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 3my1_1_A DATA FIRST_RESID 6 DATA SEQUENCE DSVECPFCDE VSKYEKLAKI GQGTFGEVFK ARHRKTGQKV ALKKVLMENE DATA SEQUENCE KEGFPITALR EIKILQLLKH ENVVNLIEIC RTKXXXXXXX KGSIYLVFDF DATA SEQUENCE CEHDLAGLLS NVLVKFTLSE IKRVMQMLLN GLYYIHRNKI LHRDMKAANV DATA SEQUENCE LITRDGVLKL ADFGLARAFS LAKNSQPNRY XNRVVTLWYR PPELLLGERD DATA SEQUENCE YGPPIDLWGA GCIMAEMWTR SPIMQGNTEQ HQLALISQLC GSITPEVWPN DATA SEQUENCE VDNYELYEKL ELVKGQKRKV KDRLKAYVRD PYALDLIDKL LVLDPAQRID DATA SEQUENCE SDDALNHDFF WSDPMPSDLK GM VARS RESID RESNAME ATOMNAME SS_SHIFT SHIFT RC_SHIFT HM_SHIFT EF_SHIFT SIGMA FORMAT %4d %4s %4s %9.3f %9.3f %9.3f %9.3f %9.3f %9.3f 6 D HA 0.000 4.640 4.640 -0.000 0.000 0.175 6 D C 0.000 176.294 176.300 -0.010 0.000 2.045 6 D CA 0.000 53.995 54.000 -0.009 0.000 0.868 6 D CB 0.000 40.794 40.800 -0.010 0.000 0.688 7 S N -1.108 114.584 115.700 -0.014 0.000 2.536 7 S HA 0.729 5.198 4.470 -0.001 0.000 0.298 7 S C -1.093 173.494 174.600 -0.021 0.000 1.083 7 S CA -0.598 57.592 58.200 -0.017 0.000 0.995 7 S CB 1.255 64.444 63.200 -0.019 0.000 1.058 7 S HN 0.442 8.752 8.310 -0.000 0.000 0.488 8 V N 3.992 123.891 119.914 -0.024 0.000 2.483 8 V HA 0.434 4.553 4.120 -0.001 0.000 0.295 8 V C 0.064 176.131 176.094 -0.045 0.000 1.035 8 V CA -0.937 61.344 62.300 -0.032 0.000 0.896 8 V CB 1.656 33.463 31.823 -0.028 0.000 0.986 8 V HN 0.810 9.000 8.190 -0.000 0.000 0.447 9 E N 1.445 121.610 120.200 -0.057 0.000 2.442 9 E HA 0.046 4.395 4.350 -0.001 0.000 0.262 9 E C -0.321 176.215 176.600 -0.106 0.000 1.004 9 E CA 0.262 56.612 56.400 -0.083 0.000 0.928 9 E CB 1.015 30.658 29.700 -0.095 0.000 0.937 9 E HN 0.743 9.103 8.360 -0.000 0.000 0.446 10 C N 5.665 124.888 119.300 -0.129 0.000 3.432 10 C HA 0.233 4.693 4.460 -0.001 0.000 0.242 10 C C -1.626 173.244 174.990 -0.200 0.000 1.152 10 C CA -1.137 57.794 59.018 -0.146 0.000 1.242 10 C CB -0.439 27.256 27.740 -0.074 0.000 1.802 10 C HN 0.563 8.793 8.230 -0.000 0.000 0.577 11 P HA -0.009 4.411 4.420 -0.000 0.000 0.218 11 P C 0.542 177.651 177.300 -0.319 0.000 1.148 11 P CA 1.471 64.256 63.100 -0.526 0.000 0.822 11 P CB 0.017 31.034 31.700 -1.139 0.000 0.784 12 F N -2.632 117.315 119.950 -0.006 0.000 2.698 12 F HA 0.312 4.838 4.527 -0.001 0.000 0.304 12 F C 0.370 176.168 175.800 -0.002 0.000 1.108 12 F CA -1.150 56.847 58.000 -0.005 0.000 1.263 12 F CB -0.523 38.471 39.000 -0.010 0.000 1.013 12 F HN -0.109 8.191 8.300 -0.000 0.000 0.532 13 C N 1.566 120.934 119.300 0.113 0.000 2.660 13 C HA 0.482 4.941 4.460 -0.001 0.000 0.336 13 C C -0.496 174.529 174.990 0.058 0.000 1.058 13 C CA -0.749 58.319 59.018 0.083 0.000 1.368 13 C CB -0.823 26.949 27.740 0.053 0.000 1.884 13 C HN 0.175 8.405 8.230 -0.000 0.000 0.454 14 D N 3.138 123.581 120.400 0.072 0.000 2.341 14 D HA 0.219 4.859 4.640 -0.001 0.000 0.245 14 D C 0.177 176.509 176.300 0.053 0.000 1.106 14 D CA 0.201 54.230 54.000 0.047 0.000 0.905 14 D CB 1.078 41.904 40.800 0.044 0.000 1.202 14 D HN 0.636 9.006 8.370 -0.000 0.000 0.426 15 E N 0.464 120.677 120.200 0.021 0.000 2.344 15 E HA 0.031 4.380 4.350 -0.001 0.000 0.270 15 E C 0.758 177.372 176.600 0.023 0.000 1.021 15 E CA -0.393 56.023 56.400 0.027 0.000 0.887 15 E CB 1.522 31.222 29.700 -0.001 0.000 0.997 15 E HN 0.105 8.465 8.360 -0.000 0.000 0.429 16 V N 3.562 123.510 119.914 0.056 0.000 2.867 16 V HA -0.236 3.883 4.120 -0.001 0.000 0.260 16 V C 2.047 178.119 176.094 -0.036 0.000 1.099 16 V CA 2.295 64.618 62.300 0.039 0.000 1.122 16 V CB -0.590 31.145 31.823 -0.147 0.000 0.708 16 V HN 0.827 9.017 8.190 -0.000 0.000 0.490 17 S N 0.877 116.534 115.700 -0.072 0.000 2.528 17 S HA -0.248 4.222 4.470 -0.001 0.000 0.244 17 S C 1.789 176.289 174.600 -0.167 0.000 0.982 17 S CA 1.407 59.543 58.200 -0.107 0.000 0.953 17 S CB -0.643 62.506 63.200 -0.084 0.000 0.754 17 S HN 0.915 9.225 8.310 -0.000 0.000 0.529 18 K N -0.306 119.950 120.400 -0.239 0.000 2.365 18 K HA -0.011 4.308 4.320 -0.001 0.000 0.199 18 K C -0.418 175.769 176.600 -0.688 0.000 1.045 18 K CA 0.335 56.334 56.287 -0.480 0.000 0.962 18 K CB -0.283 31.867 32.500 -0.583 0.000 0.759 18 K HN 0.469 8.719 8.250 -0.000 0.000 0.469 19 Y N 1.608 121.761 120.300 -0.244 0.000 2.387 19 Y HA 0.288 4.837 4.550 -0.001 0.000 0.330 19 Y C -0.396 175.389 175.900 -0.192 0.000 1.133 19 Y CA -1.239 56.738 58.100 -0.205 0.000 1.152 19 Y CB 1.633 39.998 38.460 -0.158 0.000 1.215 19 Y HN 0.002 8.282 8.280 -0.000 0.000 0.466 20 E N 3.196 123.397 120.200 0.002 0.000 2.092 20 E HA 0.241 4.591 4.350 -0.001 0.000 0.271 20 E C -0.977 175.582 176.600 -0.069 0.000 0.919 20 E CA -0.715 55.650 56.400 -0.058 0.000 0.760 20 E CB 0.572 30.241 29.700 -0.052 0.000 1.106 20 E HN 0.533 8.893 8.360 -0.000 0.000 0.408 21 K N 3.598 123.915 120.400 -0.138 0.000 2.440 21 K HA 0.048 4.368 4.320 -0.001 0.000 0.270 21 K C 0.593 177.155 176.600 -0.063 0.000 0.980 21 K CA 0.310 56.500 56.287 -0.162 0.000 0.953 21 K CB 0.841 33.115 32.500 -0.377 0.000 0.925 21 K HN 0.601 8.851 8.250 -0.000 0.000 0.497 22 L N 0.149 121.374 121.223 0.004 0.000 2.664 22 L HA 0.310 4.650 4.340 -0.001 0.000 0.198 22 L C 0.009 176.923 176.870 0.074 0.000 1.057 22 L CA -0.098 54.750 54.840 0.014 0.000 0.871 22 L CB 0.696 42.734 42.059 -0.036 0.000 1.364 22 L HN 0.707 8.937 8.230 -0.000 0.000 0.483 23 A N 0.310 123.213 122.820 0.138 0.000 2.532 23 A HA 0.379 4.699 4.320 -0.001 0.000 0.296 23 A C -1.171 176.501 177.584 0.147 0.000 1.058 23 A CA -0.637 51.484 52.037 0.140 0.000 0.729 23 A CB 1.076 20.118 19.000 0.071 0.000 1.285 23 A HN -0.007 8.143 8.150 -0.000 0.000 0.396 24 K N 1.755 122.198 120.400 0.073 0.000 2.484 24 K HA 0.163 4.483 4.320 -0.001 0.000 0.280 24 K C 0.544 177.115 176.600 -0.049 0.000 1.013 24 K CA 0.897 57.102 56.287 -0.137 0.000 1.029 24 K CB 0.255 32.648 32.500 -0.178 0.000 0.902 24 K HN 0.742 8.992 8.250 -0.000 0.000 0.481 25 I N -1.302 119.237 120.570 -0.053 0.000 4.442 25 I HA 0.212 4.381 4.170 -0.001 0.000 0.331 25 I C 0.918 177.032 176.117 -0.005 0.000 1.364 25 I CA -0.328 60.983 61.300 0.019 0.000 1.207 25 I CB 0.927 38.994 38.000 0.112 0.000 1.298 25 I HN 0.452 8.662 8.210 -0.000 0.000 0.463 26 G N 2.229 110.993 108.800 -0.059 0.000 3.574 26 G HA2 0.230 4.190 3.960 -0.001 0.000 0.262 26 G HA3 0.230 4.190 3.960 -0.001 0.000 0.262 26 G C 0.268 175.157 174.900 -0.019 0.000 1.231 26 G CA -0.284 44.791 45.100 -0.042 0.000 1.608 26 G HN 0.417 8.707 8.290 -0.000 0.000 0.628 27 Q N -0.790 119.007 119.800 -0.005 0.000 2.793 27 Q HA 0.349 4.689 4.340 -0.001 0.000 0.220 27 Q C 1.538 177.564 176.000 0.044 0.000 1.123 27 Q CA 0.825 56.635 55.803 0.012 0.000 1.073 27 Q CB 0.267 29.015 28.738 0.017 0.000 1.315 27 Q HN 0.469 8.739 8.270 -0.000 0.000 0.619 28 G N -0.884 107.951 108.800 0.057 0.000 2.179 28 G HA2 -0.336 3.623 3.960 -0.001 0.000 0.260 28 G HA3 -0.336 3.623 3.960 -0.001 0.000 0.260 28 G C 0.469 175.475 174.900 0.178 0.000 0.977 28 G CA 0.390 45.551 45.100 0.101 0.000 0.641 28 G HN 0.669 8.959 8.290 -0.000 0.000 0.533 29 T N -1.852 112.749 114.554 0.077 0.000 4.712 29 T HA -0.234 4.115 4.350 -0.001 0.000 0.304 29 T C 0.242 174.848 174.700 -0.157 0.000 1.250 29 T CA 1.708 63.789 62.100 -0.032 0.000 2.371 29 T CB -1.629 67.208 68.868 -0.051 0.000 1.829 29 T HN 1.093 9.333 8.240 -0.000 0.000 0.953 30 F N -0.246 119.676 119.950 -0.046 0.000 2.546 30 F HA 0.628 5.154 4.527 -0.001 0.000 0.320 30 F C 1.387 177.161 175.800 -0.044 0.000 1.076 30 F CA 0.599 58.573 58.000 -0.043 0.000 0.928 30 F CB 1.960 40.935 39.000 -0.041 0.000 1.189 30 F HN 0.094 8.394 8.300 -0.000 0.000 0.465 31 G N 0.995 109.872 108.800 0.128 0.000 2.527 31 G HA2 -0.256 3.704 3.960 -0.001 0.000 0.218 31 G HA3 -0.256 3.704 3.960 -0.001 0.000 0.218 31 G C 0.148 175.048 174.900 0.000 0.000 1.177 31 G CA -0.045 45.099 45.100 0.074 0.000 0.695 31 G HN 0.704 8.994 8.290 -0.000 0.000 0.517 32 E N -0.369 119.782 120.200 -0.081 0.000 2.442 32 E HA -0.117 4.233 4.350 -0.001 0.000 0.177 32 E C -0.277 176.214 176.600 -0.182 0.000 1.505 32 E CA 0.756 57.053 56.400 -0.172 0.000 0.662 32 E CB -1.319 28.335 29.700 -0.077 0.000 1.117 32 E HN 0.882 9.242 8.360 -0.000 0.000 0.375 33 V N 3.655 123.425 119.914 -0.240 0.000 2.398 33 V HA 0.535 4.654 4.120 -0.001 0.000 0.286 33 V C 0.071 176.016 176.094 -0.249 0.000 1.026 33 V CA -0.285 61.955 62.300 -0.101 0.000 0.868 33 V CB 0.904 32.727 31.823 0.001 0.000 0.982 33 V HN 0.247 8.437 8.190 -0.000 0.000 0.443 34 F N 2.847 122.859 119.950 0.104 0.000 2.492 34 F HA 0.539 5.065 4.527 -0.001 0.000 0.327 34 F C 0.354 176.180 175.800 0.043 0.000 1.079 34 F CA -0.764 57.270 58.000 0.057 0.000 0.967 34 F CB 1.641 40.654 39.000 0.021 0.000 1.169 34 F HN 0.333 8.633 8.300 -0.000 0.000 0.472 35 K N 1.889 122.393 120.400 0.174 0.000 2.185 35 K HA 0.795 5.114 4.320 -0.001 0.000 0.271 35 K C -1.003 175.560 176.600 -0.062 0.000 1.013 35 K CA -0.231 56.024 56.287 -0.053 0.000 0.943 35 K CB 0.939 33.280 32.500 -0.265 0.000 0.998 35 K HN 0.840 9.090 8.250 -0.000 0.000 0.468 36 A N 3.181 125.912 122.820 -0.149 0.000 2.602 36 A HA 0.544 4.864 4.320 -0.001 0.000 0.290 36 A C -1.618 175.938 177.584 -0.048 0.000 1.114 36 A CA -0.924 51.065 52.037 -0.080 0.000 0.683 36 A CB 1.489 20.457 19.000 -0.054 0.000 1.281 36 A HN 0.828 8.978 8.150 -0.000 0.000 0.416 37 R N 0.882 121.408 120.500 0.043 0.000 2.513 37 R HA 0.377 4.717 4.340 -0.001 0.000 0.301 37 R C -1.076 175.337 176.300 0.188 0.000 0.968 37 R CA -0.559 55.596 56.100 0.092 0.000 0.872 37 R CB 0.972 31.284 30.300 0.019 0.000 1.177 37 R HN 0.973 9.243 8.270 -0.000 0.000 0.444 38 H N 4.530 123.695 119.070 0.158 0.000 3.004 38 H HA 0.038 4.593 4.556 -0.001 0.000 0.316 38 H C 0.147 175.438 175.328 -0.062 0.000 1.014 38 H CA 0.891 56.938 56.048 -0.002 0.000 1.454 38 H CB 0.859 30.614 29.762 -0.012 0.000 1.472 38 H HN 0.656 8.936 8.280 -0.000 0.000 0.571 39 R N 3.666 123.997 120.500 -0.283 0.000 2.357 39 R HA -0.064 4.276 4.340 -0.001 0.000 0.202 39 R C 1.133 177.453 176.300 0.033 0.000 1.047 39 R CA 0.780 56.812 56.100 -0.114 0.000 1.034 39 R CB 0.437 30.622 30.300 -0.191 0.000 0.875 39 R HN 0.567 8.837 8.270 -0.000 0.000 0.473 40 K N -1.511 119.079 120.400 0.316 0.000 2.462 40 K HA 0.033 4.353 4.320 -0.001 0.000 0.201 40 K C 1.422 178.090 176.600 0.113 0.000 1.268 40 K CA 0.875 57.291 56.287 0.215 0.000 0.933 40 K CB 1.054 33.718 32.500 0.273 0.000 1.162 40 K HN 0.106 8.356 8.250 -0.000 0.000 0.527 41 T N -3.846 110.768 114.554 0.101 0.000 2.975 41 T HA 0.223 4.572 4.350 -0.001 0.000 0.261 41 T C 1.362 176.067 174.700 0.008 0.000 0.984 41 T CA 0.552 62.624 62.100 -0.047 0.000 0.911 41 T CB 1.029 69.755 68.868 -0.236 0.000 1.127 41 T HN 0.217 8.457 8.240 -0.000 0.000 0.514 42 G N 1.673 110.519 108.800 0.076 0.000 2.184 42 G HA2 -0.331 3.629 3.960 -0.001 0.000 0.264 42 G HA3 -0.331 3.629 3.960 -0.001 0.000 0.264 42 G C -0.004 174.938 174.900 0.070 0.000 0.975 42 G CA 0.371 45.509 45.100 0.064 0.000 0.642 42 G HN 0.950 9.240 8.290 -0.000 0.000 0.536 43 Q N 0.931 120.778 119.800 0.079 0.000 2.263 43 Q HA 0.233 4.572 4.340 -0.001 0.000 0.289 43 Q