195 4.350 0.001 0.000 0.191 231 E C 2.001 178.641 176.600 0.066 0.000 0.985 231 E CA 1.744 58.200 56.400 0.094 0.000 0.801 231 E CB -0.040 29.752 29.700 0.154 0.000 0.750 231 E HN 0.730 9.090 8.360 0.000 0.000 0.452 232 T N -3.982 110.608 114.554 0.059 0.000 3.037 232 T HA 0.233 4.584 4.350 0.001 0.000 0.252 232 T C 1.553 176.271 174.700 0.029 0.000 1.073 232 T CA 0.634 62.754 62.100 0.035 0.000 1.091 232 T CB 0.486 69.366 68.868 0.020 0.000 0.935 232 T HN 0.312 8.552 8.240 0.000 0.000 0.488 233 G N 1.313 110.135 108.800 0.036 0.000 2.168 233 G HA2 -0.233 3.727 3.960 0.001 0.000 0.263 233 G HA3 -0.233 3.727 3.960 0.001 0.000 0.263 233 G C -0.246 174.667 174.900 0.022 0.000 0.977 233 G CA 0.327 45.446 45.100 0.031 0.000 0.659 233 G HN 0.679 8.969 8.290 0.000 0.000 0.533 234 E N -0.423 119.784 120.200 0.013 0.000 2.191 234 E HA 0.520 4.871 4.350 0.001 0.000 0.274 234 E C 0.316 176.912 176.600 -0.008 0.000 0.948 234 E CA -1.046 55.348 56.400 -0.009 0.000 0.802 234 E CB 2.433 32.114 29.700 -0.032 0.000 1.137 234 E HN 0.064 8.424 8.360 0.000 0.000 0.397 235 V N 3.778 123.680 119.914 -0.021 0.000 2.673 235 V HA -0.014 4.106 4.120 0.001 0.000 0.303 235 V C 0.266 176.330 176.094 -0.050 0.000 1.046 235 V CA 0.462 62.756 62.300 -0.010 0.000 1.126 235 V CB 0.115 31.930 31.823 -0.013 0.000 0.934 235 V HN 0.521 8.711 8.190 0.000 0.000 0.487 236 K N 2.976 123.372 120.400 -0.006 0.000 2.328 236 K HA 0.818 5.138 4.320 0.001 0.000 0.246 236 K C 0.023 176.660 176.600 0.062 0.000 0.955 236 K CA -0.384 55.891 56.287 -0.019 0.000 0.817 236 K CB 2.353 34.859 32.500 0.010 0.000 1.208 236 K HN 0.853 9.103 8.250 0.000 0.000 0.432 237 G N 0.176 109.072 108.800 0.161 0.000 2.695 237 G HA2 0.410 4.371 3.960 0.001 0.000 0.290 237 G HA3 0.410 4.371 3.960 0.001 0.000 0.290 237 G C -1.863 173.230 174.900 0.321 0.000 1.410 237 G CA -0.266 45.019 45.100 0.308 0.000 0.844 237 G HN 0.553 8.843 8.290 0.000 0.000 0.478 238 H N 0.212 119.346 119.070 0.107 0.000 2.934 238 H HA 0.332 4.888 4.556 0.001 0.000 0.340 238 H C -1.231 174.105 175.328 0.013 0.000 1.008 238 H CA -0.594 55.447 56.048 -0.012 0.000 1.317 238 H CB 1.374 31.124 29.762 -0.019 0.000 1.670 238 H HN 0.368 8.648 8.280 0.000 0.000 0.516 239 Y N 5.562 125.616 120.300 -0.410 0.000 2.674 239 Y HA 0.140 4.691 4.550 0.000 0.000 0.354 239 Y C 0.665 176.468 175.900 -0.162 0.000 1.089 239 Y CA -0.684 57.246 58.100 -0.283 0.000 1.444 239 Y CB -0.514 37.739 38.460 -0.345 0.000 1.187 239 Y HN 0.329 8.609 8.280 0.000 0.000 0.523 240 L N 3.847 125.097 121.223 0.045 0.000 2.360 240 L HA 0.168 4.508 4.340 0.001 0.000 0.276 240 L C 0.631 177.497 176.870 -0.007 0.000 1.121 240 L CA 0.021 54.781 54.840 -0.134 0.000 0.845 240 L CB 0.400 41.979 42.059 -0.801 0.000 1.143 240 L HN 0.633 8.863 8.230 0.000 0.000 0.452 241 N N 1.848 120.634 118.700 0.144 0.000 2.442 241 N HA 0.214 4.954 4.740 0.001 0.000 0.265 241 N C 0.534 176.178 175.510 0.223 0.000 1.138 241 N CA -0.099 53.058 53.050 0.178 0.000 0.956 241 N CB 1.129 39.709 38.487 0.155 0.000 1.067 241 N HN 0.770 9.150 8.380 0.000 0.000 0.474 242 A N 2.660 125.568 122.820 0.147 0.000 2.308 242 A HA 0.084 4.404 4.320 0.001 0.000 0.217 242 A C 0.648 178.252 177.584 0.034 0.000 1.216 242 A CA -0.040 52.025 52.037 0.046 0.000 0.864 242 A CB 0.043 19.037 19.000 -0.010 0.000 0.902 242 A HN 0.596 8.746 8.150 0.000 0.000 0.499 243 T N 1.830 116.465 114.554 0.135 0.000 2.905 243 T HA 0.434 4.784 4.350 0.001 0.000 0.299 243 T C 0.233 174.935 174.700 0.003 0.000 1.024 243 T CA 0.981 63.161 62.100 0.133 0.000 1.151 243 T CB 0.589 69.471 68.868 0.024 0.000 0.987 243 T HN 0.741 8.981 8.240 0.000 0.000 0.535 244 A N 2.433 125.250 122.820 -0.006 0.000 2.588 244 A HA 0.802 5.122 4.320 0.001 0.000 0.290 244 A C 1.274 178.832 177.584 -0.044 0.000 1.136 244 A CA -0.285 51.711 52.037 -0.068 0.000 0.681 244 A CB 0.612 19.524 19.000 -0.146 0.000 1.282 244 A HN 0.753 8.903 8.150 0.000 0.000 0.421 245 G N -0.746 108.022 108.800 -0.052 0.000 2.448 245 G HA2 0.343 4.304 3.960 0.001 0.000 0.218 245 G HA3 0.343 4.304 3.960 0.001 0.000 0.218 245 G C 0.684 175.564 174.900 -0.035 0.000 1.135 245 G CA 1.789 46.867 45.100 -0.037 0.000 0.784 245 G HN 1.629 9.919 8.290 0.000 0.000 0.543 246 T N -4.485 110.040 114.554 -0.048 0.000 2.906 246 T HA 0.277 4.628 4.350 0.001 0.000 0.295 246 T C 0.882 175.542 174.700 -0.066 0.000 1.075 246 T CA -0.096 61.976 62.100 -0.047 0.000 1.005 246 T CB 1.311 70.152 68.868 -0.045 0.000 1.136 246 T HN 0.011 8.251 8.240 0.000 0.000 0.498 247 C N 1.031 120.295 119.300 -0.060 0.000 2.422 247 C HA -0.014 4.447 4.460 0.001 0.000 0.279 247 C C 2.255 177.180 174.990 -0.109 0.000 1.305 247 C CA 1.381 60.349 59.018 -0.083 0.000 1.757 247 C CB -1.550 26.151 27.740 -0.064 0.000 1.962 247 C HN 1.039 9.269 8.230 0.000 0.000 0.499 248 E N 0.753 120.899 120.200 -0.089 0.000 2.051 248 E HA -0.144 4.207 4.350 0.001 0.000 0.192 248 E C 2.320 178.842 176.600 -0.131 0.000 0.991 248 E CA 1.395 57.738 56.400 -0.094 0.000 0.799 248 E CB -0.323 29.340 29.700 -0.061 0.000 0.748 248 E HN 0.601 8.961 8.360 0.000 0.000 0.449 249 E N 0.218 120.336 120.200 -0.136 0.000 2.077 249 E HA -0.179 4.171 4.350 0.001 0.000 0.193 249 E C 2.046 178.462 176.600 -0.306 0.000 0.989 249 E CA 0.789 57.066 56.400 -0.205 0.000 0.800 249 E CB -0.294 29.302 29.700 -0.173 0.000 0.746 249 E HN 0.326 8.686 8.360 0.000 0.000 0.452 250 M N -0.115 119.340 119.600 -0.240 0.000 2.082 250 M HA -0.213 4.267 4.480 0.001 0.000 0.258 250 M C 1.988 178.103 176.300 -0.307 0.000 1.069 250 M CA 1.482 56.628 55.300 -0.256 0.000 1.102 250 M CB -0.007 32.474 32.600 -0.197 0.000 1.336 250 M HN 0.036 8.326 8.290 0.000 0.000 0.404 251 M N 0.089 119.515 119.600 -0.291 0.000 2.175 251 M HA -0.162 4.319 4.480 0.001 0.000 0.264 251 M C 1.915 178.018 176.300 -0.328 0.000 1.063 251 M CA 1.678 56.764 55.300 -0.357 0.000 1.119 251 M CB -1.164 31.262 32.600 -0.291 0.000 1.377 251 M HN 0.278 8.568 8.290 0.000 0.000 0.415 252 K N -0.162 120.077 120.400 -0.267 0.000 2.103 252 K HA -0.148 4.172 4.320 0.001 0.000 0.207 252 K C 2.149 178.561 176.600 -0.312 0.000 1.048 252 K CA 1.293 57.457 56.287 -0.205 0.000 0.930 252 K CB -0.084 32.335 32.500 -0.136 0.000 0.716 252 K HN 0.328 8.578 8.250 0.000 0.000 0.444 253 R N 0.112 120.253 120.500 -0.600 0.000 2.073 253 R HA -0.031 4.309 4.340 0.001 0.000 0.229 253 R C 2.401 178.660 176.300 -0.069 0.000 1.120 253 R CA 1.101 56.779 56.100 -0.703 0.000 0.967 253 R CB -0.309 29.475 30.300 -0.860 0.000 0.862 253 R HN 0.160 8.430 8.270 0.000 0.000 0.436 254 A N 1.234 123.973 122.820 -0.136 0.000 1.908 254 A HA -0.061 4.260 4.320 0.001 0.000 0.218 254 A C 1.421 179.032 177.584 0.045 0.000 1.181 254 A CA 0.933 52.933 52.037 -0.062 0.000 0.627 254 A CB -0.529 18.272 19.000 -0.332 0.000 0.818 254 A HN 0.057 8.207 8.150 0.000 0.000 0.445 258 K N 0.500 121.033 120.400 0.220 0.000 2.044 258 K HA -0.206 4.114 4.320 0.001 0.000 0.210 258 K C 1.337 178.033 176.600 0.159 0.000 1.049 258 K CA 1.947 58.347 56.287 0.188 0.000 0.927 258 K CB -0.132 32.506 32.500 0.229 0.000 0.713 258 K HN 0.432 8.682 8.250 0.000 0.000 0.443 259 E N 0.538 120.838 120.200 0.167 0.000 2.347 259 E HA -0.104 4.246 4.350 0.001 0.000 0.196 259 E C 1.909 178.593 176.600 0.140 0.000 1.008 259 E CA 0.628 57.109 56.400 0.136 0.000 0.852 259 E CB 0.078 29.854 29.700 0.126 0.000 0.783 259 E HN 0.432 8.792 8.360 0.000 0.000 0.505 260 L N -0.449 120.878 121.223 0.173 0.000 2.558 260 L HA 0.112 4.452 4.340 0.001 0.000 0.225 260 L C 1.436 178.448 176.870 0.238 0.000 1.128 260 L CA 0.479 55.436 54.840 0.195 0.000 0.868 260 L CB -0.093 42.087 42.059 0.202 0.000 1.006 260 L HN 0.192 8.422 8.230 0.000 0.000 0.454 261 G N 0.612 109.528 108.800 0.194 0.000 2.148 261 G HA2 -0.269 3.691 3.960 0.001 0.000 0.254 261 G HA3 -0.269 3.691 3.960 0.001 0.000 0.254 261 G C 0.414 175.448 174.900 0.224 0.000 0.981 261 G CA 0.300 45.520 45.100 0.199 0.000 0.670 261 G HN 0.258 8.548 8.290 0.000 0.000 0.528 262 V N -2.209 117.805 119.914 0.166 0.000 2.953 262 V HA 0.723 4.844 4.120 0.001 0.000 0.304 262 V C -0.093 176.047 176.094 0.077 0.000 1.073 262 V CA -0.822 61.525 62.300 0.078 0.000 1.064 262 V CB 1.266 33.081 31.823 -0.013 0.000 1.047 262 V HN 0.046 8.236 8.190 0.000 0.000 0.478 263 P HA 0.302 4.722 4.420 0.000 0.000 0.228 263 P C 0.097 177.422 177.300 0.042 0.000 1.166 263 P CA 0.692 63.834 63.100 0.070 0.000 0.812 263 P CB 0.680 32.446 31.700 0.111 0.000 0.857 264 I N -0.023 120.575 120.570 0.046 