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 1vkg_1_B DATA FIRST_RESID 15 DATA SEQUENCE VPVYIYSPEY VSMCDSLAKI PKRASMVHSL IEAYALHKQM RIVKPKVASM DATA SEQUENCE EEMATFHTDA YLQHLQKVSQ EGDDXXXXXX XXXXXXXXXA TEGIFDYAAA DATA SEQUENCE IGGATITAAQ CLIDGMCKVA INWSGGWHHA KKDEASGFCY LNDAVLGILR DATA SEQUENCE LRRKFERILY VDLDLHHGDG VEDAFSFTSK VMTVSLHKFS PGFFPGTGDV DATA SEQUENCE SDVGLGKGRY YSVNVPIQDG IQDEKYYQIc ESVLKEVYQA FNPKAVVLQL DATA SEQUENCE GADTIAGDPM CSFNMTPVGI GKcLKYILQW QLATLILGGG GYNLANTARC DATA SEQUENCE WTYLTGVILG KTLSSEIPDH EFFTAYGPDY VLEITPSCRP DRNEPHRIQQ DATA SEQUENCE ILNYIKGNLK HVV 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 15 V HA 0.000 4.123 4.120 0.004 0.000 0.244 15 V C 0.000 176.103 176.094 0.015 0.000 1.182 15 V CA 0.000 62.306 62.300 0.010 0.000 1.235 15 V CB 0.000 31.828 31.823 0.008 0.000 1.184 16 P HA 0.013 4.571 4.420 0.005 -0.135 0.270 16 P C -1.285 176.041 177.300 0.043 0.000 1.221 16 P CA 0.103 63.211 63.100 0.015 0.000 0.788 16 P CB 0.546 32.250 31.700 0.005 0.000 0.904 17 V N -1.004 118.937 119.914 0.046 0.000 2.667 17 V HA 0.601 4.995 4.120 0.102 -0.213 0.308 17 V C -1.089 175.088 176.094 0.137 0.000 1.048 17 V CA -0.801 61.546 62.300 0.078 0.000 0.928 17 V CB 2.892 34.734 31.823 0.032 0.000 1.004 17 V HN -0.274 7.926 8.190 0.017 0.000 0.444 18 Y N 7.049 127.361 120.300 0.020 0.000 2.326 18 Y HA 0.334 4.883 4.550 -0.001 0.000 0.329 18 Y C -2.275 173.669 175.900 0.074 0.000 0.973 18 Y CA -2.122 56.009 58.100 0.052 0.000 1.162 18 Y CB 3.369 41.900 38.460 0.117 0.000 1.147 18 Y HN 1.068 9.487 8.280 0.232 0.000 0.456 19 I N 9.667 130.103 120.570 -0.222 0.000 2.269 19 I HA 0.370 4.685 4.170 -0.144 -0.231 0.293 19 I C -1.396 174.563 176.117 -0.264 0.000 1.106 19 I CA -1.841 59.331 61.300 -0.213 0.000 1.248 19 I CB -1.832 36.045 38.000 -0.205 0.000 1.444 19 I HN -0.088 7.987 8.210 -0.225 0.000 0.497 20 Y N 9.506 129.599 120.300 -0.344 0.000 2.536 20 Y HA 0.154 4.595 4.550 -0.182 0.000 0.347 20 Y C -2.679 173.160 175.900 -0.102 0.000 1.000 20 Y CA -1.038 56.894 58.100 -0.281 0.000 1.051 20 Y CB 4.433 42.631 38.460 -0.436 0.000 1.259 20 Y HN -0.074 8.161 8.280 -0.075 0.000 0.468 21 S N 3.852 119.019 115.700 -0.888 0.000 2.582 21 S HA 0.407 4.559 4.470 -0.531 0.000 0.287 21 S C -2.211 171.950 174.600 -0.732 0.000 1.146 21 S CA -3.112 54.728 58.200 -0.601 0.000 0.941 21 S CB 1.646 64.705 63.200 -0.234 0.000 1.115 21 S HN 0.181 7.797 8.310 -1.157 0.000 0.458 22 P HA -0.312 3.973 4.420 -0.224 0.000 0.219 22 P C 0.712 177.934 177.300 -0.130 0.000 1.158 22 P CA 2.809 65.760 63.100 -0.250 0.000 0.895 22 P CB 0.311 31.965 31.700 -0.077 0.000 0.792 23 E N -3.539 116.600 120.200 -0.103 0.000 2.150 23 E HA -0.271 4.071 4.350 -0.014 0.000 0.193 23 E C 2.363 178.967 176.600 0.007 0.000 0.985 23 E CA 2.815 59.196 56.400 -0.032 0.000 0.814 23 E CB -0.884 28.801 29.700 -0.025 0.000 0.752 23 E HN 0.191 8.457 8.360 -0.133 0.014 0.466 24 Y N 0.961 121.146 120.300 -0.191 0.000 2.243 24 Y HA -0.249 4.213 4.550 -0.148 0.000 0.293 24 Y C 1.071 176.895 175.900 -0.127 0.000 1.124 24 Y CA 2.625 60.620 58.100 -0.176 0.000 1.159 24 Y CB 0.015 38.340 38.460 -0.223 0.000 1.008 24 Y HN -0.577 7.525 8.280 -0.042 0.153 0.527 25 V N 0.342 120.146 119.914 -0.183 0.000 2.307 25 V HA -0.599 3.365 4.120 -0.259 0.000 0.245 25 V C 1.761 177.821 176.094 -0.057 0.000 1.045 25 V CA 4.505 66.718 62.300 -0.145 0.000 1.024 25 V CB -0.305 31.519 31.823 0.002 0.000 0.651 25 V HN 0.216 8.304 8.190 -0.170 0.000 0.449 26 S N -0.090 115.603 115.700 -0.011 0.000 2.370 26 S HA -0.418 4.092 4.470 0.067 0.000 0.226 26 S C 1.871 176.495 174.600 0.039 0.000 1.033 26 S CA 3.611 61.833 58.200 0.037 0.000 1.011 26 S CB -0.173 63.051 63.200 0.040 0.000 0.852 26 S HN -0.048 8.247 8.310 -0.024 0.000 0.457 27 M N 3.276 122.877 119.600 0.001 0.000 2.126 27 M HA -0.354 4.181 4.480 0.093 0.000 0.259 27 M C 1.659 178.005 176.300 0.075 0.000 1.073 27 M CA 2.558 57.874 55.300 0.027 0.000 1.103 27 M CB -0.111 32.467 32.600 -0.037 0.000 1.284 27 M HN -0.596 7.602 8.290 -0.025 0.077 0.420 28 C N -3.813 115.390 119.300 -0.163 0.000 2.421 28 C HA -0.269 4.044 4.460 -0.244 0.000 0.296 28 C C 0.509 175.604 174.990 0.176 0.000 1.470 28 C CA 2.685 61.635 59.018 -0.114 0.000 1.779 28 C CB -1.236 26.276 27.740 -0.379 0.000 1.715 28 C HN 0.040 8.084 8.230 -0.310 0.000 0.564 29 D N -3.396 117.093 120.400 0.148 0.000 2.402 29 D HA 0.178 4.917 4.640 0.165 0.000 0.216 29 D C -0.596 175.795 176.300 0.152 0.000 1.128 29 D CA 1.023 55.114 54.000 0.151 0.000 0.833 29 D CB 0.484 41.355 40.800 0.119 0.000 0.971 29 D HN -0.605 7.631 8.370 0.103 0.196 0.503 30 S N -2.114 113.694 115.700 0.179 0.000 3.393 30 S HA 0.154 4.671 4.470 0.079 0.000 0.209 30 S C 0.026 174.621 174.600 -0.008 0.000 0.897 30 S CA 1.049 59.302 58.200 0.088 0.000 0.825 30 S CB 2.057 65.308 63.200 0.086 0.000 0.898 30 S HN -0.474 7.952 8.310 0.289 0.057 0.615 31 L N 3.576 124.734 121.223 -0.108 0.000 4.094 31 L HA -0.425 3.801 4.340 -0.189 0.000 0.466 31 L C 1.003 177.784 176.870 -0.149 0.000 0.991 31 L CA 0.859 55.552 54.840 -0.244 0.000 0.821 31 L CB -1.457 40.240 42.059 -0.604 0.000 1.201 31 L HN 0.226 8.431 8.230 -0.041 0.000 0.757 32 A N 3.687 126.455 122.820 -0.087 0.000 1.257 32 A HA -0.481 3.820 4.320 -0.031 0.000 0.399 32 A C -0.124 177.445 177.584 -0.026 0.000 5.515 32 A CA 2.735 54.742 52.037 -0.051 0.000 1.068 32 A CB -1.031 17.931 19.000 -0.064 0.000 1.218 32 A HN 0.591 8.694 8.150 -0.079 0.000 0.660 33 K N -1.099 119.283 120.400 -0.031 0.000 2.498 33 K HA 0.042 4.377 4.320 0.024 0.000 0.207 33 K C -0.895 175.736 176.600 0.051 0.000 1.033 33 K CA -1.104 55.192 56.287 0.014 0.000 1.138 33 K CB 0.931 33.438 32.500 0.012 0.000 0.860 33 K HN -0.110 8.065 8.250 -0.064 0.036 0.490 34 I N 3.506 124.094 120.570 0.029 0.000 2.291 34 I HA 0.252 4.507 4.170 0.141 0.000 0.290 34 I C -2.422 173.759 176.117 0.108 0.000 1.050 34 I CA -4.126 57.223 61.300 0.083 0.000 1.245 34 I CB 0.875 38.869 38.000 -0.010 0.000 1.405 34 I HN -0.471 7.558 8.210 -0.009 0.176 0.478 35 P HA 0.244 4.722 4.420 0.097 0.000 0.282 35 P C 0.483 177.856 177.300 0.121 0.000 1.249 35 P CA -0.926 62.240 63.100 0.111 0.000 0.806 35 P CB 0.986 32.748 31.700 0.103 0.000 0.984 36 K N 3.267 123.731 120.400 0.108 0.000 3.007 36 K HA -0.293 4.233 4.320 0.110 -0.140 0.240 36 K C 1.076 177.694 176.600 0.029 0.000 0.807 36 K CA 1.413 57.755 56.287 0.093 0.000 0.993 36 K CB -2.202 30.375 32.500 0.129 0.000 0.856 36 K HN 0.487 8.801 8.250 0.108 0.000 0.449 37 R N -0.045 120.490 120.500 0.059 0.000 2.105 37 R HA -0.383 3.930 4.340 -0.044 0.000 0.239 37 R C 1.233 177.560 176.300 0.044 0.000 1.135 37 R CA 3.223 59.340 56.100 0.028 0.000 0.967 37 R CB -0.216 30.139 30.300 0.091 0.000 0.861 37 R HN 0.319 8.549 8.270 0.105 0.103 0.442 38 A N -2.182 120.692 122.820 0.091 0.000 1.933 38 A HA -0.227 4.190 4.320 0.162 0.000 0.218 38 A C 1.994 179.633 177.584 0.091 0.000 1.175 38 A CA 3.088 55.188 52.037 0.105 0.000 0.628 38 A CB -0.902 18.128 19.000 0.051 0.000 0.814 38 A HN -0.178 8.090 8.150 0.110 -0.052 0.444 39 S N -1.432 114.281 115.700 0.021 0.000 2.406 39 S HA -0.215 4.380 4.470 0.208 0.000 0.228 39 S C 1.886 176.325 174.600 -0.270 0.000 1.020 39 S CA 3.150 61.365 58.200 0.025 0.000 0.965 39 S CB -0.449 62.838 63.200 0.144 0.000 0.798 39 S HN -0.425 8.188 8.310 0.010 -0.297 0.488 40 M N 1.981 121.261 119.600 -0.535 0.000 2.065 40 M HA -0.446 3.437 4.480 -0.996 0.000 0.259 40 M C 2.008 178.227 176.300 -0.135 0.000 1.069 40 M CA 4.486 59.458 55.300 -0.547 0.000 1.110 40 M CB -0.063 32.329 32.600 -0.347 0.000 1.328 40 M HN -0.793 7.239 8.290 -0.408 0.013 0.405 41 V N -1.196 118.707 119.914 -0.017 0.000 2.295 41 V HA -0.473 3.663 4.120 0.026 0.000 0.246 41 V C 2.014 178.194 176.094 0.144 0.000 1.049 41 V CA 4.697 67.046 62.300 0.081 0.000 1.024 41 V CB -0.497 31.451 31.823 0.208 0.000 0.648 41 V HN -0.342 7.836 8.190 -0.019 0.000 0.447 42 H N 1.017 120.172 119.070 0.140 0.000 2.270 42 H HA -0.173 4.545 4.556 0.270 0.000 0.299 42 H C 2.381 177.734 175.328 0.041 0.000 1.077 42 H CA 2.847 59.000 56.048 0.175 0.000 1.294 42 H CB -0.012 29.887 29.762 0.229 0.000 1.371 42 H HN -0.452 7.995 8.280 0.277 0.000 0.491 43 S N -0.574 115.101 115.700 -0.041 0.000 2.389 43 S HA -0.351 4.040 4.470 -0.131 0.000 0.231 43 S C 2.237 176.652 174.600 -0.309 0.000 1.052 43 S CA 3.684 61.843 58.200 -0.069 0.000 1.053 43 S CB -0.471 62.956 63.200 0.378 0.000 0.886 43 S HN 0.207 8.504 8.310 0.149 0.102 0.456 44 L N 1.481 122.519 121.223 -0.309 0.000 2.095 44 L HA -0.118 3.845 4.340 -0.629 0.000 0.204 44 L C 1.498 178.317 176.870 -0.084 0.000 1.080 44 L CA 2.712 57.357 54.840 -0.326 0.000 0.759 44 L CB 0.040 42.004 42.059 -0.158 0.000 0.914 44 L HN -0.369 7.750 8.230 -0.170 0.009 0.439 45 I N -0.568 119.940 120.570 -0.103 0.000 2.226 45 I HA -0.680 3.477 4.170 -0.020 0.000 0.245 45 I C 1.573 177.623 176.117 -0.112 0.000 1.100 45 I CA 4.749 66.005 61.300 -0.074 0.000 1.374 45 I CB -0.384 37.581 38.000 -0.058 0.000 1.057 45 I HN -0.065 8.086 8.210 -0.098 0.000 0.413 46 E N 0.363 120.321 120.200 -0.404 0.000 2.031 46 E HA -0.370 3.385 4.350 -0.992 0.000 0.193 46 E C 2.950 179.433 176.600 -0.195 0.000 0.994 46 E CA 3.067 59.066 56.400 -0.669 0.000 0.800 46 E CB -0.052 29.023 29.700 -1.043 0.000 0.752 46 E HN 0.436 8.378 8.360 -0.502 0.118 0.447 47 A N -0.052 122.664 122.820 -0.172 0.000 1.917 47 A HA -0.245 4.037 4.320 -0.063 0.000 0.219 47 A C 1.393 178.949 177.584 -0.047 0.000 1.182 47 A CA 2.491 54.473 52.037 -0.091 0.000 0.633 47 A CB -0.320 18.585 19.000 -0.159 0.000 0.819 47 A HN -0.183 7.635 8.150 -0.264 0.174 0.448 48 Y N -4.847 115.417 120.300 -0.060 0.000 2.529 48 Y HA -0.250 4.295 4.550 -0.009 0.000 0.290 48 Y C -0.991 174.914 175.900 0.008 0.000 1.177 48 Y CA 0.830 58.918 58.100 -0.019 0.000 1.305 48 Y CB 0.007 38.451 38.460 -0.025 0.000 1.047 48 Y HN -0.334 7.886 8.280 0.207 0.185 0.522 49 A N -3.836 119.097 122.820 0.188 0.000 2.860 49 A HA -0.374 4.298 4.320 0.415 -0.104 0.267 49 A C 0.044 177.662 177.584 0.057 0.000 1.421 49 A CA 0.985 53.126 52.037 0.172 0.000 0.831 49 A CB -2.501 16.521 19.000 0.036 0.000 1.041 49 A HN -0.104 7.900 8.150 0.168 0.247 0.623 50 L N -3.314 117.986 121.223 0.129 0.000 2.056 50 L HA -0.409 3.920 4.340 -0.019 0.000 0.207 50 L C 1.759 178.593 176.870 -0.059 0.000 1.078 50 L CA 3.198 58.041 54.840 0.004 0.000 0.749 50 L CB -0.747 41.298 42.059 -0.023 0.000 0.901 50 L HN 0.041 8.348 8.230 0.185 0.034 0.433 51 H N -1.940 117.024 119.070 -0.177 0.000 2.400 51 H HA -0.364 4.014 4.556 -0.297 0.000 0.295 51 H C 2.339 177.638 175.328 -0.049 0.000 1.118 51 H CA 2.967 58.911 56.048 -0.174 0.000 1.256 51 H CB -1.359 28.342 29.762 -0.102 0.000 1.365 51 H HN -0.367 8.072 8.280 0.265 0.000 0.502 52 K N -2.125 117.912 120.400 -0.606 0.000 2.211 52 K HA -0.234 3.901 4.320 -0.310 0.000 0.204 52 K C 1.402 177.907 176.600 -0.157 0.000 1.047 52 K CA 1.368 57.425 56.287 -0.384 0.000 0.935 52 K CB -0.959 31.308 32.500 -0.388 0.000 0.728 52 K HN -0.576 7.045 8.250 -1.017 0.019 0.452 53 Q N -3.322 116.404 119.800 -0.123 0.000 2.246 53 Q HA 0.094 4.403 4.340 -0.052 0.000 0.202 53 Q C -0.551 175.431 176.000 -0.030 0.000 0.883 53 Q CA -0.031 55.736 55.803 -0.061 0.000 0.952 53 Q CB 1.037 29.741 28.738 -0.056 0.000 1.078 53 Q HN -0.073 7.930 8.270 -0.151 0.176 0.493 54 M N -3.049 116.543 119.600 -0.014 0.000 2.821 54 M HA 0.301 4.866 4.480 0.025 -0.069 0.294 54 M C -1.411 174.928 176.300 0.066 0.000 1.195 54 M CA -1.329 53.991 55.300 0.033 0.000 0.784 54 M CB 4.026 36.659 32.600 0.055 0.000 1.755 54 M HN -0.386 7.701 8.290 -0.029 0.186 0.477 55 R N 0.759 121.315 120.500 0.094 0.000 2.338 55 R HA 0.293 4.683 4.340 0.083 0.000 0.317 55 R C -2.037 174.356 176.300 0.155 0.000 0.968 55 R CA -1.293 54.864 56.100 0.095 0.000 0.849 55 R CB 1.851 32.191 30.300 0.065 0.000 1.128 55 R HN 0.507 8.731 8.270 0.099 0.105 0.448 56 I N 6.263 126.936 120.570 0.173 0.000 2.331 56 I HA 0.555 5.114 4.170 0.294 -0.213 0.292 56 I C -0.463 175.732 176.117 0.131 0.000 0.998 56 I CA -0.657 60.781 61.300 0.231 0.000 1.267 56 I CB 1.050 39.225 38.000 0.293 0.000 1.386 56 I HN 0.369 8.665 8.210 0.144 0.000 0.476 57 V N 8.173 128.138 119.914 0.084 0.000 2.735 57 V HA 0.268 4.406 4.120 0.031 0.000 0.310 57 V C -1.995 174.083 176.094 -0.026 0.000 1.061 57 V CA -1.985 60.328 62.300 0.022 0.000 0.913 