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 1rus_1_A DATA FIRST_RESID 3 DATA SEQUENCE QSSRYVNLAL KEEDLIAGGE HVLCAYIMKP KAGYGYVATA AHFAAESSTG DATA SEQUENCE TXXXXXXXXX XTRGVDALVY EVDEARELTK IAYPVALFDR NITDGKAMIA DATA SEQUENCE SFLTLTMGNN QGMGDVEYAK MHDFYVPEAY RALFDGPSVN ISALWKVLGR DATA SEQUENCE PEVDGGLVVG TIIKPKLGLR PKPFAEACHA FWLGGDFIKN DEPQGNQPFA DATA SEQUENCE PLRDTIALVA DAMRRAQDET GEAKLFSANI TADDPFEIIA RGEYVLETFG DATA SEQUENCE ENASHVALLV DGYVAGAAAI TTARRRFPDN FLHYHRAGHG AVTSPQSKRG DATA SEQUENCE YTAFVHCKMA RLQGASGIHT GTMXXXXXXX XSSDRAIAYM LTQDEAQGPF DATA SEQUENCE YRQSWGGMKA CTPIISGGMN ALRMPGFFEN LGNANVILTA GGGAFGHIDG DATA SEQUENCE PVAGARSLRQ AWQAWRDGVP VLDYAREHKE LARAFESFPG DADQIYPGWR DATA SEQUENCE KALGV 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 3 Q HA 0.000 4.340 4.340 -0.000 0.000 0.214 3 Q C 0.000 176.055 176.000 0.091 0.000 1.003 3 Q CA 0.000 55.922 55.803 0.199 0.000 1.022 3 Q CB 0.000 28.793 28.738 0.092 0.000 1.108 4 S N -0.347 115.412 115.700 0.098 0.000 2.430 4 S HA -0.365 4.106 4.470 0.003 0.000 0.536 4 S C 1.397 176.018 174.600 0.034 0.000 0.920 4 S CA 2.271 60.509 58.200 0.064 0.000 3.374 4 S CB -1.418 61.807 63.200 0.042 0.000 2.344 4 S HN 0.640 8.950 8.310 -0.000 0.000 0.568 5 S N 0.538 116.240 115.700 0.003 0.000 2.440 5 S HA -0.083 4.389 4.470 0.003 0.000 0.240 5 S C 1.853 176.412 174.600 -0.069 0.000 1.014 5 S CA 1.487 59.674 58.200 -0.021 0.000 0.980 5 S CB -0.215 62.970 63.200 -0.025 0.000 0.775 5 S HN 0.411 8.721 8.310 -0.000 0.000 0.499 6 R N -0.858 119.562 120.500 -0.134 0.000 2.052 6 R HA 0.029 4.371 4.340 0.003 0.000 0.226 6 R C 0.807 176.866 176.300 -0.400 0.000 1.145 6 R CA 1.207 57.102 56.100 -0.342 0.000 0.952 6 R CB -0.158 29.811 30.300 -0.552 0.000 0.847 6 R HN 0.407 8.677 8.270 -0.000 0.000 0.431 7 Y N -0.508 119.801 120.300 0.015 0.000 2.583 7 Y HA 0.262 4.814 4.550 0.003 0.000 0.294 7 Y C -0.432 175.479 175.900 0.018 0.000 1.170 7 Y CA -0.187 57.922 58.100 0.015 0.000 1.265 7 Y CB 0.880 39.349 38.460 0.015 0.000 1.119 7 Y HN -0.204 8.076 8.280 -0.000 0.000 0.522 8 V N 1.491 121.475 119.914 0.116 0.000 2.443 8 V HA 0.313 4.435 4.120 0.003 0.000 0.293 8 V C -0.653 175.477 176.094 0.060 0.000 1.021 8 V CA -0.727 61.625 62.300 0.086 0.000 0.848 8 V CB 1.670 33.538 31.823 0.075 0.000 0.998 8 V HN 0.227 8.417 8.190 -0.000 0.000 0.424 9 N N 4.785 123.527 118.700 0.071 0.000 2.765 9 N HA 0.293 5.035 4.740 0.003 0.000 0.277 9 N C 0.730 176.284 175.510 0.073 0.000 1.750 9 N CA -0.327 52.759 53.050 0.059 0.000 0.827 9 N CB 0.697 39.214 38.487 0.050 0.000 1.200 9 N HN 0.613 8.993 8.380 -0.000 0.000 0.494 10 L N -0.072 121.188 121.223 0.060 0.000 2.651 10 L HA -0.029 4.313 4.340 0.003 0.000 0.236 10 L C 1.390 178.294 176.870 0.056 0.000 1.173 10 L CA 0.843 55.718 54.840 0.058 0.000 0.843 10 L CB -0.371 41.711 42.059 0.039 0.000 0.964 10 L HN 0.340 8.570 8.230 -0.000 0.000 0.454 11 A N -0.400 122.450 122.820 0.050 0.000 2.465 11 A HA 0.336 4.658 4.320 0.003 0.000 0.255 11 A C 0.691 178.298 177.584 0.037 0.000 1.274 11 A CA -0.333 51.727 52.037 0.037 0.000 0.920 11 A CB 0.141 19.156 19.000 0.024 0.000 1.033 11 A HN 0.237 8.387 8.150 -0.000 0.000 0.516 12 L N 1.539 122.796 121.223 0.057 0.000 2.290 12 L HA 0.226 4.568 4.340 0.003 0.000 0.284 12 L C -0.216 176.683 176.870 0.049 0.000 1.078 12 L CA -0.618 54.246 54.840 0.040 0.000 0.815 12 L CB 0.971 43.068 42.059 0.063 0.000 1.162 12 L HN 0.080 8.310 8.230 -0.000 0.000 0.435 13 K N 3.718 124.118 120.400 -0.000 0.000 2.316 13 K HA 0.003 4.324 4.320 0.003 0.000 0.289 13 K C 0.881 177.446 176.600 -0.059 0.000 1.070 13 K CA -0.002 56.282 56.287 -0.004 0.000 0.928 13 K CB 1.121 33.611 32.500 -0.016 0.000 1.039 13 K HN 0.568 8.818 8.250 -0.000 0.000 0.480 14 E N 2.586 122.759 120.200 -0.044 0.000 2.219 14 E HA -0.264 4.088 4.350 0.003 0.000 0.198 14 E C 0.184 176.693 176.600 -0.152 0.000 0.998 14 E CA 1.654 57.944 56.400 -0.183 0.000 0.818 14 E CB 0.330 30.031 29.700 0.002 0.000 0.741 14 E HN 0.493 8.853 8.360 -0.000 0.000 0.477 15 E N 0.739 120.886 120.200 -0.087 0.000 2.204 15 E HA -0.141 4.211 4.350 0.003 0.000 0.194 15 E C 1.604 178.165 176.600 -0.066 0.000 0.989 15 E CA 1.206 57.562 56.400 -0.073 0.000 0.824 15 E CB -0.025 29.650 29.700 -0.042 0.000 0.756 15 E HN 0.338 8.698 8.360 -0.000 0.000 0.477 16 D N -0.083 120.275 120.400 -0.070 0.000 2.120 16 D HA -0.025 4.617 4.640 0.003 0.000 0.202 16 D C 1.963 178.231 176.300 -0.053 0.000 0.972 16 D CA 0.614 54.584 54.000 -0.050 0.000 0.837 16 D CB 0.059 40.829 40.800 -0.050 0.000 0.989 16 D HN 0.161 8.531 8.370 -0.000 0.000 0.469 17 L N 0.749 121.904 121.223 -0.114 0.000 2.017 17 L HA -0.154 4.188 4.340 0.003 0.000 0.208 17 L C 2.598 179.466 176.870 -0.002 0.000 1.073 17 L CA 0.841 55.606 54.840 -0.125 0.000 0.745 17 L CB -0.378 41.495 42.059 -0.310 0.000 0.894 17 L HN 0.013 8.243 8.230 -0.000 0.000 0.432 18 I N -0.016 120.512 120.570 -0.069 0.000 2.226 18 I HA -0.267 3.905 4.170 0.003 0.000 0.245 18 I C 2.715 178.861 176.117 0.050 0.000 1.100 18 I CA 1.259 62.502 61.300 -0.093 0.000 1.374 18 I CB -0.467 37.327 38.000 -0.343 0.000 1.057 18 I HN 0.197 8.407 8.210 -0.000 0.000 0.413 19 A N 0.685 123.517 122.820 0.022 0.000 2.067 19 A HA 0.036 4.358 4.320 0.003 0.000 0.217 19 A C 2.356 179.980 177.584 0.066 0.000 1.156 19 A CA 1.378 53.439 52.037 0.040 0.000 0.683 19 A CB -1.060 17.946 19.000 0.010 0.000 0.808 19 A HN 0.450 8.600 8.150 -0.000 0.000 0.455 20 G N -0.827 108.018 108.800 0.076 0.000 2.424 20 G HA2 0.262 4.223 3.960 0.003 0.000 0.214 20 G HA3 0.262 4.223 3.960 0.003 0.000 0.214 20 G C 1.314 176.291 174.900 0.128 0.000 1.202 20 G CA 0.871 46.028 45.100 0.095 0.000 0.793 20 G HN 1.674 9.964 8.290 -0.000 0.000 0.534 21 G N -0.587 108.320 108.800 0.179 0.000 2.142 21 G HA2 -0.194 3.768 3.960 0.003 0.000 0.225 21 G HA3 -0.194 3.768 3.960 0.003 0.000 0.225 21 G C 0.580 175.580 174.900 0.167 0.000 1.015 21 G CA 0.653 45.868 45.100 0.191 0.000 0.716 21 G HN 0.510 8.800 8.290 -0.000 0.000 0.508 22 E N -0.629 119.694 120.200 0.205 0.000 2.562 22 E HA 0.101 4.453 4.350 0.003 0.000 0.214 22 E C 0.067 176.712 176.600 0.075 0.000 0.979 22 E CA -0.200 56.279 56.400 0.132 0.000 1.002 22 E CB 0.509 30.274 29.700 0.110 0.000 1.048 22 E HN 0.710 9.070 8.360 -0.000 0.000 0.488 23 H N -0.046 119.116 119.070 0.154 0.000 2.572 23 H HA 0.310 4.867 4.556 0.003 0.000 0.359 23 H C -0.572 174.908 175.328 0.253 0.000 1.134 23 H CA -0.646 55.520 56.048 0.197 0.000 1.187 23 H CB 2.479 32.336 29.762 0.159 0.000 1.597 23 H HN -0.159 8.120 8.280 -0.000 0.000 0.524 24 V N 4.455 124.610 119.914 0.401 0.000 2.509 24 V HA 0.117 4.238 4.120 0.003 0.000 0.284 24 V C -0.295 176.084 176.094 0.475 0.000 1.047 24 V CA -0.507 62.018 62.300 0.374 0.000 0.952 24 V CB 1.225 33.260 31.823 0.353 0.000 0.988 24 V HN 0.379 8.569 8.190 -0.000 0.000 0.469 25 L N 4.222 125.672 121.223 0.378 0.000 2.362 25 L HA 0.637 4.978 4.340 0.003 0.000 0.271 25 L C -0.334 176.705 176.870 0.281 0.000 1.002 25 L CA -0.358 54.720 54.840 0.397 0.000 0.818 25 L CB 1.487 43.759 42.059 0.355 0.000 1.298 25 L HN 0.654 8.884 8.230 -0.000 0.000 0.420 26 C N 1.366 120.931 119.300 0.443 0.000 2.712 26 C HA 0.903 5.364 4.460 0.003 0.000 0.308 26 C C 0.158 175.273 174.990 0.208 0.000 1.201 26 C CA -0.945 58.236 59.018 0.272 0.000 1.554 26 C CB 1.616 29.514 27.740 0.264 0.000 2.117 26 C HN 0.917 9.147 8.230 -0.000 0.000 0.480 27 A N 2.318 125.173 122.820 0.058 0.000 2.318 27 A HA 0.880 5.202 4.320 0.003 0.000 0.317 27 A C -1.442 176.084 177.584 -0.096 0.000 1.159 27 A CA -0.279 51.731 52.037 -0.044 0.000 0.799 27 A CB 0.478 19.355 19.000 -0.205 0.000 1.194 27 A HN 0.842 8.992 8.150 -0.000 0.000 0.479 28 Y N 0.537 120.870 120.300 0.054 0.000 2.576 28 Y HA 0.655 5.207 4.550 0.002 0.000 0.346 28 Y C -0.311 175.600 175.900 0.018 0.000 1.018 28 Y CA -0.863 57.302 58.100 0.108 0.000 1.050 28 Y CB 2.196 40.693 38.460 0.062 0.000 1.280 28 Y HN 0.436 8.716 8.280 -0.000 0.000 0.474 29 I N 3.082 123.810 120.570 0.263 0.000 2.750 29 I HA 0.252 4.424 4.170 0.003 0.000 0.279 29 I C -0.797 175.502 176.117 0.304 0.000 1.206 29 I CA -0.033 61.382 61.300 0.192 0.000 1.101 29 I CB 0.299 38.332 38.000 0.056 0.000 1.431 29 I HN 0.500 8.710 8.210 -0.000 0.000 0.551 30 M N 5.046 124.740 119.600 0.158 0.000 2.404 30 M HA 0.492 4.974 4.480 0.003 0.000 0.338 30 M C -1.421 174.826 176.300 -0.088 0.000 1.150 30 M CA -0.437 54.864 55.300 0.001 0.000 1.016 30 M CB 1.689 34.079 32.600 -0.350 0.000 1.672 30 M HN 0.224 8.514 8.290 -0.000 0.000 0.448 31 K N 5.292 125.473 120.400 -0.365 0.000 2.426 31 K HA 0.575 4.897 4.320 0.003 0.000 0.254 31 K C -2.729 173.663 176.600 -0.346 0.000 0.936 31 K CA -1.688 54.366 56.287 -0.388 0.000 0.801 31 K CB 2.289 34.362 32.500 -0.712 0.000 1.139 31 K HN 0.376 8.626 8.250 -0.000 0.000 0.424 32 P HA 0.083 4.503 4.420 -0.000 0.000 0.276 32 P C -0.443 176.801 177.300 -0.093 0.000 1.230 32 P CA -0.372 62.621 63.100 -0.178 0.000 0.776 32 P CB 0.586 32.211 31.700 -0.125 0.000 0.888 33 K N 1.922 122.246 120.400 -0.127 0.000 2.402 33 K HA 0.072 4.394 4.320 0.003 0.000 0.265 33 K C 0.475 177.212 176.600 0.228 0.000 0.978 33 K CA 0.116 56.397 56.287 -0.010 0.000 0.913 33 K CB 0.134 32.582 32.500 -0.086 0.000 0.954 33 K HN 0.567 8.817 8.250 -0.000 0.000 0.511 34 A N 1.227 124.157 122.820 0.183 0.000 2.515 34 A HA 0.225 4.547 4.320 0.003 0.000 0.276 34 A C 1.237 178.896 177.584 0.126 0.000 1.104 34 A CA 1.178 53.298 52.037 0.138 0.000 0.822 34 A CB -1.306 17.749 19.000 0.091 0.000 1.016 34 A HN 0.891 9.041 8.150 -0.000 0.000 0.530 35 G N 1.657 110.505 108.800 0.080 0.000 2.258 35 G HA2 -0.270 3.692 3.960 0.003 0.000 0.233 35 G HA3 -0.270 3.692 3.960 0.003 0.000 0.233 35 G C 0.193 175.066 174.900 -0.045 0.000 1.006 35 G CA 0.221 45.307 45.100 -0.023 0.000 0.620 35 G HN 0.767 9.057 8.290 -0.000 0.000 0.511 36 Y N 1.881 122.180 120.300 -0.001 0.000 2.610 36 Y HA 0.384 4.935 4.550 0.002 0.000 0.332 36 Y C 1.749 177.651 175.900 0.003 0.000 1.201 36 Y CA 0.591 58.689 58.100 -0.003 0.000 1.465 36 Y CB 0.465 38.916 38.460 -0.014 0.000 1.283 36 Y HN 0.388 8.668 8.280 -0.000 0.000 0.563 37 G N 2.262 111.145 108.800 0.137 0.000 2.464 37 G HA2 -0.202 3.760 3.960 0.003 0.000 0.231 37 G HA3 -0.202 3.760 3.960 0.003 0.000 0.231 37 G C 0.233 175.193 174.900 0.099 0.000 1.267 37 G CA -0.211 44.950 45.100 0.103 0.000 0.863 37 G HN 0.893 9.183 8.290 -0.000 0.000 0.559 38 Y N 1.576 121.894 120.300 0.030 0.000 2.153 38 Y HA -0.050 4.502 4.550 0.003 0.000 0.289 38 Y C 2.701 178.602 175.900 0.001 0.000 1.119 38 Y CA 1.635 59.738 58.100 0.005 0.000 1.116 38 Y CB 0.019 38.471 38.460 -0.013 0.000 1.004 38 Y HN 0.228 8.508 8.280 -0.000 0.000 0.501 39 V N 0.371 120.394 119.914 0.182 0.000 2.970 39 V HA -0.195 3.926 4.120 0.003 0.000 0.260 39 V C 2.302 178.414 176.094 0.030 0.000 1.100 39 V CA 1.242 63.600 62.300 0.097 0.000 1.122 39 V CB -1.048 30.846 31.823 0.120 0.000 0.721 39 V HN 0.556 8.745 8.190 -0.000 0.000 0.483 40 A N 0.376 123.218 122.820 0.037 0.000 1.854 40 A HA -0.165 4.157 4.320 0.003 0.000 0.214 40 A C 2.428 180.036 177.584 0.039 0.000 1.192 40 A CA 2.242 54.310 52.037 0.051 0.000 0.611 40 A CB -0.982 18.058 19.000 0.066 0.000 0.832 40 A HN 0.476 8.626 8.150 -0.000 0.000 0.442 41 T N 0.877 115.420 114.554 -0.018 0.000 2.665 41 T HA -0.123 4.229 4.350 0.003 0.000 0.268 41 T C 2.071 176.713 174.700 -0.097 0.000 1.035 41 T CA 1.738 63.804 62.100 -0.057 0.000 1.151 41 T CB -0.565 68.195 68.868 -0.179 0.000 0.862 41 T HN 0.597 8.837 8.240 -0.000 0.000 0.438 42 A N 1.017 123.711 122.820 -0.210 0.000 2.125 42 A HA 0.320 4.642 4.320 0.003 0.000 0.219 42 A C 2.497 180.066 177.584 -0.026 0.000 1.156 42 A CA 1.447 53.371 52.037 -0.187 0.000 0.671 42 A CB -0.768 18.058 19.000 -0.290 0.000 0.794 42 A HN 0.541 8.691 8.150 -0.000 0.000 0.459 43 A N -1.633 121.212 122.820 0.041 0.000 1.935 43 A HA -0.043 4.278 4.320 0.003 0.000 