0.000 2.722 264 I HA 0.359 4.529 4.170 0.001 0.000 0.292 264 I C -1.155 174.962 176.117 0.001 0.000 1.267 264 I CA -1.536 59.759 61.300 -0.009 0.000 1.036 264 I CB 2.291 40.264 38.000 -0.046 0.000 1.281 264 I HN -0.251 7.959 8.210 0.000 0.000 0.423 265 I N 4.512 125.065 120.570 -0.029 0.000 3.170 265 I HA 0.692 4.862 4.170 0.001 0.000 0.312 265 I C -0.843 175.267 176.117 -0.012 0.000 1.085 265 I CA -0.976 60.323 61.300 -0.002 0.000 0.999 265 I CB 2.168 40.184 38.000 0.028 0.000 1.233 265 I HN 0.690 8.900 8.210 0.000 0.000 0.467 266 M N 1.440 121.080 119.600 0.067 0.000 2.658 266 M HA 0.650 5.130 4.480 0.001 0.000 0.295 266 M C -1.482 174.925 176.300 0.179 0.000 1.248 266 M CA -0.581 54.793 55.300 0.123 0.000 0.843 266 M CB 2.246 34.993 32.600 0.245 0.000 1.749 266 M HN 0.786 9.076 8.290 0.000 0.000 0.464 267 H N -0.424 118.673 119.070 0.045 0.000 2.974 267 H HA 0.446 5.003 4.556 0.001 0.000 0.366 267 H C -2.007 173.360 175.328 0.065 0.000 1.155 267 H CA -0.510 55.555 56.048 0.029 0.000 1.186 267 H CB 1.811 31.572 29.762 -0.003 0.000 1.799 267 H HN 0.761 9.041 8.280 0.000 0.000 0.541 268 D N 4.790 124.920 120.400 -0.451 0.000 2.468 268 D HA 0.017 4.657 4.640 0.001 0.000 0.218 268 D C 0.728 176.709 176.300 -0.531 0.000 1.155 268 D CA -0.167 53.643 54.000 -0.316 0.000 0.924 268 D CB -0.105 40.553 40.800 -0.235 0.000 1.029 268 D HN 0.595 8.965 8.370 0.000 0.000 0.515 269 Y N 1.062 121.090 120.300 -0.453 0.000 2.293 269 Y HA -0.051 4.499 4.550 0.000 0.000 0.291 269 Y C 1.390 177.002 175.900 -0.479 0.000 1.137 269 Y CA 0.850 58.701 58.100 -0.415 0.000 1.202 269 Y CB -0.562 37.735 38.460 -0.271 0.000 0.990 269 Y HN 0.220 8.500 8.280 0.000 0.000 0.537 270 L N 0.456 121.178 121.223 -0.836 0.000 2.162 270 L HA -0.045 4.296 4.340 0.001 0.000 0.205 270 L C 2.598 179.215 176.870 -0.422 0.000 1.086 270 L CA 1.516 55.883 54.840 -0.789 0.000 0.778 270 L CB -0.766 40.857 42.059 -0.727 0.000 0.928 270 L HN 0.428 8.658 8.230 0.000 0.000 0.446 271 T N -3.603 110.763 114.554 -0.313 0.000 3.014 271 T HA 0.011 4.362 4.350 0.001 0.000 0.263 271 T C 1.877 176.471 174.700 -0.177 0.000 1.078 271 T CA 0.764 62.742 62.100 -0.204 0.000 1.135 271 T CB -0.392 68.384 68.868 -0.153 0.000 0.895 271 T HN 0.310 8.550 8.240 0.000 0.000 0.480 272 G N 1.383 110.046 108.800 -0.229 0.000 2.395 272 G HA2 0.440 4.400 3.960 0.001 0.000 0.214 272 G HA3 0.440 4.400 3.960 0.001 0.000 0.214 272 G C 0.853 175.725 174.900 -0.046 0.000 1.177 272 G CA 0.234 45.278 45.100 -0.094 0.000 0.794 272 G HN 1.236 9.526 8.290 0.000 0.000 0.532 273 G N -2.014 106.705 108.800 -0.135 0.000 2.539 273 G HA2 0.013 3.973 3.960 0.001 0.000 0.686 273 G HA3 0.013 3.973 3.960 0.001 0.000 0.686 273 G C 0.103 174.959 174.900 -0.073 0.000 1.258 273 G CA -0.185 44.822 45.100 -0.154 0.000 0.846 273 G HN 0.072 8.362 8.290 0.000 0.000 0.647 274 F N 0.631 120.587 119.950 0.011 0.000 2.171 274 F HA -0.013 4.515 4.527 0.000 0.000 0.300 274 F C 3.126 178.948 175.800 0.036 0.000 1.090 274 F CA 2.334 60.348 58.000 0.024 0.000 1.293 274 F CB -0.613 38.347 39.000 -0.067 0.000 1.013 274 F HN 0.557 8.857 8.300 0.000 0.000 0.486 275 T N -0.142 114.533 114.554 0.200 0.000 2.652 275 T HA -0.214 4.136 4.350 0.001 0.000 0.267 275 T C 2.310 177.055 174.700 0.075 0.000 1.039 275 T CA 1.514 63.684 62.100 0.116 0.000 1.153 275 T CB -0.738 68.178 68.868 0.080 0.000 0.863 275 T HN 0.288 8.528 8.240 0.000 0.000 0.428 276 A N 1.880 124.738 122.820 0.063 0.000 1.930 276 A HA -0.125 4.196 4.320 0.001 0.000 0.217 276 A C 2.268 179.825 177.584 -0.046 0.000 1.175 276 A CA 1.542 53.581 52.037 0.003 0.000 0.627 276 A CB -0.779 18.237 19.000 0.026 0.000 0.815 276 A HN 0.549 8.699 8.150 0.000 0.000 0.443 277 N N -0.409 118.346 118.700 0.092 0.000 2.084 277 N HA -0.148 4.592 4.740 0.001 0.000 0.190 277 N C 1.611 177.145 175.510 0.040 0.000 1.030 277 N CA 2.070 55.172 53.050 0.086 0.000 0.849 277 N CB -0.159 38.490 38.487 0.270 0.000 1.012 277 N HN 0.429 8.809 8.380 0.000 0.000 0.423 278 T N 0.079 114.689 114.554 0.093 0.000 2.746 278 T HA -0.051 4.299 4.350 0.001 0.000 0.267 278 T C 2.133 176.848 174.700 0.026 0.000 1.039 278 T CA 1.212 63.357 62.100 0.074 0.000 1.142 278 T CB -0.314 68.614 68.868 0.101 0.000 0.866 278 T HN 0.200 8.440 8.240 0.000 0.000 0.444 279 S N 1.280 116.984 115.700 0.007 0.000 2.359 279 S HA -0.065 4.405 4.470 0.001 0.000 0.224 279 S C 1.934 176.530 174.600 -0.007 0.000 1.035 279 S CA 0.859 59.055 58.200 -0.005 0.000 1.018 279 S CB -0.494 62.690 63.200 -0.027 0.000 0.876 279 S HN 0.263 8.573 8.310 0.000 0.000 0.448 280 L N 1.683 122.863 121.223 -0.073 0.000 2.093 280 L HA 0.059 4.399 4.340 0.001 0.000 0.208 280 L C 2.332 179.207 176.870 0.008 0.000 1.085 280 L CA 1.735 56.528 54.840 -0.079 0.000 0.755 280 L CB -1.016 40.885 42.059 -0.264 0.000 0.904 280 L HN 0.241 8.471 8.230 0.000 0.000 0.435 281 A N -0.221 122.590 122.820 -0.015 0.000 1.908 281 A HA -0.211 4.110 4.320 0.001 0.000 0.218 281 A C 2.272 179.847 177.584 -0.014 0.000 1.181 281 A CA 2.188 54.215 52.037 -0.017 0.000 0.627 281 A CB -0.893 18.092 19.000 -0.025 0.000 0.818 281 A HN 0.498 8.648 8.150 0.000 0.000 0.445 282 I N -2.172 118.401 120.570 0.006 0.000 2.226 282 I HA -0.274 3.896 4.170 0.001 0.000 0.245 282 I C 2.448 178.573 176.117 0.012 0.000 1.100 282 I CA 1.789 63.088 61.300 -0.002 0.000 1.374 282 I CB -0.413 37.592 38.000 0.009 0.000 1.057 282 I HN 0.539 8.749 8.210 0.000 0.000 0.413 283 Y N 0.935 121.207 120.300 -0.046 0.000 2.165 283 Y HA -0.348 4.202 4.550 0.000 0.000 0.286 283 Y C 2.719 178.608 175.900 -0.019 0.000 1.155 283 Y CA 1.728 59.809 58.100 -0.032 0.000 1.164 283 Y CB -0.408 38.028 38.460 -0.039 0.000 0.978 283 Y HN 0.203 8.483 8.280 0.000 0.000 0.513 284 C N 0.016 119.363 119.300 0.079 0.000 2.429 284 C HA -0.136 4.325 4.460 0.001 0.000 0.277 284 C C 2.738 177.699 174.990 -0.048 0.000 1.262 284 C CA 1.361 60.401 59.018 0.036 0.000 1.733 284 C CB -1.215 26.570 27.740 0.076 0.000 2.010 284 C HN 0.578 8.808 8.230 0.000 0.000 0.483 285 R N 1.828 122.247 120.500 -0.134 0.000 2.083 285 R HA -0.112 4.228 4.340 0.001 0.000 0.237 285 R C 1.466 177.687 176.300 -0.131 0.000 1.137 285 R CA 2.046 58.024 56.100 -0.204 0.000 0.951 285 R CB -0.853 29.338 30.300 -0.182 0.000 0.851 285 R HN 0.420 8.690 8.270 0.000 0.000 0.434 286 D N -0.468 119.836 120.400 -0.160 0.000 2.348 286 D HA -0.026 4.614 4.640 0.001 0.000 0.216 286 D C 0.408 176.586 176.300 -0.203 0.000 0.970 286 D CA 0.769 54.669 54.000 -0.167 0.000 0.889 286 D CB 0.057 40.753 40.800 -0.174 0.000 0.912 286 D HN 0.341 8.711 8.370 0.000 0.000 0.524 287 N N -0.920 117.627 118.700 -0.254 0.000 2.143 287 N HA 0.114 4.854 4.740 0.001 0.000 0.222 287 N C 0.918 176.392 175.510 -0.059 0.000 1.264 287 N CA 0.438 53.353 53.050 -0.225 0.000 0.897 287 N CB 1.985 40.186 38.487 -0.476 0.000 1.092 287 N HN 0.082 8.462 8.380 0.000 0.000 0.516 288 G N 1.576 110.398 108.800 0.037 0.000 2.143 288 G HA2 -0.263 3.698 3.960 0.001 0.000 0.248 288 G HA3 -0.263 3.698 3.960 0.001 0.000 0.248 288 G C -0.113 174.829 174.900 0.069 0.000 0.991 288 G CA -0.002 45.170 45.100 0.120 0.000 0.689 288 G HN 0.230 8.521 8.290 0.000 0.000 0.522 289 L N 0.378 121.678 121.223 0.129 0.000 2.305 289 L HA 0.516 4.856 4.340 0.001 0.000 0.281 289 L C 1.240 178.174 176.870 0.107 0.000 1.085 289 L CA -0.928 53.963 54.840 0.085 0.000 0.813 289 L CB 1.068 43.194 42.059 0.112 0.000 1.157 289 L HN 0.081 8.311 8.230 0.000 0.000 0.436 290 L N 3.870 125.068 121.223 -0.042 0.000 2.439 290 L HA 0.153 4.494 4.340 0.001 0.000 0.269 290 L C -0.329 176.478 176.870 -0.105 0.000 1.179 290 L CA -0.142 54.657 54.840 -0.069 0.000 0.828 290 L CB 0.769 42.720 42.059 -0.181 0.000 1.106 290 L HN 0.392 8.621 8.230 0.000 0.000 0.467 291 L N 3.182 124.319 121.223 -0.143 0.000 2.345 291 L HA 0.334 4.674 4.340 0.001 0.000 0.274 291 L C -0.513 176.166 176.870 -0.318 0.000 0.999 291 L CA -0.265 54.475 54.840 -0.168 0.000 0.849 291 L CB 0.995 43.008 42.059 -0.078 0.000 1.220 291 L HN 0.454 8.684 8.230 0.000 0.000 0.422 292 H N 5.390 124.151 119.070 -0.515 0.000 2.620 292 H HA 0.537 5.093 4.556 0.000 0.000 0.313 292 H C -0.811 174.390 175.328 -0.212 0.000 1.075 292 H CA -0.382 55.317 56.048 -0.582 0.000 1.397 292 H CB 0.697 29.817 29.762 -1.069 0.000 1.446 292 H HN 0.500 8.780 8.280 0.000 0.000 0.493 293 I N 5.823 126.009 120.570 -0.640 0.000 2.339 293 I HA 0.113 4.283 4.170 0.001 0.000 0.290 293 I C 0.158 176.067 176.117 -0.347 0.000 0.994 293 I CA -0.441 60.645 61.300 -0.357 