C 0.091 176.173 176.000 0.138 0.000 1.061 43 Q CA 0.240 56.100 55.803 0.095 0.000 0.927 43 Q CB 0.357 29.141 28.738 0.076 0.000 1.154 43 Q HN 0.292 8.562 8.270 -0.000 0.000 0.378 44 K N 3.130 123.588 120.400 0.097 0.000 2.118 44 K HA 0.465 4.785 4.320 -0.001 0.000 0.267 44 K C -0.101 176.567 176.600 0.114 0.000 0.991 44 K CA -0.439 55.863 56.287 0.026 0.000 0.916 44 K CB 1.516 33.954 32.500 -0.103 0.000 1.041 44 K HN 0.565 8.815 8.250 -0.000 0.000 0.455 45 V N -3.087 116.848 119.914 0.035 0.000 3.202 45 V HA 0.866 4.985 4.120 -0.001 0.000 0.306 45 V C -1.189 175.001 176.094 0.160 0.000 1.283 45 V CA -1.351 61.019 62.300 0.117 0.000 1.065 45 V CB 1.825 33.590 31.823 -0.097 0.000 1.079 45 V HN 0.781 8.971 8.190 -0.000 0.000 0.448 46 A N 1.800 124.789 122.820 0.281 0.000 2.318 46 A HA 0.893 5.212 4.320 -0.001 0.000 0.324 46 A C -0.792 176.947 177.584 0.259 0.000 1.170 46 A CA -0.694 51.535 52.037 0.320 0.000 0.810 46 A CB 0.956 20.184 19.000 0.379 0.000 1.198 46 A HN 0.995 9.145 8.150 -0.000 0.000 0.484 47 L N 2.412 123.775 121.223 0.232 0.000 2.298 47 L HA 0.462 4.801 4.340 -0.001 0.000 0.284 47 L C 0.196 177.306 176.870 0.400 0.000 1.013 47 L CA -0.402 54.590 54.840 0.253 0.000 0.824 47 L CB 1.556 43.698 42.059 0.139 0.000 1.221 47 L HN 0.771 9.001 8.230 -0.000 0.000 0.418 48 K N 4.903 125.554 120.400 0.418 0.000 2.347 48 K HA 0.247 4.567 4.320 -0.001 0.000 0.262 48 K C -0.306 176.486 176.600 0.319 0.000 1.052 48 K CA -0.658 55.845 56.287 0.360 0.000 0.946 48 K CB 0.983 33.720 32.500 0.395 0.000 1.220 48 K HN 0.414 8.664 8.250 -0.000 0.000 0.450 49 K N 3.192 123.767 120.400 0.291 0.000 2.326 49 K HA 0.077 4.397 4.320 -0.001 0.000 0.275 49 K C -0.643 175.936 176.600 -0.034 0.000 1.018 49 K CA -0.485 55.786 56.287 -0.028 0.000 0.962 49 K CB 0.863 33.318 32.500 -0.076 0.000 0.953 49 K HN 0.302 8.552 8.250 -0.000 0.000 0.475 50 V N 7.422 127.275 119.914 -0.101 0.000 2.439 50 V HA -0.032 4.087 4.120 -0.001 0.000 0.271 50 V C 1.667 177.701 176.094 -0.101 0.000 1.040 50 V CA -0.054 62.205 62.300 -0.069 0.000 1.002 50 V CB 0.509 32.288 31.823 -0.073 0.000 1.000 50 V HN 0.868 9.058 8.190 -0.000 0.000 0.477 51 L N 4.560 125.742 121.223 -0.068 0.000 1.952 51 L HA -0.257 4.082 4.340 -0.001 0.000 0.231 51 L C 1.774 178.600 176.870 -0.073 0.000 1.088 51 L CA 1.622 56.430 54.840 -0.054 0.000 0.802 51 L CB -0.324 41.725 42.059 -0.018 0.000 0.903 51 L HN 0.642 8.872 8.230 -0.000 0.000 0.439 52 M N -1.645 117.900 119.600 -0.092 0.000 2.976 52 M HA -0.186 4.293 4.480 -0.001 0.000 0.209 52 M C 1.481 177.752 176.300 -0.049 0.000 0.579 52 M CA 1.099 56.348 55.300 -0.084 0.000 0.783 52 M CB -1.680 30.875 32.600 -0.075 0.000 2.807 52 M HN 0.678 8.968 8.290 -0.000 0.000 0.362 53 E N 2.036 122.215 120.200 -0.036 0.000 2.037 53 E HA -0.257 4.093 4.350 -0.001 0.000 0.214 53 E C 1.043 177.633 176.600 -0.017 0.000 1.041 53 E CA 2.919 59.306 56.400 -0.022 0.000 0.872 53 E CB -0.656 29.039 29.700 -0.007 0.000 0.785 53 E HN 0.830 9.190 8.360 -0.000 0.000 0.476 54 N N 0.407 119.099 118.700 -0.014 0.000 2.418 54 N HA -0.047 4.693 4.740 -0.001 0.000 0.199 54 N C -0.476 175.024 175.510 -0.016 0.000 1.044 54 N CA 0.371 53.414 53.050 -0.010 0.000 0.943 54 N CB -0.217 38.267 38.487 -0.004 0.000 1.154 54 N HN 0.044 8.424 8.380 -0.000 0.000 0.467 55 E N 0.126 120.314 120.200 -0.021 0.000 2.811 55 E HA -0.181 4.168 4.350 -0.001 0.000 0.150 55 E C -0.845 175.747 176.600 -0.013 0.000 1.823 55 E CA 0.441 56.824 56.400 -0.029 0.000 0.661 55 E CB -1.155 28.510 29.700 -0.058 0.000 1.086 55 E HN 0.659 9.019 8.360 -0.000 0.000 0.354 56 K N 1.147 121.544 120.400 -0.005 0.000 2.397 56 K HA 0.073 4.392 4.320 -0.001 0.000 0.202 56 K C 0.670 177.276 176.600 0.009 0.000 1.022 56 K CA 0.015 56.304 56.287 0.003 0.000 1.141 56 K CB 0.693 33.195 32.500 0.004 0.000 0.857 56 K HN 0.020 8.270 8.250 -0.000 0.000 0.514 57 E N 0.739 120.944 120.200 0.009 0.000 2.869 57 E HA 0.171 4.520 4.350 -0.001 0.000 0.207 57 E C 0.423 177.042 176.600 0.032 0.000 0.986 57 E CA -0.083 56.328 56.400 0.018 0.000 1.131 57 E CB 0.719 30.427 29.700 0.015 0.000 1.098 57 E HN 0.392 8.752 8.360 -0.000 0.000 0.459 58 G N 1.444 110.266 108.800 0.038 0.000 2.542 58 G HA2 -0.317 3.642 3.960 -0.001 0.000 0.235 58 G HA3 -0.317 3.642 3.960 -0.001 0.000 0.235 58 G C -0.318 174.638 174.900 0.093 0.000 1.286 58 G CA -0.420 44.724 45.100 0.074 0.000 0.904 58 G HN 0.266 8.556 8.290 -0.000 0.000 0.577 59 F N 3.398 123.352 119.950 0.008 0.000 2.578 59 F HA 0.492 5.018 4.527 -0.001 0.000 0.376 59 F C -1.251 174.555 175.800 0.011 0.000 1.085 59 F CA -0.966 57.038 58.000 0.008 0.000 1.260 59 F CB 0.568 39.573 39.000 0.009 0.000 1.095 59 F HN 0.296 8.596 8.300 -0.000 0.000 0.573 60 P HA 0.049 4.469 4.420 -0.000 0.000 0.267 60 P C 1.138 178.355 177.300 -0.139 0.000 1.209 60 P CA 0.304 63.227 63.100 -0.296 0.000 0.763 60 P CB 0.618 32.093 31.700 -0.374 0.000 0.816 61 I N 3.135 123.692 120.570 -0.022 0.000 2.208 61 I HA -0.265 3.904 4.170 -0.001 0.000 0.245 61 I C 1.842 177.978 176.117 0.032 0.000 1.097 61 I CA 2.173 63.496 61.300 0.039 0.000 1.363 61 I CB -0.112 37.911 38.000 0.037 0.000 1.051 61 I HN 0.395 8.605 8.210 -0.000 0.000 0.413 62 T N -1.294 113.258 114.554 -0.003 0.000 2.962 62 T HA -0.014 4.335 4.350 -0.001 0.000 0.270 62 T C 1.805 176.516 174.700 0.018 0.000 1.088 62 T CA 0.854 62.959 62.100 0.008 0.000 1.127 62 T CB -0.410 68.455 68.868 -0.005 0.000 0.883 62 T HN 0.391 8.631 8.240 -0.000 0.000 0.493 63 A N 1.510 124.318 122.820 -0.021 0.000 1.929 63 A HA 0.292 4.612 4.320 -0.001 0.000 0.216 63 A C 2.400 180.089 177.584 0.176 0.000 1.176 63 A CA 0.844 52.896 52.037 0.024 0.000 0.628 63 A CB -0.750 18.144 19.000 -0.177 0.000 0.816 63 A HN 0.524 8.674 8.150 -0.000 0.000 0.444 64 L N -0.931 120.430 121.223 0.231 0.000 2.079 64 L HA -0.199 4.140 4.340 -0.001 0.000 0.210 64 L C 2.793 179.739 176.870 0.126 0.000 1.081 64 L CA 1.756 56.735 54.840 0.231 0.000 0.752 64 L CB -0.472 41.713 42.059 0.210 0.000 0.896 64 L HN 0.467 8.697 8.230 -0.000 0.000 0.433 65 R N 0.326 120.884 120.500 0.097 0.000 2.070 65 R HA -0.227 4.112 4.340 -0.001 0.000 0.233 65 R C 2.292 178.639 176.300 0.078 0.000 1.137 65 R CA 1.951 58.093 56.100 0.070 0.000 0.945 65 R CB -0.192 30.142 30.300 0.056 0.000 0.845 65 R HN 0.347 8.617 8.270 -0.000 0.000 0.430 66 E N 0.382 120.639 120.200 0.095 0.000 2.038 66 E HA -0.212 4.137 4.350 -0.001 0.000 0.195 66 E C 2.048 178.709 176.600 0.102 0.000 1.000 66 E CA 1.630 58.100 56.400 0.117 0.000 0.803 66 E CB -0.129 29.653 29.700 0.136 0.000 0.750 66 E HN 0.427 8.787 8.360 -0.000 0.000 0.448 67 I N 1.019 121.652 120.570 0.106 0.000 2.335 67 I HA -0.281 3.889 4.170 -0.001 0.000 0.251 67 I C 2.716 178.854 176.117 0.035 0.000 1.129 67 I CA 1.105 62.448 61.300 0.072 0.000 1.402 67 I CB -0.280 37.776 38.000 0.092 0.000 1.069 67 I HN 0.136 8.346 8.210 -0.000 0.000 0.424 68 K N 1.611 122.035 120.400 0.041 0.000 2.025 68 K HA -0.160 4.160 4.320 -0.001 0.000 0.207 68 K C 2.150 178.749 176.600 -0.001 0.000 1.049 68 K CA 1.486 57.783 56.287 0.017 0.000 0.933 68 K CB -0.052 32.462 32.500 0.023 0.000 0.714 68 K HN 0.223 8.473 8.250 -0.000 0.000 0.438 69 I N 1.377 121.950 120.570 0.005 0.000 2.226 69 I HA -0.295 3.875 4.170 -0.001 0.000 0.245 69 I C 2.198 178.248 176.117 -0.112 0.000 1.100 69 I CA 1.041 62.322 61.300 -0.030 0.000 1.374 69 I CB -0.207 37.807 38.000 0.023 0.000 1.057 69 I HN 0.163 8.373 8.210 -0.000 0.000 0.413 70 L N -0.004 121.157 121.223 -0.103 0.000 2.079 70 L HA -0.254 4.086 4.340 -0.001 0.000 0.210 70 L C 2.538 179.368 176.870 -0.068 0.000 1.081 70 L CA 1.454 56.221 54.840 -0.122 0.000 0.752 70 L CB -0.623 41.424 42.059 -0.019 0.000 0.896 70 L HN 0.317 8.547 8.230 -0.000 0.000 0.433 71 Q N -0.557 119.218 119.800 -0.041 0.000 2.297 71 Q HA -0.171 4.169 4.340 -0.001 0.000 0.204 71 Q C 2.142 178.134 176.000 -0.013 0.000 0.962 71 Q CA 1.034 56.821 55.803 -0.027 0.000 0.879 71 Q CB 0.010 28.734 28.738 -0.024 0.000 0.947 71 Q HN 0.422 8.692 8.270 -0.000 0.000 0.462 72 L N -0.418 120.794 121.223 -0.018 0.000 2.249 72 L HA 0.118 4.458 4.340 -0.001 0.000 0.207 72 L C 0.341 177.238 176.870 0.044 0.000 1.090 72 L CA 0.790 55.628 54.840 -0.003 0.000 0.802 72 L CB 0.359 42.401 42.059 -0.028 0.000 0.947 72 L HN -0.002 8.228 8.230 -0.000 0.000 0.453 73 L N 3.139 124.381 121.223 0.032 0.000 2.312 73 L HA 0.292 4.632 4.340 -0.001 0.000 0.287 73 L C -0.498 176.487 176.870 0.191 0.000 1.091 73 L CA -0.181 54.768 54.840 0.182 0.000 0.846 73 L CB 0.003 42.073 42.059 0.018 0.000 1.219 73 L HN 0.064 8.294 8.230 -0.000 0.000 0.439 74 K N 4.165 124.724 120.400 0.265 0.000 2.559 74 K HA 0.493 4.812 4.320 -0.001 0.000 0.249 74 K C -1.048 175.505 176.600 -0.079 0.000 0.958 74 K CA -0.513 55.822 56.287 0.080 0.000 0.901 74 K CB 1.827 34.364 32.500 0.062 0.000 1.124 74 K HN 0.474 8.724 8.250 -0.000 0.000 0.437 75 H N 0.671 119.574 119.070 -0.278 0.000 3.094 75 H HA 0.053 4.609 4.556 -0.001 0.000 0.335 75 H C -0.104 175.086 175.328 -0.230 0.000 1.254 75 H CA -0.234 55.531 56.048 -0.472 0.000 1.240 75 H CB 1.698 30.741 29.762 -1.199 0.000 1.936 75 H HN 0.653 8.933 8.280 -0.000 0.000 0.536 76 E N 2.029 121.921 120.200 -0.513 0.000 2.265 76 E HA -0.122 4.228 4.350 -0.001 0.000 0.196 76 E C 0.046 176.680 176.600 0.057 0.000 0.996 76 E CA 1.184 57.469 56.400 -0.192 0.000 0.832 76 E CB 0.191 29.732 29.700 -0.265 0.000 0.756 76 E HN 0.528 8.888 8.360 -0.000 0.000 0.491 77 N N -0.667 118.245 118.700 0.354 0.000 2.238 77 N HA 0.096 4.836 4.740 -0.001 0.000 0.222 77 N C -1.283 174.332 175.510 0.175 0.000 1.133 77 N CA -0.407 52.773 53.050 0.217 0.000 0.854 77 N CB 1.595 40.199 38.487 0.195 0.000 1.041 77 N HN -0.151 8.229 8.380 -0.000 0.000 0.510 78 V N 0.787 120.814 119.914 0.189 0.000 2.680 78 V HA 0.260 4.380 4.120 -0.001 0.000 0.309 78 V C 0.388 176.574 176.094 0.153 0.000 1.052 78 V CA -1.022 61.394 62.300 0.192 0.000 0.908 78 V CB 2.347 34.281 31.823 0.185 0.000 1.001 78 V HN -0.148 8.042 8.190 -0.000 0.000 0.431 79 V N 3.462 123.489 119.914 0.188 0.000 3.332 79 V HA 0.086 4.206 4.120 -0.001 0.000 0.305 79 V C 0.262 176.479 176.094 0.206 0.000 1.114 79 V CA 0.414 62.815 62.300 0.169 0.000 1.194 79 V CB 1.229 33.129 31.823 0.129 0.000 1.027 79 V HN 1.085 9.275 8.190 -0.000 0.000 0.492 80 N N 3.372 122.234 118.700 0.270 0.000 2.531 80 N HA 0.360 5.100 4.740 -0.001 0.000 0.268 80 N C -1.132 174.493 175.510 0.193 0.000 1.023 80 N CA -0.586 52.579 53.050 0.192 0.000 0.896 80 N CB 1.248 39.803 38.487 0.114 0.000 1.233 80 N HN 0.646 9.026 8.380 -0.000 0.000 0.512 81 L N 4.941 126.191 121.223 0.045 0.000 2.418 81 L HA 0.362 4.701 4.340 -0.001 0.000 0.274 81 L C 0.571 177.370 176.870 -0.118 0.000 1.135 81 L CA 0.503 55.202 54.840 -0.235 0.000 0.870 81 L CB 0.255 42.165 42.059 -0.248 0.000 1.154 81 L HN 0.727 8.957 8.230 -0.000 0.000 0.462 82 I N 3.286 123.783 120.570 -0.123 0.000 2.628 82 I HA 0.087 4.257 4.170 -0.001 0.000 0.255 82 I C 0.498 176.601 176.117 -0.023 0.000 1.119 82 I CA 0.475 61.758 61.300 -0.029 0.000 1.448 82 I CB 0.099 38.113 38.000 