0.214 43 A C 1.996 179.632 177.584 0.086 0.000 1.178 43 A CA 1.297 53.408 52.037 0.124 0.000 0.640 43 A CB -0.742 18.357 19.000 0.165 0.000 0.825 43 A HN 0.763 8.913 8.150 -0.000 0.000 0.447 44 H N -2.214 116.838 119.070 -0.030 0.000 2.363 44 H HA -0.060 4.497 4.556 0.003 0.000 0.301 44 H C 1.876 177.155 175.328 -0.083 0.000 1.074 44 H CA 1.406 57.414 56.048 -0.067 0.000 1.354 44 H CB -0.116 29.622 29.762 -0.041 0.000 1.397 44 H HN 0.540 8.820 8.280 -0.000 0.000 0.516 45 F N 0.809 120.605 119.950 -0.257 0.000 2.367 45 F HA 0.018 4.547 4.527 0.004 0.000 0.298 45 F C 2.343 177.977 175.800 -0.277 0.000 1.094 45 F CA 0.806 58.609 58.000 -0.330 0.000 1.409 45 F CB -0.037 38.756 39.000 -0.346 0.000 1.064 45 F HN 0.196 8.496 8.300 -0.000 0.000 0.528 46 A N 0.698 123.525 122.820 0.012 0.000 1.872 46 A HA -0.016 4.306 4.320 0.003 0.000 0.214 46 A C 2.373 179.710 177.584 -0.411 0.000 1.187 46 A CA 1.389 53.351 52.037 -0.126 0.000 0.614 46 A CB -1.450 17.499 19.000 -0.086 0.000 0.826 46 A HN 0.452 8.602 8.150 -0.000 0.000 0.442 47 A N -0.497 121.901 122.820 -0.703 0.000 1.902 47 A HA -0.157 4.164 4.320 0.003 0.000 0.217 47 A C 1.954 179.286 177.584 -0.420 0.000 1.181 47 A CA 1.693 53.131 52.037 -0.998 0.000 0.623 47 A CB -0.442 18.031 19.000 -0.879 0.000 0.818 47 A HN 0.462 8.612 8.150 -0.000 0.000 0.443 48 E N 0.028 120.051 120.200 -0.296 0.000 2.150 48 E HA -0.087 4.265 4.350 0.003 0.000 0.193 48 E C 2.266 178.716 176.600 -0.250 0.000 0.985 48 E CA 1.165 57.419 56.400 -0.244 0.000 0.814 48 E CB -0.237 29.286 29.700 -0.295 0.000 0.752 48 E HN 0.555 8.915 8.360 -0.000 0.000 0.466 49 S N 0.258 115.794 115.700 -0.273 0.000 2.387 49 S HA -0.037 4.434 4.470 0.003 0.000 0.226 49 S C 1.906 176.465 174.600 -0.068 0.000 1.026 49 S CA 0.564 58.668 58.200 -0.160 0.000 0.972 49 S CB 0.150 63.335 63.200 -0.025 0.000 0.814 49 S HN 0.088 8.398 8.310 -0.000 0.000 0.477 50 S N 0.656 116.294 115.700 -0.103 0.000 2.479 50 S HA 0.055 4.527 4.470 0.003 0.000 0.157 50 S C 1.800 176.365 174.600 -0.058 0.000 1.101 50 S CA 1.034 59.193 58.200 -0.069 0.000 1.696 50 S CB -0.305 62.833 63.200 -0.104 0.000 0.580 50 S HN 0.644 8.954 8.310 -0.000 0.000 0.407 51 T N -0.769 113.778 114.554 -0.011 0.000 3.085 51 T HA 0.504 4.855 4.350 0.003 0.000 0.264 51 T C 1.235 175.953 174.700 0.030 0.000 1.019 51 T CA 0.654 62.775 62.100 0.035 0.000 0.910 51 T CB -0.013 68.922 68.868 0.112 0.000 1.059 51 T HN 0.745 8.985 8.240 -0.000 0.000 0.542 52 G N 2.242 111.034 108.800 -0.013 0.000 2.665 52 G HA2 -0.132 3.830 3.960 0.003 0.000 0.326 52 G HA3 -0.132 3.830 3.960 0.003 0.000 0.326 52 G C 0.316 175.255 174.900 0.066 0.000 1.231 52 G CA 1.730 46.834 45.100 0.007 0.000 0.992 52 G HN 2.024 10.314 8.290 -0.000 0.000 0.549 65 R N 2.530 123.029 120.500 -0.002 0.000 3.441 65 R HA 0.538 4.879 4.340 0.003 0.000 0.225 65 R C 1.294 177.600 176.300 0.010 0.000 1.756 65 R CA 0.637 56.739 56.100 0.003 0.000 1.504 65 R CB -1.309 28.991 30.300 -0.000 0.000 1.183 65 R HN 0.573 8.843 8.270 -0.000 0.000 0.567 66 G N -0.086 108.728 108.800 0.024 0.000 2.289 66 G HA2 -0.217 3.745 3.960 0.003 0.000 0.280 66 G HA3 -0.217 3.745 3.960 0.003 0.000 0.280 66 G C 0.160 175.058 174.900 -0.003 0.000 1.089 66 G CA 0.041 45.159 45.100 0.031 0.000 0.939 66 G HN 0.315 8.605 8.290 -0.000 0.000 0.499 67 V N -1.342 118.580 119.914 0.013 0.000 3.497 67 V HA 0.188 4.310 4.120 0.003 0.000 0.272 67 V C 0.967 177.088 176.094 0.045 0.000 1.474 67 V CA 0.435 62.735 62.300 -0.001 0.000 1.025 67 V CB 0.533 32.351 31.823 -0.008 0.000 0.820 67 V HN 0.344 8.534 8.190 -0.000 0.000 0.437 68 D N 2.127 122.578 120.400 0.084 0.000 2.389 68 D HA 0.489 5.130 4.640 0.003 0.000 0.247 68 D C 0.287 176.693 176.300 0.177 0.000 1.128 68 D CA 0.499 54.608 54.000 0.182 0.000 0.884 68 D CB 1.484 42.326 40.800 0.070 0.000 1.194 68 D HN 0.355 8.725 8.370 -0.000 0.000 0.441 69 A N 3.405 126.343 122.820 0.197 0.000 2.366 69 A HA 0.429 4.750 4.320 0.003 0.000 0.322 69 A C -0.608 177.043 177.584 0.111 0.000 1.397 69 A CA -0.621 51.426 52.037 0.018 0.000 0.984 69 A CB -0.325 18.524 19.000 -0.251 0.000 1.149 69 A HN 0.406 8.556 8.150 -0.000 0.000 0.540 70 L N 1.959 123.259 121.223 0.128 0.000 2.439 70 L HA 0.434 4.776 4.340 0.003 0.000 0.261 70 L C 0.291 177.234 176.870 0.121 0.000 1.153 70 L CA -0.267 54.662 54.840 0.148 0.000 0.808 70 L CB 0.815 42.955 42.059 0.135 0.000 1.126 70 L HN 0.285 8.515 8.230 -0.000 0.000 0.460 71 V N 2.079 122.059 119.914 0.110 0.000 2.293 71 V HA 0.115 4.237 4.120 0.003 0.000 0.275 71 V C 0.146 176.282 176.094 0.069 0.000 1.021 71 V CA -0.409 61.918 62.300 0.044 0.000 0.815 71 V CB 0.291 32.134 31.823 0.034 0.000 1.025 71 V HN 0.792 8.982 8.190 -0.000 0.000 0.448 72 Y N 2.275 122.597 120.300 0.036 0.000 2.511 72 Y HA 0.542 5.094 4.550 0.004 0.000 0.279 72 Y C 0.523 176.439 175.900 0.027 0.000 1.157 72 Y CA -0.178 57.937 58.100 0.024 0.000 1.300 72 Y CB 0.346 38.814 38.460 0.014 0.000 1.052 72 Y HN 0.553 8.833 8.280 -0.000 0.000 0.529 73 E N -0.029 119.985 120.200 -0.310 0.000 2.401 73 E HA 0.550 4.902 4.350 0.003 0.000 0.283 73 E C -2.233 174.259 176.600 -0.180 0.000 1.053 73 E CA -0.616 55.651 56.400 -0.221 0.000 0.842 73 E CB 2.280 31.831 29.700 -0.249 0.000 1.222 73 E HN -0.033 8.327 8.360 -0.000 0.000 0.429 74 V N 2.475 122.342 119.914 -0.077 0.000 3.012 74 V HA 0.421 4.543 4.120 0.003 0.000 0.307 74 V C -1.484 174.557 176.094 -0.088 0.000 1.166 74 V CA -0.619 61.677 62.300 -0.007 0.000 0.974 74 V CB 2.231 34.148 31.823 0.157 0.000 1.040 74 V HN 0.694 8.884 8.190 -0.000 0.000 0.428 75 D N 2.260 122.562 120.400 -0.163 0.000 2.517 75 D HA 0.242 4.884 4.640 0.003 0.000 0.263 75 D C 1.136 177.206 176.300 -0.384 0.000 1.233 75 D CA -0.196 53.686 54.000 -0.196 0.000 0.849 75 D CB 0.891 41.623 40.800 -0.113 0.000 1.261 75 D HN 0.702 9.072 8.370 -0.000 0.000 0.516 76 E N 0.744 120.596 120.200 -0.579 0.000 2.196 76 E HA -0.353 3.998 4.350 0.003 0.000 0.222 76 E C 1.653 177.945 176.600 -0.515 0.000 1.072 76 E CA 1.799 57.677 56.400 -0.871 0.000 0.902 76 E CB -0.269 29.152 29.700 -0.464 0.000 0.780 76 E HN 0.424 8.784 8.360 -0.000 0.000 0.467 77 A N 1.597 124.259 122.820 -0.263 0.000 1.845 77 A HA -0.189 4.133 4.320 0.003 0.000 0.215 77 A C 2.238 179.770 177.584 -0.086 0.000 1.195 77 A CA 1.908 53.864 52.037 -0.135 0.000 0.616 77 A CB -0.550 18.396 19.000 -0.090 0.000 0.832 77 A HN 0.173 8.323 8.150 -0.000 0.000 0.443 78 R N -0.883 119.568 120.500 -0.082 0.000 2.236 78 R HA 0.093 4.435 4.340 0.003 0.000 0.208 78 R C -0.209 176.083 176.300 -0.014 0.000 1.036 78 R CA 0.721 56.803 56.100 -0.030 0.000 1.001 78 R CB -0.159 30.134 30.300 -0.011 0.000 0.896 78 R HN 0.672 8.942 8.270 -0.000 0.000 0.464 79 E N -0.413 119.747 120.200 -0.067 0.000 2.596 79 E HA -0.194 4.158 4.350 0.003 0.000 0.272 79 E C -1.118 175.541 176.600 0.098 0.000 1.039 79 E CA 0.132 56.559 56.400 0.044 0.000 0.804 79 E CB -1.425 28.364 29.700 0.147 0.000 1.373 79 E HN 0.129 8.489 8.360 -0.000 0.000 0.404 80 L N 1.250 122.477 121.223 0.006 0.000 2.262 80 L HA 0.332 4.673 4.340 0.003 0.000 0.288 80 L C -0.361 176.498 176.870 -0.018 0.000 1.035 80 L CA 0.222 55.048 54.840 -0.024 0.000 0.820 80 L CB 1.410 43.423 42.059 -0.077 0.000 1.204 80 L HN -0.039 8.191 8.230 -0.000 0.000 0.424 81 T N 4.692 119.241 114.554 -0.008 0.000 2.792 81 T HA 0.533 4.885 4.350 0.003 0.000 0.280 81 T C -0.684 173.974 174.700 -0.071 0.000 0.990 81 T CA -0.809 61.273 62.100 -0.030 0.000 0.960 81 T CB 1.101 69.927 68.868 -0.070 0.000 0.939 81 T HN 0.298 8.538 8.240 -0.000 0.000 0.439 82 K N 3.502 123.777 120.400 -0.209 0.000 2.345 82 K HA 0.609 4.931 4.320 0.003 0.000 0.255 82 K C -0.865 175.578 176.600 -0.262 0.000 0.934 82 K CA -0.550 55.560 56.287 -0.294 0.000 0.801 82 K CB 2.546 34.484 32.500 -0.937 0.000 1.137 82 K HN 0.541 8.791 8.250 -0.000 0.000 0.424 83 I N 1.331 121.970 120.570 0.115 0.000 2.545 83 I HA 0.401 4.572 4.170 0.003 0.000 0.292 83 I C -0.517 175.781 176.117 0.301 0.000 1.040 83 I CA -1.086 60.296 61.300 0.137 0.000 1.068 83 I CB 2.205 40.222 38.000 0.029 0.000 1.251 83 I HN 0.563 8.773 8.210 -0.000 0.000 0.424 84 A N 5.883 128.878 122.820 0.291 0.000 2.287 84 A HA 0.721 5.043 4.320 0.003 0.000 0.317 84 A C -1.530 176.189 177.584 0.225 0.000 1.220 84 A CA -0.272 51.982 52.037 0.363 0.000 0.835 84 A CB 0.267 19.414 19.000 0.244 0.000 1.180 84 A HN 0.585 8.735 8.150 -0.000 0.000 0.500 85 Y N 3.091 123.622 120.300 0.385 0.000 2.402 85 Y HA 0.389 4.940 4.550 0.003 0.000 0.332 85 Y C -2.345 173.593 175.900 0.063 0.000 0.960 85 Y CA -2.516 55.700 58.100 0.193 0.000 1.228 85 Y CB 1.086 39.664 38.460 0.196 0.000 1.120 85 Y HN 0.507 8.787 8.280 -0.000 0.000 0.491 86 P HA -0.105 4.315 4.420 -0.000 0.000 0.267 86 P C 1.022 178.279 177.300 -0.072 0.000 1.201 86 P CA 0.165 63.054 63.100 -0.353 0.000 0.775 86 P CB 0.902 32.430 31.700 -0.287 0.000 0.854 87 V N 0.043 119.924 119.914 -0.054 0.000 2.970 87 V HA -0.096 4.026 4.120 0.003 0.000 0.260 87 V C 1.790 177.878 176.094 -0.010 0.000 1.100 87 V CA 1.699 64.009 62.300 0.015 0.000 1.122 87 V CB -1.845 29.947 31.823 -0.053 0.000 0.721 87 V HN 0.508 8.698 8.190 -0.000 0.000 0.483 88 A N 0.344 123.128 122.820 -0.061 0.000 2.119 88 A HA 0.089 4.410 4.320 0.003 0.000 0.217 88 A C 1.992 179.512 177.584 -0.106 0.000 1.153 88 A CA 1.431 53.433 52.037 -0.060 0.000 0.692 88 A CB -0.515 18.455 19.000 -0.049 0.000 0.799 88 A HN 0.514 8.664 8.150 -0.000 0.000 0.458 89 L N -1.176 119.917 121.223 -0.216 0.000 2.046 89 L HA -0.043 4.298 4.340 0.003 0.000 0.208 89 L C 0.357 177.000 176.870 -0.379 0.000 1.077 89 L CA 0.973 55.599 54.840 -0.357 0.000 0.747 89 L CB -0.796 40.919 42.059 -0.574 0.000 0.896 89 L HN 0.344 8.574 8.230 -0.000 0.000 0.432 90 F N 0.851 120.717 119.950 -0.140 0.000 2.571 90 F HA 0.049 4.577 4.527 0.003 0.000 0.384 90 F C 1.030 176.788 175.800 -0.070 0.000 1.058 90 F CA -0.767 57.155 58.000 -0.130 0.000 1.200 90 F CB -0.577 38.257 39.000 -0.278 0.000 1.077 90 F HN -0.030 8.270 8.300 -0.000 0.000 0.558 91 D N 3.194 123.661 120.400 0.111 0.000 2.378 91 D HA 0.223 4.865 4.640 0.003 0.000 0.238 91 D C -0.219 176.116 176.300 0.058 0.000 1.180 91 D CA 0.204 54.236 54.000 0.054 0.000 0.895 91 D CB 0.588 41.406 40.800 0.031 0.000 1.192 91 D HN 0.510 8.880 8.370 -0.000 0.000 0.438 92 R N 0.984 121.496 120.500 0.020 0.000 2.771 92 R HA 0.346 4.688 4.340 0.003 0.000 0.274 92 R C -0.343 175.946 176.300 -0.017 0.000 0.987 92 R CA -0.747 55.350 56.100 -0.005 0.000 0.908 92 R CB 1.304 31.606 30.300 0.004 0.000 1.213 92 R HN 0.456 8.726 8.270 -0.000 0.000 0.468 93 N N 2.103 120.784 118.700 -0.031 0.000 2.454 93 N HA 0.016 4.758 4.740 0.003 0.000 0.254 93 N C 1.235 176.735 175.510 -0.017 0.000 1.228 93 N CA 0.016 53.051 53.050 -0.026 0.000 0.900 93 N CB 0.751 39.219 38.487 -0.033 0.000 1.089 93 N HN 0.540 8.920 8.380 -0.000 0.000 0.449 94 I N -0.744 119.819 120.570 -0.012 0.000 2.617 94 I HA -0.124 4.048 4.170 0.003 0.000 0.256 94 I C 1.945 178.057 176.117 -0.008 0.000 1.167 94 I CA 0.848 62.143 61.300 -0.008 0.000 1.469 94 I CB -0.447 37.550 38.000 -0.006 0.000 1.098 94 I HN 0.488 8.698 8.210 -0.000 0.000 0.436 95 T N -1.763 112.785 114.554 -0.011 0.000 2.814 95 T HA -0.011 4.341 4.350 0.003 0.000 0.254 95 T C 1.547 176.240 174.700 -0.013 0.000 1.037 95 T CA 1.096 63.189 62.100 -0.011 0.000 1.143 95 T CB -0.325 68.536 68.868 -0.012 0.000 0.866 95 T HN 0.243 8.483 8.240 -0.000 0.000 0.431 96 D N 1.053 121.443 120.400 -0.017 0.000 2.232 96 D HA 0.295 4.937 4.640 0.003 0.000 0.220 96 D C 1.885 178.174 176.300 -0.018 0.000 0.982 96 D CA 1.900 55.888 54.000 -0.020 0.000 0.892 96 D CB -0.175 40.607 40.800 -0.029 0.000 1.040 96 D HN 0.618 8.988 8.370 -0.000 0.000 0.463 97 G N -0.611 108.175 108.800 -0.022 0.000 2.421 97 G HA2 -0.171 3.791 3.960 0.003 0.000 0.188 97 G HA3 -0.171 3.791 3.960 0.003 0.000 0.188 97 G C 0.112 174.993 174.900 -0.032 0.000 1.001 97 G CA -0.285 44.803 