57 V CB 4.236 36.061 31.823 0.003 0.000 1.005 57 V HN 0.890 9.131 8.190 0.085 0.000 0.428 58 K N 6.669 127.043 120.400 -0.042 0.000 2.227 58 K HA 0.601 5.051 4.320 -0.120 -0.203 0.280 58 K C -1.225 175.288 176.600 -0.145 0.000 1.041 58 K CA -3.437 52.792 56.287 -0.096 0.000 0.905 58 K CB 1.176 33.638 32.500 -0.064 0.000 1.068 58 K HN 0.245 8.481 8.250 -0.022 0.000 0.470 59 P HA -0.018 4.263 4.420 -0.232 0.000 0.274 59 P C -1.344 175.832 177.300 -0.206 0.000 1.260 59 P CA -0.256 62.669 63.100 -0.292 0.000 0.793 59 P CB 0.744 32.093 31.700 -0.585 0.000 1.048 60 K N -2.656 117.637 120.400 -0.179 0.000 2.313 60 K HA 0.268 4.526 4.320 -0.102 0.000 0.235 60 K C -1.044 175.478 176.600 -0.129 0.000 1.035 60 K CA -1.334 54.883 56.287 -0.117 0.000 0.868 60 K CB 2.180 34.633 32.500 -0.078 0.000 1.232 60 K HN -0.338 7.796 8.250 -0.195 0.000 0.459 61 V N -1.708 118.152 119.914 -0.089 0.000 2.966 61 V HA 0.023 4.077 4.120 -0.110 0.000 0.317 61 V C -0.097 175.954 176.094 -0.071 0.000 1.070 61 V CA -1.101 61.147 62.300 -0.087 0.000 1.008 61 V CB 1.824 33.610 31.823 -0.062 0.000 1.070 61 V HN 0.129 8.278 8.190 -0.068 0.000 0.457 62 A N 2.488 125.260 122.820 -0.080 0.000 2.293 62 A HA 0.385 4.870 4.320 -0.031 -0.184 0.302 62 A C -0.872 176.689 177.584 -0.038 0.000 1.119 62 A CA -1.421 50.586 52.037 -0.050 0.000 0.823 62 A CB 2.049 21.019 19.000 -0.050 0.000 1.097 62 A HN 0.012 7.981 8.150 -0.106 0.117 0.491 63 S N 1.109 116.810 115.700 0.002 0.000 2.651 63 S HA 0.325 4.816 4.470 0.035 0.000 0.291 63 S C 1.076 175.714 174.600 0.062 0.000 1.141 63 S CA -1.149 57.070 58.200 0.032 0.000 1.027 63 S CB 2.320 65.540 63.200 0.034 0.000 1.043 63 S HN -0.014 8.524 8.310 0.010 -0.222 0.530 64 M N 2.904 122.568 119.600 0.106 0.000 2.116 64 M HA -0.435 4.161 4.480 0.193 0.000 0.255 64 M C 0.941 177.310 176.300 0.115 0.000 1.075 64 M CA 3.707 59.095 55.300 0.146 0.000 1.087 64 M CB -0.890 31.793 32.600 0.139 0.000 1.340 64 M HN 0.822 9.179 8.290 0.113 0.000 0.402 65 E N -4.041 116.211 120.200 0.088 0.000 2.072 65 E HA -0.352 4.049 4.350 0.085 0.000 0.191 65 E C 2.329 178.982 176.600 0.088 0.000 0.985 65 E CA 3.033 59.481 56.400 0.080 0.000 0.801 65 E CB -1.176 28.559 29.700 0.059 0.000 0.750 65 E HN 0.579 8.971 8.360 0.077 0.014 0.452 66 E N 0.058 120.305 120.200 0.078 0.000 2.051 66 E HA -0.248 4.152 4.350 0.084 0.000 0.192 66 E C 3.066 179.743 176.600 0.128 0.000 0.991 66 E CA 2.317 58.768 56.400 0.084 0.000 0.799 66 E CB -0.113 29.621 29.700 0.055 0.000 0.748 66 E HN -0.866 7.441 8.360 0.066 0.093 0.449 67 M N -0.389 119.289 119.600 0.130 0.000 2.117 67 M HA -0.339 4.284 4.480 0.238 0.000 0.262 67 M C 2.087 178.567 176.300 0.300 0.000 1.065 67 M CA 3.788 59.210 55.300 0.204 0.000 1.114 67 M CB -0.054 32.615 32.600 0.116 0.000 1.361 67 M HN 0.310 8.658 8.290 0.095 0.000 0.408 68 A N -3.089 119.858 122.820 0.213 0.000 2.131 68 A HA -0.148 4.507 4.320 0.211 -0.208 0.220 68 A C 0.910 178.585 177.584 0.152 0.000 1.158 68 A CA 2.020 54.166 52.037 0.181 0.000 0.665 68 A CB -0.832 18.243 19.000 0.124 0.000 0.795 68 A HN 0.001 8.144 8.150 0.169 0.109 0.460 69 T N -1.069 113.588 114.554 0.172 0.000 2.737 69 T HA -0.319 4.098 4.350 0.112 0.000 0.269 69 T C 0.643 175.455 174.700 0.187 0.000 1.040 69 T CA 3.161 65.355 62.100 0.156 0.000 1.142 69 T CB 0.190 69.155 68.868 0.162 0.000 0.861 69 T HN -0.517 7.631 8.240 0.182 0.201 0.456 70 F N -1.209 118.773 119.950 0.052 0.000 2.667 70 F HA 0.148 4.601 4.527 -0.124 0.000 0.288 70 F C -0.666 175.016 175.800 -0.197 0.000 1.086 70 F CA 0.125 58.061 58.000 -0.107 0.000 1.297 70 F CB 2.853 41.744 39.000 -0.181 0.000 1.059 70 F HN -0.411 7.964 8.300 0.340 0.129 0.624 71 H N -1.547 117.525 119.070 0.003 0.000 2.508 71 H HA 0.291 4.696 4.556 -0.313 -0.037 0.344 71 H C 0.274 175.601 175.328 -0.002 0.000 1.192 71 H CA -0.098 55.918 56.048 -0.053 0.000 1.290 71 H CB 1.534 31.440 29.762 0.240 0.000 1.571 71 H HN -0.202 8.214 8.280 0.410 0.109 0.555 72 T N -1.623 113.012 114.554 0.134 0.000 2.832 72 T HA 0.102 4.479 4.350 0.045 0.000 0.296 72 T C 1.117 175.924 174.700 0.178 0.000 0.968 72 T CA -0.733 61.429 62.100 0.104 0.000 1.107 72 T CB 0.837 69.742 68.868 0.061 0.000 0.916 72 T HN 0.102 8.424 8.240 0.136 0.000 0.517 73 D N 6.260 126.730 120.400 0.117 0.000 2.203 73 D HA -0.499 4.214 4.640 0.123 0.000 0.199 73 D C 1.864 178.221 176.300 0.095 0.000 0.997 73 D CA 4.706 58.767 54.000 0.103 0.000 0.863 73 D CB -0.429 40.409 40.800 0.064 0.000 0.928 73 D HN 0.679 9.099 8.370 0.082 0.000 0.458 74 A N -0.768 122.112 122.820 0.100 0.000 1.858 74 A HA -0.168 4.189 4.320 0.061 0.000 0.216 74 A C 1.698 179.361 177.584 0.133 0.000 1.190 74 A CA 2.859 54.952 52.037 0.092 0.000 0.617 74 A CB -1.046 18.003 19.000 0.082 0.000 0.827 74 A HN 0.129 8.307 8.150 0.095 0.029 0.443 75 Y N 0.174 120.526 120.300 0.087 0.000 2.049 75 Y HA -0.421 4.209 4.550 0.133 0.000 0.277 75 Y C 1.753 177.752 175.900 0.164 0.000 1.143 75 Y CA 3.155 61.334 58.100 0.132 0.000 1.115 75 Y CB -0.243 38.302 38.460 0.143 0.000 0.975 75 Y HN -0.879 7.497 8.280 0.275 0.069 0.487 76 L N -3.498 117.762 121.223 0.061 0.000 2.051 76 L HA -0.584 3.750 4.340 -0.010 0.000 0.214 76 L C 2.515 179.345 176.870 -0.067 0.000 1.076 76 L CA 3.379 58.246 54.840 0.045 0.000 0.758 76 L CB -0.775 41.407 42.059 0.205 0.000 0.890 76 L HN 0.267 8.680 8.230 0.306 0.000 0.433 77 Q N -3.568 116.187 119.800 -0.075 0.000 2.245 77 Q HA -0.310 3.856 4.340 -0.291 0.000 0.201 77 Q C 2.511 178.396 176.000 -0.191 0.000 0.955 77 Q CA 2.878 58.581 55.803 -0.167 0.000 0.870 77 Q CB 0.005 28.695 28.738 -0.079 0.000 0.945 77 Q HN 0.038 8.115 8.270 -0.000 0.193 0.461 78 H N 2.509 121.458 119.070 -0.200 0.000 2.299 78 H HA -0.264 4.213 4.556 -0.131 0.000 0.302 78 H C 1.858 177.057 175.328 -0.216 0.000 1.078 78 H CA 3.980 59.927 56.048 -0.169 0.000 1.323 78 H CB 0.172 29.868 29.762 -0.109 0.000 1.381 78 H HN -0.156 8.004 8.280 -0.021 0.108 0.498 79 L N -1.073 119.980 121.223 -0.283 0.000 1.989 79 L HA -0.443 3.782 4.340 -0.193 0.000 0.211 79 L C 1.584 178.295 176.870 -0.266 0.000 1.071 79 L CA 3.728 58.423 54.840 -0.241 0.000 0.749 79 L CB -0.338 41.573 42.059 -0.246 0.000 0.890 79 L HN 0.030 8.073 8.230 -0.311 0.000 0.431 80 Q N -1.733 117.776 119.800 -0.486 0.000 2.062 80 Q HA -0.518 2.957 4.340 -1.442 0.000 0.209 80 Q C 2.011 177.689 176.000 -0.536 0.000 0.996 80 Q CA 3.222 58.406 55.803 -1.032 0.000 0.859 80 Q CB -0.153 27.806 28.738 -1.298 0.000 0.920 80 Q HN -0.283 7.737 8.270 -0.417 0.000 0.415 81 K N -1.843 118.296 120.400 -0.435 0.000 1.978 81 K HA -0.303 3.851 4.320 -0.277 0.000 0.214 81 K C 2.911 179.335 176.600 -0.293 0.000 1.049 81 K CA 3.032 59.122 56.287 -0.328 0.000 0.939 81 K CB 0.058 32.366 32.500 -0.319 0.000 0.721 81 K HN -0.423 7.561 8.250 -0.444 0.000 0.441 82 V N 0.471 120.164 119.914 -0.369 0.000 2.250 82 V HA -0.545 3.439 4.120 -0.227 0.000 0.250 82 V C 1.692 177.672 176.094 -0.190 0.000 1.060 82 V CA 4.635 66.771 62.300 -0.273 0.000 1.030 82 V CB -0.318 31.316 31.823 -0.314 0.000 0.643 82 V HN 0.019 7.897 8.190 -0.520 0.000 0.445 83 S N -1.552 114.035 115.700 -0.187 0.000 2.461 83 S HA -0.427 4.111 4.470 -0.135 -0.149 0.246 83 S C 1.988 176.528 174.600 -0.100 0.000 1.007 83 S CA 3.240 61.366 58.200 -0.123 0.000 0.976 83 S CB -0.667 62.512 63.200 -0.035 0.000 0.763 83 S HN -0.131 8.045 8.310 -0.223 0.000 0.508 84 Q N -0.351 119.375 119.800 -0.124 0.000 2.226 84 Q HA -0.075 4.221 4.340 -0.073 0.000 0.199 84 Q C 1.432 177.381 176.000 -0.086 0.000 0.945 84 Q CA 2.287 58.031 55.803 -0.098 0.000 0.861 84 Q CB 0.582 29.250 28.738 -0.117 0.000 0.953 84 Q HN 0.015 7.967 8.270 -0.162 0.221 0.490 85 E N -2.497 117.643 120.200 -0.100 0.000 2.006 85 E HA -0.189 4.120 4.350 -0.068 0.000 0.192 85 E C 0.680 177.237 176.600 -0.071 0.000 0.993 85 E CA 0.558 56.910 56.400 -0.080 0.000 0.808 85 E CB 0.888 30.536 29.700 -0.085 0.000 0.764 85 E HN -0.352 7.847 8.360 -0.125 0.086 0.449 86 G N -1.470 107.280 108.800 -0.083 0.000 2.306 86 G HA2 -0.277 3.786 3.960 -0.088 0.000 0.262 86 G HA3 -0.277 3.698 3.960 -0.063 -0.053 0.262 86 G C -1.682 173.177 174.900 -0.068 0.000 1.263 86 G CA -0.662 44.393 45.100 -0.075 0.000 1.088 86 G HN -0.208 8.023 8.290 -0.099 0.000 0.489 87 D N 2.963 123.328 120.400 -0.058 0.000 2.517 87 D HA 0.102 4.715 4.640 -0.045 0.000 0.220 87 D C -0.940 175.338 176.300 -0.036 0.000 1.158 87 D CA 0.055 54.028 54.000 -0.046 0.000 0.992 87 D CB -1.314 39.459 40.800 -0.045 0.000 1.058 87 D HN -0.109 8.227 8.370 -0.056 0.000 0.516 105 T N -0.881 113.585 114.554 -0.147 0.000 2.602 105 T HA 0.161 4.454 4.350 -0.096 0.000 0.235 105 T C -1.261 173.355 174.700 -0.140 0.000 0.882 105 T CA -1.561 60.463 62.100 -0.127 0.000 1.123 105 T CB 1.432 70.220 68.868 -0.133 0.000 1.662 105 T HN -0.324 7.790 8.240 -0.211 0.000 0.536 106 E N -2.606 117.522 120.200 -0.121 0.000 2.254 106 E HA 0.050 4.327 4.350 -0.110 0.007 0.258 106 E C 1.037 177.571 176.600 -0.110 0.000 1.033 106 E CA -0.876 55.463 56.400 -0.102 0.000 0.893 106 E CB 0.794 30.454 29.700 -0.068 0.000 1.204 106 E HN 0.014 8.308 8.360 -0.110 0.000 0.425 107 G N -0.079 108.682 108.800 -0.065 0.000 2.900 107 G HA2 -0.464 3.621 3.960 0.018 0.000 0.223 107 G HA3 -0.464 3.467 3.960 -0.048 0.000 0.223 107 G C 1.110 175.977 174.900 -0.056 0.000 1.293 107 G CA 1.553 46.633 45.100 -0.034 0.000 0.792 107 G HN 0.504 8.687 8.290 -0.044 0.080 0.527 108 I N -0.271 120.173 120.570 -0.211 0.000 2.237 108 I HA -0.641 3.247 4.170 -0.470 0.000 0.245 108 I C 0.289 176.295 176.117 -0.184 0.000 1.013 108 I CA 3.049 64.118 61.300 -0.385 0.000 1.298 108 I CB -0.787 36.797 38.000 -0.693 0.000 0.995 108 I HN -0.396 7.571 8.210 -0.248 0.094 0.422 109 F N 1.482 121.309 119.950 -0.205 0.000 2.113 109 F HA -0.378 4.065 4.527 -0.140 0.000 0.297 109 F C 0.878 176.644 175.800 -0.056 0.000 1.103 109 F CA 4.258 62.177 58.000 -0.134 0.000 1.248 109 F CB 0.039 38.955 39.000 -0.141 0.000 0.999 109 F HN -0.111 8.185 8.300 0.037 0.026 0.475 110 D N -0.303 120.091 120.400 -0.010 0.000 2.084 110 D HA -0.437 4.131 4.640 -0.121 0.000 0.194 110 D C 2.023 178.292 176.300 -0.053 0.000 0.990 110 D CA 4.441 58.416 54.000 -0.042 0.000 0.826 110 D CB -0.670 40.169 40.800 0.065 0.000 0.971 110 D HN 0.162 8.548 8.370 0.146 0.072 0.453 111 Y N 0.752 120.973 120.300 -0.132 0.000 2.053 111 Y HA -0.638 3.876 4.550 -0.060 0.000 0.277 111 Y C 1.582 177.409 175.900 -0.121 0.000 1.159 111 Y CA 4.060 62.093 58.100 -0.111 0.000 1.125 111 Y CB 0.054 38.427 38.460 -0.144 0.000 0.969 111 Y HN 0.091 8.324 8.280 0.124 0.121 0.492 112 A N -1.858 120.958 122.820 -0.006 0.000 1.859 112 A HA -0.533 3.771 4.320 -0.026 0.000 0.217 112 A C 1.472 178.964 177.584 -0.154 0.000 1.198 112 A CA 3.201 55.190 52.037 -0.080 0.000 0.629 112 A CB -0.976 17.958 19.000 -0.109 0.000 0.830 112 A HN -0.032 8.028 8.150 0.031 0.109 0.446 113 A N -2.455 120.185 122.820 -0.300 0.000 1.972 113 A HA -0.302 3.880 4.320 -0.229 0.000 0.219 113 A C 1.932 179.424 177.584 -0.154 0.000 1.169 113 A CA 2.638 54.505 52.037 -0.283 0.000 0.635 113 A CB -0.516 18.195 19.000 -0.480 0.000 0.810 113 A HN 0.206 7.996 8.150 -0.422 0.107 0.446 114 A N -0.165 122.580 122.820 -0.124 0.000 1.854 114 A HA -0.291 3.978 4.320 -0.085 0.000 0.214 114 A C 2.013 179.591 177.584 -0.009 0.000 1.192 114 A CA 2.845 54.847 52.037 -0.058 0.000 0.611 114 A CB -0.361 18.639 19.000 -0.000 0.000 0.832 114 A HN 0.089 7.938 8.150 -0.145 0.214 0.442 115 I N -1.587 119.006 120.570 0.037 0.000 2.226 115 I HA -0.426 3.978 4.170 0.391 0.000 0.245 115 I C 2.285 178.440 176.117 0.064 0.000 1.100 115 I CA 3.566 64.957 61.300 0.152 0.000 1.374 115 I CB -0.273 37.762 38.000 0.057 0.000 1.057 115 I HN 0.298 8.465 8.210 -0.071 0.000 0.413 116 G N -1.622 107.191 108.800 0.021 0.000 2.480 116 G HA2 -0.379 3.627 3.960 0.077 0.000 0.216 116 G HA3 -0.379 3.591 3.960 0.017 0.000 0.216 116 G C 1.076 175.965 174.900 -0.018 0.000 1.200 116 G CA 2.422 47.539 45.100 0.028 0.000 0.782 116 G HN 0.472 8.641 8.290 -0.012 0.113 0.554 117 G N 1.260 110.021 108.800 -0.066 0.000 2.505 117 G HA2 -0.444 3.474 3.960 -0.070 0.000 0.220 117 G HA3 -0.444 3.628 3.960 -0.126 -0.188 0.220 117 G C 0.794 175.601 174.900 -0.154 0.000 1.145 117 G CA 1.985 47.023 45.100 -0.103 0.000 0.761 117 G HN 0.128 8.254 8.290 -0.072 0.120 0.571 118 A N 1.118 123.800 122.820 -0.231 0.000 1.902 118 A HA -0.190 3.889 4.320 -0.400 