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 1m64_1_A DATA FIRST_RESID 1 DATA SEQUENCE ADNLAEFHVQ NQECDSCHTP DGELSNDSLT YENTQCVSCH GTLAEVAETT DATA SEQUENCE KHEHYNAHAS HFPGEVACTS CHSAHEKSMV YCDSCHSFDF NMPYAKKWLR DATA SEQUENCE DEPTIAELAK DKSERQAALA SAPHDTVDVV VVGSGGAGFS AAISATDSGA DATA SEQUENCE KVILIEKEPV IGGNAKLAAG GMNAAWTDQQ KAKKITDSPE LMFEDTMKGG DATA SEQUENCE QNINDPALVK VLSSHSKDSV DWMTAMGADL TDVGMMGGAS VNRAHRPTGG DATA SEQUENCE AGVGAHVVQV LYDNAVKRNI DLRMNTRGIE VLKDDKGTVK GILVKGMYKG DATA SEQUENCE YYWVKADAVI LATGGFAKNN ERVAKLDPSL KGFISTNQPG AVGDGLDVAE DATA SEQUENCE NAGGALKDMQ YIFAHPTLSV KGGVMVTEAV RGNGAILVNR EGKRFVNEIT DATA SEQUENCE TRDKASAAIL AQTGKSAYLI FDDSVRKSLS KIDKYIGLGV APTADSLVKL DATA SEQUENCE GKMEGIDGKA LTETVARYNS LVSSGKDTDF ERPNLPRALN EGNYYAIEVT DATA SEQUENCE PGVHHTMGGV MIDTKAEVMN AKKQVIPGLY GAGEVTGGVH GANRLGGNAI DATA SEQUENCE SDIITFGRLA GEEAAKYS 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 1 A HA 0.000 4.320 4.320 -0.000 0.000 0.244 1 A C 0.000 177.727 177.584 0.238 0.000 1.274 1 A CA 0.000 52.170 52.037 0.222 0.000 0.836 1 A CB 0.000 19.150 19.000 0.250 0.000 0.831 2 D N 0.179 120.648 120.400 0.115 0.000 2.346 2 D HA 0.106 4.765 4.640 0.032 0.000 0.206 2 D C 0.281 176.584 176.300 0.005 0.000 1.001 2 D CA 1.621 55.686 54.000 0.108 0.000 0.871 2 D CB 0.191 41.034 40.800 0.072 0.000 0.943 2 D HN 0.698 9.068 8.370 -0.000 0.000 0.518 3 N N -1.200 117.330 118.700 -0.285 0.000 2.825 3 N HA 0.074 4.833 4.740 0.032 0.000 0.253 3 N C 0.007 174.949 175.510 -0.946 0.000 1.426 3 N CA -0.713 52.001 53.050 -0.560 0.000 0.851 3 N CB 1.069 39.451 38.487 -0.176 0.000 1.470 3 N HN -0.231 8.149 8.380 -0.000 0.000 0.517 4 L N -0.001 120.774 121.223 -0.746 0.000 2.141 4 L HA 0.292 4.651 4.340 0.032 0.000 0.209 4 L C 2.081 178.971 176.870 0.032 0.000 1.094 4 L CA 2.250 56.903 54.840 -0.311 0.000 0.763 4 L CB -1.013 41.043 42.059 -0.005 0.000 0.908 4 L HN 0.852 9.082 8.230 -0.000 0.000 0.437 5 A N -0.957 121.773 122.820 -0.149 0.000 1.898 5 A HA -0.231 4.108 4.320 0.032 0.000 0.216 5 A C 2.299 179.896 177.584 0.021 0.000 1.181 5 A CA 1.540 53.491 52.037 -0.143 0.000 0.620 5 A CB -0.651 18.020 19.000 -0.549 0.000 0.819 5 A HN 0.551 8.701 8.150 -0.000 0.000 0.442 6 E N -1.109 119.085 120.200 -0.010 0.000 2.085 6 E HA -0.237 4.132 4.350 0.032 0.000 0.194 6 E C 1.760 178.403 176.600 0.072 0.000 0.994 6 E CA 1.500 57.921 56.400 0.034 0.000 0.801 6 E CB -0.296 29.413 29.700 0.016 0.000 0.743 6 E HN 0.603 8.963 8.360 -0.000 0.000 0.453 7 F N 0.755 120.675 119.950 -0.051 0.000 2.095 7 F HA -0.227 4.319 4.527 0.033 0.000 0.298 7 F C 2.034 177.817 175.800 -0.028 0.000 1.104 7 F CA 2.314 60.301 58.000 -0.022 0.000 1.232 7 F CB -0.290 38.708 39.000 -0.004 0.000 0.987 7 F HN 0.133 8.433 8.300 -0.000 0.000 0.475 8 H N -0.705 118.427 119.070 0.104 0.000 2.423 8 H HA -0.063 4.512 4.556 0.032 0.000 0.297 8 H C 2.241 177.525 175.328 -0.073 0.000 1.075 8 H CA 1.741 57.790 56.048 0.001 0.000 1.342 8 H CB -0.572 29.244 29.762 0.091 0.000 1.395 8 H HN 0.305 8.585 8.280 -0.000 0.000 0.530 9 V N -1.046 118.915 119.914 0.077 0.000 3.305 9 V HA -0.132 4.007 4.120 0.032 0.000 0.269 9 V C 1.534 177.614 176.094 -0.024 0.000 1.157 9 V CA 0.963 63.285 62.300 0.036 0.000 1.157 9 V CB -0.336 31.522 31.823 0.059 0.000 0.772 9 V HN 0.358 8.548 8.190 -0.000 0.000 0.498 10 Q N 1.319 121.061 119.800 -0.097 0.000 2.170 10 Q HA -0.067 4.292 4.340 0.032 0.000 0.203 10 Q C 1.094 177.029 176.000 -0.108 0.000 0.976 10 Q CA 1.695 57.423 55.803 -0.126 0.000 0.858 10 Q CB -0.137 28.466 28.738 -0.225 0.000 0.907 10 Q HN 0.756 9.026 8.270 -0.000 0.000 0.433 11 N N -0.535 118.099 118.700 -0.111 0.000 2.232 11 N HA 0.154 4.913 4.740 0.032 0.000 0.240 11 N C -0.873 174.619 175.510 -0.031 0.000 1.307 11 N CA 0.132 53.138 53.050 -0.074 0.000 0.859 11 N CB 1.206 39.632 38.487 -0.102 0.000 1.260 11 N HN 0.165 8.545 8.380 -0.000 0.000 0.501 12 Q N 0.045 119.843 119.800 -0.003 0.000 2.456 12 Q HA 0.334 4.693 4.340 0.032 0.000 0.284 12 Q C -0.928 175.094 176.000 0.037 0.000 1.061 12 Q CA -0.753 55.066 55.803 0.027 0.000 0.799 12 Q CB 2.279 31.055 28.738 0.063 0.000 1.445 12 Q HN -0.016 8.254 8.270 -0.000 0.000 0.411 13 E N 0.075 120.300 120.200 0.041 0.000 2.314 13 E HA 0.133 4.502 4.350 0.032 0.000 0.262 13 E C 0.447 177.093 176.600 0.076 0.000 1.093 13 E CA -0.112 56.318 56.400 0.049 0.000 0.908 13 E CB 1.093 30.818 29.700 0.042 0.000 1.091 13 E HN 0.745 9.105 8.360 -0.000 0.000 0.425 14 C N 0.650 120.003 119.300 0.089 0.000 2.425 14 C HA -0.151 4.328 4.460 0.032 0.000 0.277 14 C C 1.630 176.730 174.990 0.185 0.000 1.280 14 C CA 1.073 60.180 59.018 0.148 0.000 1.744 14 C CB -0.860 26.947 27.740 0.111 0.000 1.989 14 C HN 0.758 8.988 8.230 -0.000 0.000 0.491 15 D N 1.370 121.847 120.400 0.129 0.000 2.352 15 D HA -0.059 4.600 4.640 0.032 0.000 0.232 15 D C 1.615 177.986 176.300 0.119 0.000 1.055 15 D CA 1.021 55.105 54.000 0.140 0.000 0.891 15 D CB -0.584 40.275 40.800 0.099 0.000 0.897 15 D HN 0.593 8.963 8.370 -0.000 0.000 0.529 16 S N -1.219 114.531 115.700 0.084 0.000 2.423 16 S HA -0.115 4.374 4.470 0.032 0.000 0.231 16 S C 1.841 176.451 174.600 0.015 0.000 1.014 16 S CA 0.585 58.812 58.200 0.044 0.000 0.965 16 S CB -0.530 62.689 63.200 0.031 0.000 0.785 16 S HN 0.432 8.742 8.310 -0.000 0.000 0.495 17 C N 0.057 119.362 119.300 0.009 0.000 2.937 17 C HA 0.419 4.898 4.460 0.032 0.000 0.426 17 C C 0.962 175.924 174.990 -0.046 0.000 1.321 17 C CA -0.572 58.389 59.018 -0.094 0.000 2.082 17 C CB -0.631 26.962 27.740 -0.246 0.000 2.834 17 C HN 0.571 8.801 8.230 -0.000 0.000 0.593 18 H N 1.513 120.675 119.070 0.153 0.000 2.488 18 H HA 0.298 4.873 4.556 0.032 0.000 0.347 18 H C 0.395 175.778 175.328 0.091 0.000 1.174 18 H CA 0.631 56.761 56.048 0.137 0.000 1.307 18 H CB 0.991 30.787 29.762 0.056 0.000 1.517 18 H HN 0.309 8.589 8.280 -0.000 0.000 0.554 19 T N -0.650 113.879 114.554 -0.041 0.000 2.748 19 T HA 0.022 4.391 4.350 0.032 0.000 0.304 19 T C -1.570 173.056 174.700 -0.123 0.000 1.041 19 T CA -1.301 60.561 62.100 -0.397 0.000 1.033 19 T CB 0.351 68.941 68.868 -0.463 0.000 0.995 19 T HN 0.300 8.540 8.240 -0.000 0.000 0.536 20 P HA -0.080 4.340 4.420 -0.000 0.000 0.218 20 P C 1.141 178.411 177.300 -0.050 0.000 1.148 20 P CA 1.183 64.251 63.100 -0.053 0.000 0.822 20 P CB -0.051 31.619 31.700 -0.050 0.000 0.784 21 D N -2.119 118.239 120.400 -0.069 0.000 2.350 21 D HA 0.063 4.722 4.640 0.032 0.000 0.213 21 D C 1.520 177.783 176.300 -0.062 0.000 1.031 21 D CA 0.842 54.808 54.000 -0.056 0.000 0.861 21 D CB -0.693 40.075 40.800 -0.054 0.000 0.926 21 D HN 0.231 8.601 8.370 -0.000 0.000 0.520 22 G N 0.070 108.830 108.800 -0.066 0.000 2.225 22 G HA2 -0.272 3.707 3.960 0.032 0.000 0.254 22 G HA3 -0.272 3.707 3.960 0.032 0.000 0.254 22 G C 0.102 174.950 174.900 -0.088 0.000 0.988 22 G CA 0.187 45.226 45.100 -0.102 0.000 0.625 22 G HN 0.425 8.715 8.290 -0.000 0.000 0.527 23 E N 0.628 120.798 120.200 -0.050 0.000 2.383 23 E HA 0.384 4.754 4.350 0.032 0.000 0.264 23 E C 0.904 177.519 176.600 0.025 0.000 1.050 23 E CA -0.401 55.987 56.400 -0.020 0.000 0.896 23 E CB 0.940 30.626 29.700 -0.023 0.000 0.982 23 E HN 0.432 8.792 8.360 -0.000 0.000 0.424 24 L N 2.196 123.451 121.223 0.053 0.000 2.455 24 L HA -0.081 4.278 4.340 0.032 0.000 0.272 24 L C 2.010 178.901 176.870 0.035 0.000 1.174 24 L CA -0.050 54.832 54.840 0.070 0.000 0.869 24 L CB 0.361 42.460 42.059 0.066 0.000 1.130 24 L HN 0.661 8.891 8.230 -0.000 0.000 0.474 25 S N 2.332 118.053 115.700 0.035 0.000 2.370 25 S HA -0.142 4.347 4.470 0.032 0.000 0.226 25 S C 0.553 175.174 174.600 0.035 0.000 1.033 25 S CA 1.331 59.548 58.200 0.028 0.000 1.011 25 S CB -0.344 62.905 63.200 0.083 0.000 0.852 25 S HN 0.942 9.252 8.310 -0.000 0.000 0.457 26 N N -1.229 117.498 118.700 0.044 0.000 3.413 26 N HA 0.212 4.971 4.740 0.032 0.000 0.273 26 N C -1.110 174.454 175.510 0.089 0.000 1.458 26 N CA -0.211 52.870 53.050 0.051 0.000 0.860 26 N CB -0.302 38.217 38.487 0.053 0.000 1.556 26 N HN -0.137 8.243 8.380 -0.000 0.000 0.475 27 D N -0.509 119.968 120.400 0.128 0.000 2.348 27 D HA 0.038 4.697 4.640 0.032 0.000 0.216 27 D C 0.354 176.788 176.300 0.223 0.000 0.970 27 D CA 0.865 55.004 54.000 0.231 0.000 0.889 27 D CB -0.037 40.888 40.800 0.209 0.000 0.912 27 D HN 0.484 8.854 8.370 -0.000 0.000 0.524 28 S N 0.024 115.804 115.700 0.133 0.000 2.558 28 S HA 0.092 4.581 4.470 0.032 0.000 0.217 28 S C 1.135 175.768 174.600 0.054 0.000 0.975 28 S CA -0.163 58.101 58.200 0.108 0.000 0.912 28 S CB 0.344 63.601 63.200 0.095 0.000 0.776 28 S HN 0.291 8.601 8.310 -0.000 0.000 0.526 29 L N 1.625 122.854 121.223 0.010 0.000 3.597 29 L HA -0.256 4.103 4.340 0.032 0.000 0.440 29 L C 1.188 178.064 176.870 0.009 0.000 1.277 29 L CA 0.122 54.935 54.840 -0.046 0.000 0.852 29 L CB -2.536 39.420 42.059 -0.171 0.000 1.708 29 L HN 0.242 8.472 8.230 -0.000 0.000 0.885 30 T N -1.674 112.910 114.554 0.051 0.000 2.674 30 T HA -0.247 4.122 4.350 0.032 0.000 0.265 30 T C 1.451 176.186 174.700 0.059 0.000 1.039 30 T CA 2.072 64.207 62.100 0.058 0.000 1.150 30 T CB -0.191 68.722 68.868 0.076 0.000 0.864 30 T HN 0.599 8.839 8.240 -0.000 0.000 0.427 31 Y N 2.031 122.321 120.300 -0.016 0.000 2.181 31 Y HA -0.176 4.393 4.550 0.032 0.000 0.288 31 Y C 2.319 178.190 175.900 -0.048 0.000 1.146 31 Y CA 1.602 59.689 58.100 -0.022 0.000 1.164 31 Y CB -0.131 38.321 38.460 -0.013 0.000 0.982 31 Y HN 0.196 8.476 8.280 -0.000 0.000 0.515 32 E N 0.093 120.330 120.200 0.061 0.000 2.072 32 E HA -0.189 4.180 4.350 0.032 0.000 0.191 32 E C 1.935 178.462 176.600 -0.122 0.000 0.985 32 E CA 1.438 57.803 56.400 -0.058 0.000 0.801 32 E CB -0.338 29.311 29.700 -0.086 0.000 0.750 32 E HN 0.468 8.828 8.360 -0.000 0.000 0.452 33 N N -0.081 118.568 118.700 -0.085 0.000 2.188 33 N HA -0.091 4.668 4.740 0.032 0.000 0.184 33 N C 1.627 177.082 175.510 -0.091 0.000 1.018 33 N CA 1.418 54.426 53.050 -0.069 0.000 0.858 33 N CB -0.188 38.283 38.487 -0.027 0.000 0.989 33 N HN 0.168 8.548 8.380 -0.000 0.000 0.426 34 T N 1.983 116.458 114.554 -0.132 0.000 2.759 34 T HA -0.127 4.243 4.350 0.032 0.000 0.269 34 T C 1.812 176.394 174.700 -0.195 0.000 1.042 34 T CA 1.112 63.113 62.100 -0.165 0.000 1.140 34 T CB -0.055 68.680 68.868 -0.221 0.000 0.864 34 T HN 0.243 8.483 8.240 -0.000 0.000 0.455 35 Q N 0.507 120.153 119.800 -0.257 0.000 2.119 35 Q HA -0.020 4.339 4.340 0.032 0.000 0.201 35 Q C 2.793 178.730 176.000 -0.105 0.000 0.972 35 Q CA 1.000 56.682 55.803 -0.200 0.000 0.847 35 Q CB -1.349 27.258 28.738 -0.218 0.000 0.903 35 Q HN 0.612 8.882 8.270 -0.000 0.000 0.433 36 C N 0.072 119.323 119.300 -0.081 0.000 2.413 36 C HA -0.070 4.409 4.460 0.032 0.000 0.276 36 C C 2.833 177.847 174.990 0.040 0.000 1.248 36 C CA 0.491 59.509 59.018 -0.001 0.000 1.742 36 C CB -1.159 26.561 27.740 -0.033 0.000 2.017 36 C HN 0.238 8.468 8.230 -0.000 0.000 0.481 37 V N 2.135 122.040 119.914 -0.015 0.000 2.515 37 V HA -0.162 3.977 4.120 0.032 0.000 0.250 37 V C 2.696 178.778 176.094 -0.020 0.000 1.058 37 V CA 2.313 64.609 62.300 -0.007 0.000 1.064 37 V CB -0.828 30.981 31.823 -0.024 0.000 0.675 37 V HN 0.787 8.977 8.190 -0.000 0.000 0.461 38 S N -1.114 114.557 115.700 -0.049 0.000 2.399 38 S HA -0.223 4.267 4.470 0.032 0.000 0.231 38 S C 1.901 176.466 174.600 -0.059 0.000 1.022 38 S CA 1.766 59.932 58.200 -0.057 0.000 0.983 38 S CB -0.830 62.324 63.200 -0.077 0.000 0.803 38 S HN 0.579 8.889 8.310 -0.000 0.000 0.480 39 C N 0.545 119.803 119.300 -0.071 0.000 2.524 39 C HA 0.294 4.773 4.460 0.032 0.000 0.284 39 C C 2.558 177.426 174.990 -0.202 0.000 1.346 39 C CA 0.158 59.088 59.018 -0.147 0.000 1.739 39 C CB -1.128 26.486 27.740 -0.209 0.000 2.119 39 C HN 0.658 8.888 8.230 -0.000 0.000 0.501 40 H N 0.268 119.314 119.070 -0.041 0.000 2.562 40 H HA 0.290 4.866 4.556 0.032 0.000 0.267 40 H C 1.380 176.669 175.328 -0.066 0.000 0.959 40 H CA 1.324 57.339 56.048 -0.054 0.000 1.204 40 H CB 0.148 29.866 29.762 -0.074 0.000 1.430 40 H HN 0.586 8.867 8.280 -0.000 0.000 0.545 41 G N 0.854 109.681 108.800 0.044 0.000 2.603 41 G HA2 -0.230 3.749 3.960 0.032 0.000 0.686 41 G HA3 -0.230 3.749 3.960 0.032 0.000 0.686 41 G C 0.282 175.181 174.900 -0.001 0.000 1.286 41 G CA -0.307 44.796 45.100 0.006 0.000 0.871 41 G HN 0.387 8.677 8.290 -0.000 0.000 0.568 42 T N -1.478 113.070 114.554 -0.010 0.000 2.667 42 T HA 0.425 4.795 4.350 0.032 0.000 0.305 42 T C 1.842 176.531 174.700 -0.019 0.000 1.022 42 T CA 0.608 62.703 62.100 -0.008 0.000 0.995 42 T CB 0.791 69.658 68.868 -0.001 0.000 1.026 42 T HN 1.541 9.781 8.240 -0.000 0.000 0.527 43 L N 1.176 122.397 121.223 -0.002 0.000 2.042 43 L HA 0.065 4.424 4.340 0.032 0.000 0.210 43 L C 2.837 179.709 176.870 0.003 0.000 1.076 43 L CA 2.349 57.195 54.840 0.009 0.000 0.749 43 L CB -1.481 40.605 42.059 0.045 0.000 0.893 43 L HN 0.937 9.167 8.230 -0.000 0.000 0.432 44 A N -1.111 121.711 122.820 0.004 0.000 1.969 44 A HA -0.198 4.141 4.320 0.032 0.000 0.218 44 A C 2.134 179.708 177.584 -0.017 0.000 1.169 44 A CA 1.688 53.725 52.037 0.001 0.000 0.635 44 A CB -0.496 18.506 19.000 0.004 0.000 0.810 44 A HN 0.607 8.757 8.150 -0.000 0.000 0.445 45 E N -0.366 119.818 120.200 -0.026 0.000 2.107 45 E HA -0.078 4.291 4.350 0.032 0.000 0.191 45 E C 1.892 178.455 176.600 -0.062 0.000 0.982 45 E CA 1.077 57.456 56.400 -0.035 0.000 0.809 45 E CB -0.223 29.462 29.700 -0.026 0.000 0.756 45 E HN 0.387 8.747 8.360 -0.000 0.000 0.459 46 V N 1.586 121.436 119.914 -0.106 0.000 2.407 46 V HA -0.244 3.895 4.120 0.032 0.000 0.248 46 V C 2.331 178.304 176.094 -0.202 0.000 1.055 46 V CA 1.737 63.905 62.300 -0.220 0.000 1.049 46 V CB -0.666 30.893 31.823 -0.440 0.000 0.662 46 V HN 0.307 8.497 8.190 -0.000 0.000 0.455 47 A N -0.484 122.283 122.820 -0.088 0.000 2.070 47 A HA -0.178 4.161 4.320 0.032 0.000 0.220 47 A C 2.115 179.689 177.584 -0.016 0.000 1.159 47 A CA 1.323 53.372 52.037 0.019 0.000 0.656 47 A CB -0.346 18.688 19.000 0.056 0.000 0.800 47 A HN 0.533 8.683 8.150 -0.000 0.000 0.453 48 E N -0.229 119.948 120.200 -0.039 0.000 2.338 48 E HA -0.118 4.251 4.350 0.032 0.000 0.197 48 E C 1.833 178.400 176.600 -0.055 0.000 1.007 48 E CA 1.567 57.940 56.400 -0.044 0.000 0.849 48 E CB -0.442 29.234 29.700 -0.040 0.000 0.774 48 E HN 0.832 9.192 8.360 -0.000 0.000 0.506 49 T N -2.111 112.408 114.554 -0.058 0.000 3.086 49 T HA 0.043 4.413 4.350 0.032 0.000 0.250 49 T C 1.189 175.854 174.700 -0.059 0.000 1.074 49 T CA 0.539 62.603 62.100 -0.059 0.000 0.988 49 T CB -0.026 68.809 68.868 -0.055 0.000 0.988 49 T HN 0.032 8.272 8.240 -0.000 0.000 0.530 50 T N -0.899 113.631 114.554 -0.041 0.000 3.487 50 T HA 0.417 4.786 4.350 0.032 0.000 0.287 50 T C -0.239 174.377 174.700 -0.140 0.000 1.004 50 T CA -0.835 61.246 62.100 -0.032 0.000 0.977 50 T CB -0.166 68.804 68.868 0.169 0.000 1.180 50 T HN 0.222 8.462 8.240 -0.000 0.000 0.490 51 K N 2.049 122.318 120.400 -0.217 0.000 2.298 51 K HA 0.370 4.709 4.320 0.032 0.000 0.280 51 K C -0.029 176.256 176.600 -0.526 0.000 1.032 51 K CA -0.456 55.671 56.287 -0.267 0.000 0.958 51 K CB 0.526 32.914 32.500 -0.187 0.000 0.978 51 K HN 0.465 8.715 8.250 -0.000 0.000 0.472 52 H N 1.040 119.897 119.070 -0.355 0.000 2.731 52 H HA 0.050 4.626 4.556 0.033 0.000 0.368 52 H C 0.570 175.660 175.328 -0.397 0.000 1.168 52 H CA -0.597 55.164 56.048 -0.478 0.000 1.181 52 H CB 1.979 31.142 29.762 -0.998 0.000 1.743 52 H HN 0.747 9.027 8.280 -0.000 0.000 0.547 53 E N 0.245 120.308 120.200 -0.228 0.000 2.038 53 E HA -0.196 4.173 4.350 0.032 0.000 0.195 53 E C 0.361 176.665 176.600 -0.493 0.000 1.000 53 E CA 1.407 57.575 56.400 -0.387 0.000 0.803 53 E CB 0.239 29.657 29.700 -0.470 0.000 0.750 53 E HN 0.507 8.867 8.360 -0.000 0.000 0.448 54 H N -2.281 116.781 119.070 -0.014 0.000 2.592 54 H HA 0.147 4.723 4.556 0.033 0.000 0.279 54 H C -0.729 174.628 175.328 0.048 0.000 1.089 54 H CA 0.131 56.204 56.048 0.042 0.000 1.150 54 H CB 0.282 30.108 29.762 0.107 0.000 1.575 54 H HN 0.202 8.482 8.280 -0.000 0.000 0.547 55 Y N -1.236 118.995 120.300 -0.114 0.000 2.638 55 Y HA 0.495 5.066 4.550 0.034 0.000 0.335 55 Y C -1.514 174.290 175.900 -0.160 0.000 1.155 55 Y CA -1.398 56.501 58.100 -0.335 0.000 1.046 55 Y CB 1.477 39.339 38.460 -0.996 0.000 1.303 55 Y HN -0.086 8.194 8.280 -0.000 0.000 0.460 56 N N 0.568 119.243 118.700 -0.040 0.000 2.648 56 N HA 0.485 5.244 4.740 0.032 0.000 0.272 56 N C -0.077 175.453 175.510 0.033 0.000 1.118 56 N CA 0.114 53.183 53.050 0.031 0.000 0.973 56 N CB 2.006 40.482 38.487 -0.018 0.000 1.565 56 N HN 1.024 9.404 8.380 -0.000 0.000 0.542 57 A N 2.085 124.917 122.820 0.021 0.000 1.978 57 A HA -0.165 4.174 4.320 0.032 0.000 0.220 57 A C 1.012 178.305 177.584 -0.485 0.000 1.170 57 A CA 1.497 53.305 52.037 -0.381 0.000 0.636 57 A CB -0.624 17.842 19.000 -0.889 0.000 0.810 57 A HN 0.848 8.998 8.150 -0.000 0.000 0.448 58 H N -1.479 117.548 119.070 -0.071 0.000 2.529 58 H HA 0.574 5.150 4.556 0.033 0.000 0.277 58 H C 0.306 175.600 175.328 -0.056 0.000 1.004 58 H CA 0.487 56.498 56.048 -0.063 0.000 1.167 58 H CB 0.265 30.001 29.762 -0.043 0.000 1.445 58 H HN 0.452 8.732 8.280 -0.000 0.000 0.554 59 A N 1.040 123.857 122.820 -0.005 0.000 3.007 59 A HA 0.465 4.804 4.320 0.032 0.000 0.314 59 A C -0.087 177.467 177.584 -0.050 0.000 1.153 59 A CA -0.526 51.504 52.037 -0.011 0.000 0.780 59 A CB 0.189 19.193 19.000 0.007 0.000 1.258 59 A HN 0.270 8.420 8.150 -0.000 0.000 0.460 60 S N 0.414 116.054 115.700 -0.099 0.000 2.798 60 S HA 0.534 5.024 4.470 0.032 0.000 0.312 60 S C 0.791 175.344 174.600 -0.078 0.000 1.122 60 S CA 0.152 58.249 58.200 -0.172 0.000 0.949 60 S CB 0.393 63.328 63.200 -0.442 0.000 1.235 60 S HN 0.985 9.295 8.310 -0.000 0.000 0.552 61 H N -0.840 118.256 119.070 0.045 0.000 2.556 61 H HA 0.384 4.961 4.556 0.035 0.000 0.268 61 H C -0.328 175.152 175.328 0.254 0.000 0.996 61 H CA -0.268 55.858 56.048 0.130 0.000 1.157 61 H CB -0.531 29.317 29.762 0.144 0.000 1.355 61 H HN 0.274 8.554 8.280 -0.000 0.000 0.597 62 F N 3.799 123.668 119.950 -0.135 0.000 2.543 62 F HA 0.216 4.760 4.527 0.028 0.000 0.375 62 F C -1.622 174.148 175.800 -0.052 0.000 1.075 62 F CA -3.576 54.385 58.000 -0.067 0.000 1.225 62 F CB 0.323 39.247 39.000 -0.127 0.000 1.099 62 F HN 0.201 8.501 8.300 -0.000 0.000 0.561 63 P HA 0.473 4.893 4.420 -0.000 0.000 0.276 63 P C 0.182 177.378 177.300 -0.173 0.000 1.261 63 P CA -0.007 63.077 63.100 -0.027 0.000 0.800 63 P CB 1.167 32.837 31.700 -0.049 0.000 1.066 64 G N 0.015 108.631 108.800 -0.307 0.000 2.681 64 G HA2 -0.147 3.832 3.960 0.032 0.000 0.220 64 G HA3 -0.147 3.832 3.960 0.032 0.000 0.220 64 G C -1.043 173.627 174.900 -0.384 0.000 1.353 64 G CA -0.554 44.102 45.100 -0.741 0.000 0.872 64 G HN 0.588 8.878 8.290 -0.000 0.000 0.557 65 E N -0.592 119.377 120.200 -0.386 0.000 2.070 65 E HA 0.488 4.857 4.350 0.032 0.000 0.261 65 E C 0.422 176.989 176.600 -0.054 0.000 0.926 65 E CA -0.201 56.148 56.400 -0.086 0.000 0.760 65 E CB 1.304 31.037 29.700 0.055 0.000 1.133 65 E HN 0.984 9.344 8.360 -0.000 0.000 0.420 66 V N 2.400 122.298 119.914 -0.025 0.000 2.446 66 V HA 0.335 4.474 4.120 0.032 0.000 0.276 66 V C 0.916 177.029 176.094 0.030 0.000 1.030 66 V CA -0.321 61.984 62.300 0.008 0.000 1.033 66 V CB 0.370 32.222 31.823 0.047 0.000 0.993 66 V HN 0.852 9.042 8.190 -0.000 0.000 0.477 67 A N 4.512 127.352 122.820 0.033 0.000 2.462 67 A HA 0.135 4.474 4.320 0.032 0.000 0.243 67 A C 1.423 179.047 177.584 0.067 0.000 1.076 67 A CA -0.102 51.963 52.037 0.046 0.000 0.773 67 A CB 0.085 19.114 19.000 0.047 0.000 1.010 67 A HN 1.037 9.187 8.150 -0.000 0.000 0.493 68 C N 0.730 120.072 119.300 0.071 0.000 2.413 68 C HA -0.125 4.354 4.460 0.032 0.000 0.277 68 C C 2.748 177.833 174.990 0.158 0.000 1.265 68 C CA 1.544 60.637 59.018 0.126 0.000 1.752 68 C CB -1.710 26.067 27.740 0.061 0.000 1.998 68 C HN 0.974 9.204 8.230 -0.000 0.000 0.489 69 T N -0.888 113.724 114.554 0.097 0.000 3.163 69 T HA -0.055 4.314 4.350 0.032 0.000 0.260 69 T C 1.456 176.235 174.700 0.130 0.000 1.156 69 T CA 1.296 63.459 62.100 0.104 0.000 1.072 69 T CB -0.451 68.439 68.868 0.036 0.000 0.937 69 T HN 0.500 8.740 8.240 -0.000 0.000 0.528 70 S N 0.334 116.103 115.700 0.115 0.000 2.399 70 S HA -0.060 4.429 4.470 0.032 0.000 0.231 70 S C 1.885 176.573 174.600 0.147 0.000 1.022 70 S CA 1.166 59.438 58.200 