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 3cdj_1_A DATA FIRST_RESID 21 DATA SEQUENCE DITLLNPIVR KFQYGQHTVT LETGMMARQA TAAVMVSMDD TAVFVTVVGQ DATA SEQUENCE KKAKPGQDFF PLTVNYQERT YAAGRIPXXX XXXXXXXSEG ETLIARLIDR DATA SEQUENCE PIRPLFPEXF VNEVQVIATV VSVNPQVNPD IVAMIGASAA LSLSGIPFNG DATA SEQUENCE PIGAARVGYI NDQYVLNPTQ DELKESKLDL VVAGTEAAVL MVESEAQLLS DATA SEQUENCE EDQMLGAVVF GHEQQQVVIQ NINELVKEAG KPRWDWQPEP XXXXXXXXXX DATA SEQUENCE XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX DATA SEQUENCE XAIEKNVVRS RVLAGEPRID GREKDMIRGL DVRTGVLPRT HGSALFTRGE DATA SEQUENCE TQALVTATLG TXXXXXXXXX XXXERTDTFL FHYNFPPYXX XXXXXXXXXX DATA SEQUENCE XXEIGHGRLA KRGVLAVMPD MDKFPYTVRV VSEITESNGS SSMASVCGAS DATA SEQUENCE LALMDAGVPI KAAVAGIAMG LVKEGDNYVV LSDILGDEDH LGDMDFKVAG DATA SEQUENCE SRDGISALQM DIKIEGITKE IMQVALNQAK GARLHILGVM EQA 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 21 D HA 0.000 nan 4.640 nan 0.000 0.175 21 D C 0.000 176.296 176.300 -0.006 0.000 2.045 21 D CA 0.000 53.995 54.000 -0.008 0.000 0.868 21 D CB 0.000 40.795 40.800 -0.008 0.000 0.688 22 I N 0.343 120.909 120.570 -0.007 0.000 2.927 22 I HA 0.013 4.182 4.170 -0.001 0.000 0.268 22 I C 0.932 177.048 176.117 -0.003 0.000 1.153 22 I CA 1.180 62.476 61.300 -0.005 0.000 1.459 22 I CB 0.069 38.065 38.000 -0.007 0.000 1.149 22 I HN 0.777 8.987 8.210 0.000 0.000 0.443 23 T N -0.069 114.483 114.554 -0.003 0.000 3.704 23 T HA -0.202 4.148 4.350 -0.001 0.000 0.388 23 T C 0.814 175.515 174.700 0.002 0.000 0.763 23 T CA 0.734 62.834 62.100 -0.000 0.000 2.005 23 T CB -1.832 67.036 68.868 0.001 0.000 1.752 23 T HN 0.319 8.559 8.240 0.000 0.000 0.747 24 L N -0.632 120.592 121.223 0.002 0.000 2.291 24 L HA 0.160 4.499 4.340 -0.001 0.000 0.214 24 L C 1.656 178.530 176.870 0.007 0.000 1.120 24 L CA 0.270 55.113 54.840 0.004 0.000 0.799 24 L CB -0.288 41.773 42.059 0.004 0.000 0.925 24 L HN 0.393 8.623 8.230 0.000 0.000 0.446 25 L N 1.078 122.306 121.223 0.007 0.000 2.476 25 L HA -0.016 4.323 4.340 -0.001 0.000 0.264 25 L C 1.220 178.098 176.870 0.014 0.000 1.224 25 L CA 0.597 55.443 54.840 0.011 0.000 0.821 25 L CB 0.031 42.096 42.059 0.010 0.000 1.101 25 L HN 0.233 8.463 8.230 0.000 0.000 0.488 26 N N -0.225 118.486 118.700 0.019 0.000 2.238 26 N HA 0.118 4.857 4.740 -0.001 0.000 0.235 26 N C -2.533 172.993 175.510 0.026 0.000 1.209 26 N CA -0.780 52.282 53.050 0.021 0.000 0.879 26 N CB -0.478 38.023 38.487 0.022 0.000 1.136 26 N HN 0.358 8.738 8.380 0.000 0.000 0.517 27 P HA -0.048 4.372 4.420 0.000 0.000 0.259 27 P C -0.316 177.005 177.300 0.034 0.000 1.155 27 P CA 0.169 63.290 63.100 0.036 0.000 0.759 27 P CB 0.515 32.237 31.700 0.036 0.000 0.753 28 I N 4.549 125.142 120.570 0.038 0.000 2.337 28 I HA 0.084 4.253 4.170 -0.001 0.000 0.291 28 I C 0.441 176.583 176.117 0.041 0.000 1.046 28 I CA -0.251 61.071 61.300 0.036 0.000 1.324 28 I CB 1.137 39.159 38.000 0.035 0.000 1.409 28 I HN 0.091 8.301 8.210 0.000 0.000 0.494 29 V N 7.277 127.215 119.914 0.039 0.000 2.334 29 V HA 0.472 4.591 4.120 -0.001 0.000 0.281 29 V C 0.143 176.267 176.094 0.049 0.000 1.016 29 V CA -0.793 61.533 62.300 0.042 0.000 0.832 29 V CB 1.229 33.072 31.823 0.033 0.000 0.999 29 V HN 0.658 8.848 8.190 0.000 0.000 0.439 30 R N 4.306 124.845 120.500 0.066 0.000 2.407 30 R HA 0.663 5.002 4.340 -0.001 0.000 0.303 30 R C -0.728 175.634 176.300 0.103 0.000 0.981 30 R CA -0.541 55.614 56.100 0.093 0.000 0.905 30 R CB 1.168 31.539 30.300 0.118 0.000 1.099 30 R HN 0.640 8.910 8.270 0.000 0.000 0.459 31 K N 4.975 125.441 120.400 0.110 0.000 2.578 31 K HA 0.300 4.619 4.320 -0.001 0.000 0.250 31 K C -1.470 175.215 176.600 0.141 0.000 0.955 31 K CA -0.578 55.745 56.287 0.059 0.000 0.825 31 K CB 1.320 33.832 32.500 0.019 0.000 1.151 31 K HN 0.463 8.713 8.250 0.000 0.000 0.432 32 F N -0.507 119.457 119.950 0.024 0.000 2.579 32 F HA 0.600 5.127 4.527 -0.001 0.000 0.324 32 F C -0.137 175.696 175.800 0.055 0.000 1.058 32 F CA -1.327 56.685 58.000 0.020 0.000 0.944 32 F CB 1.186 40.177 39.000 -0.015 0.000 1.245 32 F HN 0.190 8.490 8.300 0.000 0.000 0.477 33 Q N 1.406 121.373 119.800 0.279 0.000 2.306 33 Q HA 0.372 4.711 4.340 -0.001 0.000 0.241 33 Q C -1.914 174.320 176.000 0.390 0.000 0.948 33 Q CA -0.348 55.579 55.803 0.206 0.000 0.886 33 Q CB 0.960 29.795 28.738 0.162 0.000 1.227 33 Q HN 0.808 9.078 8.270 0.000 0.000 0.457 34 Y N 2.679 123.058 120.300 0.131 0.000 2.307 34 Y HA 0.434 4.983 4.550 -0.001 0.000 0.323 34 Y C 0.706 176.652 175.900 0.077 0.000 1.100 34 Y CA -0.252 57.949 58.100 0.168 0.000 1.140 34 Y CB 0.856 39.426 38.460 0.183 0.000 1.159 34 Y HN 0.870 9.150 8.280 0.000 0.000 0.436 35 G N 4.667 113.590 108.800 0.205 0.000 2.629 35 G HA2 -0.448 3.511 3.960 -0.001 0.000 0.313 35 G HA3 -0.448 3.511 3.960 -0.001 0.000 0.313 35 G C 0.388 175.260 174.900 -0.047 0.000 1.217 35 G CA 1.222 46.298 45.100 -0.040 0.000 0.994 35 G HN 0.783 9.073 8.290 0.000 0.000 0.549 36 Q N -0.064 119.617 119.800 -0.198 0.000 2.247 36 Q HA 0.418 4.757 4.340 -0.001 0.000 0.211 36 Q C 0.750 176.707 176.000 -0.071 0.000 0.861 36 Q CA 0.348 56.064 55.803 -0.145 0.000 0.949 36 Q CB 0.336 28.967 28.738 -0.178 0.000 1.115 36 Q HN 0.819 9.089 8.270 0.000 0.000 0.507 37 H N 0.275 119.349 119.070 0.007 0.000 2.502 37 H HA 0.407 4.962 4.556 -0.001 0.000 0.338 37 H C -0.593 174.745 175.328 0.016 0.000 1.155 37 H CA -0.822 55.228 56.048 0.002 0.000 1.237 37 H CB 1.804 31.554 29.762 -0.020 0.000 1.534 37 H HN -0.040 8.240 8.280 0.000 0.000 0.523 38 T N 2.367 116.992 114.554 0.117 0.000 2.801 38 T HA 0.304 4.653 4.350 -0.001 0.000 0.306 38 T C -0.180 174.461 174.700 -0.098 0.000 1.020 38 T CA -0.718 61.385 62.100 0.005 0.000 0.948 38 T CB -0.387 68.484 68.868 0.004 0.000 0.962 38 T HN 0.248 8.488 8.240 0.000 0.000 0.465 39 V N 4.423 124.172 119.914 -0.275 0.000 3.185 39 V HA 0.633 4.752 4.120 -0.001 0.000 0.305 39 V C 0.952 176.807 176.094 -0.400 0.000 1.090 39 V CA -0.364 61.691 62.300 -0.408 0.000 1.107 39 V CB 1.594 32.917 31.823 -0.834 0.000 1.061 39 V HN 1.020 9.210 8.190 0.000 0.000 0.480 40 T N 3.434 117.843 114.554 -0.243 0.000 3.237 40 T HA 0.520 4.869 4.350 -0.001 0.000 0.319 40 T C -1.337 173.342 174.700 -0.035 0.000 1.037 40 T CA -0.498 61.530 62.100 -0.120 0.000 1.048 40 T CB 0.535 69.367 68.868 -0.060 0.000 1.081 40 T HN 0.425 8.665 8.240 0.000 0.000 0.455 41 L N 3.846 125.082 121.223 0.022 0.000 2.322 41 L HA 0.771 5.110 4.340 -0.001 0.000 0.279 41 L C 0.058 176.964 176.870 0.060 0.000 1.036 41 L CA -0.740 54.138 54.840 0.063 0.000 0.807 41 L CB 1.770 43.896 42.059 0.112 0.000 1.226 41 L HN 0.720 8.950 8.230 0.000 0.000 0.433 42 E N 1.416 121.655 120.200 0.065 0.000 2.307 42 E HA 0.420 4.769 4.350 -0.001 0.000 0.280 42 E C -1.591 175.057 176.600 0.079 0.000 0.900 42 E CA -0.314 56.126 56.400 0.068 0.000 0.790 42 E CB 2.299 32.040 29.700 0.069 0.000 1.261 42 E HN 0.542 8.902 8.360 0.000 0.000 0.405 43 T N 1.638 116.233 114.554 0.068 0.000 2.883 43 T HA 0.682 5.031 4.350 -0.001 0.000 0.296 43 T C 0.599 175.338 174.700 0.065 0.000 1.117 43 T CA 0.653 62.794 62.100 0.068 0.000 1.006 43 T CB 1.409 70.303 68.868 0.044 0.000 1.191 43 T HN 0.843 9.083 8.240 0.000 0.000 0.508 44 G N 1.815 110.656 108.800 0.069 0.000 2.284 44 G HA2 -0.275 3.684 3.960 -0.001 0.000 0.230 44 G HA3 -0.275 3.684 3.960 -0.001 0.000 0.230 44 G C 0.937 175.873 174.900 0.061 0.000 1.021 44 G CA 0.928 46.063 45.100 0.058 0.000 0.619 44 G HN 0.850 9.140 8.290 0.000 0.000 0.510 45 M N 0.232 119.873 119.600 0.069 0.000 2.412 45 M HA 0.566 5.045 4.480 -0.001 0.000 0.263 45 M C 1.226 177.563 176.300 0.060 0.000 1.122 45 M CA 0.915 56.247 55.300 0.053 0.000 1.179 45 M CB 0.161 32.784 32.600 0.039 0.000 1.335 45 M HN 0.262 8.552 8.290 0.000 0.000 0.465 46 M N 0.612 120.276 119.600 0.106 0.000 2.318 46 M HA 0.423 4.902 4.480 -0.001 0.000 0.347 46 M C 0.533 176.978 176.300 0.243 0.000 1.175 46 M CA -0.167 55.206 55.300 0.122 0.000 1.075 46 M CB 1.446 34.067 32.600 0.035 0.000 1.614 46 M HN 0.354 8.644 8.290 0.000 0.000 0.456 47 A N 1.716 124.658 122.820 0.203 0.000 2.687 47 A HA -0.233 4.086 4.320 -0.001 0.000 0.299 47 A C 1.095 178.759 177.584 0.134 0.000 1.497 47 A CA 0.924 53.086 52.037 0.208 0.000 0.751 47 A CB -1.484 17.735 19.000 0.365 0.000 1.048 47 A HN 0.997 9.147 8.150 0.000 0.000 0.464 48 R N -0.446 120.112 120.500 0.096 0.000 2.127 48 R HA -0.155 4.184 4.340 -0.001 0.000 0.238 48 R C 1.924 178.262 176.300 0.064 0.000 1.134 48 R CA 1.864 58.008 56.100 0.072 0.000 0.975 48 R CB -0.170 30.163 30.300 0.056 0.000 0.865 48 R HN 0.722 8.992 8.270 0.000 0.000 0.447 49 Q N -0.102 119.735 119.800 0.062 0.000 2.541 49 Q HA 0.140 4.479 4.340 -0.001 0.000 0.215 49 Q C -0.004 176.033 176.000 0.062 0.000 0.977 49 Q CA 0.670 56.506 55.803 0.055 0.000 0.934 49 Q CB -0.072 28.695 28.738 0.048 0.000 0.988 49 Q HN 0.285 8.555 8.270 0.000 0.000 0.521 50 A N 0.069 122.929 122.820 0.067 0.000 2.309 50 A HA 0.362 4.681 4.320 -0.001 0.000 0.298 50 A C 1.122 178.745 177.584 0.065 0.000 1.165 50 A CA -0.354 51.720 52.037 0.061 0.000 0.821 50 A CB 0.617 19.646 19.000 0.047 0.000 1.102 50 A HN 0.179 8.329 8.150 0.000 0.000 0.500 51 T N 1.189 115.793 114.554 0.084 0.000 2.680 51 T HA 0.020 4.369 4.350 -0.001 0.000 0.268 51 T C 0.838 175.578 174.700 0.066 0.000 1.033 51 T CA 2.208 64.380 62.100 0.119 0.000 1.152 51 T CB -0.269 68.698 68.868 0.165 0.000 0.859 51 T HN 1.573 9.813 8.240 0.000 0.000 0.452 52 A N -0.545 122.282 122.820 0.011 0.000 2.577 52 A HA 0.762 5.081 4.320 -0.001 0.000 0.297 52 A C -1.491 176.047 177.584 -0.076 0.000 1.060 52 A CA -0.295 51.725 52.037 -0.028 0.000 0.697 52 A CB 1.294 20.256 19.000 -0.063 0.000 1.281 52 A HN 0.594 8.744 8.150 0.000 0.000 0.402 53 A N 1.064 123.837 122.820 -0.079 0.000 2.437 53 A HA 0.743 5.062 4.320 -0.001 0.000 0.293 53 A C -1.159 176.348 177.584 -0.128 0.000 1.038 53 A CA -0.419 51.506 52.037 -0.187 0.000 0.708 53 A CB 1.284 20.240 19.000 -0.074 0.000 1.251 53 A HN 1.802 9.952 8.150 0.000 0.000 0.409 54 V N 2.273 122.044 119.914 -0.238 0.000 2.876 54 V HA 0.628 4.747 4.120 -0.001 0.000 0.312 54 V C -0.414 175.680 176.094 -0.000 0.000 1.085 54 V CA -0.730 61.531 62.300 -0.066 0.000 0.945 54 V CB 2.160 33.953 31.823 -0.050 0.000 1.017 54 V HN 0.894 9.084 8.190 0.000 0.000 0.428 55 M N 3.590 123.287 119.600 0.162 0.000 2.044 55 M HA 0.514 4.993 4.480 -0.001 0.000 0.333 55 M C -1.009 175.363 176.300 0.119 0.000 1.004 55 M CA -0.323 55.121 55.300 0.240 0.000 0.954 55 M CB 1.284 34.040 32.600 0.261 0.000 1.468 55 M HN 0.527 8.817 8.290 0.000 0.000 0.414 56 V N 2.696 122.666 119.914 0.094 0.000 2.532 56 V HA 0.698 4.817 4.120 -0.001 0.000 0.295 56 V C 0.093 176.218 176.094 0.051 0.000 1.041 56 V CA -0.492 61.844 62.300 0.060 0.000 0.926 56 V CB 1.847 33.705 31.823 0.058 0.000 0.992 56 V HN 0.894 9.084 8.190 0.000 0.000 0.457 57 S N 4.626 120.336 115.700 0.018 0.000 2.536 57 S HA 0.798 5.268 4.470 -0.001 0.000 0.271 57 S C -1.179 173.402 174.600 -0.032 0.000 1.134 57 S CA -0.674 57.527 58.200 0.002 0.000 0.897 57 S CB 1.593 64.795 63.200 0.003 0.000 1.094 57 S HN 0.785 9.095 8.310 0.000 0.000 0.473 58 M N 3.482 123.058 119.600 -0.040 0.000 2.206 58 M HA 0.319 4.798 4.480 -0.001 0.000 0.272 58 M C -1.359 174.864 176.300 -0.128 0.000 1.012 58 M CA -0.001 55.256 55.300 -0.072 0.000 0.986 58 M CB 1.099 33.676 32.600 -0.038 0.000 1.740 58 M HN 0.856 9.146 8.290 0.000 0.000 0.472 59 D N 3.918 124.237 120.400 -0.135 0.000 2.704 59 D HA -0.200 4.439 4.640 -0.001 0.000 0.232 59 D C -0.514 175.727 176.300 -0.098 0.000 1.183 59 D CA 2.411 56.324 54.000 -0.145 0.000 0.647 59 D CB -0.958 39.661 40.800 -0.302 0.000 1.013 59 D HN 1.016 9.386 8.370 0.000 0.000 0.415 60 D N -3.192 117.173 120.400 -0.058 0.000 2.697 60 D HA -0.230 4.409 4.640 -0.001 0.000 0.235 60 D C -0.733 175.549 176.300 -0.030 0.000 1.167 60 D CA 1.093 55.073 54.000 -0.033 0.000 0.656 60 D CB -1.675 39.113 40.800 -0.020 0.000 1.025 60 D HN 0.270 8.640 8.370 0.000 0.000 0.419 61 T N 0.119 114.653 114.554 -0.033 0.000 2.930 61 T HA 0.678 5.027 4.350 -0.001 0.000 0.313 61 T C -0.345 174.358 174.700 0.004 0.000 1.019 61 T CA -0.070 62.019 62.100 -0.019 0.000 1.004 61 T CB 1.407 70.257 68.868 -0.030 0.000 0.987 61 T HN 0.594 8.834 8.240 0.000 0.000 0.456 62 A N 3.396 126.228 122.820 0.020 0.000 2.318 62 A HA 0.830 5.149 4.320 -0.001 0.000 0.317 62 A C -0.436 177.189 177.584 0.068 0.000 1.159 62 A CA -0.613 51.452 52.037 0.047 0.000 0.799 62 A CB 0.926 19.957 19.000 0.052 0.000 1.194 62 A HN 0.634 8.784 8.150 0.000 0.000 0.479 63 V N 1.907 121.876 119.914 0.092 0.000 2.513 63 V HA 0.481 4.600 4.120 -0.001 0.000 0.299 63 V C -0.794 175.400 176.094 0.167 0.000 1.035 63 V CA -0.389 61.976 62.300 0.109 0.000 0.889 63 V CB 1.423 33.313 31.823 0.112 0.000 0.988 63 V HN 0.791 8.981 8.190 0.000 0.000 0.440 64 F N 5.371 125.326 119.950 0.009 0.000 2.311 64 F HA 0.663 5.189 4.527 -0.002 0.000 0.371 64 F C -0.251 175.556 175.800 0.011 0.000 1.083 64 F CA -0.631 57.378 58.000 0.015 0.000 1.113 64 F CB 0.873 39.884 39.000 0.019 0.000 1.349 64 F HN 0.287 8.587 8.300 0.000 0.000 0.470 65 V N 4.270 123.957 119.914 -0.378 0.000 2.686 65 V HA 0.530 4.649 4.120 -0.001 0.000 0.295 65 V C 0.264 176.015 176.094 -0.571 0.000 1.057 65 V CA -0.354 61.732 62.300 -0.357 0.000 1.012 65 V CB 1.514 33.230 31.823 -0.178 0.000 1.006 65 V HN 0.755 8.945 8.190 0.000 0.000 0.477 66 T N 2.707 117.036 114.554 -0.374 0.000 2.912 66 T HA 0.643 4.992 4.350 -0.001 0.000 0.299 66 T C -1.043 173.557 174.700 -0.167 0.000 1.052 66 T CA -0.322 61.598 62.100 -0.301 0.000 0.996 66 T CB 1.806 70.535 68.868 -0.231 0.000 1.070 66 T HN 0.428 8.668 8.240 0.000 0.000 0.465 67 V N 3.285 123.122 119.914 -0.127 0.000 2.577 67 V HA 0.681 4.800 4.120 -0.001 0.000 0.303 67 V C -0.699 175.378 176.094 -0.029 0.000 1.042 67 V CA -0.729 61.516 62.300 -0.091 0.000 0.872 67 V CB 1.850 33.595 31.823 -0.130 0.000 0.998 67 V HN 0.655 8.845 8.190 0.000 0.000 0.423 68 V N 3.219 123.134 119.914 0.002 0.000 2.577 68 V HA 0.886 5.005 4.120 -0.001 0.000 0.303 68 V C 0.289 176.438 176.094 0.092 0.000 1.042 68 V CA -0.091 62.245 62.300 0.058 0.000 0.872 68 V CB 2.169 34.022 31.823 0.050 0.000 0.998 68 V HN 1.019 9.209 8.190 0.000 0.000 0.423 69 G N 4.090 112.999 108.800 0.182 0.000 2.845 69 G HA2 0.555 4.514 3.960 -0.001 0.000 0.282 69 G HA3 0.555 4.514 3.960 -0.001 0.000 0.282 69 G C -0.220 174.883 174.900 0.340 0.000 1.546 69 G CA 0.304 45.548 45.100 0.238 0.000 1.089 69 G HN 0.995 9.285 8.290 0.000 0.000 0.558 70 Q N 2.117 122.054 119.800 0.228 0.000 2.174 70 Q HA -0.384 3.955 4.340 -0.001 0.000 0.427 70 Q C 1.169 177.255 176.000 0.144 0.000 0.692 70 Q CA 2.807 58.722 55.803 0.188 0.000 0.909 70 Q CB -0.910 27.965 28.738 0.228 0.000 3.026 70 Q HN 0.810 9.080 8.270 0.000 0.000 0.891 71 K N -2.162 118.311 120.400 0.122 0.000 1.960 71 K HA 0.225 4.544 4.320 -0.001 0.000 0.118 71 K C -0.263 176.334 176.600 -0.005 0.000 2.331 71 K CA 0.428 56.705 56.287 -0.018 0.000 1.182 71 K CB 0.429 32.901 32.500 -0.047 0.000 2.595 71 K HN 0.576 8.826 8.250 0.000 0.000 0.428 72 K N 1.331 121.762 120.400 0.051 0.000 2.523 72 K HA 0.667 4.987 4.320 -0.001 0.000 0.257 72 K C -1.175 175.466 176.600 0.069 0.000 0.932 72 K CA -0.252 56.069 56.287 0.058 0.000 0.812 72 K CB 2.494 35.010 32.500 0.027 0.000 1.326 72 K HN 0.255 8.505 8.250 0.000 0.000 0.433 73 A N 2.570 125.428 122.820 0.063 0.000 2.251 73 A HA 0.451 4.770 4.320 -0.001 0.000 0.278 73 A C -0.336 177.281 177.584 0.054 