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 3inl_1_G DATA FIRST_RESID 7 DATA SEQUENCE AVPAPNQQPE VFCNQIFINN EWHDAVSRKT FPTVNPSTGE VICQVAEGDK DATA SEQUENCE EDVDKAVKAA RAAFQLGSPW RRMDASHRGR LLNRLADLIE RDRTYLAALE DATA SEQUENCE TLDNGKPYVI SYLVDLDMVL KCLRYYAGWA DKYHGKTIPI DGDFFSYTRH DATA SEQUENCE EPVGVCGQII PWNFPLLMQA WKLGPALATG NVVVMKVAEQ TPLTALYVAN DATA SEQUENCE LIKEAGFPPG VVNIVPGFGP TAGAAIASHE DVDKVAFTGS TEIGRVIQVA DATA SEQUENCE AGSSNLKRVT LELGGKSPNI IMSDADMDWA VEQAHFALFF NQGQCSCAGS DATA SEQUENCE RTFVQEDIYD EFVERSVARA KSRVVGNPFD SKTEQGPQVD ETQFKKILGY DATA SEQUENCE INTGKQEGAK LLCGGGIAAD RGYFIQPTVF GDVQDGMTIA KEEIFGPVMQ DATA SEQUENCE ILKFKTIEEV VGRANNSTYG LAAAVFTKDL DKANYLSQAL QAGTVWVNCY DATA SEQUENCE DVFGAQSPFG GYKMSGSGRE LGEYGLQAYT KVKTVTVKVP QKNS 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 7 A HA 0.000 4.320 4.320 -0.000 0.000 0.244 7 A C 0.000 177.572 177.584 -0.020 0.000 1.274 7 A CA 0.000 52.047 52.037 0.017 0.000 0.836 7 A CB 0.000 19.021 19.000 0.035 0.000 0.831 8 V N 2.495 122.363 119.914 -0.077 0.000 2.398 8 V HA 0.508 4.631 4.120 0.006 0.000 0.286 8 V C -1.975 174.015 176.094 -0.174 0.000 1.026 8 V CA -1.516 60.623 62.300 -0.268 0.000 0.868 8 V CB 1.302 32.979 31.823 -0.243 0.000 0.982 8 V HN 0.728 8.918 8.190 -0.000 0.000 0.443 9 P HA 0.248 4.668 4.420 -0.000 0.000 0.266 9 P C -0.154 177.158 177.300 0.021 0.000 1.195 9 P CA -0.036 63.028 63.100 -0.060 0.000 0.768 9 P CB 0.442 32.130 31.700 -0.020 0.000 0.838 10 A N 4.793 127.610 122.820 -0.004 0.000 2.511 10 A HA 0.364 4.688 4.320 0.006 0.000 0.242 10 A C -1.919 175.580 177.584 -0.142 0.000 1.069 10 A CA -0.683 51.322 52.037 -0.054 0.000 0.763 10 A CB -1.135 17.831 19.000 -0.056 0.000 1.001 10 A HN 0.416 8.566 8.150 -0.000 0.000 0.498 11 P HA 0.181 4.601 4.420 -0.000 0.000 0.282 11 P C -0.618 176.464 177.300 -0.363 0.000 1.249 11 P CA -0.780 61.984 63.100 -0.559 0.000 0.806 11 P CB 0.574 31.645 31.700 -1.049 0.000 0.984 12 N N 1.996 120.545 118.700 -0.252 0.000 2.399 12 N HA -0.022 4.722 4.740 0.006 0.000 0.259 12 N C 0.781 176.004 175.510 -0.477 0.000 1.160 12 N CA 0.387 53.288 53.050 -0.248 0.000 0.946 12 N CB 0.299 38.734 38.487 -0.087 0.000 1.156 12 N HN 0.335 8.715 8.380 -0.000 0.000 0.489 13 Q N 2.095 121.499 119.800 -0.659 0.000 2.437 13 Q HA -0.016 4.328 4.340 0.006 0.000 0.210 13 Q C -0.251 175.337 176.000 -0.686 0.000 0.972 13 Q CA 1.108 56.218 55.803 -1.154 0.000 0.903 13 Q CB 0.260 28.499 28.738 -0.833 0.000 0.967 13 Q HN 0.635 8.905 8.270 -0.000 0.000 0.486 14 Q N 0.826 120.405 119.800 -0.367 0.000 3.300 14 Q HA 0.263 4.606 4.340 0.006 0.000 0.271 14 Q C -2.465 173.455 176.000 -0.133 0.000 0.926 14 Q CA -1.623 54.058 55.803 -0.202 0.000 0.788 14 Q CB 1.526 30.169 28.738 -0.158 0.000 1.385 14 Q HN 0.139 8.409 8.270 -0.000 0.000 0.424 15 P HA -0.045 4.375 4.420 -0.000 0.000 0.272 15 P C -0.321 176.949 177.300 -0.049 0.000 1.223 15 P CA -0.076 63.017 63.100 -0.011 0.000 0.784 15 P CB 1.036 32.720 31.700 -0.027 0.000 0.923 16 E N 0.944 121.097 120.200 -0.078 0.000 2.383 16 E HA 0.202 4.556 4.350 0.006 0.000 0.264 16 E C -0.827 175.452 176.600 -0.534 0.000 1.050 16 E CA -0.604 55.580 56.400 -0.360 0.000 0.896 16 E CB 0.664 30.040 29.700 -0.540 0.000 0.982 16 E HN 0.126 8.486 8.360 -0.000 0.000 0.424 17 V N 5.934 125.552 119.914 -0.493 0.000 2.370 17 V HA 0.133 4.257 4.120 0.006 0.000 0.279 17 V C 0.033 175.856 176.094 -0.453 0.000 1.029 17 V CA -0.076 62.008 62.300 -0.360 0.000 0.870 17 V CB 0.817 32.528 31.823 -0.187 0.000 0.984 17 V HN 0.711 8.901 8.190 -0.000 0.000 0.451 18 F N 1.683 121.656 119.950 0.037 0.000 2.694 18 F HA 0.252 4.783 4.527 0.006 0.000 0.292 18 F C 0.928 176.630 175.800 -0.164 0.000 1.121 18 F CA -0.021 57.967 58.000 -0.020 0.000 1.352 18 F CB 0.460 39.502 39.000 0.070 0.000 1.107 18 F HN 0.385 8.685 8.300 -0.000 0.000 0.597 19 C N 1.826 121.102 119.300 -0.041 0.000 2.397 19 C HA 0.422 4.886 4.460 0.006 0.000 0.325 19 C C 0.124 174.916 174.990 -0.330 0.000 1.201 19 C CA -0.878 57.866 59.018 -0.457 0.000 1.377 19 C CB 0.576 28.000 27.740 -0.526 0.000 2.038 19 C HN 0.520 8.750 8.230 -0.000 0.000 0.457 20 N N 1.189 119.668 118.700 -0.368 0.000 2.381 20 N HA 0.099 4.843 4.740 0.006 0.000 0.257 20 N C -0.470 174.996 175.510 -0.074 0.000 1.409 20 N CA -0.263 52.682 53.050 -0.175 0.000 0.836 20 N CB 0.019 38.412 38.487 -0.156 0.000 1.384 20 N HN 0.787 9.167 8.380 -0.000 0.000 0.490 21 Q N -0.168 119.628 119.800 -0.006 0.000 3.226 21 Q HA 0.599 4.943 4.340 0.006 0.000 0.276 21 Q C -0.599 175.717 176.000 0.527 0.000 1.029 21 Q CA -0.966 54.999 55.803 0.271 0.000 0.854 21 Q CB 1.715 30.654 28.738 0.333 0.000 1.567 21 Q HN 0.153 8.423 8.270 -0.000 0.000 0.481 22 I N 1.022 121.906 120.570 0.524 0.000 2.385 22 I HA 0.235 4.409 4.170 0.006 0.000 0.294 22 I C -0.950 175.439 176.117 0.453 0.000 0.988 22 I CA -0.319 61.249 61.300 0.447 0.000 1.265 22 I CB 0.770 38.940 38.000 0.284 0.000 1.388 22 I HN 0.365 8.575 8.210 -0.000 0.000 0.480 23 F N 8.065 128.053 119.950 0.062 0.000 2.332 23 F HA 0.616 5.147 4.527 0.006 0.000 0.368 23 F C -0.586 175.112 175.800 -0.170 0.000 1.110 23 F CA -0.439 57.364 58.000 -0.327 0.000 1.087 23 F CB 0.348 39.000 39.000 -0.580 0.000 1.235 23 F HN 0.166 8.466 8.300 -0.000 0.000 0.470 24 I N 5.223 125.532 120.570 -0.437 0.000 2.569 24 I HA 0.226 4.400 4.170 0.006 0.000 0.290 24 I C -0.328 175.545 176.117 -0.406 0.000 1.088 24 I CA -1.161 59.919 61.300 -0.366 0.000 1.047 24 I CB 1.857 39.669 38.000 -0.314 0.000 1.237 24 I HN 0.429 8.639 8.210 -0.000 0.000 0.421 25 N N 4.511 122.991 118.700 -0.367 0.000 2.727 25 N HA -0.248 4.495 4.740 0.006 0.000 0.249 25 N C 0.044 175.315 175.510 -0.398 0.000 1.048 25 N CA 1.258 54.139 53.050 -0.281 0.000 0.714 25 N CB -1.093 37.310 38.487 -0.141 0.000 0.959 25 N HN 0.942 9.322 8.380 -0.000 0.000 0.544 26 N N -1.639 116.600 118.700 -0.769 0.000 2.708 26 N HA -0.246 4.497 4.740 0.006 0.000 0.251 26 N C -0.845 174.229 175.510 -0.728 0.000 1.123 26 N CA 1.228 53.779 53.050 -0.830 0.000 0.739 26 N CB -0.377 37.965 38.487 -0.243 0.000 1.113 26 N HN 0.620 9.000 8.380 -0.000 0.000 0.561 27 E N -0.927 118.790 120.200 -0.806 0.000 2.336 27 E HA 0.396 4.750 4.350 0.006 0.000 0.267 27 E C -0.985 175.260 176.600 -0.591 0.000 0.906 27 E CA -0.701 55.384 56.400 -0.524 0.000 0.781 27 E CB 1.128 30.640 29.700 -0.313 0.000 1.261 27 E HN 0.132 8.492 8.360 -0.000 0.000 0.436 28 W N 1.755 122.942 121.300 -0.188 0.000 2.391 28 W HA 0.305 4.969 4.660 0.006 0.000 0.311 28 W C 0.161 176.530 176.519 -0.251 0.000 1.087 28 W CA -0.381 56.933 57.345 -0.052 0.000 1.209 28 W CB 0.884 30.375 29.460 0.052 0.000 1.273 28 W HN 0.278 8.458 8.180 -0.000 0.000 0.482 29 H N 1.940 121.183 119.070 0.287 0.000 2.690 29 H HA 0.219 4.779 4.556 0.006 0.000 0.368 29 H C -0.591 174.848 175.328 0.184 0.000 1.150 29 H CA -0.935 55.217 56.048 0.172 0.000 1.174 29 H CB 1.905 31.722 29.762 0.092 0.000 1.684 29 H HN 0.237 8.517 8.280 -0.000 0.000 0.538 30 D N 0.741 121.288 120.400 0.244 0.000 2.358 30 D HA 0.262 4.905 4.640 0.006 0.000 0.244 30 D C 0.404 176.814 176.300 0.185 0.000 1.163 30 D CA -0.354 53.758 54.000 0.186 0.000 0.945 30 D CB 1.064 41.941 40.800 0.130 0.000 1.152 30 D HN 0.609 8.979 8.370 -0.000 0.000 0.451 31 A N 0.768 123.684 122.820 0.161 0.000 2.483 31 A HA 0.105 4.429 4.320 0.006 0.000 0.238 31 A C 1.596 179.246 177.584 0.110 0.000 1.070 31 A CA -0.475 51.646 52.037 0.140 0.000 0.770 31 A CB 0.275 19.364 19.000 0.148 0.000 1.008 31 A HN 0.422 8.572 8.150 -0.000 0.000 0.497 32 V N 2.213 122.180 119.914 0.088 0.000 2.370 32 V HA -0.288 3.836 4.120 0.006 0.000 0.252 32 V C 2.699 178.834 176.094 0.067 0.000 1.068 32 V CA 2.878 65.220 62.300 0.070 0.000 1.061 32 V CB -0.956 30.898 31.823 0.052 0.000 0.656 32 V HN 1.126 9.316 8.190 -0.000 0.000 0.455 33 S N -0.939 114.804 115.700 0.072 0.000 2.522 33 S HA -0.055 4.419 4.470 0.006 0.000 0.227 33 S C 1.238 175.881 174.600 0.071 0.000 0.986 33 S CA 0.574 58.814 58.200 0.065 0.000 0.929 33 S CB -0.207 63.033 63.200 0.067 0.000 0.769 33 S HN 0.613 8.923 8.310 -0.000 0.000 0.529 34 R N -0.046 120.504 120.500 0.084 0.000 3.954 34 R HA -0.117 4.226 4.340 0.006 0.000 0.422 34 R C -0.675 175.679 176.300 0.090 0.000 1.091 34 R CA 1.106 57.256 56.100 0.084 0.000 1.168 34 R CB -2.006 28.334 30.300 0.065 0.000 1.752 34 R HN 0.492 8.762 8.270 -0.000 0.000 0.547 35 K N 1.442 121.906 120.400 0.107 0.000 2.295 35 K HA 0.182 4.505 4.320 0.006 0.000 0.270 35 K C 0.764 177.464 176.600 0.167 0.000 1.011 35 K CA 0.830 57.194 56.287 0.127 0.000 0.953 35 K CB 0.748 33.330 32.500 0.136 0.000 0.956 35 K HN 0.185 8.435 8.250 -0.000 0.000 0.477 36 T N -0.957 113.696 114.554 0.166 0.000 2.887 36 T HA 0.713 5.066 4.350 0.006 0.000 0.292 36 T C -0.778 174.084 174.700 0.269 0.000 1.087 36 T CA -1.034 61.163 62.100 0.161 0.000 1.009 36 T CB 0.802 69.690 68.868 0.033 0.000 1.203 36 T HN 0.487 8.727 8.240 -0.000 0.000 0.518 37 F N -1.414 118.609 119.950 0.121 0.000 2.591 37 F HA 0.814 5.344 4.527 0.006 0.000 0.309 37 F C -3.336 172.516 175.800 0.087 0.000 1.098 37 F CA -3.015 55.077 58.000 0.154 0.000 0.937 37 F CB 1.125 40.308 39.000 0.306 0.000 1.250 37 F HN 0.351 8.651 8.300 -0.000 0.000 0.447 38 P HA 0.212 4.632 4.420 -0.000 0.000 0.280 38 P C -0.577 176.746 177.300 0.038 0.000 1.244 38 P CA -0.131 62.972 63.100 0.004 0.000 0.784 38 P CB 1.602 33.340 31.700 0.063 0.000 0.913 39 T N 2.089 116.600 114.554 -0.072 0.000 2.867 39 T HA 0.450 4.803 4.350 0.006 0.000 0.282 39 T C -0.563 174.134 174.700 -0.005 0.000 1.000 39 T CA -0.541 61.556 62.100 -0.006 0.000 1.042 39 T CB 0.362 69.203 68.868 -0.045 0.000 0.973 39 T HN 0.020 8.260 8.240 -0.000 0.000 0.465 40 V N 5.119 125.042 119.914 0.014 0.000 2.667 40 V HA 0.430 4.554 4.120 0.006 0.000 0.308 40 V C 0.369 176.468 176.094 0.008 0.000 1.048 40 V CA -1.078 61.233 62.300 0.018 0.000 0.928 40 V CB 1.784 33.639 31.823 0.053 0.000 1.004 40 V HN 0.964 9.154 8.190 -0.000 0.000 0.444 41 N N 5.151 123.854 118.700 0.004 0.000 2.415 41 N HA 0.250 4.994 4.740 0.006 0.000 0.246 41 N C -1.686 173.820 175.510 -0.007 0.000 1.078 41 N CA -1.467 51.582 53.050 -0.002 0.000 0.942 41 N CB 1.432 39.920 38.487 0.003 0.000 1.140 41 N HN 0.393 8.773 8.380 -0.000 0.000 0.501 42 P HA -0.029 4.391 4.420 -0.000 0.000 0.230 42 P C 0.475 177.666 177.300 -0.182 0.000 1.158 42 P CA 0.748 63.868 63.100 0.034 0.000 0.769 42 P CB 0.376 32.092 31.700 0.028 0.000 0.807 43 S N -0.732 114.903 115.700 -0.107 0.000 2.470 43 S HA -0.026 4.447 4.470 0.006 0.000 0.225 43 S C 1.738 176.373 174.600 0.058 0.000 1.006 43 S CA 1.675 59.881 58.200 0.010 0.000 0.934 43 S CB -0.500 62.776 63.200 0.127 0.000 0.778 43 S HN 0.440 8.750 8.310 -0.000 0.000 0.517 44 T N -3.406 111.118 114.554 -0.050 0.000 2.954 44 T HA 0.435 4.789 4.350 0.006 0.000 0.252 44 T C 1.434 176.044 174.700 -0.150 0.000 0.983 44 T CA 0.830 62.891 62.100 -0.065 0.000 0.941 44 T CB 0.339 69.190 68.868 -0.029 0.000 1.141 44 T HN 0.453 8.693 8.240 -0.000 0.000 0.500 45 G N 1.583 110.263 108.800 -0.200 0.000 2.148 45 G HA2 -0.191 3.772 3.960 0.006 0.000 0.254 45 G HA3 -0.191 3.772 3.960 0.006 0.000 0.254 45 G C -0.241 174.618 174.900 -0.068 0.000 0.981 45 G CA 0.209 45.190 45.100 -0.199 0.000 0.670 45 G HN 0.625 8.915 8.290 -0.000 0.000 0.528 46 E N -0.257 119.913 120.200 -0.050 0.000 2.222 46 E HA 0.533 4.886 4.350 0.006 0.000 0.272 46 E C 0.524 177.115 176.600 -0.016 0.000 0.982 46 E CA -0.839 55.543 56.400 -0.030 0.000 0.842 46 E CB 2.001 31.681 29.700 -0.034 0.000 1.144 46 E HN 0.109 8.469 8.360 -0.000 0.000 0.397 47 V N 3.832 123.738 119.914 -0.013 0.000 2.521 47 V HA -0.004 4.119 4.120 0.006 0.000 0.286 47 V C 1.695 177.771 176.094 -0.030 0.000 1.034 47 V CA 0.402 62.693 62.300 -0.014 0.000 1.045 47 V CB 0.135 31.952 31.823 -0.011 0.000 0.974 47 V HN 0.614 8.804 8.190 -0.000 0.000 0.480 48 I N 4.019 124.567 120.570 -0.037 0.000 2.296 48 I HA 0.033 4.207 4.170 0.006 0.000 0.242 48 I C 1.068 177.143 176.117 -0.069 0.000 1.087 48 I CA 1.317 62.586 61.300 -0.051 0.000 1.393 48 I CB 0.111 38.080 38.000 -0.051 0.000 1.093 48 I HN 0.877 9.087 8.210 -0.000 0.000 0.421 49 C N -2.113 117.137 119.300 -0.083 0.000 3.260 49 C HA 0.447 4.911 4.460 0.006 0.000 0.366 49 C C -1.424 173.486 174.990 -0.132 0.000 1.537 49 C CA -1.049 57.909 59.018 -0.101 0.000 1.160 49 C CB 1.382 29.053 27.740 -0.116 0.000 1.760 49 C HN 0.216 8.446 8.230 -0.000 0.000 0.432 50 Q N 0.310 120.021 119.800 -0.148 0.000 2.297 50 Q HA 0.810 5.153 4.340 0.006 0.000 0.268 50 Q C -1.155 174.672 176.000 -0.288 0.000 1.045 50 Q CA -0.480 55.200 55.803 -0.205 0.000 0.861 50 Q CB 2.310 30.980 28.738 -0.114 0.000 1.344 50 Q HN 0.722 8.992 8.270 -0.000 0.000 0.452 51 V N 0.404 120.021 119.914 -0.495 0.000 2.760 51 V HA 0.449 4.573 4.120 0.006 0.000 0.309 51 V C -0.492 175.440 176.094 -0.270 0.000 1.077 51 V CA -1.174 60.840 62.300 -0.476 0.000 0.910 51 V CB 1.857 33.217 31.823 -0.771 0.000 1.008 51 V HN 0.927 9.117 8.190 -0.000 0.000 0.424 52 A N 2.632 125.449 122.820 -0.004 0.000 2.580 52 A HA 0.155 4.479 4.320 0.006 0.000 0.244 52 A C 0.389 178.183 177.584 0.349 0.000 1.045 52 A CA 0.417 52.550 52.037 0.160 0.000 0.761 52 A CB -0.153 18.961 19.000 0.190 0.000 0.962 52 A HN 0.929 9.079 8.150 -0.000 0.000 0.512 53 E N 3.031 123.472 120.200 0.402 0.000 1.993 53 E HA 0.397 4.751 4.350 0.006 0.000 0.271 53 E C 0.611 177.380 176.600 0.283 0.000 1.008 53 E CA -0.256 56.434 56.400 0.483 0.000 0.814 53 E CB 0.240 30.242 29.700 0.503 0.000 1.098 53 E HN 0.793 9.153 8.360 -0.000 0.000 0.407 54 G N 3.433 112.380 108.800 0.246 0.000 2.483 54 G HA2 0.115 4.079 3.960 0.006 0.000 0.248 54 G HA3 0.115 4.079 3.960 0.006 0.000 0.248 54 G C -0.425 174.559 174.900 0.140 0.000 1.248 54 G CA -0.261 44.943 45.100 0.173 0.000 0.838 54 G HN 0.579 8.869 8.290 -0.000 0.000 0.566 55 D N -0.417 120.049 120.400 0.109 0.000 2.904 55 D HA 0.212 4.856 4.640 0.006 0.000 0.290 55 D C 1.442 177.785 176.300 0.072 0.000 1.180 55 D CA -0.807 53.245 54.000 0.087 0.000 1.065 55 D CB 1.446 42.290 40.800 0.073 0.000 1.386 55 D HN 0.265 8.635 8.370 -0.000 0.000 0.599 56 K N 0.252 120.686 120.400 0.057 0.000 2.059 56 K HA -0.208 4.116 4.320 0.006 0.000 0.212 56 K C 1.539 178.174 176.600 0.058 0.000 1.050 56 K CA 1.892 58.211 56.287 0.053 0.000 0.927 56 K CB 0.021 32.539 32.500 0.029 0.000 0.714 56 K HN 0.320 8.570 8.250 -0.000 0.000 0.447 57 E N 0.189 120.417 120.200 0.048 0.000 2.110 57 E HA -0.174 4.180 4.350 0.006 0.000 0.193 57 E C 1.757 178.382 176.600 0.042 0.000 0.988 57 E CA 1.363 57.788 56.400 0.042 0.000 0.804 57 E CB -0.015 29.706 29.700 0.035 0.000 0.745 57 E HN 0.429 8.789 8.360 -0.000 0.000 0.458 58 D N 0.498 120.927 120.400 0.048 0.000 2.144 58 D HA -0.117 4.526 4.640 0.006 0.000 0.200 58 D C 2.147 178.466 176.300 0.031 0.000 0.978 58 D CA 0.827 54.850 54.000 0.038 0.000 0.833 58 D CB -0.102 40.739 40.800 0.068 0.000 0.961 58 D HN 0.050 8.420 8.370 -0.000 0.000 0.470 59 V N 2.054 122.002 119.914 0.057 0.000 2.343 59 V HA -0.228 3.896 4.120 0.006 0.000 0.247 59 V C 1.961 178.089 176.094 0.057 0.000 1.051 59 V CA 1.763 64.098 62.300 0.058 0.000 1.036 59 V CB -0.441 31.439 31.823 0.095 0.000 0.654 59 V HN 0.026 8.216 8.190 -0.000 0.000 0.451 60 D N 0.078 120.544 120.400 0.111 0.000 2.123 60 D HA -0.175 4.468 4.640 0.006 0.000 0.196 60 D C 2.240 178.571 176.300 0.052 0.000 0.992 60 D CA 1.325 55.419 54.000 0.157 0.000 0.833 60 D CB -0.237 40.642 40.800 0.133 0.000 0.954 60 D HN 0.449 8.819 8.370 -0.000 0.000 0.455 61 K N 0.536 120.938 120.400 0.005 0.000 2.057 61 K HA -0.051 4.273 4.320 0.006 0.000 0.207 61 K C 2.155 178.709 176.600 -0.077 0.000 1.049 61 K CA 1.249 57.506 56.287 -0.049 0.000 0.931 61 K CB -0.108 32.335 32.500 -0.094 0.000 0.714 61 K HN 0.043 8.293 8.250 -0.000 0.000 0.440 62 A N 0.946 123.722 122.820 -0.073 0.000 1.898 62 A HA -0.103 4.221 4.320 0.006 0.000 0.216 62 A C 2.367 179.894 177.584 -0.096 0.000 1.181 62 A CA 1.287 53.272 52.037 -0.086 0.000 0.620 62 A CB -0.581 18.386 19.000 -0.056 0.000 0.819 62 A HN 0.073 8.223 8.150 -0.000 0.000 0.442 63 V N 0.077 119.916 119.914 -0.126 0.000 2.427 63 V HA -0.250 3.874 4.120 0.006 0.000 0.248 63 V C 2.429 178.452 176.094 -0.119 0.000 1.051 63 V CA 2.294 64.472 62.300 -0.204 0.000 1.048 63 V CB -0.619 30.896 31.823 -0.513 0.000 0.666 63 V HN 0.537 8.727 8.190 -0.000 0.000 0.456 64 K N 0.154 120.516 120.400 -0.064 0.000 2.057 64 K HA -0.095 4.229 4.320 0.006 0.000 0.206 64 K C 2.321 178.907 176.600 -0.023 0.000 1.050 64 K CA 1.404 57.678 56.287 -0.022 0.000 0.935 64 K CB -0.385 32.114 32.500 -0.002 0.000 0.715 64 K HN 0.470 8.720 8.250 -0.000 0.000 0.439 65 A N 1.552 124.343 122.820 -0.049 0.000 1.877 65 A HA -0.130 4.193 4.320 0.006 0.000 0.216 65 A C 2.377 179.944 177.584 -0.029 0.000 1.186 65 A CA 1.859 53.865 52.037 -0.050 0.000 0.620 65 A CB -0.758 18.186 19.000 -0.093 0.000 0.822 65 A HN 0.331 8.481 8.150 -0.000 0.000 0.443 66 A N -0.078 122.717 122.820 -0.042 0.000 1.865 66 A HA -0.214 4.110 4.320 0.006 0.000 0.217 66 A C 2.191 179.807 177.584 0.053 0.000 1.191 66 A CA 2.373 54.399 52.037 -0.018 0.000 0.623 66 A CB -0.519 18.446 19.000 -0.058 0.000 0.826 66 A HN 0.467 8.617 8.150 -0.000 0.000 0.444 67 R N 0.181 120.701 120.500 0.033 0.000 2.091 67 R HA -0.083 4.261 4.340 0.006 0.000 0.238 67 R C 2.124 178.509 176.300 0.141 0.000 1.136 67 R CA 2.082 58.238 56.100 0.094 0.000 0.959 67 R CB -0.951 29.379 30.300 0.051 0.000 0.856 67 R HN 0.425 8.695 8.270 -0.000 0.000 0.437 68 A N 0.109 122.981 122.820 0.086 0.000 1.902 