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 3bhs_1_A DATA FIRST_RESID 8 DATA SEQUENCE INEARLVAQY NYSINILAML LVGFGFLMVF VRRYGFSATT GTYLVVATGL DATA SEQUENCE PLYILLRANG IFGHALTPHS VDAVIYAEFA VATGLIAMGA VLGRLRVFQY DATA SEQUENCE ALLALFIVPV YLLNEWLVLD NASGLTEGFQ DSAGSIAIHA FGAYFGLGVS DATA SEQUENCE IALTTAAQRA QPIESDATSD RFSMLGSMVL WLFWPSFATA IVPFEQMPQT DATA SEQUENCE IVNTLLALCG ATLATYFLSA LFHKGKASIV DMANAALAGG VAIGSVCNIV DATA SEQUENCE GPVGAFVIGL LGGAISVVGF VFIQPMLESK AKTIDTCGVH NLHGLPGLLG DATA SEQUENCE GFSAILIVPG IAVAQLTGIG ITLALALIGG VIAGALIKLT GTTKQAYEDS DATA SEQUENCE HEFIHLAGPE DEHKAERLVL EAKTEIQGL 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 8 I HA 0.000 4.170 4.170 -0.000 0.000 0.288 8 I C 0.000 176.095 176.117 -0.036 0.000 1.063 8 I CA 0.000 61.285 61.300 -0.024 0.000 1.566 8 I CB 0.000 37.991 38.000 -0.015 0.000 1.214 9 N N 2.950 121.622 118.700 -0.048 0.000 2.415 9 N HA 0.099 4.839 4.740 0.001 0.000 0.250 9 N C 0.601 176.058 175.510 -0.089 0.000 1.127 9 N CA 0.515 53.519 53.050 -0.076 0.000 0.945 9 N CB 0.809 39.233 38.487 -0.104 0.000 1.196 9 N HN 0.355 8.735 8.380 -0.000 0.000 0.499 10 E N 2.322 122.476 120.200 -0.076 0.000 2.110 10 E HA -0.163 4.187 4.350 0.001 0.000 0.193 10 E C 1.442 177.988 176.600 -0.090 0.000 0.988 10 E CA 1.216 57.575 56.400 -0.069 0.000 0.804 10 E CB 0.070 29.739 29.700 -0.053 0.000 0.745 10 E HN 0.739 9.099 8.360 -0.000 0.000 0.458 11 A N 1.626 124.373 122.820 -0.122 0.000 1.902 11 A HA -0.180 4.140 4.320 0.001 0.000 0.217 11 A C 2.073 179.530 177.584 -0.212 0.000 1.181 11 A CA 1.209 53.158 52.037 -0.146 0.000 0.623 11 A CB -0.339 18.555 19.000 -0.177 0.000 0.818 11 A HN 0.079 8.229 8.150 -0.000 0.000 0.443 12 R N -1.328 118.996 120.500 -0.293 0.000 2.189 12 R HA 0.018 4.359 4.340 0.001 0.000 0.218 12 R C 1.937 178.167 176.300 -0.117 0.000 1.074 12 R CA 0.951 56.863 56.100 -0.313 0.000 0.991 12 R CB -0.323 29.775 30.300 -0.336 0.000 0.883 12 R HN 0.481 8.751 8.270 -0.000 0.000 0.457 13 L N 0.463 121.635 121.223 -0.085 0.000 2.109 13 L HA -0.064 4.277 4.340 0.001 0.000 0.207 13 L C 1.927 178.785 176.870 -0.019 0.000 1.086 13 L CA 1.437 56.257 54.840 -0.033 0.000 0.760 13 L CB -0.180 41.861 42.059 -0.030 0.000 0.910 13 L HN -0.146 8.084 8.230 -0.000 0.000 0.437 14 V N 0.236 120.127 119.914 -0.038 0.000 2.343 14 V HA -0.275 3.846 4.120 0.001 0.000 0.247 14 V C 2.839 178.902 176.094 -0.051 0.000 1.051 14 V CA 1.536 63.832 62.300 -0.007 0.000 1.036 14 V CB -1.396 30.418 31.823 -0.015 0.000 0.654 14 V HN 0.585 8.775 8.190 -0.000 0.000 0.451 15 A N -0.825 121.923 122.820 -0.121 0.000 1.892 15 A HA -0.358 3.963 4.320 0.001 0.000 0.218 15 A C 2.271 179.412 177.584 -0.738 0.000 1.188 15 A CA 2.476 54.313 52.037 -0.333 0.000 0.631 15 A CB -0.573 18.386 19.000 -0.068 0.000 0.822 15 A HN 0.608 8.758 8.150 -0.000 0.000 0.447 16 Q N -2.333 117.268 119.800 -0.331 0.000 2.083 16 Q HA -0.180 4.160 4.340 0.001 0.000 0.198 16 Q C 1.979 177.933 176.000 -0.077 0.000 0.969 16 Q CA 1.555 57.269 55.803 -0.148 0.000 0.838 16 Q CB -0.276 28.493 28.738 0.051 0.000 0.900 16 Q HN 0.768 9.038 8.270 -0.000 0.000 0.436 17 Y N 1.611 121.833 120.300 -0.130 0.000 2.128 17 Y HA -0.229 4.321 4.550 0.001 0.000 0.284 17 Y C 1.825 177.674 175.900 -0.085 0.000 1.154 17 Y CA 1.951 60.001 58.100 -0.084 0.000 1.149 17 Y CB -0.300 38.118 38.460 -0.069 0.000 0.976 17 Y HN 0.203 8.483 8.280 -0.000 0.000 0.505 18 N N -0.843 117.726 118.700 -0.219 0.000 2.244 18 N HA -0.189 4.551 4.740 0.001 0.000 0.183 18 N C 1.579 176.996 175.510 -0.154 0.000 1.016 18 N CA 1.396 54.303 53.050 -0.239 0.000 0.866 18 N CB -0.470 37.965 38.487 -0.087 0.000 0.980 18 N HN 0.408 8.788 8.380 -0.000 0.000 0.430 19 Y N 1.732 121.984 120.300 -0.081 0.000 2.165 19 Y HA -0.163 4.387 4.550 0.001 0.000 0.286 19 Y C 2.897 178.685 175.900 -0.187 0.000 1.155 19 Y CA 0.928 58.980 58.100 -0.080 0.000 1.164 19 Y CB -1.219 37.218 38.460 -0.038 0.000 0.978 19 Y HN 0.116 8.396 8.280 -0.000 0.000 0.513 20 S N -0.124 115.508 115.700 -0.112 0.000 2.382 20 S HA -0.137 4.334 4.470 0.001 0.000 0.228 20 S C 1.914 176.343 174.600 -0.285 0.000 1.027 20 S CA 1.376 59.446 58.200 -0.217 0.000 0.991 20 S CB -0.654 62.418 63.200 -0.213 0.000 0.823 20 S HN 0.280 8.590 8.310 -0.000 0.000 0.469 21 I N 2.864 123.190 120.570 -0.408 0.000 2.286 21 I HA -0.038 4.132 4.170 0.001 0.000 0.245 21 I C 2.159 178.048 176.117 -0.380 0.000 1.104 21 I CA 0.868 61.943 61.300 -0.375 0.000 1.397 21 I CB -1.905 35.838 38.000 -0.428 0.000 1.072 21 I HN 0.285 8.495 8.210 -0.000 0.000 0.417 22 N N 1.520 119.992 118.700 -0.381 0.000 2.061 22 N HA -0.187 4.554 4.740 0.001 0.000 0.193 22 N C 1.930 177.133 175.510 -0.512 0.000 1.030 22 N CA 1.449 54.110 53.050 -0.649 0.000 0.856 22 N CB -0.473 37.926 38.487 -0.147 0.000 1.023 22 N HN 0.348 8.728 8.380 -0.000 0.000 0.424 23 I N -0.041 120.409 120.570 -0.200 0.000 2.315 23 I HA -0.201 3.969 4.170 0.001 0.000 0.248 23 I C 2.018 178.083 176.117 -0.087 0.000 1.117 23 I CA 0.502 61.772 61.300 -0.050 0.000 1.404 23 I CB -0.122 37.857 38.000 -0.035 0.000 1.071 23 I HN 0.085 8.295 8.210 -0.000 0.000 0.419 24 L N 1.037 122.165 121.223 -0.158 0.000 2.141 24 L HA -0.092 4.248 4.340 0.001 0.000 0.209 24 L C 2.504 179.317 176.870 -0.095 0.000 1.094 24 L CA 1.845 56.622 54.840 -0.106 0.000 0.763 24 L CB -0.744 41.247 42.059 -0.114 0.000 0.908 24 L HN 0.176 8.406 8.230 -0.000 0.000 0.437 25 A N -0.714 121.978 122.820 -0.213 0.000 1.902 25 A HA -0.231 4.090 4.320 0.001 0.000 0.217 25 A C 2.261 179.844 177.584 -0.000 0.000 1.181 25 A CA 2.042 53.985 52.037 -0.156 0.000 0.623 25 A CB -0.496 18.248 19.000 -0.428 0.000 0.818 25 A HN 0.490 8.640 8.150 -0.000 0.000 0.443 26 M N -0.492 119.106 119.600 -0.003 0.000 2.080 26 M HA -0.161 4.319 4.480 0.001 0.000 0.260 26 M C 2.162 178.566 176.300 0.174 0.000 1.068 26 M CA 1.546 56.891 55.300 0.076 0.000 1.109 26 M CB -0.631 31.974 32.600 0.010 0.000 1.342 26 M HN 0.383 8.673 8.290 -0.000 0.000 0.405 27 L N -0.210 121.129 121.223 0.193 0.000 1.994 27 L HA -0.230 4.111 4.340 0.001 0.000 0.208 27 L C 2.357 179.345 176.870 0.197 0.000 1.071 27 L CA 1.393 56.387 54.840 0.256 0.000 0.745 27 L CB -0.716 41.399 42.059 0.094 0.000 0.892 27 L HN 0.335 8.565 8.230 -0.000 0.000 0.431 28 L N -1.259 120.021 121.223 0.096 0.000 2.004 28 L HA -0.102 4.238 4.340 0.001 0.000 0.205 28 L C 2.407 179.338 176.870 0.103 0.000 1.089 28 L CA 0.617 55.477 54.840 0.034 0.000 0.756 28 L CB -0.522 41.523 42.059 -0.023 0.000 0.900 28 L HN -0.045 8.185 8.230 -0.000 0.000 0.440 29 V N 0.176 120.162 119.914 0.121 0.000 2.427 29 V HA -0.143 3.977 4.120 0.001 0.000 0.248 29 V C 2.454 178.696 176.094 0.246 0.000 1.051 29 V CA 1.808 64.227 62.300 0.198 0.000 1.048 29 V CB -1.220 30.643 31.823 0.067 0.000 0.666 29 V HN 0.598 8.788 8.190 -0.000 0.000 0.456 30 G N -0.520 108.382 108.800 0.171 0.000 2.505 30 G HA2 -0.203 3.757 3.960 0.001 0.000 0.214 30 G HA3 -0.203 3.757 3.960 0.001 0.000 0.214 30 G C 1.440 176.376 174.900 0.060 0.000 1.237 30 G CA 0.795 45.955 45.100 0.098 0.000 0.802 30 G HN 0.402 8.692 8.290 -0.000 0.000 0.549 31 F N 1.822 121.841 119.950 0.115 0.000 2.146 31 F HA 0.069 4.596 4.527 0.001 0.000 0.298 31 F C 2.926 178.768 175.800 0.069 0.000 1.096 31 F CA 1.091 59.147 58.000 0.095 0.000 1.275 31 F CB -0.659 38.366 39.000 0.042 0.000 1.008 31 F HN 0.195 8.495 8.300 -0.000 0.000 0.480 32 G N -0.766 108.166 108.800 0.220 0.000 2.459 32 G HA2 -0.269 3.691 3.960 0.001 0.000 0.217 32 G HA3 -0.269 3.691 3.960 0.001 0.000 0.217 32 G C 1.508 176.352 174.900 -0.093 0.000 1.183 32 G CA 0.784 45.899 45.100 0.026 0.000 0.776 32 G HN 0.284 8.574 8.290 -0.000 0.000 0.552 33 F N -0.175 119.801 119.950 0.042 0.000 2.416 33 F HA 0.217 4.744 4.527 0.001 0.000 0.296 33 F C 2.295 178.174 175.800 0.132 0.000 1.099 33 F CA 0.106 58.143 58.000 0.062 0.000 1.427 33 F CB -0.225 38.821 39.000 0.075 0.000 1.079 33 F HN 0.081 8.381 8.300 -0.000 0.000 0.536 34 L N 0.072 121.438 121.223 0.240 0.000 2.012 34 L HA -0.221 4.119 4.340 0.001 0.000 0.210 34 L C 2.102 179.144 176.870 0.287 0.000 1.073 34 L CA 1.908 56.875 54.840 0.213 0.000 0.748 34 L CB -0.603 41.548 42.059 0.153 0.000 0.891 34 L HN 0.113 8.343 8.230 -0.000 0.000 0.431 35 M N -1.847 117.904 119.600 0.250 0.000 2.549 35 M HA -0.107 4.373 4.480 0.001 0.000 0.260 35 M C 1.721 178.112 176.300 0.152 0.000 1.076 35 M CA 0.556 56.021 55.300 0.275 0.000 1.090 35 M CB -0.183 32.517 32.600 0.167 0.000 1.418 35 M HN 0.104 8.394 8.290 -0.000 0.000 0.486 36 V N 0.993 120.929 119.914 0.037 0.000 3.444 36 V HA -0.215 3.905 4.120 0.001 0.000 0.271 36 V C 1.902 178.039 176.094 0.072 0.000 1.188 36 V CA 1.081 63.338 62.300 -0.072 0.000 1.168 36 V CB -1.407 30.239 31.823 -0.294 0.000 0.810 36 V HN 0.536 8.726 8.190 -0.000 0.000 0.500 37 F N 0.321 120.314 119.950 0.071 0.000 2.192 37 F HA -0.072 4.456 4.527 0.001 0.000 0.301 37 F C 0.906 176.741 175.800 0.058 0.000 1.079 37 F CA 0.550 58.596 58.000 0.076 0.000 1.303 37 F CB -0.893 38.144 39.000 0.062 0.000 1.024 37 F HN -0.043 8.257 8.300 -0.000 0.000 0.494 38 V N 3.203 122.601 119.914 -0.860 0.000 2.485 38 V HA 0.004 4.124 4.120 0.001 0.000 0.287 38 V C 1.668 177.620 176.094 -0.237 0.000 1.022 38 V CA 0.223 62.110 62.300 -0.687 0.000 1.067 38 V CB 0.629 32.132 31.823 -0.534 0.000 0.967 38 V HN 0.449 8.639 8.190 -0.000 0.000 0.479 39 R N 4.297 124.693 120.500 -0.173 0.000 2.083 39 R HA -0.064 4.276 4.340 0.001 0.000 0.237 39 R C 1.349 177.612 176.300 -0.061 0.000 1.137 39 R CA 1.652 57.707 56.100 -0.074 0.000 0.951 39 R CB 0.091 30.358 30.300 -0.055 0.000 0.851 39 R HN 0.632 8.902 8.270 -0.000 0.000 0.434 40 R N -1.230 119.242 120.500 -0.047 0.000 2.696 40 R HA 0.068 4.408 4.340 0.001 0.000 0.355 40 R C -0.389 175.914 176.300 0.006 0.000 1.138 40 R CA -0.140 55.921 56.100 -0.065 0.000 1.059 40 R CB 0.771 31.040 30.300 -0.052 0.000 1.380 40 R HN 0.230 8.500 8.270 -0.000 0.000 0.578 41 Y N -1.068 119.137 120.300 -0.159 0.000 2.675 41 Y HA 0.285 4.836 4.550 0.001 0.000 0.248 41 Y C 1.678 177.494 175.900 -0.141 0.000 1.161 41 Y CA -0.677 57.358 58.100 -0.108 0.000 1.203 41 Y CB 0.690 39.133 38.460 -0.029 0.000 1.262 41 Y HN 0.144 8.424 8.280 -0.000 0.000 0.544 42 G N 0.386 109.053 108.800 -0.221 0.000 2.440 42 G HA2 -0.281 3.680 3.960 0.001 0.000 0.218 42 G HA3 -0.281 3.680 3.960 0.001 0.000 0.218 42 G C 1.409 176.178 174.900 -0.219 0.000 1.154 42 G CA 1.082 46.036 45.100 -0.244 0.000 0.767 42 G HN 0.300 8.590 8.290 -0.000 0.000 0.552 43 F N 1.738 121.361 119.950 -0.545 0.000 2.146 43 F HA 0.022 4.549 4.527 0.001 0.000 0.298 43 F C 2.991 178.391 175.800 -0.666 0.000 1.096 43 F CA 0.875 58.406 58.000 -0.782 0.000 1.275 43 F CB -0.928 37.258 39.000 -1.358 0.000 1.008 43 F HN 0.108 8.408 8.300 -0.000 0.000 0.480 44 S N -0.046 115.403 115.700 -0.418 0.000 2.406 44 S HA -0.002 4.469 4.470 0.001 0.000 0.228 44 S C 2.330 176.675 174.600 -0.425 0.000 1.020 44 S CA 0.771 58.769 58.200 -0.336 0.000 0.965 44 S CB -0.455 62.109 63.200 -1.060 0.000 0.798 44 S HN 0.308 8.618 8.310 -0.000 0.000 0.488 45 A N 1.874 124.389 122.820 -0.507 0.000 1.898 45 A HA -0.101 4.220 4.320 0.001 0.000 0.216 45 A C 2.432 179.834 177.584 -0.304 0.000 1.181 45 A CA 2.008 53.848 52.037 -0.328 0.000 0.620 45 A CB -1.295 17.576 19.000 -0.216 0.000 0.819 45 A HN 0.614 8.764 8.150 -0.000 0.000 0.442 46 T N -3.332 111.026 114.554 -0.327 0.000 2.770 46 T HA -0.107 4.244 4.350 0.001 0.000 0.263 46 T C 1.860 176.470 174.700 -0.150 0.000 1.039 46 T CA 1.906 63.815 62.100 -0.318 0.000 1.142 46 T CB -1.046 67.580 68.868 -0.404 0.000 0.868 46 T HN 0.284 8.524 8.240 -0.000 0.000 0.435 47 T N 1.655 116.199 114.554 -0.016 0.000 2.684 47 T HA 0.027 4.378 4.350 0.001 0.000 0.267 47 T C 2.292 177.075 174.700 0.138 0.000 1.036 47 T CA 1.473 63.686 62.100 0.189 0.000 1.148 47 T CB -1.133 67.949 68.868 0.358 0.000 0.863 47 T HN 0.617 8.857 8.240 -0.000 0.000 0.436 48 G N 0.856 109.655 108.800 -0.001 0.000 2.422 48 G HA2 -0.204 3.756 3.960 0.001 0.000 0.218 48 G HA3 -0.204 3.756 3.960 0.001 0.000 0.218 48 G C 1.712 176.551 174.900 -0.103 0.000 1.146 48 G CA 1.384 46.431 45.100 -0.089 0.000 0.769 48 G HN 0.443 8.733 8.290 -0.000 0.000 0.547 49 T N 0.192 114.659 114.554 -0.145 0.000 2.720 49 T HA -0.149 4.201 4.350 0.001 0.000 0.268 49 T C 2.079 176.784 174.700 0.009 0.000 1.037 49 T CA 1.201 63.241 62.100 -0.101 0.000 1.144 49 T CB -0.320 68.465 68.868 -0.138 0.000 0.864 49 T HN 0.261 8.501 8.240 -0.000 0.000 0.444 50 Y N 1.309 121.603 120.300 -0.011 0.000 2.181 50 Y HA -0.000 4.550 4.550 0.001 0.000 0.288 50 Y C 2.205 178.116 175.900 0.019 0.000 1.146 50 Y CA 0.327 58.434 58.100 0.012 0.000 1.164 50 Y CB -0.719 37.754 38.460 0.022 0.000 0.982 50 Y HN 0.174 8.454 8.280 -0.000 0.000 0.515 51 L N -1.592 119.759 121.223 0.213 0.000 2.083 51 L HA -0.211 4.129 4.340 0.001 0.000 0.209 51 L C 2.260 179.193 176.870 0.105 0.000 1.083 51 L CA 0.809 55.736 54.840 0.145 0.000 0.752 51 L CB -0.710 41.451 42.059 0.169 0.000 0.899 51 L HN 0.042 8.272 8.230 -0.000 0.000 0.433 52 V N -0.854 119.110 119.914 0.083 0.000 2.358 52 V HA -0.229 3.892 4.120 0.001 0.000 0.246 52 V C 2.388 178.495 176.094 0.022 0.000 1.047 52 V CA 1.393 63.716 62.300 0.038 0.000 1.035 52 V CB -0.138 31.683 31.823 -0.004 0.000 0.658 52 V HN 0.182 8.372 8.190 -0.000 0.000 0.452 53 V N 0.319 120.257 119.914 0.041 0.000 2.307 53 V HA -0.215 3.906 4.120 0.001 0.000 0.245 53 V C 2.655 178.781 176.094 0.053 0.000 1.045 53 V CA 2.046 64.370 62.300 0.040 0.000 1.024 53 V CB -1.020 30.850 