0.000 1.206 73 A CA -0.202 51.870 52.037 0.059 0.000 0.822 73 A CB 0.296 19.323 19.000 0.044 0.000 1.187 73 A HN 0.847 8.997 8.150 0.000 0.000 0.504 74 K N -1.027 119.409 120.400 0.059 0.000 2.092 74 K HA 0.540 4.859 4.320 -0.001 0.000 0.256 74 K C -2.684 173.946 176.600 0.049 0.000 1.041 74 K CA -1.621 54.697 56.287 0.052 0.000 1.070 74 K CB -1.278 31.257 32.500 0.059 0.000 1.707 74 K HN 0.297 8.547 8.250 0.000 0.000 0.750 75 P HA 0.037 4.457 4.420 0.000 0.000 0.264 75 P C -0.385 176.950 177.300 0.058 0.000 1.193 75 P CA 0.194 63.319 63.100 0.042 0.000 0.763 75 P CB 0.197 31.919 31.700 0.038 0.000 0.810 76 G N 3.074 111.906 108.800 0.053 0.000 2.624 76 G HA2 -0.102 3.858 3.960 -0.001 0.000 0.292 76 G HA3 -0.102 3.858 3.960 -0.001 0.000 0.292 76 G C 0.749 175.702 174.900 0.088 0.000 0.777 76 G CA -0.192 44.950 45.100 0.070 0.000 1.883 76 G HN 0.549 8.839 8.290 0.000 0.000 0.505 77 Q N 0.794 120.665 119.800 0.118 0.000 2.308 77 Q HA -0.108 4.231 4.340 -0.001 0.000 0.209 77 Q C 0.852 176.941 176.000 0.148 0.000 0.985 77 Q CA 1.071 56.951 55.803 0.128 0.000 0.881 77 Q CB 0.065 28.907 28.738 0.174 0.000 0.917 77 Q HN 0.790 9.060 8.270 0.000 0.000 0.443 78 D N -1.705 118.799 120.400 0.173 0.000 2.922 78 D HA -0.181 4.458 4.640 -0.001 0.000 0.252 78 D C -1.260 175.210 176.300 0.284 0.000 1.070 78 D CA 0.535 54.639 54.000 0.172 0.000 0.813 78 D CB -1.240 39.631 40.800 0.118 0.000 1.046 78 D HN 0.287 8.657 8.370 0.000 0.000 0.429 79 F N 0.734 120.741 119.950 0.095 0.000 2.773 79 F HA 0.580 5.106 4.527 -0.002 0.000 0.314 79 F C -2.292 173.631 175.800 0.205 0.000 1.160 79 F CA -1.275 56.794 58.000 0.116 0.000 0.920 79 F CB 1.155 40.197 39.000 0.070 0.000 1.323 79 F HN -0.042 8.258 8.300 0.000 0.000 0.457 80 F N 4.926 124.420 119.950 -0.759 0.000 2.430 80 F HA 0.562 5.088 4.527 -0.001 0.000 0.362 80 F C -2.692 172.587 175.800 -0.868 0.000 1.103 80 F CA -2.404 55.246 58.000 -0.583 0.000 1.045 80 F CB 1.426 40.237 39.000 -0.315 0.000 1.276 80 F HN 0.202 8.502 8.300 0.000 0.000 0.444 81 P HA 0.136 4.556 4.420 0.000 0.000 0.273 81 P C -1.105 175.818 177.300 -0.628 0.000 1.428 81 P CA 0.136 62.922 63.100 -0.524 0.000 0.995 81 P CB 0.602 32.220 31.700 -0.137 0.000 1.286 82 L N 4.221 124.919 121.223 -0.875 0.000 2.372 82 L HA 0.600 4.939 4.340 -0.001 0.000 0.274 82 L C -0.626 175.958 176.870 -0.476 0.000 0.988 82 L CA -0.302 54.010 54.840 -0.882 0.000 0.833 82 L CB 2.015 43.171 42.059 -1.504 0.000 1.236 82 L HN 0.284 8.514 8.230 0.000 0.000 0.410 83 T N 2.479 116.853 114.554 -0.300 0.000 2.876 83 T HA 0.731 5.080 4.350 -0.001 0.000 0.289 83 T C -0.955 173.662 174.700 -0.138 0.000 1.014 83 T CA -0.534 61.456 62.100 -0.183 0.000 0.986 83 T CB 2.053 70.852 68.868 -0.116 0.000 1.021 83 T HN 0.260 8.500 8.240 0.000 0.000 0.458 84 V N 3.882 123.737 119.914 -0.099 0.000 2.604 84 V HA 0.587 4.706 4.120 -0.001 0.000 0.305 84 V C -0.744 175.341 176.094 -0.015 0.000 1.043 84 V CA -1.036 61.229 62.300 -0.059 0.000 0.888 84 V CB 1.997 33.788 31.823 -0.053 0.000 0.995 84 V HN 0.949 9.139 8.190 0.000 0.000 0.429 85 N N 3.130 121.834 118.700 0.007 0.000 2.483 85 N HA 0.343 5.082 4.740 -0.001 0.000 0.267 85 N C -1.460 174.101 175.510 0.087 0.000 0.998 85 N CA -0.363 52.708 53.050 0.035 0.000 0.918 85 N CB 2.279 40.772 38.487 0.009 0.000 1.215 85 N HN 0.768 9.148 8.380 0.000 0.000 0.500 86 Y N 1.841 122.128 120.300 -0.021 0.000 2.341 86 Y HA 0.337 4.886 4.550 -0.002 0.000 0.337 86 Y C -0.806 175.088 175.900 -0.011 0.000 1.014 86 Y CA -0.380 57.711 58.100 -0.015 0.000 1.111 86 Y CB 1.099 39.550 38.460 -0.014 0.000 1.194 86 Y HN 0.370 8.650 8.280 0.000 0.000 0.462 87 Q N 4.408 123.886 119.800 -0.536 0.000 2.271 87 Q HA 0.278 4.618 4.340 -0.001 0.000 0.268 87 Q C -1.612 174.055 176.000 -0.555 0.000 1.021 87 Q CA -0.852 54.721 55.803 -0.384 0.000 0.802 87 Q CB 2.493 31.127 28.738 -0.173 0.000 1.282 87 Q HN 0.704 8.974 8.270 0.000 0.000 0.431 88 E N 2.756 122.707 120.200 -0.415 0.000 2.174 88 E HA 0.250 4.599 4.350 -0.001 0.000 0.282 88 E C -0.684 175.760 176.600 -0.260 0.000 0.992 88 E CA -0.682 55.517 56.400 -0.336 0.000 0.803 88 E CB 0.795 30.388 29.700 -0.178 0.000 1.090 88 E HN 0.355 8.715 8.360 0.000 0.000 0.396 89 R N 3.231 123.523 120.500 -0.345 0.000 2.357 89 R HA 0.139 4.478 4.340 -0.001 0.000 0.296 89 R C 0.757 176.815 176.300 -0.403 0.000 1.052 89 R CA -0.243 55.585 56.100 -0.452 0.000 0.988 89 R CB 1.018 30.727 30.300 -0.985 0.000 1.025 89 R HN 0.643 8.913 8.270 0.000 0.000 0.469 90 T N 1.927 116.324 114.554 -0.262 0.000 2.759 90 T HA -0.187 4.162 4.350 -0.001 0.000 0.269 90 T C 1.570 176.179 174.700 -0.152 0.000 1.042 90 T CA 1.875 63.884 62.100 -0.152 0.000 1.140 90 T CB -0.288 68.555 68.868 -0.042 0.000 0.864 90 T HN 0.738 8.978 8.240 0.000 0.000 0.455 91 Y N 0.992 121.281 120.300 -0.020 0.000 2.509 91 Y HA 0.445 4.993 4.550 -0.002 0.000 0.293 91 Y C 2.423 178.312 175.900 -0.019 0.000 1.133 91 Y CA -0.056 58.032 58.100 -0.019 0.000 1.283 91 Y CB -0.908 37.539 38.460 -0.023 0.000 1.001 91 Y HN 0.131 8.411 8.280 0.000 0.000 0.555 92 A N 1.607 124.093 122.820 -0.558 0.000 1.940 92 A HA -0.091 4.228 4.320 -0.001 0.000 0.219 92 A C 2.302 179.823 177.584 -0.106 0.000 1.176 92 A CA 1.891 53.747 52.037 -0.302 0.000 0.631 92 A CB -1.171 17.610 19.000 -0.365 0.000 0.814 92 A HN 0.659 8.809 8.150 0.000 0.000 0.446 93 A N -1.890 120.867 122.820 -0.104 0.000 2.307 93 A HA 0.442 4.761 4.320 -0.001 0.000 0.218 93 A C 1.632 179.213 177.584 -0.005 0.000 1.228 93 A CA 1.040 53.051 52.037 -0.042 0.000 0.857 93 A CB -0.958 18.015 19.000 -0.044 0.000 0.897 93 A HN 1.927 10.077 8.150 0.000 0.000 0.495 94 G N -0.207 108.607 108.800 0.023 0.000 2.176 94 G HA2 -0.250 3.709 3.960 -0.001 0.000 0.252 94 G HA3 -0.250 3.709 3.960 -0.001 0.000 0.252 94 G C 0.175 175.097 174.900 0.036 0.000 1.024 94 G CA 0.425 45.553 45.100 0.046 0.000 0.755 94 G HN 0.626 8.916 8.290 0.000 0.000 0.507 95 R N -1.072 119.447 120.500 0.032 0.000 2.828 95 R HA 0.749 5.088 4.340 -0.001 0.000 0.264 95 R C -0.086 176.238 176.300 0.039 0.000 1.022 95 R CA -0.977 55.137 56.100 0.024 0.000 1.021 95 R CB 1.449 31.752 30.300 0.005 0.000 1.163 95 R HN 0.204 8.474 8.270 0.000 0.000 0.494 96 I N 3.282 123.869 120.570 0.029 0.000 2.362 96 I HA 0.272 4.442 4.170 -0.001 0.000 0.289 96 I C -1.413 174.717 176.117 0.021 0.000 0.994 96 I CA -1.860 59.459 61.300 0.031 0.000 1.158 96 I CB 1.619 39.634 38.000 0.025 0.000 1.315 96 I HN 0.424 8.634 8.210 0.000 0.000 0.451 109 E N 0.175 120.396 120.200 0.034 0.000 3.440 109 E HA -0.278 4.071 4.350 -0.001 0.000 0.328 109 E C 0.747 177.375 176.600 0.046 0.000 1.514 109 E CA 1.506 57.930 56.400 0.041 0.000 1.926 109 E CB -1.390 28.339 29.700 0.047 0.000 1.874 109 E HN 0.539 8.899 8.360 0.000 0.000 0.471 110 G N -0.034 108.797 108.800 0.051 0.000 3.690 110 G HA2 0.198 4.157 3.960 -0.001 0.000 0.283 110 G HA3 0.198 4.157 3.960 -0.001 0.000 0.283 110 G C 0.646 175.578 174.900 0.054 0.000 1.057 110 G CA 0.256 45.382 45.100 0.043 0.000 0.821 110 G HN 0.288 8.578 8.290 0.000 0.000 0.526 111 E N 0.189 120.446 120.200 0.096 0.000 2.285 111 E HA -0.098 4.251 4.350 -0.001 0.000 0.194 111 E C 2.584 179.275 176.600 0.152 0.000 0.997 111 E CA 1.244 57.764 56.400 0.201 0.000 0.845 111 E CB 0.192 30.027 29.700 0.225 0.000 0.782 111 E HN 0.493 8.853 8.360 0.000 0.000 0.491 112 T N -1.092 113.508 114.554 0.077 0.000 3.055 112 T HA -0.023 4.326 4.350 -0.001 0.000 0.265 112 T C 1.701 176.408 174.700 0.011 0.000 1.111 112 T CA 0.193 62.320 62.100 0.045 0.000 1.118 112 T CB 0.050 68.934 68.868 0.027 0.000 0.909 112 T HN -0.046 8.194 8.240 0.000 0.000 0.501 113 L N 0.172 121.395 121.223 0.001 0.000 2.179 113 L HA 0.385 4.724 4.340 -0.001 0.000 0.208 113 L C 2.065 178.896 176.870 -0.065 0.000 1.096 113 L CA 0.954 55.781 54.840 -0.021 0.000 0.779 113 L CB -0.527 41.524 42.059 -0.013 0.000 0.922 113 L HN 0.258 8.488 8.230 0.000 0.000 0.443 114 I N -0.869 119.625 120.570 -0.127 0.000 2.761 114 I HA -0.062 4.107 4.170 -0.001 0.000 0.261 114 I C 2.368 178.360 176.117 -0.207 0.000 1.198 114 I CA 0.969 62.105 61.300 -0.273 0.000 1.482 114 I CB -0.717 36.883 38.000 -0.666 0.000 1.100 114 I HN 0.123 8.333 8.210 0.000 0.000 0.445 115 A N 0.028 122.801 122.820 -0.078 0.000 2.119 115 A HA -0.052 4.267 4.320 -0.001 0.000 0.217 115 A C 2.337 179.899 177.584 -0.037 0.000 1.153 115 A CA 0.848 52.877 52.037 -0.013 0.000 0.692 115 A CB -0.316 18.707 19.000 0.039 0.000 0.799 115 A HN 0.168 8.318 8.150 0.000 0.000 0.458 116 R N -0.449 120.024 120.500 -0.045 0.000 2.127 116 R HA 0.136 4.475 4.340 -0.001 0.000 0.217 116 R C 1.598 177.877 176.300 -0.037 0.000 1.074 116 R CA 0.739 56.818 56.100 -0.035 0.000 0.991 116 R CB -0.419 29.868 30.300 -0.021 0.000 0.895 116 R HN 0.572 8.842 8.270 0.000 0.000 0.450 117 L N 0.014 121.204 121.223 -0.055 0.000 2.478 117 L HA 0.021 4.360 4.340 -0.001 0.000 0.223 117 L C 1.955 178.805 176.870 -0.034 0.000 1.140 117 L CA 0.586 55.398 54.840 -0.046 0.000 0.842 117 L CB -0.076 41.943 42.059 -0.067 0.000 0.953 117 L HN 0.087 8.317 8.230 0.000 0.000 0.452 118 I N -0.963 119.583 120.570 -0.039 0.000 2.810 118 I HA -0.155 4.014 4.170 -0.001 0.000 0.262 118 I C 2.240 178.351 176.117 -0.009 0.000 1.131 118 I CA 0.680 61.968 61.300 -0.019 0.000 1.453 118 I CB -0.079 37.907 38.000 -0.022 0.000 1.161 118 I HN 0.199 8.409 8.210 0.000 0.000 0.444 119 D N 1.444 121.827 120.400 -0.028 0.000 2.117 119 D HA -0.169 4.470 4.640 -0.001 0.000 0.198 119 D C 2.247 178.537 176.300 -0.016 0.000 0.982 119 D CA 1.199 55.175 54.000 -0.041 0.000 0.828 119 D CB 0.174 40.933 40.800 -0.068 0.000 0.967 119 D HN 0.196 8.566 8.370 0.000 0.000 0.464 120 R N 0.275 120.769 120.500 -0.011 0.000 2.097 120 R HA -0.134 4.205 4.340 -0.001 0.000 0.236 120 R C -0.459 175.855 176.300 0.023 0.000 1.135 120 R CA 1.922 58.022 56.100 0.001 0.000 0.934 120 R CB -1.554 28.744 30.300 -0.004 0.000 0.846 120 R HN 0.387 8.657 8.270 0.000 0.000 0.431 121 P HA -0.061 4.359 4.420 0.000 0.000 0.236 121 P C 1.100 178.461 177.300 0.102 0.000 1.177 121 P CA 1.135 64.261 63.100 0.044 0.000 0.773 121 P CB 0.003 31.721 31.700 0.029 0.000 0.878 122 I N -3.953 116.712 120.570 0.158 0.000 3.939 122 I HA 0.311 4.480 4.170 -0.001 0.000 0.313 122 I C 2.516 178.883 176.117 0.418 0.000 1.274 122 I CA 0.112 61.614 61.300 0.338 0.000 1.301 122 I CB -0.680 37.538 38.000 0.364 0.000 1.105 122 I HN -0.347 7.863 8.210 0.000 0.000 0.427 123 R N 2.152 122.782 120.500 0.216 0.000 2.091 123 R HA -0.044 4.295 4.340 -0.001 0.000 0.238 123 R C -0.556 175.912 176.300 0.281 0.000 1.136 123 R CA 2.047 58.251 56.100 0.173 0.000 0.959 123 R CB -1.274 29.031 30.300 0.008 0.000 0.856 123 R HN 0.360 8.630 8.270 0.000 0.000 0.437 124 P HA -0.037 4.383 4.420 0.000 0.000 0.245 124 P C 0.660 178.016 177.300 0.094 0.000 1.212 124 P CA 0.828 64.009 63.100 0.134 0.000 0.774 124 P CB 0.105 31.848 31.700 0.071 0.000 0.999 125 L N -1.703 119.584 121.223 0.107 0.000 2.591 125 L HA 0.183 4.522 4.340 -0.001 0.000 0.228 125 L C 0.594 177.332 176.870 -0.220 0.000 1.133 125 L CA -0.081 54.658 54.840 -0.169 0.000 0.880 125 L CB -0.407 41.372 42.059 -0.468 0.000 1.033 125 L HN -0.160 8.070 8.230 0.000 0.000 0.450 126 F N 2.001 121.901 119.950 -0.083 0.000 2.411 126 F HA 0.292 4.818 4.527 -0.001 0.000 0.350 126 F C -1.479 174.232 175.800 -0.148 0.000 1.114 126 F CA -2.893 55.009 58.000 -0.164 0.000 1.135 126 F CB 0.370 39.260 39.000 -0.182 0.000 1.120 126 F HN -0.154 8.146 8.300 0.000 0.000 0.495 127 P HA -0.094 4.326 4.420 0.000 0.000 0.263 127 P C 0.013 177.406 177.300 0.154 0.000 1.175 127 P CA 0.002 63.138 63.100 0.061 0.000 0.761 127 P CB 0.702 32.473 31.700 0.118 0.000 0.794 131 V N 4.056 123.721 119.914 -0.414 0.000 3.265 131 V HA 0.220 4.339 4.120 -0.001 0.000 0.346 131 V C -0.430 175.637 176.094 -0.045 0.000 1.447 131 V CA -0.374 61.866 62.300 -0.100 0.000 1.179 131 V CB 0.340 32.173 31.823 0.016 0.000 1.103 131 V HN 0.647 8.837 8.190 0.000 0.000 0.530 132 N N 2.732 121.310 118.700 -0.203 0.000 2.455 132 N HA 0.276 5.015 4.740 -0.001 0.000 0.280 132 N C 0.076 175.769 175.510 0.304 0.000 1.055 132 N CA -0.249 52.818 53.050 0.029 0.000 0.961 132 N CB 1.777 40.256 38.487 -0.015 0.000 1.121 132 N HN 0.670 9.050 8.380 0.000 0.000 0.476 133 E N 0.371 120.721 120.200 0.251 0.000 2.373 133 E HA 0.312 4.661 4.350 -0.001 0.000 0.267 133 E C -0.840 175.897 176.600 0.230 0.000 1.032 133 E CA -0.502 56.039 56.400 0.235 0.000 0.889 133 E CB 0.778 30.543 29.700 0.107 0.000 0.984 133 E HN 0.059 8.419 8.360 0.000 0.000 0.425 134 V N 2.585 122.576 119.914 0.129 0.000 2.735 134 V HA 0.312 4.431 4.120 -0.001 0.000 0.310 134 V C -0.611 175.442 176.094 -0.070 0.000 1.061 134 V CA -0.834 61.496 62.300 0.050 0.000 0.913 134 V CB 1.635 33.481 31.823 0.040 0.000 1.005 134 V HN 0.816 9.006 8.190 0.000 0.000 0.428 135 Q N 2.376 122.151 119.800 -0.042 0.000 2.303 135 Q HA 0.608 4.947 4.340 -0.001 0.000 0.267 135 Q C -1.782 174.179 176.000 -0.065 0.000 1.011 135 Q CA -0.322 55.443 55.803 -0.064 0.000 0.740 135 Q CB 2.125 30.844 28.738 -0.032 0.000 1.250 135 Q HN 0.632 8.902 8.270 0.000 0.000 0.458 136 V N 5.813 125.675 119.914 -0.087 0.000 2.439 136 V HA 0.496 4.615 4.120 -0.001 0.000 0.282 136 V C -0.160 175.898 176.094 -0.060 0.000 1.039 136 V CA -0.307 61.942 62.300 -0.085 0.000 0.913 136 V CB 1.379 33.144 31.823 -0.096 0.000 0.983 136 V HN 0.700 8.890 8.190 0.000 0.000 0.460 137 I N 4.249 124.781 120.570 -0.064 0.000 2.497 137 I HA 0.606 4.775 4.170 -0.001 0.000 0.284 137 I C 0.043 176.131 176.117 -0.048 0.000 1.060 137 I CA -0.434 60.843 61.300 -0.038 0.000 1.071 137 I CB 1.750 39.735 38.000 -0.025 0.000 1.216 137 I HN 0.644 8.854 8.210 0.000 0.000 0.442 138 A N 3.728 126.548 122.820 0.001 0.000 2.292 138 A HA 0.762 5.081 4.320 -0.001 0.000 0.319 138 A C -0.108 177.446 177.584 -0.051 0.000 1.206 138 A CA -0.459 51.587 52.037 0.015 0.000 0.835 138 A CB 1.162 20.255 19.000 0.154 0.000 1.164 138 A HN 0.595 8.745 8.150 0.000 0.000 0.505 139 T N 2.201 116.737 114.554 -0.030 0.000 2.906 139 T HA 0.456 4.805 4.350 -0.001 0.000 0.302 139 T C -0.738 173.921 174.700 -0.067 0.000 1.002 139 T CA -0.387 61.667 62.100 -0.077 0.000 0.988 139 T CB 0.167 69.065 68.868 0.050 0.000 0.972 139 T HN 0.576 8.816 8.240 0.000 0.000 0.447 140 V N 6.061 125.845 119.914 -0.216 0.000 2.479 140 V HA 0.188 4.307 4.120 -0.001 0.000 0.281 140 V C 1.339 177.347 176.094 -0.144 0.000 1.031 140 V CA 0.021 62.239 62.300 -0.137 0.000 1.038 140 V CB 1.102 32.822 31.823 -0.172 0.000 0.981 140 V HN 0.804 8.994 8.190 0.000 0.000 0.478 141 V N 3.897 123.786 119.914 -0.042 0.000 3.645 141 V HA 0.346 4.465 4.120 -0.001 0.000 0.275 141 V C 0.658 176.764 176.094 0.020 0.000 1.356 141 V CA 1.060 63.367 62.300 0.012 0.000 1.051 141 V CB 0.982 32.888 31.823 0.139 0.000 0.828 141 V HN 0.863 9.053 8.190 0.000 0.000 0.441 142 S N -0.880 114.811 115.700 -0.015 0.000 2.535 142 S HA 0.720 5.189 4.470 -0.001 0.000 0.272 142 S C -1.495 173.091 174.600 -0.023 0.000 1.149 142 S CA -0.391 57.807 58.200 -0.003 0.000 0.888 142 S CB 1.963 65.182 63.200 0.032 0.000 1.110 142 S HN 0.051 8.361 8.310 0.000 0.000 0.463 143 V N 3.981 123.879 119.914 -0.027 0.000 2.841 143 V HA 0.650 4.769 4.120 -0.001 0.000 0.310 143 V C -0.847 175.234 176.094 -0.020 0.000 1.090 143 V CA -0.968 61.317 62.300 -0.025 0.000 0.930 143 V CB 2.157 33.960 31.823 -0.033 0.000 1.014 143 V HN 0.863 9.053 8.190 0.000 0.000 0.425 144 N N 4.871 123.557 118.700 -0.023 0.000 2.442 144 N HA 