0.024 0.000 1.133 82 I HN 0.796 9.006 8.210 -0.000 0.000 0.438 83 E N 0.031 120.199 120.200 -0.053 0.000 2.432 83 E HA 0.481 4.830 4.350 -0.001 0.000 0.279 83 E C -1.344 175.238 176.600 -0.030 0.000 1.099 83 E CA -0.782 55.612 56.400 -0.009 0.000 0.859 83 E CB 1.646 31.387 29.700 0.069 0.000 1.402 83 E HN -0.075 8.285 8.360 -0.000 0.000 0.451 84 I N 0.606 121.185 120.570 0.016 0.000 2.509 84 I HA 0.498 4.668 4.170 -0.001 0.000 0.293 84 I C -0.931 175.241 176.117 0.092 0.000 1.020 84 I CA -0.557 60.767 61.300 0.040 0.000 1.088 84 I CB 1.828 39.842 38.000 0.024 0.000 1.267 84 I HN 0.635 8.845 8.210 -0.000 0.000 0.430 85 C N 4.564 123.951 119.300 0.146 0.000 2.779 85 C HA 0.715 5.174 4.460 -0.001 0.000 0.314 85 C C 0.120 175.235 174.990 0.209 0.000 1.231 85 C CA -0.734 58.389 59.018 0.175 0.000 1.652 85 C CB 2.022 29.887 27.740 0.208 0.000 2.198 85 C HN 0.863 9.093 8.230 -0.000 0.000 0.483 86 R N 0.367 120.966 120.500 0.166 0.000 2.981 86 R HA 0.815 5.155 4.340 -0.001 0.000 0.228 86 R C -0.139 176.267 176.300 0.177 0.000 1.421 86 R CA -0.460 55.734 56.100 0.158 0.000 1.073 86 R CB 0.287 30.639 30.300 0.086 0.000 1.568 86 R HN 0.544 8.814 8.270 -0.000 0.000 0.514 87 T N -1.424 113.213 114.554 0.138 0.000 3.125 87 T HA 0.147 4.496 4.350 -0.001 0.000 0.252 87 T C -0.444 174.295 174.700 0.066 0.000 0.981 87 T CA 0.492 62.667 62.100 0.126 0.000 1.069 87 T CB 0.036 68.993 68.868 0.148 0.000 1.091 87 T HN 0.754 8.994 8.240 -0.000 0.000 0.460 97 G N 1.629 110.448 108.800 0.032 0.000 2.788 97 G HA2 -0.070 3.890 3.960 -0.001 0.000 0.686 97 G HA3 -0.070 3.890 3.960 -0.001 0.000 0.686 97 G C -0.749 174.170 174.900 0.032 0.000 1.147 97 G CA -0.244 44.881 45.100 0.040 0.000 0.755 97 G HN 0.092 8.382 8.290 -0.000 0.000 0.634 98 S N 0.636 116.355 115.700 0.032 0.000 2.595 98 S HA 0.832 5.302 4.470 -0.001 0.000 0.281 98 S C -0.482 174.091 174.600 -0.044 0.000 1.117 98 S CA -0.882 57.287 58.200 -0.052 0.000 0.873 98 S CB 1.730 64.847 63.200 -0.138 0.000 1.108 98 S HN 0.759 9.069 8.310 -0.000 0.000 0.477 99 I N 2.292 122.787 120.570 -0.125 0.000 2.436 99 I HA 0.426 4.596 4.170 -0.001 0.000 0.289 99 I C -1.445 174.584 176.117 -0.147 0.000 1.010 99 I CA -0.816 60.481 61.300 -0.004 0.000 1.098 99 I CB 1.212 39.335 38.000 0.205 0.000 1.266 99 I HN 0.642 8.852 8.210 -0.000 0.000 0.434 100 Y N 5.695 126.061 120.300 0.110 0.000 2.364 100 Y HA 0.483 5.032 4.550 -0.001 0.000 0.340 100 Y C -0.162 175.773 175.900 0.058 0.000 0.975 100 Y CA -0.980 57.179 58.100 0.098 0.000 1.089 100 Y CB 1.772 40.281 38.460 0.082 0.000 1.192 100 Y HN 0.267 8.547 8.280 -0.000 0.000 0.454 101 L N 4.308 125.645 121.223 0.189 0.000 2.281 101 L HA 0.372 4.712 4.340 -0.001 0.000 0.285 101 L C -0.495 176.319 176.870 -0.093 0.000 1.074 101 L CA -0.283 54.559 54.840 0.003 0.000 0.817 101 L CB 0.785 42.856 42.059 0.021 0.000 1.168 101 L HN 0.367 8.597 8.230 -0.000 0.000 0.434 102 V N 4.838 124.605 119.914 -0.245 0.000 2.350 102 V HA 0.428 4.548 4.120 -0.001 0.000 0.276 102 V C -0.097 175.789 176.094 -0.346 0.000 1.028 102 V CA -0.540 61.624 62.300 -0.228 0.000 0.860 102 V CB 0.561 32.258 31.823 -0.210 0.000 0.990 102 V HN 0.367 8.557 8.190 -0.000 0.000 0.453 103 F N 1.254 121.216 119.950 0.020 0.000 2.483 103 F HA 0.463 4.989 4.527 -0.001 0.000 0.329 103 F C 0.734 176.574 175.800 0.067 0.000 1.064 103 F CA -0.952 57.080 58.000 0.052 0.000 0.986 103 F CB 0.934 39.979 39.000 0.075 0.000 1.218 103 F HN 0.370 8.670 8.300 -0.000 0.000 0.484 104 D N 1.811 122.371 120.400 0.266 0.000 2.450 104 D HA -0.008 4.632 4.640 -0.001 0.000 0.247 104 D C -0.266 176.175 176.300 0.236 0.000 1.162 104 D CA 0.277 54.401 54.000 0.206 0.000 0.879 104 D CB 0.312 41.198 40.800 0.144 0.000 1.163 104 D HN 0.203 8.573 8.370 -0.000 0.000 0.472 105 F N 2.516 122.515 119.950 0.081 0.000 2.496 105 F HA 0.131 4.657 4.527 -0.001 0.000 0.344 105 F C 0.008 175.823 175.800 0.025 0.000 1.155 105 F CA -0.510 57.521 58.000 0.052 0.000 1.302 105 F CB 0.526 39.549 39.000 0.038 0.000 1.159 105 F HN 0.243 8.543 8.300 -0.000 0.000 0.595 106 C N 5.743 124.482 119.300 -0.936 0.000 2.516 106 C HA 0.219 4.678 4.460 -0.001 0.000 0.338 106 C C 1.055 175.454 174.990 -0.985 0.000 1.132 106 C CA -0.813 57.819 59.018 -0.644 0.000 1.310 106 C CB 0.999 28.526 27.740 -0.355 0.000 1.898 106 C HN 0.953 9.183 8.230 -0.000 0.000 0.452 107 E N 1.518 121.337 120.200 -0.635 0.000 2.106 107 E HA -0.094 4.255 4.350 -0.001 0.000 0.192 107 E C 0.129 176.385 176.600 -0.573 0.000 0.984 107 E CA 1.711 57.748 56.400 -0.606 0.000 0.806 107 E CB 0.051 29.377 29.700 -0.625 0.000 0.750 107 E HN 0.878 9.238 8.360 -0.000 0.000 0.458 108 H N -0.349 118.640 119.070 -0.136 0.000 2.679 108 H HA 0.384 4.939 4.556 -0.001 0.000 0.367 108 H C -0.681 174.598 175.328 -0.081 0.000 1.162 108 H CA -0.645 55.361 56.048 -0.070 0.000 1.181 108 H CB 1.378 31.127 29.762 -0.022 0.000 1.693 108 H HN 0.112 8.392 8.280 -0.000 0.000 0.538 109 D N 1.429 121.881 120.400 0.087 0.000 2.423 109 D HA 0.058 4.697 4.640 -0.001 0.000 0.235 109 D C 0.379 176.708 176.300 0.048 0.000 1.011 109 D CA -0.737 53.282 54.000 0.031 0.000 0.963 109 D CB 2.246 43.038 40.800 -0.012 0.000 1.349 109 D HN 0.377 8.747 8.370 -0.000 0.000 0.508 110 L N 0.984 122.217 121.223 0.016 0.000 2.395 110 L HA 0.107 4.447 4.340 -0.001 0.000 0.218 110 L C 2.189 179.080 176.870 0.034 0.000 1.130 110 L CA 1.429 56.280 54.840 0.019 0.000 0.826 110 L CB -0.653 41.384 42.059 -0.035 0.000 0.941 110 L HN 0.672 8.902 8.230 -0.000 0.000 0.451 111 A N -0.876 121.962 122.820 0.030 0.000 1.898 111 A HA 0.060 4.379 4.320 -0.001 0.000 0.214 111 A C 2.321 179.940 177.584 0.058 0.000 1.183 111 A CA 1.086 53.154 52.037 0.050 0.000 0.622 111 A CB -1.318 17.710 19.000 0.046 0.000 0.824 111 A HN 0.425 8.575 8.150 -0.000 0.000 0.444 112 G N 0.004 108.836 108.800 0.054 0.000 2.440 112 G HA2 -0.186 3.774 3.960 -0.001 0.000 0.218 112 G HA3 -0.186 3.774 3.960 -0.001 0.000 0.218 112 G C 1.518 176.447 174.900 0.049 0.000 1.154 112 G CA 1.135 46.270 45.100 0.057 0.000 0.767 112 G HN 0.416 8.706 8.290 -0.000 0.000 0.552 113 L N -0.251 121.006 121.223 0.056 0.000 2.179 113 L HA 0.154 4.493 4.340 -0.001 0.000 0.208 113 L C 2.770 179.689 176.870 0.081 0.000 1.096 113 L CA 0.283 55.149 54.840 0.044 0.000 0.779 113 L CB -0.306 41.804 42.059 0.085 0.000 0.922 113 L HN 0.176 8.406 8.230 -0.000 0.000 0.443 114 L N -0.381 120.906 121.223 0.107 0.000 2.291 114 L HA -0.112 4.227 4.340 -0.001 0.000 0.214 114 L C 2.714 179.621 176.870 0.062 0.000 1.120 114 L CA 1.155 56.057 54.840 0.103 0.000 0.799 114 L CB -0.262 41.841 42.059 0.073 0.000 0.925 114 L HN 0.380 8.610 8.230 -0.000 0.000 0.446 115 S N -1.460 114.271 115.700 0.051 0.000 2.427 115 S HA -0.045 4.424 4.470 -0.001 0.000 0.224 115 S C 1.115 175.731 174.600 0.027 0.000 1.047 115 S CA -0.200 58.025 58.200 0.042 0.000 0.953 115 S CB -0.428 62.802 63.200 0.049 0.000 0.824 115 S HN 0.324 8.634 8.310 -0.000 0.000 0.502 116 N N 2.261 120.972 118.700 0.017 0.000 2.429 116 N HA 0.066 4.805 4.740 -0.001 0.000 0.271 116 N C 0.663 176.161 175.510 -0.020 0.000 1.272 116 N CA 0.104 53.153 53.050 -0.002 0.000 0.921 116 N CB 0.820 39.300 38.487 -0.012 0.000 1.128 116 N HN 0.151 8.531 8.380 -0.000 0.000 0.481 117 V N 4.525 124.432 119.914 -0.012 0.000 3.217 117 V HA -0.102 4.018 4.120 -0.001 0.000 0.264 117 V C 1.990 178.061 176.094 -0.038 0.000 1.135 117 V CA 0.791 63.081 62.300 -0.017 0.000 1.142 117 V CB -0.562 31.261 31.823 -0.001 0.000 0.754 117 V HN 0.656 8.846 8.190 -0.000 0.000 0.484 118 L N 0.029 121.224 121.223 -0.045 0.000 2.622 118 L HA 0.058 4.397 4.340 -0.001 0.000 0.233 118 L C 0.248 177.054 176.870 -0.107 0.000 1.156 118 L CA 0.417 55.220 54.840 -0.060 0.000 0.866 118 L CB -0.007 42.024 42.059 -0.047 0.000 0.980 118 L HN 0.216 8.446 8.230 -0.000 0.000 0.448 119 V N -0.252 119.578 119.914 -0.141 0.000 2.540 119 V HA 0.387 4.507 4.120 -0.001 0.000 0.302 119 V C -0.231 175.673 176.094 -0.317 0.000 1.035 119 V CA -0.810 61.333 62.300 -0.261 0.000 0.873 119 V CB 2.109 33.757 31.823 -0.292 0.000 0.992 119 V HN 0.068 8.258 8.190 -0.000 0.000 0.428 120 K N 3.258 123.403 120.400 -0.425 0.000 2.498 120 K HA 0.651 4.971 4.320 -0.001 0.000 0.254 120 K C -1.879 174.439 176.600 -0.470 0.000 0.933 120 K CA -0.561 55.523 56.287 -0.338 0.000 0.806 120 K CB 2.517 34.929 32.500 -0.146 0.000 1.301 120 K HN 0.471 8.721 8.250 -0.000 0.000 0.432 121 F N 1.273 121.169 119.950 -0.089 0.000 2.444 121 F HA 0.191 4.718 4.527 -0.001 0.000 0.342 121 F C 1.034 176.790 175.800 -0.073 0.000 1.121 121 F CA -0.677 57.258 58.000 -0.108 0.000 0.997 121 F CB 1.707 40.595 39.000 -0.187 0.000 1.130 121 F HN 0.429 8.729 8.300 -0.000 0.000 0.454 122 T N 1.129 115.757 114.554 0.124 0.000 2.900 122 T HA 0.070 4.420 4.350 -0.001 0.000 0.307 122 T C 1.269 176.035 174.700 0.111 0.000 1.065 122 T CA -0.647 61.511 62.100 0.098 0.000 1.105 122 T CB 0.769 69.675 68.868 0.063 0.000 0.979 122 T HN 0.638 8.878 8.240 -0.000 0.000 0.544 123 L N 2.792 124.099 121.223 0.141 0.000 2.051 123 L HA -0.133 4.207 4.340 -0.001 0.000 0.214 123 L C 2.816 179.744 176.870 0.097 0.000 1.076 123 L CA 2.797 57.753 54.840 0.192 0.000 0.758 123 L CB -1.241 40.958 42.059 0.232 0.000 0.890 123 L HN 1.015 9.245 8.230 -0.000 0.000 0.433 124 S N -1.729 113.997 115.700 0.043 0.000 2.402 124 S HA -0.178 4.292 4.470 -0.001 0.000 0.229 124 S C 1.772 176.353 174.600 -0.031 0.000 1.021 124 S CA 1.092 59.278 58.200 -0.024 0.000 0.974 124 S CB -0.600 62.589 63.200 -0.019 0.000 0.800 124 S HN 0.664 8.974 8.310 -0.000 0.000 0.484 125 E N 1.250 121.459 120.200 0.015 0.000 2.028 125 E HA -0.031 4.318 4.350 -0.001 0.000 0.191 125 E C 2.066 178.628 176.600 -0.064 0.000 0.988 125 E CA 1.398 57.817 56.400 0.032 0.000 0.799 125 E CB -0.434 29.366 29.700 0.166 0.000 0.755 125 E HN 0.522 8.882 8.360 -0.000 0.000 0.447 126 I N 1.549 122.036 120.570 -0.138 0.000 2.091 126 I HA -0.413 3.756 4.170 -0.001 0.000 0.240 126 I C 2.418 178.461 176.117 -0.124 0.000 1.046 126 I CA 1.550 62.664 61.300 -0.310 0.000 1.306 126 I CB -0.374 37.360 38.000 -0.443 0.000 1.018 126 I HN 0.096 8.306 8.210 -0.000 0.000 0.404 127 K N -0.047 120.316 120.400 -0.062 0.000 2.107 127 K HA -0.304 4.015 4.320 -0.001 0.000 0.211 127 K C 2.253 178.845 176.600 -0.015 0.000 1.049 127 K CA 1.960 58.132 56.287 -0.191 0.000 0.927 127 K CB -0.290 31.933 32.500 -0.463 0.000 0.714 127 K HN 0.141 8.391 8.250 -0.000 0.000 0.452 128 R N 1.092 121.565 120.500 -0.046 0.000 2.066 128 R HA -0.084 4.256 4.340 -0.001 0.000 0.232 128 R C 2.073 178.366 176.300 -0.012 0.000 1.131 128 R CA 1.161 57.247 56.100 -0.024 0.000 0.955 128 R CB -0.702 29.576 30.300 -0.037 0.000 0.851 128 R HN -0.029 8.241 8.270 -0.000 0.000 0.432 129 V N 0.660 120.536 119.914 -0.062 0.000 2.252 129 V HA -0.359 3.761 4.120 -0.001 0.000 0.249 129 V C 2.316 178.398 176.094 -0.020 0.000 1.056 129 V CA 2.149 64.393 62.300 -0.093 0.000 1.022 129 V CB -0.443 31.229 31.823 -0.252 0.000 0.641 129 V HN 0.349 8.539 8.190 -0.000 0.000 0.445 130 M N -0.943 118.696 119.600 0.065 0.000 