31.823 0.079 0.000 0.651 53 V HN 0.554 8.744 8.190 -0.000 0.000 0.449 54 A N -0.786 122.080 122.820 0.077 0.000 2.066 54 A HA -0.138 4.182 4.320 0.001 0.000 0.218 54 A C 2.327 179.933 177.584 0.037 0.000 1.157 54 A CA 2.112 54.181 52.037 0.054 0.000 0.670 54 A CB -0.567 18.459 19.000 0.042 0.000 0.804 54 A HN 0.520 8.670 8.150 -0.000 0.000 0.453 55 T N -0.898 113.678 114.554 0.038 0.000 2.901 55 T HA 0.095 4.446 4.350 0.001 0.000 0.252 55 T C 2.019 176.737 174.700 0.030 0.000 1.035 55 T CA 1.024 63.141 62.100 0.027 0.000 1.142 55 T CB -0.433 68.447 68.868 0.020 0.000 0.869 55 T HN 0.493 8.733 8.240 -0.000 0.000 0.442 56 G N 1.238 110.053 108.800 0.026 0.000 2.408 56 G HA2 -0.049 3.912 3.960 0.001 0.000 0.217 56 G HA3 -0.049 3.912 3.960 0.001 0.000 0.217 56 G C 1.512 176.444 174.900 0.053 0.000 1.150 56 G CA 0.301 45.419 45.100 0.031 0.000 0.776 56 G HN 0.373 8.663 8.290 -0.000 0.000 0.542 57 L N 0.824 122.068 121.223 0.035 0.000 1.988 57 L HA -0.037 4.303 4.340 0.001 0.000 0.207 57 L C 0.143 177.064 176.870 0.084 0.000 1.071 57 L CA 1.285 56.152 54.840 0.045 0.000 0.744 57 L CB -1.114 40.959 42.059 0.025 0.000 0.893 57 L HN 0.164 8.394 8.230 -0.000 0.000 0.433 58 P HA -0.187 4.233 4.420 -0.000 0.000 0.216 58 P C 1.695 179.033 177.300 0.064 0.000 1.150 58 P CA 1.126 64.260 63.100 0.057 0.000 0.837 58 P CB 0.015 31.736 31.700 0.034 0.000 0.786 59 L N -1.430 119.837 121.223 0.074 0.000 2.017 59 L HA -0.151 4.189 4.340 0.001 0.000 0.208 59 L C 2.448 179.375 176.870 0.095 0.000 1.073 59 L CA 1.796 56.676 54.840 0.068 0.000 0.745 59 L CB -1.577 40.524 42.059 0.071 0.000 0.894 59 L HN -0.128 8.102 8.230 -0.000 0.000 0.432 60 Y N -0.212 120.104 120.300 0.027 0.000 2.181 60 Y HA -0.219 4.331 4.550 0.001 0.000 0.288 60 Y C 2.375 178.294 175.900 0.031 0.000 1.146 60 Y CA 2.034 60.162 58.100 0.047 0.000 1.164 60 Y CB -0.141 38.360 38.460 0.069 0.000 0.982 60 Y HN 0.210 8.490 8.280 -0.000 0.000 0.515 61 I N -0.769 119.924 120.570 0.206 0.000 2.226 61 I HA -0.300 3.870 4.170 0.001 0.000 0.245 61 I C 2.238 178.351 176.117 -0.007 0.000 1.100 61 I CA 1.034 62.403 61.300 0.115 0.000 1.374 61 I CB -0.411 37.653 38.000 0.107 0.000 1.057 61 I HN 0.295 8.505 8.210 -0.000 0.000 0.413 62 L N 0.810 122.023 121.223 -0.017 0.000 2.017 62 L HA -0.197 4.144 4.340 0.001 0.000 0.208 62 L C 2.316 179.119 176.870 -0.111 0.000 1.073 62 L CA 1.861 56.667 54.840 -0.056 0.000 0.745 62 L CB -0.601 41.434 42.059 -0.040 0.000 0.894 62 L HN 0.129 8.359 8.230 -0.000 0.000 0.432 63 L N -0.899 120.234 121.223 -0.150 0.000 2.012 63 L HA -0.217 4.124 4.340 0.001 0.000 0.210 63 L C 2.754 179.456 176.870 -0.281 0.000 1.073 63 L CA 1.083 55.782 54.840 -0.234 0.000 0.748 63 L CB -0.679 41.218 42.059 -0.271 0.000 0.891 63 L HN 0.245 8.475 8.230 -0.000 0.000 0.431 64 R N 0.099 120.416 120.500 -0.305 0.000 2.115 64 R HA 0.005 4.345 4.340 0.001 0.000 0.226 64 R C 2.304 178.518 176.300 -0.143 0.000 1.100 64 R CA 1.227 57.181 56.100 -0.243 0.000 0.980 64 R CB -0.963 29.218 30.300 -0.197 0.000 0.875 64 R HN 0.335 8.605 8.270 -0.000 0.000 0.445 65 A N 1.770 124.523 122.820 -0.112 0.000 1.978 65 A HA -0.133 4.188 4.320 0.001 0.000 0.220 65 A C 1.555 179.079 177.584 -0.099 0.000 1.170 65 A CA 1.368 53.353 52.037 -0.085 0.000 0.636 65 A CB -0.330 18.624 19.000 -0.077 0.000 0.810 65 A HN 0.279 8.429 8.150 -0.000 0.000 0.448 66 N N -0.502 118.120 118.700 -0.130 0.000 2.313 66 N HA 0.150 4.890 4.740 0.001 0.000 0.207 66 N C 0.910 176.318 175.510 -0.170 0.000 1.141 66 N CA 0.768 53.734 53.050 -0.139 0.000 0.830 66 N CB 0.242 38.639 38.487 -0.151 0.000 1.008 66 N HN 0.578 8.958 8.380 -0.000 0.000 0.481 67 G N 1.623 110.323 108.800 -0.168 0.000 2.283 67 G HA2 -0.287 3.673 3.960 0.001 0.000 0.280 67 G HA3 -0.287 3.673 3.960 0.001 0.000 0.280 67 G C 0.107 174.831 174.900 -0.294 0.000 1.029 67 G CA 0.042 45.033 45.100 -0.181 0.000 0.840 67 G HN 0.378 8.668 8.290 -0.000 0.000 0.505 68 I N -0.062 120.280 120.570 -0.380 0.000 2.441 68 I HA 0.330 4.500 4.170 0.001 0.000 0.287 68 I C 0.979 176.714 176.117 -0.637 0.000 1.049 68 I CA -0.744 60.185 61.300 -0.618 0.000 1.381 68 I CB 0.269 37.873 38.000 -0.660 0.000 1.409 68 I HN 0.117 8.327 8.210 -0.000 0.000 0.523 69 F N 4.081 123.576 119.950 -0.758 0.000 2.907 69 F HA -0.148 4.379 4.527 0.001 0.000 0.244 69 F C 0.890 176.149 175.800 -0.902 0.000 1.007 69 F CA 0.927 58.168 58.000 -1.265 0.000 0.872 69 F CB -2.141 36.403 39.000 -0.761 0.000 0.767 69 F HN 0.783 9.083 8.300 -0.000 0.000 0.837 70 G N -1.731 106.764 108.800 -0.508 0.000 2.350 70 G HA2 0.261 4.221 3.960 0.001 0.000 0.304 70 G HA3 0.261 4.221 3.960 0.001 0.000 0.304 70 G C -0.926 173.852 174.900 -0.204 0.000 1.421 70 G CA -1.213 43.770 45.100 -0.194 0.000 0.934 70 G HN 0.268 8.558 8.290 -0.000 0.000 0.632 71 H N 0.064 119.134 119.070 -0.000 0.000 3.038 71 H HA 0.398 4.955 4.556 0.001 0.000 0.338 71 H C 1.251 176.536 175.328 -0.071 0.000 1.041 71 H CA 1.029 57.060 56.048 -0.027 0.000 1.394 71 H CB 0.815 30.571 29.762 -0.010 0.000 1.357 71 H HN 0.931 9.211 8.280 -0.000 0.000 0.600 72 A N 4.010 126.866 122.820 0.059 0.000 2.445 72 A HA 0.369 4.690 4.320 0.001 0.000 0.242 72 A C 0.196 177.781 177.584 0.001 0.000 1.075 72 A CA -0.320 51.709 52.037 -0.014 0.000 0.777 72 A CB 0.211 19.196 19.000 -0.025 0.000 1.013 72 A HN 0.614 8.764 8.150 -0.000 0.000 0.493 73 L N 1.324 122.537 121.223 -0.016 0.000 2.362 73 L HA 0.360 4.700 4.340 0.001 0.000 0.275 73 L C 0.557 177.433 176.870 0.010 0.000 0.998 73 L CA -0.607 54.241 54.840 0.013 0.000 0.820 73 L CB 2.007 44.089 42.059 0.039 0.000 1.270 73 L HN 0.792 9.023 8.230 -0.000 0.000 0.415 74 T N 3.143 117.708 114.554 0.019 0.000 2.888 74 T HA 0.130 4.481 4.350 0.001 0.000 0.301 74 T C -1.477 173.234 174.700 0.019 0.000 1.001 74 T CA -1.084 61.020 62.100 0.007 0.000 1.147 74 T CB 1.008 69.887 68.868 0.018 0.000 0.931 74 T HN 0.366 8.606 8.240 -0.000 0.000 0.541 75 P HA -0.124 4.296 4.420 -0.000 0.000 0.215 75 P C 0.188 177.530 177.300 0.070 0.000 1.163 75 P CA 1.446 64.530 63.100 -0.027 0.000 0.894 75 P CB -0.096 31.507 31.700 -0.162 0.000 0.791 76 H N -0.528 118.557 119.070 0.025 0.000 3.268 76 H HA 0.271 4.828 4.556 0.001 0.000 0.213 76 H C 0.144 175.489 175.328 0.029 0.000 1.858 76 H CA -0.671 55.391 56.048 0.023 0.000 1.386 76 H CB -0.633 29.136 29.762 0.011 0.000 1.734 76 H HN 0.151 8.431 8.280 -0.000 0.000 0.612 77 S N -0.996 114.799 115.700 0.157 0.000 2.546 77 S HA 0.158 4.629 4.470 0.001 0.000 0.274 77 S C 0.727 175.398 174.600 0.118 0.000 1.121 77 S CA -0.917 57.353 58.200 0.117 0.000 0.887 77 S CB 1.637 64.900 63.200 0.105 0.000 1.094 77 S HN 0.079 8.389 8.310 -0.000 0.000 0.474 78 V N 1.727 121.705 119.914 0.108 0.000 2.490 78 V HA -0.162 3.958 4.120 0.001 0.000 0.250 78 V C 2.126 178.281 176.094 0.103 0.000 1.061 78 V CA 2.178 64.545 62.300 0.111 0.000 1.064 78 V CB -0.930 30.967 31.823 0.124 0.000 0.670 78 V HN 0.930 9.120 8.190 -0.000 0.000 0.461 79 D N 0.961 121.444 120.400 0.139 0.000 2.116 79 D HA -0.244 4.396 4.640 0.001 0.000 0.193 79 D C 2.236 178.698 176.300 0.270 0.000 0.998 79 D CA 1.834 55.969 54.000 0.224 0.000 0.836 79 D CB -0.081 40.868 40.800 0.248 0.000 0.951 79 D HN 0.508 8.878 8.370 -0.000 0.000 0.449 80 A N 1.029 123.968 122.820 0.200 0.000 1.940 80 A HA -0.134 4.187 4.320 0.001 0.000 0.219 80 A C 2.615 180.301 177.584 0.169 0.000 1.176 80 A CA 1.191 53.352 52.037 0.207 0.000 0.631 80 A CB -0.721 18.367 19.000 0.147 0.000 0.814 80 A HN 0.140 8.290 8.150 -0.000 0.000 0.446 81 V N 0.466 120.432 119.914 0.087 0.000 2.307 81 V HA -0.234 3.887 4.120 0.001 0.000 0.245 81 V C 2.448 178.459 176.094 -0.138 0.000 1.045 81 V CA 1.706 64.005 62.300 -0.001 0.000 1.024 81 V CB -0.631 31.193 31.823 0.001 0.000 0.651 81 V HN 0.519 8.709 8.190 -0.000 0.000 0.449 82 I N -0.731 119.719 120.570 -0.200 0.000 2.179 82 I HA -0.256 3.915 4.170 0.001 0.000 0.242 82 I C 2.508 178.149 176.117 -0.793 0.000 1.088 82 I CA 2.161 63.134 61.300 -0.546 0.000 1.357 82 I CB -0.848 36.846 38.000 -0.511 0.000 1.051 82 I HN 0.324 8.534 8.210 -0.000 0.000 0.409 83 Y N 0.990 121.116 120.300 -0.290 0.000 2.293 83 Y HA -0.099 4.452 4.550 0.001 0.000 0.291 83 Y C 2.659 178.229 175.900 -0.549 0.000 1.137 83 Y CA 1.221 59.213 58.100 -0.179 0.000 1.202 83 Y CB -0.642 37.926 38.460 0.181 0.000 0.990 83 Y HN 0.127 8.407 8.280 -0.000 0.000 0.537 84 A N -0.013 122.603 122.820 -0.340 0.000 1.969 84 A HA -0.170 4.150 4.320 0.001 0.000 0.218 84 A C 2.031 179.353 177.584 -0.437 0.000 1.169 84 A CA 1.570 53.295 52.037 -0.521 0.000 0.635 84 A CB -0.482 18.495 19.000 -0.037 0.000 0.810 84 A HN 0.479 8.629 8.150 -0.000 0.000 0.445 85 E N -1.006 118.952 120.200 -0.403 0.000 2.106 85 E HA -0.149 4.201 4.350 0.001 0.000 0.192 85 E C 1.563 177.988 176.600 -0.291 0.000 0.984 85 E CA 1.118 57.312 56.400 -0.344 0.000 0.806 85 E CB -0.242 29.214 29.700 -0.407 0.000 0.750 85 E HN 0.654 9.014 8.360 -0.000 0.000 0.458 86 F N 0.789 120.530 119.950 -0.349 0.000 2.171 86 F HA -0.110 4.417 4.527 0.001 0.000 0.300 86 F C 2.371 177.809 175.800 -0.603 0.000 1.090 86 F CA 0.890 58.664 58.000 -0.377 0.000 1.293 86 F CB -1.087 37.732 39.000 -0.301 0.000 1.013 86 F HN 0.002 8.302 8.300 -0.000 0.000 0.486 87 A N -0.020 122.432 122.820 -0.614 0.000 1.883 87 A HA -0.135 4.185 4.320 0.001 0.000 0.217 87 A C 2.448 179.736 177.584 -0.494 0.000 1.186 87 A CA 2.013 53.514 52.037 -0.893 0.000 0.624 87 A CB -1.241 17.435 19.000 -0.541 0.000 0.822 87 A HN 0.177 8.327 8.150 -0.000 0.000 0.444 88 V N -0.181 119.541 119.914 -0.320 0.000 2.427 88 V HA -0.224 3.896 4.120 0.001 0.000 0.248 88 V C 3.033 178.972 176.094 -0.259 0.000 1.051 88 V CA 1.747 63.915 62.300 -0.220 0.000 1.048 88 V CB -1.159 30.575 31.823 -0.149 0.000 0.666 88 V HN 0.626 8.816 8.190 -0.000 0.000 0.456 89 A N 0.780 123.468 122.820 -0.221 0.000 1.940 89 A HA -0.274 4.046 4.320 0.001 0.000 0.219 89 A C 2.511 179.875 177.584 -0.368 0.000 1.176 89 A CA 2.684 54.568 52.037 -0.254 0.000 0.631 89 A CB -0.976 18.090 19.000 0.111 0.000 0.814 89 A HN 0.653 8.803 8.150 -0.000 0.000 0.446 90 T N -3.066 111.307 114.554 -0.302 0.000 2.904 90 T HA 0.082 4.433 4.350 0.001 0.000 0.267 90 T C 1.865 176.448 174.700 -0.195 0.000 1.059 90 T CA 1.548 63.526 62.100 -0.203 0.000 1.137 90 T CB -0.709 68.096 68.868 -0.104 0.000 0.879 90 T HN 0.393 8.633 8.240 -0.000 0.000 0.467 91 G N 1.508 110.171 108.800 -0.228 0.000 2.408 91 G HA2 0.003 3.964 3.960 0.001 0.000 0.217 91 G HA3 0.003 3.964 3.960 0.001 0.000 0.217 91 G C 1.532 176.321 174.900 -0.185 0.000 1.150 91 G CA 0.645 45.645 45.100 -0.167 0.000 0.776 91 G HN 0.527 8.817 8.290 -0.000 0.000 0.542 92 L N -0.067 120.940 121.223 -0.359 0.000 2.109 92 L HA 0.086 4.426 4.340 0.001 0.000 0.207 92 L C 2.790 179.420 176.870 -0.400 0.000 1.086 92 L CA 0.375 54.929 54.840 -0.477 0.000 0.760 92 L CB -0.285 41.203 42.059 -0.952 0.000 0.910 92 L HN 0.188 8.418 8.230 -0.000 0.000 0.437 93 I N 0.059 120.358 120.570 -0.450 0.000 2.179 93 I HA -0.287 3.883 4.170 0.001 0.000 0.242 93 I C 2.834 178.924 176.117 -0.046 0.000 1.088 93 I CA 1.270 62.423 61.300 -0.245 0.000 1.357 93 I CB -0.462 37.314 38.000 -0.372 0.000 1.051 93 I HN 0.186 8.396 8.210 -0.000 0.000 0.409 94 A N 0.483 123.286 122.820 -0.028 0.000 1.908 94 A HA -0.288 4.033 4.320 0.001 0.000 0.218 94 A C 2.426 180.087 177.584 0.129 0.000 1.181 94 A CA 2.026 54.119 52.037 0.094 0.000 0.627 94 A CB -0.751 18.347 19.000 0.163 0.000 0.818 94 A HN 0.488 8.638 8.150 -0.000 0.000 0.445 95 M N -0.156 119.503 119.600 0.099 0.000 2.149 95 M HA -0.133 4.347 4.480 0.001 0.000 0.261 95 M C 1.929 178.330 176.300 0.168 0.000 1.064 95 M CA 1.892 57.284 55.300 0.153 0.000 1.102 95 M CB -0.384 32.250 32.600 0.057 0.000 1.369 95 M HN 0.400 8.690 8.290 -0.000 0.000 0.408 96 G N -0.717 108.175 108.800 0.153 0.000 2.471 96 G HA2 -0.062 3.898 3.960 0.001 0.000 0.219 96 G HA3 -0.062 3.898 3.960 0.001 0.000 0.219 96 G C 1.430 176.462 174.900 0.220 0.000 1.125 96 G CA 0.767 46.000 45.100 0.221 0.000 0.775 96 G HN 0.632 8.922 8.290 -0.000 0.000 0.548 97 A N 0.414 123.340 122.820 0.178 0.000 1.929 97 A HA 0.147 4.468 4.320 0.001 0.000 0.216 97 A C 2.297 179.977 177.584 0.159 0.000 1.176 97 A CA 2.049 54.175 52.037 0.147 0.000 0.628 97 A CB -0.316 18.747 19.000 0.105 0.000 0.816 97 A HN 0.901 9.051 8.150 -0.000 0.000 0.444 98 V N -2.982 117.041 119.914 0.182 0.000 3.427 98 V HA 0.411 4.531 4.120 0.001 0.000 0.305 98 V C 0.525 176.761 176.094 0.236 0.000 1.412 98 V CA -0.657 61.747 62.300 0.173 0.000 1.086 98 V CB -0.916 30.992 31.823 0.141 0.000 0.964 98 V HN 0.278 8.468 8.190 -0.000 0.000 0.439 99 L N 3.131 124.525 121.223 0.286 0.000 2.578 99 L HA 0.562 4.902 4.340 0.001 0.000 0.279 99 L C 1.375 178.375 176.870 0.217 0.000 1.227 99 L CA 2.118 57.163 54.840 0.341 0.000 0.900 99 L CB 0.334 42.569 42.059 0.293 0.000 1.144 99 L HN 0.652 8.882 8.230 -0.000 0.000 0.496 100 G N 3.869 112.695 108.800 0.043 0.000 2.268 100 G HA2 -0.298 3.662 3.960 0.001 0.000 0.240 100 G HA3 -0.298 3.662 3.960 0.001 0.000 0.240 100 G C 1.135 175.681 174.900 -0.590 0.000 1.010 100 G CA 0.451 45.141 45.100 -0.684 0.000 0.618 100 G HN 0.623 8.913 8.290 -0.000 0.000 0.516 101 R N -0.752 119.580 120.500 -0.281 0.000 2.432 101 R HA 0.437 4.778 4.340 0.001 0.000 0.260 101 R C -0.147 176.036 176.300 -0.195 0.000 0.935 101 R CA -0.100 55.836 56.100 -0.274 0.000 1.080 101 R CB 0.358 30.550 30.300 -0.180 0.000 1.155 101 R HN 0.294 8.564 8.270 -0.000 0.000 0.531 102 L N 0.683 121.786 121.223 -0.199 0.000 2.334 102 L HA 