0.441 5.180 4.740 -0.001 0.000 0.274 144 N C -1.593 173.905 175.510 -0.021 0.000 1.002 144 N CA -2.245 50.789 53.050 -0.027 0.000 0.910 144 N CB 2.763 41.222 38.487 -0.047 0.000 1.244 144 N HN 0.318 8.698 8.380 0.000 0.000 0.492 145 P HA -0.178 4.242 4.420 0.000 0.000 0.222 145 P C 0.525 177.825 177.300 0.000 0.000 1.142 145 P CA 1.228 64.326 63.100 -0.003 0.000 0.788 145 P CB 0.623 32.324 31.700 -0.000 0.000 0.767 146 Q N -0.531 119.265 119.800 -0.007 0.000 2.204 146 Q HA 0.071 4.410 4.340 -0.001 0.000 0.198 146 Q C 0.794 176.794 176.000 -0.001 0.000 0.946 146 Q CA 0.670 56.475 55.803 0.003 0.000 0.859 146 Q CB -0.004 28.739 28.738 0.008 0.000 0.946 146 Q HN 0.195 8.465 8.270 0.000 0.000 0.474 147 V N 3.044 122.931 119.914 -0.044 0.000 2.304 147 V HA 0.120 4.239 4.120 -0.001 0.000 0.262 147 V C 0.165 176.249 176.094 -0.017 0.000 1.061 147 V CA -0.587 61.675 62.300 -0.064 0.000 0.872 147 V CB 0.015 31.726 31.823 -0.186 0.000 1.077 147 V HN 0.263 8.453 8.190 0.000 0.000 0.480 148 N N 7.172 125.880 118.700 0.014 0.000 2.365 148 N HA 0.033 4.772 4.740 -0.001 0.000 0.265 148 N C -1.110 174.425 175.510 0.042 0.000 1.288 148 N CA -1.002 52.065 53.050 0.028 0.000 0.869 148 N CB 1.142 39.645 38.487 0.028 0.000 1.071 148 N HN 0.357 8.737 8.380 0.000 0.000 0.480 149 P HA -0.127 4.293 4.420 0.000 0.000 0.226 149 P C 0.468 177.837 177.300 0.115 0.000 1.153 149 P CA 0.775 63.944 63.100 0.115 0.000 0.777 149 P CB 0.112 31.914 31.700 0.169 0.000 0.794 150 D N 1.691 122.105 120.400 0.024 0.000 2.104 150 D HA -0.197 4.442 4.640 -0.001 0.000 0.194 150 D C 1.838 178.115 176.300 -0.038 0.000 0.994 150 D CA 1.254 55.188 54.000 -0.110 0.000 0.830 150 D CB -1.221 39.482 40.800 -0.163 0.000 0.959 150 D HN 0.193 8.563 8.370 0.000 0.000 0.452 151 I N -0.442 120.140 120.570 0.020 0.000 2.761 151 I HA -0.043 4.126 4.170 -0.001 0.000 0.261 151 I C 2.008 178.180 176.117 0.092 0.000 1.198 151 I CA 0.404 61.740 61.300 0.059 0.000 1.482 151 I CB -1.206 36.851 38.000 0.094 0.000 1.100 151 I HN -0.065 8.145 8.210 0.000 0.000 0.445 152 V N 2.453 122.422 119.914 0.092 0.000 2.515 152 V HA -0.118 4.001 4.120 -0.001 0.000 0.250 152 V C 3.157 179.310 176.094 0.097 0.000 1.058 152 V CA 1.717 64.077 62.300 0.101 0.000 1.064 152 V CB -1.260 30.614 31.823 0.085 0.000 0.675 152 V HN 0.576 8.766 8.190 0.000 0.000 0.461 153 A N -0.748 122.136 122.820 0.106 0.000 2.016 153 A HA -0.077 4.242 4.320 -0.001 0.000 0.217 153 A C 2.203 179.826 177.584 0.065 0.000 1.162 153 A CA 1.450 53.558 52.037 0.118 0.000 0.662 153 A CB -0.359 18.782 19.000 0.236 0.000 0.812 153 A HN 0.479 8.629 8.150 0.000 0.000 0.450 154 M N -0.577 119.052 119.600 0.048 0.000 2.099 154 M HA -0.041 4.438 4.480 -0.001 0.000 0.262 154 M C 1.970 178.301 176.300 0.052 0.000 1.067 154 M CA 1.483 56.806 55.300 0.039 0.000 1.124 154 M CB -0.483 32.142 32.600 0.040 0.000 1.353 154 M HN 0.368 8.658 8.290 0.000 0.000 0.410 155 I N -0.063 120.554 120.570 0.079 0.000 2.208 155 I HA -0.213 3.957 4.170 -0.001 0.000 0.245 155 I C 2.578 178.727 176.117 0.053 0.000 1.097 155 I CA 1.431 62.784 61.300 0.088 0.000 1.363 155 I CB -1.020 37.062 38.000 0.136 0.000 1.051 155 I HN 0.385 8.595 8.210 0.000 0.000 0.413 156 G N 0.555 109.378 108.800 0.040 0.000 2.421 156 G HA2 -0.246 3.714 3.960 -0.001 0.000 0.216 156 G HA3 -0.246 3.714 3.960 -0.001 0.000 0.216 156 G C 1.875 176.747 174.900 -0.047 0.000 1.171 156 G CA 0.799 45.899 45.100 0.000 0.000 0.775 156 G HN 0.492 8.782 8.290 0.000 0.000 0.543 157 A N 0.333 123.128 122.820 -0.041 0.000 1.978 157 A HA -0.020 4.299 4.320 -0.001 0.000 0.220 157 A C 2.603 180.108 177.584 -0.132 0.000 1.170 157 A CA 2.328 54.313 52.037 -0.087 0.000 0.636 157 A CB -0.651 18.318 19.000 -0.052 0.000 0.810 157 A HN 0.411 8.561 8.150 0.000 0.000 0.448 158 S N -0.688 114.983 115.700 -0.049 0.000 2.338 158 S HA 0.025 4.494 4.470 -0.001 0.000 0.218 158 S C 2.266 176.841 174.600 -0.042 0.000 1.032 158 S CA 1.457 59.653 58.200 -0.007 0.000 0.999 158 S CB -0.499 62.740 63.200 0.065 0.000 0.905 158 S HN 0.804 9.114 8.310 0.000 0.000 0.439 159 A N 1.632 124.436 122.820 -0.026 0.000 1.858 159 A HA 0.123 4.442 4.320 -0.001 0.000 0.216 159 A C 2.464 180.001 177.584 -0.078 0.000 1.190 159 A CA 2.068 54.089 52.037 -0.026 0.000 0.617 159 A CB -1.529 17.474 19.000 0.006 0.000 0.827 159 A HN 0.735 8.885 8.150 0.000 0.000 0.443 160 A N -0.312 122.440 122.820 -0.114 0.000 1.892 160 A HA -0.137 4.182 4.320 -0.001 0.000 0.218 160 A C 2.201 179.660 177.584 -0.209 0.000 1.188 160 A CA 1.717 53.664 52.037 -0.150 0.000 0.631 160 A CB -0.731 18.164 19.000 -0.174 0.000 0.822 160 A HN 0.490 8.640 8.150 0.000 0.000 0.447 161 L N -0.497 120.525 121.223 -0.335 0.000 2.131 161 L HA -0.151 4.188 4.340 -0.001 0.000 0.210 161 L C 2.836 179.463 176.870 -0.405 0.000 1.092 161 L CA 1.307 55.813 54.840 -0.556 0.000 0.759 161 L CB -0.339 40.999 42.059 -1.200 0.000 0.903 161 L HN 0.353 8.583 8.230 0.000 0.000 0.435 162 S N 0.057 115.637 115.700 -0.199 0.000 2.355 162 S HA -0.106 4.363 4.470 -0.001 0.000 0.222 162 S C 1.941 176.497 174.600 -0.072 0.000 1.031 162 S CA 1.130 59.305 58.200 -0.042 0.000 0.993 162 S CB -0.223 62.982 63.200 0.009 0.000 0.859 162 S HN 0.288 8.598 8.310 0.000 0.000 0.453 163 L N 1.378 122.556 121.223 -0.075 0.000 2.056 163 L HA -0.017 4.322 4.340 -0.001 0.000 0.207 163 L C 0.912 177.748 176.870 -0.057 0.000 1.078 163 L CA 0.366 55.179 54.840 -0.045 0.000 0.749 163 L CB -0.698 41.342 42.059 -0.032 0.000 0.901 163 L HN 0.129 8.359 8.230 0.000 0.000 0.433 164 S N 0.353 115.983 115.700 -0.117 0.000 2.560 164 S HA 0.167 4.636 4.470 -0.001 0.000 0.284 164 S C 1.078 175.551 174.600 -0.211 0.000 1.327 164 S CA 0.024 58.134 58.200 -0.150 0.000 1.055 164 S CB 1.360 64.391 63.200 -0.281 0.000 0.868 164 S HN 0.373 8.683 8.310 0.000 0.000 0.506 165 G N 1.463 110.122 108.800 -0.236 0.000 3.042 165 G HA2 0.195 4.154 3.960 -0.001 0.000 0.212 165 G HA3 0.195 4.154 3.960 -0.001 0.000 0.212 165 G C 0.329 174.811 174.900 -0.695 0.000 1.166 165 G CA -0.437 44.508 45.100 -0.259 0.000 0.767 165 G HN 0.691 8.981 8.290 0.000 0.000 0.546 166 I N 1.668 121.590 120.570 -1.079 0.000 2.906 166 I HA 0.004 4.173 4.170 -0.001 0.000 0.302 166 I C -1.851 173.781 176.117 -0.809 0.000 1.220 166 I CA -1.197 59.306 61.300 -1.329 0.000 1.441 166 I CB 0.573 37.968 38.000 -1.008 0.000 1.336 166 I HN -0.074 8.136 8.210 0.000 0.000 0.565 167 P HA -0.095 4.325 4.420 0.000 0.000 0.250 167 P C -0.883 175.961 177.300 -0.761 0.000 1.161 167 P CA 0.724 63.506 63.100 -0.530 0.000 0.863 167 P CB -0.221 31.220 31.700 -0.431 0.000 0.827 168 F N 3.791 123.293 119.950 -0.747 0.000 2.671 168 F HA 0.322 4.848 4.527 -0.001 0.000 0.332 168 F C -0.319 175.202 175.800 -0.466 0.000 1.189 168 F CA -1.216 56.278 58.000 -0.842 0.000 0.988 168 F CB 0.827 39.343 39.000 -0.806 0.000 1.258 168 F HN 0.008 8.308 8.300 0.000 0.000 0.471 169 N N 4.848 123.056 118.700 -0.820 0.000 2.374 169 N HA 0.212 4.951 4.740 -0.001 0.000 0.269 169 N C 0.959 176.028 175.510 -0.734 0.000 1.310 169 N CA 1.359 54.050 53.050 -0.597 0.000 0.877 169 N CB 0.602 38.833 38.487 -0.427 0.000 1.096 169 N HN 1.060 9.440 8.380 0.000 0.000 0.484 170 G N 4.043 112.593 108.800 -0.415 0.000 2.602 170 G HA2 -0.267 3.692 3.960 -0.001 0.000 0.317 170 G HA3 -0.267 3.692 3.960 -0.001 0.000 0.317 170 G C -2.740 172.019 174.900 -0.234 0.000 1.327 170 G CA -0.175 44.759 45.100 -0.277 0.000 0.971 170 G HN 0.540 8.830 8.290 0.000 0.000 0.540 171 P HA 0.603 5.023 4.420 0.000 0.000 0.327 171 P C -0.564 176.732 177.300 -0.006 0.000 1.460 171 P CA -0.731 62.386 63.100 0.028 0.000 1.255 171 P CB 1.762 33.469 31.700 0.011 0.000 1.836 172 I N -1.369 119.243 120.570 0.070 0.000 2.822 172 I HA 0.962 5.131 4.170 -0.001 0.000 0.312 172 I C 0.138 176.279 176.117 0.041 0.000 1.011 172 I CA -0.753 60.570 61.300 0.038 0.000 1.105 172 I CB 1.974 40.016 38.000 0.068 0.000 1.291 172 I HN 0.342 8.552 8.210 0.000 0.000 0.474 173 G N 1.307 110.128 108.800 0.036 0.000 3.016 173 G HA2 0.851 4.810 3.960 -0.001 0.000 0.270 173 G HA3 0.851 4.810 3.960 -0.001 0.000 0.270 173 G C -1.555 173.395 174.900 0.082 0.000 1.352 173 G CA -0.675 44.453 45.100 0.047 0.000 1.060 173 G HN 1.107 9.397 8.290 0.000 0.000 0.538 174 A N -1.712 121.188 122.820 0.133 0.000 2.540 174 A HA 0.888 5.207 4.320 -0.001 0.000 0.297 174 A C -0.709 177.011 177.584 0.226 0.000 1.056 174 A CA 0.172 52.296 52.037 0.145 0.000 0.700 174 A CB 1.286 20.361 19.000 0.125 0.000 1.280 174 A HN 2.292 10.442 8.150 0.000 0.000 0.398 175 A N 1.625 124.551 122.820 0.177 0.000 2.517 175 A HA 0.821 5.140 4.320 -0.001 0.000 0.297 175 A C -0.583 177.080 177.584 0.132 0.000 1.050 175 A CA -0.501 51.652 52.037 0.194 0.000 0.694 175 A CB 1.247 20.392 19.000 0.243 0.000 1.277 175 A HN 1.247 9.397 8.150 0.000 0.000 0.400 176 R N 1.546 122.110 120.500 0.106 0.000 2.532 176 R HA 0.751 5.090 4.340 -0.001 0.000 0.295 176 R C -1.720 174.638 176.300 0.098 0.000 0.968 176 R CA -0.321 55.828 56.100 0.083 0.000 0.916 176 R CB 1.516 31.848 30.300 0.054 0.000 1.124 176 R HN 0.499 8.769 8.270 0.000 0.000 0.463 177 V N 3.481 123.450 119.914 0.092 0.000 2.531 177 V HA 0.573 4.692 4.120 -0.001 0.000 0.301 177 V C 0.389 176.514 176.094 0.052 0.000 1.034 177 V CA -0.593 61.753 62.300 0.078 0.000 0.865 177 V CB 1.639 33.534 31.823 0.121 0.000 0.995 177 V HN 1.012 9.202 8.190 0.000 0.000 0.424 178 G N 2.154 110.961 108.800 0.010 0.000 2.705 178 G HA2 0.637 4.596 3.960 -0.001 0.000 0.299 178 G HA3 0.637 4.596 3.960 -0.001 0.000 0.299 178 G C -2.029 172.884 174.900 0.021 0.000 1.315 178 G CA -0.556 44.555 45.100 0.018 0.000 1.045 178 G HN 0.516 8.806 8.290 0.000 0.000 0.517 179 Y N -0.522 119.685 120.300 -0.156 0.000 2.361 179 Y HA 0.639 5.188 4.550 -0.002 0.000 0.328 179 Y C -0.699 175.106 175.900 -0.159 0.000 1.044 179 Y CA -0.815 57.145 58.100 -0.234 0.000 1.085 179 Y CB 1.563 39.872 38.460 -0.252 0.000 1.194 179 Y HN 0.380 8.660 8.280 0.000 0.000 0.438 180 I N 4.965 125.356 120.570 -0.299 0.000 2.692 180 I HA 0.236 4.405 4.170 -0.001 0.000 0.293 180 I C -0.489 175.468 176.117 -0.268 0.000 1.200 180 I CA -1.066 60.120 61.300 -0.190 0.000 1.036 180 I CB 2.106 40.032 38.000 -0.123 0.000 1.258 180 I HN 0.642 8.852 8.210 0.000 0.000 0.421 181 N N 4.278 122.870 118.700 -0.180 0.000 2.710 181 N HA -0.219 4.520 4.740 -0.001 0.000 0.249 181 N C -0.411 174.937 175.510 -0.270 0.000 1.059 181 N CA 1.402 54.352 53.050 -0.167 0.000 0.720 181 N CB -0.789 37.622 38.487 -0.127 0.000 0.983 181 N HN 0.847 9.227 8.380 0.000 0.000 0.544 182 D N -1.300 118.850 120.400 -0.416 0.000 2.981 182 D HA -0.188 4.451 4.640 -0.001 0.000 0.223 182 D C -0.087 175.567 176.300 -1.076 0.000 1.151 182 D CA 1.391 54.990 54.000 -0.667 0.000 0.827 182 D CB -0.801 39.873 40.800 -0.209 0.000 1.101 182 D HN 0.759 9.129 8.370 0.000 0.000 0.426 183 Q N -0.907 118.182 119.800 -1.186 0.000 2.377 183 Q HA 0.424 4.763 4.340 -0.001 0.000 0.279 183 Q C -0.578 174.930 176.000 -0.820 0.000 1.049 183 Q CA -0.936 54.325 55.803 -0.904 0.000 0.825 183 Q CB 0.902 29.423 28.738 -0.362 0.000 1.401 183 Q HN 0.032 8.302 8.270 0.000 0.000 0.404 184 Y N 0.261 120.285 120.300 -0.459 0.000 2.805 184 Y HA 0.177 4.726 4.550 -0.002 0.000 0.337 184 Y C 0.282 175.746 175.900 -0.727 0.000 1.252 184 Y CA 0.121 57.825 58.100 -0.661 0.000 1.515 184 Y CB 0.450 38.209 38.460 -1.168 0.000 1.305 184 Y HN 0.304 8.584 8.280 0.000 0.000 0.600 185 V N 4.850 124.507 119.914 -0.428 0.000 2.709 185 V HA 0.243 4.362 4.120 -0.001 0.000 0.308 185 V C -0.533 175.543 176.094 -0.030 0.000 1.062 185 V CA -1.189 61.005 62.300 -0.176 0.000 0.901 185 V CB 2.216 33.971 31.823 -0.112 0.000 1.003 185 V HN 0.591 8.781 8.190 0.000 0.000 0.425 186 L N 4.601 125.912 121.223 0.147 0.000 2.305 186 L HA 0.444 4.783 4.340 -0.001 0.000 0.281 186 L C 0.274 177.128 176.870 -0.027 0.000 1.085 186 L CA -0.129 54.805 54.840 0.157 0.000 0.813 186 L CB 0.976 43.133 42.059 0.162 0.000 1.157 186 L HN 0.893 9.123 8.230 0.000 0.000 0.436 187 N N 3.502 122.182 118.700 -0.034 0.000 2.696 187 N HA -0.153 4.586 4.740 -0.001 0.000 0.271 187 N C -2.268 173.235 175.510 -0.012 0.000 0.997 187 N CA 0.263 53.290 53.050 -0.038 0.000 0.801 187 N CB -1.124 37.299 38.487 -0.107 0.000 0.913 187 N HN 0.436 8.816 8.380 0.000 0.000 0.557 188 P HA -0.006 4.414 4.420 0.000 0.000 0.268 188 P C 0.706 178.030 177.300 0.040 0.000 1.208 188 P CA 0.043 63.146 63.100 0.004 0.000 0.777 188 P CB 0.495 32.194 31.700 -0.002 0.000 0.875 189 T N -0.973 113.610 114.554 0.048 0.000 2.726 189 T HA -0.005 4.344 4.350 -0.001 0.000 0.294 189 T C 1.334 176.056 174.700 0.038 0.000 1.013 189 T CA 0.017 62.154 62.100 0.063 0.000 0.996 189 T CB 0.230 69.136 68.868 0.062 0.000 1.016 189 T HN 0.273 8.513 8.240 0.000 0.000 0.529 190 Q N 0.420 120.240 119.800 0.033 0.000 2.226 190 Q HA -0.070 4.269 4.340 -0.001 0.000 0.204 190 Q C 1.367 177.380 176.000 0.021 0.000 0.975 190 Q CA 2.065 57.883 55.803 0.025 0.000 0.866 190 Q CB -0.328 28.423 28.738 0.022 0.000 0.915 190 Q HN 0.922 9.192 8.270 0.000 0.000 0.440 191 D N -2.089 118.323 120.400 0.020 0.000 2.398 191 D HA -0.005 4.635 4.640 -0.001 0.000 0.210 191 D C 0.905 177.211 176.300 0.011 0.000 1.094 191 D CA 0.083 54.092 54.000 0.015 0.000 0.839 191 D CB -0.144 40.663 40.800 0.013 0.000 0.963 191 D HN 0.285 8.655 8.370 0.000 0.000 0.506 192 E N 0.128 120.335 120.200 0.012 0.000 2.299 192 E HA 0.117 4.466 4.350 -0.001 0.000 0.193 192 E C 1.741 178.342 176.600 0.002 0.000 0.998 192 E CA 0.057 56.458 56.400 0.003 0.000 0.851 192 E CB 0.178 29.879 29.700 0.001 0.000 0.795 192 E HN 0.282 8.642 8.360 0.000 0.000 0.492 193 L N 0.849 122.078 121.223 0.010 0.000 2.376 193 L HA -0.121 4.218 4.340 -0.001 0.000 0.219 193 L C 2.047 178.925 176.870 0.013 0.000 1.133 193 L CA 0.790 55.638 54.840 0.013 0.000 0.816 193 L CB -0.038 42.032 42.059 0.019 0.000 0.933 193 L HN 0.019 8.249 8.230 0.000 0.000 0.449 194 K N -0.278 120.129 120.400 0.011 0.000 2.148 194 K HA -0.122 4.197 4.320 -0.001 0.000 0.204 194 K C 1.557 178.161 176.600 0.007 0.000 1.050 194 K CA 0.865 57.158 56.287 0.010 0.000 0.942 194 K CB 0.093 32.599 32.500 0.009 0.000 0.724 194 K HN 0.239 8.489 8.250 0.000 0.000 0.446 195 E N 0.497 120.698 120.200 0.002 0.000 2.447 195 E HA 0.022 4.371 4.350 -0.001 0.000 0.195 195 E C 0.416 177.018 176.600 0.003 0.000 1.028 195 E CA 0.124 56.523 56.400 -0.002 0.000 0.876 195 E CB 0.422 30.115 29.700 -0.013 0.000 0.885 195 E HN -0.016 8.344 8.360 0.000 0.000 0.500 196 S N 0.675 116.380 115.700 0.008 0.000 2.565 196 S HA 0.150 4.619 4.470 -0.001 0.000 0.276 196 S C 0.787 175.407 174.600 0.034 0.000 1.326 196 S CA -0.307 57.908 58.200 0.024 0.000 1.045 196 S CB 0.807 64.019 63.200 0.020 0.000 0.918 196 S HN -0.051 8.259 8.310 0.000 0.000 0.505 197 K N 2.888 123.324 120.400 0.060 0.000 2.358 197 K HA 0.377 4.697 4.320 -0.001 0.000 0.197 197 K C -0.157 176.435 176.600 -0.014 0.000 1.025 197 K CA 0.046 56.344 56.287 0.018 0.000 1.104 197 K CB 0.318 32.822 32.500 0.006 0.000 0.855 197 K HN 0.442 8.691 8.250 0.000 0.000 0.531 198 L N 0.580 121.814 121.223 0.019 0.000 2.409 198 L HA 0.408 4.747 4.340 -0.001 0.000 0.262 198 L C -1.935 174.952 176.870 0.028 0.000 0.992 198 L CA -0.589 54.256 54.840 0.009 0.000 0.817 198 L CB 2.312 44.382 42.059 0.019 0.000 1.350 198 L HN -0.004 8.226 8.230 0.000 0.000 0.411 199 D N 4.487 124.902 120.400 0.025 0.000 2.616 199 D HA 0.413 5.052 4.640 -0.001 0.000 0.238 199 D C -1.963 174.357 176.300 0.032 0.000 1.354 