0.000 1.191 293 I CB 0.895 38.685 38.000 -0.349 0.000 1.343 293 I HN 0.726 8.936 8.210 0.000 0.000 0.458 294 H N 7.470 126.435 119.070 -0.175 0.000 2.473 294 H HA 0.302 4.858 4.556 0.001 0.000 0.327 294 H C 0.387 175.669 175.328 -0.076 0.000 1.105 294 H CA -0.389 55.533 56.048 -0.210 0.000 1.280 294 H CB 1.389 31.081 29.762 -0.118 0.000 1.450 294 H HN 0.581 8.861 8.280 0.000 0.000 0.492 295 R N 3.153 123.425 120.500 -0.379 0.000 2.568 295 R HA 0.402 4.742 4.340 0.001 0.000 0.288 295 R C 0.172 176.490 176.300 0.030 0.000 1.077 295 R CA -0.430 55.661 56.100 -0.016 0.000 1.102 295 R CB -0.030 30.226 30.300 -0.073 0.000 1.278 295 R HN 0.373 8.643 8.270 0.000 0.000 0.560 296 A N 1.614 124.551 122.820 0.196 0.000 2.598 296 A HA 0.013 4.334 4.320 0.001 0.000 0.239 296 A C 0.982 178.571 177.584 0.009 0.000 1.032 296 A CA 1.020 53.164 52.037 0.178 0.000 0.760 296 A CB -0.202 18.877 19.000 0.132 0.000 0.946 296 A HN 0.870 9.020 8.150 0.000 0.000 0.512 297 M N 0.430 120.020 119.600 -0.017 0.000 2.979 297 M HA -0.315 4.166 4.480 0.001 0.000 0.202 297 M C 1.008 177.246 176.300 -0.104 0.000 0.602 297 M CA 2.021 57.271 55.300 -0.084 0.000 0.774 297 M CB -2.032 30.504 32.600 -0.106 0.000 2.769 297 M HN 1.277 9.567 8.290 0.000 0.000 0.294 298 H N -0.752 118.257 119.070 -0.102 0.000 2.387 298 H HA 0.234 4.791 4.556 0.001 0.000 0.299 298 H C 1.714 177.013 175.328 -0.049 0.000 1.099 298 H CA 1.988 58.004 56.048 -0.055 0.000 1.315 298 H CB -0.529 29.241 29.762 0.014 0.000 1.380 298 H HN 0.499 8.779 8.280 0.000 0.000 0.513 299 A N 1.124 123.396 122.820 -0.914 0.000 2.168 299 A HA 0.040 4.361 4.320 0.001 0.000 0.215 299 A C 2.431 179.858 177.584 -0.261 0.000 1.152 299 A CA 0.871 52.546 52.037 -0.604 0.000 0.716 299 A CB -0.641 17.991 19.000 -0.614 0.000 0.794 299 A HN 0.354 8.504 8.150 0.000 0.000 0.465 300 V N -0.023 119.773 119.914 -0.197 0.000 2.392 300 V HA -0.268 3.853 4.120 0.001 0.000 0.249 300 V C 2.253 178.311 176.094 -0.060 0.000 1.059 300 V CA 2.202 64.440 62.300 -0.103 0.000 1.051 300 V CB -0.556 31.216 31.823 -0.085 0.000 0.658 300 V HN 0.627 8.817 8.190 0.000 0.000 0.455 301 I N 0.638 121.173 120.570 -0.058 0.000 2.731 301 I HA -0.032 4.138 4.170 0.001 0.000 0.260 301 I C 1.729 177.844 176.117 -0.003 0.000 1.138 301 I CA 1.225 62.513 61.300 -0.020 0.000 1.461 301 I CB -0.134 37.862 38.000 -0.006 0.000 1.128 301 I HN 0.472 8.682 8.210 0.000 0.000 0.438 302 D N -0.442 119.946 120.400 -0.020 0.000 2.433 302 D HA -0.032 4.608 4.640 0.001 0.000 0.211 302 D C 1.817 178.098 176.300 -0.031 0.000 1.114 302 D CA -0.034 53.961 54.000 -0.009 0.000 0.837 302 D CB 0.047 40.881 40.800 0.057 0.000 0.984 302 D HN -0.053 8.317 8.370 0.000 0.000 0.505 303 R N 0.250 120.728 120.500 -0.036 0.000 2.075 303 R HA 0.083 4.423 4.340 0.001 0.000 0.226 303 R C 0.462 176.778 176.300 0.027 0.000 1.114 303 R CA 1.094 57.179 56.100 -0.026 0.000 0.972 303 R CB -0.129 30.138 30.300 -0.055 0.000 0.869 303 R HN 0.027 8.297 8.270 0.000 0.000 0.437 304 Q N 0.466 120.295 119.800 0.049 0.000 2.259 304 Q HA 0.097 4.438 4.340 0.001 0.000 0.249 304 Q C 0.301 176.366 176.000 0.108 0.000 0.914 304 Q CA -0.010 55.839 55.803 0.077 0.000 0.904 304 Q CB 1.426 30.215 28.738 0.086 0.000 1.213 304 Q HN 0.221 8.491 8.270 0.000 0.000 0.428 305 R N 2.217 122.782 120.500 0.108 0.000 2.148 305 R HA -0.128 4.212 4.340 0.001 0.000 0.227 305 R C 1.143 177.514 176.300 0.118 0.000 1.103 305 R CA 1.624 57.797 56.100 0.121 0.000 0.983 305 R CB 0.312 30.674 30.300 0.103 0.000 0.874 305 R HN 0.623 8.893 8.270 0.000 0.000 0.451 306 N N -1.283 117.491 118.700 0.124 0.000 2.325 306 N HA -0.077 4.664 4.740 0.001 0.000 0.182 306 N C -0.488 175.141 175.510 0.199 0.000 1.088 306 N CA 0.413 53.542 53.050 0.132 0.000 0.879 306 N CB 0.159 38.714 38.487 0.114 0.000 0.983 306 N HN 0.265 8.645 8.380 0.000 0.000 0.471 307 H N -1.503 117.633 119.070 0.110 0.000 3.086 307 H HA 0.561 5.117 4.556 0.001 0.000 0.353 307 H C 0.061 175.485 175.328 0.159 0.000 1.134 307 H CA 0.378 56.520 56.048 0.158 0.000 1.248 307 H CB 1.387 31.228 29.762 0.132 0.000 1.878 307 H HN 0.322 8.602 8.280 0.000 0.000 0.527 308 G N 2.326 111.065 108.800 -0.102 0.000 2.295 308 G HA2 -0.026 3.934 3.960 0.001 0.000 0.195 308 G HA3 -0.026 3.934 3.960 0.001 0.000 0.195 308 G C -1.522 173.372 174.900 -0.011 0.000 1.269 308 G CA -0.329 44.752 45.100 -0.032 0.000 1.170 308 G HN 0.650 8.940 8.290 0.000 0.000 0.511 309 I N 0.972 121.526 120.570 -0.025 0.000 2.499 309 I HA 0.331 4.502 4.170 0.001 0.000 0.288 309 I C 0.270 176.416 176.117 0.049 0.000 1.048 309 I CA -0.894 60.398 61.300 -0.012 0.000 1.062 309 I CB 1.981 39.926 38.000 -0.091 0.000 1.238 309 I HN 0.692 8.902 8.210 0.000 0.000 0.426 310 H N 4.767 123.849 119.070 0.020 0.000 2.871 310 H HA -0.013 4.543 4.556 0.001 0.000 0.355 310 H C 0.448 175.830 175.328 0.090 0.000 1.092 310 H CA 0.695 56.792 56.048 0.081 0.000 1.420 310 H CB 1.022 30.828 29.762 0.072 0.000 1.400 310 H HN 0.648 8.928 8.280 0.000 0.000 0.604 311 F N 5.037 124.705 119.950 -0.468 0.000 2.202 311 F HA -0.224 4.304 4.527 0.001 0.000 0.301 311 F C 2.632 178.370 175.800 -0.103 0.000 1.082 311 F CA 1.801 59.639 58.000 -0.271 0.000 1.313 311 F CB -0.124 38.579 39.000 -0.494 0.000 1.024 311 F HN 0.685 8.985 8.300 0.000 0.000 0.495 312 R N -0.262 120.340 120.500 0.170 0.000 2.105 312 R HA -0.138 4.202 4.340 0.001 0.000 0.239 312 R C 1.812 178.080 176.300 -0.053 0.000 1.135 312 R CA 2.022 58.155 56.100 0.055 0.000 0.967 312 R CB -1.515 28.980 30.300 0.324 0.000 0.861 312 R HN 0.297 8.567 8.270 0.000 0.000 0.442 313 V N 1.998 121.918 119.914 0.010 0.000 2.379 313 V HA -0.164 3.956 4.120 0.001 0.000 0.245 313 V C 2.524 178.651 176.094 0.055 0.000 1.044 313 V CA 1.497 63.812 62.300 0.024 0.000 1.036 313 V CB -0.424 31.397 31.823 -0.003 0.000 0.664 313 V HN 0.279 8.469 8.190 0.000 0.000 0.453 314 L N 0.189 121.395 121.223 -0.029 0.000 2.131 314 L HA -0.157 4.183 4.340 0.001 0.000 0.210 314 L C 2.689 179.473 176.870 -0.144 0.000 1.092 314 L CA 1.491 56.365 54.840 0.057 0.000 0.759 314 L CB -0.812 41.268 42.059 0.034 0.000 0.903 314 L HN 0.377 8.607 8.230 0.000 0.000 0.435 315 A N 0.178 122.637 122.820 -0.603 0.000 1.897 315 A HA -0.161 4.159 4.320 0.001 0.000 0.215 315 A C 2.347 179.828 177.584 -0.171 0.000 1.181 315 A CA 1.250 52.984 52.037 -0.505 0.000 0.620 315 A CB -0.252 18.337 19.000 -0.684 0.000 0.821 315 A HN 0.268 8.418 8.150 0.000 0.000 0.443 316 K N -0.130 120.261 120.400 -0.016 0.000 2.032 316 K HA -0.136 4.185 4.320 0.001 0.000 0.209 316 K C 2.316 178.964 176.600 0.080 0.000 1.048 316 K CA 1.242 57.642 56.287 0.189 0.000 0.927 316 K CB -0.382 32.261 32.500 0.238 0.000 0.712 316 K HN 0.436 8.686 8.250 0.000 0.000 0.441 317 A N 1.990 124.835 122.820 0.042 0.000 1.908 317 A HA -0.170 4.150 4.320 0.001 0.000 0.218 317 A C 2.079 179.640 177.584 -0.039 0.000 1.181 317 A CA 1.154 53.145 52.037 -0.076 0.000 0.627 317 A CB -0.593 18.338 19.000 -0.114 0.000 0.818 317 A HN 0.256 8.406 8.150 0.000 0.000 0.445 318 L N -0.362 120.868 121.223 0.013 0.000 2.056 318 L HA -0.138 4.202 4.340 0.001 0.000 0.207 318 L C 2.489 179.229 176.870 -0.217 0.000 1.078 318 L CA 2.356 57.084 54.840 -0.186 0.000 0.749 318 L CB -0.883 40.801 42.059 -0.625 0.000 0.901 318 L HN 0.556 8.786 8.230 0.000 0.000 0.433 319 R N -0.483 119.872 120.500 -0.242 0.000 2.091 319 R HA -0.208 4.132 4.340 0.001 0.000 0.238 319 R C 2.334 178.473 176.300 -0.269 0.000 1.136 319 R CA 2.009 57.912 56.100 -0.330 0.000 0.959 319 R CB -0.142 29.804 30.300 -0.589 0.000 0.856 319 R HN 0.367 8.637 8.270 0.000 0.000 0.437 320 M N -0.885 118.567 119.600 -0.247 0.000 2.099 320 M HA -0.131 4.349 4.480 0.001 0.000 0.262 320 M C 2.534 178.730 176.300 -0.174 0.000 1.067 320 M CA 1.863 56.921 55.300 -0.403 0.000 1.124 320 M CB -0.260 31.819 32.600 -0.867 0.000 1.353 320 M HN 0.159 8.449 8.290 0.000 0.000 0.410 321 S N -0.342 115.309 115.700 -0.080 0.000 2.383 321 S HA 0.094 4.565 4.470 0.001 0.000 0.227 321 S C 0.833 175.460 174.600 0.045 0.000 1.026 321 S CA 1.193 59.444 58.200 0.086 0.000 0.981 321 S CB -0.331 63.000 63.200 0.219 0.000 0.818 321 S HN 0.665 8.975 8.310 0.000 0.000 0.472 322 G N -1.555 107.219 108.800 -0.043 0.000 2.957 322 G HA2 0.421 4.382 3.960 0.001 0.000 0.636 322 G HA3 0.421 4.382 3.960 0.001 0.000 0.636 322 G C -0.343 174.486 174.900 -0.119 0.000 1.401 322 G CA -0.459 44.593 45.100 -0.080 0.000 0.941 322 G HN 1.036 9.326 8.290 0.000 0.000 0.610 323 G N 0.580 109.287 108.800 -0.155 