0.000 0.217 118 A C 2.017 179.508 177.584 -0.156 0.000 1.181 118 A CA 3.280 55.118 52.037 -0.331 0.000 0.623 118 A CB -0.624 18.064 19.000 -0.520 0.000 0.818 118 A HN 0.196 8.118 8.150 -0.205 0.105 0.443 119 T N 2.343 116.858 114.554 -0.065 0.000 2.812 119 T HA -0.308 4.013 4.350 -0.048 0.000 0.264 119 T C 1.716 176.400 174.700 -0.027 0.000 1.042 119 T CA 5.583 67.666 62.100 -0.029 0.000 1.140 119 T CB -0.331 68.550 68.868 0.022 0.000 0.870 119 T HN -0.603 7.526 8.240 -0.036 0.090 0.445 120 I N 1.884 122.442 120.570 -0.020 0.000 2.151 120 I HA -0.613 3.567 4.170 0.017 0.000 0.243 120 I C 1.692 177.795 176.117 -0.022 0.000 1.080 120 I CA 4.702 65.998 61.300 -0.006 0.000 1.339 120 I CB -0.478 37.520 38.000 -0.003 0.000 1.039 120 I HN 0.291 8.489 8.210 -0.021 0.000 0.409 121 T N 1.994 116.514 114.554 -0.057 0.000 2.622 121 T HA -0.488 3.836 4.350 -0.043 0.000 0.266 121 T C 1.327 176.000 174.700 -0.046 0.000 1.047 121 T CA 5.320 67.383 62.100 -0.062 0.000 1.159 121 T CB -0.669 68.133 68.868 -0.110 0.000 0.863 121 T HN -0.056 8.136 8.240 -0.081 0.000 0.422 122 A N 0.910 123.692 122.820 -0.064 0.000 1.896 122 A HA -0.443 3.845 4.320 -0.054 0.000 0.220 122 A C 1.562 179.136 177.584 -0.016 0.000 1.206 122 A CA 3.184 55.189 52.037 -0.053 0.000 0.647 122 A CB -0.948 18.006 19.000 -0.078 0.000 0.828 122 A HN -0.362 7.736 8.150 -0.088 0.000 0.455 123 A N -2.721 120.099 122.820 -0.001 0.000 1.902 123 A HA -0.474 3.874 4.320 0.047 0.000 0.217 123 A C 1.741 179.363 177.584 0.063 0.000 1.181 123 A CA 2.970 55.032 52.037 0.042 0.000 0.623 123 A CB -0.725 18.309 19.000 0.056 0.000 0.818 123 A HN 0.268 8.411 8.150 -0.012 0.000 0.443 124 Q N -0.810 119.012 119.800 0.036 0.000 2.084 124 Q HA -0.279 4.090 4.340 0.048 0.000 0.202 124 Q C 2.117 178.140 176.000 0.038 0.000 0.978 124 Q CA 2.976 58.800 55.803 0.035 0.000 0.844 124 Q CB -0.623 28.123 28.738 0.013 0.000 0.898 124 Q HN -0.053 8.145 8.270 0.017 0.083 0.426 125 C N -0.579 118.736 119.300 0.025 0.000 2.413 125 C HA -0.338 4.277 4.460 0.023 -0.141 0.276 125 C C 2.402 177.424 174.990 0.054 0.000 1.236 125 C CA 5.313 64.347 59.018 0.027 0.000 1.735 125 C CB -0.725 27.021 27.740 0.011 0.000 2.031 125 C HN 0.209 8.441 8.230 0.012 0.005 0.474 126 L N 0.175 121.441 121.223 0.072 0.000 1.989 126 L HA -0.335 4.063 4.340 0.097 0.000 0.211 126 L C 3.379 180.374 176.870 0.208 0.000 1.071 126 L CA 3.060 57.976 54.840 0.126 0.000 0.749 126 L CB -0.292 41.839 42.059 0.120 0.000 0.890 126 L HN -0.471 7.722 8.230 0.055 0.070 0.431 127 I N -1.699 118.992 120.570 0.202 0.000 2.248 127 I HA -0.476 3.753 4.170 0.098 0.000 0.248 127 I C 1.276 177.407 176.117 0.025 0.000 1.107 127 I CA 2.893 64.255 61.300 0.104 0.000 1.373 127 I CB -1.084 36.944 38.000 0.046 0.000 1.055 127 I HN 0.240 8.496 8.210 0.172 0.057 0.418 128 D N -4.525 115.898 120.400 0.039 0.000 2.349 128 D HA -0.030 4.608 4.640 -0.002 0.000 0.224 128 D C 1.012 177.330 176.300 0.030 0.000 1.029 128 D CA 0.451 54.462 54.000 0.018 0.000 0.879 128 D CB -0.164 40.646 40.800 0.016 0.000 0.906 128 D HN -0.228 8.061 8.370 0.054 0.114 0.528 129 G N -1.146 107.690 108.800 0.059 0.000 2.323 129 G HA2 -0.380 3.674 3.960 0.093 0.000 0.292 129 G HA3 -0.380 3.611 3.960 0.052 0.000 0.292 129 G C -0.080 174.846 174.900 0.044 0.000 1.040 129 G CA 1.115 46.254 45.100 0.064 0.000 0.942 129 G HN 0.036 8.154 8.290 0.086 0.224 0.506 130 M N -1.051 118.575 119.600 0.043 0.000 2.287 130 M HA 0.002 4.497 4.480 0.026 0.000 0.266 130 M C -0.943 175.375 176.300 0.030 0.000 1.079 130 M CA 2.446 57.764 55.300 0.031 0.000 1.146 130 M CB 1.238 33.854 32.600 0.027 0.000 1.374 130 M HN -0.051 8.263 8.290 0.052 0.008 0.435 131 C N -6.412 112.909 119.300 0.035 0.000 3.316 131 C HA 0.342 4.817 4.460 0.024 0.000 0.360 131 C C -0.697 174.311 174.990 0.031 0.000 1.560 131 C CA -1.856 57.178 59.018 0.026 0.000 1.229 131 C CB 2.396 30.147 27.740 0.019 0.000 1.823 131 C HN -0.647 7.609 8.230 0.044 0.000 0.440 132 K N -1.851 118.559 120.400 0.016 0.000 2.391 132 K HA 0.086 4.421 4.320 0.025 0.000 0.197 132 K C -1.655 174.937 176.600 -0.014 0.000 1.087 132 K CA 0.812 57.106 56.287 0.011 0.000 1.012 132 K CB 0.905 33.410 32.500 0.009 0.000 0.925 132 K HN 0.176 8.432 8.250 0.010 0.000 0.547 133 V N -2.456 117.445 119.914 -0.021 0.000 2.709 133 V HA 0.831 5.173 4.120 -0.060 -0.258 0.308 133 V C -1.778 174.285 176.094 -0.051 0.000 1.062 133 V CA -1.793 60.477 62.300 -0.050 0.000 0.901 133 V CB 3.961 35.750 31.823 -0.057 0.000 1.003 133 V HN -0.801 7.382 8.190 -0.011 0.000 0.425 134 A N 5.842 128.614 122.820 -0.080 0.000 2.343 134 A HA 0.580 4.869 4.320 -0.051 0.000 0.308 134 A C -2.263 175.225 177.584 -0.160 0.000 1.092 134 A CA -1.456 50.532 52.037 -0.081 0.000 0.751 134 A CB 2.766 21.729 19.000 -0.061 0.000 1.203 134 A HN 0.534 8.624 8.150 -0.099 0.000 0.452 135 I N 3.252 123.713 120.570 -0.181 0.000 2.412 135 I HA 0.256 4.258 4.170 -0.510 -0.138 0.296 135 I C -1.394 174.516 176.117 -0.344 0.000 0.987 135 I CA -0.907 60.165 61.300 -0.380 0.000 1.180 135 I CB 2.782 40.565 38.000 -0.361 0.000 1.340 135 I HN 0.319 8.365 8.210 -0.096 0.106 0.455 136 N N 3.214 121.650 118.700 -0.441 0.000 2.716 136 N HA 0.341 5.005 4.740 -0.126 0.000 0.245 136 N C -0.173 175.210 175.510 -0.212 0.000 1.495 136 N CA -0.674 52.251 53.050 -0.208 0.000 0.759 136 N CB 0.742 39.167 38.487 -0.103 0.000 1.261 136 N HN 0.004 8.011 8.380 -0.623 0.000 0.515 137 W N 1.298 122.517 121.300 -0.134 0.000 2.389 137 W HA -0.251 4.087 4.660 -0.653 -0.070 0.267 137 W C 0.581 176.923 176.519 -0.296 0.000 1.219 137 W CA 1.625 58.732 57.345 -0.398 0.000 1.189 137 W CB 0.033 29.313 29.460 -0.300 0.000 1.129 137 W HN 0.487 8.517 8.180 -0.250 0.000 0.581 138 S N -2.160 113.625 115.700 0.142 0.000 2.605 138 S HA 0.116 4.721 4.470 0.226 0.000 0.217 138 S C -0.264 174.511 174.600 0.291 0.000 0.958 138 S CA 0.975 59.288 58.200 0.190 0.000 0.919 138 S CB 0.142 63.370 63.200 0.048 0.000 0.780 138 S HN -0.371 7.975 8.310 0.161 0.061 0.507 139 G N -1.569 107.319 108.800 0.147 0.000 2.753 139 G HA2 0.387 4.648 3.960 0.501 0.000 0.285 139 G HA3 0.387 4.508 3.960 0.144 -0.074 0.285 139 G C -1.785 173.029 174.900 -0.142 0.000 1.344 139 G CA -1.440 43.770 45.100 0.184 0.000 1.050 139 G HN -0.376 7.861 8.290 0.035 0.074 0.532 140 G N -2.403 106.326 108.800 -0.117 0.000 2.173 140 G HA2 -0.218 3.693 3.960 -0.080 0.000 0.174 140 G HA3 -0.218 3.530 3.960 -0.354 0.000 0.174 140 G C 0.321 174.941 174.900 -0.466 0.000 1.025 140 G CA -0.296 44.644 45.100 -0.267 0.000 0.706 140 G HN -0.420 8.375 8.290 0.086 -0.454 0.499 141 W N 1.804 123.147 121.300 0.070 0.000 1.809 141 W HA 0.071 4.801 4.660 0.117 0.000 0.399 141 W C -0.300 176.335 176.519 0.193 0.000 0.636 141 W CA -1.652 55.776 57.345 0.140 0.000 2.178 141 W CB -2.243 27.337 29.460 0.200 0.000 1.632 141 W HN 0.004 8.616 8.180 0.185 -0.321 0.470 142 H N -1.844 117.248 119.070 0.037 0.000 2.568 142 H HA -0.240 4.311 4.556 -0.009 0.000 0.285 142 H C -0.026 175.263 175.328 -0.065 0.000 1.048 142 H CA 1.081 57.104 56.048 -0.041 0.000 1.197 142 H CB -0.691 29.045 29.762 -0.042 0.000 1.343 142 H HN -0.046 8.102 8.280 -0.041 0.108 0.614 143 H N -0.868 118.412 119.070 0.351 0.000 2.750 143 H HA 0.438 5.220 4.556 -0.024 -0.241 0.263 143 H C -0.025 175.405 175.328 0.170 0.000 0.964 143 H CA -0.355 55.789 56.048 0.161 0.000 1.205 143 H CB 0.919 30.847 29.762 0.278 0.000 1.454 143 H HN -0.768 7.689 8.280 0.461 0.099 0.503 144 A N 0.298 123.322 122.820 0.340 0.000 2.483 144 A HA -0.242 4.220 4.320 0.237 0.000 0.238 144 A C -1.061 176.676 177.584 0.255 0.000 1.070 144 A CA 1.015 53.226 52.037 0.290 0.000 0.770 144 A CB 0.531 19.760 19.000 0.381 0.000 1.008 144 A HN -0.777 7.604 8.150 0.385 0.000 0.497 145 K N 2.588 123.096 120.400 0.180 0.000 2.245 145 K HA 0.380 4.816 4.320 0.195 0.000 0.234 145 K C 2.144 178.734 176.600 -0.016 0.000 1.021 145 K CA -1.840 54.510 56.287 0.104 0.000 0.898 145 K CB 1.510 34.005 32.500 -0.008 0.000 1.163 145 K HN 0.157 8.480 8.250 0.121 0.000 0.459 146 K N -1.135 119.072 120.400 -0.322 0.000 2.148 146 K HA -0.300 3.264 4.320 -1.258 0.000 0.204 146 K C -0.372 175.996 176.600 -0.386 0.000 1.050 146 K CA 2.996 58.812 56.287 -0.785 0.000 0.942 146 K CB -0.067 31.832 32.500 -1.001 0.000 0.724 146 K HN 0.731 8.835 8.250 -0.243 0.000 0.446 147 D N -6.744 113.442 120.400 -0.357 0.000 2.650 147 D HA 0.146 4.550 4.640 -0.394 0.000 0.265 147 D C -1.354 174.683 176.300 -0.438 0.000 1.339 147 D CA -1.525 52.269 54.000 -0.343 0.000 0.816 147 D CB -0.931 39.816 40.800 -0.088 0.000 1.091 147 D HN -0.201 7.971 8.370 -0.296 0.020 0.483 148 E N -0.938 118.935 120.200 -0.545 0.000 2.363 148 E HA 0.114 4.400 4.350 -0.107 0.000 0.281 148 E C -2.389 174.133 176.600 -0.129 0.000 0.953 148 E CA -0.172 56.093 56.400 -0.224 0.000 0.778 148 E CB 3.309 32.968 29.700 -0.067 0.000 1.220 148 E HN -0.965 6.958 8.360 -0.544 0.111 0.431 149 A N 4.453 127.310 122.820 0.061 0.000 2.271 149 A HA 0.520 4.982 4.320 0.102 -0.081 0.288 149 A C -1.160 176.459 177.584 0.059 0.000 1.094 149 A CA -0.785 51.303 52.037 0.084 0.000 0.828 149 A CB 1.497 20.537 19.000 0.067 0.000 1.091 149 A HN 0.337 8.577 8.150 0.150 0.000 0.493 150 S N 0.939 116.688 115.700 0.081 0.000 2.556 150 S HA 0.099 4.651 4.470 0.136 0.000 0.280 150 S C -0.163 174.607 174.600 0.283 0.000 1.141 150 S CA -0.123 58.179 58.200 0.171 0.000 0.883 150 S CB 1.152 64.454 63.200 0.171 0.000 1.103 150 S HN 0.498 8.841 8.310 0.056 0.000 0.453 151 G N 6.488 115.481 108.800 0.322 0.000 2.421 151 G HA2 -0.321 3.570 3.960 -0.114 0.000 0.300 151 G HA3 -0.321 3.787 3.960 0.247 0.000 0.300 151 G C -0.608 174.602 174.900 0.516 0.000 0.974 151 G CA 1.069 46.321 45.100 0.253 0.000 1.062 151 G HN 0.596 9.076 8.290 0.316 0.000 0.514 152 F N -8.165 111.756 119.950 -0.049 0.000 2.748 152 F HA -0.437 3.950 4.527 -0.234 0.000 0.370 152 F C -0.910 174.746 175.800 -0.241 0.000 0.620 152 F CA 0.499 58.437 58.000 -0.104 0.000 1.233 152 F CB -1.526 37.542 39.000 0.114 0.000 1.708 152 F HN -0.340 8.074 8.300 0.207 0.010 0.298 153 C N 1.125 120.500 119.300 0.124 0.000 2.347 153 C HA 0.077 4.595 4.460 0.097 0.000 0.353 153 C C -0.345 174.557 174.990 -0.147 0.000 1.273 153 C CA 0.695 59.802 59.018 0.150 0.000 1.861 153 C CB 0.605 28.654 27.740 0.515 0.000 2.420 153 C HN 0.112 8.292 8.230 0.272 0.213 0.542 154 Y N 3.215 123.629 120.300 0.189 0.000 2.422 154 Y HA -0.015 4.730 4.550 0.325 0.000 0.291 154 Y C 0.217 176.287 175.900 0.283 0.000 1.144 154 Y CA 1.906 60.156 58.100 0.251 0.000 1.208 154 Y CB 1.080 39.633 38.460 0.155 0.000 1.195 154 Y HN 0.565 8.934 8.280 0.148 0.000 0.535 155 L N -3.703 117.719 121.223 0.331 0.000 2.322 155 L HA 0.136 4.470 4.340 -0.010 0.000 0.269 155 L C -0.964 176.139 176.870 0.388 0.000 1.012 155 L CA -1.162 53.791 54.840 0.188 0.000 0.815 155 L CB 2.651 44.734 42.059 0.041 0.000 1.295 155 L HN -0.634 7.782 8.230 0.310 0.000 0.438 156 N N 2.877 121.908 118.700 0.551 0.000 2.936 156 N HA 0.154 5.267 4.740 0.357 -0.159 0.243 156 N C 0.015 175.670 175.510 0.242 0.000 1.149 156 N CA -2.038 51.222 53.050 0.351 0.000 0.914 156 N CB -0.941 37.642 38.487 0.159 0.000 1.179 156 N HN 0.219 9.119 8.380 0.866 0.000 0.502 157 D N 3.741 124.301 120.400 0.266 0.000 2.384 157 D HA -0.275 4.469 4.640 0.173 0.000 0.222 157 D C 0.575 176.947 176.300 0.120 0.000 0.976 157 D CA 2.732 56.850 54.000 0.196 0.000 0.915 157 D CB -0.189 40.758 40.800 0.245 0.000 0.896 157 D HN -0.179 8.357 8.370 0.341 0.039 0.523 158 A N -0.263 122.606 122.820 0.081 0.000 1.887 158 A HA -0.066 4.277 4.320 0.040 0.000 0.212 158 A C 1.765 179.310 177.584 -0.065 0.000 1.198 158 A CA 2.671 54.712 52.037 0.007 0.000 0.628 158 A CB -0.014 18.972 19.000 -0.024 0.000 0.847 158 A HN -0.234 8.132 8.150 0.104 -0.154 0.449 159 V N 0.932 120.764 119.914 -0.135 0.000 2.231 159 V HA -0.578 3.538 4.120 -0.007 0.000 0.248 159 V C 1.780 177.861 176.094 -0.021 0.000 1.054 159 V CA 5.210 67.419 62.300 -0.152 0.000 1.015 159 V CB -0.188 31.197 31.823 -0.729 0.000 0.638 159 V HN -0.131 8.342 8.190 -0.145 -0.370 0.444 160 L N -2.293 118.929 121.223 -0.002 0.000 2.064 160 L HA -0.469 3.945 4.340 0.124 0.000 0.216 160 L C 2.673 179.592 176.870 0.082 0.000 1.077 160 L CA 3.154 58.051 54.840 0.095 0.000 0.766 160 L CB -1.018 41.125 42.059 0.141 0.000 0.890 160 L HN -0.424 7.789 8.230 -0.029 0.000 0.435 161 G N -2.812 106.021 108.800 