2.108 130 M HA -0.223 4.256 4.480 -0.001 0.000 0.261 130 M C 2.166 178.597 176.300 0.219 0.000 1.066 130 M CA 1.588 57.013 55.300 0.207 0.000 1.107 130 M CB -1.466 31.382 32.600 0.413 0.000 1.356 130 M HN 0.436 8.726 8.290 -0.000 0.000 0.406 131 Q N -0.353 119.587 119.800 0.234 0.000 2.061 131 Q HA -0.187 4.152 4.340 -0.001 0.000 0.204 131 Q C 2.093 178.020 176.000 -0.121 0.000 0.984 131 Q CA 1.697 57.400 55.803 -0.167 0.000 0.846 131 Q CB 0.007 28.628 28.738 -0.195 0.000 0.902 131 Q HN 0.498 8.768 8.270 -0.000 0.000 0.421 132 M N -0.113 119.460 119.600 -0.044 0.000 2.077 132 M HA -0.171 4.308 4.480 -0.001 0.000 0.261 132 M C 2.338 178.631 176.300 -0.012 0.000 1.070 132 M CA 1.086 56.372 55.300 -0.022 0.000 1.125 132 M CB -0.384 32.209 32.600 -0.011 0.000 1.339 132 M HN 0.313 8.603 8.290 -0.000 0.000 0.409 133 L N 0.836 122.049 121.223 -0.016 0.000 1.990 133 L HA -0.263 4.077 4.340 -0.001 0.000 0.213 133 L C 2.303 179.161 176.870 -0.019 0.000 1.072 133 L CA 1.645 56.471 54.840 -0.024 0.000 0.755 133 L CB -0.274 41.769 42.059 -0.028 0.000 0.889 133 L HN 0.266 8.496 8.230 -0.000 0.000 0.432 134 L N -0.340 120.879 121.223 -0.007 0.000 2.083 134 L HA -0.232 4.108 4.340 -0.001 0.000 0.209 134 L C 2.329 179.199 176.870 -0.000 0.000 1.083 134 L CA 1.299 56.139 54.840 -0.000 0.000 0.752 134 L CB -0.693 41.365 42.059 -0.002 0.000 0.899 134 L HN 0.410 8.640 8.230 -0.000 0.000 0.433 135 N N 0.483 119.166 118.700 -0.028 0.000 2.120 135 N HA -0.143 4.596 4.740 -0.001 0.000 0.188 135 N C 1.842 177.376 175.510 0.040 0.000 1.024 135 N CA 1.583 54.643 53.050 0.018 0.000 0.852 135 N CB -0.321 38.178 38.487 0.020 0.000 1.003 135 N HN 0.233 8.613 8.380 -0.000 0.000 0.424 136 G N 0.470 109.259 108.800 -0.019 0.000 2.422 136 G HA2 -0.153 3.806 3.960 -0.001 0.000 0.218 136 G HA3 -0.153 3.806 3.960 -0.001 0.000 0.218 136 G C 1.599 176.463 174.900 -0.060 0.000 1.146 136 G CA 0.563 45.608 45.100 -0.091 0.000 0.769 136 G HN 0.329 8.619 8.290 -0.000 0.000 0.547 137 L N -0.982 120.189 121.223 -0.087 0.000 2.083 137 L HA -0.074 4.265 4.340 -0.001 0.000 0.209 137 L C 2.551 179.262 176.870 -0.265 0.000 1.083 137 L CA 1.154 55.829 54.840 -0.275 0.000 0.752 137 L CB -0.485 41.448 42.059 -0.210 0.000 0.899 137 L HN 0.304 8.534 8.230 -0.000 0.000 0.433 138 Y N -0.260 119.974 120.300 -0.111 0.000 2.165 138 Y HA -0.379 4.170 4.550 -0.001 0.000 0.286 138 Y C 2.649 178.555 175.900 0.011 0.000 1.155 138 Y CA 1.895 59.995 58.100 -0.000 0.000 1.164 138 Y CB -0.439 38.045 38.460 0.041 0.000 0.978 138 Y HN 0.166 8.446 8.280 -0.000 0.000 0.513 139 Y N 1.025 121.285 120.300 -0.066 0.000 2.163 139 Y HA -0.221 4.329 4.550 -0.000 0.000 0.288 139 Y C 2.340 178.162 175.900 -0.130 0.000 1.136 139 Y CA 2.127 60.140 58.100 -0.145 0.000 1.147 139 Y CB -0.672 37.541 38.460 -0.411 0.000 0.987 139 Y HN 0.282 8.562 8.280 -0.000 0.000 0.509 140 I N -1.971 118.481 120.570 -0.197 0.000 2.202 140 I HA -0.243 3.927 4.170 -0.001 0.000 0.242 140 I C 2.001 178.099 176.117 -0.031 0.000 1.091 140 I CA 1.960 63.167 61.300 -0.154 0.000 1.368 140 I CB -1.106 36.960 38.000 0.110 0.000 1.058 140 I HN 0.205 8.415 8.210 -0.000 0.000 0.410 141 H N 0.712 119.786 119.070 0.006 0.000 2.387 141 H HA -0.131 4.424 4.556 -0.001 0.000 0.299 141 H C 2.414 177.732 175.328 -0.016 0.000 1.099 141 H CA 1.355 57.466 56.048 0.105 0.000 1.315 141 H CB -0.093 29.717 29.762 0.080 0.000 1.380 141 H HN 0.333 8.613 8.280 -0.000 0.000 0.513 142 R N 0.937 121.361 120.500 -0.126 0.000 2.120 142 R HA -0.079 4.261 4.340 -0.001 0.000 0.234 142 R C 1.076 177.248 176.300 -0.215 0.000 1.123 142 R CA 1.134 57.087 56.100 -0.243 0.000 0.975 142 R CB 0.106 30.153 30.300 -0.422 0.000 0.866 142 R HN 0.375 8.645 8.270 -0.000 0.000 0.446 143 N N 0.800 119.339 118.700 -0.268 0.000 2.313 143 N HA -0.016 4.723 4.740 -0.001 0.000 0.207 143 N C -0.501 174.887 175.510 -0.204 0.000 1.141 143 N CA 0.198 53.091 53.050 -0.261 0.000 0.830 143 N CB 0.703 38.964 38.487 -0.376 0.000 1.008 143 N HN 0.036 8.416 8.380 -0.000 0.000 0.481 144 K N 0.220 120.489 120.400 -0.218 0.000 3.192 144 K HA -0.130 4.189 4.320 -0.001 0.000 0.278 144 K C -0.615 175.851 176.600 -0.224 0.000 1.164 144 K CA 0.607 56.548 56.287 -0.576 0.000 0.816 144 K CB -1.692 30.464 32.500 -0.574 0.000 1.256 144 K HN 0.259 8.509 8.250 -0.000 0.000 0.497 145 I N 1.111 121.808 120.570 0.210 0.000 2.530 145 I HA 0.396 4.566 4.170 -0.001 0.000 0.297 145 I C 0.680 177.100 176.117 0.505 0.000 1.011 145 I CA -0.904 60.586 61.300 0.317 0.000 1.107 145 I CB 1.645 39.772 38.000 0.211 0.000 1.285 145 I HN -0.035 8.175 8.210 -0.000 0.000 0.436 146 L N 4.701 126.142 121.223 0.364 0.000 2.317 146 L HA 0.374 4.713 4.340 -0.001 0.000 0.281 146 L C 1.433 178.421 176.870 0.196 0.000 1.024 146 L CA -0.641 54.348 54.840 0.248 0.000 0.810 146 L CB 1.747 43.860 42.059 0.090 0.000 1.240 146 L HN 0.614 8.844 8.230 -0.000 0.000 0.427 147 H N 4.399 123.523 119.070 0.089 0.000 2.333 147 H HA 0.030 4.586 4.556 -0.001 0.000 0.302 147 H C 0.520 175.783 175.328 -0.109 0.000 1.075 147 H CA 1.237 57.220 56.048 -0.108 0.000 1.348 147 H CB 0.546 30.175 29.762 -0.220 0.000 1.393 147 H HN 0.584 8.864 8.280 -0.000 0.000 0.509 148 R N 0.296 120.853 120.500 0.095 0.000 3.776 148 R HA -0.178 4.161 4.340 -0.001 0.000 0.312 148 R C -0.731 175.574 176.300 0.009 0.000 1.181 148 R CA 0.983 57.093 56.100 0.017 0.000 0.836 148 R CB -1.769 28.515 30.300 -0.026 0.000 1.324 148 R HN 0.399 8.669 8.270 -0.000 0.000 0.501 149 D N -0.392 120.113 120.400 0.174 0.000 3.719 149 D HA 0.082 4.721 4.640 -0.001 0.000 0.292 149 D C -0.300 176.057 176.300 0.096 0.000 1.511 149 D CA -0.241 53.808 54.000 0.082 0.000 0.760 149 D CB 0.289 41.056 40.800 -0.055 0.000 1.333 149 D HN -0.035 8.335 8.370 -0.000 0.000 0.684 150 M N 1.803 121.404 119.600 0.002 0.000 2.246 150 M HA 0.198 4.678 4.480 -0.001 0.000 0.350 150 M C 0.191 176.265 176.300 -0.376 0.000 1.406 150 M CA 0.621 55.787 55.300 -0.223 0.000 1.089 150 M CB 0.087 32.614 32.600 -0.121 0.000 1.782 150 M HN 0.264 8.554 8.290 -0.000 0.000 0.457 151 K N 1.185 121.268 120.400 -0.529 0.000 2.600 151 K HA 0.523 4.842 4.320 -0.001 0.000 0.262 151 K C -0.061 176.237 176.600 -0.505 0.000 0.935 151 K CA -0.325 55.352 56.287 -1.016 0.000 0.866 151 K CB 0.424 32.266 32.500 -1.096 0.000 1.354 151 K HN 0.404 8.654 8.250 -0.000 0.000 0.419 152 A N 2.197 124.806 122.820 -0.351 0.000 2.009 152 A HA -0.252 4.068 4.320 -0.001 0.000 0.222 152 A C 2.177 179.695 177.584 -0.110 0.000 1.175 152 A CA 2.688 54.650 52.037 -0.125 0.000 0.651 152 A CB -0.921 18.084 19.000 0.007 0.000 0.815 152 A HN 0.961 9.111 8.150 -0.000 0.000 0.459 153 A N -0.253 122.493 122.820 -0.123 0.000 1.972 153 A HA -0.156 4.163 4.320 -0.001 0.000 0.219 153 A C 1.708 179.237 177.584 -0.092 0.000 1.169 153 A CA 1.594 53.585 52.037 -0.077 0.000 0.635 153 A CB -0.440 18.522 19.000 -0.064 0.000 0.810 153 A HN 0.549 8.699 8.150 -0.000 0.000 0.446 154 N N -0.223 118.397 118.700 -0.133 0.000 2.383 154 N HA 0.086 4.825 4.740 -0.001 0.000 0.192 154 N C -0.458 174.978 175.510 -0.123 0.000 1.141 154 N CA 0.311 53.291 53.050 -0.116 0.000 0.851 154 N CB 0.514 38.937 38.487 -0.107 0.000 0.976 154 N HN 0.209 8.589 8.380 -0.000 0.000 0.465 155 V N 2.732 122.574 119.914 -0.120 0.000 2.318 155 V HA 0.332 4.451 4.120 -0.001 0.000 0.271 155 V C 0.414 176.471 176.094 -0.063 0.000 1.030 155 V CA -0.553 61.687 62.300 -0.099 0.000 0.844 155 V CB 1.087 32.844 31.823 -0.109 0.000 1.015 155 V HN -0.013 8.177 8.190 -0.000 0.000 0.460 156 L N 5.439 126.630 121.223 -0.054 0.000 2.400 156 L HA 0.709 5.048 4.340 -0.001 0.000 0.264 156 L C -0.394 176.464 176.870 -0.020 0.000 1.061 156 L CA -0.752 54.058 54.840 -0.050 0.000 0.799 156 L CB 1.515 43.519 42.059 -0.091 0.000 1.240 156 L HN 0.401 8.631 8.230 -0.000 0.000 0.461 157 I N -0.340 120.232 120.570 0.003 0.000 2.722 157 I HA 0.274 4.443 4.170 -0.001 0.000 0.295 157 I C -0.008 176.126 176.117 0.029 0.000 1.161 157 I CA -0.548 60.776 61.300 0.040 0.000 1.032 157 I CB 2.456 40.517 38.000 0.101 0.000 1.244 157 I HN 0.668 8.878 8.210 -0.000 0.000 0.421 158 T N 0.904 115.467 114.554 0.015 0.000 2.824 158 T HA 0.384 4.733 4.350 -0.001 0.000 0.277 158 T C 1.170 175.896 174.700 0.045 0.000 0.975 158 T CA -0.543 61.547 62.100 -0.017 0.000 0.966 158 T CB 1.357 70.221 68.868 -0.008 0.000 1.054 158 T HN 0.578 8.818 8.240 -0.000 0.000 0.533 159 R N 0.435 120.942 120.500 0.012 0.000 2.113 159 R HA -0.119 4.220 4.340 -0.001 0.000 0.244 159 R C 1.059 177.405 176.300 0.077 0.000 1.142 159 R CA 1.999 58.137 56.100 0.063 0.000 0.953 159 R CB -0.581 29.745 30.300 0.042 0.000 0.860 159 R HN 0.670 8.940 8.270 -0.000 0.000 0.438 160 D N -0.775 119.654 120.400 0.048 0.000 2.332 160 D HA 0.089 4.728 4.640 -0.001 0.000 0.244 160 D C 0.753 177.076 176.300 0.038 0.000 1.136 160 D CA 0.779 54.803 54.000 0.039 0.000 0.884 160 D CB 0.144 40.959 40.800 0.025 0.000 0.906 160 D HN 0.492 8.862 8.370 -0.000 0.000 0.520 161 G N -0.025 108.809 108.800 0.056 0.000 2.176 161 G HA2 -0.263 3.697 3.960 -0.001 0.000 0.252 161 G HA3 -0.263 3.697 3.960 -0.001 0.000 0.252 161 G C 0.188 175.108 174.900 0.033 0.000 1.024 161 G CA 0.177 45.308 45.100 0.052 0.000 0.755 161 G HN 0.303 8.593 8.290 -0.000 0.000 0.507 162 V N 0.783 120.713 119.914 0.027 0.000 2.383 162 V HA 0.630 4.750 4.120 -0.001 0.000 0.275 162 V C 0.852 176.955 176.094 0.015 0.000 1.036 162 V CA -0.785 61.523 62.300 0.014 0.000 0.889 162 V CB 1.691 33.518 31.823 0.007 0.000 0.985 162 V HN 0.514 8.704 8.190 -0.000 0.000 0.459 163 L N 5.613 126.843 121.223 0.011 0.000 2.349 163 L HA 0.527 4.866 4.340 -0.001 0.000 0.275 163 L C -0.165 176.715 176.870 0.017 0.000 1.115 163 L CA 0.034 54.877 54.840 0.006 0.000 0.820 163 L CB 0.596 42.648 42.059 -0.010 0.000 1.135 163 L HN 0.656 8.886 8.230 -0.000 0.000 0.445 164 K N 6.190 126.598 120.400 0.013 0.000 2.507 164 K HA 0.442 4.761 4.320 -0.001 0.000 0.251 164 K C -1.380 175.242 176.600 0.037 0.000 0.943 164 K CA -0.677 55.636 56.287 0.043 0.000 0.794 164 K CB 2.165 34.692 32.500 0.045 0.000 1.188 164 K HN 0.545 8.795 8.250 -0.000 0.000 0.428 165 L N 2.298 123.568 121.223 0.078 0.000 2.397 165 L HA 0.557 4.897 4.340 -0.001 0.000 0.271 165 L C 0.274 177.275 176.870 0.218 0.000 1.148 165 L CA -0.167 54.705 54.840 0.053 0.000 0.825 165 L CB 0.921 42.987 42.059 0.012 0.000 1.117 165 L HN 0.779 9.009 8.230 -0.000 0.000 0.456 166 A N 1.429 124.323 122.820 0.122 0.000 2.504 166 A HA 0.589 4.908 4.320 -0.001 0.000 0.285 166 A C -0.769 176.889 177.584 0.124 0.000 1.261 166 A CA -0.434 51.712 52.037 0.181 0.000 0.741 166 A CB 1.152 20.136 19.000 -0.026 0.000 1.327 166 A HN 0.701 8.851 8.150 -0.000 0.000 0.441 167 D N -1.509 118.944 120.400 0.089 0.000 3.620 167 D HA -0.154 4.486 4.640 -0.001 0.000 0.237 167 D C -0.667 175.572 176.300 -0.102 0.000 1.111 167 D CA 0.791 54.803 54.000 0.020 0.000 1.070 167 D CB -1.322 39.452 40.800 -0.044 0.000 0.891 167 D HN 0.453 8.823 8.370 -0.000 0.000 0.412 168 F N 0.259 120.166 119.950 -0.072 0.000 2.713 168 F HA 0.326 4.853 4.527 -0.001 0.000 