68 A HA -0.006 4.318 4.320 0.006 0.000 0.217 68 A C 2.350 179.998 177.584 0.106 0.000 1.181 68 A CA 1.710 53.795 52.037 0.079 0.000 0.623 68 A CB -1.052 17.972 19.000 0.041 0.000 0.818 68 A HN 0.476 8.626 8.150 -0.000 0.000 0.443 69 A N -2.087 120.801 122.820 0.113 0.000 2.070 69 A HA 0.004 4.327 4.320 0.006 0.000 0.220 69 A C 1.748 179.493 177.584 0.268 0.000 1.159 69 A CA 1.356 53.481 52.037 0.148 0.000 0.656 69 A CB -0.552 18.495 19.000 0.078 0.000 0.800 69 A HN 0.625 8.775 8.150 -0.000 0.000 0.453 70 F N 0.152 120.177 119.950 0.125 0.000 2.727 70 F HA 0.210 4.741 4.527 0.006 0.000 0.302 70 F C 0.666 176.534 175.800 0.114 0.000 1.097 70 F CA -0.279 57.818 58.000 0.162 0.000 1.330 70 F CB 0.193 39.275 39.000 0.136 0.000 1.084 70 F HN 0.086 8.386 8.300 -0.000 0.000 0.578 71 Q N 1.637 121.491 119.800 0.091 0.000 2.364 71 Q HA 0.058 4.402 4.340 0.006 0.000 0.267 71 Q C -0.230 175.728 176.000 -0.069 0.000 0.999 71 Q CA -0.225 55.592 55.803 0.022 0.000 0.886 71 Q CB 1.009 29.777 28.738 0.051 0.000 1.243 71 Q HN 0.241 8.511 8.270 -0.000 0.000 0.415 72 L N 1.561 122.736 121.223 -0.079 0.000 2.578 72 L HA 0.103 4.447 4.340 0.006 0.000 0.279 72 L C 1.283 178.124 176.870 -0.048 0.000 1.227 72 L CA 2.226 57.013 54.840 -0.088 0.000 0.900 72 L CB 0.066 42.093 42.059 -0.054 0.000 1.144 72 L HN 0.932 9.162 8.230 -0.000 0.000 0.496 73 G N 1.904 110.673 108.800 -0.051 0.000 2.195 73 G HA2 -0.286 3.677 3.960 0.006 0.000 0.246 73 G HA3 -0.286 3.677 3.960 0.006 0.000 0.246 73 G C 0.376 175.271 174.900 -0.008 0.000 0.984 73 G CA 0.385 45.470 45.100 -0.025 0.000 0.633 73 G HN 1.121 9.411 8.290 -0.000 0.000 0.525 74 S N 0.710 116.409 115.700 -0.000 0.000 2.589 74 S HA 0.534 5.008 4.470 0.006 0.000 0.265 74 S C -0.536 174.102 174.600 0.062 0.000 1.342 74 S CA -0.152 58.074 58.200 0.043 0.000 1.005 74 S CB 1.776 65.022 63.200 0.076 0.000 0.909 74 S HN 0.022 8.332 8.310 -0.000 0.000 0.555 75 P HA -0.110 4.310 4.420 -0.000 0.000 0.215 75 P C 1.337 178.751 177.300 0.191 0.000 1.157 75 P CA 1.258 64.427 63.100 0.117 0.000 0.874 75 P CB -0.150 31.629 31.700 0.132 0.000 0.790 76 W N 0.313 121.632 121.300 0.032 0.000 2.358 76 W HA -0.169 4.494 4.660 0.006 0.000 0.303 76 W C 1.839 178.371 176.519 0.021 0.000 1.208 76 W CA 0.830 58.210 57.345 0.059 0.000 1.274 76 W CB -0.157 29.365 29.460 0.102 0.000 1.138 76 W HN -0.151 8.029 8.180 -0.000 0.000 0.515 77 R N 0.331 120.817 120.500 -0.023 0.000 2.075 77 R HA -0.081 4.263 4.340 0.006 0.000 0.232 77 R C 2.130 178.328 176.300 -0.170 0.000 1.126 77 R CA 1.195 57.176 56.100 -0.198 0.000 0.963 77 R CB -0.842 29.333 30.300 -0.208 0.000 0.858 77 R HN 0.317 8.587 8.270 -0.000 0.000 0.435 78 R N -0.082 120.362 120.500 -0.094 0.000 2.153 78 R HA 0.116 4.460 4.340 0.006 0.000 0.218 78 R C 1.245 177.491 176.300 -0.089 0.000 1.072 78 R CA -0.107 55.946 56.100 -0.078 0.000 0.990 78 R CB -0.131 30.143 30.300 -0.043 0.000 0.889 78 R HN 0.145 8.415 8.270 -0.000 0.000 0.452 79 M N 2.303 121.844 119.600 -0.097 0.000 2.248 79 M HA -0.084 4.400 4.480 0.006 0.000 0.343 79 M C -0.708 175.525 176.300 -0.112 0.000 1.243 79 M CA 0.490 55.733 55.300 -0.093 0.000 1.025 79 M CB 0.465 33.031 32.600 -0.056 0.000 1.759 79 M HN -0.056 8.234 8.290 -0.000 0.000 0.452 80 D N 3.872 124.234 120.400 -0.063 0.000 2.443 80 D HA 0.092 4.736 4.640 0.006 0.000 0.239 80 D C 0.844 177.126 176.300 -0.031 0.000 1.136 80 D CA 0.580 54.559 54.000 -0.036 0.000 0.879 80 D CB 1.077 41.874 40.800 -0.004 0.000 1.195 80 D HN 0.745 9.115 8.370 -0.000 0.000 0.443 81 A N 2.317 125.114 122.820 -0.038 0.000 1.908 81 A HA -0.224 4.100 4.320 0.006 0.000 0.218 81 A C 2.104 179.691 177.584 0.005 0.000 1.181 81 A CA 2.257 54.274 52.037 -0.034 0.000 0.627 81 A CB -0.614 18.384 19.000 -0.003 0.000 0.818 81 A HN 0.594 8.744 8.150 -0.000 0.000 0.445 82 S N -1.342 114.374 115.700 0.027 0.000 2.423 82 S HA -0.222 4.252 4.470 0.006 0.000 0.231 82 S C 1.811 176.442 174.600 0.050 0.000 1.014 82 S CA 1.532 59.753 58.200 0.036 0.000 0.965 82 S CB -0.667 62.554 63.200 0.036 0.000 0.785 82 S HN 0.747 9.057 8.310 -0.000 0.000 0.495 83 H N 1.610 120.661 119.070 -0.030 0.000 2.436 83 H HA 0.244 4.804 4.556 0.006 0.000 0.294 83 H C 2.313 177.627 175.328 -0.024 0.000 1.048 83 H CA 1.215 57.245 56.048 -0.030 0.000 1.353 83 H CB -0.041 29.699 29.762 -0.036 0.000 1.414 83 H HN 0.307 8.587 8.280 -0.000 0.000 0.536 84 R N -0.568 119.939 120.500 0.013 0.000 2.117 84 R HA -0.117 4.226 4.340 0.006 0.000 0.243 84 R C 2.467 178.797 176.300 0.049 0.000 1.143 84 R CA 1.174 57.297 56.100 0.039 0.000 0.968 84 R CB -0.601 29.687 30.300 -0.019 0.000 0.863 84 R HN 0.441 8.711 8.270 -0.000 0.000 0.444 85 G N 1.135 109.946 108.800 0.017 0.000 2.404 85 G HA2 -0.237 3.726 3.960 0.006 0.000 0.215 85 G HA3 -0.237 3.726 3.960 0.006 0.000 0.215 85 G C 1.419 176.298 174.900 -0.035 0.000 1.174 85 G CA 0.174 45.287 45.100 0.021 0.000 0.780 85 G HN 0.126 8.416 8.290 -0.000 0.000 0.537 86 R N 0.243 120.665 120.500 -0.130 0.000 2.103 86 R HA 0.012 4.356 4.340 0.006 0.000 0.242 86 R C 2.625 178.793 176.300 -0.220 0.000 1.142 86 R CA 0.729 56.709 56.100 -0.199 0.000 0.960 86 R CB -1.130 28.958 30.300 -0.353 0.000 0.858 86 R HN 0.415 8.685 8.270 -0.000 0.000 0.439 87 L N 0.214 121.249 121.223 -0.314 0.000 2.056 87 L HA -0.118 4.225 4.340 0.006 0.000 0.207 87 L C 2.492 179.332 176.870 -0.050 0.000 1.078 87 L CA 0.910 55.512 54.840 -0.397 0.000 0.749 87 L CB -0.425 41.105 42.059 -0.882 0.000 0.901 87 L HN 0.107 8.337 8.230 -0.000 0.000 0.433 88 L N -0.351 120.962 121.223 0.150 0.000 2.046 88 L HA -0.228 4.116 4.340 0.006 0.000 0.208 88 L C 2.388 179.355 176.870 0.163 0.000 1.077 88 L CA 1.032 56.039 54.840 0.277 0.000 0.747 88 L CB -0.572 41.639 42.059 0.252 0.000 0.896 88 L HN 0.363 8.593 8.230 -0.000 0.000 0.432 89 N N -0.074 118.675 118.700 0.082 0.000 2.166 89 N HA -0.200 4.544 4.740 0.006 0.000 0.186 89 N C 1.955 177.496 175.510 0.052 0.000 1.019 89 N CA 1.008 54.091 53.050 0.056 0.000 0.856 89 N CB -0.203 38.296 38.487 0.019 0.000 0.993 89 N HN 0.155 8.536 8.380 -0.000 0.000 0.426 90 R N 1.285 121.803 120.500 0.030 0.000 2.075 90 R HA -0.006 4.338 4.340 0.006 0.000 0.232 90 R C 2.038 178.387 176.300 0.082 0.000 1.126 90 R CA 0.808 56.928 56.100 0.033 0.000 0.963 90 R CB -1.036 29.255 30.300 -0.014 0.000 0.858 90 R HN 0.187 8.457 8.270 -0.000 0.000 0.435 91 L N 0.344 121.653 121.223 0.144 0.000 2.042 91 L HA -0.006 4.338 4.340 0.006 0.000 0.210 91 L C 2.095 179.036 176.870 0.118 0.000 1.076 91 L CA 2.284 57.224 54.840 0.167 0.000 0.749 91 L CB -1.026 41.182 42.059 0.249 0.000 0.893 91 L HN 0.272 8.502 8.230 -0.000 0.000 0.432 92 A N -0.916 121.972 122.820 0.113 0.000 1.902 92 A HA -0.212 4.112 4.320 0.006 0.000 0.217 92 A C 1.993 179.624 177.584 0.079 0.000 1.181 92 A CA 1.809 53.903 52.037 0.095 0.000 0.623 92 A CB -0.815 18.242 19.000 0.095 0.000 0.818 92 A HN 0.528 8.678 8.150 -0.000 0.000 0.443 93 D N 0.178 120.621 120.400 0.071 0.000 2.117 93 D HA -0.124 4.520 4.640 0.006 0.000 0.197 93 D C 1.941 178.282 176.300 0.068 0.000 0.987 93 D CA 1.149 55.185 54.000 0.061 0.000 0.829 93 D CB -0.355 40.474 40.800 0.049 0.000 0.961 93 D HN 0.476 8.846 8.370 -0.000 0.000 0.460 94 L N 0.271 121.539 121.223 0.074 0.000 2.093 94 L HA -0.091 4.252 4.340 0.006 0.000 0.208 94 L C 2.518 179.454 176.870 0.110 0.000 1.085 94 L CA 0.616 55.505 54.840 0.081 0.000 0.755 94 L CB -0.287 41.814 42.059 0.069 0.000 0.904 94 L HN 0.005 8.235 8.230 -0.000 0.000 0.435 95 I N -0.112 120.524 120.570 0.109 0.000 2.286 95 I HA -0.283 3.891 4.170 0.006 0.000 0.248 95 I C 2.644 178.825 176.117 0.108 0.000 1.115 95 I CA 1.317 62.694 61.300 0.129 0.000 1.392 95 I CB -0.168 37.896 38.000 0.106 0.000 1.065 95 I HN 0.331 8.541 8.210 -0.000 0.000 0.418 96 E N 1.237 121.484 120.200 0.078 0.000 2.072 96 E HA -0.273 4.081 4.350 0.006 0.000 0.191 96 E C 2.396 179.045 176.600 0.081 0.000 0.985 96 E CA 0.971 57.405 56.400 0.056 0.000 0.801 96 E CB -0.050 29.676 29.700 0.044 0.000 0.750 96 E HN 0.249 8.609 8.360 -0.000 0.000 0.452 97 R N 0.279 120.834 120.500 0.091 0.000 2.103 97 R HA -0.159 4.184 4.340 0.006 0.000 0.242 97 R C 0.356 176.735 176.300 0.131 0.000 1.142 97 R CA 1.908 58.067 56.100 0.099 0.000 0.960 97 R CB -0.023 30.329 30.300 0.086 0.000 0.858 97 R HN 0.143 8.413 8.270 -0.000 0.000 0.439 98 D N -0.511 119.989 120.400 0.168 0.000 2.491 98 D HA 0.039 4.682 4.640 0.006 0.000 0.228 98 D C 1.012 177.453 176.300 0.236 0.000 1.183 98 D CA -0.050 54.087 54.000 0.228 0.000 0.827 98 D CB 0.271 41.277 40.800 0.342 0.000 0.989 98 D HN 0.239 8.609 8.370 -0.000 0.000 0.494 99 R N 0.241 120.845 120.500 0.173 0.000 2.073 99 R HA -0.121 4.223 4.340 0.006 0.000 0.234 99 R C 1.401 177.837 176.300 0.227 0.000 1.134 99 R CA 1.511 57.678 56.100 0.111 0.000 0.952 99 R CB -0.016 30.267 30.300 -0.029 0.000 0.850 99 R HN -0.019 8.251 8.270 -0.000 0.000 0.433 100 T N 0.064 114.834 114.554 0.360 0.000 2.708 100 T HA -0.212 4.142 4.350 0.006 0.000 0.266 100 T C 1.381 176.309 174.700 0.380 0.000 1.037 100 T CA 1.639 64.021 62.100 0.469 0.000 1.146 100 T CB -0.496 68.597 68.868 0.374 0.000 0.865 100 T HN 0.418 8.658 8.240 -0.000 0.000 0.435 101 Y N 1.559 121.962 120.300 0.171 0.000 2.163 101 Y HA -0.018 4.535 4.550 0.006 0.000 0.288 101 Y C 2.005 177.942 175.900 0.062 0.000 1.136 101 Y CA 1.063 59.215 58.100 0.086 0.000 1.147 101 Y CB -0.519 37.937 38.460 -0.006 0.000 0.987 101 Y HN 0.102 8.382 8.280 -0.000 0.000 0.509 102 L N -0.185 121.025 121.223 -0.022 0.000 2.093 102 L HA -0.186 4.157 4.340 0.006 0.000 0.208 102 L C 2.785 179.626 176.870 -0.048 0.000 1.085 102 L CA 1.116 55.892 54.840 -0.107 0.000 0.755 102 L CB -0.869 41.239 42.059 0.083 0.000 0.904 102 L HN 0.372 8.602 8.230 -0.000 0.000 0.435 103 A N -0.101 122.766 122.820 0.078 0.000 1.902 103 A HA -0.179 4.144 4.320 0.006 0.000 0.217 103 A C 2.499 180.221 177.584 0.230 0.000 1.181 103 A CA 1.754 53.866 52.037 0.126 0.000 0.623 103 A CB -0.685 18.421 19.000 0.176 0.000 0.818 103 A HN 0.405 8.555 8.150 -0.000 0.000 0.443 104 A N -0.729 122.287 122.820 0.326 0.000 1.898 104 A HA 0.024 4.347 4.320 0.006 0.000 0.216 104 A C 2.096 179.761 177.584 0.135 0.000 1.181 104 A CA 1.626 53.882 52.037 0.364 0.000 0.620 104 A CB -0.553 18.590 19.000 0.238 0.000 0.819 104 A HN 0.627 8.777 8.150 -0.000 0.000 0.442 105 L N -0.117 121.021 121.223 -0.142 0.000 2.093 105 L HA -0.096 4.247 4.340 0.006 0.000 0.208 105 L C 2.163 178.980 176.870 -0.088 0.000 1.085 105 L CA 2.547 57.262 54.840 -0.208 0.000 0.755 105 L CB -0.586 41.183 42.059 -0.482 0.000 0.904 105 L HN 0.493 8.723 8.230 -0.000 0.000 0.435 106 E N -1.074 119.088 120.200 -0.063 0.000 2.051 106 E HA -0.185 4.169 4.350 0.006 0.000 0.192 106 E C 2.020 178.580 176.600 -0.067 0.000 0.991 106 E CA 1.954 58.325 56.400 -0.047 0.000 0.799 106 E CB -0.266 29.413 29.700 -0.034 0.000 0.748 106 E HN 0.474 8.834 8.360 -0.000 0.000 0.449 107 T N 0.691 115.195 114.554 -0.084 0.000 2.821 107 T HA -0.121 4.232 4.350 0.006 0.000 0.267 107 T C 1.676 176.278 174.700 -0.165 0.000 1.046 107 T CA 1.057 63.032 62.100 -0.208 0.000 1.139 107 T CB -0.304 68.283 68.868 -0.468 0.000 0.871 107 T HN 0.103 8.343 8.240 -0.000 0.000 0.454 108 L N 1.248 122.461 121.223 -0.017 0.000 2.046 108 L HA -0.068 4.275 4.340 0.006 0.000 0.208 108 L C 1.890 178.761 176.870 0.001 0.000 1.077 108 L CA 1.874 56.759 54.840 0.076 0.000 0.747 108 L CB -0.357 41.771 42.059 0.114 0.000 0.896 108 L HN 0.070 8.300 8.230 -0.000 0.000 0.432 109 D N -2.004 118.381 120.400 -0.026 0.000 2.301 109 D HA -0.092 4.552 4.640 0.006 0.000 0.206 109 D C 1.824 178.098 176.300 -0.043 0.000 0.979 109 D CA 0.532 54.514 54.000 -0.029 0.000 0.874 109 D CB 0.119 40.906 40.800 -0.022 0.000 0.968 109 D HN 0.403 8.773 8.370 -0.000 0.000 0.510 110 N N -0.685 117.979 118.700 -0.060 0.000 2.510 110 N HA 0.011 4.754 4.740 0.006 0.000 0.186 110 N C 1.350 176.791 175.510 -0.115 0.000 1.051 110 N CA 1.552 54.560 53.050 -0.070 0.000 0.877 110 N CB 1.000 39.452 38.487 -0.059 0.000 1.183 110 N HN 0.211 8.591 8.380 -0.000 0.000 0.443 111 G N 1.479 110.196 108.800 -0.138 0.000 2.218 111 G HA2 -0.245 3.719 3.960 0.006 0.000 0.216 111 G HA3 -0.245 3.719 3.960 0.006 0.000 0.216 111 G C -0.097 174.691 174.900 -0.186 0.000 0.994 111 G CA 0.335 45.335 45.100 -0.167 0.000 0.637 111 G HN 0.679 8.969 8.290 -0.000 0.000 0.505 112 K N 1.087 121.368 120.400 -0.199 0.000 2.355 112 K HA 0.486 4.810 4.320 0.006 0.000 0.270 112 K C -2.649 173.836 176.600 -0.191 0.000 1.003 112 K CA -1.352 54.806 56.287 -0.215 0.000 0.957 112 K CB 0.611 32.953 32.500 -0.263 0.000 0.939 112 K HN 0.043 8.293 8.250 -0.000 0.000 0.482 113 P HA -0.139 4.281 4.420 -0.000 0.000 0.261 113 P C -0.318 176.935 177.300 -0.078 0.000 1.173 113 P CA 0.123 63.165 63.100 -0.097 0.000 0.760 113 P CB 0.092 31.764 31.700 -0.046 0.000 0.783 114 Y N 4.738 124.914 120.300 -0.206 0.000 2.207 114 Y HA -0.230 4.324 4.550 0.006 0.000 0.287 114 Y C 1.742 177.653 175.900 0.019 0.000 1.156 114 Y CA 1.693 59.712 58.100 -0.135 0.000 1.182 114 Y CB -0.699 37.698 38.460 -0.104 0.000 0.979 114 Y HN 0.087 8.367 8.280 -0.000 0.000 0.521 115 V N 0.413 120.283 119.914 -0.074 0.000 2.515 115 V HA -0.282 3.841 4.120 0.006 0.000 0.250 115 V C 2.231 178.300 176.094 -0.042 0.000 1.058 115 V CA 1.534 63.774 62.300 -0.101 0.000 1.064 115 V CB -0.518 31.323 31.823 0.031 0.000 0.675 115 V HN 0.451 8.641 8.190 -0.000 0.000 0.461 116 I N -0.602 119.959 120.570 -0.015 0.000 2.480 116 I HA -0.069 4.105 4.170 0.006 0.000 0.251 116 I C 2.532 178.666 176.117 0.029 0.000 1.124 116 I CA 1.079 62.411 61.300 0.055 0.000 1.444 116 I CB -1.278 36.752 38.000 0.050 0.000 1.098 116 I HN 0.245 8.455 8.210 -0.000 0.000 0.428 117 S N 0.494 116.165 115.700 -0.049 0.000 2.370 117 S HA -0.243 4.230 4.470 0.006 0.000 0.226 117 S C 2.040 176.609 174.600 -0.052 0.000 1.033 117 S CA 1.561 59.732 58.200 -0.049 0.000 1.011 117 S CB -0.479 62.682 63.200 -0.066 0.000 0.852 117 S HN 0.458 8.768 8.310 -0.000 0.000 0.457 118 Y N 1.331 121.470 120.300 -0.268 0.000 2.153 118 Y HA 0.079 4.633 4.550 0.006 0.000 0.289 118 Y C 1.888 177.727 175.900 -0.101 0.000 1.127 118 Y CA 1.318 59.271 58.100 -0.245 0.000 1.131 118 Y CB -0.122 38.054 38.460 -0.472 0.000 0.995 118 Y HN 0.117 8.397 8.280 -0.000 0.000 0.505 119 L N -1.544 119.740 121.223 0.102 0.000 2.307 119 L HA -0.043 4.301 4.340 0.006 0.000 0.211 119 L C 1.693 178.595 176.870 0.054 0.000 1.099 119 L CA 0.240 55.136 54.840 0.093 0.000 0.816 119 L CB -0.081 42.063 42.059 0.141 0.000 0.952 119 L HN 0.123 8.353 8.230 -0.000 0.000 0.455 120 V N -0.983 118.980 119.914 0.081 0.000 2.635 120 V HA -0.056 4.067 4.120 0.006 0.000 0.233 120 V C 1.700 177.840 176.094 0.078 0.000 1.097 120 V CA 0.984 63.354 62.300 0.116 0.000 1.134 120 V CB -0.306 31.668 31.823 0.253 0.000 0.841 120 V HN 0.179 8.369 8.190 -0.000 0.000 0.496 121 D N 0.786 121.242 120.400 0.094 0.000 2.103 121 D HA -0.179 4.465 4.640 0.006 0.000 0.190 121 D C 2.078 178.380 176.300 0.004 0.000 0.997 121 D CA 1.365 55.403 54.000 0.063 0.000 0.833 121 D CB -0.285 40.560 40.800 0.075 0.000 0.961 121 D HN 0.088 8.458 8.370 -0.000 0.000 0.447 122 L N 0.555 121.755 121.223 -0.037 0.000 2.093 122 L HA -0.144 4.199 4.340 0.006 0.000 0.208 122 L C 1.926 178.760 176.870 -0.059 0.000 1.085 122 L CA 1.554 56.353 54.840 -0.068 0.000 0.755 122 L CB -0.958 41.004 42.059 -0.161 0.000 0.904 122 L HN 0.075 8.305 8.230 -0.000 0.000 0.435 123 D N -0.371 119.990 120.400 -0.065 0.000 2.117 123 D HA -0.208 4.436 4.640 0.006 0.000 0.197 123 D C 2.355 178.667 176.300 0.020 0.000 0.987 123 D CA 1.243 55.225 54.000 -0.029 0.000 0.829 123 D CB 0.099 40.889 40.800 -0.017 0.000 0.961 123 D HN 0.172 8.542 8.370 -0.000 0.000 0.460 124 M N -0.609 119.011 119.600 0.033 0.000 2.229 124 M HA -0.113 4.370 4.480 0.006 0.000 0.264 124 M C 2.131 178.495 176.300 0.106 0.000 1.063 124 M CA 0.591 55.933 55.300 0.071 0.000 1.114 124 M CB 0.048 32.675 32.600 0.045 0.000 1.387 124 M HN -0.015 8.275 8.290 -0.000 0.000 0.420 125 V N 0.895 120.850 119.914 0.068 0.000 2.270 125 V HA -0.247 3.877 4.120 0.006 0.000 0.245 125 V C 2.303 178.463 176.094 0.111 0.000 1.043 125 V CA 1.613 63.967 62.300 0.091 0.000 1.014 125 V CB -0.606 31.248 31.823 0.051 0.000 0.645 125 V HN 0.447 8.637 8.190 -0.000 0.000 0.447 126 L N -0.453 120.815 121.223 0.076 0.000 2.012 126 L HA -0.240 4.103 4.340 0.006 0.000 0.210 126 L C 2.589 179.520 176.870 0.103 0.000 1.073 126 L CA 1.865 56.752 54.840 0.079 0.000 0.748 126 L CB -0.678 41.407 42.059 0.044 0.000 0.891 126 L HN 0.288 8.518 8.230 -0.000 0.000 0.431 127 K N -0.912 119.547 120.400 0.098 0.000 2.097 127 K HA -0.178 4.146 4.320 0.006 0.000 0.205 127 K C 2.304 178.998 176.600 0.156 0.000 1.050 127 K CA 1.450 57.799 56.287 0.105 0.000 0.938 127 K CB -0.421 32.122 32.500 0.072 0.000 0.718 127 K HN 0.393 8.643 8.250 -0.000 0.000 0.442 128 C N 1.300 120.720 119.300 0.199 0.000 2.436 128 C HA -0.077 4.387 4.460 0.006 0.000 0.277 128 C C 2.442 177.655 174.990 0.372 0.000 1.241 128 C CA 0.685 59.883 59.018 0.300 0.000 1.721 128 C CB -0.923 27.052 27.740 0.391 0.000 2.043 128 C HN 0.397 8.627 8.230 -0.000 0.000 0.472 129 L N 0.267 121.658 121.223 0.280 0.000 2.046 129 L HA -0.125 4.219 4.340 0.006 0.000 0.208 129 L C 3.021 180.026 176.870 0.225 0.000 1.077 129 L CA 1.790 56.783 54.840 0.255 0.000 0.747 129 L CB -0.690 41.478 42.059 0.181 0.000 0.896 129 L HN 0.353 8.583 8.230 -0.000 0.000 0.432 130 R N -1.380 119.225 120.500 0.176 0.000 2.115 130 R HA -0.191 4.153 4.340 0.006 0.000 0.230 