0.374 4.714 4.340 0.001 0.000 0.273 102 L C 0.358 176.995 176.870 -0.389 0.000 1.013 102 L CA -0.636 53.971 54.840 -0.389 0.000 0.816 102 L CB 1.427 43.060 42.059 -0.710 0.000 1.278 102 L HN -0.137 8.093 8.230 -0.000 0.000 0.431 103 R N 0.781 121.006 120.500 -0.458 0.000 2.641 103 R HA 0.194 4.534 4.340 0.001 0.000 0.269 103 R C 1.006 177.008 176.300 -0.496 0.000 1.074 103 R CA -0.507 55.359 56.100 -0.389 0.000 1.133 103 R CB 0.593 30.597 30.300 -0.494 0.000 1.029 103 R HN 0.423 8.693 8.270 -0.000 0.000 0.488 104 V N 2.856 122.691 119.914 -0.133 0.000 2.287 104 V HA -0.307 3.813 4.120 0.001 0.000 0.248 104 V C 1.987 178.094 176.094 0.022 0.000 1.053 104 V CA 2.237 64.596 62.300 0.097 0.000 1.027 104 V CB -0.742 31.195 31.823 0.190 0.000 0.646 104 V HN 0.858 9.048 8.190 -0.000 0.000 0.447 105 F N 1.174 121.120 119.950 -0.006 0.000 2.236 105 F HA -0.244 4.283 4.527 0.001 0.000 0.302 105 F C 2.171 177.942 175.800 -0.048 0.000 1.073 105 F CA 1.670 59.662 58.000 -0.014 0.000 1.336 105 F CB -0.890 38.091 39.000 -0.033 0.000 1.040 105 F HN 0.164 8.464 8.300 -0.000 0.000 0.507 106 Q N -0.529 118.805 119.800 -0.775 0.000 2.369 106 Q HA -0.127 4.214 4.340 0.001 0.000 0.206 106 Q C 1.661 177.477 176.000 -0.308 0.000 0.963 106 Q CA 1.068 56.527 55.803 -0.574 0.000 0.894 106 Q CB -0.383 27.910 28.738 -0.743 0.000 0.965 106 Q HN 0.578 8.848 8.270 -0.000 0.000 0.475 107 Y N 0.256 120.519 120.300 -0.062 0.000 2.274 107 Y HA -0.189 4.361 4.550 0.001 0.000 0.290 107 Y C 2.393 178.291 175.900 -0.002 0.000 1.145 107 Y CA 0.936 59.035 58.100 -0.002 0.000 1.203 107 Y CB -0.613 37.865 38.460 0.029 0.000 0.984 107 Y HN 0.137 8.417 8.280 -0.000 0.000 0.533 108 A N 0.206 123.105 122.820 0.131 0.000 1.902 108 A HA -0.127 4.194 4.320 0.001 0.000 0.217 108 A C 2.257 179.817 177.584 -0.040 0.000 1.181 108 A CA 1.438 53.513 52.037 0.065 0.000 0.623 108 A CB -1.053 17.997 19.000 0.083 0.000 0.818 108 A HN 0.461 8.611 8.150 -0.000 0.000 0.443 109 L N -0.999 120.176 121.223 -0.079 0.000 2.046 109 L HA -0.184 4.157 4.340 0.001 0.000 0.208 109 L C 2.569 179.224 176.870 -0.359 0.000 1.077 109 L CA 1.201 55.854 54.840 -0.311 0.000 0.747 109 L CB -0.639 41.319 42.059 -0.169 0.000 0.896 109 L HN 0.470 8.700 8.230 -0.000 0.000 0.432 110 L N 0.473 121.663 121.223 -0.055 0.000 2.013 110 L HA -0.209 4.132 4.340 0.001 0.000 0.212 110 L C 2.654 179.558 176.870 0.056 0.000 1.073 110 L CA 2.142 57.045 54.840 0.105 0.000 0.753 110 L CB -0.760 41.401 42.059 0.170 0.000 0.890 110 L HN 0.160 8.390 8.230 -0.000 0.000 0.432 111 A N -0.533 122.288 122.820 0.001 0.000 1.877 111 A HA -0.182 4.138 4.320 0.001 0.000 0.216 111 A C 2.283 179.851 177.584 -0.026 0.000 1.186 111 A CA 1.972 54.004 52.037 -0.009 0.000 0.620 111 A CB -0.973 18.026 19.000 -0.000 0.000 0.822 111 A HN 0.513 8.663 8.150 -0.000 0.000 0.443 112 L N -1.816 119.329 121.223 -0.130 0.000 2.081 112 L HA -0.222 4.119 4.340 0.001 0.000 0.212 112 L C 2.429 179.306 176.870 0.011 0.000 1.080 112 L CA 1.428 56.178 54.840 -0.151 0.000 0.754 112 L CB -0.549 41.283 42.059 -0.377 0.000 0.893 112 L HN 0.399 8.629 8.230 -0.000 0.000 0.433 113 F N -1.181 118.845 119.950 0.128 0.000 2.317 113 F HA -0.022 4.505 4.527 0.001 0.000 0.293 113 F C 2.273 178.166 175.800 0.156 0.000 1.085 113 F CA 0.339 58.446 58.000 0.178 0.000 1.390 113 F CB -0.574 38.574 39.000 0.247 0.000 1.077 113 F HN -0.097 8.203 8.300 -0.000 0.000 0.517 114 I N -0.661 120.007 120.570 0.163 0.000 2.439 114 I HA -0.196 3.975 4.170 0.001 0.000 0.251 114 I C 2.065 178.206 176.117 0.041 0.000 1.139 114 I CA 0.701 61.868 61.300 -0.222 0.000 1.438 114 I CB -0.022 37.643 38.000 -0.558 0.000 1.085 114 I HN -0.111 8.099 8.210 -0.000 0.000 0.427 115 V N 2.294 122.276 119.914 0.114 0.000 2.255 115 V HA -0.181 3.939 4.120 0.001 0.000 0.247 115 V C -0.268 175.998 176.094 0.286 0.000 1.051 115 V CA 2.259 64.685 62.300 0.210 0.000 1.018 115 V CB -2.097 29.844 31.823 0.196 0.000 0.641 115 V HN 0.344 8.534 8.190 -0.000 0.000 0.445 116 P HA -0.134 4.286 4.420 -0.000 0.000 0.216 116 P C 1.817 179.265 177.300 0.246 0.000 1.150 116 P CA 1.458 64.715 63.100 0.262 0.000 0.843 116 P CB -0.100 31.755 31.700 0.257 0.000 0.787 117 V N -1.773 118.297 119.914 0.260 0.000 2.453 117 V HA -0.224 3.897 4.120 0.001 0.000 0.247 117 V C 2.309 178.471 176.094 0.114 0.000 1.048 117 V CA 1.449 63.909 62.300 0.268 0.000 1.049 117 V CB -1.417 30.711 31.823 0.508 0.000 0.672 117 V HN 0.067 8.257 8.190 -0.000 0.000 0.457 118 Y N 0.851 121.113 120.300 -0.064 0.000 2.163 118 Y HA -0.215 4.335 4.550 0.001 0.000 0.288 118 Y C 2.217 177.986 175.900 -0.219 0.000 1.136 118 Y CA 1.732 59.542 58.100 -0.482 0.000 1.147 118 Y CB -0.312 37.989 38.460 -0.265 0.000 0.987 118 Y HN 0.198 8.478 8.280 -0.000 0.000 0.509 119 L N 0.322 121.509 121.223 -0.059 0.000 1.989 119 L HA -0.202 4.138 4.340 0.001 0.000 0.211 119 L C 2.345 179.115 176.870 -0.167 0.000 1.071 119 L CA 1.936 56.748 54.840 -0.047 0.000 0.749 119 L CB -1.438 40.732 42.059 0.185 0.000 0.890 119 L HN 0.471 8.701 8.230 -0.000 0.000 0.431 120 L N -0.004 121.061 121.223 -0.262 0.000 2.043 120 L HA -0.280 4.061 4.340 0.001 0.000 0.212 120 L C 2.281 178.992 176.870 -0.265 0.000 1.075 120 L CA 2.322 56.841 54.840 -0.535 0.000 0.752 120 L CB -1.094 40.646 42.059 -0.531 0.000 0.891 120 L HN 0.539 8.769 8.230 -0.000 0.000 0.432 121 N N -0.587 117.935 118.700 -0.297 0.000 2.188 121 N HA -0.240 4.500 4.740 0.001 0.000 0.184 121 N C 1.911 177.228 175.510 -0.322 0.000 1.018 121 N CA 1.456 54.328 53.050 -0.297 0.000 0.858 121 N CB -0.158 38.100 38.487 -0.382 0.000 0.989 121 N HN 0.575 8.955 8.380 -0.000 0.000 0.426 122 E N -1.134 118.816 120.200 -0.417 0.000 2.058 122 E HA -0.230 4.121 4.350 0.001 0.000 0.194 122 E C 1.605 178.141 176.600 -0.107 0.000 0.997 122 E CA 1.247 57.457 56.400 -0.317 0.000 0.801 122 E CB -0.290 29.165 29.700 -0.409 0.000 0.746 122 E HN 0.534 8.894 8.360 -0.000 0.000 0.450 123 W N 1.239 122.383 121.300 -0.261 0.000 2.354 123 W HA -0.147 4.513 4.660 0.001 0.000 0.315 123 W C 1.950 178.349 176.519 -0.200 0.000 1.206 123 W CA 1.536 58.765 57.345 -0.193 0.000 1.290 123 W CB -0.638 28.722 29.460 -0.166 0.000 1.152 123 W HN 0.068 8.248 8.180 -0.000 0.000 0.489 124 L N -0.392 120.686 121.223 -0.243 0.000 2.012 124 L HA -0.270 4.071 4.340 0.001 0.000 0.210 124 L C 2.129 178.777 176.870 -0.371 0.000 1.073 124 L CA 1.607 56.206 54.840 -0.402 0.000 0.748 124 L CB -1.262 40.641 42.059 -0.260 0.000 0.891 124 L HN -0.084 8.146 8.230 -0.000 0.000 0.431 125 V N -0.880 118.827 119.914 -0.346 0.000 2.403 125 V HA -0.096 4.025 4.120 0.001 0.000 0.239 125 V C 2.118 177.965 176.094 -0.411 0.000 1.041 125 V CA 0.868 62.889 62.300 -0.464 0.000 1.051 125 V CB -0.064 31.401 31.823 -0.596 0.000 0.704 125 V HN 0.248 8.438 8.190 -0.000 0.000 0.472 126 L N -0.061 120.996 121.223 -0.277 0.000 2.095 126 L HA -0.053 4.288 4.340 0.001 0.000 0.204 126 L C 1.916 178.748 176.870 -0.064 0.000 1.080 126 L CA 1.264 56.042 54.840 -0.104 0.000 0.759 126 L CB -0.558 41.488 42.059 -0.022 0.000 0.914 126 L HN 0.320 8.550 8.230 -0.000 0.000 0.439 127 D N -0.363 119.972 120.400 -0.109 0.000 2.355 127 D HA -0.082 4.558 4.640 0.001 0.000 0.218 127 D C 0.648 176.823 176.300 -0.209 0.000 1.004 127 D CA 0.293 54.225 54.000 -0.114 0.000 0.880 127 D CB -0.246 40.495 40.800 -0.098 0.000 0.911 127 D HN 0.146 8.516 8.370 -0.000 0.000 0.528 128 N N -0.268 118.280 118.700 -0.253 0.000 2.725 128 N HA -0.283 4.457 4.740 0.001 0.000 0.249 128 N C 0.835 176.125 175.510 -0.367 0.000 1.103 128 N CA 0.679 53.575 53.050 -0.256 0.000 0.707 128 N CB -1.162 37.240 38.487 -0.142 0.000 1.043 128 N HN 0.173 8.553 8.380 -0.000 0.000 0.553 129 A N -0.491 121.948 122.820 -0.634 0.000 2.024 129 A HA -0.152 4.168 4.320 0.001 0.000 0.220 129 A C 2.233 179.462 177.584 -0.591 0.000 1.164 129 A CA 2.114 53.606 52.037 -0.907 0.000 0.643 129 A CB -0.824 16.875 19.000 -2.168 0.000 0.806 129 A HN 0.965 9.115 8.150 -0.000 0.000 0.451 130 S N -1.695 113.736 115.700 -0.448 0.000 2.447 130 S HA 0.223 4.694 4.470 0.001 0.000 0.233 130 S C 1.791 176.269 174.600 -0.203 0.000 1.006 130 S CA 1.325 59.352 58.200 -0.288 0.000 0.957 130 S CB -0.728 62.332 63.200 -0.234 0.000 0.773 130 S HN 1.914 10.224 8.310 -0.000 0.000 0.507 131 G N 1.193 109.876 108.800 -0.195 0.000 2.220 131 G HA2 -0.277 3.683 3.960 0.001 0.000 0.269 131 G HA3 -0.277 3.683 3.960 0.001 0.000 0.269 131 G C 0.590 175.436 174.900 -0.090 0.000 0.977 131 G CA 0.667 45.693 45.100 -0.124 0.000 0.634 131 G HN 0.597 8.887 8.290 -0.000 0.000 0.539 132 L N 1.010 122.174 121.223 -0.099 0.000 2.640 132 L HA 0.288 4.629 4.340 0.001 0.000 0.230 132 L C 1.899 178.742 176.870 -0.046 0.000 1.123 132 L CA 1.120 55.922 54.840 -0.063 0.000 0.900 132 L CB 0.429 42.450 42.059 -0.062 0.000 1.146 132 L HN 0.391 8.621 8.230 -0.000 0.000 0.484 133 T N -4.349 110.165 114.554 -0.068 0.000 3.296 133 T HA 0.143 4.493 4.350 0.001 0.000 0.285 133 T C 0.261 174.983 174.700 0.035 0.000 1.014 133 T CA -0.438 61.646 62.100 -0.027 0.000 0.920 133 T CB 0.031 68.797 68.868 -0.171 0.000 1.143 133 T HN 0.134 8.374 8.240 -0.000 0.000 0.522 134 E N 0.986 121.197 120.200 0.019 0.000 2.414 134 E HA 0.366 4.716 4.350 0.001 0.000 0.263 134 E C 1.333 177.976 176.600 0.071 0.000 1.000 134 E CA 1.056 57.477 56.400 0.034 0.000 0.914 134 E CB -0.242 29.466 29.700 0.015 0.000 0.948 134 E HN 0.604 8.964 8.360 -0.000 0.000 0.444 135 G N 3.913 112.761 108.800 0.080 0.000 2.159 135 G HA2 -0.328 3.633 3.960 0.001 0.000 0.256 135 G HA3 -0.328 3.633 3.960 0.001 0.000 0.256 135 G C 0.024 174.985 174.900 0.102 0.000 0.977 135 G CA 0.065 45.211 45.100 0.075 0.000 0.652 135 G HN 0.585 8.875 8.290 -0.000 0.000 0.531 136 F N 1.334 121.278 119.950 -0.009 0.000 2.623 136 F HA 0.463 4.991 4.527 0.001 0.000 0.383 136 F C 0.649 176.448 175.800 -0.003 0.000 1.077 136 F CA 0.307 58.300 58.000 -0.011 0.000 1.268 136 F CB 0.868 39.854 39.000 -0.023 0.000 1.053 136 F HN 0.206 8.506 8.300 -0.000 0.000 0.571 137 Q N 4.753 124.232 119.800 -0.536 0.000 2.394 137 Q HA 0.281 4.622 4.340 0.001 0.000 0.259 137 Q C -1.542 174.186 176.000 -0.453 0.000 1.021 137 Q CA -0.242 55.358 55.803 -0.338 0.000 0.805 137 Q CB 0.958 29.562 28.738 -0.223 0.000 1.226 137 Q HN 0.616 8.886 8.270 -0.000 0.000 0.476 138 D N 1.666 121.941 120.400 -0.208 0.000 3.602 138 D HA 0.201 4.842 4.640 0.001 0.000 0.275 138 D C -0.053 176.245 176.300 -0.002 0.000 1.348 138 D CA 0.115 54.052 54.000 -0.104 0.000 0.768 138 D CB 0.257 41.059 40.800 0.003 0.000 1.373 138 D HN 0.463 8.833 8.370 -0.000 0.000 0.683 139 S N -0.169 115.523 115.700 -0.014 0.000 2.374 139 S HA -0.125 4.346 4.470 0.001 0.000 0.227 139 S C 1.621 176.202 174.600 -0.032 0.000 1.037 139 S CA 1.446 59.645 58.200 -0.003 0.000 1.024 139 S CB 0.187 63.388 63.200 0.002 0.000 0.861 139 S HN 0.516 8.826 8.310 -0.000 0.000 0.456 140 A N -0.788 122.022 122.820 -0.016 0.000 2.571 140 A HA 0.599 4.920 4.320 0.001 0.000 0.274 140 A C 1.087 178.661 177.584 -0.017 0.000 1.196 140 A CA 0.395 52.395 52.037 -0.060 0.000 0.957 140 A CB -0.028 19.018 19.000 0.077 0.000 1.150 140 A HN 0.872 9.022 8.150 -0.000 0.000 0.539 141 G N -0.287 108.532 108.800 0.032 0.000 2.140 141 G HA2 -0.221 3.740 3.960 0.001 0.000 0.211 141 G HA3 -0.221 3.740 3.960 0.001 0.000 0.211 141 G C 0.883 175.937 174.900 0.257 0.000 1.013 141 G CA 0.584 45.726 45.100 0.070 0.000 0.705 141 G HN 0.474 8.764 8.290 -0.000 0.000 0.508 142 S N -0.486 115.394 115.700 0.301 0.000 2.387 142 S HA -0.110 4.361 4.470 0.001 0.000 0.230 142 S C 2.284 177.069 174.600 0.308 0.000 1.035 142 S CA 1.404 59.813 58.200 0.348 0.000 1.014 142 S CB -0.038 63.268 63.200 0.177 0.000 0.836 142 S HN 0.493 8.803 8.310 -0.000 0.000 0.466 143 I N 0.828 121.543 120.570 0.242 0.000 2.685 143 I HA 0.164 4.334 4.170 0.001 0.000 0.251 143 I C 2.629 178.931 176.117 0.309 0.000 1.102 143 I CA 0.814 62.278 61.300 0.273 0.000 1.442 143 I CB -1.754 36.431 38.000 0.308 0.000 1.194 143 I HN 0.216 8.426 8.210 -0.000 0.000 0.448 144 A N 0.646 123.621 122.820 0.260 0.000 2.015 144 A HA -0.064 4.257 4.320 0.001 0.000 0.219 144 A C 2.279 180.016 177.584 0.256 0.000 1.163 144 A CA 1.448 53.598 52.037 0.189 0.000 0.646 144 A CB -0.360 18.703 19.000 0.104 0.000 0.806 144 A HN 0.389 8.539 8.150 -0.000 0.000 0.448 145 I N -2.984 117.699 120.570 0.188 0.000 3.132 145 I HA 0.062 4.232 4.170 0.001 0.000 0.255 145 I C 2.360 178.526 176.117 0.083 0.000 1.118 145 I CA 0.242 61.586 61.300 0.073 0.000 1.463 145 I CB -0.319 37.555 38.000 -0.210 0.000 1.356 145 I HN 0.235 8.445 8.210 -0.000 0.000 0.463 146 H N 0.988 120.239 119.070 0.302 0.000 2.294 146 H HA 0.101 4.657 4.556 0.001 0.000 0.306 146 H C 2.308 177.814 175.328 0.296 0.000 1.065 146 H CA 1.687 57.921 56.048 0.311 0.000 1.343 146 H CB -0.409 29.590 29.762 0.394 0.000 1.396 146 H HN 0.289 8.569 8.280 -0.000 0.000 0.506 147 A N 1.333 124.419 122.820 0.443 0.000 1.883 147 A HA -0.208 4.113 4.320 0.001 0.000 0.217 147 A C 2.379 180.238 177.584 0.458 0.000 1.186 147 A CA 1.638 53.938 52.037 0.437 0.000 0.624 147 A CB -1.241 18.016 19.000 0.429 0.000 0.822 147 A HN 0.347 8.497 8.150 -0.000 0.000 0.444 148 F N 1.136 121.275 119.950 0.314 0.000 2.063 148 F HA -0.186 4.341 4.527 0.001 0.000 0.298 148 F C 2.318 178.290 175.800 0.287 0.000 1.109 148 F CA 2.101 60.281 58.000 0.300 0.000 1.212 148 F CB -0.746 38.406 39.000 0.253 0.000 0.973 148 F HN 0.199 8.499 8.300 -0.000 0.000 0.480 149 G N -0.771 108.173 108.800 0.239 0.000 2.408 149 G HA2 -0.146 3.815 3.960 0.001 