45.100 -0.019 0.000 0.693 97 G HN 0.132 8.422 8.290 -0.000 0.000 0.479 98 K N 1.998 122.366 120.400 -0.052 0.000 2.412 98 K HA 0.681 5.003 4.320 0.003 0.000 0.281 98 K C 0.979 177.492 176.600 -0.147 0.000 1.027 98 K CA 0.780 57.009 56.287 -0.096 0.000 0.989 98 K CB 0.939 33.391 32.500 -0.079 0.000 0.935 98 K HN 0.679 8.929 8.250 -0.000 0.000 0.475 99 A N 3.549 126.203 122.820 -0.277 0.000 2.366 99 A HA 0.544 4.866 4.320 0.003 0.000 0.250 99 A C -0.019 177.274 177.584 -0.485 0.000 1.099 99 A CA -0.048 51.722 52.037 -0.444 0.000 0.794 99 A CB -0.038 18.450 19.000 -0.854 0.000 1.056 99 A HN 0.794 8.944 8.150 -0.000 0.000 0.499 100 M N -0.822 118.540 119.600 -0.398 0.000 2.470 100 M HA 0.522 5.003 4.480 0.003 0.000 0.285 100 M C -0.419 175.880 176.300 -0.001 0.000 1.213 100 M CA -0.643 54.558 55.300 -0.165 0.000 0.901 100 M CB 1.452 34.023 32.600 -0.049 0.000 1.718 100 M HN 0.335 8.625 8.290 -0.000 0.000 0.469 101 I N 2.337 122.990 120.570 0.138 0.000 2.500 101 I HA 0.034 4.205 4.170 0.003 0.000 0.252 101 I C 2.393 178.624 176.117 0.190 0.000 1.142 101 I CA 2.080 63.511 61.300 0.218 0.000 1.451 101 I CB -0.045 38.052 38.000 0.161 0.000 1.093 101 I HN 0.994 9.204 8.210 -0.000 0.000 0.430 102 A N -0.990 121.900 122.820 0.117 0.000 1.883 102 A HA -0.246 4.075 4.320 0.003 0.000 0.217 102 A C 2.484 180.132 177.584 0.105 0.000 1.186 102 A CA 2.216 54.306 52.037 0.089 0.000 0.624 102 A CB -1.183 17.845 19.000 0.047 0.000 0.822 102 A HN 0.426 8.576 8.150 -0.000 0.000 0.444 103 S N -1.478 114.299 115.700 0.129 0.000 2.363 103 S HA -0.179 4.292 4.470 0.003 0.000 0.218 103 S C 1.697 176.436 174.600 0.231 0.000 1.035 103 S CA 1.621 59.915 58.200 0.156 0.000 1.043 103 S CB -0.625 62.697 63.200 0.204 0.000 0.986 103 S HN 0.627 8.937 8.310 -0.000 0.000 0.423 104 F N 1.925 121.987 119.950 0.187 0.000 2.053 104 F HA -0.288 4.241 4.527 0.003 0.000 0.295 104 F C 1.778 177.603 175.800 0.043 0.000 1.102 104 F CA 2.299 60.377 58.000 0.131 0.000 1.225 104 F CB -0.616 38.371 39.000 -0.020 0.000 0.961 104 F HN 0.254 8.554 8.300 -0.000 0.000 0.495 105 L N -0.861 120.417 121.223 0.091 0.000 2.056 105 L HA -0.182 4.159 4.340 0.003 0.000 0.207 105 L C 2.455 179.282 176.870 -0.072 0.000 1.078 105 L CA 1.758 56.579 54.840 -0.032 0.000 0.749 105 L CB -1.448 40.671 42.059 0.099 0.000 0.901 105 L HN 0.176 8.406 8.230 -0.000 0.000 0.433 106 T N -0.045 114.492 114.554 -0.029 0.000 2.635 106 T HA -0.191 4.160 4.350 0.003 0.000 0.267 106 T C 1.826 176.458 174.700 -0.114 0.000 1.040 106 T CA 1.654 63.723 62.100 -0.051 0.000 1.156 106 T CB -0.161 68.693 68.868 -0.025 0.000 0.863 106 T HN 0.025 8.265 8.240 -0.000 0.000 0.430 107 L N 0.591 121.723 121.223 -0.153 0.000 1.973 107 L HA -0.005 4.337 4.340 0.003 0.000 0.208 107 L C 2.873 179.573 176.870 -0.283 0.000 1.073 107 L CA 1.930 56.628 54.840 -0.237 0.000 0.746 107 L CB -1.444 40.418 42.059 -0.330 0.000 0.891 107 L HN 0.246 8.476 8.230 -0.000 0.000 0.433 108 T N 0.407 114.707 114.554 -0.423 0.000 2.684 108 T HA -0.167 4.185 4.350 0.003 0.000 0.267 108 T C 1.187 175.865 174.700 -0.037 0.000 1.036 108 T CA 1.954 63.819 62.100 -0.392 0.000 1.148 108 T CB -0.191 68.115 68.868 -0.938 0.000 0.863 108 T HN 0.439 8.679 8.240 -0.000 0.000 0.436 109 M N -0.546 119.029 119.600 -0.042 0.000 3.859 109 M HA 0.503 4.985 4.480 0.003 0.000 0.494 109 M C 0.588 176.899 176.300 0.018 0.000 1.804 109 M CA -0.553 54.797 55.300 0.083 0.000 0.670 109 M CB 0.240 33.000 32.600 0.266 0.000 1.466 109 M HN 0.053 8.343 8.290 -0.000 0.000 0.548 110 G N 2.170 110.930 108.800 -0.067 0.000 3.048 110 G HA2 -0.032 3.930 3.960 0.003 0.000 0.151 110 G HA3 -0.032 3.930 3.960 0.003 0.000 0.151 110 G C 0.043 174.890 174.900 -0.088 0.000 1.803 110 G CA 0.020 45.079 45.100 -0.069 0.000 1.047 110 G HN 0.539 8.829 8.290 -0.000 0.000 0.513 111 N N 0.884 119.517 118.700 -0.113 0.000 2.758 111 N HA 0.036 4.778 4.740 0.003 0.000 0.293 111 N C 1.156 176.552 175.510 -0.191 0.000 1.273 111 N CA 0.032 53.013 53.050 -0.116 0.000 1.022 111 N CB -0.115 38.320 38.487 -0.086 0.000 1.334 111 N HN 0.408 8.788 8.380 -0.000 0.000 0.519 112 N N -0.759 117.777 118.700 -0.273 0.000 2.325 112 N HA -0.038 4.704 4.740 0.003 0.000 0.182 112 N C 1.140 176.435 175.510 -0.359 0.000 1.088 112 N CA 0.541 53.288 53.050 -0.504 0.000 0.879 112 N CB 0.120 38.141 38.487 -0.777 0.000 0.983 112 N HN 0.130 8.510 8.380 -0.000 0.000 0.471 113 Q N -0.044 119.660 119.800 -0.161 0.000 2.451 113 Q HA 0.298 4.640 4.340 0.003 0.000 0.206 113 Q C 1.321 177.305 176.000 -0.026 0.000 0.947 113 Q CA 0.842 56.631 55.803 -0.023 0.000 0.937 113 Q CB -0.314 28.441 28.738 0.028 0.000 1.025 113 Q HN 0.552 8.822 8.270 -0.000 0.000 0.511 114 G N -1.431 107.324 108.800 -0.076 0.000 3.192 114 G HA2 0.182 4.144 3.960 0.003 0.000 0.239 114 G HA3 0.182 4.144 3.960 0.003 0.000 0.239 114 G C 0.263 175.117 174.900 -0.077 0.000 1.084 114 G CA -0.370 44.694 45.100 -0.059 0.000 0.784 114 G HN 0.179 8.469 8.290 -0.000 0.000 0.540 115 M N 0.250 119.778 119.600 -0.119 0.000 2.203 115 M HA 0.238 4.720 4.480 0.003 0.000 0.285 115 M C 1.683 177.914 176.300 -0.115 0.000 1.093 115 M CA 1.182 56.392 55.300 -0.150 0.000 1.126 115 M CB 0.623 33.083 32.600 -0.233 0.000 1.374 115 M HN 0.057 8.347 8.290 -0.000 0.000 0.426 116 G N -0.290 108.434 108.800 -0.128 0.000 3.228 116 G HA2 0.058 4.020 3.960 0.003 0.000 0.245 116 G HA3 0.058 4.020 3.960 0.003 0.000 0.245 116 G C -0.039 174.740 174.900 -0.201 0.000 1.051 116 G CA -0.055 44.979 45.100 -0.110 0.000 0.809 116 G HN 0.836 9.126 8.290 -0.000 0.000 0.531 117 D N 0.053 120.272 120.400 -0.302 0.000 2.819 117 D HA 0.239 4.881 4.640 0.003 0.000 0.326 117 D C -0.816 175.194 176.300 -0.483 0.000 1.408 117 D CA -0.385 53.248 54.000 -0.612 0.000 0.811 117 D CB 0.572 40.960 40.800 -0.686 0.000 1.148 117 D HN -0.055 8.315 8.370 -0.000 0.000 0.457 118 V N 1.108 120.842 119.914 -0.300 0.000 2.653 118 V HA 0.062 4.184 4.120 0.003 0.000 0.298 118 V C 0.941 176.937 176.094 -0.164 0.000 1.097 118 V CA -0.632 61.536 62.300 -0.220 0.000 0.908 118 V CB 2.206 33.955 31.823 -0.124 0.000 1.024 118 V HN 0.034 8.224 8.190 -0.000 0.000 0.435 119 E N 3.146 123.214 120.200 -0.221 0.000 2.002 119 E HA -0.133 4.218 4.350 0.003 0.000 0.205 119 E C -0.232 176.331 176.600 -0.062 0.000 1.020 119 E CA 2.228 58.510 56.400 -0.197 0.000 0.856 119 E CB 0.088 29.523 29.700 -0.442 0.000 0.788 119 E HN 0.740 9.100 8.360 -0.000 0.000 0.477 120 Y N -2.661 117.649 120.300 0.017 0.000 2.588 120 Y HA 0.713 5.264 4.550 0.002 0.000 0.343 120 Y C -0.994 174.937 175.900 0.051 0.000 1.065 120 Y CA -1.622 56.504 58.100 0.043 0.000 1.038 120 Y CB 1.412 39.906 38.460 0.057 0.000 1.297 120 Y HN 0.038 8.318 8.280 -0.000 0.000 0.467 121 A N 2.436 125.465 122.820 0.348 0.000 2.456 121 A HA 0.687 5.009 4.320 0.003 0.000 0.288 121 A C -1.600 176.201 177.584 0.360 0.000 1.042 121 A CA -0.888 51.319 52.037 0.284 0.000 0.738 121 A CB 1.562 20.681 19.000 0.197 0.000 1.266 121 A HN 0.680 8.830 8.150 -0.000 0.000 0.407 122 K N 2.698 123.350 120.400 0.420 0.000 2.471 122 K HA 0.479 4.801 4.320 0.003 0.000 0.252 122 K C -0.876 176.075 176.600 0.584 0.000 0.938 122 K CA -0.564 55.990 56.287 0.446 0.000 0.796 122 K CB 1.857 34.575 32.500 0.363 0.000 1.161 122 K HN 0.895 9.145 8.250 -0.000 0.000 0.425 123 M N 3.512 123.435 119.600 0.539 0.000 2.162 123 M HA 0.118 4.599 4.480 0.003 0.000 0.356 123 M C -0.304 176.206 176.300 0.351 0.000 1.303 123 M CA 0.490 55.946 55.300 0.261 0.000 1.116 123 M CB 0.480 33.145 32.600 0.109 0.000 1.632 123 M HN 0.730 9.020 8.290 -0.000 0.000 0.469 124 H N 1.355 120.560 119.070 0.225 0.000 2.750 124 H HA 0.397 4.955 4.556 0.003 0.000 0.263 124 H C -0.916 174.657 175.328 0.409 0.000 0.964 124 H CA 0.216 56.462 56.048 0.329 0.000 1.205 124 H CB 0.653 30.636 29.762 0.369 0.000 1.454 124 H HN 0.737 9.017 8.280 -0.000 0.000 0.503 125 D N -1.222 119.496 120.400 0.530 0.000 2.755 125 D HA 0.239 4.881 4.640 0.003 0.000 0.277 125 D C -1.738 174.885 176.300 0.538 0.000 1.261 125 D CA -0.689 53.663 54.000 0.586 0.000 0.759 125 D CB 1.116 42.337 40.800 0.702 0.000 1.279 125 D HN -0.042 8.328 8.370 -0.000 0.000 0.420 126 F N 0.147 120.227 119.950 0.217 0.000 2.635 126 F HA 0.596 5.125 4.527 0.003 0.000 0.314 126 F C -2.217 173.468 175.800 -0.191 0.000 1.119 126 F CA -1.150 56.826 58.000 -0.041 0.000 1.000 126 F CB 0.910 39.991 39.000 0.134 0.000 1.278 126 F HN 0.264 8.564 8.300 -0.000 0.000 0.446 127 Y N 3.842 123.930 120.300 -0.354 0.000 2.352 127 Y HA 0.764 5.315 4.550 0.003 0.000 0.339 127 Y C -1.688 174.217 175.900 0.008 0.000 0.992 127 Y CA -1.158 56.783 58.100 -0.266 0.000 1.100 127 Y CB 1.948 40.215 38.460 -0.321 0.000 1.192 127 Y HN 0.659 8.939 8.280 -0.000 0.000 0.458 128 V N 8.718 128.235 119.914 -0.661 0.000 2.357 128 V HA 0.422 4.543 4.120 0.003 0.000 0.284 128 V C -2.315 173.217 176.094 -0.937 0.000 1.018 128 V CA -1.998 59.987 62.300 -0.525 0.000 0.841 128 V CB 1.014 32.602 31.823 -0.392 0.000 0.991 128 V HN 0.715 8.905 8.190 -0.000 0.000 0.437 129 P HA 0.208 4.628 4.420 -0.000 0.000 0.276 129 P C 0.889 178.107 177.300 -0.137 0.000 1.252 129 P CA -0.429 62.466 63.100 -0.341 0.000 0.802 129 P CB 1.027 32.699 31.700 -0.047 0.000 1.035 130 E N 1.335 121.503 120.200 -0.052 0.000 2.097 130 E HA -0.279 4.072 4.350 0.003 0.000 0.196 130 E C 1.613 178.227 176.600 0.024 0.000 1.000 130 E CA 2.079 58.468 56.400 -0.018 0.000 0.804 130 E CB -0.527 29.183 29.700 0.017 0.000 0.740 130 E HN 0.432 8.792 8.360 -0.000 0.000 0.454 131 A N 0.381 123.238 122.820 0.062 0.000 1.883 131 A HA -0.208 4.114 4.320 0.003 0.000 0.217 131 A C 2.182 179.848 177.584 0.136 0.000 1.186 131 A CA 1.619 53.708 52.037 0.087 0.000 0.624 131 A CB -0.996 18.058 19.000 0.091 0.000 0.822 131 A HN 0.594 8.744 8.150 -0.000 0.000 0.444 132 Y N -0.740 119.559 120.300 -0.002 0.000 2.163 132 Y HA -0.085 4.467 4.550 0.003 0.000 0.288 132 Y C 2.707 178.646 175.900 0.065 0.000 1.112 132 Y CA 1.307 59.411 58.100 0.007 0.000 1.104 132 Y CB -0.251 38.200 38.460 -0.014 0.000 1.016 132 Y HN 0.217 8.497 8.280 -0.000 0.000 0.497 133 R N 0.790 121.253 120.500 -0.062 0.000 2.134 133 R HA -0.294 4.047 4.340 0.003 0.000 0.248 133 R C 2.107 178.406 176.300 -0.003 0.000 1.143 133 R CA 1.767 57.783 56.100 -0.141 0.000 0.957 133 R CB -0.748 29.410 30.300 -0.236 0.000 0.867 133 R HN 0.511 8.781 8.270 -0.000 0.000 0.441 134 A N 0.440 123.265 122.820 0.009 0.000 2.125 134 A HA -0.082 4.239 4.320 0.003 0.000 0.219 134 A C 2.007 179.611 177.584 0.033 0.000 1.156 134 A CA 1.011 53.067 52.037 0.031 0.000 0.671 134 A CB -0.245 18.770 19.000 0.026 0.000 0.794 134 A HN 0.361 8.511 8.150 -0.000 0.000 0.459 135 L N -2.215 119.011 121.223 0.005 0.000 2.558 135 L HA 0.219 4.561 4.340 0.003 0.000 0.225 135 L C 0.423 177.223 176.870 -0.115 0.000 1.128 135 L CA -0.315 54.487 54.840 -0.062 0.000 0.868 135 L CB -0.210 41.798 42.059 -0.085 0.000 1.006 135 L HN 0.261 8.491 8.230 -0.000 0.000 0.454 136 F N 0.296 120.154 119.950 -0.153 0.000 2.380 136 F HA 0.037 4.565 4.527 0.003 0.000 0.325 136 F C 1.597 177.345 175.800 -0.086 0.000 1.136 136 F CA -0.243 57.666 58.000 -0.151 0.000 1.171 136 F CB 0.810 39.673 39.000 -0.228 0.000 1.230 136 F HN -0.139 8.161 8.300 -0.000 0.000 0.554 137 D N 0.914 121.422 120.400 0.179 0.000 2.077 137 D HA 0.092 4.734 4.640 0.003 0.000 0.193 137 D C 0.986 177.316 176.300 0.050 0.000 0.989 137 D CA 1.847 55.894 54.000 0.077 0.000 0.831 137 D CB -0.548 40.291 40.800 0.064 0.000 0.979 137 D HN 0.727 9.097 8.370 -0.000 0.000 0.449 138 G N 0.116 108.938 108.800 0.037 0.000 2.829 138 G HA2 -0.171 3.791 3.960 0.003 0.000 0.628 138 G HA3 -0.171 3.791 3.960 0.003 0.000 0.628 138 G C -2.621 172.252 174.900 -0.045 0.000 1.412 138 G CA -0.584 44.510 45.100 -0.011 0.000 0.864 138 G HN 0.109 8.399 8.290 -0.000 0.000 0.544 139 P HA 0.326 4.746 4.420 -0.000 0.000 0.269 139 P C 0.600 177.853 177.300 -0.078 0.000 1.215 139 P CA 