0.294 168 F C 2.245 177.988 175.800 -0.095 0.000 1.152 168 F CA 0.055 57.965 58.000 -0.151 0.000 1.385 168 F CB 0.574 39.557 39.000 -0.028 0.000 0.981 168 F HN 0.390 8.690 8.300 -0.000 0.000 0.514 169 G N -0.041 108.781 108.800 0.037 0.000 2.471 169 G HA2 -0.153 3.807 3.960 -0.001 0.000 0.219 169 G HA3 -0.153 3.807 3.960 -0.001 0.000 0.219 169 G C 1.449 176.339 174.900 -0.016 0.000 1.125 169 G CA 0.508 45.628 45.100 0.033 0.000 0.775 169 G HN 0.408 8.698 8.290 -0.000 0.000 0.548 170 L N 0.183 121.353 121.223 -0.088 0.000 2.616 170 L HA 0.372 4.712 4.340 -0.001 0.000 0.229 170 L C 1.689 178.509 176.870 -0.083 0.000 1.110 170 L CA -0.323 54.464 54.840 -0.089 0.000 0.884 170 L CB 0.079 42.066 42.059 -0.121 0.000 1.115 170 L HN 0.224 8.454 8.230 -0.000 0.000 0.481 171 A N 1.605 124.372 122.820 -0.090 0.000 2.466 171 A HA 0.378 4.697 4.320 -0.001 0.000 0.238 171 A C 0.319 177.925 177.584 0.037 0.000 1.074 171 A CA 0.131 52.156 52.037 -0.021 0.000 0.774 171 A CB 0.243 19.329 19.000 0.144 0.000 1.015 171 A HN 0.520 8.670 8.150 -0.000 0.000 0.498 172 R N 0.080 120.605 120.500 0.043 0.000 2.764 172 R HA 0.725 5.064 4.340 -0.001 0.000 0.270 172 R C -0.555 175.763 176.300 0.030 0.000 1.014 172 R CA -0.267 55.839 56.100 0.010 0.000 0.904 172 R CB 1.267 31.528 30.300 -0.065 0.000 1.236 172 R HN 1.015 9.285 8.270 -0.000 0.000 0.466 173 A N 1.515 124.334 122.820 -0.002 0.000 2.304 173 A HA 0.650 4.970 4.320 -0.001 0.000 0.271 173 A C -0.627 176.948 177.584 -0.014 0.000 1.091 173 A CA -0.524 51.511 52.037 -0.003 0.000 0.812 173 A CB 0.115 19.086 19.000 -0.048 0.000 1.056 173 A HN 0.627 8.777 8.150 -0.000 0.000 0.489 174 F N -0.254 119.634 119.950 -0.103 0.000 2.613 174 F HA 0.812 5.339 4.527 -0.001 0.000 0.314 174 F C -0.299 175.528 175.800 0.045 0.000 1.075 174 F CA -0.804 57.159 58.000 -0.063 0.000 0.945 174 F CB 1.405 40.350 39.000 -0.091 0.000 1.310 174 F HN 0.502 8.802 8.300 -0.000 0.000 0.467 175 S N 1.427 117.278 115.700 0.251 0.000 2.566 175 S HA 0.715 5.184 4.470 -0.001 0.000 0.298 175 S C -1.176 173.508 174.600 0.139 0.000 1.083 175 S CA -0.680 57.562 58.200 0.071 0.000 0.978 175 S CB 1.068 64.316 63.200 0.081 0.000 1.073 175 S HN 0.657 8.967 8.310 -0.000 0.000 0.491 176 L N 3.354 124.604 121.223 0.046 0.000 2.565 176 L HA 0.339 4.678 4.340 -0.001 0.000 0.275 176 L C 0.830 177.724 176.870 0.040 0.000 1.137 176 L CA 0.249 55.124 54.840 0.059 0.000 0.915 176 L CB -0.259 41.813 42.059 0.021 0.000 1.232 176 L HN 0.701 8.931 8.230 -0.000 0.000 0.473 177 A N 5.523 128.367 122.820 0.041 0.000 3.004 177 A HA 0.383 4.702 4.320 -0.001 0.000 0.286 177 A C 0.617 178.195 177.584 -0.009 0.000 1.632 177 A CA -0.534 51.502 52.037 -0.002 0.000 1.339 177 A CB -0.722 18.258 19.000 -0.034 0.000 1.136 177 A HN 0.749 8.899 8.150 -0.000 0.000 0.577 178 K N -0.006 120.390 120.400 -0.007 0.000 2.400 178 K HA 0.579 4.899 4.320 -0.001 0.000 0.249 178 K C -0.013 176.578 176.600 -0.015 0.000 1.069 178 K CA -0.866 55.416 56.287 -0.009 0.000 0.965 178 K CB 0.523 33.022 32.500 -0.002 0.000 1.365 178 K HN 0.150 8.400 8.250 -0.000 0.000 0.539 179 N N -0.241 118.451 118.700 -0.013 0.000 2.882 179 N HA -0.200 4.539 4.740 -0.001 0.000 0.249 179 N C -0.799 174.700 175.510 -0.019 0.000 1.079 179 N CA 1.118 54.159 53.050 -0.014 0.000 0.800 179 N CB -1.411 37.067 38.487 -0.015 0.000 1.124 179 N HN 0.811 9.191 8.380 -0.000 0.000 0.557 180 S N -0.455 115.233 115.700 -0.020 0.000 3.631 180 S HA -0.252 4.218 4.470 -0.001 0.000 0.366 180 S C -0.272 174.308 174.600 -0.033 0.000 0.993 180 S CA 1.460 59.646 58.200 -0.024 0.000 1.167 180 S CB -0.876 62.312 63.200 -0.020 0.000 0.909 180 S HN 0.507 8.817 8.310 -0.000 0.000 0.478 181 Q N 0.562 120.338 119.800 -0.041 0.000 3.147 181 Q HA 0.278 4.617 4.340 -0.001 0.000 0.224 181 Q C -2.644 173.309 176.000 -0.078 0.000 0.901 181 Q CA -1.381 54.390 55.803 -0.054 0.000 0.729 181 Q CB 1.525 30.235 28.738 -0.047 0.000 1.363 181 Q HN 0.328 8.598 8.270 -0.000 0.000 0.467 182 P HA -0.042 4.378 4.420 -0.000 0.000 0.266 182 P C -0.298 176.889 177.300 -0.188 0.000 1.193 182 P CA 0.074 63.097 63.100 -0.128 0.000 0.770 182 P CB 0.632 32.261 31.700 -0.118 0.000 0.836 183 N N 2.120 120.641 118.700 -0.299 0.000 2.415 183 N HA 0.100 4.840 4.740 -0.001 0.000 0.248 183 N C 0.265 175.498 175.510 -0.462 0.000 1.271 183 N CA 0.211 52.964 53.050 -0.495 0.000 0.913 183 N CB 0.444 38.322 38.487 -1.014 0.000 1.129 183 N HN 0.280 8.660 8.380 -0.000 0.000 0.444 184 R N 1.892 122.144 120.500 -0.413 0.000 2.402 184 R HA 0.234 4.573 4.340 -0.001 0.000 0.290 184 R C -0.767 175.463 176.300 -0.116 0.000 1.321 184 R CA -0.421 55.546 56.100 -0.221 0.000 1.283 184 R CB 0.161 30.405 30.300 -0.094 0.000 1.111 184 R HN 0.483 8.753 8.270 -0.000 0.000 0.578 188 R N 2.375 122.883 120.500 0.013 0.000 4.886 188 R HA 0.176 4.516 4.340 -0.001 0.000 0.181 188 R C 0.196 176.473 176.300 -0.038 0.000 1.989 188 R CA -0.014 56.075 56.100 -0.019 0.000 1.623 188 R CB -0.258 30.034 30.300 -0.012 0.000 1.383 188 R HN 0.105 8.375 8.270 -0.000 0.000 0.847 189 V N -2.905 116.970 119.914 -0.066 0.000 2.975 189 V HA 0.604 4.723 4.120 -0.001 0.000 0.318 189 V C 0.377 176.419 176.094 -0.087 0.000 1.077 189 V CA -1.340 60.914 62.300 -0.077 0.000 1.000 189 V CB 1.862 33.636 31.823 -0.081 0.000 1.066 189 V HN 0.131 8.321 8.190 -0.000 0.000 0.452 190 V N -0.249 119.624 119.914 -0.069 0.000 3.478 190 V HA -0.179 3.941 4.120 -0.001 0.000 0.498 190 V C 0.537 176.616 176.094 -0.026 0.000 0.682 190 V CA 0.620 62.898 62.300 -0.036 0.000 2.047 190 V CB -1.878 29.936 31.823 -0.016 0.000 2.481 190 V HN 1.366 9.556 8.190 -0.000 0.000 0.507 191 T N 5.299 119.843 114.554 -0.017 0.000 2.898 191 T HA 0.068 4.418 4.350 -0.001 0.000 0.331 191 T C 1.069 175.784 174.700 0.025 0.000 1.085 191 T CA 0.714 62.799 62.100 -0.025 0.000 1.129 191 T CB 0.304 69.189 68.868 0.030 0.000 1.054 191 T HN 0.886 9.126 8.240 -0.000 0.000 0.540 192 L N 2.098 123.275 121.223 -0.075 0.000 1.994 192 L HA -0.034 4.305 4.340 -0.001 0.000 0.208 192 L C 2.022 178.988 176.870 0.161 0.000 1.071 192 L CA 1.822 56.655 54.840 -0.011 0.000 0.745 192 L CB -0.632 41.377 42.059 -0.083 0.000 0.892 192 L HN 0.735 8.965 8.230 -0.000 0.000 0.431 193 W N -0.839 120.503 121.300 0.071 0.000 2.363 193 W HA -0.168 4.492 4.660 -0.001 0.000 0.296 193 W C 2.185 178.639 176.519 -0.107 0.000 1.212 193 W CA 0.807 58.112 57.345 -0.067 0.000 1.260 193 W CB -1.331 28.009 29.460 -0.200 0.000 1.131 193 W HN 0.271 8.451 8.180 -0.000 0.000 0.530 194 Y N -0.491 119.978 120.300 0.282 0.000 2.493 194 Y HA 0.218 4.767 4.550 -0.001 0.000 0.275 194 Y C 1.368 177.426 175.900 0.264 0.000 1.183 194 Y CA -0.279 57.971 58.100 0.250 0.000 1.258 194 Y CB -0.336 38.215 38.460 0.153 0.000 1.108 194 Y HN -0.315 7.965 8.280 -0.000 0.000 0.521 195 R N 2.426 123.100 120.500 0.290 0.000 2.441 195 R HA 0.242 4.581 4.340 -0.001 0.000 0.284 195 R C -2.837 173.407 176.300 -0.094 0.000 1.070 195 R CA -1.621 54.535 56.100 0.093 0.000 1.047 195 R CB 0.546 30.855 30.300 0.016 0.000 1.016 195 R HN -0.065 8.205 8.270 -0.000 0.000 0.477 196 P HA 0.306 4.726 4.420 -0.000 0.000 0.283 196 P C -2.457 174.409 177.300 -0.723 0.000 1.271 196 P CA -1.951 60.416 63.100 -1.222 0.000 0.841 196 P CB 0.952 32.095 31.700 -0.928 0.000 1.122 197 P HA -0.194 4.226 4.420 -0.000 0.000 0.215 197 P C 1.128 178.350 177.300 -0.130 0.000 1.153 197 P CA 1.655 64.559 63.100 -0.327 0.000 0.853 197 P CB -0.142 31.428 31.700 -0.216 0.000 0.788 198 E N -0.360 119.778 120.200 -0.103 0.000 2.114 198 E HA -0.188 4.161 4.350 -0.001 0.000 0.199 198 E C 1.973 178.619 176.600 0.078 0.000 1.008 198 E CA 1.170 57.630 56.400 0.101 0.000 0.810 198 E CB -1.045 28.709 29.700 0.090 0.000 0.739 198 E HN 0.267 8.627 8.360 -0.000 0.000 0.456 199 L N -0.054 121.129 121.223 -0.067 0.000 2.131 199 L HA -0.052 4.287 4.340 -0.001 0.000 0.206 199 L C 2.316 179.174 176.870 -0.020 0.000 1.087 199 L CA 0.574 55.373 54.840 -0.068 0.000 0.767 199 L CB -0.418 41.528 42.059 -0.188 0.000 0.917 199 L HN 0.143 8.373 8.230 -0.000 0.000 0.441 200 L N -0.072 121.123 121.223 -0.046 0.000 2.046 200 L HA -0.208 4.131 4.340 -0.001 0.000 0.208 200 L C 2.179 179.058 176.870 0.015 0.000 1.077 200 L CA 1.114 55.942 54.840 -0.020 0.000 0.747 200 L CB -0.513 41.523 42.059 -0.039 0.000 0.896 200 L HN 0.284 8.514 8.230 -0.000 0.000 0.432 201 L N 0.607 121.840 121.223 0.016 0.000 2.711 201 L HA 0.050 4.390 4.340 -0.001 0.000 0.242 201 L C 1.067 178.083 176.870 0.243 0.000 1.153 201 L CA 0.427 55.306 54.840 0.064 0.000 0.898 201 L CB -1.244 40.697 42.059 -0.197 0.000 1.044 201 L HN 0.559 8.789 8.230 -0.000 0.000 0.437 202 G N 1.520 110.418 108.800 0.163 0.000 2.298 202 G HA2 -0.298 3.661 3.960 -0.001 0.000 0.287 202 G HA3 -0.298 3.661 3.960 -0.001 0.000 0.287 202 G C 0.034 175.043 174.900 0.182 0.000 1.075 202 G CA 0.310 45.498 45.100 0.146 0.000 0.960 202 G HN 0.494 8.784 8.290 -0.000 0.000 0.502 203 E N -0.687 119.669 120.200 0.260 0.000 2.343 203 E HA 0.656 5.005 4.350 -0.001 0.000 0.269 203 E C 1.317 178.082 176.600 0.276 0.000 1.047 203 E CA -0.575 55.980 56.400 0.259 0.000 0.874 203 E CB 0.417 30.361 29.700 0.406 0.000 1.033 203 E HN 0.346 8.706 8.360 -0.000 0.000 0.409 204 R N 2.222 122.823 120.500 0.169 0.000 2.531 204 R HA 0.128 4.468 4.340 -0.001 0.000 0.316 204 R C -0.513 175.708 176.300 -0.132 0.000 0.955 204 R CA -0.020 56.155 56.100 0.126 0.000 1.120 204 R CB 0.639 30.951 30.300 0.020 0.000 1.361 204 R HN 0.410 8.680 8.270 -0.000 0.000 0.534 205 D N 1.184 121.533 120.400 -0.084 0.000 2.736 205 D HA 0.084 4.724 4.640 -0.001 0.000 0.293 205 D C -0.841 175.442 176.300 -0.029 0.000 1.241 205 D CA -0.495 53.390 54.000 -0.192 0.000 0.965 205 D CB -0.044 40.669 40.800 -0.145 0.000 0.992 205 D HN 0.094 8.464 8.370 -0.000 0.000 0.510 206 Y N -0.775 119.570 120.300 0.076 0.000 2.596 206 Y HA 0.915 5.465 4.550 -0.000 0.000 0.326 206 Y C 0.598 176.506 175.900 0.013 0.000 1.167 206 Y CA -1.091 57.042 58.100 0.055 0.000 1.246 206 Y CB 1.151 39.645 38.460 0.056 0.000 1.347 206 Y HN 0.017 8.297 8.280 -0.000 0.000 0.515 207 G N -0.933 107.930 108.800 0.104 0.000 2.947 207 G HA2 0.405 4.365 3.960 -0.001 0.000 0.293 207 G HA3 0.405 4.365 3.960 -0.001 0.000 0.293 207 G C -2.515 172.174 174.900 -0.353 0.000 1.243 207 G CA -1.588 43.357 45.100 -0.258 0.000 0.802 207 G HN 0.313 8.603 8.290 -0.000 0.000 0.560 208 P HA -0.113 4.307 4.420 -0.000 0.000 0.219 208 P C -1.454 175.638 177.300 -0.347 0.000 1.153 208 P CA 1.836 64.444 63.100 -0.820 0.000 0.865 208 P CB -0.440 30.753 31.700 -0.846 0.000 0.788 209 P HA -0.142 4.278 4.420 -0.000 0.000 0.219 209 P C 1.535 178.848 177.300 0.022 0.000 1.146 209 P CA 1.052 64.129 63.100 -0.037 0.000 0.808 209 P CB -0.834 30.845 31.700 -0.036 0.000 0.779 210 I N -3.585 116.978 120.570 -0.011 0.000 2.614 210 I HA -0.142 4.028 4.170 -0.001 0.000 0.258 210 I C 1.135 177.307 176.117 0.091 0.000 1.189 210 I CA 1.753 63.051 61.300 -0.003 0.000 1.462 210 I CB -0.536 37.400 38.000 -0.108 0.000 1.092 210 I HN -0.197 8.013 8.210 -0.000 0.000 0.442 211 D N 1.456 