0.000 0.217 149 G HA3 -0.146 3.815 3.960 0.001 0.000 0.217 149 G C 1.770 176.692 174.900 0.036 0.000 1.150 149 G CA 0.744 45.888 45.100 0.074 0.000 0.776 149 G HN 0.669 8.959 8.290 -0.000 0.000 0.542 150 A N 0.193 123.040 122.820 0.044 0.000 1.877 150 A HA 0.029 4.349 4.320 0.001 0.000 0.216 150 A C 2.229 179.706 177.584 -0.178 0.000 1.186 150 A CA 1.471 53.470 52.037 -0.064 0.000 0.620 150 A CB -0.592 18.329 19.000 -0.131 0.000 0.822 150 A HN 0.381 8.531 8.150 -0.000 0.000 0.443 151 Y N -2.051 118.300 120.300 0.086 0.000 2.337 151 Y HA -0.011 4.539 4.550 0.001 0.000 0.293 151 Y C 2.034 177.901 175.900 -0.054 0.000 1.123 151 Y CA 0.738 58.851 58.100 0.020 0.000 1.201 151 Y CB -0.614 37.865 38.460 0.032 0.000 1.011 151 Y HN 0.420 8.700 8.280 -0.000 0.000 0.545 152 F N 0.229 120.088 119.950 -0.152 0.000 2.134 152 F HA -0.082 4.445 4.527 0.001 0.000 0.299 152 F C 2.348 178.104 175.800 -0.074 0.000 1.097 152 F CA 1.641 59.516 58.000 -0.209 0.000 1.264 152 F CB -0.508 38.221 39.000 -0.451 0.000 1.001 152 F HN 0.004 8.304 8.300 -0.000 0.000 0.479 153 G N 0.417 109.319 108.800 0.170 0.000 2.408 153 G HA2 -0.192 3.769 3.960 0.001 0.000 0.217 153 G HA3 -0.192 3.769 3.960 0.001 0.000 0.217 153 G C 1.711 176.631 174.900 0.032 0.000 1.150 153 G CA 0.922 46.100 45.100 0.131 0.000 0.776 153 G HN 0.400 8.690 8.290 -0.000 0.000 0.542 154 L N 0.792 122.014 121.223 -0.003 0.000 2.083 154 L HA 0.010 4.351 4.340 0.001 0.000 0.209 154 L C 3.177 180.021 176.870 -0.042 0.000 1.083 154 L CA 0.929 55.756 54.840 -0.022 0.000 0.752 154 L CB -0.699 41.341 42.059 -0.033 0.000 0.899 154 L HN 0.326 8.556 8.230 -0.000 0.000 0.433 155 G N -0.155 108.595 108.800 -0.083 0.000 2.446 155 G HA2 -0.227 3.734 3.960 0.001 0.000 0.217 155 G HA3 -0.227 3.734 3.960 0.001 0.000 0.217 155 G C 1.573 176.372 174.900 -0.170 0.000 1.168 155 G CA 1.089 46.093 45.100 -0.159 0.000 0.771 155 G HN 0.209 8.499 8.290 -0.000 0.000 0.551 156 V N 0.637 120.445 119.914 -0.176 0.000 2.343 156 V HA -0.170 3.951 4.120 0.001 0.000 0.247 156 V C 2.992 179.062 176.094 -0.040 0.000 1.051 156 V CA 2.168 64.411 62.300 -0.093 0.000 1.036 156 V CB -0.475 31.352 31.823 0.006 0.000 0.654 156 V HN 0.479 8.669 8.190 -0.000 0.000 0.451 157 S N 0.518 116.208 115.700 -0.018 0.000 2.356 157 S HA -0.184 4.286 4.470 0.001 0.000 0.223 157 S C 2.023 176.613 174.600 -0.017 0.000 1.032 157 S CA 2.082 60.282 58.200 0.000 0.000 1.005 157 S CB -0.438 62.772 63.200 0.016 0.000 0.867 157 S HN 0.677 8.987 8.310 -0.000 0.000 0.449 158 I N -0.254 120.299 120.570 -0.029 0.000 2.394 158 I HA 0.059 4.229 4.170 0.001 0.000 0.251 158 I C 2.353 178.448 176.117 -0.036 0.000 1.136 158 I CA 1.365 62.647 61.300 -0.030 0.000 1.425 158 I CB -0.761 37.219 38.000 -0.034 0.000 1.079 158 I HN 0.297 8.507 8.210 -0.000 0.000 0.425 159 A N 2.189 124.980 122.820 -0.049 0.000 1.930 159 A HA -0.014 4.306 4.320 0.001 0.000 0.217 159 A C 2.096 179.657 177.584 -0.039 0.000 1.175 159 A CA 1.984 53.990 52.037 -0.050 0.000 0.627 159 A CB -0.509 18.449 19.000 -0.070 0.000 0.815 159 A HN 0.664 8.814 8.150 -0.000 0.000 0.443 160 L N -4.265 116.937 121.223 -0.035 0.000 2.920 160 L HA 0.372 4.712 4.340 0.001 0.000 0.257 160 L C 0.241 177.088 176.870 -0.038 0.000 1.150 160 L CA 0.031 54.850 54.840 -0.035 0.000 0.959 160 L CB -1.066 40.971 42.059 -0.037 0.000 1.321 160 L HN -0.142 8.088 8.230 -0.000 0.000 0.555 161 T N 2.521 117.057 114.554 -0.030 0.000 2.853 161 T HA 0.397 4.747 4.350 0.001 0.000 0.298 161 T C 0.708 175.392 174.700 -0.026 0.000 0.978 161 T CA 0.621 62.704 62.100 -0.028 0.000 1.152 161 T CB 0.453 69.316 68.868 -0.009 0.000 0.914 161 T HN 0.581 8.821 8.240 -0.000 0.000 0.539 162 T N 0.188 114.722 114.554 -0.034 0.000 2.927 162 T HA 0.605 4.956 4.350 0.001 0.000 0.281 162 T C 1.664 176.355 174.700 -0.015 0.000 0.998 162 T CA -0.547 61.537 62.100 -0.027 0.000 1.019 162 T CB 1.282 70.129 68.868 -0.035 0.000 1.061 162 T HN 0.467 8.707 8.240 -0.000 0.000 0.518 163 A N 1.327 124.141 122.820 -0.010 0.000 1.940 163 A HA 0.163 4.484 4.320 0.001 0.000 0.219 163 A C 2.634 180.219 177.584 0.001 0.000 1.176 163 A CA 1.923 53.959 52.037 -0.001 0.000 0.631 163 A CB -1.582 17.417 19.000 -0.001 0.000 0.814 163 A HN 1.298 9.448 8.150 -0.000 0.000 0.446 164 A N -0.535 122.280 122.820 -0.008 0.000 1.873 164 A HA -0.297 4.023 4.320 0.001 0.000 0.218 164 A C 2.129 179.710 177.584 -0.004 0.000 1.193 164 A CA 1.950 53.982 52.037 -0.008 0.000 0.629 164 A CB -0.707 18.280 19.000 -0.023 0.000 0.826 164 A HN 0.662 8.812 8.150 -0.000 0.000 0.447 165 Q N -0.998 118.789 119.800 -0.023 0.000 2.124 165 Q HA -0.119 4.221 4.340 0.001 0.000 0.202 165 Q C 2.270 178.297 176.000 0.046 0.000 0.977 165 Q CA 1.331 57.115 55.803 -0.031 0.000 0.850 165 Q CB -0.166 28.520 28.738 -0.087 0.000 0.901 165 Q HN 0.604 8.874 8.270 -0.000 0.000 0.429 166 R N -0.025 120.501 120.500 0.042 0.000 2.189 166 R HA -0.038 4.303 4.340 0.001 0.000 0.223 166 R C 1.863 178.205 176.300 0.070 0.000 1.092 166 R CA 0.937 57.077 56.100 0.066 0.000 0.989 166 R CB -0.103 30.221 30.300 0.041 0.000 0.876 166 R HN 0.161 8.431 8.270 -0.000 0.000 0.457 167 A N 0.514 123.368 122.820 0.057 0.000 2.169 167 A HA 0.012 4.332 4.320 0.001 0.000 0.212 167 A C 0.639 178.267 177.584 0.074 0.000 1.153 167 A CA 0.265 52.334 52.037 0.053 0.000 0.756 167 A CB 0.258 19.279 19.000 0.035 0.000 0.813 167 A HN 0.090 8.240 8.150 -0.000 0.000 0.471 168 Q N 1.224 121.094 119.800 0.116 0.000 2.279 168 Q HA 0.303 4.643 4.340 0.001 0.000 0.256 168 Q C -2.511 173.592 176.000 0.172 0.000 0.937 168 Q CA -1.886 54.015 55.803 0.164 0.000 0.933 168 Q CB 1.255 30.126 28.738 0.222 0.000 1.189 168 Q HN 0.323 8.593 8.270 -0.000 0.000 0.417 169 P HA 0.280 4.700 4.420 -0.000 0.000 0.277 169 P C -0.389 176.794 177.300 -0.195 0.000 1.240 169 P CA -0.338 62.751 63.100 -0.019 0.000 0.798 169 P CB 0.928 32.627 31.700 -0.002 0.000 0.979 170 I N 2.056 122.442 120.570 -0.306 0.000 2.291 170 I HA 0.203 4.374 4.170 0.001 0.000 0.290 170 I C 0.915 176.905 176.117 -0.210 0.000 1.050 170 I CA -0.039 60.964 61.300 -0.495 0.000 1.245 170 I CB 0.302 38.047 38.000 -0.425 0.000 1.405 170 I HN 0.226 8.436 8.210 -0.000 0.000 0.478 171 E N 4.422 124.500 120.200 -0.204 0.000 2.249 171 E HA 0.679 5.030 4.350 0.001 0.000 0.263 171 E C -0.694 175.857 176.600 -0.081 0.000 0.950 171 E CA -0.695 55.652 56.400 -0.088 0.000 0.827 171 E CB 2.180 31.843 29.700 -0.062 0.000 1.220 171 E HN 0.623 8.983 8.360 -0.000 0.000 0.411 172 S N 0.560 116.263 115.700 0.006 0.000 2.638 172 S HA 0.637 5.108 4.470 0.001 0.000 0.274 172 S C -1.465 173.159 174.600 0.039 0.000 1.157 172 S CA -0.939 57.289 58.200 0.047 0.000 0.826 172 S CB 1.962 65.286 63.200 0.207 0.000 1.139 172 S HN 0.563 8.873 8.310 -0.000 0.000 0.474 173 D N -0.399 120.030 120.400 0.048 0.000 2.744 173 D HA 0.665 5.305 4.640 0.001 0.000 0.304 173 D C 1.062 177.383 176.300 0.036 0.000 1.179 173 D CA -0.274 53.744 54.000 0.031 0.000 1.024 173 D CB 0.689 41.499 40.800 0.016 0.000 1.453 173 D HN 0.731 9.101 8.370 -0.000 0.000 0.529 174 A N -0.506 122.322 122.820 0.014 0.000 1.933 174 A HA -0.080 4.240 4.320 0.001 0.000 0.218 174 A C 1.906 179.487 177.584 -0.005 0.000 1.175 174 A CA 2.324 54.360 52.037 -0.002 0.000 0.628 174 A CB -1.216 17.772 19.000 -0.020 0.000 0.814 174 A HN 0.602 8.752 8.150 -0.000 0.000 0.444 175 T N 0.144 114.705 114.554 0.013 0.000 2.770 175 T HA -0.113 4.238 4.350 0.001 0.000 0.263 175 T C 2.429 177.204 174.700 0.124 0.000 1.039 175 T CA 1.872 63.977 62.100 0.009 0.000 1.142 175 T CB -0.380 68.523 68.868 0.059 0.000 0.868 175 T HN 0.795 9.035 8.240 -0.000 0.000 0.435 176 S N 1.902 117.716 115.700 0.189 0.000 2.368 176 S HA -0.149 4.322 4.470 0.001 0.000 0.224 176 S C 1.658 176.420 174.600 0.271 0.000 1.029 176 S CA 1.143 59.510 58.200 0.278 0.000 0.988 176 S CB -0.494 62.797 63.200 0.151 0.000 0.838 176 S HN 0.328 8.638 8.310 -0.000 0.000 0.462 177 D N 1.453 121.957 120.400 0.174 0.000 2.224 177 D HA 0.038 4.678 4.640 0.001 0.000 0.205 177 D C 2.225 178.577 176.300 0.087 0.000 0.965 177 D CA 0.668 54.753 54.000 0.142 0.000 0.852 177 D CB -0.235 40.610 40.800 0.076 0.000 0.947 177 D HN 0.477 8.847 8.370 -0.000 0.000 0.494 178 R N -0.353 120.162 120.500 0.025 0.000 2.075 178 R HA -0.071 4.269 4.340 0.001 0.000 0.232 178 R C 2.237 178.537 176.300 0.000 0.000 1.126 178 R CA 0.710 56.776 56.100 -0.057 0.000 0.963 178 R CB -0.277 29.918 30.300 -0.175 0.000 0.858 178 R HN 0.125 8.395 8.270 -0.000 0.000 0.435 179 F N 0.501 120.520 119.950 0.115 0.000 2.126 179 F HA -0.237 4.290 4.527 0.001 0.000 0.299 179 F C 2.760 178.690 175.800 0.217 0.000 1.096 179 F CA 1.451 59.576 58.000 0.209 0.000 1.255 179 F CB -0.855 38.313 39.000 0.280 0.000 0.997 179 F HN -0.024 8.276 8.300 -0.000 0.000 0.479 180 S N -0.521 115.397 115.700 0.362 0.000 2.383 180 S HA -0.193 4.277 4.470 0.001 0.000 0.229 180 S C 2.155 176.849 174.600 0.157 0.000 1.030 180 S CA 1.182 59.536 58.200 0.256 0.000 1.002 180 S CB -0.181 63.152 63.200 0.222 0.000 0.829 180 S HN 0.154 8.464 8.310 -0.000 0.000 0.467 181 M N 0.520 120.178 119.600 0.097 0.000 2.296 181 M HA 0.014 4.494 4.480 0.001 0.000 0.265 181 M C 2.094 178.417 176.300 0.038 0.000 1.064 181 M CA 0.812 56.130 55.300 0.029 0.000 1.109 181 M CB -1.285 31.300 32.600 -0.024 0.000 1.396 181 M HN 0.400 8.690 8.290 -0.000 0.000 0.430 182 L N 0.554 121.827 121.223 0.084 0.000 2.027 182 L HA 0.009 4.350 4.340 0.001 0.000 0.206 182 L C 2.293 179.224 176.870 0.100 0.000 1.074 182 L CA 2.133 57.012 54.840 0.065 0.000 0.745 182 L CB -1.282 40.824 42.059 0.078 0.000 0.898 182 L HN 0.267 8.497 8.230 -0.000 0.000 0.433 183 G N -1.568 107.346 108.800 0.191 0.000 2.418 183 G HA2 -0.320 3.641 3.960 0.001 0.000 0.217 183 G HA3 -0.320 3.641 3.960 0.001 0.000 0.217 183 G C 1.689 176.656 174.900 0.112 0.000 1.158 183 G CA 0.963 46.173 45.100 0.184 0.000 0.771 183 G HN 0.491 8.781 8.290 -0.000 0.000 0.545 184 S N 0.082 115.837 115.700 0.092 0.000 2.353 184 S HA -0.144 4.326 4.470 0.001 0.000 0.222 184 S C 2.521 177.187 174.600 0.109 0.000 1.035 184 S CA 1.818 60.066 58.200 0.080 0.000 1.025 184 S CB -0.316 62.906 63.200 0.037 0.000 0.902 184 S HN 0.381 8.691 8.310 -0.000 0.000 0.440 185 M N 0.409 120.035 119.600 0.043 0.000 2.159 185 M HA -0.068 4.412 4.480 0.001 0.000 0.263 185 M C 2.132 178.477 176.300 0.076 0.000 1.063 185 M CA 1.113 56.416 55.300 0.004 0.000 1.110 185 M CB -0.454 32.089 32.600 -0.095 0.000 1.374 185 M HN 0.237 8.527 8.290 -0.000 0.000 0.411 186 V N 0.770 120.736 119.914 0.086 0.000 2.358 186 V HA -0.246 3.874 4.120 0.001 0.000 0.246 186 V C 2.275 178.515 176.094 0.243 0.000 1.047 186 V CA 1.571 63.952 62.300 0.135 0.000 1.035 186 V CB -0.529 31.398 31.823 0.173 0.000 0.658 186 V HN 0.445 8.635 8.190 -0.000 0.000 0.452 187 L N -1.814 119.534 121.223 0.208 0.000 2.017 187 L HA -0.220 4.120 4.340 0.001 0.000 0.208 187 L C 2.296 179.429 176.870 0.438 0.000 1.073 187 L CA 2.172 57.154 54.840 0.236 0.000 0.745 187 L CB -0.491 41.642 42.059 0.125 0.000 0.894 187 L HN 0.458 8.688 8.230 -0.000 0.000 0.432 188 W N 1.091 122.485 121.300 0.157 0.000 2.335 188 W HA -0.265 4.396 4.660 0.001 0.000 0.311 188 W C 2.444 179.023 176.519 0.100 0.000 1.213 188 W CA 1.938 59.343 57.345 0.101 0.000 1.274 188 W CB -0.029 29.421 29.460 -0.017 0.000 1.148 188 W HN 0.166 8.346 8.180 -0.000 0.000 0.498 189 L N -2.781 118.683 121.223 0.402 0.000 2.217 189 L HA 0.057 4.397 4.340 0.001 0.000 0.211 189 L C 1.676 178.575 176.870 0.049 0.000 1.107 189 L CA 1.687 56.639 54.840 0.185 0.000 0.783 189 L CB -1.311 40.668 42.059 -0.133 0.000 0.919 189 L HN -0.137 8.093 8.230 -0.000 0.000 0.442 190 F N -1.499 118.593 119.950 0.236 0.000 2.754 190 F HA 0.085 4.612 4.527 0.001 0.000 0.297 190 F C 2.102 178.030 175.800 0.213 0.000 1.122 190 F CA -0.276 57.834 58.000 0.184 0.000 1.400 190 F CB -0.594 38.481 39.000 0.126 0.000 1.117 190 F HN 0.217 8.517 8.300 -0.000 0.000 0.587 191 W N 2.629 124.041 121.300 0.188 0.000 2.325 191 W HA -0.180 4.480 4.660 0.001 0.000 0.299 191 W C -0.949 175.652 176.519 0.137 0.000 1.215 191 W CA 1.813 59.221 57.345 0.105 0.000 1.244 191 W CB -1.626 27.785 29.460 -0.080 0.000 1.140 191 W HN 0.056 8.236 8.180 -0.000 0.000 0.523 192 P HA -0.139 4.281 4.420 -0.000 0.000 0.216 192 P C 1.967 179.355 177.300 0.147 0.000 1.150 192 P CA 2.454 65.687 63.100 0.221 0.000 0.837 192 P CB -0.179 31.611 31.700 0.150 0.000 0.786 193 S N -1.382 114.423 115.700 0.176 0.000 2.382 193 S HA -0.150 4.321 4.470 0.001 0.000 0.228 193 S C 1.608 176.207 174.600 -0.002 0.000 1.027 193 S CA 0.901 59.127 58.200 0.044 0.000 0.991 193 S CB -1.175 62.168 63.200 0.238 0.000 0.823 193 S HN 0.114 8.424 8.310 -0.000 0.000 0.469 194 F N 2.374 122.308 119.950 -0.027 0.000 2.126 194 F HA -0.143 4.384 4.527 0.001 0.000 0.299 194 F C 2.310 178.111 175.800 0.002 0.000 1.096 194 F CA 1.160 59.141 58.000 -0.033 0.000 1.255 194 F CB -0.513 38.318 39.000 -0.282 0.000 0.997 194 F HN 0.189 8.489 8.300 -0.000 0.000 0.479 195 A N -1.716 121.232 122.820 0.213 0.000 1.929 195 A HA -0.143 4.177 4.320 0.001 0.000 0.216 195 A C 2.162 179.731 177.584 -0.026 0.000 1.176 195 A CA 1.989 54.109 52.037 0.140 0.000 0.628 195 A CB -1.229 17.919 19.000 0.247 0.000 0.816 195 A HN 0.377 8.527 8.150 -0.000 0.000 0.444 196 T N -1.133 113.346 114.554 -0.125 0.000 3.081 196 T HA 0.351 4.701 4.350 0.001 0.000 0.250 196 T C 1.774 176.279 174.700 -0.324 0.000 1.100 196 T CA 0.954 62.925 62.100 -0.214 0.000 1.038 196 T CB -0.383 68.333 68.868 -0.253 0.000 0.962 196 T HN 