199 D CA -0.219 53.798 54.000 0.029 0.000 0.970 199 D CB 2.293 43.108 40.800 0.024 0.000 1.369 199 D HN 0.487 8.857 8.370 0.000 0.000 0.585 200 L N 3.506 124.755 121.223 0.044 0.000 2.493 200 L HA 0.569 4.908 4.340 -0.001 0.000 0.265 200 L C -2.032 174.870 176.870 0.053 0.000 0.954 200 L CA -0.514 54.354 54.840 0.046 0.000 0.844 200 L CB 2.033 44.127 42.059 0.058 0.000 1.302 200 L HN 0.116 8.346 8.230 0.000 0.000 0.405 201 V N 5.230 125.169 119.914 0.041 0.000 2.495 201 V HA 0.676 4.795 4.120 -0.001 0.000 0.298 201 V C -0.540 175.575 176.094 0.035 0.000 1.031 201 V CA -0.452 61.873 62.300 0.042 0.000 0.871 201 V CB 1.975 33.814 31.823 0.026 0.000 0.988 201 V HN 0.560 8.750 8.190 0.000 0.000 0.432 202 V N 3.317 123.259 119.914 0.048 0.000 2.789 202 V HA 0.954 5.074 4.120 -0.001 0.000 0.311 202 V C -0.068 176.039 176.094 0.021 0.000 1.073 202 V CA -0.559 61.753 62.300 0.021 0.000 0.921 202 V CB 1.863 33.702 31.823 0.026 0.000 1.009 202 V HN 1.022 9.212 8.190 0.000 0.000 0.426 203 A N 2.212 125.020 122.820 -0.019 0.000 2.475 203 A HA 1.065 5.384 4.320 -0.001 0.000 0.301 203 A C -0.151 177.386 177.584 -0.078 0.000 1.059 203 A CA 0.020 52.049 52.037 -0.013 0.000 0.710 203 A CB 2.140 21.145 19.000 0.009 0.000 1.288 203 A HN 1.729 9.879 8.150 0.000 0.000 0.408 204 G N -0.460 108.296 108.800 -0.073 0.000 2.430 204 G HA2 0.666 4.625 3.960 -0.001 0.000 0.300 204 G HA3 0.666 4.625 3.960 -0.001 0.000 0.300 204 G C -0.389 174.478 174.900 -0.054 0.000 1.330 204 G CA 0.346 45.368 45.100 -0.130 0.000 0.813 204 G HN 1.547 9.837 8.290 0.000 0.000 0.487 205 T N -2.395 112.131 114.554 -0.048 0.000 2.884 205 T HA 0.507 4.856 4.350 -0.001 0.000 0.277 205 T C 1.486 176.237 174.700 0.085 0.000 0.976 205 T CA 0.647 62.736 62.100 -0.019 0.000 0.956 205 T CB 1.663 70.486 68.868 -0.074 0.000 1.113 205 T HN 0.877 9.117 8.240 0.000 0.000 0.554 206 E N 0.534 120.744 120.200 0.017 0.000 2.171 206 E HA -0.145 4.204 4.350 -0.001 0.000 0.197 206 E C 2.034 178.646 176.600 0.019 0.000 0.997 206 E CA 1.363 57.764 56.400 0.000 0.000 0.810 206 E CB -0.579 29.090 29.700 -0.050 0.000 0.738 206 E HN 0.678 9.038 8.360 0.000 0.000 0.467 207 A N 0.979 123.817 122.820 0.031 0.000 1.911 207 A HA 0.529 4.848 4.320 -0.001 0.000 0.212 207 A C 1.308 178.956 177.584 0.105 0.000 1.189 207 A CA 0.846 52.901 52.037 0.030 0.000 0.639 207 A CB 0.048 19.041 19.000 -0.011 0.000 0.839 207 A HN 0.428 8.578 8.150 0.000 0.000 0.449 208 A N -1.719 121.164 122.820 0.105 0.000 2.594 208 A HA 0.605 4.924 4.320 -0.001 0.000 0.291 208 A C -0.851 176.611 177.584 -0.205 0.000 1.105 208 A CA -0.409 51.662 52.037 0.056 0.000 0.694 208 A CB 0.728 19.719 19.000 -0.015 0.000 1.291 208 A HN 0.370 8.520 8.150 0.000 0.000 0.410 209 V N 1.469 121.169 119.914 -0.356 0.000 2.649 209 V HA 0.263 4.382 4.120 -0.001 0.000 0.292 209 V C 0.740 176.709 176.094 -0.208 0.000 1.055 209 V CA 0.111 62.142 62.300 -0.448 0.000 1.023 209 V CB 1.131 32.736 31.823 -0.364 0.000 0.992 209 V HN 0.777 8.967 8.190 0.000 0.000 0.480 210 L N 3.605 124.731 121.223 -0.161 0.000 2.653 210 L HA 0.408 4.748 4.340 -0.001 0.000 0.230 210 L C 0.203 177.039 176.870 -0.057 0.000 1.055 210 L CA 0.278 55.065 54.840 -0.087 0.000 0.880 210 L CB 0.315 42.337 42.059 -0.063 0.000 1.195 210 L HN 0.725 8.955 8.230 0.000 0.000 0.492 211 M N -0.253 119.312 119.600 -0.058 0.000 2.421 211 M HA 0.717 5.196 4.480 -0.001 0.000 0.287 211 M C -1.715 174.567 176.300 -0.030 0.000 1.183 211 M CA -0.448 54.833 55.300 -0.032 0.000 0.916 211 M CB 2.527 35.119 32.600 -0.013 0.000 1.701 211 M HN -0.253 8.037 8.290 0.000 0.000 0.470 212 V N 1.653 121.557 119.914 -0.015 0.000 2.760 212 V HA 0.769 4.888 4.120 -0.001 0.000 0.309 212 V C -1.312 174.788 176.094 0.010 0.000 1.077 212 V CA -0.295 62.001 62.300 -0.006 0.000 0.910 212 V CB 1.962 33.775 31.823 -0.016 0.000 1.008 212 V HN 0.932 9.122 8.190 0.000 0.000 0.424 213 E N 2.575 122.783 120.200 0.013 0.000 2.279 213 E HA 0.651 5.000 4.350 -0.001 0.000 0.252 213 E C -0.924 175.688 176.600 0.020 0.000 0.894 213 E CA -0.133 56.277 56.400 0.018 0.000 0.785 213 E CB 1.643 31.349 29.700 0.011 0.000 1.237 213 E HN 0.765 9.125 8.360 0.000 0.000 0.418 214 S N 3.073 118.786 115.700 0.023 0.000 2.600 214 S HA 0.699 5.168 4.470 -0.001 0.000 0.300 214 S C -0.710 173.901 174.600 0.017 0.000 1.087 214 S CA -1.062 57.151 58.200 0.021 0.000 0.965 214 S CB 1.942 65.154 63.200 0.021 0.000 1.089 214 S HN 0.502 8.812 8.310 0.000 0.000 0.496 215 E N 0.059 120.267 120.200 0.014 0.000 2.292 215 E HA 0.690 5.039 4.350 -0.001 0.000 0.272 215 E C -1.406 175.195 176.600 0.002 0.000 0.881 215 E CA -0.917 55.490 56.400 0.011 0.000 0.754 215 E CB 1.700 31.410 29.700 0.017 0.000 1.201 215 E HN 0.905 9.265 8.360 0.000 0.000 0.425 216 A N 3.466 126.282 122.820 -0.008 0.000 2.594 216 A HA 0.385 4.705 4.320 -0.001 0.000 0.291 216 A C -1.091 176.473 177.584 -0.033 0.000 1.105 216 A CA -0.693 51.326 52.037 -0.030 0.000 0.694 216 A CB 1.989 20.959 19.000 -0.050 0.000 1.291 216 A HN 0.628 8.778 8.150 0.000 0.000 0.410 217 Q N 0.864 120.634 119.800 -0.050 0.000 3.135 217 Q HA 0.541 4.880 4.340 -0.001 0.000 0.344 217 Q C -0.751 175.216 176.000 -0.056 0.000 1.321 217 Q CA -0.064 55.712 55.803 -0.045 0.000 1.050 217 Q CB -0.721 27.994 28.738 -0.038 0.000 1.498 217 Q HN 0.651 8.921 8.270 0.000 0.000 0.503 218 L N 0.560 121.754 121.223 -0.049 0.000 3.634 218 L HA -0.288 4.052 4.340 -0.001 0.000 0.423 218 L C -0.641 176.189 176.870 -0.066 0.000 1.253 218 L CA 0.209 55.022 54.840 -0.046 0.000 0.885 218 L CB -1.837 40.200 42.059 -0.037 0.000 1.789 218 L HN 0.472 8.702 8.230 0.000 0.000 0.904 219 L N -0.491 120.675 121.223 -0.095 0.000 2.421 219 L HA 0.457 4.796 4.340 -0.001 0.000 0.263 219 L C 1.255 178.069 176.870 -0.093 0.000 1.122 219 L CA -0.059 54.695 54.840 -0.143 0.000 0.804 219 L CB 1.392 43.299 42.059 -0.253 0.000 1.150 219 L HN 0.396 8.626 8.230 0.000 0.000 0.457 220 S N -0.027 115.620 115.700 -0.088 0.000 2.593 220 S HA 0.060 4.529 4.470 -0.001 0.000 0.269 220 S C 0.779 175.362 174.600 -0.029 0.000 1.334 220 S CA -0.542 57.632 58.200 -0.043 0.000 1.015 220 S CB 1.222 64.404 63.200 -0.030 0.000 0.912 220 S HN 0.629 8.939 8.310 0.000 0.000 0.541 221 E N 1.234 121.430 120.200 -0.007 0.000 2.130 221 E HA -0.136 4.213 4.350 -0.001 0.000 0.196 221 E C 1.323 177.925 176.600 0.003 0.000 0.998 221 E CA 2.014 58.415 56.400 0.001 0.000 0.806 221 E CB -0.375 29.331 29.700 0.010 0.000 0.738 221 E HN 0.830 9.190 8.360 0.000 0.000 0.459 222 D N -0.413 119.994 120.400 0.012 0.000 2.084 222 D HA -0.112 4.527 4.640 -0.001 0.000 0.196 222 D C 1.893 178.235 176.300 0.071 0.000 0.985 222 D CA 1.004 55.024 54.000 0.034 0.000 0.826 222 D CB 0.005 40.831 40.800 0.042 0.000 0.978 222 D HN 0.165 8.535 8.370 0.000 0.000 0.456 223 Q N -0.451 119.377 119.800 0.047 0.000 2.112 223 Q HA -0.177 4.162 4.340 -0.001 0.000 0.206 223 Q C 1.851 177.921 176.000 0.116 0.000 0.987 223 Q CA 0.996 56.832 55.803 0.055 0.000 0.858 223 Q CB -0.097 28.511 28.738 -0.217 0.000 0.905 223 Q HN 0.304 8.574 8.270 0.000 0.000 0.420 224 M N -0.246 119.367 119.600 0.021 0.000 2.446 224 M HA -0.082 4.397 4.480 -0.001 0.000 0.263 224 M C 1.795 178.119 176.300 0.040 0.000 1.066 224 M CA 1.139 56.455 55.300 0.026 0.000 1.087 224 M CB -0.429 32.166 32.600 -0.007 0.000 1.406 224 M HN 0.264 8.554 8.290 0.000 0.000 0.459 225 L N -1.554 119.691 121.223 0.038 0.000 2.470 225 L HA 0.137 4.476 4.340 -0.001 0.000 0.219 225 L C 2.143 178.986 176.870 -0.045 0.000 1.071 225 L CA 0.249 55.084 54.840 -0.009 0.000 0.850 225 L CB -0.321 41.725 42.059 -0.022 0.000 1.040 225 L HN 0.290 8.520 8.230 0.000 0.000 0.475 226 G N -0.676 108.110 108.800 -0.024 0.000 2.559 226 G HA2 -0.150 3.809 3.960 -0.001 0.000 0.216 226 G HA3 -0.150 3.809 3.960 -0.001 0.000 0.216 226 G C 1.516 175.849 174.900 -0.945 0.000 1.126 226 G CA 0.777 45.688 45.100 -0.314 0.000 0.778 226 G HN 0.449 8.739 8.290 0.000 0.000 0.543 227 A N 0.147 122.733 122.820 -0.390 0.000 1.878 227 A HA 0.215 4.535 4.320 -0.001 0.000 0.213 227 A C 2.503 180.069 177.584 -0.030 0.000 1.192 227 A CA 1.357 53.298 52.037 -0.160 0.000 0.619 227 A CB -0.377 18.753 19.000 0.216 0.000 0.837 227 A HN 0.195 8.345 8.150 0.000 0.000 0.446 228 V N -0.146 119.757 119.914 -0.018 0.000 2.427 228 V HA -0.189 3.930 4.120 -0.001 0.000 0.248 228 V C 2.459 178.578 176.094 0.042 0.000 1.051 228 V CA 1.939 64.244 62.300 0.009 0.000 1.048 228 V CB -0.730 31.078 31.823 -0.026 0.000 0.666 228 V HN 0.335 8.525 8.190 0.000 0.000 0.456 229 V N -0.738 119.180 119.914 0.007 0.000 2.488 229 V HA -0.149 3.970 4.120 -0.001 0.000 0.246 229 V C 2.097 178.212 176.094 0.034 0.000 1.046 229 V CA 1.762 64.082 62.300 0.033 0.000 1.053 229 V CB -0.665 31.145 31.823 -0.021 0.000 0.679 229 V HN 0.538 8.728 8.190 0.000 0.000 0.458 230 F N 2.471 122.310 119.950 -0.184 0.000 2.046 230 F HA -0.106 4.420 4.527 -0.001 0.000 0.297 230 F C 2.236 178.019 175.800 -0.029 0.000 1.123 230 F CA 2.068 59.971 58.000 -0.161 0.000 1.199 230 F CB -0.953 37.865 39.000 -0.302 0.000 0.972 230 F HN 0.147 8.447 8.300 0.000 0.000 0.474 231 G N -1.590 107.438 108.800 0.379 0.000 2.432 231 G HA2 -0.303 3.656 3.960 -0.001 0.000 0.219 231 G HA3 -0.303 3.656 3.960 -0.001 0.000 0.219 231 G C 1.659 176.664 174.900 0.175 0.000 1.135 231 G CA 0.990 46.262 45.100 0.285 0.000 0.767 231 G HN 0.644 8.934 8.290 0.000 0.000 0.550 232 H N 0.328 119.408 119.070 0.016 0.000 2.389 232 H HA 0.033 4.588 4.556 -0.001 0.000 0.299 232 H C 2.367 177.661 175.328 -0.056 0.000 1.081 232 H CA 1.129 57.166 56.048 -0.018 0.000 1.345 232 H CB 0.255 29.997 29.762 -0.033 0.000 1.393 232 H HN 0.455 8.735 8.280 0.000 0.000 0.520 233 E N 0.026 120.176 120.200 -0.083 0.000 2.208 233 E HA -0.136 4.213 4.350 -0.001 0.000 0.193 233 E C 2.234 178.740 176.600 -0.157 0.000 0.988 233 E CA 0.430 56.708 56.400 -0.203 0.000 0.828 233 E CB 0.213 29.772 29.700 -0.235 0.000 0.763 233 E HN 0.558 8.918 8.360 0.000 0.000 0.478 234 Q N 0.563 120.294 119.800 -0.116 0.000 2.187 234 Q HA -0.101 4.238 4.340 -0.001 0.000 0.199 234 Q C 1.984 178.032 176.000 0.081 0.000 0.957 234 Q CA 0.975 56.771 55.803 -0.012 0.000 0.857 234 Q CB -0.045 28.712 28.738 0.031 0.000 0.929 234 Q HN 0.453 8.723 8.270 0.000 0.000 0.453 235 Q N 0.357 120.212 119.800 0.092 0.000 2.226 235 Q HA -0.155 4.184 4.340 -0.001 0.000 0.204 235 Q C 1.935 177.885 176.000 -0.083 0.000 0.975 235 Q CA 0.705 56.537 55.803 0.048 0.000 0.866 235 Q CB -0.036 28.765 28.738 0.106 0.000 0.915 235 Q HN 0.243 8.513 8.270 0.000 0.000 0.440 236 Q N 0.318 120.070 119.800 -0.080 0.000 2.197 236 Q HA -0.177 4.162 4.340 -0.001 0.000 0.211 236 Q C 2.240 178.117 176.000 -0.205 0.000 0.993 236 Q CA 1.262 56.986 55.803 -0.131 0.000 0.883 236 Q CB -0.687 27.968 28.738 -0.138 0.000 0.916 236 Q HN 0.305 8.575 8.270 0.000 0.000 0.418 237 V N 0.040 119.805 119.914 -0.247 0.000 2.287 237 V HA -0.246 3.873 4.120 -0.001 0.000 0.248 237 V C 2.474 178.193 176.094 -0.626 0.000 1.053 237 V CA 1.613 63.690 62.300 -0.371 0.000 1.027 237 V CB -0.743 30.891 31.823 -0.314 0.000 0.646 237 V HN 0.124 8.314 8.190 0.000 0.000 0.447 238 V N 0.192 119.749 119.914 -0.595 0.000 2.233 238 V HA -0.309 3.810 4.120 -0.001 0.000 0.247 238 V C 2.201 178.068 176.094 -0.377 0.000 1.050 238 V CA 2.602 64.579 62.300 -0.537 0.000 1.010 238 V CB -0.615 31.076 31.823 -0.220 0.000 0.637 238 V HN 0.466 8.656 8.190 0.000 0.000 0.444 239 I N -0.413 120.018 120.570 -0.231 0.000 2.194 239 I HA -0.387 3.782 4.170 -0.001 0.000 0.246 239 I C 2.657 178.662 176.117 -0.186 0.000 1.093 239 I CA 1.872 63.079 61.300 -0.155 0.000 1.355 239 I CB -0.591 37.346 38.000 -0.105 0.000 1.046 239 I HN 0.378 8.588 8.210 0.000 0.000 0.413 240 Q N 0.593 120.247 119.800 -0.243 0.000 2.084 240 Q HA -0.180 4.159 4.340 -0.001 0.000 0.202 240 Q C 2.043 177.899 176.000 -0.241 0.000 0.978 240 Q CA 1.534 57.204 55.803 -0.223 0.000 0.844 240 Q CB -0.142 28.454 28.738 -0.237 0.000 0.898 240 Q HN 0.548 8.818 8.270 0.000 0.000 0.426 241 N N 0.021 118.486 118.700 -0.392 0.000 2.331 241 N HA -0.086 4.653 4.740 -0.001 0.000 0.180 241 N C 1.553 176.971 175.510 -0.153 0.000 1.019 241 N CA 0.740 53.586 53.050 -0.341 0.000 0.881 241 N CB 0.175 38.221 38.487 -0.735 0.000 0.972 241 N HN 0.217 8.597 8.380 0.000 0.000 0.435 242 I N 1.920 122.403 120.570 -0.145 0.000 2.233 242 I HA -0.143 4.026 4.170 -0.001 0.000 0.243 242 I C 1.921 178.011 176.117 -0.044 0.000 1.093 242 I CA 0.924 62.193 61.300 -0.052 0.000 1.380 242 I CB -1.054 36.925 38.000 -0.036 0.000 1.067 242 I HN 0.086 8.296 8.210 0.000 0.000 0.413 243 N N 0.695 119.356 118.700 -0.064 0.000 2.166 243 N HA -0.201 4.538 4.740 -0.001 0.000 0.186 243 N C 1.785 177.269 175.510 -0.043 0.000 1.019 243 N CA 0.904 53.924 53.050 -0.050 0.000 0.856 243 N CB -0.192 38.258 38.487 -0.062 0.000 0.993 243 N HN 0.358 8.738 8.380 0.000 0.000 0.426 244 E N 1.238 121.404 120.200 -0.055 0.000 2.204 244 E HA -0.121 4.228 4.350 -0.001 0.000 0.195 244 E C 1.868 178.458 176.600 -0.017 0.000 0.990 244 E CA 0.377 56.754 56.400 -0.039 0.000 0.821 244 E CB -0.018 29.651 29.700 -0.052 0.000 0.750 244 E HN 0.358 8.718 8.360 0.000 0.000 0.477 245 L N -0.275 120.941 121.223 -0.011 0.000 2.354 245 L HA -0.012 4.327 4.340 -0.001 0.000 0.212 245 L C 2.077 178.951 176.870 0.007 0.000 1.091 245 L CA 0.260 55.106 54.840 0.010 0.000 0.828 245 L CB 0.205 42.281 42.059 0.028 0.000 0.973 245 L HN -0.098 8.132 8.230 0.000 0.000 0.461 246 V N 0.088 120.000 119.914 -0.003 0.000 2.515 246 V HA -0.227 3.892 4.120 -0.001 0.000 0.250 246 V C 2.423 178.518 176.094 0.002 0.000 1.058 246 V CA 1.628 63.927 62.300 -0.002 0.000 1.064 246 V CB -0.550 31.267 31.823 -0.010 0.000 0.675 246 V HN 0.393 8.583 8.190 0.000 0.000 0.461 247 K N 0.012 120.410 120.400 -0.003 0.000 2.025 247 K HA -0.174 4.145 4.320 -0.001 0.000 0.207 247 K C 2.255 178.859 176.600 0.007 0.000 1.049 247 K CA 1.621 57.908 56.287 0.000 0.000 0.933 247 K CB -0.137 32.359 32.500 -0.006 0.000 0.714 247 K HN 0.461 8.711 8.250 0.000 0.000 0.438 248 E N -0.855 119.350 120.200 0.008 0.000 2.150 248 E HA -0.131 4.218 4.350 -0.001 0.000 0.193 248 E C 1.084 177.694 176.600 0.018 0.000 0.985 248 E CA 1.181 57.589 56.400 0.013 0.000 0.814 248 E CB 0.235 29.945 29.700 0.016 0.000 0.752 248 E HN 0.340 8.700 8.360 0.000 0.000 0.466 249 A N -0.217 122.614 122.820 0.019 0.000 2.591 249 A HA 0.291 4.610 4.320 -0.001 0.000 0.204 249 A C 0.899 178.497 177.584 0.023 0.000 1.410 249 A CA 0.219 52.270 52.037 0.023 0.000 1.065 249 A CB 0.408 19.424 19.000 0.026 0.000 1.362 249 A HN 0.198 8.348 8.150 0.000 0.000 0.566 250 G N 1.175 109.986 108.800 0.018 0.000 2.353 250 G HA2 0.337 4.296 3.960 -0.001 0.000 0.239 250 G HA3 0.337 4.296 3.960 -0.001 0.000 0.239 250 G C 0.032 174.950 174.900 0.031 0.000 1.295 250 G CA 0.028 45.138 45.100 0.017 0.000 0.884 250 G HN 0.441 8.731 8.290 0.000 0.000 0.537 251 K N 2.289 122.715 120.400 0.043 0.000 2.180 251 K HA 0.170 4.489 4.320 -0.001 0.000 0.251 251 K C -2.110 174.546 176.600 0.094 0.000 1.014 251 K CA -1.079 55.253 56.287 0.076 0.000 0.913 251 K CB 0.368 32.933 32.500 0.109 0.000 1.008 251 K HN 0.282 8.532 8.250 0.000 0.000 0.490 252 P HA 0.012 4.432 4.420 0.000 0.000 0.264 252 P C -0.631 176.799 177.300 0.216 0.000 1.193 252 P CA 0.047 63.231 63.100 0.140 0.000 0.763 252 P CB 0.441 32.219 31.700 0.131 0.000 0.810 253 R N 3.120 123.712 120.500 0.152 0.000 2.449 253 R HA 0.051 4.390 4.340 -0.001 0.000 0.296 253 R C -0.077 176.409 176.300 0.310 