0.120 0.000 0.983 70 S CB -0.370 62.866 63.200 0.060 0.000 0.803 70 S HN 0.780 9.090 8.310 -0.000 0.000 0.480 71 C N -0.886 118.463 119.300 0.082 0.000 3.294 71 C HA 0.278 4.757 4.460 0.032 0.000 0.441 71 C C 0.400 175.334 174.990 -0.093 0.000 1.364 71 C CA -0.585 58.427 59.018 -0.009 0.000 2.059 71 C CB -0.336 27.300 27.740 -0.172 0.000 2.925 71 C HN 0.502 8.732 8.230 -0.000 0.000 0.633 72 H N 1.807 120.925 119.070 0.079 0.000 2.724 72 H HA 0.388 4.963 4.556 0.033 0.000 0.278 72 H C -0.133 175.233 175.328 0.064 0.000 1.159 72 H CA 0.258 56.349 56.048 0.070 0.000 1.254 72 H CB 0.901 30.689 29.762 0.042 0.000 1.412 72 H HN 0.267 8.547 8.280 -0.000 0.000 0.488 73 S N 0.993 116.796 115.700 0.172 0.000 2.652 73 S HA 0.357 4.846 4.470 0.032 0.000 0.270 73 S C 1.305 175.949 174.600 0.074 0.000 1.243 73 S CA -0.171 58.109 58.200 0.132 0.000 0.999 73 S CB 1.817 65.106 63.200 0.148 0.000 0.973 73 S HN 0.775 9.085 8.310 -0.000 0.000 0.544 74 A N 0.855 123.683 122.820 0.013 0.000 1.901 74 A HA 0.084 4.423 4.320 0.032 0.000 0.210 74 A C 1.312 178.745 177.584 -0.253 0.000 1.208 74 A CA 0.412 52.348 52.037 -0.168 0.000 0.644 74 A CB -0.511 18.302 19.000 -0.312 0.000 0.863 74 A HN 0.876 9.026 8.150 -0.000 0.000 0.454 75 H N 0.356 119.457 119.070 0.051 0.000 2.526 75 H HA 0.175 4.750 4.556 0.032 0.000 0.274 75 H C -0.290 175.062 175.328 0.040 0.000 0.999 75 H CA 0.898 56.972 56.048 0.043 0.000 1.157 75 H CB 0.155 29.953 29.762 0.061 0.000 1.407 75 H HN 0.807 9.087 8.280 -0.000 0.000 0.568 76 E N 0.151 120.422 120.200 0.118 0.000 2.412 76 E HA 0.347 4.716 4.350 0.032 0.000 0.279 76 E C -1.092 175.563 176.600 0.091 0.000 0.984 76 E CA -1.020 55.438 56.400 0.097 0.000 0.788 76 E CB 1.927 31.689 29.700 0.104 0.000 1.277 76 E HN -0.121 8.239 8.360 -0.000 0.000 0.455 77 K N 0.754 121.213 120.400 0.098 0.000 2.380 77 K HA 0.268 4.607 4.320 0.032 0.000 0.267 77 K C -0.267 176.396 176.600 0.105 0.000 0.990 77 K CA 0.450 56.813 56.287 0.127 0.000 0.946 77 K CB 0.736 33.311 32.500 0.126 0.000 0.937 77 K HN 0.654 8.904 8.250 -0.000 0.000 0.491 78 S N 1.164 116.931 115.700 0.111 0.000 2.651 78 S HA 0.590 5.079 4.470 0.032 0.000 0.279 78 S C -0.662 173.987 174.600 0.083 0.000 1.148 78 S CA -1.183 57.071 58.200 0.089 0.000 0.837 78 S CB 1.174 64.436 63.200 0.104 0.000 1.138 78 S HN 0.427 8.737 8.310 -0.000 0.000 0.478 79 M N 1.469 121.129 119.600 0.100 0.000 2.423 79 M HA 0.491 4.990 4.480 0.032 0.000 0.335 79 M C -0.975 175.463 176.300 0.230 0.000 1.177 79 M CA -0.973 54.432 55.300 0.175 0.000 1.038 79 M CB 1.811 34.517 32.600 0.178 0.000 1.641 79 M HN 0.466 8.756 8.290 -0.000 0.000 0.455 80 V N 2.363 122.411 119.914 0.224 0.000 2.455 80 V HA -0.014 4.125 4.120 0.032 0.000 0.273 80 V C 0.515 176.738 176.094 0.215 0.000 1.045 80 V CA -0.047 62.329 62.300 0.126 0.000 0.976 80 V CB 0.265 32.109 31.823 0.036 0.000 0.993 80 V HN 0.796 8.986 8.190 -0.000 0.000 0.475 81 Y N 3.566 123.912 120.300 0.077 0.000 2.274 81 Y HA -0.231 4.338 4.550 0.032 0.000 0.290 81 Y C 2.335 178.110 175.900 -0.207 0.000 1.145 81 Y CA 2.150 60.247 58.100 -0.006 0.000 1.203 81 Y CB 0.063 38.601 38.460 0.131 0.000 0.984 81 Y HN 0.699 8.979 8.280 -0.000 0.000 0.533 82 C N 0.189 119.523 119.300 0.056 0.000 2.409 82 C HA -0.180 4.299 4.460 0.032 0.000 0.284 82 C C 1.921 176.900 174.990 -0.018 0.000 1.354 82 C CA 0.960 60.030 59.018 0.087 0.000 1.787 82 C CB -1.062 26.845 27.740 0.279 0.000 1.900 82 C HN 0.520 8.750 8.230 -0.000 0.000 0.520 83 D N 1.207 121.536 120.400 -0.117 0.000 2.371 83 D HA -0.053 4.606 4.640 0.032 0.000 0.221 83 D C 2.150 178.139 176.300 -0.519 0.000 0.986 83 D CA 1.248 55.148 54.000 -0.166 0.000 0.899 83 D CB -0.276 40.547 40.800 0.038 0.000 0.902 83 D HN 0.681 9.051 8.370 -0.000 0.000 0.530 84 S N -1.506 113.586 115.700 -1.013 0.000 2.515 84 S HA -0.064 4.425 4.470 0.032 0.000 0.231 84 S C 1.723 175.991 174.600 -0.554 0.000 0.987 84 S CA 0.319 57.806 58.200 -1.188 0.000 0.936 84 S CB -0.083 62.131 63.200 -1.644 0.000 0.766 84 S HN 0.283 8.593 8.310 -0.000 0.000 0.528 85 C N -0.301 118.740 119.300 -0.431 0.000 3.685 85 C HA 0.469 4.949 4.460 0.032 0.000 0.513 85 C C 0.485 175.175 174.990 -0.500 0.000 1.448 85 C CA -0.501 58.267 59.018 -0.418 0.000 2.275 85 C CB -0.368 27.103 27.740 -0.449 0.000 3.373 85 C HN 0.575 8.805 8.230 -0.000 0.000 0.627 86 H N -0.121 118.783 119.070 -0.278 0.000 2.797 86 H HA 0.433 5.011 4.556 0.037 0.000 0.362 86 H C -0.602 174.462 175.328 -0.439 0.000 1.183 86 H CA -0.135 55.635 56.048 -0.463 0.000 1.197 86 H CB 1.576 30.876 29.762 -0.770 0.000 1.835 86 H HN -0.087 8.193 8.280 -0.000 0.000 0.567 87 S N 1.571 117.019 115.700 -0.421 0.000 2.272 87 S HA 0.258 4.747 4.470 0.032 0.000 0.207 87 S C -0.351 173.989 174.600 -0.434 0.000 1.336 87 S CA -0.499 57.510 58.200 -0.317 0.000 1.259 87 S CB -0.600 62.475 63.200 -0.208 0.000 1.130 87 S HN 0.274 8.584 8.310 -0.000 0.000 0.444 88 F N 1.484 121.143 119.950 -0.486 0.000 2.444 88 F HA 0.204 4.753 4.527 0.036 0.000 0.331 88 F C 1.117 176.426 175.800 -0.818 0.000 1.167 88 F CA -0.651 56.784 58.000 -0.943 0.000 1.262 88 F CB 0.433 38.433 39.000 -1.667 0.000 1.196 88 F HN 0.118 8.418 8.300 -0.000 0.000 0.583 89 D N 2.748 122.847 120.400 -0.502 0.000 2.383 89 D HA 0.193 4.852 4.640 0.032 0.000 0.245 89 D C -0.902 175.290 176.300 -0.180 0.000 1.263 89 D CA 0.417 54.280 54.000 -0.229 0.000 0.936 89 D CB -0.361 40.390 40.800 -0.082 0.000 1.053 89 D HN 0.219 8.589 8.370 -0.000 0.000 0.507 90 F N 1.546 121.524 119.950 0.046 0.000 2.618 90 F HA 0.400 4.946 4.527 0.031 0.000 0.332 90 F C 1.257 177.090 175.800 0.056 0.000 1.061 90 F CA -1.094 56.948 58.000 0.070 0.000 0.974 90 F CB 1.604 40.641 39.000 0.062 0.000 1.310 90 F HN 0.108 8.408 8.300 -0.000 0.000 0.491 91 N N 2.359 121.234 118.700 0.291 0.000 2.687 91 N HA 0.143 4.902 4.740 0.032 0.000 0.275 91 N C -1.272 174.281 175.510 0.072 0.000 1.789 91 N CA -0.091 53.044 53.050 0.141 0.000 0.806 91 N CB 0.785 39.340 38.487 0.114 0.000 1.256 91 N HN 0.603 8.983 8.380 -0.000 0.000 0.500 92 M N 1.829 121.456 119.600 0.045 0.000 2.219 92 M HA 0.307 4.806 4.480 0.032 0.000 0.353 92 M C -2.192 174.077 176.300 -0.050 0.000 1.304 92 M CA -0.748 54.546 55.300 -0.010 0.000 1.115 92 M CB 0.591 33.143 32.600 -0.080 0.000 1.664 92 M HN 0.000 8.290 8.290 -0.000 0.000 0.459 93 P HA -0.013 4.407 4.420 -0.000 0.000 0.266 93 P C -1.257 175.871 177.300 -0.287 0.000 1.195 93 P CA 0.424 63.294 63.100 -0.384 0.000 0.768 93 P CB 0.008 31.434 31.700 -0.457 0.000 0.838 94 Y N -1.410 118.909 120.300 0.031 0.000 3.589 94 Y HA -0.216 4.353 4.550 0.032 0.000 0.218 94 Y C 0.919 176.848 175.900 0.047 0.000 1.234 94 Y CA 0.287 58.414 58.100 0.045 0.000 1.576 94 Y CB -2.593 35.901 38.460 0.057 0.000 1.487 94 Y HN 0.428 8.708 8.280 -0.000 0.000 0.616 95 A N 0.863 123.730 122.820 0.078 0.000 2.287 95 A HA 0.770 5.109 4.320 0.032 0.000 0.273 95 A C 0.583 178.216 177.584 0.081 0.000 1.091 95 A CA 0.069 52.152 52.037 0.075 0.000 0.817 95 A CB 0.909 19.940 19.000 0.051 0.000 1.069 95 A HN 0.434 8.584 8.150 -0.000 0.000 0.492 96 K N 0.186 120.633 120.400 0.079 0.000 2.509 96 K HA 0.556 4.895 4.320 0.032 0.000 0.266 96 K C -0.784 175.860 176.600 0.074 0.000 0.987 96 K CA -0.942 55.384 56.287 0.065 0.000 0.868 96 K CB 1.432 33.961 32.500 0.049 0.000 1.421 96 K HN 0.536 8.786 8.250 -0.000 0.000 0.444 97 K N 1.386 121.824 120.400 0.063 0.000 2.355 97 K HA -0.017 4.322 4.320 0.032 0.000 0.270 97 K C -0.636 176.021 176.600 0.095 0.000 1.003 97 K CA -0.638 55.704 56.287 0.091 0.000 0.957 97 K CB 0.521 33.059 32.500 0.064 0.000 0.939 97 K HN 0.634 8.884 8.250 -0.000 0.000 0.482 98 W N 6.424 127.726 121.300 0.005 0.000 2.251 98 W HA 0.224 4.905 4.660 0.035 0.000 0.327 98 W C -1.543 174.967 176.519 -0.016 0.000 1.361 98 W CA -0.274 57.064 57.345 -0.011 0.000 1.234 98 W CB 0.286 29.729 29.460 -0.028 0.000 1.212 98 W HN 0.411 8.591 8.180 -0.000 0.000 0.557 99 L N 7.034 127.768 121.223 -0.814 0.000 2.543 99 L HA 0.358 4.718 4.340 0.032 0.000 0.265 99 L C -1.231 175.187 176.870 -0.753 0.000 0.945 99 L CA -0.614 53.899 54.840 -0.545 0.000 0.869 99 L CB 1.596 43.507 42.059 -0.247 0.000 1.294 99 L HN 0.451 8.681 8.230 -0.000 0.000 0.405 100 R N 3.289 123.511 120.500 -0.465 0.000 2.229 100 R HA 0.714 5.073 4.340 0.032 0.000 0.328 100 R C -0.917 175.291 176.300 -0.154 0.000 1.009 100 R CA 0.584 56.503 56.100 -0.303 0.000 0.864 100 R CB 0.861 31.148 30.300 -0.022 0.000 1.085 100 R HN 0.756 9.026 8.270 -0.000 0.000 0.453 101 D N 3.256 123.567 120.400 -0.147 0.000 2.405 101 D HA 0.194 4.853 4.640 0.032 0.000 0.264 101 D C -0.854 175.406 176.300 -0.067 0.000 1.240 101 D CA -0.593 53.353 54.000 -0.089 0.000 0.893 101 D CB 0.599 41.343 40.800 -0.094 0.000 1.198 101 D HN 0.627 8.997 8.370 -0.000 0.000 0.514 102 E N 1.921 122.096 120.200 -0.041 0.000 2.133 102 E HA 0.517 4.886 4.350 0.032 0.000 0.274 102 E C -2.319 174.270 176.600 -0.018 0.000 0.930 102 E CA -1.630 54.752 56.400 -0.029 0.000 0.770 102 E CB 1.517 31.209 29.700 -0.012 0.000 1.104 102 E HN 0.229 8.589 8.360 -0.000 0.000 0.403 103 P HA -0.005 4.415 4.420 -0.000 0.000 0.267 103 P C -0.426 176.871 177.300 -0.006 0.000 1.200 103 P CA -0.131 62.963 63.100 -0.010 0.000 0.772 103 P CB 0.549 32.246 31.700 -0.005 0.000 0.855 104 T N -0.746 113.805 114.554 -0.005 0.000 2.766 104 T HA 0.147 4.517 4.350 0.032 0.000 0.295 104 T C 1.496 176.195 174.700 -0.002 0.000 1.024 104 T CA -0.657 61.439 62.100 -0.007 0.000 1.018 104 T CB 0.308 69.168 68.868 -0.014 0.000 1.002 104 T HN 0.105 8.345 8.240 -0.000 0.000 0.532 105 I N 0.933 121.500 120.570 -0.005 0.000 2.264 105 I HA -0.136 4.053 4.170 0.032 0.000 0.248 105 I C 2.945 179.060 176.117 -0.003 0.000 1.111 105 I CA 1.739 63.039 61.300 0.000 0.000 1.382 105 I CB -2.131 35.864 38.000 -0.007 0.000 1.060 105 I HN 0.891 9.101 8.210 -0.000 0.000 0.418 106 A N 0.523 123.335 122.820 -0.013 0.000 1.902 106 A HA -0.199 4.141 4.320 0.032 0.000 0.217 106 A C 2.235 179.813 177.584 -0.010 0.000 1.181 106 A CA 1.431 53.458 52.037 -0.016 0.000 0.623 106 A CB -0.603 18.383 19.000 -0.023 0.000 0.818 106 A HN 0.460 8.610 8.150 -0.000 0.000 0.443 107 E N -0.191 120.005 120.200 -0.006 0.000 2.204 107 E HA -0.084 4.285 4.350 0.032 0.000 0.195 107 E C 1.510 178.115 176.600 0.009 0.000 0.990 107 E CA 0.670 57.069 56.400 -0.001 0.000 0.821 107 E CB -0.240 29.458 29.700 -0.002 0.000 0.750 107 E HN 0.615 8.975 8.360 -0.000 0.000 0.477 108 L N 0.348 121.583 121.223 0.021 0.000 2.622 108 L HA -0.023 4.336 4.340 0.032 0.000 0.233 108 L C 2.241 179.124 176.870 0.022 0.000 1.156 108 L CA 0.013 54.882 54.840 0.048 0.000 0.866 108 L CB -0.299 41.812 42.059 0.088 0.000 0.980 108 L HN 0.138 8.368 8.230 -0.000 0.000 0.448 109 A N 1.238 124.056 122.820 -0.004 0.000 2.125 109 A HA -0.213 4.126 4.320 0.032 0.000 0.219 109 A C 2.354 179.923 177.584 -0.025 0.000 1.156 109 A CA 1.578 53.600 52.037 -0.025 0.000 0.671 109 A CB -0.389 18.596 19.000 -0.025 0.000 0.794 109 A HN 0.564 8.714 8.150 -0.000 0.000 0.459 110 K N -0.438 119.957 120.400 -0.009 0.000 2.280 110 K HA -0.151 4.188 4.320 0.032 0.000 0.202 110 K C -0.406 176.190 176.600 -0.007 0.000 1.047 110 K CA 1.562 57.846 56.287 -0.005 0.000 0.942 110 K CB -0.222 32.282 32.500 0.006 0.000 0.739 110 K HN 0.208 8.458 8.250 -0.000 0.000 0.457 111 D N 1.334 121.728 120.400 -0.010 0.000 2.706 111 D HA 0.075 4.734 4.640 0.032 0.000 0.236 111 D C 1.461 177.688 176.300 -0.122 0.000 1.231 111 D CA 0.294 54.275 54.000 -0.032 0.000 0.828 111 D CB 0.888 41.711 40.800 0.039 0.000 1.015 111 D HN 0.398 8.768 8.370 -0.000 0.000 0.484 112 K N 0.519 120.865 120.400 -0.090 0.000 2.034 112 K HA -0.237 4.102 4.320 0.032 0.000 0.214 112 K C 2.125 178.663 176.600 -0.103 0.000 1.051 112 K CA 1.936 58.163 56.287 -0.100 0.000 0.931 112 K CB -1.060 31.402 32.500 -0.064 0.000 0.715 112 K HN 0.255 8.505 8.250 -0.000 0.000 0.446 113 S N 0.302 115.961 115.700 -0.069 0.000 2.368 113 S HA -0.189 4.300 4.470 0.032 0.000 0.225 113 S C 2.142 176.705 174.600 -0.060 0.000 1.030 113 S CA 1.846 60.016 58.200 -0.051 0.000 0.999 113 S CB -0.214 62.972 63.200 -0.023 0.000 0.844 113 S HN 0.685 8.995 8.310 -0.000 0.000 0.459 114 E N 0.301 120.457 120.200 -0.073 0.000 2.106 114 E HA -0.062 4.307 4.350 0.032 0.000 0.192 114 E C 2.525 179.010 176.600 -0.192 0.000 0.984 114 E CA 0.893 57.256 56.400 -0.062 0.000 0.806 114 E CB -0.045 29.677 29.700 0.037 0.000 0.750 114 E HN 0.519 8.879 8.360 -0.000 0.000 0.458 115 R N 0.460 120.731 120.500 -0.381 0.000 2.075 115 R HA -0.136 4.223 4.340 0.032 0.000 0.232 115 R C 2.374 178.556 176.300 -0.197 0.000 1.126 115 R CA 1.235 57.077 56.100 -0.430 0.000 0.963 115 R CB -0.156 29.847 30.300 -0.496 0.000 0.858 115 R HN 0.177 8.447 8.270 -0.000 0.000 0.435 116 Q N 0.009 119.725 119.800 -0.141 0.000 2.119 116 Q HA -0.090 4.269 4.340 0.032 0.000 0.201 116 Q C 2.169 178.144 176.000 -0.043 0.000 0.972 116 Q CA 1.513 57.263 55.803 -0.088 0.000 0.847 116 Q CB -0.051 28.645 28.738 -0.070 0.000 0.903 116 Q HN 0.386 8.656 8.270 -0.000 0.000 0.433 117 A N 0.711 123.518 122.820 -0.021 0.000 1.930 117 A HA -0.106 4.233 4.320 0.032 0.000 0.217 117 A C 2.229 179.859 177.584 0.077 0.000 1.175 117 A CA 1.506 53.559 52.037 0.028 0.000 0.627 117 A CB -0.722 18.300 19.000 0.036 0.000 0.815 117 A HN 0.408 8.558 8.150 -0.000 0.000 0.443 118 A N -0.230 122.641 122.820 0.084 0.000 1.898 118 A HA -0.007 4.333 4.320 0.032 0.000 0.216 118 A C 2.102 179.830 177.584 0.240 0.000 1.181 118 A CA 1.428 53.584 52.037 0.198 0.000 0.620 118 A CB -0.572 18.563 19.000 0.225 0.000 0.819 118 A HN 0.461 8.611 8.150 -0.000 0.000 0.442 119 L N -0.924 120.323 121.223 0.041 0.000 2.291 119 L HA -0.101 4.258 4.340 0.032 0.000 0.214 119 L C 2.790 179.637 176.870 -0.037 0.000 1.120 119 L CA 0.738 55.484 54.840 -0.156 0.000 0.799 119 L CB -0.344 41.553 42.059 -0.271 0.000 0.925 119 L HN 0.440 8.670 8.230 -0.000 0.000 0.446 120 A N -1.115 121.735 122.820 0.049 0.000 2.167 120 A HA 0.054 4.393 4.320 0.032 0.000 0.214 120 A C 1.383 179.064 177.584 0.162 0.000 1.151 120 A CA 0.268 52.351 52.037 0.076 0.000 0.735 120 A CB -0.111 18.916 19.000 0.045 0.000 0.802 120 A HN 0.299 8.449 8.150 -0.000 0.000 0.467 121 S N -0.416 115.432 115.700 0.248 0.000 2.645 121 S HA 0.573 5.062 4.470 0.032 0.000 0.266 121 S C 0.610 175.414 174.600 0.341 0.000 1.258 121 S CA -0.184 58.167 58.200 0.251 0.000 0.990 121 S CB 1.087 64.426 63.200 0.232 0.000 0.967 121 S HN 0.682 8.992 8.310 -0.000 0.000 0.556 122 A N 2.771 125.693 122.820 0.171 0.000 2.466 122 A HA 0.417 4.756 4.320 0.032 0.000 0.238 122 A C -2.195 175.287 177.584 -0.171 0.000 1.074 122 A CA -1.101 50.977 52.037 0.068 0.000 0.774 122 A CB -0.711 18.278 19.000 -0.018 0.000 1.015 122 A HN 0.551 8.701 8.150 -0.000 0.000 0.498 123 P HA -0.030 4.390 4.420 -0.000 0.000 0.268 123 P C 0.420 177.424 177.300 -0.493 0.000 1.204 123 P CA 0.219 62.585 63.100 -1.222 0.000 0.768 123 P CB 0.380 31.230 31.700 -1.418 0.000 0.842 124 H N 1.921 120.766 119.070 -0.375 0.000 2.423 124 H HA -0.045 4.530 4.556 0.032 0.000 0.297 124 H C -0.442 174.774 175.328 -0.187 0.000 1.075 124 H CA 1.316 57.231 56.048 -0.222 0.000 1.342 124 H CB 0.472 30.086 29.762 -0.245 0.000 1.395 124 H HN 0.499 8.779 8.280 -0.000 0.000 0.530 125 D N -1.117 119.230 120.400 -0.089 0.000 2.661 125 D HA 0.255 4.914 4.640 0.032 0.000 0.228 125 D C -1.096 175.148 176.300 -0.093 0.000 1.210 125 D CA -0.491 53.468 54.000 -0.068 0.000 0.826 125 D CB 2.326 43.160 40.800 0.058 0.000 1.542 125 D HN -0.129 8.241 8.370 -0.000 0.000 0.447 126 T N 0.857 115.370 114.554 -0.069 0.000 2.930 126 T HA 0.586 4.955 4.350 0.032 0.000 0.313 126 T C -0.417 174.281 174.700 -0.003 0.000 1.019 126 T CA -0.602 61.471 62.100 -0.045 0.000 1.004 126 T CB 0.690 69.522 68.868 -0.059 0.000 0.987 126 T HN 0.334 8.574 8.240 -0.000 0.000 0.456 127 V N 0.447 120.376 119.914 0.026 0.000 3.119 127 V HA 0.687 4.826 4.120 0.032 0.000 0.311 127 V C -0.037 176.089 176.094 0.054 0.000 1.259 127 V CA -0.807 61.515 62.300 0.038 0.000 1.067 127 V CB 1.825 33.676 31.823 0.046 0.000 1.123 127 V HN 0.447 8.637 8.190 -0.000 0.000 0.463 128 D N -0.055 120.378 120.400 0.055 0.000 2.197 128 D HA 0.205 4.864 4.640 0.032 0.000 0.212 128 D C 0.377 176.729 176.300 0.086 0.000 0.963 128 D CA 1.357 55.398 54.000 0.068 0.000 0.864 128 D CB 0.650 41.483 40.800 0.055 0.000 1.009 128 D HN 0.380 8.750 8.370 -0.000 0.000 0.479 129 V N 1.130 121.086 119.914 0.071 0.000 2.760 129 V HA 0.342 4.481 4.120 0.032 0.000 0.309 129 V C -0.365 175.768 176.094 0.063 0.000 1.077 129 V CA -0.864 61.477 62.300 0.069 0.000 0.910 129 V CB 2.988 34.835 31.823 0.039 0.000 1.008 129 V HN -0.245 7.945 8.190 -0.000 0.000 0.424 130 V N 4.586 124.541 119.914 0.070 0.000 2.417 130 V HA 0.518 4.657 4.120 0.032 0.000 0.291 130 V C -0.279 175.842 176.094 0.044 0.000 1.024 130 V CA -0.599 61.736 62.300 0.060 0.000 0.861 130 V CB 1.954 33.820 31.823 0.072 0.000 0.985 130 V HN 0.618 8.808 8.190 -0.000 0.000 0.436 131 V N 5.538 125.467 119.914 0.024 0.000 2.435 131 V HA 0.431 4.570 4.120 0.032 0.000 0.290 131 V C -0.131 175.960 176.094 -0.005 0.000 1.030 131 V CA -0.591 61.715 62.300 0.010 0.000 0.881 131 V CB 1.880 33.699 31.823 -0.007 0.000 0.983 131 V HN 0.605 8.795 8.190 -0.000 0.000 0.445 132 V N 4.020 123.935 119.914 0.003 0.000 2.311 132 V HA 0.887 5.027 4.120 0.032 0.000 0.275 132 V C 0.513 176.598 176.094 -0.014 0.000 1.022 132 V CA 0.217 62.514 62.300 -0.005 0.000 0.830 132 V CB 0.563 32.392 31.823 0.009 0.000 1.012 132 V HN 1.286 9.476 8.190 -0.000 0.000 0.452 133 G N 3.532 112.307 108.800 -0.040 0.000 3.014 133 G HA2 0.026 4.006 3.960 0.032 0.000 0.683 133 G HA3 0.026 4.006 3.960 0.032 0.000 0.683 133 G C -0.112 174.722 174.900 -0.110 0.000 1.271 133 G CA -0.278 44.795 45.100 -0.044 0.000 0.843 133 G HN 1.189 9.479 8.290 -0.000 0.000 0.612 134 S N 1.202 116.825 115.700 -0.128 0.000 2.526 134 S HA 0.609 5.098 4.470 0.032 0.000 0.247 134 S C 1.251 175.861 174.600 0.018 0.000 1.076 134 S CA 0.682 58.725 58.200 -0.262 0.000 1.105 134 S CB 0.514 63.533 63.200 -0.301 0.000 0.793 134 S HN 1.789 10.100 8.310 -0.000 0.000 0.458 135 G N 0.909 109.751 108.800 0.070 0.000 2.509 135 G HA2 0.502 4.481 3.960 0.032 0.000 0.269 135 G HA3 0.502 4.481 3.960 0.032 0.000 0.269 135 G C 0.977 176.030 174.900 0.254 0.000 1.416 135 G CA -0.337 44.858 45.100 0.159 0.000 1.052 135 G HN 0.408 8.698 8.290 -0.000 0.000 0.542 136 G N -0.476 108.449 108.800 0.209 0.000 2.408 136 G HA2 0.100 4.080 3.960 0.032 0.000 0.217 136 G HA3 0.100 4.080 3.960 0.032 0.000 0.217 136 G C 1.907 176.945 174.900 0.230 0.000 1.150 136 G CA 1.750 46.986 45.100 0.227 0.000 0.776 136 G HN 0.859 9.149 8.290 -0.000 0.000 0.542 137 A N 0.904 123.833 122.820 0.183 0.000 1.873 137 A HA 0.198 4.537 4.320 0.032 0.000 0.215 137 A C 2.692 180.367 177.584 0.152 0.000 1.186 137 A CA 2.036 54.174 52.037 0.169 0.000 0.616 137 A CB -1.043 18.041 19.000 0.139 0.000 0.823 137 A HN 0.475 8.625 8.150 -0.000 0.000 0.442 138 G N -1.304 107.560 108.800 0.107 0.000 2.421 138 G HA2 -0.147 3.833 3.960 0.032 0.000 0.216 138 G HA3 -0.147 3.833 3.960 0.032 0.000 0.216 138 G C 1.370 176.295 174.900 0.041 0.000 1.171 138 G CA 1.049 46.168 45.100 0.033 0.000 0.775 138 G HN 0.378 8.668 8.290 -0.000 0.000 0.543 139 F N 1.794 121.802 119.950 0.097 0.000 2.134 139 F HA -0.062 4.483 4.527 0.030 0.000 0.299 139 F C 3.139 179.020 175.800 0.136 0.000 1.097 139 F CA 1.518 59.576 58.000 0.098 0.000 1.264 139 F CB -0.346 38.705 39.000 0.084 0.000 1.001 139 F HN 0.085 8.385 8.300 -0.000 0.000 0.479 140 S N -0.178 115.743 115.700 0.368 0.000 2.356 140 S HA -0.210 4.279 4.470 0.032 0.000 0.223 140 S C 2.351 177.148 174.600 0.327 0.000 1.032 140 S CA 1.146 59.601 58.200 0.425 0.000 1.005 140 S CB -0.765 62.681 63.200 0.408 0.000 0.867 140 S HN 0.379 8.689 8.310 -0.000 0.000 0.449 141 A N 1.306 124.242 122.820 0.193 0.000 1.930 141 A HA 0.170 4.509 4.320 0.032 0.000 0.217 141 A C 2.306 179.952 177.584 0.102 0.000 1.175 141 A CA 1.609 53.710 52.037 0.106 0.000 0.627 141 A CB -0.919 18.118 19.000 0.062 0.000 0.815 141 A HN 0.509 8.659 8.150 -0.000 0.000 0.443 142 A N -0.245 122.644 122.820 0.115 0.000 1.930 142 A HA 0.006 4.345 4.320 0.032 0.000 0.217 142 A C 2.085 179.750 177.584 0.134 0.000 1.175 142 A CA 1.390 53.484 