0.471 8.711 8.240 -0.000 0.000 0.516 197 A N 1.752 124.361 122.820 -0.352 0.000 1.940 197 A HA 0.026 4.346 4.320 0.001 0.000 0.219 197 A C 1.832 179.401 177.584 -0.024 0.000 1.176 197 A CA 1.631 53.490 52.037 -0.297 0.000 0.631 197 A CB -0.541 18.376 19.000 -0.138 0.000 0.814 197 A HN 0.772 8.922 8.150 -0.000 0.000 0.446 198 I N -3.583 116.992 120.570 0.008 0.000 3.936 198 I HA 0.397 4.567 4.170 0.001 0.000 0.330 198 I C -0.420 175.745 176.117 0.080 0.000 1.509 198 I CA -0.526 60.818 61.300 0.072 0.000 1.126 198 I CB 0.535 38.586 38.000 0.086 0.000 1.115 198 I HN -0.127 8.083 8.210 -0.000 0.000 0.424 199 V N 2.930 122.869 119.914 0.043 0.000 2.686 199 V HA 0.372 4.492 4.120 0.001 0.000 0.295 199 V C -1.773 174.381 176.094 0.098 0.000 1.057 199 V CA -1.308 61.024 62.300 0.053 0.000 1.012 199 V CB 0.925 32.755 31.823 0.012 0.000 1.006 199 V HN 0.184 8.374 8.190 -0.000 0.000 0.477 200 P HA -0.026 4.394 4.420 -0.000 0.000 0.265 200 P C 0.518 177.929 177.300 0.186 0.000 1.187 200 P CA 0.149 63.340 63.100 0.152 0.000 0.766 200 P CB 0.278 32.050 31.700 0.119 0.000 0.820 201 F N 2.774 122.782 119.950 0.097 0.000 2.154 201 F HA -0.258 4.270 4.527 0.001 0.000 0.301 201 F C 1.754 177.605 175.800 0.086 0.000 1.087 201 F CA 1.872 59.937 58.000 0.108 0.000 1.274 201 F CB -0.189 38.872 39.000 0.101 0.000 1.009 201 F HN 0.350 8.650 8.300 -0.000 0.000 0.485 202 E N -0.329 119.969 120.200 0.163 0.000 2.204 202 E HA -0.195 4.155 4.350 0.001 0.000 0.194 202 E C 1.808 178.399 176.600 -0.016 0.000 0.989 202 E CA 1.188 57.633 56.400 0.075 0.000 0.824 202 E CB -0.284 29.481 29.700 0.109 0.000 0.756 202 E HN 0.575 8.935 8.360 -0.000 0.000 0.477 203 Q N -0.485 119.307 119.800 -0.013 0.000 2.360 203 Q HA 0.148 4.488 4.340 0.001 0.000 0.202 203 Q C 1.642 177.605 176.000 -0.063 0.000 0.915 203 Q CA -0.108 55.680 55.803 -0.023 0.000 0.943 203 Q CB 0.162 28.904 28.738 0.006 0.000 1.064 203 Q HN 0.279 8.549 8.270 -0.000 0.000 0.511 204 M N 1.549 121.066 119.600 -0.138 0.000 2.067 204 M HA -0.063 4.418 4.480 0.001 0.000 0.260 204 M C -1.164 175.074 176.300 -0.103 0.000 1.069 204 M CA 1.780 56.990 55.300 -0.150 0.000 1.117 204 M CB -1.056 31.374 32.600 -0.284 0.000 1.334 204 M HN -0.025 8.265 8.290 -0.000 0.000 0.407 205 P HA -0.178 4.242 4.420 -0.000 0.000 0.216 205 P C 1.507 178.789 177.300 -0.030 0.000 1.150 205 P CA 1.542 64.606 63.100 -0.059 0.000 0.837 205 P CB -0.359 31.307 31.700 -0.057 0.000 0.786 206 Q N -0.734 119.049 119.800 -0.029 0.000 2.050 206 Q HA -0.138 4.202 4.340 0.001 0.000 0.202 206 Q C 1.724 177.720 176.000 -0.008 0.000 0.980 206 Q CA 2.250 58.046 55.803 -0.012 0.000 0.840 206 Q CB -0.758 27.975 28.738 -0.009 0.000 0.898 206 Q HN 0.107 8.377 8.270 -0.000 0.000 0.424 207 T N 1.594 116.139 114.554 -0.014 0.000 2.777 207 T HA -0.134 4.217 4.350 0.001 0.000 0.266 207 T C 1.817 176.520 174.700 0.006 0.000 1.040 207 T CA 1.568 63.666 62.100 -0.005 0.000 1.141 207 T CB -0.326 68.533 68.868 -0.015 0.000 0.868 207 T HN 0.577 8.817 8.240 -0.000 0.000 0.444 208 I N 0.132 120.703 120.570 0.002 0.000 2.353 208 I HA 0.004 4.175 4.170 0.001 0.000 0.248 208 I C 2.237 178.366 176.117 0.020 0.000 1.119 208 I CA 0.922 62.236 61.300 0.023 0.000 1.417 208 I CB -1.105 36.916 38.000 0.036 0.000 1.078 208 I HN -0.030 8.180 8.210 -0.000 0.000 0.421 209 V N 2.059 121.981 119.914 0.014 0.000 2.287 209 V HA -0.266 3.854 4.120 0.001 0.000 0.248 209 V C 2.523 178.623 176.094 0.009 0.000 1.053 209 V CA 2.357 64.666 62.300 0.015 0.000 1.027 209 V CB -1.217 30.613 31.823 0.012 0.000 0.646 209 V HN 0.487 8.677 8.190 -0.000 0.000 0.447 210 N N 0.001 118.705 118.700 0.007 0.000 2.166 210 N HA -0.136 4.605 4.740 0.001 0.000 0.186 210 N C 1.908 177.405 175.510 -0.021 0.000 1.019 210 N CA 1.923 54.976 53.050 0.004 0.000 0.856 210 N CB -0.578 37.913 38.487 0.006 0.000 0.993 210 N HN 0.479 8.859 8.380 -0.000 0.000 0.426 211 T N 1.660 116.199 114.554 -0.025 0.000 2.777 211 T HA 0.012 4.363 4.350 0.001 0.000 0.266 211 T C 2.132 176.722 174.700 -0.184 0.000 1.040 211 T CA 0.566 62.622 62.100 -0.074 0.000 1.141 211 T CB -0.201 68.677 68.868 0.017 0.000 0.868 211 T HN 0.138 8.378 8.240 -0.000 0.000 0.444 212 L N 0.323 121.470 121.223 -0.125 0.000 2.046 212 L HA -0.040 4.300 4.340 0.001 0.000 0.208 212 L C 2.438 179.248 176.870 -0.099 0.000 1.077 212 L CA 1.146 55.887 54.840 -0.164 0.000 0.747 212 L CB -0.495 41.557 42.059 -0.012 0.000 0.896 212 L HN 0.263 8.493 8.230 -0.000 0.000 0.432 213 L N -0.791 120.430 121.223 -0.003 0.000 2.093 213 L HA -0.145 4.195 4.340 0.001 0.000 0.208 213 L C 2.826 179.757 176.870 0.101 0.000 1.085 213 L CA 0.953 55.868 54.840 0.125 0.000 0.755 213 L CB -0.660 41.488 42.059 0.148 0.000 0.904 213 L HN 0.216 8.446 8.230 -0.000 0.000 0.435 214 A N 0.141 122.928 122.820 -0.054 0.000 1.933 214 A HA -0.154 4.167 4.320 0.001 0.000 0.218 214 A C 2.256 179.681 177.584 -0.265 0.000 1.175 214 A CA 1.337 53.278 52.037 -0.162 0.000 0.628 214 A CB -0.624 18.261 19.000 -0.192 0.000 0.814 214 A HN 0.337 8.487 8.150 -0.000 0.000 0.444 215 L N -0.855 120.127 121.223 -0.401 0.000 2.046 215 L HA -0.251 4.090 4.340 0.001 0.000 0.208 215 L C 2.751 179.547 176.870 -0.123 0.000 1.077 215 L CA 1.345 55.834 54.840 -0.585 0.000 0.747 215 L CB -0.638 40.569 42.059 -1.419 0.000 0.896 215 L HN 0.496 8.726 8.230 -0.000 0.000 0.432 216 C N -0.160 119.180 119.300 0.066 0.000 2.413 216 C HA -0.131 4.330 4.460 0.001 0.000 0.276 216 C C 2.920 178.015 174.990 0.175 0.000 1.236 216 C CA 0.856 60.060 59.018 0.310 0.000 1.735 216 C CB -1.647 26.319 27.740 0.375 0.000 2.031 216 C HN 0.718 8.948 8.230 -0.000 0.000 0.474 217 G N 0.423 109.182 108.800 -0.069 0.000 2.476 217 G HA2 -0.138 3.823 3.960 0.001 0.000 0.218 217 G HA3 -0.138 3.823 3.960 0.001 0.000 0.218 217 G C 1.854 176.596 174.900 -0.262 0.000 1.164 217 G CA 1.196 45.953 45.100 -0.570 0.000 0.768 217 G HN 0.648 8.938 8.290 -0.000 0.000 0.560 218 A N -0.240 122.470 122.820 -0.182 0.000 2.015 218 A HA 0.080 4.400 4.320 0.001 0.000 0.219 218 A C 2.496 180.068 177.584 -0.019 0.000 1.163 218 A CA 2.266 54.230 52.037 -0.121 0.000 0.646 218 A CB -0.588 18.309 19.000 -0.170 0.000 0.806 218 A HN 0.308 8.458 8.150 -0.000 0.000 0.448 219 T N 0.267 114.858 114.554 0.062 0.000 2.812 219 T HA 0.001 4.351 4.350 0.001 0.000 0.264 219 T C 1.807 176.570 174.700 0.106 0.000 1.042 219 T CA 1.269 63.444 62.100 0.124 0.000 1.140 219 T CB -0.290 68.722 68.868 0.239 0.000 0.870 219 T HN 0.365 8.605 8.240 -0.000 0.000 0.445 220 L N 0.792 122.099 121.223 0.140 0.000 2.027 220 L HA -0.029 4.311 4.340 0.001 0.000 0.206 220 L C 3.059 180.093 176.870 0.274 0.000 1.074 220 L CA 1.196 56.185 54.840 0.248 0.000 0.745 220 L CB -0.656 41.576 42.059 0.289 0.000 0.898 220 L HN 0.227 8.457 8.230 -0.000 0.000 0.433 221 A N -0.483 122.410 122.820 0.121 0.000 1.902 221 A HA -0.199 4.121 4.320 0.001 0.000 0.217 221 A C 2.364 179.985 177.584 0.062 0.000 1.181 221 A CA 2.329 54.416 52.037 0.084 0.000 0.623 221 A CB -0.915 18.077 19.000 -0.013 0.000 0.818 221 A HN 0.377 8.527 8.150 -0.000 0.000 0.443 222 T N -1.604 112.972 114.554 0.037 0.000 2.708 222 T HA -0.172 4.178 4.350 0.001 0.000 0.266 222 T C 1.805 176.474 174.700 -0.051 0.000 1.037 222 T CA 1.757 63.857 62.100 0.001 0.000 1.146 222 T CB -0.422 68.444 68.868 -0.004 0.000 0.865 222 T HN 0.581 8.821 8.240 -0.000 0.000 0.435 223 Y N 0.944 121.154 120.300 -0.150 0.000 2.114 223 Y HA -0.102 4.448 4.550 0.001 0.000 0.284 223 Y C 1.846 177.541 175.900 -0.342 0.000 1.143 223 Y CA 1.148 59.059 58.100 -0.316 0.000 1.135 223 Y CB -0.566 37.570 38.460 -0.540 0.000 0.980 223 Y HN 0.169 8.449 8.280 -0.000 0.000 0.499 224 F N -0.243 119.635 119.950 -0.120 0.000 2.186 224 F HA -0.152 4.376 4.527 0.001 0.000 0.299 224 F C 2.173 177.781 175.800 -0.321 0.000 1.090 224 F CA 1.236 59.115 58.000 -0.201 0.000 1.307 224 F CB -0.747 38.239 39.000 -0.025 0.000 1.019 224 F HN 0.034 8.334 8.300 -0.000 0.000 0.489 225 L N -1.557 119.568 121.223 -0.162 0.000 2.109 225 L HA -0.161 4.180 4.340 0.001 0.000 0.207 225 L C 2.626 179.220 176.870 -0.460 0.000 1.086 225 L CA 1.115 55.704 54.840 -0.418 0.000 0.760 225 L CB -0.823 41.074 42.059 -0.271 0.000 0.910 225 L HN 0.103 8.333 8.230 -0.000 0.000 0.437 226 S N 0.009 115.562 115.700 -0.246 0.000 2.359 226 S HA -0.212 4.258 4.470 0.001 0.000 0.224 226 S C 2.161 176.681 174.600 -0.133 0.000 1.035 226 S CA 1.422 59.563 58.200 -0.098 0.000 1.018 226 S CB -0.109 63.018 63.200 -0.122 0.000 0.876 226 S HN 0.449 8.759 8.310 -0.000 0.000 0.448 227 A N 0.989 123.581 122.820 -0.379 0.000 1.933 227 A HA -0.015 4.305 4.320 0.001 0.000 0.218 227 A C 2.119 179.601 177.584 -0.171 0.000 1.175 227 A CA 1.594 53.446 52.037 -0.309 0.000 0.628 227 A CB -0.765 17.939 19.000 -0.494 0.000 0.814 227 A HN 0.547 8.697 8.150 -0.000 0.000 0.444 228 L N -1.513 119.555 121.223 -0.259 0.000 2.005 228 L HA -0.035 4.305 4.340 0.001 0.000 0.207 228 L C 1.970 178.752 176.870 -0.147 0.000 1.072 228 L CA 1.986 56.674 54.840 -0.253 0.000 0.744 228 L CB -0.668 41.112 42.059 -0.465 0.000 0.895 228 L HN 0.338 8.568 8.230 -0.000 0.000 0.433 229 F N -1.104 118.771 119.950 -0.126 0.000 2.661 229 F HA 0.009 4.537 4.527 0.001 0.000 0.298 229 F C 1.636 177.217 175.800 -0.365 0.000 1.137 229 F CA 0.491 58.352 58.000 -0.232 0.000 1.454 229 F CB -0.595 38.165 39.000 -0.400 0.000 1.103 229 F HN 0.240 8.540 8.300 -0.000 0.000 0.577 230 H N 0.238 119.356 119.070 0.080 0.000 2.472 230 H HA 0.220 4.776 4.556 0.001 0.000 0.287 230 H C 0.158 175.487 175.328 0.002 0.000 1.112 230 H CA -0.298 55.761 56.048 0.018 0.000 1.021 230 H CB -0.116 29.628 29.762 -0.032 0.000 1.635 230 H HN 0.138 8.418 8.280 -0.000 0.000 0.559 231 K N 0.240 120.692 120.400 0.086 0.000 3.096 231 K HA -0.239 4.081 4.320 0.001 0.000 0.266 231 K C 1.014 177.637 176.600 0.038 0.000 1.043 231 K CA 0.559 56.880 56.287 0.057 0.000 0.758 231 K CB -1.659 30.879 32.500 0.063 0.000 1.260 231 K HN 0.738 8.988 8.250 -0.000 0.000 0.481 232 G N -0.596 108.215 108.800 0.017 0.000 2.213 232 G HA2 -0.298 3.662 3.960 0.001 0.000 0.226 232 G HA3 -0.298 3.662 3.960 0.001 0.000 0.226 232 G C -0.093 174.803 174.900 -0.006 0.000 0.992 232 G CA 0.349 45.452 45.100 0.005 0.000 0.632 232 G HN 0.264 8.554 8.290 -0.000 0.000 0.511 233 K N 0.893 121.294 120.400 0.001 0.000 2.164 233 K HA 0.740 5.061 4.320 0.001 0.000 0.258 233 K C 0.471 177.034 176.600 -0.062 0.000 0.951 233 K CA 0.007 56.280 56.287 -0.024 0.000 0.844 233 K CB 1.979 34.467 32.500 -0.021 0.000 1.099 233 K HN 0.423 8.673 8.250 -0.000 0.000 0.435 234 A N 1.344 124.095 122.820 -0.115 0.000 2.272 234 A HA 0.318 4.639 4.320 0.001 0.000 0.275 234 A C -0.217 177.248 177.584 -0.198 0.000 1.096 234 A CA -0.322 51.613 52.037 -0.169 0.000 0.822 234 A CB 1.002 19.898 19.000 -0.174 0.000 1.088 234 A HN 0.562 8.712 8.150 -0.000 0.000 0.495 235 S N -0.325 115.234 115.700 -0.236 0.000 2.451 235 S HA 0.392 4.863 4.470 0.001 0.000 0.301 235 S C 0.671 175.146 174.600 -0.208 0.000 1.116 235 S CA -0.596 57.425 58.200 -0.299 0.000 1.093 235 S CB 0.622 63.585 63.200 -0.394 0.000 1.017 235 S HN 0.680 8.990 8.310 -0.000 0.000 0.482 236 I N 6.052 126.516 120.570 -0.176 0.000 2.546 236 I HA 0.009 4.179 4.170 0.001 0.000 0.255 236 I C 1.857 177.852 176.117 -0.203 0.000 1.163 236 I CA 1.187 62.400 61.300 -0.145 0.000 1.457 236 I CB -0.209 37.733 38.000 -0.097 0.000 1.092 236 I HN 0.636 8.846 8.210 -0.000 0.000 0.434 237 V N 0.668 120.423 119.914 -0.265 0.000 2.343 237 V HA -0.293 3.827 4.120 0.001 0.000 0.247 237 V C 2.204 177.939 176.094 -0.597 0.000 1.051 237 V CA 2.103 64.152 62.300 -0.419 0.000 1.036 237 V CB -0.914 30.656 31.823 -0.422 0.000 0.654 237 V HN 0.357 8.547 8.190 -0.000 0.000 0.451 238 D N -0.562 119.513 120.400 -0.541 0.000 2.092 238 D HA -0.201 4.440 4.640 0.001 0.000 0.193 238 D C 2.026 178.104 176.300 -0.369 0.000 0.994 238 D CA 1.452 55.110 54.000 -0.571 0.000 0.828 238 D CB -0.326 40.314 40.800 -0.268 0.000 0.963 238 D HN 0.298 8.668 8.370 -0.000 0.000 0.450 239 M N 0.835 120.294 119.600 -0.235 0.000 2.108 239 M HA -0.108 4.372 4.480 0.001 0.000 0.261 239 M C 1.898 178.116 176.300 -0.136 0.000 1.066 239 M CA 1.436 56.653 55.300 -0.139 0.000 1.107 239 M CB -0.472 32.073 32.600 -0.091 0.000 1.356 239 M HN 0.020 8.310 8.290 -0.000 0.000 0.406 240 A N -0.545 122.172 122.820 -0.172 0.000 1.968 240 A HA -0.104 4.217 4.320 0.001 0.000 0.217 240 A C 1.994 179.521 177.584 -0.095 0.000 1.169 240 A CA 1.795 53.764 52.037 -0.114 0.000 0.638 240 A CB -0.620 18.311 19.000 -0.115 0.000 0.812 240 A HN 0.666 8.816 8.150 -0.000 0.000 0.446 241 N N -0.535 118.062 118.700 -0.171 0.000 2.511 241 N HA 0.073 4.813 4.740 0.001 0.000 0.190 241 N C 1.948 177.438 175.510 -0.033 0.000 1.037 241 N CA 1.019 54.023 53.050 -0.076 0.000 0.895 241 N CB -0.185 38.290 38.487 -0.021 0.000 1.149 241 N HN 0.381 8.761 8.380 -0.000 0.000 0.437 242 A N 1.484 124.263 122.820 -0.068 0.000 2.014 242 A HA 0.161 4.482 4.320 0.001 0.000 0.218 242 A C 2.304 179.860 177.584 -0.047 0.000 1.163 242 A CA 1.373 53.412 52.037 0.003 0.000 0.652 242 A CB -0.500 18.520 19.000 0.034 0.000 0.808 242 A HN 0.297 8.447 8.150 -0.000 0.000 0.449 243 A N 0.101 122.902 122.820 -0.032 0.000 1.986 243 A HA -0.121 4.200 4.320 0.001 0.000 0.220 243 A C 1.978 179.518 177.584 -0.072 0.000 1.171 243 A CA 1.586 53.638 52.037 0.025 0.000 0.640 243 A CB -0.587 18.496 19.000 0.139 0.000 0.811 243 A HN 0.503 8.653 8.150 -0.000 0.000 0.451 244 L N -1.003 120.136 121.223 -0.141 0.000 2.478 244 L HA -0.028 4.312 4.340 