0.056 0.000 2.403 161 G HA2 -0.260 3.732 3.960 0.053 0.000 0.216 161 G HA3 -0.260 3.721 3.960 0.034 0.000 0.216 161 G C 1.231 176.163 174.900 0.053 0.000 1.154 161 G CA 1.410 46.539 45.100 0.048 0.000 0.784 161 G HN -0.853 7.353 8.290 0.044 0.111 0.538 162 I N 2.801 123.391 120.570 0.033 0.000 2.142 162 I HA -0.530 3.638 4.170 -0.003 0.000 0.240 162 I C 1.576 177.756 176.117 0.104 0.000 1.078 162 I CA 3.857 65.161 61.300 0.006 0.000 1.343 162 I CB 0.026 37.921 38.000 -0.176 0.000 1.046 162 I HN -0.062 8.058 8.210 0.017 0.100 0.405 163 L N -3.153 118.178 121.223 0.180 0.000 2.261 163 L HA -0.364 4.121 4.340 0.242 0.000 0.216 163 L C 1.740 178.694 176.870 0.141 0.000 1.114 163 L CA 2.625 57.585 54.840 0.200 0.000 0.777 163 L CB -0.802 41.373 42.059 0.194 0.000 0.910 163 L HN 0.355 8.587 8.230 0.185 0.109 0.440 164 R N -2.503 118.069 120.500 0.119 0.000 2.161 164 R HA -0.081 4.313 4.340 0.091 0.000 0.213 164 R C 2.211 178.588 176.300 0.127 0.000 1.055 164 R CA 1.242 57.403 56.100 0.102 0.000 0.996 164 R CB -0.228 30.122 30.300 0.082 0.000 0.901 164 R HN -0.657 7.500 8.270 0.111 0.179 0.456 165 L N -0.508 120.813 121.223 0.163 0.000 2.240 165 L HA -0.133 4.418 4.340 0.351 0.000 0.211 165 L C 0.753 177.791 176.870 0.281 0.000 1.106 165 L CA 1.839 56.856 54.840 0.296 0.000 0.793 165 L CB -0.203 42.011 42.059 0.257 0.000 0.927 165 L HN -0.133 8.026 8.230 0.136 0.153 0.446 166 R N -4.080 116.530 120.500 0.182 0.000 2.366 166 R HA -0.120 4.542 4.340 0.165 -0.224 0.201 166 R C 1.134 177.483 176.300 0.082 0.000 1.057 166 R CA 1.178 57.365 56.100 0.145 0.000 1.086 166 R CB -1.288 29.103 30.300 0.151 0.000 0.914 166 R HN -0.582 7.661 8.270 0.164 0.125 0.476 167 R N -3.029 117.500 120.500 0.048 0.000 2.105 167 R HA 0.010 4.356 4.340 0.010 0.000 0.214 167 R C 1.021 177.274 176.300 -0.078 0.000 1.091 167 R CA 2.090 58.186 56.100 -0.007 0.000 1.007 167 R CB 0.437 30.729 30.300 -0.013 0.000 0.912 167 R HN -0.561 7.627 8.270 0.074 0.127 0.450 168 K N -1.305 118.988 120.400 -0.179 0.000 2.225 168 K HA -0.007 4.149 4.320 -0.273 0.000 0.204 168 K C 0.560 176.907 176.600 -0.422 0.000 1.047 168 K CA 0.859 56.905 56.287 -0.401 0.000 0.970 168 K CB 1.793 33.867 32.500 -0.710 0.000 0.939 168 K HN -0.640 7.528 8.250 -0.136 0.000 0.472 169 F N -0.708 119.250 119.950 0.013 0.000 2.382 169 F HA 0.033 4.558 4.527 -0.003 0.000 0.331 169 F C 0.729 176.534 175.800 0.009 0.000 1.121 169 F CA -0.295 57.709 58.000 0.008 0.000 1.183 169 F CB 0.773 39.784 39.000 0.017 0.000 1.207 169 F HN -0.136 7.998 8.300 -0.277 0.000 0.555 170 E N 1.297 121.605 120.200 0.180 0.000 2.192 170 E HA -0.043 4.360 4.350 0.089 0.000 0.196 170 E C -0.668 175.984 176.600 0.086 0.000 0.922 170 E CA 1.143 57.596 56.400 0.088 0.000 0.924 170 E CB 1.383 31.097 29.700 0.023 0.000 0.911 170 E HN 0.361 8.846 8.360 0.208 0.000 0.478 171 R N -0.610 119.905 120.500 0.025 0.000 2.215 171 R HA 0.485 5.190 4.340 0.164 -0.267 0.336 171 R C -1.004 175.378 176.300 0.136 0.000 0.996 171 R CA -0.834 55.257 56.100 -0.015 0.000 0.847 171 R CB 0.420 30.369 30.300 -0.584 0.000 1.127 171 R HN -0.327 7.948 8.270 0.008 0.000 0.465 172 I N 3.935 124.664 120.570 0.265 0.000 2.493 172 I HA 0.499 4.893 4.170 0.101 -0.164 0.298 172 I C -1.826 174.443 176.117 0.253 0.000 0.998 172 I CA -2.817 58.581 61.300 0.163 0.000 1.137 172 I CB 2.030 40.051 38.000 0.035 0.000 1.310 172 I HN 0.579 8.980 8.210 0.319 0.000 0.445 173 L N 6.669 128.015 121.223 0.205 0.000 2.346 173 L HA 0.736 5.315 4.340 0.091 -0.184 0.276 173 L C -2.744 174.217 176.870 0.152 0.000 1.006 173 L CA -1.939 53.008 54.840 0.178 0.000 0.817 173 L CB 3.731 45.946 42.059 0.260 0.000 1.272 173 L HN -0.070 8.250 8.230 0.151 0.000 0.421 174 Y N 7.621 127.906 120.300 -0.025 0.000 2.331 174 Y HA 0.881 5.669 4.550 -0.018 -0.249 0.334 174 Y C -2.423 173.491 175.900 0.024 0.000 0.960 174 Y CA -3.048 55.035 58.100 -0.028 0.000 1.130 174 Y CB 2.837 41.243 38.460 -0.090 0.000 1.164 174 Y HN 0.855 9.216 8.280 0.136 0.000 0.458 175 V N 8.022 127.714 119.914 -0.371 0.000 2.513 175 V HA 0.605 4.803 4.120 -0.168 -0.179 0.299 175 V C -1.957 173.807 176.094 -0.549 0.000 1.035 175 V CA -1.296 60.838 62.300 -0.277 0.000 0.889 175 V CB 2.675 34.454 31.823 -0.073 0.000 0.988 175 V HN 0.668 8.658 8.190 -0.334 0.000 0.440 176 D N 5.642 125.837 120.400 -0.343 0.000 2.440 176 D HA 0.414 5.000 4.640 -0.311 -0.133 0.252 176 D C -1.062 175.274 176.300 0.060 0.000 1.180 176 D CA -0.822 53.043 54.000 -0.224 0.000 0.894 176 D CB 2.088 42.811 40.800 -0.127 0.000 1.111 176 D HN 0.376 8.649 8.370 -0.162 0.000 0.544 177 L N 5.144 126.423 121.223 0.093 0.000 2.978 177 L HA 0.361 4.897 4.340 0.326 0.000 0.239 177 L C -2.023 174.976 176.870 0.215 0.000 1.293 177 L CA -0.999 53.980 54.840 0.231 0.000 1.085 177 L CB -0.978 41.222 42.059 0.236 0.000 1.432 177 L HN 0.448 8.694 8.230 0.027 0.000 0.512 178 D N -0.216 120.309 120.400 0.208 0.000 2.168 178 D HA 0.159 5.130 4.640 0.137 -0.248 0.246 178 D C 0.785 177.239 176.300 0.257 0.000 1.050 178 D CA -1.769 52.346 54.000 0.192 0.000 0.857 178 D CB 2.574 43.448 40.800 0.123 0.000 1.169 178 D HN -0.789 7.853 8.370 0.218 -0.142 0.453 179 L N 3.706 125.003 121.223 0.124 0.000 2.186 179 L HA -0.443 3.646 4.340 -0.418 0.000 0.221 179 L C -0.744 176.133 176.870 0.012 0.000 1.087 179 L CA 2.524 57.286 54.840 -0.129 0.000 0.794 179 L CB 0.380 42.328 42.059 -0.186 0.000 0.893 179 L HN 0.141 8.658 8.230 0.082 -0.238 0.442 180 H N -6.207 113.111 119.070 0.413 0.000 2.496 180 H HA 0.156 5.045 4.556 0.554 0.000 0.342 180 H C -0.611 174.941 175.328 0.373 0.000 1.170 180 H CA -1.344 54.995 56.048 0.485 0.000 1.274 180 H CB 1.323 31.418 29.762 0.555 0.000 1.538 180 H HN -0.588 8.353 8.280 0.623 -0.287 0.542 181 H N 1.212 120.390 119.070 0.179 0.000 2.767 181 H HA -0.106 4.311 4.556 -0.232 0.000 0.316 181 H C 1.216 176.416 175.328 -0.213 0.000 1.059 181 H CA 0.573 56.493 56.048 -0.213 0.000 1.461 181 H CB 0.588 30.049 29.762 -0.502 0.000 1.475 181 H HN 0.291 8.818 8.280 0.411 0.000 0.531 182 G N 7.957 116.488 108.800 -0.449 0.000 3.343 182 G HA2 -0.000 3.438 3.960 -1.030 0.000 0.279 182 G HA3 -0.000 4.108 3.960 0.023 -0.135 0.279 182 G C -0.758 173.814 174.900 -0.547 0.000 0.919 182 G CA -0.817 44.002 45.100 -0.467 0.000 1.812 182 G HN -0.051 8.117 8.290 -0.204 0.000 0.584 183 D N 4.150 124.137 120.400 -0.689 0.000 2.097 183 D HA -0.235 4.009 4.640 -0.661 0.000 0.197 183 D C 2.063 178.267 176.300 -0.160 0.000 0.984 183 D CA 2.021 55.741 54.000 -0.467 0.000 0.826 183 D CB -0.677 40.033 40.800 -0.150 0.000 0.973 183 D HN -0.304 7.645 8.370 -0.596 0.063 0.460 184 G N -0.718 108.032 108.800 -0.084 0.000 2.475 184 G HA2 -0.298 3.694 3.960 0.054 0.000 0.220 184 G HA3 -0.298 3.838 3.960 0.057 -0.143 0.220 184 G C 1.536 176.409 174.900 -0.046 0.000 1.125 184 G CA 2.289 47.395 45.100 0.009 0.000 0.755 184 G HN -0.246 7.987 8.290 -0.094 0.000 0.565 185 V N -1.408 118.438 119.914 -0.114 0.000 3.235 185 V HA -0.191 3.848 4.120 -0.135 0.000 0.259 185 V C 0.935 177.023 176.094 -0.009 0.000 1.133 185 V CA 2.090 64.298 62.300 -0.154 0.000 1.128 185 V CB -0.237 31.293 31.823 -0.489 0.000 0.757 185 V HN -0.631 7.452 8.190 -0.131 0.028 0.469 186 E N 0.869 121.049 120.200 -0.034 0.000 2.030 186 E HA -0.258 4.139 4.350 0.080 0.000 0.189 186 E C 1.801 178.430 176.600 0.048 0.000 0.974 186 E CA 2.648 59.068 56.400 0.033 0.000 0.807 186 E CB 0.124 29.825 29.700 0.001 0.000 0.771 186 E HN -0.407 7.707 8.360 -0.098 0.187 0.451 187 D N 1.378 121.785 120.400 0.012 0.000 2.160 187 D HA -0.356 4.264 4.640 -0.034 0.000 0.189 187 D C 2.127 178.433 176.300 0.010 0.000 1.003 187 D CA 3.363 57.366 54.000 0.005 0.000 0.846 187 D CB -0.134 40.684 40.800 0.030 0.000 0.949 187 D HN 0.282 8.647 8.370 -0.007 0.000 0.446 188 A N -0.533 122.301 122.820 0.024 0.000 1.971 188 A HA -0.301 4.079 4.320 0.100 0.000 0.222 188 A C 0.952 178.280 177.584 -0.427 0.000 1.182 188 A CA 2.357 54.327 52.037 -0.113 0.000 0.649 188 A CB -0.304 18.450 19.000 -0.409 0.000 0.818 188 A HN -0.449 7.726 8.150 0.041 0.000 0.458 189 F N -5.827 114.123 119.950 -0.000 0.000 2.698 189 F HA 0.307 4.868 4.527 0.056 0.000 0.304 189 F C 0.180 175.952 175.800 -0.046 0.000 1.108 189 F CA -1.294 56.708 58.000 0.004 0.000 1.263 189 F CB 0.661 39.649 39.000 -0.019 0.000 1.013 189 F HN -0.498 7.770 8.300 0.180 0.140 0.532 190 S N 2.588 118.258 115.700 -0.050 0.000 2.402 190 S HA -0.328 4.038 4.470 -0.173 0.000 0.233 190 S C 0.227 174.569 174.600 -0.430 0.000 1.030 190 S CA 3.943 61.949 58.200 -0.323 0.000 1.003 190 S CB 0.320 63.105 63.200 -0.691 0.000 0.813 190 S HN -0.086 8.070 8.310 -0.056 0.120 0.477 191 F N -5.295 114.685 119.950 0.049 0.000 2.923 191 F HA 0.633 5.357 4.527 0.020 -0.185 0.314 191 F C -0.474 175.337 175.800 0.018 0.000 1.196 191 F CA -1.408 56.606 58.000 0.023 0.000 1.320 191 F CB -0.298 38.705 39.000 0.004 0.000 0.953 191 F HN -0.211 8.059 8.300 0.001 0.030 0.505 192 T N 0.025 114.663 114.554 0.139 0.000 2.909 192 T HA 0.270 4.657 4.350 0.061 0.000 0.299 192 T C -1.141 173.527 174.700 -0.052 0.000 1.073 192 T CA -2.446 59.708 62.100 0.089 0.000 0.999 192 T CB 2.669 71.650 68.868 0.189 0.000 1.098 192 T HN -0.601 7.707 8.240 0.113 0.000 0.477 193 S N 4.796 120.368 115.700 -0.213 0.000 2.574 193 S HA 0.231 4.100 4.470 -1.002 0.000 0.242 193 S C 0.296 174.847 174.600 -0.081 0.000 0.982 193 S CA -0.157 57.633 58.200 -0.683 0.000 0.977 193 S CB 0.367 62.965 63.200 -1.004 0.000 0.814 193 S HN 0.381 8.613 8.310 -0.130 0.000 0.464 194 K N 1.024 121.475 120.400 0.086 0.000 2.323 194 K HA 0.093 4.538 4.320 0.208 0.000 0.197 194 K C -1.692 175.104 176.600 0.326 0.000 1.043 194 K CA 0.789 57.200 56.287 0.206 0.000 0.997 194 K CB 1.018 33.607 32.500 0.148 0.000 0.807 194 K HN -0.279 7.909 8.250 0.065 0.101 0.497 195 V N -2.200 117.840 119.914 0.210 0.000 2.656 195 V HA 0.706 5.112 4.120 0.131 -0.207 0.307 195 V C -0.983 175.060 176.094 -0.086 0.000 1.051 195 V CA -1.163 61.149 62.300 0.019 0.000 0.893 195 V CB 3.110 34.686 31.823 -0.412 0.000 0.999 195 V HN -0.772 7.488 8.190 0.171 0.032 0.426 196 M N 8.255 127.682 119.600 -0.289 0.000 2.253 196 M HA 0.692 5.300 4.480 -0.186 -0.240 0.314 196 M C -1.851 174.359 176.300 -0.150 0.000 1.019 196 M CA -1.735 53.337 55.300 -0.379 0.000 0.932 196 M CB 4.311 36.318 32.600 -0.988 0.000 1.606 196 M HN 0.821 8.985 8.290 -0.210 0.000 0.430 197 T N 4.819 119.355 114.554 -0.030 0.000 2.824 197 T HA 0.736 5.385 4.350 0.210 -0.173 0.280 197 T C -1.096 173.664 174.700 0.099 0.000 0.995 197 T CA -1.964 60.214 62.100 0.129 0.000 1.009 197 T CB 1.445 70.421 68.868 0.180 0.000 0.955 197 T HN 0.195 8.419 8.240 -0.027 0.000 0.452 198 V N 5.576 125.551 119.914 0.101 0.000 2.531 198 V HA 0.639 5.028 4.120 0.084 -0.218 0.301 198 V C -1.781 174.370 176.094 0.094 0.000 1.034 198 V CA -1.124 61.221 62.300 0.075 0.000 0.865 198 V CB 2.993 34.844 31.823 0.046 0.000 0.995 198 V HN 0.969 9.219 8.190 0.100 0.000 0.424 199 S N 5.546 121.350 115.700 0.174 0.000 2.557 199 S HA 0.536 5.266 4.470 0.177 -0.154 0.291 199 S C -2.174 172.602 174.600 0.293 0.000 1.116 199 S CA -1.818 56.547 58.200 0.274 0.000 0.992 199 S CB 2.109 65.549 63.200 0.400 0.000 1.028 199 S HN 0.081 8.499 8.310 0.180 0.000 0.484 200 L N 5.501 126.868 121.223 0.239 0.000 2.322 200 L HA 0.678 5.143 4.340 -0.082 -0.175 0.281 200 L C -1.114 175.916 176.870 0.267 0.000 1.014 200 L CA -0.739 54.158 54.840 0.095 0.000 0.815 200 L CB 2.323 44.419 42.059 0.062 0.000 1.247 200 L HN -0.078 8.306 8.230 0.257 0.000 0.421 201 H N -1.691 117.570 119.070 0.318 0.000 2.883 201 H HA 0.368 5.163 4.556 0.309 -0.053 0.277 201 H C -2.416 173.122 175.328 0.351 0.000 1.451 201 H CA -1.286 54.959 56.048 0.327 0.000 1.157 201 H CB 1.563 31.519 29.762 0.324 0.000 1.851 201 H HN 0.480 8.573 8.280 -0.313 0.000 0.566 202 K N 0.608 121.199 120.400 0.319 0.000 2.130 202 K HA 0.572 5.268 4.320 0.264 -0.217 0.268 202 K C -1.307 175.527 176.600 0.389 0.000 0.983 202 K CA -1.605 54.775 56.287 0.154 0.000 0.893 202 K CB 2.456 34.661 32.500 -0.493 0.000 1.066 202 K HN -0.006 8.431 8.250 0.311 0.000 0.450 203 F N 8.243 128.271 119.950 0.129 0.000 2.553 203 F HA 0.221 4.922 4.527 0.291 0.000 0.335 203 F C -2.627 173.231 175.800 0.097 0.000 1.148 203 F CA -0.140 57.971 58.000 0.185 0.000 0.963 203 F CB 2.410 41.502 39.000 0.154 0.000 1.217 203 F HN -0.015 8.430 8.300 0.242 0.000 