0.513 63.547 63.100 -0.111 0.000 0.780 139 P CB 1.489 33.087 31.700 -0.170 0.000 0.898 140 S N 0.942 116.600 115.700 -0.071 0.000 2.499 140 S HA 0.200 4.672 4.470 0.003 0.000 0.225 140 S C 0.465 175.041 174.600 -0.040 0.000 1.050 140 S CA 0.240 58.416 58.200 -0.041 0.000 0.928 140 S CB 0.135 63.321 63.200 -0.024 0.000 0.803 140 S HN 0.254 8.564 8.310 -0.000 0.000 0.506 141 V N 1.769 121.646 119.914 -0.061 0.000 3.188 141 V HA 0.522 4.643 4.120 0.003 0.000 0.305 141 V C -1.239 174.812 176.094 -0.070 0.000 1.232 141 V CA -0.588 61.689 62.300 -0.037 0.000 1.043 141 V CB 2.508 34.337 31.823 0.009 0.000 1.068 141 V HN 0.704 8.894 8.190 -0.000 0.000 0.439 142 N N 0.863 119.542 118.700 -0.036 0.000 3.643 142 N HA 0.364 5.105 4.740 0.003 0.000 0.336 142 N C 0.741 176.285 175.510 0.056 0.000 1.559 142 N CA -0.192 52.843 53.050 -0.027 0.000 0.644 142 N CB 0.365 38.766 38.487 -0.143 0.000 2.909 142 N HN 0.520 8.900 8.380 -0.000 0.000 0.592 143 I N 0.119 120.548 120.570 -0.235 0.000 2.394 143 I HA -0.191 3.981 4.170 0.003 0.000 0.251 143 I C 1.993 177.503 176.117 -1.011 0.000 1.136 143 I CA 1.374 62.252 61.300 -0.704 0.000 1.425 143 I CB -0.166 37.337 38.000 -0.828 0.000 1.079 143 I HN 0.626 8.836 8.210 -0.000 0.000 0.425 144 S N 1.153 116.378 115.700 -0.793 0.000 2.374 144 S HA -0.262 4.210 4.470 0.003 0.000 0.227 144 S C 2.189 176.710 174.600 -0.132 0.000 1.037 144 S CA 1.688 59.675 58.200 -0.355 0.000 1.024 144 S CB -0.434 62.692 63.200 -0.122 0.000 0.861 144 S HN 0.603 8.913 8.310 -0.000 0.000 0.456 145 A N 0.946 123.684 122.820 -0.137 0.000 1.968 145 A HA 0.218 4.540 4.320 0.003 0.000 0.217 145 A C 2.297 179.816 177.584 -0.108 0.000 1.169 145 A CA 1.128 53.131 52.037 -0.058 0.000 0.638 145 A CB -0.578 18.423 19.000 0.002 0.000 0.812 145 A HN 0.592 8.742 8.150 -0.000 0.000 0.446 146 L N -1.905 119.168 121.223 -0.250 0.000 2.072 146 L HA -0.151 4.191 4.340 0.003 0.000 0.205 146 L C 2.715 179.504 176.870 -0.134 0.000 1.079 146 L CA 0.756 55.421 54.840 -0.292 0.000 0.752 146 L CB -0.507 41.227 42.059 -0.542 0.000 0.906 146 L HN 0.541 8.771 8.230 -0.000 0.000 0.436 147 W N 0.905 122.118 121.300 -0.145 0.000 2.352 147 W HA -0.212 4.450 4.660 0.003 0.000 0.322 147 W C 2.597 179.067 176.519 -0.081 0.000 1.208 147 W CA 1.114 58.391 57.345 -0.113 0.000 1.286 147 W CB -1.096 28.313 29.460 -0.084 0.000 1.167 147 W HN 0.163 8.343 8.180 -0.000 0.000 0.469 148 K N 0.462 120.976 120.400 0.191 0.000 2.218 148 K HA -0.187 4.135 4.320 0.003 0.000 0.205 148 K C 1.679 178.296 176.600 0.029 0.000 1.046 148 K CA 1.673 58.017 56.287 0.095 0.000 0.933 148 K CB -0.140 32.407 32.500 0.078 0.000 0.728 148 K HN -0.026 8.224 8.250 -0.000 0.000 0.454 149 V N 1.452 121.351 119.914 -0.026 0.000 2.273 149 V HA -0.174 3.948 4.120 0.003 0.000 0.242 149 V C 2.233 178.264 176.094 -0.105 0.000 1.035 149 V CA 1.245 63.473 62.300 -0.120 0.000 1.013 149 V CB -0.275 31.389 31.823 -0.265 0.000 0.652 149 V HN 0.328 8.518 8.190 -0.000 0.000 0.452 150 L N 0.789 121.973 121.223 -0.064 0.000 2.549 150 L HA 0.015 4.357 4.340 0.003 0.000 0.230 150 L C 1.534 178.415 176.870 0.019 0.000 1.162 150 L CA 1.070 55.898 54.840 -0.021 0.000 0.834 150 L CB -1.135 40.931 42.059 0.010 0.000 0.947 150 L HN 0.680 8.910 8.230 -0.000 0.000 0.452 151 G N 1.160 109.977 108.800 0.029 0.000 2.298 151 G HA2 -0.255 3.706 3.960 0.003 0.000 0.287 151 G HA3 -0.255 3.706 3.960 0.003 0.000 0.287 151 G C 0.112 175.036 174.900 0.040 0.000 1.075 151 G CA -0.061 45.060 45.100 0.034 0.000 0.960 151 G HN 0.372 8.662 8.290 -0.000 0.000 0.502 152 R N -0.185 120.347 120.500 0.053 0.000 2.856 152 R HA 0.590 4.931 4.340 0.003 0.000 0.258 152 R C -2.395 173.891 176.300 -0.022 0.000 1.066 152 R CA -1.913 54.184 56.100 -0.005 0.000 1.045 152 R CB 1.542 31.800 30.300 -0.069 0.000 1.178 152 R HN 0.166 8.436 8.270 -0.000 0.000 0.499 153 P HA 0.070 4.490 4.420 -0.000 0.000 0.271 153 P C -0.390 176.855 177.300 -0.092 0.000 1.216 153 P CA 0.086 63.122 63.100 -0.107 0.000 0.771 153 P CB 0.692 32.304 31.700 -0.146 0.000 0.864 154 E N 0.562 120.805 120.200 0.073 0.000 2.358 154 E HA 0.033 4.385 4.350 0.003 0.000 0.195 154 E C 0.150 176.937 176.600 0.312 0.000 1.010 154 E CA 0.484 57.059 56.400 0.292 0.000 0.856 154 E CB 0.283 30.104 29.700 0.201 0.000 0.795 154 E HN 0.225 8.585 8.360 -0.000 0.000 0.504 155 V N 2.358 122.317 119.914 0.074 0.000 2.394 155 V HA 0.014 4.135 4.120 0.003 0.000 0.282 155 V C -0.068 175.925 176.094 -0.168 0.000 1.031 155 V CA -0.334 62.009 62.300 0.072 0.000 0.881 155 V CB 1.477 33.321 31.823 0.035 0.000 0.982 155 V HN 0.187 8.377 8.190 -0.000 0.000 0.451 156 D N 4.016 124.293 120.400 -0.206 0.000 2.751 156 D HA -0.172 4.470 4.640 0.003 0.000 0.233 156 D C 1.523 177.366 176.300 -0.760 0.000 1.149 156 D CA 1.086 54.884 54.000 -0.337 0.000 0.682 156 D CB -0.536 40.200 40.800 -0.106 0.000 1.068 156 D HN 0.891 9.261 8.370 -0.000 0.000 0.429 157 G N -0.219 107.435 108.800 -1.910 0.000 2.559 157 G HA2 0.262 4.223 3.960 0.003 0.000 0.216 157 G HA3 0.262 4.223 3.960 0.003 0.000 0.216 157 G C 1.085 175.318 174.900 -1.112 0.000 1.126 157 G CA 1.126 45.086 45.100 -1.900 0.000 0.778 157 G HN 0.907 9.197 8.290 -0.000 0.000 0.543 158 G N -0.919 107.524 108.800 -0.595 0.000 2.587 158 G HA2 -0.011 3.951 3.960 0.003 0.000 0.212 158 G HA3 -0.011 3.951 3.960 0.003 0.000 0.212 158 G C -0.401 174.147 174.900 -0.587 0.000 1.327 158 G CA -0.301 44.480 45.100 -0.533 0.000 0.898 158 G HN 0.900 9.190 8.290 -0.000 0.000 0.551 159 L N 0.064 120.559 121.223 -1.213 0.000 2.410 159 L HA 0.589 4.930 4.340 0.003 0.000 0.273 159 L C 0.415 176.997 176.870 -0.481 0.000 1.144 159 L CA -0.168 54.255 54.840 -0.695 0.000 0.863 159 L CB 1.123 42.853 42.059 -0.547 0.000 1.140 159 L HN 0.720 8.950 8.230 -0.000 0.000 0.463 160 V N 6.368 126.126 119.914 -0.259 0.000 2.350 160 V HA 0.322 4.444 4.120 0.003 0.000 0.285 160 V C -0.090 175.955 176.094 -0.081 0.000 1.014 160 V CA -0.727 61.462 62.300 -0.185 0.000 0.831 160 V CB 1.427 33.080 31.823 -0.282 0.000 1.000 160 V HN 0.506 8.696 8.190 -0.000 0.000 0.433 161 V N 4.811 124.756 119.914 0.052 0.000 2.406 161 V HA 0.800 4.921 4.120 0.003 0.000 0.272 161 V C 0.778 177.089 176.094 0.363 0.000 1.043 161 V CA 0.432 62.853 62.300 0.202 0.000 0.915 161 V CB 1.328 33.277 31.823 0.211 0.000 0.988 161 V HN 0.995 9.185 8.190 -0.000 0.000 0.466 162 G N 3.484 112.522 108.800 0.397 0.000 2.642 162 G HA2 0.800 4.762 3.960 0.003 0.000 0.293 162 G HA3 0.800 4.762 3.960 0.003 0.000 0.293 162 G C -0.570 174.503 174.900 0.288 0.000 1.341 162 G CA -0.173 45.163 45.100 0.394 0.000 0.916 162 G HN 0.709 8.999 8.290 -0.000 0.000 0.474 163 T N -2.026 112.443 114.554 -0.142 0.000 2.773 163 T HA 0.776 5.127 4.350 0.003 0.000 0.278 163 T C -0.459 174.110 174.700 -0.218 0.000 1.011 163 T CA -0.714 61.274 62.100 -0.186 0.000 1.014 163 T CB 1.565 70.213 68.868 -0.367 0.000 1.293 163 T HN 0.408 8.648 8.240 -0.000 0.000 0.554 164 I N 0.258 120.729 120.570 -0.165 0.000 2.740 164 I HA 0.400 4.572 4.170 0.003 0.000 0.303 164 I C -0.598 175.433 176.117 -0.143 0.000 1.044 164 I CA -1.337 59.896 61.300 -0.111 0.000 1.064 164 I CB 1.957 39.944 38.000 -0.021 0.000 1.249 164 I HN 0.468 8.678 8.210 -0.000 0.000 0.433 165 I N 4.625 125.127 120.570 -0.113 0.000 2.278 165 I HA 0.174 4.346 4.170 0.003 0.000 0.296 165 I C 0.264 176.364 176.117 -0.027 0.000 1.121 165 I CA -0.192 61.026 61.300 -0.135 0.000 1.267 165 I CB -0.649 37.236 38.000 -0.193 0.000 1.447 165 I HN 0.437 8.647 8.210 -0.000 0.000 0.509 166 K N 7.541 127.922 120.400 -0.031 0.000 2.297 166 K HA 0.331 4.653 4.320 0.003 0.000 0.286 166 K C -1.870 174.735 176.600 0.009 0.000 1.053 166 K CA -1.342 54.949 56.287 0.007 0.000 0.940 166 K CB 0.860 33.365 32.500 0.009 0.000 1.019 166 K HN 0.362 8.612 8.250 -0.000 0.000 0.475 167 P HA 0.010 4.430 4.420 -0.000 0.000 0.272 167 P C 0.165 177.517 177.300 0.085 0.000 1.223 167 P CA -0.212 62.917 63.100 0.049 0.000 0.784 167 P CB 0.901 32.627 31.700 0.044 0.000 0.923 168 K N 1.563 122.010 120.400 0.080 0.000 2.209 168 K HA -0.012 4.310 4.320 0.003 0.000 0.204 168 K C 0.018 176.701 176.600 0.137 0.000 1.048 168 K CA 0.966 57.314 56.287 0.101 0.000 0.940 168 K CB 0.005 32.550 32.500 0.075 0.000 0.729 168 K HN 0.465 8.715 8.250 -0.000 0.000 0.451 169 L N -1.349 119.953 121.223 0.133 0.000 2.545 169 L HA 0.339 4.681 4.340 0.003 0.000 0.258 169 L C -0.386 176.550 176.870 0.111 0.000 0.942 169 L CA -0.305 54.644 54.840 0.183 0.000 0.855 169 L CB 2.525 44.697 42.059 0.190 0.000 1.374 169 L HN 0.302 8.532 8.230 -0.000 0.000 0.411 170 G N 2.509 111.388 108.800 0.132 0.000 2.147 170 G HA2 -0.117 3.845 3.960 0.003 0.000 0.128 170 G HA3 -0.117 3.845 3.960 0.003 0.000 0.128 170 G C -0.698 174.206 174.900 0.008 0.000 1.026 170 G CA -0.658 44.360 45.100 -0.136 0.000 0.693 170 G HN 0.300 8.590 8.290 -0.000 0.000 0.499 171 L N 1.598 122.934 121.223 0.188 0.000 2.280 171 L HA 0.499 4.841 4.340 0.003 0.000 0.287 171 L C 1.158 178.178 176.870 0.249 0.000 1.023 171 L CA -0.862 54.106 54.840 0.213 0.000 0.819 171 L CB 1.076 43.327 42.059 0.320 0.000 1.212 171 L HN 0.175 8.405 8.230 -0.000 0.000 0.420 172 R N 3.569 124.181 120.500 0.188 0.000 2.801 172 R HA 0.089 4.431 4.340 0.003 0.000 0.273 172 R C -1.381 175.017 176.300 0.162 0.000 1.080 172 R CA -1.411 54.796 56.100 0.179 0.000 1.197 172 R CB -0.016 30.363 30.300 0.133 0.000 1.109 172 R HN 0.361 8.631 8.270 -0.000 0.000 0.535 173 P HA -0.290 4.130 4.420 -0.000 0.000 0.217 173 P C 0.875 178.259 177.300 0.140 0.000 1.162 173 P CA 1.640 64.790 63.100 0.084 0.000 0.901 173 P CB 0.066 31.785 31.700 0.031 0.000 0.793 174 K N -1.177 119.287 120.400 0.106 0.000 1.973 174 K HA -0.083 4.239 4.320 0.003 0.000 0.210 174 K C -0.461 176.197 176.600 0.097 0.000 1.045 174 K CA 1.991 58.328 56.287 0.083 0.000 0.937 174 K CB -1.705 30.824 32.500 0.049 0.000 0.721 174 K HN 0.064 8.314 8.250 -0.000 0.000 0.438 175 P HA -0.212 4.208 4.420 -0.000 0.000 0.217 175 P C 1.214 178.574 177.300 0.099 0.000 1.158 175 P CA 1.373 64.525 63.100 0.085 0.000 0.887 175 P CB -0.116 31.639 31.700 0.090 0.000 0.792 176 F N 0.304 120.270 119.950 0.027 0.000 2.046 176 F HA -0.221 4.308 4.527 0.003 0.000 0.297 176 F C 2.317 178.118 175.800 0.003 0.000 1.123 176 F CA 1.990 60.005 58.000 0.024 0.000 1.199 176 F CB -0.951 38.075 39.000 0.042 0.000 0.972 176 F HN -0.136 8.164 8.300 -0.000 0.000 0.474 177 A N -0.046 122.936 122.820 0.269 0.000 1.883 177 A HA -0.192 4.130 4.320 0.003 0.000 0.217 177 A C 2.126 179.736 177.584 0.043 0.000 1.186 177 A CA 1.859 53.983 52.037 0.145 0.000 0.624 177 A CB -0.792 18.284 19.000 0.126 0.000 0.822 177 A HN 0.454 8.604 8.150 -0.000 0.000 0.444 178 E N -0.027 120.193 120.200 0.032 0.000 2.051 178 E HA -0.133 4.219 4.350 0.003 0.000 0.192 178 E C 2.367 178.964 176.600 -0.006 0.000 0.991 178 E CA 1.287 57.701 56.400 0.023 0.000 0.799 178 E CB -0.795 28.910 29.700 0.008 0.000 0.748 178 E HN 0.566 8.926 8.360 -0.000 0.000 0.449 179 A N 0.817 123.582 122.820 -0.092 0.000 1.940 179 A HA -0.227 4.095 4.320 0.003 0.000 0.219 179 A C 2.648 180.107 177.584 -0.208 0.000 1.176 179 A CA 1.583 53.527 52.037 -0.155 0.000 0.631 179 A CB -0.991 17.858 19.000 -0.250 0.000 0.814 179 A HN 0.345 8.495 8.150 -0.000 0.000 0.446 180 C N -1.761 117.350 119.300 -0.315 0.000 2.436 180 C HA -0.098 4.364 4.460 0.003 0.000 0.277 180 C C 2.643 177.483 174.990 -0.249 0.000 1.241 180 C CA 1.068 59.794 59.018 -0.488 0.000 1.721 180 C CB -1.346 26.068 27.740 -0.543 0.000 2.043 180 C HN 0.785 9.015 8.230 -0.000 0.000 0.472 181 H N 1.397 120.463 119.070 -0.005 0.000 2.251 181 H HA -0.194 4.364 4.556 0.003 0.000 0.294 181 H C 2.279 177.693 175.328 0.142 0.000 1.078 181 H CA 2.531 58.699 56.048 0.200 0.000 1.246 181 H CB -0.643 29.195 29.762 0.127 0.000 1.358 181 H HN 0.390 8.670 8.280 -0.000 0.000 0.488 182 A N 1.127 124.058 122.820 0.185 0.000 1.870 182 A HA -0.292 4.030 4.320 0.003 