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 3drf_1_A DATA FIRST_RESID 32 DATA SEQUENCE GGNLKVAYQS DSPMKAQWLS GLSNDATFAT MSGPGGGQDG LFFTDSGFKF DATA SEQUENCE IKGGAADVAL DKESKTATIT LRKDLKWSDG SEVTAKDYEF TYETIANPAY DATA SEQUENCE GSDRWTDSLA NIVGLSDYHT GKAKTISGIT FPDGENGKVI KVQFKEMKPG DATA SEQUENCE MTQSGNGYFL ETVAPYQYLK DVAPKDLASS PKTTTKPLVT GPFKPENVVA DATA SEQUENCE GESIKYVPNP YYWGEKPKLN SITYEVVSTA KSVAALSSSK YDIINGMVSS DATA SEQUENCE QYKQVKNLKG YKVLGQQAMY ISLMYYNLGH YDAKNSINVQ DRKTPLQDQN DATA SEQUENCE VRQAIGYARN VAEVDNKFSN GLSTPANSLI PPIFKQFTSS SVKGYEKQDL DATA SEQUENCE DKANKLLDED GWKLNKSTGY REKDGKELSL VYAARVGDAN AETIAQNYIQ DATA SEQUENCE QWKKIGVKVS LYNGKLMEFN SWVDHMTTPP GANDWDITDG SWSLASEPSQ DATA SEQUENCE QDLFSAAAPY NFGHFNDSEI TKDLNDIDSA KSENPTYRKA AFVKYQEDMN DATA SEQUENCE KKAYVIPTNF MLNYTPVNKR VVGMTLDYGA MNTWSEIGV 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 32 G HA2 0.000 nan 3.960 nan 0.000 0.244 32 G HA3 0.000 3.959 3.960 -0.002 0.000 0.244 32 G C 0.000 174.932 174.900 0.053 0.000 0.946 32 G CA 0.000 45.128 45.100 0.046 0.000 0.502 33 G N -1.046 107.788 108.800 0.057 0.000 2.563 33 G HA2 0.488 4.447 3.960 -0.002 0.000 0.283 33 G HA3 0.488 4.447 3.960 -0.002 0.000 0.283 33 G C -0.576 174.363 174.900 0.066 0.000 1.309 33 G CA -0.567 44.564 45.100 0.051 0.000 1.022 33 G HN 0.529 8.819 8.290 0.000 0.000 0.501 34 N N 0.048 118.778 118.700 0.051 0.000 2.573 34 N HA 0.233 4.972 4.740 -0.002 0.000 0.262 34 N C -1.219 174.316 175.510 0.042 0.000 1.029 34 N CA -0.414 52.668 53.050 0.054 0.000 0.882 34 N CB 2.246 40.762 38.487 0.049 0.000 1.204 34 N HN 0.251 8.631 8.380 0.000 0.000 0.519 35 L N 1.759 123.005 121.223 0.038 0.000 2.350 35 L HA 0.372 4.711 4.340 -0.002 0.000 0.275 35 L C -0.119 176.772 176.870 0.034 0.000 1.099 35 L CA 0.034 54.892 54.840 0.030 0.000 0.808 35 L CB 0.589 42.662 42.059 0.023 0.000 1.149 35 L HN 0.228 8.458 8.230 0.000 0.000 0.442 36 K N 4.345 124.778 120.400 0.055 0.000 2.394 36 K HA 0.611 4.930 4.320 -0.002 0.000 0.260 36 K C -1.540 175.130 176.600 0.117 0.000 0.967 36 K CA -0.670 55.685 56.287 0.113 0.000 0.855 36 K CB 1.943 34.526 32.500 0.139 0.000 1.101 36 K HN 0.390 8.640 8.250 0.000 0.000 0.433 37 V N 1.452 121.354 119.914 -0.021 0.000 2.769 37 V HA 0.769 4.888 4.120 -0.002 0.000 0.312 37 V C -0.532 175.335 176.094 -0.378 0.000 1.061 37 V CA -0.944 61.184 62.300 -0.287 0.000 0.931 37 V CB 1.788 33.154 31.823 -0.762 0.000 1.010 37 V HN 0.892 9.082 8.190 0.000 0.000 0.433 38 A N 2.620 125.155 122.820 -0.474 0.000 2.469 38 A HA 0.857 5.176 4.320 -0.002 0.000 0.299 38 A C -1.904 175.666 177.584 -0.024 0.000 1.098 38 A CA -0.604 51.184 52.037 -0.415 0.000 0.737 38 A CB 1.622 19.919 19.000 -1.171 0.000 1.312 38 A HN 0.855 9.005 8.150 0.000 0.000 0.414 39 Y N 0.583 120.893 120.300 0.016 0.000 2.364 39 Y HA 0.462 5.011 4.550 -0.002 0.000 0.340 39 Y C 0.399 176.248 175.900 -0.085 0.000 0.975 39 Y CA -0.238 57.861 58.100 -0.000 0.000 1.089 39 Y CB 1.603 40.076 38.460 0.022 0.000 1.192 39 Y HN 0.764 9.044 8.280 0.000 0.000 0.454 40 Q N 4.245 123.816 119.800 -0.382 0.000 2.296 40 Q HA 0.344 4.683 4.340 -0.002 0.000 0.263 40 Q C -1.185 174.780 176.000 -0.058 0.000 1.026 40 Q CA 0.151 55.822 55.803 -0.220 0.000 0.912 40 Q CB 0.540 29.101 28.738 -0.296 0.000 1.198 40 Q HN 0.637 8.907 8.270 0.000 0.000 0.407 41 S N 3.267 118.974 115.700 0.013 0.000 2.562 41 S HA 0.178 4.647 4.470 -0.002 0.000 0.274 41 S C -0.653 173.946 174.600 -0.001 0.000 1.160 41 S CA -0.750 57.465 58.200 0.023 0.000 0.933 41 S CB 1.233 64.491 63.200 0.096 0.000 1.100 41 S HN 0.743 9.053 8.310 0.000 0.000 0.468 42 D N 2.036 122.419 120.400 -0.027 0.000 2.347 42 D HA 0.165 4.804 4.640 -0.002 0.000 0.213 42 D C 0.257 176.567 176.300 0.017 0.000 0.985 42 D CA 0.629 54.622 54.000 -0.011 0.000 0.879 42 D CB 0.451 41.233 40.800 -0.030 0.000 0.919 42 D HN 0.379 8.749 8.370 0.000 0.000 0.526 43 S N 0.947 116.670 115.700 0.038 0.000 2.608 43 S HA 0.434 4.903 4.470 -0.002 0.000 0.291 43 S C -2.430 172.209 174.600 0.064 0.000 1.146 43 S CA -1.241 57.003 58.200 0.073 0.000 1.043 43 S CB 2.067 65.365 63.200 0.165 0.000 1.037 43 S HN -0.098 8.212 8.310 0.000 0.000 0.520 44 P HA 0.036 4.456 4.420 0.000 0.000 0.267 44 P C -0.208 177.117 177.300 0.040 0.000 1.200 44 P CA -0.100 63.024 63.100 0.039 0.000 0.772 44 P CB 0.292 32.006 31.700 0.023 0.000 0.855 45 M N 3.031 122.650 119.600 0.032 0.000 2.250 45 M HA -0.007 4.472 4.480 -0.002 0.000 0.337 45 M C -0.150 176.127 176.300 -0.038 0.000 1.161 45 M CA 0.896 56.209 55.300 0.023 0.000 1.088 45 M CB 0.068 32.694 32.600 0.044 0.000 1.639 45 M HN 0.187 8.477 8.290 0.000 0.000 0.447 46 K N 4.504 124.853 120.400 -0.084 0.000 2.423 46 K HA 0.406 4.725 4.320 -0.002 0.000 0.234 46 K C -0.709 175.568 176.600 -0.539 0.000 1.051 46 K CA -0.462 55.707 56.287 -0.197 0.000 1.021 46 K CB 0.940 33.369 32.500 -0.118 0.000 1.474 46 K HN 0.765 9.015 8.250 0.000 0.000 0.474 47 A N 2.852 125.267 122.820 -0.675 0.000 2.515 47 A HA 0.064 4.383 4.320 -0.002 0.000 0.263 47 A C -0.134 176.852 177.584 -0.997 0.000 1.096 47 A CA 0.377 51.597 52.037 -1.362 0.000 0.769 47 A CB 0.194 18.843 19.000 -0.585 0.000 1.040 47 A HN 0.556 8.706 8.150 0.000 0.000 0.505 48 Q N 2.640 121.625 119.800 -1.359 0.000 2.406 48 Q HA 0.362 4.701 4.340 -0.002 0.000 0.244 48 Q C -1.031 174.824 176.000 -0.241 0.000 0.884 48 Q CA -0.307 55.219 55.803 -0.462 0.000 0.813 48 Q CB 0.355 28.950 28.738 -0.238 0.000 1.368 48 Q HN 0.715 8.985 8.270 0.000 0.000 0.439 49 W N 3.279 124.624 121.300 0.075 0.000 3.139 49 W HA 0.303 4.961 4.660 -0.002 0.000 0.260 49 W C 0.067 176.703 176.519 0.195 0.000 1.312 49 W CA -0.076 57.413 57.345 0.240 0.000 1.606 49 W CB 0.646 30.235 29.460 0.216 0.000 1.118 49 W HN 0.364 8.544 8.180 0.000 0.000 0.675 50 L N 1.695 123.084 121.223 0.276 0.000 2.260 50 L HA 0.138 4.477 4.340 -0.002 0.000 0.289 50 L C 1.910 178.854 176.870 0.124 0.000 1.057 50 L CA -0.256 54.693 54.840 0.183 0.000 0.811 50 L CB 1.299 43.417 42.059 0.099 0.000 1.184 50 L HN -0.068 8.162 8.230 0.000 0.000 0.429 51 S N 2.164 117.940 115.700 0.127 0.000 2.387 51 S HA -0.166 4.303 4.470 -0.002 0.000 0.230 51 S C 1.785 176.416 174.600 0.051 0.000 1.035 51 S CA 1.315 59.574 58.200 0.098 0.000 1.014 51 S CB -0.417 62.843 63.200 0.100 0.000 0.836 51 S HN 0.839 9.149 8.310 0.000 0.000 0.466 52 G N 1.047 109.850 108.800 0.005 0.000 2.443 52 G HA2 0.126 4.085 3.960 -0.002 0.000 0.219 52 G HA3 0.126 4.085 3.960 -0.002 0.000 0.219 52 G C 1.329 176.235 174.900 0.009 0.000 1.131 52 G CA 0.677 45.761 45.100 -0.027 0.000 0.775 52 G HN 0.563 8.853 8.290 0.000 0.000 0.547 53 L N 0.405 121.642 121.223 0.024 0.000 2.640 53 L HA 0.277 4.616 4.340 -0.002 0.000 0.230 53 L C 0.917 177.816 176.870 0.049 0.000 1.123 53 L CA -0.113 54.751 54.840 0.040 0.000 0.900 53 L CB 0.526 42.606 42.059 0.034 0.000 1.146 53 L HN 0.153 8.383 8.230 0.000 0.000 0.484 54 S N 0.008 115.748 115.700 0.067 0.000 2.449 54 S HA 0.349 4.818 4.470 -0.002 0.000 0.310 54 S C 0.597 175.274 174.600 0.128 0.000 1.096 54 S CA -0.634 57.610 58.200 0.073 0.000 1.095 54 S CB 0.900 64.152 63.200 0.088 0.000 1.007 54 S HN 0.154 8.464 8.310 0.000 0.000 0.474 55 N N 2.719 121.495 118.700 0.127 0.000 2.294 55 N HA 0.094 4.833 4.740 -0.002 0.000 0.186 55 N C -0.403 175.198 175.510 0.151 0.000 1.107 55 N CA 0.163 53.325 53.050 0.187 0.000 0.884 55 N CB 0.295 38.868 38.487 0.144 0.000 1.030 55 N HN 0.818 9.198 8.380 0.000 0.000 0.482 56 D N -0.574 119.904 120.400 0.130 0.000 2.198 56 D HA 0.353 4.992 4.640 -0.002 0.000 0.247 56 D C 0.486 176.842 176.300 0.094 0.000 1.010 56 D CA -0.634 53.462 54.000 0.161 0.000 0.880 56 D CB 2.091 43.032 40.800 0.237 0.000 1.209 56 D HN -0.129 8.241 8.370 0.000 0.000 0.451 57 A N 2.105 124.964 122.820 0.066 0.000 2.014 57 A HA -0.079 4.240 4.320 -0.002 0.000 0.218 57 A C 2.026 179.469 177.584 -0.235 0.000 1.163 57 A CA 1.275 53.306 52.037 -0.010 0.000 0.652 57 A CB -0.641 18.395 19.000 0.060 0.000 0.808 57 A HN 0.691 8.841 8.150 0.000 0.000 0.449 58 T N -0.733 113.625 114.554 -0.327 0.000 2.622 58 T HA -0.153 4.196 4.350 -0.002 0.000 0.266 58 T C 1.621 175.963 174.700 -0.597 0.000 1.047 58 T CA 1.803 63.446 62.100 -0.762 0.000 1.159 58 T CB -0.389 68.242 68.868 -0.395 0.000 0.863 58 T HN 0.465 8.705 8.240 0.000 0.000 0.422 59 F N 1.779 121.501 119.950 -0.380 0.000 2.206 59 F HA 0.186 4.712 4.527 -0.001 0.000 0.298 59 F C 2.412 178.000 175.800 -0.354 0.000 1.090 59 F CA 0.500 58.271 58.000 -0.381 0.000 1.323 59 F CB -0.684 38.121 39.000 -0.325 0.000 1.028 59 F HN 0.132 8.432 8.300 0.000 0.000 0.492 60 A N -0.527 122.127 122.820 -0.277 0.000 1.917 60 A HA -0.226 4.093 4.320 -0.002 0.000 0.219 60 A C 2.219 179.620 177.584 -0.306 0.000 1.182 60 A CA 2.487 54.387 52.037 -0.228 0.000 0.633 60 A CB -1.410 17.564 19.000 -0.044 0.000 0.819 60 A HN 0.412 8.562 8.150 0.000 0.000 0.448 61 T N 0.017 114.371 114.554 -0.334 0.000 2.737 61 T HA -0.096 4.253 4.350 -0.002 0.000 0.265 61 T C 1.907 176.349 174.700 -0.428 0.000 1.038 61 T CA 1.683 63.645 62.100 -0.230 0.000 1.144 61 T CB -0.312 68.481 68.868 -0.126 0.000 0.866 61 T HN 0.460 8.700 8.240 0.000 0.000 0.434 62 M N 1.855 120.961 119.600 -0.822 0.000 2.358 62 M HA -0.068 4.411 4.480 -0.002 0.000 0.264 62 M C 2.410 178.163 176.300 -0.913 0.000 1.064 62 M CA 1.182 55.725 55.300 -1.260 0.000 1.093 62 M CB -0.557 31.378 32.600 -1.109 0.000 1.401 62 M HN 0.315 8.605 8.290 0.000 0.000 0.440 63 S N -0.074 115.066 115.700 -0.934 0.000 2.561 63 S HA 0.028 4.497 4.470 -0.002 0.000 0.225 63 S C 1.857 176.356 174.600 -0.169 0.000 0.977 63 S CA 0.545 58.410 58.200 -0.557 0.000 0.926 63 S CB -0.821 61.983 63.200 -0.660 0.000 0.769 63 S HN 0.523 8.833 8.310 0.000 0.000 0.533 64 G N 3.117 111.779 108.800 -0.229 0.000 2.491 64 G HA2 -0.162 3.797 3.960 -0.002 0.000 0.218 64 G HA3 -0.162 3.797 3.960 -0.002 0.000 0.218 64 G C -0.674 173.907 174.900 -0.533 0.000 1.180 64 G CA 1.027 46.061 45.100 -0.109 0.000 0.774 64 G HN 0.547 8.837 8.290 0.000 0.000 0.562 65 P HA 0.016 4.436 4.420 0.000 0.000 0.222 65 P C 1.737 178.657 177.300 -0.634 0.000 1.147 65 P CA 1.558 63.725 63.100 -1.556 0.000 0.790 65 P CB -0.296 30.042 31.700 -2.270 0.000 0.780 66 G N -1.810 106.827 108.800 -0.272 0.000 3.088 66 G HA2 0.305 4.264 3.960 -0.002 0.000 0.212 66 G HA3 0.305 4.264 3.960 -0.002 0.000 0.212 66 G C 0.995 176.010 174.900 0.191 0.000 1.173 66 G CA 0.384 45.597 45.100 0.190 0.000 0.779 66 G HN 0.389 8.679 8.290 0.000 0.000 0.540 67 G N -1.495 107.376 108.800 0.118 0.000 2.192 67 G HA2 0.263 4.222 3.960 -0.002 0.000 0.193 67 G HA3 0.263 4.222 3.960 -0.002 0.000 0.193 67 G C 0.937 175.966 174.900 0.215 0.000 0.999 67 G CA 0.561 45.775 45.100 0.190 0.000 0.659 67 G HN 1.762 10.052 8.290 0.000 0.000 0.503 68 G N 0.068 108.972 108.800 0.174 0.000 2.295 68 G HA2 0.023 3.982 3.960 -0.002 0.000 0.287 68 G HA3 0.023 3.982 3.960 -0.002 0.000 0.287 68 G C 0.519 175.520 174.900 0.168 0.000 1.055 68 G CA 1.074 46.259 45.100 0.141 0.000 0.922 68 G HN 1.916 10.206 8.290 0.000 0.000 0.503 69 Q N -1.118 118.821 119.800 0.233 0.000 2.478 69 Q HA -0.170 4.169 4.340 -0.002 0.000 0.286 69 Q C 0.410 176.576 176.000 0.277 0.000 1.299 69 Q CA 0.786 56.765 55.803 0.294 0.000 0.826 69 Q CB -1.141 27.725 28.738 0.214 0.000 1.199 69 Q HN 0.861 9.131 8.270 0.000 0.000 0.451 70 D N -2.652 117.916 120.400 0.280 0.000 2.716 70 D HA -0.136 4.503 4.640 -0.002 0.000 0.239 70 D C 0.518 176.919 176.300 0.169 0.000 1.125 70 D CA 1.476 55.615 54.000 0.233 0.000 0.681 70 D CB -1.439 39.532 40.800 0.285 0.000 1.070 70 D HN 0.635 9.005 8.370 0.000 0.000 0.432 71 G N -0.337 108.571 108.800 0.180 0.000 2.432 71 G HA2 0.327 4.286 3.960 -0.002 0.000 0.239 71 G HA3 0.327 4.286 3.960 -0.002 0.000 0.239 71 G C 1.304 176.247 174.900 0.071 0.000 1.291 71 G CA -0.414 44.777 45.100 0.151 0.000 0.863 71 G HN 0.302 8.592 8.290 0.000 0.000 0.560 72 L N 0.712 121.846 121.223 -0.148 0.000 2.425 72 L HA 0.309 4.648 4.340 -0.002 0.000 0.215 72 L C 0.020 176.653 176.870 -0.395 0.000 1.065 72 L CA 0.146 54.708 54.840 -0.464 0.000 0.842 72 L CB 0.030 41.447 42.059 -1.070 0.000 1.033 72 L HN 0.330 8.560 8.230 0.000 0.000 0.474 73 F N -0.927 119.178 119.950 0.258 0.000 2.480 73 F HA 0.459 4.985 4.527 -0.002 0.000 0.329 73 F C 0.130 176.257 175.800 0.545 0.000 1.091 73 F CA -1.154 57.031 58.000 0.308 0.000 0.972 73 F CB 0.907 40.143 39.000 0.393 0.000 1.150 73 F HN -0.307 7.993 8.300 0.000 0.000 0.467 74 F N 0.711 120.945 119.950 0.474 0.000 2.378 74 F HA 0.603 5.129 4.527 -0.001 0.000 0.325 74 F C 0.684 176.711 175.800 0.378 0.000 1.097 74 F CA -1.156 57.067 58.000 0.372 0.000 1.079 74 F CB 1.519 40.694 39.000 0.291 0.000 1.240 74 F HN 0.481 8.781 8.300 0.000 0.000 0.519 75 T N -1.721 113.089 114.554 0.427 0.000 2.883 75 T HA 0.548 4.897 4.350 -0.002 0.000 0.296 75 T C -0.833 173.955 174.700 0.146 0.000 1.117 75 T CA -0.971 61.288 62.100 0.264 0.000 1.006 75 T CB 2.184 71.175 68.868 0.205 0.000 1.191 75 T HN 0.416 8.656 8.240 0.000 0.000 0.508 76 D N 0.123 120.569 120.400 0.077 0.000 2.447 76 D HA 0.261 4.900 4.640 -0.002 0.000 0.265 76 D C 1.595 177.832 176.300 -0.105 0.000 1.250 76 D CA -0.078 53.922 54.000 0.002 0.000 1.046 76 D CB 0.126 40.926 40.800 0.001 0.000 1.095 76 D HN 0.600 8.970 8.370 0.000 0.000 0.555 77 S N -2.240 113.375 115.700 -0.142 0.000 2.515 77 S HA 0.063 4.532 4.470 -0.002 0.000 0.231 77 S C 1.741 176.029 174.600 -0.520 0.000 0.987 77 S CA 0.291 58.343 58.200 -0.247 0.000 0.936 77 S CB -0.746 62.376 63.200 -0.131 0.000 0.766 77 S HN 0.690 9.000 8.310 0.000 0.000 0.528 78 G N -0.475 108.085 108.800 -0.400 0.000 3.284 78 G HA2 0.417 4.376 3.960 -0.002 0.000 0.236 78 G HA3 0.417 4.376 3.960 -0.002 0.000 0.236 78 G C 0.185 174.902 174.900 -0.304 0.000 1.158 78 G CA -0.463 44.400 45.100 -0.394 0.000 0.774 78 G HN 0.421 8.711 8.290 0.000 0.000 0.545 79 F N -1.253 118.678 119.950 -0.032 0.000 2.794 79 F HA -0.161 4.366 4.527 -0.001 0.000 0.335 79 F C 1.012 176.710 175.800 -0.171 0.000 0.653 79 F CA 0.473 58.427 58.000 -0.078 0.000 1.266 79 F CB -1.645 37.308 39.000 -0.078 0.000 1.666 79 F HN 0.229 8.529 8.300 0.000 0.000 0.314 80 K N 1.475 121.861 120.400 -0.023 0.000 2.322 80 K HA 0.330 4.649 4.320 -0.002 0.000 0.283 80 K C 0.173 176.765 176.600 -0.013 0.000 1.042 80 K CA -0.420 55.832 56.287 -0.060 0.000 0.958 80 K CB 0.338 32.845 32.500 0.013 0.000 0.984 80 K HN -0.088 8.162 8.250 0.000 0.000 0.473 81 F N 5.003 125.030 119.950 0.128 0.000 2.607 81 F HA 0.053 4.579 4.527 -0.002 0.000 0.374 81 F C 0.888 176.758 175.800 0.117 0.000 1.104 81 F CA -0.042 58.034 58.000 0.127 0.000 1.296 81 F CB 0.059 39.080 39.000 0.035 0.000 1.085 81 F HN 0.360 8.660 8.300 0.000 0.000 0.584 82 I N -0.756 120.034 120.570 0.366 0.000 3.108 82 I HA 0.578 4.747 4.170 -0.002 0.000 0.312 82 I C -0.765 175.497 176.117 0.242 0.000 1.095 82 I CA -1.415 60.041 61.300 0.259 0.000 1.000 82 I CB 2.025 40.167 38.000 0.237 0.000 1.229 82 I HN 0.315 8.525 8.210 0.000 0.000 0.454 83 K N 1.007 121.504 120.400 0.161 0.000 2.126 83 K HA 0.520 4.839 4.320 -0.002 0.000 0.257 83 K C 0.580 177.240 176.600 0.099 0.000 1.007 83 K CA 0.376 56.719 56.287 0.094 0.000 0.928 83 K CB 1.035 33.565 32.500 0.050 0.000 1.013 83 K HN 1.080 9.330 8.250 0.000 0.000 0.473 84 G N 0.633 109.412 108.800 -0.036 0.000 2.211 84 G HA2 -0.176 3.783 3.960 -0.002 0.000 0.201 84 G HA3 -0.176 3.783 3.960 -0.002 0.000 0.201 84 G C 0.496 175.101 174.900 -0.492 0.000 0.997 84 G CA -0.248 44.789 45.100 -0.106 0.000 0.652 84 G HN 0.841 9.131 8.290 0.000 0.000 0.500 85 G N -0.049 108.287 108.800 -0.774 0.000 2.485 85 G HA2 0.606 4.565 3.960 -0.002 0.000 0.260 85 G HA3 0.606 4.565 3.960 -0.002 0.000 0.260 85 G C 1.572 175.872 174.900 -0.999 0.000 1.459 85 G CA 1.114 45.378 45.100 -1.394 0.000 1.060 85 G HN 1.232 9.522 8.290 0.000 0.000 0.546 86 A N -1.267 121.176 122.820 -0.628 0.000 2.024 86 A HA 0.449 4.768 4.320 -0.002 0.000 0.220 86 A C 1.349 178.567 177.584 -0.609 0.000 1.164 86 A CA 2.254 53.870 52.037 -0.702 0.000 0.643 86 A CB -0.537 18.358 19.000 -0.175 0.000 0.806 86 A HN 1.780 9.930 8.150 0.000 0.000 0.451 87 A N -1.197 121.365 122.820 -0.431 0.000 2.594 87 A HA 0.625 4.944 4.320 -0.002 0.000 0.291 87 A C -1.901 175.687 177.584 0.007 0.000 1.105 87 A CA -0.719 51.162 52.037 -0.261 0.000 0.694 87 A CB 0.926 19.748 19.000 -0.296 0.000 1.291 87 A HN 0.082 8.232 8.150 0.000 0.000 0.410 88 D N -0.209 120.214 120.400 0.038 0.000 2.340 88 D HA 0.551 5.190 4.640 -0.002 0.000 0.240 88 D C -1.132 175.164 176.300 -0.007 0.000 1.001 88 D CA -0.164 53.869 54.000 0.054 0.000 0.888 88 D CB 2.168 42.941 40.800 -0.045 0.000 1.310 88 D HN 0.443 8.813 8.370 0.000 0.000 0.474 89 V N 0.152 119.906 119.914 -0.267 0.000 2.656 89 V HA 0.778 4.897 4.120 -0.002 0.000 0.307 89 V C -1.367 174.545 176.094 -0.304 0.000 1.051 89 V CA -0.521 61.508 62.300 -0.453 0.000 0.893 89 V CB 1.515 32.722 31.823 -1.027 0.000 0.999 89 V HN 0.688 8.878 8.190 0.000 0.000 0.426 90 A N 7.293 129.968 122.820 -0.240 0.000 2.330 90 A HA 0.819 5.138 4.320 -0.002 0.000 0.313 90 A C -0.959 176.539 177.584 -0.143 0.000 1.124 90 A CA -0.652 51.297 52.037 -0.148 0.000 0.774 90 A CB 0.982 19.919 19.000 -0.105 0.000 1.198 90 A HN 0.884 9.034 8.150 0.000 0.000 0.465 91 L N 2.035 123.208 121.223 -0.083 0.000 2.312 91 L HA 0.404 4.743 4.340 -0.002 0.000 0.281 91 L C -0.412 176.449 176.870 -0.016 0.000 1.070 91 L CA -0.593 54.227 54.840 -0.033 0.000 0.805 91 L CB 1.289 43.360 42.059 0.020 0.000 1.174 91 L HN 0.671 8.901 8.230 0.000 0.000 0.434 92 D N 2.847 123.244 120.400 -0.004 0.000 2.446 92 D HA 0.104 4.743 4.640 -0.002 0.000 0.251 92 D C 0.787 177.098 176.300 0.019 0.000 1.137 92 D CA -0.542 53.456 54.000 -0.003 0.000 0.890 92 D CB 1.242 42.028 40.800 -0.022 0.000 1.071 92 D HN 0.577 8.947 8.370 0.000 0.000 0.528 93 K N 2.485 122.895 120.400 0.016 0.000 2.283 93 K HA -0.072 4.247 4.320 -0.002 0.000 0.202 93 K C 0.666 177.272 176.600 0.010 0.000 1.048 93 K CA 0.734 57.032 56.287 0.017 0.000 0.948 93 K CB 0.359 32.862 32.500 0.005 0.000 0.742 93 K HN 0.133 8.383 8.250 0.000 0.000 0.458 94 E N 1.475 121.677 120.200 0.003 0.000 2.051 94 E HA -0.028 4.321 4.350 -0.002 0.000 0.189 94 E C 2.059 178.658 176.600 -0.001 0.000 0.979 94 E CA 1.066 57.465 56.400 -0.002 0.000 0.803 94 E CB -0.276 29.420 29.700 -0.007 0.000 0.761 94 E HN 0.264 8.624 8.360 0.000 0.000 0.451 95 S N 0.450 116.148 115.700 -0.004 0.000 2.453 95 S HA -0.023 4.446 4.470 -0.002 0.000 0.231 95 S C 0.247 174.850 174.600 0.005 0.000 1.005 95 S CA 0.283 58.477 58.200 -0.011 0.000 0.949 95 S CB -0.037 63.146 63.200 -0.028 0.000 0.774 95 S HN 0.230 8.540 8.310 0.000 0.000 0.510 96 K N 1.683 122.106 120.400 0.038 0.000 3.239 96 K HA -0.129 4.190 4.320 -0.002 0.000 0.270 96 K C -0.389 176.300 176.600 0.148 0.000 1.083 96 K CA 0.746 57.103 56.287 0.117 0.000 0.782 96 K CB -2.490 30.073 32.500 0.105 0.000 1.290 96 K HN 0.599 8.849 8.250 0.000 0.000 0.474 97 T N -2.806 111.792 114.554 0.074 0.000 2.916 97 T HA 0.788 5.137 4.350 -0.002 0.000 0.292 97 T C -0.461 174.227 174.700 -0.019 0.000 1.055 97 T CA -0.494 61.547 62.100 -0.098 0.000 1.009 97 T CB 2.450 71.225 68.868 -0.155 0.000 1.118 97 T HN 0.359 8.599 8.240 0.000 0.000 0.497 98 A N 1.432 124.136 122.820 -0.193 0.000 2.318 98 A HA 0.729 5.048 4.320 -0.002 0.000 0.324 98 A C -0.031 177.386 177.584 -0.279 0.000 1.170 98 A CA -0.793 51.096 52.037 -0.246 0.000 0.810 98 A CB 0.984 19.710 19.000 -0.456 0.000 1.198 98 A HN 0.866 9.016 8.150 0.000 0.000 0.484 99 T N 2.899 117.308 114.554 -0.241 0.000 2.791 99 T HA 0.513 4.863 4.350 -0.002 0.000 0.288 99 T C -0.563 174.016 174.700 -0.201 0.000 0.999 99 T CA 0.041 62.028 62.100 -0.188 0.000 0.952 99 T CB 0.365 69.151 68.868 -0.136 0.000 0.938 99 T HN 0.386 8.626 8.240 0.000 0.000 0.444 100 I N 3.111 123.572 120.570 -0.182 0.000 2.336 100 I HA 0.335 4.504 4.170 -0.002 0.000 0.292 100 I C 0.478 176.517 176.117 -0.130 0.000 0.991 100 I CA -0.144 61.052 61.300 -0.173 0.000 1.227 100 I CB 1.662 39.469 38.000 -0.321 0.000 1.366 100 I HN 0.513 8.723 8.210 0.000 0.000 0.466 101 T N 7.217 121.708 114.554 -0.104 0.000 2.809 101 T HA 0.531 4.880 4.350 -0.002 0.000 0.296 101 T C 0.013 174.630 174.700 -0.139 0.000 1.015 101 T CA -0.546 61.491 62.100 -0.106 0.000 0.954 101 T CB 0.301 69.111 68.868 -0.095 0.000 0.950 101 T HN 0.235 8.475 8.240 0.000 0.000 0.450 102 L N 3.052 124.183 121.223 -0.154 0.000 2.426 102 L HA 0.392 4.731 4.340 -0.002 0.000 0.271 102 L C 1.228 177.962 176.870 -0.226 0.000 1.169 102 L CA -0.746 53.970 54.840 -0.207 0.000 0.836 102 L CB 0.432 42.389 42.059 -0.170 0.000 1.112 102 L HN 0.401 8.631 8.230 0.000 0.000 0.465 103 R N 1.753 122.054 120.500 -0.330 0.000 2.640 103 R HA -0.075 4.264 4.340 -0.002 0.000 0.270 103 R C 1.255 177.421 176.300 -0.223 0.000 1.024 103 R CA 0.098 55.995 56.100 -0.337 0.000 1.085 103 R CB 0.451 30.409 30.300 -0.570 0.000 0.963 103 R HN 0.533 8.803 8.270 0.000 0.000 0.426 104 K N 1.757 122.061 120.400 -0.161 0.000 2.113 104 K HA -0.203 4.116 4.320 -0.002 0.000 0.208 104 K C 0.686 177.237 176.600 -0.082 0.000 1.047 104 K CA 2.181 58.408 56.287 -0.101 0.000 0.928 104 K CB 0.090 32.547 32.500 -0.072 0.000 0.716 104 K HN 0.639 8.889 8.250 0.000 0.000 0.446 105 D N 0.325 120.674 120.400 -0.085 0.000 2.342 105 D HA -0.035 4.604 4.640 -0.002 0.000 0.221 105 D C 0.129 176.424 176.300 -0.009 0.000 1.101 105 D CA -0.325 53.662 54.000 -0.023 0.000 0.837 105 D CB -0.253 40.563 40.800 0.026 0.000 0.938 105 D HN 0.050 8.420 8.370 0.000 0.000 0.508 106 L N 1.051 122.208 121.223 -0.110 0.000 2.433 106 L HA 0.264 4.604 4.340 -0.002 0.000 0.275 106 L C -0.271 176.529 176.870 -0.116 0.000 1.128 106 L CA 0.365 55.138 54.840 -0.111 0.000 0.875 106 L CB 0.069 41.969 42.059 -0.265 0.000 1.171 106 L HN -0.130 8.100 8.230 0.000 0.000 0.463 107 K N 3.797 124.156 120.400 -0.068 0.000 2.395 107 K HA 0.384 4.703 4.320 -0.002 0.000 0.247 107 K C -1.171 175.313 176.600 -0.193 0.000 0.973 107 K CA -0.700 55.517 56.287 -0.116 0.000 0.828 107 K CB 1.360 33.849 32.500 -0.018 0.000 1.272 107 K HN 0.447 8.697 8.250 0.000 0.000 0.439 108 W N 0.471 121.760 121.300 -0.017 0.000 2.086 108 W HA -0.000 4.659 4.660 -0.001 0.000 0.355 108 W C 1.579 178.061 176.519 -0.061 0.000 1.313 108 W CA -0.141 57.182 57.345 -0.035 0.000 1.358 108 W CB 0.544 29.943 29.460 -0.101 0.000 1.166 108 W HN 0.681 8.861 8.180 0.000 0.000 0.630 109 S N -0.451 115.406 115.700 0.262 0.000 2.603 109 S HA -0.184 4.285 4.470 -0.002 0.000 0.229 109 S C 0.860 175.552 174.600 0.154 0.000 0.972 109 S CA 1.070 59.402 58.200 0.220 0.000 0.935 109 S CB -0.431 62.857 63.200 0.147 0.000 0.769 109 S HN 0.613 8.923 8.310 0.000 0.000 0.536 110 D N 0.134 120.525 120.400 -0.015 0.000 2.340 110 D HA 0.238 4.877 4.640 -0.002 0.000 0.217 110 D C 1.364 177.443 176.300 -0.369 0.000 1.081 110 D CA 0.479 54.422 54.000 -0.094 0.000 0.842 110 D CB -0.435 40.288 40.800 -0.128 0.000 0.934 110 D HN 0.476 8.846 8.370 0.000 0.000 0.511 111 G N 0.544 108.808 108.800 -0.893 0.000 2.199 111 G HA2 -0.300 3.659 3.960 -0.002 0.000 0.254 111 G HA3 -0.300 3.659 3.960 -0.002 0.000 0.254 111 G C 0.439 175.077 174.900 -0.437 0.000 0.982 111 G CA 0.452 44.754 45.100 -1.330 0.000 0.632 111 G HN 0.822 9.112 8.290 0.000 0.000 0.529 112 S N 0.351 115.948 115.700 -0.171 0.000 2.603 112 S HA 0.586 5.055 4.470 -0.002 0.000 0.268 112 S C 0.141 174.801 174.600 0.099 0.000 1.317 112 S CA -0.473 57.732 58.200 0.007 0.000 1.012 112 S CB 1.712 64.955 63.200 0.072 0.000 0.926 112 S HN 0.287 8.597 8.310 0.000 0.000 0.539 113 E N 1.085 121.340 120.200 0.092 0.000 2.360 113 E HA 0.221 4.570 4.350 -0.002 0.000 0.269 113 E C -0.437 176.238 176.600 0.125 0.000 1.022 113 E CA -0.326 56.107 56.400 0.056 0.000 0.887 113 E CB 1.170 30.887 29.700 0.029 0.000 0.990 113 E HN 0.507 8.867 8.360 0.000 0.000 0.426 114 V N 3.766 123.618 119.914 -0.104 0.000 2.470 114 V HA 0.132 4.251 4.120 -0.002 0.000 0.276 114 V C 0.847 176.943 176.094 0.003 0.000 1.040 114 V CA -0.037 62.189 62.300 -0.123 0.000 1.008 114 V CB 0.571 32.117 31.823 -0.462 0.000 0.990 114 V HN 0.777 8.967 8.190 0.000 0.000 0.477 115 T N 1.924 116.546 114.554 0.114 0.000 2.910 115 T HA 0.694 5.043 4.350 -0.002 0.000 0.287 115 T C 1.189 175.928 174.700 0.065 0.000 1.050 115 T CA -0.083 62.050 62.100 0.054 0.000 1.011 115 T CB 1.964 70.854 68.868 0.037 0.000 1.195 115 T HN 0.599 8.839 8.240 0.000 0.000 0.540 116 A N 0.859 123.675 122.820 -0.007 0.000 1.917 116 A HA -0.097 4.222 4.320 -0.002 0.000 0.219 116 A C 2.198 179.777 177.584 -0.010 0.000 1.182 116 A CA 2.405 54.462 52.037 0.033 0.000 0.633 116 A CB -1.120 17.853 19.000 -0.045 0.000 0.819 116 A HN 0.872 9.022 8.150 0.000 0.000 0.448 117 K N 0.382 120.620 120.400 -0.270 0.000 2.147 117 K HA -0.158 4.161 4.320 -0.002 0.000 0.205 117 K C 1.251 177.903 176.600 0.087 0.000 1.049 117 K CA 1.905 58.049 56.287 -0.239 0.000 0.936 117 K CB -0.435 31.854 32.500 -0.351 0.000 0.722 117 K HN 0.456 8.706 8.250 0.000 0.000 0.446 118 D N -0.779 119.757 120.400 0.227 0.000 2.144 118 D HA -0.184 4.455 4.640 -0.002 0.000 0.199 118 D C 1.667 178.234 176.300 0.445 0.000 0.984 118 D CA 1.054 55.309 54.000 0.424 0.000 0.834 118 D CB -0.296 40.842 40.800 0.563 0.000 0.955 118 D HN 0.290 8.660 8.370 0.000 0.000 0.465 119 Y N 1.771 122.235 120.300 0.273 0.000 2.163 119 Y HA -0.138 4.411 4.550 -0.001 0.000 0.288 119 Y C 2.213 178.358 175.900 0.408 0.000 1.136 119 Y CA 1.419 59.697 58.100 0.296 0.000 1.147 119 Y CB -0.103 38.508 38.460 0.251 0.000 0.987 119 Y HN -0.163 8.117 8.280 0.000 0.000 0.509 120 E N -0.016 120.363 120.200 0.299 0.000 2.118 120 E HA -0.289 4.061 4.350 -0.002 0.000 0.195 120 E C 2.237 178.988 176.600 0.252 0.000 0.992 120 E CA 1.449 57.993 56.400 0.239 0.000 0.804 120 E CB -0.752 29.174 29.700 0.377 0.000 0.741 120 E HN 0.609 8.969 8.360 0.000 0.000 0.458 121 F N 1.226 121.227 119.950 0.085 0.000 2.216 121 F HA -0.191 4.335 4.527 -0.002 0.000 0.300 121 F C 2.303 178.127 175.800 0.039 0.000 1.085 121 F CA 1.628 59.663 58.000 0.059 0.000 1.326 121 F CB -0.078 38.985 39.000 0.105 0.000 1.027 121 F HN 0.002 8.302 8.300 0.000 0.000 0.497 122 T N -0.107 114.421 114.554 -0.044 0.000 2.685 122 T HA -0.295 4.054 4.350 -0.002 0.000 0.268 122 T C 1.440 175.980 174.700 -0.268 0.000 1.034 122 T CA 2.138 64.109 62.100 -0.214 0.000 1.149 122 T CB -0.696 68.043 68.868 -0.215 0.000 0.860 122 T HN 0.354 8.594 8.240 0.000 0.000 0.449 123 Y N 1.527 121.718 120.300 -0.182 0.000 2.224 123 Y HA -0.075 4.474 4.550 -0.002 0.000 0.289 123 Y C 2.559 178.433 175.900 -0.043 0.000 1.146 123 Y CA 0.975 59.015 58.100 -0.100 0.000 1.182 123 Y CB -0.321 38.073 38.460 -0.110 0.000 0.983 123 Y HN 0.360 8.640 8.280 0.000 0.000 0.524 124 E N -0.653 119.576 120.200 0.049 0.000 2.106 124 E HA -0.181 4.168 4.350 -0.002 0.000 0.192 124 E C 2.244 178.819 176.600 -0.042 0.000 0.984 124 E CA 1.739 58.221 56.400 0.136 0.000 0.806 124 E CB -0.336 29.483 29.700 0.198 0.000 0.750 124 E HN 0.581 8.941 8.360 0.000 0.000 0.458 125 T N -0.459 113.795 114.554 -0.501 0.000 2.833 125 T HA -0.116 4.233 4.350 -0.002 0.000 0.269 125 T C 1.914 176.537 174.700 -0.127 0.000 1.054 125 T CA 0.877 62.587 62.100 -0.649 0.000 1.135 125 T CB -0.233 68.219 68.868 -0.694 0.000 0.869 125 T HN 0.079 8.319 8.240 0.000 0.000 0.466 126 I N 0.938 121.500 120.570 -0.014 0.000 2.494 126 I HA 0.195 4.364 4.170 -0.002 0.000 0.250 126 I C 3.093 179.381 176.117 0.285 0.000 1.112 126 I CA 0.821 62.190 61.300 0.115 0.000 1.438 126 I CB -0.364 37.671 38.000 0.059 0.000 1.111 126 I HN 0.323 8.533 8.210 0.000 0.000 0.431 127 A N 0.195 123.234 122.820 0.366 0.000 1.975 127 A HA -0.048 4.271 4.320 -0.002 0.000 0.215 127 A C 1.247 179.070 177.584 0.398 0.000 1.170 127 A CA 0.554 52.866 52.037 0.458 0.000 0.656 127 A CB -0.382 18.976 19.000 0.597 0.000 0.821 127 A HN 0.370 8.520 8.150 0.000 0.000 0.449 128 N N 0.554 119.501 118.700 0.412 0.000 2.411 128 N HA 0.207 4.946 4.740 -0.002 0.000 0.259 128 N C -2.288 173.313 175.510 0.152 0.000 1.103 128 N CA -1.989 51.182 53.050 0.202 0.000 0.954 128 N CB 1.249 39.947 38.487 0.352 0.000 1.085 128 N HN -0.062 8.318 8.380 0.000 0.000 0.485 129 P HA 0.000 4.420 4.420 0.000 0.000 0.226 129 P C 0.691 177.974 177.300 -0.028 0.000 1.153 129 P CA 0.640 63.736 63.100 -0.006 0.000 0.777 129 P CB 0.211 31.842 31.700 -0.116 0.000 0.794 130 A N -1.328 121.418 122.820 -0.123 0.000 2.019 130 A HA -0.193 4.126 4.320 -0.002 0.000 0.219 130 A C 1.603 179.062 177.584 -0.208 0.000 1.164 130 A CA 1.231 53.143 52.037 -0.208 0.000 0.644 130 A CB -1.671 17.141 19.000 -0.314 0.000 0.805 130 A HN 0.218 8.368 8.150 0.000 0.000 0.449 131 Y N -1.000 119.317 120.300 0.028 0.000 2.561 131 Y HA 0.264 4.813 4.550 -0.001 0.000 0.291 131 Y C 1.961 177.875 175.900 0.023 0.000 1.141 131 Y CA 0.578 58.695 58.100 0.029 0.000 1.303 131 Y CB -0.059 38.416 38.460 0.025 0.000 1.015 131 Y HN 0.446 8.726 8.280 0.000 0.000 0.547 132 G N 0.306 109.188 108.800 0.137 0.000 2.136 132 G HA2 -0.309 3.650 3.960 -0.002 0.000 0.242 132 G HA3 -0.309 3.650 3.960 -0.002 0.000 0.242 132 G C 0.298 175.257 174.900 0.098 0.000 0.989 132 G CA 0.285 45.439 45.100 0.091 0.000 0.682 132 G HN 0.362 8.652 8.290 0.000 0.000 0.522 133 S N -0.235 115.541 115.700 0.127 0.000 2.568 133 S HA 0.390 4.859 4.470 -0.002 0.000 0.282 133 S C 0.941 175.592 174.600 0.085 0.000 1.338 133 S CA 0.454 58.714 58.200 0.099 0.000 1.045 133 S CB 0.479 63.739 63.200 0.100 0.000 0.873 133 S HN 0.239 8.549 8.310 0.000 0.000 0.516 134 D N 3.268 123.707 120.400 0.065 0.000 2.368 134 D HA 0.141 4.780 4.640 -0.002 0.000 0.218 134 D C 0.721 176.933 176.300 -0.147 0.000 1.112 134 D CA 0.075 54.101 54.000 0.045 0.000 0.834 134 D CB 0.235 41.146 40.800 0.185 0.000 0.953 134 D HN 0.520 8.890 8.370 0.000 0.000 0.505 135 R N -0.067 120.338 120.500 -0.158 0.000 2.466 135 R HA 0.085 4.424 4.340 -0.002 0.000 0.279 135 R C 0.612 176.774 176.300 -0.229 0.000 0.976 135 R CA -0.447 55.439 56.100 -0.357 0.000 1.081 135 R CB 0.600 30.750 30.300 -0.250 0.000 1.215 135 R HN 0.192 8.462 8.270 0.000 0.000 0.546 136 W N 1.801 122.955 121.300 -0.244 0.000 2.170 136 W HA 0.079 4.738 4.660 -0.001 0.000 0.342 136 W C -0.278 176.097 176.519 -0.240 0.000 1.294 136 W CA 1.325 58.531 57.345 -0.232 0.000 1.246 136 W CB 1.049 30.382 29.460 -0.211 0.000 1.156 136 W HN -0.114 8.066 8.180 0.000 0.000 0.572 137 T N 3.152 117.017 114.554 -1.149 0.000 2.886 137 T HA 0.050 4.399 4.350 -0.002 0.000 0.330 137 T C 0.281 174.443 174.700 -0.897 0.000 1.488 137 T CA -0.503 61.135 62.100 -0.770 0.000 1.054 137 T CB 1.092 69.608 68.868 -0.587 0.000 1.348 137 T HN 0.379 8.619 8.240 0.000 0.000 0.489 138 D N 1.257 121.374 120.400 -0.472 0.000 2.190 138 D HA -0.064 4.575 4.640 -0.002 0.000 0.200 138 D C 2.051 178.160 176.300 -0.318 0.000 0.992 138 D CA 1.837 55.658 54.000 -0.298 0.000 0.854 138 D CB -0.003 40.718 40.800 -0.133 0.000 0.936 138 D HN 0.468 8.838 8.370 0.000 0.000 0.462 139 S N -0.193 115.243 115.700 -0.440 0.000 2.383 139 S HA -0.117 4.352 4.470 -0.002 0.000 0.229 139 S C 1.981 176.418 174.600 -0.273 0.000 1.030 139 S CA 0.597 58.491 58.200 -0.510 0.000 1.002 139 S CB -0.193 62.460 63.200 -0.911 0.000 0.829 139 S HN 0.318 8.628 8.310 0.000 0.000 0.467 140 L N 0.884 121.846 121.223 -0.436 0.000 2.376 140 L HA 0.029 4.368 4.340 -0.002 0.000 0.219 140 L C 2.534 179.347 176.870 -0.094 0.000 1.133 140 L CA 0.613 55.280 54.840 -0.289 0.000 0.816 140 L CB -0.567 41.141 42.059 -0.584 0.000 0.933 140 L HN 0.311 8.541 8.230 0.000 0.000 0.449 141 A N 0.263 123.012 122.820 -0.119 0.000 2.121 141 A HA -0.220 4.099 4.320 -0.002 0.000 0.218 141 A C 1.918 179.591 177.584 0.149 0.000 1.154 141 A CA 1.697 53.804 52.037 0.117 0.000 0.679 141 A CB -0.657 18.416 19.000 0.122 0.000 0.795 141 A HN 0.484 8.634 8.150 0.000 0.000 0.458 142 N N -0.502 118.296 118.700 0.162 0.000 2.467 142 N HA 0.066 4.805 4.740 -0.002 0.000 0.184 142 N C 0.020 175.709 175.510 0.297 0.000 1.106 142 N CA 0.136 53.314 53.050 0.213 0.000 0.892 142 N CB -0.299 38.324 38.487 0.227 0.000 0.969 142 N HN 0.468 8.848 8.380 0.000 0.000 0.454 143 I N 1.224 121.957 120.570 0.272 0.000 2.325 143 I HA 0.100 4.269 4.170 -0.002 0.000 0.291 143 I C -0.006 176.172 176.117 0.101 0.000 1.019 143 I CA -0.856 60.557 61.300 0.190 0.000 1.302 143 I CB 1.430 39.509 38.000 0.132 0.000 1.401 143 I HN -0.198 8.012 8.210 0.000 0.000 0.485 144 V N 6.949 126.887 119.914 0.040 0.000 2.584 144 V HA 0.010 4.129 4.120 -0.002 0.000 0.303 144 V C 1.376 177.481 176.094 0.018 0.000 1.035 144 V CA 1.661 63.975 62.300 0.024 0.000 1.172 144 V CB 0.148 31.959 31.823 -0.019 0.000 0.896 144 V HN 1.185 9.375 8.190 0.000 0.000 0.486 145 G N 3.769 112.604 108.800 0.058 0.000 2.234 145 G HA2 -0.287 3.673 3.960 -0.002 0.000 0.260 145 G HA3 -0.287 3.673 3.960 -0.002 0.000 0.260 145 G C 0.578 175.562 174.900 0.140 0.000 0.987 145 G CA 0.493 45.636 45.100 0.073 0.000 0.625 145 G HN 0.737 9.027 8.290 0.000 0.000 0.532 146 L N 1.494 122.819 121.223 0.171 0.000 2.131 146 L HA 0.311 4.650 4.340 -0.002 0.000 0.206 146 L C 2.699 179.814 176.870 0.407 0.000 1.087 146 L CA 2.868 57.879 54.840 0.285 0.000 0.767 146 L CB -0.610 41.620 42.059 0.285 0.000 0.917 146 L HN 0.236 8.466 8.230 0.000 0.000 0.441 147 S N -0.195 115.725 115.700 0.367 0.000 2.359 147 S HA -0.181 4.288 4.470 -0.002 0.000 0.224 147 S C 1.557 176.277 174.600 0.201 0.000 1.035 147 S CA 1.521 59.928 58.200 0.346 0.000 1.018 147 S CB -0.384 62.993 63.200 0.295 0.000 0.876 147 S HN 0.509 8.819 8.310 0.000 0.000 0.448 148 D N -0.204 120.296 120.400 0.167 0.000 2.183 148 D HA -0.033 4.606 4.640 -0.002 0.000 0.203 148 D C 1.554 177.912 176.300 0.096 0.000 0.969 148 D CA 0.630 54.689 54.000 0.099 0.000 0.842 148 D CB -0.278 40.575 40.800 0.089 0.000 0.957 148 D HN 0.465 8.835 8.370 0.000 0.000 0.484 149 Y N 0.636 120.969 120.300 0.054 0.000 2.181 149 Y HA -0.260 4.289 4.550 -0.001 0.000 0.288 149 Y C 2.411 178.319 175.900 0.013 0.000 1.146 149 Y CA 1.920 60.048 58.100 0.047 0.000 1.164 149 Y CB -0.369 38.142 38.460 0.084 0.000 0.982 149 Y HN 0.063 8.343 8.280 0.000 0.000 0.515 150 H N -0.398 118.623 119.070 -0.082 0.000 2.387 150 H HA -0.121 4.434 4.556 -0.001 0.000 0.299 150 H C 2.074 177.183 175.328 -0.365 0.000 1.090 150 H CA 2.272 58.105 56.048 -0.359 0.000 1.332 150 H CB -0.447 28.826 29.762 -0.816 0.000 1.386 150 H HN 0.423 8.703 8.280 0.000 0.000 0.516 151 T N -3.863 110.478 114.554 -0.355 0.000 3.100 151 T HA 0.213 4.562 4.350 -0.002 0.000 0.253 151 T C 1.772 176.312 174.700 -0.266 0.000 1.118 151 T CA 0.586 62.482 62.100 -0.340 0.000 1.058 151 T CB -0.197 68.565 68.868 -0.177 0.000 0.953 151 T HN 0.587 8.827 8.240 0.000 0.000 0.515 152 G N 1.769 110.406 108.800 -0.272 0.000 2.179 152 G HA2 -0.345 3.614 3.960 -0.002 0.000 0.260 152 G HA3 -0.345 3.614 3.960 -0.002 0.000 0.260 152 G C 0.717 175.539 174.900 -0.130 0.000 0.977 152 G CA 0.619 45.581 45.100 -0.230 0.000 0.641 152 G HN 0.644 8.934 8.290 0.000 0.000 0.533 153 K N 0.455 120.801 120.400 -0.091 0.000 2.148 153 K HA 0.392 4.711 4.320 -0.002 0.000 0.204 153 K C 1.350 177.945 176.600 -0.009 0.000 1.050 153 K CA 1.472 57.735 56.287 -0.040 0.000 0.942 153 K CB -0.135 32.352 32.500 -0.021 0.000 0.724 153 K HN 0.899 9.149 8.250 0.000 0.000 0.446 154 A N 0.346 123.176 122.820 0.015 0.000 2.355 154 A HA 0.390 4.709 4.320 -0.002 0.000 0.324 154 A C -0.257 177.391 177.584 0.107 0.000 1.117 154 A CA -0.768 51.313 52.037 0.073 0.000 0.785 154 A CB 1.288 20.361 19.000 0.122 0.000 1.254 154 A HN 0.048 8.198 8.150 0.000 0.000 0.453 155 K N 0.512 120.990 120.400 0.130 0.000 2.393 155 K HA 0.129 4.448 4.320 -0.002 0.000 0.193 155 K C 0.634 177.425 176.600 0.318 0.000 1.026 155 K CA 1.113 57.505 56.287 0.175 0.000 1.064 155 K CB 0.020 32.579 32.500 0.098 0.000 0.833 155 K HN 0.917 9.167 8.250 0.000 0.000 0.521 156 T N -2.972 111.749 114.554 0.279 0.000 2.887 156 T HA 0.621 4.970 4.350 -0.002 0.000 0.292 156 T C -0.155 174.589 174.700 0.074 0.000 1.087 156 T CA -0.847 61.340 62.100 0.145 0.000 1.009 156 T CB 1.508 70.408 68.868 0.053 0.000 1.203 156 T HN -0.080 8.160 8.240 0.000 0.000 0.518 157 I N 3.094 123.565 120.570 -0.166 0.000 2.282 157 I HA 0.193 4.362 4.170 -0.002 0.000 0.290 157 I C 1.761 177.792 176.117 -0.145 0.000 1.090 157 I CA -0.614 60.578 61.300 -0.181 0.000 1.231 157 I CB 1.222 39.020 38.000 -0.338 0.000 1.434 157 I HN 0.940 9.150 8.210 0.000 0.000 0.487 158 S N 3.648 119.305 115.700 -0.073 0.000 2.400 158 S HA -0.141 4.328 4.470 -0.002 0.000 0.232 158 S C 1.891 176.408 174.600 -0.140 0.000 1.025 158 S CA 1.126 59.276 58.200 -0.084 0.000 0.993 158 S CB -0.410 62.769 63.200 -0.035 0.000 0.808 158 S HN 0.739 9.049 8.310 0.000 0.000 0.478 159 G N 0.660 109.369 108.800 -0.151 0.000 2.848 159 G HA2 0.302 4.261 3.960 -0.002 0.000 0.208 159 G HA3 0.302 4.261 3.960 -0.002 0.000 0.208 159 G C 0.431 175.153 174.900 -0.297 0.000 1.152 159 G CA -0.102 44.878 45.100 -0.200 0.000 0.789 159 G HN 0.567 8.857 8.290 0.000 0.000 0.531 160 I N 2.042 122.404 120.570 -0.347 0.000 2.355 160 I HA 0.347 4.516 4.170 -0.002 0.000 0.288 160 I C 0.062 175.794 176.117 -0.640 0.000 0.999 160 I CA -0.496 60.527 61.300 -0.461 0.000 1.163 160 I CB 1.843 39.556 38.000 -0.479 0.000 1.316 160 I HN 0.022 8.232 8.210 0.000 0.000 0.454 161 T N 1.887 116.036 114.554 -0.675 0.000 2.887 161 T HA 0.670 5.019 4.350 -0.002 0.000 0.292 161 T C -0.803 173.439 174.700 -0.763 0.000 1.087 161 T CA -0.671 60.959 62.100 -0.782 0.000 1.009 161 T CB 1.875 70.528 68.868 -0.357 0.000 1.203 161 T HN 0.130 8.370 8.240 0.000 0.000 0.518 162 F N 0.888 120.813 119.950 -0.041 0.000 2.532 162 F HA 0.454 4.980 4.527 -0.002 0.000 0.365 162 F C -2.091 173.690 175.800 -0.031 0.000 1.112 162 F CA -2.546 55.437 58.000 -0.028 0.000 1.082 162 F CB 1.313 40.302 39.000 -0.017 0.000 1.319 162 F HN 0.366 8.666 8.300 0.000 0.000 0.457 163 P HA -0.139 4.281 4.420 0.000 0.000 0.222 163 P C 0.619 177.948 177.300 0.048 0.000 1.147 163 P CA 1.346 64.469 63.100 0.039 0.000 0.790 163 P CB 0.360 32.063 31.700 0.004 0.000 0.780 164 D N -1.144 119.296 120.400 0.068 0.000 2.696 164 D HA 0.347 4.986 4.640 -0.002 0.000 0.269 164 D C 0.443 176.767 176.300 0.041 0.000 1.319 164 D CA -0.005 54.018 54.000 0.038 0.000 0.826 164 D CB -0.237 40.572 40.800 0.015 0.000 1.086 164 D HN 0.044 8.414 8.370 