130 R C 2.265 178.631 176.300 0.110 0.000 1.111 130 R CA 1.375 57.549 56.100 0.123 0.000 0.976 130 R CB -0.435 29.920 30.300 0.093 0.000 0.870 130 R HN 0.266 8.536 8.270 -0.000 0.000 0.445 131 Y N 0.198 120.503 120.300 0.008 0.000 2.114 131 Y HA -0.280 4.274 4.550 0.006 0.000 0.284 131 Y C 1.676 177.518 175.900 -0.097 0.000 1.143 131 Y CA 1.518 59.557 58.100 -0.103 0.000 1.135 131 Y CB -0.463 37.894 38.460 -0.172 0.000 0.980 131 Y HN 0.004 8.284 8.280 -0.000 0.000 0.499 132 Y N -0.359 119.999 120.300 0.096 0.000 2.314 132 Y HA -0.107 4.446 4.550 0.006 0.000 0.293 132 Y C 2.619 178.543 175.900 0.040 0.000 1.129 132 Y CA 0.789 58.932 58.100 0.072 0.000 1.201 132 Y CB -0.579 37.979 38.460 0.164 0.000 0.999 132 Y HN 0.267 8.547 8.280 -0.000 0.000 0.541 133 A N 0.186 123.109 122.820 0.172 0.000 1.948 133 A HA -0.221 4.103 4.320 0.006 0.000 0.220 133 A C 2.489 180.084 177.584 0.019 0.000 1.177 133 A CA 1.930 54.031 52.037 0.106 0.000 0.636 133 A CB -1.453 17.596 19.000 0.080 0.000 0.815 133 A HN 0.487 8.637 8.150 -0.000 0.000 0.449 134 G N -2.624 106.113 108.800 -0.105 0.000 2.448 134 G HA2 -0.181 3.782 3.960 0.006 0.000 0.218 134 G HA3 -0.181 3.782 3.960 0.006 0.000 0.218 134 G C 1.306 176.058 174.900 -0.246 0.000 1.135 134 G CA 0.626 45.589 45.100 -0.229 0.000 0.784 134 G HN 0.692 8.982 8.290 -0.000 0.000 0.543 135 W N 0.592 121.780 121.300 -0.188 0.000 2.770 135 W HA 0.320 4.984 4.660 0.006 0.000 0.256 135 W C 2.686 179.175 176.519 -0.050 0.000 1.291 135 W CA 0.097 57.356 57.345 -0.144 0.000 1.396 135 W CB 0.383 29.753 29.460 -0.151 0.000 1.114 135 W HN 0.248 8.428 8.180 -0.000 0.000 0.637 136 A N 1.101 124.043 122.820 0.203 0.000 1.917 136 A HA -0.276 4.048 4.320 0.006 0.000 0.219 136 A C 1.340 178.993 177.584 0.115 0.000 1.182 136 A CA 2.330 54.455 52.037 0.146 0.000 0.633 136 A CB -0.788 18.272 19.000 0.100 0.000 0.819 136 A HN 0.346 8.496 8.150 -0.000 0.000 0.448 137 D N -2.213 118.239 120.400 0.087 0.000 2.559 137 D HA 0.213 4.856 4.640 0.006 0.000 0.234 137 D C 0.537 176.859 176.300 0.036 0.000 1.226 137 D CA 0.005 54.040 54.000 0.058 0.000 0.830 137 D CB 0.110 40.932 40.800 0.038 0.000 1.028 137 D HN 0.450 8.820 8.370 -0.000 0.000 0.492 138 K N -0.744 119.698 120.400 0.070 0.000 2.477 138 K HA 0.069 4.393 4.320 0.006 0.000 0.208 138 K C -0.576 175.933 176.600 -0.151 0.000 1.117 138 K CA -0.505 55.749 56.287 -0.055 0.000 1.039 138 K CB 0.815 33.353 32.500 0.063 0.000 0.937 138 K HN -0.022 8.228 8.250 -0.000 0.000 0.570 139 Y N 2.677 122.893 120.300 -0.140 0.000 2.627 139 Y HA 0.150 4.703 4.550 0.006 0.000 0.347 139 Y C -0.413 175.366 175.900 -0.203 0.000 1.099 139 Y CA -1.140 56.876 58.100 -0.139 0.000 1.408 139 Y CB -0.550 37.892 38.460 -0.031 0.000 1.247 139 Y HN 0.078 8.358 8.280 -0.000 0.000 0.506 140 H N 1.735 120.702 119.070 -0.171 0.000 2.551 140 H HA 0.496 5.055 4.556 0.006 0.000 0.358 140 H C 0.818 175.711 175.328 -0.725 0.000 1.151 140 H CA 0.004 55.879 56.048 -0.289 0.000 1.374 140 H CB 0.976 30.648 29.762 -0.151 0.000 1.473 140 H HN 0.758 9.038 8.280 -0.000 0.000 0.574 141 G N 0.752 109.225 108.800 -0.545 0.000 2.509 141 G HA2 0.409 4.373 3.960 0.006 0.000 0.269 141 G HA3 0.409 4.373 3.960 0.006 0.000 0.269 141 G C -0.723 174.030 174.900 -0.245 0.000 1.416 141 G CA -0.798 43.897 45.100 -0.676 0.000 1.052 141 G HN 0.525 8.815 8.290 -0.000 0.000 0.542 142 K N -0.582 119.756 120.400 -0.104 0.000 2.375 142 K HA 0.512 4.836 4.320 0.006 0.000 0.249 142 K C -0.766 175.867 176.600 0.054 0.000 0.942 142 K CA -0.634 55.639 56.287 -0.023 0.000 0.806 142 K CB 2.144 34.638 32.500 -0.009 0.000 1.227 142 K HN 0.616 8.866 8.250 -0.000 0.000 0.430 143 T N -0.628 113.971 114.554 0.076 0.000 2.795 143 T HA 0.619 4.973 4.350 0.006 0.000 0.282 143 T C 0.005 174.774 174.700 0.114 0.000 0.980 143 T CA -0.739 61.454 62.100 0.154 0.000 1.012 143 T CB 0.197 69.215 68.868 0.249 0.000 0.936 143 T HN 0.379 8.619 8.240 -0.000 0.000 0.457 144 I N 4.021 124.658 120.570 0.112 0.000 2.436 144 I HA 0.341 4.514 4.170 0.006 0.000 0.289 144 I C -2.202 173.971 176.117 0.094 0.000 1.010 144 I CA -2.922 58.421 61.300 0.072 0.000 1.098 144 I CB 2.404 40.420 38.000 0.028 0.000 1.266 144 I HN 0.429 8.639 8.210 -0.000 0.000 0.434 145 P HA 0.168 4.588 4.420 -0.000 0.000 0.238 145 P C 0.149 177.495 177.300 0.078 0.000 1.714 145 P CA 0.122 63.271 63.100 0.082 0.000 0.908 145 P CB -0.293 31.441 31.700 0.057 0.000 1.893 146 I N 0.439 121.063 120.570 0.089 0.000 2.836 146 I HA 0.001 4.175 4.170 0.006 0.000 0.285 146 I C 0.426 176.615 176.117 0.121 0.000 1.174 146 I CA -0.139 61.209 61.300 0.079 0.000 1.405 146 I CB 0.648 38.679 38.000 0.051 0.000 1.385 146 I HN -0.009 8.201 8.210 -0.000 0.000 0.594 147 D N 4.639 125.102 120.400 0.105 0.000 2.400 147 D HA 0.418 5.061 4.640 0.006 0.000 0.238 147 D C 0.356 176.806 176.300 0.250 0.000 1.157 147 D CA 1.181 55.258 54.000 0.129 0.000 0.889 147 D CB 0.783 41.638 40.800 0.091 0.000 1.199 147 D HN 0.928 9.298 8.370 -0.000 0.000 0.436 148 G N 1.407 110.325 108.800 0.197 0.000 2.757 148 G HA2 -0.188 3.776 3.960 0.006 0.000 0.638 148 G HA3 -0.188 3.776 3.960 0.006 0.000 0.638 148 G C -0.780 174.114 174.900 -0.010 0.000 1.344 148 G CA -0.749 44.460 45.100 0.181 0.000 0.855 148 G HN 0.488 8.778 8.290 -0.000 0.000 0.537 149 D N 0.986 121.139 120.400 -0.411 0.000 2.608 149 D HA 0.486 5.130 4.640 0.006 0.000 0.224 149 D C -0.091 175.739 176.300 -0.783 0.000 1.123 149 D CA 0.924 54.642 54.000 -0.471 0.000 1.030 149 D CB -0.543 40.023 40.800 -0.390 0.000 1.093 149 D HN 0.292 8.662 8.370 -0.000 0.000 0.497 150 F N 0.430 120.424 119.950 0.073 0.000 2.599 150 F HA 0.387 4.918 4.527 0.006 0.000 0.311 150 F C -0.331 175.584 175.800 0.191 0.000 1.076 150 F CA -1.479 56.582 58.000 0.101 0.000 0.937 150 F CB 1.602 40.634 39.000 0.054 0.000 1.282 150 F HN -0.138 8.162 8.300 -0.000 0.000 0.460 151 F N 2.130 122.221 119.950 0.235 0.000 2.411 151 F HA 0.684 5.215 4.527 0.006 0.000 0.352 151 F C -0.514 175.411 175.800 0.208 0.000 1.123 151 F CA -1.006 57.107 58.000 0.189 0.000 1.044 151 F CB 1.174 40.271 39.000 0.161 0.000 1.135 151 F HN 0.287 8.587 8.300 -0.000 0.000 0.461 152 S N 6.623 122.280 115.700 -0.072 0.000 2.521 152 S HA 0.812 5.286 4.470 0.006 0.000 0.295 152 S C -1.492 172.960 174.600 -0.246 0.000 1.098 152 S CA -0.298 57.755 58.200 -0.245 0.000 0.999 152 S CB 0.743 63.884 63.200 -0.098 0.000 1.034 152 S HN 0.721 9.031 8.310 -0.000 0.000 0.483 153 Y N -0.061 120.003 120.300 -0.393 0.000 2.670 153 Y HA 0.765 5.319 4.550 0.006 0.000 0.334 153 Y C -0.733 175.067 175.900 -0.166 0.000 1.185 153 Y CA -1.027 56.907 58.100 -0.276 0.000 1.053 153 Y CB 0.891 39.133 38.460 -0.364 0.000 1.298 153 Y HN 0.544 8.824 8.280 -0.000 0.000 0.459 154 T N -0.301 114.293 114.554 0.067 0.000 2.841 154 T HA 0.680 5.033 4.350 0.006 0.000 0.283 154 T C -0.897 173.885 174.700 0.137 0.000 1.000 154 T CA -1.035 61.084 62.100 0.032 0.000 0.977 154 T CB 1.670 70.572 68.868 0.056 0.000 0.979 154 T HN 0.821 9.061 8.240 -0.000 0.000 0.446 155 R N 1.479 122.060 120.500 0.135 0.000 2.368 155 R HA 0.325 4.669 4.340 0.006 0.000 0.302 155 R C -0.187 176.263 176.300 0.250 0.000 1.002 155 R CA -0.673 55.524 56.100 0.161 0.000 0.929 155 R CB 0.795 31.180 30.300 0.141 0.000 1.073 155 R HN 0.719 8.989 8.270 -0.000 0.000 0.464 156 H N 2.542 121.637 119.070 0.041 0.000 2.818 156 H HA 0.114 4.674 4.556 0.006 0.000 0.269 156 H C -0.309 175.075 175.328 0.093 0.000 1.277 156 H CA -0.391 55.688 56.048 0.053 0.000 1.290 156 H CB 0.765 30.538 29.762 0.018 0.000 1.479 156 H HN 0.431 8.711 8.280 -0.000 0.000 0.507 157 E N 3.803 124.112 120.200 0.182 0.000 2.280 157 E HA 0.237 4.591 4.350 0.006 0.000 0.264 157 E C -2.458 174.253 176.600 0.184 0.000 1.064 157 E CA -2.252 54.245 56.400 0.162 0.000 0.900 157 E CB 0.848 30.632 29.700 0.140 0.000 1.123 157 E HN 0.364 8.724 8.360 -0.000 0.000 0.418 158 P HA -0.031 4.389 4.420 -0.000 0.000 0.275 158 P C 0.660 178.092 177.300 0.221 0.000 1.228 158 P CA -0.110 63.158 63.100 0.280 0.000 0.786 158 P CB 0.693 32.670 31.700 0.461 0.000 0.927 159 V N 1.248 121.230 119.914 0.115 0.000 2.332 159 V HA -0.061 4.062 4.120 0.006 0.000 0.248 159 V C 1.515 177.540 176.094 -0.115 0.000 1.055 159 V CA 2.723 65.030 62.300 0.012 0.000 1.038 159 V CB -1.571 30.237 31.823 -0.025 0.000 0.651 159 V HN 1.048 9.238 8.190 -0.000 0.000 0.450 160 G N -1.270 107.334 108.800 -0.327 0.000 2.254 160 G HA2 -0.121 3.843 3.960 0.006 0.000 0.193 160 G HA3 -0.121 3.843 3.960 0.006 0.000 0.193 160 G C -0.556 173.931 174.900 -0.688 0.000 1.233 160 G CA -0.296 44.168 45.100 -1.059 0.000 1.290 160 G HN 0.287 8.577 8.290 -0.000 0.000 0.517 161 V N 1.105 120.728 119.914 -0.485 0.000 2.439 161 V HA 0.412 4.536 4.120 0.006 0.000 0.271 161 V C 0.370 176.385 176.094 -0.132 0.000 1.040 161 V CA -0.125 62.028 62.300 -0.245 0.000 1.002 161 V CB 0.327 32.036 31.823 -0.190 0.000 1.000 161 V HN 0.802 8.992 8.190 -0.000 0.000 0.477 162 C N 4.861 124.125 119.300 -0.059 0.000 2.298 162 C HA 0.699 5.163 4.460 0.006 0.000 0.323 162 C C 1.003 176.006 174.990 0.022 0.000 1.284 162 C CA -0.909 58.120 59.018 0.018 0.000 1.577 162 C CB 0.440 28.271 27.740 0.151 0.000 2.249 162 C HN 1.018 9.248 8.230 -0.000 0.000 0.497 163 G N 3.004 111.817 108.800 0.020 0.000 2.325 163 G HA2 0.525 4.489 3.960 0.006 0.000 0.298 163 G HA3 0.525 4.489 3.960 0.006 0.000 0.298 163 G C -0.807 174.138 174.900 0.075 0.000 1.134 163 G CA -0.118 45.002 45.100 0.033 0.000 0.876 163 G HN 0.804 9.094 8.290 -0.000 0.000 0.452 164 Q N 1.655 121.503 119.800 0.079 0.000 2.309 164 Q HA 0.405 4.749 4.340 0.006 0.000 0.270 164 Q C -0.762 175.298 176.000 0.101 0.000 1.023 164 Q CA -0.425 55.439 55.803 0.101 0.000 0.758 164 Q CB 2.678 31.470 28.738 0.090 0.000 1.247 164 Q HN 0.522 8.792 8.270 -0.000 0.000 0.455 165 I N 4.937 125.589 120.570 0.137 0.000 2.355 165 I HA 0.459 4.633 4.170 0.006 0.000 0.288 165 I C -0.106 176.044 176.117 0.055 0.000 0.999 165 I CA -0.806 60.588 61.300 0.156 0.000 1.163 165 I CB 0.846 39.045 38.000 0.332 0.000 1.316 165 I HN 0.541 8.751 8.210 -0.000 0.000 0.454 166 I N 5.099 125.681 120.570 0.020 0.000 2.693 166 I HA 0.762 4.936 4.170 0.006 0.000 0.303 166 I C -2.758 173.315 176.117 -0.073 0.000 1.025 166 I CA -2.353 58.915 61.300 -0.053 0.000 1.086 166 I CB 2.118 40.104 38.000 -0.024 0.000 1.268 166 I HN 0.188 8.398 8.210 -0.000 0.000 0.440 167 P HA 0.211 4.631 4.420 -0.000 0.000 0.282 167 P C -0.094 177.122 177.300 -0.139 0.000 1.287 167 P CA -0.365 62.582 63.100 -0.255 0.000 0.792 167 P CB 0.310 31.752 31.700 -0.431 0.000 1.163 168 W N 0.213 121.501 121.300 -0.019 0.000 3.107 168 W HA 0.068 4.731 4.660 0.006 0.000 0.293 168 W C 0.768 177.237 176.519 -0.083 0.000 1.239 168 W CA 0.204 57.526 57.345 -0.038 0.000 1.653 168 W CB -1.289 28.153 29.460 -0.031 0.000 1.068 168 W HN 0.239 8.419 8.180 -0.000 0.000 0.615 169 N N 2.001 120.533 118.700 -0.281 0.000 2.216 169 N HA -0.152 4.592 4.740 0.006 0.000 0.183 169 N C -0.143 175.026 175.510 -0.569 0.000 1.017 169 N CA 0.745 53.594 53.050 -0.334 0.000 0.861 169 N CB -1.104 37.037 38.487 -0.577 0.000 0.986 169 N HN 0.079 8.459 8.380 -0.000 0.000 0.428 170 F N 0.049 119.880 119.950 -0.199 0.000 2.660 170 F HA 0.453 4.984 4.527 0.006 0.000 0.352 170 F C -1.778 173.906 175.800 -0.194 0.000 1.257 170 F CA -2.097 55.770 58.000 -0.222 0.000 1.200 170 F CB 2.225 41.003 39.000 -0.371 0.000 1.473 170 F HN -0.150 8.150 8.300 -0.000 0.000 0.561 171 P HA -0.162 4.258 4.420 -0.000 0.000 0.213 171 P C 1.959 179.256 177.300 -0.005 0.000 1.170 171 P CA 1.486 64.593 63.100 0.011 0.000 0.898 171 P CB 0.451 32.169 31.700 0.030 0.000 0.787 172 L N -1.670 119.554 121.223 0.001 0.000 2.017 172 L HA -0.170 4.174 4.340 0.006 0.000 0.208 172 L C 2.435 179.276 176.870 -0.049 0.000 1.073 172 L CA 1.056 55.895 54.840 -0.002 0.000 0.745 172 L CB -1.035 41.033 42.059 0.015 0.000 0.894 172 L HN -0.022 8.208 8.230 -0.000 0.000 0.432 173 L N -0.711 120.449 121.223 -0.105 0.000 2.012 173 L HA -0.233 4.111 4.340 0.006 0.000 0.210 173 L C 2.488 179.074 176.870 -0.474 0.000 1.073 173 L CA 1.892 56.553 54.840 -0.298 0.000 0.748 173 L CB -0.505 41.276 42.059 -0.464 0.000 0.891 173 L HN 0.188 8.418 8.230 -0.000 0.000 0.431 174 M N -0.955 118.407 119.600 -0.396 0.000 2.159 174 M HA -0.237 4.247 4.480 0.006 0.000 0.263 174 M C 2.245 178.501 176.300 -0.073 0.000 1.063 174 M CA 1.598 56.724 55.300 -0.290 0.000 1.110 174 M CB -1.268 31.218 32.600 -0.190 0.000 1.374 174 M HN 0.523 8.813 8.290 -0.000 0.000 0.411 175 Q N -0.078 119.692 119.800 -0.051 0.000 2.050 175 Q HA -0.132 4.211 4.340 0.006 0.000 0.202 175 Q C 2.025 178.038 176.000 0.022 0.000 0.980 175 Q CA 1.997 57.796 55.803 -0.007 0.000 0.840 175 Q CB -0.012 28.722 28.738 -0.007 0.000 0.898 175 Q HN 0.474 8.744 8.270 -0.000 0.000 0.424 176 A N 0.026 122.873 122.820 0.046 0.000 1.902 176 A HA -0.176 4.147 4.320 0.006 0.000 0.217 176 A C 1.547 179.277 177.584 0.244 0.000 1.181 176 A CA 1.214 53.328 52.037 0.127 0.000 0.623 176 A CB -1.157 17.939 19.000 0.159 0.000 0.818 176 A HN 0.640 8.790 8.150 -0.000 0.000 0.443 177 W N 0.493 121.787 121.300 -0.009 0.000 2.364 177 W HA -0.074 4.590 4.660 0.006 0.000 0.281 177 W C 2.080 178.556 176.519 -0.071 0.000 1.219 177 W CA 1.365 58.710 57.345 -0.000 0.000 1.220 177 W CB -0.164 29.296 29.460 -0.000 0.000 1.127 177 W HN 0.279 8.459 8.180 -0.000 0.000 0.556 178 K N -0.664 119.818 120.400 0.136 0.000 2.168 178 K HA 0.116 4.440 4.320 0.006 0.000 0.201 178 K C 2.034 178.535 176.600 -0.164 0.000 1.049 178 K CA 0.548 56.840 56.287 0.009 0.000 0.974 178 K CB -0.767 31.767 32.500 0.056 0.000 0.792 178 K HN 0.202 8.452 8.250 -0.000 0.000 0.463 179 L N 0.482 121.638 121.223 -0.112 0.000 2.109 179 L HA -0.063 4.281 4.340 0.006 0.000 0.207 179 L C 2.483 179.236 176.870 -0.195 0.000 1.086 179 L CA 1.260 56.005 54.840 -0.159 0.000 0.760 179 L CB -1.024 40.962 42.059 -0.123 0.000 0.910 179 L HN 0.259 8.489 8.230 -0.000 0.000 0.437 180 G N 1.408 110.106 108.800 -0.170 0.000 2.586 180 G HA2 -0.244 3.719 3.960 0.006 0.000 0.218 180 G HA3 -0.244 3.719 3.960 0.006 0.000 0.218 180 G C -0.530 174.051 174.900 -0.532 0.000 1.216 180 G CA 1.114 46.089 45.100 -0.207 0.000 0.786 180 G HN 0.310 8.600 8.290 -0.000 0.000 0.583 181 P HA 0.006 4.426 4.420 -0.000 0.000 0.217 181 P C 2.023 178.935 177.300 -0.646 0.000 1.151 181 P CA 1.991 64.544 63.100 -0.911 0.000 0.828 181 P CB -0.149 31.040 31.700 -0.852 0.000 0.788 182 A N 0.272 122.582 122.820 -0.850 0.000 1.898 182 A HA -0.095 4.228 4.320 0.006 0.000 0.216 182 A C 2.424 179.935 177.584 -0.122 0.000 1.181 182 A CA 1.314 52.942 52.037 -0.681 0.000 0.620 182 A CB -1.531 17.084 19.000 -0.642 0.000 0.819 182 A HN 0.115 8.265 8.150 -0.000 0.000 0.442 183 L N -0.998 120.205 121.223 -0.034 0.000 2.179 183 L HA -0.066 4.277 4.340 0.006 0.000 0.208 183 L C 3.023 180.083 176.870 0.317 0.000 1.096 183 L CA 0.770 55.777 54.840 0.279 0.000 0.779 183 L CB -0.541 41.660 42.059 0.236 0.000 0.922 183 L HN 0.414 8.644 8.230 -0.000 0.000 0.443 184 A N 0.415 123.322 122.820 0.145 0.000 1.933 184 A HA -0.198 4.126 4.320 0.006 0.000 0.218 184 A C 2.284 179.934 177.584 0.110 0.000 1.175 184 A CA 2.240 54.367 52.037 0.151 0.000 0.628 184 A CB -0.827 18.274 19.000 0.169 0.000 0.814 184 A HN 0.506 8.656 8.150 -0.000 0.000 0.444 185 T N -4.604 109.997 114.554 0.079 0.000 3.107 185 T HA 0.418 4.772 4.350 0.006 0.000 0.249 185 T C 1.254 176.034 174.700 0.134 0.000 1.096 185 T CA 1.002 63.160 62.100 0.097 0.000 1.012 185 T CB 0.177 69.097 68.868 0.086 0.000 0.977 185 T HN 1.701 9.941 8.240 -0.000 0.000 0.527 186 G N 1.593 110.499 108.800 0.178 0.000 2.132 186 G HA2 -0.226 3.738 3.960 0.006 0.000 0.234 186 G HA3 -0.226 3.738 3.960 0.006 0.000 0.234 186 G C -0.053 175.165 174.900 0.529 0.000 0.989 186 G CA -0.302 44.880 45.100 0.138 0.000 0.676 186 G HN 0.575 8.865 8.290 -0.000 0.000 0.522 187 N N -0.479 118.522 118.700 0.502 0.000 2.347 187 N HA 0.549 5.292 4.740 0.006 0.000 0.253 187 N C 0.599 176.400 175.510 0.485 0.000 1.274 187 N CA 0.634 53.944 53.050 0.434 0.000 0.941 187 N CB 1.658 40.286 38.487 0.234 0.000 1.200 187 N HN 0.768 9.148 8.380 -0.000 0.000 0.514 188 V N -2.321 117.725 119.914 0.219 0.000 2.919 188 V HA 0.737 4.861 4.120 0.006 0.000 0.316 188 V C -0.198 175.886 176.094 -0.016 0.000 1.077 188 V CA -0.768 61.571 62.300 0.064 0.000 0.977 188 V CB 1.748 33.619 31.823 0.080 0.000 1.039 188 V HN 0.249 8.439 8.190 -0.000 0.000 0.441 189 V N 2.599 122.478 119.914 -0.059 0.000 2.709 189 V HA 0.577 4.701 4.120 0.006 0.000 0.308 189 V C -0.534 175.533 176.094 -0.045 0.000 1.062 189 V CA -0.498 61.775 62.300 -0.045 0.000 0.901 189 V CB 2.096 33.884 31.823 -0.059 0.000 1.003 189 V HN 0.809 8.999 8.190 -0.000 0.000 0.425 190 V N 5.675 125.572 119.914 -0.029 0.000 2.350 190 V HA 0.509 4.633 4.120 0.006 0.000 0.285 190 V C -0.167 175.934 176.094 0.011 0.000 1.014 190 V CA -0.289 62.000 62.300 -0.019 0.000 0.831 190 V CB 1.428 33.224 31.823 -0.045 0.000 1.000 190 V HN 0.903 9.092 8.190 -0.000 0.000 0.433 191 M N 5.088 124.704 119.600 0.026 0.000 2.364 191 M HA 0.608 5.092 4.480 0.006 0.000 0.334 191 M C -0.851 175.487 176.300 0.063 0.000 1.107 191 M CA -0.570 54.755 55.300 0.042 0.000 0.988 191 M CB 1.632 34.248 32.600 0.026 0.000 1.673 191 M HN 0.415 8.705 8.290 -0.000 0.000 0.441 192 K N 4.886 125.329 120.400 0.072 0.000 2.339 192 K HA 0.469 4.792 4.320 0.006 0.000 0.264 192 K C -1.286 175.361 176.600 0.078 0.000 0.986 192 K CA -0.388 55.948 56.287 0.081 0.000 0.866 192 K CB 1.143 33.696 32.500 0.088 