0.441 204 S N 6.515 122.034 115.700 -0.303 0.000 2.543 204 S HA 0.354 4.655 4.470 -0.281 0.000 0.273 204 S C -2.799 171.661 174.600 -0.233 0.000 1.152 204 S CA -1.697 56.359 58.200 -0.240 0.000 0.910 204 S CB 2.337 65.480 63.200 -0.096 0.000 1.105 204 S HN 0.013 8.194 8.310 -0.215 0.000 0.465 205 P HA -0.192 4.120 4.420 -0.180 0.000 0.245 205 P C 0.109 177.390 177.300 -0.032 0.000 1.123 205 P CA 1.383 64.403 63.100 -0.134 0.000 0.853 205 P CB -0.374 31.272 31.700 -0.090 0.000 0.786 206 G N 2.088 110.884 108.800 -0.006 0.000 2.231 206 G HA2 -0.315 3.668 3.960 0.040 0.000 0.206 206 G HA3 -0.315 3.682 3.960 0.063 0.000 0.206 206 G C -1.159 173.822 174.900 0.135 0.000 0.996 206 G CA -0.484 44.651 45.100 0.058 0.000 0.645 206 G HN 0.059 8.320 8.290 -0.048 0.000 0.498 207 F N 3.582 123.525 119.950 -0.011 0.000 2.420 207 F HA 0.158 4.749 4.527 0.107 0.000 0.352 207 F C -1.795 174.078 175.800 0.123 0.000 1.108 207 F CA -0.926 57.112 58.000 0.063 0.000 1.162 207 F CB 1.222 40.231 39.000 0.014 0.000 1.118 207 F HN -0.198 8.138 8.300 0.167 0.065 0.510 208 F N 8.202 127.828 119.950 -0.539 0.000 2.496 208 F HA 0.013 4.439 4.527 -0.169 0.000 0.344 208 F C -1.230 174.465 175.800 -0.175 0.000 1.155 208 F CA -1.995 55.813 58.000 -0.320 0.000 1.302 208 F CB 1.369 40.163 39.000 -0.342 0.000 1.159 208 F HN 0.138 8.144 8.300 -0.490 0.000 0.595 209 P HA -0.110 2.975 4.420 -2.225 0.000 0.223 209 P C -0.627 176.437 177.300 -0.395 0.000 1.151 209 P CA 1.319 63.708 63.100 -1.185 0.000 0.787 209 P CB 0.194 31.314 31.700 -0.966 0.000 0.788 210 G N -3.315 105.404 108.800 -0.134 0.000 2.231 210 G HA2 -0.233 3.803 3.960 -0.035 0.000 0.206 210 G HA3 -0.233 3.694 3.960 -0.054 0.000 0.206 210 G C -0.692 174.284 174.900 0.126 0.000 0.996 210 G CA -0.008 45.078 45.100 -0.023 0.000 0.645 210 G HN 0.076 8.289 8.290 -0.060 0.041 0.498 211 T N -1.982 112.621 114.554 0.081 0.000 2.893 211 T HA -0.045 4.386 4.350 0.135 0.000 0.279 211 T C -0.523 173.991 174.700 -0.310 0.000 0.991 211 T CA -1.664 60.441 62.100 0.007 0.000 0.950 211 T CB 2.104 70.965 68.868 -0.013 0.000 1.223 211 T HN -0.885 7.293 8.240 0.006 0.066 0.585 212 G N -1.559 106.817 108.800 -0.705 0.000 2.138 212 G HA2 -0.399 2.970 3.960 -0.985 0.000 0.193 212 G HA3 -0.399 2.943 3.960 -1.030 0.000 0.193 212 G C -0.797 173.728 174.900 -0.627 0.000 0.998 212 G CA -0.258 44.311 45.100 -0.886 0.000 0.668 212 G HN -0.227 7.980 8.290 -0.458 -0.192 0.516 213 D N -0.837 119.070 120.400 -0.821 0.000 2.363 213 D HA -0.012 3.705 4.640 -1.539 0.000 0.240 213 D C 1.381 177.414 176.300 -0.445 0.000 1.236 213 D CA -0.614 52.798 54.000 -0.979 0.000 0.927 213 D CB 1.901 42.307 40.800 -0.657 0.000 1.150 213 D HN -0.690 7.514 8.370 -0.555 -0.167 0.458 214 V N 0.746 120.439 119.914 -0.368 0.000 3.305 214 V HA -0.153 4.033 4.120 -0.108 -0.131 0.269 214 V C -0.346 175.650 176.094 -0.164 0.000 1.157 214 V CA 1.779 63.959 62.300 -0.201 0.000 1.157 214 V CB 0.512 32.211 31.823 -0.207 0.000 0.772 214 V HN 0.200 8.136 8.190 -0.424 0.000 0.498 215 S N -5.971 109.588 115.700 -0.234 0.000 2.605 215 S HA -0.002 4.420 4.470 -0.079 0.000 0.217 215 S C -0.585 174.006 174.600 -0.014 0.000 0.958 215 S CA -0.105 58.014 58.200 -0.134 0.000 0.919 215 S CB 0.106 63.192 63.200 -0.189 0.000 0.780 215 S HN -0.487 7.590 8.310 -0.277 0.067 0.507 216 D N 3.354 123.732 120.400 -0.037 0.000 2.485 216 D HA 0.216 4.845 4.640 -0.019 0.000 0.221 216 D C -0.745 175.570 176.300 0.025 0.000 1.112 216 D CA -0.364 53.622 54.000 -0.023 0.000 0.911 216 D CB -0.316 40.442 40.800 -0.070 0.000 1.019 216 D HN -0.624 7.604 8.370 -0.078 0.096 0.516 217 V N -4.214 115.719 119.914 0.032 0.000 3.376 217 V HA 0.424 4.819 4.120 0.073 -0.231 0.313 217 V C -0.652 175.421 176.094 -0.036 0.000 1.393 217 V CA -1.726 60.596 62.300 0.036 0.000 1.125 217 V CB 1.205 33.078 31.823 0.084 0.000 1.037 217 V HN -0.665 7.534 8.190 0.015 0.000 0.440 218 G N -1.320 107.444 108.800 -0.060 0.000 2.498 218 G HA2 -0.237 3.650 3.960 -0.121 0.000 0.651 218 G HA3 -0.237 3.942 3.960 -0.050 -0.250 0.651 218 G C -1.892 172.905 174.900 -0.172 0.000 1.284 218 G CA -0.734 44.304 45.100 -0.103 0.000 0.950 218 G HN -0.821 7.438 8.290 -0.052 0.000 0.511 219 L N -0.864 120.208 121.223 -0.251 0.000 2.350 219 L HA 0.428 4.707 4.340 -0.102 0.000 0.260 219 L C 0.726 177.606 176.870 0.016 0.000 1.015 219 L CA -1.221 53.504 54.840 -0.190 0.000 0.821 219 L CB 3.151 44.910 42.059 -0.500 0.000 1.370 219 L HN 0.671 8.627 8.230 -0.291 0.099 0.416 220 G N -0.159 108.723 108.800 0.138 0.000 2.667 220 G HA2 -0.532 3.489 3.960 0.101 0.000 0.379 220 G HA3 -0.532 3.578 3.960 0.249 0.000 0.379 220 G C 1.203 176.177 174.900 0.123 0.000 1.236 220 G CA 2.279 47.477 45.100 0.164 0.000 0.946 220 G HN 0.290 8.650 8.290 0.115 0.000 0.573 221 K N 4.682 125.169 120.400 0.145 0.000 2.242 221 K HA -0.306 4.052 4.320 0.064 0.000 0.206 221 K C 0.712 177.332 176.600 0.033 0.000 1.045 221 K CA 1.691 58.026 56.287 0.080 0.000 0.930 221 K CB -0.409 32.136 32.500 0.077 0.000 0.726 221 K HN 0.451 8.812 8.250 0.185 0.000 0.462 222 G N -3.305 105.532 108.800 0.062 0.000 3.707 222 G HA2 0.213 4.159 3.960 -0.023 0.000 0.286 222 G HA3 0.213 4.310 3.960 0.047 -0.109 0.286 222 G C -1.282 173.714 174.900 0.160 0.000 1.112 222 G CA -1.072 44.073 45.100 0.076 0.000 0.861 222 G HN -0.134 8.173 8.290 0.104 0.045 0.534 223 R N 0.661 121.199 120.500 0.064 0.000 2.543 223 R HA -0.259 3.967 4.340 -0.196 -0.003 0.277 223 R C -0.571 175.667 176.300 -0.104 0.000 1.074 223 R CA 0.997 56.971 56.100 -0.211 0.000 1.076 223 R CB 0.317 30.344 30.300 -0.455 0.000 0.993 223 R HN -0.093 8.077 8.270 0.076 0.145 0.459 224 Y N -3.252 117.110 120.300 0.104 0.000 4.929 224 Y HA -0.347 4.163 4.550 -0.067 0.000 0.252 224 Y C -1.516 174.256 175.900 -0.213 0.000 0.950 224 Y CA 1.352 59.421 58.100 -0.051 0.000 1.935 224 Y CB -2.607 35.804 38.460 -0.083 0.000 1.440 224 Y HN 0.644 8.630 8.280 -0.307 0.110 0.567 225 Y N -4.786 115.540 120.300 0.042 0.000 2.555 225 Y HA 0.078 4.577 4.550 -0.085 0.000 0.259 225 Y C -1.606 174.250 175.900 -0.073 0.000 1.179 225 Y CA 0.045 58.118 58.100 -0.045 0.000 1.230 225 Y CB 0.910 39.351 38.460 -0.032 0.000 1.146 225 Y HN -0.341 7.934 8.280 0.231 0.143 0.526 226 S N 0.680 116.409 115.700 0.048 0.000 2.552 226 S HA 0.512 5.121 4.470 0.045 -0.112 0.314 226 S C -1.500 173.128 174.600 0.048 0.000 1.099 226 S CA -0.910 57.319 58.200 0.049 0.000 1.070 226 S CB 2.020 65.251 63.200 0.052 0.000 0.998 226 S HN -0.750 7.523 8.310 0.052 0.068 0.474 227 V N 5.909 125.852 119.914 0.049 0.000 2.459 227 V HA 0.203 4.357 4.120 0.058 0.000 0.295 227 V C -1.657 174.500 176.094 0.105 0.000 1.029 227 V CA -1.325 61.007 62.300 0.053 0.000 0.874 227 V CB 2.234 34.062 31.823 0.009 0.000 0.985 227 V HN 0.953 9.173 8.190 0.050 0.000 0.438 228 N N 5.642 124.401 118.700 0.099 0.000 2.295 228 N HA 0.417 5.462 4.740 0.262 -0.148 0.293 228 N C -1.430 174.083 175.510 0.006 0.000 1.040 228 N CA -0.646 52.495 53.050 0.152 0.000 0.840 228 N CB 4.060 42.637 38.487 0.150 0.000 1.468 228 N HN 0.272 8.695 8.380 0.073 0.000 0.478 229 V N 3.485 123.343 119.914 -0.093 0.000 2.289 229 V HA 0.460 4.490 4.120 -0.150 0.000 0.272 229 V C -2.687 173.185 176.094 -0.369 0.000 1.026 229 V CA -3.351 58.832 62.300 -0.195 0.000 0.807 229 V CB 1.051 32.778 31.823 -0.159 0.000 1.044 229 V HN 0.893 9.049 8.190 -0.056 0.000 0.443 230 P HA 0.152 4.436 4.420 -0.415 -0.112 0.281 230 P C -1.228 176.027 177.300 -0.074 0.000 1.286 230 P CA -0.988 61.973 63.100 -0.231 0.000 0.772 230 P CB -0.313 31.301 31.700 -0.143 0.000 0.862 231 I N 2.627 123.199 120.570 0.004 0.000 3.100 231 I HA 0.437 4.575 4.170 -0.053 0.000 0.312 231 I C -0.819 175.363 176.117 0.109 0.000 1.063 231 I CA -2.216 59.093 61.300 0.016 0.000 1.031 231 I CB 2.711 40.680 38.000 -0.052 0.000 1.243 231 I HN 0.693 8.924 8.210 0.035 0.000 0.483 232 Q N -1.523 118.298 119.800 0.035 0.000 2.712 232 Q HA 0.407 4.788 4.340 0.067 0.000 0.267 232 Q C -0.667 175.393 176.000 0.100 0.000 1.062 232 Q CA -2.281 53.554 55.803 0.052 0.000 0.888 232 Q CB 2.559 31.290 28.738 -0.011 0.000 1.374 232 Q HN -0.086 8.411 8.270 -0.063 -0.264 0.498 233 D N -2.213 118.227 120.400 0.066 0.000 2.344 233 D HA -0.112 4.804 4.640 0.292 -0.101 0.244 233 D C 1.376 177.693 176.300 0.028 0.000 1.134 233 D CA 1.281 55.345 54.000 0.106 0.000 0.930 233 D CB 0.907 41.729 40.800 0.037 0.000 1.175 233 D HN 0.019 8.399 8.370 0.016 0.000 0.437 234 G N -1.180 107.652 108.800 0.054 0.000 2.176 234 G HA2 -0.544 3.426 3.960 0.017 0.000 0.252 234 G HA3 -0.544 3.671 3.960 -0.015 -0.264 0.252 234 G C -1.192 173.664 174.900 -0.073 0.000 1.024 234 G CA 0.374 45.471 45.100 -0.005 0.000 0.755 234 G HN 0.601 8.870 8.290 0.145 0.108 0.507 235 I N -0.845 119.619 120.570 -0.176 0.000 2.581 235 I HA -0.046 4.209 4.170 -0.156 -0.179 0.288 235 I C -1.886 174.137 176.117 -0.157 0.000 1.047 235 I CA -1.162 60.000 61.300 -0.230 0.000 1.374 235 I CB 1.696 39.430 38.000 -0.443 0.000 1.423 235 I HN -0.488 7.591 8.210 -0.219 0.000 0.549 236 Q N 4.351 124.095 119.800 -0.094 0.000 2.399 236 Q HA 0.402 4.863 4.340 -0.076 -0.167 0.276 236 Q C 0.517 176.506 176.000 -0.018 0.000 1.098 236 Q CA -1.672 54.094 55.803 -0.062 0.000 0.827 236 Q CB 3.987 32.696 28.738 -0.050 0.000 1.386 236 Q HN 0.390 8.609 8.270 -0.084 0.000 0.443 237 D N 0.513 120.897 120.400 -0.027 0.000 2.612 237 D HA -0.521 4.127 4.640 0.013 0.000 0.191 237 D C 1.565 177.912 176.300 0.079 0.000 1.061 237 D CA 4.022 58.028 54.000 0.010 0.000 0.912 237 D CB -0.093 40.684 40.800 -0.038 0.000 0.891 237 D HN 0.744 9.080 8.370 -0.057 0.000 0.463 238 E N -1.760 118.469 120.200 0.048 0.000 2.042 238 E HA -0.290 4.128 4.350 0.113 0.000 0.189 238 E C 1.470 178.111 176.600 0.068 0.000 0.974 238 E CA 2.412 58.855 56.400 0.070 0.000 0.806 238 E CB -0.316 29.399 29.700 0.025 0.000 0.769 238 E HN 0.114 8.443 8.360 0.014 0.039 0.451 239 K N 0.388 120.800 120.400 0.021 0.000 2.026 239 K HA -0.335 3.961 4.320 -0.040 0.000 0.208 239 K C 2.160 178.744 176.600 -0.025 0.000 1.048 239 K CA 2.901 59.172 56.287 -0.027 0.000 0.929 239 K CB -0.046 32.416 32.500 -0.063 0.000 0.713 239 K HN -0.612 7.643 8.250 0.008 0.000 0.439 240 Y N -0.715 119.519 120.300 -0.109 0.000 2.030 240 Y HA -0.552 3.897 4.550 -0.170 0.000 0.274 240 Y C 1.631 177.499 175.900 -0.053 0.000 1.153 240 Y CA 4.060 62.092 58.100 -0.114 0.000 1.115 240 Y CB 0.019 38.418 38.460 -0.102 0.000 0.969 240 Y HN -0.318 8.023 8.280 0.103 0.000 0.488 241 Y N -1.074 119.316 120.300 0.149 0.000 2.040 241 Y HA -0.528 4.078 4.550 0.093 0.000 0.275 241 Y C 2.013 177.849 175.900 -0.108 0.000 1.171 241 Y CA 2.966 61.086 58.100 0.035 0.000 1.123 241 Y CB -0.330 38.141 38.460 0.018 0.000 0.963 241 Y HN -0.636 7.884 8.280 0.400 0.000 0.493 242 Q N -2.192 117.481 119.800 -0.211 0.000 2.152 242 Q HA -0.477 3.589 4.340 -0.456 0.000 0.206 242 Q C 2.675 178.468 176.000 -0.346 0.000 0.985 242 Q CA 3.332 58.948 55.803 -0.310 0.000 0.863 242 Q CB -0.148 28.522 28.738 -0.114 0.000 0.904 242 Q HN -0.438 7.867 8.270 0.057 0.000 0.422 243 I N -0.642 119.739 120.570 -0.315 0.000 2.141 243 I HA -0.488 3.532 4.170 -0.250 0.000 0.236 243 I C 1.675 177.577 176.117 -0.359 0.000 1.071 243 I CA 4.102 65.215 61.300 -0.312 0.000 1.345 243 I CB -0.072 37.721 38.000 -0.344 0.000 1.066 243 I HN -0.462 7.472 8.210 -0.278 0.109 0.406 244 c N 0.374 118.715 118.600 -0.432 0.000 2.303 244 c HA -0.642 3.757 4.570 -0.284 0.000 0.273 244 c C 1.697 175.560 174.090 -0.377 0.000 1.154 244 c CA 4.586 60.702 56.329 -0.356 0.000 1.784 244 c CB -1.729 40.619 42.510 -0.271 0.000 1.993 244 c HN -0.060 7.868 8.230 -0.503 0.000 0.430 245 E N -0.756 119.053 120.200 -0.651 0.000 2.136 245 E HA -0.542 3.216 4.350 -0.986 0.000 0.202 245 E C 1.984 178.334 176.600 -0.417 0.000 1.019 245 E CA 3.412 59.327 56.400 -0.808 0.000 0.819 245 E CB -0.218 28.795 29.700 -1.145 0.000 0.739 245 E HN 0.360 8.230 8.360 -0.816 0.000 0.458 246 S N -0.616 114.901 115.700 -0.306 0.000 2.368 246 S HA -0.287 4.109 4.470 -0.124 0.000 0.224 246 S C 2.021 176.574 174.600 -0.079 0.000 1.029 246 S CA 3.893 61.999 58.200 -0.157 0.000 0.988 246 S CB -0.057 63.053 63.200 -0.151 0.000 0.838 246 S HN -0.462 7.527 8.310 -0.359 0.105 0.462 247 V N 2.688 122.547 119.914 -0.092 0.000 2.323 247 V HA -0.417 3.685 4.120 -0.031 0.000 0.244 247 V C 1.292 177.420 176.094 0.057 0.000 1.041 247 V CA 4.528 