0.000 0.000 0.481 165 G N 0.522 109.372 108.800 0.083 0.000 2.781 165 G HA2 -0.250 3.710 3.960 -0.002 0.000 0.683 165 G HA3 -0.250 3.710 3.960 -0.002 0.000 0.683 165 G C 0.730 175.576 174.900 -0.090 0.000 1.390 165 G CA -0.204 44.923 45.100 0.045 0.000 0.850 165 G HN 0.209 8.499 8.290 0.000 0.000 0.557 166 E N 0.160 120.208 120.200 -0.252 0.000 2.160 166 E HA -0.133 4.216 4.350 -0.002 0.000 0.195 166 E C 1.804 178.211 176.600 -0.322 0.000 0.991 166 E CA 1.255 57.304 56.400 -0.584 0.000 0.810 166 E CB -0.031 29.400 29.700 -0.448 0.000 0.742 166 E HN 0.417 8.777 8.360 0.000 0.000 0.466 167 N N 0.235 118.841 118.700 -0.155 0.000 2.280 167 N HA 0.031 4.771 4.740 -0.002 0.000 0.192 167 N C 0.523 176.002 175.510 -0.052 0.000 1.109 167 N CA 0.188 53.192 53.050 -0.077 0.000 0.855 167 N CB 0.672 39.136 38.487 -0.039 0.000 0.974 167 N HN 0.022 8.402 8.380 0.000 0.000 0.482 168 G N 0.321 109.086 108.800 -0.058 0.000 2.508 168 G HA2 0.125 4.084 3.960 -0.002 0.000 0.278 168 G HA3 0.125 4.084 3.960 -0.002 0.000 0.278 168 G C 0.784 175.666 174.900 -0.028 0.000 1.389 168 G CA -0.150 44.932 45.100 -0.030 0.000 1.050 168 G HN -0.026 8.264 8.290 0.000 0.000 0.522 169 K N -1.055 119.332 120.400 -0.022 0.000 2.374 169 K HA 0.256 4.575 4.320 -0.002 0.000 0.202 169 K C -0.183 176.402 176.600 -0.025 0.000 1.040 169 K CA 0.059 56.325 56.287 -0.036 0.000 1.085 169 K CB 1.199 33.662 32.500 -0.062 0.000 0.873 169 K HN 0.161 8.411 8.250 0.000 0.000 0.539 170 V N 2.165 122.089 119.914 0.015 0.000 2.495 170 V HA 0.478 4.597 4.120 -0.002 0.000 0.298 170 V C -0.464 175.697 176.094 0.112 0.000 1.031 170 V CA -0.991 61.322 62.300 0.021 0.000 0.871 170 V CB 1.790 33.614 31.823 0.002 0.000 0.988 170 V HN -0.035 8.155 8.190 0.000 0.000 0.432 171 I N 3.819 124.432 120.570 0.071 0.000 2.466 171 I HA 0.492 4.661 4.170 -0.002 0.000 0.289 171 I C -0.278 175.819 176.117 -0.033 0.000 1.026 171 I CA -0.440 60.932 61.300 0.120 0.000 1.078 171 I CB 1.856 40.018 38.000 0.269 0.000 1.249 171 I HN 0.501 8.711 8.210 0.000 0.000 0.429 172 K N 5.606 125.942 120.400 -0.107 0.000 2.213 172 K HA 0.717 5.036 4.320 -0.002 0.000 0.270 172 K C -1.450 174.998 176.600 -0.254 0.000 1.002 172 K CA -0.502 55.678 56.287 -0.178 0.000 0.868 172 K CB 1.325 33.720 32.500 -0.175 0.000 1.093 172 K HN 0.489 8.739 8.250 0.000 0.000 0.454 173 V N 4.288 124.011 119.914 -0.319 0.000 2.357 173 V HA 0.170 4.289 4.120 -0.002 0.000 0.284 173 V C -0.479 175.190 176.094 -0.708 0.000 1.018 173 V CA -0.827 61.185 62.300 -0.481 0.000 0.841 173 V CB 1.197 32.745 31.823 -0.457 0.000 0.991 173 V HN 0.746 8.936 8.190 0.000 0.000 0.437 174 Q N 4.166 123.635 119.800 -0.552 0.000 2.303 174 Q HA 0.552 4.891 4.340 -0.002 0.000 0.257 174 Q C -1.248 174.502 176.000 -0.416 0.000 0.941 174 Q CA -0.020 55.522 55.803 -0.435 0.000 0.931 174 Q CB 0.803 29.403 28.738 -0.230 0.000 1.215 174 Q HN 0.519 8.789 8.270 0.000 0.000 0.437 175 F N 1.895 121.833 119.950 -0.020 0.000 2.408 175 F HA 0.414 4.940 4.527 -0.002 0.000 0.325 175 F C 1.330 177.126 175.800 -0.007 0.000 1.082 175 F CA -0.745 57.258 58.000 0.004 0.000 1.032 175 F CB 0.958 39.963 39.000 0.009 0.000 1.259 175 F HN 0.560 8.860 8.300 0.000 0.000 0.503 176 K N -0.086 120.443 120.400 0.214 0.000 2.031 176 K HA 0.014 4.333 4.320 -0.002 0.000 0.205 176 K C -0.131 176.515 176.600 0.077 0.000 1.049 176 K CA 1.166 57.517 56.287 0.108 0.000 0.939 176 K CB 0.090 32.640 32.500 0.084 0.000 0.717 176 K HN 0.463 8.713 8.250 0.000 0.000 0.438 177 E N -0.199 120.036 120.200 0.059 0.000 2.383 177 E HA 0.237 4.586 4.350 -0.002 0.000 0.275 177 E C -0.606 175.927 176.600 -0.113 0.000 0.918 177 E CA -0.618 55.770 56.400 -0.021 0.000 0.764 177 E CB 1.420 31.073 29.700 -0.079 0.000 1.252 177 E HN -0.082 8.278 8.360 0.000 0.000 0.449 178 M N 1.011 120.538 119.600 -0.122 0.000 2.240 178 M HA 0.259 4.738 4.480 -0.002 0.000 0.333 178 M C 0.158 176.265 176.300 -0.321 0.000 1.110 178 M CA 0.103 55.269 55.300 -0.225 0.000 1.173 178 M CB -0.200 32.335 32.600 -0.108 0.000 1.458 178 M HN 0.139 8.429 8.290 0.000 0.000 0.458 179 K N 2.543 122.695 120.400 -0.414 0.000 2.371 179 K HA 0.418 4.737 4.320 -0.002 0.000 0.251 179 K C -1.956 174.500 176.600 -0.241 0.000 0.934 179 K CA -1.677 54.337 56.287 -0.454 0.000 0.798 179 K CB 1.666 33.586 32.500 -0.965 0.000 1.204 179 K HN 0.221 8.471 8.250 0.000 0.000 0.427 180 P HA -0.120 4.300 4.420 0.000 0.000 0.220 180 P C 1.061 178.351 177.300 -0.016 0.000 1.148 180 P CA 1.024 64.086 63.100 -0.063 0.000 0.803 180 P CB 0.230 31.907 31.700 -0.040 0.000 0.782 181 G N -0.552 108.229 108.800 -0.031 0.000 2.744 181 G HA2 -0.105 3.854 3.960 -0.002 0.000 0.211 181 G HA3 -0.105 3.854 3.960 -0.002 0.000 0.211 181 G C 1.431 176.359 174.900 0.047 0.000 1.143 181 G CA -0.017 45.091 45.100 0.013 0.000 0.788 181 G HN 0.185 8.475 8.290 0.000 0.000 0.534 182 M N 1.375 121.015 119.600 0.067 0.000 2.446 182 M HA -0.068 4.411 4.480 -0.002 0.000 0.263 182 M C 2.616 179.152 176.300 0.393 0.000 1.066 182 M CA 1.525 56.962 55.300 0.228 0.000 1.087 182 M CB -0.240 32.474 32.600 0.191 0.000 1.406 182 M HN 0.332 8.622 8.290 0.000 0.000 0.459 183 T N -2.625 112.069 114.554 0.233 0.000 3.118 183 T HA -0.034 4.315 4.350 -0.002 0.000 0.260 183 T C 0.591 175.329 174.700 0.062 0.000 1.139 183 T CA 0.236 62.486 62.100 0.250 0.000 1.085 183 T CB -0.022 68.929 68.868 0.137 0.000 0.934 183 T HN 0.399 8.639 8.240 0.000 0.000 0.518 184 Q N 0.987 120.711 119.800 -0.128 0.000 2.356 184 Q HA 0.524 4.864 4.340 -0.002 0.000 0.270 184 Q C -0.663 174.924 176.000 -0.689 0.000 1.058 184 Q CA -0.576 54.981 55.803 -0.411 0.000 0.802 184 Q CB 2.107 30.778 28.738 -0.112 0.000 1.303 184 Q HN 0.236 8.506 8.270 0.000 0.000 0.444 185 S N 1.879 117.010 115.700 -0.949 0.000 2.568 185 S HA 0.383 4.852 4.470 -0.002 0.000 0.282 185 S C 0.939 175.439 174.600 -0.167 0.000 1.338 185 S CA 1.406 59.335 58.200 -0.452 0.000 1.045 185 S CB 0.124 63.251 63.200 -0.121 0.000 0.873 185 S HN 1.111 9.421 8.310 0.000 0.000 0.516 186 G N 3.830 112.595 108.800 -0.058 0.000 2.157 186 G HA2 -0.324 3.635 3.960 -0.002 0.000 0.248 186 G HA3 -0.324 3.635 3.960 -0.002 0.000 0.248 186 G C 0.512 175.332 174.900 -0.133 0.000 0.979 186 G CA 0.805 45.853 45.100 -0.088 0.000 0.650 186 G HN 1.006 9.296 8.290 0.000 0.000 0.529 187 N N 0.008 118.624 118.700 -0.141 0.000 2.289 187 N HA 0.273 5.013 4.740 -0.002 0.000 0.184 187 N C 2.052 177.449 175.510 -0.188 0.000 1.016 187 N CA 2.209 55.192 53.050 -0.113 0.000 0.872 187 N CB -0.413 38.046 38.487 -0.047 0.000 0.973 187 N HN 1.722 10.102 8.380 0.000 0.000 0.433 188 G N -1.211 107.435 108.800 -0.255 0.000 2.234 188 G HA2 -0.366 3.593 3.960 -0.002 0.000 0.260 188 G HA3 -0.366 3.593 3.960 -0.002 0.000 0.260 188 G C 0.661 175.323 174.900 -0.396 0.000 0.987 188 G CA 0.618 45.507 45.100 -0.351 0.000 0.625 188 G HN 0.449 8.739 8.290 0.000 0.000 0.532 189 Y N 0.103 120.315 120.300 -0.147 0.000 2.475 189 Y HA 0.422 4.971 4.550 -0.002 0.000 0.289 189 Y C 1.341 177.411 175.900 0.283 0.000 1.121 189 Y CA 1.098 59.180 58.100 -0.029 0.000 1.257 189 Y CB 0.039 38.404 38.460 -0.159 0.000 1.026 189 Y HN 0.535 8.815 8.280 0.000 0.000 0.555 190 F N -1.943 118.222 119.950 0.359 0.000 2.588 190 F HA 0.682 5.208 4.527 -0.002 0.000 0.310 190 F C -1.263 174.753 175.800 0.360 0.000 1.082 190 F CA -2.224 56.076 58.000 0.501 0.000 0.929 190 F CB 0.711 40.093 39.000 0.637 0.000 1.254 190 F HN -0.383 7.917 8.300 0.000 0.000 0.455 191 L N 1.509 123.003 121.223 0.450 0.000 2.454 191 L HA 0.488 4.827 4.340 -0.002 0.000 0.256 191 L C 0.322 177.517 176.870 0.542 0.000 1.136 191 L CA -0.477 54.451 54.840 0.147 0.000 0.804 191 L CB 1.137 42.935 42.059 -0.434 0.000 1.181 191 L HN 0.819 9.049 8.230 0.000 0.000 0.469 192 E N -0.539 119.888 120.200 0.378 0.000 2.810 192 E HA 0.112 4.461 4.350 -0.002 0.000 0.214 192 E C -0.666 176.054 176.600 0.200 0.000 0.980 192 E CA -0.053 56.611 56.400 0.440 0.000 1.159 192 E CB 1.171 31.171 29.700 0.500 0.000 1.047 192 E HN 0.765 9.125 8.360 0.000 0.000 0.484 193 T N -1.708 112.978 114.554 0.221 0.000 2.916 193 T HA 0.651 5.000 4.350 -0.002 0.000 0.292 193 T C -0.016 174.838 174.700 0.257 0.000 1.064 193 T CA -0.862 61.346 62.100 0.179 0.000 1.011 193 T CB 1.991 70.949 68.868 0.150 0.000 1.152 193 T HN -0.044 8.196 8.240 0.000 0.000 0.510 194 V N -1.426 118.650 119.914 0.269 0.000 2.769 194 V HA 1.001 5.120 4.120 -0.002 0.000 0.312 194 V C -0.118 176.288 176.094 0.519 0.000 1.058 194 V CA -1.297 61.232 62.300 0.382 0.000 0.952 194 V CB 0.913 32.922 31.823 0.310 0.000 1.019 194 V HN 1.471 9.661 8.190 0.000 0.000 0.445 195 A N 3.360 126.516 122.820 0.561 0.000 2.386 195 A HA 0.918 5.237 4.320 -0.002 0.000 0.311 195 A C -2.867 174.980 177.584 0.440 0.000 1.068 195 A CA -1.979 50.353 52.037 0.491 0.000 0.743 195 A CB 1.971 21.164 19.000 0.322 0.000 1.258 195 A HN 0.753 8.903 8.150 0.000 0.000 0.429 196 P HA 0.071 4.491 4.420 0.000 0.000 0.256 196 P C -0.055 177.144 177.300 -0.169 0.000 1.689 196 P CA 0.094 62.777 63.100 -0.694 0.000 1.124 196 P CB -0.007 30.739 31.700 -1.590 0.000 1.766 197 Y N 4.222 124.449 120.300 -0.122 0.000 2.128 197 Y HA -0.265 4.284 4.550 -0.002 0.000 0.284 197 Y C 2.157 177.883 175.900 -0.290 0.000 1.154 197 Y CA 1.916 59.782 58.100 -0.390 0.000 1.149 197 Y CB -0.311 37.880 38.460 -0.448 0.000 0.976 197 Y HN 0.160 8.440 8.280 0.000 0.000 0.505 198 Q N -1.037 118.592 119.800 -0.284 0.000 2.170 198 Q HA -0.231 4.108 4.340 -0.002 0.000 0.203 198 Q C 2.104 177.954 176.000 -0.251 0.000 0.976 198 Q CA 1.698 57.315 55.803 -0.310 0.000 0.858 198 Q CB -0.903 27.773 28.738 -0.105 0.000 0.907 198 Q HN 0.697 8.967 8.270 0.000 0.000 0.433 199 Y N 0.433 120.519 120.300 -0.357 0.000 2.293 199 Y HA -0.076 4.473 4.550 -0.001 0.000 0.291 199 Y C 1.700 177.454 175.900 -0.243 0.000 1.137 199 Y CA 1.062 58.986 58.100 -0.292 0.000 1.202 199 Y CB 0.112 38.365 38.460 -0.346 0.000 0.990 199 Y HN 0.001 8.281 8.280 0.000 0.000 0.537 200 L N 0.126 121.198 121.223 -0.252 0.000 2.664 200 L HA 0.059 4.398 4.340 -0.002 0.000 0.233 200 L C 1.980 178.710 176.870 -0.232 0.000 1.113 200 L CA 0.229 54.947 54.840 -0.203 0.000 0.896 200 L CB -0.122 41.963 42.059 0.044 0.000 1.163 200 L HN 0.080 8.310 8.230 0.000 0.000 0.497 201 K N -0.764 119.359 120.400 -0.462 0.000 2.362 201 K HA -0.156 4.163 4.320 -0.002 0.000 0.200 201 K C 1.023 177.488 176.600 -0.225 0.000 1.046 201 K CA 1.368 57.352 56.287 -0.505 0.000 0.952 201 K CB -0.032 31.894 32.500 -0.956 0.000 0.753 201 K HN 0.010 8.260 8.250 0.000 0.000 0.466 202 D N 0.864 121.147 120.400 -0.196 0.000 2.339 202 D HA 0.042 4.681 4.640 -0.002 0.000 0.217 202 D C -0.651 175.602 176.300 -0.080 0.000 1.050 202 D CA -0.032 53.894 54.000 -0.124 0.000 0.856 202 D CB 0.542 41.261 40.800 -0.135 0.000 0.922 202 D HN -0.025 8.345 8.370 0.000 0.000 0.518 203 V N 1.460 121.340 119.914 -0.058 0.000 2.407 203 V HA 0.571 4.690 4.120 -0.002 0.000 0.278 203 V C 0.617 176.738 176.094 0.045 0.000 1.037 203 V CA -1.119 61.172 62.300 -0.015 0.000 0.900 203 V CB 0.969 32.786 31.823 -0.011 0.000 0.983 203 V HN 0.191 8.381 8.190 0.000 0.000 0.459 204 A N 7.692 130.523 122.820 0.019 0.000 2.498 204 A HA 0.363 4.682 4.320 -0.002 0.000 0.239 204 A C -1.130 176.469 177.584 0.024 0.000 1.068 204 A CA -0.740 51.304 52.037 0.011 0.000 0.766 204 A CB -0.074 18.915 19.000 -0.018 0.000 1.003 204 A HN 0.684 8.834 8.150 0.000 0.000 0.497 205 P HA -0.224 4.196 4.420 0.000 0.000 0.216 205 P C 1.299 178.541 177.300 -0.097 0.000 1.153 205 P CA 2.104 65.046 63.100 -0.265 0.000 0.858 205 P CB 0.004 31.193 31.700 -0.851 0.000 0.789 206 K N -0.801 119.541 120.400 -0.098 0.000 2.280 206 K HA -0.125 4.194 4.320 -0.002 0.000 0.202 206 K C 0.808 177.411 176.600 0.004 0.000 1.047 206 K CA 1.567 57.828 56.287 -0.042 0.000 0.942 206 K CB -0.520 31.950 32.500 -0.052 0.000 0.739 206 K HN 0.043 8.293 8.250 0.000 0.000 0.457 207 D N 0.534 120.944 120.400 0.017 0.000 2.349 207 D HA -0.002 4.637 4.640 -0.002 0.000 0.214 207 D C 1.529 177.862 176.300 0.055 0.000 1.063 207 D CA 0.057 54.071 54.000 0.024 0.000 0.847 207 D CB 0.288 41.094 40.800 0.009 0.000 0.933 207 D HN 0.117 8.487 8.370 0.000 0.000 0.513 208 L N 1.330 122.619 121.223 0.109 0.000 2.056 208 L HA -0.029 4.310 4.340 -0.002 0.000 0.207 208 L C 2.095 179.026 176.870 0.102 0.000 1.078 208 L CA 1.447 56.373 54.840 0.143 0.000 0.749 208 L CB -0.541 41.689 42.059 0.286 0.000 0.901 208 L HN -0.033 8.197 8.230 0.000 0.000 0.433 209 A N -1.941 120.934 122.820 0.092 0.000 1.969 209 A HA -0.121 4.198 4.320 -0.002 0.000 0.218 209 A C 2.301 179.902 177.584 0.028 0.000 1.169 209 A CA 1.815 53.885 52.037 0.056 0.000 0.635 209 A CB -0.588 18.439 19.000 0.045 0.000 0.810 209 A HN 0.490 8.640 8.150 0.000 0.000 0.445 210 S N -0.589 115.126 115.700 0.025 0.000 2.548 210 S HA 0.126 4.595 4.470 -0.002 0.000 0.215 210 S C 1.002 175.610 174.600 0.013 0.000 0.976 210 S CA 0.315 58.521 58.200 0.009 0.000 0.908 210 S CB -0.153 63.049 63.200 0.002 0.000 0.781 210 S HN 0.550 8.860 8.310 0.000 0.000 0.519 211 S N 2.338 118.051 115.700 0.022 0.000 2.568 211 S HA 0.124 4.593 4.470 -0.002 0.000 0.282 211 S C -1.786 172.826 174.600 0.020 0.000 1.338 211 S CA -1.261 56.945 58.200 0.010 0.000 1.045 211 S CB 0.744 63.946 63.200 0.003 0.000 0.873 211 S HN -0.005 8.305 8.310 0.000 0.000 0.516 212 P HA -0.071 4.349 4.420 0.000 0.000 0.219 212 P C 0.684 178.014 177.300 0.049 0.000 1.146 212 P CA 1.311 64.427 63.100 0.026 0.000 0.808 212 P CB 0.088 31.793 31.700 0.008 0.000 0.779 213 K N -1.162 119.246 120.400 0.014 0.000 2.439 213 K HA -0.009 4.310 4.320 -0.002 0.000 0.197 213 K C 1.286 177.978 176.600 0.153 0.000 1.041 213 K CA 1.530 57.846 56.287 0.047 0.000 0.970 213 K CB -0.390 31.976 32.500 -0.223 0.000 0.773 213 K HN 0.304 8.554 8.250 0.000 0.000 0.479 214 T N -3.529 111.112 114.554 0.144 0.000 3.091 214 T HA 0.087 4.436 4.350 -0.002 0.000 0.277 214 T C 1.215 176.110 174.700 0.326 0.000 0.996 214 T CA 0.230 62.467 62.100 0.228 0.000 0.897 214 T CB 0.426 69.391 68.868 0.163 0.000 1.109 214 T HN 0.136 8.376 8.240 0.000 0.000 0.534 215 T N -0.889 113.824 114.554 0.265 0.000 3.425 215 T HA 0.121 4.470 4.350 -0.002 0.000 0.225 215 T C 1.948 176.823 174.700 0.292 0.000 0.992 215 T CA 0.860 63.094 62.100 0.222 0.000 1.174 215 T CB -0.127 68.775 68.868 0.056 0.000 1.240 215 T HN 0.252 8.492 8.240 0.000 0.000 0.350 216 T N -0.222 114.424 114.554 0.153 0.000 3.037 216 T HA 0.383 4.732 4.350 -0.002 0.000 0.251 216 T C 0.859 175.592 174.700 0.055 0.000 1.079 216 T CA -0.033 62.135 62.100 0.115 0.000 1.067 216 T CB -0.149 68.759 68.868 0.066 0.000 0.948 216 T HN 0.370 8.610 8.240 0.000 0.000 0.496 217 K N 2.197 122.620 120.400 0.039 0.000 3.301 217 K HA 0.296 4.615 4.320 -0.002 0.000 0.170 217 K C -2.970 173.654 176.600 0.039 0.000 1.061 217 K CA -1.423 54.875 56.287 0.019 0.000 0.807 217 K CB 1.794 34.334 32.500 0.066 0.000 0.889 217 K HN 0.314 8.564 8.250 0.000 0.000 0.564 218 P HA 0.239 4.659 4.420 0.000 0.000 0.278 218 P C -0.329 176.796 177.300 -0.292 0.000 1.266 218 P CA -0.520 62.482 63.100 -0.164 0.000 0.807 218 P CB 1.229 32.613 31.700 -0.526 0.000 1.094 219 L N 0.633 121.638 121.223 -0.364 0.000 2.343 219 L HA 0.590 4.929 4.340 -0.002 0.000 0.275 219 L C 0.720 177.629 176.870 0.064 0.000 1.056 219 L CA -0.878 53.786 54.840 -0.293 0.000 0.804 219 L CB 1.430 43.155 42.059 -0.557 0.000 1.203 219 L HN 0.261 8.491 8.230 0.000 0.000 0.440 220 V N -1.250 118.798 119.914 0.223 0.000 3.167 220 V HA 0.614 4.733 4.120 -0.002 0.000 0.310 220 V C 0.240 176.525 176.094 0.320 0.000 1.207 220 V CA -0.039 62.460 62.300 0.331 0.000 1.059 220 V CB 1.817 33.721 31.823 0.136 0.000 1.079 220 V HN 0.836 9.026 8.190 0.000 0.000 0.446 221 T N -2.545 112.132 114.554 0.204 0.000 3.043 221 T HA 0.454 4.803 4.350 -0.002 0.000 0.272 221 T C 0.832 175.662 174.700 0.216 0.000 0.990 221 T CA 0.546 62.708 62.100 0.102 0.000 0.897 221 T CB -0.089 68.727 68.868 -0.088 0.000 1.111 221 T HN 1.447 9.687 8.240 0.000 0.000 0.529 222 G N 2.271 111.157 108.800 0.144 0.000 2.535 222 G HA2 0.493 4.452 3.960 -0.002 0.000 0.282 222 G HA3 0.493 4.452 3.960 -0.002 0.000 0.282 222 G C -1.439 173.233 174.900 -0.380 0.000 1.350 222 G CA -1.348 43.745 45.100 -0.012 0.000 1.039 222 G HN 0.036 8.326 8.290 0.000 0.000 0.509 223 P HA 0.043 4.463 4.420 0.000 0.000 0.223 223 P C -0.184 176.710 177.300 -0.676 0.000 1.151 223 P CA 0.907 63.361 63.100 -1.077 0.000 0.787 223 P CB 0.155 31.334 31.700 -0.868 0.000 0.788 224 F N 0.480 120.263 119.950 -0.279 0.000 2.561 224 F HA 0.418 4.944 4.527 -0.002 0.000 0.321 224 F C 0.903 176.717 175.800 0.023 0.000 1.065 224 F CA -1.129 56.797 58.000 -0.123 0.000 0.934 224 F CB 1.889 40.752 39.000 -0.229 0.000 1.215 224 F HN -0.366 7.934 8.300 0.000 0.000 0.471 225 K N 1.418 121.989 120.400 0.284 0.000 2.259 225 K HA 0.590 4.909 4.320 -0.002 0.000 0.249 225 K C -3.133 173.599 176.600 0.220 0.000 0.942 225 K CA -2.070 54.335 56.287 0.197 0.000 0.816 225 K CB 2.092 34.641 32.500 0.083 0.000 1.155 225 K HN 0.143 8.393 8.250 0.000 0.000 0.428 226 P HA 0.074 4.494 4.420 0.000 0.000 0.280 226 P C -0.307 176.931 177.300 -0.104 0.000 1.386 226 P CA 0.044 63.028 63.100 -0.193 0.000 0.899 226 P CB 1.227 32.700 31.700 -0.379 0.000 1.098 227 E N 3.308 123.491 120.200 -0.029 0.000 2.152 227 E HA -0.076 4.273 4.350 -0.002 0.000 0.192 227 E C 0.350 176.944 176.600 -0.010 0.000 0.983 227 E CA 0.551 56.950 56.400 -0.001 0.000 0.818 227 E CB 0.301 30.023 29.700 0.036 0.000 0.758 227 E HN 0.426 8.786 8.360 0.000 0.000 0.467 228 N N -0.770 117.920 118.700 -0.017 0.000 2.331 228 N HA 0.233 4.972 4.740 -0.002 0.000 0.280 228 N C -1.919 173.595 175.510 0.007 0.000 1.155 228 N CA -0.446 52.604 53.050 0.001 0.000 0.822 228 N CB 2.344 40.840 38.487 0.016 0.000 1.619 228 N HN -0.188 8.192 8.380 0.000 0.000 0.476 229 V N 2.340 122.278 119.914 0.040 0.000 2.525 229 V HA 0.359 4.478 4.120 -0.002 0.000 0.299 229 V C -0.335 175.797 176.094 0.063 0.000 1.034 229 V CA -0.736 61.612 62.300 0.080 0.000 0.863 229 V CB 1.745 33.664 31.823 0.160 0.000 0.999 229 V HN 0.411 8.601 8.190 0.000 0.000 0.423 230 V N 4.561 124.511 119.914 0.059 0.000 2.318 230 V HA 0.536 4.656 4.120 -0.002 0.000 0.271 230 V C 0.888 177.008 176.094 0.043 0.000 1.030 230 V CA -0.566 61.763 62.300 0.047 0.000 0.844 230 V CB 1.353 33.204 31.823 0.047 0.000 1.015 230 V HN 1.028 9.218 8.190 0.000 0.000 0.460 231 A N 4.291 127.130 122.820 0.031 0.000 2.584 231 A HA 0.432 4.752 4.320 -0.002 0.000 0.239 231 A C 1.658 179.249 177.584 0.013 0.000 1.043 231 A CA 0.936 52.981 52.037 0.013 0.000 0.756 231 A CB -0.520 18.483 19.000 0.005 0.000 0.963 231 A HN 2.140 10.290 8.150 0.000 0.000 0.511 232 G N 1.743 110.544 108.800 0.002 0.000 2.234 232 G HA2 -0.278 3.681 3.960 -0.002 0.000 0.260 232 G HA3 -0.278 3.681 3.960 -0.002 0.000 0.260 232 G C 0.552 175.472 174.900 0.033 0.000 0.987 232 G CA 0.989 46.095 45.100 0.011 0.000 0.625 232 G HN 0.792 9.082 8.290 0.000 0.000 0.532 233 E N -0.924 119.303 120.200 0.045 0.000 2.713 233 E HA 0.360 4.709 4.350 -0.002 0.000 0.201 233 E C 0.826 177.476 176.600 0.082 0.000 0.935 233 E CA 0.717 57.154 56.400 0.063 0.000 1.273 233 E CB 0.877 