0.000 1.103 192 K HN 0.683 8.933 8.250 -0.000 0.000 0.441 193 V N 0.712 120.675 119.914 0.081 0.000 2.973 193 V HA 0.723 4.846 4.120 0.006 0.000 0.314 193 V C 0.378 176.515 176.094 0.071 0.000 1.066 193 V CA -1.202 61.145 62.300 0.079 0.000 1.021 193 V CB 1.198 33.077 31.823 0.093 0.000 1.076 193 V HN 0.731 8.921 8.190 -0.000 0.000 0.462 194 A N 2.039 124.911 122.820 0.087 0.000 2.425 194 A HA 0.325 4.649 4.320 0.006 0.000 0.249 194 A C 1.248 178.860 177.584 0.047 0.000 1.084 194 A CA 0.247 52.345 52.037 0.102 0.000 0.781 194 A CB 0.043 19.180 19.000 0.228 0.000 1.019 194 A HN 1.131 9.281 8.150 -0.000 0.000 0.490 195 E N 1.713 121.855 120.200 -0.096 0.000 2.204 195 E HA -0.273 4.081 4.350 0.006 0.000 0.195 195 E C 1.000 177.604 176.600 0.005 0.000 0.990 195 E CA 1.669 57.930 56.400 -0.232 0.000 0.821 195 E CB -0.192 29.012 29.700 -0.826 0.000 0.750 195 E HN 0.813 9.173 8.360 -0.000 0.000 0.477 196 Q N 0.685 120.477 119.800 -0.012 0.000 2.245 196 Q HA -0.004 4.340 4.340 0.006 0.000 0.201 196 Q C 0.642 176.653 176.000 0.019 0.000 0.955 196 Q CA 1.695 57.471 55.803 -0.046 0.000 0.870 196 Q CB 0.540 29.141 28.738 -0.229 0.000 0.945 196 Q HN 0.463 8.733 8.270 -0.000 0.000 0.461 197 T N -4.096 110.507 114.554 0.081 0.000 3.816 197 T HA 0.312 4.666 4.350 0.006 0.000 0.232 197 T C -2.614 172.138 174.700 0.086 0.000 1.125 197 T CA -1.282 60.865 62.100 0.078 0.000 1.609 197 T CB 0.946 69.880 68.868 0.110 0.000 0.805 197 T HN -0.098 8.142 8.240 -0.000 0.000 0.647 198 P HA 0.247 4.667 4.420 -0.000 0.000 0.230 198 P C 1.596 178.948 177.300 0.087 0.000 1.168 198 P CA -0.013 63.153 63.100 0.111 0.000 0.793 198 P CB 0.232 32.025 31.700 0.154 0.000 0.851 199 L N -0.070 121.184 121.223 0.052 0.000 2.027 199 L HA -0.118 4.226 4.340 0.006 0.000 0.206 199 L C 2.594 179.523 176.870 0.098 0.000 1.074 199 L CA 2.351 57.221 54.840 0.050 0.000 0.745 199 L CB -2.044 40.016 42.059 0.001 0.000 0.898 199 L HN 0.084 8.314 8.230 -0.000 0.000 0.433 200 T N -1.954 112.644 114.554 0.073 0.000 2.788 200 T HA -0.143 4.211 4.350 0.006 0.000 0.268 200 T C 1.965 176.755 174.700 0.150 0.000 1.044 200 T CA 1.015 63.176 62.100 0.102 0.000 1.139 200 T CB -0.438 68.457 68.868 0.045 0.000 0.867 200 T HN 0.317 8.557 8.240 -0.000 0.000 0.454 201 A N 1.680 124.565 122.820 0.109 0.000 1.930 201 A HA 0.185 4.508 4.320 0.006 0.000 0.217 201 A C 2.447 180.095 177.584 0.106 0.000 1.175 201 A CA 1.207 53.297 52.037 0.088 0.000 0.627 201 A CB -0.853 18.187 19.000 0.068 0.000 0.815 201 A HN 0.543 8.693 8.150 -0.000 0.000 0.443 202 L N -2.259 119.066 121.223 0.170 0.000 2.056 202 L HA -0.185 4.159 4.340 0.006 0.000 0.207 202 L C 2.589 179.632 176.870 0.288 0.000 1.078 202 L CA 1.746 56.749 54.840 0.272 0.000 0.749 202 L CB -0.692 41.508 42.059 0.235 0.000 0.901 202 L HN 0.568 8.798 8.230 -0.000 0.000 0.433 203 Y N 0.354 120.744 120.300 0.150 0.000 2.181 203 Y HA -0.219 4.334 4.550 0.006 0.000 0.288 203 Y C 2.416 178.393 175.900 0.129 0.000 1.146 203 Y CA 1.452 59.663 58.100 0.185 0.000 1.164 203 Y CB -0.219 38.409 38.460 0.279 0.000 0.982 203 Y HN -0.171 8.109 8.280 -0.000 0.000 0.515 204 V N 0.395 120.381 119.914 0.121 0.000 2.490 204 V HA -0.346 3.778 4.120 0.006 0.000 0.250 204 V C 2.645 178.626 176.094 -0.187 0.000 1.061 204 V CA 1.640 63.932 62.300 -0.014 0.000 1.064 204 V CB -1.515 30.329 31.823 0.035 0.000 0.670 204 V HN 0.586 8.776 8.190 -0.000 0.000 0.461 205 A N 0.230 122.885 122.820 -0.276 0.000 1.940 205 A HA -0.297 4.026 4.320 0.006 0.000 0.219 205 A C 2.070 179.231 177.584 -0.704 0.000 1.176 205 A CA 2.332 53.913 52.037 -0.760 0.000 0.631 205 A CB -0.773 17.509 19.000 -1.196 0.000 0.814 205 A HN 0.570 8.720 8.150 -0.000 0.000 0.446 206 N N -0.115 118.429 118.700 -0.260 0.000 2.223 206 N HA -0.060 4.684 4.740 0.006 0.000 0.185 206 N C 1.514 176.942 175.510 -0.137 0.000 1.016 206 N CA 1.229 54.241 53.050 -0.064 0.000 0.863 206 N CB -0.361 38.094 38.487 -0.053 0.000 0.983 206 N HN 0.536 8.916 8.380 -0.000 0.000 0.429 207 L N -0.313 120.778 121.223 -0.221 0.000 2.156 207 L HA -0.007 4.337 4.340 0.006 0.000 0.208 207 L C 1.965 178.831 176.870 -0.007 0.000 1.095 207 L CA 0.526 55.299 54.840 -0.111 0.000 0.770 207 L CB -0.268 41.735 42.059 -0.094 0.000 0.914 207 L HN 0.151 8.381 8.230 -0.000 0.000 0.439 208 I N 0.254 120.789 120.570 -0.059 0.000 2.226 208 I HA -0.321 3.852 4.170 0.006 0.000 0.245 208 I C 2.746 178.979 176.117 0.193 0.000 1.100 208 I CA 1.404 62.718 61.300 0.023 0.000 1.374 208 I CB -0.237 37.631 38.000 -0.220 0.000 1.057 208 I HN 0.253 8.463 8.210 -0.000 0.000 0.413 209 K N 1.142 121.629 120.400 0.145 0.000 2.026 209 K HA -0.264 4.060 4.320 0.006 0.000 0.208 209 K C 2.120 178.797 176.600 0.129 0.000 1.048 209 K CA 1.810 58.208 56.287 0.184 0.000 0.929 209 K CB -0.139 32.488 32.500 0.213 0.000 0.713 209 K HN 0.255 8.505 8.250 -0.000 0.000 0.439 210 E N -0.164 120.089 120.200 0.088 0.000 2.118 210 E HA -0.190 4.164 4.350 0.006 0.000 0.195 210 E C 1.649 178.291 176.600 0.071 0.000 0.992 210 E CA 1.031 57.467 56.400 0.061 0.000 0.804 210 E CB -0.109 29.605 29.700 0.024 0.000 0.741 210 E HN 0.463 8.823 8.360 -0.000 0.000 0.458 211 A N -0.065 122.822 122.820 0.112 0.000 2.067 211 A HA 0.072 4.396 4.320 0.006 0.000 0.219 211 A C 1.863 179.459 177.584 0.020 0.000 1.158 211 A CA 1.396 53.492 52.037 0.098 0.000 0.661 211 A CB -0.372 18.758 19.000 0.217 0.000 0.801 211 A HN 0.525 8.675 8.150 -0.000 0.000 0.452 212 G N -2.786 106.057 108.800 0.072 0.000 2.154 212 G HA2 -0.160 3.803 3.960 0.006 0.000 0.186 212 G HA3 -0.160 3.803 3.960 0.006 0.000 0.186 212 G C -0.035 174.868 174.900 0.005 0.000 1.000 212 G CA -0.246 44.868 45.100 0.024 0.000 0.664 212 G HN 0.266 8.556 8.290 -0.000 0.000 0.513 213 F N 1.781 121.748 119.950 0.029 0.000 2.572 213 F HA 0.383 4.914 4.527 0.006 0.000 0.370 213 F C -1.100 174.676 175.800 -0.040 0.000 1.103 213 F CA -1.197 56.787 58.000 -0.027 0.000 1.286 213 F CB 0.368 39.291 39.000 -0.130 0.000 1.105 213 F HN -0.080 8.220 8.300 -0.000 0.000 0.583 214 P HA 0.026 4.446 4.420 -0.000 0.000 0.267 214 P C -2.466 174.834 177.300 0.001 0.000 1.200 214 P CA -0.939 62.207 63.100 0.076 0.000 0.772 214 P CB -0.165 31.615 31.700 0.134 0.000 0.855 215 P HA 0.011 4.431 4.420 -0.000 0.000 0.268 215 P C 0.841 178.086 177.300 -0.093 0.000 1.204 215 P CA 0.874 63.927 63.100 -0.077 0.000 0.768 215 P CB 0.296 31.952 31.700 -0.074 0.000 0.842 216 G N 1.755 110.471 108.800 -0.140 0.000 2.217 216 G HA2 -0.290 3.673 3.960 0.006 0.000 0.246 216 G HA3 -0.290 3.673 3.960 0.006 0.000 0.246 216 G C 0.855 175.673 174.900 -0.136 0.000 0.990 216 G CA 0.141 45.168 45.100 -0.121 0.000 0.627 216 G HN 0.384 8.674 8.290 -0.000 0.000 0.522 217 V N -0.127 119.656 119.914 -0.217 0.000 2.427 217 V HA 0.116 4.240 4.120 0.006 0.000 0.248 217 V C 1.351 177.266 176.094 -0.297 0.000 1.051 217 V CA 1.978 64.039 62.300 -0.398 0.000 1.048 217 V CB 0.278 31.622 31.823 -0.798 0.000 0.666 217 V HN 0.386 8.576 8.190 -0.000 0.000 0.456 218 V N 1.652 121.442 119.914 -0.208 0.000 2.525 218 V HA 0.472 4.596 4.120 0.006 0.000 0.299 218 V C -0.842 175.268 176.094 0.027 0.000 1.034 218 V CA -0.804 61.420 62.300 -0.126 0.000 0.863 218 V CB 1.786 33.486 31.823 -0.205 0.000 0.999 218 V HN 0.428 8.618 8.190 -0.000 0.000 0.423 219 N N 5.528 124.240 118.700 0.020 0.000 2.258 219 N HA 0.664 5.408 4.740 0.006 0.000 0.299 219 N C -1.282 174.286 175.510 0.096 0.000 1.047 219 N CA -0.476 52.617 53.050 0.071 0.000 0.814 219 N CB 3.115 41.583 38.487 -0.032 0.000 1.413 219 N HN 0.475 8.855 8.380 -0.000 0.000 0.478 220 I N 1.323 121.998 120.570 0.175 0.000 2.436 220 I HA 0.358 4.532 4.170 0.006 0.000 0.289 220 I C -0.539 175.681 176.117 0.171 0.000 1.010 220 I CA -1.039 60.348 61.300 0.145 0.000 1.098 220 I CB 2.198 40.275 38.000 0.128 0.000 1.266 220 I HN 0.051 8.261 8.210 -0.000 0.000 0.434 221 V N 7.300 127.296 119.914 0.137 0.000 2.325 221 V HA 0.314 4.438 4.120 0.006 0.000 0.280 221 V C -2.297 173.890 176.094 0.155 0.000 1.016 221 V CA -1.669 60.720 62.300 0.148 0.000 0.818 221 V CB 1.228 33.115 31.823 0.106 0.000 1.019 221 V HN 0.558 8.748 8.190 -0.000 0.000 0.434 222 P HA 0.647 5.067 4.420 -0.000 0.000 0.274 222 P C 0.369 177.778 177.300 0.182 0.000 1.231 222 P CA 0.360 63.596 63.100 0.226 0.000 0.790 222 P CB 1.492 33.395 31.700 0.339 0.000 0.951 223 G N -0.182 108.592 108.800 -0.042 0.000 2.351 223 G HA2 0.293 4.257 3.960 0.006 0.000 0.279 223 G HA3 0.293 4.257 3.960 0.006 0.000 0.279 223 G C -1.631 172.958 174.900 -0.518 0.000 1.297 223 G CA -0.753 44.202 45.100 -0.242 0.000 0.886 223 G HN 0.294 8.584 8.290 -0.000 0.000 0.493 224 F N -0.003 119.816 119.950 -0.219 0.000 2.461 224 F HA 0.608 5.138 4.527 0.006 0.000 0.337 224 F C 1.758 177.526 175.800 -0.053 0.000 1.079 224 F CA 0.345 58.250 58.000 -0.158 0.000 1.032 224 F CB 1.598 40.500 39.000 -0.163 0.000 1.327 224 F HN 0.665 8.965 8.300 -0.000 0.000 0.491 225 G N -0.011 108.896 108.800 0.177 0.000 2.425 225 G HA2 -0.038 3.925 3.960 0.006 0.000 0.213 225 G HA3 -0.038 3.925 3.960 0.006 0.000 0.213 225 G C -1.184 173.764 174.900 0.081 0.000 1.201 225 G CA 0.421 45.590 45.100 0.115 0.000 0.799 225 G HN 0.442 8.732 8.290 -0.000 0.000 0.534 226 P HA 0.011 4.431 4.420 -0.000 0.000 0.228 226 P C 1.640 178.957 177.300 0.029 0.000 1.151 226 P CA 1.865 64.983 63.100 0.030 0.000 0.770 226 P CB 0.125 31.833 31.700 0.013 0.000 0.786 227 T N -3.769 110.820 114.554 0.058 0.000 3.480 227 T HA 0.310 4.664 4.350 0.006 0.000 0.229 227 T C 1.957 176.696 174.700 0.064 0.000 0.944 227 T CA 0.567 62.699 62.100 0.054 0.000 1.388 227 T CB -1.108 67.798 68.868 0.063 0.000 1.180 227 T HN -0.106 8.134 8.240 -0.000 0.000 0.414 228 A N 1.786 124.657 122.820 0.086 0.000 1.883 228 A HA 0.220 4.543 4.320 0.006 0.000 0.217 228 A C 2.619 180.245 177.584 0.071 0.000 1.186 228 A CA 2.077 54.162 52.037 0.080 0.000 0.624 228 A CB -1.752 17.298 19.000 0.083 0.000 0.822 228 A HN 0.699 8.849 8.150 -0.000 0.000 0.444 229 G N -0.666 108.175 108.800 0.070 0.000 2.421 229 G HA2 0.023 3.987 3.960 0.006 0.000 0.216 229 G HA3 0.023 3.987 3.960 0.006 0.000 0.216 229 G C 1.769 176.689 174.900 0.033 0.000 1.171 229 G CA 1.477 46.614 45.100 0.063 0.000 0.775 229 G HN 0.823 9.113 8.290 -0.000 0.000 0.543 230 A N 1.205 124.036 122.820 0.019 0.000 1.902 230 A HA 0.234 4.557 4.320 0.006 0.000 0.217 230 A C 2.801 180.397 177.584 0.019 0.000 1.181 230 A CA 2.287 54.325 52.037 0.000 0.000 0.623 230 A CB -0.771 18.226 19.000 -0.005 0.000 0.818 230 A HN 0.816 8.966 8.150 -0.000 0.000 0.443 231 A N -0.198 122.646 122.820 0.040 0.000 1.972 231 A HA -0.057 4.267 4.320 0.006 0.000 0.219 231 A C 2.099 179.749 177.584 0.109 0.000 1.169 231 A CA 1.470 53.545 52.037 0.063 0.000 0.635 231 A CB -0.548 18.496 19.000 0.073 0.000 0.810 231 A HN 0.523 8.673 8.150 -0.000 0.000 0.446 232 I N -0.469 120.154 120.570 0.088 0.000 2.202 232 I HA -0.229 3.945 4.170 0.006 0.000 0.242 232 I C 2.954 179.116 176.117 0.075 0.000 1.091 232 I CA 1.056 62.406 61.300 0.083 0.000 1.368 232 I CB -0.390 37.644 38.000 0.058 0.000 1.058 232 I HN 0.338 8.548 8.210 -0.000 0.000 0.410 233 A N -0.244 122.601 122.820 0.042 0.000 1.972 233 A HA -0.146 4.178 4.320 0.006 0.000 0.219 233 A C 2.331 179.928 177.584 0.021 0.000 1.169 233 A CA 1.910 53.957 52.037 0.016 0.000 0.635 233 A CB -0.459 18.525 19.000 -0.027 0.000 0.810 233 A HN 0.382 8.532 8.150 -0.000 0.000 0.446 234 S N -1.076 114.642 115.700 0.030 0.000 2.575 234 S HA 0.067 4.541 4.470 0.006 0.000 0.215 234 S C 0.582 175.199 174.600 0.028 0.000 0.966 234 S CA -0.486 57.721 58.200 0.013 0.000 0.911 234 S CB -0.239 62.955 63.200 -0.011 0.000 0.780 234 S HN 0.666 8.976 8.310 -0.000 0.000 0.514 235 H N 2.641 121.704 119.070 -0.011 0.000 2.803 235 H HA 0.127 4.686 4.556 0.006 0.000 0.330 235 H C 0.889 176.210 175.328 -0.011 0.000 1.057 235 H CA 0.396 56.439 56.048 -0.009 0.000 1.458 235 H CB 0.677 30.436 29.762 -0.006 0.000 1.470 235 H HN 0.119 8.399 8.280 -0.000 0.000 0.560 236 E N 2.922 123.158 120.200 0.061 0.000 2.347 236 E HA -0.126 4.228 4.350 0.006 0.000 0.196 236 E C 0.531 177.233 176.600 0.170 0.000 1.008 236 E CA 0.784 57.231 56.400 0.079 0.000 0.852 236 E CB 0.289 29.980 29.700 -0.014 0.000 0.783 236 E HN 0.592 8.952 8.360 -0.000 0.000 0.505 237 D N -0.401 120.228 120.400 0.381 0.000 2.479 237 D HA 0.054 4.698 4.640 0.006 0.000 0.218 237 D C -0.713 175.594 176.300 0.012 0.000 1.177 237 D CA -0.057 54.038 54.000 0.159 0.000 0.830 237 D CB 0.637 41.528 40.800 0.153 0.000 1.014 237 D HN -0.218 8.152 8.370 -0.000 0.000 0.503 238 V N 1.571 121.501 119.914 0.027 0.000 2.432 238 V HA 0.157 4.280 4.120 0.006 0.000 0.275 238 V C 0.833 176.910 176.094 -0.028 0.000 1.043 238 V CA -0.342 61.929 62.300 -0.049 0.000 0.925 238 V CB 1.767 33.569 31.823 -0.035 0.000 0.985 238 V HN 0.069 8.259 8.190 -0.000 0.000 0.466 239 D N 2.976 123.338 120.400 -0.064 0.000 2.305 239 D HA 0.068 4.712 4.640 0.006 0.000 0.206 239 D C 0.738 177.003 176.300 -0.058 0.000 0.974 239 D CA 0.799 54.762 54.000 -0.062 0.000 0.871 239 D CB 0.634 41.375 40.800 -0.099 0.000 0.947 239 D HN 0.385 8.755 8.370 -0.000 0.000 0.516 240 K N 0.656 121.021 120.400 -0.057 0.000 2.557 240 K HA 0.323 4.647 4.320 0.006 0.000 0.261 240 K C -2.086 174.493 176.600 -0.034 0.000 0.932 240 K CA -0.558 55.691 56.287 -0.063 0.000 0.829 240 K CB 2.910 35.344 32.500 -0.109 0.000 1.358 240 K HN -0.149 8.101 8.250 -0.000 0.000 0.430 241 V N 2.112 122.011 119.914 -0.025 0.000 2.656 241 V HA 0.850 4.974 4.120 0.006 0.000 0.307 241 V C -1.371 174.744 176.094 0.035 0.000 1.051 241 V CA -0.362 61.950 62.300 0.019 0.000 0.893 241 V CB 1.588 33.428 31.823 0.029 0.000 0.999 241 V HN 0.875 9.065 8.190 -0.000 0.000 0.426 242 A N 6.411 129.284 122.820 0.088 0.000 2.335 242 A HA 0.842 5.165 4.320 0.006 0.000 0.304 242 A C -1.389 176.314 177.584 0.198 0.000 1.118 242 A CA -0.433 51.675 52.037 0.119 0.000 0.757 242 A CB 1.065 20.142 19.000 0.128 0.000 1.188 242 A HN 1.154 9.304 8.150 -0.000 0.000 0.460 243 F N 2.133 122.107 119.950 0.039 0.000 2.529 243 F HA 0.703 5.233 4.527 0.006 0.000 0.320 243 F C -0.392 175.434 175.800 0.044 0.000 1.118 243 F CA -0.074 57.948 58.000 0.036 0.000 0.915 243 F CB 2.298 41.312 39.000 0.022 0.000 1.161 243 F HN 0.399 8.699 8.300 -0.000 0.000 0.445 244 T N 4.845 118.908 114.554 -0.818 0.000 2.809 244 T HA 0.783 5.136 4.350 0.006 0.000 0.284 244 T C -0.089 173.933 174.700 -1.131 0.000 0.992 244 T CA -0.280 61.393 62.100 -0.711 0.000 0.957 244 T CB 1.132 69.835 68.868 -0.276 0.000 0.942 244 T HN 1.070 9.310 8.240 -0.000 0.000 0.439 245 G N 1.833 110.093 108.800 -0.899 0.000 2.435 245 G HA2 0.503 4.467 3.960 0.006 0.000 0.228 245 G HA3 0.503 4.467 3.960 0.006 0.000 0.228 245 G C -0.748 174.049 174.900 -0.170 0.000 1.198 245 G CA -0.401 44.372 45.100 -0.545 0.000 0.948 245 G HN 0.850 9.140 8.290 -0.000 0.000 0.487 246 S N -0.390 115.327 115.700 0.028 0.000 2.584 246 S HA 0.441 4.915 4.470 0.006 0.000 0.273 246 S C 1.266 175.967 174.600 0.168 0.000 1.311 246 S CA 0.861 59.079 58.200 0.029 0.000 1.034 246 S CB 1.385 64.603 63.200 0.029 0.000 0.939 246 S HN 0.706 9.016 8.310 -0.000 0.000 0.513 247 T N 1.500 116.142 114.554 0.147 0.000 2.778 247 T HA -0.184 4.170 4.350 0.006 0.000 0.269 247 T C 1.585 176.365 174.700 0.133 0.000 1.050 247 T CA 1.902 64.112 62.100 0.182 0.000 1.137 247 T CB -0.521 68.496 68.868 0.248 0.000 0.860 247 T HN 0.882 9.122 8.240 -0.000 0.000 0.468 248 E N 0.719 120.987 120.200 0.113 0.000 2.033 248 E HA -0.150 4.204 4.350 0.006 0.000 0.199 248 E C 2.083 178.705 176.600 0.037 0.000 1.011 248 E CA 1.363 57.805 56.400 0.071 0.000 0.815 248 E CB -0.247 29.495 29.700 0.070 0.000 0.755 248 E HN 0.497 8.857 8.360 -0.000 0.000 0.451 249 I N 0.670 121.270 120.570 0.051 0.000 2.546 249 I HA -0.091 4.082 4.170 0.006 0.000 0.255 249 I C 2.464 178.416 176.117 -0.275 0.000 1.163 249 I CA 0.724 61.974 61.300 -0.083 0.000 1.457 249 I CB -0.448 37.531 38.000 -0.035 0.000 1.092 249 I HN 0.283 8.493 8.210 -0.000 0.000 0.434 250 G N 1.034 109.797 108.800 -0.061 0.000 2.462 250 G HA2 -0.228 3.735 3.960 0.006 0.000 0.220 250 G HA3 -0.228 3.735 3.960 0.006 0.000 0.220 250 G C 1.822 176.675 174.900 -0.078 0.000 1.121 250 G CA 0.393 45.465 45.100 -0.046 0.000 0.758 250 G HN 0.337 8.627 8.290 -0.000 0.000 0.559 251 R N -0.385 120.085 120.500 -0.050 0.000 2.090 251 R HA 0.033 4.377 4.340 0.006 0.000 0.228 251 R C 2.635 178.888 176.300 -0.079 0.000 1.110 251 R CA 0.971 57.044 56.100 -0.045 0.000 0.973 251 R CB -0.361 29.926 30.300 -0.021 0.000 0.869 251 R HN 0.324 8.594 8.270 -0.000 0.000 0.440 252 V N 1.573 121.419 119.914 -0.114 0.000 2.307 252 V HA -0.216 3.908 4.120 0.006 0.000 0.245 252 V C 2.312 178.315 176.094 -0.151 0.000 1.045 252 V CA 1.405 63.633 62.300 -0.120 0.000 1.024 252 V CB -0.383 31.366 31.823 -0.123 0.000 0.651 252 V HN 0.222 8.412 8.190 -0.000 0.000 0.449 253 I N 0.299 120.718 120.570 -0.251 0.000 2.226 253 I HA -0.260 3.914 4.170 0.006 0.000 0.245 253 I C 2.555 178.596 176.117 -0.127 0.000 1.100 253 I CA 1.899 63.056 61.300 -0.239 0.000 1.374 253 I CB -1.272 36.471 38.000 -0.427 0.000 1.057 253 I HN 0.422 8.632 8.210 -0.000 0.000 0.413 254 Q N 1.253 120.990 119.800 -0.104 0.000 2.050 254 Q HA -0.133 4.211 4.340 0.006 0.000 0.202 254 Q C 2.252 178.223 176.000 -0.049 0.000 0.980 254 Q CA 1.887 57.657 55.803 -0.055 0.000 0.840 254 Q CB -0.151 28.564 28.738 -0.037 0.000 0.898 254 Q HN 0.303 8.573 8.270 -0.000 0.000 0.424 255 V N 0.653 120.535 119.914 -0.054 0.000 2.358 255 V HA -0.189 3.935 4.120 0.006 0.000 0.246 255 