0.000 1.047 253 R CA 0.098 56.285 56.100 0.144 0.000 1.018 253 R CB 0.137 30.482 30.300 0.074 0.000 0.962 253 R HN 0.520 8.790 8.270 0.000 0.000 0.428 254 W N 1.965 123.311 121.300 0.076 0.000 2.150 254 W HA 0.102 4.761 4.660 -0.002 0.000 0.341 254 W C 0.581 177.202 176.519 0.169 0.000 1.276 254 W CA -0.603 56.813 57.345 0.119 0.000 1.238 254 W CB -0.097 29.453 29.460 0.151 0.000 1.128 254 W HN 0.468 8.648 8.180 0.000 0.000 0.581 255 D N 0.051 120.698 120.400 0.410 0.000 2.217 255 D HA 0.510 5.149 4.640 -0.001 0.000 0.248 255 D C -1.604 174.962 176.300 0.444 0.000 1.008 255 D CA 0.113 54.312 54.000 0.332 0.000 0.914 255 D CB 1.005 41.914 40.800 0.181 0.000 1.182 255 D HN 0.340 8.710 8.370 0.000 0.000 0.451 256 W N 2.235 123.622 121.300 0.144 0.000 4.427 256 W HA 0.183 4.842 4.660 -0.001 0.000 0.241 256 W C -2.258 174.322 176.519 0.102 0.000 1.315 256 W CA -0.370 57.054 57.345 0.130 0.000 1.359 256 W CB -0.542 29.060 29.460 0.236 0.000 1.074 256 W HN 0.369 8.549 8.180 0.000 0.000 0.548 257 Q N 6.200 125.716 119.800 -0.474 0.000 2.456 257 Q HA 0.661 5.000 4.340 -0.001 0.000 0.283 257 Q C -2.361 172.995 176.000 -1.073 0.000 1.084 257 Q CA -1.745 53.679 55.803 -0.631 0.000 0.801 257 Q CB 3.585 32.164 28.738 -0.265 0.000 1.434 257 Q HN 0.288 8.558 8.270 0.000 0.000 0.419 258 P HA 0.223 4.643 4.420 0.000 0.000 0.285 258 P C -0.814 176.261 177.300 -0.375 0.000 1.280 258 P CA -0.529 62.085 63.100 -0.810 0.000 0.862 258 P CB 1.085 32.284 31.700 -0.835 0.000 1.153 259 E N 0.738 120.789 120.200 -0.248 0.000 2.552 259 E HA -0.004 4.345 4.350 -0.001 0.000 0.269 259 E C -1.543 174.995 176.600 -0.103 0.000 1.287 259 E CA -0.336 55.982 56.400 -0.137 0.000 1.120 259 E CB -1.576 28.075 29.700 -0.082 0.000 1.010 259 E HN 0.478 8.838 8.360 0.000 0.000 0.489 323 I N -2.572 118.012 120.570 0.024 0.000 3.888 323 I HA 0.279 4.448 4.170 -0.001 0.000 0.268 323 I C 0.258 176.391 176.117 0.026 0.000 1.118 323 I CA 0.848 62.162 61.300 0.023 0.000 1.352 323 I CB -1.383 36.630 38.000 0.021 0.000 1.742 323 I HN 0.217 8.427 8.210 0.000 0.000 0.415 324 E N 5.150 125.368 120.200 0.031 0.000 3.645 324 E HA -0.252 4.097 4.350 -0.001 0.000 0.326 324 E C 1.081 177.701 176.600 0.032 0.000 0.836 324 E CA 1.154 57.576 56.400 0.036 0.000 1.038 324 E CB -0.282 29.443 29.700 0.042 0.000 1.043 324 E HN 0.621 8.981 8.360 0.000 0.000 0.507 325 K N 3.555 123.976 120.400 0.034 0.000 2.009 325 K HA -0.384 3.935 4.320 -0.001 0.000 0.210 325 K C 1.288 177.905 176.600 0.027 0.000 1.049 325 K CA 1.989 58.293 56.287 0.029 0.000 0.929 325 K CB -0.824 31.694 32.500 0.031 0.000 0.714 325 K HN 0.765 9.015 8.250 0.000 0.000 0.440 326 N N 0.004 118.722 118.700 0.030 0.000 2.647 326 N HA -0.284 4.455 4.740 -0.001 0.000 0.233 326 N C 1.196 176.720 175.510 0.023 0.000 0.751 326 N CA 2.229 55.296 53.050 0.028 0.000 1.820 326 N CB -1.276 37.227 38.487 0.026 0.000 0.904 326 N HN 0.216 8.596 8.380 0.000 0.000 0.584 327 V N -0.235 119.692 119.914 0.021 0.000 2.343 327 V HA -0.138 3.981 4.120 -0.001 0.000 0.247 327 V C 1.869 177.973 176.094 0.017 0.000 1.051 327 V CA 2.333 64.644 62.300 0.018 0.000 1.036 327 V CB -0.207 31.626 31.823 0.016 0.000 0.654 327 V HN 0.366 8.556 8.190 0.000 0.000 0.451 328 V N -0.059 119.867 119.914 0.019 0.000 2.878 328 V HA 0.090 4.209 4.120 -0.001 0.000 0.250 328 V C 2.515 178.620 176.094 0.019 0.000 1.075 328 V CA 1.317 63.627 62.300 0.018 0.000 1.096 328 V CB -0.851 30.984 31.823 0.019 0.000 0.724 328 V HN 0.397 8.587 8.190 0.000 0.000 0.467 329 R N 0.181 120.694 120.500 0.023 0.000 2.313 329 R HA 0.152 4.491 4.340 -0.001 0.000 0.199 329 R C 1.483 177.797 176.300 0.024 0.000 0.958 329 R CA 0.638 56.753 56.100 0.025 0.000 1.047 329 R CB 0.139 30.457 30.300 0.030 0.000 0.955 329 R HN 0.504 8.774 8.270 0.000 0.000 0.481 330 S N -0.678 115.034 115.700 0.020 0.000 2.663 330 S HA 0.115 4.585 4.470 -0.001 0.000 0.247 330 S C 1.318 175.926 174.600 0.013 0.000 1.074 330 S CA -0.368 57.842 58.200 0.017 0.000 0.955 330 S CB 0.622 63.831 63.200 0.016 0.000 0.901 330 S HN 0.386 8.696 8.310 0.000 0.000 0.505 331 R N 1.158 121.665 120.500 0.012 0.000 2.276 331 R HA 0.289 4.628 4.340 -0.001 0.000 0.196 331 R C 1.784 178.089 176.300 0.009 0.000 0.961 331 R CA 0.306 56.411 56.100 0.009 0.000 1.024 331 R CB -0.873 29.432 30.300 0.008 0.000 0.940 331 R HN 0.243 8.513 8.270 0.000 0.000 0.480 332 V N 1.727 121.649 119.914 0.013 0.000 2.439 332 V HA -0.112 4.008 4.120 -0.001 0.000 0.253 332 V C 0.649 176.751 176.094 0.014 0.000 1.074 332 V CA 1.406 63.715 62.300 0.015 0.000 1.076 332 V CB -0.171 31.664 31.823 0.021 0.000 0.664 332 V HN 0.165 8.355 8.190 0.000 0.000 0.461 333 L N 0.938 122.168 121.223 0.011 0.000 2.278 333 L HA 0.487 4.827 4.340 -0.001 0.000 0.287 333 L C 1.071 177.939 176.870 -0.004 0.000 1.072 333 L CA 0.706 55.548 54.840 0.004 0.000 0.819 333 L CB -0.693 41.367 42.059 0.003 0.000 1.176 333 L HN 0.457 8.687 8.230 0.000 0.000 0.435 334 A N 3.021 125.835 122.820 -0.010 0.000 2.596 334 A HA -0.071 4.248 4.320 -0.001 0.000 0.300 334 A C 0.885 178.465 177.584 -0.007 0.000 1.495 334 A CA 1.004 53.034 52.037 -0.013 0.000 0.769 334 A CB -1.904 17.085 19.000 -0.019 0.000 1.047 334 A HN 0.976 9.126 8.150 0.000 0.000 0.436 335 G N -1.808 106.990 108.800 -0.003 0.000 2.630 335 G HA2 0.577 4.537 3.960 -0.001 0.000 0.296 335 G HA3 0.577 4.537 3.960 -0.001 0.000 0.296 335 G C 0.292 175.192 174.900 -0.001 0.000 1.285 335 G CA 0.456 45.555 45.100 -0.001 0.000 0.958 335 G HN 0.486 8.776 8.290 0.000 0.000 0.479 336 E N 0.042 120.241 120.200 -0.001 0.000 2.058 336 E HA -0.019 4.330 4.350 -0.001 0.000 0.194 336 E C -1.414 175.186 176.600 -0.000 0.000 0.997 336 E CA 1.145 57.544 56.400 -0.001 0.000 0.801 336 E CB -1.161 28.538 29.700 -0.001 0.000 0.746 336 E HN 0.277 8.637 8.360 0.000 0.000 0.450 337 P HA -0.170 4.250 4.420 0.000 0.000 0.053 337 P C -0.502 176.800 177.300 0.002 0.000 0.953 337 P CA 1.146 64.248 63.100 0.003 0.000 1.019 337 P CB -0.320 31.382 31.700 0.004 0.000 1.826 338 R N 2.255 122.758 120.500 0.004 0.000 3.238 338 R HA -0.253 4.087 4.340 -0.001 0.000 0.662 338 R C 0.782 177.085 176.300 0.004 0.000 0.241 338 R CA 1.784 57.887 56.100 0.005 0.000 2.009 338 R CB -1.902 28.402 30.300 0.007 0.000 0.727 338 R HN 0.468 8.738 8.270 0.000 0.000 0.659 339 I N 2.482 123.055 120.570 0.006 0.000 2.483 339 I HA 0.084 4.253 4.170 -0.001 0.000 0.291 339 I C -0.400 175.719 176.117 0.004 0.000 1.112 339 I CA 0.584 61.888 61.300 0.006 0.000 1.350 339 I CB -0.415 37.590 38.000 0.009 0.000 1.419 339 I HN 0.496 8.706 8.210 0.000 0.000 0.523 340 D N 5.009 125.411 120.400 0.002 0.000 4.161 340 D HA -0.111 4.529 4.640 -0.001 0.000 0.246 340 D C 0.668 176.968 176.300 -0.001 0.000 1.064 340 D CA 0.814 54.814 54.000 0.000 0.000 1.187 340 D CB -0.029 40.771 40.800 -0.000 0.000 0.871 340 D HN 0.859 9.229 8.370 0.000 0.000 0.413 341 G N 3.195 111.995 108.800 -0.001 0.000 2.686 341 G HA2 -0.018 3.941 3.960 -0.001 0.000 0.280 341 G HA3 -0.018 3.941 3.960 -0.001 0.000 0.280 341 G C 0.513 175.411 174.900 -0.004 0.000 0.666 341 G CA -0.285 44.813 45.100 -0.002 0.000 2.114 341 G HN 0.316 8.606 8.290 0.000 0.000 0.553 342 R N 1.257 121.755 120.500 -0.005 0.000 2.491 342 R HA 0.119 4.458 4.340 -0.001 0.000 0.283 342 R C 0.917 177.212 176.300 -0.009 0.000 1.072 342 R CA -0.337 55.758 56.100 -0.008 0.000 1.048 342 R CB 1.354 31.648 30.300 -0.009 0.000 0.983 342 R HN 0.684 8.954 8.270 0.000 0.000 0.450 343 E N 2.497 122.689 120.200 -0.013 0.000 1.928 343 E HA -0.239 4.111 4.350 -0.001 0.000 0.215 343 E C 0.670 177.263 176.600 -0.011 0.000 0.926 343 E CA 1.738 58.131 56.400 -0.012 0.000 0.951 343 E CB 0.220 29.910 29.700 -0.018 0.000 0.826 343 E HN 0.624 8.984 8.360 0.000 0.000 0.587 344 K N -1.280 119.112 120.400 -0.014 0.000 2.664 344 K HA 0.034 4.354 4.320 -0.001 0.000 0.151 344 K C -0.922 175.672 176.600 -0.011 0.000 1.259 344 K CA 0.301 56.584 56.287 -0.007 0.000 1.140 344 K CB 0.580 33.081 32.500 0.001 0.000 1.054 344 K HN 0.133 8.383 8.250 0.000 0.000 0.463 345 D N 0.861 121.246 120.400 -0.026 0.000 2.538 345 D HA 0.214 4.853 4.640 -0.001 0.000 0.241 345 D C 0.023 176.279 176.300 -0.073 0.000 1.297 345 D CA -0.096 53.880 54.000 -0.041 0.000 0.804 345 D CB 0.576 41.351 40.800 -0.041 0.000 1.122 345 D HN 0.179 8.549 8.370 0.000 0.000 0.519 346 M N 1.368 120.935 119.600 -0.055 0.000 2.233 346 M HA 0.218 4.698 4.480 -0.001 0.000 0.350 346 M C 1.125 177.398 176.300 -0.045 0.000 1.176 346 M CA 0.061 55.325 55.300 -0.059 0.000 1.150 346 M CB 1.542 34.123 32.600 -0.033 0.000 1.530 346 M HN -0.071 8.219 8.290 0.000 0.000 0.459 347 I N -0.262 120.287 120.570 -0.036 0.000 4.327 347 I HA 0.338 4.507 4.170 -0.001 0.000 0.331 347 I C -0.322 175.820 176.117 0.042 0.000 1.348 347 I CA -0.202 61.108 61.300 0.015 0.000 1.152 347 I CB -0.127 37.907 38.000 0.058 0.000 1.151 347 I HN 0.910 9.120 8.210 0.000 0.000 0.410 348 R N 0.580 121.099 120.500 0.032 0.000 1.516 348 R HA 0.041 4.380 4.340 -0.001 0.000 0.427 348 R C 0.266 176.585 176.300 0.032 0.000 1.308 348 R CA 0.522 56.636 56.100 0.024 0.000 1.110 348 R CB -1.526 28.782 30.300 0.013 0.000 3.153 348 R HN 0.526 8.796 8.270 0.000 0.000 0.525 349 G N 1.530 110.334 108.800 0.005 0.000 2.483 349 G HA2 0.522 4.482 3.960 -0.001 0.000 0.248 349 G HA3 0.522 4.482 3.960 -0.001 0.000 0.248 349 G C -0.199 174.661 174.900 -0.066 0.000 1.248 349 G CA -0.655 44.438 45.100 -0.011 0.000 0.838 349 G HN 0.352 8.642 8.290 0.000 0.000 0.566 350 L N 0.244 121.411 121.223 -0.093 0.000 2.304 350 L HA 0.566 4.905 4.340 -0.001 0.000 0.268 350 L C -0.723 176.035 176.870 -0.188 0.000 1.010 350 L CA -0.939 53.778 54.840 -0.205 0.000 0.813 350 L CB 2.290 44.232 42.059 -0.195 0.000 1.315 350 L HN 0.492 8.722 8.230 0.000 0.000 0.445 351 D N 0.272 120.507 120.400 -0.274 0.000 2.575 351 D HA 0.478 5.117 4.640 -0.001 0.000 0.250 351 D C -1.533 174.667 176.300 -0.166 0.000 1.279 351 D CA -0.207 53.689 54.000 -0.174 0.000 0.925 351 D CB 1.807 42.517 40.800 -0.150 0.000 1.261 351 D HN 0.117 8.487 8.370 0.000 0.000 0.567 352 V N 4.804 124.677 119.914 -0.069 0.000 2.349 352 V HA 0.558 4.677 4.120 -0.001 0.000 0.284 352 V C 0.070 176.173 176.094 0.015 0.000 1.014 352 V CA -0.727 61.578 62.300 0.007 0.000 0.826 352 V CB 1.189 33.040 31.823 0.048 0.000 1.009 352 V HN 0.442 8.632 8.190 0.000 0.000 0.431 353 R N 2.268 122.785 120.500 0.028 0.000 2.637 353 R HA 0.805 5.144 4.340 -0.001 0.000 0.291 353 R C -0.645 175.673 176.300 0.031 0.000 0.963 353 R CA -0.548 55.563 56.100 0.020 0.000 0.901 353 R CB 2.498 32.803 30.300 0.009 0.000 1.160 353 R HN 0.637 8.907 8.270 0.000 0.000 0.457 354 T N -0.020 114.546 114.554 0.021 0.000 2.907 354 T HA 0.452 4.802 4.350 -0.001 0.000 0.292 354 T C 0.444 175.151 174.700 0.012 0.000 1.043 354 T CA 0.154 62.265 62.100 0.019 0.000 1.003 354 T CB 1.754 70.632 68.868 0.016 0.000 1.084 354 T HN 0.833 9.073 8.240 0.000 0.000 0.483 355 G N 1.106 109.912 108.800 0.011 0.000 2.198 355 G HA2 -0.247 3.712 3.960 -0.001 0.000 0.260 355 G HA3 -0.247 3.712 3.960 -0.001 0.000 0.260 355 G C 0.940 175.844 174.900 0.007 0.000 1.025 355 G CA 0.365 45.471 45.100 0.009 0.000 0.769 355 G HN 0.688 8.978 8.290 0.000 0.000 0.507 356 V N -0.742 119.176 119.914 0.006 0.000 2.594 356 V HA 0.048 4.167 4.120 -0.001 0.000 0.253 356 V C 1.617 177.711 176.094 0.000 0.000 1.069 356 V CA 1.851 64.154 62.300 0.004 0.000 1.082 356 V CB -0.259 31.567 31.823 0.005 0.000 0.680 356 V HN 0.494 8.684 8.190 0.000 0.000 0.469 357 L N -0.645 120.577 121.223 -0.001 0.000 2.346 357 L HA 0.347 4.686 4.340 -0.001 0.000 0.276 357 L C -1.476 175.395 176.870 0.002 0.000 1.006 357 L CA -1.648 53.190 54.840 -0.004 0.000 0.817 357 L CB 1.855 43.907 42.059 -0.013 0.000 1.272 357 L HN -0.045 8.185 8.230 0.000 0.000 0.421 358 P HA -0.098 4.322 4.420 0.000 0.000 0.214 358 P C 0.803 178.112 177.300 0.016 0.000 1.163 358 P CA 1.187 64.291 63.100 0.008 0.000 0.883 358 P CB 0.251 31.953 31.700 0.004 0.000 0.788 359 R N -0.903 119.605 120.500 0.013 0.000 2.432 359 R HA 0.184 4.523 4.340 -0.001 0.000 0.260 359 R C 0.561 176.879 176.300 0.030 0.000 0.935 359 R CA 0.329 56.444 56.100 0.025 0.000 1.080 359 R CB -0.940 29.369 30.300 0.014 0.000 1.155 359 R HN 0.319 8.589 8.270 0.000 0.000 0.531 360 T N -2.679 111.881 114.554 0.010 0.000 2.909 360 T HA 0.244 4.593 4.350 -0.001 0.000 0.286 360 T C 1.110 175.861 174.700 0.085 0.000 1.002 360 T CA -0.490 61.593 62.100 -0.029 0.000 1.074 360 T CB 1.253 70.088 68.868 -0.055 0.000 0.984 360 T HN 0.274 8.514 8.240 0.000 0.000 0.495 361 H N 1.401 120.467 119.070 -0.007 0.000 2.456 361 H HA 0.247 4.801 4.556 -0.003 0.000 0.296 361 H C 1.301 176.626 175.328 -0.005 0.000 1.079 361 H CA 0.100 56.146 56.048 -0.004 0.000 1.322 361 H CB 0.183 29.946 29.762 0.003 0.000 1.388 361 H HN 0.876 9.156 8.280 0.000 0.000 0.538 362 G N -0.521 108.339 108.800 0.099 0.000 2.703 362 G HA2 0.461 4.420 3.960 -0.001 0.000 0.294 362 G HA3 0.461 4.420 3.960 -0.001 0.000 0.294 362 G C -1.411 173.496 174.900 0.011 0.000 1.451 362 G CA -0.282 44.846 45.100 0.047 0.000 0.869 362 G HN 0.241 8.531 8.290 0.000 0.000 0.516 363 S N -1.261 114.442 115.700 0.006 0.000 2.567 363 S HA 0.954 5.423 4.470 -0.001 0.000 0.270 363 S C -0.744 173.859 174.600 0.006 0.000 1.152 363 S CA -0.273 57.924 58.200 -0.005 0.000 0.835 363 S CB 1.594 64.789 63.200 -0.007 0.000 1.115 363 S HN 2.552 10.862 8.310 0.000 0.000 0.459 364 A N 1.293 124.119 122.820 0.010 0.000 2.565 364 A HA 0.676 4.995 4.320 -0.001 0.000 0.298 364 A C -1.806 175.810 177.584 0.054 0.000 1.062 364 A CA -0.579 51.480 52.037 0.037 0.000 0.723 364 A CB 1.132 20.160 19.000 0.048 0.000 1.282 364 A HN 1.026 9.176 8.150 0.000 0.000 0.400 365 L N 2.416 123.681 121.223 0.069 0.000 2.296 365 L HA 0.761 5.100 4.340 -0.001 0.000 0.286 365 L C -1.528 175.428 176.870 0.144 0.000 1.023 365 L CA -0.685 54.202 54.840 0.077 0.000 0.812 365 L CB 1.279 43.358 42.059 0.034 0.000 1.223 365 L HN 0.801 9.031 8.230 0.000 0.000 0.421 366 F N 4.052 124.001 119.950 -0.002 0.000 2.499 366 F HA 0.426 4.952 4.527 -0.001 0.000 0.333 366 F C -0.406 175.401 175.800 0.011 0.000 1.138 366 F CA -0.291 57.714 58.000 0.008 0.000 0.945 366 F CB 1.759 40.770 39.000 0.017 0.000 1.181 366 F HN 0.341 8.641 8.300 0.000 0.000 0.435 367 T N 6.443 120.754 114.554 -0.405 0.000 2.881 367 T HA 0.499 4.848 4.350 -0.001 0.000 0.291 367 T C -1.445 172.993 174.700 -0.437 0.000 0.990 367 T CA -0.648 61.286 62.100 -0.276 0.000 0.976 367 T CB 0.932 69.726 68.868 -0.123 0.000 0.970 367 T HN 0.897 9.137 8.240 0.000 0.000 0.438 368 R N 3.854 124.174 120.500 -0.301 0.000 2.507 368 R HA 0.579 4.918 4.340 -0.001 0.000 0.298 368 R C 0.707 176.972 176.300 -0.059 0.000 1.087 368 R CA 0.440 56.412 56.100 -0.214 0.000 0.917 368 R CB 0.554 30.730 30.300 -0.206 0.000 1.173 368 R HN 1.213 9.483 8.270 0.000 0.000 0.472 369 G N 3.177 111.948 108.800 -0.048 0.000 2.514 369 G HA2 -0.320 3.639 3.960 -0.001 0.000 0.265 369 G HA3 -0.320 3.639 3.960 -0.001 0.000 0.265 369 G C 0.383 175.281 174.900 -0.002 0.000 1.150 369 G CA 0.204 45.297 45.100 -0.012 0.000 0.959 369 G HN 0.614 8.904 8.290 0.000 0.000 0.556 370 E N 1.227 121.438 120.200 0.019 0.000 2.299 370 E HA 0.069 4.418 4.350 -0.001 0.000 0.193 370 E C 1.688 178.314 176.600 0.042 0.000 0.998 370 E CA 1.186 57.603 56.400 0.028 0.000 0.851 370 E CB -0.076 29.646 29.700 0.038 0.000 0.795 370 E HN 0.836 9.196 8.360 0.000 0.000 0.492 371 T N -0.785 113.803 114.554 0.057 0.000 2.913 371 T HA 