66.808 62.300 -0.033 0.000 1.025 247 V CB -0.170 31.619 31.823 -0.057 0.000 0.656 247 V HN -0.663 7.436 8.190 -0.152 0.000 0.451 248 L N -1.852 119.432 121.223 0.100 0.000 2.131 248 L HA -0.450 4.097 4.340 0.345 0.000 0.210 248 L C 2.149 179.303 176.870 0.473 0.000 1.092 248 L CA 3.356 58.408 54.840 0.353 0.000 0.759 248 L CB -1.111 41.228 42.059 0.466 0.000 0.903 248 L HN 0.337 8.566 8.230 -0.001 0.000 0.435 249 K N 0.242 120.848 120.400 0.343 0.000 2.001 249 K HA -0.367 4.267 4.320 0.524 0.000 0.208 249 K C 2.233 178.961 176.600 0.214 0.000 1.048 249 K CA 3.521 60.018 56.287 0.350 0.000 0.932 249 K CB -0.131 32.500 32.500 0.219 0.000 0.715 249 K HN -0.086 8.250 8.250 0.175 0.019 0.437 250 E N -1.055 119.214 120.200 0.115 0.000 2.077 250 E HA -0.294 4.078 4.350 0.037 0.000 0.193 250 E C 2.867 179.492 176.600 0.043 0.000 0.989 250 E CA 2.821 59.249 56.400 0.046 0.000 0.800 250 E CB -0.312 29.384 29.700 -0.006 0.000 0.746 250 E HN -0.618 7.797 8.360 0.091 0.000 0.452 251 V N 0.397 120.357 119.914 0.077 0.000 2.358 251 V HA -0.388 3.742 4.120 0.017 0.000 0.246 251 V C 1.919 178.062 176.094 0.081 0.000 1.047 251 V CA 4.510 66.852 62.300 0.070 0.000 1.035 251 V CB -0.149 31.732 31.823 0.098 0.000 0.658 251 V HN 0.417 8.670 8.190 0.105 0.000 0.452 252 Y N 1.003 121.260 120.300 -0.071 0.000 2.114 252 Y HA -0.528 3.801 4.550 -0.370 0.000 0.284 252 Y C 1.511 177.285 175.900 -0.210 0.000 1.143 252 Y CA 4.123 62.027 58.100 -0.328 0.000 1.135 252 Y CB 0.017 38.066 38.460 -0.685 0.000 0.980 252 Y HN 0.124 8.434 8.280 0.236 0.112 0.499 253 Q N -0.723 119.033 119.800 -0.074 0.000 2.124 253 Q HA -0.317 3.859 4.340 -0.273 0.000 0.202 253 Q C 1.708 177.624 176.000 -0.140 0.000 0.977 253 Q CA 2.457 58.176 55.803 -0.140 0.000 0.850 253 Q CB -0.374 28.360 28.738 -0.006 0.000 0.901 253 Q HN 0.090 8.426 8.270 0.111 0.000 0.429 254 A N -2.380 120.395 122.820 -0.074 0.000 1.935 254 A HA -0.180 4.106 4.320 -0.057 0.000 0.214 254 A C -0.215 177.375 177.584 0.010 0.000 1.178 254 A CA 1.923 53.933 52.037 -0.046 0.000 0.640 254 A CB 0.486 19.458 19.000 -0.047 0.000 0.825 254 A HN -0.012 7.996 8.150 -0.040 0.118 0.447 255 F N -3.100 116.754 119.950 -0.159 0.000 2.746 255 F HA -0.008 4.494 4.527 -0.042 0.000 0.297 255 F C -0.746 174.959 175.800 -0.158 0.000 1.113 255 F CA -0.346 57.591 58.000 -0.105 0.000 1.367 255 F CB 2.321 41.279 39.000 -0.071 0.000 1.111 255 F HN -0.252 7.982 8.300 0.081 0.114 0.590 256 N N 0.864 119.355 118.700 -0.348 0.000 2.652 256 N HA -0.339 3.997 4.740 -0.871 -0.118 0.281 256 N C -2.729 172.458 175.510 -0.538 0.000 1.084 256 N CA 0.117 52.820 53.050 -0.577 0.000 0.775 256 N CB -0.523 37.701 38.487 -0.438 0.000 0.923 256 N HN -0.486 7.684 8.380 -0.273 0.046 0.558 257 P HA -0.007 4.213 4.420 -0.333 0.000 0.276 257 P C -1.333 175.882 177.300 -0.142 0.000 1.261 257 P CA 0.213 63.194 63.100 -0.197 0.000 0.800 257 P CB 1.298 33.043 31.700 0.075 0.000 1.066 258 K N -3.635 116.719 120.400 -0.076 0.000 2.436 258 K HA 0.340 4.652 4.320 -0.014 0.000 0.198 258 K C -0.620 175.856 176.600 -0.206 0.000 1.174 258 K CA -0.338 55.931 56.287 -0.029 0.000 0.951 258 K CB 2.472 35.042 32.500 0.116 0.000 1.040 258 K HN 0.482 8.700 8.250 -0.053 0.000 0.536 259 A N -2.782 119.865 122.820 -0.288 0.000 2.566 259 A HA 0.601 4.715 4.320 -0.512 -0.101 0.292 259 A C -2.621 174.873 177.584 -0.149 0.000 1.112 259 A CA -1.115 50.615 52.037 -0.511 0.000 0.707 259 A CB 3.346 21.712 19.000 -1.057 0.000 1.302 259 A HN -0.848 7.226 8.150 -0.126 0.000 0.409 260 V N -1.859 117.997 119.914 -0.097 0.000 3.040 260 V HA 0.834 5.190 4.120 0.074 -0.192 0.312 260 V C -1.184 174.909 176.094 -0.000 0.000 1.115 260 V CA -1.792 60.525 62.300 0.030 0.000 0.998 260 V CB 4.706 36.592 31.823 0.105 0.000 1.042 260 V HN 0.735 8.729 8.190 -0.162 0.099 0.433 261 V N 3.141 123.085 119.914 0.050 0.000 2.482 261 V HA 0.294 4.553 4.120 0.014 -0.131 0.295 261 V C -2.336 173.777 176.094 0.033 0.000 1.026 261 V CA -0.411 61.931 62.300 0.071 0.000 0.856 261 V CB 3.168 35.093 31.823 0.169 0.000 1.001 261 V HN 0.370 8.610 8.190 0.083 0.000 0.424 262 L N 7.275 128.474 121.223 -0.041 0.000 2.356 262 L HA 0.793 5.197 4.340 -0.182 -0.173 0.277 262 L C -2.826 173.973 176.870 -0.117 0.000 0.996 262 L CA -1.744 53.030 54.840 -0.110 0.000 0.822 262 L CB 4.108 46.121 42.059 -0.077 0.000 1.256 262 L HN 1.060 9.260 8.230 -0.050 0.000 0.413 263 Q N 6.056 125.757 119.800 -0.165 0.000 2.322 263 Q HA 0.404 4.849 4.340 -0.093 -0.160 0.265 263 Q C -1.920 174.060 176.000 -0.033 0.000 0.985 263 Q CA -1.689 54.055 55.803 -0.099 0.000 0.849 263 Q CB 2.758 31.449 28.738 -0.078 0.000 1.274 263 Q HN 0.585 8.685 8.270 -0.283 0.000 0.449 264 L N 5.825 127.070 121.223 0.037 0.000 3.154 264 L HA 0.372 4.802 4.340 0.150 0.000 0.266 264 L C -0.818 176.233 176.870 0.301 0.000 1.300 264 L CA -1.760 53.189 54.840 0.181 0.000 1.028 264 L CB 0.051 42.284 42.059 0.290 0.000 1.412 264 L HN 0.325 8.551 8.230 -0.007 0.000 0.564 265 G N -0.185 108.717 108.800 0.170 0.000 2.109 265 G HA2 -0.258 3.919 3.960 0.322 0.000 0.249 265 G HA3 -0.258 3.959 3.960 0.030 -0.239 0.249 265 G C -0.415 174.576 174.900 0.152 0.000 1.126 265 G CA 0.192 45.395 45.100 0.172 0.000 0.923 265 G HN -0.105 8.355 8.290 0.059 -0.134 0.439 266 A N 7.454 130.321 122.820 0.079 0.000 3.019 266 A HA 0.080 4.351 4.320 -0.082 0.000 0.262 266 A C -0.760 176.672 177.584 -0.253 0.000 1.509 266 A CA -1.143 50.781 52.037 -0.189 0.000 1.159 266 A CB -0.497 18.132 19.000 -0.618 0.000 1.042 266 A HN 0.430 8.693 8.150 0.187 0.000 0.641 267 D N -3.813 116.490 120.400 -0.162 0.000 2.402 267 D HA 0.195 4.949 4.640 -0.200 -0.234 0.216 267 D C 0.446 176.687 176.300 -0.099 0.000 1.128 267 D CA 0.008 53.921 54.000 -0.145 0.000 0.833 267 D CB -0.132 40.634 40.800 -0.056 0.000 0.971 267 D HN -0.420 7.805 8.370 -0.079 0.098 0.503 268 T N -3.555 110.946 114.554 -0.089 0.000 3.040 268 T HA -0.054 4.234 4.350 -0.103 0.000 0.252 268 T C 0.055 174.749 174.700 -0.010 0.000 1.064 268 T CA 1.004 63.084 62.100 -0.034 0.000 1.110 268 T CB 0.745 69.644 68.868 0.051 0.000 0.921 268 T HN -0.288 7.823 8.240 -0.087 0.077 0.480 269 I N 1.649 122.171 120.570 -0.081 0.000 2.932 269 I HA -0.236 3.968 4.170 -0.099 -0.094 0.295 269 I C 0.614 176.684 176.117 -0.078 0.000 1.227 269 I CA -0.616 60.621 61.300 -0.104 0.000 1.429 269 I CB -0.651 37.250 38.000 -0.165 0.000 1.339 269 I HN -0.589 7.556 8.210 -0.108 0.000 0.589 270 A N 3.865 126.639 122.820 -0.076 0.000 2.425 270 A HA 0.019 4.318 4.320 -0.034 0.000 0.249 270 A C 0.010 177.549 177.584 -0.075 0.000 1.084 270 A CA 0.271 52.273 52.037 -0.058 0.000 0.781 270 A CB 1.247 20.211 19.000 -0.059 0.000 1.019 270 A HN 0.407 8.423 8.150 -0.090 0.080 0.490 271 G N 4.778 113.543 108.800 -0.060 0.000 2.992 271 G HA2 -0.309 3.616 3.960 -0.059 0.000 0.229 271 G HA3 -0.309 3.747 3.960 -0.088 -0.149 0.229 271 G C -0.595 174.273 174.900 -0.052 0.000 1.969 271 G CA -0.289 44.771 45.100 -0.067 0.000 1.603 271 G HN 0.316 8.580 8.290 -0.042 0.000 0.573 272 D N 4.340 124.699 120.400 -0.068 0.000 4.662 272 D HA -0.190 4.415 4.640 -0.057 0.000 0.116 272 D C -0.009 176.298 176.300 0.012 0.000 0.953 272 D CA 0.272 54.246 54.000 -0.044 0.000 0.570 272 D CB 0.679 41.442 40.800 -0.062 0.000 1.127 272 D HN -0.520 7.948 8.370 -0.097 -0.156 0.595 273 P HA -0.277 4.162 4.420 0.032 0.000 0.222 273 P C 0.531 177.874 177.300 0.072 0.000 1.157 273 P CA 2.120 65.255 63.100 0.058 0.000 0.905 273 P CB -0.036 31.713 31.700 0.081 0.000 0.792 274 M N -5.943 113.727 119.600 0.116 0.000 2.331 274 M HA -0.282 4.294 4.480 0.160 0.000 0.260 274 M C 0.795 177.137 176.300 0.070 0.000 1.072 274 M CA 0.282 55.662 55.300 0.134 0.000 1.065 274 M CB -0.389 32.319 32.600 0.180 0.000 1.392 274 M HN -0.622 7.979 8.290 0.153 -0.220 0.427 275 C N -0.514 118.809 119.300 0.038 0.000 3.603 275 C HA -0.472 3.994 4.460 0.010 0.000 0.279 275 C C -0.854 174.143 174.990 0.011 0.000 1.436 275 C CA 1.137 60.166 59.018 0.018 0.000 2.054 275 C CB -1.499 26.252 27.740 0.018 0.000 1.341 275 C HN 0.365 8.437 8.230 0.037 0.180 0.608 276 S N -0.699 115.000 115.700 -0.002 0.000 2.811 276 S HA 0.056 4.581 4.470 -0.012 -0.062 0.237 276 S C -0.625 174.079 174.600 0.175 0.000 1.038 276 S CA 2.164 60.355 58.200 -0.016 0.000 0.881 276 S CB 1.638 64.708 63.200 -0.216 0.000 0.815 276 S HN 0.131 8.424 8.310 -0.006 0.013 0.582 277 F N -0.693 119.219 119.950 -0.064 0.000 2.403 277 F HA -0.002 4.492 4.527 -0.054 0.000 0.326 277 F C -1.352 174.406 175.800 -0.069 0.000 1.099 277 F CA -0.068 57.894 58.000 -0.063 0.000 1.036 277 F CB 2.529 41.486 39.000 -0.072 0.000 1.336 277 F HN -0.358 7.970 8.300 0.047 0.000 0.497 278 N N -0.524 118.241 118.700 0.108 0.000 2.703 278 N HA 0.253 4.999 4.740 0.011 0.000 0.283 278 N C -1.665 173.827 175.510 -0.031 0.000 1.851 278 N CA -0.748 52.310 53.050 0.014 0.000 0.826 278 N CB 0.725 39.209 38.487 -0.005 0.000 1.239 278 N HN 0.372 8.791 8.380 0.066 0.000 0.495 279 M N 0.612 120.191 119.600 -0.035 0.000 2.613 279 M HA 0.850 5.436 4.480 -0.101 -0.167 0.301 279 M C -0.825 175.410 176.300 -0.109 0.000 1.205 279 M CA -1.802 53.441 55.300 -0.096 0.000 0.950 279 M CB 3.304 35.813 32.600 -0.153 0.000 1.585 279 M HN -0.255 8.039 8.290 0.007 0.000 0.490 280 T N -3.542 110.933 114.554 -0.131 0.000 2.901 280 T HA 0.591 4.847 4.350 -0.157 0.000 0.293 280 T C -1.471 173.124 174.700 -0.176 0.000 1.084 280 T CA -2.748 59.255 62.100 -0.161 0.000 1.008 280 T CB 1.244 70.009 68.868 -0.171 0.000 1.170 280 T HN 0.286 8.804 8.240 -0.132 -0.357 0.509 281 P HA -0.166 4.232 4.420 -0.037 0.000 0.220 281 P C 0.166 177.382 177.300 -0.140 0.000 1.144 281 P CA 2.183 65.181 63.100 -0.170 0.000 0.800 281 P CB -0.055 31.487 31.700 -0.264 0.000 0.772 282 V N -3.012 116.712 119.914 -0.316 0.000 2.453 282 V HA -0.284 3.831 4.120 -0.009 0.000 0.247 282 V C 2.194 178.263 176.094 -0.040 0.000 1.048 282 V CA 3.548 65.751 62.300 -0.162 0.000 1.049 282 V CB -0.625 31.050 31.823 -0.245 0.000 0.672 282 V HN -0.749 7.163 8.190 -0.364 0.060 0.457 283 G N -0.968 107.793 108.800 -0.065 0.000 2.422 283 G HA2 -0.190 3.747 3.960 -0.038 0.000 0.218 283 G HA3 -0.190 3.775 3.960 -0.029 -0.022 0.218 283 G C 1.355 176.284 174.900 0.047 0.000 1.140 283 G CA 2.096 47.183 45.100 -0.021 0.000 0.775 283 G HN -0.415 7.915 8.290 -0.103 -0.102 0.545 284 I N 0.765 121.355 120.570 0.032 0.000 2.584 284 I HA -0.086 4.160 4.170 0.127 0.000 0.255 284 I C 1.365 177.567 176.117 0.140 0.000 1.145 284 I CA -0.403 60.953 61.300 0.093 0.000 1.462 284 I CB -1.046 37.000 38.000 0.076 0.000 1.102 284 I HN -0.848 7.336 8.210 -0.004 0.024 0.433 285 G N 0.614 109.523 108.800 0.182 0.000 2.442 285 G HA2 -0.382 3.664 3.960 0.143 0.000 0.219 285 G HA3 -0.382 3.824 3.960 0.377 -0.019 0.219 285 G C 1.139 176.076 174.900 0.062 0.000 1.141 285 G CA 2.336 47.554 45.100 0.196 0.000 0.763 285 G HN 0.494 8.704 8.290 0.186 0.191 0.554 286 K N 1.420 121.817 120.400 -0.005 0.000 2.025 286 K HA -0.201 4.035 4.320 -0.141 0.000 0.207 286 K C 2.073 178.727 176.600 0.091 0.000 1.049 286 K CA 3.179 59.370 56.287 -0.159 0.000 0.933 286 K CB -0.062 32.017 32.500 -0.702 0.000 0.714 286 K HN -0.425 7.817 8.250 0.004 0.011 0.438 287 c N -0.051 118.694 118.600 0.241 0.000 2.388 287 c HA -0.340 4.446 4.570 0.360 0.000 0.277 287 c C 1.891 176.056 174.090 0.125 0.000 1.210 287 c CA 4.988 61.481 56.329 0.273 0.000 1.743 287 c CB -1.865 40.797 42.510 0.253 0.000 2.047 287 c HN -0.540 7.822 8.230 0.220 0.000 0.458 288 L N -0.437 120.832 121.223 0.077 0.000 1.978 288 L HA -0.522 3.799 4.340 -0.030 0.000 0.218 288 L C 1.551 178.387 176.870 -0.056 0.000 1.075 288 L CA 3.748 58.588 54.840 -0.000 0.000 0.767 288 L CB -0.356 41.719 42.059 0.027 0.000 0.890 288 L HN -0.004 8.292 8.230 0.109 0.000 0.434 289 K N -2.077 118.304 120.400 -0.031 0.000 2.074 289 K HA -0.515 3.753 4.320 -0.087 0.000 0.209 289 K C 2.321 178.860 176.600 -0.101 0.000 1.048 289 K CA 3.557 59.807 56.287 -0.062 0.000 0.926 289 K CB -0.323 32.153 32.500 -0.039 0.000 0.713 289 K HN -0.209 8.040 8.250 -0.003 0.000 0.444 290 Y N 0.424 120.615 120.300 -0.183 0.000 2.036 290 Y HA -0.443 3.968 4.550 -0.232 0.000 0.273 290 Y C 2.291 177.762 175.900 -0.715 0.000 1.135 290 Y CA 3.564 61.481 58.100 -0.306 0.000 1.106 290 Y CB -0.068 38.298 38.460 -0.157 0.000 0.976 290 Y HN -0.140 8.118 8.280 0.119 0.093 0.483 291 I N -1.576 118.551 120.570 -0.737 0.000 