V C 2.268 178.337 176.094 -0.042 0.000 1.047 255 V CA 1.626 63.900 62.300 -0.044 0.000 1.035 255 V CB -1.060 30.737 31.823 -0.043 0.000 0.658 255 V HN 0.548 8.738 8.190 -0.000 0.000 0.452 256 A N -0.215 122.575 122.820 -0.051 0.000 2.070 256 A HA -0.031 4.293 4.320 0.006 0.000 0.220 256 A C 2.291 179.856 177.584 -0.032 0.000 1.159 256 A CA 1.823 53.834 52.037 -0.043 0.000 0.656 256 A CB -0.470 18.500 19.000 -0.051 0.000 0.800 256 A HN 0.562 8.712 8.150 -0.000 0.000 0.453 257 A N -0.969 121.831 122.820 -0.034 0.000 2.021 257 A HA 0.314 4.638 4.320 0.006 0.000 0.216 257 A C 2.189 179.761 177.584 -0.021 0.000 1.163 257 A CA 1.364 53.386 52.037 -0.024 0.000 0.676 257 A CB -0.741 18.244 19.000 -0.025 0.000 0.818 257 A HN 0.634 8.784 8.150 -0.000 0.000 0.453 258 G N -1.250 107.535 108.800 -0.025 0.000 2.603 258 G HA2 0.093 4.057 3.960 0.006 0.000 0.214 258 G HA3 0.093 4.057 3.960 0.006 0.000 0.214 258 G C 1.390 176.278 174.900 -0.021 0.000 1.140 258 G CA 0.975 46.062 45.100 -0.022 0.000 0.800 258 G HN 0.441 8.731 8.290 -0.000 0.000 0.533 259 S N 0.459 116.145 115.700 -0.022 0.000 2.558 259 S HA 0.054 4.527 4.470 0.006 0.000 0.217 259 S C 2.246 176.834 174.600 -0.020 0.000 0.975 259 S CA 0.757 58.944 58.200 -0.022 0.000 0.912 259 S CB 0.167 63.352 63.200 -0.024 0.000 0.776 259 S HN 0.568 8.878 8.310 -0.000 0.000 0.526 260 S N 3.188 118.877 115.700 -0.018 0.000 2.836 260 S HA 0.109 4.583 4.470 0.006 0.000 0.164 260 S C 0.969 175.563 174.600 -0.010 0.000 0.714 260 S CA 0.185 58.376 58.200 -0.015 0.000 0.906 260 S CB -0.465 62.730 63.200 -0.010 0.000 0.702 260 S HN 0.496 8.806 8.310 -0.000 0.000 0.571 261 N N 0.903 119.601 118.700 -0.004 0.000 2.238 261 N HA 0.241 4.984 4.740 0.006 0.000 0.235 261 N C -0.307 175.200 175.510 -0.006 0.000 1.209 261 N CA -0.128 52.921 53.050 -0.001 0.000 0.879 261 N CB -0.261 38.232 38.487 0.010 0.000 1.136 261 N HN 0.402 8.782 8.380 -0.000 0.000 0.517 262 L N -0.123 121.093 121.223 -0.011 0.000 3.865 262 L HA -0.287 4.056 4.340 0.006 0.000 0.408 262 L C -0.017 176.842 176.870 -0.018 0.000 1.209 262 L CA 0.938 55.768 54.840 -0.016 0.000 0.940 262 L CB -2.269 39.780 42.059 -0.016 0.000 1.971 262 L HN 0.432 8.662 8.230 -0.000 0.000 0.899 263 K N -0.227 120.164 120.400 -0.016 0.000 2.440 263 K HA 0.344 4.668 4.320 0.006 0.000 0.270 263 K C 0.422 177.002 176.600 -0.032 0.000 0.980 263 K CA -0.477 55.797 56.287 -0.022 0.000 0.953 263 K CB 0.432 32.923 32.500 -0.015 0.000 0.925 263 K HN 0.172 8.422 8.250 -0.000 0.000 0.497 264 R N 0.797 121.269 120.500 -0.046 0.000 2.594 264 R HA 0.227 4.571 4.340 0.006 0.000 0.272 264 R C -0.643 175.623 176.300 -0.057 0.000 1.074 264 R CA -0.453 55.612 56.100 -0.059 0.000 1.105 264 R CB 0.828 31.077 30.300 -0.084 0.000 1.008 264 R HN 0.388 8.658 8.270 -0.000 0.000 0.472 265 V N 1.674 121.558 119.914 -0.050 0.000 2.668 265 V HA 0.308 4.432 4.120 0.006 0.000 0.304 265 V C -0.390 175.690 176.094 -0.024 0.000 1.071 265 V CA -0.828 61.455 62.300 -0.029 0.000 0.894 265 V CB 2.100 33.915 31.823 -0.013 0.000 1.008 265 V HN 0.988 9.178 8.190 -0.000 0.000 0.425 266 T N 3.280 117.828 114.554 -0.009 0.000 2.856 266 T HA 0.891 5.244 4.350 0.006 0.000 0.283 266 T C -0.892 173.855 174.700 0.079 0.000 1.008 266 T CA -0.726 61.380 62.100 0.010 0.000 0.997 266 T CB 1.791 70.642 68.868 -0.028 0.000 0.992 266 T HN 0.381 8.621 8.240 -0.000 0.000 0.454 267 L N 1.582 122.857 121.223 0.087 0.000 2.408 267 L HA 0.629 4.973 4.340 0.006 0.000 0.268 267 L C -0.303 176.625 176.870 0.097 0.000 0.986 267 L CA -0.854 54.072 54.840 0.143 0.000 0.820 267 L CB 2.322 44.483 42.059 0.171 0.000 1.303 267 L HN 0.672 8.902 8.230 -0.000 0.000 0.411 268 E N 4.034 124.280 120.200 0.076 0.000 2.182 268 E HA 0.563 4.917 4.350 0.006 0.000 0.258 268 E C -1.341 175.271 176.600 0.019 0.000 0.879 268 E CA -0.250 56.184 56.400 0.056 0.000 0.754 268 E CB 1.657 31.416 29.700 0.099 0.000 1.162 268 E HN 0.551 8.911 8.360 -0.000 0.000 0.419 269 L N 1.489 122.741 121.223 0.049 0.000 2.777 269 L HA 0.654 4.998 4.340 0.006 0.000 0.241 269 L C 1.190 178.051 176.870 -0.016 0.000 1.854 269 L CA -1.014 53.855 54.840 0.048 0.000 2.070 269 L CB 0.091 42.234 42.059 0.139 0.000 2.441 269 L HN 0.472 8.702 8.230 -0.000 0.000 0.587 270 G N -1.474 107.292 108.800 -0.056 0.000 2.563 270 G HA2 0.561 4.525 3.960 0.006 0.000 0.283 270 G HA3 0.561 4.525 3.960 0.006 0.000 0.283 270 G C -0.731 173.781 174.900 -0.646 0.000 1.309 270 G CA 0.099 45.007 45.100 -0.320 0.000 1.022 270 G HN 0.749 9.039 8.290 -0.000 0.000 0.501 271 G N -1.589 106.699 108.800 -0.854 0.000 2.677 271 G HA2 0.494 4.458 3.960 0.006 0.000 0.291 271 G HA3 0.494 4.458 3.960 0.006 0.000 0.291 271 G C -1.335 173.286 174.900 -0.465 0.000 1.435 271 G CA -0.637 44.053 45.100 -0.683 0.000 0.826 271 G HN 0.554 8.844 8.290 -0.000 0.000 0.491 272 K N 0.709 121.070 120.400 -0.064 0.000 3.146 272 K HA 0.444 4.768 4.320 0.006 0.000 0.168 272 K C -0.075 176.610 176.600 0.142 0.000 1.075 272 K CA -0.332 56.013 56.287 0.096 0.000 0.843 272 K CB 0.266 32.911 32.500 0.241 0.000 1.002 272 K HN 0.396 8.646 8.250 -0.000 0.000 0.597 273 S N 2.994 118.779 115.700 0.142 0.000 2.531 273 S HA 0.274 4.747 4.470 0.006 0.000 0.279 273 S C -2.450 172.292 174.600 0.236 0.000 1.305 273 S CA -0.881 57.438 58.200 0.198 0.000 1.058 273 S CB 0.564 63.931 63.200 0.278 0.000 0.899 273 S HN 0.325 8.634 8.310 -0.000 0.000 0.493 274 P HA 0.270 4.690 4.420 -0.000 0.000 0.292 274 P C -0.919 176.588 177.300 0.344 0.000 1.287 274 P CA -0.590 62.711 63.100 0.335 0.000 0.800 274 P CB 0.341 32.215 31.700 0.289 0.000 0.945 275 N N 3.572 122.475 118.700 0.339 0.000 2.476 275 N HA 0.363 5.107 4.740 0.006 0.000 0.257 275 N C -0.938 174.760 175.510 0.313 0.000 0.970 275 N CA -0.557 52.700 53.050 0.346 0.000 0.938 275 N CB 0.461 39.060 38.487 0.188 0.000 1.144 275 N HN 0.289 8.668 8.380 -0.000 0.000 0.500 276 I N 4.876 125.640 120.570 0.322 0.000 2.330 276 I HA 0.312 4.486 4.170 0.006 0.000 0.289 276 I C -0.297 176.011 176.117 0.319 0.000 1.001 276 I CA -0.787 60.670 61.300 0.261 0.000 1.193 276 I CB 1.304 39.348 38.000 0.072 0.000 1.345 276 I HN 0.391 8.601 8.210 -0.000 0.000 0.461 277 I N 6.866 127.604 120.570 0.280 0.000 2.328 277 I HA 0.339 4.513 4.170 0.006 0.000 0.287 277 I C 0.159 176.449 176.117 0.288 0.000 1.012 277 I CA -0.557 60.868 61.300 0.208 0.000 1.195 277 I CB 1.031 38.943 38.000 -0.147 0.000 1.350 277 I HN 0.459 8.669 8.210 -0.000 0.000 0.464 278 M N 3.853 123.635 119.600 0.304 0.000 2.247 278 M HA 0.169 4.652 4.480 0.006 0.000 0.326 278 M C 1.631 178.026 176.300 0.158 0.000 1.134 278 M CA -0.099 55.361 55.300 0.267 0.000 1.136 278 M CB 0.809 33.556 32.600 0.245 0.000 1.454 278 M HN 0.664 8.954 8.290 -0.000 0.000 0.467 279 S N 0.243 115.999 115.700 0.093 0.000 2.469 279 S HA -0.153 4.321 4.470 0.006 0.000 0.238 279 S C 0.764 175.419 174.600 0.093 0.000 0.998 279 S CA 1.292 59.530 58.200 0.063 0.000 0.957 279 S CB -0.585 62.628 63.200 0.022 0.000 0.764 279 S HN 0.749 9.059 8.310 -0.000 0.000 0.514 280 D N 1.657 122.124 120.400 0.111 0.000 2.325 280 D HA 0.393 5.036 4.640 0.006 0.000 0.225 280 D C 0.522 176.911 176.300 0.147 0.000 1.096 280 D CA 0.054 54.121 54.000 0.112 0.000 0.844 280 D CB -0.318 40.540 40.800 0.095 0.000 0.925 280 D HN 0.506 8.876 8.370 -0.000 0.000 0.513 281 A N 0.436 123.369 122.820 0.188 0.000 2.386 281 A HA 0.219 4.543 4.320 0.006 0.000 0.248 281 A C 0.258 177.988 177.584 0.243 0.000 1.082 281 A CA -0.448 51.745 52.037 0.260 0.000 0.789 281 A CB 0.261 19.461 19.000 0.334 0.000 1.025 281 A HN 0.142 8.292 8.150 -0.000 0.000 0.490 282 D N 1.863 122.439 120.400 0.294 0.000 2.363 282 D HA 0.067 4.710 4.640 0.006 0.000 0.263 282 D C 0.980 177.451 176.300 0.285 0.000 1.258 282 D CA -0.085 54.077 54.000 0.270 0.000 0.907 282 D CB 0.467 41.443 40.800 0.294 0.000 1.107 282 D HN 0.464 8.834 8.370 -0.000 0.000 0.495 283 M N 4.142 123.865 119.600 0.204 0.000 2.086 283 M HA -0.166 4.318 4.480 0.006 0.000 0.261 283 M C 1.020 177.398 176.300 0.130 0.000 1.067 283 M CA 1.617 57.022 55.300 0.176 0.000 1.116 283 M CB -0.162 32.515 32.600 0.128 0.000 1.348 283 M HN 0.262 8.552 8.290 -0.000 0.000 0.407 284 D N -0.628 119.850 120.400 0.129 0.000 2.092 284 D HA -0.246 4.398 4.640 0.006 0.000 0.193 284 D C 1.852 178.244 176.300 0.153 0.000 0.994 284 D CA 1.605 55.666 54.000 0.102 0.000 0.828 284 D CB -0.885 39.984 40.800 0.116 0.000 0.963 284 D HN 0.664 9.034 8.370 -0.000 0.000 0.450 285 W N 1.728 123.063 121.300 0.059 0.000 2.358 285 W HA -0.160 4.503 4.660 0.005 0.000 0.303 285 W C 2.097 178.667 176.519 0.086 0.000 1.208 285 W CA 1.637 59.040 57.345 0.097 0.000 1.274 285 W CB -0.046 29.509 29.460 0.158 0.000 1.138 285 W HN -0.025 8.155 8.180 -0.000 0.000 0.515 286 A N 0.204 123.075 122.820 0.086 0.000 1.930 286 A HA -0.143 4.180 4.320 0.006 0.000 0.217 286 A C 2.037 179.506 177.584 -0.190 0.000 1.175 286 A CA 1.962 53.861 52.037 -0.230 0.000 0.627 286 A CB -1.046 17.977 19.000 0.039 0.000 0.815 286 A HN 0.145 8.295 8.150 -0.000 0.000 0.443 287 V N -0.164 119.668 119.914 -0.137 0.000 2.379 287 V HA -0.177 3.947 4.120 0.006 0.000 0.245 287 V C 2.599 178.548 176.094 -0.242 0.000 1.044 287 V CA 2.256 64.341 62.300 -0.360 0.000 1.036 287 V CB -0.559 30.991 31.823 -0.456 0.000 0.664 287 V HN 0.647 8.837 8.190 -0.000 0.000 0.453 288 E N 0.003 120.080 120.200 -0.205 0.000 2.072 288 E HA -0.193 4.161 4.350 0.006 0.000 0.191 288 E C 2.280 178.786 176.600 -0.157 0.000 0.985 288 E CA 1.254 57.555 56.400 -0.166 0.000 0.801 288 E CB -0.232 29.367 29.700 -0.169 0.000 0.750 288 E HN 0.468 8.828 8.360 -0.000 0.000 0.452 289 Q N -0.305 119.281 119.800 -0.357 0.000 2.079 289 Q HA -0.031 4.313 4.340 0.006 0.000 0.200 289 Q C 2.115 178.038 176.000 -0.127 0.000 0.974 289 Q CA 1.498 57.123 55.803 -0.296 0.000 0.840 289 Q CB -0.497 27.958 28.738 -0.470 0.000 0.898 289 Q HN 0.376 8.646 8.270 -0.000 0.000 0.430 290 A N -0.103 122.608 122.820 -0.182 0.000 1.969 290 A HA -0.207 4.116 4.320 0.006 0.000 0.218 290 A C 1.884 179.457 177.584 -0.019 0.000 1.169 290 A CA 1.783 53.760 52.037 -0.100 0.000 0.635 290 A CB -0.647 18.429 19.000 0.127 0.000 0.810 290 A HN 0.471 8.621 8.150 -0.000 0.000 0.445 291 H N -1.551 117.514 119.070 -0.009 0.000 2.326 291 H HA -0.103 4.456 4.556 0.006 0.000 0.301 291 H C 1.703 177.175 175.328 0.239 0.000 1.081 291 H CA 2.029 58.178 56.048 0.169 0.000 1.334 291 H CB -0.410 29.418 29.762 0.111 0.000 1.385 291 H HN 0.461 8.741 8.280 -0.000 0.000 0.504 292 F N 0.859 120.843 119.950 0.057 0.000 2.095 292 F HA -0.220 4.310 4.527 0.006 0.000 0.298 292 F C 2.520 178.277 175.800 -0.072 0.000 1.104 292 F CA 1.616 59.627 58.000 0.019 0.000 1.232 292 F CB -0.618 38.367 39.000 -0.025 0.000 0.987 292 F HN 0.295 8.595 8.300 -0.000 0.000 0.475 293 A N 0.482 123.103 122.820 -0.332 0.000 1.978 293 A HA -0.181 4.143 4.320 0.006 0.000 0.220 293 A C 2.181 179.438 177.584 -0.544 0.000 1.170 293 A CA 1.827 53.429 52.037 -0.726 0.000 0.636 293 A CB -0.882 17.388 19.000 -1.217 0.000 0.810 293 A HN 0.566 8.716 8.150 -0.000 0.000 0.448 294 L N -2.405 118.551 121.223 -0.444 0.000 2.269 294 L HA 0.232 4.575 4.340 0.006 0.000 0.200 294 L C 1.891 178.454 176.870 -0.511 0.000 1.069 294 L CA 1.478 56.016 54.840 -0.504 0.000 0.804 294 L CB -0.700 40.959 42.059 -0.667 0.000 0.987 294 L HN 0.416 8.646 8.230 -0.000 0.000 0.468 295 F N -0.718 119.054 119.950 -0.297 0.000 2.743 295 F HA -0.004 4.526 4.527 0.006 0.000 0.297 295 F C 1.078 176.764 175.800 -0.190 0.000 1.131 295 F CA -0.291 57.543 58.000 -0.276 0.000 1.426 295 F CB -0.182 38.552 39.000 -0.443 0.000 1.116 295 F HN -0.087 8.213 8.300 -0.000 0.000 0.583 296 F N 2.106 121.938 119.950 -0.195 0.000 2.629 296 F HA -0.054 4.477 4.527 0.006 0.000 0.377 296 F C 1.230 176.942 175.800 -0.146 0.000 1.101 296 F CA 0.018 57.906 58.000 -0.186 0.000 1.301 296 F CB 0.129 38.857 39.000 -0.454 0.000 1.062 296 F HN 0.091 8.391 8.300 -0.000 0.000 0.583 297 N N 3.302 121.419 118.700 -0.972 0.000 2.740 297 N HA -0.298 4.446 4.740 0.006 0.000 0.248 297 N C -0.026 175.236 175.510 -0.413 0.000 1.062 297 N CA 1.379 53.970 53.050 -0.765 0.000 0.704 297 N CB -1.074 36.942 38.487 -0.785 0.000 0.968 297 N HN 0.758 9.138 8.380 -0.000 0.000 0.547 298 Q N -2.296 117.347 119.800 -0.261 0.000 2.480 298 Q HA -0.173 4.171 4.340 0.006 0.000 0.265 298 Q C 1.149 177.061 176.000 -0.148 0.000 1.072 298 Q CA 2.165 57.888 55.803 -0.134 0.000 1.018 298 Q CB -1.838 26.822 28.738 -0.131 0.000 1.433 298 Q HN 1.149 9.419 8.270 -0.000 0.000 0.513 299 G N -1.030 107.652 108.800 -0.196 0.000 2.168 299 G HA2 -0.390 3.573 3.960 0.006 0.000 0.263 299 G HA3 -0.390 3.573 3.960 0.006 0.000 0.263 299 G C 0.127 174.745 174.900 -0.470 0.000 0.977 299 G CA 0.429 45.371 45.100 -0.264 0.000 0.659 299 G HN 0.463 8.753 8.290 -0.000 0.000 0.533 300 Q N -0.047 119.409 119.800 -0.574 0.000 3.207 300 Q HA 0.465 4.809 4.340 0.006 0.000 0.335 300 Q C -0.193 175.222 176.000 -0.975 0.000 1.374 300 Q CA -0.098 55.031 55.803 -1.123 0.000 1.023 300 Q CB 0.290 28.705 28.738 -0.539 0.000 1.576 300 Q HN 0.426 8.696 8.270 -0.000 0.000 0.515 301 C N 0.177 119.060 119.300 -0.694 0.000 2.431 301 C HA 0.192 4.656 4.460 0.006 0.000 0.321 301 C C 1.667 176.746 174.990 0.149 0.000 1.202 301 C CA -0.667 58.311 59.018 -0.067 0.000 1.398 301 C CB 1.586 29.410 27.740 0.140 0.000 2.047 301 C HN 0.732 8.962 8.230 -0.000 0.000 0.465 302 S N 0.118 116.060 115.700 0.403 0.000 2.474 302 S HA -0.138 4.335 4.470 0.006 0.000 0.235 302 S C 1.199 175.959 174.600 0.266 0.000 0.997 302 S CA 1.381 59.803 58.200 0.371 0.000 0.949 302 S CB -0.526 62.824 63.200 0.250 0.000 0.766 302 S HN 0.997 9.307 8.310 -0.000 0.000 0.517 303 C N 0.963 120.479 119.300 0.360 0.000 2.855 303 C HA 0.801 5.264 4.460 0.006 0.000 0.279 303 C C 1.219 176.469 174.990 0.433 0.000 1.270 303 C CA -1.254 58.027 59.018 0.438 0.000 1.702 303 C CB -1.924 26.233 27.740 0.696 0.000 1.949 303 C HN 0.605 8.835 8.230 -0.000 0.000 0.618 304 A N 1.296 124.266 122.820 0.251 0.000 2.587 304 A HA 0.421 4.745 4.320 0.006 0.000 0.233 304 A C 1.127 178.783 177.584 0.120 0.000 1.049 304 A CA 0.883 52.988 52.037 0.114 0.000 0.754 304 A CB -0.181 18.789 19.000 -0.049 0.000 0.977 304 A HN 1.171 9.321 8.150 -0.000 0.000 0.509 305 G N 1.475 110.220 108.800 -0.092 0.000 2.916 305 G HA2 0.342 4.305 3.960 0.006 0.000 0.280 305 G HA3 0.342 4.305 3.960 0.006 0.000 0.280 305 G C 0.879 175.713 174.900 -0.109 0.000 0.758 305 G CA 0.391 45.423 45.100 -0.112 0.000 1.993 305 G HN 1.234 9.524 8.290 -0.000 0.000 0.564 306 S N 0.913 116.595 115.700 -0.030 0.000 2.605 306 S HA 0.204 4.677 4.470 0.006 0.000 0.217 306 S C 0.901 175.468 174.600 -0.055 0.000 0.958 306 S CA -0.387 57.770 58.200 -0.072 0.000 0.919 306 S CB 0.399 63.567 63.200 -0.054 0.000 0.780 306 S HN 0.421 8.731 8.310 -0.000 0.000 0.507 307 R N 1.701 122.188 120.500 -0.022 0.000 2.472 307 R HA 0.291 4.634 4.340 0.006 0.000 0.294 307 R C -1.274 174.965 176.300 -0.102 0.000 1.243 307 R CA -0.132 55.908 56.100 -0.100 0.000 1.023 307 R CB 1.391 31.685 30.300 -0.010 0.000 1.157 307 R HN 0.147 8.417 8.270 -0.000 0.000 0.530 308 T N 3.747 118.213 114.554 -0.147 0.000 2.794 308 T HA 0.274 4.628 4.350 0.006 0.000 0.304 308 T C -0.129 174.501 174.700 -0.115 0.000 0.973 308 T CA -0.093 61.968 62.100 -0.065 0.000 0.972 308 T CB -0.096 68.761 68.868 -0.018 0.000 0.952 308 T HN 0.177 8.417 8.240 -0.000 0.000 0.509 309 F N 2.600 122.589 119.950 0.065 0.000 2.424 309 F HA 0.443 4.973 4.527 0.005 0.000 0.356 309 F C 0.308 176.276 175.800 0.281 0.000 1.110 309 F CA -0.709 57.400 58.000 0.182 0.000 1.161 309 F CB 0.930 39.949 39.000 0.030 0.000 1.115 309 F HN 0.194 8.494 8.300 -0.000 0.000 0.507 310 V N 3.976 124.163 119.914 0.456 0.000 2.483 310 V HA 0.235 4.359 4.120 0.006 0.000 0.297 310 V C -0.141 175.908 176.094 -0.075 0.000 1.027 310 V CA -1.155 61.221 62.300 0.125 0.000 0.855 310 V CB 1.422 33.138 31.823 -0.179 0.000 0.995 310 V HN 0.668 8.858 8.190 -0.000 0.000 0.424 311 Q N 2.616 122.149 119.800 -0.447 0.000 2.286 311 Q HA -0.007 4.337 4.340 0.006 0.000 0.290 311 Q C 1.438 177.231 176.000 -0.344 0.000 1.049 311 Q CA 0.407 55.667 55.803 -0.906 0.000 0.923 311 Q CB 0.840 29.203 28.738 -0.624 0.000 1.183 311 Q HN 0.953 9.223 8.270 -0.000 0.000 0.383 312 E N 2.628 122.630 120.200 -0.330 0.000 2.187 312 E HA -0.312 4.042 4.350 0.006 0.000 0.199 312 E C 0.353 176.937 176.600 -0.026 0.000 1.004 312 E CA 1.764 58.084 56.400 -0.135 0.000 0.813 312 E CB 0.005 29.618 29.700 -0.146 0.000 0.736 312 E HN 0.632 8.992 8.360 -0.000 0.000 0.468 313 D N 1.090 121.461 120.400 -0.048 0.000 2.178 313 D HA -0.105 4.539 4.640 0.006 0.000 0.201 313 D C 2.046 178.372 176.300 0.043 0.000 0.980 313 D CA 1.485 55.485 54.000 0.000 0.000 0.842 313 D CB -0.072 40.723 40.800 -0.009 0.000 0.948 313 D HN 0.628 8.998 8.370 -0.000 0.000 0.472 314 I N -3.257 117.344 120.570 0.051 0.000 4.082 314 I HA 0.167 4.340 4.170 0.006 0.000 0.337 314 I C 1.871 178.072 176.117 0.141 0.000 1.352 314 I CA -0.500 60.855 61.300 0.092 0.000 1.097 314 I CB -0.138 37.916 38.000 0.090 0.000 1.048 314 I HN -0.226 7.984 8.210 -0.000 0.000 0.393 315 Y N 2.746 123.055 120.300 0.014 0.000 2.097 315 Y HA -0.298 4.255 4.550 0.005 0.000 0.282 315 Y C 2.121 178.083 175.900 0.103 0.000 1.152 315 Y CA 2.243 60.368 58.100 0.042 0.000 1.136 315 Y CB -0.089 38.370 38.460 -0.003 0.000 0.975 315 Y HN 0.192 8.472 8.280 -0.000 0.000 0.498 316 D N 0.029 120.546 120.400 0.195 0.000 2.123 316 D HA -0.224 4.419 4.640 0.006 0.000 0.196 316 D C 2.071 178.382 176.300 