0.000 0.219 182 A C 2.546 180.132 177.584 0.003 0.000 1.224 182 A CA 2.246 54.338 52.037 0.093 0.000 0.650 182 A CB -1.708 17.340 19.000 0.080 0.000 0.836 182 A HN 0.589 8.739 8.150 -0.000 0.000 0.454 183 F N -0.784 119.083 119.950 -0.139 0.000 2.095 183 F HA -0.193 4.335 4.527 0.003 0.000 0.298 183 F C 1.881 177.621 175.800 -0.099 0.000 1.104 183 F CA 1.628 59.512 58.000 -0.193 0.000 1.232 183 F CB -0.408 38.429 39.000 -0.271 0.000 0.987 183 F HN 0.420 8.720 8.300 -0.000 0.000 0.475 184 W N 1.113 122.444 121.300 0.051 0.000 2.874 184 W HA -0.058 4.604 4.660 0.003 0.000 0.242 184 W C 1.528 177.933 176.519 -0.190 0.000 1.285 184 W CA 0.495 57.811 57.345 -0.047 0.000 1.379 184 W CB -1.136 28.340 29.460 0.027 0.000 1.137 184 W HN 0.204 8.384 8.180 -0.000 0.000 0.683 185 L N -1.267 119.915 121.223 -0.068 0.000 2.529 185 L HA 0.145 4.487 4.340 0.003 0.000 0.223 185 L C 2.189 178.957 176.870 -0.169 0.000 1.113 185 L CA 0.968 55.736 54.840 -0.121 0.000 0.861 185 L CB -0.471 41.507 42.059 -0.136 0.000 1.012 185 L HN -0.071 8.159 8.230 -0.000 0.000 0.461 186 G N -0.863 107.753 108.800 -0.306 0.000 2.906 186 G HA2 0.195 4.157 3.960 0.003 0.000 0.200 186 G HA3 0.195 4.157 3.960 0.003 0.000 0.200 186 G C 0.726 175.403 174.900 -0.373 0.000 1.101 186 G CA 0.524 45.401 45.100 -0.371 0.000 0.760 186 G HN 0.294 8.584 8.290 -0.000 0.000 0.694 187 G N -0.162 108.284 108.800 -0.590 0.000 2.580 187 G HA2 0.424 4.386 3.960 0.003 0.000 0.278 187 G HA3 0.424 4.386 3.960 0.003 0.000 0.278 187 G C -0.112 174.899 174.900 0.184 0.000 1.212 187 G CA 0.014 44.941 45.100 -0.287 0.000 0.939 187 G HN 0.058 8.348 8.290 -0.000 0.000 0.513 188 D N -1.383 119.237 120.400 0.367 0.000 2.597 188 D HA 0.082 4.724 4.640 0.003 0.000 0.261 188 D C -0.278 176.359 176.300 0.562 0.000 1.023 188 D CA 0.427 54.639 54.000 0.354 0.000 0.927 188 D CB 0.596 41.517 40.800 0.201 0.000 1.168 188 D HN 0.204 8.574 8.370 -0.000 0.000 0.491 189 F N 1.698 121.873 119.950 0.376 0.000 2.493 189 F HA 0.446 4.975 4.527 0.003 0.000 0.329 189 F C -0.757 175.176 175.800 0.221 0.000 1.126 189 F CA -0.809 57.376 58.000 0.308 0.000 0.937 189 F CB 1.306 40.346 39.000 0.066 0.000 1.146 189 F HN -0.322 7.978 8.300 -0.000 0.000 0.442 190 I N 5.670 126.110 120.570 -0.216 0.000 2.493 190 I HA 0.392 4.564 4.170 0.003 0.000 0.298 190 I C -1.126 174.586 176.117 -0.675 0.000 0.998 190 I CA -0.992 60.048 61.300 -0.433 0.000 1.137 190 I CB 2.201 39.952 38.000 -0.415 0.000 1.310 190 I HN 0.552 8.762 8.210 -0.000 0.000 0.445 191 K N 4.239 124.333 120.400 -0.511 0.000 2.471 191 K HA 0.396 4.718 4.320 0.003 0.000 0.252 191 K C -0.944 175.520 176.600 -0.228 0.000 0.938 191 K CA -0.670 55.340 56.287 -0.462 0.000 0.796 191 K CB 1.472 33.893 32.500 -0.131 0.000 1.161 191 K HN 0.469 8.719 8.250 -0.000 0.000 0.425 192 N N 2.622 121.182 118.700 -0.233 0.000 2.357 192 N HA -0.095 4.646 4.740 0.003 0.000 0.257 192 N C -0.446 175.073 175.510 0.014 0.000 1.250 192 N CA 0.308 53.369 53.050 0.018 0.000 0.862 192 N CB 0.438 38.924 38.487 -0.002 0.000 1.066 192 N HN 0.609 8.989 8.380 -0.000 0.000 0.468 193 D N 1.236 121.689 120.400 0.087 0.000 2.369 193 D HA -0.076 4.566 4.640 0.003 0.000 0.241 193 D C 1.263 177.620 176.300 0.095 0.000 1.271 193 D CA -0.035 54.017 54.000 0.087 0.000 0.942 193 D CB 0.615 41.477 40.800 0.104 0.000 1.129 193 D HN 0.629 8.999 8.370 -0.000 0.000 0.476 194 E N -0.080 120.209 120.200 0.148 0.000 2.055 194 E HA -0.211 4.141 4.350 0.003 0.000 0.209 194 E C -1.107 175.507 176.600 0.023 0.000 1.036 194 E CA 1.313 57.773 56.400 0.100 0.000 0.849 194 E CB -1.246 28.444 29.700 -0.017 0.000 0.767 194 E HN 0.356 8.716 8.360 -0.000 0.000 0.461 195 P HA 0.048 4.468 4.420 -0.000 0.000 0.255 195 P C -0.438 176.866 177.300 0.007 0.000 1.248 195 P CA 0.143 63.249 63.100 0.010 0.000 0.807 195 P CB 0.234 31.948 31.700 0.024 0.000 1.150 196 Q N 0.357 120.170 119.800 0.022 0.000 2.239 196 Q HA 0.324 4.666 4.340 0.003 0.000 0.286 196 Q C 0.946 176.919 176.000 -0.045 0.000 1.102 196 Q CA 0.589 56.388 55.803 -0.007 0.000 0.936 196 Q CB 0.067 28.816 28.738 0.019 0.000 1.127 196 Q HN 0.227 8.497 8.270 -0.000 0.000 0.380 197 G N 2.289 111.037 108.800 -0.086 0.000 3.481 197 G HA2 0.032 3.993 3.960 0.003 0.000 0.180 197 G HA3 0.032 3.993 3.960 0.003 0.000 0.180 197 G C -0.631 174.187 174.900 -0.137 0.000 1.345 197 G CA -0.306 44.739 45.100 -0.090 0.000 1.104 197 G HN 0.518 8.808 8.290 -0.000 0.000 0.749 198 N N 0.774 119.382 118.700 -0.153 0.000 2.644 198 N HA 0.362 5.104 4.740 0.003 0.000 0.313 198 N C -0.386 174.974 175.510 -0.249 0.000 1.863 198 N CA -0.294 52.645 53.050 -0.185 0.000 0.918 198 N CB 0.603 39.007 38.487 -0.137 0.000 1.320 198 N HN 0.197 8.577 8.380 -0.000 0.000 0.490 199 Q N 0.143 119.709 119.800 -0.390 0.000 2.432 199 Q HA 0.186 4.528 4.340 0.003 0.000 0.264 199 Q C -1.397 174.257 176.000 -0.576 0.000 1.035 199 Q CA -1.109 54.331 55.803 -0.603 0.000 0.908 199 Q CB 0.534 28.523 28.738 -1.250 0.000 1.280 199 Q HN 0.269 8.539 8.270 -0.000 0.000 0.455 200 P HA -0.122 4.298 4.420 -0.000 0.000 0.220 200 P C 0.237 177.451 177.300 -0.144 0.000 1.148 200 P CA 1.113 64.098 63.100 -0.192 0.000 0.803 200 P CB 0.041 31.709 31.700 -0.053 0.000 0.782 201 F N -2.332 117.607 119.950 -0.019 0.000 2.797 201 F HA 0.590 5.119 4.527 0.003 0.000 0.302 201 F C 0.698 176.487 175.800 -0.018 0.000 1.130 201 F CA -0.238 57.754 58.000 -0.014 0.000 1.387 201 F CB -0.237 38.760 39.000 -0.006 0.000 1.107 201 F HN -0.185 8.115 8.300 -0.000 0.000 0.577 202 A N 0.604 123.278 122.820 -0.244 0.000 3.330 202 A HA 0.458 4.780 4.320 0.003 0.000 0.256 202 A C -2.885 174.564 177.584 -0.225 0.000 1.185 202 A CA -1.147 50.813 52.037 -0.128 0.000 0.940 202 A CB -0.487 18.501 19.000 -0.021 0.000 1.397 202 A HN -0.031 8.119 8.150 -0.000 0.000 0.678 203 P HA 0.046 4.466 4.420 -0.000 0.000 0.265 203 P C 1.321 178.533 177.300 -0.146 0.000 1.187 203 P CA -0.101 62.899 63.100 -0.166 0.000 0.766 203 P CB 0.740 32.366 31.700 -0.124 0.000 0.820 204 L N 3.873 125.005 121.223 -0.152 0.000 2.012 204 L HA -0.234 4.108 4.340 0.003 0.000 0.210 204 L C 2.357 179.190 176.870 -0.060 0.000 1.073 204 L CA 1.867 56.643 54.840 -0.108 0.000 0.748 204 L CB -0.204 41.787 42.059 -0.113 0.000 0.891 204 L HN 0.282 8.512 8.230 -0.000 0.000 0.431 205 R N -0.530 119.860 120.500 -0.183 0.000 2.092 205 R HA -0.136 4.206 4.340 0.003 0.000 0.231 205 R C 1.868 178.203 176.300 0.060 0.000 1.119 205 R CA 1.566 57.540 56.100 -0.209 0.000 0.970 205 R CB -0.385 29.668 30.300 -0.411 0.000 0.864 205 R HN 0.453 8.723 8.270 -0.000 0.000 0.440 206 D N -0.604 119.787 120.400 -0.015 0.000 2.097 206 D HA -0.091 4.550 4.640 0.003 0.000 0.197 206 D C 1.791 178.097 176.300 0.010 0.000 0.984 206 D CA 1.477 55.479 54.000 0.004 0.000 0.826 206 D CB -0.361 40.426 40.800 -0.022 0.000 0.973 206 D HN 0.114 8.484 8.370 -0.000 0.000 0.460 207 T N 0.846 115.389 114.554 -0.018 0.000 2.777 207 T HA -0.029 4.323 4.350 0.003 0.000 0.266 207 T C 1.788 176.483 174.700 -0.007 0.000 1.040 207 T CA 0.405 62.479 62.100 -0.044 0.000 1.141 207 T CB 0.062 68.828 68.868 -0.170 0.000 0.868 207 T HN 0.080 8.320 8.240 -0.000 0.000 0.444 208 I N 1.351 121.959 120.570 0.062 0.000 3.111 208 I HA 0.095 4.267 4.170 0.003 0.000 0.272 208 I C 2.525 178.608 176.117 -0.055 0.000 1.268 208 I CA 0.356 61.716 61.300 0.099 0.000 1.467 208 I CB -1.193 36.998 38.000 0.318 0.000 1.087 208 I HN 0.179 8.389 8.210 -0.000 0.000 0.467 209 A N 0.379 123.198 122.820 -0.002 0.000 1.943 209 A HA 0.013 4.335 4.320 0.003 0.000 0.213 209 A C 2.292 179.798 177.584 -0.129 0.000 1.181 209 A CA 0.497 52.483 52.037 -0.085 0.000 0.653 209 A CB -0.280 18.734 19.000 0.023 0.000 0.833 209 A HN 0.256 8.406 8.150 -0.000 0.000 0.451 210 L N -0.206 120.978 121.223 -0.066 0.000 2.005 210 L HA -0.127 4.215 4.340 0.003 0.000 0.207 210 L C 2.552 179.386 176.870 -0.060 0.000 1.072 210 L CA 1.359 56.175 54.840 -0.041 0.000 0.744 210 L CB -0.574 41.493 42.059 0.014 0.000 0.895 210 L HN 0.252 8.482 8.230 -0.000 0.000 0.433 211 V N 0.257 120.129 119.914 -0.070 0.000 2.392 211 V HA -0.292 3.830 4.120 0.003 0.000 0.249 211 V C 2.783 178.728 176.094 -0.249 0.000 1.059 211 V CA 1.636 63.887 62.300 -0.082 0.000 1.051 211 V CB -0.981 30.739 31.823 -0.171 0.000 0.658 211 V HN 0.494 8.684 8.190 -0.000 0.000 0.455 212 A N 0.193 122.678 122.820 -0.559 0.000 1.908 212 A HA -0.341 3.981 4.320 0.003 0.000 0.218 212 A C 2.054 179.390 177.584 -0.414 0.000 1.181 212 A CA 2.420 53.901 52.037 -0.926 0.000 0.627 212 A CB -0.708 17.653 19.000 -1.065 0.000 0.818 212 A HN 0.614 8.764 8.150 -0.000 0.000 0.445 213 D N -0.557 119.707 120.400 -0.226 0.000 2.097 213 D HA -0.000 4.642 4.640 0.003 0.000 0.197 213 D C 2.086 178.384 176.300 -0.003 0.000 0.984 213 D CA 1.654 55.592 54.000 -0.103 0.000 0.826 213 D CB -0.254 40.502 40.800 -0.072 0.000 0.973 213 D HN 0.330 8.700 8.370 -0.000 0.000 0.460 214 A N 0.232 123.100 122.820 0.080 0.000 1.948 214 A HA -0.219 4.103 4.320 0.003 0.000 0.220 214 A C 2.300 180.063 177.584 0.298 0.000 1.177 214 A CA 1.799 53.998 52.037 0.271 0.000 0.636 214 A CB -0.806 18.390 19.000 0.327 0.000 0.815 214 A HN 0.440 8.590 8.150 -0.000 0.000 0.449 215 M N -0.856 118.808 119.600 0.108 0.000 2.059 215 M HA -0.208 4.274 4.480 0.003 0.000 0.259 215 M C 2.417 178.637 176.300 -0.133 0.000 1.072 215 M CA 1.938 57.093 55.300 -0.243 0.000 1.117 215 M CB -0.219 32.225 32.600 -0.261 0.000 1.320 215 M HN 0.416 8.706 8.290 -0.000 0.000 0.408 216 R N -0.393 120.056 120.500 -0.085 0.000 2.115 216 R HA -0.200 4.141 4.340 0.003 0.000 0.239 216 R C 2.249 178.549 176.300 0.001 0.000 1.133 216 R CA 2.213 58.279 56.100 -0.057 0.000 0.935 216 R CB -0.597 29.666 30.300 -0.061 0.000 0.853 216 R HN 0.478 8.748 8.270 -0.000 0.000 0.433 217 R N 0.233 120.774 120.500 0.068 0.000 2.070 217 R HA -0.106 4.236 4.340 0.003 0.000 0.233 217 R C 2.461 178.839 176.300 0.130 0.000 1.137 217 R CA 1.427 57.612 56.100 0.143 0.000 0.945 217 R CB -0.546 29.898 30.300 0.241 0.000 0.845 217 R HN 0.255 8.525 8.270 -0.000 0.000 0.430 218 A N 1.493 124.367 122.820 0.090 0.000 1.883 218 A HA -0.257 4.065 4.320 0.003 0.000 0.217 218 A C 2.152 179.696 177.584 -0.068 0.000 1.186 218 A CA 1.478 53.480 52.037 -0.059 0.000 0.624 218 A CB -0.549 18.443 19.000 -0.014 0.000 0.822 218 A HN 0.367 8.517 8.150 -0.000 0.000 0.444 219 Q N -0.545 119.203 119.800 -0.087 0.000 2.045 219 Q HA -0.235 4.107 4.340 0.003 0.000 0.206 219 Q C 1.701 177.685 176.000 -0.028 0.000 0.991 219 Q CA 1.705 57.466 55.803 -0.069 0.000 0.851 219 Q CB -0.412 28.285 28.738 -0.068 0.000 0.911 219 Q HN 0.635 8.905 8.270 -0.000 0.000 0.418 220 D N 0.572 120.965 120.400 -0.012 0.000 2.182 220 D HA -0.146 4.496 4.640 0.003 0.000 0.201 220 D C 1.271 177.578 176.300 0.012 0.000 0.986 220 D CA 1.240 55.242 54.000 0.004 0.000 0.847 220 D CB -0.121 40.684 40.800 0.009 0.000 0.942 220 D HN 0.436 8.806 8.370 -0.000 0.000 0.467 221 E N -0.857 119.352 120.200 0.016 0.000 2.474 221 E HA 0.064 4.415 4.350 0.003 0.000 0.194 221 E C 1.265 177.866 176.600 0.001 0.000 1.041 221 E CA 0.456 56.867 56.400 0.018 0.000 0.874 221 E CB 0.425 30.147 29.700 0.036 0.000 0.914 221 E HN 0.056 8.416 8.360 -0.000 0.000 0.498 222 T N -1.150 113.399 114.554 -0.009 0.000 3.026 222 T HA 0.178 4.530 4.350 0.003 0.000 0.245 222 T C 1.353 176.051 174.700 -0.004 0.000 1.004 222 T CA 0.734 62.826 62.100 -0.014 0.000 1.069 222 T CB 0.552 69.400 68.868 -0.033 0.000 1.005 222 T HN 0.354 8.594 8.240 -0.000 0.000 0.472 223 G N 2.095 110.893 108.800 -0.004 0.000 2.179 223 G HA2 -0.205 3.756 3.960 0.003 0.000 0.260 223 G HA3 -0.205 3.756 3.960 0.003 0.000 0.260 223 G C -0.206 174.697 174.900 0.006 0.000 0.977 223 G CA 0.359 45.461 45.100 0.004 0.000 0.641 223 G HN 0.563 8.853 8.290 -0.000 0.000 0.533 224 E N 0.081 120.280 120.200 -0.003 0.000 2.221 224 E HA 0.726 5.078 4.350 0.003 0.000 0.268 224 E C 0.314 176.904 176.600 -0.017 0.000 