30.613 29.700 0.061 0.000 1.221 233 E HN 0.820 9.180 8.360 0.000 0.000 0.547 234 S N 0.076 115.826 115.700 0.083 0.000 2.588 234 S HA 0.628 5.097 4.470 -0.002 0.000 0.269 234 S C -1.255 173.393 174.600 0.080 0.000 1.157 234 S CA -0.932 57.327 58.200 0.097 0.000 0.824 234 S CB 1.403 64.665 63.200 0.103 0.000 1.126 234 S HN 0.120 8.430 8.310 0.000 0.000 0.464 235 I N 0.807 121.412 120.570 0.059 0.000 2.533 235 I HA 0.499 4.668 4.170 -0.002 0.000 0.290 235 I C -0.582 175.489 176.117 -0.077 0.000 1.056 235 I CA -0.605 60.662 61.300 -0.054 0.000 1.057 235 I CB 2.308 40.164 38.000 -0.241 0.000 1.240 235 I HN 0.647 8.857 8.210 0.000 0.000 0.423 236 K N 5.685 126.034 120.400 -0.085 0.000 2.263 236 K HA 0.431 4.751 4.320 -0.002 0.000 0.272 236 K C -1.675 174.900 176.600 -0.042 0.000 1.033 236 K CA -0.475 55.804 56.287 -0.014 0.000 0.884 236 K CB 0.761 33.280 32.500 0.032 0.000 1.107 236 K HN 0.404 8.654 8.250 0.000 0.000 0.460 237 Y N 2.473 122.806 120.300 0.056 0.000 2.323 237 Y HA 0.286 4.835 4.550 -0.001 0.000 0.331 237 Y C 0.336 176.342 175.900 0.176 0.000 1.092 237 Y CA -0.560 57.587 58.100 0.078 0.000 1.150 237 Y CB 1.652 40.066 38.460 -0.077 0.000 1.200 237 Y HN 0.298 8.578 8.280 0.000 0.000 0.472 238 V N 0.771 120.941 119.914 0.426 0.000 3.074 238 V HA 0.756 4.875 4.120 -0.002 0.000 0.314 238 V C -3.027 173.236 176.094 0.282 0.000 1.117 238 V CA -3.508 58.999 62.300 0.346 0.000 1.014 238 V CB 2.086 34.007 31.823 0.162 0.000 1.057 238 V HN 0.449 8.639 8.190 0.000 0.000 0.438 239 P HA 0.183 4.603 4.420 0.000 0.000 0.268 239 P C -0.947 176.261 177.300 -0.153 0.000 1.205 239 P CA 0.223 63.134 63.100 -0.315 0.000 0.771 239 P CB 0.196 31.729 31.700 -0.277 0.000 0.858 240 N N 4.358 122.945 118.700 -0.189 0.000 2.437 240 N HA 0.116 4.855 4.740 -0.002 0.000 0.243 240 N C -1.571 173.895 175.510 -0.072 0.000 1.041 240 N CA -2.403 50.614 53.050 -0.055 0.000 0.940 240 N CB 0.208 38.700 38.487 0.009 0.000 1.133 240 N HN 0.197 8.577 8.380 0.000 0.000 0.506 241 P HA -0.095 4.325 4.420 0.000 0.000 0.226 241 P C 0.179 177.308 177.300 -0.284 0.000 1.153 241 P CA 1.053 63.990 63.100 -0.271 0.000 0.777 241 P CB 0.018 31.464 31.700 -0.423 0.000 0.794 242 Y N -2.301 118.024 120.300 0.042 0.000 2.466 242 Y HA 0.108 4.657 4.550 -0.002 0.000 0.272 242 Y C 1.272 177.220 175.900 0.081 0.000 1.169 242 Y CA -0.820 57.314 58.100 0.056 0.000 1.285 242 Y CB -1.090 37.408 38.460 0.063 0.000 1.078 242 Y HN -0.117 8.163 8.280 0.000 0.000 0.523 243 Y N 1.806 122.121 120.300 0.025 0.000 2.610 243 Y HA -0.139 4.410 4.550 -0.002 0.000 0.332 243 Y C 1.289 177.120 175.900 -0.115 0.000 1.201 243 Y CA -0.979 57.064 58.100 -0.095 0.000 1.465 243 Y CB 0.430 38.751 38.460 -0.232 0.000 1.283 243 Y HN 0.359 8.639 8.280 0.000 0.000 0.563 244 W N 4.585 125.529 121.300 -0.593 0.000 2.584 244 W HA 0.249 4.908 4.660 -0.002 0.000 0.264 244 W C 0.293 176.491 176.519 -0.535 0.000 1.264 244 W CA 0.473 57.544 57.345 -0.457 0.000 1.306 244 W CB -0.917 28.328 29.460 -0.359 0.000 1.110 244 W HN 0.675 8.855 8.180 0.000 0.000 0.606 245 G N 1.354 109.009 108.800 -1.908 0.000 2.782 245 G HA2 0.186 4.145 3.960 -0.002 0.000 0.201 245 G HA3 0.186 4.145 3.960 -0.002 0.000 0.201 245 G C -0.477 174.164 174.900 -0.432 0.000 1.374 245 G CA -0.745 43.532 45.100 -1.372 0.000 1.039 245 G HN -0.145 8.145 8.290 0.000 0.000 0.576 246 E N 1.418 121.545 120.200 -0.121 0.000 2.415 246 E HA 0.087 4.436 4.350 -0.002 0.000 0.260 246 E C -0.027 176.621 176.600 0.079 0.000 1.016 246 E CA 0.155 56.569 56.400 0.025 0.000 0.924 246 E CB 0.833 30.572 29.700 0.064 0.000 0.961 246 E HN 0.155 8.515 8.360 0.000 0.000 0.459 247 K N 4.184 124.598 120.400 0.023 0.000 2.350 247 K HA 0.240 4.560 4.320 -0.002 0.000 0.279 247 K C -2.066 174.506 176.600 -0.048 0.000 1.027 247 K CA -1.802 54.476 56.287 -0.015 0.000 0.969 247 K CB -0.047 32.433 32.500 -0.034 0.000 0.954 247 K HN 0.293 8.543 8.250 0.000 0.000 0.474 248 P HA 0.141 4.561 4.420 0.000 0.000 0.272 248 P C 0.161 177.460 177.300 -0.002 0.000 1.223 248 P CA -0.226 62.833 63.100 -0.069 0.000 0.784 248 P CB 0.802 32.347 31.700 -0.259 0.000 0.923 249 K N 0.466 120.906 120.400 0.067 0.000 2.167 249 K HA 0.062 4.381 4.320 -0.002 0.000 0.203 249 K C 0.846 177.504 176.600 0.096 0.000 1.052 249 K CA 0.547 56.873 56.287 0.065 0.000 0.956 249 K CB -0.209 32.328 32.500 0.062 0.000 0.735 249 K HN 0.375 8.625 8.250 0.000 0.000 0.451 250 L N 1.487 122.818 121.223 0.179 0.000 2.417 250 L HA 0.018 4.358 4.340 -0.002 0.000 0.268 250 L C 1.343 178.340 176.870 0.212 0.000 1.158 250 L CA -0.317 54.649 54.840 0.211 0.000 0.819 250 L CB 0.448 42.678 42.059 0.286 0.000 1.112 250 L HN 0.053 8.283 8.230 0.000 0.000 0.458 251 N N 0.051 118.847 118.700 0.160 0.000 2.250 251 N HA -0.085 4.654 4.740 -0.002 0.000 0.181 251 N C 0.020 175.657 175.510 0.211 0.000 1.017 251 N CA 0.887 54.024 53.050 0.145 0.000 0.866 251 N CB 0.437 38.978 38.487 0.090 0.000 0.985 251 N HN 0.742 9.122 8.380 0.000 0.000 0.429 252 S N -1.437 114.387 115.700 0.206 0.000 2.588 252 S HA 0.565 5.034 4.470 -0.002 0.000 0.269 252 S C -1.243 173.397 174.600 0.068 0.000 1.157 252 S CA -1.039 57.275 58.200 0.190 0.000 0.824 252 S CB 1.090 64.371 63.200 0.135 0.000 1.126 252 S HN 0.037 8.347 8.310 0.000 0.000 0.464 253 I N 1.854 122.421 120.570 -0.006 0.000 2.499 253 I HA 0.459 4.628 4.170 -0.002 0.000 0.288 253 I C -0.306 175.865 176.117 0.089 0.000 1.048 253 I CA -0.591 60.673 61.300 -0.060 0.000 1.062 253 I CB 2.669 40.459 38.000 -0.351 0.000 1.238 253 I HN 0.910 9.120 8.210 0.000 0.000 0.426 254 T N 1.883 116.490 114.554 0.088 0.000 2.829 254 T HA 0.549 4.898 4.350 -0.002 0.000 0.282 254 T C -1.042 173.756 174.700 0.163 0.000 0.990 254 T CA -0.595 61.587 62.100 0.135 0.000 1.028 254 T CB 1.539 70.480 68.868 0.122 0.000 0.951 254 T HN 0.351 8.591 8.240 0.000 0.000 0.460 255 Y N 1.316 121.675 120.300 0.099 0.000 2.329 255 Y HA 0.480 5.030 4.550 -0.001 0.000 0.328 255 Y C -0.293 175.638 175.900 0.051 0.000 0.992 255 Y CA -1.429 56.717 58.100 0.077 0.000 1.151 255 Y CB 1.557 40.083 38.460 0.110 0.000 1.150 255 Y HN 0.870 9.150 8.280 0.000 0.000 0.450 256 E N 2.813 123.195 120.200 0.303 0.000 2.359 256 E HA 0.585 4.934 4.350 -0.002 0.000 0.266 256 E C -1.352 175.316 176.600 0.113 0.000 0.920 256 E CA -1.343 55.163 56.400 0.177 0.000 0.788 256 E CB 2.814 32.640 29.700 0.209 0.000 1.279 256 E HN 0.241 8.601 8.360 0.000 0.000 0.438 257 V N 1.725 121.695 119.914 0.094 0.000 2.498 257 V HA 0.251 4.370 4.120 -0.002 0.000 0.279 257 V C -0.353 175.767 176.094 0.044 0.000 1.048 257 V CA -0.367 61.976 62.300 0.071 0.000 0.967 257 V CB 1.375 33.242 31.823 0.073 0.000 0.988 257 V HN 0.354 8.544 8.190 0.000 0.000 0.473 258 V N 5.561 125.475 119.914 -0.001 0.000 2.638 258 V HA 0.593 4.712 4.120 -0.002 0.000 0.306 258 V C 0.305 176.403 176.094 0.007 0.000 1.052 258 V CA -0.265 62.048 62.300 0.021 0.000 0.885 258 V CB 2.600 34.422 31.823 -0.003 0.000 0.999 258 V HN 1.070 9.260 8.190 0.000 0.000 0.424 259 S N 3.602 119.316 115.700 0.024 0.000 2.584 259 S HA 0.090 4.559 4.470 -0.002 0.000 0.270 259 S C 1.505 176.096 174.600 -0.016 0.000 1.346 259 S CA 0.382 58.584 58.200 0.002 0.000 1.018 259 S CB 1.159 64.365 63.200 0.010 0.000 0.899 259 S HN 1.299 9.609 8.310 0.000 0.000 0.542 260 T N -0.222 114.312 114.554 -0.034 0.000 2.684 260 T HA -0.155 4.194 4.350 -0.002 0.000 0.267 260 T C 1.939 176.626 174.700 -0.023 0.000 1.036 260 T CA 1.264 63.338 62.100 -0.043 0.000 1.148 260 T CB -1.171 67.664 68.868 -0.056 0.000 0.863 260 T HN 0.977 9.217 8.240 0.000 0.000 0.436 261 A N 1.603 124.414 122.820 -0.015 0.000 2.119 261 A HA 0.087 4.406 4.320 -0.002 0.000 0.217 261 A C 2.216 179.802 177.584 0.004 0.000 1.153 261 A CA 1.015 53.048 52.037 -0.006 0.000 0.692 261 A CB -0.389 18.608 19.000 -0.006 0.000 0.799 261 A HN 0.617 8.767 8.150 0.000 0.000 0.458 262 K N -0.629 119.779 120.400 0.013 0.000 2.358 262 K HA 0.186 4.506 4.320 -0.002 0.000 0.197 262 K C 1.652 178.277 176.600 0.041 0.000 1.025 262 K CA 0.420 56.724 56.287 0.030 0.000 1.104 262 K CB 0.391 32.918 32.500 0.045 0.000 0.855 262 K HN 0.320 8.570 8.250 0.000 0.000 0.531 263 S N 0.832 116.546 115.700 0.023 0.000 2.345 263 S HA -0.109 4.361 4.470 -0.002 0.000 0.220 263 S C 2.016 176.624 174.600 0.014 0.000 1.031 263 S CA 1.068 59.281 58.200 0.022 0.000 0.996 263 S CB -0.065 63.121 63.200 -0.023 0.000 0.882 263 S HN 0.028 8.338 8.310 0.000 0.000 0.445 264 V N 2.120 122.034 119.914 -0.001 0.000 2.343 264 V HA -0.202 3.917 4.120 -0.002 0.000 0.247 264 V C 2.625 178.715 176.094 -0.007 0.000 1.051 264 V CA 1.723 64.013 62.300 -0.016 0.000 1.036 264 V CB -1.196 30.619 31.823 -0.013 0.000 0.654 264 V HN 0.537 8.727 8.190 0.000 0.000 0.451 265 A N -0.067 122.758 122.820 0.008 0.000 1.933 265 A HA -0.094 4.225 4.320 -0.002 0.000 0.218 265 A C 2.411 180.007 177.584 0.021 0.000 1.175 265 A CA 1.962 54.007 52.037 0.013 0.000 0.628 265 A CB -0.696 18.312 19.000 0.013 0.000 0.814 265 A HN 0.575 8.725 8.150 0.000 0.000 0.444 266 A N -0.275 122.570 122.820 0.041 0.000 1.933 266 A HA -0.008 4.311 4.320 -0.002 0.000 0.218 266 A C 2.134 179.756 177.584 0.064 0.000 1.175 266 A CA 1.449 53.520 52.037 0.057 0.000 0.628 266 A CB -0.521 18.598 19.000 0.197 0.000 0.814 266 A HN 0.481 8.631 8.150 0.000 0.000 0.444 267 L N -0.679 120.566 121.223 0.036 0.000 2.072 267 L HA -0.114 4.225 4.340 -0.002 0.000 0.205 267 L C 2.772 179.703 176.870 0.102 0.000 1.079 267 L CA 1.331 56.165 54.840 -0.010 0.000 0.752 267 L CB -0.454 41.415 42.059 -0.317 0.000 0.906 267 L HN 0.283 8.513 8.230 0.000 0.000 0.436 268 S N -0.254 115.477 115.700 0.051 0.000 2.399 268 S HA -0.147 4.322 4.470 -0.002 0.000 0.231 268 S C 1.989 176.632 174.600 0.071 0.000 1.022 268 S CA 1.560 59.804 58.200 0.072 0.000 0.983 268 S CB -0.217 63.003 63.200 0.032 0.000 0.803 268 S HN 0.606 8.916 8.310 0.000 0.000 0.480 269 S N 0.142 115.870 115.700 0.047 0.000 2.575 269 S HA 0.250 4.719 4.470 -0.002 0.000 0.215 269 S C 0.629 175.239 174.600 0.016 0.000 0.966 269 S CA 0.311 58.522 58.200 0.020 0.000 0.911 269 S CB -0.121 63.074 63.200 -0.007 0.000 0.780 269 S HN 0.170 8.480 8.310 0.000 0.000 0.514 270 S N 0.868 116.608 115.700 0.068 0.000 3.561 270 S HA -0.199 4.271 4.470 -0.002 0.000 0.318 270 S C 0.949 175.533 174.600 -0.027 0.000 1.181 270 S CA 1.023 59.262 58.200 0.066 0.000 0.916 270 S CB -1.769 61.443 63.200 0.020 0.000 0.966 270 S HN 0.809 9.119 8.310 0.000 0.000 0.550 271 K N -0.472 119.859 120.400 -0.114 0.000 2.147 271 K HA -0.071 4.248 4.320 -0.002 0.000 0.205 271 K C -0.144 176.113 176.600 -0.572 0.000 1.049 271 K CA 1.267 57.333 56.287 -0.368 0.000 0.936 271 K CB 0.096 32.297 32.500 -0.498 0.000 0.722 271 K HN 0.514 8.764 8.250 0.000 0.000 0.446 272 Y N 0.065 120.402 120.300 0.062 0.000 2.462 272 Y HA 0.178 4.727 4.550 -0.002 0.000 0.346 272 Y C 0.396 176.358 175.900 0.102 0.000 0.976 272 Y CA -1.351 56.780 58.100 0.053 0.000 1.044 272 Y CB 1.911 40.387 38.460 0.026 0.000 1.230 272 Y HN -0.079 8.201 8.280 0.000 0.000 0.455 273 D N 1.699 122.233 120.400 0.222 0.000 2.194 273 D HA 0.066 4.705 4.640 -0.002 0.000 0.204 273 D C 0.095 176.514 176.300 0.199 0.000 0.964 273 D CA 1.660 55.760 54.000 0.165 0.000 0.846 273 D CB 0.764 41.609 40.800 0.075 0.000 0.962 273 D HN 0.368 8.738 8.370 0.000 0.000 0.490 274 I N 0.718 121.369 120.570 0.136 0.000 2.656 274 I HA 0.314 4.483 4.170 -0.002 0.000 0.292 274 I C -0.893 175.211 176.117 -0.022 0.000 1.144 274 I CA -0.627 60.705 61.300 0.053 0.000 1.038 274 I CB 2.983 40.975 38.000 -0.012 0.000 1.244 274 I HN -0.316 7.894 8.210 0.000 0.000 0.420 275 I N 5.096 125.626 120.570 -0.068 0.000 2.447 275 I HA 0.379 4.548 4.170 -0.002 0.000 0.287 275 I C -0.649 175.344 176.117 -0.206 0.000 1.023 275 I CA -0.673 60.530 61.300 -0.163 0.000 1.083 275 I CB 1.659 39.557 38.000 -0.171 0.000 1.245 275 I HN 0.490 8.700 8.210 0.000 0.000 0.434 276 N N 3.673 122.242 118.700 -0.218 0.000 2.492 276 N HA 0.410 5.149 4.740 -0.002 0.000 0.289 276 N C 0.844 175.957 175.510 -0.662 0.000 1.133 276 N CA 0.316 53.193 53.050 -0.289 0.000 0.961 276 N CB 1.964 40.444 38.487 -0.012 0.000 1.186 276 N HN 0.945 9.325 8.380 0.000 0.000 0.493 277 G N 0.504 108.920 108.800 -0.641 0.000 2.143 277 G HA2 -0.273 3.686 3.960 -0.002 0.000 0.248 277 G HA3 -0.273 3.686 3.960 -0.002 0.000 0.248 277 G C 0.127 174.690 174.900 -0.562 0.000 0.991 277 G CA -0.045 44.611 45.100 -0.741 0.000 0.689 277 G HN 0.478 8.768 8.290 0.000 0.000 0.522 278 M N 0.935 120.199 119.600 -0.561 0.000 2.239 278 M HA 0.371 4.850 4.480 -0.002 0.000 0.348 278 M C 1.429 177.547 176.300 -0.303 0.000 1.239 278 M CA -0.150 54.897 55.300 -0.423 0.000 1.114 278 M CB 0.987 33.338 32.600 -0.416 0.000 1.641 278 M HN 0.408 8.698 8.290 0.000 0.000 0.453 279 V N 1.049 120.890 119.914 -0.120 0.000 2.963 279 V HA 0.069 4.188 4.120 -0.002 0.000 0.306 279 V C 1.225 177.396 176.094 0.130 0.000 1.077 279 V CA 0.154 62.431 62.300 -0.038 0.000 1.124 279 V CB 0.844 32.640 31.823 -0.045 0.000 0.987 279 V HN 1.079 9.269 8.190 0.000 0.000 0.487 280 S N 1.899 117.653 115.700 0.090 0.000 2.400 280 S HA -0.213 4.257 4.470 -0.002 0.000 0.232 280 S C 1.851 176.518 174.600 0.111 0.000 1.025 280 S CA 1.466 59.731 58.200 0.109 0.000 0.993 280 S CB -1.076 62.138 63.200 0.024 0.000 0.808 280 S HN 1.546 9.856 8.310 0.000 0.000 0.478 281 S N 1.345 117.101 115.700 0.094 0.000 2.474 281 S HA -0.062 4.407 4.470 -0.002 0.000 0.235 281 S C 1.711 176.366 174.600 0.091 0.000 0.997 281 S CA 0.725 58.986 58.200 0.100 0.000 0.949 281 S CB -0.572 62.678 63.200 0.083 0.000 0.766 281 S HN 0.705 9.015 8.310 0.000 0.000 0.517 282 Q N -0.943 118.924 119.800 0.112 0.000 2.360 282 Q HA 0.182 4.521 4.340 -0.002 0.000 0.202 282 Q C 1.142 177.188 176.000 0.076 0.000 0.915 282 Q CA -0.010 55.852 55.803 0.099 0.000 0.943 282 Q CB -0.174 28.635 28.738 0.117 0.000 1.064 282 Q HN 0.657 8.927 8.270 0.000 0.000 0.511 283 Y N 2.113 122.310 120.300 -0.171 0.000 2.165 283 Y HA -0.289 4.260 4.550 -0.002 0.000 0.286 283 Y C 2.147 177.870 175.900 -0.296 0.000 1.155 283 Y CA 1.698 59.496 58.100 -0.502 0.000 1.164 283 Y CB 0.070 38.181 38.460 -0.582 0.000 0.978 283 Y HN -0.071 8.209 8.280 0.000 0.000 0.513 284 K N -0.176 120.107 120.400 -0.195 0.000 2.025 284 K HA -0.207 4.112 4.320 -0.002 0.000 0.207 284 K C 2.125 178.618 176.600 -0.179 0.000 1.049 284 K CA 1.683 57.826 56.287 -0.239 0.000 0.933 284 K CB -0.175 32.248 32.500 -0.128 0.000 0.714 284 K HN 0.448 8.698 8.250 0.000 0.000 0.438 285 Q N 0.057 119.796 119.800 -0.103 0.000 2.112 285 Q HA -0.173 4.166 4.340 -0.002 0.000 0.206 285 Q C 2.114 178.060 176.000 -0.090 0.000 0.987 285 Q CA 1.815 57.575 55.803 -0.073 0.000 0.858 285 Q CB -0.080 28.638 28.738 -0.034 0.000 0.905 285 Q HN 0.177 8.447 8.270 0.000 0.000 0.420 286 V N 1.161 121.013 119.914 -0.103 0.000 2.358 286 V HA -0.231 3.888 4.120 -0.002 0.000 0.246 286 V C 1.996 178.008 176.094 -0.136 0.000 1.047 286 V CA 1.695 63.936 62.300 -0.098 0.000 1.035 286 V CB -0.374 31.456 31.823 0.012 0.000 0.658 286 V HN 0.289 8.479 8.190 0.000 0.000 0.452 287 K N 0.196 120.449 120.400 -0.246 0.000 2.211 287 K HA -0.117 4.202 4.320 -0.002 0.000 0.203 287 K C 1.830 178.347 176.600 -0.138 0.000 1.050 287 K CA 1.171 57.313 56.287 -0.241 0.000 0.945 287 K CB -0.225 32.023 32.500 -0.419 0.000 0.732 287 K HN 0.398 8.648 8.250 0.000 0.000 0.451 288 N N 0.755 119.383 118.700 -0.120 0.000 2.459 288 N HA -0.026 4.713 4.740 -0.002 0.000 0.181 288 N C 0.333 175.824 175.510 -0.032 0.000 1.046 288 N CA 0.567 53.574 53.050 -0.073 0.000 0.904 288 N CB -0.036 38.411 38.487 -0.067 0.000 0.964 288 N HN 0.109 8.489 8.380 0.000 0.000 0.444 289 L N 1.308 122.521 121.223 -0.017 0.000 2.426 289 L HA 0.113 4.452 4.340 -0.002 0.000 0.271 289 L C 0.624 177.550 176.870 0.093 0.000 1.169 289 L CA -0.299 54.568 54.840 0.045 0.000 0.836 289 L CB 0.498 42.586 42.059 0.049 0.000 1.112 289 L HN -0.175 8.055 8.230 0.000 0.000 0.465 290 K N 1.593 122.050 120.400 0.095 0.000 2.144 290 K HA 0.395 4.714 4.320 -0.002 0.000 0.270 290 K C 0.832 177.492 176.600 0.100 0.000 1.005 290 K CA 0.251 56.582 56.287 0.073 0.000 0.932 290 K CB 1.186 33.706 32.500 0.032 0.000 1.021 290 K HN 0.834 9.084 8.250 0.000 0.000 0.462 291 G N 1.228 110.036 108.800 0.013 0.000 2.157 291 G HA2 -0.251 3.708 3.960 -0.002 0.000 0.239 291 G HA3 -0.251 3.708 3.960 -0.002 0.000 0.239 291 G C -0.637 174.064 174.900 -0.331 0.000 0.982 291 G CA -0.040 44.974 45.100 -0.142 0.000 0.650 291 G HN 0.452 8.742 8.290 0.000 0.000 0.527 292 Y N -0.173 120.123 120.300 -0.006 0.000 2.499 292 Y HA 0.652 5.201 4.550 -0.002 0.000 0.347 292 Y C 0.353 176.250 175.900 -0.004 0.000 0.987 292 Y CA -0.972 57.127 58.100 -0.000 0.000 1.044 292 Y CB 1.756 40.222 38.460 0.011 0.000 1.245 292 Y HN 0.101 8.381 8.280 0.000 0.000 0.461 293 K N 1.814 122.295 120.400 0.135 0.000 2.156 293 K HA 0.684 5.003 4.320 -0.002 0.000 0.271 293 K C -1.616 175.053 176.600 0.115 0.000 0.995 293 K CA -0.534 55.803 56.287 0.084 0.000 0.890 293 K CB 0.967 33.490 32.500 0.039 0.000 1.073 293 K HN 0.515 8.765 8.250 0.000 0.000 0.454 294 V N 6.359 126.329 119.914 0.093 0.000 2.334 294 V HA 0.289 4.408 4.120 -0.002 0.000 0.281 294 V C -0.044 176.117 176.094 0.112 0.000 1.016 294 V CA -0.827 61.551 62.300 0.129 0.000 0.832 294 V CB 0.872 32.774 31.823 0.133 0.000 0.999 294 V HN 0.713 8.903 8.190 0.000 0.000 0.439 295 L N 3.846 125.125 121.223 0.095 0.000 2.439 295 L HA 0.899 5.238 4.340 -0.002 0.000 0.259 295 L C 0.814 177.722 176.870 0.064 0.000 1.129 295 L CA -0.161 54.706 54.840 0.045 0.000 0.803 295 L CB 1.238 43.292 42.059 -0.008 0.000 1.161 295 L HN 0.729 8.959 8.230 0.000 0.000 0.462 296 G N 0.508 109.318 108.800 0.016 0.000 2.660 296 G HA2 0.660 4.619 3.960 -0.002 0.000 0.294 296 G HA3 0.660 4.619 3.960 -0.002 0.000 0.294 296 G C -1.889 172.979 174.900 -0.053 0.000 1.369 296 G CA -0.354 44.749 45.100 0.006 0.000 0.912 296 G HN 0.631 8.921 8.290 0.000 0.000 0.479 297 Q N -0.483 119.284 119.800 -0.055 0.000 2.522 297 Q HA 0.378 4.717 4.340 -0.002 0.000 0.285 297 Q C -1.316 174.691 176.000 0.012 0.000 0.982 297 Q CA -0.978 54.787 55.803 -0.063 0.000 0.805 297 Q CB 1.450 30.063 28.738 -0.209 0.000 1.457 297 Q HN 0.485 8.755 8.270 0.000 0.000 0.394 298 Q N 0.747 120.594 119.800 0.079 0.000 2.255 298 Q HA 0.366 4.705 4.340 -0.002 0.000 0.280 298 Q C -0.383 175.702 176.000 0.142 0.000 1.068 298 Q CA 0.326 56.181 55.803 0.086 0.000 0.911 298 Q CB 0.834 29.615 28.738 0.071 0.000 1.157 298 Q HN 0.569 8.839 8.270 0.000 0.000 0.380 299 A N 3.671 126.537 122.820 0.077 0.000 2.401 299 A HA 0.211 4.530 4.320 -0.002 0.000 0.259 299 A C -0.061 177.585 177.584 0.103 0.000 1.103 299 A CA -0.293 51.809 52.037 0.108 0.000 0.789 299 A CB 0.223 19.242 19.000 0.032 0.000 1.035 299 A HN 0.866 9.016 8.150 0.000 0.000 0.491 300 M N 3.642 123.306 119.600 0.107 0.000 2.974 300 M HA 0.372 4.851 4.480 -0.002 0.000 0.301 300 M C -1.234 175.171 176.300 0.175 0.000 1.409 300 M CA 0.289 55.577 55.300 -0.021 0.000 1.515 300 M CB -0.685 31.838 32.600 -0.128 0.000 1.163 300 M HN 0.716 9.006 8.290 0.000 0.000 0.520 301 Y N 3.095 123.435 120.300 0.067 0.000 2.552 301 Y HA 0.678 5.228 4.550 -0.001 0.000 0.337 301 Y C -2.141 173.911 175.900 0.254 0.000 1.094 301 Y CA -1.373 56.828 58.100 0.169 0.000 1.028 301 Y CB 1.322 39.865 38.460 0.138 0.000 1.321 301 Y HN 0.473 8.753 8.280 0.000 0.000 0.456 302 I N 4.253 124.700 120.570 -0.205 0.000 2.692 302 I HA 0.594 4.763 4.170 -0.002 0.000 0.293 302 I C -1.413 174.443 176.117 -0.436 0.000 1.200 302 I CA -0.231 61.027 61.300 -0.069 0.000 1.036 302 I CB 2.224 40.351 38.000 0.212 0.000 1.258 302 I HN 0.644 8.854 8.210 0.000 0.000 0.421 303 S N 7.658 123.232 115.700 -0.210 0.000 2.593 303 S HA 0.975 5.444 4.470 -0.002 0.000 0.297 303 S C -0.742 173.874 174.600 0.026 0.000 1.112 303 S CA -0.649 57.511 58.200 -0.066 0.000 1.043 303 S CB 1.591 64.826 63.200 0.058 0.000 1.054 303 S HN 1.006 9.316 8.310 0.000 0.000 0.516 304 L N -0.595 120.660 121.223 0.054 0.000 2.582 304 L HA 0.626 4.965 4.340 -0.002 0.000 0.257 304 L C -1.145 175.720 176.870 -0.009 0.000 0.974 304 L CA -1.122 53.708 54.840 -0.017 0.000 0.851 304 L CB 2.029 44.057 42.059 -0.051 0.000 1.424 304 L HN 0.828 9.058 8.230 0.000 0.000 0.412 305 M N 2.350 121.875 119.600 -0.126 0.000 2.157 305 M HA 0.506 4.986 4.480 -0.002 0.000 0.354 305 M C -1.763 174.376 176.300 -0.268 0.000 1.170 305 M CA -0.244 54.989 55.300 -0.112 0.000 1.060 305 M CB 0.854 33.324 32.600 -0.216 0.000 1.615 305 M HN 0.637 8.927 8.290 0.000 0.000 0.460 306 Y N 3.500 123.797 120.300 -0.005 0.000 2.361 306 Y HA 0.455 5.004 4.550 -0.002 0.000 0.332 306 Y C -1.098 174.858 175.900 0.092 0.000 1.101 306 Y CA -0.216 57.953 58.100 0.116 0.000 1.137 306 Y CB 1.191 39.904 38.460 0.421 0.000 1.207 306 Y HN 0.474 8.754 8.280 0.000 0.000 0.463 307 Y N 1.064 121.637 120.300 0.456 0.000 2.377 307 Y HA 0.254 4.803 4.550 -0.001 0.000 0.339 307 Y C -0.004 176.003 175.900 0.179 0.000 1.011 307 Y CA -1.865 56.395 58.100 0.265 0.000 1.093 307 Y CB 1.076 39.608 38.460 0.121 0.000 1.201 307 Y HN 0.500 8.780 8.280 0.000 0.000 0.455 308 N N 3.208 121.885 118.700 -0.038 0.000 2.406 308 N HA 0.253 4.992 4.740 -0.002 0.000 0.251 308 N C -0.447 174.983 175.510 -0.134 0.000 1.069 308 N CA 0.168 52.953 53.050 -0.442 0.000 0.947 308 N CB 0.310 37.913 38.487 -1.473 0.000 1.111 308 N HN 0.762 9.142 8.380 0.000 0.000 0.497 309 L N 1.698 122.939 121.223 0.030 0.000 2.966 309 L HA 0.503 4.842 4.340 -0.002 0.000 0.262 309 L C 1.017 177.941 176.870 0.090 0.000 1.165 309 L CA -0.278 54.599 54.840 0.062 0.000 0.978 309 L CB 0.355 42.468 42.059 0.090 0.000 1.337 309 L HN 0.607 8.837 8.230 0.000 0.000 0.563 310 G N -1.020 107.875 108.800 0.157 0.000 2.450 310 G HA2 0.300 4.259 3.960 -0.002 0.000 0.273 310 G HA3 0.300 4.259 3.960 -0.002 0.000 0.273 310 G C -1.817 173.204 174.900 0.201 0.000 1.221 310 G CA -0.392 44.814 45.100 0.175 0.000 0.900 310 G HN 0.088 8.378 8.290 0.000 0.000 0.483 311 H N -1.548 117.470 119.070 -0.088 0.000 2.949 311 H HA 0.653 5.208 4.556 -0.002 0.000 0.356 311 H C -2.080 172.996 175.328 -0.419 0.000 1.212 311 H CA -0.898 54.916 56.048 -0.391 0.000 1.136 311 H CB 1.935 31.590 29.762 -0.179 0.000 1.869 311 H HN 0.530 8.810 8.280 0.000 0.000 0.556 312 Y N 1.476 121.450 120.300 -0.543 0.000 2.331 312 Y HA 0.187 4.736 4.550 -0.001 0.000 0.338 312 Y C -0.511 175.343 175.900 -0.077 0.000 0.976 312 Y CA -0.682 57.254 58.100 -0.274 0.000 1.137 312 Y CB 1.150 39.538 38.460 -0.120 0.000 1.172 312 Y HN 0.688 8.968 8.280 0.000 0.000 0.478 313 D N 5.012 125.052 120.400 -0.601 0.000 2.411 313 D HA 0.259 4.898 4.640 -0.002 0.000 0.225 313 D C 0.543 176.556 176.300 -0.478 0.000 1.156 313 D CA 0.266 54.059 54.000 -0.344 0.000 0.874 313 D CB 1.384 42.017 40.800 -0.279 0.000 1.034 313 D HN 0.770 9.140 8.370 0.000 0.000 0.502 314 A N 4.660 127.391 122.820 -0.148 0.000 1.929 314 A HA -0.146 4.173 4.320 -0.002 0.000 0.216 314 A C 1.970 179.515 177.584 -0.066 0.000 1.176 314 A CA 1.382 53.427 52.037 0.013 0.000 0.628 314 A CB -0.217 18.852 19.000 0.116 0.000 0.816 314 A HN 0.514 8.664 8.150 0.000 0.000 0.444 315 K N 0.708 121.054 120.400 -0.089 0.000 2.057 315 K HA -0.099 4.220 4.320 -0.002 0.000 0.207 315 K C 1.047 177.572 176.600 -0.124 0.000 1.049 315 K CA 1.996 58.221 56.287 -0.103 0.000 0.931 315 K CB -0.191 32.261 32.500 -0.080 0.000 0.714 315 K HN 0.453 8.703 8.250 0.000 0.000 0.440 316 N N 0.095 118.719 118.700 -0.126 0.000 2.236 316 N HA 0.044 4.783 4.740 -0.002 0.000 0.196 316 N C -0.872 174.585 175.510 -0.088 0.000 1.114 316 N CA 0.460 53.449 53.050 -0.103 0.000 0.859 316 N CB 0.682 39.115 38.487 -0.090 0.000 0.982 316 N HN 0.038 8.418 8.380 0.000 0.000 0.493 317 S N 1.057 116.680 115.700 -0.128 0.000 3.484 317 S HA -0.191 4.278 4.470 -0.002 0.000 0.384 317 S C -0.177 174.383 174.600 -0.067 0.000 0.932 317 S CA 0.395 58.588 58.200 -0.011 0.000 1.293 317 S CB -1.331 62.029 63.200 0.267 0.000 0.919 317 S HN 0.520 8.830 8.310 0.000 0.000 0.540 318 I N 0.882 121.178 120.570 -0.457 0.000 2.692 318 I HA 0.286 4.455 4.170 -0.002 0.000 0.293 318 I C -0.858 175.015 176.117 -0.407 0.000 1.200 318 I CA -0.754 60.387 61.300 -0.265 0.000 1.036 318 I CB 1.368 39.286 38.000 -0.136 0.000 1.258 318 I HN 0.116 8.326 8.210 0.000 0.000 0.421 319 N N 5.922 124.569 118.700 -0.090 0.000 2.497 319 N HA 0.270 5.009 4.740 -0.002 0.000 0.268 319 N C -1.021 174.408 175.510 -0.134 0.000 1.171 319 N CA -0.023 53.013 53.050 -0.023 0.000 0.948 319 N CB 1.935 40.497 38.487 0.126 0.000 1.069 319 N HN 0.258 8.638 8.380 0.000 0.000 0.460 320 V N 2.652 122.409 119.914 -0.262 0.000 2.376 320 V HA 0.158 4.277 4.120 -0.002 0.000 0.287 320 V C 0.414 176.441 176.094 -0.112 0.000 1.015 320 V CA -0.670 61.477 62.300 -0.255 0.000 0.834 320 V CB 1.513 33.036 31.823 -0.499 0.000 1.001 320 V HN 0.593 8.783 8.190 0.000 0.000 0.428 321 Q N 3.552 123.341 119.800 -0.017 0.000 3.181 321 Q HA 0.129 4.468 4.340 -0.002 0.000 0.293 321 Q C 0.123 176.150 176.000 0.044 0.000 1.406 321 Q CA -0.151 55.669 55.803 0.029 0.000 1.026 321 Q CB 0.206 28.953 28.738 0.014 0.000 1.630 321 Q HN 0.939 9.209 8.270 0.000 0.000 0.553 322 D N 0.485 120.929 120.400 0.072 0.000 2.513 322 D HA 0.031 4.670 4.640 -0.002 0.000 0.222 322 D C 0.027 176.372 176.300 0.074 0.000 1.210 322 D CA -0.412 53.637 54.000 0.081 0.000 0.825 322 D CB 0.124 40.990 40.800 0.111 0.000 1.037 322 D HN 0.200 8.570 8.370 0.000 0.000 0.506 323 R N 1.236 121.776 120.500 0.067 0.000 2.389 323 R HA 0.209 4.548 4.340 -0.002 0.000 0.295 323 R C -0.269 176.043 176.300 0.020 0.000 1.075 323 R CA -0.313 55.808 56.100 0.035 0.000 1.005 323 R CB 0.623 30.931 30.300 0.013 0.000 0.987 323 R HN -0.146 8.124 8.270 0.000 0.000 0.452 324 K N 2.837 123.243 120.400 0.011 0.000 2.285 324 K HA 0.153 4.472 4.320 -0.002 0.000 0.286 324 K C -0.534 176.070 176.600 0.007 0.000 1.072 324 K CA 0.002 56.298 56.287 0.015 0.000 0.913 324 K CB 1.557 34.066 32.500 0.015 0.000 1.067 324 K HN 0.579 8.829 8.250 0.000 0.000 0.479 325 T N 1.960 116.523 114.554 0.015 0.000 2.893 325 T HA 0.222 4.571 4.350 -0.002 0.000 0.337 325 T C -2.436 172.277 174.700 0.021 0.000 1.587 325 T CA -1.406 60.693 62.100 -0.002 0.000 1.066 325 T CB 1.319 70.158 68.868 -0.048 0.000 1.414 325 T HN 0.138 8.378 8.240 0.000 0.000 0.488 326 P HA 0.058 4.478 4.420 0.000 0.000 0.218 326 P C 1.501 178.744 177.300 -0.094 0.000 1.146 326 P CA 0.853 63.966 63.100 0.023 0.000 0.813 326 P CB 0.021 31.596 31.700 -0.208 0.000 0.778 327 L N -1.012 120.114 121.223 -0.162 0.000 2.549 327 L HA -0.143 4.196 4.340 -0.002 0.000 0.229 327 L C 2.254 179.062 176.870 -0.105 0.000 1.158 327 L CA 0.976 55.676 54.840 -0.233 0.000 0.842 327 L CB -0.809 41.079 42.059 -0.286 0.000 0.952 327 L HN 0.068 8.298 8.230 0.000 0.000 0.452 328 Q N -0.389 119.400 119.800 -0.017 0.000 2.291 328 Q HA -0.105 4.234 4.340 -0.002 0.000 0.206 328 Q C -0.024 176.008 176.000 0.053 0.000 0.976 328 Q CA 0.605 56.432 55.803 0.041 0.000 0.875 328 Q CB 0.042 28.814 28.738 0.056 0.000 0.927 328 Q HN 0.423 8.693 8.270 0.000 0.000 0.450 329 D N 0.721 121.148 120.400 0.046 0.000 2.336 329 D HA -0.030 4.609 4.640 -0.002 0.000 0.249 329 D C 0.559 176.863 176.300 0.007 0.000 1.213 329 D CA 0.182 54.228 54.000 0.076 0.000 0.870 329 D CB 1.259 42.177 40.800 0.197 0.000 1.076 329 D HN 0.169 8.539 8.370 0.000 0.000 0.483 330 Q N 2.956 122.766 119.800 0.017 0.000 2.133 330 Q HA -0.271 4.068 4.340 -0.002 0.000 0.208 330 Q C 0.974 176.966 176.000 -0.012 0.000 0.991 330 Q CA 1.665 57.458 55.803 -0.017 0.000 0.867 330 Q CB 0.178 28.908 28.738 -0.014 0.000 0.911 330 Q HN 0.308 8.578 8.270 0.000 0.000 0.417 331 N N -0.602 118.116 118.700 0.031 0.000 2.149 331 N HA -0.142 4.597 4.740 -0.002 0.000 0.188 331 N C 1.615 177.127 175.510 0.004 0.000 1.019 331 N CA 1.383 54.465 53.050 0.055 0.000 0.857 331 N CB -0.263 38.284 38.487 0.099 0.000 0.997 331 N HN 0.086 8.466 8.380 0.000 0.000 0.426 332 V N 1.140 121.011 119.914 -0.073 0.000 2.295 332 V HA -0.211 3.908 4.120 -0.002 0.000 0.246 332 V C 2.227 178.150 176.094 -0.286 0.000 1.049 332 V CA 1.557 63.719 62.300 -0.230 0.000 1.024 332 V CB -0.394 31.209 31.823 -0.366 0.000 0.648 332 V HN 0.299 8.489 8.190 0.000 0.000 0.447 333 R N -0.259 120.045 120.500 -0.326 0.000 2.083 333 R HA -0.222 4.117 4.340 -0.002 0.000 0.237 333 R C 2.421 178.621 176.300 -0.167 0.000 1.137 333 R CA 1.900 57.736 56.100 -0.440 0.000 0.951 333 R CB -0.403 29.714 30.300 -0.305 0.000 0.851 333 R HN 0.617 8.887 8.270 0.000 0.000 0.434 334 Q N -0.030 119.730 119.800 -0.067 0.000 2.079 334 Q HA -0.086 4.253 4.340 -0.002 0.000 0.200 334 Q C 2.253 178.337 176.000 0.139 0.000 0.974 334 Q CA 1.440 57.270 55.803 0.046 0.000 0.840 334 Q CB -0.133 28.737 28.738 0.220 0.000 0.898 334 Q HN 0.368 8.638 8.270 0.000 0.000 0.430 335 A N 0.992 123.899 122.820 0.146 0.000 1.902 335 A HA -0.180 4.139 4.320 -0.002 0.000 0.217 335 A C 2.031 179.721 177.584 0.177 0.000 1.181 335 A CA 1.191 53.353 52.037 0.207 0.000 0.623 335 A CB -0.648 18.411 19.000 0.098 0.000 0.818 335 A HN 0.310 8.460 8.150 0.000 0.000 0.443 336 I N -0.377 120.213 120.570 0.035 0.000 2.286 336 I HA -0.187 3.982 4.170 -0.002 0.000 0.248 336 I C 2.632 178.895 176.117 0.243 0.000 1.115 336 I CA 0.985 62.321 61.300 0.060 0.000 1.392 336 I CB -0.500 37.343 38.000 -0.262 0.000 1.065 336 I HN 0.413 8.623 8.210 0.000 0.000 0.418 337 G N 0.041 108.841 108.800 0.000 0.000 2.404 337 G HA2 -0.258 3.701 3.960 -0.002 0.000 0.215 337 G HA3 -0.258 3.701 3.960 -0.002 0.000 0.215 337 G C 1.408 176.338 174.900 0.051 0.000 1.174 337 G CA 0.528 45.490 45.100 -0.230 0.000 0.780 337 G HN 0.266 8.556 8.290 0.000 0.000 0.537 338 Y N 1.212 121.693 120.300 0.301 0.000 2.421 338 Y HA 0.147 4.696 4.550 -0.002 0.000 0.292 338 Y C 2.962 178.971 175.900 0.182 0.000 1.136 338 Y CA 0.358 58.624 58.100 0.276 0.000 1.255 338 Y CB -0.242 38.348 38.460 0.215 0.000 0.991 338 Y HN 0.272 8.552 8.280 0.000 0.000 0.552 339 A N -0.022 123.001 122.820 0.337 0.000 2.067 339 A HA -0.009 4.310 4.320 -0.002 0.000 0.217 339 A C 1.367 179.017 177.584 0.111 0.000 1.156 339 A CA 0.041 52.227 52.037 0.247 0.000 0.683 339 A CB -0.286 18.928 19.000 0.357 0.000 0.808 339 A HN 0.180 8.330 8.150 0.000 0.000 0.455 340 R N 1.258 121.805 120.500 0.078 0.000 2.694 340 R HA 0.099 4.438 4.340 -0.002 0.000 0.268 340 R C -0.609 175.750 176.300 0.098 0.000 1.061 340 R CA 0.231 56.309 56.100 -0.037 0.000 1.133 340 R CB 0.157 30.305 30.300 -0.254 0.000 1.020 340 R HN 0.555 8.825 8.270 0.000 0.000 0.475 341 N N 1.646 120.462 118.700 0.193 0.000 3.040 341 N HA 0.035 4.774 4.740 -0.002 0.000 0.305 341 N C 0.451 176.087 175.510 0.211 0.000 1.611 341 N CA -0.219 52.927 53.050 0.159 0.000 1.049 341 N CB 0.778 39.318 38.487 0.088 0.000 1.342 341 N HN 0.213 8.593 8.380 0.000 0.000 0.497 342 V N 0.450 120.484 119.914 0.199 0.000 2.427 342 V HA -0.201 3.918 4.120 -0.002 0.000 0.248 342 V C 2.539 178.712 176.094 0.132 0.000 1.051 342 V CA 2.181 64.601 62.300 0.200 0.000 1.048 342 V CB -0.808 31.081 31.823 0.110 0.000 0.666 342 V HN 0.609 8.799 8.190 0.000 0.000 0.456 343 A N -0.306 122.569 122.820 0.092 0.000 1.877 343 A HA -0.247 4.072 4.320 -0.002 0.000 0.216 343 A C 2.192 179.806 177.584 0.051 0.000 1.186 343 A CA 1.890 53.965 52.037 0.064 0.000 0.620 343 A CB -0.483 18.547 19.000 0.050 0.000 0.822 343 A HN 0.606 8.756 8.150 0.000 0.000 0.443 344 E N -0.411 119.817 120.200 0.047 0.000 2.085 344 E HA -0.143 4.206 4.350 -0.002 0.000 0.194 344 E C 2.026 178.631 176.600 0.008 0.000 0.994 344 E CA 1.374 57.781 56.400 0.012 0.000 0.801 344 E CB -0.301 29.402 29.700 0.004 0.000 0.743 344 E HN 0.409 8.769 8.360 0.000 0.000 0.453 345 V N 1.921 121.877 119.914 0.069 0.000 2.295 345 V HA -0.249 3.870 4.120 -0.002 0.000 0.246 345 V C 1.737 177.939 176.094 0.180 0.000 1.049 345 V CA 2.013 64.407 62.300 0.156 0.000 1.024 345 V CB -0.424 31.489 31.823 0.151 0.000 0.648 345 V HN 0.186 8.376 8.190 0.000 0.000 0.447 346 D N 0.116 120.593 120.400 0.128 0.000 2.117 346 D HA -0.129 4.510 4.640 -0.002 0.000 0.197 346 D C 2.062 178.396 176.300 0.057 0.000 0.987 346 D CA 1.072 55.136 54.000 0.107 0.000 0.829 346 D CB -0.430 40.420 40.800 0.084 0.000 0.961 346 D HN 0.373 8.743 8.370 0.000 0.000 0.460 347 N N 0.650 119.360 118.700 0.016 0.000 2.120 347 N HA -0.145 4.594 4.740 -0.002 0.000 0.188 347 N C 1.650 177.107 175.510 -0.089 0.000 1.024 347 N CA 0.759 53.793 53.050 -0.025 0.000 0.852 347 N CB -0.177 38.292 38.487 -0.031 0.000 1.003 347 N HN 0.273 8.653 8.380 0.000 0.000 0.424 348 K N -0.717 119.574 120.400 -0.182 0.000 2.103 348 K HA 0.006 4.325 4.320 -0.002 0.000 0.204 348 K C 0.794 177.108 176.600 -0.476 0.000 1.052 348 K CA 1.080 57.101 56.287 -0.443 0.000 0.945 348 K CB 0.070 32.095 32.500 -0.790 0.000 0.722 348 K HN 0.052 8.302 8.250 0.000 0.000 0.443 349 F N -0.909 119.033 119.950 -0.013 0.000 2.711 349 F HA 0.132 4.658 4.527 -0.002 0.000 0.296 349 F C 2.044 177.843 175.800 -0.001 0.000 1.096 349 F CA 0.139 58.132 58.000 -0.012 0.000 1.280 349 F CB 0.430 39.419 39.000 -0.020 0.000 1.060 349 F HN 0.013 8.313 8.300 0.000 0.000 0.608 350 S N -0.643 115.154 115.700 0.161 0.000 2.575 350 S HA 0.019 4.488 4.470 -0.002 0.000 0.215 350 S C 0.544 175.185 174.600 0.068 0.000 0.966 350 S CA 0.032 58.294 58.200 0.103 0.000 0.911 350 S CB -0.662 62.585 63.200 0.078 0.000 0.780 350 S HN 0.367 8.677 8.310 0.000 0.000 0.514 351 N N 1.372 120.114 118.700 0.071 0.000 2.721 351 N HA -0.192 4.547 4.740 -0.002 0.000 0.249 351 N C 0.873 176.438 175.510 0.091 0.000 1.072 351 N CA 1.061 54.163 53.050 0.087 0.000 0.710 351 N CB -1.851 36.725 38.487 0.148 0.000 0.993 351 N HN 1.068 9.448 8.380 0.000 0.000 0.547 352 G N -1.218 107.611 108.800 0.048 0.000 2.184 352 G HA2 -0.348 3.611 3.960 -0.002 0.000 0.264 352 G HA3 -0.348 3.611 3.960 -0.002 0.000 0.264 352 G C 0.885 175.788 174.900 0.004 0.000 0.975 352 G CA 0.598 45.719 45.100 0.036 0.000 0.642 352 G HN 0.442 8.732 8.290 0.000 0.000 0.536 353 L N 0.418 121.619 121.223 -0.037 0.000 2.375 353 L HA 0.260 4.599 4.340 -0.002 0.000 0.215 353 L C 1.181 178.033 176.870 -0.030 0.000 1.108 353 L CA 0.838 55.622 54.840 -0.094 0.000 0.830 353 L CB 0.189 42.128 42.059 -0.201 0.000 0.959 353 L HN 0.210 8.441 8.230 0.000 0.000 0.457 354 S N -0.615 115.091 115.700 0.010 0.000 2.451 354 S HA 0.462 4.931 4.470 -0.002 0.000 0.301 354 S C -0.139 174.504 174.600 0.071 0.000 1.116 354 S CA -0.413 57.816 58.200 0.049 0.000 1.093 354 S CB 1.823 65.057 63.200 0.057 0.000 1.017 354 S HN -0.007 8.303 8.310 0.000 0.000 0.482 355 T N 4.833 119.449 114.554 0.103 0.000 2.812 355 T HA 0.424 4.773 4.350 -0.002 0.000 0.282 355 T C -2.775 171.949 174.700 0.040 0.000 0.990 355 T CA -1.549 60.611 62.100 0.100 0.000 0.960 355 T CB 1.495 70.463 68.868 0.166 0.000 0.948 355 T HN 0.197 8.437 8.240 0.000 0.000 0.438 356 P HA 0.208 4.628 4.420 0.000 0.000 0.261 356 P C -0.784 176.399 177.300 -0.194 0.000 1.183 356 P CA -0.120 62.947 63.100 -0.055 0.000 0.761 356 P CB 0.248 31.947 31.700 -0.001 0.000 0.785 357 A N 3.752 126.314 122.820 -0.429 0.000 2.388 357 A HA 0.153 4.472 4.320 -0.002 0.000 0.257 357 A C 1.360 178.744 177.584 -0.333 0.000 1.095 357 A CA -0.384 51.119 52.037 -0.891 0.000 0.791 357 A CB 0.041 18.311 19.000 -1.217 0.000 1.029 357 A HN 0.653 8.803 8.150 0.000 0.000 0.489 358 N N 0.610 119.223 118.700 -0.146 0.000 2.373 358 N HA 0.002 4.741 4.740 -0.002 0.000 0.181 358 N C 0.203 175.740 175.510 0.045 0.000 1.082 358 N CA 0.915 53.971 53.050 0.011 0.000 0.885 358 N CB 0.011 38.552 38.487 0.091 0.000 0.977 358 N HN 0.825 9.205 8.380 0.000 0.000 0.462 359 S N -1.248 114.509 115.700 0.096 0.000 2.661 359 S HA 0.383 4.852 4.470 -0.002 0.000 0.268 359 S C 0.022 174.760 174.600 0.230 0.000 1.162 359 S CA -0.869 57.414 58.200 0.138 0.000 0.817 359 S CB 0.147 63.452 63.200 0.174 0.000 1.141 359 S HN -0.046 8.264 8.310 0.000 0.000 0.477 360 L N 0.495 121.838 121.223 0.200 0.000 2.558 360 L HA 0.360 4.700 4.340 -0.002 0.000 0.225 360 L C -0.183 176.924 176.870 0.394 0.000 1.128 360 L CA 0.279 55.288 54.840 0.282 0.000 0.868 360 L CB -0.188 42.003 42.059 0.221 0.000 1.006 360 L HN 0.510 8.740 8.230 0.000 0.000 0.454 361 I N 2.244 123.043 120.570 0.382 0.000 2.312 361 I HA 0.297 4.466 4.170 -0.002 0.000 0.290 361 I C -2.101 174.087 176.117 0.118 0.000 1.008 361 I CA -2.355 59.127 61.300 0.303 0.000 1.226 361 I CB 0.823 38.962 38.000 0.233 0.000 1.371 361 I HN -0.175 8.035 8.210 0.000 0.000 0.468 362 P HA 0.345 4.765 4.420 0.000 0.000 0.278 362 P C -2.354 174.636 177.300 -0.517 0.000 1.258 362 P CA -1.671 61.059 63.100 -0.617 0.000 0.811 362 P CB 0.578 32.108 31.700 -0.283 0.000 1.063 363 P HA -0.058 4.362 4.420 0.000 0.000 0.218 363 P C 1.757 178.905 177.300 -0.253 0.000 1.148 363 P CA 0.901 63.793 63.100 -0.347 0.000 0.822 363 P CB -0.238 31.295 31.700 -0.279 0.000 0.784 364 I N -1.646 118.721 120.570 -0.339 0.000 2.315 364 I HA -0.210 3.959 4.170 -0.002 0.000 0.251 364 I C 0.294 176.215 176.117 -0.326 0.000 1.125 364 I CA 1.214 62.298 61.300 -0.360 0.000 1.392 364 I CB -0.111 37.592 38.000 -0.496 0.000 1.065 364 I HN -0.222 7.988 8.210 0.000 0.000 0.424 365 F N 1.719 121.618 119.950 -0.085 0.000 2.660 365 F HA 0.193 4.719 4.527 -0.001 0.000 0.342 365 F C 1.557 177.276 175.800 -0.134 0.000 1.195 365 F CA -0.302 57.650 58.000 -0.081 0.000 1.300 365 F CB -0.672 38.286 39.000 -0.069 0.000 1.616 365 F HN -0.020 8.280 8.300 0.000 0.000 0.592 366 K N 0.746 121.136 120.400 -0.016 0.000 2.147 366 K HA -0.196 4.123 4.320 -0.002 0.000 0.205 366 K C 1.457 177.971 176.600 -0.142 0.000 1.049 366 K CA 1.462 57.703 56.287 -0.077 0.000 0.936 366 K CB 0.136 32.590 32.500 -0.078 0.000 0.722 366 K HN 0.505 8.755 8.250 0.000 0.000 0.446 367 Q N -0.921 118.711 119.800 -0.280 0.000 2.291 367 Q HA -0.108 4.231 4.340 -0.002 0.000 0.206 367 Q C 0.905 176.524 176.000 -0.633 0.000 0.976 367 Q CA 1.298 56.772 55.803 -0.549 0.000 0.875 367 Q CB 0.072 28.304 28.738 -0.843 0.000 0.927 367 Q HN 0.358 8.628 8.270 0.000 0.000 0.450 368 F N -0.171 119.711 119.950 -0.114 0.000 2.688 368 F HA 0.147 4.673 4.527 -0.001 0.000 0.310 368 F C 0.808 176.542 175.800 -0.109 0.000 1.098 368 F CA -0.657 57.215 58.000 -0.213 0.000 1.228 368 F CB 0.809 39.370 39.000 -0.731 0.000 1.042 368 F HN -0.104 8.196 8.300 0.000 0.000 0.557 369 T N -2.290 112.296 