0.018 0.000 0.992 316 D CA 1.810 55.869 54.000 0.099 0.000 0.833 316 D CB -0.388 40.490 40.800 0.130 0.000 0.954 316 D HN 0.635 9.005 8.370 -0.000 0.000 0.455 317 E N -0.675 119.554 120.200 0.049 0.000 2.107 317 E HA -0.146 4.208 4.350 0.006 0.000 0.191 317 E C 2.059 178.666 176.600 0.013 0.000 0.982 317 E CA 0.280 56.697 56.400 0.028 0.000 0.809 317 E CB -0.172 29.557 29.700 0.047 0.000 0.756 317 E HN 0.202 8.562 8.360 -0.000 0.000 0.459 318 F N 0.798 120.690 119.950 -0.098 0.000 2.102 318 F HA -0.209 4.321 4.527 0.005 0.000 0.298 318 F C 2.075 177.777 175.800 -0.162 0.000 1.105 318 F CA 1.313 59.243 58.000 -0.117 0.000 1.239 318 F CB -0.191 38.740 39.000 -0.114 0.000 0.991 318 F HN -0.119 8.181 8.300 -0.000 0.000 0.474 319 V N 0.452 120.343 119.914 -0.038 0.000 2.287 319 V HA -0.334 3.790 4.120 0.006 0.000 0.248 319 V C 2.360 178.376 176.094 -0.131 0.000 1.053 319 V CA 2.332 64.549 62.300 -0.138 0.000 1.027 319 V CB -0.761 30.886 31.823 -0.295 0.000 0.646 319 V HN 0.445 8.635 8.190 -0.000 0.000 0.447 320 E N 0.049 120.184 120.200 -0.108 0.000 2.058 320 E HA -0.261 4.092 4.350 0.006 0.000 0.194 320 E C 2.448 178.972 176.600 -0.126 0.000 0.997 320 E CA 1.507 57.854 56.400 -0.089 0.000 0.801 320 E CB -0.046 29.620 29.700 -0.057 0.000 0.746 320 E HN 0.529 8.889 8.360 -0.000 0.000 0.450 321 R N -0.059 120.334 120.500 -0.179 0.000 2.075 321 R HA -0.038 4.305 4.340 0.006 0.000 0.232 321 R C 2.673 178.812 176.300 -0.269 0.000 1.126 321 R CA 1.391 57.356 56.100 -0.225 0.000 0.963 321 R CB -0.148 29.987 30.300 -0.275 0.000 0.858 321 R HN 0.062 8.332 8.270 -0.000 0.000 0.435 322 S N 0.399 115.893 115.700 -0.344 0.000 2.353 322 S HA -0.134 4.340 4.470 0.006 0.000 0.222 322 S C 2.117 176.652 174.600 -0.107 0.000 1.035 322 S CA 1.453 59.501 58.200 -0.253 0.000 1.025 322 S CB -0.265 62.798 63.200 -0.228 0.000 0.902 322 S HN 0.069 8.379 8.310 -0.000 0.000 0.440 323 V N 2.105 121.963 119.914 -0.094 0.000 2.332 323 V HA -0.240 3.884 4.120 0.006 0.000 0.248 323 V C 2.646 178.688 176.094 -0.087 0.000 1.055 323 V CA 1.748 64.010 62.300 -0.063 0.000 1.038 323 V CB -1.277 30.511 31.823 -0.058 0.000 0.651 323 V HN 0.555 8.745 8.190 -0.000 0.000 0.450 324 A N 0.258 123.011 122.820 -0.112 0.000 1.902 324 A HA -0.262 4.062 4.320 0.006 0.000 0.217 324 A C 2.312 179.802 177.584 -0.157 0.000 1.181 324 A CA 2.192 54.158 52.037 -0.119 0.000 0.623 324 A CB -0.517 18.413 19.000 -0.117 0.000 0.818 324 A HN 0.468 8.618 8.150 -0.000 0.000 0.443 325 R N 0.136 120.510 120.500 -0.210 0.000 2.075 325 R HA 0.039 4.383 4.340 0.006 0.000 0.232 325 R C 2.141 178.227 176.300 -0.355 0.000 1.126 325 R CA 1.834 57.728 56.100 -0.343 0.000 0.963 325 R CB -0.894 29.120 30.300 -0.477 0.000 0.858 325 R HN 0.376 8.646 8.270 -0.000 0.000 0.435 326 A N 0.792 123.503 122.820 -0.180 0.000 1.877 326 A HA -0.167 4.157 4.320 0.006 0.000 0.216 326 A C 2.019 179.506 177.584 -0.162 0.000 1.186 326 A CA 1.764 53.719 52.037 -0.135 0.000 0.620 326 A CB -0.456 18.541 19.000 -0.005 0.000 0.822 326 A HN 0.377 8.527 8.150 -0.000 0.000 0.443 327 K N 0.188 120.514 120.400 -0.123 0.000 2.211 327 K HA -0.094 4.230 4.320 0.006 0.000 0.203 327 K C 2.068 178.603 176.600 -0.108 0.000 1.050 327 K CA 1.451 57.677 56.287 -0.102 0.000 0.945 327 K CB -0.116 32.334 32.500 -0.082 0.000 0.732 327 K HN 0.683 8.933 8.250 -0.000 0.000 0.451 328 S N 0.383 116.003 115.700 -0.132 0.000 2.548 328 S HA -0.001 4.473 4.470 0.006 0.000 0.215 328 S C 0.814 175.344 174.600 -0.117 0.000 0.976 328 S CA -0.340 57.789 58.200 -0.118 0.000 0.908 328 S CB -0.047 63.078 63.200 -0.124 0.000 0.781 328 S HN 0.149 8.459 8.310 -0.000 0.000 0.519 329 R N 2.076 122.491 120.500 -0.142 0.000 2.446 329 R HA 0.196 4.540 4.340 0.006 0.000 0.314 329 R C -0.989 175.262 176.300 -0.081 0.000 1.003 329 R CA -0.095 55.938 56.100 -0.111 0.000 1.018 329 R CB 0.155 30.361 30.300 -0.156 0.000 0.945 329 R HN 0.159 8.429 8.270 -0.000 0.000 0.419 330 V N 6.495 126.380 119.914 -0.050 0.000 2.427 330 V HA 0.113 4.236 4.120 0.006 0.000 0.268 330 V C 0.170 176.253 176.094 -0.019 0.000 1.046 330 V CA -0.368 61.910 62.300 -0.038 0.000 0.970 330 V CB 1.148 32.954 31.823 -0.028 0.000 1.001 330 V HN 0.480 8.670 8.190 -0.000 0.000 0.476 331 V N 4.845 124.746 119.914 -0.022 0.000 2.472 331 V HA 1.002 5.125 4.120 0.006 0.000 0.290 331 V C 0.718 176.777 176.094 -0.058 0.000 1.037 331 V CA 0.575 62.885 62.300 0.017 0.000 0.908 331 V CB 0.908 32.756 31.823 0.042 0.000 0.985 331 V HN 1.154 9.344 8.190 -0.000 0.000 0.454 332 G N 3.289 112.072 108.800 -0.029 0.000 2.360 332 G HA2 0.100 4.064 3.960 0.006 0.000 0.276 332 G HA3 0.100 4.064 3.960 0.006 0.000 0.276 332 G C -0.935 173.965 174.900 0.000 0.000 1.256 332 G CA -0.795 44.190 45.100 -0.191 0.000 0.890 332 G HN 0.659 8.949 8.290 -0.000 0.000 0.486 333 N N 2.149 120.832 118.700 -0.029 0.000 2.414 333 N HA 0.163 4.906 4.740 0.006 0.000 0.268 333 N C -0.694 174.873 175.510 0.095 0.000 1.286 333 N CA -1.074 52.026 53.050 0.084 0.000 0.896 333 N CB 1.304 39.830 38.487 0.065 0.000 1.093 333 N HN 0.141 8.521 8.380 -0.000 0.000 0.480 334 P HA -0.111 4.309 4.420 -0.000 0.000 0.228 334 P C 0.696 177.917 177.300 -0.130 0.000 1.151 334 P CA 1.121 64.183 63.100 -0.063 0.000 0.770 334 P CB -0.040 31.551 31.700 -0.182 0.000 0.786 335 F N -0.356 119.621 119.950 0.045 0.000 2.743 335 F HA 0.102 4.633 4.527 0.006 0.000 0.297 335 F C 1.202 177.004 175.800 0.002 0.000 1.131 335 F CA -0.069 57.933 58.000 0.003 0.000 1.426 335 F CB -0.105 38.848 39.000 -0.079 0.000 1.116 335 F HN -0.168 8.132 8.300 -0.000 0.000 0.583 336 D N 0.158 120.651 120.400 0.155 0.000 2.317 336 D HA 0.002 4.646 4.640 0.006 0.000 0.252 336 D C 1.312 177.662 176.300 0.083 0.000 1.174 336 D CA 0.183 54.238 54.000 0.091 0.000 0.866 336 D CB 1.334 42.165 40.800 0.051 0.000 1.127 336 D HN 0.116 8.486 8.370 -0.000 0.000 0.467 337 S N 3.605 119.354 115.700 0.082 0.000 2.440 337 S HA -0.167 4.307 4.470 0.006 0.000 0.238 337 S C 1.372 176.003 174.600 0.052 0.000 1.010 337 S CA 0.841 59.089 58.200 0.080 0.000 0.972 337 S CB -0.024 63.217 63.200 0.068 0.000 0.774 337 S HN 0.485 8.795 8.310 -0.000 0.000 0.501 338 K N 0.891 121.313 120.400 0.036 0.000 2.426 338 K HA 0.119 4.443 4.320 0.006 0.000 0.193 338 K C -0.056 176.555 176.600 0.017 0.000 1.028 338 K CA 0.252 56.551 56.287 0.020 0.000 1.047 338 K CB 0.026 32.529 32.500 0.006 0.000 0.821 338 K HN 0.317 8.567 8.250 -0.000 0.000 0.513 339 T N 1.527 116.097 114.554 0.027 0.000 2.814 339 T HA 0.076 4.430 4.350 0.006 0.000 0.297 339 T C 0.855 175.571 174.700 0.027 0.000 0.956 339 T CA 0.108 62.222 62.100 0.024 0.000 1.123 339 T CB 1.284 70.172 68.868 0.034 0.000 0.902 339 T HN 0.168 8.408 8.240 -0.000 0.000 0.528 340 E N 1.797 122.011 120.200 0.023 0.000 2.251 340 E HA 0.050 4.404 4.350 0.006 0.000 0.194 340 E C 0.765 177.373 176.600 0.014 0.000 0.964 340 E CA 0.194 56.613 56.400 0.031 0.000 0.868 340 E CB 0.580 30.303 29.700 0.038 0.000 0.828 340 E HN 0.535 8.896 8.360 -0.000 0.000 0.481 341 Q N 0.440 120.252 119.800 0.020 0.000 2.292 341 Q HA 0.411 4.755 4.340 0.006 0.000 0.270 341 Q C -0.505 175.553 176.000 0.098 0.000 1.024 341 Q CA -0.605 55.212 55.803 0.024 0.000 0.768 341 Q CB 1.731 30.485 28.738 0.027 0.000 1.250 341 Q HN 0.129 8.399 8.270 -0.000 0.000 0.447 342 G N 3.283 112.109 108.800 0.043 0.000 2.531 342 G HA2 0.586 4.550 3.960 0.006 0.000 0.253 342 G HA3 0.586 4.550 3.960 0.006 0.000 0.253 342 G C -2.594 172.231 174.900 -0.126 0.000 1.439 342 G CA -0.992 44.158 45.100 0.084 0.000 1.056 342 G HN 0.534 8.824 8.290 -0.000 0.000 0.555 343 P HA 0.257 4.677 4.420 -0.000 0.000 0.280 343 P C -0.599 176.518 177.300 -0.304 0.000 1.272 343 P CA -0.641 61.956 63.100 -0.838 0.000 0.819 343 P CB 0.775 31.821 31.700 -1.089 0.000 1.122 344 Q N -0.030 119.687 119.800 -0.138 0.000 2.535 344 Q HA 0.053 4.396 4.340 0.006 0.000 0.228 344 Q C 1.265 177.169 176.000 -0.161 0.000 1.062 344 Q CA -0.286 55.472 55.803 -0.076 0.000 0.967 344 Q CB 0.000 28.762 28.738 0.040 0.000 1.273 344 Q HN 0.179 8.449 8.270 -0.000 0.000 0.554 345 V N 0.186 119.923 119.914 -0.295 0.000 2.515 345 V HA -0.169 3.955 4.120 0.006 0.000 0.250 345 V C 0.224 176.051 176.094 -0.444 0.000 1.058 345 V CA 2.480 64.520 62.300 -0.433 0.000 1.064 345 V CB -0.095 31.189 31.823 -0.899 0.000 0.675 345 V HN 0.968 9.158 8.190 -0.000 0.000 0.461 346 D N -3.479 116.574 120.400 -0.579 0.000 2.768 346 D HA 0.101 4.744 4.640 0.006 0.000 0.327 346 D C 0.728 176.353 176.300 -1.124 0.000 1.302 346 D CA -0.269 53.256 54.000 -0.792 0.000 0.897 346 D CB 0.431 40.911 40.800 -0.534 0.000 1.420 346 D HN -0.105 8.265 8.370 -0.000 0.000 0.494 347 E N -0.551 118.972 120.200 -1.129 0.000 2.106 347 E HA -0.129 4.225 4.350 0.006 0.000 0.192 347 E C 1.296 177.756 176.600 -0.234 0.000 0.984 347 E CA 1.553 57.527 56.400 -0.710 0.000 0.806 347 E CB -0.052 29.461 29.700 -0.311 0.000 0.750 347 E HN 0.545 8.905 8.360 -0.000 0.000 0.458 348 T N 1.435 115.862 114.554 -0.210 0.000 2.684 348 T HA -0.170 4.184 4.350 0.006 0.000 0.267 348 T C 1.821 176.497 174.700 -0.040 0.000 1.036 348 T CA 1.245 63.293 62.100 -0.088 0.000 1.148 348 T CB -0.115 68.706 68.868 -0.079 0.000 0.863 348 T HN 0.153 8.393 8.240 -0.000 0.000 0.436 349 Q N 0.048 119.795 119.800 -0.088 0.000 2.079 349 Q HA -0.011 4.333 4.340 0.006 0.000 0.200 349 Q C 2.085 178.126 176.000 0.068 0.000 0.974 349 Q CA 1.097 56.906 55.803 0.010 0.000 0.840 349 Q CB -0.776 27.936 28.738 -0.044 0.000 0.898 349 Q HN 0.550 8.820 8.270 -0.000 0.000 0.430 350 F N 2.100 121.974 119.950 -0.126 0.000 2.063 350 F HA -0.294 4.237 4.527 0.006 0.000 0.298 350 F C 2.073 177.881 175.800 0.013 0.000 1.109 350 F CA 1.870 59.846 58.000 -0.041 0.000 1.212 350 F CB 0.011 38.979 39.000 -0.054 0.000 0.973 350 F HN -0.003 8.297 8.300 -0.000 0.000 0.480 351 K N -0.131 120.341 120.400 0.120 0.000 2.097 351 K HA -0.191 4.133 4.320 0.006 0.000 0.205 351 K C 2.188 178.772 176.600 -0.027 0.000 1.050 351 K CA 1.395 57.700 56.287 0.030 0.000 0.938 351 K CB -0.249 32.300 32.500 0.081 0.000 0.718 351 K HN 0.243 8.493 8.250 -0.000 0.000 0.442 352 K N 1.193 121.599 120.400 0.010 0.000 2.057 352 K HA -0.106 4.218 4.320 0.006 0.000 0.207 352 K C 1.963 178.610 176.600 0.077 0.000 1.049 352 K CA 1.200 57.500 56.287 0.021 0.000 0.931 352 K CB -0.016 32.546 32.500 0.104 0.000 0.714 352 K HN 0.043 8.293 8.250 -0.000 0.000 0.440 353 I N 1.050 121.676 120.570 0.094 0.000 2.394 353 I HA -0.257 3.917 4.170 0.006 0.000 0.251 353 I C 1.983 178.126 176.117 0.044 0.000 1.136 353 I CA 0.831 62.208 61.300 0.129 0.000 1.425 353 I CB -0.099 37.939 38.000 0.063 0.000 1.079 353 I HN 0.146 8.356 8.210 -0.000 0.000 0.425 354 L N 0.312 121.477 121.223 -0.098 0.000 2.093 354 L HA -0.112 4.232 4.340 0.006 0.000 0.208 354 L C 2.680 179.534 176.870 -0.027 0.000 1.085 354 L CA 1.450 56.228 54.840 -0.103 0.000 0.755 354 L CB -1.187 40.754 42.059 -0.196 0.000 0.904 354 L HN 0.332 8.562 8.230 -0.000 0.000 0.435 355 G N -0.951 107.817 108.800 -0.053 0.000 2.418 355 G HA2 -0.280 3.684 3.960 0.006 0.000 0.217 355 G HA3 -0.280 3.684 3.960 0.006 0.000 0.217 355 G C 1.405 176.255 174.900 -0.084 0.000 1.158 355 G CA 0.547 45.587 45.100 -0.100 0.000 0.771 355 G HN 0.301 8.591 8.290 -0.000 0.000 0.545 356 Y N 0.352 120.659 120.300 0.012 0.000 2.293 356 Y HA 0.057 4.611 4.550 0.006 0.000 0.291 356 Y C 2.740 178.658 175.900 0.031 0.000 1.137 356 Y CA 0.389 58.496 58.100 0.012 0.000 1.202 356 Y CB 0.008 38.484 38.460 0.026 0.000 0.990 356 Y HN 0.117 8.397 8.280 -0.000 0.000 0.537 357 I N 0.047 120.759 120.570 0.236 0.000 2.226 357 I HA -0.347 3.827 4.170 0.006 0.000 0.245 357 I C 2.423 178.686 176.117 0.244 0.000 1.100 357 I CA 1.478 62.957 61.300 0.298 0.000 1.374 357 I CB -0.425 37.703 38.000 0.213 0.000 1.057 357 I HN 0.368 8.578 8.210 -0.000 0.000 0.413 358 N N 0.325 119.099 118.700 0.124 0.000 2.188 358 N HA -0.158 4.586 4.740 0.006 0.000 0.184 358 N C 1.715 177.258 175.510 0.054 0.000 1.018 358 N CA 1.767 54.867 53.050 0.084 0.000 0.858 358 N CB 0.127 38.635 38.487 0.036 0.000 0.989 358 N HN 0.268 8.648 8.380 -0.000 0.000 0.426 359 T N -0.199 114.372 114.554 0.029 0.000 2.684 359 T HA -0.101 4.253 4.350 0.006 0.000 0.267 359 T C 1.795 176.463 174.700 -0.053 0.000 1.036 359 T CA 1.448 63.547 62.100 -0.002 0.000 1.148 359 T CB -0.804 68.077 68.868 0.021 0.000 0.863 359 T HN 0.438 8.678 8.240 -0.000 0.000 0.436 360 G N 1.677 110.384 108.800 -0.153 0.000 2.418 360 G HA2 -0.209 3.755 3.960 0.006 0.000 0.217 360 G HA3 -0.209 3.755 3.960 0.006 0.000 0.217 360 G C 1.606 176.374 174.900 -0.218 0.000 1.158 360 G CA 0.630 45.446 45.100 -0.473 0.000 0.771 360 G HN 0.431 8.721 8.290 -0.000 0.000 0.545 361 K N -0.340 120.092 120.400 0.053 0.000 2.097 361 K HA -0.087 4.237 4.320 0.006 0.000 0.206 361 K C 2.573 179.215 176.600 0.070 0.000 1.049 361 K CA 1.255 57.642 56.287 0.166 0.000 0.933 361 K CB -0.085 32.536 32.500 0.201 0.000 0.717 361 K HN 0.218 8.468 8.250 -0.000 0.000 0.442 362 Q N 1.060 120.880 119.800 0.033 0.000 2.230 362 Q HA -0.078 4.266 4.340 0.006 0.000 0.202 362 Q C 1.171 177.175 176.000 0.007 0.000 0.963 362 Q CA 1.224 57.039 55.803 0.020 0.000 0.866 362 Q CB 0.309 29.054 28.738 0.012 0.000 0.931 362 Q HN 0.305 8.575 8.270 -0.000 0.000 0.452 363 E N -1.755 118.436 120.200 -0.014 0.000 2.371 363 E HA 0.092 4.445 4.350 0.006 0.000 0.194 363 E C 0.593 177.190 176.600 -0.006 0.000 1.012 363 E CA 0.507 56.896 56.400 -0.019 0.000 0.860 363 E CB 0.316 29.988 29.700 -0.047 0.000 0.811 363 E HN 0.431 8.791 8.360 -0.000 0.000 0.502 364 G N 1.077 109.883 108.800 0.010 0.000 2.138 364 G HA2 -0.215 3.749 3.960 0.006 0.000 0.193 364 G HA3 -0.215 3.749 3.960 0.006 0.000 0.193 364 G C 0.222 175.152 174.900 0.051 0.000 0.998 364 G CA -0.125 44.995 45.100 0.035 0.000 0.668 364 G HN 0.427 8.717 8.290 -0.000 0.000 0.516 365 A N 0.218 123.060 122.820 0.037 0.000 2.425 365 A HA 0.621 4.944 4.320 0.006 0.000 0.249 365 A C 0.631 178.379 177.584 0.273 0.000 1.084 365 A CA 0.140 52.237 52.037 0.099 0.000 0.781 365 A CB 0.350 19.297 19.000 -0.089 0.000 1.019 365 A HN 0.382 8.532 8.150 -0.000 0.000 0.490 366 K N 1.975 122.535 120.400 0.266 0.000 2.273 366 K HA 0.220 4.544 4.320 0.006 0.000 0.287 366 K C -0.694 176.028 176.600 0.202 0.000 1.089 366 K CA -0.377 56.037 56.287 0.212 0.000 0.909 366 K CB 0.604 33.191 32.500 0.143 0.000 1.123 366 K HN 0.548 8.798 8.250 -0.000 0.000 0.473 367 L N 5.001 126.298 121.223 0.124 0.000 2.500 367 L HA -0.003 4.341 4.340 0.006 0.000 0.272 367 L C 0.389 177.194 176.870 -0.108 0.000 1.149 367 L CA 0.634 55.374 54.840 -0.167 0.000 0.897 367 L CB 0.159 42.121 42.059 -0.161 0.000 1.178 367 L HN 0.698 8.928 8.230 -0.000 0.000 0.473 368 L N 4.933 126.071 121.223 -0.141 0.000 2.515 368 L HA 0.226 4.570 4.340 0.006 0.000 0.223 368 L C 0.431 177.252 176.870 -0.081 0.000 1.079 368 L CA 0.191 54.989 54.840 -0.071 0.000 0.857 368 L CB -0.037 41.999 42.059 -0.038 0.000 1.050 368 L HN 0.851 9.081 8.230 -0.000 0.000 0.476 369 C N -3.422 115.805 119.300 -0.122 0.000 3.231 369 C HA 0.715 5.178 4.460 0.006 0.000 0.343 369 C C 0.793 175.716 174.990 -0.110 0.000 1.349 369 C CA -0.604 58.360 59.018 -0.091 0.000 1.209 369 C CB 0.777 28.479 27.740 -0.063 0.000 1.475 369 C HN 0.593 8.823 8.230 -0.000 0.000 0.460 370 G N 0.738 109.495 108.800 -0.072 0.000 2.582 370 G HA2 0.330 4.294 3.960 0.006 0.000 0.288 370 G HA3 0.330 4.294 3.960 0.006 0.000 0.288 370 G C 1.332 176.190 174.900 -0.071 0.000 1.247 370 G CA 2.481 47.548 45.100 -0.055 0.000 0.972 370 G HN 3.352 11.642 8.290 -0.000 0.000 0.557 371 G N -2.603 106.163 108.800 -0.058 0.000 2.211 371 G HA2 0.424 4.388 3.960 0.006 0.000 0.201 371 G HA3 0.424 4.388 3.960 0.006 0.000 0.201 371 G C 1.332 176.228 174.900 -0.006 0.000 0.997 371 G CA 0.972 46.041 45.100 -0.052 0.000 0.652 371 G HN 2.458 10.748 8.290 -0.000 0.000 0.500 372 G N -0.826 107.975 108.800 0.001 0.000 3.222 372 G HA2 0.676 4.639 3.960 0.006 0.000 0.263 372 G HA3 0.676 4.639 3.960 0.006 0.000 0.263 372 G C -0.607 174.313 174.900 0.033 0.000 1.312 372 G CA -0.890 44.218 45.100 0.013 0.000 0.934 372 G HN 0.539 8.829 8.290 -0.000 0.000 0.577 373 I N 1.494 122.107 120.570 0.071 0.000 2.371 373 I HA 0.321 4.495 4.170 0.006 0.000 0.290 373 I C 1.327 177.536 176.117 0.153 0.000 1.028 373 I CA -0.387 61.013 61.300 0.166 0.000 1.345 373 I CB 1.933 40.088 38.000 0.259 0.000 1.407 373 I HN 0.542 8.752 8.210 -0.000 0.000 0.501 374 A N 5.287 128.225 122.820 0.196 0.000 2.178 374 A HA 0.610 4.934 4.320 0.006 0.000 0.211 374 A C 0.872 178.488 177.584 0.053 0.000 1.157 374 A CA 0.792 52.900 52.037 0.117 0.000 0.780 374 A CB 0.063 19.145 19.000 0.137 0.000 0.828 374 A HN 0.779 8.929 8.150 -0.000 0.000 0.476 375 A N -1.323 121.560 122.820 0.105 0.000 2.581 375 A HA 0.536 4.859 4.320 0.006 0.000 0.290 375 A C 0.214 177.823 177.584 0.042 0.000 1.119 375 A CA 0.279 52.312 52.037 -0.007 0.000 0.670 375 A CB 0.193 19.057 19.000 -0.226 0.000 1.280 375 A HN -0.019 8.131 8.150 -0.000 0.000 0.425 376 D N -0.010 120.378 120.400 -0.020 0.000 2.154 376 D HA 0.019 4.663 4.640 0.006 0.000 0.211 376 D C 0.436 176.706 176.300 -0.050 0.000 0.977 376 D CA 1.016 55.003 54.000 -0.021 0.000 0.869 376 D CB 0.098 40.877 40.800 -0.036 0.000 1.022 376 D HN 0.400 8.770 8.370 -0.000 0.000 0.461 377 R N 0.124 120.587 120.500 -0.061 0.000 2.560 377 R HA 0.521 4.865 4.340 0.006 0.000 0.270 377 R C 1.135 177.398 176.300 -0.062 0.000 1.074 377 R CA 0.380 56.424 56.100 -0.093 0.000 1.140 377 R CB -0.067 30.191 30.300 -0.071 0.000 1.073 377 R HN 0.396 8.666 