0.933 224 E CA -0.409 55.989 56.400 -0.002 0.000 0.809 224 E CB 1.733 31.435 29.700 0.003 0.000 1.190 224 E HN 0.662 9.022 8.360 -0.000 0.000 0.406 225 A N 2.183 124.996 122.820 -0.011 0.000 2.354 225 A HA 0.445 4.766 4.320 0.003 0.000 0.269 225 A C -0.470 177.071 177.584 -0.072 0.000 1.109 225 A CA -0.367 51.669 52.037 -0.001 0.000 0.800 225 A CB 0.367 19.346 19.000 -0.036 0.000 1.045 225 A HN 0.348 8.498 8.150 -0.000 0.000 0.489 226 K N 0.596 120.932 120.400 -0.105 0.000 2.328 226 K HA 0.730 5.052 4.320 0.003 0.000 0.246 226 K C -1.143 175.391 176.600 -0.109 0.000 0.955 226 K CA -0.272 55.837 56.287 -0.295 0.000 0.817 226 K CB 1.715 33.682 32.500 -0.889 0.000 1.208 226 K HN 0.585 8.835 8.250 -0.000 0.000 0.432 227 L N 2.206 123.474 121.223 0.076 0.000 2.329 227 L HA 0.610 4.952 4.340 0.003 0.000 0.279 227 L C -0.960 176.201 176.870 0.486 0.000 1.014 227 L CA -0.942 54.073 54.840 0.292 0.000 0.814 227 L CB 1.017 43.311 42.059 0.391 0.000 1.257 227 L HN 0.460 8.690 8.230 -0.000 0.000 0.424 228 F N 1.350 121.380 119.950 0.134 0.000 2.569 228 F HA 0.502 5.031 4.527 0.003 0.000 0.312 228 F C -0.410 175.306 175.800 -0.140 0.000 1.109 228 F CA -0.435 57.597 58.000 0.053 0.000 0.919 228 F CB 2.259 41.429 39.000 0.283 0.000 1.211 228 F HN 0.253 8.553 8.300 -0.000 0.000 0.446 229 S N 4.294 119.370 115.700 -1.040 0.000 2.667 229 S HA 0.799 5.270 4.470 0.003 0.000 0.304 229 S C -0.881 173.224 174.600 -0.825 0.000 1.135 229 S CA -0.375 57.460 58.200 -0.607 0.000 1.125 229 S CB 0.298 63.360 63.200 -0.229 0.000 0.996 229 S HN 0.882 9.192 8.310 -0.000 0.000 0.474 230 A N 4.512 127.052 122.820 -0.467 0.000 2.260 230 A HA 0.540 4.862 4.320 0.003 0.000 0.314 230 A C 0.127 177.664 177.584 -0.078 0.000 1.257 230 A CA -0.887 51.061 52.037 -0.149 0.000 0.871 230 A CB -0.001 19.124 19.000 0.208 0.000 1.166 230 A HN 0.940 9.090 8.150 -0.000 0.000 0.522 231 N N 1.264 119.928 118.700 -0.059 0.000 2.520 231 N HA 0.376 5.118 4.740 0.003 0.000 0.273 231 N C 0.163 175.656 175.510 -0.028 0.000 1.155 231 N CA -0.402 52.615 53.050 -0.055 0.000 0.967 231 N CB 0.650 39.106 38.487 -0.051 0.000 1.092 231 N HN 0.609 8.989 8.380 -0.000 0.000 0.457 232 I N -2.243 118.302 120.570 -0.042 0.000 4.009 232 I HA 0.274 4.446 4.170 0.003 0.000 0.331 232 I C -0.471 175.627 176.117 -0.032 0.000 1.462 232 I CA -0.661 60.620 61.300 -0.033 0.000 1.117 232 I CB 0.142 38.105 38.000 -0.062 0.000 1.091 232 I HN 0.300 8.510 8.210 -0.000 0.000 0.410 233 T N 3.213 117.742 114.554 -0.042 0.000 2.933 233 T HA 0.481 4.833 4.350 0.003 0.000 0.306 233 T C 0.202 174.882 174.700 -0.033 0.000 1.045 233 T CA 0.646 62.719 62.100 -0.046 0.000 1.143 233 T CB 0.734 69.571 68.868 -0.052 0.000 1.003 233 T HN 0.644 8.884 8.240 -0.000 0.000 0.540 234 A N 2.497 125.299 122.820 -0.030 0.000 2.566 234 A HA 0.561 4.883 4.320 0.003 0.000 0.290 234 A C 0.379 177.952 177.584 -0.018 0.000 1.071 234 A CA -0.702 51.324 52.037 -0.018 0.000 0.658 234 A CB 0.821 19.819 19.000 -0.003 0.000 1.285 234 A HN 0.593 8.743 8.150 -0.000 0.000 0.427 235 D N 0.095 120.490 120.400 -0.008 0.000 2.162 235 D HA 0.062 4.704 4.640 0.003 0.000 0.203 235 D C -0.159 176.147 176.300 0.009 0.000 0.967 235 D CA 1.580 55.577 54.000 -0.005 0.000 0.840 235 D CB 0.276 41.075 40.800 -0.001 0.000 0.972 235 D HN 0.525 8.895 8.370 -0.000 0.000 0.482 236 D N -0.974 119.444 120.400 0.030 0.000 2.280 236 D HA 0.153 4.795 4.640 0.003 0.000 0.236 236 D C -1.949 174.382 176.300 0.053 0.000 1.082 236 D CA -2.307 51.737 54.000 0.073 0.000 0.834 236 D CB 2.015 42.877 40.800 0.103 0.000 1.100 236 D HN -0.175 8.195 8.370 -0.000 0.000 0.486 237 P HA -0.087 4.333 4.420 -0.000 0.000 0.218 237 P C 0.996 178.152 177.300 -0.240 0.000 1.148 237 P CA 0.952 63.942 63.100 -0.182 0.000 0.822 237 P CB 0.020 31.508 31.700 -0.354 0.000 0.784 238 F N -0.528 119.437 119.950 0.024 0.000 2.502 238 F HA -0.057 4.472 4.527 0.003 0.000 0.298 238 F C 2.338 178.163 175.800 0.042 0.000 1.111 238 F CA 0.941 58.960 58.000 0.031 0.000 1.445 238 F CB -0.579 38.431 39.000 0.016 0.000 1.081 238 F HN -0.043 8.257 8.300 -0.000 0.000 0.558 239 E N 0.888 121.194 120.200 0.177 0.000 2.102 239 E HA -0.058 4.294 4.350 0.003 0.000 0.190 239 E C 2.091 178.739 176.600 0.080 0.000 0.971 239 E CA 1.034 57.500 56.400 0.110 0.000 0.821 239 E CB -0.362 29.382 29.700 0.074 0.000 0.777 239 E HN 0.364 8.724 8.360 -0.000 0.000 0.460 240 I N 0.686 121.288 120.570 0.054 0.000 2.226 240 I HA -0.246 3.926 4.170 0.003 0.000 0.245 240 I C 2.256 178.446 176.117 0.121 0.000 1.100 240 I CA 1.126 62.455 61.300 0.048 0.000 1.374 240 I CB -0.332 37.675 38.000 0.011 0.000 1.057 240 I HN 0.188 8.399 8.210 -0.000 0.000 0.413 241 I N 0.796 121.451 120.570 0.142 0.000 2.286 241 I HA -0.228 3.943 4.170 0.003 0.000 0.245 241 I C 2.883 179.175 176.117 0.291 0.000 1.104 241 I CA 1.071 62.534 61.300 0.272 0.000 1.397 241 I CB -0.474 37.569 38.000 0.073 0.000 1.072 241 I HN 0.157 8.367 8.210 -0.000 0.000 0.417 242 A N 1.374 124.313 122.820 0.197 0.000 1.892 242 A HA -0.253 4.069 4.320 0.003 0.000 0.218 242 A C 2.408 180.097 177.584 0.176 0.000 1.188 242 A CA 1.826 53.967 52.037 0.174 0.000 0.631 242 A CB -0.630 18.443 19.000 0.122 0.000 0.822 242 A HN 0.348 8.498 8.150 -0.000 0.000 0.447 243 R N -1.209 119.369 120.500 0.130 0.000 2.062 243 R HA -0.054 4.288 4.340 0.003 0.000 0.231 243 R C 2.516 178.857 176.300 0.068 0.000 1.136 243 R CA 1.057 57.224 56.100 0.111 0.000 0.948 243 R CB -0.944 29.387 30.300 0.052 0.000 0.845 243 R HN 0.517 8.787 8.270 -0.000 0.000 0.430 244 G N 1.663 110.427 108.800 -0.059 0.000 2.556 244 G HA2 -0.322 3.640 3.960 0.003 0.000 0.220 244 G HA3 -0.322 3.640 3.960 0.003 0.000 0.220 244 G C 1.199 175.941 174.900 -0.264 0.000 1.156 244 G CA 1.099 45.877 45.100 -0.536 0.000 0.766 244 G HN 0.389 8.678 8.290 -0.000 0.000 0.583 245 E N -1.034 119.265 120.200 0.164 0.000 2.152 245 E HA -0.064 4.288 4.350 0.003 0.000 0.192 245 E C 2.075 178.789 176.600 0.191 0.000 0.983 245 E CA 0.705 57.266 56.400 0.267 0.000 0.818 245 E CB -0.123 29.764 29.700 0.311 0.000 0.758 245 E HN 0.668 9.028 8.360 -0.000 0.000 0.467 246 Y N 0.536 120.889 120.300 0.088 0.000 2.420 246 Y HA -0.066 4.486 4.550 0.003 0.000 0.292 246 Y C 1.911 177.874 175.900 0.104 0.000 1.119 246 Y CA 0.532 58.681 58.100 0.081 0.000 1.229 246 Y CB 0.151 38.648 38.460 0.061 0.000 1.026 246 Y HN -0.219 8.061 8.280 -0.000 0.000 0.554 247 V N 0.469 120.433 119.914 0.084 0.000 2.302 247 V HA -0.261 3.861 4.120 0.003 0.000 0.243 247 V C 2.294 178.477 176.094 0.149 0.000 1.036 247 V CA 1.859 64.234 62.300 0.125 0.000 1.020 247 V CB -0.560 31.356 31.823 0.155 0.000 0.657 247 V HN 0.420 8.610 8.190 -0.000 0.000 0.453 248 L N 0.527 121.772 121.223 0.036 0.000 2.201 248 L HA -0.151 4.190 4.340 0.003 0.000 0.212 248 L C 2.391 179.307 176.870 0.076 0.000 1.105 248 L CA 1.843 56.709 54.840 0.043 0.000 0.775 248 L CB -0.441 41.633 42.059 0.025 0.000 0.913 248 L HN 0.590 8.820 8.230 -0.000 0.000 0.440 249 E N -1.327 118.886 120.200 0.022 0.000 2.474 249 E HA -0.031 4.321 4.350 0.003 0.000 0.195 249 E C 1.139 177.688 176.600 -0.084 0.000 1.039 249 E CA 0.439 56.833 56.400 -0.009 0.000 0.881 249 E CB 0.254 29.955 29.700 0.002 0.000 0.970 249 E HN 0.180 8.540 8.360 -0.000 0.000 0.486 250 T N -0.408 114.066 114.554 -0.134 0.000 2.990 250 T HA 0.182 4.534 4.350 0.003 0.000 0.250 250 T C 0.608 175.171 174.700 -0.227 0.000 1.041 250 T CA -0.106 61.838 62.100 -0.260 0.000 1.010 250 T CB -0.056 68.487 68.868 -0.543 0.000 1.003 250 T HN 0.145 8.385 8.240 -0.000 0.000 0.499 251 F N 1.444 121.309 119.950 -0.142 0.000 2.754 251 F HA 0.302 4.831 4.527 0.003 0.000 0.297 251 F C 2.169 177.901 175.800 -0.114 0.000 1.122 251 F CA 0.092 58.023 58.000 -0.115 0.000 1.400 251 F CB -0.369 38.586 39.000 -0.075 0.000 1.117 251 F HN 0.273 8.573 8.300 -0.000 0.000 0.587 252 G N 0.983 109.823 108.800 0.067 0.000 2.740 252 G HA2 -0.499 3.462 3.960 0.003 0.000 0.365 252 G HA3 -0.499 3.462 3.960 0.003 0.000 0.365 252 G C 1.408 176.319 174.900 0.020 0.000 1.135 252 G CA 1.318 46.430 45.100 0.019 0.000 0.948 252 G HN 0.357 8.647 8.290 -0.000 0.000 0.629 253 E N 0.597 120.788 120.200 -0.015 0.000 2.097 253 E HA -0.123 4.228 4.350 0.003 0.000 0.196 253 E C 1.765 178.329 176.600 -0.060 0.000 1.000 253 E CA 1.139 57.521 56.400 -0.030 0.000 0.804 253 E CB -0.144 29.522 29.700 -0.056 0.000 0.740 253 E HN 0.489 8.849 8.360 -0.000 0.000 0.454 254 N N 0.041 118.670 118.700 -0.118 0.000 2.322 254 N HA 0.084 4.825 4.740 0.003 0.000 0.216 254 N C 0.851 176.352 175.510 -0.016 0.000 1.144 254 N CA 0.347 53.205 53.050 -0.320 0.000 0.830 254 N CB 0.666 38.927 38.487 -0.377 0.000 1.034 254 N HN 0.091 8.471 8.380 -0.000 0.000 0.484 255 A N 1.054 123.910 122.820 0.060 0.000 1.940 255 A HA -0.176 4.146 4.320 0.003 0.000 0.219 255 A C 2.244 179.869 177.584 0.067 0.000 1.176 255 A CA 1.940 54.017 52.037 0.068 0.000 0.631 255 A CB -0.443 18.601 19.000 0.073 0.000 0.814 255 A HN 0.406 8.556 8.150 -0.000 0.000 0.446 256 S N -1.653 114.132 115.700 0.142 0.000 2.593 256 S HA 0.026 4.498 4.470 0.003 0.000 0.217 256 S C 1.088 175.797 174.600 0.183 0.000 0.966 256 S CA 0.421 58.711 58.200 0.151 0.000 0.914 256 S CB -0.770 62.516 63.200 0.144 0.000 0.776 256 S HN 0.764 9.074 8.310 -0.000 0.000 0.523 257 H N 0.035 119.091 119.070 -0.023 0.000 2.586 257 H HA 0.337 4.895 4.556 0.003 0.000 0.273 257 H C -0.347 174.946 175.328 -0.058 0.000 0.997 257 H CA -0.213 55.820 56.048 -0.025 0.000 1.177 257 H CB 0.750 30.503 29.762 -0.013 0.000 1.471 257 H HN 0.295 8.575 8.280 -0.000 0.000 0.538 258 V N 1.665 121.568 119.914 -0.019 0.000 2.427 258 V HA 0.491 4.613 4.120 0.003 0.000 0.286 258 V C 0.296 176.383 176.094 -0.010 0.000 1.034 258 V CA -0.777 61.438 62.300 -0.143 0.000 0.893 258 V CB 1.400 32.978 31.823 -0.409 0.000 0.982 258 V HN 0.249 8.439 8.190 -0.000 0.000 0.452 259 A N 5.398 128.242 122.820 0.041 0.000 2.325 259 A HA 0.889 5.210 4.320 0.003 0.000 0.333 259 A C -0.765 176.872 177.584 0.088 0.000 1.155 259 A CA -0.651 51.499 52.037 0.188 0.000 0.814 259 A CB 0.888 20.109 19.000 0.367 0.000 1.206 259 A HN 0.813 8.963 8.150 -0.000 0.000 0.482 260 L N 2.561 123.846 121.223 0.104 0.000 2.294 260 L HA 0.379 4.721 4.340 0.003 0.000 0.283 260 L C -0.681 176.213 176.870 0.039 0.000 1.015 260 L CA -0.654 54.181 54.840 -0.008 0.000 0.831 260 L CB 1.272 43.269 42.059 -0.105 0.000 1.217 260 L HN 0.687 8.917 8.230 -0.000 0.000 0.420 261 L N 5.356 126.574 121.223 -0.009 0.000 2.305 261 L HA 0.570 4.911 4.340 0.003 0.000 0.281 261 L C -0.643 176.175 176.870 -0.086 0.000 1.085 261 L CA 0.118 54.916 54.840 -0.070 0.000 0.813 261 L CB 1.468 43.413 42.059 -0.189 0.000 1.157 261 L HN 0.303 8.533 8.230 -0.000 0.000 0.436 262 V N 4.980 124.834 119.914 -0.101 0.000 2.488 262 V HA 0.225 4.347 4.120 0.003 0.000 0.293 262 V C -0.590 175.402 176.094 -0.170 0.000 1.027 262 V CA -0.741 61.483 62.300 -0.127 0.000 0.862 262 V CB 1.458 33.195 31.823 -0.144 0.000 1.008 262 V HN 0.740 8.930 8.190 -0.000 0.000 0.428 263 D N 3.945 124.280 120.400 -0.109 0.000 2.429 263 D HA 0.064 4.706 4.640 0.003 0.000 0.253 263 D C 1.399 177.623 176.300 -0.127 0.000 1.294 263 D CA 0.725 54.682 54.000 -0.072 0.000 1.063 263 D CB 1.335 42.097 40.800 -0.064 0.000 1.096 263 D HN 0.724 9.094 8.370 -0.000 0.000 0.516 264 G N 2.631 111.224 108.800 -0.345 0.000 2.509 264 G HA2 -0.296 3.666 3.960 0.003 0.000 0.218 264 G HA3 -0.296 3.666 3.960 0.003 0.000 0.218 264 G C 1.161 176.076 174.900 0.025 0.000 1.124 264 G CA 0.308 45.096 45.100 -0.519 0.000 0.776 264 G HN 0.512 8.802 8.290 -0.000 0.000 0.547 265 Y N 0.304 120.704 120.300 0.166 0.000 2.177 265 Y HA 0.148 4.700 4.550 0.003 0.000 0.291 265 Y C 2.551 178.505 175.900 0.091 0.000 1.117 265 Y CA 0.940 59.175 58.100 0.224 0.000 1.114 265 Y CB -0.120 38.511 38.460 0.285 0.000 1.017 265 Y HN 0.001 8.281 8.280 -0.000 0.000 0.505 266 V N 0.084 120.056 119.914 0.097 