0.391 4.740 4.350 -0.001 0.000 0.287 371 T C -0.149 174.598 174.700 0.078 0.000 1.008 371 T CA -0.665 61.486 62.100 0.086 0.000 1.067 371 T CB 2.255 71.200 68.868 0.129 0.000 0.996 371 T HN -0.047 8.193 8.240 0.000 0.000 0.513 372 Q N 0.519 120.374 119.800 0.091 0.000 2.320 372 Q HA 0.578 4.917 4.340 -0.001 0.000 0.272 372 Q C -2.152 173.905 176.000 0.094 0.000 1.023 372 Q CA -0.953 54.902 55.803 0.087 0.000 0.855 372 Q CB 1.924 30.684 28.738 0.036 0.000 1.367 372 Q HN 1.131 9.401 8.270 0.000 0.000 0.406 373 A N 3.959 126.862 122.820 0.138 0.000 2.398 373 A HA 0.564 4.883 4.320 -0.001 0.000 0.301 373 A C -1.716 175.906 177.584 0.064 0.000 1.041 373 A CA -0.624 51.464 52.037 0.085 0.000 0.711 373 A CB 1.409 20.474 19.000 0.107 0.000 1.240 373 A HN 0.752 8.902 8.150 0.000 0.000 0.420 374 L N 4.365 125.589 121.223 0.002 0.000 2.270 374 L HA 0.494 4.834 4.340 -0.001 0.000 0.286 374 L C -1.097 175.742 176.870 -0.052 0.000 1.059 374 L CA -0.456 54.378 54.840 -0.011 0.000 0.839 374 L CB 0.597 42.641 42.059 -0.025 0.000 1.221 374 L HN 0.507 8.737 8.230 0.000 0.000 0.431 375 V N 3.225 123.113 119.914 -0.044 0.000 2.539 375 V HA 0.581 4.700 4.120 -0.001 0.000 0.292 375 V C 0.398 176.437 176.094 -0.092 0.000 1.045 375 V CA -0.364 61.875 62.300 -0.101 0.000 0.945 375 V CB 1.870 33.638 31.823 -0.091 0.000 0.993 375 V HN 0.844 9.034 8.190 0.000 0.000 0.464 376 T N 0.800 115.273 114.554 -0.136 0.000 2.896 376 T HA 0.874 5.223 4.350 -0.001 0.000 0.297 376 T C -0.662 173.973 174.700 -0.108 0.000 1.108 376 T CA -0.664 61.375 62.100 -0.101 0.000 1.004 376 T CB 2.098 70.904 68.868 -0.103 0.000 1.159 376 T HN 1.099 9.339 8.240 0.000 0.000 0.499 377 A N 1.221 124.010 122.820 -0.053 0.000 2.356 377 A HA 0.838 5.157 4.320 -0.001 0.000 0.310 377 A C -0.091 177.495 177.584 0.003 0.000 1.075 377 A CA -0.808 51.225 52.037 -0.007 0.000 0.746 377 A CB 1.656 20.686 19.000 0.050 0.000 1.221 377 A HN 1.234 9.384 8.150 0.000 0.000 0.443 378 T N 3.134 117.691 114.554 0.004 0.000 2.879 378 T HA 0.596 4.945 4.350 -0.001 0.000 0.290 378 T C -0.474 174.359 174.700 0.222 0.000 0.993 378 T CA -0.513 61.566 62.100 -0.036 0.000 0.975 378 T CB 0.066 68.758 68.868 -0.294 0.000 0.981 378 T HN 0.540 8.780 8.240 0.000 0.000 0.439 379 L N 3.560 125.136 121.223 0.589 0.000 2.439 379 L HA 0.893 5.232 4.340 -0.001 0.000 0.259 379 L C 1.066 178.097 176.870 0.268 0.000 1.129 379 L CA -0.866 54.165 54.840 0.318 0.000 0.803 379 L CB 0.988 43.117 42.059 0.117 0.000 1.161 379 L HN 0.931 9.161 8.230 0.000 0.000 0.462 380 G N -0.341 108.571 108.800 0.187 0.000 2.506 380 G HA2 0.430 4.389 3.960 -0.001 0.000 0.292 380 G HA3 0.430 4.389 3.960 -0.001 0.000 0.292 380 G C -1.238 173.749 174.900 0.145 0.000 1.425 380 G CA -0.409 44.782 45.100 0.151 0.000 0.788 380 G HN 0.425 8.715 8.290 0.000 0.000 0.490 395 R N 0.466 120.973 120.500 0.011 0.000 2.009 395 R HA 0.168 4.507 4.340 -0.001 0.000 0.213 395 R C 1.407 177.717 176.300 0.016 0.000 1.297 395 R CA 1.930 58.038 56.100 0.013 0.000 1.008 395 R CB -0.322 29.986 30.300 0.014 0.000 0.852 395 R HN 0.362 8.632 8.270 0.000 0.000 0.475 396 T N 0.786 115.355 114.554 0.024 0.000 2.959 396 T HA 0.149 4.498 4.350 -0.001 0.000 0.254 396 T C -0.556 174.173 174.700 0.048 0.000 1.003 396 T CA -0.401 61.718 62.100 0.032 0.000 0.950 396 T CB 0.184 69.071 68.868 0.032 0.000 1.090 396 T HN 0.269 8.509 8.240 0.000 0.000 0.503 397 D N 2.430 122.861 120.400 0.051 0.000 2.525 397 D HA -0.004 4.635 4.640 -0.001 0.000 0.235 397 D C 1.216 177.575 176.300 0.099 0.000 1.137 397 D CA 0.724 54.772 54.000 0.080 0.000 0.868 397 D CB 1.456 42.298 40.800 0.069 0.000 1.180 397 D HN 0.344 8.714 8.370 0.000 0.000 0.465 398 T N -0.006 114.634 114.554 0.144 0.000 3.069 398 T HA 0.136 4.485 4.350 -0.001 0.000 0.252 398 T C 0.496 175.357 174.700 0.269 0.000 1.053 398 T CA -0.414 61.779 62.100 0.156 0.000 0.964 398 T CB -0.039 68.906 68.868 0.127 0.000 1.005 398 T HN 0.329 8.569 8.240 0.000 0.000 0.532 399 F N 2.237 122.236 119.950 0.081 0.000 2.427 399 F HA 0.650 5.175 4.527 -0.002 0.000 0.348 399 F C -1.405 174.457 175.800 0.103 0.000 1.125 399 F CA -1.664 56.396 58.000 0.101 0.000 0.989 399 F CB 0.916 39.977 39.000 0.102 0.000 1.165 399 F HN -0.074 8.226 8.300 0.000 0.000 0.442 400 L N 6.749 127.868 121.223 -0.173 0.000 2.346 400 L HA 0.540 4.879 4.340 -0.001 0.000 0.274 400 L C -1.398 175.277 176.870 -0.325 0.000 1.007 400 L CA -0.960 53.747 54.840 -0.221 0.000 0.818 400 L CB 2.314 44.331 42.059 -0.071 0.000 1.284 400 L HN 0.611 8.841 8.230 0.000 0.000 0.424 401 F N 2.441 122.156 119.950 -0.393 0.000 2.562 401 F HA 0.435 4.961 4.527 -0.002 0.000 0.319 401 F C -0.516 175.187 175.800 -0.161 0.000 1.154 401 F CA -0.343 57.448 58.000 -0.348 0.000 0.931 401 F CB 1.212 39.946 39.000 -0.443 0.000 1.198 401 F HN 0.464 8.764 8.300 0.000 0.000 0.444 402 H N 4.886 123.784 119.070 -0.285 0.000 2.690 402 H HA 0.381 4.937 4.556 0.001 0.000 0.368 402 H C -1.797 173.402 175.328 -0.216 0.000 1.150 402 H CA -0.680 55.294 56.048 -0.123 0.000 1.174 402 H CB 1.916 31.616 29.762 -0.104 0.000 1.684 402 H HN 0.608 8.888 8.280 0.000 0.000 0.538 403 Y N 2.405 122.330 120.300 -0.625 0.000 2.328 403 Y HA 0.197 4.746 4.550 -0.001 0.000 0.337 403 Y C 0.090 175.637 175.900 -0.589 0.000 0.966 403 Y CA -0.791 57.052 58.100 -0.428 0.000 1.136 403 Y CB 1.225 39.717 38.460 0.054 0.000 1.170 403 Y HN 0.512 8.792 8.280 0.000 0.000 0.470 404 N N 4.095 122.632 118.700 -0.271 0.000 2.437 404 N HA 0.304 5.043 4.740 -0.001 0.000 0.259 404 N C -1.372 174.049 175.510 -0.148 0.000 0.983 404 N CA -0.237 52.742 53.050 -0.118 0.000 0.937 404 N CB 0.765 39.214 38.487 -0.063 0.000 1.122 404 N HN 0.410 8.790 8.380 0.000 0.000 0.499 405 F N 2.446 122.400 119.950 0.006 0.000 2.470 405 F HA 0.496 5.021 4.527 -0.002 0.000 0.329 405 F C -1.382 174.437 175.800 0.032 0.000 1.072 405 F CA -1.524 56.486 58.000 0.017 0.000 0.989 405 F CB 1.233 40.226 39.000 -0.012 0.000 1.193 405 F HN 0.295 8.595 8.300 0.000 0.000 0.481 406 P HA 0.373 4.793 4.420 0.000 0.000 0.284 406 P C -2.259 175.159 177.300 0.197 0.000 1.253 406 P CA -0.611 62.585 63.100 0.160 0.000 0.800 406 P CB 0.459 32.227 31.700 0.114 0.000 0.961 407 P HA -0.288 4.132 4.420 0.000 0.000 0.299 407 P C 0.184 177.629 177.300 0.242 0.000 1.965 407 P CA 0.655 63.876 63.100 0.201 0.000 1.762 407 P CB -1.578 30.240 31.700 0.196 0.000 0.245 424 I N 0.767 121.220 120.570 -0.194 0.000 2.943 424 I HA -0.115 4.055 4.170 -0.001 0.000 0.296 424 I C 1.501 177.479 176.117 -0.230 0.000 1.220 424 I CA 1.526 62.650 61.300 -0.293 0.000 1.409 424 I CB 0.524 38.149 38.000 -0.625 0.000 1.374 424 I HN 0.362 8.572 8.210 0.000 0.000 0.545 425 G N 4.373 113.082 108.800 -0.152 0.000 3.441 425 G HA2 -0.011 3.948 3.960 -0.001 0.000 0.263 425 G HA3 -0.011 3.948 3.960 -0.001 0.000 0.263 425 G C 0.970 175.832 174.900 -0.064 0.000 1.014 425 G CA -0.166 44.896 45.100 -0.064 0.000 0.833 425 G HN 0.876 9.166 8.290 0.000 0.000 0.514 426 H N -0.832 118.205 119.070 -0.056 0.000 2.568 426 H HA 0.129 4.684 4.556 -0.001 0.000 0.281 426 H C 1.948 177.263 175.328 -0.022 0.000 1.028 426 H CA 0.775 56.796 56.048 -0.045 0.000 1.199 426 H CB -0.110 29.615 29.762 -0.063 0.000 1.352 426 H HN 0.121 8.401 8.280 0.000 0.000 0.605 427 G N 0.092 108.767 108.800 -0.209 0.000 3.088 427 G HA2 -0.049 3.910 3.960 -0.001 0.000 0.217 427 G HA3 -0.049 3.910 3.960 -0.001 0.000 0.217 427 G C 1.556 176.477 174.900 0.035 0.000 1.159 427 G CA -0.434 44.676 45.100 0.017 0.000 0.760 427 G HN 0.305 8.595 8.290 0.000 0.000 0.550 428 R N -0.073 120.425 120.500 -0.002 0.000 2.285 428 R HA 0.051 4.390 4.340 -0.001 0.000 0.213 428 R C 2.136 178.389 176.300 -0.078 0.000 1.068 428 R CA 0.368 56.444 56.100 -0.040 0.000 1.004 428 R CB -0.132 30.164 30.300 -0.007 0.000 0.873 428 R HN 0.427 8.697 8.270 0.000 0.000 0.467 429 L N 0.514 121.714 121.223 -0.039 0.000 1.994 429 L HA -0.077 4.262 4.340 -0.001 0.000 0.208 429 L C 2.210 179.024 176.870 -0.093 0.000 1.071 429 L CA 2.167 56.993 54.840 -0.022 0.000 0.745 429 L CB -0.733 41.356 42.059 0.049 0.000 0.892 429 L HN 0.091 8.321 8.230 0.000 0.000 0.431 430 A N -0.678 122.040 122.820 -0.170 0.000 1.933 430 A HA -0.273 4.046 4.320 -0.001 0.000 0.218 430 A C 2.456 179.695 177.584 -0.575 0.000 1.175 430 A CA 2.032 53.860 52.037 -0.348 0.000 0.628 430 A CB -0.638 18.093 19.000 -0.449 0.000 0.814 430 A HN 0.531 8.681 8.150 0.000 0.000 0.444 431 K N -0.408 119.586 120.400 -0.677 0.000 2.025 431 K HA -0.144 4.175 4.320 -0.001 0.000 0.207 431 K C 2.286 178.855 176.600 -0.051 0.000 1.049 431 K CA 1.404 57.421 56.287 -0.450 0.000 0.933 431 K CB -0.162 32.131 32.500 -0.346 0.000 0.714 431 K HN 0.462 8.712 8.250 0.000 0.000 0.438 432 R N -0.380 120.085 120.500 -0.059 0.000 2.081 432 R HA -0.071 4.268 4.340 -0.001 0.000 0.235 432 R C 2.498 178.806 176.300 0.013 0.000 1.131 432 R CA 1.307 57.412 56.100 0.009 0.000 0.960 432 R CB -0.601 29.698 30.300 -0.002 0.000 0.856 432 R HN 0.354 8.624 8.270 0.000 0.000 0.436 433 G N 0.568 109.354 108.800 -0.022 0.000 2.469 433 G HA2 -0.238 3.721 3.960 -0.001 0.000 0.219 433 G HA3 -0.238 3.721 3.960 -0.001 0.000 0.219 433 G C 1.434 176.343 174.900 0.014 0.000 1.150 433 G CA 1.028 46.122 45.100 -0.010 0.000 0.763 433 G HN 0.163 8.453 8.290 0.000 0.000 0.561 434 V N 0.616 120.563 119.914 0.056 0.000 2.488 434 V HA 0.038 4.157 4.120 -0.001 0.000 0.246 434 V C 2.667 178.781 176.094 0.034 0.000 1.046 434 V CA 0.856 63.219 62.300 0.105 0.000 1.053 434 V CB -0.356 31.649 31.823 0.304 0.000 0.679 434 V HN 0.348 8.538 8.190 0.000 0.000 0.458 435 L N 0.565 121.869 121.223 0.135 0.000 2.151 435 L HA -0.313 4.026 4.340 -0.001 0.000 0.215 435 L C 2.481 179.317 176.870 -0.057 0.000 1.084 435 L CA 1.925 56.788 54.840 0.037 0.000 0.764 435 L CB -0.416 41.736 42.059 0.155 0.000 0.891 435 L HN 0.426 8.656 8.230 0.000 0.000 0.435 436 A N -1.520 121.282 122.820 -0.030 0.000 2.067 436 A HA -0.079 4.240 4.320 -0.001 0.000 0.219 436 A C 1.890 179.437 177.584 -0.063 0.000 1.158 436 A CA 1.477 53.492 52.037 -0.038 0.000 0.661 436 A CB -0.205 18.780 19.000 -0.025 0.000 0.801 436 A HN 0.343 8.493 8.150 0.000 0.000 0.452 437 V N -0.176 119.683 119.914 -0.091 0.000 3.661 437 V HA 0.107 4.226 4.120 -0.001 0.000 0.271 437 V C 0.808 176.811 176.094 -0.153 0.000 1.315 437 V CA -0.133 62.105 62.300 -0.103 0.000 1.072 437 V CB -0.420 31.352 31.823 -0.086 0.000 0.830 437 V HN 0.437 8.627 8.190 0.000 0.000 0.443 438 M N 1.476 120.937 119.600 -0.232 0.000 2.250 438 M HA 0.170 4.649 4.480 -0.001 0.000 0.337 438 M C -2.180 174.025 176.300 -0.158 0.000 1.161 438 M CA -1.390 53.733 55.300 -0.295 0.000 1.088 438 M CB -0.297 31.994 32.600 -0.514 0.000 1.639 438 M HN -0.014 8.276 8.290 0.000 0.000 0.447 439 P HA -0.001 4.419 4.420 0.000 0.000 0.268 439 P C -0.093 177.219 177.300 0.020 0.000 1.208 439 P CA 0.024 63.101 63.100 -0.037 0.000 0.777 439 P CB 0.381 32.075 31.700 -0.009 0.000 0.875 440 D N 1.993 122.410 120.400 0.028 0.000 2.389 440 D HA -0.130 4.509 4.640 -0.001 0.000 0.221 440 D C 1.282 177.614 176.300 0.053 0.000 0.974 440 D CA 0.712 54.730 54.000 0.032 0.000 0.923 440 D CB -0.521 40.293 40.800 0.025 0.000 0.892 440 D HN 0.336 8.706 8.370 0.000 0.000 0.518 441 M N -1.025 118.633 119.600 0.098 0.000 2.909 441 M HA -0.282 4.197 4.480 -0.001 0.000 0.182 441 M C -0.211 176.113 176.300 0.041 0.000 0.642 441 M CA 1.466 56.818 55.300 0.087 0.000 0.695 441 M CB -0.840 31.793 32.600 0.055 0.000 2.505 441 M HN 0.031 8.321 8.290 0.000 0.000 0.282 442 D N -0.415 120.010 120.400 0.040 0.000 2.388 442 D HA 0.081 4.720 4.640 -0.001 0.000 0.208 442 D C 1.582 177.903 176.300 0.034 0.000 1.035 442 D CA 1.104 55.112 54.000 0.014 0.000 0.875 442 D CB 0.067 40.874 40.800 0.012 0.000 0.984 442 D HN 0.714 9.084 8.370 0.000 0.000 0.508 443 K N -0.194 120.254 120.400 0.080 0.000 2.202 443 K HA -0.015 4.304 4.320 -0.001 0.000 0.201 443 K C 0.027 176.772 176.600 0.242 0.000 1.051 443 K CA 0.188 56.548 56.287 0.121 0.000 0.977 443 K CB 0.473 33.035 32.500 0.104 0.000 0.792 443 K HN -0.077 8.173 8.250 0.000 0.000 0.469 444 F N 2.839 122.834 119.950 0.075 0.000 2.513 444 F HA 0.371 4.899 4.527 0.001 0.000 0.358 444 F C -2.260 173.609 175.800 0.115 0.000 1.118 444 F CA -2.480 55.635 58.000 0.192 0.000 1.037 444 F CB 2.131 41.222 39.000 0.152 0.000 1.276 444 F HN -0.074 8.226 8.300 0.000 0.000 0.446 445 P HA -0.025 4.395 4.420 0.000 0.000 0.249 445 P C -0.687 176.275 177.300 -0.564 0.000 1.229 445 P CA 0.469 63.308 63.100 -0.437 0.000 0.788 445 P CB -0.162 31.242 31.700 -0.494 0.000 1.072 446 Y N 0.137 120.221 120.300 -0.359 0.000 2.309 446 Y HA 0.230 4.780 4.550 -0.001 0.000 0.327 446 Y C 1.417 177.276 175.900 -0.069 0.000 1.172 446 Y CA -0.374 57.556 58.100 -0.283 0.000 1.280 446 Y CB -0.156 37.967 38.460 -0.562 0.000 1.234 446 Y HN -0.316 7.964 8.280 0.000 0.000 0.512 447 T N 3.578 118.199 114.554 0.112 0.000 2.779 447 T HA 0.355 4.704 4.350 -0.001 0.000 0.296 447 T C -0.336 174.487 174.700 0.205 0.000 0.938 447 T CA -0.439 61.746 62.100 0.141 0.000 1.119 447 T CB -0.021 68.904 68.868 0.094 0.000 0.891 447 T HN 0.346 8.586 8.240 0.000 0.000 0.526 448 V N 5.028 125.101 119.914 0.266 0.000 2.417 448 V HA 0.538 4.657 4.120 -0.001 0.000 0.291 448 V C 0.182 176.433 176.094 0.262 0.000 1.024 448 V CA -0.924 61.559 62.300 0.304 0.000 0.861 448 V CB 1.498 33.561 31.823 0.400 0.000 0.985 448 V HN 0.734 8.924 8.190 0.000 0.000 0.436 449 R N 3.818 124.406 120.500 0.147 0.000 2.409 449 R HA 0.703 5.042 4.340 -0.001 0.000 0.313 449 R C -1.733 174.536 176.300 -0.053 0.000 0.953 449 R CA -0.360 55.757 56.100 0.028 0.000 0.849 449 R CB 1.778 32.070 30.300 -0.012 0.000 1.171 449 R HN 0.549 8.819 8.270 0.000 0.000 0.458 450 V N 5.359 125.164 119.914 -0.182 0.000 2.427 450 V HA 0.411 4.531 4.120 -0.001 0.000 0.286 450 V C -0.318 175.403 176.094 -0.622 0.000 1.034 450 V CA -0.670 61.408 62.300 -0.369 0.000 0.893 450 V CB 1.749 33.321 31.823 -0.418 0.000 0.982 450 V HN 0.498 8.688 8.190 0.000 0.000 0.452 451 V N 3.533 123.163 119.914 -0.473 0.000 2.495 451 V HA 0.494 4.613 4.120 -0.001 0.000 0.298 451 V C 0.078 175.882 176.094 -0.482 0.000 1.031 451 V CA -0.371 61.669 62.300 -0.434 0.000 0.871 451 V CB 2.010 33.726 31.823 -0.178 0.000 0.988 451 V HN 0.835 9.025 8.190 0.000 0.000 0.432 452 S N 3.722 119.081 115.700 -0.569 0.000 2.498 452 S HA 0.397 4.866 4.470 -0.001 0.000 0.324 452 S C -0.421 174.024 174.600 -0.259 0.000 1.071 452 S CA -0.609 57.352 58.200 -0.400 0.000 1.113 452 S CB 0.460 63.380 63.200 -0.467 0.000 0.976 452 S HN 0.758 9.068 8.310 0.000 0.000 0.462 453 E N 4.260 124.352 120.200 -0.181 0.000 2.081 453 E HA 0.231 4.581 4.350 -0.001 0.000 0.276 453 E C -0.800 175.713 176.600 -0.144 0.000 0.950 453 E CA -0.488 55.819 56.400 -0.155 0.000 0.776 453 E CB 0.901 30.542 29.700 -0.098 0.000 1.094 453 E HN 0.562 8.922 8.360 0.000 0.000 0.402 454 I N 2.959 123.387 120.570 -0.236 0.000 2.294 454 I HA -0.033 4.136 4.170 -0.001 0.000 0.295 454 I C 1.825 177.881 176.117 -0.101 0.000 1.098 454 I CA 0.109 61.291 61.300 -0.197 0.000 1.277 454 I CB 0.589 38.342 38.000 -0.413 0.000 1.434 454 I HN 0.420 8.630 8.210 0.000 0.000 0.498 455 T N 1.714 116.244 114.554 -0.040 0.000 2.985 455 T HA 0.001 4.350 4.350 -0.001 0.000 0.266 455 T C 0.479 175.185 174.700 0.011 0.000 1.076 455 T CA 0.578 62.672 62.100 -0.011 0.000 1.135 455 T CB -0.224 68.642 68.868 -0.003 0.000 0.890 455 T HN 0.694 8.934 8.240 0.000 0.000 0.480 456 E N -0.926 119.286 120.200 0.020 