8.270 -0.000 0.000 0.527 378 G N 0.780 109.395 108.800 -0.309 0.000 2.642 378 G HA2 -0.297 3.667 3.960 0.006 0.000 0.231 378 G HA3 -0.297 3.667 3.960 0.006 0.000 0.231 378 G C -1.027 173.312 174.900 -0.935 0.000 1.338 378 G CA -0.212 44.547 45.100 -0.568 0.000 0.883 378 G HN 0.593 8.883 8.290 -0.000 0.000 0.570 379 Y N -0.473 119.565 120.300 -0.436 0.000 2.495 379 Y HA 0.578 5.131 4.550 0.006 0.000 0.362 379 Y C 0.174 175.993 175.900 -0.136 0.000 0.956 379 Y CA -0.767 57.004 58.100 -0.548 0.000 1.127 379 Y CB 0.344 38.529 38.460 -0.459 0.000 1.173 379 Y HN 0.376 8.656 8.280 -0.000 0.000 0.639 380 F N 2.016 122.094 119.950 0.214 0.000 2.404 380 F HA 0.548 5.078 4.527 0.006 0.000 0.345 380 F C 0.197 176.193 175.800 0.327 0.000 1.110 380 F CA -0.880 57.254 58.000 0.224 0.000 1.130 380 F CB 0.852 39.903 39.000 0.085 0.000 1.129 380 F HN 0.075 8.375 8.300 -0.000 0.000 0.500 381 I N 2.768 123.551 120.570 0.354 0.000 2.465 381 I HA 0.242 4.416 4.170 0.006 0.000 0.291 381 I C -0.585 175.622 176.117 0.151 0.000 1.014 381 I CA -1.005 60.414 61.300 0.198 0.000 1.093 381 I CB 1.945 39.990 38.000 0.076 0.000 1.267 381 I HN 0.522 8.732 8.210 -0.000 0.000 0.431 382 Q N 6.292 126.153 119.800 0.102 0.000 2.337 382 Q HA 0.167 4.511 4.340 0.006 0.000 0.270 382 Q C -2.295 173.745 176.000 0.066 0.000 1.002 382 Q CA -1.618 54.222 55.803 0.063 0.000 0.888 382 Q CB -0.063 28.693 28.738 0.029 0.000 1.222 382 Q HN 0.253 8.523 8.270 -0.000 0.000 0.400 383 P HA -0.073 4.347 4.420 -0.000 0.000 0.260 383 P C -1.012 176.361 177.300 0.122 0.000 1.185 383 P CA 0.605 63.754 63.100 0.082 0.000 0.763 383 P CB 0.512 32.045 31.700 -0.278 0.000 0.776 384 T N 2.901 117.592 114.554 0.228 0.000 2.829 384 T HA 0.493 4.847 4.350 0.006 0.000 0.280 384 T C -0.472 174.256 174.700 0.047 0.000 0.999 384 T CA -0.449 61.678 62.100 0.044 0.000 0.983 384 T CB 1.128 69.985 68.868 -0.017 0.000 0.968 384 T HN -0.045 8.195 8.240 -0.000 0.000 0.446 385 V N 3.703 123.552 119.914 -0.108 0.000 2.525 385 V HA 0.505 4.629 4.120 0.006 0.000 0.299 385 V C -1.089 174.870 176.094 -0.225 0.000 1.034 385 V CA -0.906 61.357 62.300 -0.062 0.000 0.863 385 V CB 1.159 33.001 31.823 0.030 0.000 0.999 385 V HN 0.821 9.011 8.190 -0.000 0.000 0.423 386 F N 2.475 122.447 119.950 0.036 0.000 2.421 386 F HA 0.786 5.316 4.527 0.006 0.000 0.337 386 F C 0.967 176.794 175.800 0.044 0.000 1.105 386 F CA -0.167 57.855 58.000 0.036 0.000 1.049 386 F CB 1.981 40.996 39.000 0.024 0.000 1.139 386 F HN 0.586 8.886 8.300 -0.000 0.000 0.479 387 G N 0.408 109.356 108.800 0.247 0.000 2.537 387 G HA2 0.385 4.348 3.960 0.006 0.000 0.323 387 G HA3 0.385 4.348 3.960 0.006 0.000 0.323 387 G C -0.723 174.315 174.900 0.231 0.000 1.207 387 G CA -0.751 44.481 45.100 0.220 0.000 0.976 387 G HN 0.678 8.968 8.290 -0.000 0.000 0.487 388 D N -1.041 119.525 120.400 0.277 0.000 2.708 388 D HA -0.162 4.482 4.640 0.006 0.000 0.236 388 D C 0.598 176.956 176.300 0.096 0.000 1.146 388 D CA 0.668 54.762 54.000 0.157 0.000 0.662 388 D CB -1.219 39.653 40.800 0.121 0.000 1.059 388 D HN 0.205 8.575 8.370 -0.000 0.000 0.428 389 V N 0.761 120.728 119.914 0.087 0.000 2.686 389 V HA 0.067 4.191 4.120 0.006 0.000 0.295 389 V C 0.870 176.965 176.094 0.000 0.000 1.055 389 V CA 0.043 62.357 62.300 0.023 0.000 1.050 389 V CB 1.722 33.540 31.823 -0.009 0.000 0.984 389 V HN 0.058 8.248 8.190 -0.000 0.000 0.482 390 Q N 1.913 121.711 119.800 -0.004 0.000 2.301 390 Q HA 0.340 4.684 4.340 0.006 0.000 0.267 390 Q C 0.331 176.339 176.000 0.015 0.000 1.035 390 Q CA -0.778 55.033 55.803 0.013 0.000 0.856 390 Q CB 1.583 30.331 28.738 0.017 0.000 1.337 390 Q HN 0.657 8.927 8.270 -0.000 0.000 0.450 391 D N 1.126 121.555 120.400 0.048 0.000 2.182 391 D HA -0.115 4.528 4.640 0.006 0.000 0.201 391 D C 1.484 177.808 176.300 0.040 0.000 0.986 391 D CA 1.586 55.625 54.000 0.066 0.000 0.847 391 D CB -0.040 40.821 40.800 0.102 0.000 0.942 391 D HN 0.821 9.191 8.370 -0.000 0.000 0.467 392 G N -0.361 108.456 108.800 0.028 0.000 2.712 392 G HA2 0.013 3.976 3.960 0.006 0.000 0.212 392 G HA3 0.013 3.976 3.960 0.006 0.000 0.212 392 G C 0.767 175.672 174.900 0.008 0.000 1.142 392 G CA -0.200 44.911 45.100 0.019 0.000 0.789 392 G HN 0.156 8.446 8.290 -0.000 0.000 0.535 393 M N 0.265 119.864 119.600 -0.003 0.000 2.245 393 M HA 0.145 4.629 4.480 0.006 0.000 0.330 393 M C 1.753 178.046 176.300 -0.012 0.000 1.098 393 M CA 0.006 55.294 55.300 -0.020 0.000 1.172 393 M CB 0.910 33.478 32.600 -0.053 0.000 1.467 393 M HN -0.100 8.190 8.290 -0.000 0.000 0.454 394 T N 1.761 116.312 114.554 -0.004 0.000 2.857 394 T HA -0.039 4.315 4.350 0.006 0.000 0.266 394 T C 1.549 176.263 174.700 0.023 0.000 1.048 394 T CA 1.308 63.430 62.100 0.038 0.000 1.139 394 T CB -0.358 68.557 68.868 0.078 0.000 0.874 394 T HN 0.737 8.977 8.240 -0.000 0.000 0.455 395 I N -0.384 120.160 120.570 -0.043 0.000 2.916 395 I HA 0.172 4.346 4.170 0.006 0.000 0.267 395 I C 2.195 178.251 176.117 -0.101 0.000 1.263 395 I CA 0.828 62.060 61.300 -0.113 0.000 1.471 395 I CB -0.334 37.521 38.000 -0.241 0.000 1.089 395 I HN 0.060 8.270 8.210 -0.000 0.000 0.468 396 A N 0.862 123.644 122.820 -0.063 0.000 2.238 396 A HA 0.195 4.519 4.320 0.006 0.000 0.210 396 A C 2.128 179.720 177.584 0.014 0.000 1.179 396 A CA 0.193 52.208 52.037 -0.036 0.000 0.827 396 A CB -0.090 18.890 19.000 -0.034 0.000 0.856 396 A HN 0.447 8.597 8.150 -0.000 0.000 0.488 397 K N -0.394 120.021 120.400 0.024 0.000 2.380 397 K HA 0.164 4.487 4.320 0.006 0.000 0.200 397 K C -0.103 176.562 176.600 0.108 0.000 1.201 397 K CA 0.239 56.564 56.287 0.063 0.000 0.916 397 K CB 0.546 33.073 32.500 0.045 0.000 1.187 397 K HN 0.398 8.648 8.250 -0.000 0.000 0.498 398 E N 1.936 122.177 120.200 0.069 0.000 2.231 398 E HA 0.088 4.442 4.350 0.006 0.000 0.277 398 E C -0.957 175.611 176.600 -0.052 0.000 0.999 398 E CA -0.339 56.118 56.400 0.095 0.000 0.827 398 E CB 1.739 31.526 29.700 0.145 0.000 1.101 398 E HN 0.082 8.442 8.360 -0.000 0.000 0.393 399 E N 2.979 123.194 120.200 0.024 0.000 2.351 399 E HA -0.012 4.342 4.350 0.006 0.000 0.266 399 E C 0.229 176.692 176.600 -0.228 0.000 1.031 399 E CA 0.044 56.394 56.400 -0.083 0.000 0.911 399 E CB 0.460 30.105 29.700 -0.092 0.000 0.986 399 E HN 0.524 8.884 8.360 -0.000 0.000 0.446 400 I N 4.364 124.767 120.570 -0.278 0.000 2.731 400 I HA -0.027 4.147 4.170 0.006 0.000 0.260 400 I C 0.494 176.668 176.117 0.096 0.000 1.138 400 I CA -0.022 61.055 61.300 -0.371 0.000 1.461 400 I CB 0.135 37.920 38.000 -0.359 0.000 1.128 400 I HN 0.688 8.898 8.210 -0.000 0.000 0.438 401 F N 1.691 121.588 119.950 -0.088 0.000 3.074 401 F HA -0.187 4.344 4.527 0.006 0.000 0.289 401 F C 0.421 176.240 175.800 0.032 0.000 0.863 401 F CA 0.595 58.591 58.000 -0.006 0.000 1.121 401 F CB -1.334 37.704 39.000 0.062 0.000 1.169 401 F HN 0.149 8.449 8.300 -0.000 0.000 0.570 402 G N -0.973 107.830 108.800 0.006 0.000 2.866 402 G HA2 0.660 4.623 3.960 0.006 0.000 0.289 402 G HA3 0.660 4.623 3.960 0.006 0.000 0.289 402 G C -3.019 171.846 174.900 -0.058 0.000 1.396 402 G CA -0.905 44.192 45.100 -0.005 0.000 0.848 402 G HN -0.204 8.086 8.290 -0.000 0.000 0.515 403 P HA 0.320 4.740 4.420 -0.000 0.000 0.226 403 P C -0.660 176.674 177.300 0.056 0.000 1.783 403 P CA -0.165 62.988 63.100 0.088 0.000 0.980 403 P CB 0.290 32.171 31.700 0.302 0.000 1.967 404 V N 2.449 122.304 119.914 -0.098 0.000 2.409 404 V HA 0.372 4.496 4.120 0.006 0.000 0.290 404 V C 0.054 176.083 176.094 -0.110 0.000 1.017 404 V CA -0.618 61.679 62.300 -0.006 0.000 0.841 404 V CB 1.899 33.789 31.823 0.112 0.000 1.003 404 V HN 0.283 8.473 8.190 -0.000 0.000 0.426 405 M N 4.074 123.608 119.600 -0.110 0.000 2.264 405 M HA 0.598 5.082 4.480 0.006 0.000 0.352 405 M C -0.848 175.478 176.300 0.043 0.000 1.173 405 M CA -0.348 54.867 55.300 -0.141 0.000 1.075 405 M CB 1.514 34.003 32.600 -0.186 0.000 1.621 405 M HN 0.623 8.913 8.290 -0.000 0.000 0.457 406 Q N 5.129 124.928 119.800 -0.001 0.000 2.341 406 Q HA 0.558 4.901 4.340 0.006 0.000 0.268 406 Q C -1.269 174.723 176.000 -0.012 0.000 1.013 406 Q CA 0.014 55.834 55.803 0.028 0.000 0.798 406 Q CB 1.662 30.377 28.738 -0.039 0.000 1.253 406 Q HN 0.686 8.956 8.270 -0.000 0.000 0.457 407 I N 4.029 124.630 120.570 0.051 0.000 2.354 407 I HA 0.411 4.585 4.170 0.006 0.000 0.292 407 I C -0.791 175.385 176.117 0.098 0.000 0.989 407 I CA -0.901 60.433 61.300 0.057 0.000 1.188 407 I CB 0.772 38.827 38.000 0.092 0.000 1.342 407 I HN 0.331 8.541 8.210 -0.000 0.000 0.457 408 L N 6.373 127.597 121.223 0.001 0.000 2.333 408 L HA 0.551 4.895 4.340 0.006 0.000 0.269 408 L C -0.155 176.838 176.870 0.204 0.000 1.010 408 L CA -0.550 54.289 54.840 -0.001 0.000 0.818 408 L CB 1.490 43.329 42.059 -0.366 0.000 1.306 408 L HN 0.459 8.689 8.230 -0.000 0.000 0.430 409 K N 1.551 122.015 120.400 0.108 0.000 2.164 409 K HA 0.704 5.028 4.320 0.006 0.000 0.258 409 K C -1.485 175.244 176.600 0.216 0.000 0.951 409 K CA -0.475 55.818 56.287 0.010 0.000 0.844 409 K CB 1.436 33.583 32.500 -0.588 0.000 1.099 409 K HN 0.539 8.789 8.250 -0.000 0.000 0.435 410 F N 0.976 120.983 119.950 0.095 0.000 2.664 410 F HA 0.470 5.003 4.527 0.009 0.000 0.317 410 F C 0.233 176.065 175.800 0.053 0.000 1.108 410 F CA -0.896 57.163 58.000 0.098 0.000 0.957 410 F CB 1.539 40.636 39.000 0.161 0.000 1.365 410 F HN 0.517 8.817 8.300 -0.000 0.000 0.475 411 K N -0.205 120.259 120.400 0.108 0.000 2.312 411 K HA 0.219 4.543 4.320 0.006 0.000 0.206 411 K C 0.045 176.700 176.600 0.092 0.000 1.121 411 K CA 1.003 57.275 56.287 -0.025 0.000 0.923 411 K CB 0.424 32.936 32.500 0.021 0.000 1.162 411 K HN 0.906 9.156 8.250 -0.000 0.000 0.478 412 T N -2.141 112.581 114.554 0.279 0.000 2.932 412 T HA 0.293 4.647 4.350 0.006 0.000 0.289 412 T C 1.079 175.962 174.700 0.307 0.000 1.039 412 T CA -0.880 61.361 62.100 0.236 0.000 1.024 412 T CB 1.532 70.470 68.868 0.117 0.000 1.090 412 T HN 0.154 8.394 8.240 -0.000 0.000 0.496 413 I N 0.497 121.192 120.570 0.208 0.000 2.361 413 I HA -0.110 4.064 4.170 0.006 0.000 0.251 413 I C 2.066 178.253 176.117 0.117 0.000 1.133 413 I CA 1.529 62.922 61.300 0.155 0.000 1.413 413 I CB 0.023 38.088 38.000 0.108 0.000 1.073 413 I HN 0.782 8.992 8.210 -0.000 0.000 0.424 414 E N 0.520 120.773 120.200 0.087 0.000 2.107 414 E HA -0.257 4.097 4.350 0.006 0.000 0.191 414 E C 1.943 178.570 176.600 0.044 0.000 0.982 414 E CA 1.161 57.617 56.400 0.093 0.000 0.809 414 E CB -0.180 29.552 29.700 0.053 0.000 0.756 414 E HN 0.510 8.870 8.360 -0.000 0.000 0.459 415 E N 0.552 120.779 120.200 0.045 0.000 2.031 415 E HA -0.187 4.167 4.350 0.006 0.000 0.193 415 E C 2.072 178.618 176.600 -0.090 0.000 0.994 415 E CA 1.287 57.700 56.400 0.022 0.000 0.800 415 E CB -0.087 29.672 29.700 0.099 0.000 0.752 415 E HN 0.168 8.528 8.360 -0.000 0.000 0.447 416 V N 0.510 120.295 119.914 -0.215 0.000 2.626 416 V HA -0.166 3.958 4.120 0.006 0.000 0.252 416 V C 2.267 178.062 176.094 -0.499 0.000 1.067 416 V CA 1.165 63.108 62.300 -0.595 0.000 1.081 416 V CB 0.093 31.152 31.823 -1.274 0.000 0.686 416 V HN 0.229 8.419 8.190 -0.000 0.000 0.468 417 V N 0.626 120.382 119.914 -0.262 0.000 2.295 417 V HA -0.155 3.969 4.120 0.006 0.000 0.246 417 V C 2.653 178.639 176.094 -0.181 0.000 1.049 417 V CA 2.246 64.425 62.300 -0.202 0.000 1.024 417 V CB -1.298 30.469 31.823 -0.093 0.000 0.648 417 V HN 0.623 8.813 8.190 -0.000 0.000 0.447 418 G N -0.647 108.077 108.800 -0.127 0.000 2.422 418 G HA2 -0.185 3.778 3.960 0.006 0.000 0.218 418 G HA3 -0.185 3.778 3.960 0.006 0.000 0.218 418 G C 1.757 176.597 174.900 -0.099 0.000 1.140 418 G CA 0.440 45.488 45.100 -0.087 0.000 0.775 418 G HN 0.433 8.723 8.290 -0.000 0.000 0.545 419 R N 0.383 120.790 120.500 -0.155 0.000 2.073 419 R HA 0.147 4.491 4.340 0.006 0.000 0.229 419 R C 3.009 179.216 176.300 -0.155 0.000 1.120 419 R CA 0.982 57.011 56.100 -0.119 0.000 0.967 419 R CB -0.299 29.938 30.300 -0.106 0.000 0.862 419 R HN 0.314 8.584 8.270 -0.000 0.000 0.436 420 A N 1.542 124.132 122.820 -0.383 0.000 1.933 420 A HA -0.153 4.171 4.320 0.006 0.000 0.218 420 A C 1.638 179.171 177.584 -0.085 0.000 1.175 420 A CA 1.456 53.333 52.037 -0.267 0.000 0.628 420 A CB -0.333 18.441 19.000 -0.376 0.000 0.814 420 A HN 0.214 8.364 8.150 -0.000 0.000 0.444 421 N N 0.155 118.795 118.700 -0.100 0.000 2.463 421 N HA -0.057 4.687 4.740 0.006 0.000 0.181 421 N C 0.329 175.828 175.510 -0.019 0.000 1.078 421 N CA 0.330 53.348 53.050 -0.053 0.000 0.902 421 N CB -0.439 38.009 38.487 -0.066 0.000 0.970 421 N HN 0.415 8.795 8.380 -0.000 0.000 0.451 422 N N 0.928 119.621 118.700 -0.012 0.000 2.971 422 N HA 0.027 4.771 4.740 0.006 0.000 0.294 422 N C -1.314 174.212 175.510 0.027 0.000 1.210 422 N CA 0.107 53.161 53.050 0.007 0.000 1.157 422 N CB -0.248 38.247 38.487 0.014 0.000 1.450 422 N HN -0.108 8.272 8.380 -0.000 0.000 0.527 423 S N -0.318 115.393 115.700 0.018 0.000 2.550 423 S HA 0.281 4.754 4.470 0.006 0.000 0.270 423 S C 0.911 175.492 174.600 -0.030 0.000 1.145 423 S CA -0.466 57.746 58.200 0.019 0.000 0.852 423 S CB 0.490 63.743 63.200 0.088 0.000 1.119 423 S HN 0.420 8.730 8.310 -0.000 0.000 0.465 424 T N 0.627 115.102 114.554 -0.131 0.000 3.085 424 T HA 0.236 4.590 4.350 0.006 0.000 0.263 424 T C 0.462 175.022 174.700 -0.234 0.000 1.127 424 T CA 0.586 62.555 62.100 -0.218 0.000 1.103 424 T CB -0.502 68.165 68.868 -0.335 0.000 0.921 424 T HN 0.547 8.787 8.240 -0.000 0.000 0.510 425 Y N 0.308 120.625 120.300 0.029 0.000 2.432 425 Y HA 0.588 5.141 4.550 0.006 0.000 0.322 425 Y C 1.250 177.161 175.900 0.019 0.000 1.246 425 Y CA -1.053 57.064 58.100 0.028 0.000 1.268 425 Y CB 1.804 40.286 38.460 0.036 0.000 1.276 425 Y HN 0.091 8.371 8.280 -0.000 0.000 0.499 426 G N 1.191 110.108 108.800 0.196 0.000 5.414 426 G HA2 0.119 4.083 3.960 0.006 0.000 0.202 426 G HA3 0.119 4.083 3.960 0.006 0.000 0.202 426 G C -0.130 174.713 174.900 -0.095 0.000 0.727 426 G CA -0.188 44.937 45.100 0.042 0.000 0.670 426 G HN 0.535 8.825 8.290 -0.000 0.000 0.442 427 L N 0.610 121.795 121.223 -0.063 0.000 2.049 427 L HA 0.747 5.091 4.340 0.006 0.000 0.203 427 L C 1.134 177.847 176.870 -0.262 0.000 1.074 427 L CA 2.148 56.889 54.840 -0.165 0.000 0.749 427 L CB -0.079 41.949 42.059 -0.051 0.000 0.907 427 L HN 0.393 8.623 8.230 -0.000 0.000 0.439 428 A N -2.146 120.591 122.820 -0.139 0.000 2.583 428 A HA 0.907 5.230 4.320 0.006 0.000 0.289 428 A C -1.441 176.093 177.584 -0.083 0.000 1.151 428 A CA -0.082 51.829 52.037 -0.210 0.000 0.695 428 A CB 0.930 19.872 19.000 -0.096 0.000 1.290 428 A HN 0.563 8.713 8.150 -0.000 0.000 0.419 429 A N -1.382 121.374 122.820 -0.108 0.000 2.586 429 A HA 0.980 5.303 4.320 0.006 0.000 0.291 429 A C -0.685 176.980 177.584 0.136 0.000 1.062 429 A CA 0.139 52.217 52.037 0.069 0.000 0.666 429 A CB 0.422 19.404 19.000 -0.030 0.000 1.281 429 A HN 2.683 10.832 8.150 -0.000 0.000 0.421 430 A N -0.425 122.579 122.820 0.306 0.000 2.566 430 A HA 0.848 5.172 4.320 0.006 0.000 0.292 430 A C -1.493 176.267 177.584 0.294 0.000 1.112 430 A CA -0.503 51.746 52.037 0.353 0.000 0.707 430 A CB 1.564 20.986 19.000 0.704 0.000 1.302 430 A HN 1.837 9.987 8.150 -0.000 0.000 0.409 431 V N 0.608 120.642 119.914 0.199 0.000 2.686 431 V HA 0.546 4.670 4.120 0.006 0.000 0.306 431 V C -1.627 174.537 176.094 0.117 0.000 1.065 431 V CA -0.263 62.157 62.300 0.199 0.000 0.894 431 V CB 1.532 33.413 31.823 0.097 0.000 1.004 431 V HN 0.702 8.892 8.190 -0.000 0.000 0.424 432 F N 2.614 122.679 119.950 0.191 0.000 2.402 432 F HA 0.787 5.317 4.527 0.005 0.000 0.355 432 F C 0.365 176.275 175.800 0.183 0.000 1.123 432 F CA -0.225 57.901 58.000 0.210 0.000 1.021 432 F CB 2.056 41.193 39.000 0.228 0.000 1.160 432 F HN 0.517 8.817 8.300 -0.000 0.000 0.451 433 T N 2.132 116.838 114.554 0.255 0.000 2.907 433 T HA 0.247 4.600 4.350 0.006 0.000 0.344 433 T C 0.064 174.846 174.700 0.138 0.000 1.675 433 T CA -0.712 61.503 62.100 0.193 0.000 1.076 433 T CB 1.338 70.302 68.868 0.159 0.000 1.483 433 T HN 0.660 8.900 8.240 -0.000 0.000 0.487 434 K N 0.878 121.349 120.400 0.118 0.000 2.361 434 K HA 0.166 4.490 4.320 0.006 0.000 0.194 434 K C -0.116 176.521 176.600 0.062 0.000 1.032 434 K CA -0.036 56.300 56.287 0.082 0.000 1.048 434 K CB 0.222 32.768 32.500 0.076 0.000 0.842 434 K HN 0.489 8.739 8.250 -0.000 0.000 0.526 435 D N 1.008 121.450 120.400 0.070 0.000 2.317 435 D HA 0.009 4.653 4.640 0.006 0.000 0.252 435 D C 0.880 177.211 176.300 0.052 0.000 1.174 435 D CA -0.270 53.764 54.000 0.056 0.000 0.866 435 D CB 1.048 41.884 40.800 0.060 0.000 1.127 435 D HN -0.158 8.212 8.370 -0.000 0.000 0.467 436 L N 4.269 125.516 121.223 0.039 0.000 1.971 436 L HA -0.171 4.172 4.340 0.006 0.000 0.215 436 L C 1.306 178.203 176.870 0.045 0.000 1.072 436 L CA 2.012 56.873 54.840 0.035 0.000 0.758 436 L CB -0.550 41.525 42.059 0.026 0.000 0.889 436 L HN 0.504 8.734 8.230 -0.000 0.000 0.433 437 D N -0.342 120.085 120.400 0.044 0.000 2.123 437 D HA -0.190 4.454 4.640 0.006 0.000 0.196 437 D C 2.223 178.576 176.300 0.089 0.000 0.992 437 D CA 1.468 55.500 54.000 0.053 0.000 0.833 437 D CB -0.095 40.722 40.800 0.028 0.000 0.954 437 D HN 0.410 8.780 8.370 -0.000 0.000 0.455 438 K N 0.389 120.840 120.400 0.084 0.000 2.057 438 K HA -0.064 4.260 4.320 0.006 0.000 0.207 438 K C 2.136 178.823 176.600 0.146 0.000 1.049 438 K CA 1.157 57.520 56.287 0.127 0.000 0.931 438 K CB -0.119 32.446 32.500 0.110 0.000 0.714 438 K HN 0.039 8.289 8.250 -0.000 0.000 0.440 439 A N 2.030 124.908 122.820 0.095 0.000 1.883 439 A HA -0.215 4.109 4.320 0.006 0.000 0.217 439 A C 1.852 179.466 177.584 0.051 0.000 1.186 