0.000 2.733 323 G HA2 0.592 4.552 3.960 0.001 0.000 0.297 323 G HA3 0.592 4.552 3.960 0.001 0.000 0.297 323 G C -0.104 174.706 174.900 -0.150 0.000 1.452 323 G CA 0.177 45.173 45.100 -0.173 0.000 0.940 323 G HN 0.355 8.645 8.290 0.000 0.000 0.547 324 D N -0.136 120.179 120.400 -0.142 0.000 2.213 324 D HA 0.067 4.707 4.640 0.001 0.000 0.205 324 D C 0.448 176.758 176.300 0.017 0.000 0.961 324 D CA 1.131 55.086 54.000 -0.076 0.000 0.853 324 D CB 0.296 41.045 40.800 -0.085 0.000 0.967 324 D HN 0.601 8.971 8.370 0.000 0.000 0.496 325 H N -0.939 118.002 119.070 -0.215 0.000 2.679 325 H HA 0.569 5.125 4.556 0.001 0.000 0.367 325 H C -1.070 174.059 175.328 -0.332 0.000 1.162 325 H CA -1.109 54.791 56.048 -0.247 0.000 1.181 325 H CB 2.661 32.273 29.762 -0.250 0.000 1.693 325 H HN -0.133 8.147 8.280 0.000 0.000 0.538 326 L N 1.503 122.655 121.223 -0.118 0.000 2.493 326 L HA 0.229 4.569 4.340 0.001 0.000 0.265 326 L C -0.919 175.933 176.870 -0.029 0.000 0.954 326 L CA -0.375 54.385 54.840 -0.133 0.000 0.844 326 L CB 1.631 43.615 42.059 -0.125 0.000 1.302 326 L HN 0.717 8.947 8.230 0.000 0.000 0.405 327 H N 2.467 121.414 119.070 -0.206 0.000 2.928 327 H HA 0.197 4.754 4.556 0.001 0.000 0.338 327 H C 0.245 175.483 175.328 -0.151 0.000 1.047 327 H CA 0.702 56.634 56.048 -0.193 0.000 1.435 327 H CB 1.027 30.609 29.762 -0.300 0.000 1.428 327 H HN 0.760 9.040 8.280 0.000 0.000 0.590 328 S N 1.709 117.417 115.700 0.013 0.000 2.603 328 S HA 0.290 4.760 4.470 0.001 0.000 0.232 328 S C 1.004 175.733 174.600 0.214 0.000 1.016 328 S CA 0.023 58.359 58.200 0.227 0.000 0.976 328 S CB 0.932 64.357 63.200 0.374 0.000 0.921 328 S HN 1.091 9.401 8.310 0.000 0.000 0.516 329 G N 1.454 110.259 108.800 0.008 0.000 2.829 329 G HA2 -0.159 3.801 3.960 0.001 0.000 0.628 329 G HA3 -0.159 3.801 3.960 0.001 0.000 0.628 329 G C 0.361 175.319 174.900 0.098 0.000 1.412 329 G CA 0.245 45.364 45.100 0.032 0.000 0.864 329 G HN 1.043 9.333 8.290 0.000 0.000 0.544 330 T N -3.628 110.958 114.554 0.053 0.000 2.955 330 T HA 0.442 4.792 4.350 0.001 0.000 0.251 330 T C 1.832 176.593 174.700 0.101 0.000 1.002 330 T CA 1.418 63.557 62.100 0.066 0.000 0.970 330 T CB 0.406 69.201 68.868 -0.122 0.000 1.091 330 T HN 2.292 10.532 8.240 0.000 0.000 0.495 331 V N 0.749 120.694 119.914 0.051 0.000 0.473 331 V HA -0.330 3.791 4.120 0.001 0.000 0.092 331 V C 2.039 178.140 176.094 0.012 0.000 2.433 331 V CA 1.934 64.248 62.300 0.023 0.000 3.661 331 V CB -1.935 29.884 31.823 -0.006 0.000 0.941 331 V HN 0.723 8.913 8.190 0.000 0.000 0.987 332 V N -1.159 118.736 119.914 -0.032 0.000 3.650 332 V HA 0.685 4.806 4.120 0.001 0.000 0.271 332 V C 1.264 177.266 176.094 -0.152 0.000 1.281 332 V CA 1.304 63.577 62.300 -0.046 0.000 1.120 332 V CB -0.019 31.786 31.823 -0.031 0.000 0.856 332 V HN 0.911 9.101 8.190 0.000 0.000 0.443 333 G N 1.434 110.083 108.800 -0.250 0.000 2.531 333 G HA2 0.275 4.235 3.960 0.001 0.000 0.253 333 G HA3 0.275 4.235 3.960 0.001 0.000 0.253 333 G C 0.749 175.326 174.900 -0.538 0.000 1.439 333 G CA 0.055 44.907 45.100 -0.413 0.000 1.056 333 G HN 0.484 8.774 8.290 0.000 0.000 0.555 334 K N -1.192 118.681 120.400 -0.879 0.000 2.366 334 K HA 0.164 4.484 4.320 0.001 0.000 0.198 334 K C 0.144 176.550 176.600 -0.323 0.000 1.044 334 K CA 0.332 56.100 56.287 -0.865 0.000 0.973 334 K CB -0.206 31.793 32.500 -0.836 0.000 0.767 334 K HN 0.164 8.414 8.250 0.000 0.000 0.475 335 L N 1.708 122.794 121.223 -0.228 0.000 2.334 335 L HA 0.315 4.656 4.340 0.001 0.000 0.272 335 L C -0.047 176.787 176.870 -0.061 0.000 1.020 335 L CA -0.926 53.840 54.840 -0.123 0.000 0.812 335 L CB 1.752 43.755 42.059 -0.093 0.000 1.264 335 L HN 0.083 8.313 8.230 0.000 0.000 0.439 336 E N 0.593 120.774 120.200 -0.030 0.000 2.383 336 E HA 0.509 4.860 4.350 0.001 0.000 0.264 336 E C -0.377 176.253 176.600 0.050 0.000 1.050 336 E CA -0.107 56.304 56.400 0.019 0.000 0.896 336 E CB 0.838 30.548 29.700 0.017 0.000 0.982 336 E HN 0.750 9.110 8.360 0.000 0.000 0.424 337 G N 4.045 112.891 108.800 0.076 0.000 2.374 337 G HA2 -0.024 3.937 3.960 0.001 0.000 0.298 337 G HA3 -0.024 3.937 3.960 0.001 0.000 0.298 337 G C -1.029 173.922 174.900 0.084 0.000 2.674 337 G CA -0.715 44.454 45.100 0.115 0.000 0.775 337 G HN 0.474 8.764 8.290 0.000 0.000 0.437 338 E N 2.218 122.476 120.200 0.098 0.000 2.398 338 E HA 0.148 4.498 4.350 0.001 0.000 0.263 338 E C 1.427 178.029 176.600 0.002 0.000 1.046 338 E CA -0.563 55.872 56.400 0.059 0.000 0.908 338 E CB 1.058 30.805 29.700 0.079 0.000 0.963 338 E HN 0.566 8.926 8.360 0.000 0.000 0.431 339 R N 2.991 123.476 120.500 -0.025 0.000 2.097 339 R HA -0.184 4.156 4.340 0.001 0.000 0.236 339 R C 1.546 177.778 176.300 -0.113 0.000 1.135 339 R CA 1.803 57.854 56.100 -0.083 0.000 0.934 339 R CB 0.018 30.280 30.300 -0.064 0.000 0.846 339 R HN 0.518 8.788 8.270 0.000 0.000 0.431 340 E N 0.144 120.304 120.200 -0.068 0.000 2.072 340 E HA -0.129 4.221 4.350 0.001 0.000 0.191 340 E C 2.170 178.720 176.600 -0.083 0.000 0.985 340 E CA 1.102 57.459 56.400 -0.073 0.000 0.801 340 E CB -0.363 29.313 29.700 -0.040 0.000 0.750 340 E HN 0.220 8.580 8.360 0.000 0.000 0.452 341 V N 1.543 121.437 119.914 -0.034 0.000 2.282 341 V HA -0.287 3.833 4.120 0.001 0.000 0.249 341 V C 2.395 178.347 176.094 -0.236 0.000 1.057 341 V CA 2.352 64.665 62.300 0.022 0.000 1.032 341 V CB -0.957 30.989 31.823 0.206 0.000 0.645 341 V HN 0.297 8.487 8.190 0.000 0.000 0.447 342 T N 0.195 114.493 114.554 -0.427 0.000 2.777 342 T HA -0.095 4.255 4.350 0.001 0.000 0.266 342 T C 1.886 176.120 174.700 -0.777 0.000 1.040 342 T CA 1.459 62.965 62.100 -0.989 0.000 1.141 342 T CB -0.300 68.291 68.868 -0.462 0.000 0.868 342 T HN 0.299 8.539 8.240 0.000 0.000 0.444 343 L N 0.727 121.701 121.223 -0.415 0.000 2.042 343 L HA -0.045 4.296 4.340 0.001 0.000 0.210 343 L C 2.986 179.744 176.870 -0.187 0.000 1.076 343 L CA 1.382 56.053 54.840 -0.282 0.000 0.749 343 L CB -1.020 40.920 42.059 -0.199 0.000 0.893 343 L HN 0.358 8.588 8.230 0.000 0.000 0.432 344 G N 0.899 109.604 108.800 -0.158 0.000 2.433 344 G HA2 -0.315 3.646 3.960 0.001 0.000 0.216 344 G HA3 -0.315 3.646 3.960 0.001 0.000 0.216 344 G C 1.312 176.258 174.900 0.078 0.000 1.186 344 G CA 1.016 46.100 45.100 -0.026 0.000 0.779 344 G HN 0.481 8.771 8.290 0.000 0.000 0.543 345 F N 0.739 120.773 119.950 0.139 0.000 2.456 345 F HA 0.238 4.765 4.527 0.001 0.000 0.298 345 F C 2.162 178.054 175.800 0.154 0.000 1.104 345 F CA -0.058 58.044 58.000 0.170 0.000 1.435 345 F CB -0.897 38.252 39.000 0.249 0.000 1.078 345 F HN -0.007 8.293 8.300 0.000 0.000 0.546 346 V N 1.408 121.421 119.914 0.165 0.000 2.343 346 V HA -0.265 3.855 4.120 0.001 0.000 0.247 346 V C 2.142 178.323 176.094 0.144 0.000 1.051 346 V CA 2.323 64.739 62.300 0.194 0.000 1.036 346 V CB -0.719 31.161 31.823 0.094 0.000 0.654 346 V HN 0.228 8.418 8.190 0.000 0.000 0.451 347 D N 0.115 120.576 120.400 0.101 0.000 2.117 347 D HA -0.133 4.507 4.640 0.001 0.000 0.197 347 D C 2.096 178.491 176.300 0.159 0.000 0.987 347 D CA 1.193 55.258 54.000 0.108 0.000 0.829 347 D CB -0.279 40.573 40.800 0.087 0.000 0.961 347 D HN 0.342 8.712 8.370 0.000 0.000 0.460 348 L N -0.218 121.135 121.223 0.217 0.000 2.141 348 L HA -0.100 4.241 4.340 0.001 0.000 0.209 348 L C 2.443 179.425 176.870 0.186 0.000 1.094 348 L CA 0.701 55.734 54.840 0.322 0.000 0.763 348 L CB -0.243 42.021 42.059 0.343 0.000 0.908 348 L HN 0.043 8.273 8.230 0.000 0.000 0.437 349 M N -1.265 118.389 119.600 0.090 0.000 2.200 349 M HA -0.112 4.368 4.480 0.001 0.000 0.265 349 M C 2.258 178.459 176.300 -0.165 0.000 1.066 349 M CA 1.631 56.888 55.300 -0.071 0.000 1.127 349 M CB -0.091 32.538 32.600 0.048 0.000 1.379 349 M HN 0.111 8.401 8.290 0.000 0.000 0.420 350 R N -0.567 119.901 120.500 -0.053 0.000 2.175 350 R HA 0.101 4.441 4.340 0.001 0.000 0.202 350 R C -0.026 176.249 176.300 -0.041 0.000 1.018 350 R CA 0.287 56.359 56.100 -0.046 0.000 1.029 350 R CB 0.252 30.568 30.300 0.026 0.000 0.959 350 R HN 0.257 8.527 8.270 0.000 0.000 0.480 351 D N 0.086 120.498 120.400 0.019 0.000 2.388 351 D HA 0.014 4.654 4.640 0.001 0.000 0.254 351 D C 0.280 176.677 176.300 0.162 0.000 1.111 351 D CA -0.131 53.927 54.000 0.096 0.000 0.993 351 D CB 1.136 42.022 40.800 0.144 0.000 1.118 351 D HN -0.137 8.233 8.370 0.000 0.000 0.502 352 D N -1.297 119.230 120.400 0.213 0.000 2.271 352 D HA -0.065 4.575 4.640 0.001 0.000 0.206 352 D C -0.694 175.858 176.300 0.420 0.000 0.967 352 D CA 0.545 54.724 54.000 0.298 0.000 0.867 