0.000 2.354 456 E HA 0.595 4.944 4.350 -0.001 0.000 0.283 456 E C -0.968 175.671 176.600 0.064 0.000 0.938 456 E CA -0.923 55.503 56.400 0.042 0.000 0.777 456 E CB 1.574 31.293 29.700 0.033 0.000 1.222 456 E HN 0.049 8.409 8.360 0.000 0.000 0.423 457 S N 1.475 117.226 115.700 0.085 0.000 2.490 457 S HA -0.059 4.410 4.470 -0.001 0.000 0.289 457 S C -0.246 174.429 174.600 0.125 0.000 0.982 457 S CA -0.106 58.154 58.200 0.100 0.000 1.196 457 S CB -0.692 62.564 63.200 0.093 0.000 1.430 457 S HN 0.751 9.061 8.310 0.000 0.000 0.439 458 N N 0.566 119.336 118.700 0.117 0.000 2.513 458 N HA -0.047 4.692 4.740 -0.001 0.000 0.187 458 N C 1.298 176.889 175.510 0.135 0.000 1.056 458 N CA 2.074 55.196 53.050 0.118 0.000 0.907 458 N CB -0.231 38.318 38.487 0.104 0.000 0.954 458 N HN 0.944 9.324 8.380 0.000 0.000 0.445 459 G N -0.240 108.659 108.800 0.166 0.000 3.642 459 G HA2 -0.379 3.580 3.960 -0.001 0.000 0.205 459 G HA3 -0.379 3.580 3.960 -0.001 0.000 0.205 459 G C 0.973 175.977 174.900 0.174 0.000 1.526 459 G CA 0.840 46.035 45.100 0.158 0.000 1.097 459 G HN 0.478 8.768 8.290 0.000 0.000 0.596 460 S N 0.449 116.227 115.700 0.130 0.000 2.471 460 S HA -0.020 4.449 4.470 -0.001 0.000 0.260 460 S C 1.275 175.958 174.600 0.138 0.000 1.116 460 S CA 2.714 60.967 58.200 0.087 0.000 1.069 460 S CB -0.735 62.501 63.200 0.059 0.000 0.897 460 S HN 2.742 11.052 8.310 0.000 0.000 0.471 461 S N -1.481 114.348 115.700 0.215 0.000 2.703 461 S HA 0.649 5.118 4.470 -0.001 0.000 0.273 461 S C -1.009 173.743 174.600 0.254 0.000 1.178 461 S CA -0.101 58.247 58.200 0.247 0.000 0.838 461 S CB 1.332 64.629 63.200 0.161 0.000 1.178 461 S HN 1.176 9.486 8.310 0.000 0.000 0.494 462 S N 0.216 116.062 115.700 0.245 0.000 2.481 462 S HA 0.606 5.075 4.470 -0.001 0.000 0.262 462 S C -0.998 173.700 174.600 0.164 0.000 1.061 462 S CA -0.465 57.887 58.200 0.253 0.000 1.039 462 S CB 0.651 64.126 63.200 0.459 0.000 1.170 462 S HN 0.757 9.067 8.310 0.000 0.000 0.437 463 M N 2.726 122.378 119.600 0.086 0.000 1.851 463 M HA 0.343 4.823 4.480 -0.001 0.000 0.395 463 M C 1.214 177.486 176.300 -0.046 0.000 0.809 463 M CA 0.999 56.318 55.300 0.031 0.000 1.182 463 M CB -0.339 32.287 32.600 0.043 0.000 2.382 463 M HN 0.676 8.966 8.290 0.000 0.000 0.840 464 A N -0.818 121.987 122.820 -0.025 0.000 2.014 464 A HA 0.210 4.529 4.320 -0.001 0.000 0.210 464 A C 1.928 179.337 177.584 -0.292 0.000 1.188 464 A CA 1.345 53.265 52.037 -0.196 0.000 0.731 464 A CB -0.132 18.992 19.000 0.207 0.000 0.858 464 A HN 0.333 8.483 8.150 0.000 0.000 0.464 465 S N -0.183 115.514 115.700 -0.004 0.000 2.496 465 S HA -0.009 4.461 4.470 -0.001 0.000 0.224 465 S C 1.723 176.376 174.600 0.088 0.000 0.996 465 S CA 0.991 59.245 58.200 0.090 0.000 0.927 465 S CB -0.004 63.381 63.200 0.308 0.000 0.774 465 S HN 0.311 8.621 8.310 0.000 0.000 0.524 466 V N 1.044 120.960 119.914 0.002 0.000 2.283 466 V HA -0.195 3.925 4.120 -0.001 0.000 0.243 466 V C 2.458 178.497 176.094 -0.092 0.000 1.039 466 V CA 1.448 63.743 62.300 -0.007 0.000 1.016 466 V CB -0.992 30.811 31.823 -0.035 0.000 0.650 466 V HN 0.548 8.738 8.190 0.000 0.000 0.449 467 C N 0.999 120.126 119.300 -0.289 0.000 2.413 467 C HA -0.076 4.383 4.460 -0.001 0.000 0.277 467 C C 3.005 177.798 174.990 -0.329 0.000 1.228 467 C CA 0.829 59.603 59.018 -0.405 0.000 1.731 467 C CB -1.770 25.433 27.740 -0.895 0.000 2.042 467 C HN 0.692 8.922 8.230 0.000 0.000 0.468 468 G N 0.693 109.235 108.800 -0.430 0.000 2.553 468 G HA2 -0.203 3.756 3.960 -0.001 0.000 0.218 468 G HA3 -0.203 3.756 3.960 -0.001 0.000 0.218 468 G C 1.891 176.760 174.900 -0.052 0.000 1.195 468 G CA 1.606 46.620 45.100 -0.143 0.000 0.779 468 G HN 0.664 8.954 8.290 0.000 0.000 0.577 469 A N 0.324 123.139 122.820 -0.007 0.000 1.883 469 A HA -0.069 4.250 4.320 -0.001 0.000 0.217 469 A C 2.664 180.275 177.584 0.045 0.000 1.186 469 A CA 2.563 54.630 52.037 0.050 0.000 0.624 469 A CB -1.100 18.051 19.000 0.251 0.000 0.822 469 A HN 0.523 8.673 8.150 0.000 0.000 0.444 470 S N -0.483 115.233 115.700 0.026 0.000 2.380 470 S HA -0.191 4.278 4.470 -0.001 0.000 0.229 470 S C 1.936 176.532 174.600 -0.006 0.000 1.043 470 S CA 1.787 59.989 58.200 0.003 0.000 1.038 470 S CB -0.569 62.620 63.200 -0.019 0.000 0.872 470 S HN 0.472 8.782 8.310 0.000 0.000 0.456 471 L N 0.908 122.128 121.223 -0.005 0.000 1.994 471 L HA -0.076 4.263 4.340 -0.001 0.000 0.208 471 L C 3.009 179.882 176.870 0.006 0.000 1.071 471 L CA 1.341 56.187 54.840 0.009 0.000 0.745 471 L CB -0.859 41.223 42.059 0.038 0.000 0.892 471 L HN 0.418 8.648 8.230 0.000 0.000 0.431 472 A N 0.158 122.980 122.820 0.004 0.000 1.917 472 A HA -0.219 4.100 4.320 -0.001 0.000 0.219 472 A C 2.271 179.858 177.584 0.005 0.000 1.182 472 A CA 1.766 53.803 52.037 0.000 0.000 0.633 472 A CB -0.889 18.099 19.000 -0.020 0.000 0.819 472 A HN 0.367 8.517 8.150 0.000 0.000 0.448 473 L N -1.915 119.313 121.223 0.007 0.000 2.042 473 L HA -0.215 4.124 4.340 -0.001 0.000 0.210 473 L C 2.841 179.689 176.870 -0.037 0.000 1.076 473 L CA 1.821 56.661 54.840 -0.001 0.000 0.749 473 L CB -0.367 41.690 42.059 -0.004 0.000 0.893 473 L HN 0.441 8.671 8.230 0.000 0.000 0.432 474 M N -0.273 119.305 119.600 -0.037 0.000 2.086 474 M HA -0.255 4.224 4.480 -0.001 0.000 0.261 474 M C 1.906 178.186 176.300 -0.034 0.000 1.067 474 M CA 2.064 57.334 55.300 -0.049 0.000 1.116 474 M CB -0.209 32.370 32.600 -0.035 0.000 1.348 474 M HN 0.183 8.473 8.290 0.000 0.000 0.407 475 D N -0.189 120.202 120.400 -0.014 0.000 2.123 475 D HA -0.143 4.496 4.640 -0.001 0.000 0.196 475 D C 1.682 177.983 176.300 0.001 0.000 0.992 475 D CA 1.660 55.657 54.000 -0.004 0.000 0.833 475 D CB -0.001 40.802 40.800 0.006 0.000 0.954 475 D HN 0.372 8.742 8.370 0.000 0.000 0.455 476 A N -0.795 122.031 122.820 0.010 0.000 2.216 476 A HA 0.287 4.606 4.320 -0.001 0.000 0.214 476 A C 1.910 179.496 177.584 0.004 0.000 1.160 476 A CA 1.363 53.421 52.037 0.034 0.000 0.725 476 A CB -0.806 18.235 19.000 0.070 0.000 0.784 476 A HN 0.611 8.761 8.150 0.000 0.000 0.472 477 G N -1.764 107.013 108.800 -0.038 0.000 2.137 477 G HA2 -0.185 3.774 3.960 -0.001 0.000 0.237 477 G HA3 -0.185 3.774 3.960 -0.001 0.000 0.237 477 G C 0.080 174.876 174.900 -0.174 0.000 1.002 477 G CA 0.100 45.157 45.100 -0.072 0.000 0.702 477 G HN 0.840 9.130 8.290 0.000 0.000 0.515 478 V N 2.369 122.137 119.914 -0.243 0.000 2.427 478 V HA 0.305 4.424 4.120 -0.001 0.000 0.268 478 V C -0.761 175.029 176.094 -0.506 0.000 1.046 478 V CA -0.792 61.166 62.300 -0.570 0.000 0.970 478 V CB 1.149 32.755 31.823 -0.360 0.000 1.001 478 V HN 0.277 8.467 8.190 0.000 0.000 0.476 479 P HA 0.022 4.442 4.420 0.000 0.000 0.235 479 P C 0.031 177.166 177.300 -0.275 0.000 1.670 479 P CA -0.071 62.816 63.100 -0.355 0.000 1.017 479 P CB -0.427 31.093 31.700 -0.300 0.000 1.945 480 I N -1.657 118.774 120.570 -0.231 0.000 2.588 480 I HA 0.128 4.297 4.170 -0.001 0.000 0.283 480 I C 1.210 177.256 176.117 -0.118 0.000 1.119 480 I CA -0.365 60.832 61.300 -0.172 0.000 1.419 480 I CB 0.266 38.179 38.000 -0.146 0.000 1.394 480 I HN -0.025 8.185 8.210 0.000 0.000 0.562 481 K N 4.122 124.462 120.400 -0.100 0.000 2.228 481 K HA 0.011 4.330 4.320 -0.001 0.000 0.205 481 K C 0.660 177.226 176.600 -0.058 0.000 1.045 481 K CA 1.872 58.116 56.287 -0.071 0.000 0.931 481 K CB -0.150 32.314 32.500 -0.061 0.000 0.727 481 K HN 0.907 9.157 8.250 0.000 0.000 0.458 482 A N -0.881 121.903 122.820 -0.060 0.000 2.490 482 A HA 0.623 4.942 4.320 -0.001 0.000 0.292 482 A C -1.668 175.889 177.584 -0.044 0.000 1.047 482 A CA -0.495 51.515 52.037 -0.045 0.000 0.632 482 A CB 0.257 19.236 19.000 -0.035 0.000 1.323 482 A HN 0.056 8.206 8.150 0.000 0.000 0.448 483 A N -0.505 122.296 122.820 -0.032 0.000 2.304 483 A HA 0.703 5.023 4.320 -0.001 0.000 0.271 483 A C -0.274 177.296 177.584 -0.023 0.000 1.091 483 A CA -0.116 51.905 52.037 -0.027 0.000 0.812 483 A CB 0.368 19.357 19.000 -0.018 0.000 1.056 483 A HN 1.798 9.948 8.150 0.000 0.000 0.489 484 V N -0.251 119.650 119.914 -0.021 0.000 2.841 484 V HA 0.770 4.889 4.120 -0.001 0.000 0.310 484 V C 0.110 176.190 176.094 -0.024 0.000 1.090 484 V CA -0.005 62.285 62.300 -0.018 0.000 0.930 484 V CB 1.676 33.489 31.823 -0.016 0.000 1.014 484 V HN 1.500 9.690 8.190 0.000 0.000 0.425 485 A N 2.010 124.819 122.820 -0.018 0.000 2.515 485 A HA 1.006 5.325 4.320 -0.001 0.000 0.296 485 A C -0.218 177.355 177.584 -0.019 0.000 1.094 485 A CA -0.146 51.873 52.037 -0.030 0.000 0.718 485 A CB 2.060 21.061 19.000 0.001 0.000 1.307 485 A HN 1.296 9.446 8.150 0.000 0.000 0.408 486 G N -0.724 108.056 108.800 -0.034 0.000 2.473 486 G HA2 0.667 4.626 3.960 -0.001 0.000 0.321 486 G HA3 0.667 4.626 3.960 -0.001 0.000 0.321 486 G C -1.288 173.620 174.900 0.013 0.000 1.200 486 G CA -0.542 44.552 45.100 -0.009 0.000 0.963 486 G HN 1.151 9.441 8.290 0.000 0.000 0.483 487 I N -0.040 120.533 120.570 0.006 0.000 2.722 487 I HA 0.632 4.801 4.170 -0.001 0.000 0.292 487 I C -0.529 175.546 176.117 -0.071 0.000 1.267 487 I CA -0.775 60.520 61.300 -0.009 0.000 1.036 487 I CB 2.076 40.075 38.000 -0.002 0.000 1.281 487 I HN 0.721 8.931 8.210 0.000 0.000 0.423 488 A N 8.431 131.196 122.820 -0.092 0.000 2.260 488 A HA 0.811 5.130 4.320 -0.001 0.000 0.314 488 A C -0.536 176.882 177.584 -0.276 0.000 1.257 488 A CA -0.564 51.371 52.037 -0.169 0.000 0.871 488 A CB 0.707 19.647 19.000 -0.100 0.000 1.166 488 A HN 0.628 8.778 8.150 0.000 0.000 0.522 489 M N 1.490 120.760 119.600 -0.550 0.000 2.706 489 M HA 0.704 5.183 4.480 -0.001 0.000 0.304 489 M C 0.413 176.410 176.300 -0.504 0.000 1.217 489 M CA -0.324 54.566 55.300 -0.683 0.000 0.922 489 M CB 1.734 33.473 32.600 -1.436 0.000 1.637 489 M HN 0.829 9.119 8.290 0.000 0.000 0.492 490 G N 0.772 109.418 108.800 -0.256 0.000 2.704 490 G HA2 0.684 4.644 3.960 -0.001 0.000 0.293 490 G HA3 0.684 4.644 3.960 -0.001 0.000 0.293 490 G C -2.526 172.411 174.900 0.062 0.000 1.421 490 G CA -0.380 44.679 45.100 -0.068 0.000 0.870 490 G HN 0.550 8.840 8.290 0.000 0.000 0.492 491 L N 1.036 122.315 121.223 0.093 0.000 2.455 491 L HA 0.847 5.186 4.340 -0.001 0.000 0.264 491 L C -1.361 175.557 176.870 0.080 0.000 0.968 491 L CA -1.089 53.817 54.840 0.110 0.000 0.827 491 L CB 1.981 44.116 42.059 0.127 0.000 1.317 491 L HN 0.709 8.939 8.230 0.000 0.000 0.407 492 V N 5.307 125.277 119.914 0.094 0.000 2.588 492 V HA 0.693 4.813 4.120 -0.001 0.000 0.304 492 V C -1.147 175.013 176.094 0.111 0.000 1.042 492 V CA -0.420 61.927 62.300 0.080 0.000 0.877 492 V CB 1.788 33.648 31.823 0.062 0.000 0.996 492 V HN 0.917 9.107 8.190 0.000 0.000 0.425 493 K N 4.437 124.891 120.400 0.091 0.000 2.565 493 K HA 0.559 4.879 4.320 -0.001 0.000 0.249 493 K C -1.621 175.023 176.600 0.073 0.000 0.958 493 K CA -0.536 55.817 56.287 0.110 0.000 0.806 493 K CB 1.971 34.540 32.500 0.114 0.000 1.194 493 K HN 0.749 8.999 8.250 0.000 0.000 0.434 494 E N 2.659 122.899 120.200 0.067 0.000 2.191 494 E HA 0.493 4.842 4.350 -0.001 0.000 0.263 494 E C 0.342 176.968 176.600 0.043 0.000 0.881 494 E CA 0.607 57.034 56.400 0.045 0.000 0.757 494 E CB 1.509 31.230 29.700 0.034 0.000 1.147 494 E HN 0.822 9.182 8.360 0.000 0.000 0.414 495 G N 4.795 113.617 108.800 0.037 0.000 2.602 495 G HA2 -0.345 3.614 3.960 -0.001 0.000 0.310 495 G HA3 -0.345 3.614 3.960 -0.001 0.000 0.310 495 G C 0.266 175.197 174.900 0.051 0.000 1.183 495 G CA 0.665 45.785 45.100 0.034 0.000 0.979 495 G HN 0.731 9.021 8.290 0.000 0.000 0.545 496 D N 0.599 121.029 120.400 0.049 0.000 2.563 496 D HA 0.189 4.828 4.640 -0.001 0.000 0.237 496 D C 0.275 176.611 176.300 0.060 0.000 1.282 496 D CA -0.102 53.944 54.000 0.078 0.000 0.816 496 D CB -0.063 40.773 40.800 0.061 0.000 1.066 496 D HN 0.367 8.737 8.370 0.000 0.000 0.501 497 N N 1.512 120.227 118.700 0.026 0.000 2.457 497 N HA 0.200 4.940 4.740 -0.001 0.000 0.250 497 N C -1.280 174.238 175.510 0.015 0.000 0.982 497 N CA -0.519 52.499 53.050 -0.054 0.000 0.941 497 N CB 0.377 38.836 38.487 -0.047 0.000 1.120 497 N HN 0.108 8.488 8.380 0.000 0.000 0.505 498 Y N 1.293 121.600 120.300 0.012 0.000 2.468 498 Y HA 0.780 5.330 4.550 -0.001 0.000 0.342 498 Y C -1.164 174.748 175.900 0.020 0.000 1.021 498 Y CA -1.384 56.727 58.100 0.017 0.000 1.079 498 Y CB 0.829 39.300 38.460 0.019 0.000 1.226 498 Y HN 0.051 8.331 8.280 0.000 0.000 0.460 499 V N 4.136 124.192 119.914 0.237 0.000 2.487 499 V HA 0.401 4.520 4.120 -0.001 0.000 0.298 499 V C -0.636 175.577 176.094 0.198 0.000 1.028 499 V CA -1.012 61.383 62.300 0.158 0.000 0.860 499 V CB 1.622 33.487 31.823 0.070 0.000 0.991 499 V HN 0.778 8.968 8.190 0.000 0.000 0.427 500 V N 6.598 126.631 119.914 0.198 0.000 2.406 500 V HA 0.401 4.520 4.120 -0.001 0.000 0.272 500 V C -0.075 176.072 176.094 0.088 0.000 1.043 500 V CA -0.234 62.166 62.300 0.167 0.000 0.915 500 V CB 1.427 33.368 31.823 0.195 0.000 0.988 500 V HN 0.625 8.815 8.190 0.000 0.000 0.466 501 L N 5.067 126.319 121.223 0.049 0.000 2.282 501 L HA 0.463 4.802 4.340 -0.001 0.000 0.288 501 L C 0.365 177.213 176.870 -0.037 0.000 1.033 501 L CA -0.007 54.835 54.840 0.002 0.000 0.807 501 L CB 1.708 43.759 42.059 -0.013 0.000 1.209 501 L HN 0.545 8.775 8.230 0.000 0.000 0.423 502 S N 1.582 117.264 115.700 -0.030 0.000 2.554 502 S HA 0.106 4.575 4.470 -0.001 0.000 0.278 502 S C 0.088 174.659 174.600 -0.049 0.000 1.242 502 S CA -0.372 57.800 58.200 -0.046 0.000 1.051 502 S CB 0.993 64.178 63.200 -0.025 0.000 0.986 502 S HN 0.768 9.078 8.310 0.000 0.000 0.502 503 D N 1.750 122.114 120.400 -0.059 0.000 2.697 503 D HA -0.198 4.441 4.640 -0.001 0.000 0.235 503 D C 0.075 176.352 176.300 -0.039 0.000 1.167 503 D CA 0.342 54.321 54.000 -0.034 0.000 0.656 503 D CB -1.513 39.292 40.800 0.008 0.000 1.025 503 D HN 0.652 9.022 8.370 0.000 0.000 0.419 504 I N -1.997 118.529 120.570 -0.072 0.000 2.880 504 I HA 0.174 4.344 4.170 -0.001 0.000 0.296 504 I C 0.670 176.758 176.117 -0.048 0.000 1.220 504 I CA -0.622 60.637 61.300 -0.068 0.000 1.435 504 I CB 0.252 38.190 38.000 -0.103 0.000 1.339 504 I HN 0.092 8.302 8.210 0.000 0.000 0.583 505 L N 4.299 125.500 121.223 -0.035 0.000 2.332 505 L HA 0.749 5.088 4.340 -0.001 0.000 0.269 505 L C 1.378 178.234 176.870 -0.023 0.000 1.016 505 L CA -0.091 54.740 54.840 -0.015 0.000 0.809 505 L CB 0.305 42.365 42.059 0.002 0.000 1.280 505 L HN 0.766 8.996 8.230 0.000 0.000 0.447 506 G N -0.343 108.464 108.800 0.011 0.000 2.869 506 G HA2 -0.355 3.604 3.960 -0.001 0.000 0.236 506 G HA3 -0.355 3.604 3.960 -0.001 0.000 0.236 506 G C 1.001 175.919 174.900 0.030 0.000 1.134 506 G CA 1.605 46.731 45.100 0.043 0.000 0.748 506 G HN 0.890 9.180 8.290 0.000 0.000 0.644 507 D N 0.377 120.796 120.400 0.031 0.000 2.323 507 D HA 0.012 4.651 4.640 -0.001 0.000 0.209 507 D C 2.234 178.523 176.300 -0.018 0.000 0.973 507 D CA 0.397 54.423 54.000 0.044 0.000 0.874 507 D CB -0.044 40.786 40.800 0.050 0.000 0.930 507 D HN 0.539 8.909 8.370 0.000 0.000 0.521 508 E N 0.628 120.793 120.200 -0.057 0.000 2.516 508 E HA -0.060 4.289 4.350 -0.001 0.000 0.199 508 E C 0.452 176.975 176.600 -0.128 0.000 1.069 508 E CA 0.296 56.657 56.400 -0.066 0.000 0.876 508 E CB 0.396 30.064 29.700 -0.053 0.000 0.843 508 E HN 0.181 8.541 8.360 0.000 0.000 0.530 509 D N -1.091 119.145 120.400 -0.274 0.000 2.569 509 D HA 0.053 4.692 4.640 -0.001 0.000 0.266 509 D C 0.211 176.211 176.300 -0.501 0.000 1.164 509 D CA -0.476 53.253 54.000 -0.452 0.000 1.071 509 D CB 0.586 40.980 40.800 -0.676 0.000 1.183 509 D HN 0.021 8.392 8.370 0.000 0.000 0.613 510 H N -0.747 118.329 