0.000 3.573 266 V HA 0.076 4.198 4.120 0.003 0.000 0.270 266 V C 1.269 177.329 176.094 -0.056 0.000 1.221 266 V CA 1.223 63.530 62.300 0.011 0.000 1.163 266 V CB -0.454 31.427 31.823 0.098 0.000 0.847 266 V HN 0.528 8.718 8.190 -0.000 0.000 0.468 267 A N -1.380 121.397 122.820 -0.073 0.000 2.551 267 A HA 0.643 4.965 4.320 0.003 0.000 0.252 267 A C 1.012 178.545 177.584 -0.085 0.000 1.199 267 A CA 0.578 52.571 52.037 -0.073 0.000 0.972 267 A CB 0.218 19.177 19.000 -0.068 0.000 1.153 267 A HN 1.085 9.235 8.150 -0.000 0.000 0.559 268 G N -1.338 107.398 108.800 -0.106 0.000 2.829 268 G HA2 0.203 4.164 3.960 0.003 0.000 0.628 268 G HA3 0.203 4.164 3.960 0.003 0.000 0.628 268 G C 0.906 175.768 174.900 -0.065 0.000 1.412 268 G CA -0.176 44.871 45.100 -0.089 0.000 0.864 268 G HN 1.484 9.774 8.290 -0.000 0.000 0.544 269 A N -0.406 122.397 122.820 -0.029 0.000 2.066 269 A HA 0.417 4.739 4.320 0.003 0.000 0.218 269 A C 2.814 180.382 177.584 -0.026 0.000 1.157 269 A CA 2.621 54.655 52.037 -0.006 0.000 0.670 269 A CB -0.610 18.411 19.000 0.035 0.000 0.804 269 A HN 2.408 10.558 8.150 -0.000 0.000 0.453 270 A N -0.294 122.506 122.820 -0.034 0.000 2.014 270 A HA 0.284 4.606 4.320 0.003 0.000 0.218 270 A C 2.333 179.883 177.584 -0.058 0.000 1.163 270 A CA 1.562 53.575 52.037 -0.040 0.000 0.652 270 A CB -0.607 18.371 19.000 -0.036 0.000 0.808 270 A HN 0.870 9.020 8.150 -0.000 0.000 0.449 271 A N -0.308 122.472 122.820 -0.067 0.000 1.930 271 A HA 0.074 4.395 4.320 0.003 0.000 0.215 271 A C 1.905 179.434 177.584 -0.091 0.000 1.176 271 A CA 1.296 53.285 52.037 -0.079 0.000 0.632 271 A CB -0.319 18.628 19.000 -0.089 0.000 0.819 271 A HN 0.351 8.501 8.150 -0.000 0.000 0.445 272 I N 0.066 120.568 120.570 -0.113 0.000 2.439 272 I HA -0.099 4.072 4.170 0.003 0.000 0.251 272 I C 2.140 178.220 176.117 -0.060 0.000 1.139 272 I CA 1.589 62.812 61.300 -0.128 0.000 1.438 272 I CB -1.433 36.470 38.000 -0.162 0.000 1.085 272 I HN 0.208 8.418 8.210 -0.000 0.000 0.427 273 T N -0.036 114.492 114.554 -0.044 0.000 3.043 273 T HA -0.052 4.300 4.350 0.003 0.000 0.263 273 T C 1.844 176.518 174.700 -0.043 0.000 1.094 273 T CA 1.106 63.188 62.100 -0.030 0.000 1.127 273 T CB 0.027 68.881 68.868 -0.023 0.000 0.905 273 T HN 0.274 8.514 8.240 -0.000 0.000 0.490 274 T N 1.825 116.346 114.554 -0.054 0.000 2.737 274 T HA 0.035 4.387 4.350 0.003 0.000 0.265 274 T C 2.384 177.077 174.700 -0.012 0.000 1.038 274 T CA 1.146 63.203 62.100 -0.070 0.000 1.144 274 T CB -0.346 68.468 68.868 -0.090 0.000 0.866 274 T HN 0.402 8.642 8.240 -0.000 0.000 0.434 275 A N 1.700 124.550 122.820 0.050 0.000 1.897 275 A HA -0.006 4.315 4.320 0.003 0.000 0.215 275 A C 2.217 179.890 177.584 0.148 0.000 1.181 275 A CA 1.659 53.811 52.037 0.192 0.000 0.620 275 A CB -0.483 18.584 19.000 0.112 0.000 0.821 275 A HN 0.306 8.456 8.150 -0.000 0.000 0.443 276 R N 0.344 120.871 120.500 0.045 0.000 2.091 276 R HA -0.078 4.264 4.340 0.003 0.000 0.238 276 R C 1.982 178.283 176.300 0.002 0.000 1.136 276 R CA 2.093 58.203 56.100 0.016 0.000 0.959 276 R CB -0.445 29.851 30.300 -0.008 0.000 0.856 276 R HN 0.543 8.813 8.270 -0.000 0.000 0.437 277 R N -1.128 119.355 120.500 -0.028 0.000 2.237 277 R HA 0.115 4.457 4.340 0.003 0.000 0.195 277 R C 2.120 178.345 176.300 -0.125 0.000 0.956 277 R CA 0.654 56.717 56.100 -0.062 0.000 1.029 277 R CB -0.065 30.194 30.300 -0.069 0.000 0.972 277 R HN 0.059 8.329 8.270 -0.000 0.000 0.493 278 R N 0.841 121.229 120.500 -0.187 0.000 2.055 278 R HA 0.008 4.350 4.340 0.003 0.000 0.226 278 R C -0.153 175.750 176.300 -0.661 0.000 1.135 278 R CA 1.356 57.163 56.100 -0.488 0.000 0.959 278 R CB 0.033 29.952 30.300 -0.635 0.000 0.854 278 R HN -0.034 8.236 8.270 -0.000 0.000 0.431 279 F N 1.504 121.443 119.950 -0.018 0.000 2.453 279 F HA 0.426 4.954 4.527 0.003 0.000 0.358 279 F C -1.767 174.028 175.800 -0.009 0.000 1.129 279 F CA -2.234 55.764 58.000 -0.004 0.000 1.200 279 F CB 2.145 41.147 39.000 0.004 0.000 1.431 279 F HN 0.089 8.389 8.300 -0.000 0.000 0.503 280 P HA 0.082 4.502 4.420 -0.000 0.000 0.261 280 P C 0.279 177.613 177.300 0.057 0.000 1.268 280 P CA 0.523 63.654 63.100 0.051 0.000 0.833 280 P CB 0.575 32.282 31.700 0.011 0.000 1.231 281 D N -0.443 120.012 120.400 0.091 0.000 2.369 281 D HA 0.112 4.754 4.640 0.003 0.000 0.211 281 D C -0.004 176.353 176.300 0.096 0.000 1.077 281 D CA 0.367 54.417 54.000 0.082 0.000 0.842 281 D CB 0.087 40.938 40.800 0.086 0.000 0.947 281 D HN 0.202 8.572 8.370 -0.000 0.000 0.509 282 N N -0.547 118.223 118.700 0.116 0.000 2.272 282 N HA 0.268 5.010 4.740 0.003 0.000 0.305 282 N C -1.081 174.508 175.510 0.131 0.000 1.103 282 N CA -0.699 52.425 53.050 0.122 0.000 0.791 282 N CB 1.826 40.373 38.487 0.099 0.000 1.356 282 N HN -0.173 8.207 8.380 -0.000 0.000 0.486 283 F N 2.068 122.015 119.950 -0.005 0.000 2.571 283 F HA 0.144 4.672 4.527 0.003 0.000 0.384 283 F C -0.095 175.718 175.800 0.022 0.000 1.058 283 F CA -0.041 57.949 58.000 -0.017 0.000 1.200 283 F CB 0.287 39.264 39.000 -0.039 0.000 1.077 283 F HN 0.279 8.579 8.300 -0.000 0.000 0.558 284 L N 8.267 129.321 121.223 -0.282 0.000 2.288 284 L HA 0.195 4.537 4.340 0.003 0.000 0.283 284 L C -0.515 176.221 176.870 -0.222 0.000 1.072 284 L CA -0.383 54.362 54.840 -0.160 0.000 0.862 284 L CB -0.065 41.913 42.059 -0.135 0.000 1.245 284 L HN 0.657 8.887 8.230 -0.000 0.000 0.432 285 H N 4.470 123.494 119.070 -0.077 0.000 2.820 285 H HA 0.078 4.635 4.556 0.003 0.000 0.278 285 H C -1.146 174.243 175.328 0.102 0.000 1.142 285 H CA -0.737 55.371 56.048 0.100 0.000 1.346 285 H CB 0.549 30.517 29.762 0.343 0.000 1.438 285 H HN 0.527 8.807 8.280 -0.000 0.000 0.473 286 Y N 6.466 126.872 120.300 0.177 0.000 2.504 286 Y HA 0.065 4.617 4.550 0.003 0.000 0.351 286 Y C -0.292 175.652 175.900 0.073 0.000 0.988 286 Y CA -0.667 57.477 58.100 0.074 0.000 1.239 286 Y CB -0.381 38.090 38.460 0.019 0.000 1.128 286 Y HN 0.670 8.950 8.280 -0.000 0.000 0.525 287 H N 6.296 125.447 119.070 0.135 0.000 2.767 287 H HA 0.209 4.766 4.556 0.003 0.000 0.316 287 H C -0.245 175.191 175.328 0.180 0.000 1.059 287 H CA -0.557 55.419 56.048 -0.120 0.000 1.461 287 H CB 0.527 30.155 29.762 -0.223 0.000 1.475 287 H HN 0.705 8.985 8.280 -0.000 0.000 0.531 288 R N 3.578 124.364 120.500 0.478 0.000 3.171 288 R HA 0.451 4.793 4.340 0.003 0.000 0.241 288 R C 0.963 177.527 176.300 0.439 0.000 1.421 288 R CA -0.015 56.303 56.100 0.363 0.000 1.444 288 R CB -0.085 30.216 30.300 0.003 0.000 1.247 288 R HN 0.444 8.714 8.270 -0.000 0.000 0.636 289 A N 2.088 124.992 122.820 0.139 0.000 1.948 289 A HA 0.006 4.328 4.320 0.003 0.000 0.220 289 A C 1.403 178.943 177.584 -0.072 0.000 1.177 289 A CA 1.277 53.159 52.037 -0.260 0.000 0.636 289 A CB -0.292 18.589 19.000 -0.199 0.000 0.815 289 A HN 0.873 9.023 8.150 -0.000 0.000 0.449 290 G N -2.163 106.647 108.800 0.017 0.000 3.705 290 G HA2 0.333 4.295 3.960 0.003 0.000 0.237 290 G HA3 0.333 4.295 3.960 0.003 0.000 0.237 290 G C -0.036 174.663 174.900 -0.336 0.000 3.926 290 G CA 0.243 45.215 45.100 -0.213 0.000 0.492 290 G HN 0.629 8.919 8.290 -0.000 0.000 0.257 291 H N 0.751 119.559 119.070 -0.437 0.000 2.265 291 H HA 0.157 4.715 4.556 0.003 0.000 0.295 291 H C 2.464 177.582 175.328 -0.351 0.000 1.084 291 H CA 1.203 56.857 56.048 -0.657 0.000 1.261 291 H CB -0.006 29.564 29.762 -0.320 0.000 1.360 291 H HN 1.243 9.523 8.280 -0.000 0.000 0.487 292 G N 0.993 109.637 108.800 -0.259 0.000 2.629 292 G HA2 -0.486 3.476 3.960 0.003 0.000 0.313 292 G HA3 -0.486 3.476 3.960 0.003 0.000 0.313 292 G C 1.622 176.469 174.900 -0.088 0.000 1.217 292 G CA 1.531 46.532 45.100 -0.165 0.000 0.994 292 G HN 0.937 9.227 8.290 -0.000 0.000 0.549 293 A N -1.084 121.698 122.820 -0.063 0.000 2.009 293 A HA 0.075 4.397 4.320 0.003 0.000 0.222 293 A C 2.722 180.276 177.584 -0.050 0.000 1.175 293 A CA 3.593 55.607 52.037 -0.038 0.000 0.651 293 A CB -0.605 18.387 19.000 -0.014 0.000 0.815 293 A HN 1.437 9.587 8.150 -0.000 0.000 0.459 294 V N -1.062 118.802 119.914 -0.083 0.000 2.339 294 V HA -0.044 4.077 4.120 0.003 0.000 0.234 294 V C 1.259 177.252 176.094 -0.169 0.000 1.053 294 V CA 1.862 64.065 62.300 -0.162 0.000 1.042 294 V CB -0.366 31.307 31.823 -0.250 0.000 0.678 294 V HN 0.466 8.656 8.190 -0.000 0.000 0.475 295 T N 1.290 115.755 114.554 -0.149 0.000 3.176 295 T HA 0.403 4.755 4.350 0.003 0.000 0.301 295 T C -0.108 174.624 174.700 0.052 0.000 1.115 295 T CA 0.382 62.476 62.100 -0.010 0.000 1.027 295 T CB 0.341 69.253 68.868 0.073 0.000 1.063 295 T HN 0.318 8.558 8.240 -0.000 0.000 0.669 296 S N 1.878 117.586 115.700 0.013 0.000 2.911 296 S HA 0.503 4.975 4.470 0.003 0.000 0.319 296 S C -1.619 172.984 174.600 0.006 0.000 1.154 296 S CA -1.265 56.938 58.200 0.004 0.000 0.857 296 S CB 0.767 63.954 63.200 -0.022 0.000 1.279 296 S HN 0.228 8.538 8.310 -0.000 0.000 0.593 297 P HA -0.024 4.396 4.420 -0.000 0.000 0.225 297 P C -0.452 176.844 177.300 -0.006 0.000 1.141 297 P CA 1.179 64.276 63.100 -0.005 0.000 0.774 297 P CB -0.048 31.644 31.700 -0.013 0.000 0.760 298 Q N -2.076 117.719 119.800 -0.009 0.000 2.130 298 Q HA -0.080 4.261 4.340 0.003 0.000 0.271 298 Q C -0.453 175.519 176.000 -0.047 0.000 1.067 298 Q CA 0.195 55.991 55.803 -0.012 0.000 0.582 298 Q CB -2.125 26.615 28.738 0.003 0.000 0.957 298 Q HN 0.110 8.380 8.270 -0.000 0.000 0.360 299 S N 1.203 116.882 115.700 -0.035 0.000 2.507 299 S HA 0.081 4.553 4.470 0.003 0.000 0.299 299 S C 0.982 175.558 174.600 -0.040 0.000 1.214 299 S CA 0.119 58.297 58.200 -0.038 0.000 1.137 299 S CB 0.419 63.602 63.200 -0.028 0.000 1.009 299 S HN 0.354 8.664 8.310 -0.000 0.000 0.512 300 K N 3.690 124.028 120.400 -0.103 0.000 2.664 300 K HA 0.009 4.331 4.320 0.003 0.000 0.193 300 K C 0.373 177.013 176.600 0.067 0.000 1.028 300 K CA 0.489 56.676 56.287 -0.165 0.000 1.005 300 K CB -0.241 31.858 32.500 -0.667 0.000 0.815 300 K HN 0.473 8.723 8.250 -0.000 0.000 0.496 301 R N -0.395 120.146 120.500 0.067 0.000 2.534 301 R HA 0.361 4.703 4.340 0.003 0.000 0.301 301 R C 0.356 176.698 176.300 0.069 0.000 0.961 301 R CA 0.365 56.528 56.100 0.105 0.000 0.871 301 R CB 1.876 32.220 30.300 0.073 0.000 1.170 301 R HN 0.248 8.518 8.270 -0.000 0.000 0.446 302 G N 1.865 110.744 108.800 0.131 0.000 2.669 302 G HA2 -0.293 3.669 3.960 0.003 0.000 0.250 302 G HA3 -0.293 3.669 3.960 0.003 0.000 0.250 302 G C -1.244 173.798 174.900 0.238 0.000 1.247 302 G CA 0.205 45.365 45.100 0.099 0.000 0.958 302 G HN 0.638 8.928 8.290 -0.000 0.000 0.559 303 Y N -0.932 119.461 120.300 0.155 0.000 2.705 303 Y HA 0.844 5.395 4.550 0.003 0.000 0.332 303 Y C 0.499 176.452 175.900 0.088 0.000 1.157 303 Y CA -0.250 57.937 58.100 0.145 0.000 1.091 303 Y CB 0.732 39.298 38.460 0.177 0.000 1.301 303 Y HN 1.147 9.428 8.280 -0.000 0.000 0.488 304 T N -2.313 112.427 114.554 0.310 0.000 2.923 304 T HA 0.634 4.985 4.350 0.003 0.000 0.281 304 T C 0.972 175.862 174.700 0.316 0.000 0.995 304 T CA -0.326 61.882 62.100 0.180 0.000 0.985 304 T CB 1.475 70.365 68.868 0.038 0.000 1.114 304 T HN 1.106 9.346 8.240 -0.000 0.000 0.548 305 A N 0.238 123.180 122.820 0.204 0.000 2.015 305 A HA 0.104 4.425 4.320 0.003 0.000 0.219 305 A C 1.831 179.503 177.584 0.146 0.000 1.163 305 A CA 0.959 53.090 52.037 0.157 0.000 0.646 305 A CB -1.219 17.820 19.000 0.066 0.000 0.806 305 A HN 0.843 8.993 8.150 -0.000 0.000 0.448 306 F N 0.934 120.927 119.950 0.072 0.000 2.069 306 F HA -0.198 4.331 4.527 0.003 0.000 0.298 306 F C 2.214 178.068 175.800 0.089 0.000 1.113 306 F CA 2.320 60.353 58.000 0.054 0.000 1.214 306 F CB -0.359 38.680 39.000 0.065 0.000 0.978 306 F HN 0.039 8.339 8.300 -0.000 0.000 0.474 307 V N -0.115 119.962 119.914 0.271 0.000 2.427 307 V HA -0.294 3.828 4.120 0.003 0.000 0.248 307 V C 2.396 178.575 176.094 0.141 0.000 1.051 307 V CA 2.125 64.585 62.300 0.266 0.000 1.048 307 V CB -1.195 30.871 31.823 0.405 0.000 0.666 307 V HN 0.481 8.671 8.190 -0.000 0.000 0.456 308 H N 0.090 119.186 