352 D CB 0.282 41.210 40.800 0.213 0.000 0.960 352 D HN 0.306 8.676 8.370 0.000 0.000 0.509 353 Y N -0.182 120.238 120.300 0.200 0.000 2.323 353 Y HA 0.420 4.971 4.550 0.000 0.000 0.322 353 Y C -1.763 174.211 175.900 0.123 0.000 1.133 353 Y CA -0.919 57.263 58.100 0.137 0.000 1.093 353 Y CB 1.482 39.993 38.460 0.085 0.000 1.203 353 Y HN -0.332 7.948 8.280 0.000 0.000 0.427 354 V N 6.061 125.886 119.914 -0.148 0.000 2.409 354 V HA 0.325 4.445 4.120 0.001 0.000 0.290 354 V C -0.353 175.647 176.094 -0.156 0.000 1.017 354 V CA -0.958 61.321 62.300 -0.035 0.000 0.841 354 V CB 1.389 33.248 31.823 0.061 0.000 1.003 354 V HN 0.670 8.860 8.190 0.000 0.000 0.426 355 E N 2.869 123.046 120.200 -0.039 0.000 2.383 355 E HA 0.123 4.473 4.350 0.001 0.000 0.264 355 E C 0.155 176.745 176.600 -0.017 0.000 1.050 355 E CA -0.389 55.997 56.400 -0.024 0.000 0.896 355 E CB 1.059 30.802 29.700 0.071 0.000 0.982 355 E HN 0.547 8.907 8.360 0.000 0.000 0.424 356 K N 2.028 122.419 120.400 -0.015 0.000 2.543 356 K HA -0.164 4.156 4.320 0.001 0.000 0.279 356 K C -0.565 176.014 176.600 -0.034 0.000 1.001 356 K CA 0.809 57.084 56.287 -0.019 0.000 1.088 356 K CB 0.272 32.762 32.500 -0.018 0.000 0.863 356 K HN 0.324 8.574 8.250 0.000 0.000 0.488 357 D N 3.856 124.220 120.400 -0.060 0.000 2.362 357 D HA 0.138 4.778 4.640 0.001 0.000 0.232 357 D C 0.202 176.431 176.300 -0.120 0.000 1.329 357 D CA -0.475 53.483 54.000 -0.069 0.000 0.944 357 D CB 0.567 41.346 40.800 -0.036 0.000 1.471 357 D HN 0.484 8.854 8.370 0.000 0.000 0.533 358 R N 0.811 121.206 120.500 -0.175 0.000 2.189 358 R HA -0.054 4.287 4.340 0.001 0.000 0.223 358 R C 1.812 178.005 176.300 -0.178 0.000 1.092 358 R CA 1.055 56.994 56.100 -0.269 0.000 0.989 358 R CB -0.480 29.632 30.300 -0.313 0.000 0.876 358 R HN 0.497 8.767 8.270 0.000 0.000 0.457 359 S N 0.329 115.962 115.700 -0.111 0.000 2.474 359 S HA -0.057 4.413 4.470 0.001 0.000 0.235 359 S C 1.455 176.018 174.600 -0.062 0.000 0.997 359 S CA 0.630 58.785 58.200 -0.075 0.000 0.949 359 S CB 0.011 63.178 63.200 -0.054 0.000 0.766 359 S HN 0.283 8.593 8.310 0.000 0.000 0.517 360 R N 0.053 120.514 120.500 -0.064 0.000 2.577 360 R HA 0.338 4.678 4.340 0.001 0.000 0.344 360 R C 1.119 177.401 176.300 -0.031 0.000 1.037 360 R CA 0.268 56.341 56.100 -0.045 0.000 1.102 360 R CB 0.447 30.724 30.300 -0.039 0.000 1.313 360 R HN 0.481 8.751 8.270 0.000 0.000 0.561 361 G N 1.781 110.540 108.800 -0.068 0.000 2.143 361 G HA2 -0.270 3.690 3.960 0.001 0.000 0.248 361 G HA3 -0.270 3.690 3.960 0.001 0.000 0.248 361 G C 0.118 175.042 174.900 0.040 0.000 0.991 361 G CA -0.141 44.935 45.100 -0.040 0.000 0.689 361 G HN 0.288 8.578 8.290 0.000 0.000 0.522 362 I N 0.788 121.345 120.570 -0.022 0.000 2.287 362 I HA 0.320 4.490 4.170 0.001 0.000 0.290 362 I C 1.274 177.370 176.117 -0.036 0.000 1.069 362 I CA -0.918 60.409 61.300 0.045 0.000 1.237 362 I CB 0.429 38.448 38.000 0.032 0.000 1.418 362 I HN 0.059 8.269 8.210 0.000 0.000 0.481 363 Y N 5.114 125.315 120.300 -0.166 0.000 2.420 363 Y HA 0.133 4.683 4.550 0.001 0.000 0.292 363 Y C 0.332 175.914 175.900 -0.530 0.000 1.119 363 Y CA 0.667 58.540 58.100 -0.378 0.000 1.229 363 Y CB 0.023 38.136 38.460 -0.579 0.000 1.026 363 Y HN 0.303 8.583 8.280 0.000 0.000 0.554 364 F N -1.506 118.543 119.950 0.166 0.000 2.565 364 F HA 0.369 4.896 4.527 0.001 0.000 0.313 364 F C 0.314 176.096 175.800 -0.030 0.000 1.091 364 F CA -1.788 56.254 58.000 0.069 0.000 0.915 364 F CB 0.970 40.003 39.000 0.055 0.000 1.208 364 F HN -0.483 7.817 8.300 0.000 0.000 0.453 365 T N 1.976 116.600 114.554 0.117 0.000 2.902 365 T HA 0.166 4.517 4.350 0.001 0.000 0.301 365 T C -0.333 174.263 174.700 -0.173 0.000 1.012 365 T CA 0.148 62.197 62.100 -0.084 0.000 1.151 365 T CB 0.385 69.185 68.868 -0.112 0.000 0.946 365 T HN 0.432 8.672 8.240 0.000 0.000 0.542 366 Q N 2.710 122.318 119.800 -0.320 0.000 2.327 366 Q HA 0.327 4.668 4.340 0.001 0.000 0.270 366 Q C -1.472 174.202 176.000 -0.544 0.000 1.022 366 Q CA -0.666 54.887 55.803 -0.417 0.000 0.773 366 Q CB 1.249 29.768 28.738 -0.364 0.000 1.251 366 Q HN 0.488 8.758 8.270 0.000 0.000 0.457 367 D N 4.026 124.148 120.400 -0.464 0.000 2.392 367 D HA 0.251 4.891 4.640 0.001 0.000 0.228 367 D C -1.066 175.114 176.300 -0.200 0.000 1.074 367 D CA -0.221 53.668 54.000 -0.185 0.000 0.838 367 D CB 0.373 41.197 40.800 0.041 0.000 1.067 367 D HN 0.470 8.840 8.370 0.000 0.000 0.511 371 M N 3.927 123.602 119.600 0.126 0.000 2.260 371 M HA 0.193 4.673 4.480 0.001 0.000 0.348 371 M C -2.553 173.722 176.300 -0.041 0.000 1.342 371 M CA -0.727 54.604 55.300 0.053 0.000 1.040 371 M CB 0.244 32.906 32.600 0.104 0.000 1.810 371 M HN -0.148 8.142 8.290 0.000 0.000 0.453 372 P HA 0.096 4.516 4.420 0.000 0.000 0.266 372 P C -0.468 176.732 177.300 -0.166 0.000 1.193 372 P CA -0.044 63.009 63.100 -0.080 0.000 0.770 372 P CB 0.266 31.929 31.700 -0.062 0.000 0.836 373 G N 0.924 109.647 108.800 -0.128 0.000 2.476 373 G HA2 0.435 4.396 3.960 0.001 0.000 0.269 373 G HA3 0.435 4.396 3.960 0.001 0.000 0.269 373 G C -0.761 174.062 174.900 -0.129 0.000 1.195 373 G CA -0.409 44.590 45.100 -0.168 0.000 0.843 373 G HN 0.352 8.642 8.290 0.000 0.000 0.545 374 V N 2.966 122.787 119.914 -0.155 0.000 2.427 374 V HA 0.298 4.419 4.120 0.001 0.000 0.286 374 V C 0.543 176.608 176.094 -0.048 0.000 1.034 374 V CA -0.635 61.600 62.300 -0.108 0.000 0.893 374 V CB 1.524 33.249 31.823 -0.163 0.000 0.982 374 V HN 0.839 9.029 8.190 0.000 0.000 0.452 375 M N 8.856 128.450 119.600 -0.010 0.000 2.227 375 M HA 0.288 4.768 4.480 0.001 0.000 0.349 375 M C -2.299 173.949 176.300 -0.086 0.000 1.443 375 M CA -1.294 53.982 55.300 -0.040 0.000 1.110 375 M CB 1.053 33.614 32.600 -0.065 0.000 1.773 375 M HN 0.382 8.672 8.290 0.000 0.000 0.463 376 P HA 0.131 4.551 4.420 0.000 0.000 0.276 376 P C -1.283 175.864 177.300 -0.256 0.000 1.230 376 P CA -0.266 62.793 63.100 -0.069 0.000 0.776 376 P CB 0.846 32.593 31.700 0.078 0.000 0.888 377 V N 3.087 122.826 119.914 -0.293 0.000 2.350 377 V HA 0.474 4.594 4.120 0.001 0.000 0.285 377 V C 0.464 176.260 176.094 -0.497 0.000 1.014 377 V CA -0.819 61.221 62.300 -0.433 0.000 0.831 377 V CB 1.159 32.707 31.823 -0.458 0.000 1.000 377 V HN 0.676 8.866 8.190 0.000 0.000 0.433 378 A N 3.953 126.420 122.820 -0.587 0.000 2.269 378 A HA 0.791 5.112 4.320 0.001 0.000 0.302 378 A C 0.113 177.432 177.584 -0.442 0.000 1.266 378 A CA -0.146 51.573 52.037 -0.530 0.000 0.894 378 A CB 0.821 19.368 19.000 -0.754 0.000 1.147 378 A HN 0.839 8.989 8.150 0.000 0.000 0.537 379 S N 1.742 117.243 115.700 -0.330 0.000 2.533 379 S HA 0.750 5.221 4.470 0.001 0.000 0.271 379 S C -0.537 173.948 174.600 -0.192 0.000 1.143 379 S CA 0.375 58.404 58.200 -0.286 0.000 0.891 379 S CB 1.306 64.380 63.200 -0.211 0.000 1.105 379 S HN 2.557 10.867 8.310 0.000 0.000 0.468 380 G N 1.704 110.372 108.800 -0.219 0.000 3.071 380 G HA2 0.453 4.414 3.960 0.001 0.000 0.620 380 G HA3 0.453 4.414 3.960 0.001 0.000 0.620 380 G C 0.807 175.535 174.900 -0.287 0.000 1.204 380 G CA 0.301 45.289 45.100 -0.186 0.000 1.200 380 G HN 2.138 10.428 8.290 0.000 0.000 0.530 381 G N 0.281 108.933 108.800 -0.246 0.000 2.176 381 G HA2 -0.023 3.937 3.960 0.001 0.000 0.252 381 G HA3 -0.023 3.937 3.960 0.001 0.000 0.252 381 G C 0.585 175.401 174.900 -0.139 0.000 1.024 381 G CA 1.007 45.933 45.100 -0.290 0.000 0.755 381 G HN 2.253 10.543 8.290 0.000 0.000 0.507 382 I N -2.081 118.405 120.570 -0.140 0.000 2.607 382 I HA 0.957 5.127 4.170 0.001 0.000 0.305 382 I C 0.225 176.531 176.117 0.315 0.000 0.995 382 I CA -1.373 59.920 61.300 -0.012 0.000 1.148 382 I CB 1.661 39.506 38.000 -0.258 0.000 1.323 382 I HN 0.329 8.539 8.210 0.000 0.000 0.461 383 H N 1.455 120.892 119.070 0.612 0.000 2.959 383 H HA 0.473 5.029 4.556 0.001 0.000 0.296 383 H C 0.640 176.114 175.328 0.243 0.000 1.421 383 H CA -0.400 55.791 56.048 0.239 0.000 1.206 383 H CB 0.558 30.183 29.762 -0.230 0.000 1.891 383 H HN 0.347 8.627 8.280 0.000 0.000 0.573 384 V N -2.800 117.265 119.914 0.253 0.000 2.392 384 V HA -0.217 3.904 4.120 0.001 0.000 0.249 384 V C 1.319 177.417 176.094 0.007 0.000 1.059 384 V CA 1.740 64.034 62.300 -0.011 0.000 1.051 384 V CB -1.225 30.504 31.823 -0.157 0.000 0.658 384 V HN 0.771 8.961 8.190 0.000 0.000 0.455 385 W N -0.216 121.217 121.300 0.222 0.000 2.465 385 W HA 0.044 4.705 4.660 0.001 0.000 0.268 385 W C 2.579 179.049 176.519 -0.081 0.000 1.242 385 W CA 1.076 58.453 57.345 0.053 0.000 1.248 385 W CB -0.464 29.059 29.460 0.104 0.000 