119.070 0.009 0.000 3.047 510 H HA -0.181 4.375 4.556 -0.002 0.000 0.263 510 H C 1.100 176.443 175.328 0.024 0.000 1.168 510 H CA 0.476 56.534 56.048 0.018 0.000 1.152 510 H CB -1.672 28.101 29.762 0.019 0.000 1.278 510 H HN 0.182 8.462 8.280 0.000 0.000 0.339 511 L N -0.153 121.093 121.223 0.038 0.000 2.202 511 L HA 0.384 4.723 4.340 -0.001 0.000 0.205 511 L C 1.559 178.455 176.870 0.043 0.000 1.083 511 L CA 2.096 56.957 54.840 0.034 0.000 0.790 511 L CB 0.288 42.347 42.059 0.000 0.000 0.942 511 L HN 0.760 8.990 8.230 0.000 0.000 0.452 512 G N -1.808 107.015 108.800 0.038 0.000 2.497 512 G HA2 0.091 4.050 3.960 -0.001 0.000 0.686 512 G HA3 0.091 4.050 3.960 -0.001 0.000 0.686 512 G C -0.285 174.637 174.900 0.036 0.000 1.288 512 G CA -0.289 44.837 45.100 0.043 0.000 0.899 512 G HN 0.077 8.367 8.290 0.000 0.000 0.608 513 D N -1.495 118.926 120.400 0.035 0.000 4.195 513 D HA -0.199 4.440 4.640 -0.001 0.000 0.198 513 D C 0.727 177.044 176.300 0.028 0.000 1.063 513 D CA 2.579 56.597 54.000 0.030 0.000 2.321 513 D CB -0.829 39.992 40.800 0.036 0.000 1.163 513 D HN 1.604 9.974 8.370 0.000 0.000 0.415 514 M N 0.823 120.449 119.600 0.043 0.000 2.373 514 M HA 0.328 4.808 4.480 -0.001 0.000 0.290 514 M C -2.341 174.023 176.300 0.106 0.000 1.143 514 M CA -0.544 54.796 55.300 0.067 0.000 0.949 514 M CB 2.252 34.888 32.600 0.059 0.000 1.756 514 M HN 0.192 8.482 8.290 0.000 0.000 0.494 515 D N 4.167 124.642 120.400 0.125 0.000 2.934 515 D HA 0.645 5.284 4.640 -0.001 0.000 0.230 515 D C -1.441 174.977 176.300 0.197 0.000 1.204 515 D CA -0.199 53.855 54.000 0.090 0.000 0.873 515 D CB 1.762 42.553 40.800 -0.016 0.000 1.645 515 D HN 0.546 8.916 8.370 0.000 0.000 0.502 516 F N -1.331 118.599 119.950 -0.033 0.000 2.685 516 F HA 0.756 5.281 4.527 -0.002 0.000 0.315 516 F C -1.349 174.441 175.800 -0.018 0.000 1.126 516 F CA -1.053 56.931 58.000 -0.027 0.000 0.950 516 F CB 1.987 40.971 39.000 -0.026 0.000 1.360 516 F HN 0.086 8.386 8.300 0.000 0.000 0.469 517 K N 1.195 121.663 120.400 0.114 0.000 2.435 517 K HA 0.840 5.159 4.320 -0.001 0.000 0.251 517 K C -1.898 174.776 176.600 0.125 0.000 0.954 517 K CA -1.183 55.108 56.287 0.007 0.000 0.820 517 K CB 3.072 35.577 32.500 0.007 0.000 1.292 517 K HN 0.563 8.813 8.250 0.000 0.000 0.436 518 V N 0.861 120.816 119.914 0.068 0.000 2.777 518 V HA 0.694 4.813 4.120 -0.001 0.000 0.306 518 V C -1.243 174.880 176.094 0.047 0.000 1.112 518 V CA -0.919 61.436 62.300 0.092 0.000 0.917 518 V CB 1.763 33.669 31.823 0.138 0.000 1.018 518 V HN 0.930 9.120 8.190 0.000 0.000 0.426 519 A N 2.494 125.337 122.820 0.037 0.000 2.401 519 A HA 1.091 5.410 4.320 -0.001 0.000 0.310 519 A C 0.033 177.626 177.584 0.015 0.000 1.075 519 A CA -0.062 51.986 52.037 0.019 0.000 0.746 519 A CB 2.076 21.081 19.000 0.008 0.000 1.277 519 A HN 1.972 10.121 8.150 0.000 0.000 0.425 520 G N -0.485 108.320 108.800 0.007 0.000 2.316 520 G HA2 0.580 4.539 3.960 -0.001 0.000 0.296 520 G HA3 0.580 4.539 3.960 -0.001 0.000 0.296 520 G C -0.177 174.723 174.900 -0.001 0.000 1.399 520 G CA 0.239 45.340 45.100 0.002 0.000 0.833 520 G HN 1.786 10.076 8.290 0.000 0.000 0.565 521 S N -0.672 115.024 115.700 -0.007 0.000 2.546 521 S HA 0.428 4.897 4.470 -0.001 0.000 0.265 521 S C 1.503 176.103 174.600 -0.001 0.000 1.190 521 S CA 0.326 58.521 58.200 -0.008 0.000 1.014 521 S CB 1.237 64.427 63.200 -0.017 0.000 1.087 521 S HN 0.825 9.135 8.310 0.000 0.000 0.525 522 R N -0.215 120.284 120.500 -0.002 0.000 2.153 522 R HA 0.045 4.384 4.340 -0.001 0.000 0.218 522 R C 0.539 176.841 176.300 0.003 0.000 1.072 522 R CA 1.390 57.493 56.100 0.004 0.000 0.990 522 R CB -0.357 29.944 30.300 0.002 0.000 0.889 522 R HN 0.697 8.967 8.270 0.000 0.000 0.452 523 D N -1.416 118.981 120.400 -0.004 0.000 2.366 523 D HA 0.182 4.821 4.640 -0.001 0.000 0.205 523 D C 0.401 176.695 176.300 -0.009 0.000 1.022 523 D CA 0.742 54.739 54.000 -0.006 0.000 0.868 523 D CB 1.137 41.930 40.800 -0.010 0.000 0.953 523 D HN 0.322 8.692 8.370 0.000 0.000 0.514 524 G N -0.547 108.246 108.800 -0.011 0.000 2.550 524 G HA2 0.442 4.401 3.960 -0.001 0.000 0.293 524 G HA3 0.442 4.401 3.960 -0.001 0.000 0.293 524 G C -1.613 173.279 174.900 -0.012 0.000 1.402 524 G CA -0.734 44.356 45.100 -0.017 0.000 0.784 524 G HN -0.129 8.161 8.290 0.000 0.000 0.482 525 I N 1.573 122.132 120.570 -0.017 0.000 2.396 525 I HA 0.316 4.485 4.170 -0.001 0.000 0.292 525 I C 1.520 177.627 176.117 -0.016 0.000 0.999 525 I CA -0.411 60.885 61.300 -0.008 0.000 1.310 525 I CB 1.279 39.279 38.000 -0.001 0.000 1.404 525 I HN 0.642 8.852 8.210 0.000 0.000 0.496 526 S N 3.906 119.602 115.700 -0.006 0.000 2.506 526 S HA 0.536 5.005 4.470 -0.001 0.000 0.219 526 S C 0.505 175.105 174.600 0.001 0.000 1.031 526 S CA 0.172 58.368 58.200 -0.008 0.000 0.911 526 S CB 0.628 63.823 63.200 -0.007 0.000 0.812 526 S HN 0.755 9.065 8.310 0.000 0.000 0.497 527 A N 0.765 123.591 122.820 0.009 0.000 2.540 527 A HA 0.722 5.041 4.320 -0.001 0.000 0.297 527 A C -1.603 176.002 177.584 0.034 0.000 1.056 527 A CA -0.591 51.456 52.037 0.017 0.000 0.700 527 A CB 1.362 20.369 19.000 0.012 0.000 1.280 527 A HN 0.471 8.621 8.150 0.000 0.000 0.398 528 L N 1.789 123.035 121.223 0.039 0.000 2.476 528 L HA 0.599 4.938 4.340 -0.001 0.000 0.269 528 L C -0.987 175.920 176.870 0.061 0.000 0.965 528 L CA -0.235 54.641 54.840 0.061 0.000 0.845 528 L CB 1.932 44.018 42.059 0.044 0.000 1.259 528 L HN 0.970 9.200 8.230 0.000 0.000 0.403 529 Q N 5.018 124.872 119.800 0.090 0.000 2.340 529 Q HA 0.702 5.041 4.340 -0.001 0.000 0.268 529 Q C -1.656 174.416 176.000 0.121 0.000 1.031 529 Q CA -0.646 55.204 55.803 0.079 0.000 0.804 529 Q CB 2.384 31.160 28.738 0.064 0.000 1.286 529 Q HN 0.679 8.949 8.270 0.000 0.000 0.448 530 M N 2.624 122.268 119.600 0.073 0.000 2.324 530 M HA 0.398 4.877 4.480 -0.001 0.000 0.288 530 M C -1.695 174.626 176.300 0.035 0.000 1.097 530 M CA -0.821 54.525 55.300 0.076 0.000 0.928 530 M CB 2.300 34.893 32.600 -0.011 0.000 1.648 530 M HN 0.399 8.689 8.290 0.000 0.000 0.460 531 D N 3.657 124.086 120.400 0.048 0.000 2.408 531 D HA 0.493 5.132 4.640 -0.001 0.000 0.261 531 D C -0.981 175.331 176.300 0.020 0.000 1.190 531 D CA -0.040 53.973 54.000 0.022 0.000 0.910 531 D CB 1.110 41.922 40.800 0.020 0.000 1.097 531 D HN 0.467 8.837 8.370 0.000 0.000 0.522 532 I N 2.398 122.963 120.570 -0.008 0.000 2.304 532 I HA 0.204 4.373 4.170 -0.001 0.000 0.291 532 I C 1.568 177.676 176.117 -0.016 0.000 1.018 532 I CA -0.311 60.977 61.300 -0.019 0.000 1.260 532 I CB 1.517 39.484 38.000 -0.056 0.000 1.390 532 I HN 0.203 8.413 8.210 0.000 0.000 0.475 533 K N 7.886 128.285 120.400 -0.001 0.000 2.370 533 K HA 0.226 4.545 4.320 -0.001 0.000 0.194 533 K C 0.597 177.195 176.600 -0.002 0.000 1.070 533 K CA 0.049 56.338 56.287 0.004 0.000 0.998 533 K CB 0.371 32.885 32.500 0.023 0.000 0.911 533 K HN 0.680 8.930 8.250 0.000 0.000 0.533 534 I N -0.108 120.460 120.570 -0.003 0.000 2.934 534 I HA 0.259 4.428 4.170 -0.001 0.000 0.315 534 I C 0.203 176.309 176.117 -0.018 0.000 0.997 534 I CA -0.787 60.511 61.300 -0.005 0.000 1.184 534 I CB 1.613 39.616 38.000 0.005 0.000 1.400 534 I HN 0.167 8.377 8.210 0.000 0.000 0.549 535 E N 1.080 121.270 120.200 -0.017 0.000 2.630 535 E HA 0.252 4.601 4.350 -0.001 0.000 0.218 535 E C 1.075 177.665 176.600 -0.017 0.000 0.977 535 E CA -0.057 56.330 56.400 -0.022 0.000 1.038 535 E CB 0.654 30.339 29.700 -0.025 0.000 1.051 535 E HN 0.885 9.245 8.360 0.000 0.000 0.487 536 G N 1.269 110.061 108.800 -0.013 0.000 3.088 536 G HA2 0.160 4.119 3.960 -0.001 0.000 0.212 536 G HA3 0.160 4.119 3.960 -0.001 0.000 0.212 536 G C 0.184 175.073 174.900 -0.020 0.000 1.173 536 G CA -0.239 44.856 45.100 -0.008 0.000 0.779 536 G HN 0.131 8.421 8.290 0.000 0.000 0.540 537 I N 0.770 121.316 120.570 -0.041 0.000 2.291 537 I HA 0.332 4.501 4.170 -0.001 0.000 0.290 537 I C 1.102 177.179 176.117 -0.068 0.000 1.050 537 I CA -0.112 61.141 61.300 -0.078 0.000 1.245 537 I CB 1.400 39.333 38.000 -0.112 0.000 1.405 537 I HN -0.103 8.107 8.210 0.000 0.000 0.478 538 T N 3.467 117.985 114.554 -0.059 0.000 3.252 538 T HA 0.160 4.509 4.350 -0.001 0.000 0.233 538 T C 1.489 176.155 174.700 -0.056 0.000 0.975 538 T CA 0.884 62.960 62.100 -0.040 0.000 1.318 538 T CB 0.286 69.141 68.868 -0.021 0.000 1.014 538 T HN 0.525 8.765 8.240 0.000 0.000 0.418 539 K N -0.490 119.877 120.400 -0.056 0.000 2.868 539 K HA 0.139 4.458 4.320 -0.001 0.000 0.217 539 K C 2.090 178.654 176.600 -0.060 0.000 1.712 539 K CA 0.437 56.689 56.287 -0.059 0.000 1.134 539 K CB -0.281 32.198 32.500 -0.036 0.000 2.040 539 K HN 0.187 8.437 8.250 0.000 0.000 0.487 540 E N 2.491 122.675 120.200 -0.028 0.000 2.136 540 E HA -0.233 4.116 4.350 -0.001 0.000 0.202 540 E C 2.003 178.587 176.600 -0.027 0.000 1.019 540 E CA 1.269 57.665 56.400 -0.007 0.000 0.819 540 E CB -0.497 29.219 29.700 0.026 0.000 0.739 540 E HN 0.257 8.617 8.360 0.000 0.000 0.458 541 I N 0.981 121.503 120.570 -0.080 0.000 2.118 541 I HA -0.191 3.979 4.170 -0.001 0.000 0.241 541 I C 1.879 177.841 176.117 -0.258 0.000 1.070 541 I CA 0.930 62.072 61.300 -0.262 0.000 1.327 541 I CB -1.007 36.741 38.000 -0.419 0.000 1.034 541 I HN 0.148 8.358 8.210 0.000 0.000 0.405 542 M N 0.808 120.280 119.600 -0.213 0.000 2.383 542 M HA 0.084 4.563 4.480 -0.001 0.000 0.337 542 M C 0.740 176.956 176.300 -0.141 0.000 1.422 542 M CA 0.679 55.848 55.300 -0.219 0.000 1.333 542 M CB 0.050 32.526 32.600 -0.207 0.000 1.488 542 M HN 0.378 8.668 8.290 0.000 0.000 0.454 543 Q N 1.491 121.223 119.800 -0.113 0.000 7.936 543 Q HA -0.116 4.223 4.340 -0.001 0.000 0.368 543 Q C -0.132 175.864 176.000 -0.007 0.000 0.943 543 Q CA 0.233 56.006 55.803 -0.050 0.000 0.541 543 Q CB -0.464 28.257 28.738 -0.030 0.000 0.164 543 Q HN 0.570 8.840 8.270 0.000 0.000 0.899 544 V N 0.973 120.888 119.914 0.001 0.000 2.302 544 V HA -0.016 4.103 4.120 -0.001 0.000 0.243 544 V C 2.336 178.476 176.094 0.078 0.000 1.036 544 V CA 2.199 64.541 62.300 0.070 0.000 1.020 544 V CB -0.729 31.189 31.823 0.159 0.000 0.657 544 V HN 0.483 8.673 8.190 0.000 0.000 0.453 545 A N -0.112 122.731 122.820 0.038 0.000 1.845 545 A HA -0.130 4.189 4.320 -0.001 0.000 0.215 545 A C 2.143 179.825 177.584 0.163 0.000 1.195 545 A CA 1.521 53.630 52.037 0.121 0.000 0.616 545 A CB -0.715 18.301 19.000 0.026 0.000 0.832 545 A HN 0.366 8.516 8.150 0.000 0.000 0.443 546 L N 0.404 121.616 121.223 -0.018 0.000 2.549 546 L HA -0.065 4.274 4.340 -0.001 0.000 0.230 546 L C 1.584 178.496 176.870 0.070 0.000 1.162 546 L CA 1.414 56.263 54.840 0.015 0.000 0.834 546 L CB -1.052 40.940 42.059 -0.110 0.000 0.947 546 L HN 0.535 8.765 8.230 0.000 0.000 0.452 547 N N -0.981 117.759 118.700 0.066 0.000 2.294 547 N HA -0.086 4.653 4.740 -0.001 0.000 0.186 547 N C 1.562 177.117 175.510 0.074 0.000 1.107 547 N CA 0.112 53.199 53.050 0.060 0.000 0.884 547 N CB 0.716 39.229 38.487 0.043 0.000 1.030 547 N HN 0.483 8.863 8.380 0.000 0.000 0.482 548 Q N 0.305 120.164 119.800 0.098 0.000 2.123 548 Q HA 0.129 4.468 4.340 -0.001 0.000 0.196 548 Q C 1.832 177.886 176.000 0.090 0.000 0.958 548 Q CA 1.042 56.898 55.803 0.089 0.000 0.841 548 Q CB -0.033 28.766 28.738 0.102 0.000 0.915 548 Q HN 0.234 8.504 8.270 0.000 0.000 0.455 549 A N 1.598 124.499 122.820 0.134 0.000 2.024 549 A HA -0.228 4.091 4.320 -0.001 0.000 0.220 549 A C 2.028 179.667 177.584 0.091 0.000 1.164 549 A CA 1.679 53.785 52.037 0.115 0.000 0.643 549 A CB -0.601 18.527 19.000 0.212 0.000 0.806 549 A HN 0.442 8.592 8.150 0.000 0.000 0.451 550 K N -0.540 119.914 120.400 0.090 0.000 2.026 550 K HA -0.118 4.202 4.320 -0.001 0.000 0.208 550 K C 2.055 178.693 176.600 0.063 0.000 1.048 550 K CA 1.568 57.897 56.287 0.069 0.000 0.929 550 K CB -0.575 31.959 32.500 0.057 0.000 0.713 550 K HN 0.357 8.607 8.250 0.000 0.000 0.439 551 G N 0.341 109.177 108.800 0.060 0.000 2.402 551 G HA2 -0.210 3.749 3.960 -0.001 0.000 0.216 551 G HA3 -0.210 3.749 3.960 -0.001 0.000 0.216 551 G C 1.597 176.543 174.900 0.077 0.000 1.162 551 G CA 0.807 45.943 45.100 0.060 0.000 0.777 551 G HN 0.448 8.738 8.290 0.000 0.000 0.539 552 A N 0.482 123.338 122.820 0.061 0.000 2.024 552 A HA -0.026 4.294 4.320 -0.001 0.000 0.220 552 A C 2.286 179.936 177.584 0.111 0.000 1.164 552 A CA 1.842 53.917 52.037 0.064 0.000 0.643 552 A CB -0.366 18.651 19.000 0.029 0.000 0.806 552 A HN 0.397 8.547 8.150 0.000 0.000 0.451 553 R N -0.478 120.075 120.500 0.088 0.000 2.075 553 R HA 0.104 4.443 4.340 -0.001 0.000 0.226 553 R C 1.797 178.147 176.300 0.083 0.000 1.114 553 R CA 0.916 57.063 56.100 0.079 0.000 0.972 553 R CB -0.292 30.042 30.300 0.058 0.000 0.869 553 R HN 0.492 8.762 8.270 0.000 0.000 0.437 554 L N -0.078 121.195 121.223 0.084 0.000 2.201 554 L HA -0.152 4.187 4.340 -0.001 0.000 0.212 554 L C 2.425 179.348 176.870 0.088 0.000 1.105 554 L CA 1.284 56.167 54.840 0.071 0.000 0.775 554 L CB -0.555 41.542 42.059 0.063 0.000 0.913 554 L HN 0.364 8.594 8.230 0.000 0.000 0.440 555 H N 0.580 119.667 119.070 0.029 0.000 2.293 555 H HA -0.181 4.375 4.556 -0.001 0.000 0.300 555 H C 2.182 177.534 175.328 0.039 0.000 1.082 555 H CA 1.888 57.954 56.048 0.030 0.000 1.308 555 H CB 0.140 29.919 29.762 0.028 0.000 1.375 555 H HN 0.022 8.302 8.280 0.000 0.000 0.495 556 I N 0.293 120.900 120.570 0.063 0.000 2.208 556 I HA -0.237 3.932 4.170 -0.001 0.000 0.245 556 I C 2.474 178.594 176.117 0.006 0.000 1.097 556 I CA 1.090 62.411 61.300 0.035 0.000 1.363 556 I CB -1.178 36.896 38.000 0.122 0.000 1.051 556 I HN 0.330 8.540 8.210 0.000 0.000 0.413 557 L N 0.636 121.867 121.223 0.013 0.000 2.191 557 L HA -0.120 4.219 4.340 -0.001 0.000 0.212 557 L C 2.644 179.501 176.870 -0.022 0.000 1.103 557 L CA 1.401 56.244 54.840 0.004 0.000 0.769 557 L CB -0.897 41.167 42.059 0.010 0.000 0.908 557 L HN 0.279 8.509 8.230 0.000 0.000 0.438 558 G N -0.655 108.110 108.800 -0.058 0.000 2.440 558 G HA2 -0.201 3.759 3.960 -0.001 0.000 0.218 558 G HA3 -0.201 3.759 3.960 -0.001 0.000 0.218 558 G C 1.543 176.389 174.900 -0.090 0.000 1.154 558 G CA 1.066 46.117 45.100 -0.083 0.000 0.767 558 G HN 0.221 8.511 8.290 0.000 0.000 0.552 559 V N 0.961 120.802 119.914 -0.121 0.000 2.323 559 V HA -0.145 3.974 4.120 -0.001 0.000 0.244 559 V C 2.870 178.954 176.094 -0.018 0.000 1.041 559 V CA 1.996 64.248 62.300 -0.079 0.000 1.025 559 V CB -0.505 31.266 31.823 -0.087 0.000 0.656 559 V HN 0.338 8.528 8.190 0.000 0.000 0.451 560 M N 0.098 119.707 119.600 0.016 0.000 2.144 560 M HA -0.228 4.251 4.480 -0.001 0.000 0.260 560 M C 2.175 178.485 176.300 0.016 0.000 1.067 560 M CA 2.010 57.337 55.300 0.045 0.000 1.095 560 M CB -0.484 32.151 32.600 0.059 0.000 1.365 560 M HN 0.329 8.619 8.290 0.000 0.000 0.406 561 E N 0.749 120.948 120.200 -0.001 0.000 2.401 561 E HA -0.179 4.170 4.350 -0.001 0.000 0.199 561 E C 1.447 178.042 176.600 -0.008 0.000 1.023 561 E CA 1.267 57.662 56.400 -0.007 0.000 0.859 561 E CB -0.120 29.572 29.700 -0.013 0.000 0.780 561 E HN 0.553 8.913 8.360 0.000 0.000 0.523 562 Q N -0.627 119.168 119.800 -0.009 0.000 2.403 562 Q HA 0.283 4.622 4.340 -0.001 0.000 0.203 562 Q C 0.045 176.043 176.000 -0.003 0.000 0.932 562 Q CA 0.395 56.193 55.803 -0.009 0.000 0.945 562 Q CB 0.735 29.465 28.738 -0.014 0.000 1.045 562 Q HN 0.247 8.517 8.270 0.000 0.000 0.511 563 A N 0.000 122.822 122.820 0.003 0.000 2.254 563 A HA 0.000 4.319 4.320 -0.001 0.000 0.244 563 A CA 0.000 52.041 52.037 0.007 0.000 0.836 563 A CB 0.000 19.011 19.000 0.018 0.000 0.831 563 A HN 0.000 8.150 8.150 0.000 0.000 0.486