114.554 0.054 0.000 2.902 369 T HA 0.580 4.929 4.350 -0.002 0.000 0.280 369 T C -0.127 174.612 174.700 0.065 0.000 0.992 369 T CA -0.682 61.457 62.100 0.064 0.000 1.015 369 T CB 2.056 70.934 68.868 0.016 0.000 1.044 369 T HN -0.021 8.219 8.240 0.000 0.000 0.520 370 S N -0.205 115.542 115.700 0.078 0.000 2.603 370 S HA 0.395 4.864 4.470 -0.002 0.000 0.274 370 S C 1.015 175.654 174.600 0.065 0.000 1.168 370 S CA -0.171 58.068 58.200 0.065 0.000 0.963 370 S CB 1.316 64.560 63.200 0.073 0.000 1.078 370 S HN 1.067 9.377 8.310 0.000 0.000 0.477 371 S N 3.168 118.898 115.700 0.050 0.000 2.507 371 S HA -0.103 4.366 4.470 -0.002 0.000 0.235 371 S C 2.059 176.683 174.600 0.040 0.000 0.988 371 S CA 1.361 59.590 58.200 0.048 0.000 0.944 371 S CB -0.631 62.592 63.200 0.038 0.000 0.762 371 S HN 1.119 9.429 8.310 0.000 0.000 0.526 372 S N 1.232 116.954 115.700 0.037 0.000 2.387 372 S HA -0.044 4.425 4.470 -0.002 0.000 0.230 372 S C 0.766 175.383 174.600 0.028 0.000 1.035 372 S CA 0.754 58.972 58.200 0.029 0.000 1.014 372 S CB -1.026 62.191 63.200 0.029 0.000 0.836 372 S HN 0.368 8.678 8.310 0.000 0.000 0.466 373 V N 3.423 123.361 119.914 0.041 0.000 2.488 373 V HA 0.336 4.455 4.120 -0.002 0.000 0.277 373 V C -0.043 176.062 176.094 0.019 0.000 1.046 373 V CA -0.313 62.006 62.300 0.031 0.000 0.986 373 V CB 0.915 32.770 31.823 0.053 0.000 0.989 373 V HN 0.324 8.514 8.190 0.000 0.000 0.475 374 K N 4.079 124.470 120.400 -0.013 0.000 2.206 374 K HA 0.673 4.992 4.320 -0.002 0.000 0.264 374 K C 0.401 176.939 176.600 -0.104 0.000 0.967 374 K CA -0.194 56.069 56.287 -0.040 0.000 0.844 374 K CB 2.055 34.530 32.500 -0.042 0.000 1.099 374 K HN 0.765 9.015 8.250 0.000 0.000 0.441 375 G N 0.632 109.355 108.800 -0.128 0.000 3.356 375 G HA2 0.260 4.219 3.960 -0.002 0.000 0.178 375 G HA3 0.260 4.219 3.960 -0.002 0.000 0.178 375 G C -0.627 174.006 174.900 -0.446 0.000 1.175 375 G CA -0.169 44.785 45.100 -0.243 0.000 0.840 375 G HN 0.487 8.777 8.290 0.000 0.000 0.658 376 Y N 1.163 121.403 120.300 -0.099 0.000 2.696 376 Y HA 0.221 4.770 4.550 -0.002 0.000 0.260 376 Y C 2.172 178.054 175.900 -0.030 0.000 1.165 376 Y CA -0.118 57.912 58.100 -0.118 0.000 1.189 376 Y CB 0.803 39.110 38.460 -0.255 0.000 1.180 376 Y HN 0.471 8.751 8.280 0.000 0.000 0.538 377 E N 1.133 121.365 120.200 0.054 0.000 2.418 377 E HA -0.132 4.217 4.350 -0.002 0.000 0.197 377 E C 0.221 176.859 176.600 0.064 0.000 1.026 377 E CA 0.603 57.028 56.400 0.042 0.000 0.862 377 E CB 0.204 29.910 29.700 0.010 0.000 0.799 377 E HN 0.336 8.696 8.360 0.000 0.000 0.518 378 K N 1.365 121.817 120.400 0.087 0.000 2.323 378 K HA 0.118 4.437 4.320 -0.002 0.000 0.259 378 K C -0.522 176.165 176.600 0.144 0.000 0.947 378 K CA -0.616 55.726 56.287 0.092 0.000 0.819 378 K CB 1.523 34.062 32.500 0.065 0.000 1.109 378 K HN -0.092 8.158 8.250 0.000 0.000 0.429 379 Q N 2.656 122.530 119.800 0.123 0.000 2.330 379 Q HA -0.059 4.280 4.340 -0.002 0.000 0.279 379 Q C -1.061 175.016 176.000 0.128 0.000 1.024 379 Q CA 0.709 56.598 55.803 0.144 0.000 0.900 379 Q CB 0.628 29.427 28.738 0.102 0.000 1.221 379 Q HN 0.509 8.779 8.270 0.000 0.000 0.396 380 D N 4.767 125.265 120.400 0.163 0.000 2.429 380 D HA 0.150 4.789 4.640 -0.002 0.000 0.255 380 D C 0.364 176.706 176.300 0.070 0.000 1.257 380 D CA -0.161 53.871 54.000 0.054 0.000 0.890 380 D CB 0.435 41.179 40.800 -0.093 0.000 1.267 380 D HN 0.684 9.054 8.370 0.000 0.000 0.521 381 L N 1.026 122.292 121.223 0.072 0.000 2.093 381 L HA -0.090 4.249 4.340 -0.002 0.000 0.208 381 L C 1.545 178.444 176.870 0.048 0.000 1.085 381 L CA 0.873 55.761 54.840 0.080 0.000 0.755 381 L CB 0.049 42.149 42.059 0.068 0.000 0.904 381 L HN 0.219 8.449 8.230 0.000 0.000 0.435 382 D N 0.134 120.543 120.400 0.014 0.000 2.097 382 D HA -0.206 4.433 4.640 -0.002 0.000 0.195 382 D C 2.089 178.377 176.300 -0.021 0.000 0.989 382 D CA 1.168 55.167 54.000 -0.002 0.000 0.827 382 D CB -0.050 40.740 40.800 -0.016 0.000 0.966 382 D HN 0.209 8.579 8.370 0.000 0.000 0.456 383 K N 0.661 121.015 120.400 -0.076 0.000 2.057 383 K HA -0.100 4.219 4.320 -0.002 0.000 0.207 383 K C 2.013 178.589 176.600 -0.041 0.000 1.049 383 K CA 1.269 57.473 56.287 -0.139 0.000 0.931 383 K CB -0.051 32.213 32.500 -0.392 0.000 0.714 383 K HN 0.029 8.279 8.250 0.000 0.000 0.440 384 A N 1.763 124.608 122.820 0.042 0.000 1.865 384 A HA -0.220 4.099 4.320 -0.002 0.000 0.217 384 A C 1.895 179.540 177.584 0.103 0.000 1.191 384 A CA 1.888 54.012 52.037 0.145 0.000 0.623 384 A CB -0.797 18.327 19.000 0.207 0.000 0.826 384 A HN 0.404 8.554 8.150 0.000 0.000 0.444 385 N N -0.284 118.464 118.700 0.080 0.000 2.104 385 N HA -0.176 4.563 4.740 -0.002 0.000 0.190 385 N C 1.760 177.308 175.510 0.064 0.000 1.024 385 N CA 1.660 54.754 53.050 0.073 0.000 0.853 385 N CB -0.335 38.188 38.487 0.059 0.000 1.008 385 N HN 0.686 9.066 8.380 0.000 0.000 0.424 386 K N 1.181 121.606 120.400 0.043 0.000 2.026 386 K HA -0.064 4.255 4.320 -0.002 0.000 0.208 386 K C 2.176 178.808 176.600 0.053 0.000 1.048 386 K CA 0.831 57.139 56.287 0.034 0.000 0.929 386 K CB -0.156 32.348 32.500 0.006 0.000 0.713 386 K HN 0.060 8.310 8.250 0.000 0.000 0.439 387 L N 0.928 122.188 121.223 0.062 0.000 2.042 387 L HA -0.227 4.112 4.340 -0.002 0.000 0.210 387 L C 2.421 179.358 176.870 0.111 0.000 1.076 387 L CA 1.181 56.072 54.840 0.085 0.000 0.749 387 L CB -0.340 41.785 42.059 0.111 0.000 0.893 387 L HN 0.257 8.487 8.230 0.000 0.000 0.432 388 L N -0.970 120.325 121.223 0.119 0.000 2.072 388 L HA -0.186 4.153 4.340 -0.002 0.000 0.205 388 L C 2.244 179.231 176.870 0.196 0.000 1.079 388 L CA 0.896 55.840 54.840 0.174 0.000 0.752 388 L CB -0.577 41.562 42.059 0.134 0.000 0.906 388 L HN 0.233 8.463 8.230 0.000 0.000 0.436 389 D N 0.337 120.814 120.400 0.129 0.000 2.104 389 D HA -0.200 4.439 4.640 -0.002 0.000 0.194 389 D C 2.100 178.448 176.300 0.080 0.000 0.994 389 D CA 1.280 55.338 54.000 0.098 0.000 0.830 389 D CB -0.066 40.773 40.800 0.066 0.000 0.959 389 D HN 0.349 8.719 8.370 0.000 0.000 0.452 390 E N -0.057 120.187 120.200 0.073 0.000 2.204 390 E HA -0.170 4.179 4.350 -0.002 0.000 0.195 390 E C 0.933 177.570 176.600 0.060 0.000 0.990 390 E CA 0.862 57.295 56.400 0.055 0.000 0.821 390 E CB 0.035 29.764 29.700 0.048 0.000 0.750 390 E HN 0.154 8.514 8.360 0.000 0.000 0.477 391 D N -1.273 119.189 120.400 0.105 0.000 2.328 391 D HA 0.059 4.698 4.640 -0.002 0.000 0.221 391 D C 0.761 177.078 176.300 0.028 0.000 1.072 391 D CA 0.642 54.711 54.000 0.115 0.000 0.850 391 D CB 0.319 41.262 40.800 0.238 0.000 0.922 391 D HN 0.217 8.587 8.370 0.000 0.000 0.516 392 G N -0.039 108.761 108.800 0.001 0.000 2.143 392 G HA2 -0.277 3.682 3.960 -0.002 0.000 0.249 392 G HA3 -0.277 3.682 3.960 -0.002 0.000 0.249 392 G C -0.114 174.661 174.900 -0.210 0.000 0.981 392 G CA -0.145 44.883 45.100 -0.119 0.000 0.665 392 G HN 0.278 8.568 8.290 0.000 0.000 0.528 393 W N 1.794 123.103 121.300 0.014 0.000 2.226 393 W HA 0.542 5.202 4.660 -0.001 0.000 0.379 393 W C 0.881 177.416 176.519 0.027 0.000 0.923 393 W CA -0.672 56.684 57.345 0.019 0.000 1.524 393 W CB 0.577 30.048 29.460 0.018 0.000 1.552 393 W HN 0.148 8.328 8.180 0.000 0.000 0.337 394 K N 2.691 123.178 120.400 0.145 0.000 2.276 394 K HA 0.233 4.552 4.320 -0.002 0.000 0.283 394 K C -0.174 176.504 176.600 0.130 0.000 1.044 394 K CA -0.879 55.472 56.287 0.106 0.000 0.944 394 K CB 0.701 33.226 32.500 0.043 0.000 1.012 394 K HN 0.255 8.505 8.250 0.000 0.000 0.472 395 L N 4.677 125.965 121.223 0.109 0.000 2.462 395 L HA 0.058 4.397 4.340 -0.002 0.000 0.272 395 L C -0.262 176.653 176.870 0.075 0.000 1.166 395 L CA 0.422 55.320 54.840 0.097 0.000 0.880 395 L CB 0.192 42.291 42.059 0.067 0.000 1.142 395 L HN 0.621 8.851 8.230 0.000 0.000 0.473 396 N N 4.274 123.026 118.700 0.087 0.000 2.415 396 N HA 0.075 4.814 4.740 -0.002 0.000 0.246 396 N C 0.475 176.009 175.510 0.040 0.000 1.078 396 N CA 0.125 53.216 53.050 0.068 0.000 0.942 396 N CB 0.718 39.260 38.487 0.092 0.000 1.140 396 N HN 0.628 9.008 8.380 0.000 0.000 0.501 397 K N 1.314 121.730 120.400 0.027 0.000 2.439 397 K HA 0.020 4.339 4.320 -0.002 0.000 0.197 397 K C 1.346 177.950 176.600 0.007 0.000 1.041 397 K CA 0.535 56.828 56.287 0.010 0.000 0.970 397 K CB 0.326 32.832 32.500 0.010 0.000 0.773 397 K HN 0.410 8.660 8.250 0.000 0.000 0.479 398 S N 0.248 115.960 115.700 0.020 0.000 2.357 398 S HA -0.101 4.368 4.470 -0.002 0.000 0.221 398 S C 2.113 176.727 174.600 0.023 0.000 1.031 398 S CA 1.773 59.987 58.200 0.023 0.000 0.982 398 S CB -0.075 63.145 63.200 0.033 0.000 0.853 398 S HN 0.542 8.852 8.310 0.000 0.000 0.458 399 T N -2.165 112.412 114.554 0.039 0.000 3.037 399 T HA 0.396 4.745 4.350 -0.002 0.000 0.252 399 T C 1.553 176.209 174.700 -0.074 0.000 1.073 399 T CA 0.936 63.077 62.100 0.067 0.000 1.091 399 T CB 0.116 69.092 68.868 0.180 0.000 0.935 399 T HN 0.566 8.806 8.240 0.000 0.000 0.488 400 G N 0.561 109.283 108.800 -0.130 0.000 2.159 400 G HA2 -0.214 3.745 3.960 -0.002 0.000 0.256 400 G HA3 -0.214 3.745 3.960 -0.002 0.000 0.256 400 G C -0.235 174.377 174.900 -0.480 0.000 0.977 400 G CA 0.338 45.247 45.100 -0.317 0.000 0.652 400 G HN 0.635 8.925 8.290 0.000 0.000 0.531 401 Y N -0.347 119.993 120.300 0.067 0.000 2.562 401 Y HA 0.742 5.291 4.550 -0.002 0.000 0.343 401 Y C 0.934 176.892 175.900 0.096 0.000 1.025 401 Y CA -1.287 56.858 58.100 0.075 0.000 1.082 401 Y CB 1.118 39.619 38.460 0.068 0.000 1.264 401 Y HN 0.120 8.400 8.280 0.000 0.000 0.478 402 R N 1.203 121.878 120.500 0.291 0.000 2.500 402 R HA 0.504 4.843 4.340 -0.002 0.000 0.275 402 R C -0.920 175.600 176.300 0.368 0.000 1.051 402 R CA -0.643 55.629 56.100 0.286 0.000 1.088 402 R CB 0.839 31.317 30.300 0.297 0.000 1.063 402 R HN 0.695 8.965 8.270 0.000 0.000 0.511 403 E N 0.777 121.198 120.200 0.368 0.000 2.383 403 E HA 0.290 4.639 4.350 -0.002 0.000 0.275 403 E C -1.357 175.272 176.600 0.048 0.000 0.918 403 E CA -0.945 55.636 56.400 0.301 0.000 0.764 403 E CB 2.852 32.641 29.700 0.149 0.000 1.252 403 E HN 0.235 8.595 8.360 0.000 0.000 0.449 404 K N 2.120 122.358 120.400 -0.270 0.000 2.578 404 K HA 0.158 4.477 4.320 -0.002 0.000 0.250 404 K C -1.223 175.175 176.600 -0.338 0.000 0.955 404 K CA -0.382 55.532 56.287 -0.621 0.000 0.825 404 K CB 0.965 32.501 32.500 -1.607 0.000 1.151 404 K HN 0.556 8.806 8.250 0.000 0.000 0.432 405 D N 3.596 123.868 120.400 -0.213 0.000 2.686 405 D HA -0.200 4.439 4.640 -0.002 0.000 0.235 405 D C 0.735 176.992 176.300 -0.072 0.000 1.160 405 D CA 2.280 56.205 54.000 -0.125 0.000 0.645 405 D CB -1.006 39.716 40.800 -0.130 0.000 1.039 405 D HN 1.053 9.423 8.370 0.000 0.000 0.423 406 G N -0.317 108.458 108.800 -0.042 0.000 2.267 406 G HA2 -0.398 3.561 3.960 -0.002 0.000 0.257 406 G HA3 -0.398 3.561 3.960 -0.002 0.000 0.257 406 G C 0.421 175.341 174.900 0.033 0.000 0.998 406 G CA 0.792 45.893 45.100 0.001 0.000 0.620 406 G HN 0.741 9.031 8.290 0.000 0.000 0.529 407 K N 2.346 122.766 120.400 0.034 0.000 2.379 407 K HA 0.456 4.775 4.320 -0.002 0.000 0.284 407 K C 0.389 177.126 176.600 0.227 0.000 1.044 407 K CA -0.092 56.264 56.287 0.116 0.000 0.974 407 K CB 0.188 32.770 32.500 0.138 0.000 0.962 407 K HN 0.492 8.742 8.250 0.000 0.000 0.474 408 E N 3.254 123.561 120.200 0.178 0.000 2.313 408 E HA 0.086 4.435 4.350 -0.002 0.000 0.276 408 E C -0.589 176.103 176.600 0.152 0.000 1.031 408 E CA -0.761 55.743 56.400 0.175 0.000 0.857 408 E CB 0.740 30.490 29.700 0.083 0.000 1.040 408 E HN 0.327 8.687 8.360 0.000 0.000 0.408 409 L N 3.488 124.783 121.223 0.120 0.000 2.415 409 L HA 0.118 4.457 4.340 -0.002 0.000 0.269 409 L C -0.624 176.147 176.870 -0.164 0.000 1.244 409 L CA 0.553 55.300 54.840 -0.156 0.000 1.113 409 L CB -0.380 41.473 42.059 -0.343 0.000 1.352 409 L HN 0.287 8.517 8.230 0.000 0.000 0.433 410 S N 4.835 120.451 115.700 -0.139 0.000 2.605 410 S HA 0.788 5.257 4.470 -0.002 0.000 0.308 410 S C -0.839 173.696 174.600 -0.108 0.000 1.113 410 S CA -0.630 57.486 58.200 -0.141 0.000 1.049 410 S CB 0.569 63.701 63.200 -0.113 0.000 1.001 410 S HN 0.456 8.766 8.310 0.000 0.000 0.480 411 L N 3.740 124.903 121.223 -0.100 0.000 2.371 411 L HA 0.697 5.036 4.340 -0.002 0.000 0.262 411 L C -0.867 176.025 176.870 0.036 0.000 1.006 411 L CA -1.216 53.589 54.840 -0.058 0.000 0.818 411 L CB 2.231 44.208 42.059 -0.137 0.000 1.354 411 L HN 0.318 8.548 8.230 0.000 0.000 0.415 412 V N 1.369 121.350 119.914 0.112 0.000 2.394 412 V HA 0.249 4.368 4.120 -0.002 0.000 0.282 412 V C -1.046 175.274 176.094 0.377 0.000 1.031 412 V CA -0.481 61.955 62.300 0.225 0.000 0.881 412 V CB 1.368 33.333 31.823 0.237 0.000 0.982 412 V HN 0.444 8.634 8.190 0.000 0.000 0.451 413 Y N 4.858 125.303 120.300 0.241 0.000 2.417 413 Y HA 0.634 5.183 4.550 -0.002 0.000 0.336 413 Y C 0.446 176.523 175.900 0.294 0.000 0.961 413 Y CA -2.123 56.144 58.100 0.279 0.000 1.215 413 Y CB 1.104 39.738 38.460 0.289 0.000 1.120 413 Y HN 0.662 8.942 8.280 0.000 0.000 0.499 414 A N 6.211 129.274 122.820 0.405 0.000 3.063 414 A HA 0.596 4.915 4.320 -0.002 0.000 0.263 414 A C 0.614 178.126 177.584 -0.121 0.000 1.736 414 A CA 0.140 52.248 52.037 0.118 0.000 1.408 414 A CB -1.450 17.556 19.000 0.010 0.000 1.108 414 A HN 0.867 9.017 8.150 0.000 0.000 0.621 415 A N 1.873 124.398 122.820 -0.492 0.000 2.407 415 A HA 0.525 4.845 4.320 -0.002 0.000 0.248 415 A C 0.689 178.075 177.584 -0.330 0.000 1.082 415 A CA -0.233 51.437 52.037 -0.611 0.000 0.785 415 A CB 0.264 18.711 19.000 -0.922 0.000 1.020 415 A HN 0.767 8.917 8.150 0.000 0.000 0.489 416 R N 0.970 121.276 120.500 -0.322 0.000 2.598 416 R HA 0.462 4.801 4.340 -0.002 0.000 0.279 416 R C -0.643 175.533 176.300 -0.206 0.000 0.984 416 R CA -0.904 55.009 56.100 -0.311 0.000 0.999 416 R CB 1.271 31.281 30.300 -0.484 0.000 1.114 416 R HN 0.490 8.760 8.270 0.000 0.000 0.493 417 V N 1.617 121.438 119.914 -0.154 0.000 2.788 417 V HA 0.142 4.261 4.120 -0.002 0.000 0.307 417 V C 0.995 177.009 176.094 -0.133 0.000 1.069 417 V CA 1.112 63.344 62.300 -0.114 0.000 1.173 417 V CB 1.027 32.808 31.823 -0.070 0.000 0.925 417 V HN 1.064 9.254 8.190 0.000 0.000 0.492 418 G N 3.287 112.014 108.800 -0.122 0.000 3.100 418 G HA2 0.474 4.433 3.960 -0.002 0.000 0.174 418 G HA3 0.474 4.433 3.960 -0.002 0.000 0.174 418 G C -0.757 174.078 174.900 -0.109 0.000 1.136 418 G CA 0.063 45.086 45.100 -0.127 0.000 0.881 418 G HN 0.710 9.000 8.290 0.000 0.000 0.616 419 D N -0.094 120.237 120.400 -0.114 0.000 2.440 419 D HA 0.472 5.111 4.640 -0.002 0.000 0.269 419 D C 1.630 177.868 176.300 -0.104 0.000 1.249 419 D CA 0.309 54.250 54.000 -0.098 0.000 1.055 419 D CB 0.465 41.211 40.800 -0.090 0.000 1.104 419 D HN 0.571 8.941 8.370 0.000 0.000 0.561 420 A N -0.552 122.217 122.820 -0.084 0.000 2.125 420 A HA -0.168 4.151 4.320 -0.002 0.000 0.219 420 A C 1.428 178.944 177.584 -0.114 0.000 1.156 420 A CA 0.984 52.976 52.037 -0.074 0.000 0.671 420 A CB -0.709 18.268 19.000 -0.039 0.000 0.794 420 A HN 0.531 8.681 8.150 0.000 0.000 0.459 421 N N -0.247 118.334 118.700 -0.199 0.000 2.280 421 N HA 0.159 4.898 4.740 -0.002 0.000 0.192 421 N C 1.572 176.869 175.510 -0.356 0.000 1.109 421 N CA 0.832 53.665 53.050 -0.361 0.000 0.855 421 N CB -0.042 37.982 38.487 -0.772 0.000 0.974 421 N HN 0.437 8.817 8.380 0.000 0.000 0.482 422 A N 1.749 124.428 122.820 -0.236 0.000 1.902 422 A HA -0.144 4.175 4.320 -0.002 0.000 0.217 422 A C 2.073 179.567 177.584 -0.149 0.000 1.181 422 A CA 1.133 53.056 52.037 -0.190 0.000 0.623 422 A CB -0.178 18.735 19.000 -0.144 0.000 0.818 422 A HN 0.150 8.300 8.150 0.000 0.000 0.443 423 E N -0.531 119.597 120.200 -0.120 0.000 2.077 423 E HA -0.136 4.214 4.350 -0.002 0.000 0.193 423 E C 2.134 178.689 176.600 -0.076 0.000 0.989 423 E CA 1.703 58.056 56.400 -0.079 0.000 0.800 423 E CB -0.687 28.981 29.700 -0.054 0.000 0.746 423 E HN 0.592 8.952 8.360 0.000 0.000 0.452 424 T N 1.896 116.387 114.554 -0.104 0.000 2.684 424 T HA -0.127 4.222 4.350 -0.002 0.000 0.267 424 T C 2.124 176.747 174.700 -0.129 0.000 1.036 424 T CA 1.028 63.077 62.100 -0.084 0.000 1.148 424 T CB -0.212 68.620 68.868 -0.060 0.000 0.863 424 T HN 0.099 8.339 8.240 0.000 0.000 0.436 425 I N 1.103 121.536 120.570 -0.229 0.000 2.202 425 I HA -0.142 4.027 4.170 -0.002 0.000 0.242 425 I C 2.901 178.855 176.117 -0.272 0.000 1.091 425 I CA 1.041 62.156 61.300 -0.309 0.000 1.368 425 I CB -0.458 37.341 38.000 -0.335 0.000 1.058 425 I HN 0.185 8.395 8.210 0.000 0.000 0.410 426 A N 0.109 122.893 122.820 -0.060 0.000 1.902 426 A HA -0.230 4.089 4.320 -0.002 0.000 0.217 426 A C 2.271 179.948 177.584 0.155 0.000 1.181 426 A CA 1.395 53.531 52.037 0.165 0.000 0.623 426 A CB -0.477 18.569 19.000 0.077 0.000 0.818 426 A HN 0.376 8.526 8.150 0.000 0.000 0.443 427 Q N -0.289 119.540 119.800 0.048 0.000 2.124 427 Q HA -0.200 4.139 4.340 -0.002 0.000 0.202 427 Q C 1.896 177.895 176.000 -0.002 0.000 0.977 427 Q CA 1.761 57.598 55.803 0.056 0.000 0.850 427 Q CB -0.723 28.033 28.738 0.031 0.000 0.901 427 Q HN 0.882 9.152 8.270 0.000 0.000 0.429 428 N N -0.202 118.434 118.700 -0.106 0.000 2.104 428 N HA -0.214 4.525 4.740 -0.002 0.000 0.190 428 N C 1.471 176.838 175.510 -0.239 0.000 1.024 428 N CA 1.375 54.313 53.050 -0.188 0.000 0.853 428 N CB -0.151 38.168 38.487 -0.279 0.000 1.008 428 N HN 0.124 8.504 8.380 0.000 0.000 0.424 429 Y N 0.646 120.810 120.300 -0.227 0.000 2.200 429 Y HA 0.024 4.573 4.550 -0.002 0.000 0.290 429 Y C 2.176 177.680 175.900 -0.661 0.000 1.137 429 Y CA 0.571 58.270 58.100 -0.669 0.000 1.163 429 Y CB -0.585 37.352 38.460 -0.871 0.000 0.988 429 Y HN 0.131 8.411 8.280 0.000 0.000 0.518 430 I N -0.005 120.588 120.570 0.038 0.000 2.208 430 I HA -0.389 3.780 4.170 -0.002 0.000 0.245 430 I C 2.652 178.882 176.117 0.188 0.000 1.097 430 I CA 1.845 63.316 61.300 0.285 0.000 1.363 430 I CB -0.439 37.749 38.000 0.314 0.000 1.051 430 I HN 0.303 8.513 8.210 0.000 0.000 0.413 431 Q N 0.499 120.346 119.800 0.078 0.000 2.084 431 Q HA -0.258 4.081 4.340 -0.002 0.000 0.202 431 Q C 2.232 178.257 176.000 0.041 0.000 0.978 431 Q CA 1.422 57.263 55.803 0.063 0.000 0.844 431 Q CB 0.066 28.816 28.738 0.020 0.000 0.898 431 Q HN 0.481 8.751 8.270 0.000 0.000 0.426 432 Q N -0.473 119.294 119.800 -0.056 0.000 2.084 432 Q HA -0.159 4.180 4.340 -0.002 0.000 0.202 432 Q C 1.796 177.833 176.000 0.062 0.000 0.978 432 Q CA 1.091 56.858 55.803 -0.060 0.000 0.844 432 Q CB -0.460 28.176 28.738 -0.170 0.000 0.898 432 Q HN 0.562 8.832 8.270 0.000 0.000 0.426 433 W N 1.615 122.987 121.300 0.119 0.000 2.388 433 W HA -0.052 4.607 4.660 -0.002 0.000 0.294 433 W C 2.155 178.752 176.519 0.129 0.000 1.212 433 W CA 0.653 58.057 57.345 0.099 0.000 1.271 433 W CB -0.658 28.846 29.460 0.075 0.000 1.126 433 W HN 0.240 8.420 8.180 0.000 0.000 0.535 434 K N 1.199 121.808 120.400 0.348 0.000 2.103 434 K HA -0.200 4.119 4.320 -0.002 0.000 0.207 434 K C 1.875 178.559 176.600 0.140 0.000 1.048 434 K CA 1.677 58.131 56.287 0.278 0.000 0.930 434 K CB -0.161 32.480 32.500 0.234 0.000 0.716 434 K HN -0.020 8.230 8.250 0.000 0.000 0.444 435 K N 0.571 121.044 120.400 0.123 0.000 2.211 435 K HA -0.132 4.187 4.320 -0.002 0.000 0.204 435 K C 1.792 178.449 176.600 0.094 0.000 1.047 435 K CA 1.631 57.967 56.287 0.081 0.000 0.935 