121.924 120.400 0.113 0.000 2.183 211 D HA 0.036 4.675 4.640 -0.001 0.000 0.205 211 D C 2.368 178.771 176.300 0.171 0.000 0.962 211 D CA 1.024 55.121 54.000 0.163 0.000 0.849 211 D CB -0.086 40.871 40.800 0.261 0.000 0.978 211 D HN 0.407 8.777 8.370 -0.000 0.000 0.488 212 L N 0.262 121.596 121.223 0.185 0.000 2.083 212 L HA -0.138 4.201 4.340 -0.001 0.000 0.209 212 L C 2.505 179.468 176.870 0.154 0.000 1.083 212 L CA 0.935 55.869 54.840 0.157 0.000 0.752 212 L CB -0.243 41.901 42.059 0.141 0.000 0.899 212 L HN 0.238 8.468 8.230 -0.000 0.000 0.433 213 W N 1.257 122.560 121.300 0.006 0.000 2.333 213 W HA -0.179 4.481 4.660 -0.001 0.000 0.316 213 W C 2.107 178.645 176.519 0.033 0.000 1.215 213 W CA 1.954 59.297 57.345 -0.002 0.000 1.278 213 W CB -0.609 28.840 29.460 -0.019 0.000 1.154 213 W HN 0.215 8.395 8.180 -0.000 0.000 0.486 214 G N 0.859 109.849 108.800 0.316 0.000 2.513 214 G HA2 -0.345 3.615 3.960 -0.001 0.000 0.219 214 G HA3 -0.345 3.615 3.960 -0.001 0.000 0.219 214 G C 1.719 176.678 174.900 0.098 0.000 1.160 214 G CA 2.317 47.557 45.100 0.234 0.000 0.767 214 G HN 0.415 8.705 8.290 -0.000 0.000 0.571 215 A N 0.642 123.490 122.820 0.046 0.000 2.024 215 A HA 0.166 4.486 4.320 -0.001 0.000 0.220 215 A C 2.620 180.181 177.584 -0.039 0.000 1.164 215 A CA 2.103 54.142 52.037 0.005 0.000 0.643 215 A CB -0.892 18.121 19.000 0.021 0.000 0.806 215 A HN 0.578 8.728 8.150 -0.000 0.000 0.451 216 G N -0.571 108.159 108.800 -0.116 0.000 2.464 216 G HA2 -0.250 3.710 3.960 -0.001 0.000 0.214 216 G HA3 -0.250 3.710 3.960 -0.001 0.000 0.214 216 G C 1.585 176.357 174.900 -0.214 0.000 1.218 216 G CA 1.232 46.197 45.100 -0.224 0.000 0.794 216 G HN 0.517 8.807 8.290 -0.000 0.000 0.542 217 C N 0.873 120.013 119.300 -0.267 0.000 2.396 217 C HA -0.104 4.356 4.460 -0.001 0.000 0.279 217 C C 2.825 177.790 174.990 -0.042 0.000 1.229 217 C CA 0.740 59.642 59.018 -0.193 0.000 1.801 217 C CB -1.172 26.470 27.740 -0.164 0.000 2.050 217 C HN 0.455 8.685 8.230 -0.000 0.000 0.491 218 I N -0.680 119.915 120.570 0.041 0.000 2.406 218 I HA -0.169 4.001 4.170 -0.001 0.000 0.249 218 I C 2.688 178.791 176.117 -0.024 0.000 1.122 218 I CA 1.147 62.476 61.300 0.049 0.000 1.431 218 I CB -0.606 37.413 38.000 0.031 0.000 1.087 218 I HN 0.331 8.541 8.210 -0.000 0.000 0.424 219 M N 0.993 120.575 119.600 -0.030 0.000 2.073 219 M HA -0.251 4.229 4.480 -0.001 0.000 0.258 219 M C 2.585 178.947 176.300 0.103 0.000 1.070 219 M CA 2.410 57.716 55.300 0.010 0.000 1.103 219 M CB -0.369 32.231 32.600 0.001 0.000 1.321 219 M HN 0.346 8.636 8.290 -0.000 0.000 0.405 220 A N -0.671 122.175 122.820 0.043 0.000 1.930 220 A HA -0.206 4.114 4.320 -0.001 0.000 0.217 220 A C 1.808 179.416 177.584 0.039 0.000 1.175 220 A CA 1.775 53.854 52.037 0.070 0.000 0.627 220 A CB -0.775 18.170 19.000 -0.091 0.000 0.815 220 A HN 0.599 8.749 8.150 -0.000 0.000 0.443 221 E N -0.872 119.309 120.200 -0.032 0.000 2.463 221 E HA -0.136 4.213 4.350 -0.001 0.000 0.201 221 E C 1.554 178.118 176.600 -0.061 0.000 1.045 221 E CA 0.739 57.111 56.400 -0.045 0.000 0.872 221 E CB -0.095 29.606 29.700 0.001 0.000 0.797 221 E HN 0.482 8.842 8.360 -0.000 0.000 0.538 222 M N -1.108 118.421 119.600 -0.117 0.000 2.447 222 M HA -0.056 4.423 4.480 -0.001 0.000 0.264 222 M C 1.238 177.312 176.300 -0.376 0.000 1.095 222 M CA 0.748 55.834 55.300 -0.356 0.000 1.125 222 M CB -0.194 32.006 32.600 -0.666 0.000 1.389 222 M HN 0.361 8.651 8.290 -0.000 0.000 0.459 223 W N 0.144 121.417 121.300 -0.045 0.000 2.798 223 W HA 0.070 4.729 4.660 -0.001 0.000 0.260 223 W C 2.205 178.718 176.519 -0.010 0.000 1.165 223 W CA 1.381 58.731 57.345 0.009 0.000 1.501 223 W CB -0.795 28.676 29.460 0.018 0.000 1.023 223 W HN 0.273 8.453 8.180 -0.000 0.000 0.615 224 T N -1.087 113.495 114.554 0.048 0.000 3.160 224 T HA -0.008 4.341 4.350 -0.001 0.000 0.257 224 T C 1.093 175.743 174.700 -0.083 0.000 1.147 224 T CA 0.338 62.305 62.100 -0.221 0.000 1.064 224 T CB -0.117 68.420 68.868 -0.551 0.000 0.949 224 T HN -0.042 8.198 8.240 -0.000 0.000 0.526 225 R N -0.188 120.305 120.500 -0.012 0.000 3.989 225 R HA -0.144 4.196 4.340 -0.001 0.000 0.335 225 R C 0.054 176.345 176.300 -0.015 0.000 1.223 225 R CA 1.171 57.276 56.100 0.009 0.000 0.962 225 R CB -2.866 27.459 30.300 0.041 0.000 1.393 225 R HN 0.632 8.902 8.270 -0.000 0.000 0.554 226 S N -0.309 115.350 115.700 -0.069 0.000 2.603 226 S HA 0.484 4.953 4.470 -0.001 0.000 0.274 226 S C -2.802 171.704 174.600 -0.156 0.000 1.168 226 S CA -1.354 56.790 58.200 -0.093 0.000 0.963 226 S CB 1.954 65.086 63.200 -0.114 0.000 1.078 226 S HN -0.184 8.126 8.310 -0.000 0.000 0.477 227 P HA 0.024 4.444 4.420 -0.000 0.000 0.255 227 P C 0.871 177.942 177.300 -0.381 0.000 1.161 227 P CA 0.291 63.231 63.100 -0.266 0.000 0.768 227 P CB -0.180 31.368 31.700 -0.254 0.000 0.746 228 I N 0.247 120.611 120.570 -0.342 0.000 2.830 228 I HA 0.061 4.231 4.170 -0.001 0.000 0.263 228 I C 0.691 176.622 176.117 -0.311 0.000 1.230 228 I CA 1.278 62.391 61.300 -0.311 0.000 1.480 228 I CB -0.413 37.425 38.000 -0.270 0.000 1.095 228 I HN 0.163 8.373 8.210 -0.000 0.000 0.455 229 M N 2.203 121.584 119.600 -0.365 0.000 1.956 229 M HA 0.378 4.857 4.480 -0.001 0.000 0.256 229 M C -1.195 174.810 176.300 -0.493 0.000 0.869 229 M CA -0.076 55.035 55.300 -0.314 0.000 0.886 229 M CB 1.571 34.077 32.600 -0.157 0.000 1.739 229 M HN 0.148 8.438 8.290 -0.000 0.000 0.381 230 Q N 1.332 120.720 119.800 -0.687 0.000 2.296 230 Q HA 0.637 4.976 4.340 -0.001 0.000 0.257 230 Q C 0.246 176.146 176.000 -0.167 0.000 0.942 230 Q CA -0.471 54.668 55.803 -1.106 0.000 0.939 230 Q CB 1.968 29.997 28.738 -1.181 0.000 1.198 230 Q HN 0.735 9.005 8.270 -0.000 0.000 0.429 231 G N 1.788 110.804 108.800 0.360 0.000 2.524 231 G HA2 0.219 4.178 3.960 -0.001 0.000 0.310 231 G HA3 0.219 4.178 3.960 -0.001 0.000 0.310 231 G C -0.002 175.252 174.900 0.590 0.000 1.279 231 G CA -0.582 44.834 45.100 0.527 0.000 0.974 231 G HN 0.444 8.734 8.290 -0.000 0.000 0.484 232 N N -0.501 118.500 118.700 0.501 0.000 2.135 232 N HA 0.020 4.759 4.740 -0.001 0.000 0.186 232 N C 1.428 177.035 175.510 0.162 0.000 1.027 232 N CA 1.644 54.819 53.050 0.208 0.000 0.849 232 N CB -0.009 38.482 38.487 0.006 0.000 1.002 232 N HN 0.739 9.119 8.380 -0.000 0.000 0.425 233 T N -3.143 111.520 114.554 0.181 0.000 2.804 233 T HA 0.381 4.730 4.350 -0.001 0.000 0.290 233 T C 0.602 175.373 174.700 0.118 0.000 1.099 233 T CA -0.718 61.450 62.100 0.113 0.000 1.011 233 T CB 1.526 70.439 68.868 0.075 0.000 1.291 233 T HN -0.090 8.150 8.240 -0.000 0.000 0.523 234 E N 0.026 120.267 120.200 0.069 0.000 2.209 234 E HA -0.178 4.171 4.350 -0.001 0.000 0.196 234 E C 2.067 178.700 176.600 0.055 0.000 0.993 234 E CA 1.418 57.849 56.400 0.051 0.000 0.819 234 E CB -0.092 29.625 29.700 0.027 0.000 0.745 234 E HN 0.577 8.937 8.360 -0.000 0.000 0.477 235 Q N -0.750 119.092 119.800 0.070 0.000 2.123 235 Q HA -0.090 4.249 4.340 -0.001 0.000 0.196 235 Q C 2.154 178.215 176.000 0.102 0.000 0.958 235 Q CA 0.691 56.534 55.803 0.067 0.000 0.841 235 Q CB -0.048 28.725 28.738 0.058 0.000 0.915 235 Q HN 0.442 8.712 8.270 -0.000 0.000 0.455 236 H N 0.434 119.525 119.070 0.036 0.000 2.353 236 H HA -0.163 4.393 4.556 -0.001 0.000 0.300 236 H C 2.061 177.420 175.328 0.052 0.000 1.090 236 H CA 1.592 57.665 56.048 0.041 0.000 1.327 236 H CB 0.567 30.360 29.762 0.051 0.000 1.383 236 H HN 0.157 8.437 8.280 -0.000 0.000 0.508 237 Q N 0.875 120.684 119.800 0.015 0.000 1.967 237 Q HA -0.146 4.193 4.340 -0.001 0.000 0.202 237 Q C 2.502 178.480 176.000 -0.036 0.000 0.985 237 Q CA 1.719 57.509 55.803 -0.022 0.000 0.839 237 Q CB -0.626 28.159 28.738 0.078 0.000 0.906 237 Q HN 0.432 8.702 8.270 -0.000 0.000 0.423 238 L N 0.222 121.445 121.223 -0.000 0.000 2.129 238 L HA -0.135 4.204 4.340 -0.001 0.000 0.212 238 L C 1.971 178.839 176.870 -0.002 0.000 1.087 238 L CA 2.239 57.080 54.840 0.002 0.000 0.757 238 L CB -0.984 41.078 42.059 0.004 0.000 0.896 238 L HN 0.330 8.560 8.230 -0.000 0.000 0.434 239 A N -0.970 121.837 122.820 -0.022 0.000 1.854 239 A HA -0.157 4.162 4.320 -0.001 0.000 0.214 239 A C 2.168 179.722 177.584 -0.051 0.000 1.192 239 A CA 1.545 53.567 52.037 -0.025 0.000 0.611 239 A CB -0.990 18.001 19.000 -0.014 0.000 0.832 239 A HN 0.402 8.552 8.150 -0.000 0.000 0.442 240 L N 0.166 121.312 121.223 -0.130 0.000 2.129 240 L HA -0.158 4.182 4.340 -0.001 0.000 0.212 240 L C 2.180 179.017 176.870 -0.054 0.000 1.087 240 L CA 1.570 56.322 54.840 -0.147 0.000 0.757 240 L CB -0.504 41.385 42.059 -0.284 0.000 0.896 240 L HN 0.463 8.693 8.230 -0.000 0.000 0.434 241 I N -1.847 118.724 120.570 0.001 0.000 2.163 241 I HA -0.289 3.881 4.170 -0.001 0.000 0.240 241 I C 2.525 178.690 176.117 0.079 0.000 1.081 241 I CA 1.510 62.864 61.300 0.090 0.000 1.353 241 I CB -0.425 37.669 38.000 0.157 0.000 1.054 241 I HN 0.208 8.418 8.210 -0.000 0.000 0.407 242 S N -0.183 115.550 115.700 0.056 0.000 2.442 242 S HA -0.217 4.253 4.470 -0.001 0.000 0.236 242 S C 1.740 176.358 174.600 0.031 0.000 1.007 242 S CA 1.097 59.329 58.200 0.055 0.000 0.965 242 S CB -0.244 62.985 63.200 0.047 0.000 0.773 242 S HN 0.384 8.694 8.310 -0.000 0.000 0.504 243 Q N -0.020 119.785 119.800 0.008 0.000 2.291 243 Q HA 0.180 4.520 4.340 -0.001 0.000 0.211 243 Q C 0.826 176.820 176.000 -0.010 0.000 0.925 243 Q CA 0.153 55.953 55.803 -0.005 0.000 0.949 243 Q CB 0.162 28.887 28.738 -0.021 0.000 1.015 243 Q HN 0.516 8.786 8.270 -0.000 0.000 0.477 244 L N -2.952 118.272 121.223 0.002 0.000 3.048 244 L HA 0.163 4.503 4.340 -0.001 0.000 0.278 244 L C 0.940 177.810 176.870 0.000 0.000 1.057 244 L CA 0.537 55.370 54.840 -0.012 0.000 1.073 244 L CB 0.466 42.505 42.059 -0.033 0.000 1.802 244 L HN 0.147 8.377 8.230 -0.000 0.000 0.562 245 C N 1.042 120.365 119.300 0.038 0.000 3.065 245 C HA 0.820 5.279 4.460 -0.001 0.000 0.285 245 C C 1.170 176.193 174.990 0.055 0.000 1.257 245 C CA 0.022 59.072 59.018 0.054 0.000 1.691 245 C CB -1.035 26.781 27.740 0.126 0.000 2.089 245 C HN 0.773 9.003 8.230 -0.000 0.000 0.630 246 G N 0.996 109.827 108.800 0.052 0.000 2.479 246 G HA2 0.107 4.066 3.960 -0.001 0.000 0.686 246 G HA3 0.107 4.066 3.960 -0.001 0.000 0.686 246 G C -0.431 174.512 174.900 0.071 0.000 1.295 246 G CA -0.295 44.837 45.100 0.053 0.000 0.922 246 G HN 0.736 9.026 8.290 -0.000 0.000 0.582 247 S N -0.667 115.074 115.700 0.069 0.000 2.565 247 S HA 0.653 5.123 4.470 -0.001 0.000 0.274 247 S C 0.609 175.277 174.600 0.113 0.000 1.309 247 S CA -0.648 57.601 58.200 0.082 0.000 1.043 247 S CB 1.109 64.349 63.200 0.067 0.000 0.939 247 S HN 0.883 9.193 8.310 -0.000 0.000 0.504 248 I N 3.718 124.369 120.570 0.135 0.000 2.505 248 I HA 0.236 4.405 4.170 -0.001 0.000 0.287 248 I C 0.606 176.788 176.117 0.108 0.000 1.104 248 I CA 0.131 61.518 61.300 0.144 0.000 1.387 248 I CB -0.206 37.859 38.000 0.108 0.000 1.404 248 I HN 0.893 9.103 8.210 -0.000 0.000 0.528 249 T N 2.813 117.396 114.554 0.048 0.000 2.894 249 T HA 0.351 4.700 4.350 -0.001 0.000 0.309 249 T C -2.365 172.302 174.700 -0.054 0.000 1.208 249 T CA -1.799 60.303 62.100 