0.001 0.000 0.223 244 L C 2.779 179.295 176.870 -0.590 0.000 1.140 244 L CA 0.433 55.031 54.840 -0.403 0.000 0.842 244 L CB -0.419 41.492 42.059 -0.248 0.000 0.953 244 L HN 0.421 8.651 8.230 -0.000 0.000 0.452 245 A N 0.656 123.261 122.820 -0.358 0.000 2.019 245 A HA -0.112 4.209 4.320 0.001 0.000 0.219 245 A C 2.393 179.756 177.584 -0.368 0.000 1.164 245 A CA 1.559 53.402 52.037 -0.323 0.000 0.644 245 A CB -0.889 18.009 19.000 -0.171 0.000 0.805 245 A HN 0.434 8.584 8.150 -0.000 0.000 0.449 246 G N -0.492 108.061 108.800 -0.411 0.000 2.408 246 G HA2 0.044 4.004 3.960 0.001 0.000 0.217 246 G HA3 0.044 4.004 3.960 0.001 0.000 0.217 246 G C 1.470 176.056 174.900 -0.523 0.000 1.150 246 G CA 1.168 46.028 45.100 -0.399 0.000 0.776 246 G HN 0.649 8.939 8.290 -0.000 0.000 0.542 247 G N 0.436 108.688 108.800 -0.913 0.000 2.402 247 G HA2 -0.115 3.846 3.960 0.001 0.000 0.216 247 G HA3 -0.115 3.846 3.960 0.001 0.000 0.216 247 G C 1.772 176.334 174.900 -0.563 0.000 1.162 247 G CA 1.167 45.492 45.100 -1.293 0.000 0.777 247 G HN 0.299 8.589 8.290 -0.000 0.000 0.539 248 V N 1.557 121.142 119.914 -0.548 0.000 2.295 248 V HA -0.117 4.003 4.120 0.001 0.000 0.246 248 V C 3.309 179.346 176.094 -0.095 0.000 1.049 248 V CA 2.081 64.217 62.300 -0.274 0.000 1.024 248 V CB -0.825 30.780 31.823 -0.363 0.000 0.648 248 V HN 0.457 8.647 8.190 -0.000 0.000 0.447 249 A N -0.616 122.116 122.820 -0.146 0.000 2.015 249 A HA -0.114 4.206 4.320 0.001 0.000 0.219 249 A C 2.046 179.606 177.584 -0.040 0.000 1.163 249 A CA 1.523 53.517 52.037 -0.071 0.000 0.646 249 A CB -0.452 18.491 19.000 -0.095 0.000 0.806 249 A HN 0.449 8.599 8.150 -0.000 0.000 0.448 250 I N 0.090 120.622 120.570 -0.064 0.000 3.428 250 I HA 0.088 4.258 4.170 0.001 0.000 0.286 250 I C 2.090 178.228 176.117 0.035 0.000 1.287 250 I CA 0.437 61.719 61.300 -0.031 0.000 1.396 250 I CB -0.581 37.377 38.000 -0.070 0.000 1.062 250 I HN 0.196 8.406 8.210 -0.000 0.000 0.471 251 G N -0.289 108.570 108.800 0.098 0.000 2.476 251 G HA2 -0.284 3.677 3.960 0.001 0.000 0.218 251 G HA3 -0.284 3.677 3.960 0.001 0.000 0.218 251 G C 1.717 176.667 174.900 0.082 0.000 1.164 251 G CA 1.060 46.259 45.100 0.165 0.000 0.768 251 G HN 0.438 8.728 8.290 -0.000 0.000 0.560 252 S N -0.432 115.292 115.700 0.040 0.000 2.382 252 S HA -0.086 4.384 4.470 0.001 0.000 0.228 252 S C 2.085 176.666 174.600 -0.031 0.000 1.027 252 S CA 1.481 59.666 58.200 -0.024 0.000 0.991 252 S CB -0.105 63.049 63.200 -0.077 0.000 0.823 252 S HN 0.677 8.987 8.310 -0.000 0.000 0.469 253 V N -0.273 119.633 119.914 -0.013 0.000 3.085 253 V HA 0.218 4.338 4.120 0.001 0.000 0.345 253 V C 1.484 177.579 176.094 0.002 0.000 1.397 253 V CA -0.109 62.184 62.300 -0.012 0.000 1.165 253 V CB -1.136 30.679 31.823 -0.014 0.000 1.153 253 V HN 0.653 8.843 8.190 -0.000 0.000 0.495 254 C N 0.861 120.169 119.300 0.013 0.000 2.422 254 C HA -0.053 4.407 4.460 0.001 0.000 0.279 254 C C 2.432 177.428 174.990 0.011 0.000 1.305 254 C CA 1.134 60.162 59.018 0.017 0.000 1.757 254 C CB -1.642 26.121 27.740 0.039 0.000 1.962 254 C HN 0.794 9.024 8.230 -0.000 0.000 0.499 255 N N 2.553 121.259 118.700 0.009 0.000 2.412 255 N HA -0.002 4.739 4.740 0.001 0.000 0.184 255 N C 1.308 176.822 175.510 0.006 0.000 1.101 255 N CA 1.342 54.396 53.050 0.006 0.000 0.881 255 N CB -0.559 37.933 38.487 0.008 0.000 0.969 255 N HN 0.834 9.214 8.380 -0.000 0.000 0.459 256 I N -2.570 118.003 120.570 0.005 0.000 4.312 256 I HA 0.245 4.415 4.170 0.001 0.000 0.324 256 I C 0.366 176.486 176.117 0.006 0.000 1.298 256 I CA -0.430 60.874 61.300 0.005 0.000 1.231 256 I CB 0.154 38.156 38.000 0.003 0.000 1.152 256 I HN -0.148 8.062 8.210 -0.000 0.000 0.421 257 V N 1.148 121.066 119.914 0.007 0.000 3.264 257 V HA 0.746 4.866 4.120 0.001 0.000 0.304 257 V C 0.951 177.053 176.094 0.012 0.000 1.086 257 V CA -0.105 62.201 62.300 0.010 0.000 1.090 257 V CB 0.238 32.067 31.823 0.011 0.000 1.112 257 V HN 0.185 8.375 8.190 -0.000 0.000 0.472 258 G N 0.337 109.147 108.800 0.015 0.000 2.547 258 G HA2 0.518 4.478 3.960 0.001 0.000 0.291 258 G HA3 0.518 4.478 3.960 0.001 0.000 0.291 258 G C -1.382 173.532 174.900 0.024 0.000 1.211 258 G CA -0.785 44.325 45.100 0.016 0.000 0.950 258 G HN 0.670 8.960 8.290 -0.000 0.000 0.504 259 P HA -0.088 4.332 4.420 -0.000 0.000 0.217 259 P C 1.889 179.224 177.300 0.059 0.000 1.150 259 P CA 0.677 63.794 63.100 0.030 0.000 0.832 259 P CB 0.138 31.842 31.700 0.007 0.000 0.787 260 V N 0.500 120.442 119.914 0.048 0.000 2.453 260 V HA -0.088 4.032 4.120 0.001 0.000 0.247 260 V C 2.876 179.042 176.094 0.119 0.000 1.048 260 V CA 2.251 64.601 62.300 0.083 0.000 1.049 260 V CB -1.843 30.008 31.823 0.047 0.000 0.672 260 V HN 0.157 8.347 8.190 -0.000 0.000 0.457 261 G N -0.072 108.770 108.800 0.071 0.000 2.440 261 G HA2 -0.242 3.718 3.960 0.001 0.000 0.218 261 G HA3 -0.242 3.718 3.960 0.001 0.000 0.218 261 G C 1.793 176.725 174.900 0.053 0.000 1.154 261 G CA 1.136 46.269 45.100 0.054 0.000 0.767 261 G HN 0.588 8.878 8.290 -0.000 0.000 0.552 262 A N 0.525 123.380 122.820 0.058 0.000 1.865 262 A HA -0.026 4.294 4.320 0.001 0.000 0.217 262 A C 2.204 179.824 177.584 0.060 0.000 1.191 262 A CA 1.778 53.840 52.037 0.042 0.000 0.623 262 A CB -0.689 18.335 19.000 0.041 0.000 0.826 262 A HN 0.418 8.568 8.150 -0.000 0.000 0.444 263 F N 0.744 120.676 119.950 -0.030 0.000 2.095 263 F HA -0.178 4.350 4.527 0.001 0.000 0.298 263 F C 2.275 178.062 175.800 -0.022 0.000 1.104 263 F CA 2.029 60.014 58.000 -0.026 0.000 1.232 263 F CB -0.361 38.631 39.000 -0.012 0.000 0.987 263 F HN 0.030 8.330 8.300 -0.000 0.000 0.475 264 V N 0.599 120.526 119.914 0.022 0.000 2.358 264 V HA -0.299 3.821 4.120 0.001 0.000 0.246 264 V C 2.435 178.463 176.094 -0.110 0.000 1.047 264 V CA 2.029 64.286 62.300 -0.071 0.000 1.035 264 V CB -0.643 31.198 31.823 0.030 0.000 0.658 264 V HN 0.358 8.548 8.190 -0.000 0.000 0.452 265 I N 0.859 121.387 120.570 -0.070 0.000 2.208 265 I HA -0.219 3.952 4.170 0.001 0.000 0.245 265 I C 2.603 178.642 176.117 -0.129 0.000 1.097 265 I CA 1.799 63.054 61.300 -0.074 0.000 1.363 265 I CB -0.930 37.042 38.000 -0.048 0.000 1.051 265 I HN 0.403 8.613 8.210 -0.000 0.000 0.413 266 G N 1.030 109.718 108.800 -0.187 0.000 2.491 266 G HA2 -0.239 3.721 3.960 0.001 0.000 0.218 266 G HA3 -0.239 3.721 3.960 0.001 0.000 0.218 266 G C 1.679 176.426 174.900 -0.256 0.000 1.180 266 G CA 0.758 45.710 45.100 -0.247 0.000 0.774 266 G HN 0.295 8.585 8.290 -0.000 0.000 0.562 267 L N -0.050 120.971 121.223 -0.336 0.000 2.043 267 L HA -0.091 4.249 4.340 0.001 0.000 0.212 267 L C 2.948 179.737 176.870 -0.136 0.000 1.075 267 L CA 0.771 55.453 54.840 -0.263 0.000 0.752 267 L CB -0.412 41.476 42.059 -0.284 0.000 0.891 267 L HN 0.200 8.430 8.230 -0.000 0.000 0.432 268 L N -0.829 120.326 121.223 -0.113 0.000 2.093 268 L HA -0.096 4.244 4.340 0.001 0.000 0.208 268 L C 2.686 179.527 176.870 -0.048 0.000 1.085 268 L CA 1.253 56.059 54.840 -0.057 0.000 0.755 268 L CB -1.161 40.874 42.059 -0.040 0.000 0.904 268 L HN 0.326 8.556 8.230 -0.000 0.000 0.435 269 G N -0.098 108.654 108.800 -0.081 0.000 2.418 269 G HA2 -0.177 3.783 3.960 0.001 0.000 0.217 269 G HA3 -0.177 3.783 3.960 0.001 0.000 0.217 269 G C 1.595 176.453 174.900 -0.070 0.000 1.158 269 G CA 0.719 45.769 45.100 -0.083 0.000 0.771 269 G HN 0.463 8.753 8.290 -0.000 0.000 0.545 270 G N 1.246 109.997 108.800 -0.082 0.000 2.446 270 G HA2 -0.017 3.944 3.960 0.001 0.000 0.217 270 G HA3 -0.017 3.944 3.960 0.001 0.000 0.217 270 G C 2.082 176.990 174.900 0.013 0.000 1.168 270 G CA 1.733 46.806 45.100 -0.045 0.000 0.771 270 G HN 0.661 8.951 8.290 -0.000 0.000 0.551 271 A N 0.789 123.618 122.820 0.014 0.000 1.865 271 A HA -0.011 4.309 4.320 0.001 0.000 0.217 271 A C 2.432 180.078 177.584 0.104 0.000 1.191 271 A CA 1.533 53.611 52.037 0.069 0.000 0.623 271 A CB -0.440 18.588 19.000 0.047 0.000 0.826 271 A HN 0.381 8.531 8.150 -0.000 0.000 0.444 272 I N -0.779 119.825 120.570 0.057 0.000 2.286 272 I HA -0.204 3.967 4.170 0.001 0.000 0.248 272 I C 2.811 178.958 176.117 0.050 0.000 1.115 272 I CA 1.451 62.781 61.300 0.051 0.000 1.392 272 I CB -0.171 37.839 38.000 0.017 0.000 1.065 272 I HN 0.395 8.605 8.210 -0.000 0.000 0.418 273 S N 0.211 115.941 115.700 0.049 0.000 2.368 273 S HA -0.113 4.358 4.470 0.001 0.000 0.224 273 S C 2.103 176.842 174.600 0.231 0.000 1.029 273 S CA 1.167 59.414 58.200 0.079 0.000 0.988 273 S CB -0.150 63.096 63.200 0.078 0.000 0.838 273 S HN 0.216 8.526 8.310 -0.000 0.000 0.462 274 V N 1.599 121.648 119.914 0.225 0.000 2.343 274 V HA -0.116 4.005 4.120 0.001 0.000 0.247 274 V C 2.458 178.699 176.094 0.245 0.000 1.051 274 V CA 1.713 64.179 62.300 0.275 0.000 1.036 274 V CB -0.716 31.250 31.823 0.239 0.000 0.654 274 V HN 0.410 8.600 8.190 -0.000 0.000 0.451 275 V N 1.052 121.110 119.914 0.240 0.000 2.380 275 V HA -0.247 3.874 4.120 0.001 0.000 0.251 275 V C 2.613 178.787 176.094 0.132 0.000 1.063 275 V CA 2.212 64.639 62.300 0.212 0.000 1.055 275 V CB -1.522 30.427 31.823 0.210 0.000 0.657 275 V HN 0.624 8.814 8.190 -0.000 0.000 0.455 276 G N -0.729 108.113 108.800 0.070 0.000 2.459 276 G HA2 -0.264 3.697 3.960 0.001 0.000 0.217 276 G HA3 -0.264 3.697 3.960 0.001 0.000 0.217 276 G C 1.468 176.324 174.900 -0.073 0.000 1.183 276 G CA 1.025 46.099 45.100 -0.042 0.000 0.776 276 G HN 0.461 8.751 8.290 -0.000 0.000 0.552 277 F N 0.240 120.172 119.950 -0.030 0.000 2.146 277 F HA -0.003 4.525 4.527 0.001 0.000 0.298 277 F C 2.856 178.586 175.800 -0.117 0.000 1.096 277 F CA 0.830 58.802 58.000 -0.047 0.000 1.275 277 F CB -0.324 38.651 39.000 -0.041 0.000 1.008 277 F HN -0.016 8.284 8.300 -0.000 0.000 0.480 278 V N -1.371 118.503 119.914 -0.067 0.000 2.346 278 V HA -0.209 3.911 4.120 0.001 0.000 0.244 278 V C 1.691 177.405 176.094 -0.633 0.000 1.037 278 V CA 1.751 63.754 62.300 -0.496 0.000 1.029 278 V CB -0.447 30.766 31.823 -1.015 0.000 0.663 278 V HN 0.175 8.365 8.190 -0.000 0.000 0.454 279 F N -1.475 118.417 119.950 -0.097 0.000 2.537 279 F HA 0.337 4.864 4.527 0.001 0.000 0.277 279 F C 1.911 177.683 175.800 -0.047 0.000 1.013 279 F CA 0.216 58.154 58.000 -0.105 0.000 1.332 279 F CB -0.346 38.548 39.000 -0.175 0.000 1.108 279 F HN -0.060 8.240 8.300 -0.000 0.000 0.679 280 I N -0.013 120.642 120.570 0.142 0.000 2.277 280 I HA -0.206 3.964 4.170 0.001 0.000 0.243 280 I C 2.518 178.682 176.117 0.077 0.000 1.094 280 I CA 1.161 62.526 61.300 0.108 0.000 1.393 280 I CB -0.488 37.581 38.000 0.115 0.000 1.078 280 I HN 0.189 8.399 8.210 -0.000 0.000 0.417 281 Q N 1.573 121.396 119.800 0.037 0.000 2.061 281 Q HA -0.186 4.154 4.340 0.001 0.000 0.204 281 Q C -0.660 175.359 176.000 0.031 0.000 0.984 281 Q CA 2.157 57.971 55.803 0.019 0.000 0.846 281 Q CB -0.788 27.923 28.738 -0.045 0.000 0.902 281 Q HN 0.292 8.562 8.270 -0.000 0.000 0.421 282 P HA -0.194 4.226 4.420 -0.000 0.000 0.218 282 P C 1.452 178.776 177.300 0.040 0.000 1.149 282 P CA 1.253 64.376 63.100 0.038 0.000 0.817 282 P CB -0.339 31.381 31.700 0.033 0.000 0.785 283 M N -0.503 119.127 119.600 0.049 0.000 2.086 283 M HA -0.138 4.342 4.480 0.001 0.000 0.261 283 M C 2.035 178.353 176.300 0.030 0.000 1.067 283 M CA 1.814 57.140 55.300 0.043 0.000 1.116 283 M CB -0.823 31.808 32.600 0.053 0.000 1.348 283 M HN -0.124 8.166 8.290 -0.000 0.000 0.407 284 L N -0.117 121.122 121.223 0.028 0.000 2.131 284 L HA -0.227 4.114 4.340 0.001 0.000 0.210 284 L C 2.427 179.303 176.870 0.010 0.000 1.092 284 L CA 1.545 56.391 54.840 0.010 0.000 0.759 284 L CB -0.639 41.414 42.059 -0.010 0.000 0.903 284 L HN 0.459 8.689 8.230 -0.000 0.000 0.435 285 E N -0.155 120.057 120.200 0.020 0.000 2.046 285 E HA -0.182 4.168 4.350 0.001 0.000 0.190 285 E C 2.269 178.882 176.600 0.023 0.000 0.982 285 E CA 1.401 57.815 56.400 0.024 0.000 0.800 285 E CB 0.155 29.875 29.700 0.033 0.000 0.756 285 E HN 0.503 8.863 8.360 -0.000 0.000 0.449 286 S N 0.360 116.074 115.700 0.024 0.000 2.336 286 S HA -0.045 4.426 4.470 0.001 0.000 0.216 286 S C 1.907 176.517 174.600 0.017 0.000 1.032 286 S CA 0.681 58.894 58.200 0.022 0.000 0.973 286 S CB -0.224 62.990 63.200 0.024 0.000 0.888 286 S HN 0.111 8.421 8.310 -0.000 0.000 0.455 287 K N 1.441 121.850 120.400 0.016 0.000 2.167 287 K HA 0.276 4.597 4.320 0.001 0.000 0.203 287 K C 1.747 178.351 176.600 0.007 0.000 1.052 287 K CA 0.935 57.229 56.287 0.012 0.000 0.956 287 K CB -0.138 32.370 32.500 0.013 0.000 0.735 287 K HN 0.501 8.751 8.250 -0.000 0.000 0.451 288 A N 0.549 123.373 122.820 0.006 0.000 2.469 288 A HA 0.130 4.450 4.320 0.001 0.000 0.245 288 A C -0.165 177.418 177.584 -0.000 0.000 1.221 288 A CA -0.245 51.792 52.037 0.000 0.000 0.946 288 A CB 0.168 19.165 19.000 -0.005 0.000 1.049 288 A HN 0.155 8.305 8.150 -0.000 0.000 0.529 289 K N 0.334 120.737 120.400 0.005 0.000 3.035 289 K HA -0.140 4.181 4.320 0.001 0.000 0.262 289 K C -0.742 175.861 176.600 0.006 0.000 1.024 289 K CA 1.178 57.469 56.287 0.008 0.000 0.748 289 K CB -2.356 30.146 32.500 0.005 0.000 1.247 289 K HN 0.426 8.676 8.250 -0.000 0.000 0.482 290 T N 1.821 116.377 114.554 0.004 0.000 2.874 290 T HA 0.383 4.733 4.350 0.001 0.000 0.321 290 T C 0.141 174.847 174.700 0.011 0.000 1.075 290 T CA -0.694 61.404 62.100 -0.003 0.000 0.966 290 T CB 0.632 69.485 68.868 -0.024 0.000 1.001 290 T HN 0.052 8.292 8.240 -0.000 0.000 0.476 291 I N 3.203 123.790 120.570 0.029 0.000 2.396 291 I HA 0.416 4.586 4.170 0.001 0.000 0.292 291 I C 0.339 176.495 176.117 0.065 0.000 0.999 291 I CA -0.876 60.459 61.300 0.058 0.000 1.310 291 I CB 1.212 39.264 38.000 0.087 0.000 1.404 