435 K CB -0.223 32.320 32.500 0.071 0.000 0.728 435 K HN 0.463 8.713 8.250 0.000 0.000 0.452 436 I N -3.713 116.945 120.570 0.147 0.000 3.904 436 I HA 0.341 4.510 4.170 -0.002 0.000 0.333 436 I C 0.538 176.735 176.117 0.134 0.000 1.361 436 I CA -0.063 61.319 61.300 0.138 0.000 1.116 436 I CB 0.398 38.497 38.000 0.166 0.000 1.028 436 I HN 0.119 8.329 8.210 0.000 0.000 0.398 437 G N 1.594 110.482 108.800 0.146 0.000 2.160 437 G HA2 -0.192 3.767 3.960 -0.002 0.000 0.244 437 G HA3 -0.192 3.767 3.960 -0.002 0.000 0.244 437 G C -0.090 174.993 174.900 0.305 0.000 1.022 437 G CA 0.157 45.367 45.100 0.183 0.000 0.741 437 G HN 0.340 8.630 8.290 0.000 0.000 0.508 438 V N 0.569 120.657 119.914 0.289 0.000 2.384 438 V HA 0.471 4.590 4.120 -0.002 0.000 0.287 438 V C 0.595 176.805 176.094 0.194 0.000 1.020 438 V CA -0.905 61.481 62.300 0.143 0.000 0.850 438 V CB 1.831 33.641 31.823 -0.021 0.000 0.987 438 V HN 0.340 8.530 8.190 0.000 0.000 0.436 439 K N 4.296 124.631 120.400 -0.109 0.000 2.262 439 K HA 0.598 4.917 4.320 -0.002 0.000 0.282 439 K C -1.287 175.245 176.600 -0.114 0.000 1.066 439 K CA -0.244 55.836 56.287 -0.346 0.000 0.901 439 K CB 1.166 33.116 32.500 -0.918 0.000 1.089 439 K HN 0.521 8.771 8.250 0.000 0.000 0.476 440 V N 2.995 122.941 119.914 0.053 0.000 2.540 440 V HA 0.344 4.464 4.120 -0.002 0.000 0.302 440 V C -0.687 175.520 176.094 0.189 0.000 1.035 440 V CA -0.758 61.619 62.300 0.128 0.000 0.873 440 V CB 2.002 33.978 31.823 0.255 0.000 0.992 440 V HN 0.784 8.974 8.190 0.000 0.000 0.428 441 S N 4.386 120.192 115.700 0.177 0.000 2.526 441 S HA 0.690 5.159 4.470 -0.002 0.000 0.293 441 S C -0.482 174.249 174.600 0.219 0.000 1.092 441 S CA -0.652 57.646 58.200 0.163 0.000 0.980 441 S CB 1.686 64.935 63.200 0.082 0.000 1.048 441 S HN 0.537 8.847 8.310 0.000 0.000 0.483 442 L N 2.333 123.664 121.223 0.180 0.000 2.461 442 L HA 0.206 4.545 4.340 -0.002 0.000 0.272 442 L C 0.001 176.963 176.870 0.153 0.000 1.197 442 L CA -0.395 54.536 54.840 0.153 0.000 0.836 442 L CB 0.109 42.217 42.059 0.081 0.000 1.105 442 L HN 0.708 8.938 8.230 0.000 0.000 0.477 443 Y N 4.522 124.857 120.300 0.058 0.000 2.677 443 Y HA -0.128 4.422 4.550 -0.001 0.000 0.335 443 Y C 0.912 176.818 175.900 0.011 0.000 1.162 443 Y CA 0.221 58.350 58.100 0.049 0.000 1.483 443 Y CB -0.093 38.386 38.460 0.033 0.000 1.209 443 Y HN 0.683 8.963 8.280 0.000 0.000 0.528 444 N N 3.779 122.362 118.700 -0.194 0.000 2.714 444 N HA -0.211 4.528 4.740 -0.002 0.000 0.250 444 N C 0.778 176.287 175.510 -0.002 0.000 1.117 444 N CA 1.522 54.512 53.050 -0.099 0.000 0.719 444 N CB -1.504 36.966 38.487 -0.030 0.000 1.081 444 N HN 1.205 9.585 8.380 0.000 0.000 0.557 445 G N -0.899 107.911 108.800 0.016 0.000 2.153 445 G HA2 -0.369 3.590 3.960 -0.002 0.000 0.252 445 G HA3 -0.369 3.590 3.960 -0.002 0.000 0.252 445 G C 0.026 174.945 174.900 0.032 0.000 0.994 445 G CA 1.371 46.487 45.100 0.028 0.000 0.698 445 G HN 0.949 9.239 8.290 0.000 0.000 0.521 446 K N -1.430 118.994 120.400 0.041 0.000 2.533 446 K HA 0.774 5.093 4.320 -0.002 0.000 0.284 446 K C -0.265 176.339 176.600 0.006 0.000 1.025 446 K CA -1.437 54.863 56.287 0.021 0.000 0.900 446 K CB 1.026 33.538 32.500 0.020 0.000 1.519 446 K HN 0.086 8.336 8.250 0.000 0.000 0.432 447 L N 1.376 122.582 121.223 -0.029 0.000 2.417 447 L HA 0.348 4.687 4.340 -0.002 0.000 0.268 447 L C 0.233 177.067 176.870 -0.060 0.000 1.158 447 L CA -0.645 54.152 54.840 -0.072 0.000 0.819 447 L CB 0.824 42.830 42.059 -0.089 0.000 1.112 447 L HN 0.610 8.840 8.230 0.000 0.000 0.458 448 M N 3.164 122.707 119.600 -0.095 0.000 2.209 448 M HA 0.177 4.657 4.480 -0.002 0.000 0.355 448 M C 0.169 176.426 176.300 -0.071 0.000 1.171 448 M CA -0.423 54.823 55.300 -0.089 0.000 1.069 448 M CB 1.098 33.617 32.600 -0.134 0.000 1.622 448 M HN 0.516 8.806 8.290 0.000 0.000 0.459 449 E N 3.338 123.515 120.200 -0.039 0.000 2.413 449 E HA -0.095 4.254 4.350 -0.002 0.000 0.263 449 E C 0.019 176.644 176.600 0.043 0.000 1.015 449 E CA 0.213 56.614 56.400 0.002 0.000 0.916 449 E CB 0.574 30.274 29.700 0.000 0.000 0.947 449 E HN 0.773 9.133 8.360 0.000 0.000 0.440 450 F N 6.002 125.909 119.950 -0.072 0.000 2.069 450 F HA -0.246 4.281 4.527 -0.001 0.000 0.298 450 F C 1.610 177.425 175.800 0.026 0.000 1.113 450 F CA 1.852 59.819 58.000 -0.054 0.000 1.214 450 F CB -0.126 38.821 39.000 -0.088 0.000 0.978 450 F HN 0.496 8.796 8.300 0.000 0.000 0.474 451 N N 0.313 118.945 118.700 -0.113 0.000 2.166 451 N HA -0.176 4.563 4.740 -0.002 0.000 0.186 451 N C 2.163 177.544 175.510 -0.215 0.000 1.019 451 N CA 1.708 54.621 53.050 -0.228 0.000 0.856 451 N CB -0.878 37.568 38.487 -0.068 0.000 0.993 451 N HN 0.489 8.869 8.380 0.000 0.000 0.426 452 S N -0.724 114.897 115.700 -0.132 0.000 2.402 452 S HA -0.127 4.343 4.470 -0.002 0.000 0.229 452 S C 1.896 176.387 174.600 -0.181 0.000 1.021 452 S CA 0.481 58.600 58.200 -0.135 0.000 0.974 452 S CB -0.745 62.394 63.200 -0.102 0.000 0.800 452 S HN 0.566 8.876 8.310 0.000 0.000 0.484 453 W N 2.381 123.450 121.300 -0.386 0.000 2.381 453 W HA -0.046 4.613 4.660 -0.001 0.000 0.301 453 W C 1.973 178.168 176.519 -0.539 0.000 1.205 453 W CA 1.339 58.405 57.345 -0.464 0.000 1.285 453 W CB -0.455 28.743 29.460 -0.436 0.000 1.133 453 W HN 0.111 8.291 8.180 0.000 0.000 0.521 454 V N 1.259 120.890 119.914 -0.472 0.000 2.332 454 V HA -0.335 3.784 4.120 -0.002 0.000 0.248 454 V C 2.083 177.827 176.094 -0.583 0.000 1.055 454 V CA 2.397 64.288 62.300 -0.682 0.000 1.038 454 V CB -1.014 30.463 31.823 -0.577 0.000 0.651 454 V HN 0.099 8.289 8.190 0.000 0.000 0.450 455 D N -0.938 119.232 120.400 -0.384 0.000 2.104 455 D HA -0.199 4.440 4.640 -0.002 0.000 0.194 455 D C 2.113 178.242 176.300 -0.286 0.000 0.994 455 D CA 1.737 55.580 54.000 -0.262 0.000 0.830 455 D CB -0.384 40.321 40.800 -0.159 0.000 0.959 455 D HN 0.544 8.914 8.370 0.000 0.000 0.452 456 H N -0.309 118.488 119.070 -0.456 0.000 2.352 456 H HA -0.053 4.502 4.556 -0.002 0.000 0.299 456 H C 1.951 176.945 175.328 -0.556 0.000 1.097 456 H CA 1.352 57.124 56.048 -0.460 0.000 1.311 456 H CB 0.063 29.494 29.762 -0.550 0.000 1.377 456 H HN -0.005 8.275 8.280 0.000 0.000 0.504 457 M N -0.722 118.347 119.600 -0.884 0.000 2.236 457 M HA -0.058 4.421 4.480 -0.002 0.000 0.266 457 M C 2.178 178.100 176.300 -0.631 0.000 1.070 457 M CA 1.744 56.368 55.300 -1.127 0.000 1.137 457 M CB -0.868 30.334 32.600 -2.329 0.000 1.378 457 M HN 0.501 8.791 8.290 0.000 0.000 0.426 458 T N -3.886 110.382 114.554 -0.476 0.000 3.040 458 T HA 0.069 4.418 4.350 -0.002 0.000 0.252 458 T C 0.878 175.524 174.700 -0.090 0.000 1.064 458 T CA 0.153 62.152 62.100 -0.168 0.000 1.110 458 T CB -0.537 68.267 68.868 -0.106 0.000 0.921 458 T HN 0.136 8.376 8.240 0.000 0.000 0.480 459 T N 5.080 119.560 114.554 -0.124 0.000 2.769 459 T HA 0.346 4.695 4.350 -0.002 0.000 0.293 459 T C -2.532 172.156 174.700 -0.021 0.000 0.931 459 T CA -0.857 61.204 62.100 -0.065 0.000 1.139 459 T CB 0.761 69.582 68.868 -0.079 0.000 0.881 459 T HN 0.260 8.500 8.240 0.000 0.000 0.532 460 P HA 0.181 4.601 4.420 0.000 0.000 0.271 460 P C -1.732 175.596 177.300 0.047 0.000 1.218 460 P CA -1.319 61.836 63.100 0.092 0.000 0.780 460 P CB 0.106 31.911 31.700 0.175 0.000 0.901 461 P HA 0.171 4.591 4.420 0.000 0.000 0.258 461 P C 0.279 177.593 177.300 0.023 0.000 1.416 461 P CA 0.159 63.310 63.100 0.085 0.000 0.927 461 P CB -0.139 31.599 31.700 0.064 0.000 1.444 462 G N 0.217 109.031 108.800 0.024 0.000 2.730 462 G HA2 0.150 4.109 3.960 -0.002 0.000 0.686 462 G HA3 0.150 4.109 3.960 -0.002 0.000 0.686 462 G C -0.564 174.350 174.900 0.024 0.000 1.343 462 G CA -0.541 44.603 45.100 0.074 0.000 0.826 462 G HN 0.450 8.740 8.290 0.000 0.000 0.582 463 A N 0.002 122.843 122.820 0.036 0.000 2.295 463 A HA 0.785 5.105 4.320 -0.002 0.000 0.318 463 A C 0.828 178.447 177.584 0.057 0.000 1.134 463 A CA 0.189 52.229 52.037 0.005 0.000 0.827 463 A CB 1.398 20.270 19.000 -0.212 0.000 1.136 463 A HN 1.217 9.367 8.150 0.000 0.000 0.493 464 N N -0.311 118.418 118.700 0.049 0.000 2.203 464 N HA 0.048 4.787 4.740 -0.002 0.000 0.207 464 N C -0.116 175.410 175.510 0.027 0.000 1.130 464 N CA 0.581 53.622 53.050 -0.015 0.000 0.861 464 N CB 0.450 38.931 38.487 -0.010 0.000 1.005 464 N HN 0.670 9.050 8.380 0.000 0.000 0.507 465 D N -0.852 119.665 120.400 0.195 0.000 2.462 465 D HA 0.024 4.663 4.640 -0.002 0.000 0.221 465 D C -0.150 176.456 176.300 0.511 0.000 1.173 465 D CA -0.529 53.652 54.000 0.301 0.000 0.831 465 D CB -0.564 40.445 40.800 0.348 0.000 1.001 465 D HN 0.229 8.599 8.370 0.000 0.000 0.499 466 W N 0.210 121.688 121.300 0.296 0.000 3.033 466 W HA 0.540 5.199 4.660 -0.001 0.000 0.336 466 W C -0.879 175.766 176.519 0.210 0.000 1.173 466 W CA -0.690 56.833 57.345 0.296 0.000 1.185 466 W CB 0.930 30.578 29.460 0.312 0.000 1.425 466 W HN -0.346 7.834 8.180 0.000 0.000 0.536 467 D N 1.060 121.641 120.400 0.303 0.000 2.597 467 D HA 0.244 4.883 4.640 -0.002 0.000 0.261 467 D C 0.357 176.878 176.300 0.367 0.000 1.023 467 D CA 0.746 54.807 54.000 0.102 0.000 0.927 467 D CB 1.721 42.554 40.800 0.054 0.000 1.168 467 D HN 0.184 8.554 8.370 0.000 0.000 0.491 468 I N 0.293 121.215 120.570 0.587 0.000 2.545 468 I HA 0.310 4.479 4.170 -0.002 0.000 0.292 468 I C -0.236 176.324 176.117 0.739 0.000 1.040 468 I CA -0.278 61.362 61.300 0.567 0.000 1.068 468 I CB 2.716 40.814 38.000 0.163 0.000 1.251 468 I HN -0.233 7.977 8.210 0.000 0.000 0.424 469 T N 2.827 117.750 114.554 0.614 0.000 2.787 469 T HA 0.380 4.729 4.350 -0.002 0.000 0.297 469 T C -1.976 172.988 174.700 0.440 0.000 1.221 469 T CA -0.602 61.770 62.100 0.454 0.000 1.006 469 T CB 1.746 70.664 68.868 0.083 0.000 1.328 469 T HN 0.487 8.727 8.240 0.000 0.000 0.509 470 D N 0.810 121.407 120.400 0.328 0.000 2.375 470 D HA 0.569 5.208 4.640 -0.002 0.000 0.247 470 D C -0.088 176.297 176.300 0.142 0.000 1.061 470 D CA -0.163 53.978 54.000 0.235 0.000 0.834 470 D CB 1.817 42.696 40.800 0.131 0.000 1.247 470 D HN 0.714 9.084 8.370 0.000 0.000 0.489 471 G N -0.072 108.927 108.800 0.333 0.000 2.568 471 G HA2 0.657 4.616 3.960 -0.002 0.000 0.313 471 G HA3 0.657 4.616 3.960 -0.002 0.000 0.313 471 G C -0.901 174.003 174.900 0.008 0.000 1.227 471 G CA -0.669 44.570 45.100 0.232 0.000 0.979 471 G HN 0.421 8.711 8.290 0.000 0.000 0.486 472 S N -1.345 114.207 115.700 -0.247 0.000 2.537 472 S HA 0.657 5.126 4.470 -0.002 0.000 0.270 472 S C -1.958 172.366 174.600 -0.460 0.000 1.142 472 S CA -0.932 57.089 58.200 -0.299 0.000 0.870 472 S CB 1.348 64.442 63.200 -0.177 0.000 1.112 472 S HN 0.665 8.975 8.310 0.000 0.000 0.466 473 W N 1.003 122.184 121.300 -0.199 0.000 2.739 473 W HA 0.626 5.285 4.660 -0.002 0.000 0.331 473 W C 0.186 176.686 176.519 -0.032 0.000 1.049 473 W CA -0.591 56.714 57.345 -0.067 0.000 1.234 473 W CB 2.236 31.667 29.460 -0.048 0.000 1.404 473 W HN 0.711 8.891 8.180 0.000 0.000 0.477 474 S N 4.227 120.122 115.700 0.325 0.000 2.414 474 S HA 0.383 4.852 4.470 -0.002 0.000 0.290 474 S C -0.137 174.626 174.600 0.271 0.000 1.160 474 S CA -0.429 57.947 58.200 0.294 0.000 1.069 474 S CB -0.448 62.895 63.200 0.238 0.000 1.012 474 S HN 0.407 8.717 8.310 0.000 0.000 0.510 475 L N 4.079 125.433 121.223 0.218 0.000 2.436 475 L HA 0.449 4.788 4.340 -0.002 0.000 0.265 475 L C 1.003 177.925 176.870 0.087 0.000 1.168 475 L CA -0.755 54.176 54.840 0.151 0.000 0.815 475 L CB 0.487 42.655 42.059 0.182 0.000 1.109 475 L HN 0.670 8.900 8.230 0.000 0.000 0.462 476 A N 1.172 124.011 122.820 0.032 0.000 2.466 476 A HA 0.147 4.466 4.320 -0.002 0.000 0.238 476 A C 0.975 178.538 177.584 -0.034 0.000 1.074 476 A CA 0.155 52.177 52.037 -0.025 0.000 0.774 476 A CB 0.164 19.117 19.000 -0.078 0.000 1.015 476 A HN 0.845 8.995 8.150 0.000 0.000 0.498 477 S N 0.296 115.896 115.700 -0.167 0.000 2.803 477 S HA 0.149 4.618 4.470 -0.002 0.000 0.228 477 S C 0.229 174.712 174.600 -0.195 0.000 0.953 477 S CA 0.157 58.133 58.200 -0.374 0.000 0.983 477 S CB -0.201 62.419 63.200 -0.968 0.000 0.784 477 S HN 0.710 9.020 8.310 0.000 0.000 0.498 478 E N 1.691 121.773 120.200 -0.195 0.000 2.272 478 E HA 0.326 4.675 4.350 -0.002 0.000 0.269 478 E C -2.430 173.833 176.600 -0.563 0.000 0.877 478 E CA -2.241 53.974 56.400 -0.308 0.000 0.755 478 E CB 2.252 31.847 29.700 -0.175 0.000 1.192 478 E HN -0.008 8.352 8.360 0.000 0.000 0.422 479 P HA -0.031 4.389 4.420 0.000 0.000 0.233 479 P C 0.648 177.843 177.300 -0.176 0.000 1.167 479 P CA 0.204 62.755 63.100 -0.915 0.000 0.770 479 P CB 0.325 31.366 31.700 -1.099 0.000 0.837 480 S N 0.571 116.234 115.700 -0.063 0.000 2.552 480 S HA -0.030 4.439 4.470 -0.002 0.000 0.289 480 S C 0.865 175.391 174.600 -0.123 0.000 1.304 480 S CA 0.112 58.270 58.200 -0.071 0.000 1.063 480 S CB -0.045 63.095 63.200 -0.101 0.000 0.848 480 S HN 0.139 8.449 8.310 0.000 0.000 0.499 481 Q N 2.912 122.635 119.800 -0.127 0.000 2.189 481 Q HA 0.139 4.478 4.340 -0.002 0.000 0.221 481 Q C 1.381 177.309 176.000 -0.120 0.000 0.848 481 Q CA -0.407 55.345 55.803 -0.085 0.000 1.007 481 Q CB 0.369 29.215 28.738 0.180 0.000 1.116 481 Q HN 0.698 8.968 8.270 0.000 0.000 0.481 482 Q N 0.793 120.481 119.800 -0.187 0.000 2.173 482 Q HA -0.196 4.143 4.340 -0.002 0.000 0.208 482 Q C 0.615 176.455 176.000 -0.267 0.000 0.989 482 Q CA 1.423 57.106 55.803 -0.200 0.000 0.872 482 Q CB 0.086 28.668 28.738 -0.260 0.000 0.909 482 Q HN 0.455 8.725 8.270 0.000 0.000 0.420 483 D N -0.366 119.833 120.400 -0.336 0.000 2.349 483 D HA 0.049 4.688 4.640 -0.002 0.000 0.224 483 D C 1.699 177.736 176.300 -0.437 0.000 1.029 483 D CA 0.277 54.045 54.000 -0.387 0.000 0.879 483 D CB 0.209 40.785 40.800 -0.375 0.000 0.906 483 D HN 0.222 8.592 8.370 0.000 0.000 0.528 484 L N -1.428 119.460 121.223 -0.558 0.000 2.316 484 L HA 0.118 4.457 4.340 -0.002 0.000 0.207 484 L C 0.964 177.288 176.870 -0.911 0.000 1.070 484 L CA 0.567 54.832 54.840 -0.958 0.000 0.820 484 L CB 0.166 41.358 42.059 -1.445 0.000 0.992 484 L HN -0.077 8.153 8.230 0.000 0.000 0.466 485 F N -0.880 118.983 119.950 -0.145 0.000 2.817 485 F HA 0.153 4.679 4.527 -0.002 0.000 0.333 485 F C 1.490 177.200 175.800 -0.149 0.000 1.085 485 F CA -0.855 57.072 58.000 -0.122 0.000 1.170 485 F CB -0.046 39.041 39.000 0.144 0.000 1.066 485 F HN -0.147 8.153 8.300 0.000 0.000 0.564 486 S N 0.882 116.579 115.700 -0.004 0.000 2.573 486 S HA 0.344 4.813 4.470 -0.002 0.000 0.277 486 S C 1.590 176.183 174.600 -0.012 0.000 1.346 486 S CA -0.037 58.154 58.200 -0.015 0.000 1.034 486 S CB 1.431 64.579 63.200 -0.087 0.000 0.879 486 S HN 0.262 8.572 8.310 0.000 0.000 0.528 487 A N 2.688 125.523 122.820 0.025 0.000 1.948 487 A HA 0.072 4.391 4.320 -0.002 0.000 0.220 487 A C 2.264 179.917 177.584 0.115 0.000 1.177 487 A CA 1.773 53.839 52.037 0.048 0.000 0.636 487 A CB -1.454 17.580 19.000 0.057 0.000 0.815 487 A HN 1.470 9.620 8.150 0.000 0.000 0.449 488 A N -1.132 121.764 122.820 0.126 0.000 2.238 488 A HA 0.578 4.897 4.320 -0.002 0.000 0.208 488 A C 1.188 178.987 177.584 0.358 0.000 1.177 488 A CA 0.708 52.912 52.037 0.279 0.000 0.804 488 A CB -0.592 18.579 19.000 0.285 0.000 0.823 488 A HN 0.972 9.121 8.150 0.000 0.000 0.482 489 A N 0.474 123.375 122.820 0.135 0.000 2.276 489 A HA 0.598 4.917 4.320 -0.002 0.000 0.300 489 A C -1.595 175.949 177.584 -0.067 0.000 1.235 489 A CA -1.439 50.580 52.037 -0.030 0.000 0.867 489 A CB 0.485 19.377 19.000 -0.180 0.000 1.137 489 A HN 0.101 8.251 8.150 0.000 0.000 0.527 490 P HA -0.126 4.294 4.420 0.000 0.000 0.225 490 P C 0.511 177.867 177.300 0.093 0.000 1.148 490 P CA 0.983 63.856 63.100 -0.379 0.000 0.779 490 P CB 0.039 31.501 31.700 -0.397 0.000 0.780 491 Y N -1.017 119.171 120.300 -0.187 0.000 2.571 491 Y HA -0.008 4.541 4.550 -0.002 0.000 0.294 491 Y C 1.199 176.701 175.900 -0.662 0.000 1.141 491 Y CA -0.237 57.628 58.100 -0.391 0.000 1.308 491 Y CB -1.321 36.905 38.460 -0.390 0.000 1.002 491 Y HN 0.002 8.282 8.280 0.000 0.000 0.551 492 N N 0.986 119.568 118.700 -0.197 0.000 2.671 492 N HA -0.067 4.672 4.740 -0.002 0.000 0.274 492 N C 0.393 175.846 175.510 -0.095 0.000 1.188 492 N CA 0.155 53.120 53.050 -0.143 0.000 1.065 492 N CB -0.426 37.965 38.487 -0.160 0.000 1.415 492 N HN -0.042 8.338 8.380 0.000 0.000 0.511 493 F N 0.730 120.611 119.950 -0.115 0.000 2.293 493 F HA 0.100 4.626 4.527 -0.002 0.000 0.300 493 F C 2.344 177.901 175.800 -0.404 0.000 1.086 493 F CA 0.665 58.451 58.000 -0.357 0.000 1.375 493 F CB -0.711 37.917 39.000 -0.620 0.000 1.045 493 F HN 0.482 8.782 8.300 0.000 0.000 0.516 494 G N -2.191 106.688 108.800 0.132 0.000 2.880 494 G HA2 -0.061 3.898 3.960 -0.002 0.000 0.209 494 G HA3 -0.061 3.898 3.960 -0.002 0.000 0.209 494 G C -0.011 174.888 174.900 -0.001 0.000 1.157 494 G CA 0.227 45.435 45.100 0.180 0.000 0.779 494 G HN 0.543 8.833 8.290 0.000 0.000 0.539 495 H N -0.949 118.238 119.070 0.195 0.000 2.826 495 H HA -0.173 4.382 4.556 -0.001 0.000 0.306 495 H C 0.230 175.566 175.328 0.013 0.000 1.235 495 H CA 0.865 56.953 56.048 0.067 0.000 1.150 495 H CB -2.711 27.107 29.762 0.094 0.000 1.409 495 H HN 0.601 8.881 8.280 0.000 0.000 0.420 496 F N 0.053 120.026 119.950 0.040 0.000 2.410 496 F HA 0.554 5.080 4.527 -0.002 0.000 0.334 496 F C 0.448 176.212 175.800 -0.060 0.000 1.134 496 F CA -1.050 56.840 58.000 -0.183 0.000 1.227 496 F CB 0.844 39.484 39.000 -0.599 0.000 1.194 496 F HN 0.083 8.383 8.300 0.000 0.000 0.571 497 N N 2.103 120.908 118.700 0.175 0.000 2.629 497 N HA 0.142 4.881 4.740 -0.002 0.000 0.277 497 N C -2.505 173.111 175.510 0.177 0.000 1.188 497 N CA -0.323 52.820 53.050 0.154 0.000 0.835 497 N CB 1.008 39.528 38.487 0.055 0.000 1.420 497 N HN 0.935 9.315 8.380 0.000 0.000 0.542 498 D N 1.789 122.348 120.400 0.266 0.000 2.757 498 D HA 0.271 4.910 4.640 -0.002 0.000 0.249 498 D C 0.189 176.603 176.300 0.189 0.000 1.168 498 D CA -0.264 53.875 54.000 0.233 0.000 0.870 498 D CB 1.852 42.856 40.800 0.341 0.000 1.411 498 D HN 0.296 8.666 8.370 0.000 0.000 0.525 499 S N 2.690 118.470 115.700 0.133 0.000 2.382 499 S HA -0.172 4.297 4.470 -0.002 0.000 0.228 499 S C 1.549 176.207 174.600 0.097 0.000 1.027 499 S CA 1.051 59.312 58.200 0.102 0.000 0.991 499 S CB 0.080 63.325 63.200 0.075 0.000 0.823 499 S HN 0.683 8.993 8.310 0.000 0.000 0.469 500 E N 0.734 120.991 120.200 0.095 0.000 2.072 500 E HA -0.116 4.233 4.350 -0.002 0.000 0.191 500 E C 1.803 178.461 176.600 0.096 0.000 0.985 500 E CA 0.957 57.401 56.400 0.074 0.000 0.801 500 E CB -0.027 29.701 29.700 0.046 0.000 0.750 500 E HN 0.287 8.647 8.360 0.000 0.000 0.452 501 I N 1.129 121.781 120.570 0.136 0.000 2.179 501 I HA -0.223 3.946 4.170 -0.002 0.000 0.242 501 I C 2.366 178.602 176.117 0.199 0.000 1.088 501 I CA 1.394 62.812 61.300 0.196 0.000 1.357 501 I CB -1.625 36.528 38.000 0.254 0.000 1.051 501 I HN 0.191 8.401 8.210 0.000 0.000 0.409 502 T N 0.866 115.529 114.554 0.182 0.000 2.684 502 T HA -0.241 4.108 4.350 -0.002 0.000 0.267 502 T C 2.003 176.745 174.700 0.071 0.000 1.036 502 T CA 1.778 63.954 62.100 0.126 0.000 1.148 502 T CB -0.164 68.772 68.868 0.113 0.000 0.863 502 T HN 0.295 8.535 8.240 0.000 0.000 0.436 503 K N 0.596 121.036 120.400 0.067 0.000 2.063 503 K HA -0.177 4.142 4.320 -0.002 0.000 0.208 503 K C 1.874 178.486 176.600 0.020 0.000 