1.118 385 W HN 0.353 8.533 8.180 0.000 0.000 0.587 386 H N -0.727 118.441 119.070 0.164 0.000 2.551 386 H HA 0.008 4.564 4.556 0.001 0.000 0.266 386 H C 1.861 177.278 175.328 0.148 0.000 0.977 386 H CA 0.953 57.065 56.048 0.107 0.000 1.163 386 H CB -0.343 29.429 29.762 0.016 0.000 1.381 386 H HN 0.186 8.466 8.280 0.000 0.000 0.581 387 M N 1.610 121.356 119.600 0.243 0.000 2.082 387 M HA -0.080 4.400 4.480 0.001 0.000 0.258 387 M C -0.926 175.470 176.300 0.160 0.000 1.069 387 M CA 1.624 57.040 55.300 0.194 0.000 1.102 387 M CB -0.886 31.765 32.600 0.084 0.000 1.336 387 M HN 0.062 8.352 8.290 0.000 0.000 0.404 388 P HA -0.081 4.339 4.420 0.000 0.000 0.215 388 P C 1.128 178.502 177.300 0.123 0.000 1.153 388 P CA 2.251 65.420 63.100 0.116 0.000 0.853 388 P CB -0.412 31.355 31.700 0.111 0.000 0.788 389 A N -0.580 122.329 122.820 0.148 0.000 1.902 389 A HA -0.146 4.174 4.320 0.001 0.000 0.217 389 A C 2.282 179.948 177.584 0.136 0.000 1.181 389 A CA 1.409 53.523 52.037 0.128 0.000 0.623 389 A CB -1.651 17.438 19.000 0.150 0.000 0.818 389 A HN 0.107 8.257 8.150 0.000 0.000 0.443 390 L N -0.593 120.749 121.223 0.198 0.000 2.017 390 L HA -0.156 4.184 4.340 0.001 0.000 0.208 390 L C 2.512 179.558 176.870 0.293 0.000 1.073 390 L CA 1.115 56.130 54.840 0.291 0.000 0.745 390 L CB -0.612 41.600 42.059 0.255 0.000 0.894 390 L HN 0.237 8.467 8.230 0.000 0.000 0.432 391 V N -0.369 119.660 119.914 0.192 0.000 2.407 391 V HA -0.253 3.867 4.120 0.001 0.000 0.248 391 V C 2.591 178.752 176.094 0.112 0.000 1.055 391 V CA 1.760 64.150 62.300 0.151 0.000 1.049 391 V CB -0.528 31.359 31.823 0.108 0.000 0.662 391 V HN 0.486 8.676 8.190 0.000 0.000 0.455 392 E N 0.328 120.576 120.200 0.080 0.000 2.077 392 E HA -0.196 4.154 4.350 0.001 0.000 0.193 392 E C 2.168 178.754 176.600 -0.024 0.000 0.989 392 E CA 1.599 58.018 56.400 0.032 0.000 0.800 392 E CB -0.111 29.606 29.700 0.028 0.000 0.746 392 E HN 0.611 8.971 8.360 0.000 0.000 0.452 393 I N -0.423 120.103 120.570 -0.072 0.000 2.163 393 I HA -0.239 3.931 4.170 0.001 0.000 0.240 393 I C 1.976 177.857 176.117 -0.393 0.000 1.081 393 I CA 1.112 62.227 61.300 -0.309 0.000 1.353 393 I CB -0.197 37.487 38.000 -0.527 0.000 1.054 393 I HN 0.029 8.239 8.210 0.000 0.000 0.407 394 F N 0.297 120.245 119.950 -0.004 0.000 2.656 394 F HA 0.323 4.851 4.527 0.001 0.000 0.291 394 F C 1.634 177.437 175.800 0.005 0.000 1.122 394 F CA 0.560 58.557 58.000 -0.005 0.000 1.427 394 F CB -0.590 38.404 39.000 -0.010 0.000 1.125 394 F HN 0.146 8.446 8.300 0.000 0.000 0.583 395 G N 0.788 109.685 108.800 0.162 0.000 2.645 395 G HA2 -0.306 3.654 3.960 0.001 0.000 0.246 395 G HA3 -0.306 3.654 3.960 0.001 0.000 0.246 395 G C 0.307 175.281 174.900 0.124 0.000 1.322 395 G CA 0.224 45.393 45.100 0.114 0.000 0.898 395 G HN 0.175 8.465 8.290 0.000 0.000 0.573 396 D N 0.502 120.955 120.400 0.090 0.000 2.224 396 D HA 0.076 4.716 4.640 0.001 0.000 0.205 396 D C 0.883 177.223 176.300 0.066 0.000 0.965 396 D CA 1.142 55.187 54.000 0.075 0.000 0.852 396 D CB -0.086 40.755 40.800 0.068 0.000 0.947 396 D HN 0.359 8.729 8.370 0.000 0.000 0.494 397 D N 0.785 121.231 120.400 0.075 0.000 2.619 397 D HA 0.475 5.116 4.640 0.001 0.000 0.224 397 D C -0.384 175.938 176.300 0.037 0.000 1.133 397 D CA 0.101 54.135 54.000 0.056 0.000 1.017 397 D CB 0.208 41.046 40.800 0.063 0.000 1.077 397 D HN 0.012 8.382 8.370 0.000 0.000 0.503 398 A N 0.297 123.108 122.820 -0.015 0.000 2.612 398 A HA 0.524 4.845 4.320 0.001 0.000 0.293 398 A C -1.160 176.333 177.584 -0.153 0.000 1.075 398 A CA -0.763 51.197 52.037 -0.129 0.000 0.680 398 A CB 1.530 20.396 19.000 -0.224 0.000 1.279 398 A HN 0.387 8.537 8.150 0.000 0.000 0.411 399 C N 2.234 121.387 119.300 -0.246 0.000 2.298 399 C HA 0.743 5.203 4.460 0.001 0.000 0.323 399 C C -0.678 174.169 174.990 -0.238 0.000 1.284 399 C CA -0.577 58.337 59.018 -0.173 0.000 1.577 399 C CB -1.265 26.362 27.740 -0.187 0.000 2.249 399 C HN 0.642 8.872 8.230 0.000 0.000 0.497 400 L N 6.805 127.941 121.223 -0.146 0.000 2.272 400 L HA 0.499 4.840 4.340 0.001 0.000 0.289 400 L C -0.046 176.687 176.870 -0.228 0.000 1.032 400 L CA -0.047 54.661 54.840 -0.220 0.000 0.810 400 L CB 0.951 43.002 42.059 -0.013 0.000 1.205 400 L HN 0.636 8.866 8.230 0.000 0.000 0.422 401 Q N 3.621 123.127 119.800 -0.491 0.000 2.333 401 Q HA 0.529 4.870 4.340 0.001 0.000 0.267 401 Q C -1.476 174.147 176.000 -0.628 0.000 1.012 401 Q CA -0.482 55.111 55.803 -0.350 0.000 0.824 401 Q CB 2.629 31.232 28.738 -0.226 0.000 1.290 401 Q HN 0.430 8.700 8.270 0.000 0.000 0.449 402 F N 0.874 120.792 119.950 -0.054 0.000 2.552 402 F HA 0.342 4.869 4.527 0.001 0.000 0.369 402 F C 0.853 176.629 175.800 -0.040 0.000 1.112 402 F CA -0.646 57.322 58.000 -0.053 0.000 1.129 402 F CB 1.262 40.237 39.000 -0.042 0.000 1.360 402 F HN 0.757 9.057 8.300 0.000 0.000 0.473 403 G N 1.385 110.217 108.800 0.055 0.000 2.655 403 G HA2 0.051 4.011 3.960 0.001 0.000 0.217 403 G HA3 0.051 4.011 3.960 0.001 0.000 0.217 403 G C 1.795 176.739 174.900 0.074 0.000 1.279 403 G CA 0.617 45.745 45.100 0.047 0.000 0.870 403 G HN 0.720 9.010 8.290 0.000 0.000 0.560 404 G N 0.722 109.558 108.800 0.060 0.000 2.469 404 G HA2 0.016 3.976 3.960 0.001 0.000 0.220 404 G HA3 0.016 3.976 3.960 0.001 0.000 0.220 404 G C 1.666 176.614 174.900 0.080 0.000 1.136 404 G CA 1.414 46.568 45.100 0.089 0.000 0.759 404 G HN 0.708 8.998 8.290 0.000 0.000 0.562 405 G N -0.912 107.880 108.800 -0.014 0.000 2.679 405 G HA2 0.159 4.119 3.960 0.001 0.000 0.212 405 G HA3 0.159 4.119 3.960 0.001 0.000 0.212 405 G C 1.461 176.451 174.900 0.150 0.000 1.137 405 G CA 1.519 46.517 45.100 -0.170 0.000 0.787 405 G HN 0.418 8.708 8.290 0.000 0.000 0.534 406 T N 0.333 115.008 114.554 0.202 0.000 3.114 406 T HA 0.094 4.444 4.350 0.001 0.000 0.240 406 T C 1.954 176.777 174.700 0.205 0.000 0.983 406 T CA -0.055 62.158 62.100 0.188 0.000 1.151 406 T CB -0.030 68.901 68.868 0.105 0.000 0.974 406 T HN 0.062 8.302 8.240 0.000 0.000 0.442 407 L N 1.519 122.839 121.223 0.162 0.000 2.610 407 L HA 0.279 4.619 4.340 0.001 0.000 0.232 407 L C 2.159 179.146 176.870 0.195 0.000 1.149 407 L CA 0.731 55.653 54.840 0.137 0.000 0.872 407 L CB -0.211 41.894 42.059 0.077 0.000 0.992 407 L HN 0.353 8.583 8.230 0.000 0.000 0.447 408 G N -3.034 105.955 108.800 0.314 0.000 3.126 408 G HA2 -0.055 3.906 3.960 0.001 0.000 0.224 408 G HA3 -0.055 3.906 3.960 0.001 0.000 0.224 408 G C 0.468 175.570 174.900 0.338 0.000 1.142 408 G CA -0.298 45.031 45.100 0.382 0.000 0.759 408 G HN 0.258 8.548 8.290 0.000 0.000 0.550 409 H N 2.010 121.222 119.070 0.235 0.000 2.848 409 H HA 0.095 4.651 4.556 0.001 0.000 0.341 409 H C -1.184 174.102 175.328 -0.069 0.000 1.060 409 H CA -1.116 54.920 56.048 -0.020 0.000 1.444 409 H CB 2.085 31.856 29.762 0.015 0.000 1.446 409 H HN 0.005 8.285 8.280 0.000 0.000 0.583 410 P HA -0.109 4.311 4.420 0.000 0.000 0.226 410 P C 0.636 178.153 177.300 0.362 0.000 1.153 410 P CA 0.984 64.062 63.100 -0.036 0.000 0.777 410 P CB 0.128 31.709 31.700 -0.199 0.000 0.794 411 W N 0.331 121.821 121.300 0.317 0.000 3.220 411 W HA 0.509 5.170 4.660 0.000 0.000 0.328 411 W C 1.068 177.631 176.519 0.074 0.000 1.205 411 W CA 0.384 57.828 57.345 0.164 0.000 1.773 411 W CB -0.587 28.961 29.460 0.146 0.000 1.086 411 W HN 0.038 8.218 8.180 0.000 0.000 0.622 412 G N 1.004 109.982 108.800 0.296 0.000 2.566 412 G HA2 -0.279 3.681 3.960 0.001 0.000 0.599 412 G HA3 -0.279 3.681 3.960 0.001 0.000 0.599 412 G C 0.593 175.517 174.900 0.040 0.000 1.292 412 G CA -0.175 45.004 45.100 0.132 0.000 0.922 412 G HN -0.038 8.252 8.290 0.000 0.000 0.514 413 N N -0.052 118.647 118.700 -0.001 0.000 2.216 413 N HA 0.078 4.819 4.740 0.001 0.000 0.183 413 N C 2.659 178.109 175.510 -0.100 0.000 1.017 413 N CA 2.223 55.251 53.050 -0.038 0.000 0.861 413 N CB -0.576 37.881 38.487 -0.049 0.000 0.986 413 N HN 1.021 9.401 8.380 0.000 0.000 0.428 414 A N 1.510 124.259 122.820 -0.118 0.000 1.873 414 A HA -0.016 4.304 4.320 0.001 0.000 0.215 414 A C -0.235 177.255 177.584 -0.157 0.000 1.186 414 A CA 1.230 53.181 52.037 -0.142 0.000 0.616 414 A CB -1.435 17.477 19.000 -0.147 0.000 0.823 414 A HN 0.199 8.349 8.150 0.000 0.000 0.442 415 P HA -0.061 4.359 4.420 0.000 0.000 0.217 415 P C 1.711 178.623 177.300 -0.646 0.000 1.150 415 P CA 1.647 64.556 63.100 -0.319 0.000 0.832 415 P CB -0.323 31.272 31.700 -0.175 0.000 0.787 416 G N 0.215 108.647 108.800 -0.614 0.000 2.418 416 G HA2 -0.238 3.722 3.960 0.001 0.000 0.217 416 G HA3 -0.238 