291 I HN 0.550 8.760 8.210 -0.000 0.000 0.496 292 D N 3.986 124.434 120.400 0.080 0.000 2.363 292 D HA 0.208 4.848 4.640 0.001 0.000 0.258 292 D C 0.820 177.205 176.300 0.141 0.000 1.259 292 D CA -0.275 53.778 54.000 0.090 0.000 0.921 292 D CB 0.951 41.778 40.800 0.045 0.000 1.201 292 D HN 0.485 8.855 8.370 -0.000 0.000 0.524 293 T N 0.942 115.613 114.554 0.194 0.000 2.653 293 T HA -0.166 4.184 4.350 0.001 0.000 0.268 293 T C 1.508 176.421 174.700 0.354 0.000 1.035 293 T CA 1.353 63.608 62.100 0.258 0.000 1.154 293 T CB -0.024 69.019 68.868 0.292 0.000 0.862 293 T HN 0.560 8.800 8.240 -0.000 0.000 0.441 294 C N 0.713 120.203 119.300 0.318 0.000 3.000 294 C HA 0.594 5.054 4.460 0.001 0.000 0.286 294 C C 1.804 176.927 174.990 0.222 0.000 1.343 294 C CA -0.778 58.423 59.018 0.305 0.000 1.742 294 C CB -0.914 27.035 27.740 0.348 0.000 2.200 294 C HN 0.829 9.059 8.230 -0.000 0.000 0.621 295 G N 1.866 110.739 108.800 0.121 0.000 2.273 295 G HA2 -0.261 3.699 3.960 0.001 0.000 0.280 295 G HA3 -0.261 3.699 3.960 0.001 0.000 0.280 295 G C 0.715 175.554 174.900 -0.102 0.000 1.047 295 G CA 0.805 45.823 45.100 -0.137 0.000 0.869 295 G HN 1.012 9.302 8.290 -0.000 0.000 0.502 296 V N -3.235 116.734 119.914 0.092 0.000 2.594 296 V HA -0.148 3.972 4.120 0.001 0.000 0.253 296 V C 2.091 178.243 176.094 0.096 0.000 1.069 296 V CA 2.508 64.936 62.300 0.213 0.000 1.082 296 V CB -0.571 31.424 31.823 0.287 0.000 0.680 296 V HN 0.663 8.853 8.190 -0.000 0.000 0.469 297 H N 1.217 120.220 119.070 -0.111 0.000 2.423 297 H HA -0.101 4.455 4.556 0.001 0.000 0.297 297 H C 1.924 177.154 175.328 -0.164 0.000 1.075 297 H CA 1.760 57.699 56.048 -0.181 0.000 1.342 297 H CB 0.242 29.900 29.762 -0.173 0.000 1.395 297 H HN 0.505 8.785 8.280 -0.000 0.000 0.530 298 N N 0.528 119.020 118.700 -0.348 0.000 2.333 298 N HA -0.088 4.653 4.740 0.001 0.000 0.178 298 N C 2.042 177.396 175.510 -0.261 0.000 1.018 298 N CA 0.355 53.141 53.050 -0.440 0.000 0.882 298 N CB 0.019 37.968 38.487 -0.897 0.000 0.984 298 N HN 0.308 8.688 8.380 -0.000 0.000 0.434 299 L N 0.719 121.821 121.223 -0.202 0.000 2.121 299 L HA 0.090 4.430 4.340 0.001 0.000 0.200 299 L C 1.985 178.689 176.870 -0.277 0.000 1.077 299 L CA 1.723 56.435 54.840 -0.214 0.000 0.766 299 L CB -0.679 41.213 42.059 -0.278 0.000 0.931 299 L HN 0.103 8.333 8.230 -0.000 0.000 0.452 300 H N -1.056 118.039 119.070 0.041 0.000 2.418 300 H HA 0.242 4.799 4.556 0.001 0.000 0.300 300 H C 1.889 177.266 175.328 0.081 0.000 1.041 300 H CA 0.902 57.021 56.048 0.117 0.000 1.364 300 H CB -0.469 29.443 29.762 0.250 0.000 1.439 300 H HN 0.444 8.724 8.280 -0.000 0.000 0.540 301 G N 1.569 110.412 108.800 0.071 0.000 2.575 301 G HA2 -0.174 3.786 3.960 0.001 0.000 0.215 301 G HA3 -0.174 3.786 3.960 0.001 0.000 0.215 301 G C 1.825 176.762 174.900 0.061 0.000 1.262 301 G CA 0.701 45.785 45.100 -0.026 0.000 0.807 301 G HN 0.184 8.474 8.290 -0.000 0.000 0.567 302 L N 1.088 122.224 121.223 -0.146 0.000 2.027 302 L HA -0.023 4.318 4.340 0.001 0.000 0.206 302 L C 0.020 176.905 176.870 0.026 0.000 1.074 302 L CA 0.985 55.795 54.840 -0.050 0.000 0.745 302 L CB -1.224 40.726 42.059 -0.181 0.000 0.898 302 L HN 0.218 8.448 8.230 -0.000 0.000 0.433 303 P HA -0.105 4.315 4.420 -0.000 0.000 0.220 303 P C 1.578 178.905 177.300 0.044 0.000 1.148 303 P CA 1.498 64.594 63.100 -0.008 0.000 0.803 303 P CB -0.148 31.505 31.700 -0.078 0.000 0.782 304 G N 0.183 109.046 108.800 0.105 0.000 2.433 304 G HA2 -0.225 3.735 3.960 0.001 0.000 0.216 304 G HA3 -0.225 3.735 3.960 0.001 0.000 0.216 304 G C 1.481 176.454 174.900 0.123 0.000 1.186 304 G CA 0.515 45.721 45.100 0.177 0.000 0.779 304 G HN 0.212 8.502 8.290 -0.000 0.000 0.543 305 L N -0.137 121.173 121.223 0.145 0.000 2.042 305 L HA -0.099 4.241 4.340 0.001 0.000 0.210 305 L C 2.737 179.672 176.870 0.109 0.000 1.076 305 L CA 0.741 55.620 54.840 0.066 0.000 0.749 305 L CB -0.500 41.721 42.059 0.269 0.000 0.893 305 L HN 0.252 8.482 8.230 -0.000 0.000 0.432 306 L N 0.352 121.680 121.223 0.175 0.000 2.042 306 L HA -0.106 4.235 4.340 0.001 0.000 0.210 306 L C 2.324 179.256 176.870 0.103 0.000 1.076 306 L CA 2.220 57.166 54.840 0.177 0.000 0.749 306 L CB -1.122 40.994 42.059 0.095 0.000 0.893 306 L HN 0.127 8.357 8.230 -0.000 0.000 0.432 307 G N -1.057 107.771 108.800 0.047 0.000 2.433 307 G HA2 -0.199 3.761 3.960 0.001 0.000 0.216 307 G HA3 -0.199 3.761 3.960 0.001 0.000 0.216 307 G C 1.526 176.404 174.900 -0.036 0.000 1.186 307 G CA 0.592 45.702 45.100 0.016 0.000 0.779 307 G HN 0.610 8.900 8.290 -0.000 0.000 0.543 308 G N 0.503 109.236 108.800 -0.112 0.000 2.476 308 G HA2 -0.184 3.777 3.960 0.001 0.000 0.218 308 G HA3 -0.184 3.777 3.960 0.001 0.000 0.218 308 G C 1.594 176.353 174.900 -0.234 0.000 1.164 308 G CA 0.950 45.894 45.100 -0.259 0.000 0.768 308 G HN 0.329 8.619 8.290 -0.000 0.000 0.560 309 F N 2.147 122.101 119.950 0.007 0.000 2.325 309 F HA -0.022 4.505 4.527 0.001 0.000 0.299 309 F C 3.087 178.880 175.800 -0.012 0.000 1.090 309 F CA 1.063 59.064 58.000 0.002 0.000 1.392 309 F CB -0.494 38.517 39.000 0.018 0.000 1.053 309 F HN 0.260 8.560 8.300 -0.000 0.000 0.521 310 S N 0.257 116.040 115.700 0.137 0.000 2.399 310 S HA -0.178 4.292 4.470 0.001 0.000 0.231 310 S C 2.295 176.913 174.600 0.030 0.000 1.022 310 S CA 0.792 59.034 58.200 0.070 0.000 0.983 310 S CB -0.970 62.254 63.200 0.039 0.000 0.803 310 S HN 0.258 8.568 8.310 -0.000 0.000 0.480 311 A N 2.207 125.023 122.820 -0.007 0.000 1.908 311 A HA 0.047 4.368 4.320 0.001 0.000 0.218 311 A C 2.204 179.780 177.584 -0.014 0.000 1.181 311 A CA 1.541 53.553 52.037 -0.043 0.000 0.627 311 A CB -0.879 18.045 19.000 -0.127 0.000 0.818 311 A HN 0.606 8.756 8.150 -0.000 0.000 0.445 312 I N -0.267 120.317 120.570 0.023 0.000 2.454 312 I HA -0.224 3.947 4.170 0.001 0.000 0.254 312 I C 1.910 178.049 176.117 0.036 0.000 1.156 312 I CA 0.911 62.236 61.300 0.043 0.000 1.433 312 I CB -0.249 37.812 38.000 0.100 0.000 1.082 312 I HN 0.290 8.500 8.210 -0.000 0.000 0.432 313 L N -0.190 121.056 121.223 0.038 0.000 2.418 313 L HA -0.014 4.327 4.340 0.001 0.000 0.218 313 L C 2.064 178.944 176.870 0.017 0.000 1.125 313 L CA 0.897 55.753 54.840 0.027 0.000 0.835 313 L CB -0.103 41.974 42.059 0.030 0.000 0.953 313 L HN 0.231 8.461 8.230 -0.000 0.000 0.454 314 I N -1.778 118.799 120.570 0.011 0.000 3.616 314 I HA 0.045 4.215 4.170 0.001 0.000 0.296 314 I C 0.258 176.377 176.117 0.002 0.000 1.226 314 I CA 0.208 61.512 61.300 0.006 0.000 1.394 314 I CB 1.075 39.076 38.000 0.001 0.000 1.171 314 I HN -0.184 8.026 8.210 -0.000 0.000 0.442 315 V N 4.254 124.167 119.914 -0.002 0.000 2.357 315 V HA 0.327 4.448 4.120 0.001 0.000 0.284 315 V C -2.267 173.829 176.094 0.004 0.000 1.018 315 V CA -1.617 60.681 62.300 -0.003 0.000 0.841 315 V CB 1.059 32.873 31.823 -0.015 0.000 0.991 315 V HN 0.031 8.221 8.190 -0.000 0.000 0.437 316 P HA 0.262 4.682 4.420 -0.000 0.000 0.271 316 P C 0.856 178.163 177.300 0.012 0.000 1.216 316 P CA 0.863 63.969 63.100 0.010 0.000 0.771 316 P CB 1.296 33.002 31.700 0.010 0.000 0.864 317 G N 3.192 112.002 108.800 0.015 0.000 2.175 317 G HA2 -0.288 3.673 3.960 0.001 0.000 0.244 317 G HA3 -0.288 3.673 3.960 0.001 0.000 0.244 317 G C 0.538 175.452 174.900 0.023 0.000 0.982 317 G CA 0.283 45.394 45.100 0.018 0.000 0.641 317 G HN 0.665 8.955 8.290 -0.000 0.000 0.527 318 I N -1.647 118.937 120.570 0.022 0.000 3.875 318 I HA 0.718 4.889 4.170 0.001 0.000 0.329 318 I C 2.166 178.309 176.117 0.043 0.000 1.295 318 I CA 0.778 62.095 61.300 0.028 0.000 1.129 318 I CB -0.056 37.949 38.000 0.009 0.000 1.008 318 I HN 0.159 8.369 8.210 -0.000 0.000 0.413 319 A N 1.903 124.750 122.820 0.044 0.000 1.859 319 A HA -0.157 4.163 4.320 0.001 0.000 0.217 319 A C 2.323 179.953 177.584 0.077 0.000 1.198 319 A CA 2.587 54.661 52.037 0.061 0.000 0.629 319 A CB -1.138 17.894 19.000 0.052 0.000 0.830 319 A HN 0.343 8.493 8.150 -0.000 0.000 0.446 320 V N -0.340 119.612 119.914 0.063 0.000 2.407 320 V HA -0.213 3.907 4.120 0.001 0.000 0.248 320 V C 3.004 179.146 176.094 0.080 0.000 1.055 320 V CA 1.949 64.287 62.300 0.064 0.000 1.049 320 V CB -1.218 30.631 31.823 0.043 0.000 0.662 320 V HN 0.658 8.848 8.190 -0.000 0.000 0.455 321 A N -0.652 122.220 122.820 0.086 0.000 1.873 321 A HA -0.252 4.069 4.320 0.001 0.000 0.215 321 A C 2.172 179.886 177.584 0.217 0.000 1.186 321 A CA 1.938 54.046 52.037 0.119 0.000 0.616 321 A CB -0.542 18.526 19.000 0.112 0.000 0.823 321 A HN 0.500 8.650 8.150 -0.000 0.000 0.442 322 Q N 0.084 119.995 119.800 0.184 0.000 2.014 322 Q HA -0.136 4.205 4.340 0.001 0.000 0.207 322 Q C 1.925 178.063 176.000 0.230 0.000 0.993 322 Q CA 2.027 57.942 55.803 0.186 0.000 0.850 322 Q CB -0.546 28.200 28.738 0.014 0.000 0.916 322 Q HN 0.648 8.918 8.270 -0.000 0.000 0.417 323 L N -0.528 120.799 121.223 0.174 0.000 2.079 323 L HA -0.219 4.121 4.340 0.001 0.000 0.210 323 L C 2.313 179.268 176.870 0.141 0.000 1.081 323 L CA 1.645 56.595 54.840 0.182 0.000 0.752 323 L CB -0.784 41.377 42.059 0.171 0.000 0.896 323 L HN 0.312 8.542 8.230 -0.000 0.000 0.433 324 T N -0.404 114.219 114.554 0.114 0.000 2.737 324 T HA -0.099 4.252 4.350 0.001 0.000 0.265 324 T C 1.862 176.574 174.700 0.020 0.000 1.038 324 T CA 1.320 63.453 62.100 0.055 0.000 1.144 324 T CB -0.500 68.385 68.868 0.027 0.000 0.866 324 T HN 0.549 8.789 8.240 -0.000 0.000 0.434 325 G N 1.214 110.030 108.800 0.026 0.000 2.422 325 G HA2 -0.137 3.824 3.960 0.001 0.000 0.218 325 G HA3 -0.137 3.824 3.960 0.001 0.000 0.218 325 G C 1.541 176.417 174.900 -0.040 0.000 1.146 325 G CA 0.467 45.447 45.100 -0.199 0.000 0.769 325 G HN 0.476 8.766 8.290 -0.000 0.000 0.547 326 I N 1.201 121.868 120.570 0.160 0.000 2.179 326 I HA -0.110 4.060 4.170 0.001 0.000 0.242 326 I C 3.100 179.253 176.117 0.059 0.000 1.088 326 I CA 1.114 62.478 61.300 0.107 0.000 1.357 326 I CB -0.481 37.521 38.000 0.003 0.000 1.051 326 I HN 0.249 8.459 8.210 -0.000 0.000 0.409 327 G N 1.056 109.889 108.800 0.056 0.000 2.418 327 G HA2 -0.211 3.749 3.960 0.001 0.000 0.217 327 G HA3 -0.211 3.749 3.960 0.001 0.000 0.217 327 G C 1.697 176.607 174.900 0.017 0.000 1.158 327 G CA 0.677 45.798 45.100 0.035 0.000 0.771 327 G HN 0.322 8.612 8.290 -0.000 0.000 0.545 328 I N 0.866 121.433 120.570 -0.006 0.000 2.226 328 I HA -0.174 3.996 4.170 0.001 0.000 0.245 328 I C 2.996 179.132 176.117 0.032 0.000 1.100 328 I CA 1.510 62.799 61.300 -0.018 0.000 1.374 328 I CB -0.475 37.475 38.000 -0.083 0.000 1.057 328 I HN 0.103 8.313 8.210 -0.000 0.000 0.413 329 T N 1.364 115.947 114.554 0.048 0.000 2.708 329 T HA -0.129 4.221 4.350 0.001 0.000 0.266 329 T C 1.951 176.784 174.700 0.222 0.000 1.037 329 T CA 1.274 63.481 62.100 0.178 0.000 1.146 329 T CB -0.372 68.606 68.868 0.184 0.000 0.865 329 T HN 0.236 8.476 8.240 -0.000 0.000 0.435 330 L N 0.747 122.032 121.223 0.104 0.000 2.046 330 L HA -0.112 4.229 4.340 0.001 0.000 0.208 330 L C 3.070 179.951 176.870 0.019 0.000 1.077 330 L CA 1.279 56.125 54.840 0.011 0.000 0.747 330 L CB -0.740 41.254 42.059 -0.108 0.000 0.896 330 L HN 0.254 8.484 8.230 -0.000 0.000 0.432 331 A N 0.184 123.024 122.820 0.033 0.000 1.855 331 A HA -0.151 4.170 4.320 0.001 0.000 0.215 331 A C 2.260 179.883 177.584 0.065 0.000 1.191 331 A CA 1.354 53.408 52.037 0.028 0.000 0.613 331 A CB -0.731 18.281 19.000 0.020 0.000 0.829 331 A HN 0.327 8.477 8.150 -0.000 0.000 0.442 332 L N -0.789 120.509 121.223 0.125 0.000 2.046 332 L HA -0.217 4.123 4.340 0.001 0.000 0.208 332 L C 3.139 180.168 176.870 0.264 0.000 1.077 332 L CA 1.067 56.031 54.840 0.207 0.000 0.747 332 L CB -0.646 41.577 42.059 0.273 0.000 0.896 332 L HN 0.482 8.712 8.230 -0.000 0.000 0.432 333 A N 0.349 123.304 122.820 0.226 0.000 1.851 333 A HA -0.201 4.120 4.320 0.001 0.000 0.216 333 A C 2.225 179.774 177.584 -0.059 0.000 1.195 333 A CA 1.614 53.648 52.037 -0.006 0.000 0.622 333 A CB -0.787 18.154 19.000 -0.097 0.000 0.831 333 A HN 0.336 8.486 8.150 -0.000 0.000 0.444 334 L N -0.671 120.535 121.223 -0.028 0.000 2.027 334 L HA -0.165 4.176 4.340 0.001 0.000 0.206 334 L C 2.562 179.354 176.870 -0.129 0.000 1.074 334 L CA 1.316 56.109 54.840 -0.078 0.000 0.745 334 L CB -0.521 41.513 42.059 -0.041 0.000 0.898 334 L HN 0.388 8.618 8.230 -0.000 0.000 0.433 335 I N -0.235 120.295 120.570 -0.068 0.000 2.142 335 I HA -0.229 3.942 4.170 0.001 0.000 0.240 335 I C 2.651 178.710 176.117 -0.096 0.000 1.078 335 I CA 1.586 62.849 61.300 -0.062 0.000 1.343 335 I CB -0.967 37.027 38.000 -0.009 0.000 1.046 335 I HN 0.288 8.498 8.210 -0.000 0.000 0.405 336 G N 0.420 109.197 108.800 -0.039 0.000 2.440 336 G HA2 -0.199 3.762 3.960 0.001 0.000 0.218 336 G HA3 -0.199 3.762 3.960 0.001 0.000 0.218 336 G C 1.705 176.354 174.900 -0.418 0.000 1.154 336 G CA 0.891 46.004 45.100 0.021 0.000 0.767 336 G HN 0.514 8.804 8.290 -0.000 0.000 0.552 337 G N 0.446 108.654 108.800 -0.986 0.000 2.421 337 G HA2 -0.161 3.799 3.960 0.001 0.000 0.216 337 G HA3 -0.161 3.799 3.960 0.001 0.000 0.216 337 G C 1.793 176.375 174.900 -0.530 0.000 1.171 337 G CA 1.233 45.557 45.100 -1.294 0.000 0.775 337 G HN 0.313 8.603 8.290 -0.000 0.000 0.543 338 V N 1.224 120.945 119.914 -0.323 0.000 2.332 338 V HA -0.185 3.935 4.120 0.001 0.000 0.248 338 V C 2.800 178.795 176.094 -0.164 0.000 1.055 338 V CA 1.649 63.837 62.300 -0.188 0.000 1.038 338 V CB -0.380 31.366 31.823 -0.128 0.000 0.651 338 V HN 0.407 8.597 8.190 -0.000 0.000 0.450 339 I N 0.288 120.755 120.570 -0.171 0.000 2.252 339 I HA -0.208 3.963 4.170 0.001 0.000 0.245 339 I C 2.682 178.681 176.117 -0.197 