1.048 503 K CA 1.771 58.082 56.287 0.041 0.000 0.928 503 K CB -0.127 32.399 32.500 0.043 0.000 0.713 503 K HN 0.181 8.431 8.250 0.000 0.000 0.442 504 D N 0.941 121.366 120.400 0.040 0.000 2.092 504 D HA -0.191 4.448 4.640 -0.002 0.000 0.193 504 D C 2.008 178.245 176.300 -0.105 0.000 0.994 504 D CA 1.185 55.195 54.000 0.017 0.000 0.828 504 D CB -0.300 40.590 40.800 0.151 0.000 0.963 504 D HN 0.212 8.582 8.370 0.000 0.000 0.450 505 L N 0.699 121.858 121.223 -0.106 0.000 2.042 505 L HA -0.206 4.133 4.340 -0.002 0.000 0.210 505 L C 2.080 178.842 176.870 -0.179 0.000 1.076 505 L CA 1.036 55.736 54.840 -0.232 0.000 0.749 505 L CB -0.403 41.595 42.059 -0.102 0.000 0.893 505 L HN 0.014 8.244 8.230 0.000 0.000 0.432 506 N N -0.348 118.301 118.700 -0.084 0.000 2.142 506 N HA -0.194 4.545 4.740 -0.002 0.000 0.186 506 N C 1.530 176.994 175.510 -0.078 0.000 1.023 506 N CA 1.307 54.322 53.050 -0.059 0.000 0.852 506 N CB -0.417 38.059 38.487 -0.017 0.000 0.998 506 N HN 0.267 8.647 8.380 0.000 0.000 0.424 507 D N 0.791 121.153 120.400 -0.064 0.000 2.123 507 D HA -0.029 4.610 4.640 -0.002 0.000 0.196 507 D C 1.933 178.194 176.300 -0.064 0.000 0.992 507 D CA 0.567 54.561 54.000 -0.010 0.000 0.833 507 D CB -0.153 40.660 40.800 0.021 0.000 0.954 507 D HN 0.201 8.571 8.370 0.000 0.000 0.455 508 I N 0.290 120.711 120.570 -0.247 0.000 2.335 508 I HA -0.223 3.946 4.170 -0.002 0.000 0.251 508 I C 0.938 176.868 176.117 -0.312 0.000 1.129 508 I CA 1.239 62.266 61.300 -0.455 0.000 1.402 508 I CB -0.034 37.436 38.000 -0.884 0.000 1.069 508 I HN -0.009 8.201 8.210 0.000 0.000 0.424 509 D N -0.170 120.097 120.400 -0.223 0.000 2.402 509 D HA 0.085 4.724 4.640 -0.002 0.000 0.216 509 D C 0.852 177.038 176.300 -0.189 0.000 1.128 509 D CA 0.151 54.036 54.000 -0.191 0.000 0.833 509 D CB 0.178 40.902 40.800 -0.126 0.000 0.971 509 D HN 0.238 8.608 8.370 0.000 0.000 0.503 510 S N -0.269 115.349 115.700 -0.137 0.000 2.608 510 S HA 0.400 4.869 4.470 -0.002 0.000 0.261 510 S C 1.671 176.175 174.600 -0.159 0.000 1.314 510 S CA -0.098 58.022 58.200 -0.133 0.000 0.992 510 S CB 1.842 64.987 63.200 -0.092 0.000 0.935 510 S HN 0.037 8.347 8.310 0.000 0.000 0.564 511 A N 1.311 124.035 122.820 -0.159 0.000 1.978 511 A HA -0.099 4.220 4.320 -0.002 0.000 0.220 511 A C 2.150 179.608 177.584 -0.209 0.000 1.170 511 A CA 1.620 53.563 52.037 -0.157 0.000 0.636 511 A CB -0.850 18.075 19.000 -0.127 0.000 0.810 511 A HN 0.914 9.064 8.150 0.000 0.000 0.448 512 K N -0.185 120.018 120.400 -0.329 0.000 2.147 512 K HA -0.030 4.289 4.320 -0.002 0.000 0.205 512 K C 1.790 178.071 176.600 -0.531 0.000 1.049 512 K CA 1.272 57.186 56.287 -0.621 0.000 0.936 512 K CB -0.133 31.639 32.500 -1.212 0.000 0.722 512 K HN 0.349 8.599 8.250 0.000 0.000 0.446 513 S N 1.266 116.824 115.700 -0.237 0.000 2.603 513 S HA -0.022 4.447 4.470 -0.002 0.000 0.229 513 S C 1.133 175.736 174.600 0.006 0.000 0.972 513 S CA 0.461 58.678 58.200 0.029 0.000 0.935 513 S CB -0.087 63.133 63.200 0.034 0.000 0.769 513 S HN 0.225 8.535 8.310 0.000 0.000 0.536 514 E N 1.714 121.883 120.200 -0.052 0.000 2.268 514 E HA -0.036 4.313 4.350 -0.002 0.000 0.195 514 E C 0.712 177.326 176.600 0.024 0.000 0.995 514 E CA 0.326 56.716 56.400 -0.016 0.000 0.836 514 E CB -0.235 29.440 29.700 -0.042 0.000 0.763 514 E HN 0.346 8.706 8.360 0.000 0.000 0.491 515 N N 1.662 120.378 118.700 0.026 0.000 2.401 515 N HA 0.016 4.755 4.740 -0.002 0.000 0.255 515 N C -1.908 173.697 175.510 0.158 0.000 1.110 515 N CA -1.909 51.189 53.050 0.079 0.000 0.949 515 N CB 1.319 39.850 38.487 0.073 0.000 1.110 515 N HN -0.217 8.163 8.380 0.000 0.000 0.490 516 P HA -0.098 4.322 4.420 0.000 0.000 0.219 516 P C 0.954 178.398 177.300 0.241 0.000 1.146 516 P CA 1.244 64.482 63.100 0.231 0.000 0.808 516 P CB 0.160 31.968 31.700 0.181 0.000 0.779 517 T N -1.135 113.525 114.554 0.177 0.000 2.684 517 T HA -0.225 4.124 4.350 -0.002 0.000 0.267 517 T C 1.688 176.493 174.700 0.175 0.000 1.036 517 T CA 1.405 63.597 62.100 0.154 0.000 1.148 517 T CB -1.200 67.740 68.868 0.119 0.000 0.863 517 T HN 0.123 8.363 8.240 0.000 0.000 0.436 518 Y N 1.606 121.952 120.300 0.078 0.000 2.200 518 Y HA -0.073 4.476 4.550 -0.002 0.000 0.290 518 Y C 2.789 178.724 175.900 0.059 0.000 1.137 518 Y CA 1.354 59.486 58.100 0.053 0.000 1.163 518 Y CB -0.069 38.405 38.460 0.024 0.000 0.988 518 Y HN -0.049 8.231 8.280 0.000 0.000 0.518 519 R N 0.629 121.307 120.500 0.298 0.000 2.092 519 R HA -0.174 4.165 4.340 -0.002 0.000 0.231 519 R C 2.429 178.874 176.300 0.241 0.000 1.119 519 R CA 1.615 57.827 56.100 0.186 0.000 0.970 519 R CB -0.205 30.196 30.300 0.170 0.000 0.864 519 R HN 0.288 8.558 8.270 0.000 0.000 0.440 520 K N -0.076 120.559 120.400 0.393 0.000 2.026 520 K HA -0.135 4.184 4.320 -0.002 0.000 0.208 520 K C 1.881 178.627 176.600 0.243 0.000 1.048 520 K CA 1.532 58.089 56.287 0.450 0.000 0.929 520 K CB -0.158 32.537 32.500 0.325 0.000 0.713 520 K HN 0.222 8.472 8.250 0.000 0.000 0.439 521 A N 0.918 123.788 122.820 0.084 0.000 1.933 521 A HA -0.090 4.229 4.320 -0.002 0.000 0.218 521 A C 2.280 179.826 177.584 -0.063 0.000 1.175 521 A CA 1.804 53.830 52.037 -0.018 0.000 0.628 521 A CB -0.683 18.246 19.000 -0.118 0.000 0.814 521 A HN 0.494 8.644 8.150 0.000 0.000 0.444 522 A N -1.246 121.489 122.820 -0.142 0.000 1.898 522 A HA 0.014 4.333 4.320 -0.002 0.000 0.216 522 A C 1.926 179.464 177.584 -0.077 0.000 1.181 522 A CA 1.451 53.387 52.037 -0.168 0.000 0.620 522 A CB -0.697 18.161 19.000 -0.237 0.000 0.819 522 A HN 0.436 8.586 8.150 0.000 0.000 0.442 523 F N -0.161 119.777 119.950 -0.020 0.000 2.134 523 F HA -0.139 4.388 4.527 -0.001 0.000 0.299 523 F C 2.475 178.356 175.800 0.135 0.000 1.097 523 F CA 1.471 59.505 58.000 0.057 0.000 1.264 523 F CB -0.460 38.551 39.000 0.019 0.000 1.001 523 F HN 0.032 8.332 8.300 0.000 0.000 0.479 524 V N 0.028 120.103 119.914 0.269 0.000 2.295 524 V HA -0.318 3.801 4.120 -0.002 0.000 0.246 524 V C 2.456 178.616 176.094 0.110 0.000 1.049 524 V CA 2.094 64.496 62.300 0.170 0.000 1.024 524 V CB -0.603 31.288 31.823 0.113 0.000 0.648 524 V HN 0.253 8.443 8.190 0.000 0.000 0.447 525 K N -0.744 119.703 120.400 0.077 0.000 2.032 525 K HA -0.270 4.049 4.320 -0.002 0.000 0.209 525 K C 2.288 178.927 176.600 0.065 0.000 1.048 525 K CA 2.161 58.472 56.287 0.039 0.000 0.927 525 K CB -0.423 32.078 32.500 0.001 0.000 0.712 525 K HN 0.505 8.755 8.250 0.000 0.000 0.441 526 Y N 1.922 122.208 120.300 -0.023 0.000 2.128 526 Y HA -0.280 4.269 4.550 -0.002 0.000 0.284 526 Y C 2.084 177.988 175.900 0.005 0.000 1.154 526 Y CA 2.079 60.165 58.100 -0.022 0.000 1.149 526 Y CB -0.393 38.045 38.460 -0.036 0.000 0.976 526 Y HN 0.228 8.508 8.280 0.000 0.000 0.505 527 Q N -0.075 119.675 119.800 -0.084 0.000 2.084 527 Q HA -0.213 4.126 4.340 -0.002 0.000 0.202 527 Q C 2.183 178.093 176.000 -0.149 0.000 0.978 527 Q CA 2.037 57.742 55.803 -0.163 0.000 0.844 527 Q CB -0.200 28.570 28.738 0.054 0.000 0.898 527 Q HN 0.632 8.902 8.270 0.000 0.000 0.426 528 E N 0.502 120.657 120.200 -0.075 0.000 2.072 528 E HA -0.179 4.170 4.350 -0.002 0.000 0.191 528 E C 1.570 178.102 176.600 -0.114 0.000 0.985 528 E CA 1.163 57.520 56.400 -0.072 0.000 0.801 528 E CB 0.061 29.740 29.700 -0.035 0.000 0.750 528 E HN 0.316 8.676 8.360 0.000 0.000 0.452 529 D N 0.094 120.417 120.400 -0.130 0.000 2.144 529 D HA -0.106 4.533 4.640 -0.002 0.000 0.200 529 D C 1.882 178.032 176.300 -0.250 0.000 0.978 529 D CA 0.849 54.760 54.000 -0.150 0.000 0.833 529 D CB -0.035 40.709 40.800 -0.093 0.000 0.961 529 D HN 0.103 8.473 8.370 0.000 0.000 0.470 530 M N 0.599 119.991 119.600 -0.346 0.000 2.132 530 M HA -0.091 4.388 4.480 -0.002 0.000 0.263 530 M C 1.568 177.684 176.300 -0.308 0.000 1.065 530 M CA 0.957 55.998 55.300 -0.432 0.000 1.122 530 M CB -0.807 31.431 32.600 -0.603 0.000 1.365 530 M HN -0.022 8.268 8.290 0.000 0.000 0.411 531 N N 0.432 119.016 118.700 -0.193 0.000 2.188 531 N HA -0.139 4.600 4.740 -0.002 0.000 0.184 531 N C 1.654 177.159 175.510 -0.009 0.000 1.018 531 N CA 1.081 54.115 53.050 -0.027 0.000 0.858 531 N CB -0.286 38.185 38.487 -0.027 0.000 0.989 531 N HN 0.407 8.787 8.380 0.000 0.000 0.426 532 K N 0.996 121.338 120.400 -0.098 0.000 2.062 532 K HA -0.014 4.305 4.320 -0.002 0.000 0.205 532 K C 1.566 178.063 176.600 -0.173 0.000 1.051 532 K CA 0.894 57.128 56.287 -0.087 0.000 0.941 532 K CB 0.202 32.648 32.500 -0.089 0.000 0.719 532 K HN -0.080 8.170 8.250 0.000 0.000 0.440 533 K N 0.039 120.238 120.400 -0.335 0.000 2.097 533 K HA -0.058 4.261 4.320 -0.002 0.000 0.205 533 K C 0.943 177.164 176.600 -0.630 0.000 1.050 533 K CA 1.043 56.951 56.287 -0.631 0.000 0.938 533 K CB -0.220 31.658 32.500 -1.036 0.000 0.718 533 K HN 0.356 8.606 8.250 0.000 0.000 0.442 534 A N 0.721 123.281 122.820 -0.432 0.000 2.869 534 A HA -0.204 4.115 4.320 -0.002 0.000 0.280 534 A C 0.528 178.063 177.584 -0.081 0.000 1.458 534 A CA 0.970 52.866 52.037 -0.234 0.000 0.776 534 A CB -2.488 16.432 19.000 -0.133 0.000 1.028 534 A HN 0.320 8.470 8.150 0.000 0.000 0.547 535 Y N -1.126 119.081 120.300 -0.155 0.000 2.373 535 Y HA 0.230 4.779 4.550 -0.002 0.000 0.293 535 Y C 1.499 177.393 175.900 -0.010 0.000 1.129 535 Y CA 1.289 59.352 58.100 -0.060 0.000 1.226 535 Y CB -0.290 37.911 38.460 -0.431 0.000 1.000 535 Y HN 0.982 9.262 8.280 0.000 0.000 0.549 536 V N -2.499 117.363 119.914 -0.087 0.000 3.078 536 V HA 0.594 4.713 4.120 -0.002 0.000 0.311 536 V C -0.857 175.036 176.094 -0.335 0.000 1.138 536 V CA -1.419 60.716 62.300 -0.275 0.000 1.007 536 V CB 2.978 34.627 31.823 -0.290 0.000 1.045 536 V HN -0.180 8.010 8.190 0.000 0.000 0.432 537 I N 2.280 122.608 120.570 -0.403 0.000 2.418 537 I HA 0.558 4.727 4.170 -0.002 0.000 0.287 537 I C -2.696 173.282 176.117 -0.231 0.000 1.008 537 I CA -2.423 58.648 61.300 -0.383 0.000 1.104 537 I CB 1.609 39.294 38.000 -0.525 0.000 1.264 537 I HN 0.498 8.708 8.210 0.000 0.000 0.438 538 P HA 0.232 4.652 4.420 0.000 0.000 0.268 538 P C 0.283 177.516 177.300 -0.112 0.000 1.205 538 P CA 0.217 63.260 63.100 -0.096 0.000 0.771 538 P CB 1.121 32.775 31.700 -0.076 0.000 0.858 539 T N 0.841 115.335 114.554 -0.100 0.000 3.480 539 T HA 0.142 4.491 4.350 -0.002 0.000 0.229 539 T C 0.168 174.812 174.700 -0.094 0.000 0.944 539 T CA 0.422 62.479 62.100 -0.071 0.000 1.388 539 T CB -0.266 68.592 68.868 -0.018 0.000 1.180 539 T HN 0.388 8.628 8.240 0.000 0.000 0.414 540 N N -0.141 118.536 118.700 -0.039 0.000 2.240 540 N HA 0.588 5.328 4.740 -0.002 0.000 0.302 540 N C -1.691 173.880 175.510 0.101 0.000 1.106 540 N CA -0.626 52.422 53.050 -0.004 0.000 0.778 540 N CB 1.792 40.370 38.487 0.151 0.000 1.431 540 N HN 0.046 8.426 8.380 0.000 0.000 0.479 541 F N 1.012 121.077 119.950 0.193 0.000 2.408 541 F HA 0.627 5.153 4.527 -0.001 0.000 0.325 541 F C 0.342 176.225 175.800 0.138 0.000 1.082 541 F CA -0.687 57.435 58.000 0.204 0.000 1.032 541 F CB 0.936 40.011 39.000 0.124 0.000 1.259 541 F HN 0.185 8.485 8.300 0.000 0.000 0.503 542 M N 1.204 120.973 119.600 0.281 0.000 2.569 542 M HA 0.527 5.006 4.480 -0.002 0.000 0.279 542 M C -1.952 174.347 176.300 -0.003 0.000 1.253 542 M CA -0.478 54.841 55.300 0.033 0.000 0.867 542 M CB 2.484 34.925 32.600 -0.265 0.000 1.727 542 M HN 0.394 8.684 8.290 0.000 0.000 0.467 543 L N 2.706 123.897 121.223 -0.052 0.000 2.309 543 L HA 0.522 4.861 4.340 -0.002 0.000 0.282 543 L C -0.433 176.375 176.870 -0.103 0.000 1.036 543 L CA -1.046 53.756 54.840 -0.064 0.000 0.806 543 L CB 1.393 43.406 42.059 -0.077 0.000 1.220 543 L HN 0.643 8.873 8.230 0.000 0.000 0.429 544 N N 1.532 120.183 118.700 -0.082 0.000 2.493 544 N HA 0.444 5.183 4.740 -0.002 0.000 0.275 544 N C -1.045 174.447 175.510 -0.031 0.000 1.186 544 N CA -0.198 52.790 53.050 -0.103 0.000 0.978 544 N CB 1.442 39.868 38.487 -0.101 0.000 1.184 544 N HN 0.463 8.843 8.380 0.000 0.000 0.487 545 Y N -2.651 117.543 120.300 -0.176 0.000 2.562 545 Y HA 0.682 5.231 4.550 -0.002 0.000 0.345 545 Y C -1.088 174.767 175.900 -0.075 0.000 1.045 545 Y CA -0.881 57.153 58.100 -0.111 0.000 1.028 545 Y CB 1.367 39.767 38.460 -0.101 0.000 1.297 545 Y HN 0.208 8.488 8.280 0.000 0.000 0.463 546 T N 4.645 119.200 114.554 0.003 0.000 3.031 546 T HA 0.394 4.743 4.350 -0.002 0.000 0.305 546 T C -3.126 171.614 174.700 0.066 0.000 0.985 546 T CA -1.385 60.669 62.100 -0.077 0.000 1.008 546 T CB 1.822 70.638 68.868 -0.087 0.000 1.005 546 T HN 0.492 8.732 8.240 0.000 0.000 0.444 547 P HA 0.462 4.882 4.420 0.000 0.000 0.279 547 P C -1.065 176.328 177.300 0.156 0.000 1.239 547 P CA -0.436 62.728 63.100 0.107 0.000 0.789 547 P CB 1.062 32.737 31.700 -0.041 0.000 0.933 548 V N 3.310 123.374 119.914 0.249 0.000 2.525 548 V HA 0.243 4.362 4.120 -0.002 0.000 0.299 548 V C 0.517 176.724 176.094 0.188 0.000 1.034 548 V CA -0.947 61.468 62.300 0.193 0.000 0.863 548 V CB 1.451 33.311 31.823 0.063 0.000 0.999 548 V HN 0.627 8.817 8.190 0.000 0.000 0.423 549 N N 3.810 122.550 118.700 0.065 0.000 2.412 549 N HA 0.035 4.774 4.740 -0.002 0.000 0.254 549 N C 1.052 176.450 175.510 -0.187 0.000 1.232 549 N CA 0.256 53.102 53.050 -0.341 0.000 0.880 549 N CB 0.935 39.260 38.487 -0.270 0.000 1.076 549 N HN 0.641 9.021 8.380 0.000 0.000 0.458 550 K N 2.380 122.644 120.400 -0.227 0.000 2.360 550 K HA -0.162 4.157 4.320 -0.002 0.000 0.201 550 K C 1.692 178.237 176.600 -0.092 0.000 1.046 550 K CA 0.891 57.105 56.287 -0.122 0.000 0.945 550 K CB 0.043 32.477 32.500 -0.110 0.000 0.750 550 K HN 0.630 8.880 8.250 0.000 0.000 0.464 551 R N 0.437 120.876 120.500 -0.101 0.000 2.235 551 R HA 0.005 4.344 4.340 -0.002 0.000 0.213 551 R C 0.274 176.547 176.300 -0.045 0.000 1.059 551 R CA 0.388 56.448 56.100 -0.066 0.000 0.997 551 R CB -0.148 30.114 30.300 -0.064 0.000 0.884 551 R HN -0.160 8.110 8.270 0.000 0.000 0.462 552 V N 3.088 122.974 119.914 -0.046 0.000 2.498 552 V HA 0.225 4.344 4.120 -0.002 0.000 0.279 552 V C 0.281 176.355 176.094 -0.034 0.000 1.048 552 V CA -0.739 61.542 62.300 -0.031 0.000 0.967 552 V CB 1.298 33.105 31.823 -0.027 0.000 0.988 552 V HN 0.213 8.403 8.190 0.000 0.000 0.473 553 V N 1.813 121.710 119.914 -0.029 0.000 2.628 553 V HA 1.010 5.129 4.120 -0.002 0.000 0.306 553 V C 0.794 176.863 176.094 -0.042 0.000 1.045 553 V CA 0.120 62.400 62.300 -0.033 0.000 0.905 553 V CB 0.983 32.792 31.823 -0.023 0.000 0.997 553 V HN 1.337 9.527 8.190 0.000 0.000 0.436 554 G N 2.557 111.324 108.800 -0.055 0.000 2.175 554 G HA2 -0.214 3.745 3.960 -0.002 0.000 0.244 554 G HA3 -0.214 3.745 3.960 -0.002 0.000 0.244 554 G C -0.160 174.667 174.900 -0.121 0.000 0.982 554 G CA 0.331 45.387 45.100 -0.074 0.000 0.641 554 G HN 1.334 9.624 8.290 0.000 0.000 0.527 555 M N 1.646 121.172 119.600 -0.123 0.000 2.242 555 M HA 0.733 5.212 4.480 -0.002 0.000 0.344 555 M C 0.285 176.496 176.300 -0.148 0.000 1.140 555 M CA 0.415 55.612 55.300 -0.172 0.000 1.160 555 M CB 1.358 33.872 32.600 -0.143 0.000 1.491 555 M HN 0.414 8.704 8.290 0.000 0.000 0.459 556 T N 3.964 118.408 114.554 -0.183 0.000 2.885 556 T HA 0.537 4.886 4.350 -0.002 0.000 0.322 556 T C -0.503 174.092 174.700 -0.175 0.000 1.387 556 T CA -0.735 61.272 62.100 -0.155 0.000 1.041 556 T CB 0.726 69.506 68.868 -0.147 0.000 1.287 556 T HN 0.689 8.929 8.240 0.000 0.000 0.491 557 L N 1.923 123.043 121.223 -0.173 0.000 2.910 557 L HA 0.372 4.711 4.340 -0.002 0.000 0.252 557 L C -0.263 176.400 176.870 -0.345 0.000 1.195 557 L CA -0.341 54.359 54.840 -0.234 0.000 1.003 557 L CB 0.399 42.340 42.059 -0.197 0.000 1.328 557 L HN 0.526 8.756 8.230 0.000 0.000 0.540 558 D N 0.093 120.342 120.400 -0.251 0.000 2.389 558 D HA 0.131 4.770 4.640 -0.002 0.000 0.247 558 D C -0.251 175.917 176.300 -0.220 0.000 1.128 558 D CA 0.266 54.130 54.000 -0.228 0.000 0.884 558 D CB 0.630 41.355 40.800 -0.125 0.000 1.194 558 D HN -0.126 8.244 8.370 0.000 0.000 0.441 559 Y N 0.258 120.534 120.300 -0.040 0.000 2.336 559 Y HA 0.351 4.900 4.550 -0.002 0.000 0.331 559 Y C 1.919 177.756 175.900 -0.105 0.000 1.211 559 Y CA 0.360 58.435 58.100 -0.042 0.000 1.346 559 Y CB 1.018 39.418 38.460 -0.100 0.000 1.271 559 Y HN 0.633 8.913 8.280 0.000 0.000 0.538 560 G N 0.501 109.358 108.800 0.095 0.000 2.199 560 G HA2 -0.216 3.743 3.960 -0.002 0.000 0.254 560 G HA3 -0.216 3.743 3.960 -0.002 0.000 0.254 560 G C 0.178 175.058 174.900 -0.034 0.000 0.982 560 G CA -0.174 44.927 45.100 0.003 0.000 0.632 560 G HN 1.048 9.338 8.290 0.000 0.000 0.529 561 A N 0.635 123.430 122.820 -0.042 0.000 2.347 561 A HA 0.716 5.035 4.320 -0.002 0.000 0.287 561 A C 1.242 178.749 177.584 -0.128 0.000 1.199 561 A CA 0.386 52.367 52.037 -0.092 0.000 0.851 561 A CB 0.095 19.031 19.000 -0.107 0.000 1.118 561 A HN 0.282 8.432 8.150 0.000 0.000 0.525 562 M N 1.442 120.907 119.600 -0.226 0.000 2.382 562 M HA 0.136 4.615 4.480 -0.002 0.000 0.247 562 M C 0.374 176.510 176.300 -0.273 0.000 1.104 562 M CA 0.551 55.592 55.300 -0.432 0.000 1.030 562 M CB -0.308 31.604 32.600 -1.148 0.000 1.424 562 M HN 0.703 8.993 8.290 0.000 0.000 0.486 563 N N -0.080 118.537 118.700 -0.139 0.000 2.377 563 N HA 0.142 4.881 4.740 -0.002 0.000 0.259 563 N C 0.745 176.225 175.510 -0.050 0.000 1.332 563 N CA 0.160 53.197 53.050 -0.023 0.000 0.877 563 N CB 0.747 39.245 38.487 0.018 0.000 1.299 563 N HN 0.092 8.472 8.380 0.000 0.000 0.501 564 T N -0.537 113.923 114.554 -0.156 0.000 2.665 564 T HA -0.175 4.174 4.350 -0.002 0.000 0.268 564 T C 1.448 175.981 174.700 -0.278 0.000 1.035 564 T CA 1.452 63.370 62.100 -0.302 0.000 1.151 564 T CB -0.199 68.358 68.868 -0.519 0.000 0.862 564 T HN 0.454 8.694 8.240 0.000 0.000 0.438 565 W N 1.266 122.579 121.300 0.020 0.000 2.465 565 W HA 0.001 4.660 4.660 -0.001 0.000 0.268 565 W C 2.745 179.354 176.519 0.151 0.000 1.242 565 W CA 0.241 57.627 57.345 0.068 0.000 1.248 565 W CB -0.285 29.220 29.460 0.076 0.000 1.118 565 W HN 0.149 8.329 8.180 0.000 0.000 0.587 566 S N -0.257 115.578 115.700 0.226 0.000 2.470 566 S HA -0.068 4.401 4.470 -0.002 0.000 0.225 566 S C 1.297 175.949 174.600 0.086 0.000 1.006 566 S CA 0.792 59.069 58.200 0.128 0.000 0.934 566 S CB -0.053 63.190 63.200 0.072 0.000 0.778 566 S HN 0.344 8.654 8.310 0.000 0.000 0.517 567 E N 0.517 120.744 120.200 0.045 0.000 2.276 567 E HA 0.180 4.529 4.350 -0.002 0.000 0.193 567 E C 0.015 176.617 176.600 0.004 0.000 0.983 567 E CA 0.064 56.469 56.400 0.009 0.000 0.861 567 E CB 0.180 29.862 29.700 -0.030 0.000 0.817 567 E HN 0.423 8.783 8.360 0.000 0.000 0.485 568 I N 1.311 121.883 120.570 0.005 0.000 2.648 568 I HA 0.123 4.292 4.170 -0.002 0.000 0.284 568 I C 0.690 176.835 176.117 0.046 0.000 1.153 568 I CA 0.133 61.430 61.300 -0.004 0.000 1.426 568 I CB 0.890 38.872 38.000 -0.030 0.000 1.381 568 I HN -0.006 8.204 8.210 0.000 0.000 0.571 569 G N 4.613 113.426 108.800 0.023 0.000 2.682 569 G HA2 0.705 4.664 3.960 -0.002 0.000 0.290 569 G HA3 0.705 4.664 3.960 -0.002 0.000 0.290 569 G C -1.129 173.780 174.900 0.015 0.000 1.425 569 G CA -0.384 44.735 45.100 0.033 0.000 0.807 569 G HN 0.633 8.923 8.290 0.000 0.000 0.482 570 V N 0.000 119.924 119.914 0.017 0.000 2.409 570 V HA 0.000 4.119 4.120 -0.002 0.000 0.244 570 V CA 0.000 62.303 62.300 0.004 0.000 1.235 570 V CB 0.000 31.827 31.823 0.006 0.000 1.184 570 V HN 0.000 8.190 8.190 0.000 0.000 0.556