439 A CA 1.809 53.884 52.037 0.063 0.000 0.624 439 A CB -0.507 18.517 19.000 0.040 0.000 0.822 439 A HN 0.233 8.383 8.150 -0.000 0.000 0.444 440 N N -1.642 117.096 118.700 0.063 0.000 2.216 440 N HA -0.132 4.611 4.740 0.006 0.000 0.183 440 N C 1.572 177.120 175.510 0.063 0.000 1.017 440 N CA 1.539 54.618 53.050 0.048 0.000 0.861 440 N CB -0.605 37.912 38.487 0.050 0.000 0.986 440 N HN 0.652 9.032 8.380 -0.000 0.000 0.428 441 Y N 1.537 121.832 120.300 -0.009 0.000 2.128 441 Y HA -0.093 4.461 4.550 0.007 0.000 0.284 441 Y C 2.094 177.979 175.900 -0.025 0.000 1.154 441 Y CA 1.467 59.559 58.100 -0.013 0.000 1.149 441 Y CB -0.443 38.014 38.460 -0.006 0.000 0.976 441 Y HN -0.028 8.252 8.280 -0.000 0.000 0.505 442 L N -0.409 120.762 121.223 -0.086 0.000 2.131 442 L HA -0.153 4.191 4.340 0.006 0.000 0.206 442 L C 2.732 179.496 176.870 -0.177 0.000 1.087 442 L CA 1.289 56.019 54.840 -0.183 0.000 0.767 442 L CB -0.751 41.295 42.059 -0.020 0.000 0.917 442 L HN 0.343 8.573 8.230 -0.000 0.000 0.441 443 S N -0.779 114.853 115.700 -0.112 0.000 2.382 443 S HA -0.299 4.174 4.470 0.006 0.000 0.228 443 S C 1.907 176.422 174.600 -0.141 0.000 1.027 443 S CA 1.384 59.513 58.200 -0.120 0.000 0.991 443 S CB -0.393 62.756 63.200 -0.086 0.000 0.823 443 S HN 0.494 8.804 8.310 -0.000 0.000 0.469 444 Q N 1.208 120.921 119.800 -0.144 0.000 2.049 444 Q HA 0.087 4.430 4.340 0.006 0.000 0.198 444 Q C 2.259 178.154 176.000 -0.176 0.000 0.971 444 Q CA 1.159 56.880 55.803 -0.137 0.000 0.833 444 Q CB -0.469 28.204 28.738 -0.109 0.000 0.896 444 Q HN 0.701 8.971 8.270 -0.000 0.000 0.434 445 A N 0.509 123.155 122.820 -0.289 0.000 2.067 445 A HA 0.092 4.416 4.320 0.006 0.000 0.217 445 A C 0.900 178.355 177.584 -0.215 0.000 1.156 445 A CA 0.115 51.970 52.037 -0.304 0.000 0.683 445 A CB -0.242 18.425 19.000 -0.555 0.000 0.808 445 A HN 0.357 8.507 8.150 -0.000 0.000 0.455 446 L N 1.034 122.132 121.223 -0.208 0.000 2.418 446 L HA 0.067 4.411 4.340 0.006 0.000 0.274 446 L C 0.121 176.898 176.870 -0.155 0.000 1.135 446 L CA -0.155 54.580 54.840 -0.175 0.000 0.870 446 L CB 0.656 42.609 42.059 -0.176 0.000 1.154 446 L HN 0.386 8.616 8.230 -0.000 0.000 0.462 447 Q N 3.865 123.599 119.800 -0.111 0.000 3.027 447 Q HA 0.448 4.792 4.340 0.006 0.000 0.260 447 Q C -0.342 175.522 176.000 -0.228 0.000 1.379 447 Q CA -0.272 55.506 55.803 -0.042 0.000 1.038 447 Q CB 0.569 29.341 28.738 0.056 0.000 1.578 447 Q HN 0.675 8.945 8.270 -0.000 0.000 0.571 448 A N -0.417 122.066 122.820 -0.562 0.000 2.515 448 A HA 0.659 4.983 4.320 0.006 0.000 0.298 448 A C 0.877 177.789 177.584 -1.120 0.000 1.059 448 A CA -0.454 51.155 52.037 -0.713 0.000 0.698 448 A CB 1.266 20.027 19.000 -0.398 0.000 1.289 448 A HN 0.520 8.670 8.150 -0.000 0.000 0.404 449 G N 0.192 108.375 108.800 -1.028 0.000 2.432 449 G HA2 0.256 4.220 3.960 0.006 0.000 0.219 449 G HA3 0.256 4.220 3.960 0.006 0.000 0.219 449 G C 0.532 175.076 174.900 -0.594 0.000 1.135 449 G CA 1.676 46.305 45.100 -0.784 0.000 0.767 449 G HN 0.810 9.100 8.290 -0.000 0.000 0.550 450 T N -0.219 113.956 114.554 -0.632 0.000 2.881 450 T HA 0.513 4.866 4.350 0.006 0.000 0.290 450 T C -1.034 173.206 174.700 -0.767 0.000 1.000 450 T CA -0.414 61.257 62.100 -0.716 0.000 0.978 450 T CB 2.663 70.987 68.868 -0.907 0.000 0.997 450 T HN -0.080 8.160 8.240 -0.000 0.000 0.443 451 V N 3.704 123.234 119.914 -0.640 0.000 2.378 451 V HA 0.445 4.569 4.120 0.006 0.000 0.288 451 V C -0.631 175.201 176.094 -0.438 0.000 1.016 451 V CA -1.062 60.958 62.300 -0.466 0.000 0.840 451 V CB 1.247 32.906 31.823 -0.274 0.000 0.994 451 V HN 0.767 8.957 8.190 -0.000 0.000 0.431 452 W N 3.517 124.696 121.300 -0.203 0.000 2.365 452 W HA 0.613 5.276 4.660 0.006 0.000 0.316 452 W C -0.566 175.853 176.519 -0.167 0.000 1.164 452 W CA -0.681 56.546 57.345 -0.197 0.000 1.204 452 W CB 1.848 31.153 29.460 -0.258 0.000 1.213 452 W HN 0.276 8.456 8.180 -0.000 0.000 0.539 453 V N 4.959 124.901 119.914 0.046 0.000 2.357 453 V HA 0.124 4.247 4.120 0.006 0.000 0.284 453 V C 0.307 176.299 176.094 -0.170 0.000 1.018 453 V CA -0.866 61.388 62.300 -0.077 0.000 0.841 453 V CB 1.088 32.887 31.823 -0.040 0.000 0.991 453 V HN 0.668 8.858 8.190 -0.000 0.000 0.437 454 N N 1.975 120.369 118.700 -0.509 0.000 2.714 454 N HA -0.184 4.560 4.740 0.006 0.000 0.250 454 N C -0.154 175.282 175.510 -0.123 0.000 1.117 454 N CA 1.365 54.080 53.050 -0.558 0.000 0.719 454 N CB -1.148 37.313 38.487 -0.045 0.000 1.081 454 N HN 1.008 9.388 8.380 -0.000 0.000 0.557 455 C N -4.118 115.050 119.300 -0.219 0.000 3.293 455 C HA 0.837 5.301 4.460 0.006 0.000 0.362 455 C C -0.858 174.229 174.990 0.162 0.000 1.539 455 C CA -1.288 57.823 59.018 0.155 0.000 1.201 455 C CB 1.881 29.704 27.740 0.138 0.000 1.770 455 C HN 0.252 8.482 8.230 -0.000 0.000 0.440 456 Y N -0.325 119.852 120.300 -0.204 0.000 2.592 456 Y HA 0.440 4.993 4.550 0.006 0.000 0.334 456 Y C -0.481 174.834 175.900 -0.975 0.000 1.136 456 Y CA 0.324 58.048 58.100 -0.626 0.000 1.042 456 Y CB 1.302 39.684 38.460 -0.131 0.000 1.325 456 Y HN 0.997 9.277 8.280 -0.000 0.000 0.457 457 D N 1.580 120.800 120.400 -1.967 0.000 2.751 457 D HA -0.141 4.503 4.640 0.006 0.000 0.233 457 D C -0.891 175.024 176.300 -0.642 0.000 1.149 457 D CA 0.937 54.297 54.000 -1.068 0.000 0.682 457 D CB -1.034 39.591 40.800 -0.290 0.000 1.068 457 D HN 0.153 8.523 8.370 -0.000 0.000 0.429 458 V N 1.141 120.473 119.914 -0.970 0.000 2.389 458 V HA 0.303 4.427 4.120 0.006 0.000 0.264 458 V C 0.453 176.466 176.094 -0.134 0.000 1.049 458 V CA -0.132 62.010 62.300 -0.263 0.000 0.932 458 V CB 0.142 31.900 31.823 -0.109 0.000 1.011 458 V HN -0.010 8.180 8.190 -0.000 0.000 0.475 459 F N 2.721 122.718 119.950 0.078 0.000 2.495 459 F HA 0.792 5.323 4.527 0.006 0.000 0.327 459 F C 0.732 176.537 175.800 0.009 0.000 1.103 459 F CA -0.512 57.525 58.000 0.063 0.000 0.949 459 F CB 2.185 41.203 39.000 0.029 0.000 1.142 459 F HN 0.520 8.820 8.300 -0.000 0.000 0.457 460 G N 0.353 109.225 108.800 0.120 0.000 2.542 460 G HA2 0.527 4.491 3.960 0.006 0.000 0.311 460 G HA3 0.527 4.491 3.960 0.006 0.000 0.311 460 G C 0.225 175.042 174.900 -0.139 0.000 1.298 460 G CA -0.446 44.650 45.100 -0.007 0.000 0.973 460 G HN 0.870 9.160 8.290 -0.000 0.000 0.487 461 A N 0.892 123.558 122.820 -0.257 0.000 2.024 461 A HA -0.073 4.251 4.320 0.006 0.000 0.220 461 A C 2.129 179.093 177.584 -1.033 0.000 1.164 461 A CA 1.820 53.531 52.037 -0.544 0.000 0.643 461 A CB -0.154 18.540 19.000 -0.510 0.000 0.806 461 A HN 0.570 8.720 8.150 -0.000 0.000 0.451 462 Q N -0.053 119.290 119.800 -0.763 0.000 2.245 462 Q HA 0.139 4.483 4.340 0.006 0.000 0.201 462 Q C 0.354 176.266 176.000 -0.146 0.000 0.955 462 Q CA 0.763 56.249 55.803 -0.528 0.000 0.870 462 Q CB 0.086 28.707 28.738 -0.195 0.000 0.945 462 Q HN 0.462 8.732 8.270 -0.000 0.000 0.461 463 S N 2.121 117.748 115.700 -0.121 0.000 2.437 463 S HA 0.419 4.893 4.470 0.006 0.000 0.305 463 S C -2.478 172.114 174.600 -0.014 0.000 1.109 463 S CA -1.412 56.775 58.200 -0.021 0.000 1.099 463 S CB 1.271 64.454 63.200 -0.028 0.000 1.004 463 S HN 0.039 8.349 8.310 -0.000 0.000 0.475 464 P HA 0.353 4.773 4.420 -0.000 0.000 0.272 464 P C -0.962 176.341 177.300 0.006 0.000 1.230 464 P CA -0.316 62.779 63.100 -0.009 0.000 0.788 464 P CB 0.389 32.000 31.700 -0.149 0.000 0.949 465 F N 0.448 120.312 119.950 -0.143 0.000 2.596 465 F HA 0.658 5.189 4.527 0.006 0.000 0.311 465 F C -0.566 175.207 175.800 -0.045 0.000 1.116 465 F CA 0.226 58.167 58.000 -0.098 0.000 0.957 465 F CB 2.015 41.026 39.000 0.018 0.000 1.250 465 F HN 0.711 9.011 8.300 -0.000 0.000 0.444 466 G N 2.190 110.457 108.800 -0.888 0.000 2.316 466 G HA2 0.466 4.430 3.960 0.006 0.000 0.296 466 G HA3 0.466 4.430 3.960 0.006 0.000 0.296 466 G C -1.521 173.088 174.900 -0.484 0.000 1.399 466 G CA -0.208 44.550 45.100 -0.570 0.000 0.833 466 G HN 1.089 9.379 8.290 -0.000 0.000 0.565 467 G N -1.494 107.167 108.800 -0.232 0.000 2.491 467 G HA2 0.639 4.603 3.960 0.006 0.000 0.327 467 G HA3 0.639 4.603 3.960 0.006 0.000 0.327 467 G C -1.218 173.773 174.900 0.151 0.000 1.189 467 G CA -0.546 44.489 45.100 -0.108 0.000 0.956 467 G HN 0.438 8.728 8.290 -0.000 0.000 0.491 468 Y N -0.058 120.180 120.300 -0.104 0.000 2.519 468 Y HA 0.470 5.023 4.550 0.006 0.000 0.324 468 Y C 1.318 177.201 175.900 -0.028 0.000 1.214 468 Y CA -1.281 56.776 58.100 -0.073 0.000 1.260 468 Y CB 1.426 39.839 38.460 -0.078 0.000 1.311 468 Y HN 0.845 9.125 8.280 -0.000 0.000 0.505 469 K N -0.546 119.922 120.400 0.113 0.000 1.867 469 K HA -0.268 4.056 4.320 0.006 0.000 0.140 469 K C 0.805 177.442 176.600 0.062 0.000 1.408 469 K CA 1.734 58.056 56.287 0.059 0.000 0.461 469 K CB -1.054 31.485 32.500 0.065 0.000 0.594 469 K HN 0.501 8.751 8.250 -0.000 0.000 0.888 470 M N 0.884 120.522 119.600 0.062 0.000 2.682 470 M HA 0.027 4.511 4.480 0.006 0.000 0.235 470 M C 1.158 177.597 176.300 0.232 0.000 1.114 470 M CA 1.182 56.531 55.300 0.081 0.000 1.053 470 M CB -0.356 32.206 32.600 -0.063 0.000 1.599 470 M HN 0.313 8.603 8.290 -0.000 0.000 0.520 471 S N 0.250 116.089 115.700 0.232 0.000 2.593 471 S HA 0.394 4.868 4.470 0.006 0.000 0.217 471 S C 1.085 175.743 174.600 0.097 0.000 0.966 471 S CA 0.464 58.777 58.200 0.189 0.000 0.914 471 S CB 0.178 63.452 63.200 0.122 0.000 0.776 471 S HN 0.748 9.058 8.310 -0.000 0.000 0.523 472 G N 1.036 109.890 108.800 0.091 0.000 2.353 472 G HA2 0.142 4.106 3.960 0.006 0.000 0.615 472 G HA3 0.142 4.106 3.960 0.006 0.000 0.615 472 G C -0.853 174.069 174.900 0.036 0.000 1.280 472 G CA -0.510 44.629 45.100 0.065 0.000 1.000 472 G HN 0.751 9.041 8.290 -0.000 0.000 0.516 473 S N -1.115 114.599 115.700 0.024 0.000 2.569 473 S HA 1.003 5.477 4.470 0.006 0.000 0.280 473 S C 0.387 174.985 174.600 -0.003 0.000 1.111 473 S CA 0.443 58.643 58.200 -0.001 0.000 0.887 473 S CB 1.664 64.858 63.200 -0.010 0.000 1.095 473 S HN 3.000 11.310 8.310 -0.000 0.000 0.476 474 G N 1.751 110.541 108.800 -0.016 0.000 2.728 474 G HA2 0.013 3.977 3.960 0.006 0.000 0.686 474 G HA3 0.013 3.977 3.960 0.006 0.000 0.686 474 G C -1.010 173.887 174.900 -0.005 0.000 1.337 474 G CA -0.988 44.106 45.100 -0.010 0.000 0.861 474 G HN 0.755 9.045 8.290 -0.000 0.000 0.597 475 R N 0.891 121.396 120.500 0.008 0.000 2.828 475 R HA 0.685 5.028 4.340 0.006 0.000 0.264 475 R C 0.241 176.583 176.300 0.070 0.000 1.022 475 R CA -0.684 55.419 56.100 0.005 0.000 1.021 475 R CB 1.524 31.796 30.300 -0.048 0.000 1.163 475 R HN 0.763 9.033 8.270 -0.000 0.000 0.494 476 E N 1.194 121.437 120.200 0.072 0.000 2.320 476 E HA 0.521 4.875 4.350 0.006 0.000 0.264 476 E C -0.208 176.383 176.600 -0.015 0.000 0.923 476 E CA -0.922 55.510 56.400 0.054 0.000 0.796 476 E CB 1.945 31.670 29.700 0.042 0.000 1.262 476 E HN 0.329 8.689 8.360 -0.000 0.000 0.428 477 L N -0.517 120.717 121.223 0.019 0.000 0.596 477 L HA -0.288 4.056 4.340 0.006 0.000 0.356 477 L C 0.711 177.696 176.870 0.192 0.000 0.994 477 L CA 0.834 55.706 54.840 0.053 0.000 1.223 477 L CB -1.522 40.375 42.059 -0.270 0.000 0.044 477 L HN 1.015 9.245 8.230 -0.000 0.000 0.093 478 G N -0.069 108.805 108.800 0.122 0.000 2.740 478 G HA2 -0.303 3.661 3.960 0.006 0.000 0.250 478 G HA3 -0.303 3.661 3.960 0.006 0.000 0.250 478 G C 0.439 175.547 174.900 0.345 0.000 1.358 478 G CA 0.924 46.205 45.100 0.302 0.000 0.897 478 G HN 1.168 9.458 8.290 -0.000 0.000 0.567 479 E N -1.047 119.283 120.200 0.216 0.000 2.153 479 E HA -0.122 4.232 4.350 0.006 0.000 0.194 479 E C 2.129 178.537 176.600 -0.321 0.000 0.988 479 E CA 1.715 57.898 56.400 -0.362 0.000 0.811 479 E CB -0.159 29.326 29.700 -0.359 0.000 0.746 479 E HN 0.633 8.993 8.360 -0.000 0.000 0.466 480 Y N -0.242 120.033 120.300 -0.042 0.000 2.403 480 Y HA -0.065 4.489 4.550 0.006 0.000 0.291 480 Y C 2.386 178.272 175.900 -0.023 0.000 1.143 480 Y CA 0.958 59.043 58.100 -0.025 0.000 1.257 480 Y CB -0.615 37.850 38.460 0.009 0.000 0.984 480 Y HN 0.154 8.434 8.280 -0.000 0.000 0.550 481 G N -0.015 108.892 108.800 0.178 0.000 2.470 481 G HA2 -0.173 3.791 3.960 0.006 0.000 0.220 481 G HA3 -0.173 3.791 3.960 0.006 0.000 0.220 481 G C 1.471 176.422 174.900 0.084 0.000 1.121 481 G CA 0.854 46.060 45.100 0.176 0.000 0.766 481 G HN 0.418 8.708 8.290 -0.000 0.000 0.553 482 L N -0.573 120.576 121.223 -0.124 0.000 2.270 482 L HA 0.061 4.405 4.340 0.006 0.000 0.210 482 L C 2.912 179.682 176.870 -0.166 0.000 1.104 482 L CA 0.360 55.027 54.840 -0.290 0.000 0.804 482 L CB -0.381 41.116 42.059 -0.937 0.000 0.937 482 L HN 0.198 8.428 8.230 -0.000 0.000 0.450 483 Q N 0.689 120.427 119.800 -0.104 0.000 2.096 483 Q HA -0.197 4.146 4.340 0.006 0.000 0.204 483 Q C 2.441 178.418 176.000 -0.039 0.000 0.982 483 Q CA 1.731 57.528 55.803 -0.009 0.000 0.850 483 Q CB -0.298 28.460 28.738 0.033 0.000 0.901 483 Q HN 0.575 8.845 8.270 -0.000 0.000 0.422 484 A N -0.245 122.528 122.820 -0.079 0.000 2.121 484 A HA -0.130 4.194 4.320 0.006 0.000 0.218 484 A C 0.996 178.337 177.584 -0.406 0.000 1.154 484 A CA 0.915 52.800 52.037 -0.253 0.000 0.679 484 A CB -0.314 18.473 19.000 -0.355 0.000 0.795 484 A HN 0.412 8.562 8.150 -0.000 0.000 0.458 485 Y N -0.415 119.851 120.300 -0.056 0.000 2.485 485 Y HA 0.208 4.761 4.550 0.006 0.000 0.260 485 Y C 0.384 176.276 175.900 -0.013 0.000 1.173 485 Y CA 0.118 58.193 58.100 -0.042 0.000 1.252 485 Y CB 0.471 38.894 38.460 -0.061 0.000 1.123 485 Y HN 0.056 8.336 8.280 -0.000 0.000 0.524 486 T N 0.655 115.246 114.554 0.061 0.000 2.856 486 T HA 0.367 4.720 4.350 0.006 0.000 0.283 486 T C -0.842 173.851 174.700 -0.011 0.000 1.008 486 T CA -0.889 61.246 62.100 0.058 0.000 0.997 486 T CB 1.946 70.865 68.868 0.084 0.000 0.992 486 T HN -0.077 8.163 8.240 -0.000 0.000 0.454 487 K N 2.187 122.594 120.400 0.011 0.000 2.244 487 K HA 0.630 4.953 4.320 0.006 0.000 0.260 487 K C -1.056 175.533 176.600 -0.017 0.000 0.951 487 K CA -0.642 55.641 56.287 -0.006 0.000 0.826 487 K CB 1.162 33.683 32.500 0.034 0.000 1.108 487 K HN 0.328 8.578 8.250 -0.000 0.000 0.433 488 V N 4.686 124.573 119.914 -0.046 0.000 2.406 488 V HA 0.246 4.370 4.120 0.006 0.000 0.272 488 V C -0.109 175.988 176.094 0.004 0.000 1.043 488 V CA -0.479 61.811 62.300 -0.016 0.000 0.915 488 V CB 1.039 32.837 31.823 -0.042 0.000 0.988 488 V HN 0.671 8.861 8.190 -0.000 0.000 0.466 489 K N 3.336 123.751 120.400 0.025 0.000 2.274 489 K HA 0.502 4.826 4.320 0.006 0.000 0.262 489 K C -0.555 176.000 176.600 -0.075 0.000 0.961 489 K CA -0.372 55.902 56.287 -0.021 0.000 0.833 489 K CB 1.471 33.965 32.500 -0.009 0.000 1.102 489 K HN 0.681 8.931 8.250 -0.000 0.000 0.436 490 T N 3.168 117.648 114.554 -0.122 0.000 2.771 490 T HA 0.272 4.626 4.350 0.006 0.000 0.291 490 T C -0.608 173.904 174.700 -0.313 0.000 0.954 490 T CA -0.550 61.424 62.100 -0.209 0.000 1.045 490 T CB 1.087 69.857 68.868 -0.164 0.000 0.917 490 T HN 0.314 8.554 8.240 -0.000 0.000 0.484 491 V N 3.929 123.499 119.914 -0.574 0.000 2.384 491 V HA 0.479 4.602 4.120 0.006 0.000 0.287 491 V C 0.203 175.934 176.094 -0.605 0.000 1.020 491 V CA -0.719 61.194 62.300 -0.646 0.000 0.850 491 V CB 1.738 32.977 31.823 -0.973 0.000 0.987 491 V HN 0.930 9.120 8.190 -0.000 0.000 0.436 492 T N 4.577 118.932 114.554 -0.332 0.000 2.864 492 T HA 0.506 4.859 4.350 0.006 0.000 0.310 492 T C -0.384 174.281 174.700 -0.059 0.000 1.040 492 T CA -0.275 61.693 62.100 -0.221 0.000 0.977 492 T CB 1.287 70.007 68.868 -0.247 0.000 0.976 492 T HN 0.350 8.590 8.240 -0.000 0.000 0.459 493 V N 4.104 124.060 119.914 0.069 0.000 2.435 493 V HA 0.443 4.566 4.120 0.006 0.000 0.290 493 V C 0.476 176.780 176.094 0.351 0.000 1.030 493 V CA -1.107 61.312 62.300 0.199 0.000 0.881 493 V CB 1.716 33.685 31.823 0.243 0.000 0.983 493 V HN 0.700 8.890 8.190 -0.000 0.000 0.445 494 K N 4.010 124.594 120.400 0.307 0.000 2.379 494 K HA 0.451 4.775 4.320 0.006 0.000 0.284 494 K C -0.550 176.098 176.600 0.081 0.000 1.044 494 K CA -0.216 56.185 56.287 0.190 0.000 0.974 494 K CB 0.920 33.503 32.500 0.138 0.000 0.962 494 K HN 0.664 8.914 8.250 -0.000 0.000 0.474 495 V N 2.061 121.964 119.914 -0.018 0.000 2.960 495 V HA 0.418 4.541 4.120 0.006 0.000 0.315 495 V C -2.138 173.914 176.094 -0.070 0.000 1.087 495 V CA -1.977 60.319 62.300 -0.006 0.000 0.982 495 V CB 1.338 33.182 31.823 0.035 0.000 1.039 495 V HN 0.666 8.856 8.190 -0.000 0.000 0.437 496 P HA -0.090 4.330 4.420 -0.000 0.000 0.214 496 P C 0.108 177.367 177.300 -0.068 0.000 1.163 496 P CA 1.360 64.429 63.100 -0.052 0.000 0.889 496 P CB 0.147 31.826 31.700 -0.035 0.000 0.790 497 Q N -1.123 118.639 119.800 -0.062 0.000 2.444 497 Q HA 0.136 4.479 4.340 0.006 0.000 0.239 497 Q C -1.036 174.934 176.000 -0.050 0.000 0.853 497 Q CA -0.681 55.085 55.803 -0.062 0.000 0.856 497 Q CB 1.037 29.747 28.738 -0.046 0.000 1.413 497 Q HN -0.200 8.070 8.270 -0.000 0.000 0.437 498 K N 3.697 124.066 120.400 -0.052 0.000 2.412 498 K HA 0.225 4.549 4.320 0.006 0.000 0.281 498 K C -1.051 175.540 176.600 -0.016 0.000 1.027 498 K CA 0.442 56.716 56.287 -0.022 0.000 0.989 498 K CB 0.453 32.951 32.500 -0.003 0.000 0.935 498 K HN 0.686 8.936 8.250 -0.000 0.000 0.475 499 N N 1.193 119.885 118.700 -0.013 0.000 2.321 499 N HA 0.134 4.877 4.740 0.006 0.000 0.290 499 N C -0.541 174.966 175.510 -0.005 0.000 1.212 499 N CA -0.524 52.519 53.050 -0.012 0.000 0.767 499 N CB 1.739 40.214 38.487 -0.021 0.000 1.494 499 N HN 0.661 9.041 8.380 -0.000 0.000 0.479 500 S N 0.000 115.699 115.700 -0.002 0.000 2.498 500 S HA 0.000 4.474 4.470 0.006 0.000 0.327 500 S CA 0.000 58.201 58.200 0.001 0.000 1.107 500 S CB 0.000 63.202 63.200 0.003 0.000 0.593 500 S HN 0.000 8.310 8.310 -0.000 0.000 0.517