0.000 1.102 339 I CA 1.407 62.615 61.300 -0.153 0.000 1.385 339 I CB -0.638 37.286 38.000 -0.126 0.000 1.064 339 I HN 0.285 8.495 8.210 -0.000 0.000 0.414 340 A N 1.036 123.741 122.820 -0.191 0.000 1.908 340 A HA -0.150 4.171 4.320 0.001 0.000 0.218 340 A C 2.430 180.004 177.584 -0.018 0.000 1.181 340 A CA 2.008 53.974 52.037 -0.119 0.000 0.627 340 A CB -1.432 17.708 19.000 0.233 0.000 0.818 340 A HN 0.471 8.621 8.150 -0.000 0.000 0.445 341 G N -0.698 108.068 108.800 -0.056 0.000 2.408 341 G HA2 0.046 4.006 3.960 0.001 0.000 0.217 341 G HA3 0.046 4.006 3.960 0.001 0.000 0.217 341 G C 1.727 176.610 174.900 -0.028 0.000 1.150 341 G CA 1.350 46.436 45.100 -0.023 0.000 0.776 341 G HN 0.787 9.077 8.290 -0.000 0.000 0.542 342 A N 0.671 123.454 122.820 -0.061 0.000 1.883 342 A HA 0.034 4.355 4.320 0.001 0.000 0.217 342 A C 2.440 180.003 177.584 -0.035 0.000 1.186 342 A CA 1.400 53.406 52.037 -0.052 0.000 0.624 342 A CB -0.434 18.525 19.000 -0.069 0.000 0.822 342 A HN 0.359 8.509 8.150 -0.000 0.000 0.444 343 L N -0.790 120.394 121.223 -0.064 0.000 2.027 343 L HA -0.139 4.201 4.340 0.001 0.000 0.206 343 L C 2.507 179.443 176.870 0.110 0.000 1.074 343 L CA 1.240 56.063 54.840 -0.027 0.000 0.745 343 L CB -0.522 41.401 42.059 -0.227 0.000 0.898 343 L HN 0.356 8.586 8.230 -0.000 0.000 0.433 344 I N -0.003 120.671 120.570 0.173 0.000 2.208 344 I HA -0.344 3.827 4.170 0.001 0.000 0.245 344 I C 2.647 178.804 176.117 0.068 0.000 1.097 344 I CA 1.392 62.793 61.300 0.169 0.000 1.363 344 I CB -0.346 37.735 38.000 0.136 0.000 1.051 344 I HN 0.239 8.449 8.210 -0.000 0.000 0.413 345 K N 1.262 121.680 120.400 0.030 0.000 2.218 345 K HA -0.173 4.148 4.320 0.001 0.000 0.205 345 K C 2.005 178.619 176.600 0.023 0.000 1.046 345 K CA 1.215 57.504 56.287 0.004 0.000 0.933 345 K CB -0.093 32.401 32.500 -0.011 0.000 0.728 345 K HN 0.347 8.597 8.250 -0.000 0.000 0.454 346 L N 0.437 121.686 121.223 0.044 0.000 2.362 346 L HA -0.104 4.237 4.340 0.001 0.000 0.219 346 L C 2.090 179.006 176.870 0.078 0.000 1.134 346 L CA 1.460 56.330 54.840 0.051 0.000 0.807 346 L CB -0.693 41.397 42.059 0.052 0.000 0.927 346 L HN 0.354 8.584 8.230 -0.000 0.000 0.447 347 T N -3.205 111.419 114.554 0.117 0.000 3.107 347 T HA 0.471 4.822 4.350 0.001 0.000 0.249 347 T C 0.805 175.626 174.700 0.202 0.000 1.096 347 T CA 0.238 62.456 62.100 0.196 0.000 1.012 347 T CB 0.504 69.590 68.868 0.363 0.000 0.977 347 T HN 0.462 8.702 8.240 -0.000 0.000 0.527 348 G N -0.436 108.419 108.800 0.091 0.000 2.354 348 G HA2 0.315 4.276 3.960 0.001 0.000 0.582 348 G HA3 0.315 4.276 3.960 0.001 0.000 0.582 348 G C -0.788 174.099 174.900 -0.022 0.000 1.316 348 G CA -0.353 44.777 45.100 0.050 0.000 0.995 348 G HN 0.484 8.774 8.290 -0.000 0.000 0.573 349 T N -1.281 113.248 114.554 -0.041 0.000 2.831 349 T HA 0.818 5.169 4.350 0.001 0.000 0.287 349 T C 0.678 175.320 174.700 -0.095 0.000 1.070 349 T CA 0.794 62.845 62.100 -0.082 0.000 1.010 349 T CB 1.191 70.017 68.868 -0.070 0.000 1.264 349 T HN 1.751 9.991 8.240 -0.000 0.000 0.532 350 T N 1.125 115.606 114.554 -0.121 0.000 2.897 350 T HA 0.395 4.746 4.350 0.001 0.000 0.294 350 T C 1.253 175.867 174.700 -0.143 0.000 1.004 350 T CA -0.661 61.364 62.100 -0.125 0.000 1.106 350 T CB 0.977 69.757 68.868 -0.148 0.000 0.949 350 T HN 0.627 8.867 8.240 -0.000 0.000 0.520 351 K N 0.857 121.130 120.400 -0.211 0.000 1.991 351 K HA -0.108 4.212 4.320 0.001 0.000 0.212 351 K C 1.048 177.509 176.600 -0.232 0.000 1.049 351 K CA 1.423 57.521 56.287 -0.315 0.000 0.932 351 K CB 0.018 32.103 32.500 -0.692 0.000 0.717 351 K HN 0.702 8.952 8.250 -0.000 0.000 0.441 352 Q N -0.702 118.998 119.800 -0.166 0.000 2.263 352 Q HA 0.381 4.721 4.340 0.001 0.000 0.266 352 Q C -1.752 174.235 176.000 -0.022 0.000 1.002 352 Q CA -0.532 55.275 55.803 0.008 0.000 0.790 352 Q CB 2.052 30.923 28.738 0.221 0.000 1.272 352 Q HN 0.244 8.514 8.270 -0.000 0.000 0.435 353 A N 2.545 125.251 122.820 -0.190 0.000 2.466 353 A HA 0.201 4.521 4.320 0.001 0.000 0.238 353 A C -0.650 176.666 177.584 -0.448 0.000 1.074 353 A CA 0.495 52.196 52.037 -0.560 0.000 0.774 353 A CB -0.268 18.139 19.000 -0.987 0.000 1.015 353 A HN 0.962 9.112 8.150 -0.000 0.000 0.498 354 Y N -2.345 117.758 120.300 -0.329 0.000 4.490 354 Y HA -0.140 4.410 4.550 0.001 0.000 0.233 354 Y C 0.288 176.136 175.900 -0.086 0.000 1.101 354 Y CA 1.136 58.973 58.100 -0.439 0.000 2.010 354 Y CB -2.114 36.190 38.460 -0.259 0.000 1.622 354 Y HN 0.845 9.125 8.280 -0.000 0.000 0.675 355 E N 0.684 120.988 120.200 0.174 0.000 2.220 355 E HA 0.379 4.729 4.350 0.001 0.000 0.256 355 E C 0.341 177.091 176.600 0.250 0.000 0.881 355 E CA -0.402 56.114 56.400 0.193 0.000 0.766 355 E CB 0.797 30.556 29.700 0.099 0.000 1.187 355 E HN 0.087 8.447 8.360 -0.000 0.000 0.419 356 D N 2.068 122.569 120.400 0.168 0.000 2.219 356 D HA -0.140 4.500 4.640 0.001 0.000 0.205 356 D C 1.364 177.738 176.300 0.124 0.000 0.970 356 D CA 1.440 55.517 54.000 0.129 0.000 0.851 356 D CB 0.137 40.812 40.800 -0.208 0.000 0.943 356 D HN 0.531 8.901 8.370 -0.000 0.000 0.488 357 S N -0.197 115.471 115.700 -0.053 0.000 2.447 357 S HA -0.162 4.309 4.470 0.001 0.000 0.233 357 S C 1.587 176.145 174.600 -0.070 0.000 1.006 357 S CA 0.716 58.865 58.200 -0.085 0.000 0.957 357 S CB -0.438 62.656 63.200 -0.177 0.000 0.773 357 S HN 0.334 8.644 8.310 -0.000 0.000 0.507 358 H N 1.094 120.228 119.070 0.107 0.000 2.547 358 H HA 0.267 4.823 4.556 0.001 0.000 0.272 358 H C 1.485 176.850 175.328 0.061 0.000 0.989 358 H CA 1.005 57.099 56.048 0.076 0.000 1.214 358 H CB 0.120 29.922 29.762 0.067 0.000 1.389 358 H HN 0.554 8.834 8.280 -0.000 0.000 0.577 359 E N -0.496 119.811 120.200 0.180 0.000 2.453 359 E HA 0.134 4.484 4.350 0.001 0.000 0.211 359 E C -0.450 175.939 176.600 -0.351 0.000 0.897 359 E CA 0.092 56.481 56.400 -0.018 0.000 1.063 359 E CB 0.829 30.576 29.700 0.078 0.000 1.080 359 E HN 0.152 8.512 8.360 -0.000 0.000 0.512 360 F N 1.011 121.018 119.950 0.096 0.000 2.556 360 F HA 0.378 4.906 4.527 0.001 0.000 0.314 360 F C 0.567 176.402 175.800 0.058 0.000 1.106 360 F CA -1.372 56.694 58.000 0.110 0.000 0.911 360 F CB 1.480 40.637 39.000 0.261 0.000 1.190 360 F HN -0.218 8.082 8.300 -0.000 0.000 0.448 361 I N -0.027 120.614 120.570 0.119 0.000 3.138 361 I HA 0.252 4.422 4.170 0.001 0.000 0.288 361 I C 0.229 176.357 176.117 0.019 0.000 1.148 361 I CA -0.333 60.924 61.300 -0.072 0.000 1.315 361 I CB 0.340 38.128 38.000 -0.354 0.000 1.426 361 I HN 0.764 8.974 8.210 -0.000 0.000 0.615 362 H N 0.825 119.969 119.070 0.123 0.000 2.862 362 H HA -0.099 4.457 4.556 0.001 0.000 0.290 362 H C -1.075 174.319 175.328 0.111 0.000 1.211 362 H CA 0.597 56.710 56.048 0.108 0.000 1.140 362 H CB -1.828 28.001 29.762 0.111 0.000 1.341 362 H HN 0.519 8.799 8.280 -0.000 0.000 0.392 363 L N -0.100 121.229 121.223 0.177 0.000 2.381 363 L HA 0.655 4.995 4.340 0.001 0.000 0.274 363 L C 0.634 177.530 176.870 0.043 0.000 0.988 363 L CA -0.639 54.257 54.840 0.092 0.000 0.824 363 L CB 1.874 43.956 42.059 0.038 0.000 1.263 363 L HN 0.291 8.521 8.230 -0.000 0.000 0.410 364 A N 2.506 125.340 122.820 0.024 0.000 2.445 364 A HA 0.534 4.854 4.320 0.001 0.000 0.242 364 A C 0.680 178.248 177.584 -0.027 0.000 1.075 364 A CA 0.309 52.351 52.037 0.008 0.000 0.777 364 A CB 0.370 19.375 19.000 0.008 0.000 1.013 364 A HN 0.793 8.943 8.150 -0.000 0.000 0.493 365 G N 0.993 109.778 108.800 -0.026 0.000 2.699 365 G HA2 0.390 4.351 3.960 0.001 0.000 0.246 365 G HA3 0.390 4.351 3.960 0.001 0.000 0.246 365 G C -1.220 173.660 174.900 -0.034 0.000 1.219 365 G CA -0.472 44.598 45.100 -0.049 0.000 0.866 365 G HN 0.531 8.821 8.290 -0.000 0.000 0.572 366 P HA -0.034 4.386 4.420 -0.000 0.000 0.223 366 P C 1.025 178.340 177.300 0.025 0.000 1.151 366 P CA 0.889 63.980 63.100 -0.014 0.000 0.787 366 P CB 0.281 31.989 31.700 0.014 0.000 0.788 367 E N 0.691 120.930 120.200 0.064 0.000 2.130 367 E HA -0.201 4.149 4.350 0.001 0.000 0.196 367 E C 1.532 178.173 176.600 0.068 0.000 0.998 367 E CA 1.425 57.889 56.400 0.107 0.000 0.806 367 E CB -1.294 28.453 29.700 0.079 0.000 0.738 367 E HN 0.265 8.625 8.360 -0.000 0.000 0.459 368 D N 0.547 120.959 120.400 0.019 0.000 2.309 368 D HA -0.125 4.516 4.640 0.001 0.000 0.212 368 D C 1.381 177.661 176.300 -0.034 0.000 0.968 368 D CA 0.809 54.810 54.000 0.002 0.000 0.882 368 D CB -0.072 40.725 40.800 -0.004 0.000 0.918 368 D HN 0.368 8.738 8.370 -0.000 0.000 0.503 369 E N -0.435 119.703 120.200 -0.102 0.000 2.107 369 E HA -0.105 4.245 4.350 0.001 0.000 0.191 369 E C 1.190 177.647 176.600 -0.239 0.000 0.982 369 E CA 0.672 56.949 56.400 -0.206 0.000 0.809 369 E CB -0.015 29.487 29.700 -0.329 0.000 0.756 369 E HN 0.526 8.886 8.360 -0.000 0.000 0.459 370 H N 0.364 119.437 119.070 0.006 0.000 2.533 370 H HA 0.099 4.655 4.556 0.001 0.000 0.271 370 H C 1.682 177.014 175.328 0.007 0.000 1.000 370 H CA 0.370 56.422 56.048 0.007 0.000 1.149 370 H CB 0.283 30.050 29.762 0.008 0.000 1.375 370 H HN 0.093 8.373 8.280 -0.000 0.000 0.582 371 K N 1.365 121.812 120.400 0.078 0.000 2.057 371 K HA -0.077 4.243 4.320 0.001 0.000 0.207 371 K C 2.198 178.824 176.600 0.044 0.000 1.049 371 K CA 1.040 57.361 56.287 0.056 0.000 0.931 371 K CB 0.131 32.650 32.500 0.031 0.000 0.714 371 K HN 0.176 8.426 8.250 -0.000 0.000 0.440 372 A N 1.124 123.963 122.820 0.033 0.000 2.015 372 A HA -0.150 4.171 4.320 0.001 0.000 0.219 372 A C 1.724 179.330 177.584 0.037 0.000 1.163 372 A CA 1.379 53.433 52.037 0.027 0.000 0.646 372 A CB -0.327 18.682 19.000 0.015 0.000 0.806 372 A HN 0.449 8.599 8.150 -0.000 0.000 0.448 373 E N -0.387 119.848 120.200 0.058 0.000 2.072 373 E HA -0.174 4.176 4.350 0.001 0.000 0.191 373 E C 2.297 178.923 176.600 0.045 0.000 0.985 373 E CA 0.963 57.399 56.400 0.060 0.000 0.801 373 E CB -0.173 29.586 29.700 0.098 0.000 0.750 373 E HN 0.533 8.893 8.360 -0.000 0.000 0.452 374 R N 0.520 121.049 120.500 0.049 0.000 2.083 374 R HA -0.143 4.198 4.340 0.001 0.000 0.237 374 R C 2.482 178.797 176.300 0.025 0.000 1.137 374 R CA 1.108 57.228 56.100 0.034 0.000 0.951 374 R CB -0.368 29.954 30.300 0.037 0.000 0.851 374 R HN 0.158 8.428 8.270 -0.000 0.000 0.434 375 L N -0.017 121.222 121.223 0.026 0.000 2.083 375 L HA -0.192 4.148 4.340 0.001 0.000 0.209 375 L C 2.367 179.247 176.870 0.017 0.000 1.083 375 L CA 0.927 55.779 54.840 0.020 0.000 0.752 375 L CB -0.406 41.664 42.059 0.019 0.000 0.899 375 L HN 0.042 8.272 8.230 -0.000 0.000 0.433 376 V N 0.078 120.003 119.914 0.018 0.000 2.261 376 V HA -0.287 3.834 4.120 0.001 0.000 0.246 376 V C 2.341 178.443 176.094 0.013 0.000 1.047 376 V CA 1.804 64.113 62.300 0.015 0.000 1.015 376 V CB -0.351 31.482 31.823 0.017 0.000 0.642 376 V HN 0.345 8.535 8.190 -0.000 0.000 0.446 377 L N -0.212 121.019 121.223 0.014 0.000 2.131 377 L HA -0.194 4.147 4.340 0.001 0.000 0.210 377 L C 2.558 179.434 176.870 0.010 0.000 1.092 377 L CA 1.789 56.636 54.840 0.011 0.000 0.759 377 L CB -0.696 41.369 42.059 0.010 0.000 0.903 377 L HN 0.481 8.711 8.230 -0.000 0.000 0.435 378 E N 0.769 120.976 120.200 0.011 0.000 2.077 378 E HA -0.251 4.099 4.350 0.001 0.000 0.193 378 E C 2.221 178.826 176.600 0.009 0.000 0.989 378 E CA 1.356 57.762 56.400 0.010 0.000 0.800 378 E CB 0.074 29.781 29.700 0.012 0.000 0.746 378 E HN 0.463 8.823 8.360 -0.000 0.000 0.452 379 A N 1.449 124.274 122.820 0.010 0.000 1.855 379 A HA -0.188 4.132 4.320 0.001 0.000 0.215 379 A C 2.098 179.686 177.584 0.007 0.000 1.191 379 A CA 1.649 53.691 52.037 0.008 0.000 0.613 379 A CB -0.438 18.568 19.000 0.009 0.000 0.829 379 A HN 0.136 8.286 8.150 -0.000 0.000 0.442 380 K N -0.949 119.455 120.400 0.008 0.000 2.074 380 K HA -0.150 4.170 4.320 0.001 0.000 0.209 380 K C 2.176 178.780 176.600 0.006 0.000 1.048 380 K CA 1.897 58.188 56.287 0.007 0.000 0.926 380 K CB -0.449 32.055 32.500 0.007 0.000 0.713 380 K HN 0.518 8.768 8.250 -0.000 0.000 0.444 381 T N 1.066 115.624 114.554 0.006 0.000 2.674 381 T HA -0.154 4.196 4.350 0.001 0.000 0.265 381 T C 1.610 176.313 174.700 0.005 0.000 1.039 381 T CA 1.426 63.529 62.100 0.005 0.000 1.150 381 T CB -0.150 68.721 68.868 0.006 0.000 0.864 381 T HN 0.341 8.581 8.240 -0.000 0.000 0.427 382 E N 0.203 120.406 120.200 0.006 0.000 2.058 382 E HA -0.117 4.233 4.350 0.001 0.000 0.194 382 E C 2.212 178.815 176.600 0.005 0.000 0.997 382 E CA 1.009 57.413 56.400 0.005 0.000 0.801 382 E CB -0.262 29.442 29.700 0.006 0.000 0.746 382 E HN 0.301 8.661 8.360 -0.000 0.000 0.450 383 I N 1.026 121.599 120.570 0.005 0.000 2.118 383 I HA -0.299 3.872 4.170 0.001 0.000 0.241 383 I C 2.420 178.539 176.117 0.004 0.000 1.070 383 I CA 1.678 62.980 61.300 0.005 0.000 1.327 383 I CB -0.220 37.783 38.000 0.005 0.000 1.034 383 I HN 0.052 8.262 8.210 -0.000 0.000 0.405 384 Q N -0.503 119.299 119.800 0.004 0.000 2.360 384 Q HA 0.092 4.432 4.340 0.001 0.000 0.202 384 Q C 1.988 177.990 176.000 0.004 0.000 0.915 384 Q CA 0.513 56.319 55.803 0.004 0.000 0.943 384 Q CB 0.018 28.759 28.738 0.004 0.000 1.064 384 Q HN 0.516 8.786 8.270 -0.000 0.000 0.511 385 G N 0.475 109.278 108.800 0.004 0.000 2.535 385 G HA2 -0.056 3.904 3.960 0.001 0.000 0.218 385 G HA3 -0.056 3.904 3.960 0.001 0.000 0.218 385 G C 0.551 175.453 174.900 0.004 0.000 1.122 385 G CA 0.228 45.330 45.100 0.004 0.000 0.769 385 G HN 0.199 8.489 8.290 -0.000 0.000 0.549 386 L N 0.000 121.225 121.223 0.004 0.000 2.949 386 L HA 0.000 4.340 4.340 0.001 0.000 0.249 386 L CA 0.000 54.842 54.840 0.003 0.000 0.813 386 L CB 0.000 42.061 42.059 0.003 0.000 0.961 386 L HN 0.000 8.230 8.230 -0.000 0.000 0.502