2.143 291 I HA -0.640 2.080 4.170 -2.417 0.000 0.245 291 I C 2.269 177.955 176.117 -0.719 0.000 1.068 291 I CA 4.014 64.629 61.300 -1.142 0.000 1.326 291 I CB -0.365 37.328 38.000 -0.512 0.000 1.028 291 I HN -0.133 7.892 8.210 -0.307 0.000 0.412 292 L N -2.566 118.417 121.223 -0.400 0.000 2.131 292 L HA -0.220 4.029 4.340 -0.151 0.000 0.210 292 L C 2.188 178.927 176.870 -0.219 0.000 1.092 292 L CA 3.174 57.881 54.840 -0.221 0.000 0.759 292 L CB -0.765 41.208 42.059 -0.144 0.000 0.903 292 L HN 0.334 8.354 8.230 -0.337 0.007 0.435 293 Q N -0.386 119.210 119.800 -0.340 0.000 2.297 293 Q HA -0.294 3.964 4.340 -0.136 0.000 0.208 293 Q C 1.379 177.318 176.000 -0.102 0.000 0.981 293 Q CA 2.608 58.271 55.803 -0.234 0.000 0.876 293 Q CB -1.042 27.515 28.738 -0.302 0.000 0.921 293 Q HN 0.005 7.864 8.270 -0.454 0.139 0.446 294 W N -2.193 118.929 121.300 -0.296 0.000 2.465 294 W HA -0.078 4.378 4.660 -0.340 0.000 0.268 294 W C -0.312 176.140 176.519 -0.112 0.000 1.242 294 W CA 0.285 57.459 57.345 -0.284 0.000 1.248 294 W CB -0.133 29.113 29.460 -0.358 0.000 1.118 294 W HN -0.641 7.140 8.180 -0.390 0.165 0.587 295 Q N -7.412 112.447 119.800 0.098 0.000 2.494 295 Q HA -0.460 3.899 4.340 0.032 0.000 0.272 295 Q C -1.692 174.356 176.000 0.080 0.000 1.145 295 Q CA 0.734 56.576 55.803 0.065 0.000 0.943 295 Q CB -2.971 25.802 28.738 0.057 0.000 1.338 295 Q HN -0.009 8.129 8.270 0.041 0.157 0.492 296 L N -3.518 117.764 121.223 0.099 0.000 2.332 296 L HA 0.260 4.627 4.340 0.045 0.000 0.269 296 L C -0.412 176.450 176.870 -0.013 0.000 1.016 296 L CA -1.947 52.926 54.840 0.054 0.000 0.809 296 L CB 1.694 43.806 42.059 0.088 0.000 1.280 296 L HN -0.534 7.772 8.230 0.126 0.000 0.447 297 A N 0.176 122.933 122.820 -0.105 0.000 2.484 297 A HA 0.160 4.656 4.320 -0.047 -0.205 0.268 297 A C -0.703 176.800 177.584 -0.136 0.000 1.114 297 A CA -0.038 51.924 52.037 -0.126 0.000 0.780 297 A CB 0.160 19.024 19.000 -0.227 0.000 1.061 297 A HN 0.691 8.745 8.150 -0.159 0.000 0.505 298 T N 6.729 121.237 114.554 -0.077 0.000 2.856 298 T HA 0.508 5.014 4.350 -0.066 -0.196 0.283 298 T C -1.176 173.474 174.700 -0.084 0.000 1.008 298 T CA -0.586 61.472 62.100 -0.070 0.000 0.997 298 T CB 2.421 71.255 68.868 -0.056 0.000 0.992 298 T HN 0.903 9.000 8.240 -0.059 0.108 0.454 299 L N 5.945 127.117 121.223 -0.085 0.000 2.341 299 L HA 0.760 5.204 4.340 -0.114 -0.173 0.278 299 L C -2.443 174.339 176.870 -0.147 0.000 1.005 299 L CA -1.512 53.266 54.840 -0.102 0.000 0.818 299 L CB 3.279 45.302 42.059 -0.060 0.000 1.259 299 L HN -0.022 8.167 8.230 -0.068 0.000 0.418 300 I N 4.048 124.470 120.570 -0.248 0.000 2.412 300 I HA 0.701 4.875 4.170 -0.262 -0.161 0.296 300 I C -1.303 174.553 176.117 -0.435 0.000 0.987 300 I CA -2.094 58.982 61.300 -0.374 0.000 1.180 300 I CB 1.286 38.922 38.000 -0.606 0.000 1.340 300 I HN 0.852 8.904 8.210 -0.264 0.000 0.455 301 L N 3.172 124.189 121.223 -0.343 0.000 2.354 301 L HA 0.611 4.947 4.340 -0.314 -0.185 0.264 301 L C -0.134 176.561 176.870 -0.291 0.000 1.008 301 L CA -2.054 52.620 54.840 -0.277 0.000 0.819 301 L CB 4.005 45.991 42.059 -0.121 0.000 1.339 301 L HN 0.674 8.745 8.230 -0.265 0.000 0.420 302 G N -1.197 107.413 108.800 -0.317 0.000 3.411 302 G HA2 0.553 4.151 3.960 -0.603 0.000 0.186 302 G HA3 0.553 4.073 3.960 -1.091 -0.215 0.186 302 G C -1.553 173.206 174.900 -0.234 0.000 1.766 302 G CA -1.240 43.511 45.100 -0.581 0.000 0.971 302 G HN -0.166 7.962 8.290 -0.270 0.000 0.590 303 G N -0.631 108.105 108.800 -0.107 0.000 2.295 303 G HA2 -0.180 3.411 3.960 -0.614 0.000 0.155 303 G HA3 -0.180 3.629 3.960 -0.251 0.000 0.155 303 G C -1.504 173.310 174.900 -0.143 0.000 1.307 303 G CA -0.546 44.397 45.100 -0.261 0.000 1.140 303 G HN -0.769 7.529 8.290 0.013 0.000 0.470 304 G N -0.833 107.841 108.800 -0.210 0.000 2.667 304 G HA2 -0.068 3.695 3.960 -0.329 0.000 0.250 304 G HA3 -0.068 3.725 3.960 -0.278 0.000 0.250 304 G C -1.599 172.962 174.900 -0.565 0.000 1.212 304 G CA -0.265 44.607 45.100 -0.380 0.000 0.874 304 G HN -0.078 8.371 8.290 -0.221 -0.292 0.561 305 G N -0.900 107.148 108.800 -1.253 0.000 2.315 305 G HA2 -0.106 3.746 3.960 -0.693 0.000 0.197 305 G HA3 -0.106 3.422 3.960 -0.719 0.000 0.197 305 G C -0.828 173.597 174.900 -0.793 0.000 2.750 305 G CA -0.377 44.218 45.100 -0.842 0.000 0.960 305 G HN -0.347 6.319 8.290 -2.708 0.000 0.557 306 Y N 1.858 122.093 120.300 -0.109 0.000 2.746 306 Y HA -0.046 4.465 4.550 -0.064 0.000 0.312 306 Y C -1.126 174.717 175.900 -0.096 0.000 1.117 306 Y CA -1.437 56.615 58.100 -0.080 0.000 1.324 306 Y CB -0.137 38.289 38.460 -0.057 0.000 1.173 306 Y HN -0.549 7.440 8.280 -0.768 -0.169 0.529 307 N N 0.680 119.314 118.700 -0.110 0.000 2.690 307 N HA 0.222 4.911 4.740 -0.086 0.000 0.255 307 N C -0.149 175.235 175.510 -0.210 0.000 1.195 307 N CA -1.110 51.861 53.050 -0.132 0.000 0.790 307 N CB 0.522 38.920 38.487 -0.148 0.000 1.216 307 N HN -0.756 7.396 8.380 -0.225 0.093 0.528 308 L N 4.914 126.036 121.223 -0.169 0.000 1.978 308 L HA -0.441 3.770 4.340 -0.214 0.000 0.218 308 L C 1.405 178.103 176.870 -0.285 0.000 1.075 308 L CA 3.769 58.487 54.840 -0.203 0.000 0.767 308 L CB -0.561 41.423 42.059 -0.125 0.000 0.890 308 L HN 0.492 8.658 8.230 -0.107 0.000 0.434 309 A N -1.448 121.158 122.820 -0.356 0.000 1.908 309 A HA -0.416 3.465 4.320 -0.731 0.000 0.218 309 A C 1.979 179.321 177.584 -0.404 0.000 1.181 309 A CA 3.127 54.793 52.037 -0.618 0.000 0.627 309 A CB -1.174 17.331 19.000 -0.825 0.000 0.818 309 A HN 0.449 8.418 8.150 -0.302 0.000 0.445 310 N N -1.323 117.179 118.700 -0.331 0.000 2.025 310 N HA -0.391 4.206 4.740 -0.238 0.000 0.194 310 N C 1.866 177.149 175.510 -0.378 0.000 1.044 310 N CA 3.464 56.340 53.050 -0.289 0.000 0.851 310 N CB -0.371 37.958 38.487 -0.263 0.000 1.036 310 N HN -0.135 8.050 8.380 -0.315 0.006 0.422 311 T N 2.815 117.070 114.554 -0.497 0.000 2.635 311 T HA -0.462 3.284 4.350 -1.007 0.000 0.267 311 T C 1.270 175.499 174.700 -0.785 0.000 1.040 311 T CA 5.261 66.845 62.100 -0.859 0.000 1.156 311 T CB -0.398 67.923 68.868 -0.912 0.000 0.863 311 T HN 0.229 8.102 8.240 -0.433 0.107 0.430 312 A N 1.088 123.648 122.820 -0.433 0.000 1.883 312 A HA -0.431 3.772 4.320 -0.195 0.000 0.217 312 A C 2.128 179.624 177.584 -0.148 0.000 1.186 312 A CA 3.259 55.175 52.037 -0.200 0.000 0.624 312 A CB -0.656 18.341 19.000 -0.006 0.000 0.822 312 A HN 0.274 8.198 8.150 -0.377 0.000 0.444 313 R N -1.648 118.796 120.500 -0.094 0.000 2.096 313 R HA -0.399 3.956 4.340 0.026 0.000 0.240 313 R C 2.036 178.263 176.300 -0.122 0.000 1.139 313 R CA 3.243 59.317 56.100 -0.045 0.000 0.952 313 R CB -0.239 30.043 30.300 -0.031 0.000 0.854 313 R HN -0.070 8.066 8.270 -0.117 0.064 0.436 314 C N 0.173 119.329 119.300 -0.239 0.000 2.418 314 C HA -0.400 4.018 4.460 -0.071 0.000 0.280 314 C C 1.792 176.722 174.990 -0.099 0.000 1.223 314 C CA 5.274 64.175 59.018 -0.195 0.000 1.736 314 C CB -0.568 26.945 27.740 -0.379 0.000 2.056 314 C HN 0.290 8.327 8.230 -0.321 0.000 0.459 315 W N -2.342 118.687 121.300 -0.452 0.000 2.387 315 W HA -0.255 3.806 4.660 -0.999 0.000 0.272 315 W C 2.161 178.361 176.519 -0.533 0.000 1.224 315 W CA 2.501 59.294 57.345 -0.920 0.000 1.210 315 W CB -1.435 27.100 29.460 -1.542 0.000 1.125 315 W HN 0.537 8.331 8.180 -0.644 0.000 0.572 316 T N 2.064 116.533 114.554 -0.142 0.000 2.896 316 T HA -0.271 4.015 4.350 -0.106 0.000 0.263 316 T C 1.254 175.878 174.700 -0.127 0.000 1.050 316 T CA 4.939 66.955 62.100 -0.140 0.000 1.140 316 T CB 0.036 68.788 68.868 -0.194 0.000 0.877 316 T HN 0.075 8.089 8.240 -0.146 0.139 0.457 317 Y N 3.024 123.214 120.300 -0.183 0.000 2.089 317 Y HA -0.446 3.989 4.550 -0.192 0.000 0.282 317 Y C 1.391 177.258 175.900 -0.055 0.000 1.139 317 Y CA 3.822 61.837 58.100 -0.143 0.000 1.123 317 Y CB 0.147 38.537 38.460 -0.117 0.000 0.980 317 Y HN 0.046 8.156 8.280 0.033 0.190 0.493 318 L N -2.426 118.727 121.223 -0.117 0.000 1.990 318 L HA -0.545 3.636 4.340 -0.266 0.000 0.213 318 L C 2.409 179.286 176.870 0.011 0.000 1.072 318 L CA 3.450 58.251 54.840 -0.064 0.000 0.755 318 L CB -0.706 41.489 42.059 0.226 0.000 0.889 318 L HN 0.471 8.775 8.230 0.123 0.000 0.432 319 T N -0.263 114.380 114.554 0.148 0.000 2.737 319 T HA -0.387 4.102 4.350 0.232 0.000 0.269 319 T C 1.859 176.544 174.700 -0.025 0.000 1.040 319 T CA 5.784 67.981 62.100 0.163 0.000 1.142 319 T CB -0.752 68.236 68.868 0.201 0.000 0.861 319 T HN 0.199 8.414 8.240 0.146 0.113 0.456 320 G N 0.323 109.047 108.800 -0.126 0.000 2.408 320 G HA2 -0.198 3.697 3.960 -0.108 0.000 0.217 320 G HA3 -0.198 3.660 3.960 -0.207 -0.022 0.217 320 G C 1.019 175.797 174.900 -0.204 0.000 1.150 320 G CA 1.754 46.754 45.100 -0.167 0.000 0.776 320 G HN -0.720 7.378 8.290 -0.148 0.104 0.542 321 V N 3.496 123.224 119.914 -0.309 0.000 2.261 321 V HA -0.465 3.489 4.120 -0.276 0.000 0.246 321 V C 2.642 178.653 176.094 -0.139 0.000 1.047 321 V CA 4.263 66.395 62.300 -0.279 0.000 1.015 321 V CB -0.065 31.559 31.823 -0.331 0.000 0.642 321 V HN -0.365 7.467 8.190 -0.375 0.133 0.446 322 I N -0.814 119.702 120.570 -0.090 0.000 2.185 322 I HA -0.516 3.618 4.170 -0.059 0.000 0.246 322 I C 1.422 177.507 176.117 -0.052 0.000 1.088 322 I CA 3.790 65.058 61.300 -0.053 0.000 1.347 322 I CB -0.130 37.860 38.000 -0.016 0.000 1.041 322 I HN 0.035 8.196 8.210 -0.081 0.000 0.415 323 L N -5.968 115.221 121.223 -0.056 0.000 2.418 323 L HA -0.002 4.316 4.340 -0.038 0.000 0.218 323 L C -0.027 176.811 176.870 -0.053 0.000 1.125 323 L CA 0.189 55.001 54.840 -0.048 0.000 0.835 323 L CB 0.786 42.818 42.059 -0.046 0.000 0.953 323 L HN -0.409 7.680 8.230 -0.065 0.102 0.454 324 G N -2.425 106.332 108.800 -0.072 0.000 2.272 324 G HA2 -0.366 3.582 3.960 -0.079 0.000 0.280 324 G HA3 -0.366 3.564 3.960 -0.051 0.000 0.280 324 G C -0.502 174.367 174.900 -0.051 0.000 1.067 324 G CA 0.407 45.468 45.100 -0.064 0.000 0.902 324 G HN -0.295 7.678 8.290 -0.092 0.262 0.500 325 K N -1.136 119.228 120.400 -0.060 0.000 2.340 325 K HA 0.279 4.586 4.320 -0.022 0.000 0.244 325 K C -0.983 175.598 176.600 -0.031 0.000 0.973 325 K CA -2.070 54.197 56.287 -0.034 0.000 0.828 325 K CB 2.189 34.674 32.500 -0.025 0.000 1.226 325 K HN -0.036 8.162 8.250 -0.086 0.000 0.437 326 T N 2.213 116.769 114.554 0.002 0.000 2.867 326 T HA 0.166 4.532 4.350 0.026 0.000 0.282 326 T C -0.484 174.248 174.700 0.054 0.000 1.000 326 T CA -0.230 61.887 62.100 0.028 0.000 1.042 326 T CB 0.632 69.521 68.868 0.035 0.000 0.973 326 T HN 0.018 8.263 8.240 0.009 0.000 0.465 327 L N 3.420 124.687 121.223 0.075 0.000 2.332 327 L HA 0.280 4.732 4.340 0.187 0.000 0.269 327 L C 0.179 177.173 176.870 0.207 0.000 1.016 327 L CA -1.090 53.835 54.840 0.142 0.000 0.809 327 L CB 1.627 43.667 42.059 -0.032 0.000 1.280 327 L HN 0.065 8.344 8.230 0.081 0.000 0.447 328 S N 0.664 116.572 115.700 0.346 0.000 2.562 328 S HA -0.012 4.546 4.470 0.147 0.000 0.281 328 S C 1.251 175.999 174.600 0.246 0.000 1.333 328 S CA 0.134 58.474 58.200 0.232 0.000 1.052 328 S CB 1.278 64.565 63.200 0.144 0.000 0.884 328 S HN 0.048 8.675 8.310 0.529 0.000 0.506 329 S N 5.714 121.503 115.700 0.148 0.000 2.406 329 S HA -0.115 4.576 4.470 0.124 -0.146 0.228 329 S C 0.429 175.119 174.600 0.151 0.000 1.020 329 S CA 2.118 60.393 58.200 0.125 0.000 0.965 329 S CB 0.199 63.445 63.200 0.076 0.000 0.798 329 S HN 0.516 8.895 8.310 0.114 0.000 0.488 330 E N 0.891 121.173 120.200 0.137 0.000 2.373 330 E HA 0.120 4.706 4.350 0.161 -0.140 0.263 330 E C 0.239 176.936 176.600 0.162 0.000 1.073 330 E CA -0.805 55.682 56.400 0.145 0.000 0.894 330 E CB 0.963 30.727 29.700 0.107 0.000 1.008 330 E HN -0.656 7.763 8.360 0.115 0.010 0.420 331 I N 5.433 126.122 120.570 0.197 0.000 2.371 331 I HA 0.151 4.429 4.170 0.181 0.000 0.290 331 I C -1.404 174.786 176.117 0.121 0.000 1.028 331 I CA -3.348 58.056 61.300 0.173 0.000 1.345 331 I CB -1.613 36.474 38.000 0.145 0.000 1.407 331 I HN 0.097 8.448 8.210 0.234 0.000 0.501 332 P HA -0.082 4.227 4.420 -0.186 0.000 0.272 332 P C -1.956 175.339 177.300 -0.008 0.000 1.239 332 P CA 0.070 63.066 63.100 -0.173 0.000 0.807 332 P CB 0.656 32.131 31.700 -0.374 0.000 0.951 333 D N -0.229 120.036 120.400 -0.225 0.000 2.349 333 D HA 0.003 4.116 4.640 -0.878 0.000 0.232 333 D C -1.325 174.862 176.300 -0.189 0.000 1.071 333 D CA -0.397 53.283 54.000 -0.533 0.000 0.832 333 D CB 0.993 41.373 40.800 -0.701 0.000 1.086 333 D HN 0.084 8.324 8.370 -0.217 0.000 