3.722 3.960 0.001 0.000 0.217 416 G C 1.653 176.463 174.900 -0.150 0.000 1.158 416 G CA 0.932 45.835 45.100 -0.328 0.000 0.771 416 G HN 0.304 8.594 8.290 0.000 0.000 0.545 417 A N 1.253 123.990 122.820 -0.137 0.000 1.877 417 A HA 0.255 4.575 4.320 0.001 0.000 0.216 417 A C 2.832 180.344 177.584 -0.120 0.000 1.186 417 A CA 2.321 54.295 52.037 -0.106 0.000 0.620 417 A CB -0.863 18.081 19.000 -0.093 0.000 0.822 417 A HN 0.799 8.949 8.150 0.000 0.000 0.443 418 A N -0.149 122.590 122.820 -0.135 0.000 1.902 418 A HA 0.143 4.463 4.320 0.001 0.000 0.217 418 A C 2.507 180.026 177.584 -0.109 0.000 1.181 418 A CA 2.153 54.126 52.037 -0.107 0.000 0.623 418 A CB -1.033 17.905 19.000 -0.102 0.000 0.818 418 A HN 1.078 9.228 8.150 0.000 0.000 0.443 419 A N 0.361 123.095 122.820 -0.144 0.000 1.883 419 A HA -0.251 4.070 4.320 0.001 0.000 0.217 419 A C 1.903 179.400 177.584 -0.146 0.000 1.186 419 A CA 1.928 53.895 52.037 -0.116 0.000 0.624 419 A CB -0.899 18.069 19.000 -0.054 0.000 0.822 419 A HN 0.711 8.861 8.150 0.000 0.000 0.444 420 N N -1.228 117.350 118.700 -0.203 0.000 2.142 420 N HA -0.163 4.578 4.740 0.001 0.000 0.186 420 N C 1.969 177.350 175.510 -0.215 0.000 1.023 420 N CA 1.340 54.180 53.050 -0.350 0.000 0.852 420 N CB -0.139 38.036 38.487 -0.521 0.000 0.998 420 N HN 0.421 8.801 8.380 0.000 0.000 0.424 421 R N 1.155 121.577 120.500 -0.129 0.000 2.075 421 R HA -0.008 4.333 4.340 0.001 0.000 0.232 421 R C 1.746 178.024 176.300 -0.037 0.000 1.126 421 R CA 1.043 57.102 56.100 -0.069 0.000 0.963 421 R CB -0.763 29.507 30.300 -0.051 0.000 0.858 421 R HN 0.020 8.290 8.270 0.000 0.000 0.435 422 V N 0.890 120.792 119.914 -0.021 0.000 2.295 422 V HA -0.230 3.891 4.120 0.001 0.000 0.246 422 V C 2.369 178.462 176.094 -0.002 0.000 1.049 422 V CA 2.004 64.326 62.300 0.037 0.000 1.024 422 V CB -1.024 30.855 31.823 0.094 0.000 0.648 422 V HN 0.546 8.736 8.190 0.000 0.000 0.447 423 A N -0.135 122.649 122.820 -0.061 0.000 1.883 423 A HA -0.232 4.089 4.320 0.001 0.000 0.217 423 A C 2.184 179.740 177.584 -0.048 0.000 1.186 423 A CA 2.275 54.262 52.037 -0.082 0.000 0.624 423 A CB -0.671 18.238 19.000 -0.151 0.000 0.822 423 A HN 0.464 8.614 8.150 0.000 0.000 0.444 424 L N 0.126 121.320 121.223 -0.047 0.000 2.012 424 L HA -0.174 4.167 4.340 0.001 0.000 0.210 424 L C 2.201 179.073 176.870 0.003 0.000 1.073 424 L CA 2.542 57.380 54.840 -0.004 0.000 0.748 424 L CB -0.704 41.358 42.059 0.006 0.000 0.891 424 L HN 0.533 8.763 8.230 0.000 0.000 0.431 425 E N -0.463 119.734 120.200 -0.005 0.000 2.110 425 E HA -0.194 4.156 4.350 0.001 0.000 0.193 425 E C 2.139 178.731 176.600 -0.014 0.000 0.988 425 E CA 1.037 57.435 56.400 -0.004 0.000 0.804 425 E CB -0.280 29.419 29.700 -0.002 0.000 0.745 425 E HN 0.677 9.037 8.360 0.000 0.000 0.458 426 A N 0.813 123.623 122.820 -0.017 0.000 1.898 426 A HA -0.174 4.147 4.320 0.001 0.000 0.216 426 A C 2.425 179.999 177.584 -0.016 0.000 1.181 426 A CA 1.074 53.093 52.037 -0.030 0.000 0.620 426 A CB -0.762 18.223 19.000 -0.026 0.000 0.819 426 A HN 0.338 8.488 8.150 0.000 0.000 0.442 427 C N -1.068 118.231 119.300 -0.001 0.000 2.446 427 C HA -0.063 4.398 4.460 0.001 0.000 0.277 427 C C 3.039 178.041 174.990 0.019 0.000 1.275 427 C CA 1.522 60.549 59.018 0.016 0.000 1.727 427 C CB -1.440 26.321 27.740 0.034 0.000 2.010 427 C HN 0.645 8.875 8.230 0.000 0.000 0.486 428 T N 0.118 114.682 114.554 0.017 0.000 2.777 428 T HA -0.246 4.104 4.350 0.001 0.000 0.266 428 T C 1.861 176.566 174.700 0.008 0.000 1.040 428 T CA 1.670 63.782 62.100 0.020 0.000 1.141 428 T CB -0.375 68.505 68.868 0.021 0.000 0.868 428 T HN 0.669 8.909 8.240 0.000 0.000 0.444 429 Q N 0.610 120.407 119.800 -0.006 0.000 2.084 429 Q HA -0.094 4.246 4.340 0.001 0.000 0.202 429 Q C 2.493 178.485 176.000 -0.014 0.000 0.978 429 Q CA 1.462 57.255 55.803 -0.017 0.000 0.844 429 Q CB -0.294 28.421 28.738 -0.039 0.000 0.898 429 Q HN 0.532 8.802 8.270 0.000 0.000 0.426 430 A N 1.407 124.220 122.820 -0.011 0.000 1.877 430 A HA -0.224 4.096 4.320 0.001 0.000 0.216 430 A C 2.155 179.741 177.584 0.004 0.000 1.186 430 A CA 1.540 53.574 52.037 -0.006 0.000 0.620 430 A CB -0.749 18.251 19.000 -0.000 0.000 0.822 430 A HN 0.426 8.576 8.150 0.000 0.000 0.443 431 R N 0.159 120.666 120.500 0.011 0.000 2.083 431 R HA -0.173 4.167 4.340 0.001 0.000 0.237 431 R C 1.880 178.187 176.300 0.012 0.000 1.137 431 R CA 1.992 58.101 56.100 0.016 0.000 0.951 431 R CB -0.597 29.717 30.300 0.024 0.000 0.851 431 R HN 0.745 9.015 8.270 0.000 0.000 0.434 432 N N 0.078 118.783 118.700 0.009 0.000 2.205 432 N HA -0.160 4.581 4.740 0.001 0.000 0.186 432 N C 1.090 176.601 175.510 0.002 0.000 1.015 432 N CA 1.111 54.166 53.050 0.007 0.000 0.862 432 N CB -0.019 38.471 38.487 0.005 0.000 0.986 432 N HN 0.437 8.817 8.380 0.000 0.000 0.429 433 E N -0.397 119.802 120.200 -0.002 0.000 2.502 433 E HA 0.037 4.387 4.350 0.001 0.000 0.194 433 E C 0.940 177.539 176.600 -0.002 0.000 1.062 433 E CA 0.137 56.534 56.400 -0.005 0.000 0.867 433 E CB 0.338 30.031 29.700 -0.012 0.000 0.888 433 E HN 0.477 8.837 8.360 0.000 0.000 0.510 434 G N 1.685 110.486 108.800 0.002 0.000 2.184 434 G HA2 -0.235 3.726 3.960 0.001 0.000 0.206 434 G HA3 -0.235 3.726 3.960 0.001 0.000 0.206 434 G C 0.113 175.017 174.900 0.007 0.000 0.995 434 G CA -0.529 44.573 45.100 0.004 0.000 0.651 434 G HN 0.087 8.377 8.290 0.000 0.000 0.511 435 R N 0.725 121.230 120.500 0.007 0.000 2.490 435 R HA 0.373 4.713 4.340 0.001 0.000 0.280 435 R C -0.746 175.563 176.300 0.016 0.000 1.077 435 R CA -0.411 55.696 56.100 0.011 0.000 1.065 435 R CB 0.731 31.038 30.300 0.011 0.000 1.003 435 R HN 0.167 8.437 8.270 0.000 0.000 0.470 436 D N 3.696 124.107 120.400 0.018 0.000 2.365 436 D HA 0.042 4.682 4.640 0.001 0.000 0.237 436 D C 0.925 177.241 176.300 0.027 0.000 1.190 436 D CA -0.097 53.915 54.000 0.020 0.000 0.867 436 D CB 0.793 41.603 40.800 0.017 0.000 1.050 436 D HN 0.445 8.815 8.370 0.000 0.000 0.491 437 L N 3.149 124.390 121.223 0.031 0.000 2.201 437 L HA -0.079 4.261 4.340 0.001 0.000 0.212 437 L C 2.354 179.252 176.870 0.048 0.000 1.105 437 L CA 0.855 55.721 54.840 0.043 0.000 0.775 437 L CB -0.225 41.862 42.059 0.048 0.000 0.913 437 L HN 0.447 8.677 8.230 0.000 0.000 0.440 438 A N -0.008 122.834 122.820 0.037 0.000 1.933 438 A HA -0.170 4.151 4.320 0.001 0.000 0.218 438 A C 2.431 180.038 177.584 0.037 0.000 1.175 438 A CA 1.390 53.448 52.037 0.035 0.000 0.628 438 A CB -0.280 18.733 19.000 0.021 0.000 0.814 438 A HN 0.322 8.472 8.150 0.000 0.000 0.444 439 R N -1.189 119.331 120.500 0.033 0.000 2.146 439 R HA 0.085 4.425 4.340 0.001 0.000 0.206 439 R C 0.993 177.318 176.300 0.041 0.000 1.049 439 R CA 1.007 57.126 56.100 0.032 0.000 1.029 439 R CB 0.103 30.418 30.300 0.024 0.000 0.949 439 R HN 0.586 8.856 8.270 0.000 0.000 0.471 440 E N -0.558 119.668 120.200 0.044 0.000 2.526 440 E HA 0.102 4.453 4.350 0.001 0.000 0.208 440 E C 1.427 178.066 176.600 0.066 0.000 0.997 440 E CA -0.063 56.366 56.400 0.049 0.000 0.961 440 E CB 0.958 30.680 29.700 0.037 0.000 1.030 440 E HN 0.313 8.673 8.360 0.000 0.000 0.483 441 G N 1.504 110.350 108.800 0.077 0.000 2.476 441 G HA2 -0.297 3.663 3.960 0.001 0.000 0.218 441 G HA3 -0.297 3.663 3.960 0.001 0.000 0.218 441 G C 1.502 176.484 174.900 0.137 0.000 1.164 441 G CA 0.950 46.108 45.100 0.097 0.000 0.768 441 G HN 0.387 8.677 8.290 0.000 0.000 0.560 442 G N 0.705 109.608 108.800 0.171 0.000 2.418 442 G HA2 -0.177 3.783 3.960 0.001 0.000 0.217 442 G HA3 -0.177 3.783 3.960 0.001 0.000 0.217 442 G C 1.474 176.509 174.900 0.225 0.000 1.158 442 G CA 1.339 46.601 45.100 0.270 0.000 0.771 442 G HN 0.348 8.638 8.290 0.000 0.000 0.545 443 D N 0.310 120.791 120.400 0.136 0.000 2.117 443 D HA -0.094 4.546 4.640 0.001 0.000 0.197 443 D C 2.786 179.132 176.300 0.076 0.000 0.987 443 D CA 0.790 54.849 54.000 0.100 0.000 0.829 443 D CB -0.537 40.303 40.800 0.066 0.000 0.961 443 D HN 0.207 8.577 8.370 0.000 0.000 0.460 444 V N 1.596 121.547 119.914 0.061 0.000 2.287 444 V HA -0.222 3.898 4.120 0.001 0.000 0.248 444 V C 2.481 178.580 176.094 0.008 0.000 1.053 444 V CA 1.060 63.378 62.300 0.030 0.000 1.027 444 V CB -0.251 31.587 31.823 0.026 0.000 0.646 444 V HN 0.180 8.370 8.190 0.000 0.000 0.447 445 I N -0.142 120.428 120.570 -0.000 0.000 2.202 445 I HA -0.180 3.991 4.170 0.001 0.000 0.242 445 I C 2.649 178.682 176.117 -0.140 0.000 1.091 445 I CA 1.593 62.813 61.300 -0.133 0.000 1.368 445 I CB -1.193 36.639 38.000 -0.280 0.000 1.058 445 I HN 0.300 8.510 8.210 0.000 