0.003 0.000 1.016 249 T CB 2.143 71.053 68.868 0.069 0.000 1.192 249 T HN 0.105 8.345 8.240 -0.000 0.000 0.491 250 P HA -0.094 4.326 4.420 -0.000 0.000 0.218 250 P C 1.331 178.643 177.300 0.021 0.000 1.146 250 P CA 0.969 64.025 63.100 -0.075 0.000 0.813 250 P CB 0.245 31.901 31.700 -0.073 0.000 0.778 251 E N -0.240 119.980 120.200 0.033 0.000 2.031 251 E HA -0.148 4.202 4.350 -0.001 0.000 0.193 251 E C 1.619 178.261 176.600 0.070 0.000 0.994 251 E CA 1.503 57.931 56.400 0.048 0.000 0.800 251 E CB -0.286 29.440 29.700 0.043 0.000 0.752 251 E HN -0.009 8.351 8.360 -0.000 0.000 0.447 252 V N -0.180 119.789 119.914 0.092 0.000 2.649 252 V HA -0.085 4.034 4.120 -0.001 0.000 0.248 252 V C 0.647 176.849 176.094 0.180 0.000 1.054 252 V CA 0.913 63.281 62.300 0.112 0.000 1.073 252 V CB -0.098 31.793 31.823 0.113 0.000 0.699 252 V HN 0.437 8.627 8.190 -0.000 0.000 0.463 253 W N 2.557 123.830 121.300 -0.045 0.000 2.387 253 W HA 0.502 5.161 4.660 -0.002 0.000 0.285 253 W C -3.221 173.255 176.519 -0.071 0.000 1.011 253 W CA -3.655 53.653 57.345 -0.061 0.000 1.576 253 W CB 0.441 29.841 29.460 -0.099 0.000 1.540 253 W HN 0.075 8.255 8.180 -0.000 0.000 0.383 254 P HA -0.121 4.299 4.420 -0.000 0.000 0.263 254 P C 0.429 177.790 177.300 0.102 0.000 1.168 254 P CA 1.311 64.499 63.100 0.147 0.000 0.759 254 P CB 0.572 32.354 31.700 0.136 0.000 0.782 255 N N 0.477 119.168 118.700 -0.015 0.000 2.708 255 N HA -0.162 4.578 4.740 -0.001 0.000 0.251 255 N C 0.875 176.287 175.510 -0.164 0.000 1.123 255 N CA 0.844 53.864 53.050 -0.050 0.000 0.739 255 N CB -1.557 36.947 38.487 0.029 0.000 1.113 255 N HN 0.268 8.648 8.380 -0.000 0.000 0.561 256 V N -0.221 119.408 119.914 -0.474 0.000 2.970 256 V HA -0.148 3.971 4.120 -0.001 0.000 0.260 256 V C 1.980 177.637 176.094 -0.728 0.000 1.100 256 V CA 2.273 63.993 62.300 -0.967 0.000 1.122 256 V CB -0.127 30.708 31.823 -1.647 0.000 0.721 256 V HN 0.316 8.506 8.190 -0.000 0.000 0.483 257 D N 1.174 121.246 120.400 -0.546 0.000 2.123 257 D HA -0.207 4.433 4.640 -0.001 0.000 0.196 257 D C 1.689 177.957 176.300 -0.054 0.000 0.992 257 D CA 1.776 55.565 54.000 -0.352 0.000 0.833 257 D CB -0.371 40.352 40.800 -0.129 0.000 0.954 257 D HN 0.524 8.894 8.370 -0.000 0.000 0.455 258 N N -0.779 117.903 118.700 -0.030 0.000 2.513 258 N HA -0.150 4.590 4.740 -0.001 0.000 0.187 258 N C -0.239 175.266 175.510 -0.008 0.000 1.056 258 N CA 0.359 53.400 53.050 -0.016 0.000 0.907 258 N CB -0.504 37.942 38.487 -0.068 0.000 0.954 258 N HN 0.422 8.802 8.380 -0.000 0.000 0.445 259 Y N 1.403 121.631 120.300 -0.120 0.000 2.465 259 Y HA -0.015 4.535 4.550 -0.000 0.000 0.331 259 Y C 1.659 177.554 175.900 -0.010 0.000 1.102 259 Y CA -0.309 57.747 58.100 -0.074 0.000 1.358 259 Y CB 0.526 38.912 38.460 -0.122 0.000 1.213 259 Y HN 0.060 8.340 8.280 -0.000 0.000 0.525 260 E N 2.371 122.626 120.200 0.093 0.000 2.147 260 E HA -0.239 4.111 4.350 -0.001 0.000 0.199 260 E C 1.326 177.978 176.600 0.087 0.000 1.005 260 E CA 1.348 57.788 56.400 0.067 0.000 0.810 260 E CB -0.044 29.674 29.700 0.030 0.000 0.736 260 E HN 0.714 9.074 8.360 -0.000 0.000 0.460 261 L N 0.487 121.779 121.223 0.114 0.000 2.591 261 L HA -0.021 4.318 4.340 -0.001 0.000 0.228 261 L C 1.928 178.843 176.870 0.076 0.000 1.133 261 L CA -0.282 54.603 54.840 0.075 0.000 0.880 261 L CB -0.283 41.817 42.059 0.069 0.000 1.033 261 L HN 0.163 8.393 8.230 -0.000 0.000 0.450 262 Y N 2.052 122.334 120.300 -0.029 0.000 2.073 262 Y HA -0.325 4.224 4.550 -0.001 0.000 0.257 262 Y C 2.439 178.299 175.900 -0.067 0.000 1.093 262 Y CA 2.201 60.247 58.100 -0.090 0.000 1.076 262 Y CB -0.278 38.111 38.460 -0.118 0.000 0.984 262 Y HN 0.137 8.417 8.280 -0.000 0.000 0.478 263 E N 0.592 120.457 120.200 -0.558 0.000 2.347 263 E HA -0.100 4.250 4.350 -0.001 0.000 0.196 263 E C 1.297 177.760 176.600 -0.228 0.000 1.008 263 E CA 0.746 56.822 56.400 -0.539 0.000 0.852 263 E CB -0.267 29.189 29.700 -0.407 0.000 0.783 263 E HN 0.406 8.766 8.360 -0.000 0.000 0.505 264 K N 0.065 120.392 120.400 -0.121 0.000 2.627 264 K HA 0.096 4.416 4.320 -0.001 0.000 0.212 264 K C 0.023 176.594 176.600 -0.048 0.000 1.041 264 K CA 0.003 56.254 56.287 -0.060 0.000 1.205 264 K CB 0.094 32.584 32.500 -0.018 0.000 0.936 264 K HN 0.119 8.369 8.250 -0.000 0.000 0.489 265 L N -0.123 121.056 121.223 -0.073 0.000 3.695 265 L HA 0.183 4.523 4.340 -0.001 0.000 0.349 265 L C -0.780 176.056 176.870 -0.057 0.000 1.304 265 L CA 0.220 55.032 54.840 -0.046 0.000 1.078 265 L CB 0.051 42.095 42.059 -0.024 0.000 1.440 265 L HN 0.195 8.425 8.230 -0.000 0.000 0.620 266 E N 1.168 121.318 120.200 -0.084 0.000 2.246 266 E HA -0.252 4.097 4.350 -0.001 0.000 0.173 266 E C -0.276 176.284 176.600 -0.067 0.000 1.532 266 E CA 0.718 57.072 56.400 -0.076 0.000 0.672 266 E CB -0.645 29.029 29.700 -0.044 0.000 1.078 266 E HN 0.512 8.872 8.360 -0.000 0.000 0.338 267 L N 1.691 122.854 121.223 -0.101 0.000 2.331 267 L HA 0.246 4.585 4.340 -0.001 0.000 0.278 267 L C 0.214 177.054 176.870 -0.050 0.000 1.106 267 L CA -0.811 53.991 54.840 -0.064 0.000 0.824 267 L CB 0.938 42.957 42.059 -0.067 0.000 1.142 267 L HN -0.027 8.203 8.230 -0.000 0.000 0.443 268 V N 6.482 126.385 119.914 -0.018 0.000 2.458 268 V HA -0.067 4.053 4.120 -0.001 0.000 0.287 268 V C 1.168 177.261 176.094 -0.003 0.000 1.009 268 V CA 0.329 62.623 62.300 -0.010 0.000 1.091 268 V CB 0.281 32.105 31.823 0.002 0.000 0.960 268 V HN 0.870 9.060 8.190 -0.000 0.000 0.476 269 K N 3.789 124.182 120.400 -0.011 0.000 2.062 269 K HA 0.025 4.344 4.320 -0.001 0.000 0.205 269 K C 1.213 177.821 176.600 0.013 0.000 1.051 269 K CA 1.111 57.397 56.287 -0.002 0.000 0.941 269 K CB 0.052 32.544 32.500 -0.013 0.000 0.719 269 K HN 0.796 9.046 8.250 -0.000 0.000 0.440 270 G N 1.588 110.393 108.800 0.009 0.000 2.607 270 G HA2 0.223 4.182 3.960 -0.001 0.000 0.332 270 G HA3 0.223 4.182 3.960 -0.001 0.000 0.332 270 G C -0.827 174.081 174.900 0.014 0.000 1.046 270 G CA -0.310 44.797 45.100 0.012 0.000 1.099 270 G HN -0.039 8.251 8.290 -0.000 0.000 0.451 271 Q N 1.374 121.186 119.800 0.020 0.000 2.313 271 Q HA 0.234 4.573 4.340 -0.001 0.000 0.255 271 Q C -0.952 175.062 176.000 0.024 0.000 0.944 271 Q CA -0.467 55.348 55.803 0.020 0.000 0.881 271 Q CB 2.891 31.643 28.738 0.024 0.000 1.375 271 Q HN 0.568 8.838 8.270 -0.000 0.000 0.422 272 K N 0.955 121.364 120.400 0.016 0.000 2.207 272 K HA 0.444 4.763 4.320 -0.001 0.000 0.255 272 K C -0.161 176.445 176.600 0.011 0.000 0.941 272 K CA -0.831 55.465 56.287 0.015 0.000 0.825 272 K CB 2.215 34.721 32.500 0.010 0.000 1.119 272 K HN 0.315 8.565 8.250 -0.000 0.000 0.430 273 R N 2.718 123.225 120.500 0.012 0.000 2.561 273 R HA -0.078 4.261 4.340 -0.001 0.000 0.347 273 R C -0.615 175.680 176.300 -0.009 0.000 0.916 273 R CA 0.827 56.930 56.100 0.006 0.000 1.063 273 R CB 0.125 30.428 30.300 0.006 0.000 0.916 273 R HN 0.441 8.711 8.270 -0.000 0.000 0.410 274 K N 4.534 124.926 120.400 -0.013 0.000 3.174 274 K HA 0.047 4.367 4.320 -0.001 0.000 0.207 274 K C 0.504 177.082 176.600 -0.037 0.000 1.190 274 K CA -0.251 56.022 56.287 -0.023 0.000 1.054 274 K CB 1.279 33.768 32.500 -0.018 0.000 1.154 274 K HN 0.442 8.692 8.250 -0.000 0.000 0.495 275 V N 0.219 120.105 119.914 -0.048 0.000 2.490 275 V HA -0.069 4.050 4.120 -0.001 0.000 0.238 275 V C 1.776 177.819 176.094 -0.086 0.000 1.056 275 V CA 1.120 63.377 62.300 -0.072 0.000 1.075 275 V CB 0.156 31.928 31.823 -0.084 0.000 0.746 275 V HN 0.338 8.528 8.190 -0.000 0.000 0.479 276 K N -0.073 120.276 120.400 -0.086 0.000 2.044 276 K HA -0.222 4.097 4.320 -0.001 0.000 0.210 276 K C 1.996 178.545 176.600 -0.085 0.000 1.049 276 K CA 2.144 58.372 56.287 -0.098 0.000 0.927 276 K CB -0.494 31.952 32.500 -0.090 0.000 0.713 276 K HN 0.515 8.765 8.250 -0.000 0.000 0.443 277 D N 0.329 120.690 120.400 -0.064 0.000 2.092 277 D HA -0.165 4.474 4.640 -0.001 0.000 0.193 277 D C 1.832 178.107 176.300 -0.041 0.000 0.994 277 D CA 1.085 55.053 54.000 -0.053 0.000 0.828 277 D CB -0.152 40.623 40.800 -0.042 0.000 0.963 277 D HN 0.104 8.474 8.370 -0.000 0.000 0.450 278 R N 0.058 120.539 120.500 -0.031 0.000 2.328 278 R HA 0.006 4.345 4.340 -0.001 0.000 0.207 278 R C 1.684 178.008 176.300 0.041 0.000 1.056 278 R CA 0.383 56.482 56.100 -0.002 0.000 1.016 278 R CB 0.036 30.329 30.300 -0.012 0.000 0.872 278 R HN 0.233 8.503 8.270 -0.000 0.000 0.471 279 L N -1.205 120.018 121.223 0.001 0.000 2.717 279 L HA 0.110 4.450 4.340 -0.001 0.000 0.239 279 L C 1.652 178.513 176.870 -0.015 0.000 1.086 279 L CA 0.028 54.883 54.840 0.026 0.000 0.897 279 L CB 0.100 42.109 42.059 -0.083 0.000 1.214 279 L HN 0.014 8.244 8.230 -0.000 0.000 0.508 280 K N 1.081 121.436 120.400 -0.075 0.000 2.059 280 K HA -0.236 4.083 4.320 -0.001 0.000 0.212 280 K C 2.107 178.635 176.600 -0.120 0.000 1.050 280 K CA 1.823 58.040 56.287 -0.116 0.000 0.927 280 K CB -0.304 32.134 32.500 -0.104 0.000 0.714 280 K HN 0.292 8.542 8.250 -0.000 0.000 0.447 281 A N 0.400 123.145 122.820 -0.125 0.000 2.032 281 A HA -0.192 4.127 4.320 -0.001 0.000 0.221 281 A C 1.719 179.127 177.584 -0.295 0.000 1.165 281 A CA 1.463 53.358 52.037 -0.236 0.000 0.645 281 A CB -0.522 18.273 19.000 -0.341 0.000 0.807 281 A HN 0.345 8.495 8.150 -0.000 0.000 0.453 282 Y N -1.732 118.509 120.300 -0.099 0.000 2.314 282 Y HA 0.252 4.801 4.550 -0.001 0.000 0.294 282 Y C 1.188 176.983 175.900 -0.175 0.000 1.139 282 Y CA 0.814 58.878 58.100 -0.061 0.000 1.162 282 Y CB -0.011 38.443 38.460 -0.010 0.000 1.121 282 Y HN 0.066 8.346 8.280 -0.000 0.000 0.529 283 V N 2.424 122.187 119.914 -0.252 0.000 2.364 283 V HA 0.263 4.382 4.120 -0.001 0.000 0.272 283 V C 0.407 176.229 176.094 -0.452 0.000 1.036 283 V CA -0.403 61.426 62.300 -0.785 0.000 0.880 283 V CB 1.283 32.277 31.823 -1.382 0.000 0.991 283 V HN 0.340 8.530 8.190 -0.000 0.000 0.460 284 R N 3.015 123.322 120.500 -0.322 0.000 2.057 284 R HA 0.085 4.424 4.340 -0.001 0.000 0.224 284 R C 0.538 176.733 176.300 -0.174 0.000 1.136 284 R CA 0.848 56.840 56.100 -0.179 0.000 0.968 284 R CB -0.093 30.161 30.300 -0.078 0.000 0.863 284 R HN 0.880 9.150 8.270 -0.000 0.000 0.433 285 D N 2.565 122.878 120.400 -0.146 0.000 2.570 285 D HA -0.042 4.597 4.640 -0.001 0.000 0.243 285 D C -1.416 174.802 176.300 -0.136 0.000 1.171 285 D CA -0.951 53.012 54.000 -0.061 0.000 0.879 285 D CB 1.058 41.910 40.800 0.088 0.000 1.143 285 D HN 0.011 8.381 8.370 -0.000 0.000 0.511 286 P HA -0.164 4.256 4.420 -0.000 0.000 0.223 286 P C 0.607 177.794 177.300 -0.188 0.000 1.151 286 P CA 1.026 63.997 63.100 -0.215 0.000 0.787 286 P CB 0.074 31.602 31.700 -0.286 0.000 0.788 287 Y N 1.011 121.310 120.300 -0.002 0.000 2.206 287 Y HA 0.038 4.587 4.550 -0.001 0.000 0.292 287 Y C 2.940 178.768 175.900 -0.120 0.000 1.123 287 Y CA 1.157 59.315 58.100 0.097 0.000 1.142 287 Y CB -1.559 37.051 38.460 0.251 0.000 1.006 287 Y HN -0.066 8.214 8.280 -0.000 0.000 0.518 288 A N 0.298 122.998 122.820 -0.199 0.000 1.883 288 A HA -0.197 4.122 4.320 -0.001 0.000 0.217 288 A C 2.267 179.519 177.584 -0.555 0.000 1.186 288 A CA 1.802 53.374 52.037 -0.774 0.000 0.624 288 A