52.037 0.095 0.000 0.627 142 A CB -0.492 18.546 19.000 0.063 0.000 0.815 142 A HN 0.478 8.628 8.150 -0.000 0.000 0.443 143 I N -1.215 119.477 120.570 0.204 0.000 2.286 143 I HA -0.168 4.021 4.170 0.032 0.000 0.245 143 I C 2.798 179.062 176.117 0.244 0.000 1.104 143 I CA 1.265 62.691 61.300 0.210 0.000 1.397 143 I CB -0.214 37.912 38.000 0.209 0.000 1.072 143 I HN 0.344 8.554 8.210 -0.000 0.000 0.417 144 S N 0.482 116.356 115.700 0.290 0.000 2.353 144 S HA -0.226 4.263 4.470 0.032 0.000 0.222 144 S C 2.234 176.889 174.600 0.091 0.000 1.035 144 S CA 1.658 59.972 58.200 0.189 0.000 1.025 144 S CB -0.261 62.968 63.200 0.048 0.000 0.902 144 S HN 0.487 8.797 8.310 -0.000 0.000 0.440 145 A N 0.321 123.178 122.820 0.063 0.000 1.902 145 A HA -0.086 4.253 4.320 0.032 0.000 0.217 145 A C 2.358 179.970 177.584 0.047 0.000 1.181 145 A CA 2.304 54.360 52.037 0.031 0.000 0.623 145 A CB -1.512 17.497 19.000 0.014 0.000 0.818 145 A HN 0.574 8.724 8.150 -0.000 0.000 0.443 146 T N 0.162 114.755 114.554 0.065 0.000 2.746 146 T HA -0.125 4.244 4.350 0.032 0.000 0.267 146 T C 1.472 176.207 174.700 0.058 0.000 1.039 146 T CA 1.597 63.732 62.100 0.058 0.000 1.142 146 T CB -0.419 68.486 68.868 0.063 0.000 0.866 146 T HN 0.443 8.683 8.240 -0.000 0.000 0.444 147 D N 1.006 121.454 120.400 0.080 0.000 2.219 147 D HA 0.003 4.662 4.640 0.032 0.000 0.205 147 D C 2.063 178.398 176.300 0.058 0.000 0.970 147 D CA 0.712 54.760 54.000 0.081 0.000 0.851 147 D CB -0.232 40.648 40.800 0.132 0.000 0.943 147 D HN 0.266 8.636 8.370 -0.000 0.000 0.488 148 S N -1.134 114.594 115.700 0.047 0.000 2.603 148 S HA 0.266 4.755 4.470 0.032 0.000 0.220 148 S C 1.584 176.199 174.600 0.025 0.000 0.967 148 S CA 0.579 58.796 58.200 0.028 0.000 0.920 148 S CB 0.718 63.927 63.200 0.015 0.000 0.773 148 S HN 0.445 8.755 8.310 -0.000 0.000 0.529 149 G N 0.701 109.518 108.800 0.028 0.000 2.184 149 G HA2 -0.096 3.883 3.960 0.032 0.000 0.206 149 G HA3 -0.096 3.883 3.960 0.032 0.000 0.206 149 G C 0.096 175.010 174.900 0.024 0.000 0.995 149 G CA -0.247 44.867 45.100 0.023 0.000 0.651 149 G HN 0.776 9.066 8.290 -0.000 0.000 0.511 150 A N -0.184 122.652 122.820 0.027 0.000 2.293 150 A HA 0.790 5.129 4.320 0.032 0.000 0.302 150 A C 0.211 177.814 177.584 0.031 0.000 1.119 150 A CA 0.144 52.198 52.037 0.029 0.000 0.823 150 A CB 1.014 20.032 19.000 0.030 0.000 1.097 150 A HN 0.697 8.847 8.150 -0.000 0.000 0.491 151 K N 1.544 121.963 120.400 0.032 0.000 2.234 151 K HA 0.531 4.870 4.320 0.032 0.000 0.277 151 K C -1.074 175.549 176.600 0.038 0.000 1.038 151 K CA 0.002 56.308 56.287 0.032 0.000 0.888 151 K CB 0.634 33.150 32.500 0.027 0.000 1.091 151 K HN 0.373 8.623 8.250 -0.000 0.000 0.467 152 V N 5.515 125.452 119.914 0.039 0.000 2.919 152 V HA 0.564 4.703 4.120 0.032 0.000 0.316 152 V C -0.108 176.012 176.094 0.043 0.000 1.077 152 V CA -0.949 61.375 62.300 0.041 0.000 0.977 152 V CB 1.774 33.620 31.823 0.039 0.000 1.039 152 V HN 0.688 8.878 8.190 -0.000 0.000 0.441 153 I N 3.278 123.876 120.570 0.047 0.000 2.466 153 I HA 0.434 4.623 4.170 0.032 0.000 0.289 153 I C -1.225 174.910 176.117 0.030 0.000 1.026 153 I CA -0.601 60.729 61.300 0.050 0.000 1.078 153 I CB 1.917 39.962 38.000 0.075 0.000 1.249 153 I HN 0.387 8.597 8.210 -0.000 0.000 0.429 154 L N 8.824 130.052 121.223 0.009 0.000 2.305 154 L HA 0.655 5.014 4.340 0.032 0.000 0.284 154 L C -0.540 176.309 176.870 -0.036 0.000 1.013 154 L CA -0.262 54.554 54.840 -0.040 0.000 0.819 154 L CB 1.064 43.059 42.059 -0.106 0.000 1.227 154 L HN 0.487 8.717 8.230 -0.000 0.000 0.417 155 I N 1.299 121.849 120.570 -0.034 0.000 2.648 155 I HA 0.867 5.056 4.170 0.032 0.000 0.304 155 I C -0.931 175.163 176.117 -0.038 0.000 1.009 155 I CA -0.682 60.608 61.300 -0.017 0.000 1.114 155 I CB 2.084 40.082 38.000 -0.002 0.000 1.293 155 I HN 0.680 8.890 8.210 -0.000 0.000 0.449 156 E N 3.548 123.737 120.200 -0.018 0.000 2.278 156 E HA 0.263 4.632 4.350 0.032 0.000 0.272 156 E C -0.134 176.470 176.600 0.007 0.000 0.890 156 E CA -0.839 55.552 56.400 -0.016 0.000 0.770 156 E CB 1.966 31.653 29.700 -0.022 0.000 1.212 156 E HN 0.748 9.108 8.360 -0.000 0.000 0.415 157 K N 2.866 123.272 120.400 0.010 0.000 2.155 157 K HA 0.089 4.428 4.320 0.032 0.000 0.203 157 K C 0.276 176.902 176.600 0.042 0.000 1.052 157 K CA 0.511 56.807 56.287 0.015 0.000 0.948 157 K CB 0.077 32.584 32.500 0.012 0.000 0.728 157 K HN 0.349 8.599 8.250 -0.000 0.000 0.448 158 E N 1.426 121.663 120.200 0.063 0.000 2.369 158 E HA 0.053 4.422 4.350 0.032 0.000 0.255 158 E C -1.750 174.890 176.600 0.067 0.000 1.172 158 E CA -2.158 54.304 56.400 0.103 0.000 0.932 158 E CB 0.523 30.291 29.700 0.114 0.000 1.040 158 E HN 0.049 8.409 8.360 -0.000 0.000 0.454 159 P HA -0.041 4.379 4.420 -0.000 0.000 0.229 159 P C 0.553 177.825 177.300 -0.047 0.000 1.160 159 P CA 0.724 63.849 63.100 0.042 0.000 0.777 159 P CB 0.257 32.007 31.700 0.083 0.000 0.814 160 V N -2.178 117.643 119.914 -0.156 0.000 2.960 160 V HA 0.554 4.693 4.120 0.032 0.000 0.315 160 V C 0.429 176.431 176.094 -0.155 0.000 1.087 160 V CA -1.842 60.336 62.300 -0.203 0.000 0.982 160 V CB 1.937 33.522 31.823 -0.398 0.000 1.039 160 V HN -0.016 8.174 8.190 -0.000 0.000 0.437 161 I N 0.515 121.014 120.570 -0.117 0.000 3.021 161 I HA 0.831 5.020 4.170 0.032 0.000 0.303 161 I C 1.240 177.318 176.117 -0.064 0.000 1.044 161 I CA 0.337 61.629 61.300 -0.013 0.000 1.266 161 I CB 0.965 39.051 38.000 0.143 0.000 1.447 161 I HN 1.372 9.582 8.210 -0.000 0.000 0.593 162 G N 1.121 109.962 108.800 0.067 0.000 2.234 162 G HA2 -0.037 3.942 3.960 0.032 0.000 0.235 162 G HA3 -0.037 3.942 3.960 0.032 0.000 0.235 162 G C 0.958 175.878 174.900 0.032 0.000 0.997 162 G CA 0.164 45.303 45.100 0.065 0.000 0.623 162 G HN 2.121 10.411 8.290 -0.000 0.000 0.514 163 G N 0.715 109.514 108.800 -0.003 0.000 2.614 163 G HA2 -0.381 3.598 3.960 0.032 0.000 0.303 163 G HA3 -0.381 3.598 3.960 0.032 0.000 0.303 163 G C 0.821 175.732 174.900 0.019 0.000 1.270 163 G CA 0.990 46.101 45.100 0.018 0.000 0.988 163 G HN 1.048 9.338 8.290 -0.000 0.000 0.551 164 N N 1.040 119.760 118.700 0.035 0.000 2.416 164 N HA 0.160 4.919 4.740 0.032 0.000 0.177 164 N C 2.477 178.021 175.510 0.057 0.000 1.036 164 N CA 1.487 54.560 53.050 0.038 0.000 0.901 164 N CB -0.388 38.106 38.487 0.012 0.000 0.976 164 N HN 0.804 9.184 8.380 -0.000 0.000 0.444 165 A N 2.089 124.950 122.820 0.068 0.000 1.972 165 A HA -0.195 4.144 4.320 0.032 0.000 0.219 165 A C 2.058 179.692 177.584 0.083 0.000 1.169 165 A CA 1.475 53.565 52.037 0.087 0.000 0.635 165 A CB -0.404 18.660 19.000 0.108 0.000 0.810 165 A HN 0.496 8.646 8.150 -0.000 0.000 0.446 166 K N -0.096 120.343 120.400 0.064 0.000 2.362 166 K HA 0.030 4.369 4.320 0.032 0.000 0.200 166 K C 1.168 177.837 176.600 0.115 0.000 1.046 166 K CA 1.408 57.735 56.287 0.067 0.000 0.952 166 K CB -0.408 32.094 32.500 0.004 0.000 0.753 166 K HN 0.456 8.706 8.250 -0.000 0.000 0.466 167 L N 0.963 122.251 121.223 0.109 0.000 2.567 167 L HA 0.246 4.605 4.340 0.032 0.000 0.225 167 L C 0.921 177.850 176.870 0.098 0.000 1.119 167 L CA -0.519 54.389 54.840 0.114 0.000 0.871 167 L CB -0.071 42.056 42.059 0.114 0.000 1.036 167 L HN 0.156 8.386 8.230 -0.000 0.000 0.459 168 A N 0.224 123.106 122.820 0.104 0.000 2.498 168 A HA 0.465 4.804 4.320 0.032 0.000 0.239 168 A C 0.936 178.579 177.584 0.098 0.000 1.068 168 A CA 0.773 52.877 52.037 0.112 0.000 0.766 168 A CB 0.568 19.637 19.000 0.115 0.000 1.003 168 A HN 0.325 8.475 8.150 -0.000 0.000 0.497 169 A N 2.407 125.289 122.820 0.104 0.000 2.042 169 A HA 0.469 4.808 4.320 0.032 0.000 0.204 169 A C 2.078 179.710 177.584 0.081 0.000 1.712 169 A CA 1.105 53.191 52.037 0.083 0.000 0.890 169 A CB -0.993 18.063 19.000 0.094 0.000 1.176 169 A HN 1.346 9.496 8.150 -0.000 0.000 0.573 170 G N -0.446 108.410 108.800 0.093 0.000 2.469 170 G HA2 0.331 4.310 3.960 0.032 0.000 0.219 170 G HA3 0.331 4.310 3.960 0.032 0.000 0.219 170 G C 0.934 175.877 174.900 0.071 0.000 1.150 170 G CA 1.401 46.548 45.100 0.078 0.000 0.763 170 G HN 1.839 10.129 8.290 -0.000 0.000 0.561 171 G N -1.819 107.034 108.800 0.087 0.000 2.369 171 G HA2 0.333 4.312 3.960 0.032 0.000 0.293 171 G HA3 0.333 4.312 3.960 0.032 0.000 0.293 171 G C -1.168 173.803 174.900 0.117 0.000 1.301 171 G CA -0.177 44.985 45.100 0.103 0.000 0.913 171 G HN 0.553 8.843 8.290 -0.000 0.000 0.540 172 M N 1.331 121.021 119.600 0.150 0.000 2.134 172 M HA 0.450 4.949 4.480 0.032 0.000 0.310 172 M C -0.870 175.535 176.300 0.174 0.000 0.966 172 M CA -0.912 54.474 55.300 0.142 0.000 0.922 172 M CB 1.072 33.747 32.600 0.125 0.000 1.537 172 M HN 0.498 8.788 8.290 -0.000 0.000 0.424 173 N N 3.427 122.212 118.700 0.142 0.000 2.520 173 N HA 0.697 5.456 4.740 0.032 0.000 0.273 173 N C -1.052 174.528 175.510 0.117 0.000 1.155 173 N CA 0.058 53.204 53.050 0.161 0.000 0.967 173 N CB 1.521 40.076 38.487 0.113 0.000 1.092 173 N HN 0.757 9.137 8.380 -0.000 0.000 0.457 174 A N 0.238 123.146 122.820 0.148 0.000 2.605 174 A HA 0.828 5.167 4.320 0.032 0.000 0.294 174 A C -1.653 176.041 177.584 0.184 0.000 1.062 174 A CA -0.624 51.455 52.037 0.070 0.000 0.682 174 A CB 1.154 20.067 19.000 -0.145 0.000 1.278 174 A HN 0.694 8.844 8.150 -0.000 0.000 0.410 175 A N 0.047 122.964 122.820 0.163 0.000 2.488 175 A HA 0.716 5.056 4.320 0.032 0.000 0.298 175 A C -1.883 175.852 177.584 0.251 0.000 1.044 175 A CA -0.165 52.009 52.037 0.227 0.000 0.693 175 A CB 1.075 20.177 19.000 0.170 0.000 1.272 175 A HN 1.709 9.859 8.150 -0.000 0.000 0.402 176 W N 3.176 124.515 121.300 0.065 0.000 1.982 176 W HA 0.391 5.070 4.660 0.031 0.000 0.299 176 W C 0.256 176.814 176.519 0.066 0.000 1.011 176 W CA -0.481 56.901 57.345 0.063 0.000 1.324 176 W CB 0.931 30.419 29.460 0.046 0.000 1.372 176 W HN 0.923 9.103 8.180 -0.000 0.000 0.323 177 T N -1.487 113.211 114.554 0.240 0.000 2.874 177 T HA 0.213 4.582 4.350 0.032 0.000 0.281 177 T C 0.958 175.621 174.700 -0.062 0.000 0.994 177 T CA -0.095 62.055 62.100 0.082 0.000 1.015 177 T CB 1.797 70.787 68.868 0.202 0.000 1.028 177 T HN 0.099 8.339 8.240 -0.000 0.000 0.523 178 D N 0.670 121.032 120.400 -0.062 0.000 2.178 178 D HA -0.070 4.590 4.640 0.032 0.000 0.202 178 D C 2.090 178.375 176.300 -0.025 0.000 0.974 178 D CA 1.138 55.081 54.000 -0.094 0.000 0.841 178 D CB -0.199 40.561 40.800 -0.066 0.000 0.953 178 D HN 0.596 8.966 8.370 -0.000 0.000 0.478 179 Q N 0.491 120.330 119.800 0.065 0.000 2.084 179 Q HA -0.096 4.263 4.340 0.032 0.000 0.202 179 Q C 2.182 178.221 176.000 0.064 0.000 0.978 179 Q CA 1.080 56.940 55.803 0.095 0.000 0.844 179 Q CB -0.146 28.721 28.738 0.216 0.000 0.898 179 Q HN 0.395 8.665 8.270 -0.000 0.000 0.426 180 Q N 0.179 120.046 119.800 0.112 0.000 2.046 180 Q HA -0.135 4.224 4.340 0.032 0.000 0.200 180 Q C 1.902 177.967 176.000 0.108 0.000 0.975 180 Q CA 1.202 57.081 55.803 0.126 0.000 0.836 180 Q CB -0.016 28.904 28.738 0.302 0.000 0.896 180 Q HN 0.268 8.538 8.270 -0.000 0.000 0.428 181 K N 0.284 120.691 120.400 0.012 0.000 2.103 181 K HA -0.120 4.219 4.320 0.032 0.000 0.207 181 K C 1.965 178.563 176.600 -0.004 0.000 1.048 181 K CA 1.165 57.430 56.287 -0.036 0.000 0.930 181 K CB -0.144 32.206 32.500 -0.250 0.000 0.716 181 K HN 0.131 8.381 8.250 -0.000 0.000 0.444 182 A N 1.116 123.931 122.820 -0.009 0.000 2.121 182 A HA -0.099 4.240 4.320 0.032 0.000 0.218 182 A C 1.360 178.951 177.584 0.012 0.000 1.154 182 A CA 1.272 53.308 52.037 -0.002 0.000 0.679 182 A CB 0.049 19.047 19.000 -0.004 0.000 0.795 182 A HN 0.023 8.173 8.150 -0.000 0.000 0.458 183 K N -0.992 119.422 120.400 0.023 0.000 2.399 183 K HA 0.272 4.611 4.320 0.032 0.000 0.204 183 K C 0.666 177.291 176.600 0.042 0.000 1.023 183 K CA 0.712 57.013 56.287 0.023 0.000 1.127 183 K CB -0.195 32.309 32.500 0.007 0.000 0.856 183 K HN 0.523 8.773 8.250 -0.000 0.000 0.514 184 K N 0.862 121.299 120.400 0.062 0.000 3.117 184 K HA -0.193 4.146 4.320 0.032 0.000 0.269 184 K C 0.123 176.792 176.600 0.114 0.000 1.098 184 K CA 1.359 57.697 56.287 0.085 0.000 0.785 184 K CB -2.942 29.592 32.500 0.057 0.000 1.242 184 K HN 0.341 8.591 8.250 -0.000 0.000 0.491 185 I N 0.977 121.642 120.570 0.158 0.000 2.428 185 I HA 0.389 4.578 4.170 0.032 0.000 0.296 185 I C 0.755 177.050 176.117 0.296 0.000 0.985 185 I CA -0.768 60.633 61.300 0.168 0.000 1.260 185 I CB 2.302 40.386 38.000 0.141 0.000 1.389 185 I HN 0.295 8.505 8.210 -0.000 0.000 0.484 186 T N 4.338 118.952 114.554 0.099 0.000 2.779 186 T HA 0.408 4.777 4.350 0.032 0.000 0.280 186 T C -0.727 173.714 174.700 -0.432 0.000 0.987 186 T CA -0.434 61.561 62.100 -0.174 0.000 0.966 186 T CB 1.239 69.983 68.868 -0.206 0.000 0.933 186 T HN 0.521 8.761 8.240 -0.000 0.000 0.442 187 D N 0.900 120.737 120.400 -0.938 0.000 2.752 187 D HA 0.715 5.374 4.640 0.032 0.000 0.313 187 D C -1.197 174.725 176.300 -0.629 0.000 1.225 187 D CA -0.315 53.367 54.000 -0.529 0.000 0.976 187 D CB 2.126 42.834 40.800 -0.153 0.000 1.443 187 D HN 0.589 8.959 8.370 -0.000 0.000 0.515 188 S N -1.252 114.314 115.700 -0.223 0.000 2.567 188 S HA 0.508 4.997 4.470 0.032 0.000 0.270 188 S C -2.578 172.041 174.600 0.031 0.000 1.152 188 S CA -0.905 57.243 58.200 -0.085 0.000 0.835 188 S CB 1.941 65.072 63.200 -0.115 0.000 1.115 188 S HN 0.208 8.518 8.310 -0.000 0.000 0.459 189 P HA -0.033 4.387 4.420 -0.000 0.000 0.216 189 P C 0.938 178.294 177.300 0.094 0.000 1.150 189 P CA 1.329 64.486 63.100 0.096 0.000 0.837 189 P CB 0.024 31.777 31.700 0.089 0.000 0.786 190 E N -0.797 119.432 120.200 0.048 0.000 2.110 190 E HA -0.150 4.219 4.350 0.032 0.000 0.193 190 E C 1.832 178.494 176.600 0.103 0.000 0.988 190 E CA 0.743 57.171 56.400 0.048 0.000 0.804 190 E CB -1.113 28.583 29.700 -0.007 0.000 0.745 190 E HN 0.113 8.473 8.360 -0.000 0.000 0.458 191 L N 0.230 121.485 121.223 0.053 0.000 2.056 191 L HA -0.043 4.316 4.340 0.032 0.000 0.207 191 L C 2.177 179.090 176.870 0.072 0.000 1.078 191 L CA 1.667 56.533 54.840 0.043 0.000 0.749 191 L CB -0.414 41.636 42.059 -0.014 0.000 0.901 191 L HN 0.224 8.454 8.230 -0.000 0.000 0.433 192 M N -1.879 117.772 119.600 0.086 0.000 2.108 192 M HA -0.281 4.218 4.480 0.032 0.000 0.261 192 M C 2.228 178.595 176.300 0.113 0.000 1.066 192 M CA 2.143 57.498 55.300 0.091 0.000 1.107 192 M CB -0.339 32.325 32.600 0.107 0.000 1.356 192 M HN 0.334 8.624 8.290 -0.000 0.000 0.406 193 F N 1.004 120.964 119.950 0.015 0.000 2.102 193 F HA -0.225 4.323 4.527 0.035 0.000 0.298 193 F C 2.318 178.120 175.800 0.004 0.000 1.105 193 F CA 2.372 60.380 58.000 0.013 0.000 1.239 193 F CB -0.521 38.487 39.000 0.014 0.000 0.991 193 F HN 0.309 8.609 8.300 -0.000 0.000 0.474 194 E N -0.022 120.304 120.200 0.209 0.000 2.077 194 E HA -0.247 4.122 4.350 0.032 0.000 0.193 194 E C 1.796 178.375 176.600 -0.036 0.000 0.989 194 E CA 1.695 58.145 56.400 0.083 0.000 0.800 194 E CB -0.242 29.531 29.700 0.122 0.000 0.746 194 E HN 0.416 8.776 8.360 -0.000 0.000 0.452 195 D N -0.155 120.233 120.400 -0.021 0.000 2.117 195 D HA -0.130 4.529 4.640 0.032 0.000 0.197 195 D C 1.953 178.202 176.300 -0.085 0.000 0.987 195 D CA 1.669 55.644 54.000 -0.041 0.000 0.829 195 D CB -0.563 40.225 40.800 -0.020 0.000 0.961 195 D HN 0.196 8.566 8.370 -0.000 0.000 0.460 196 T N 1.004 115.490 114.554 -0.114 0.000 2.746 196 T HA -0.104 4.265 4.350 0.032 0.000 0.267 196 T C 1.948 176.525 174.700 -0.205 0.000 1.039 196 T CA 0.866 62.879 62.100 -0.146 0.000 1.142 196 T CB -0.034 68.749 68.868 -0.141 0.000 0.866 196 T HN 0.079 8.319 8.240 -0.000 0.000 0.444 197 M N 1.126 120.538 119.600 -0.313 0.000 2.175 197 M HA 0.001 4.501 4.480 0.032 0.000 0.264 197 M C 2.264 178.466 176.300 -0.162 0.000 1.063 197 M CA 1.365 56.496 55.300 -0.281 0.000 1.119 197 M CB -0.946 31.436 32.600 -0.364 0.000 1.377 197 M HN 0.232 8.522 8.290 -0.000 0.000 0.415 198 K N 0.218 120.543 120.400 -0.125 0.000 2.057 198 K HA -0.101 4.238 4.320 0.032 0.000 0.206 198 K C 2.000 178.548 176.600 -0.087 0.000 1.050 198 K CA 1.583 57.820 56.287 -0.083 0.000 0.935 198 K CB -0.343 32.123 32.500 -0.058 0.000 0.715 198 K HN 0.342 8.592 8.250 -0.000 0.000 0.439 199 G N 0.083 108.825 108.800 -0.098 0.000 2.450 199 G HA2 -0.192 3.788 3.960 0.032 0.000 0.220 199 G HA3 -0.192 3.788 3.960 0.032 0.000 0.220 199 G C 1.267 176.096 174.900 -0.118 0.000 1.130 199 G CA 0.827 45.866 45.100 -0.102 0.000 0.760 199 G HN 0.467 8.757 8.290 -0.000 0.000 0.557 200 G N -0.872 107.851 108.800 -0.128 0.000 3.371 200 G HA2 0.348 4.327 3.960 0.032 0.000 0.248 200 G HA3 0.348 4.327 3.960 0.032 0.000 0.248 200 G C 0.522 175.327 174.900 -0.159 0.000 1.161 200 G CA 0.201 45.211 45.100 -0.150 0.000 0.796 200 G HN 0.480 8.770 8.290 -0.000 0.000 0.539 201 Q N -0.042 119.685 119.800 -0.122 0.000 2.481 201 Q HA -0.225 4.134 4.340 0.032 0.000 0.272 201 Q C 0.417 176.366 176.000 -0.085 0.000 1.157 201 Q CA 0.482 56.227 55.803 -0.096 0.000 0.935 201 Q CB -1.623 27.055 28.738 -0.101 0.000 1.338 201 Q HN 0.610 8.880 8.270 -0.000 0.000 0.494 202 N N -1.197 117.449 118.700 -0.090 0.000 2.708 202 N HA -0.227 4.532 4.740 0.032 0.000 0.251 202 N C 0.287 175.759 175.510 -0.064 0.000 1.123 202 N CA 1.284 54.291 53.050 -0.073 0.000 0.739 202 N CB -0.466 37.995 38.487 -0.042 0.000 1.113 202 N HN 0.401 8.781 8.380 -0.000 0.000 0.561 203 I N 0.288 120.806 120.570 -0.087 0.000 3.427 203 I HA 0.007 4.196 4.170 0.032 0.000 0.288 203 I C 1.086 177.167 176.117 -0.061 0.000 1.249 203 I CA 0.401 61.660 61.300 -0.069 0.000 1.421 203 I CB -0.570 37.357 38.000 -0.123 0.000 1.086 203 I HN 0.146 8.356 8.210 -0.000 0.000 0.448 204 N N 2.276 120.923 118.700 -0.089 0.000 2.344 204 N HA -0.080 4.679 4.740 0.032 0.000 0.236 204 N C 0.071 175.550 175.510 -0.052 0.000 1.279 204 N CA -0.032 52.967 53.050 -0.084 0.000 0.882 204 N CB 0.674 39.085 38.487 -0.126 0.000 1.110 204 N HN 0.043 8.423 8.380 -0.000 0.000 0.436 205 D N 1.248 121.625 120.400 -0.039 0.000 2.338 205 D HA 0.089 4.748 4.640 0.032 0.000 0.255 205 D C -1.449 174.864 176.300 0.022 0.000 1.237 205 D CA -2.199 51.798 54.000 -0.004 0.000 0.883 205 D CB 1.022 41.818 40.800 -0.007 0.000 1.087 205 D HN 0.311 8.681 8.370 -0.000 0.000 0.485 206 P HA -0.117 4.303 4.420 -0.000 0.000 0.220 206 P C 0.998 178.429 177.300 0.218 0.000 1.148 206 P CA 0.844 64.047 63.100 0.172 0.000 0.803 206 P CB 0.194 32.020 31.700 0.210 0.000 0.782 207 A N 0.160 123.058 122.820 0.129 0.000 1.898 207 A HA -0.118 4.221 4.320 0.032 0.000 0.216 207 A C 2.357 180.020 177.584 0.132 0.000 1.181 207 A CA 1.313 53.418 52.037 0.113 0.000 0.620 207 A CB -1.517 17.528 19.000 0.076 0.000 0.819 207 A HN 0.134 8.284 8.150 -0.000 0.000 0.442 208 L N -0.514 120.782 121.223 0.121 0.000 2.109 208 L HA -0.105 4.254 4.340 0.032 0.000 0.207 208 L C 2.374 179.361 176.870 0.196 0.000 1.086 208 L CA 0.769 55.715 54.840 0.178 0.000 0.760 208 L CB -0.531 41.555 42.059 0.045 0.000 0.910 208 L HN 0.223 8.453 8.230 -0.000 0.000 0.437 209 V N 0.475 120.470 119.914 0.135 0.000 2.626 209 V HA -0.244 3.895 4.120 0.032 0.000 0.252 209 V C 3.067 179.355 176.094 0.323 0.000 1.067 209 V CA 2.104 64.480 62.300 0.125 0.000 1.081 209 V CB -1.029 30.724 31.823 -0.117 0.000 0.686 209 V HN 0.537 8.727 8.190 -0.000 0.000 0.468 210 K N -0.178 120.451 120.400 0.381 0.000 2.097 210 K HA -0.105 4.234 4.320 0.032 0.000 0.205 210 K C 2.168 178.840 176.600 0.120 0.000 1.050 210 K CA 1.720 58.158 56.287 0.252 0.000 0.938 210 K CB -1.014 31.545 32.500 0.099 0.000 0.718 210 K HN 0.364 8.614 8.250 -0.000 0.000 0.442 211 V N 0.606 120.542 119.914 0.036 0.000 2.307 211 V HA -0.188 3.951 4.120 0.032 0.000 0.245 211 V C 2.470 178.432 176.094 -0.220 0.000 1.045 211 V CA 1.691 63.847 62.300 -0.240 0.000 1.024 211 V CB -0.351 31.210 31.823 -0.437 0.000 0.651 211 V HN 0.552 8.742 8.190 -0.000 0.000 0.449 212 L N 0.999 122.222 121.223 -0.001 0.000 2.012 212 L HA -0.188 4.171 4.340 0.032 0.000 0.210 212 L C 2.697 179.623 176.870 0.093 0.000 1.073 212 L CA 2.673 57.556 54.840 0.072 0.000 0.748 212 L CB -0.616 41.541 42.059 0.163 0.000 0.891 212 L HN 0.525 8.755 8.230 -0.000 0.000 0.431 213 S N -1.719 114.068 115.700 0.145 0.000 2.377 213 S HA -0.147 4.342 4.470 0.032 0.000 0.223 213 S C 2.100 176.782 174.600 0.136 0.000 1.030 213 S CA 0.940 59.234 58.200 0.156 0.000 0.970 213 S CB -1.090 62.248 63.200 0.231 0.000 0.830 213 S HN 0.642 8.952 8.310 -0.000 0.000 0.473 214 S N 1.604 117.389 115.700 