0.504 334 H N 0.478 119.502 119.070 -0.077 0.000 2.942 334 H HA 0.284 4.798 4.556 -0.069 0.000 0.316 334 H C 0.027 175.368 175.328 0.020 0.000 1.323 334 H CA -1.564 54.473 56.048 -0.018 0.000 1.144 334 H CB 2.039 31.821 29.762 0.033 0.000 1.866 334 H HN -0.226 7.797 8.280 -0.429 0.000 0.545 335 E N 0.311 120.539 120.200 0.047 0.000 2.284 335 E HA -0.302 3.903 4.350 -0.242 0.000 0.200 335 E C -0.185 176.119 176.600 -0.494 0.000 1.008 335 E CA 2.285 58.532 56.400 -0.255 0.000 0.829 335 E CB 0.186 29.662 29.700 -0.374 0.000 0.744 335 E HN 0.634 9.105 8.360 0.184 0.000 0.491 336 F N -2.891 117.145 119.950 0.142 0.000 2.627 336 F HA 0.141 4.779 4.527 0.185 0.000 0.329 336 F C -1.261 174.580 175.800 0.068 0.000 1.378 336 F CA -1.163 56.976 58.000 0.231 0.000 1.134 336 F CB 0.112 39.398 39.000 0.476 0.000 1.229 336 F HN -0.586 7.865 8.300 0.341 0.054 0.537 337 F N 1.267 121.086 119.950 -0.218 0.000 2.188 337 F HA -0.025 4.289 4.527 -0.355 0.000 0.289 337 F C 1.218 177.126 175.800 0.180 0.000 1.082 337 F CA 2.412 60.283 58.000 -0.214 0.000 1.282 337 F CB 1.760 40.545 39.000 -0.358 0.000 1.060 337 F HN -0.708 7.547 8.300 0.008 0.050 0.493 338 T N 0.201 114.884 114.554 0.215 0.000 2.649 338 T HA -0.477 4.054 4.350 0.301 0.000 0.268 338 T C 1.718 176.558 174.700 0.233 0.000 1.036 338 T CA 3.781 66.024 62.100 0.237 0.000 1.157 338 T CB -1.367 67.602 68.868 0.167 0.000 0.861 338 T HN 0.301 8.679 8.240 0.230 0.000 0.445 339 A N 0.819 123.769 122.820 0.216 0.000 2.139 339 A HA -0.192 4.158 4.320 0.050 0.000 0.221 339 A C 0.737 178.307 177.584 -0.023 0.000 1.159 339 A CA 1.801 53.911 52.037 0.123 0.000 0.662 339 A CB -0.901 18.216 19.000 0.194 0.000 0.796 339 A HN 0.205 8.483 8.150 0.244 0.018 0.463 340 Y N -4.854 115.415 120.300 -0.052 0.000 2.658 340 Y HA 0.108 4.586 4.550 -0.120 0.000 0.276 340 Y C -0.776 174.843 175.900 -0.469 0.000 1.167 340 Y CA -1.198 56.817 58.100 -0.142 0.000 1.230 340 Y CB -0.301 38.128 38.460 -0.053 0.000 1.144 340 Y HN -0.232 8.084 8.280 0.366 0.184 0.529 341 G N -0.257 108.202 108.800 -0.568 0.000 2.522 341 G HA2 0.241 2.921 3.960 -2.262 0.000 0.304 341 G HA3 0.241 3.427 3.960 -1.290 0.000 0.304 341 G C -1.829 172.727 174.900 -0.574 0.000 1.210 341 G CA -2.163 42.142 45.100 -1.324 0.000 0.960 341 G HN -0.610 7.471 8.290 -0.229 0.072 0.497 342 P HA 0.222 4.206 4.420 -0.727 0.000 0.267 342 P C -1.280 175.731 177.300 -0.481 0.000 1.289 342 P CA 0.318 63.102 63.100 -0.527 0.000 0.866 342 P CB 0.501 32.070 31.700 -0.218 0.000 1.309 343 D N -0.034 120.117 120.400 -0.415 0.000 2.501 343 D HA 0.102 4.702 4.640 -0.066 0.000 0.226 343 D C -0.965 175.291 176.300 -0.075 0.000 1.198 343 D CA -0.359 53.543 54.000 -0.163 0.000 0.830 343 D CB 0.142 40.886 40.800 -0.093 0.000 1.014 343 D HN 0.027 8.087 8.370 -0.421 0.058 0.496 344 Y N -2.985 117.289 120.300 -0.043 0.000 2.968 344 Y HA -0.386 4.325 4.550 -0.091 -0.214 0.227 344 Y C -0.803 175.109 175.900 0.021 0.000 0.981 344 Y CA 0.510 58.566 58.100 -0.073 0.000 0.856 344 Y CB -2.394 35.961 38.460 -0.175 0.000 1.013 344 Y HN -0.026 7.584 8.280 -0.973 0.086 0.486 345 V N -6.387 113.604 119.914 0.129 0.000 3.158 345 V HA 0.835 5.201 4.120 0.165 -0.146 0.315 345 V C -1.054 175.125 176.094 0.142 0.000 1.148 345 V CA -3.699 58.680 62.300 0.131 0.000 1.042 345 V CB 3.139 35.005 31.823 0.073 0.000 1.101 345 V HN -0.621 7.592 8.190 0.064 0.015 0.448 346 L N -1.156 120.146 121.223 0.131 0.000 2.529 346 L HA 0.203 4.626 4.340 0.138 0.000 0.223 346 L C -0.390 176.475 176.870 -0.008 0.000 1.113 346 L CA -0.272 54.625 54.840 0.095 0.000 0.861 346 L CB 0.657 42.773 42.059 0.095 0.000 1.012 346 L HN 0.280 8.589 8.230 0.132 0.000 0.461 347 E N -2.697 117.488 120.200 -0.025 0.000 2.345 347 E HA 0.077 4.339 4.350 -0.148 0.000 0.259 347 E C -0.996 175.550 176.600 -0.090 0.000 1.117 347 E CA -0.383 55.964 56.400 -0.090 0.000 0.913 347 E CB 0.935 30.588 29.700 -0.079 0.000 1.057 347 E HN -0.194 8.131 8.360 0.009 0.041 0.432 348 I N -0.229 120.269 120.570 -0.120 0.000 2.689 348 I HA 0.141 4.253 4.170 -0.097 0.000 0.299 348 I C -1.067 174.990 176.117 -0.101 0.000 1.059 348 I CA -1.201 60.032 61.300 -0.112 0.000 1.055 348 I CB 2.169 40.087 38.000 -0.135 0.000 1.243 348 I HN -0.208 7.914 8.210 -0.147 0.000 0.425 349 T N 6.024 120.527 114.554 -0.085 0.000 2.797 349 T HA 0.367 4.672 4.350 -0.075 0.000 0.279 349 T C -2.129 172.530 174.700 -0.069 0.000 0.991 349 T CA -2.445 59.611 62.100 -0.072 0.000 0.979 349 T CB 0.131 68.963 68.868 -0.060 0.000 0.943 349 T HN -0.046 8.144 8.240 -0.084 0.000 0.444 350 P HA -0.172 4.300 4.420 -0.056 -0.085 0.271 350 P C -1.129 176.143 177.300 -0.045 0.000 1.228 350 P CA 0.117 63.184 63.100 -0.054 0.000 0.797 350 P CB 0.527 32.197 31.700 -0.050 0.000 0.914 351 S N -0.607 115.071 115.700 -0.037 0.000 2.718 351 S HA 0.189 4.639 4.470 -0.034 0.000 0.300 351 S C -0.725 173.859 174.600 -0.026 0.000 1.117 351 S CA -0.799 57.383 58.200 -0.031 0.000 1.002 351 S CB 1.341 64.525 63.200 -0.026 0.000 1.092 351 S HN 0.151 8.814 8.310 -0.035 -0.374 0.542 352 C N 3.314 122.600 119.300 -0.024 0.000 2.484 352 C HA 0.125 4.571 4.460 -0.022 0.000 0.494 352 C C -1.182 173.798 174.990 -0.017 0.000 1.052 352 C CA -0.804 58.202 59.018 -0.021 0.000 1.307 352 C CB -2.095 25.633 27.740 -0.020 0.000 1.464 352 C HN 0.261 8.477 8.230 -0.024 0.000 0.564 353 R N 5.633 126.123 120.500 -0.017 0.000 2.744 353 R HA 0.449 4.782 4.340 -0.012 0.000 0.279 353 R C -2.156 174.134 176.300 -0.016 0.000 0.977 353 R CA -2.449 53.643 56.100 -0.013 0.000 0.906 353 R CB 1.812 32.107 30.300 -0.008 0.000 1.197 353 R HN -0.426 7.787 8.270 -0.019 0.045 0.463 354 P HA 0.140 4.547 4.420 -0.022 0.000 0.276 354 P C -2.123 175.162 177.300 -0.025 0.000 1.261 354 P CA -0.591 62.496 63.100 -0.020 0.000 0.800 354 P CB 1.252 32.941 31.700 -0.018 0.000 1.066 355 D N -0.124 120.255 120.400 -0.034 0.000 2.163 355 D HA 0.171 4.934 4.640 -0.048 -0.151 0.248 355 D C 0.132 176.403 176.300 -0.049 0.000 1.035 355 D CA -0.619 53.352 54.000 -0.049 0.000 0.872 355 D CB 1.600 42.363 40.800 -0.062 0.000 1.183 355 D HN 0.043 8.393 8.370 -0.033 0.000 0.445 356 R N 2.279 122.748 120.500 -0.053 0.000 2.633 356 R HA 0.260 4.572 4.340 -0.046 0.000 0.348 356 R C -0.183 176.073 176.300 -0.074 0.000 1.100 356 R CA -1.690 54.380 56.100 -0.051 0.000 1.068 356 R CB -0.169 30.111 30.300 -0.034 0.000 1.351 356 R HN 0.470 8.706 8.270 -0.056 0.000 0.575 357 N N 2.522 121.165 118.700 -0.095 0.000 2.918 357 N HA 0.058 4.725 4.740 -0.121 0.000 0.247 357 N C -1.627 173.787 175.510 -0.160 0.000 1.117 357 N CA -0.373 52.602 53.050 -0.126 0.000 1.005 357 N CB -0.293 38.112 38.487 -0.136 0.000 1.297 357 N HN -0.369 8.090 8.380 -0.090 -0.133 0.513 358 E N 3.098 123.178 120.200 -0.201 0.000 2.752 358 E HA -0.132 4.089 4.350 -0.215 0.000 0.241 358 E C -0.568 175.754 176.600 -0.465 0.000 1.016 358 E CA -0.100 56.098 56.400 -0.336 0.000 0.952 358 E CB -0.453 28.985 29.700 -0.437 0.000 0.921 358 E HN -0.605 7.602 8.360 -0.162 0.055 0.515 359 P HA -0.190 4.208 4.420 -0.149 -0.067 0.215 359 P C 0.957 178.171 177.300 -0.144 0.000 1.153 359 P CA 2.822 65.823 63.100 -0.164 0.000 0.853 359 P CB 0.234 31.895 31.700 -0.066 0.000 0.788 360 H N -2.786 116.267 119.070 -0.028 0.000 2.352 360 H HA -0.214 4.327 4.556 -0.025 0.000 0.299 360 H C 2.217 177.529 175.328 -0.026 0.000 1.097 360 H CA 3.065 59.098 56.048 -0.024 0.000 1.311 360 H CB -1.136 28.615 29.762 -0.019 0.000 1.377 360 H HN 0.176 8.328 8.280 -0.183 0.018 0.504 361 R N 0.529 120.897 120.500 -0.220 0.000 2.081 361 R HA -0.230 4.409 4.340 0.080 -0.251 0.235 361 R C 2.079 178.338 176.300 -0.069 0.000 1.131 361 R CA 1.664 57.727 56.100 -0.062 0.000 0.960 361 R CB -0.955 29.263 30.300 -0.137 0.000 0.856 361 R HN -0.527 7.128 8.270 -0.868 0.094 0.436 362 I N -0.473 120.028 120.570 -0.116 0.000 2.091 362 I HA -0.489 3.620 4.170 -0.102 0.000 0.239 362 I C 2.107 178.183 176.117 -0.068 0.000 1.061 362 I CA 3.394 64.634 61.300 -0.101 0.000 1.317 362 I CB -1.267 36.660 38.000 -0.121 0.000 1.031 362 I HN -0.696 7.409 8.210 -0.174 0.000 0.401 363 Q N -0.787 118.984 119.800 -0.049 0.000 2.096 363 Q HA -0.465 3.850 4.340 -0.042 0.000 0.208 363 Q C 2.425 178.420 176.000 -0.009 0.000 0.993 363 Q CA 3.109 58.895 55.803 -0.027 0.000 0.862 363 Q CB -0.513 28.220 28.738 -0.007 0.000 0.915 363 Q HN -0.477 7.762 8.270 -0.052 0.000 0.416 364 Q N -1.423 118.381 119.800 0.007 0.000 2.133 364 Q HA -0.382 3.978 4.340 0.033 0.000 0.208 364 Q C 2.610 178.627 176.000 0.027 0.000 0.991 364 Q CA 3.064 58.881 55.803 0.023 0.000 0.867 364 Q CB -0.361 28.391 28.738 0.024 0.000 0.911 364 Q HN -0.558 7.720 8.270 0.012 0.000 0.417 365 I N -0.431 120.136 120.570 -0.005 0.000 2.163 365 I HA -0.463 3.719 4.170 0.019 0.000 0.240 365 I C 1.564 177.688 176.117 0.011 0.000 1.081 365 I CA 3.485 64.782 61.300 -0.005 0.000 1.353 365 I CB -0.287 37.678 38.000 -0.059 0.000 1.054 365 I HN -0.350 7.730 8.210 -0.023 0.116 0.407 366 L N -1.351 119.856 121.223 -0.026 0.000 2.189 366 L HA -0.521 3.789 4.340 -0.049 0.000 0.214 366 L C 2.520 179.376 176.870 -0.024 0.000 1.097 366 L CA 3.217 58.033 54.840 -0.039 0.000 0.764 366 L CB -1.131 40.894 42.059 -0.057 0.000 0.900 366 L HN -0.179 7.971 8.230 -0.040 0.056 0.436 367 N N -0.793 117.907 118.700 0.001 0.000 2.258 367 N HA -0.109 4.610 4.740 -0.034 0.000 0.183 367 N C 1.583 177.097 175.510 0.008 0.000 1.029 367 N CA 2.686 55.733 53.050 -0.005 0.000 0.857 367 N CB -0.278 38.213 38.487 0.007 0.000 1.008 367 N HN 0.041 8.279 8.380 0.011 0.148 0.433 368 Y N 2.432 122.698 120.300 -0.057 0.000 2.102 368 Y HA -0.484 4.034 4.550 -0.053 0.000 0.280 368 Y C 1.880 177.733 175.900 -0.079 0.000 1.178 368 Y CA 4.142 62.209 58.100 -0.056 0.000 1.146 368 Y CB 0.050 38.488 38.460 -0.038 0.000 0.968 368 Y HN -0.002 8.373 8.280 0.158 0.000 0.504 369 I N -1.974 118.620 120.570 0.040 0.000 2.058 369 I HA -0.695 3.444 4.170 -0.053 0.000 0.235 369 I C 1.901 177.925 176.117 -0.155 0.000 1.053 369 I CA 4.382 65.651 61.300 -0.052 0.000 1.313 369 I CB -0.193 37.801 38.000 -0.009 0.000 1.039 369 I HN 0.176 8.466 8.210 0.127 -0.003 0.396 370 K N -0.982 119.345 120.400 -0.122 0.000 2.173 370 K HA -0.391 3.849 4.320 -0.133 0.000 0.207 370 K C 2.476 178.941 176.600 -0.224 0.000 1.046 370 K CA 2.867 59.069 56.287 -0.143 0.000 0.929 370 K CB -0.434 32.008 32.500 -0.097 0.000 0.720 370 K HN -0.580 7.622 8.250 -0.081 0.000 0.453 371 G N -2.501 106.136 108.800 -0.271 0.000 2.396 371 G HA2 -0.158 3.615 3.960 -0.312 0.000 0.214 371 G HA3 -0.158 3.597 3.960 -0.340 0.000 0.214 371 G C 0.930 175.458 174.900 -0.621 0.000 1.166 371 G CA 0.970 45.848 45.100 -0.371 0.000 0.793 371 G HN 0.065 8.091 8.290 -0.232 0.125 0.533 372 N N 3.130 121.451 118.700 -0.632 0.000 2.166 372 N HA -0.313 3.714 4.740 -1.188 0.000 0.186 372 N C 1.952 177.025 175.510 -0.729 0.000 1.019 372 N CA 2.462 55.030 53.050 -0.804 0.000 0.856 372 N CB 0.208 38.451 38.487 -0.406 0.000 0.993 372 N HN 0.041 7.925 8.380 -0.520 0.185 0.426 373 L N -3.487 117.463 121.223 -0.454 0.000 2.713 373 L HA -0.039 4.112 4.340 -0.316 0.000 0.245 373 L C 0.520 177.200 176.870 -0.317 0.000 1.169 373 L CA 0.843 55.487 54.840 -0.326 0.000 0.962 373 L CB -1.513 40.425 42.059 -0.202 0.000 1.161 373 L HN 0.214 8.107 8.230 -0.384 0.107 0.427 374 K N -1.860 118.244 120.400 -0.493 0.000 2.214 374 K HA 0.066 4.269 4.320 -0.195 0.000 0.201 374 K C 1.316 177.824 176.600 -0.152 0.000 1.049 374 K CA 0.811 56.898 56.287 -0.333 0.000 0.978 374 K CB 0.605 32.848 32.500 -0.428 0.000 0.842 374 K HN -0.529 7.115 8.250 -0.767 0.146 0.474 375 H N 0.232 119.138 119.070 -0.272 0.000 2.669 375 H HA -0.043 4.468 4.556 -0.074 0.000 0.297 375 H C -1.074 174.243 175.328 -0.018 0.000 1.071 375 H CA -0.655 55.302 56.048 -0.151 0.000 1.182 375 H CB -0.728 28.866 29.762 -0.280 0.000 1.343 375 H HN -0.525 7.177 8.280 -0.964 0.000 0.582 376 V N -0.532 119.395 119.914 0.021 0.000 2.628 376 V HA -0.076 4.155 4.120 0.185 0.000 0.306 376 V C -1.157 175.009 176.094 0.119 0.000 1.045 376 V CA -1.211 61.115 62.300 0.044 0.000 0.905 376 V CB 2.740 34.445 31.823 -0.197 0.000 0.997 376 V HN -0.844 7.209 8.190 -0.044 0.111 0.436 377 V N 0.000 120.061 119.914 0.246 0.000 2.409 377 V HA 0.000 4.173 4.120 0.089 0.000 0.244 377 V CA 0.000 62.397 62.300 0.162 0.000 1.235 377 V CB 0.000 31.910 31.823 0.145 0.000 1.184 377 V HN 0.000 8.459 8.190 0.448 0.000 0.556