0.000 0.410 446 R N 0.376 120.885 120.500 0.015 0.000 2.091 446 R HA -0.134 4.206 4.340 0.001 0.000 0.238 446 R C 2.515 178.846 176.300 0.052 0.000 1.136 446 R CA 1.759 57.910 56.100 0.086 0.000 0.959 446 R CB -0.265 30.151 30.300 0.192 0.000 0.856 446 R HN 0.278 8.548 8.270 0.000 0.000 0.437 447 S N 0.407 116.135 115.700 0.047 0.000 2.368 447 S HA -0.140 4.331 4.470 0.001 0.000 0.225 447 S C 2.024 176.666 174.600 0.071 0.000 1.030 447 S CA 1.271 59.501 58.200 0.050 0.000 0.999 447 S CB -0.143 63.074 63.200 0.028 0.000 0.844 447 S HN 0.498 8.808 8.310 0.000 0.000 0.459 448 A N 0.572 123.419 122.820 0.045 0.000 1.968 448 A HA -0.088 4.232 4.320 0.001 0.000 0.217 448 A C 2.369 180.019 177.584 0.109 0.000 1.169 448 A CA 1.272 53.373 52.037 0.107 0.000 0.638 448 A CB -1.203 17.824 19.000 0.046 0.000 0.812 448 A HN 0.629 8.779 8.150 0.000 0.000 0.446 449 C N -0.159 119.136 119.300 -0.008 0.000 2.398 449 C HA -0.134 4.327 4.460 0.001 0.000 0.276 449 C C 2.620 177.622 174.990 0.019 0.000 1.222 449 C CA 1.349 60.341 59.018 -0.043 0.000 1.746 449 C CB -1.132 26.560 27.740 -0.080 0.000 2.039 449 C HN 0.601 8.831 8.230 0.000 0.000 0.470 450 K N -0.959 119.483 120.400 0.069 0.000 2.147 450 K HA -0.192 4.128 4.320 0.001 0.000 0.205 450 K C 1.846 178.518 176.600 0.120 0.000 1.049 450 K CA 1.700 58.037 56.287 0.084 0.000 0.936 450 K CB -0.197 32.359 32.500 0.094 0.000 0.722 450 K HN 0.723 8.973 8.250 0.000 0.000 0.446 451 W N 1.535 122.827 121.300 -0.014 0.000 2.480 451 W HA 0.046 4.707 4.660 0.000 0.000 0.299 451 W C 0.734 177.251 176.519 -0.004 0.000 1.187 451 W CA 0.644 57.985 57.345 -0.008 0.000 1.347 451 W CB -0.052 29.399 29.460 -0.014 0.000 1.121 451 W HN -0.250 7.930 8.180 0.000 0.000 0.533 452 S N 1.234 116.799 115.700 -0.225 0.000 2.422 452 S HA 0.266 4.736 4.470 0.001 0.000 0.298 452 S C -1.504 172.953 174.600 -0.237 0.000 1.118 452 S CA -1.465 56.459 58.200 -0.461 0.000 1.083 452 S CB 1.222 64.302 63.200 -0.200 0.000 0.971 452 S HN -0.129 8.181 8.310 0.000 0.000 0.478 453 P HA -0.041 4.379 4.420 0.000 0.000 0.217 453 P C 0.850 178.065 177.300 -0.141 0.000 1.150 453 P CA 0.976 64.061 63.100 -0.025 0.000 0.832 453 P CB 0.197 31.989 31.700 0.155 0.000 0.787 454 E N -0.598 119.527 120.200 -0.125 0.000 2.047 454 E HA -0.140 4.210 4.350 0.001 0.000 0.191 454 E C 1.854 178.337 176.600 -0.196 0.000 0.987 454 E CA 0.724 56.975 56.400 -0.248 0.000 0.799 454 E CB -1.319 28.299 29.700 -0.136 0.000 0.752 454 E HN 0.095 8.455 8.360 0.000 0.000 0.449 455 L N 0.629 121.758 121.223 -0.157 0.000 2.046 455 L HA -0.065 4.275 4.340 0.001 0.000 0.208 455 L C 2.053 178.808 176.870 -0.191 0.000 1.077 455 L CA 2.041 56.795 54.840 -0.142 0.000 0.747 455 L CB -0.966 41.027 42.059 -0.109 0.000 0.896 455 L HN 0.119 8.349 8.230 0.000 0.000 0.432 456 A N -0.418 122.290 122.820 -0.186 0.000 1.917 456 A HA -0.185 4.135 4.320 0.001 0.000 0.219 456 A C 2.458 179.890 177.584 -0.253 0.000 1.182 456 A CA 2.061 53.998 52.037 -0.168 0.000 0.633 456 A CB -1.198 17.740 19.000 -0.104 0.000 0.819 456 A HN 0.592 8.742 8.150 0.000 0.000 0.448 457 A N -0.381 122.175 122.820 -0.441 0.000 1.933 457 A HA 0.192 4.512 4.320 0.001 0.000 0.218 457 A C 2.482 179.646 177.584 -0.701 0.000 1.175 457 A CA 2.003 53.641 52.037 -0.665 0.000 0.628 457 A CB -0.908 17.324 19.000 -1.280 0.000 0.814 457 A HN 1.051 9.201 8.150 0.000 0.000 0.444 458 A N -0.857 121.624 122.820 -0.566 0.000 1.898 458 A HA -0.129 4.191 4.320 0.001 0.000 0.216 458 A C 2.286 179.766 177.584 -0.174 0.000 1.181 458 A CA 1.578 53.378 52.037 -0.395 0.000 0.620 458 A CB -1.258 17.771 19.000 0.049 0.000 0.819 458 A HN 0.612 8.762 8.150 0.000 0.000 0.442 459 C N -0.773 118.437 119.300 -0.150 0.000 2.413 459 C HA -0.080 4.380 4.460 0.001 0.000 0.276 459 C C 2.686 177.834 174.990 0.263 0.000 1.248 459 C CA 1.412 60.443 59.018 0.022 0.000 1.742 459 C CB -1.062 26.599 27.740 -0.132 0.000 2.017 459 C HN 0.780 9.010 8.230 0.000 0.000 0.481 460 E N 1.537 121.732 120.200 -0.007 0.000 2.072 460 E HA -0.148 4.202 4.350 0.001 0.000 0.191 460 E C 2.103 178.613 176.600 -0.151 0.000 0.985 460 E CA 2.056 58.429 56.400 -0.046 0.000 0.801 460 E CB -0.283 29.351 29.700 -0.111 0.000 0.750 460 E HN 0.528 8.888 8.360 0.000 0.000 0.452 461 V N -2.004 117.684 119.914 -0.377 0.000 2.427 461 V HA -0.059 4.061 4.120 0.001 0.000 0.248 461 V C 1.503 177.308 176.094 -0.483 0.000 1.051 461 V CA 1.465 63.414 62.300 -0.584 0.000 1.048 461 V CB -0.696 30.488 31.823 -1.066 0.000 0.666 461 V HN 0.296 8.486 8.190 0.000 0.000 0.456 462 W N 0.494 121.727 121.300 -0.111 0.000 2.991 462 W HA 0.454 5.114 4.660 0.001 0.000 0.391 462 W C 1.926 178.318 176.519 -0.211 0.000 1.054 462 W CA -0.790 56.394 57.345 -0.269 0.000 1.856 462 W CB -0.021 29.055 29.460 -0.640 0.000 1.132 462 W HN 0.317 8.497 8.180 0.000 0.000 0.601 463 K N 1.173 121.621 120.400 0.080 0.000 2.074 463 K HA -0.196 4.124 4.320 0.001 0.000 0.209 463 K C 1.129 177.532 176.600 -0.328 0.000 1.048 463 K CA 1.513 57.654 56.287 -0.244 0.000 0.926 463 K CB 0.279 32.691 32.500 -0.145 0.000 0.713 463 K HN -0.147 8.103 8.250 0.000 0.000 0.444 464 E N 0.441 120.542 120.200 -0.164 0.000 2.444 464 E HA 0.055 4.406 4.350 0.001 0.000 0.191 464 E C -0.350 176.188 176.600 -0.104 0.000 1.041 464 E CA 0.037 56.346 56.400 -0.152 0.000 0.883 464 E CB 0.420 30.049 29.700 -0.118 0.000 1.024 464 E HN 0.223 8.583 8.360 0.000 0.000 0.470 465 I N 1.901 122.443 120.570 -0.046 0.000 2.304 465 I HA 0.209 4.379 4.170 0.001 0.000 0.291 465 I C 0.119 176.256 176.117 0.034 0.000 1.018 465 I CA -0.400 60.889 61.300 -0.019 0.000 1.260 465 I CB 0.522 38.567 38.000 0.075 0.000 1.390 465 I HN -0.270 7.940 8.210 0.000 0.000 0.475 466 K N 5.673 125.960 120.400 -0.187 0.000 2.443 466 K HA 0.651 4.971 4.320 0.001 0.000 0.251 466 K C -1.243 175.114 176.600 -0.405 0.000 0.972 466 K CA -0.358 55.864 56.287 -0.108 0.000 0.833 466 K CB 2.028 34.508 32.500 -0.033 0.000 1.317 466 K HN 0.155 8.405 8.250 0.000 0.000 0.441 467 F N 1.224 121.269 119.950 0.158 0.000 2.552 467 F HA 0.342 4.869 4.527 0.001 0.000 0.369 467 F C -0.567 175.296 175.800 0.105 0.000 1.112 467 F CA -0.459 57.644 58.000 0.171 0.000 1.129 467 F CB 1.473 40.609 39.000 0.226 0.000 1.360 467 F HN 0.294 8.594 8.300 0.000 0.000 0.473 468 E N 3.683 123.868 120.200 -0.025 0.000 2.267 468 E HA 0.506 4.856 4.350 0.001 0.000 0.248 468 E C -1.285 175.135 176.600 -0.299 0.000 0.899 468 E CA -0.419 55.941 56.400 -0.068 0.000 0.764 468 E CB 1.669 31.312 29.700 -0.095 0.000 1.227 468 E HN 0.307 8.667 8.360 0.000 0.000 0.421 469 F N 0.399 120.399 119.950 0.083 0.000 2.613 469 F HA 0.215 4.743 4.527 0.001 0.000 0.314 469 F C 0.244 176.076 175.800 0.053 0.000 1.075 469 F CA -1.196 56.844 58.000 0.067 0.000 0.945 469 F CB 1.416 40.462 39.000 0.076 0.000 1.310 469 F HN 0.230 8.530 8.300 0.000 0.000 0.467 470 D N 0.848 121.400 120.400 0.253 0.000 2.458 470 D HA 0.117 4.757 4.640 0.001 0.000 0.243 470 D C -0.464 175.923 176.300 0.145 0.000 1.146 470 D CA 0.549 54.642 54.000 0.155 0.000 0.877 470 D CB 0.767 41.640 40.800 0.121 0.000 1.176 470 D HN 0.407 8.777 8.370 0.000 0.000 0.461 471 T N 5.489 120.109 114.554 0.111 0.000 2.817 471 T HA 0.141 4.492 4.350 0.001 0.000 0.293 471 T C 1.353 176.101 174.700 0.081 0.000 0.964 471 T CA -0.760 61.398 62.100 0.097 0.000 1.085 471 T CB 0.844 69.767 68.868 0.092 0.000 0.921 471 T HN 0.285 8.525 8.240 0.000 0.000 0.502 472 I N 1.606 122.218 120.570 0.071 0.000 2.385 472 I HA 0.035 4.205 4.170 0.001 0.000 0.244 472 I C 1.390 177.556 176.117 0.081 0.000 1.089 472 I CA 0.829 62.167 61.300 0.063 0.000 1.410 472 I CB -0.684 37.340 38.000 0.041 0.000 1.117 472 I HN 0.574 8.784 8.210 0.000 0.000 0.429 473 D N 2.907 123.364 120.400 0.095 0.000 2.608 473 D HA 0.080 4.720 4.640 0.001 0.000 0.224 473 D C -0.022 176.374 176.300 0.160 0.000 1.123 473 D CA 0.153 54.236 54.000 0.138 0.000 1.030 473 D CB -0.225 40.662 40.800 0.145 0.000 1.093 473 D HN 0.091 8.461 8.370 0.000 0.000 0.497 474 K N 1.729 122.207 120.400 0.129 0.000 2.098 474 K HA 0.367 4.687 4.320 0.001 0.000 0.258 474 K C 0.590 177.259 176.600 0.114 0.000 0.973 474 K CA -0.896 55.456 56.287 0.110 0.000 0.898 474 K CB 1.670 34.217 32.500 0.078 0.000 1.057 474 K HN 0.242 8.492 8.250 0.000 0.000 0.447 475 L N 0.000 121.277 121.223 0.090 0.000 2.949 475 L HA 0.000 4.340 4.340 0.001 0.000 0.249 475 L CA 0.000 54.884 54.840 0.074 0.000 0.813 475 L CB 0.000 42.076 42.059 0.029 0.000 0.961 475 L HN 0.000 8.230 8.230 0.000 0.000 0.502