0.142 0.000 2.402 214 S HA -0.100 4.389 4.470 0.032 0.000 0.229 214 S C 1.606 176.307 174.600 0.169 0.000 1.021 214 S CA 0.841 59.127 58.200 0.144 0.000 0.974 214 S CB -1.106 62.180 63.200 0.143 0.000 0.800 214 S HN 0.789 9.099 8.310 -0.000 0.000 0.484 215 H N 1.287 120.333 119.070 -0.040 0.000 2.539 215 H HA 0.182 4.757 4.556 0.032 0.000 0.269 215 H C 2.406 177.709 175.328 -0.040 0.000 0.980 215 H CA 0.481 56.487 56.048 -0.070 0.000 1.152 215 H CB 0.179 29.852 29.762 -0.147 0.000 1.407 215 H HN 0.705 8.985 8.280 -0.000 0.000 0.564 216 S N 1.345 117.109 115.700 0.108 0.000 2.356 216 S HA -0.221 4.268 4.470 0.032 0.000 0.223 216 S C 2.036 176.658 174.600 0.036 0.000 1.032 216 S CA 1.205 59.446 58.200 0.069 0.000 1.005 216 S CB -0.108 63.137 63.200 0.075 0.000 0.867 216 S HN 0.360 8.670 8.310 -0.000 0.000 0.449 217 K N 1.136 121.560 120.400 0.040 0.000 2.057 217 K HA -0.177 4.163 4.320 0.032 0.000 0.207 217 K C 1.539 178.148 176.600 0.015 0.000 1.049 217 K CA 1.810 58.110 56.287 0.021 0.000 0.931 217 K CB -0.431 32.094 32.500 0.042 0.000 0.714 217 K HN 0.274 8.524 8.250 -0.000 0.000 0.440 218 D N 0.272 120.675 120.400 0.006 0.000 2.149 218 D HA -0.114 4.545 4.640 0.032 0.000 0.198 218 D C 1.953 178.284 176.300 0.051 0.000 0.990 218 D CA 1.085 55.083 54.000 -0.003 0.000 0.839 218 D CB -0.181 40.569 40.800 -0.083 0.000 0.948 218 D HN 0.140 8.510 8.370 -0.000 0.000 0.460 219 S N -0.360 115.373 115.700 0.055 0.000 2.368 219 S HA -0.088 4.401 4.470 0.032 0.000 0.224 219 S C 2.263 176.961 174.600 0.163 0.000 1.029 219 S CA 0.405 58.682 58.200 0.129 0.000 0.988 219 S CB -0.085 63.172 63.200 0.095 0.000 0.838 219 S HN 0.085 8.395 8.310 -0.000 0.000 0.462 220 V N 2.379 122.331 119.914 0.063 0.000 2.343 220 V HA -0.167 3.972 4.120 0.032 0.000 0.247 220 V C 2.020 178.155 176.094 0.069 0.000 1.051 220 V CA 1.741 64.055 62.300 0.023 0.000 1.036 220 V CB -0.645 31.110 31.823 -0.115 0.000 0.654 220 V HN 0.389 8.579 8.190 -0.000 0.000 0.451 221 D N -1.323 119.125 120.400 0.079 0.000 2.117 221 D HA -0.216 4.443 4.640 0.032 0.000 0.197 221 D C 1.706 178.096 176.300 0.149 0.000 0.987 221 D CA 1.291 55.344 54.000 0.089 0.000 0.829 221 D CB -0.254 40.587 40.800 0.068 0.000 0.961 221 D HN 0.624 8.994 8.370 -0.000 0.000 0.460 222 W N 1.225 122.518 121.300 -0.012 0.000 2.354 222 W HA -0.141 4.537 4.660 0.030 0.000 0.315 222 W C 2.161 178.678 176.519 -0.002 0.000 1.206 222 W CA 1.171 58.512 57.345 -0.007 0.000 1.290 222 W CB -0.298 29.160 29.460 -0.003 0.000 1.152 222 W HN -0.169 8.011 8.180 -0.000 0.000 0.489 223 M N -0.217 119.440 119.600 0.095 0.000 2.117 223 M HA -0.169 4.330 4.480 0.032 0.000 0.262 223 M C 1.843 178.093 176.300 -0.084 0.000 1.065 223 M CA 2.134 57.382 55.300 -0.087 0.000 1.114 223 M CB -1.964 30.647 32.600 0.018 0.000 1.361 223 M HN -0.055 8.235 8.290 -0.000 0.000 0.408 224 T N 1.183 115.733 114.554 -0.006 0.000 2.788 224 T HA -0.055 4.314 4.350 0.032 0.000 0.268 224 T C 1.867 176.551 174.700 -0.027 0.000 1.044 224 T CA 1.568 63.671 62.100 0.005 0.000 1.139 224 T CB -0.308 68.580 68.868 0.033 0.000 0.867 224 T HN 0.498 8.738 8.240 -0.000 0.000 0.454 225 A N 1.135 123.931 122.820 -0.039 0.000 2.019 225 A HA 0.053 4.392 4.320 0.032 0.000 0.219 225 A C 2.183 179.700 177.584 -0.111 0.000 1.164 225 A CA 1.138 53.142 52.037 -0.054 0.000 0.644 225 A CB -0.597 18.388 19.000 -0.024 0.000 0.805 225 A HN 0.462 8.612 8.150 -0.000 0.000 0.449 226 M N -1.676 117.808 119.600 -0.195 0.000 2.595 226 M HA 0.125 4.624 4.480 0.032 0.000 0.248 226 M C 1.333 177.539 176.300 -0.157 0.000 1.119 226 M CA 0.951 56.114 55.300 -0.228 0.000 1.079 226 M CB 0.303 32.669 32.600 -0.390 0.000 1.472 226 M HN 0.641 8.931 8.290 -0.000 0.000 0.501 227 G N 0.022 108.761 108.800 -0.102 0.000 2.227 227 G HA2 -0.076 3.904 3.960 0.032 0.000 0.168 227 G HA3 -0.076 3.904 3.960 0.032 0.000 0.168 227 G C 0.084 174.981 174.900 -0.005 0.000 1.006 227 G CA -0.182 44.886 45.100 -0.053 0.000 0.684 227 G HN 0.591 8.881 8.290 -0.000 0.000 0.489 228 A N 0.203 123.019 122.820 -0.007 0.000 2.351 228 A HA 0.571 4.910 4.320 0.032 0.000 0.257 228 A C -0.052 177.669 177.584 0.228 0.000 1.087 228 A CA 0.503 52.626 52.037 0.144 0.000 0.798 228 A CB 0.661 19.700 19.000 0.064 0.000 1.033 228 A HN 0.388 8.538 8.150 -0.000 0.000 0.488 229 D N 1.727 122.348 120.400 0.369 0.000 2.427 229 D HA 0.429 5.088 4.640 0.032 0.000 0.226 229 D C -0.512 175.830 176.300 0.070 0.000 1.076 229 D CA -0.065 53.989 54.000 0.091 0.000 0.849 229 D CB 0.377 41.134 40.800 -0.073 0.000 1.052 229 D HN 0.325 8.695 8.370 -0.000 0.000 0.515 230 L N 3.625 124.909 121.223 0.102 0.000 3.209 230 L HA 0.156 4.516 4.340 0.032 0.000 0.279 230 L C 1.710 178.674 176.870 0.156 0.000 1.301 230 L CA -0.115 54.811 54.840 0.143 0.000 1.004 230 L CB 0.583 42.743 42.059 0.170 0.000 1.402 230 L HN 0.408 8.638 8.230 -0.000 0.000 0.577 231 T N -5.422 109.176 114.554 0.074 0.000 3.081 231 T HA -0.019 4.351 4.350 0.032 0.000 0.255 231 T C 0.572 175.273 174.700 0.002 0.000 1.113 231 T CA -0.028 62.100 62.100 0.047 0.000 1.082 231 T CB 0.034 68.915 68.868 0.022 0.000 0.939 231 T HN 0.152 8.392 8.240 -0.000 0.000 0.506 232 D N 1.256 121.649 120.400 -0.011 0.000 2.277 232 D HA 0.390 5.049 4.640 0.032 0.000 0.249 232 D C -0.919 175.331 176.300 -0.082 0.000 1.134 232 D CA -0.388 53.589 54.000 -0.038 0.000 0.863 232 D CB 1.288 42.069 40.800 -0.031 0.000 1.143 232 D HN 0.054 8.424 8.370 -0.000 0.000 0.458 233 V N 3.859 123.703 119.914 -0.118 0.000 2.350 233 V HA 0.746 4.886 4.120 0.032 0.000 0.285 233 V C 0.912 176.946 176.094 -0.100 0.000 1.014 233 V CA -0.649 61.533 62.300 -0.196 0.000 0.831 233 V CB 1.186 32.833 31.823 -0.294 0.000 1.000 233 V HN 0.638 8.828 8.190 -0.000 0.000 0.433 234 G N 3.318 112.077 108.800 -0.069 0.000 2.735 234 G HA2 0.720 4.699 3.960 0.032 0.000 0.301 234 G HA3 0.720 4.699 3.960 0.032 0.000 0.301 234 G C -0.998 173.891 174.900 -0.018 0.000 1.279 234 G CA -0.883 44.197 45.100 -0.033 0.000 1.019 234 G HN 0.556 8.846 8.290 -0.000 0.000 0.497 235 M N 0.273 119.868 119.600 -0.009 0.000 2.363 235 M HA 0.766 5.265 4.480 0.032 0.000 0.343 235 M C -0.590 175.708 176.300 -0.002 0.000 1.165 235 M CA -0.353 54.946 55.300 -0.003 0.000 1.046 235 M CB 1.285 33.885 32.600 -0.001 0.000 1.648 235 M HN 0.428 8.718 8.290 -0.000 0.000 0.452 236 M N 2.306 121.903 119.600 -0.005 0.000 2.593 236 M HA 0.546 5.046 4.480 0.032 0.000 0.290 236 M C 0.100 176.384 176.300 -0.026 0.000 1.244 236 M CA -1.064 54.227 55.300 -0.015 0.000 0.857 236 M CB 2.280 34.872 32.600 -0.013 0.000 1.738 236 M HN 0.891 9.181 8.290 -0.000 0.000 0.461 237 G N -0.162 108.615 108.800 -0.039 0.000 2.414 237 G HA2 0.370 4.349 3.960 0.032 0.000 0.236 237 G HA3 0.370 4.349 3.960 0.032 0.000 0.236 237 G C 0.878 175.747 174.900 -0.051 0.000 1.293 237 G CA 0.656 45.730 45.100 -0.043 0.000 0.869 237 G HN 1.156 9.446 8.290 -0.000 0.000 0.556 238 G N 0.042 108.817 108.800 -0.041 0.000 2.199 238 G HA2 0.145 4.124 3.960 0.032 0.000 0.254 238 G HA3 0.145 4.124 3.960 0.032 0.000 0.254 238 G C 0.602 175.482 174.900 -0.032 0.000 0.982 238 G CA 0.670 45.743 45.100 -0.044 0.000 0.632 238 G HN 1.999 10.289 8.290 -0.000 0.000 0.529 239 A N 0.275 123.082 122.820 -0.022 0.000 2.290 239 A HA 0.812 5.151 4.320 0.032 0.000 0.310 239 A C 1.315 178.894 177.584 -0.009 0.000 1.202 239 A CA 0.985 53.016 52.037 -0.010 0.000 0.837 239 A CB 1.064 20.064 19.000 -0.000 0.000 1.139 239 A HN 0.730 8.880 8.150 -0.000 0.000 0.509 240 S N 0.112 115.807 115.700 -0.009 0.000 2.428 240 S HA 0.090 4.579 4.470 0.032 0.000 0.230 240 S C 0.856 175.449 174.600 -0.013 0.000 1.014 240 S CA 1.239 59.432 58.200 -0.012 0.000 0.957 240 S CB -0.544 62.646 63.200 -0.017 0.000 0.784 240 S HN 1.290 9.600 8.310 -0.000 0.000 0.499 241 V N -1.195 118.713 119.914 -0.009 0.000 3.181 241 V HA 0.590 4.729 4.120 0.032 0.000 0.308 241 V C -1.403 174.694 176.094 0.005 0.000 1.214 241 V CA -1.691 60.606 62.300 -0.006 0.000 1.053 241 V CB 1.136 32.949 31.823 -0.016 0.000 1.069 241 V HN -0.131 8.059 8.190 -0.000 0.000 0.441 242 N N 2.193 120.896 118.700 0.005 0.000 2.447 242 N HA 0.382 5.141 4.740 0.032 0.000 0.263 242 N C 0.634 176.148 175.510 0.007 0.000 1.226 242 N CA 0.486 53.536 53.050 -0.001 0.000 0.906 242 N CB 0.249 38.728 38.487 -0.014 0.000 1.060 242 N HN 0.877 9.257 8.380 -0.000 0.000 0.468 243 R N 0.385 120.896 120.500 0.020 0.000 2.504 243 R HA 0.377 4.736 4.340 0.032 0.000 0.396 243 R C -0.723 175.657 176.300 0.133 0.000 0.896 243 R CA -0.461 55.685 56.100 0.078 0.000 1.152 243 R CB 0.000 30.382 30.300 0.137 0.000 1.681 243 R HN 0.310 8.580 8.270 -0.000 0.000 0.537 244 A N 2.237 125.090 122.820 0.055 0.000 2.316 244 A HA 0.340 4.679 4.320 0.032 0.000 0.311 244 A C -0.741 176.886 177.584 0.071 0.000 1.339 244 A CA -0.466 51.634 52.037 0.106 0.000 0.960 244 A CB -0.177 18.858 19.000 0.059 0.000 1.152 244 A HN 0.398 8.548 8.150 -0.000 0.000 0.547 245 H N 2.753 121.857 119.070 0.058 0.000 2.525 245 H HA 0.581 5.155 4.556 0.030 0.000 0.339 245 H C 0.342 175.701 175.328 0.052 0.000 1.109 245 H CA -0.104 55.977 56.048 0.055 0.000 1.352 245 H CB 1.124 30.926 29.762 0.067 0.000 1.461 245 H HN 0.858 9.138 8.280 -0.000 0.000 0.533 246 R N 1.285 121.861 120.500 0.126 0.000 2.741 246 R HA 0.365 4.724 4.340 0.032 0.000 0.274 246 R C -3.635 172.674 176.300 0.015 0.000 1.029 246 R CA -2.149 53.996 56.100 0.076 0.000 0.880 246 R CB 0.464 30.793 30.300 0.048 0.000 1.264 246 R HN 0.260 8.530 8.270 -0.000 0.000 0.465 247 P HA 0.047 4.467 4.420 -0.000 0.000 0.269 247 P C -0.460 176.787 177.300 -0.088 0.000 1.215 247 P CA 0.153 63.167 63.100 -0.143 0.000 0.780 247 P CB 0.338 31.856 31.700 -0.303 0.000 0.898 248 T N 2.244 116.748 114.554 -0.083 0.000 2.819 248 T HA 0.207 4.577 4.350 0.032 0.000 0.282 248 T C 1.460 176.129 174.700 -0.052 0.000 1.013 248 T CA 1.825 63.892 62.100 -0.055 0.000 1.159 248 T CB -0.809 68.030 68.868 -0.048 0.000 1.007 248 T HN 0.859 9.099 8.240 -0.000 0.000 0.514 249 G N 2.390 111.166 108.800 -0.040 0.000 2.195 249 G HA2 0.013 3.992 3.960 0.032 0.000 0.246 249 G HA3 0.013 3.992 3.960 0.032 0.000 0.246 249 G C 0.829 175.704 174.900 -0.042 0.000 0.984 249 G CA 0.192 45.269 45.100 -0.038 0.000 0.633 249 G HN 2.040 10.330 8.290 -0.000 0.000 0.525 250 G N -0.903 107.871 108.800 -0.043 0.000 2.203 250 G HA2 0.322 4.301 3.960 0.032 0.000 0.231 250 G HA3 0.322 4.301 3.960 0.032 0.000 0.231 250 G C 0.622 175.494 174.900 -0.046 0.000 1.058 250 G CA 0.925 46.001 45.100 -0.040 0.000 0.781 250 G HN 2.218 10.508 8.290 -0.000 0.000 0.496 251 A N -0.307 122.482 122.820 -0.051 0.000 2.272 251 A HA 0.857 5.196 4.320 0.032 0.000 0.275 251 A C 1.298 178.865 177.584 -0.028 0.000 1.096 251 A CA 0.461 52.467 52.037 -0.052 0.000 0.822 251 A CB 0.392 19.355 19.000 -0.060 0.000 1.088 251 A HN 1.896 10.046 8.150 -0.000 0.000 0.495 252 G N -0.958 107.833 108.800 -0.016 0.000 2.365 252 G HA2 0.346 4.325 3.960 0.032 0.000 0.249 252 G HA3 0.346 4.325 3.960 0.032 0.000 0.249 252 G C 0.767 175.704 174.900 0.062 0.000 1.288 252 G CA 0.290 45.402 45.100 0.021 0.000 0.887 252 G HN 1.130 9.420 8.290 -0.000 0.000 0.524 253 V N 3.262 123.226 119.914 0.082 0.000 2.548 253 V HA -0.005 4.134 4.120 0.032 0.000 0.249 253 V C 2.465 178.645 176.094 0.144 0.000 1.055 253 V CA 2.804 65.179 62.300 0.124 0.000 1.065 253 V CB -0.594 31.301 31.823 0.121 0.000 0.681 253 V HN 0.782 8.972 8.190 -0.000 0.000 0.462 254 G N -0.670 108.200 108.800 0.117 0.000 2.404 254 G HA2 -0.148 3.831 3.960 0.032 0.000 0.214 254 G HA3 -0.148 3.831 3.960 0.032 0.000 0.214 254 G C 1.771 176.732 174.900 0.101 0.000 1.189 254 G CA 0.858 46.022 45.100 0.107 0.000 0.789 254 G HN 0.684 8.974 8.290 -0.000 0.000 0.533 255 A N 0.354 123.244 122.820 0.116 0.000 1.933 255 A HA -0.100 4.239 4.320 0.032 0.000 0.218 255 A C 2.097 179.742 177.584 0.100 0.000 1.175 255 A CA 2.177 54.284 52.037 0.116 0.000 0.628 255 A CB -0.732 18.361 19.000 0.156 0.000 0.814 255 A HN 0.569 8.719 8.150 -0.000 0.000 0.444 256 H N -0.432 118.658 119.070 0.034 0.000 2.299 256 H HA -0.051 4.524 4.556 0.031 0.000 0.302 256 H C 1.823 177.152 175.328 0.001 0.000 1.078 256 H CA 2.047 58.106 56.048 0.017 0.000 1.323 256 H CB -0.302 29.472 29.762 0.020 0.000 1.381 256 H HN 0.095 8.375 8.280 -0.000 0.000 0.498 257 V N -0.136 119.724 119.914 -0.090 0.000 2.407 257 V HA -0.213 3.926 4.120 0.032 0.000 0.248 257 V C 2.570 178.575 176.094 -0.147 0.000 1.055 257 V CA 1.515 63.728 62.300 -0.145 0.000 1.049 257 V CB -0.461 31.369 31.823 0.012 0.000 0.662 257 V HN 0.350 8.540 8.190 -0.000 0.000 0.455 258 V N -0.352 119.512 119.914 -0.083 0.000 2.515 258 V HA -0.278 3.861 4.120 0.032 0.000 0.250 258 V C 2.409 178.381 176.094 -0.203 0.000 1.058 258 V CA 2.090 64.317 62.300 -0.122 0.000 1.064 258 V CB -0.574 31.226 31.823 -0.038 0.000 0.675 258 V HN 0.575 8.765 8.190 -0.000 0.000 0.461 259 Q N 0.156 119.866 119.800 -0.150 0.000 2.079 259 Q HA -0.143 4.216 4.340 0.032 0.000 0.200 259 Q C 2.060 177.970 176.000 -0.150 0.000 0.974 259 Q CA 2.026 57.759 55.803 -0.117 0.000 0.840 259 Q CB -0.420 28.279 28.738 -0.066 0.000 0.898 259 Q HN 0.439 8.709 8.270 -0.000 0.000 0.430 260 V N 0.372 120.135 119.914 -0.251 0.000 2.427 260 V HA -0.235 3.904 4.120 0.032 0.000 0.248 260 V C 2.220 178.157 176.094 -0.263 0.000 1.051 260 V CA 1.609 63.753 62.300 -0.259 0.000 1.048 260 V CB -0.503 31.115 31.823 -0.341 0.000 0.666 260 V HN 0.374 8.564 8.190 -0.000 0.000 0.456 261 L N -1.382 119.654 121.223 -0.312 0.000 2.093 261 L HA -0.185 4.174 4.340 0.032 0.000 0.208 261 L C 2.466 179.020 176.870 -0.527 0.000 1.085 261 L CA 1.874 56.485 54.840 -0.382 0.000 0.755 261 L CB -0.705 41.139 42.059 -0.359 0.000 0.904 261 L HN 0.406 8.636 8.230 -0.000 0.000 0.435 262 Y N 1.194 121.036 120.300 -0.764 0.000 2.145 262 Y HA -0.288 4.281 4.550 0.033 0.000 0.286 262 Y C 2.287 178.044 175.900 -0.238 0.000 1.145 262 Y CA 1.787 59.532 58.100 -0.591 0.000 1.148 262 Y CB -0.252 37.966 38.460 -0.404 0.000 0.981 262 Y HN 0.191 8.471 8.280 -0.000 0.000 0.507 263 D N -0.069 120.223 120.400 -0.180 0.000 2.149 263 D HA -0.203 4.456 4.640 0.032 0.000 0.198 263 D C 1.749 177.916 176.300 -0.222 0.000 0.990 263 D CA 1.339 55.214 54.000 -0.208 0.000 0.839 263 D CB -0.408 40.341 40.800 -0.086 0.000 0.948 263 D HN 0.510 8.880 8.370 -0.000 0.000 0.460 264 N N 0.309 118.886 118.700 -0.205 0.000 2.270 264 N HA -0.067 4.693 4.740 0.032 0.000 0.181 264 N C 1.723 177.156 175.510 -0.129 0.000 1.016 264 N CA 0.848 53.798 53.050 -0.166 0.000 0.870 264 N CB 0.141 38.513 38.487 -0.192 0.000 0.979 264 N HN 0.090 8.470 8.380 -0.000 0.000 0.431 265 A N 0.892 123.636 122.820 -0.128 0.000 1.898 265 A HA -0.045 4.294 4.320 0.032 0.000 0.216 265 A C 2.490 180.009 177.584 -0.109 0.000 1.181 265 A CA 0.945 52.963 52.037 -0.033 0.000 0.620 265 A CB -0.624 18.465 19.000 0.148 0.000 0.819 265 A HN 0.071 8.221 8.150 -0.000 0.000 0.442 266 V N 0.532 120.291 119.914 -0.258 0.000 2.343 266 V HA -0.269 3.870 4.120 0.032 0.000 0.247 266 V C 2.539 178.552 176.094 -0.135 0.000 1.051 266 V CA 2.317 64.471 62.300 -0.243 0.000 1.036 266 V CB -0.653 30.928 31.823 -0.405 0.000 0.654 266 V HN 0.706 8.896 8.190 -0.000 0.000 0.451 267 K N 0.355 120.680 120.400 -0.125 0.000 2.152 267 K HA -0.186 4.153 4.320 0.032 0.000 0.206 267 K C 2.047 178.616 176.600 -0.052 0.000 1.048 267 K CA 1.561 57.801 56.287 -0.079 0.000 0.933 267 K CB -0.081 32.370 32.500 -0.080 0.000 0.721 267 K HN 0.364 8.614 8.250 -0.000 0.000 0.447 268 R N 0.297 120.770 120.500 -0.045 0.000 2.334 268 R HA 0.101 4.460 4.340 0.032 0.000 0.220 268 R C -0.340 175.954 176.300 -0.010 0.000 0.917 268 R CA 0.341 56.430 56.100 -0.018 0.000 1.073 268 R CB -0.116 30.182 30.300 -0.002 0.000 1.056 268 R HN 0.373 8.643 8.270 -0.000 0.000 0.506 269 N N 0.698 119.385 118.700 -0.021 0.000 2.727 269 N HA -0.193 4.566 4.740 0.032 0.000 0.249 269 N C -0.843 174.671 175.510 0.007 0.000 1.048 269 N CA 0.332 53.377 53.050 -0.010 0.000 0.714 269 N CB -1.091 37.394 38.487 -0.003 0.000 0.959 269 N HN 0.273 8.653 8.380 -0.000 0.000 0.544 270 I N 0.269 120.846 120.570 0.012 0.000 2.556 270 I HA -0.006 4.183 4.170 0.032 0.000 0.284 270 I C 0.822 176.962 176.117 0.038 0.000 1.114 270 I CA -0.088 61.232 61.300 0.033 0.000 1.418 270 I CB 0.415 38.447 38.000 0.054 0.000 1.394 270 I HN 0.147 8.357 8.210 -0.000 0.000 0.552 271 D N 7.267 127.691 120.400 0.041 0.000 2.342 271 D HA 0.136 4.795 4.640 0.032 0.000 0.260 271 D C -0.928 175.403 176.300 0.051 0.000 1.278 271 D CA -0.181 53.848 54.000 0.048 0.000 0.910 271 D CB 0.549 41.380 40.800 0.050 0.000 1.079 271 D HN 0.162 8.532 8.370 -0.000 0.000 0.496 272 L N 4.878 126.139 121.223 0.062 0.000 2.305 272 L HA 0.456 4.815 4.340 0.032 0.000 0.284 272 L C -0.685 176.230 176.870 0.076 0.000 1.013 272 L CA -0.468 54.410 54.840 0.063 0.000 0.819 272 L CB 1.113 43.235 42.059 0.105 0.000 1.227 272 L HN 0.213 8.443 8.230 -0.000 0.000 0.417 273 R N 6.208 126.746 120.500 0.064 0.000 2.337 273 R HA 0.539 4.898 4.340 0.032 0.000 0.319 273 R C -0.698 175.646 176.300 0.073 0.000 0.954 273 R CA -0.886 55.263 56.100 0.082 0.000 0.840 273 R CB 1.410 31.770 30.300 0.100 0.000 1.164 273 R HN 0.527 8.797 8.270 -0.000 0.000 0.472 274 M N 1.523 121.176 119.600 0.088 0.000 2.197 274 M HA 0.151 4.650 4.480 0.032 0.000 0.305 274 M C 0.746 177.105 176.300 0.098 0.000 1.162 274 M CA -0.310 55.039 55.300 0.083 0.000 1.099 274 M CB 0.122 32.776 32.600 0.090 0.000 1.430 274 M HN 0.583 8.873 8.290 -0.000 0.000 0.481 275 N N 0.027 118.778 118.700 0.085 0.000 2.727 275 N HA -0.143 4.616 4.740 0.032 0.000 0.249 275 N C -0.977 174.547 175.510 0.023 0.000 1.048 275 N CA 0.714 53.802 53.050 0.064 0.000 0.714 275 N CB -1.471 37.094 38.487 0.130 0.000 0.959 275 N HN 0.651 9.031 8.380 -0.000 0.000 0.544 276 T N 0.618 115.179 114.554 0.013 0.000 2.906 276 T HA 0.300 4.669 4.350 0.032 0.000 0.302 276 T C 0.204 174.878 174.700 -0.043 0.000 1.002 276 T CA -0.615 61.475 62.100 -0.015 0.000 0.988 276 T CB 2.134 71.016 68.868 0.024 0.000 0.972 276 T HN 0.191 8.431 8.240 -0.000 0.000 0.447 277 R N 1.974 122.429 120.500 -0.075 0.000 2.346 277 R HA 0.638 4.997 4.340 0.032 0.000 0.311 277 R C 0.410 176.673 176.300 -0.062 0.000 0.983 277 R CA -0.533 55.533 56.100 -0.058 0.000 0.880 277 R CB 0.918 31.183 30.300 -0.059 0.000 1.100 277 R HN 0.750 9.020 8.270 -0.000 0.000 0.453 278 G N 4.198 112.977 108.800 -0.035 0.000 2.378 278 G HA2 0.223 4.202 3.960 0.032 0.000 0.255 278 G HA3 0.223 4.202 3.960 0.032 0.000 0.255 278 G C 0.530 175.426 174.900 -0.006 0.000 1.270 278 G CA -0.468 44.618 45.100 -0.022 0.000 0.876 278 G HN 0.557 8.848 8.290 -0.000 0.000 0.521 279 I N 0.681 121.257 120.570 0.010 0.000 3.673 279 I HA 0.252 4.441 4.170 0.032 0.000 0.281 279 I C 0.789 176.918 176.117 0.020 0.000 1.182 279 I CA 0.774 62.093 61.300 0.032 0.000 1.391 279 I CB -0.022 38.036 38.000 0.096 0.000 1.383 279 I HN 0.510 8.720 8.210 -0.000 0.000 0.456 280 E N 1.252 121.462 120.200 0.017 0.000 2.287 280 E HA 0.346 4.715 4.350 0.032 0.000 0.274 280 E C -1.420 175.180 176.600 0.001 0.000 0.896 280 E CA -0.238 56.161 56.400 -0.001 0.000 0.788 280 E CB 2.928 32.617 29.700 -0.018 0.000 1.244 280 E HN -0.192 8.168 8.360 -0.000 0.000 0.408 281 V N 5.416 125.329 119.914 -0.002 0.000 2.572 281 V HA 0.157 4.296 4.120 0.032 0.000 0.291 281 V C 0.320 176.407 176.094 -0.012 0.000 1.039 281 V CA 0.113 62.417 62.300 0.006 0.000 1.055 281 V CB 0.564 32.389 31.823 0.004 0.000 0.969 281 V HN 0.575 8.765 8.190 -0.000 0.000 0.482 282 L N 6.025 127.245 121.223 -0.005 0.000 2.322 282 L HA 0.615 4.974 4.340 0.032 0.000 0.279 282 L C 0.051 176.910 176.870 -0.017 0.000 1.036 282 L CA -0.563 54.250 54.840 -0.045 0.000 0.807 282 L CB 1.276 43.277 42.059 -0.097 0.000 1.226 282 L HN 0.553 8.783 8.230 -0.000 0.000 0.433 283 K N 0.877 121.256 120.400 -0.035 0.000 2.385 283 K HA 0.388 4.727 4.320 0.032 0.000 0.248 283 K C -1.132 175.458 176.600 -0.016 0.000 0.955 283 K CA -0.955 55.326 56.287 -0.010 0.000 0.816 283 K CB 2.200 34.692 32.500 -0.013 0.000 1.250 283 K HN 0.605 8.855 8.250 -0.000 0.000 0.434 284 D N -0.647 119.759 120.400 0.009 0.000 2.469 284 D HA -0.042 4.618 4.640 0.032 0.000 0.278 284 D C 0.470 176.769 176.300 -0.001 0.000 1.231 284 D CA -0.294 53.710 54.000 0.007 0.000 1.075 284 D CB 0.080 40.897 40.800 