CB -1.235 17.325 19.000 -0.734 0.000 0.822 288 A HN 0.457 8.607 8.150 -0.000 0.000 0.444 289 L N -0.607 120.374 121.223 -0.404 0.000 1.990 289 L HA -0.268 4.072 4.340 -0.001 0.000 0.213 289 L C 2.477 179.206 176.870 -0.235 0.000 1.072 289 L CA 2.022 56.673 54.840 -0.314 0.000 0.755 289 L CB -0.608 41.303 42.059 -0.248 0.000 0.889 289 L HN 0.483 8.713 8.230 -0.000 0.000 0.432 290 D N -0.372 119.936 120.400 -0.153 0.000 2.149 290 D HA -0.217 4.422 4.640 -0.001 0.000 0.198 290 D C 2.008 178.209 176.300 -0.166 0.000 0.990 290 D CA 1.008 54.971 54.000 -0.063 0.000 0.839 290 D CB 0.051 40.930 40.800 0.132 0.000 0.948 290 D HN 0.116 8.486 8.370 -0.000 0.000 0.460 291 L N 0.447 121.438 121.223 -0.386 0.000 2.005 291 L HA -0.022 4.317 4.340 -0.001 0.000 0.207 291 L C 2.188 178.865 176.870 -0.321 0.000 1.072 291 L CA 1.453 55.967 54.840 -0.544 0.000 0.744 291 L CB -0.698 40.920 42.059 -0.734 0.000 0.895 291 L HN 0.164 8.394 8.230 -0.000 0.000 0.433 292 I N -0.059 120.319 120.570 -0.321 0.000 2.236 292 I HA -0.357 3.812 4.170 -0.001 0.000 0.249 292 I C 2.176 178.159 176.117 -0.223 0.000 1.102 292 I CA 1.969 63.117 61.300 -0.254 0.000 1.365 292 I CB -0.627 37.220 38.000 -0.255 0.000 1.051 292 I HN 0.440 8.650 8.210 -0.000 0.000 0.420 293 D N 1.052 121.337 120.400 -0.193 0.000 2.117 293 D HA -0.161 4.478 4.640 -0.001 0.000 0.198 293 D C 2.075 178.308 176.300 -0.112 0.000 0.982 293 D CA 1.347 55.261 54.000 -0.143 0.000 0.828 293 D CB 0.079 40.815 40.800 -0.107 0.000 0.967 293 D HN 0.175 8.545 8.370 -0.000 0.000 0.464 294 K N -0.542 119.799 120.400 -0.099 0.000 2.432 294 K HA 0.054 4.373 4.320 -0.001 0.000 0.196 294 K C 1.786 178.356 176.600 -0.050 0.000 1.038 294 K CA 0.228 56.486 56.287 -0.050 0.000 0.986 294 K CB 0.287 32.780 32.500 -0.012 0.000 0.782 294 K HN 0.253 8.503 8.250 -0.000 0.000 0.485 295 L N 0.115 121.278 121.223 -0.100 0.000 2.298 295 L HA 0.028 4.367 4.340 -0.001 0.000 0.209 295 L C 1.381 178.158 176.870 -0.154 0.000 1.084 295 L CA 0.470 55.253 54.840 -0.095 0.000 0.816 295 L CB 0.146 42.132 42.059 -0.122 0.000 0.967 295 L HN 0.083 8.313 8.230 -0.000 0.000 0.460 296 L N 0.327 121.391 121.223 -0.266 0.000 2.737 296 L HA 0.135 4.474 4.340 -0.001 0.000 0.236 296 L C 0.032 176.859 176.870 -0.073 0.000 1.219 296 L CA -0.493 54.062 54.840 -0.475 0.000 1.021 296 L CB 0.027 41.761 42.059 -0.543 0.000 1.291 296 L HN -0.058 8.172 8.230 -0.000 0.000 0.470 297 V N 0.733 120.677 119.914 0.049 0.000 2.655 297 V HA -0.052 4.067 4.120 -0.001 0.000 0.300 297 V C 1.496 177.676 176.094 0.143 0.000 1.044 297 V CA 0.150 62.493 62.300 0.071 0.000 1.095 297 V CB 1.799 33.620 31.823 -0.004 0.000 0.952 297 V HN 0.378 8.568 8.190 -0.000 0.000 0.485 298 L N 2.096 123.326 121.223 0.011 0.000 2.005 298 L HA -0.030 4.310 4.340 -0.001 0.000 0.207 298 L C 1.182 177.560 176.870 -0.820 0.000 1.072 298 L CA 1.140 55.866 54.840 -0.191 0.000 0.744 298 L CB -0.142 41.905 42.059 -0.019 0.000 0.895 298 L HN 0.723 8.953 8.230 -0.000 0.000 0.433 299 D N -0.199 119.686 120.400 -0.859 0.000 2.338 299 D HA 0.064 4.703 4.640 -0.001 0.000 0.255 299 D C -1.630 174.275 176.300 -0.658 0.000 1.237 299 D CA -1.951 51.263 54.000 -1.310 0.000 0.883 299 D CB 1.286 41.587 40.800 -0.832 0.000 1.087 299 D HN -0.143 8.227 8.370 -0.000 0.000 0.485 300 P HA -0.234 4.186 4.420 -0.000 0.000 0.216 300 P C 0.813 178.027 177.300 -0.144 0.000 1.167 300 P CA 1.960 64.910 63.100 -0.250 0.000 0.914 300 P CB 0.035 31.651 31.700 -0.140 0.000 0.793 301 A N -1.261 121.489 122.820 -0.115 0.000 2.248 301 A HA -0.157 4.162 4.320 -0.001 0.000 0.210 301 A C 1.971 179.527 177.584 -0.047 0.000 1.174 301 A CA 1.165 53.173 52.037 -0.047 0.000 0.750 301 A CB -1.011 17.986 19.000 -0.003 0.000 0.780 301 A HN 0.289 8.439 8.150 -0.000 0.000 0.478 302 Q N -1.337 118.407 119.800 -0.093 0.000 2.317 302 Q HA 0.142 4.481 4.340 -0.001 0.000 0.220 302 Q C 0.902 176.879 176.000 -0.039 0.000 0.873 302 Q CA -0.303 55.465 55.803 -0.059 0.000 0.936 302 Q CB 0.478 29.169 28.738 -0.079 0.000 1.105 302 Q HN 0.594 8.864 8.270 -0.000 0.000 0.520 303 R N 1.284 121.755 120.500 -0.048 0.000 2.539 303 R HA 0.217 4.556 4.340 -0.001 0.000 0.275 303 R C -0.282 176.033 176.300 0.024 0.000 1.077 303 R CA -0.152 55.944 56.100 -0.005 0.000 1.097 303 R CB 0.494 30.801 30.300 0.013 0.000 1.018 303 R HN 0.110 8.380 8.270 -0.000 0.000 0.483 304 I N 3.305 123.899 120.570 0.040 0.000 2.754 304 I HA -0.056 4.114 4.170 -0.001 0.000 0.285 304 I C -0.151 176.017 176.117 0.085 0.000 1.166 304 I CA 0.063 61.402 61.300 0.066 0.000 1.417 304 I CB 0.559 38.601 38.000 0.070 0.000 1.382 304 I HN 0.779 8.989 8.210 -0.000 0.000 0.588 305 D N 4.019 124.484 120.400 0.108 0.000 2.385 305 D HA 0.237 4.876 4.640 -0.001 0.000 0.254 305 D C 0.655 177.056 176.300 0.169 0.000 1.053 305 D CA -0.607 53.475 54.000 0.135 0.000 0.992 305 D CB 1.291 42.170 40.800 0.133 0.000 1.145 305 D HN 0.486 8.856 8.370 -0.000 0.000 0.523 306 S N 0.270 116.098 115.700 0.213 0.000 2.359 306 S HA -0.248 4.222 4.470 -0.001 0.000 0.224 306 S C 1.325 176.042 174.600 0.195 0.000 1.035 306 S CA 1.633 59.962 58.200 0.216 0.000 1.018 306 S CB -0.620 62.750 63.200 0.283 0.000 0.876 306 S HN 0.755 9.065 8.310 -0.000 0.000 0.448 307 D N 1.422 121.978 120.400 0.260 0.000 2.120 307 D HA -0.170 4.469 4.640 -0.001 0.000 0.191 307 D C 1.536 177.917 176.300 0.136 0.000 0.994 307 D CA 1.701 55.804 54.000 0.172 0.000 0.838 307 D CB -0.209 40.738 40.800 0.245 0.000 0.976 307 D HN 0.157 8.527 8.370 -0.000 0.000 0.447 308 D N -0.385 120.110 120.400 0.158 0.000 2.149 308 D HA -0.150 4.489 4.640 -0.001 0.000 0.198 308 D C 1.941 178.375 176.300 0.224 0.000 0.990 308 D CA 1.253 55.355 54.000 0.170 0.000 0.839 308 D CB -0.558 40.334 40.800 0.152 0.000 0.948 308 D HN 0.328 8.698 8.370 -0.000 0.000 0.460 309 A N 0.449 123.393 122.820 0.206 0.000 1.933 309 A HA -0.120 4.199 4.320 -0.001 0.000 0.218 309 A C 2.331 180.116 177.584 0.335 0.000 1.175 309 A CA 0.860 53.051 52.037 0.256 0.000 0.628 309 A CB -0.680 18.436 19.000 0.194 0.000 0.814 309 A HN 0.237 8.387 8.150 -0.000 0.000 0.444 310 L N -0.754 120.555 121.223 0.143 0.000 2.240 310 L HA -0.071 4.268 4.340 -0.001 0.000 0.211 310 L C 2.012 179.029 176.870 0.244 0.000 1.106 310 L CA 1.106 55.902 54.840 -0.073 0.000 0.793 310 L CB -0.228 41.730 42.059 -0.167 0.000 0.927 310 L HN 0.447 8.677 8.230 -0.000 0.000 0.446 311 N N -1.165 117.747 118.700 0.354 0.000 2.336 311 N HA -0.105 4.634 4.740 -0.001 0.000 0.189 311 N C 0.616 176.428 175.510 0.504 0.000 1.113 311 N CA -0.004 53.317 53.050 0.451 0.000 0.858 311 N CB 0.011 38.622 38.487 0.207 0.000 0.970 311 N HN 0.203 8.583 8.380 -0.000 0.000 0.471 312 H N 0.584 119.929 119.070 0.457 0.000 2.815 312 H HA -0.002 4.553 4.556 -0.001 0.000 0.350 312 H C 0.170 175.749 175.328 0.420 0.000 1.080 312 H CA 0.459 56.745 56.048 0.396 0.000 1.433 312 H CB 1.025 31.009 29.762 0.370 0.000 1.432 312 H HN 0.184 8.464 8.280 -0.000 0.000 0.592 313 D N 4.453 124.734 120.400 -0.199 0.000 2.228 313 D HA -0.215 4.424 4.640 -0.001 0.000 0.203 313 D C 1.826 178.027 176.300 -0.165 0.000 0.988 313 D CA 0.736 54.653 54.000 -0.139 0.000 0.864 313 D CB -0.288 40.320 40.800 -0.320 0.000 0.928 313 D HN 0.543 8.913 8.370 -0.000 0.000 0.469 314 F N 1.121 121.067 119.950 -0.007 0.000 2.085 314 F HA -0.273 4.253 4.527 -0.001 0.000 0.299 314 F C 1.706 177.269 175.800 -0.396 0.000 1.096 314 F CA 1.396 59.303 58.000 -0.154 0.000 1.227 314 F CB -0.736 38.182 39.000 -0.137 0.000 0.983 314 F HN -0.107 8.193 8.300 -0.000 0.000 0.482 315 F N -2.290 117.420 119.950 -0.400 0.000 2.811 315 F HA 0.028 4.555 4.527 -0.001 0.000 0.301 315 F C 0.313 175.482 175.800 -1.051 0.000 1.151 315 F CA 0.168 57.640 58.000 -0.880 0.000 1.412 315 F CB -0.548 37.881 39.000 -0.952 0.000 1.113 315 F HN -0.067 8.233 8.300 -0.000 0.000 0.579 316 W N -0.398 120.850 121.300 -0.087 0.000 1.645 316 W HA 0.409 5.069 4.660 -0.001 0.000 0.315 316 W C -0.154 176.257 176.519 -0.180 0.000 0.870 316 W CA -0.216 57.070 57.345 -0.099 0.000 2.483 316 W CB 0.222 29.646 29.460 -0.060 0.000 1.339 316 W HN -0.376 7.804 8.180 -0.000 0.000 0.549 317 S N 0.209 115.841 115.700 -0.113 0.000 2.599 317 S HA 0.336 4.805 4.470 -0.001 0.000 0.287 317 S C -0.756 173.804 174.600 -0.066 0.000 1.105 317 S CA -0.843 57.276 58.200 -0.135 0.000 0.899 317 S CB 1.962 64.958 63.200 -0.340 0.000 1.100 317 S HN -0.092 8.218 8.310 -0.000 0.000 0.482 318 D N 3.158 123.556 120.400 -0.003 0.000 2.351 318 D HA 0.368 5.007 4.640 -0.001 0.000 0.251 318 D C -2.190 174.129 176.300 0.032 0.000 1.137 318 D CA -0.853 53.155 54.000 0.013 0.000 0.879 318 D CB 0.304 41.124 40.800 0.034 0.000 1.181 318 D HN 0.166 8.536 8.370 -0.000 0.000 0.448 319 P HA 0.223 4.643 4.420 -0.000 0.000 0.284 319 P C -0.090 177.173 177.300 -0.061 0.000 1.253 319 P CA -0.734 62.362 63.100 -0.007 0.000 0.800 319 P CB 0.661 32.368 31.700 0.011 0.000 0.961 320 M N 3.060 122.627 119.600 -0.055 0.000 2.240 320 M HA 0.259 4.738 4.480 -0.001 0.000 0.333 320 M C -2.110 174.124 176.300 -0.110 0.000 1.110 320 M CA -2.727 52.518 55.300 -0.092 0.000 1.173 320 M CB -0.863 31.711 32.600 -0.043 0.000 1.458 320 M HN 0.155 8.445 8.290 -0.000 0.000 0.458 321 P HA 0.043 4.463 4.420 -0.000 0.000 0.264 321 P C -0.687 176.569 177.300 -0.074 0.000 1.193 321 P CA 0.018 63.039 63.100 -0.131 0.000 0.763 321 P CB 0.250 31.860 31.700 -0.149 0.000 0.810 322 S N 1.765 117.436 115.700 -0.048 0.000 2.621 322 S HA 0.455 4.924 4.470 -0.001 0.000 0.302 322 S C -0.094 174.498 174.600 -0.014 0.000 1.093 322 S CA -0.854 57.332 58.200 -0.023 0.000 1.017 322 S CB 1.100 64.295 63.200 -0.009 0.000 1.077 322 S HN 0.193 8.503 8.310 -0.000 0.000 0.517 323 D N 0.243 120.639 120.400 -0.007 0.000 2.369 323 D HA 0.359 4.998 4.640 -0.001 0.000 0.241 323 D C -0.625 175.684 176.300 0.014 0.000 1.271 323 D CA 0.074 54.075 54.000 0.001 0.000 0.942 323 D CB 0.209 41.010 40.800 0.001 0.000 1.129 323 D HN 0.384 8.754 8.370 -0.000 0.000 0.476 324 L N 0.899 122.135 121.223 0.022 0.000 2.325 324 L HA 0.327 4.666 4.340 -0.001 0.000 0.281 324 L C 1.054 177.939 176.870 0.025 0.000 1.004 324 L CA 0.111 54.973 54.840 0.036 0.000 0.823 324 L CB 1.585 43.680 42.059 0.061 0.000 1.236 324 L HN 0.349 8.579 8.230 -0.000 0.000 0.415 325 K N 1.239 121.646 120.400 0.011 0.000 2.603 325 K HA 0.185 4.505 4.320 -0.001 0.000 0.216 325 K C 1.124 177.710 176.600 -0.024 0.000 1.562 325 K CA 0.201 56.489 56.287 0.001 0.000 1.012 325 K CB 1.092 33.593 32.500 0.002 0.000 1.280 325 K HN 0.648 8.898 8.250 -0.000 0.000 0.620 326 G N 3.389 112.162 108.800 -0.044 0.000 3.325 326 G HA2 0.145 4.104 3.960 -0.001 0.000 0.242 326 G HA3 0.145 4.104 3.960 -0.001 0.000 0.242 326 G C 0.248 175.055 174.900 -0.156 0.000 1.120 326 G CA 0.256 45.297 45.100 -0.099 0.000 1.778 326 G HN 0.133 8.423 8.290 -0.000 0.000 0.610 327 M N 0.000 119.532 119.600 -0.113 0.000 2.572 327 M HA 0.000 4.479 4.480 -0.001 0.000 0.227 327 M CA 0.000 55.199 55.300 -0.169 0.000 0.988 327 M CB 0.000 32.429 32.600 -0.285 0.000 1.302 327 M HN 0.000 8.290 8.290 -0.000 0.000 0.411