0.029 0.000 1.121 284 D HN 0.624 8.994 8.370 -0.000 0.000 0.571 285 D N -2.061 118.340 120.400 0.001 0.000 2.371 285 D HA -0.084 4.575 4.640 0.032 0.000 0.221 285 D C 1.088 177.390 176.300 0.002 0.000 0.986 285 D CA 0.632 54.631 54.000 -0.002 0.000 0.899 285 D CB -0.094 40.705 40.800 -0.001 0.000 0.902 285 D HN 0.245 8.615 8.370 -0.000 0.000 0.530 286 K N -0.687 119.719 120.400 0.010 0.000 2.373 286 K HA 0.242 4.581 4.320 0.032 0.000 0.202 286 K C 0.885 177.493 176.600 0.014 0.000 1.025 286 K CA 0.288 56.583 56.287 0.013 0.000 1.115 286 K CB 0.753 33.265 32.500 0.021 0.000 0.858 286 K HN 0.239 8.489 8.250 -0.000 0.000 0.525 287 G N 2.187 110.993 108.800 0.009 0.000 2.136 287 G HA2 -0.278 3.701 3.960 0.032 0.000 0.242 287 G HA3 -0.278 3.701 3.960 0.032 0.000 0.242 287 G C 0.166 175.075 174.900 0.015 0.000 0.989 287 G CA 0.728 45.831 45.100 0.005 0.000 0.682 287 G HN 0.407 8.697 8.290 -0.000 0.000 0.522 288 T N -2.258 112.318 114.554 0.037 0.000 2.943 288 T HA 0.696 5.065 4.350 0.032 0.000 0.284 288 T C 0.532 175.272 174.700 0.066 0.000 1.015 288 T CA -0.242 61.897 62.100 0.065 0.000 1.042 288 T CB 2.318 71.260 68.868 0.124 0.000 1.055 288 T HN 0.843 9.083 8.240 -0.000 0.000 0.500 289 V N 3.449 123.407 119.914 0.073 0.000 2.673 289 V HA 0.173 4.312 4.120 0.032 0.000 0.303 289 V C 1.441 177.606 176.094 0.119 0.000 1.046 289 V CA 0.557 62.904 62.300 0.079 0.000 1.126 289 V CB 0.453 32.320 31.823 0.073 0.000 0.934 289 V HN 1.111 9.301 8.190 -0.000 0.000 0.487 290 K N 2.859 123.325 120.400 0.109 0.000 2.440 290 K HA 0.576 4.915 4.320 0.032 0.000 0.207 290 K C 0.511 177.240 176.600 0.214 0.000 1.112 290 K CA 0.412 56.786 56.287 0.147 0.000 1.036 290 K CB 1.214 33.782 32.500 0.114 0.000 0.935 290 K HN 0.908 9.158 8.250 -0.000 0.000 0.564 291 G N 1.032 109.946 108.800 0.191 0.000 2.345 291 G HA2 0.268 4.247 3.960 0.032 0.000 0.285 291 G HA3 0.268 4.247 3.960 0.032 0.000 0.285 291 G C -2.222 172.792 174.900 0.190 0.000 1.297 291 G CA -0.650 44.605 45.100 0.260 0.000 0.875 291 G HN 0.131 8.421 8.290 -0.000 0.000 0.506 292 I N -0.421 120.287 120.570 0.229 0.000 2.692 292 I HA 0.650 4.839 4.170 0.032 0.000 0.293 292 I C -1.431 174.788 176.117 0.170 0.000 1.200 292 I CA -1.122 60.264 61.300 0.142 0.000 1.036 292 I CB 1.934 39.989 38.000 0.092 0.000 1.258 292 I HN 0.719 8.929 8.210 -0.000 0.000 0.421 293 L N 8.918 130.202 121.223 0.101 0.000 2.290 293 L HA 0.622 4.982 4.340 0.032 0.000 0.284 293 L C -0.704 176.184 176.870 0.030 0.000 1.078 293 L CA 0.028 54.929 54.840 0.101 0.000 0.815 293 L CB 1.300 43.396 42.059 0.061 0.000 1.162 293 L HN 0.419 8.649 8.230 -0.000 0.000 0.435 294 V N 2.341 122.203 119.914 -0.087 0.000 3.019 294 V HA 0.659 4.798 4.120 0.032 0.000 0.317 294 V C -0.700 175.259 176.094 -0.224 0.000 1.094 294 V CA -1.005 61.175 62.300 -0.200 0.000 1.000 294 V CB 1.795 33.393 31.823 -0.374 0.000 1.060 294 V HN 0.845 9.035 8.190 -0.000 0.000 0.443 295 K N 1.800 122.045 120.400 -0.258 0.000 2.507 295 K HA 0.627 4.967 4.320 0.032 0.000 0.253 295 K C 0.004 176.439 176.600 -0.274 0.000 0.969 295 K CA -0.249 55.785 56.287 -0.420 0.000 0.908 295 K CB 1.090 33.246 32.500 -0.573 0.000 1.127 295 K HN 1.226 9.476 8.250 -0.000 0.000 0.437 296 G N 3.419 112.114 108.800 -0.175 0.000 2.370 296 G HA2 0.093 4.072 3.960 0.032 0.000 0.272 296 G HA3 0.093 4.072 3.960 0.032 0.000 0.272 296 G C 0.699 175.526 174.900 -0.122 0.000 1.208 296 G CA -0.572 44.502 45.100 -0.044 0.000 0.856 296 G HN 0.870 9.160 8.290 -0.000 0.000 0.500 297 M N 2.505 121.994 119.600 -0.184 0.000 2.159 297 M HA -0.086 4.413 4.480 0.032 0.000 0.263 297 M C 1.266 177.294 176.300 -0.452 0.000 1.063 297 M CA 1.733 56.795 55.300 -0.397 0.000 1.110 297 M CB -0.039 32.191 32.600 -0.616 0.000 1.374 297 M HN 0.714 9.004 8.290 -0.000 0.000 0.411 298 Y N -1.044 119.265 120.300 0.015 0.000 2.524 298 Y HA 0.154 4.723 4.550 0.032 0.000 0.270 298 Y C 1.868 177.784 175.900 0.025 0.000 1.094 298 Y CA -0.037 58.080 58.100 0.028 0.000 1.276 298 Y CB 0.256 38.744 38.460 0.046 0.000 1.130 298 Y HN 0.034 8.314 8.280 -0.000 0.000 0.536 299 K N 0.129 120.617 120.400 0.146 0.000 2.354 299 K HA 0.370 4.709 4.320 0.032 0.000 0.194 299 K C 0.969 177.622 176.600 0.088 0.000 1.038 299 K CA 0.789 57.137 56.287 0.101 0.000 1.052 299 K CB 0.330 32.869 32.500 0.066 0.000 0.861 299 K HN 0.364 8.614 8.250 -0.000 0.000 0.535 300 G N 0.806 109.633 108.800 0.045 0.000 2.587 300 G HA2 -0.256 3.723 3.960 0.032 0.000 0.212 300 G HA3 -0.256 3.723 3.960 0.032 0.000 0.212 300 G C -1.080 173.835 174.900 0.024 0.000 1.327 300 G CA -0.827 44.281 45.100 0.012 0.000 0.898 300 G HN 0.066 8.356 8.290 -0.000 0.000 0.551 301 Y N 0.748 121.105 120.300 0.095 0.000 2.359 301 Y HA 0.568 5.137 4.550 0.032 0.000 0.330 301 Y C 0.933 176.956 175.900 0.205 0.000 1.143 301 Y CA 1.200 59.347 58.100 0.079 0.000 1.318 301 Y CB 0.945 39.439 38.460 0.057 0.000 1.234 301 Y HN 0.834 9.114 8.280 -0.000 0.000 0.522 302 Y N 0.667 121.110 120.300 0.239 0.000 2.725 302 Y HA 0.630 5.199 4.550 0.032 0.000 0.333 302 Y C -1.779 174.310 175.900 0.314 0.000 1.242 302 Y CA -2.416 55.816 58.100 0.221 0.000 1.059 302 Y CB 1.042 39.535 38.460 0.055 0.000 1.306 302 Y HN 0.591 8.871 8.280 -0.000 0.000 0.454 303 W N 0.908 122.386 121.300 0.296 0.000 2.950 303 W HA 0.830 5.509 4.660 0.031 0.000 0.340 303 W C -2.428 174.247 176.519 0.260 0.000 1.139 303 W CA -1.625 55.816 57.345 0.160 0.000 1.188 303 W CB 0.970 30.490 29.460 0.100 0.000 1.426 303 W HN 0.545 8.725 8.180 -0.000 0.000 0.531 304 V N 2.843 122.936 119.914 0.298 0.000 2.448 304 V HA 0.275 4.414 4.120 0.032 0.000 0.295 304 V C 0.036 176.237 176.094 0.179 0.000 1.025 304 V CA -0.971 61.406 62.300 0.128 0.000 0.859 304 V CB 1.490 33.416 31.823 0.171 0.000 0.988 304 V HN 0.528 8.718 8.190 -0.000 0.000 0.431 305 K N 3.694 124.085 120.400 -0.016 0.000 2.258 305 K HA 0.767 5.106 4.320 0.032 0.000 0.284 305 K C -0.448 176.228 176.600 0.127 0.000 1.051 305 K CA -0.042 56.323 56.287 0.130 0.000 0.923 305 K CB 1.079 33.567 32.500 -0.020 0.000 1.046 305 K HN 0.918 9.168 8.250 -0.000 0.000 0.474 306 A N 3.391 126.314 122.820 0.172 0.000 2.610 306 A HA 0.260 4.599 4.320 0.032 0.000 0.291 306 A C -0.598 177.084 177.584 0.163 0.000 1.086 306 A CA -0.766 51.356 52.037 0.141 0.000 0.677 306 A CB 1.206 20.286 19.000 0.132 0.000 1.278 306 A HN 0.794 8.944 8.150 -0.000 0.000 0.414 307 D N 0.211 120.710 120.400 0.166 0.000 2.194 307 D HA 0.313 4.972 4.640 0.032 0.000 0.204 307 D C 0.802 177.289 176.300 0.311 0.000 0.964 307 D CA 2.031 56.171 54.000 0.234 0.000 0.846 307 D CB 0.321 41.250 40.800 0.215 0.000 0.962 307 D HN 0.859 9.229 8.370 -0.000 0.000 0.490 308 A N -0.013 122.947 122.820 0.233 0.000 2.515 308 A HA 0.588 4.927 4.320 0.032 0.000 0.298 308 A C -1.168 176.507 177.584 0.151 0.000 1.059 308 A CA -0.543 51.616 52.037 0.203 0.000 0.698 308 A CB 2.060 21.192 19.000 0.220 0.000 1.289 308 A HN -0.107 8.043 8.150 -0.000 0.000 0.404 309 V N 2.559 122.564 119.914 0.152 0.000 2.487 309 V HA 0.437 4.576 4.120 0.032 0.000 0.298 309 V C -0.624 175.561 176.094 0.151 0.000 1.028 309 V CA -0.179 62.193 62.300 0.119 0.000 0.860 309 V CB 1.502 33.377 31.823 0.087 0.000 0.991 309 V HN 0.717 8.907 8.190 -0.000 0.000 0.427 310 I N 5.867 126.504 120.570 0.112 0.000 2.328 310 I HA 0.392 4.581 4.170 0.032 0.000 0.287 310 I C -0.482 175.682 176.117 0.078 0.000 1.012 310 I CA -0.392 60.980 61.300 0.119 0.000 1.195 310 I CB 1.380 39.419 38.000 0.064 0.000 1.350 310 I HN 0.356 8.566 8.210 -0.000 0.000 0.464 311 L N 6.583 127.852 121.223 0.077 0.000 2.278 311 L HA 0.503 4.862 4.340 0.032 0.000 0.287 311 L C 0.619 177.519 176.870 0.049 0.000 1.072 311 L CA -0.143 54.726 54.840 0.048 0.000 0.819 311 L CB 1.060 43.139 42.059 0.034 0.000 1.176 311 L HN 0.723 8.953 8.230 -0.000 0.000 0.435 312 A N 1.231 124.075 122.820 0.039 0.000 3.129 312 A HA 0.277 4.617 4.320 0.032 0.000 0.282 312 A C 0.898 178.502 177.584 0.034 0.000 0.948 312 A CA -0.250 51.814 52.037 0.044 0.000 1.027 312 A CB -0.140 18.890 19.000 0.049 0.000 1.123 312 A HN 0.738 8.888 8.150 -0.000 0.000 0.485 313 T N -3.085 111.487 114.554 0.030 0.000 3.129 313 T HA 0.459 4.828 4.350 0.032 0.000 0.251 313 T C 1.212 175.931 174.700 0.031 0.000 1.117 313 T CA 0.871 62.988 62.100 0.027 0.000 1.034 313 T CB -0.166 68.717 68.868 0.024 0.000 0.968 313 T HN 2.044 10.284 8.240 -0.000 0.000 0.526 314 G N 0.146 108.964 108.800 0.030 0.000 2.681 314 G HA2 0.235 4.214 3.960 0.032 0.000 0.220 314 G HA3 0.235 4.214 3.960 0.032 0.000 0.220 314 G C 0.077 174.981 174.900 0.007 0.000 1.353 314 G CA -0.520 44.588 45.100 0.014 0.000 0.872 314 G HN 0.904 9.194 8.290 -0.000 0.000 0.557 315 G N -1.774 107.002 108.800 -0.040 0.000 2.583 315 G HA2 0.769 4.748 3.960 0.032 0.000 0.280 315 G HA3 0.769 4.748 3.960 0.032 0.000 0.280 315 G C 0.304 175.252 174.900 0.079 0.000 1.376 315 G CA 0.253 45.332 45.100 -0.035 0.000 1.043 315 G HN 1.714 10.004 8.290 -0.000 0.000 0.538 316 F N -2.166 117.747 119.950 -0.062 0.000 2.805 316 F HA 0.616 5.171 4.527 0.047 0.000 0.317 316 F C 1.567 177.353 175.800 -0.023 0.000 1.146 316 F CA -0.168 57.812 58.000 -0.032 0.000 1.265 316 F CB 0.303 39.287 39.000 -0.026 0.000 0.992 316 F HN 0.366 8.666 8.300 -0.000 0.000 0.511 317 A N 0.779 123.469 122.820 -0.216 0.000 2.121 317 A HA -0.119 4.220 4.320 0.032 0.000 0.218 317 A C 2.163 179.725 177.584 -0.036 0.000 1.154 317 A CA 1.401 53.327 52.037 -0.185 0.000 0.679 317 A CB -0.372 18.524 19.000 -0.174 0.000 0.795 317 A HN 0.356 8.506 8.150 -0.000 0.000 0.458 318 K N 0.515 120.923 120.400 0.014 0.000 2.366 318 K HA -0.024 4.315 4.320 0.032 0.000 0.198 318 K C 0.520 177.163 176.600 0.071 0.000 1.044 318 K CA 0.418 56.731 56.287 0.043 0.000 0.973 318 K CB -0.147 32.382 32.500 0.048 0.000 0.767 318 K HN 0.367 8.617 8.250 -0.000 0.000 0.475 319 N N 1.329 120.095 118.700 0.110 0.000 2.719 319 N HA -0.005 4.754 4.740 0.032 0.000 0.243 319 N C -0.004 175.579 175.510 0.123 0.000 1.104 319 N CA 0.103 53.227 53.050 0.123 0.000 0.981 319 N CB -0.215 38.364 38.487 0.154 0.000 1.290 319 N HN 0.233 8.613 8.380 -0.000 0.000 0.513 320 N N 1.210 119.960 118.700 0.084 0.000 2.309 320 N HA -0.146 4.613 4.740 0.032 0.000 0.182 320 N C 0.562 176.113 175.510 0.068 0.000 1.018 320 N CA 0.928 54.022 53.050 0.074 0.000 0.876 320 N CB 0.530 39.057 38.487 0.066 0.000 0.972 320 N HN 0.418 8.798 8.380 -0.000 0.000 0.434 321 E N 0.398 120.633 120.200 0.058 0.000 2.072 321 E HA -0.134 4.235 4.350 0.032 0.000 0.191 321 E C 2.004 178.629 176.600 0.042 0.000 0.985 321 E CA 0.764 57.188 56.400 0.040 0.000 0.801 321 E CB -0.269 29.446 29.700 0.025 0.000 0.750 321 E HN 0.480 8.840 8.360 -0.000 0.000 0.452 322 R N 0.063 120.598 120.500 0.059 0.000 2.075 322 R HA -0.081 4.278 4.340 0.032 0.000 0.232 322 R C 2.426 178.809 176.300 0.137 0.000 1.126 322 R CA 1.262 57.389 56.100 0.045 0.000 0.963 322 R CB -0.384 29.898 30.300 -0.029 0.000 0.858 322 R HN 0.223 8.493 8.270 -0.000 0.000 0.435 323 V N 0.983 121.025 119.914 0.213 0.000 2.287 323 V HA -0.248 3.891 4.120 0.032 0.000 0.248 323 V C 2.402 178.545 176.094 0.081 0.000 1.053 323 V CA 2.046 64.457 62.300 0.186 0.000 1.027 323 V CB -0.696 31.182 31.823 0.091 0.000 0.646 323 V HN 0.544 8.734 8.190 -0.000 0.000 0.447 324 A N -0.711 122.140 122.820 0.051 0.000 2.015 324 A HA -0.195 4.144 4.320 0.032 0.000 0.219 324 A C 2.258 179.851 177.584 0.016 0.000 1.163 324 A CA 1.622 53.672 52.037 0.022 0.000 0.646 324 A CB -0.394 18.620 19.000 0.025 0.000 0.806 324 A HN 0.556 8.706 8.150 -0.000 0.000 0.448 325 K N -0.578 119.833 120.400 0.020 0.000 2.097 325 K HA -0.016 4.323 4.320 0.032 0.000 0.206 325 K C 1.616 178.217 176.600 0.001 0.000 1.049 325 K CA 1.322 57.611 56.287 0.003 0.000 0.933 325 K CB -0.253 32.242 32.500 -0.009 0.000 0.717 325 K HN 0.467 8.717 8.250 -0.000 0.000 0.442 326 L N -0.139 121.096 121.223 0.020 0.000 2.249 326 L HA 0.004 4.363 4.340 0.032 0.000 0.207 326 L C 0.465 177.333 176.870 -0.004 0.000 1.090 326 L CA 0.423 55.271 54.840 0.013 0.000 0.802 326 L CB 0.322 42.421 42.059 0.067 0.000 0.947 326 L HN 0.075 8.305 8.230 -0.000 0.000 0.453 327 D N -1.212 119.186 120.400 -0.002 0.000 2.381 327 D HA 0.176 4.836 4.640 0.032 0.000 0.245 327 D C -2.072 174.206 176.300 -0.036 0.000 1.297 327 D CA -1.720 52.264 54.000 -0.026 0.000 0.931 327 D CB 1.389 42.166 40.800 -0.038 0.000 1.334 327 D HN -0.226 8.144 8.370 -0.000 0.000 0.535 328 P HA -0.164 4.256 4.420 -0.000 0.000 0.218 328 P C 1.406 178.691 177.300 -0.024 0.000 1.146 328 P CA 1.131 64.222 63.100 -0.015 0.000 0.813 328 P CB 0.188 31.884 31.700 -0.007 0.000 0.778 329 S N -1.267 114.404 115.700 -0.048 0.000 2.474 329 S HA -0.070 4.419 4.470 0.032 0.000 0.235 329 S C 1.535 176.030 174.600 -0.176 0.000 0.997 329 S CA 0.837 58.998 58.200 -0.065 0.000 0.949 329 S CB -1.285 61.871 63.200 -0.072 0.000 0.766 329 S HN 0.145 8.455 8.310 -0.000 0.000 0.517 330 L N 0.417 121.497 121.223 -0.238 0.000 2.628 330 L HA 0.328 4.687 4.340 0.032 0.000 0.229 330 L C 0.971 177.763 176.870 -0.130 0.000 1.137 330 L CA -0.236 54.330 54.840 -0.458 0.000 0.909 330 L CB -0.117 41.699 42.059 -0.406 0.000 1.137 330 L HN 0.208 8.438 8.230 -0.000 0.000 0.470 331 K N 0.873 121.283 120.400 0.017 0.000 2.451 331 K HA 0.195 4.534 4.320 0.032 0.000 0.280 331 K C 1.189 177.908 176.600 0.198 0.000 1.020 331 K CA 0.992 57.333 56.287 0.089 0.000 1.008 331 K CB 0.446 32.982 32.500 0.060 0.000 0.917 331 K HN 0.190 8.440 8.250 -0.000 0.000 0.478 332 G N 3.214 112.113 108.800 0.165 0.000 2.199 332 G HA2 -0.264 3.715 3.960 0.032 0.000 0.254 332 G HA3 -0.264 3.715 3.960 0.032 0.000 0.254 332 G C -0.163 174.841 174.900 0.173 0.000 0.982 332 G CA -0.076 45.110 45.100 0.143 0.000 0.632 332 G HN 0.493 8.783 8.290 -0.000 0.000 0.529 333 F N 1.802 121.740 119.950 -0.021 0.000 2.410 333 F HA 0.595 5.093 4.527 -0.048 0.000 0.334 333 F C 1.648 177.430 175.800 -0.030 0.000 1.134 333 F CA -0.986 56.996 58.000 -0.031 0.000 1.227 333 F CB 0.489 39.466 39.000 -0.038 0.000 1.194 333 F HN 0.324 8.624 8.300 -0.000 0.000 0.571 334 I N -0.644 119.984 120.570 0.097 0.000 3.079 334 I HA 0.495 4.684 4.170 0.032 0.000 0.295 334 I C 0.125 176.284 176.117 0.070 0.000 1.094 334 I CA -0.395 60.931 61.300 0.043 0.000 1.295 334 I CB 1.213 39.200 38.000 -0.022 0.000 1.443 334 I HN 0.429 8.639 8.210 -0.000 0.000 0.607 335 S N 0.354 116.075 115.700 0.034 0.000 2.600 335 S HA 0.439 4.928 4.470 0.032 0.000 0.300 335 S C 0.669 175.281 174.600 0.020 0.000 1.087 335 S CA -0.087 58.136 58.200 0.038 0.000 0.965 335 S CB 1.646 64.864 63.200 0.030 0.000 1.089 335 S HN 0.846 9.156 8.310 -0.000 0.000 0.496 336 T N 0.147 114.733 114.554 0.054 0.000 3.100 336 T HA 0.242 4.611 4.350 0.032 0.000 0.253 336 T C 0.529 175.252 174.700 0.040 0.000 1.118 336 T CA 0.043 62.177 62.100 0.056 0.000 1.058 336 T CB -0.644 68.335 68.868 0.185 0.000 0.953 336 T HN 0.527 8.767 8.240 -0.000 0.000 0.515 337 N N 2.003 120.716 118.700 0.022 0.000 2.434 337 N HA 0.299 5.058 4.740 0.032 0.000 0.266 337 N C -0.145 175.373 175.510 0.014 0.000 1.223 337 N CA -0.790 52.267 53.050 0.012 0.000 0.972 337 N CB 0.754 39.240 38.487 -0.002 0.000 1.207 337 N HN 0.434 8.814 8.380 -0.000 0.000 0.525 338 Q N 0.679 120.500 119.800 0.034 0.000 2.454 338 Q HA 0.141 4.501 4.340 0.032 0.000 0.247 338 Q C -2.066 173.965 176.000 0.050 0.000 1.028 338 Q CA -0.736 55.100 55.803 0.056 0.000 0.910 338 Q CB 0.196 28.988 28.738 0.091 0.000 1.276 338 Q HN 0.324 8.594 8.270 -0.000 0.000 0.489 339 P HA -0.085 4.335 4.420 -0.000 0.000 0.220 339 P C 0.573 177.949 177.300 0.127 0.000 1.148 339 P CA 1.620 64.777 63.100 0.096 0.000 0.803 339 P CB 0.027 31.822 31.700 0.158 0.000 0.782 340 G N -0.327 108.552 108.800 0.132 0.000 3.141 340 G HA2 0.241 4.220 3.960 0.032 0.000 0.218 340 G HA3 0.241 4.220 3.960 0.032 0.000 0.218 340 G C 0.777 175.727 174.900 0.083 0.000 1.170 340 G CA 0.146 45.313 45.100 0.112 0.000 0.769 340 G HN 0.372 8.662 8.290 -0.000 0.000 0.546 341 A N 1.070 123.934 122.820 0.073 0.000 3.037 341 A HA 0.473 4.812 4.320 0.032 0.000 0.272 341 A C 1.189 178.824 177.584 0.084 0.000 1.723 341 A CA 0.045 52.118 52.037 0.060 0.000 1.413 341 A CB -0.388 18.630 19.000 0.030 0.000 1.112 341 A HN 0.797 8.947 8.150 -0.000 0.000 0.606 342 V N -1.462 118.509 119.914 0.096 0.000 3.477 342 V HA 0.569 4.708 4.120 0.032 0.000 0.297 342 V C 1.022 177.186 176.094 0.117 0.000 1.433 342 V CA 0.450 62.818 62.300 0.113 0.000 1.052 342 V CB -0.583 31.285 31.823 0.076 0.000 0.895 342 V HN 1.636 9.826 8.190 -0.000 0.000 0.438 343 G N 2.019 110.889 108.800 0.116 0.000 2.141 343 G HA2 -0.290 3.689 3.960 0.032 0.000 0.242 343 G HA3 -0.290 3.689 3.960 0.032 0.000 0.242 343 G C 0.464 175.363 174.900 -0.002 0.000 0.982 343 G CA 0.535 45.674 45.100 0.064 0.000 0.662 343 G HN 0.704 8.994 8.290 -0.000 0.000 0.527 344 D N 0.610 121.017 120.400 0.012 0.000 2.178 344 D HA -0.022 4.637 4.640 0.032 0.000 0.202 344 D C 2.260 178.558 176.300 -0.004 0.000 0.974 344 D CA 1.610 55.608 54.000 -0.003 0.000 0.841 344 D CB -1.167 39.636 40.800 0.004 0.000 0.953 344 D HN 0.684 9.054 8.370 -0.000 0.000 0.478 345 G N 1.125 109.930 108.800 0.008 0.000 2.442 345 G HA2 -0.198 3.781 3.960 0.032 0.000 0.219 345 G HA3 -0.198 3.781 3.960 0.032 0.000 0.219 345 G C 1.913 176.811 174.900 -0.004 0.000 1.141 345 G CA 0.649 45.754 45.100 0.007 0.000 0.763 345 G HN 0.307 8.597 8.290 -0.000 0.000 0.554 346 L N 0.380 121.596 121.223 -0.013 0.000 2.093 346 L HA -0.053 4.306 4.340 0.032 0.000 0.208 346 L C 2.495 179.336 176.870 -0.049 0.000 1.085 346 L CA 1.102 55.921 54.840 -0.035 0.000 0.755 346 L CB -0.342 41.674 42.059 -0.071 0.000 0.904 346 L HN 0.105 8.335 8.230 -0.000 0.000 0.435 347 D N -0.307 120.061 120.400 -0.052 0.000 2.117 347 D HA -0.146 4.513 4.640 0.032 0.000 0.197 347 D C 2.333 178.613 176.300 -0.034 0.000 0.987 347 D CA 1.068 55.038 54.000 -0.049 0.000 0.829 347 D CB -0.248 40.524 40.800 -0.047 0.000 0.961 347 D HN 0.097 8.467 8.370 -0.000 0.000 0.460 348 V N 1.528 121.428 119.914 -0.023 0.000 2.343 348 V HA -0.247 3.893 4.120 0.032 0.000 0.247 348 V C 2.552 178.634 176.094 -0.020 0.000 1.051 348 V CA 1.814 64.105 62.300 -0.016 0.000 1.036 348 V CB -0.849 30.970 31.823 -0.007 0.000 0.654 348 V HN 0.185 8.375 8.190 -0.000 0.000 0.451 349 A N -0.623 122.185 122.820 -0.021 0.000 1.883 349 A HA -0.264 4.075 4.320 0.032 0.000 0.217 349 A C 2.236 179.801 177.584 -0.032 0.000 1.186 349 A CA 1.987 54.010 52.037 -0.025 0.000 0.624 349 A CB -0.540 18.446 19.000 -0.022 0.000 0.822 349 A HN 0.587 8.737 8.150 -0.000 0.000 0.444 350 E N -0.286 119.891 120.200 -0.037 0.000 2.077 350 E HA -0.189 4.180 4.350 0.032 0.000 0.193 350 E C 1.651 178.228 176.600 -0.038 0.000 0.989 350 E CA 1.139 57.515 56.400 -0.041 0.000 0.800 350 E CB -0.193 29.478 29.700 -0.048 0.000 0.746 350 E HN 0.540 8.900 8.360 -0.000 0.000 0.452 351 N N 0.446 119.125 118.700 -0.035 0.000 2.289 351 N HA -0.117 4.642 4.740 0.032 0.000 0.184 351 N C 1.348 176.838 175.510 -0.033 0.000 1.016 351 N CA 1.032 54.061 53.050 -0.034 0.000 0.872 351 N CB -0.139 38.329 38.487 -0.032 0.000 0.973 351 N HN 0.104 8.484 8.380 -0.000 0.000 0.433 352 A N -0.560 122.241 122.820 -0.032 0.000 2.208 352 A HA 0.421 4.760 4.320 0.032 0.000 0.209 352 A C 1.537 179.100 177.584 -0.036 0.000 1.161 352 A CA 0.994 53.012 52.037 -0.032 0.000 0.782 352 A CB -0.114 18.869 19.000 -0.030 0.000 0.816 352 A HN 0.328 8.478 8.150 -0.000 0.000 0.477 353 G N -2.211 106.567 108.800 -0.036 0.000 2.192 353 G HA2 0.013 3.993 3.960 0.032 0.000 0.193 353 G HA3 0.013 3.993 3.960 0.032 0.000 0.193 353 G C 0.667 175.543 174.900 -0.039 0.000 0.999 353 G CA 0.024 45.102 45.100 -0.037 0.000 0.659 353 G HN 1.306 9.596 8.290 -0.000 0.000 0.503 354 G N 0.365 109.140 108.800 -0.042 0.000 2.483 354 G HA2 0.692 4.671 3.960 0.032 0.000 0.248 354 G HA3 0.692 4.671 3.960 0.032 0.000 0.248 354 G C 0.365 175.242 174.900 -0.038 0.000 1.248 354 G CA 0.873 45.947 45.100 -0.043 0.000 0.838 354 G HN 1.470 9.760 8.290 -0.000 0.000 0.566 355 A N 1.283 124.082 122.820 -0.035 0.000 2.294 355 A HA 0.785 5.124 4.320 0.032 0.000 0.330 355 A C 0.050 177.617 177.584 -0.028 0.000 1.133 355 A CA -0.636 51.383 52.037 -0.031 0.000 0.836 355 A CB 0.887 19.871 19.000 -0.027 0.000 1.190 355 A HN 0.653 8.803 8.150 -0.000 0.000 0.492 356 L N 0.660 121.867 121.223 -0.027 0.000 2.332 356 L HA 0.677 5.036 4.340 0.032 0.000 0.269 356 L C 0.156 177.021 176.870 -0.009 0.000 1.016 356 L CA -0.794 54.034 54.840 -0.020 0.000 0.809 356 L CB 1.727 43.767 42.059 -0.032 0.000 1.280 356 L HN 0.952 9.182 8.230 -0.000 0.000 0.447 357 K N -1.193 119.212 120.400 0.009 0.000 2.536 357 K HA 0.408 4.747 4.320 0.032 0.000 0.269 357 K C -1.057 175.578 176.600 0.058 0.000 0.965 357 K CA -0.798 55.503 56.287 0.024 0.000 0.860 357 K CB 1.964 34.480 32.500 0.026 0.000 1.423 357 K HN 0.409 8.659 8.250 -0.000 0.000 0.438 358 D N 0.810 121.254 120.400 0.073 0.000 2.983 358 D HA -0.171 4.488 4.640 0.032 0.000 0.225 358 D C 0.792 177.144 176.300 0.086 0.000 1.174 358 D CA 1.027 55.112 54.000 0.141 0.000 0.831 358 D CB -0.558 40.422 40.800 0.300 0.000 1.104 358 D HN 0.619 8.989 8.370 -0.000 0.000 0.421 359 M N -0.300 119.319 119.600 0.032 0.000 2.358 359 M HA -0.160 4.339 4.480 0.032 0.000 0.264 359 M C 2.258 178.589 176.300 0.053 0.000 1.064 359 M CA 1.410 56.763 55.300 0.089 0.000 1.093 359 M CB -0.527 32.097 32.600 0.039 0.000 1.401 359 M HN 0.344 8.634 8.290 -0.000 0.000 0.440 360 Q N -0.203 119.504 119.800 -0.154 0.000 2.435 360 Q HA -0.107 4.252 4.340 0.032 0.000 0.207 360 Q C -0.415 175.476 176.000 -0.182 0.000 0.956 360 Q CA 0.761 56.440 55.803 -0.208 0.000 0.917 360 Q CB -0.717 27.811 28.738 -0.350 0.000 0.997 360 Q HN 0.372 8.642 8.270 -0.000 0.000 0.497 361 Y N 1.462 121.804 120.300 0.070 0.000 2.556 361 Y HA 0.422 4.988 4.550 0.027 0.000 0.352 361 Y C 0.082 176.019 175.900 0.062 0.000 1.006 361 Y CA -0.889 57.248 58.100 0.062 0.000 1.277 361 Y CB 0.271 38.769 38.460 0.063 0.000 1.136 361 Y HN -0.021 8.259 8.280 -0.000 0.000 0.523 362 I N 4.305 124.979 120.570 0.174 0.000 2.436 362 I HA 0.222 4.411 4.170 0.032 0.000 0.289 362 I C -0.916 175.288 176.117 0.144 0.000 1.010 362 I CA -0.943 60.409 61.300 0.087 0.000 1.098 362 I CB 1.609 39.593 38.000 -0.025 0.000 1.266 362 I HN 0.288 8.498 8.210 -0.000 0.000 0.434 363 F N 6.537 126.502 119.950 0.025 0.000 2.405 363 F HA 0.685 5.310 4.527 0.163 0.000 0.355 363 F C 0.149 175.979 175.800 0.050 0.000 1.121 363 F CA -0.740 57.282 58.000 0.037 0.000 1.112 363 F CB 1.025 40.066 39.000 0.069 0.000 1.126 363 F HN 0.465 8.765 8.300 -0.000 0.000 0.481 364 A N 5.936 128.366 122.820 -0.650 0.000 2.252 364 A HA 0.251 4.590 4.320 0.032 0.000 0.309 364 A C -0.564 176.371 177.584 -1.083 0.000 1.285 364 A CA -0.534 51.139 52.037 -0.607 0.000 0.900 364 A CB -0.186 18.596 19.000 -0.363 0.000 1.157 364 A HN 0.851 9.001 8.150 -0.000 0.000 0.536 365 H N 5.343 123.892 119.070 -0.869 0.000 2.886 365 H HA 0.093 4.563 4.556 -0.144 0.000 0.329 365 H C -1.576 173.538 175.328 -0.357 0.000 1.044 365 H CA -1.017 54.627 56.048 -0.675 0.000 1.456 365 H CB 1.448 30.910 29.762 -0.499 0.000 1.464 365 H HN 0.428 8.708 8.280 -0.000 0.000 0.573 366 P HA -0.068 4.352 4.420 -0.000 0.000 0.222 366 P C 0.293 177.622 177.300 0.049 0.000 1.153 366 P CA 0.857 63.917 63.100 -0.066 0.000 0.798 366 P CB 0.241 31.889 31.700 -0.087 0.000 0.796 367 T N -1.335 113.353 114.554 0.224 0.000 3.253 367 T HA 0.519 4.888 4.350 0.032 0.000 0.391 367 T C -0.082 174.603 174.700 -0.025 0.000 1.527 367 T CA -0.701 61.451 62.100 0.086 0.000 1.268 367 T CB -0.507 68.393 68.868 0.053 0.000 1.126 367 T HN -0.156 8.084 8.240 -0.000 0.000 0.620 368 L N 1.749 122.930 121.223 -0.070 0.000 2.325 368 L HA 0.542 4.901 4.340 0.032 0.000 0.279 368 L C 0.930 177.724 176.870 -0.127 0.000 1.054 368 L CA -1.082 53.681 54.840 -0.128 0.000 0.804 368 L CB 1.569 43.565 42.059 -0.104 0.000 1.200 368 L HN 0.565 8.795 8.230 -0.000 0.000 0.436 369 S N 1.046 116.664 115.700 -0.138 0.000 2.498 369 S HA 0.090 4.579 4.470 0.032 0.000 0.281 369 S C 1.144 175.678 174.600 -0.110 0.000 1.265 369 S CA -0.672 57.454 58.200 -0.123 0.000 1.071 369 S CB 0.852 63.993 63.200 -0.099 0.000 0.894 369 S HN 0.403 8.713 8.310 -0.000 0.000 0.491 370 V N 6.463 126.304 119.914 -0.122 0.000 2.295 370 V HA -0.151 3.988 4.120 0.032 0.000 0.246 370 V C 2.562 178.600 176.094 -0.094 0.000 1.049 370 V CA 2.274 64.503 62.300 -0.119 0.000 1.024 370 V CB -0.687 31.050 31.823 -0.142 0.000 0.648 370 V HN 0.932 9.122 8.190 -0.000 0.000 0.447 371 K N -0.025 120.330 120.400 -0.075 0.000 2.025 371 K HA -0.117 4.222 4.320 0.032 0.000 0.207 371 K C 1.989 178.550 176.600 -0.065 0.000 1.049 371 K CA 1.663 57.915 56.287 -0.057 0.000 0.933 371 K CB -0.442 32.040 32.500 -0.030 0.000 0.714 371 K HN 0.503 8.754 8.250 -0.000 0.000 0.438 372 G N -1.074 107.692 108.800 -0.056 0.000 2.744 372 G HA2 0.108 4.087 3.960 0.032 0.000 0.211 372 G HA3 0.108 4.087 3.960 0.032 0.000 0.211 372 G C 0.789 175.637 174.900 -0.085 0.000 1.146 372 G CA 0.387 45.456 45.100 -0.052 0.000 0.787 372 G HN 0.518 8.808 8.290 -0.000 0.000 0.534 373 G N -0.793 107.949 108.800 -0.096 0.000 2.179 373 G HA2 -0.045 3.934 3.960 0.032 0.000 0.257 373 G HA3 -0.045 3.934 3.960 0.032 0.000 0.257 373 G C 0.267 175.095 174.900 -0.119 0.000 1.010 373 G CA 0.841 45.874 45.100 -0.113 0.000 0.736 373 G HN 1.582 9.872 8.290 -0.000 0.000 0.513 374 V N -3.631 116.225 119.914 -0.096 0.000 3.001 374 V HA 0.844 4.983 4.120 0.032 0.000 0.314 374 V C 0.724 176.766 176.094 -0.087 0.000 1.099 374 V CA -1.153 61.099 62.300 -0.081 0.000 0.989 374 V CB 1.988 33.789 31.823 -0.036 0.000 1.040 374 V HN 0.495 8.685 8.190 -0.000 0.000 0.434 375 M N 2.653 122.194 119.600 -0.098 0.000 2.248 375 M HA 0.374 4.873 4.480 0.032 0.000 0.345 375 M C -0.966 175.231 176.300 -0.171 0.000 1.243 375 M CA 0.253 55.426 55.300 -0.212 0.000 1.090 375 M CB 0.912 33.361 32.600 -0.252 0.000 1.683 375 M HN 0.703 8.993 8.290 -0.000 0.000 0.450 376 V N 4.782 124.524 119.914 -0.288 0.000 2.357 376 V HA 0.187 4.326 4.120 0.032 0.000 0.284 376 V C 0.428 176.432 176.094 -0.150 0.000 1.018 376 V CA -0.665 61.394 62.300 -0.402 0.000 0.841 376 V CB 1.344 32.840 31.823 -0.544 0.000 0.991 376 V HN 0.950 9.140 8.190 -0.000 0.000 0.437 377 T N 2.578 117.155 114.554 0.038 0.000 2.937 377 T HA -0.030 4.339 4.350 0.032 0.000 0.316 377 T C 1.288 176.051 174.700 0.106 0.000 1.079 377 T CA 0.511 62.679 62.100 0.114 0.000 1.131 377 T CB 0.527 69.485 68.868 0.150 0.000 1.000 377 T HN 0.961 9.201 8.240 -0.000 0.000 0.549 378 E N 2.741 123.034 120.200 0.154 0.000 2.267 378 E HA -0.149 4.220 4.350 0.032 0.000 0.197 378 E C 2.044 178.659 176.600 0.025 0.000 0.998 378 E CA 1.080 57.517 56.400 0.061 0.000 0.830 378 E CB -0.364 29.347 29.700 0.018 0.000 0.751 378 E HN 0.805 9.165 8.360 -0.000 0.000 0.491 379 A N 0.255 123.097 122.820 0.037 0.000 2.070 379 A HA -0.103 4.236 4.320 0.032 0.000 0.220 379 A C 2.255 179.826 177.584 -0.022 0.000 1.159 379 A CA 1.045 53.088 52.037 0.011 0.000 0.656 379 A CB -0.311 18.701 19.000 0.019 0.000 0.800 379 A HN 0.226 8.376 8.150 -0.000 0.000 0.453 380 V N -0.218 119.676 119.914 -0.034 0.000 2.343 380 V HA -0.256 3.883 4.120 0.032 0.000 0.247 380 V C 2.620 178.657 176.094 -0.096 0.000 1.051 380 V CA 2.263 64.491 62.300 -0.119 0.000 1.036 380 V CB -0.727 31.006 31.823 -0.151 0.000 0.654 380 V HN 0.556 8.746 8.190 -0.000 0.000 0.451 381 R N 0.063 120.534 120.500 -0.048 0.000 2.073 381 R HA -0.021 4.338 4.340 0.032 0.000 0.229 381 R C 2.497 178.786 176.300 -0.018 0.000 1.120 381 R CA 1.255 57.335 56.100 -0.033 0.000 0.967 381 R CB -0.785 29.492 30.300 -0.038 0.000 0.862 381 R HN 0.565 8.835 8.270 -0.000 0.000 0.436 382 G N 0.843 109.633 108.800 -0.017 0.000 2.432 382 G HA2 -0.251 3.728 3.960 0.032 0.000 0.219 382 G HA3 -0.251 3.728 3.960 0.032 0.000 0.219 382 G C 1.069 175.968 174.900 -0.002 0.000 1.135 382 G CA 0.725 45.821 45.100 -0.007 0.000 0.767 382 G HN 0.249 8.539 8.290 -0.000 0.000 0.550 383 N N 0.005 118.695 118.700 -0.017 0.000 2.461 383 N HA 0.274 5.033 4.740 0.032 0.000 0.188 383 N C 1.427 176.941 175.510 0.007 0.000 1.134 383 N CA 0.972 54.013 53.050 -0.015 0.000 0.878 383 N CB 0.497 38.957 38.487 -0.044 0.000 0.972 383 N HN 0.413 8.793 8.380 -0.000 0.000 0.456 384 G N -1.889 106.926 108.800 0.025 0.000 2.425 384 G HA2 -0.062 3.917 3.960 0.032 0.000 0.177 384 G HA3 -0.062 3.917 3.960 0.032 0.000 0.177 384 G C 0.186 175.137 174.900 0.084 0.000 0.999 384 G CA -0.146 45.003 45.100 0.081 0.000 0.723 384 G HN 0.465 8.755 8.290 -0.000 0.000 0.491 385 A N 0.600 123.444 122.820 0.040 0.000 2.406 385 A HA 0.721 5.060 4.320 0.032 0.000 0.243 385 A C 0.737 178.299 177.584 -0.038 0.000 1.082 385 A CA 0.519 52.602 52.037 0.076 0.000 0.786 385 A CB 0.032 19.099 19.000 0.112 0.000 1.029 385 A HN 1.521 9.671 8.150 -0.000 0.000 0.495 386 I N -1.734 118.779 120.570 -0.094 0.000 3.100 386 I HA 0.754 4.943 4.170 0.032 0.000 0.312 386 I C -0.898 175.136 176.117 -0.139 0.000 1.063 386 I CA -1.125 60.032 61.300 -0.238 0.000 1.031 386 I CB 1.528 39.249 38.000 -0.464 0.000 1.243 386 I HN 0.442 8.652 8.210 -0.000 0.000 0.483 387 L N 3.474 124.565 121.223 -0.219 0.000 2.341 387 L HA 0.687 5.046 4.340 0.032 0.000 0.278 387 L C -0.379 176.440 176.870 -0.085 0.000 1.005 387 L CA -0.908 53.841 54.840 -0.152 0.000 0.818 387 L CB 1.853 43.733 42.059 -0.297 0.000 1.259 387 L HN 0.605 8.835 8.230 -0.000 0.000 0.418 388 V N -0.357 119.652 119.914 0.158 0.000 2.960 388 V HA 0.691 4.830 4.120 0.032 0.000 0.315 388 V C -0.571 175.760 176.094 0.396 0.000 1.087 388 V CA -0.814 61.637 62.300 0.251 0.000 0.982 388 V CB 1.890 33.780 31.823 0.111 0.000 1.039 388 V HN 0.840 9.030 8.190 -0.000 0.000 0.437 389 N N 1.934 120.800 118.700 0.277 0.000 2.538 389 N HA 0.423 5.182 4.740 0.032 0.000 0.292 389 N C 0.578 176.141 175.510 0.088 0.000 1.262 389 N CA -0.809 52.286 53.050 0.075 0.000 0.976 389 N CB 0.355 38.749 38.487 -0.154 0.000 1.161 389 N HN 0.622 9.002 8.380 -0.000 0.000 0.598 390 R N -0.967 119.565 120.500 0.053 0.000 2.189 390 R HA -0.043 4.316 4.340 0.032 0.000 0.223 390 R C 0.432 176.725 176.300 -0.011 0.000 1.092 390 R CA 1.059 57.178 56.100 0.031 0.000 0.989 390 R CB -0.184 30.138 30.300 0.038 0.000 0.876 390 R HN 0.627 8.897 8.270 -0.000 0.000 0.457 391 E N -0.710 119.487 120.200 -0.005 0.000 2.511 391 E HA 0.058 4.427 4.350 0.032 0.000 0.196 391 E C 0.925 177.527 176.600 0.002 0.000 1.066 391 E CA 0.641 57.039 56.400 -0.004 0.000 0.871 391 E CB 0.402 30.104 29.700 0.004 0.000 0.863 391 E HN 0.439 8.799 8.360 -0.000 0.000 0.520 392 G N 0.698 109.501 108.800 0.005 0.000 2.136 392 G HA2 -0.330 3.649 3.960 0.032 0.000 0.242 392 G HA3 -0.330 3.649 3.960 0.032 0.000 0.242 392 G C 0.033 174.954 174.900 0.035 0.000 0.989 392 G CA 0.320 45.419 45.100 -0.002 0.000 0.682 392 G HN 0.231 8.521 8.290 -0.000 0.000 0.522 393 K N -0.349 120.100 120.400 0.081 0.000 2.267 393 K HA 0.617 4.956 4.320 0.032 0.000 0.246 393 K C 0.699 177.403 176.600 0.173 0.000 0.954 393 K CA -1.010 55.349 56.287 0.120 0.000 0.824 393 K CB 1.552 34.134 32.500 0.136 0.000 1.167 393 K HN 0.171 8.421 8.250 -0.000 0.000 0.431 394 R N 0.957 121.538 120.500 0.136 0.000 2.679 394 R HA 0.155 4.514 4.340 0.032 0.000 0.269 394 R C 0.287 176.577 176.300 -0.016 0.000 1.076 394 R CA 0.273 56.365 56.100 -0.014 0.000 1.160 394 R CB 0.236 30.520 30.300 -0.027 0.000 1.054 394 R HN 0.696 8.966 8.270 -0.000 0.000 0.507 395 F N -1.806 117.827 119.950 -0.527 0.000 3.031 395 F HA 0.411 4.948 4.527 0.016 0.000 0.365 395 F C -0.681 174.590 175.800 -0.882 0.000 1.128 395 F CA -0.579 57.093 58.000 -0.545 0.000 1.068 395 F CB 0.581 39.473 39.000 -0.180 0.000 1.280 395 F HN 0.219 8.519 8.300 -0.000 0.000 0.529 396 V N 1.399 120.416 119.914 -1.495 0.000 3.225 396 V HA 0.399 4.538 4.120 0.032 0.000 0.293 396 V C -1.435 174.264 176.094 -0.659 0.000 1.405 396 V CA -0.946 60.829 62.300 -0.875 0.000 1.038 396 V CB 1.979 33.487 31.823 -0.524 0.000 1.123 396 V HN 0.274 8.464 8.190 -0.000 0.000 0.447 397 N N 2.785 121.344 118.700 -0.235 0.000 2.438 397 N HA 0.129 4.888 4.740 0.032 0.000 0.267 397 N C 0.642 176.062 175.510 -0.149 0.000 1.222 397 N CA 0.541 53.540 53.050 -0.085 0.000 0.930 397 N CB 1.403 39.905 38.487 0.025 0.000 1.083 397 N HN 0.688 9.068 8.380 -0.000 0.000 0.476 398 E N 2.575 122.679 120.200 -0.161 0.000 2.338 398 E HA -0.053 4.316 4.350 0.032 0.000 0.197 398 E C 0.772 177.317 176.600 -0.092 0.000 1.007 398 E CA 0.915 57.219 56.400 -0.160 0.000 0.849 398 E CB -0.167 29.435 29.700 -0.164 0.000 0.774 398 E HN 0.837 9.197 8.360 -0.000 0.000 0.506 399 I N -2.613 117.923 120.570 -0.056 0.000 3.736 399 I HA 0.284 4.473 4.170 0.032 0.000 0.338 399 I C 0.416 176.511 176.117 -0.037 0.000 1.558 399 I CA -0.500 60.775 61.300 -0.042 0.000 1.147 399 I CB 0.529 38.515 38.000 -0.023 0.000 1.275 399 I HN -0.254 7.956 8.210 -0.000 0.000 0.454 400 T N 2.106 116.636 114.554 -0.039 0.000 2.900 400 T HA 0.278 4.647 4.350 0.032 0.000 0.307 400 T C 0.803 175.486 174.700 -0.028 0.000 1.065 400 T CA 0.493 62.577 62.100 -0.025 0.000 1.105 400 T CB 0.752 69.608 68.868 -0.019 0.000 0.979 400 T HN 0.654 8.894 8.240 -0.000 0.000 0.544 401 T N 2.271 116.810 114.554 -0.025 0.000 2.888 401 T HA 0.616 4.986 4.350 0.032 0.000 0.283 401 T C 0.683 175.377 174.700 -0.011 0.000 1.013 401 T CA -0.821 61.258 62.100 -0.036 0.000 0.938 401 T CB 0.541 69.377 68.868 -0.053 0.000 1.298 401 T HN 0.919 9.159 8.240 -0.000 0.000 0.580 402 R N -0.179 120.307 120.500 -0.023 0.000 3.878 402 R HA -0.163 4.196 4.340 0.032 0.000 0.446 402 R C -0.300 176.059 176.300 0.099 0.000 0.241 402 R CA 1.264 57.374 56.100 0.017 0.000 1.411 402 R CB -1.711 28.593 30.300 0.007 0.000 1.019 402 R HN 0.838 9.108 8.270 -0.000 0.000 0.555 403 D N 1.134 121.586 120.400 0.088 0.000 2.463 403 D HA 0.131 4.790 4.640 0.032 0.000 0.224 403 D C 0.817 177.145 176.300 0.047 0.000 1.174 403 D CA 0.155 54.206 54.000 0.086 0.000 0.829 403 D CB 0.312 41.148 40.800 0.060 0.000 0.993 403 D HN 0.266 8.636 8.370 -0.000 0.000 0.497 404 K N 0.696 121.121 120.400 0.042 0.000 2.155 404 K HA -0.019 4.320 4.320 0.032 0.000 0.203 404 K C 2.027 178.645 176.600 0.030 0.000 1.052 404 K CA 0.846 57.153 56.287 0.034 0.000 0.948 404 K CB 0.231 32.748 32.500 0.028 0.000 0.728 404 K HN 0.005 8.255 8.250 -0.000 0.000 0.448 405 A N 1.558 124.387 122.820 0.016 0.000 1.897 405 A HA -0.156 4.183 4.320 0.032 0.000 0.215 405 A C 2.251 179.853 177.584 0.030 0.000 1.181 405 A CA 1.911 53.951 52.037 0.006 0.000 0.620 405 A CB -0.619 18.363 19.000 -0.030 0.000 0.821 405 A HN 0.365 8.515 8.150 -0.000 0.000 0.443 406 S N 0.347 116.049 115.700 0.005 0.000 2.368 406 S HA 0.026 4.515 4.470 0.032 0.000 0.224 406 S C 2.114 176.736 174.600 0.038 0.000 1.029 406 S CA 1.312 59.515 58.200 0.005 0.000 0.988 406 S CB -0.714 62.455 63.200 -0.051 0.000 0.838 406 S HN 0.868 9.178 8.310 -0.000 0.000 0.462 407 A N 2.122 124.964 122.820 0.037 0.000 1.933 407 A HA 0.320 4.659 4.320 0.032 0.000 0.218 407 A C 2.524 180.141 177.584 0.055 0.000 1.175 407 A CA 1.720 53.783 52.037 0.044 0.000 0.628 407 A CB -1.422 17.601 19.000 0.039 0.000 0.814 407 A HN 0.859 9.009 8.150 -0.000 0.000 0.444 408 A N -0.167 122.707 122.820 0.090 0.000 1.930 408 A HA -0.020 4.319 4.320 0.032 0.000 0.217 408 A C 2.103 179.763 177.584 0.126 0.000 1.175 408 A CA 1.389 53.518 52.037 0.153 0.000 0.627 408 A CB -0.544 18.607 19.000 0.251 0.000 0.815 408 A HN 0.484 8.634 8.150 -0.000 0.000 0.443 409 I N -0.295 120.368 120.570 0.155 0.000 2.226 409 I HA -0.245 3.945 4.170 0.032 0.000 0.245 409 I C 2.194 178.266 176.117 -0.075 0.000 1.100 409 I CA 1.082 62.409 61.300 0.044 0.000 1.374 409 I CB -0.279 37.775 38.000 0.088 0.000 1.057 409 I HN 0.273 8.483 8.210 -0.000 0.000 0.413 410 L N 0.440 121.648 121.223 -0.025 0.000 2.265 410 L HA -0.144 4.215 4.340 0.032 0.000 0.215 410 L C 2.512 179.345 176.870 -0.061 0.000 1.117 410 L CA 0.878 55.696 54.840 -0.036 0.000 0.782 410 L CB -0.552 41.521 42.059 0.024 0.000 0.914 410 L HN 0.231 8.461 8.230 -0.000 0.000 0.441 411 A N -1.517 121.261 122.820 -0.070 0.000 2.208 411 A HA 0.022 4.361 4.320 0.032 0.000 0.209 411 A C 1.054 178.551 177.584 -0.144 0.000 1.161 411 A CA 0.235 52.225 52.037 -0.080 0.000 0.782 411 A CB -0.068 18.906 19.000 -0.043 0.000 0.816 411 A HN 0.233 8.383 8.150 -0.000 0.000 0.477 412 Q N 0.117 119.775 119.800 -0.237 0.000 2.317 412 Q HA 0.253 4.612 4.340 0.032 0.000 0.229 412 Q C -0.236 175.656 176.000 -0.180 0.000 0.984 412 Q CA -0.070 55.557 55.803 -0.294 0.000 0.911 412 Q CB -0.068 28.354 28.738 -0.527 0.000 1.217 412 Q HN 0.244 8.514 8.270 -0.000 0.000 0.501 413 T N 1.223 115.690 114.554 -0.145 0.000 2.778 413 T HA 0.252 4.622 4.350 0.032 0.000 0.282 413 T C 1.083 175.734 174.700 -0.082 0.000 0.983 413 T CA 1.137 63.182 62.100 -0.090 0.000 1.193 413 T CB -0.302 68.528 68.868 -0.064 0.000 0.938 413 T HN 0.786 9.026 8.240 -0.000 0.000 0.523 414 G N 3.510 112.265 108.800 -0.074 0.000 2.175 414 G HA2 -0.317 3.662 3.960 0.032 0.000 0.244 414 G HA3 -0.317 3.662 3.960 0.032 0.000 0.244 414 G C 0.428 175.270 174.900 -0.097 0.000 0.982 414 G CA 0.048 45.104 45.100 -0.073 0.000 0.641 414 G HN 0.777 9.067 8.290 -0.000 0.000 0.527 415 K N -1.092 119.242 120.400 -0.109 0.000 3.160 415 K HA -0.198 4.141 4.320 0.032 0.000 0.280 415 K C 0.445 176.963 176.600 -0.136 0.000 1.154 415 K CA 1.264 57.480 56.287 -0.118 0.000 0.822 415 K CB -2.107 30.326 32.500 -0.112 0.000 1.239 415 K HN 1.882 10.132 8.250 -0.000 0.000 0.489 416 S N -1.841 113.767 115.700 -0.152 0.000 2.625 416 S HA 0.893 5.382 4.470 0.032 0.000 0.271 416 S C -0.909 173.576 174.600 -0.191 0.000 1.161 416 S CA -0.441 57.652 58.200 -0.177 0.000 0.820 416 S CB 2.779 65.848 63.200 -0.218 0.000 1.137 416 S HN 0.501 8.811 8.310 -0.000 0.000 0.470 417 A N 0.131 122.832 122.820 -0.199 0.000 2.524 417 A HA 0.867 5.206 4.320 0.032 0.000 0.289 417 A C -2.225 175.212 177.584 -0.244 0.000 1.248 417 A CA -0.854 51.132 52.037 -0.086 0.000 0.712 417 A CB 0.755 19.860 19.000 0.176 0.000 1.312 417 A HN 0.873 9.023 8.150 -0.000 0.000 0.441 418 Y N -0.344 119.996 120.300 0.067 0.000 2.391 418 Y HA 0.543 5.123 4.550 0.049 0.000 0.341 418 Y C -0.113 175.812 175.900 0.043 0.000 0.965 418 Y CA -0.405 57.717 58.100 0.036 0.000 1.067 418 Y CB 1.842 40.310 38.460 0.012 0.000 1.199 418 Y HN 0.552 8.832 8.280 -0.000 0.000 0.450 419 L N 4.904 126.228 121.223 0.168 0.000 2.380 419 L HA 0.308 4.667 4.340 0.032 0.000 0.273 419 L C -0.611 176.372 176.870 0.187 0.000 1.138 419 L CA -0.172 54.768 54.840 0.166 0.000 0.832 419 L CB 0.379 42.555 42.059 0.194 0.000 1.124 419 L HN 0.465 8.695 8.230 -0.000 0.000 0.454 420 I N 4.070 124.737 120.570 0.161 0.000 2.498 420 I HA 0.502 4.691 4.170 0.032 0.000 0.290 420 I C -0.364 175.885 176.117 0.220 0.000 1.032 420 I CA -0.363 60.987 61.300 0.084 0.000 1.073 420 I CB 1.470 39.483 38.000 0.022 0.000 1.251 420 I HN 0.478 8.688 8.210 -0.000 0.000 0.426 421 F N 3.802 123.863 119.950 0.184 0.000 2.831 421 F HA 0.734 5.277 4.527 0.026 0.000 0.318 421 F C -0.981 175.011 175.800 0.321 0.000 1.174 421 F CA -0.978 57.142 58.000 0.200 0.000 0.918 421 F CB 1.070 40.143 39.000 0.122 0.000 1.364 421 F HN 0.423 8.723 8.300 -0.000 0.000 0.475 422 D N -1.024 119.676 120.400 0.499 0.000 2.668 422 D HA 0.246 4.905 4.640 0.032 0.000 0.249 422 D C -0.216 176.317 176.300 0.388 0.000 1.150 422 D CA -0.275 53.911 54.000 0.310 0.000 1.090 422 D CB 0.413 41.285 40.800 0.121 0.000 1.244 422 D HN 0.522 8.892 8.370 -0.000 0.000 0.636 423 D N -0.741 119.787 120.400 0.214 0.000 2.277 423 D HA -0.091 4.568 4.640 0.032 0.000 0.208 423 D C 1.979 178.351 176.300 0.120 0.000 0.962 423 D CA 1.158 55.278 54.000 0.201 0.000 0.865 423 D CB 0.122 41.001 40.800 0.131 0.000 0.939 423 D HN 0.441 8.811 8.370 -0.000 0.000 0.510 424 S N 0.054 115.814 115.700 0.100 0.000 2.355 424 S HA -0.110 4.379 4.470 0.032 0.000 0.222 424 S C 2.243 176.883 174.600 0.066 0.000 1.031 424 S CA 0.816 59.059 58.200 0.072 0.000 0.993 424 S CB -0.664 62.576 63.200 0.066 0.000 0.859 424 S HN 0.041 8.351 8.310 -0.000 0.000 0.453 425 V N 2.664 122.638 119.914 0.101 0.000 2.343 425 V HA -0.151 3.988 4.120 0.032 0.000 0.247 425 V C 2.964 179.029 176.094 -0.048 0.000 1.051 425 V CA 2.191 64.512 62.300 0.034 0.000 1.036 425 V CB -0.946 30.916 31.823 0.065 0.000 0.654 425 V HN 0.542 8.732 8.190 -0.000 0.000 0.451 426 R N 0.436 120.936 120.500 0.000 0.000 2.083 426 R HA -0.220 4.139 4.340 0.032 0.000 0.237 426 R C 2.340 178.605 176.300 -0.057 0.000 1.137 426 R CA 1.979 58.033 56.100 -0.078 0.000 0.951 426 R CB -0.211 30.059 30.300 -0.050 0.000 0.851 426 R HN 0.444 8.714 8.270 -0.000 0.000 0.434 427 K N 0.071 120.465 120.400 -0.010 0.000 2.283 427 K HA -0.060 4.279 4.320 0.032 0.000 0.202 427 K C 1.962 178.550 176.600 -0.021 0.000 1.048 427 K CA 1.390 57.671 56.287 -0.009 0.000 0.948 427 K CB 0.073 32.579 32.500 0.011 0.000 0.742 427 K HN 0.282 8.532 8.250 -0.000 0.000 0.458 428 S N 0.142 115.826 115.700 -0.026 0.000 2.527 428 S HA -0.009 4.480 4.470 0.032 0.000 0.222 428 S C 0.491 175.063 174.600 -0.047 0.000 0.985 428 S CA 0.034 58.216 58.200 -0.029 0.000 0.921 428 S CB 0.130 63.317 63.200 -0.021 0.000 0.772 428 S HN 0.138 8.448 8.310 -0.000 0.000 0.529 429 L N 2.008 123.189 121.223 -0.069 0.000 2.518 429 L HA 0.449 4.808 4.340 0.032 0.000 0.262 429 L C 0.996 177.814 176.870 -0.087 0.000 0.982 429 L CA 0.162 54.956 54.840 -0.076 0.000 0.873 429 L CB 1.419 43.424 42.059 -0.090 0.000 1.198 429 L HN 0.193 8.423 8.230 -0.000 0.000 0.427 430 S N 2.023 117.679 115.700 -0.073 0.000 2.440 430 S HA -0.201 4.288 4.470 0.032 0.000 0.238 430 S C 1.811 176.344 174.600 -0.111 0.000 1.010 430 S CA 1.293 59.446 58.200 -0.078 0.000 0.972 430 S CB -0.218 62.947 63.200 -0.060 0.000 0.774 430 S HN 0.637 8.947 8.310 -0.000 0.000 0.501 431 K N 1.851 122.175 120.400 -0.127 0.000 2.152 431 K HA 0.060 4.400 4.320 0.032 0.000 0.206 431 K C 1.689 178.090 176.600 -0.332 0.000 1.048 431 K CA 1.483 57.642 56.287 -0.214 0.000 0.933 431 K CB -0.854 31.553 32.500 -0.156 0.000 0.721 431 K HN 0.593 8.843 8.250 -0.000 0.000 0.447 432 I N 0.906 121.366 120.570 -0.183 0.000 2.335 432 I HA -0.277 3.912 4.170 0.032 0.000 0.251 432 I C 1.322 177.373 176.117 -0.110 0.000 1.129 432 I CA 1.337 62.575 61.300 -0.104 0.000 1.402 432 I CB -0.355 37.536 38.000 -0.182 0.000 1.069 432 I HN 0.206 8.416 8.210 -0.000 0.000 0.424 433 D N 0.921 121.247 120.400 -0.124 0.000 2.263 433 D HA -0.131 4.528 4.640 0.032 0.000 0.208 433 D C 2.090 178.336 176.300 -0.091 0.000 0.971 433 D CA 0.836 54.789 54.000 -0.077 0.000 0.867 433 D CB -0.096 40.673 40.800 -0.053 0.000 0.929 433 D HN 0.274 8.644 8.370 -0.000 0.000 0.492 434 K N 0.256 120.532 120.400 -0.207 0.000 2.103 434 K HA -0.093 4.246 4.320 0.032 0.000 0.204 434 K C 2.168 178.656 176.600 -0.186 0.000 1.052 434 K CA 0.677 56.826 56.287 -0.230 0.000 0.945 434 K CB -0.699 31.591 32.500 -0.350 0.000 0.722 434 K HN 0.415 8.665 8.250 -0.000 0.000 0.443 435 Y N 0.855 121.162 120.300 0.012 0.000 2.242 435 Y HA -0.038 4.540 4.550 0.047 0.000 0.291 435 Y C 2.318 178.241 175.900 0.039 0.000 1.137 435 Y CA 0.378 58.496 58.100 0.031 0.000 1.181 435 Y CB -0.437 38.047 38.460 0.041 0.000 0.989 435 Y HN -0.105 8.175 8.280 -0.000 0.000 0.527 436 I N -0.113 120.540 120.570 0.138 0.000 2.226 436 I HA -0.224 3.965 4.170 0.032 0.000 0.245 436 I C 2.678 178.805 176.117 0.016 0.000 1.100 436 I CA 1.423 62.780 61.300 0.095 0.000 1.374 436 I CB -0.798 37.250 38.000 0.079 0.000 1.057 436 I HN 0.286 8.496 8.210 -0.000 0.000 0.413 437 G N 0.949 109.749 108.800 0.001 0.000 2.422 437 G HA2 -0.250 3.729 3.960 0.032 0.000 0.218 437 G HA3 -0.250 3.729 3.960 0.032 0.000 0.218 437 G C 1.616 176.507 174.900 -0.015 0.000 1.146 437 G CA 0.397 45.477 45.100 -0.033 0.000 0.769 437 G HN 0.257 8.547 8.290 -0.000 0.000 0.547 438 L N 0.720 121.982 121.223 0.064 0.000 2.376 438 L HA 0.273 4.632 4.340 0.032 0.000 0.219 438 L C 2.010 178.922 176.870 0.069 0.000 1.133 438 L CA 1.557 56.464 54.840 0.113 0.000 0.816 438 L CB -0.143 42.012 42.059 0.160 0.000 0.933 438 L HN 0.458 8.688 8.230 -0.000 0.000 0.449 439 G N -1.428 107.388 108.800 0.027 0.000 2.141 439 G HA2 -0.239 3.740 3.960 0.032 0.000 0.231 439 G HA3 -0.239 3.740 3.960 0.032 0.000 0.231 439 G C 0.708 175.637 174.900 0.047 0.000 0.984 439 G CA 0.528 45.637 45.100 0.015 0.000 0.660 439 G HN 0.848 9.138 8.290 -0.000 0.000 0.525 440 V N -3.258 116.704 119.914 0.081 0.000 3.444 440 V HA 0.796 4.935 4.120 0.032 0.000 0.308 440 V C 0.947 177.105 176.094 0.108 0.000 1.371 440 V CA 0.937 63.284 62.300 0.079 0.000 1.141 440 V CB 0.609 32.471 31.823 0.065 0.000 1.037 440 V HN 1.708 9.898 8.190 -0.000 0.000 0.433 441 A N 1.681 124.585 122.820 0.140 0.000 3.204 441 A HA 0.744 5.083 4.320 0.032 0.000 0.327 441 A C -2.417 175.277 177.584 0.183 0.000 0.998 441 A CA -1.372 50.777 52.037 0.186 0.000 0.891 441 A CB -0.147 19.016 19.000 0.271 0.000 1.061 441 A HN 0.430 8.580 8.150 -0.000 0.000 0.478 442 P HA 0.142 4.562 4.420 -0.000 0.000 0.266 442 P C 0.133 177.431 177.300 -0.003 0.000 1.186 442 P CA 0.764 63.893 63.100 0.049 0.000 0.767 442 P CB 0.788 32.502 31.700 0.023 0.000 0.820 443 T N -0.289 114.216 114.554 -0.082 0.000 2.896 443 T HA 0.725 5.094 4.350 0.032 0.000 0.297 443 T C -1.666 172.915 174.700 -0.199 0.000 1.108 443 T CA -0.399 61.535 62.100 -0.277 0.000 1.004 443 T CB 1.203 69.795 68.868 -0.461 0.000 1.159 443 T HN 0.551 8.791 8.240 -0.000 0.000 0.499 444 A N 1.790 124.483 122.820 -0.211 0.000 2.612 444 A HA 0.599 4.938 4.320 0.032 0.000 0.293 444 A C -0.108 177.439 177.584 -0.063 0.000 1.075 444 A CA -0.275 51.699 52.037 -0.105 0.000 0.680 444 A CB 1.233 20.195 19.000 -0.063 0.000 1.279 444 A HN 0.858 9.008 8.150 -0.000 0.000 0.411 445 D N 0.031 120.416 120.400 -0.026 0.000 2.349 445 D HA 0.164 4.823 4.640 0.032 0.000 0.224 445 D C 0.536 176.916 176.300 0.133 0.000 1.029 445 D CA 1.026 55.032 54.000 0.010 0.000 0.879 445 D CB -0.024 40.768 40.800 -0.014 0.000 0.906 445 D HN 0.791 9.161 8.370 -0.000 0.000 0.528 446 S N -1.563 114.217 115.700 0.133 0.000 2.579 446 S HA 0.419 4.908 4.470 0.032 0.000 0.272 446 S C 0.467 175.032 174.600 -0.058 0.000 1.141 446 S CA -0.962 57.298 58.200 0.100 0.000 0.843 446 S CB 0.931 64.145 63.200 0.023 0.000 1.122 446 S HN -0.004 8.306 8.310 -0.000 0.000 0.468 447 L N 1.483 122.546 121.223 -0.265 0.000 2.217 447 L HA 0.048 4.407 4.340 0.032 0.000 0.211 447 L C 2.340 179.102 176.870 -0.180 0.000 1.107 447 L CA 0.547 55.196 54.840 -0.320 0.000 0.783 447 L CB -0.469 41.327 42.059 -0.438 0.000 0.919 447 L HN 0.661 8.891 8.230 -0.000 0.000 0.442 448 V N 0.076 119.914 119.914 -0.127 0.000 2.307 448 V HA -0.270 3.869 4.120 0.032 0.000 0.245 448 V C 2.465 178.510 176.094 -0.082 0.000 1.045 448 V CA 1.739 63.984 62.300 -0.092 0.000 1.024 448 V CB -0.366 31.419 31.823 -0.065 0.000 0.651 448 V HN 0.410 8.600 8.190 -0.000 0.000 0.449 449 K N -0.445 119.914 120.400 -0.068 0.000 2.057 449 K HA -0.182 4.157 4.320 0.032 0.000 0.207 449 K C 2.083 178.637 176.600 -0.076 0.000 1.049 449 K CA 1.427 57.679 56.287 -0.059 0.000 0.931 449 K CB -0.373 32.102 32.500 -0.041 0.000 0.714 449 K HN 0.256 8.506 8.250 -0.000 0.000 0.440 450 L N 0.813 121.980 121.223 -0.093 0.000 2.046 450 L HA -0.069 4.290 4.340 0.032 0.000 0.208 450 L C 2.119 178.904 176.870 -0.143 0.000 1.077 450 L CA 1.909 56.681 54.840 -0.114 0.000 0.747 450 L CB -0.873 41.111 42.059 -0.125 0.000 0.896 450 L HN 0.200 8.430 8.230 -0.000 0.000 0.432 451 G N -1.374 107.336 108.800 -0.151 0.000 2.418 451 G HA2 -0.304 3.675 3.960 0.032 0.000 0.217 451 G HA3 -0.304 3.675 3.960 0.032 0.000 0.217 451 G C 1.767 176.587 174.900 -0.132 0.000 1.158 451 G CA 0.860 45.861 45.100 -0.166 0.000 0.771 451 G HN 0.296 8.586 8.290 -0.000 0.000 0.545 452 K N 0.105 120.446 120.400 -0.098 0.000 2.097 452 K HA 0.022 4.361 4.320 0.032 0.000 0.206 452 K C 2.822 179.380 176.600 -0.070 0.000 1.049 452 K CA 1.582 57.825 56.287 -0.074 0.000 0.933 452 K CB -0.474 31.992 32.500 -0.057 0.000 0.717 452 K HN 0.542 8.792 8.250 -0.000 0.000 0.442 453 M N 0.242 119.797 119.600 -0.075 0.000 2.086 453 M HA -0.063 4.436 4.480 0.032 0.000 0.261 453 M C 1.832 178.094 176.300 -0.064 0.000 1.067 453 M CA 1.671 56.934 55.300 -0.061 0.000 1.116 453 M CB -0.117 32.448 32.600 -0.058 0.000 1.348 453 M HN 0.127 8.417 8.290 -0.000 0.000 0.407 454 E N -0.467 119.666 120.200 -0.111 0.000 2.474 454 E HA 0.183 4.552 4.350 0.032 0.000 0.195 454 E C 1.017 177.531 176.600 -0.144 0.000 1.039 454 E CA 0.547 56.870 56.400 -0.128 0.000 0.881 454 E CB 0.417 29.950 29.700 -0.279 0.000 0.970 454 E HN 0.604 8.964 8.360 -0.000 0.000 0.486 455 G N 1.874 110.599 108.800 -0.124 0.000 2.149 455 G HA2 -0.268 3.711 3.960 0.032 0.000 0.235 455 G HA3 -0.268 3.711 3.960 0.032 0.000 0.235 455 G C 0.153 174.974 174.900 -0.130 0.000 1.018 455 G CA 0.123 45.168 45.100 -0.092 0.000 0.728 455 G HN 0.244 8.534 8.290 -0.000 0.000 0.508 456 I N 0.405 120.856 120.570 -0.200 0.000 2.412 456 I HA 0.267 4.456 4.170 0.032 0.000 0.296 456 I C 0.177 176.219 176.117 -0.126 0.000 0.987 456 I CA -1.026 60.157 61.300 -0.195 0.000 1.180 456 I CB 1.508 39.321 38.000 -0.311 0.000 1.340 456 I HN 0.045 8.255 8.210 -0.000 0.000 0.455 457 D N 4.998 125.347 120.400 -0.085 0.000 2.402 457 D HA -0.016 4.643 4.640 0.032 0.000 0.268 457 D C 1.199 177.454 176.300 -0.075 0.000 1.294 457 D CA 0.367 54.329 54.000 -0.064 0.000 0.945 457 D CB 1.241 42.016 40.800 -0.041 0.000 1.112 457 D HN 0.751 9.121 8.370 -0.000 0.000 0.517 458 G N 4.221 112.973 108.800 -0.080 0.000 2.418 458 G HA2 -0.258 3.721 3.960 0.032 0.000 0.217 458 G HA3 -0.258 3.721 3.960 0.032 0.000 0.217 458 G C 1.508 176.362 174.900 -0.077 0.000 1.158 458 G CA 0.483 45.529 45.100 -0.089 0.000 0.771 458 G HN 0.485 8.775 8.290 -0.000 0.000 0.545 459 K N 0.480 120.846 120.400 -0.056 0.000 2.097 459 K HA 0.139 4.478 4.320 0.032 0.000 0.205 459 K C 2.899 179.475 176.600 -0.039 0.000 1.050 459 K CA 0.905 57.165 56.287 -0.045 0.000 0.938 459 K CB -0.152 32.328 32.500 -0.033 0.000 0.718 459 K HN 0.255 8.505 8.250 -0.000 0.000 0.442 460 A N 1.202 124.002 122.820 -0.034 0.000 1.930 460 A HA -0.122 4.218 4.320 0.032 0.000 0.217 460 A C 2.057 179.625 177.584 -0.028 0.000 1.175 460 A CA 0.956 52.980 52.037 -0.021 0.000 0.627 460 A CB -0.430 18.564 19.000 -0.010 0.000 0.815 460 A HN 0.218 8.368 8.150 -0.000 0.000 0.443 461 L N -0.037 121.153 121.223 -0.054 0.000 2.046 461 L HA -0.125 4.234 4.340 0.032 0.000 0.208 461 L C 2.442 179.260 176.870 -0.087 0.000 1.077 461 L CA 2.786 57.581 54.840 -0.074 0.000 0.747 461 L CB -1.062 40.928 42.059 -0.115 0.000 0.896 461 L HN 0.374 8.604 8.230 -0.000 0.000 0.432 462 T N -0.615 113.882 114.554 -0.096 0.000 2.684 462 T HA -0.157 4.212 4.350 0.032 0.000 0.267 462 T C 1.745 176.416 174.700 -0.049 0.000 1.036 462 T CA 1.501 63.542 62.100 -0.099 0.000 1.148 462 T CB -0.231 68.585 68.868 -0.088 0.000 0.863 462 T HN 0.321 8.561 8.240 -0.000 0.000 0.436 463 E N 0.871 121.056 120.200 -0.026 0.000 2.077 463 E HA -0.079 4.290 4.350 0.032 0.000 0.193 463 E C 2.529 179.142 176.600 0.021 0.000 0.989 463 E CA 1.133 57.533 56.400 0.000 0.000 0.800 463 E CB -0.815 28.887 29.700 0.005 0.000 0.746 463 E HN 0.425 8.785 8.360 -0.000 0.000 0.452 464 T N 0.961 115.527 114.554 0.021 0.000 2.746 464 T HA -0.096 4.274 4.350 0.032 0.000 0.267 464 T C 2.074 176.820 174.700 0.077 0.000 1.039 464 T CA 1.232 63.363 62.100 0.052 0.000 1.142 464 T CB -0.160 68.731 68.868 0.038 0.000 0.866 464 T HN -0.025 8.215 8.240 -0.000 0.000 0.444 465 V N 1.509 121.446 119.914 0.038 0.000 2.358 465 V HA -0.111 4.029 4.120 0.032 0.000 0.246 465 V C 2.837 179.000 176.094 0.115 0.000 1.047 465 V CA 1.525 63.874 62.300 0.080 0.000 1.035 465 V CB -1.130 30.690 31.823 -0.004 0.000 0.658 465 V HN 0.507 8.697 8.190 -0.000 0.000 0.452 466 A N 0.663 123.521 122.820 0.063 0.000 1.908 466 A HA -0.284 4.055 4.320 0.032 0.000 0.218 466 A C 2.303 179.928 177.584 0.068 0.000 1.181 466 A CA 2.329 54.401 52.037 0.059 0.000 0.627 466 A CB -0.527 18.493 19.000 0.033 0.000 0.818 466 A HN 0.499 8.649 8.150 -0.000 0.000 0.445 467 R N -1.380 119.167 120.500 0.078 0.000 2.073 467 R HA -0.174 4.185 4.340 0.032 0.000 0.234 467 R C 1.971 178.332 176.300 0.102 0.000 1.134 467 R CA 2.146 58.293 56.100 0.078 0.000 0.952 467 R CB -1.095 29.256 30.300 0.084 0.000 0.850 467 R HN 0.562 8.832 8.270 -0.000 0.000 0.433 468 Y N 1.233 121.557 120.300 0.040 0.000 2.181 468 Y HA -0.164 4.408 4.550 0.036 0.000 0.288 468 Y C 1.519 177.446 175.900 0.044 0.000 1.146 468 Y CA 2.124 60.252 58.100 0.048 0.000 1.164 468 Y CB -0.348 38.144 38.460 0.054 0.000 0.982 468 Y HN 0.203 8.483 8.280 -0.000 0.000 0.515 469 N N -0.350 118.362 118.700 0.021 0.000 2.223 469 N HA -0.157 4.602 4.740 0.032 0.000 0.185 469 N C 1.961 177.419 175.510 -0.087 0.000 1.016 469 N CA 1.453 54.476 53.050 -0.045 0.000 0.863 469 N CB -0.481 38.044 38.487 0.063 0.000 0.983 469 N HN 0.306 8.686 8.380 -0.000 0.000 0.429 470 S N 0.863 116.532 115.700 -0.053 0.000 2.383 470 S HA 0.050 4.539 4.470 0.032 0.000 0.227 470 S C 2.022 176.571 174.600 -0.085 0.000 1.026 470 S CA 0.603 58.774 58.200 -0.048 0.000 0.981 470 S CB -0.118 63.071 63.200 -0.019 0.000 0.818 470 S HN 0.268 8.578 8.310 -0.000 0.000 0.472 471 L N 0.830 121.974 121.223 -0.131 0.000 2.156 471 L HA -0.018 4.341 4.340 0.032 0.000 0.208 471 L C 2.239 178.987 176.870 -0.203 0.000 1.095 471 L CA 0.535 55.286 54.840 -0.148 0.000 0.770 471 L CB -0.659 41.319 42.059 -0.135 0.000 0.914 471 L HN 0.173 8.403 8.230 -0.000 0.000 0.439 472 V N -0.869 118.858 119.914 -0.311 0.000 2.295 472 V HA -0.293 3.847 4.120 0.032 0.000 0.246 472 V C 2.719 178.740 176.094 -0.122 0.000 1.049 472 V CA 2.102 64.253 62.300 -0.248 0.000 1.024 472 V CB -0.314 31.345 31.823 -0.274 0.000 0.648 472 V HN 0.453 8.643 8.190 -0.000 0.000 0.447 473 S N 0.401 116.043 115.700 -0.097 0.000 2.382 473 S HA -0.177 4.312 4.470 0.032 0.000 0.228 473 S C 2.192 176.765 174.600 -0.045 0.000 1.027 473 S CA 2.003 60.170 58.200 -0.054 0.000 0.991 473 S CB -0.313 62.863 63.200 -0.039 0.000 0.823 473 S HN 0.801 9.111 8.310 -0.000 0.000 0.469 474 S N -0.510 115.160 115.700 -0.051 0.000 2.496 474 S HA 0.319 4.808 4.470 0.032 0.000 0.224 474 S C 1.566 176.143 174.600 -0.038 0.000 0.996 474 S CA 1.007 59.184 58.200 -0.038 0.000 0.927 474 S CB -0.276 62.903 63.200 -0.035 0.000 0.774 474 S HN 1.293 9.603 8.310 -0.000 0.000 0.524 475 G N 0.214 108.984 108.800 -0.050 0.000 2.141 475 G HA2 -0.205 3.774 3.960 0.032 0.000 0.242 475 G HA3 -0.205 3.774 3.960 0.032 0.000 0.242 475 G C -0.171 174.708 174.900 -0.034 0.000 0.982 475 G CA 0.293 45.369 45.100 -0.041 0.000 0.662 475 G HN 0.766 9.056 8.290 -0.000 0.000 0.527 476 K N 0.527 120.904 120.400 -0.039 0.000 2.553 476 K HA 0.523 4.862 4.320 0.032 0.000 0.250 476 K C -1.656 174.930 176.600 -0.024 0.000 0.953 476 K CA -0.971 55.301 56.287 -0.024 0.000 0.800 476 K CB 1.535 34.024 32.500 -0.019 0.000 1.243 476 K HN 0.009 8.259 8.250 -0.000 0.000 0.435 477 D N 2.794 123.194 120.400 -0.000 0.000 2.468 477 D HA 0.083 4.742 4.640 0.032 0.000 0.218 477 D C 0.429 176.736 176.300 0.012 0.000 1.155 477 D CA -0.114 53.903 54.000 0.028 0.000 0.924 477 D CB 0.765 41.623 40.800 0.097 0.000 1.029 477 D HN 0.622 8.992 8.370 -0.000 0.000 0.515 478 T N -0.030 114.515 114.554 -0.016 0.000 3.085 478 T HA -0.065 4.304 4.350 0.032 0.000 0.263 478 T C 1.058 175.695 174.700 -0.106 0.000 1.127 478 T CA 0.370 62.442 62.100 -0.046 0.000 1.103 478 T CB 0.213 69.055 68.868 -0.044 0.000 0.921 478 T HN 0.127 8.367 8.240 -0.000 0.000 0.510 479 D N 0.940 121.263 120.400 -0.129 0.000 2.110 479 D HA 0.119 4.778 4.640 0.032 0.000 0.202 479 D C 0.858 176.736 176.300 -0.703 0.000 0.975 479 D CA 0.941 54.712 54.000 -0.382 0.000 0.839 479 D CB -0.112 40.540 40.800 -0.248 0.000 0.996 479 D HN 0.545 8.915 8.370 -0.000 0.000 0.464 480 F N -0.261 119.707 119.950 0.028 0.000 2.781 480 F HA 0.229 4.780 4.527 0.041 0.000 0.322 480 F C 0.105 175.913 175.800 0.012 0.000 1.108 480 F CA -0.282 57.727 58.000 0.015 0.000 1.179 480 F CB 0.516 39.514 39.000 -0.004 0.000 1.072 480 F HN -0.281 8.019 8.300 -0.000 0.000 0.545 481 E N 1.026 121.291 120.200 0.109 0.000 2.586 481 E HA -0.283 4.086 4.350 0.032 0.000 0.259 481 E C 0.556 177.206 176.600 0.084 0.000 1.107 481 E CA 0.161 56.606 56.400 0.075 0.000 0.754 481 E CB -0.938 28.792 29.700 0.050 0.000 1.335 481 E HN 0.457 8.817 8.360 -0.000 0.000 0.411 482 R N 1.617 122.185 120.500 0.114 0.000 2.484 482 R HA 0.050 4.409 4.340 0.032 0.000 0.293 482 R C -1.391 174.947 176.300 0.063 0.000 1.023 482 R CA -0.722 55.431 56.100 0.089 0.000 1.037 482 R CB 0.602 30.978 30.300 0.126 0.000 0.951 482 R HN -0.092 8.178 8.270 -0.000 0.000 0.418 483 P HA -0.009 4.411 4.420 -0.000 0.000 0.245 483 P C -0.818 176.495 177.300 0.023 0.000 1.206 483 P CA 0.530 63.645 63.100 0.026 0.000 0.781 483 P CB 0.244 31.954 31.700 0.015 0.000 0.994 484 N N 0.744 119.463 118.700 0.032 0.000 2.430 484 N HA 0.269 5.029 4.740 0.032 0.000 0.290 484 N C -1.437 174.104 175.510 0.051 0.000 1.063 484 N CA -0.428 52.640 53.050 0.030 0.000 0.883 484 N CB 1.552 40.052 38.487 0.022 0.000 1.465 484 N HN -0.130 8.250 8.380 -0.000 0.000 0.493 485 L N 5.617 126.863 121.223 0.037 0.000 2.462 485 L HA 0.414 4.773 4.340 0.032 0.000 0.255 485 L C -1.363 175.525 176.870 0.030 0.000 1.076 485 L CA -1.081 53.785 54.840 0.043 0.000 0.920 485 L CB 1.815 43.856 42.059 -0.029 0.000 1.214 485 L HN 0.434 8.664 8.230 -0.000 0.000 0.472 486 P HA 0.073 4.493 4.420 -0.000 0.000 0.226 486 P C 0.051 177.378 177.300 0.045 0.000 1.161 486 P CA 0.494 63.619 63.100 0.042 0.000 0.804 486 P CB 0.731 32.456 31.700 0.041 0.000 0.829 487 R N -0.828 119.716 120.500 0.074 0.000 2.680 487 R HA 0.671 5.030 4.340 0.032 0.000 0.269 487 R C -1.004 175.363 176.300 0.112 0.000 1.026 487 R CA -0.822 55.325 56.100 0.079 0.000 0.889 487 R CB 1.814 32.169 30.300 0.092 0.000 1.241 487 R HN -0.104 8.166 8.270 -0.000 0.000 0.463 488 A N 2.374 125.248 122.820 0.090 0.000 2.340 488 A HA 0.466 4.805 4.320 0.032 0.000 0.268 488 A C 0.038 177.727 177.584 0.176 0.000 1.100 488 A CA -0.548 51.560 52.037 0.117 0.000 0.803 488 A CB 0.298 19.341 19.000 0.071 0.000 1.043 488 A HN 0.613 8.763 8.150 -0.000 0.000 0.488 489 L N 2.913 124.282 121.223 0.243 0.000 2.389 489 L HA 0.274 4.633 4.340 0.032 0.000 0.265 489 L C 0.706 177.742 176.870 0.277 0.000 1.167 489 L CA 0.057 55.060 54.840 0.271 0.000 1.045 489 L CB -0.780 41.469 42.059 0.317 0.000 1.351 489 L HN 0.995 9.225 8.230 -0.000 0.000 0.419 490 N N 0.782 119.589 118.700 0.177 0.000 2.261 490 N HA 0.058 4.817 4.740 0.032 0.000 0.241 490 N C -0.301 175.233 175.510 0.039 0.000 1.374 490 N CA -0.456 52.678 53.050 0.139 0.000 0.802 490 N CB 0.871 39.431 38.487 0.121 0.000 1.339 490 N HN 0.474 8.854 8.380 -0.000 0.000 0.498 491 E N 1.178 121.372 120.200 -0.011 0.000 2.165 491 E HA 0.452 4.821 4.350 0.032 0.000 0.266 491 E C 0.754 177.287 176.600 -0.112 0.000 0.889 491 E CA -0.005 56.373 56.400 -0.036 0.000 0.756 491 E CB 1.389 31.096 29.700 0.011 0.000 1.131 491 E HN 0.339 8.699 8.360 -0.000 0.000 0.411 492 G N 4.538 113.265 108.800 -0.122 0.000 2.550 492 G HA2 -0.314 3.665 3.960 0.032 0.000 0.277 492 G HA3 -0.314 3.665 3.960 0.032 0.000 0.277 492 G C -0.082 174.624 174.900 -0.324 0.000 1.190 492 G CA 0.072 45.085 45.100 -0.145 0.000 0.971 492 G HN 0.644 8.934 8.290 -0.000 0.000 0.559 493 N N -0.245 118.279 118.700 -0.294 0.000 2.447 493 N HA 0.642 5.401 4.740 0.032 0.000 0.271 493 N C -0.659 174.450 175.510 -0.669 0.000 1.226 493 N CA -0.089 52.684 53.050 -0.461 0.000 0.980 493 N CB 0.531 38.802 38.487 -0.360 0.000 1.206 493 N HN 0.455 8.835 8.380 -0.000 0.000 0.558 494 Y N -0.367 119.728 120.300 -0.342 0.000 2.487 494 Y HA 0.459 5.027 4.550 0.030 0.000 0.337 494 Y C -0.510 175.003 175.900 -0.646 0.000 1.076 494 Y CA -0.546 57.361 58.100 -0.322 0.000 1.115 494 Y CB 1.039 39.387 38.460 -0.186 0.000 1.235 494 Y HN 0.353 8.633 8.280 -0.000 0.000 0.468 495 Y N 0.060 120.200 120.300 -0.267 0.000 2.545 495 Y HA 0.784 5.353 4.550 0.031 0.000 0.348 495 Y C -0.398 175.230 175.900 -0.453 0.000 1.002 495 Y CA -1.378 56.448 58.100 -0.456 0.000 1.039 495 Y CB 2.127 40.030 38.460 -0.929 0.000 1.271 495 Y HN 0.645 8.925 8.280 -0.000 0.000 0.467 496 A N 2.705 125.468 122.820 -0.096 0.000 2.414 496 A HA 0.880 5.220 4.320 0.032 0.000 0.306 496 A C -1.463 176.194 177.584 0.121 0.000 1.054 496 A CA -0.671 51.370 52.037 0.006 0.000 0.724 496 A CB 0.923 19.934 19.000 0.018 0.000 1.267 496 A HN 0.702 8.852 8.150 -0.000 0.000 0.418 497 I N 1.596 122.277 120.570 0.184 0.000 2.439 497 I HA 0.261 4.450 4.170 0.032 0.000 0.285 497 I C 0.057 176.204 176.117 0.051 0.000 1.021 497 I CA -0.278 61.100 61.300 0.130 0.000 1.091 497 I CB 1.887 39.942 38.000 0.092 0.000 1.242 497 I HN 0.816 9.026 8.210 -0.000 0.000 0.439 498 E N 6.430 126.594 120.200 -0.060 0.000 2.324 498 E HA 0.353 4.722 4.350 0.032 0.000 0.271 498 E C -0.962 175.469 176.600 -0.282 0.000 1.028 498 E CA -0.328 55.807 56.400 -0.441 0.000 0.890 498 E CB 1.065 30.485 29.700 -0.467 0.000 1.004 498 E HN 0.480 8.840 8.360 -0.000 0.000 0.431 499 V N 1.062 120.807 119.914 -0.281 0.000 3.001 499 V HA 0.816 4.956 4.120 0.032 0.000 0.314 499 V C -0.293 175.711 176.094 -0.151 0.000 1.099 499 V CA -0.666 61.532 62.300 -0.169 0.000 0.989 499 V CB 1.912 33.673 31.823 -0.102 0.000 1.040 499 V HN 0.652 8.842 8.190 -0.000 0.000 0.434 500 T N 2.354 116.841 114.554 -0.112 0.000 2.821 500 T HA 0.678 5.048 4.350 0.032 0.000 0.306 500 T C -3.131 171.540 174.700 -0.049 0.000 1.313 500 T CA -1.168 60.876 62.100 -0.095 0.000 1.012 500 T CB 2.428 71.211 68.868 -0.141 0.000 1.298 500 T HN 0.722 8.962 8.240 -0.000 0.000 0.502 501 P HA 0.572 4.992 4.420 -0.000 0.000 0.276 501 P C -0.938 176.440 177.300 0.130 0.000 1.244 501 P CA -0.080 63.060 63.100 0.066 0.000 0.801 501 P CB 0.874 32.661 31.700 0.145 0.000 1.006 502 G N -0.020 108.844 108.800 0.107 0.000 2.733 502 G HA2 0.456 4.435 3.960 0.032 0.000 0.297 502 G HA3 0.456 4.435 3.960 0.032 0.000 0.297 502 G C -1.198 173.740 174.900 0.063 0.000 1.422 502 G CA -0.583 44.596 45.100 0.131 0.000 0.942 502 G HN 0.306 8.596 8.290 -0.000 0.000 0.510 503 V N 0.990 120.942 119.914 0.064 0.000 2.599 503 V HA 0.199 4.338 4.120 0.032 0.000 0.300 503 V C 0.953 177.100 176.094 0.087 0.000 1.034 503 V CA 0.808 63.112 62.300 0.006 0.000 1.115 503 V CB 0.994 32.805 31.823 -0.020 0.000 0.934 503 V HN 1.039 9.229 8.190 -0.000 0.000 0.485 504 H N 2.460 121.521 119.070 -0.014 0.000 2.602 504 H HA 0.308 4.910 4.556 0.078 0.000 0.222 504 H C 0.196 175.619 175.328 0.159 0.000 0.886 504 H CA 0.499 56.603 56.048 0.093 0.000 1.008 504 H CB 0.633 30.514 29.762 0.198 0.000 1.380 504 H HN 0.772 9.052 8.280 -0.000 0.000 0.417 505 H N -0.161 118.942 119.070 0.054 0.000 2.894 505 H HA 0.439 5.009 4.556 0.023 0.000 0.367 505 H C -1.231 174.044 175.328 -0.088 0.000 1.144 505 H CA -0.254 55.758 56.048 -0.060 0.000 1.180 505 H CB 1.543 31.312 29.762 0.012 0.000 1.758 505 H HN 0.232 8.512 8.280 -0.000 0.000 0.541 506 T N 3.447 117.730 114.554 -0.451 0.000 2.853 506 T HA 0.200 4.569 4.350 0.032 0.000 0.317 506 T C 0.793 175.436 174.700 -0.095 0.000 1.059 506 T CA -0.851 61.030 62.100 -0.365 0.000 0.954 506 T CB 0.571 68.899 68.868 -0.901 0.000 0.994 506 T HN 0.507 8.747 8.240 -0.000 0.000 0.479 507 M N 2.465 122.170 119.600 0.175 0.000 2.476 507 M HA 0.227 4.726 4.480 0.032 0.000 0.262 507 M C 1.557 177.989 176.300 0.219 0.000 1.079 507 M CA 0.446 55.918 55.300 0.286 0.000 1.104 507 M CB -0.344 32.420 32.600 0.274 0.000 1.409 507 M HN 0.823 9.113 8.290 -0.000 0.000 0.467 508 G N -1.049 107.872 108.800 0.201 0.000 2.557 508 G HA2 0.632 4.611 3.960 0.032 0.000 0.292 508 G HA3 0.632 4.611 3.960 0.032 0.000 0.292 508 G C 0.053 175.047 174.900 0.156 0.000 1.237 508 G CA -0.094 45.116 45.100 0.183 0.000 0.978 508 G HN 0.507 8.797 8.290 -0.000 0.000 0.498 509 G N -2.392 106.471 108.800 0.105 0.000 2.356 509 G HA2 0.404 4.383 3.960 0.032 0.000 0.266 509 G HA3 0.404 4.383 3.960 0.032 0.000 0.266 509 G C -0.862 174.050 174.900 0.021 0.000 1.312 509 G CA 0.044 45.187 45.100 0.072 0.000 0.922 509 G HN 1.398 9.688 8.290 -0.000 0.000 0.480 510 V N 1.741 121.657 119.914 0.003 0.000 2.740 510 V HA 0.456 4.595 4.120 0.032 0.000 0.303 510 V C 1.020 177.097 176.094 -0.028 0.000 1.054 510 V CA 0.053 62.343 62.300 -0.017 0.000 1.106 510 V CB 0.680 32.491 31.823 -0.021 0.000 0.957 510 V HN 0.610 8.800 8.190 -0.000 0.000 0.486 511 M N 7.889 127.471 119.600 -0.030 0.000 2.188 511 M HA 0.385 4.884 4.480 0.032 0.000 0.354 511 M C -0.272 176.002 176.300 -0.043 0.000 1.342 511 M CA 0.337 55.616 55.300 -0.034 0.000 1.117 511 M CB 0.396 32.980 32.600 -0.027 0.000 1.670 511 M HN 0.650 8.940 8.290 -0.000 0.000 0.466 512 I N -0.382 120.158 120.570 -0.050 0.000 3.002 512 I HA 0.704 4.893 4.170 0.032 0.000 0.310 512 I C -0.783 175.324 176.117 -0.015 0.000 1.087 512 I CA -1.122 60.154 61.300 -0.039 0.000 1.017 512 I CB 1.983 39.961 38.000 -0.037 0.000 1.226 512 I HN 0.531 8.741 8.210 -0.000 0.000 0.443 513 D N 0.452 120.859 120.400 0.011 0.000 2.564 513 D HA 0.226 4.886 4.640 0.032 0.000 0.273 513 D C 1.079 177.437 176.300 0.096 0.000 1.192 513 D CA 0.028 54.051 54.000 0.037 0.000 1.080 513 D CB 0.282 41.096 40.800 0.023 0.000 1.160 513 D HN 0.755 9.125 8.370 -0.000 0.000 0.607 514 T N -3.399 111.214 114.554 0.098 0.000 3.113 514 T HA -0.031 4.338 4.350 0.032 0.000 0.263 514 T C 1.033 175.801 174.700 0.113 0.000 1.143 514 T CA 0.639 62.814 62.100 0.126 0.000 1.090 514 T CB -0.337 68.575 68.868 0.074 0.000 0.922 514 T HN 0.369 8.609 8.240 -0.000 0.000 0.521 515 K N 0.751 121.220 120.400 0.115 0.000 2.397 515 K HA 0.605 4.945 4.320 0.032 0.000 0.202 515 K C 1.056 177.784 176.600 0.213 0.000 1.022 515 K CA 0.271 56.639 56.287 0.134 0.000 1.141 515 K CB 0.263 32.841 32.500 0.130 0.000 0.857 515 K HN 0.342 8.592 8.250 -0.000 0.000 0.514 516 A N 1.409 124.362 122.820 0.223 0.000 2.899 516 A HA -0.224 4.115 4.320 0.032 0.000 0.257 516 A C -0.326 177.367 177.584 0.183 0.000 1.335 516 A CA 0.951 53.141 52.037 0.255 0.000 0.924 516 A CB -1.905 17.289 19.000 0.323 0.000 1.105 516 A HN 0.491 8.641 8.150 -0.000 0.000 0.765 517 E N 0.037 120.250 120.200 0.021 0.000 2.259 517 E HA 0.411 4.780 4.350 0.032 0.000 0.281 517 E C 0.145 176.638 176.600 -0.178 0.000 1.037 517 E CA -0.475 55.770 56.400 -0.259 0.000 0.854 517 E CB 1.350 30.914 29.700 -0.228 0.000 1.051 517 E HN 0.313 8.673 8.360 -0.000 0.000 0.409 518 V N 4.987 124.771 119.914 -0.217 0.000 2.637 518 V HA 0.079 4.218 4.120 0.032 0.000 0.296 518 V C 0.357 176.381 176.094 -0.117 0.000 1.046 518 V CA 0.524 62.746 62.300 -0.130 0.000 1.066 518 V CB 0.525 32.277 31.823 -0.119 0.000 0.968 518 V HN 0.669 8.859 8.190 -0.000 0.000 0.483 519 M N 4.140 123.694 119.600 -0.076 0.000 2.662 519 M HA 0.467 4.966 4.480 0.032 0.000 0.310 519 M C -0.150 176.122 176.300 -0.048 0.000 1.204 519 M CA -0.802 54.462 55.300 -0.061 0.000 0.891 519 M CB 2.078 34.651 32.600 -0.044 0.000 1.732 519 M HN 0.812 9.102 8.290 -0.000 0.000 0.467 520 N N 0.894 119.569 118.700 -0.041 0.000 2.495 520 N HA 0.435 5.194 4.740 0.032 0.000 0.294 520 N C 0.514 176.007 175.510 -0.027 0.000 1.276 520 N CA -0.296 52.733 53.050 -0.034 0.000 0.973 520 N CB 0.067 38.535 38.487 -0.032 0.000 1.143 520 N HN 0.701 9.081 8.380 -0.000 0.000 0.589 521 A N -0.667 122.139 122.820 -0.024 0.000 2.070 521 A HA -0.099 4.240 4.320 0.032 0.000 0.220 521 A C 1.555 179.130 177.584 -0.015 0.000 1.159 521 A CA 1.161 53.187 52.037 -0.019 0.000 0.656 521 A CB -0.632 18.357 19.000 -0.019 0.000 0.800 521 A HN 0.715 8.865 8.150 -0.000 0.000 0.453 522 K N -0.732 119.659 120.400 -0.016 0.000 2.444 522 K HA 0.058 4.397 4.320 0.032 0.000 0.193 522 K C -0.250 176.343 176.600 -0.012 0.000 1.024 522 K CA -0.006 56.274 56.287 -0.012 0.000 1.077 522 K CB 0.333 32.826 32.500 -0.012 0.000 0.833 522 K HN 0.155 8.405 8.250 -0.000 0.000 0.517 523 K N 0.572 120.963 120.400 -0.015 0.000 3.251 523 K HA -0.176 4.163 4.320 0.032 0.000 0.282 523 K C -0.960 175.630 176.600 -0.017 0.000 1.201 523 K CA 0.876 57.154 56.287 -0.015 0.000 0.827 523 K CB -2.281 30.214 32.500 -0.008 0.000 1.286 523 K HN 0.436 8.686 8.250 -0.000 0.000 0.503 524 Q N 0.091 119.878 119.800 -0.021 0.000 2.241 524 Q HA 0.484 4.843 4.340 0.032 0.000 0.254 524 Q C 0.242 176.219 176.000 -0.037 0.000 0.917 524 Q CA -0.827 54.962 55.803 -0.023 0.000 0.919 524 Q CB 1.917 30.644 28.738 -0.019 0.000 1.237 524 Q HN -0.015 8.255 8.270 -0.000 0.000 0.434 525 V N 3.521 123.410 119.914 -0.043 0.000 2.637 525 V HA 0.054 4.193 4.120 0.032 0.000 0.296 525 V C 0.188 176.233 176.094 -0.082 0.000 1.046 525 V CA 0.134 62.389 62.300 -0.075 0.000 1.066 525 V CB 0.466 32.244 31.823 -0.076 0.000 0.968 525 V HN 0.631 8.821 8.190 -0.000 0.000 0.483 526 I N 7.333 127.833 120.570 -0.118 0.000 2.291 526 I HA 0.258 4.447 4.170 0.032 0.000 0.292 526 I C -2.145 173.873 176.117 -0.164 0.000 1.064 526 I CA -1.743 59.490 61.300 -0.110 0.000 1.269 526 I CB 1.089 39.026 38.000 -0.105 0.000 1.418 526 I HN 0.470 8.680 8.210 -0.000 0.000 0.485 527 P HA 0.057 4.477 4.420 -0.000 0.000 0.263 527 P C 0.928 178.091 177.300 -0.229 0.000 1.195 527 P CA 0.626 63.656 63.100 -0.118 0.000 0.762 527 P CB 0.647 32.406 31.700 0.098 0.000 0.799 528 G N 1.929 110.331 108.800 -0.664 0.000 2.217 528 G HA2 -0.242 3.737 3.960 0.032 0.000 0.246 528 G HA3 -0.242 3.737 3.960 0.032 0.000 0.246 528 G C -0.336 174.409 174.900 -0.259 0.000 0.990 528 G CA -0.132 44.664 45.100 -0.507 0.000 0.627 528 G HN 0.591 8.881 8.290 -0.000 0.000 0.522 529 L N 1.264 122.259 121.223 -0.381 0.000 2.296 529 L HA 0.844 5.203 4.340 0.032 0.000 0.286 529 L C -0.599 175.996 176.870 -0.457 0.000 1.023 529 L CA -1.662 53.034 54.840 -0.240 0.000 0.812 529 L CB 0.706 42.674 42.059 -0.151 0.000 1.223 529 L HN 0.137 8.367 8.230 -0.000 0.000 0.421 530 Y N 2.712 122.974 120.300 -0.063 0.000 2.562 530 Y HA 0.842 5.411 4.550 0.031 0.000 0.343 530 Y C 0.625 176.516 175.900 -0.014 0.000 1.025 530 Y CA -0.631 57.447 58.100 -0.037 0.000 1.082 530 Y CB 2.418 40.862 38.460 -0.026 0.000 1.264 530 Y HN 0.654 8.934 8.280 -0.000 0.000 0.478 531 G N 0.028 108.914 108.800 0.142 0.000 2.682 531 G HA2 0.743 4.722 3.960 0.032 0.000 0.300 531 G HA3 0.743 4.722 3.960 0.032 0.000 0.300 531 G C -1.948 173.005 174.900 0.088 0.000 1.391 531 G CA -0.773 44.376 45.100 0.081 0.000 0.990 531 G HN 0.812 9.102 8.290 -0.000 0.000 0.501 532 A N 0.356 123.222 122.820 0.076 0.000 2.547 532 A HA 1.078 5.417 4.320 0.032 0.000 0.297 532 A C 0.402 178.027 177.584 0.067 0.000 1.056 532 A CA 0.424 52.515 52.037 0.090 0.000 0.688 532 A CB 1.379 20.475 19.000 0.159 0.000 1.282 532 A HN 2.734 10.884 8.150 -0.000 0.000 0.400 533 G N 0.619 109.450 108.800 0.051 0.000 2.545 533 G HA2 -0.124 3.855 3.960 0.032 0.000 0.216 533 G HA3 -0.124 3.855 3.960 0.032 0.000 0.216 533 G C 0.666 175.596 174.900 0.051 0.000 1.314 533 G CA 0.577 45.723 45.100 0.077 0.000 0.906 533 G HN 1.277 9.567 8.290 -0.000 0.000 0.563 534 E N -0.770 119.471 120.200 0.068 0.000 2.333 534 E HA -0.003 4.366 4.350 0.032 0.000 0.198 534 E C 2.426 179.021 176.600 -0.009 0.000 1.007 534 E CA 1.366 57.772 56.400 0.009 0.000 0.845 534 E CB -0.089 29.541 29.700 -0.115 0.000 0.766 534 E HN 0.655 9.015 8.360 -0.000 0.000 0.507 535 V N 1.077 120.999 119.914 0.014 0.000 2.913 535 V HA -0.094 4.045 4.120 0.032 0.000 0.260 535 V C 1.015 177.119 176.094 0.017 0.000 1.098 535 V CA 1.517 63.833 62.300 0.027 0.000 1.121 535 V CB -0.368 31.471 31.823 0.027 0.000 0.714 535 V HN 0.421 8.611 8.190 -0.000 0.000 0.487 536 T N -1.461 113.087 114.554 -0.011 0.000 2.918 536 T HA 0.654 5.024 4.350 0.032 0.000 0.283 536 T C 0.134 174.818 174.700 -0.028 0.000 1.001 536 T CA -0.003 62.070 62.100 -0.045 0.000 1.041 536 T CB 1.587 70.375 68.868 -0.133 0.000 1.028 536 T HN 0.393 8.633 8.240 -0.000 0.000 0.511 537 G N -1.663 107.118 108.800 -0.031 0.000 2.473 537 G HA2 0.599 4.578 3.960 0.032 0.000 0.321 537 G HA3 0.599 4.578 3.960 0.032 0.000 0.321 537 G C 0.686 175.552 174.900 -0.057 0.000 1.200 537 G CA -0.488 44.611 45.100 -0.002 0.000 0.963 537 G HN 1.785 10.075 8.290 -0.000 0.000 0.483 538 G N -1.127 107.646 108.800 -0.045 0.000 2.238 538 G HA2 -0.243 3.736 3.960 0.032 0.000 0.217 538 G HA3 -0.243 3.736 3.960 0.032 0.000 0.217 538 G C 1.175 175.987 174.900 -0.146 0.000 0.996 538 G CA 0.683 45.738 45.100 -0.074 0.000 0.632 538 G HN 1.081 9.371 8.290 -0.000 0.000 0.503 539 V N 0.372 120.126 119.914 -0.266 0.000 2.346 539 V HA 0.015 4.154 4.120 0.032 0.000 0.244 539 V C 2.130 177.981 176.094 -0.406 0.000 1.037 539 V CA 2.633 64.688 62.300 -0.408 0.000 1.029 539 V CB -0.566 30.843 31.823 -0.689 0.000 0.663 539 V HN 0.590 8.780 8.190 -0.000 0.000 0.454 540 H N -0.531 118.499 119.070 -0.067 0.000 2.562 540 H HA 0.432 5.012 4.556 0.041 0.000 0.267 540 H C 1.527 176.781 175.328 -0.124 0.000 0.959 540 H CA 0.473 56.465 56.048 -0.095 0.000 1.204 540 H CB 0.188 29.899 29.762 -0.086 0.000 1.430 540 H HN 0.532 8.812 8.280 -0.000 0.000 0.545 541 G N 0.893 109.675 108.800 -0.030 0.000 2.528 541 G HA2 -0.381 3.598 3.960 0.032 0.000 0.262 541 G HA3 -0.381 3.598 3.960 0.032 0.000 0.262 541 G C 1.216 175.940 174.900 -0.294 0.000 1.200 541 G CA 0.324 45.348 45.100 -0.127 0.000 0.951 541 G HN 0.530 8.820 8.290 -0.000 0.000 0.566 542 A N -0.235 122.263 122.820 -0.535 0.000 2.123 542 A HA 0.404 4.743 4.320 0.032 0.000 0.214 542 A C 0.986 178.306 177.584 -0.439 0.000 1.152 542 A CA 1.705 53.133 52.037 -1.015 0.000 0.728 542 A CB -0.183 18.236 19.000 -0.967 0.000 0.814 542 A HN 0.758 8.908 8.150 -0.000 0.000 0.464 543 N N -0.564 117.993 118.700 -0.239 0.000 2.484 543 N HA 0.395 5.154 4.740 0.032 0.000 0.269 543 N C -1.229 174.167 175.510 -0.191 0.000 1.237 543 N CA -0.607 52.349 53.050 -0.156 0.000 0.838 543 N CB 1.837 40.250 38.487 -0.124 0.000 1.593 543 N HN 0.434 8.814 8.380 -0.000 0.000 0.485 544 R N 0.081 120.390 120.500 -0.318 0.000 2.674 544 R HA 0.711 5.070 4.340 0.032 0.000 0.266 544 R C -0.680 175.375 176.300 -0.408 0.000 1.016 544 R CA -0.686 55.162 56.100 -0.419 0.000 1.062 544 R CB 0.978 30.861 30.300 -0.695 0.000 1.142 544 R HN 0.359 8.629 8.270 -0.000 0.000 0.517 545 L N 1.210 122.243 121.223 -0.316 0.000 2.329 545 L HA 0.501 4.860 4.340 0.032 0.000 0.279 545 L C 0.597 177.320 176.870 -0.245 0.000 1.014 545 L CA -1.182 53.515 54.840 -0.238 0.000 0.814 545 L CB 2.009 43.992 42.059 -0.127 0.000 1.257 545 L HN 0.988 9.218 8.230 -0.000 0.000 0.424 546 G N 0.592 109.267 108.800 -0.207 0.000 2.353 546 G HA2 0.352 4.331 3.960 0.032 0.000 0.239 546 G HA3 0.352 4.331 3.960 0.032 0.000 0.239 546 G C 0.950 175.813 174.900 -0.061 0.000 1.295 546 G CA 0.671 45.691 45.100 -0.133 0.000 0.884 546 G HN 1.048 9.338 8.290 -0.000 0.000 0.537 547 G N 2.215 111.000 108.800 -0.026 0.000 2.217 547 G HA2 -0.310 3.669 3.960 0.032 0.000 0.246 547 G HA3 -0.310 3.669 3.960 0.032 0.000 0.246 547 G C 1.215 176.138 174.900 0.038 0.000 0.990 547 G CA 0.639 45.756 45.100 0.028 0.000 0.627 547 G HN 0.657 8.947 8.290 -0.000 0.000 0.522 548 N N 0.744 119.444 118.700 -0.000 0.000 2.416 548 N HA 0.295 5.054 4.740 0.032 0.000 0.177 548 N C 2.415 178.019 175.510 0.156 0.000 1.036 548 N CA 1.533 54.630 53.050 0.079 0.000 0.901 548 N CB -0.354 38.191 38.487 0.097 0.000 0.976 548 N HN 0.702 9.082 8.380 -0.000 0.000 0.444 549 A N 1.055 123.895 122.820 0.033 0.000 1.898 549 A HA -0.036 4.303 4.320 0.032 0.000 0.216 549 A C 1.996 179.678 177.584 0.163 0.000 1.181 549 A CA 0.782 52.884 52.037 0.107 0.000 0.620 549 A CB -0.364 18.616 19.000 -0.033 0.000 0.819 549 A HN 0.108 8.258 8.150 -0.000 0.000 0.442 550 I N -0.186 120.461 120.570 0.128 0.000 2.394 550 I HA -0.145 4.044 4.170 0.032 0.000 0.251 550 I C 2.678 178.886 176.117 0.151 0.000 1.136 550 I CA 1.699 63.083 61.300 0.140 0.000 1.425 550 I CB -1.220 36.855 38.000 0.124 0.000 1.079 550 I HN 0.388 8.598 8.210 -0.000 0.000 0.425 551 S N 0.745 116.532 115.700 0.145 0.000 2.356 551 S HA -0.241 4.248 4.470 0.032 0.000 0.223 551 S C 1.864 176.572 174.600 0.180 0.000 1.032 551 S CA 1.990 60.275 58.200 0.143 0.000 1.005 551 S CB -0.222 63.053 63.200 0.125 0.000 0.867 551 S HN 0.490 8.800 8.310 -0.000 0.000 0.449 552 D N 1.644 122.179 120.400 0.225 0.000 2.092 552 D HA -0.154 4.505 4.640 0.032 0.000 0.193 552 D C 2.002 178.490 176.300 0.313 0.000 0.994 552 D CA 1.981 56.163 54.000 0.304 0.000 0.828 552 D CB -0.650 40.293 40.800 0.239 0.000 0.963 552 D HN 0.658 9.028 8.370 -0.000 0.000 0.450 553 I N -1.779 118.934 120.570 0.237 0.000 2.361 553 I HA -0.187 4.002 4.170 0.032 0.000 0.251 553 I C 1.822 178.068 176.117 0.215 0.000 1.133 553 I CA 0.853 62.283 61.300 0.217 0.000 1.413 553 I CB -0.334 37.776 38.000 0.185 0.000 1.073 553 I HN -0.054 8.156 8.210 -0.000 0.000 0.424 554 I N 1.780 122.472 120.570 0.203 0.000 2.233 554 I HA -0.163 4.026 4.170 0.032 0.000 0.243 554 I C 2.669 178.865 176.117 0.131 0.000 1.093 554 I CA 1.533 62.961 61.300 0.213 0.000 1.380 554 I CB -1.810 36.326 38.000 0.226 0.000 1.067 554 I HN 0.283 8.493 8.210 -0.000 0.000 0.413 555 T N 1.201 115.806 114.554 0.085 0.000 2.674 555 T HA -0.137 4.232 4.350 0.032 0.000 0.265 555 T C 1.820 176.417 174.700 -0.172 0.000 1.039 555 T CA 1.576 63.632 62.100 -0.073 0.000 1.150 555 T CB -0.368 68.425 68.868 -0.125 0.000 0.864 555 T HN 0.092 8.332 8.240 -0.000 0.000 0.427 556 F N 1.112 121.057 119.950 -0.010 0.000 2.325 556 F HA 0.151 4.697 4.527 0.032 0.000 0.299 556 F C 2.549 178.353 175.800 0.006 0.000 1.090 556 F CA 0.659 58.650 58.000 -0.014 0.000 1.392 556 F CB -0.753 38.243 39.000 -0.007 0.000 1.053 556 F HN 0.218 8.518 8.300 -0.000 0.000 0.521 557 G N -0.217 108.691 108.800 0.180 0.000 2.404 557 G HA2 -0.247 3.732 3.960 0.032 0.000 0.215 557 G HA3 -0.247 3.732 3.960 0.032 0.000 0.215 557 G C 1.765 176.697 174.900 0.053 0.000 1.174 557 G CA 0.626 45.806 45.100 0.134 0.000 0.780 557 G HN 0.228 8.518 8.290 -0.000 0.000 0.537 558 R N -0.212 120.271 120.500 -0.028 0.000 2.081 558 R HA -0.049 4.310 4.340 0.032 0.000 0.235 558 R C 2.497 178.686 176.300 -0.185 0.000 1.131 558 R CA 1.542 57.509 56.100 -0.222 0.000 0.960 558 R CB -0.407 29.518 30.300 -0.626 0.000 0.856 558 R HN 0.355 8.625 8.270 -0.000 0.000 0.436 559 L N 0.769 121.904 121.223 -0.146 0.000 2.017 559 L HA -0.063 4.296 4.340 0.032 0.000 0.208 559 L C 2.254 179.083 176.870 -0.069 0.000 1.073 559 L CA 2.273 57.047 54.840 -0.109 0.000 0.745 559 L CB -0.834 41.137 42.059 -0.147 0.000 0.894 559 L HN 0.220 8.450 8.230 -0.000 0.000 0.432 560 A N -0.350 122.454 122.820 -0.027 0.000 1.933 560 A HA -0.040 4.299 4.320 0.032 0.000 0.218 560 A C 2.340 179.795 177.584 -0.214 0.000 1.175 560 A CA 1.513 53.500 52.037 -0.082 0.000 0.628 560 A CB -1.607 17.411 19.000 0.030 0.000 0.814 560 A HN 0.566 8.716 8.150 -0.000 0.000 0.444 561 G N -0.547 108.183 108.800 -0.117 0.000 2.402 561 G HA2 -0.190 3.789 3.960 0.032 0.000 0.216 561 G HA3 -0.190 3.789 3.960 0.032 0.000 0.216 561 G C 1.450 176.284 174.900 -0.109 0.000 1.162 561 G CA 0.951 45.992 45.100 -0.099 0.000 0.777 561 G HN 0.649 8.939 8.290 -0.000 0.000 0.539 562 E N 0.213 120.351 120.200 -0.103 0.000 2.047 562 E HA -0.092 4.277 4.350 0.032 0.000 0.191 562 E C 2.520 179.073 176.600 -0.079 0.000 0.987 562 E CA 0.862 57.214 56.400 -0.080 0.000 0.799 562 E CB -0.034 29.614 29.700 -0.086 0.000 0.752 562 E HN 0.332 8.692 8.360 -0.000 0.000 0.449 563 E N 0.578 120.712 120.200 -0.109 0.000 2.077 563 E HA -0.164 4.205 4.350 0.032 0.000 0.193 563 E C 2.073 178.574 176.600 -0.165 0.000 0.989 563 E CA 0.975 57.327 56.400 -0.080 0.000 0.800 563 E CB -0.203 29.495 29.700 -0.002 0.000 0.746 563 E HN 0.210 8.570 8.360 -0.000 0.000 0.452 564 A N 1.520 124.055 122.820 -0.476 0.000 1.933 564 A HA -0.070 4.269 4.320 0.032 0.000 0.218 564 A C 2.419 179.981 177.584 -0.037 0.000 1.175 564 A CA 1.867 53.662 52.037 -0.403 0.000 0.628 564 A CB -0.476 18.206 19.000 -0.531 0.000 0.814 564 A HN 0.263 8.413 8.150 -0.000 0.000 0.444 565 A N -0.080 122.713 122.820 -0.044 0.000 1.902 565 A HA -0.160 4.179 4.320 0.032 0.000 0.217 565 A C 2.116 179.727 177.584 0.045 0.000 1.181 565 A CA 1.826 53.871 52.037 0.013 0.000 0.623 565 A CB -0.397 18.603 19.000 -0.001 0.000 0.818 565 A HN 0.546 8.696 8.150 -0.000 0.000 0.443 566 K N -1.808 118.621 120.400 0.049 0.000 2.057 566 K HA -0.125 4.214 4.320 0.032 0.000 0.206 566 K C 1.978 178.642 176.600 0.107 0.000 1.050 566 K CA 1.554 57.879 56.287 0.064 0.000 0.935 566 K CB -0.382 32.154 32.500 0.059 0.000 0.715 566 K HN 0.613 8.863 8.250 -0.000 0.000 0.439 567 Y N 1.994 122.320 120.300 0.043 0.000 2.128 567 Y HA -0.183 4.386 4.550 0.033 0.000 0.284 567 Y C 1.575 177.514 175.900 0.064 0.000 1.154 567 Y CA 1.243 59.392 58.100 0.082 0.000 1.149 567 Y CB -0.230 38.331 38.460 0.169 0.000 0.976 567 Y HN -0.054 8.226 8.280 -0.000 0.000 0.505 568 S N 0.000 115.799 115.700 0.166 0.000 2.498 568 S HA 0.000 4.489 4.470 0.032 0.000 0.327 568 S CA 0.000 58.240 58.200 0.066 0.000 1.107 568 S CB 0.000 63.267 63.200 0.111 0.000 0.593 568 S HN 0.000 8.310 8.310 -0.000 0.000 0.517