119.070 0.044 0.000 2.321 308 H HA -0.154 4.404 4.556 0.003 0.000 0.300 308 H C 2.257 177.491 175.328 -0.157 0.000 1.087 308 H CA 2.043 58.084 56.048 -0.011 0.000 1.319 308 H CB -0.631 29.244 29.762 0.188 0.000 1.379 308 H HN 0.413 8.693 8.280 -0.000 0.000 0.501 309 C N 0.783 119.973 119.300 -0.184 0.000 2.476 309 C HA -0.017 4.445 4.460 0.003 0.000 0.278 309 C C 2.805 177.612 174.990 -0.305 0.000 1.274 309 C CA 1.008 59.808 59.018 -0.362 0.000 1.713 309 C CB -0.608 26.914 27.740 -0.364 0.000 2.039 309 C HN 0.612 8.842 8.230 -0.000 0.000 0.484 310 K N 0.329 120.529 120.400 -0.333 0.000 2.152 310 K HA -0.160 4.162 4.320 0.003 0.000 0.206 310 K C 2.068 178.615 176.600 -0.090 0.000 1.048 310 K CA 1.487 57.599 56.287 -0.293 0.000 0.933 310 K CB -0.255 31.970 32.500 -0.458 0.000 0.721 310 K HN 0.452 8.702 8.250 -0.000 0.000 0.447 311 M N -0.106 119.489 119.600 -0.008 0.000 2.229 311 M HA -0.120 4.361 4.480 0.003 0.000 0.264 311 M C 2.102 178.347 176.300 -0.091 0.000 1.063 311 M CA 1.422 56.705 55.300 -0.028 0.000 1.114 311 M CB -0.053 32.501 32.600 -0.077 0.000 1.387 311 M HN 0.306 8.596 8.290 -0.000 0.000 0.420 312 A N -0.167 122.594 122.820 -0.097 0.000 1.969 312 A HA -0.166 4.156 4.320 0.003 0.000 0.218 312 A C 2.091 179.613 177.584 -0.104 0.000 1.169 312 A CA 1.411 53.405 52.037 -0.072 0.000 0.635 312 A CB -0.608 18.249 19.000 -0.238 0.000 0.810 312 A HN 0.455 8.605 8.150 -0.000 0.000 0.445 313 R N -0.368 120.024 120.500 -0.180 0.000 2.066 313 R HA -0.045 4.297 4.340 0.003 0.000 0.232 313 R C 1.926 178.133 176.300 -0.155 0.000 1.131 313 R CA 1.459 57.420 56.100 -0.231 0.000 0.955 313 R CB -0.395 29.654 30.300 -0.419 0.000 0.851 313 R HN 0.521 8.790 8.270 -0.000 0.000 0.432 314 L N 0.474 121.606 121.223 -0.151 0.000 2.127 314 L HA -0.216 4.125 4.340 0.003 0.000 0.211 314 L C 2.612 179.398 176.870 -0.140 0.000 1.089 314 L CA 1.469 56.131 54.840 -0.297 0.000 0.757 314 L CB -0.321 41.278 42.059 -0.768 0.000 0.899 314 L HN 0.335 8.565 8.230 -0.000 0.000 0.434 315 Q N -0.665 119.095 119.800 -0.067 0.000 2.083 315 Q HA -0.033 4.308 4.340 0.003 0.000 0.198 315 Q C 1.366 177.385 176.000 0.031 0.000 0.969 315 Q CA 1.116 56.947 55.803 0.047 0.000 0.838 315 Q CB 0.215 29.002 28.738 0.082 0.000 0.900 315 Q HN 0.627 8.897 8.270 -0.000 0.000 0.436 316 G N -0.434 108.358 108.800 -0.014 0.000 2.174 316 G HA2 -0.074 3.888 3.960 0.003 0.000 0.140 316 G HA3 -0.074 3.888 3.960 0.003 0.000 0.140 316 G C -0.135 174.721 174.900 -0.073 0.000 1.031 316 G CA -0.227 44.848 45.100 -0.042 0.000 0.728 316 G HN 0.443 8.733 8.290 -0.000 0.000 0.496 317 A N 0.305 123.091 122.820 -0.057 0.000 2.462 317 A HA 0.739 5.060 4.320 0.003 0.000 0.243 317 A C 1.471 178.904 177.584 -0.252 0.000 1.076 317 A CA 1.127 53.108 52.037 -0.094 0.000 0.773 317 A CB 0.626 19.644 19.000 0.030 0.000 1.010 317 A HN 0.788 8.938 8.150 -0.000 0.000 0.493 318 S N 0.711 116.142 115.700 -0.449 0.000 2.421 318 S HA 0.312 4.784 4.470 0.003 0.000 0.224 318 S C 0.933 175.116 174.600 -0.695 0.000 1.035 318 S CA 0.881 58.666 58.200 -0.692 0.000 0.953 318 S CB 0.126 62.597 63.200 -1.215 0.000 0.810 318 S HN 1.305 9.615 8.310 -0.000 0.000 0.497 319 G N 0.249 108.633 108.800 -0.693 0.000 2.733 319 G HA2 0.683 4.644 3.960 0.003 0.000 0.297 319 G HA3 0.683 4.644 3.960 0.003 0.000 0.297 319 G C -1.834 173.030 174.900 -0.060 0.000 1.422 319 G CA -0.437 44.526 45.100 -0.229 0.000 0.942 319 G HN 0.210 8.500 8.290 -0.000 0.000 0.510 320 I N 1.081 121.636 120.570 -0.025 0.000 2.610 320 I HA 0.307 4.479 4.170 0.003 0.000 0.289 320 I C -0.327 175.816 176.117 0.043 0.000 1.163 320 I CA -0.825 60.497 61.300 0.036 0.000 1.044 320 I CB 1.736 39.612 38.000 -0.207 0.000 1.251 320 I HN 0.645 8.855 8.210 -0.000 0.000 0.424 321 H N 5.815 124.892 119.070 0.011 0.000 3.223 321 H HA -0.074 4.483 4.556 0.003 0.000 0.287 321 H C 0.210 175.479 175.328 -0.098 0.000 0.910 321 H CA 0.887 56.930 56.048 -0.009 0.000 1.406 321 H CB 0.780 30.571 29.762 0.049 0.000 1.377 321 H HN 0.633 8.913 8.280 -0.000 0.000 0.556 322 T N 2.011 116.537 114.554 -0.047 0.000 3.075 322 T HA 0.279 4.630 4.350 0.003 0.000 0.251 322 T C 0.529 175.201 174.700 -0.046 0.000 0.979 322 T CA 0.500 62.549 62.100 -0.085 0.000 1.033 322 T CB 0.940 69.747 68.868 -0.101 0.000 1.104 322 T HN 0.915 9.155 8.240 -0.000 0.000 0.473 323 G N -0.200 108.580 108.800 -0.033 0.000 2.361 323 G HA2 0.422 4.384 3.960 0.003 0.000 0.299 323 G HA3 0.422 4.384 3.960 0.003 0.000 0.299 323 G C -0.156 174.730 174.900 -0.023 0.000 1.544 323 G CA 0.163 45.257 45.100 -0.010 0.000 0.860 323 G HN 0.015 8.305 8.290 -0.000 0.000 0.610 324 T N 0.295 114.840 114.554 -0.016 0.000 3.393 324 T HA 0.296 4.647 4.350 0.003 0.000 0.231 324 T C 1.620 176.316 174.700 -0.007 0.000 0.983 324 T CA 0.299 62.376 62.100 -0.039 0.000 1.272 324 T CB -0.336 68.500 68.868 -0.054 0.000 1.214 324 T HN 0.512 8.752 8.240 -0.000 0.000 0.368 335 S N 0.743 116.437 115.700 -0.010 0.000 2.708 335 S HA 0.122 4.594 4.470 0.003 0.000 0.274 335 S C -1.272 173.334 174.600 0.009 0.000 0.927 335 S CA -0.108 58.087 58.200 -0.009 0.000 1.002 335 S CB -0.341 62.836 63.200 -0.038 0.000 1.265 335 S HN 0.148 8.458 8.310 -0.000 0.000 0.457 336 D N 0.035 120.426 120.400 -0.014 0.000 2.328 336 D HA 0.065 4.706 4.640 0.003 0.000 0.226 336 D C 1.248 177.485 176.300 -0.105 0.000 1.066 336 D CA -0.263 53.723 54.000 -0.022 0.000 0.861 336 D CB 0.062 40.856 40.800 -0.009 0.000 0.912 336 D HN 0.550 8.920 8.370 -0.000 0.000 0.521 337 R N 0.758 121.153 120.500 -0.176 0.000 2.254 337 R HA 0.181 4.523 4.340 0.003 0.000 0.193 337 R C 1.774 177.703 176.300 -0.617 0.000 0.929 337 R CA 0.494 56.340 56.100 -0.423 0.000 1.038 337 R CB 0.191 30.271 30.300 -0.367 0.000 1.009 337 R HN 0.078 8.348 8.270 -0.000 0.000 0.512 338 A N 1.220 123.920 122.820 -0.199 0.000 1.930 338 A HA 0.031 4.353 4.320 0.003 0.000 0.215 338 A C 2.010 179.716 177.584 0.204 0.000 1.176 338 A CA 0.600 52.660 52.037 0.038 0.000 0.632 338 A CB -0.254 18.794 19.000 0.082 0.000 0.819 338 A HN 0.252 8.402 8.150 -0.000 0.000 0.445 339 I N -0.022 120.646 120.570 0.163 0.000 2.179 339 I HA -0.284 3.888 4.170 0.003 0.000 0.242 339 I C 3.004 179.063 176.117 -0.098 0.000 1.088 339 I CA 1.041 62.371 61.300 0.050 0.000 1.357 339 I CB -0.370 37.626 38.000 -0.006 0.000 1.051 339 I HN 0.351 8.561 8.210 -0.000 0.000 0.409 340 A N 0.464 123.183 122.820 -0.168 0.000 1.892 340 A HA -0.266 4.055 4.320 0.003 0.000 0.218 340 A C 2.226 179.757 177.584 -0.087 0.000 1.188 340 A CA 1.786 53.703 52.037 -0.199 0.000 0.631 340 A CB -1.240 17.563 19.000 -0.330 0.000 0.822 340 A HN 0.502 8.652 8.150 -0.000 0.000 0.447 341 Y N -2.107 118.193 120.300 0.000 0.000 2.220 341 Y HA -0.167 4.385 4.550 0.003 0.000 0.291 341 Y C 2.565 178.462 175.900 -0.004 0.000 1.129 341 Y CA 1.101 59.204 58.100 0.006 0.000 1.161 341 Y CB -0.246 38.240 38.460 0.044 0.000 0.997 341 Y HN 0.393 8.673 8.280 -0.000 0.000 0.522 342 M N 0.321 120.036 119.600 0.193 0.000 2.213 342 M HA -0.165 4.316 4.480 0.003 0.000 0.263 342 M C 1.590 177.815 176.300 -0.124 0.000 1.062 342 M CA 1.684 57.066 55.300 0.137 0.000 1.105 342 M CB -0.548 32.126 32.600 0.123 0.000 1.385 342 M HN 0.235 8.525 8.290 -0.000 0.000 0.417 343 L N -1.210 119.890 121.223 -0.205 0.000 2.209 343 L HA -0.062 4.280 4.340 0.003 0.000 0.207 343 L C 1.846 178.495 176.870 -0.368 0.000 1.094 343 L CA 1.625 56.252 54.840 -0.354 0.000 0.790 343 L CB -0.726 41.171 42.059 -0.270 0.000 0.932 343 L HN 0.449 8.679 8.230 -0.000 0.000 0.447 344 T N -4.193 110.238 114.554 -0.205 0.000 3.023 344 T HA 0.109 4.460 4.350 0.003 0.000 0.249 344 T C 0.961 175.584 174.700 -0.128 0.000 1.050 344 T CA -0.188 61.823 62.100 -0.149 0.000 1.088 344 T CB 0.199 69.049 68.868 -0.030 0.000 0.946 344 T HN 0.173 8.413 8.240 -0.000 0.000 0.480 345 Q N 0.859 120.608 119.800 -0.085 0.000 2.237 345 Q HA 0.386 4.728 4.340 0.003 0.000 0.219 345 Q C 0.276 176.243 176.000 -0.055 0.000 0.999 345 Q CA -0.361 55.423 55.803 -0.032 0.000 0.959 345 Q CB 0.848 29.606 28.738 0.033 0.000 1.173 345 Q HN 0.077 8.347 8.270 -0.000 0.000 0.527 346 D N -0.672 119.768 120.400 0.066 0.000 2.360 346 D HA 0.028 4.670 4.640 0.003 0.000 0.210 346 D C -0.757 175.750 176.300 0.345 0.000 1.047 346 D CA 0.336 54.452 54.000 0.193 0.000 0.854 346 D CB 0.643 41.516 40.800 0.122 0.000 0.936 346 D HN 0.321 8.691 8.370 -0.000 0.000 0.514 347 E N -0.241 120.113 120.200 0.256 0.000 2.294 347 E HA 0.646 4.998 4.350 0.003 0.000 0.272 347 E C -1.757 174.961 176.600 0.196 0.000 0.896 347 E CA -0.611 55.920 56.400 0.218 0.000 0.802 347 E CB 1.524 31.296 29.700 0.120 0.000 1.267 347 E HN 0.026 8.386 8.360 -0.000 0.000 0.406 348 A N 3.679 126.649 122.820 0.251 0.000 2.486 348 A HA 0.640 4.961 4.320 0.003 0.000 0.300 348 A C -1.331 176.385 177.584 0.221 0.000 1.048 348 A CA -0.782 51.398 52.037 0.239 0.000 0.696 348 A CB 1.770 20.961 19.000 0.318 0.000 1.278 348 A HN 0.453 8.603 8.150 -0.000 0.000 0.405 349 Q N 1.320 121.226 119.800 0.177 0.000 2.303 349 Q HA 0.563 4.904 4.340 0.003 0.000 0.257 349 Q C 0.338 176.419 176.000 0.135 0.000 0.941 349 Q CA 0.427 56.308 55.803 0.130 0.000 0.931 349 Q CB 1.227 30.002 28.738 0.062 0.000 1.215 349 Q HN 1.028 9.298 8.270 -0.000 0.000 0.437 350 G N 3.454 112.333 108.800 0.131 0.000 2.537 350 G HA2 0.338 4.299 3.960 0.003 0.000 0.297 350 G HA3 0.338 4.299 3.960 0.003 0.000 0.297 350 G C -1.741 173.017 174.900 -0.237 0.000 1.310 350 G CA -1.298 43.764 45.100 -0.064 0.000 1.027 350 G HN 0.655 8.945 8.290 -0.000 0.000 0.505 351 P HA -0.010 4.410 4.420 -0.000 0.000 0.216 351 P C 0.719 177.671 177.300 -0.580 0.000 1.150 351 P CA 1.321 64.138 63.100 -0.471 0.000 0.837 351 P CB 0.087 31.514 31.700 -0.455 0.000 0.786 352 F N -4.480 115.420 119.950 -0.082 0.000 2.699 352 F HA 0.252 4.780 4.527 0.002 0.000 0.295 352 F C 0.599 176.140 175.800 -0.431 0.000 1.052 352 F CA -0.098 57.747 58.000 -0.258 0.000 1.239 352 F CB 0.111 38.908 39.000 -0.340 0.000 1.018 352 F HN -0.279 8.021 8.300 -0.000 0.000 0.627 353 Y N 0.059 120.489 120.300 0.218 0.000 2.446 353 Y HA 0.556 5.108 4.550 0.003 0.000 0.345 353 Y C 0.085 176.048 175.900 0.105 0.000 0.984 353 Y CA -1.619 56.567 58.100 0.143 0.000 1.058 353 Y CB 1.141 39.722 38.460 0.201 0.000 1.220 353 Y HN -0.301 7.979 8.280 -0.000 0.000 0.455 354 R N 2.082 122.709 120.500 0.212 0.000 2.297 354 R HA 0.436 4.778 4.340 0.003 0.000 0.308 354 R C -1.113 175.297 176.300 0.183 0.000 1.029 354 R CA -0.599 55.590 56.100 0.150 0.000 0.929 354 R CB 0.876 31.219 30.300 0.070 0.000 1.046 354 R HN 0.754 9.024 8.270 -0.000 0.000 0.461 355 Q N 1.899 121.789 119.800 0.151 0.000 2.356 355 Q HA 0.394 4.735 4.340 0.003 0.000 0.270 355 Q C -1.512 174.452 176.000 -0.060 0.000 1.058 355 Q CA -0.521 55.290 55.803 0.013 0.000 0.802 355 Q CB 2.256 30.904 28.738 -0.150 0.000 1.303 355 Q HN 0.672 8.942 8.270 -0.000 0.000 0.444 356 S N 2.381 117.968 115.700 -0.189 0.000 2.578 356 S HA 0.531 5.003 4.470 0.003 0.000 0.301 356 S C -0.703 173.647 174.600 -0.417 0.000 1.091 356 S CA -0.614 57.522 58.200 -0.107 0.000 1.032 356 S CB 0.773 63.975 63.200 0.004 0.000 1.064 356 S HN 0.820 9.130 8.310 -0.000 0.000 0.508 357 W N 0.220 121.512 121.300 -0.012 0.000 2.518 357 W HA 0.414 5.075 4.660 0.003 0.000 0.352 357 W C 1.245 177.745 176.519 -0.031 0.000 0.952 357 W CA -0.570 56.748 57.345 -0.045 0.000 1.624 357 W CB -0.068 29.357 29.460 -0.059 0.000 1.135 357 W HN 1.034 9.214 8.180 -0.000 0.000 0.540 358 G N 1.512 110.398 108.800 0.144 0.000 2.332 358 G HA2 0.016 3.978 3.960 0.003 0.000 0.277 358 G HA3 0.016 3.978 3.960 0.003 0.000 0.277 358 G C 1.093 176.054 174.900 0.102 0.000 0.884 358 G CA 0.812 45.969 45.100 0.095 0.000 1.251 358 G HN 1.153 9.443 8.290 -0.000 0.000 0.462 359 G N -0.608 108.261 108.800 0.115 0.000 2.246 359 G HA2 -0.214 3.748 3.960 0.003 0.000 0.273 359 G HA3 -0.214 3.748 3.960 0.003 0.000 0.273 359 G C 0.347 175.290 174.900 0.071 0.000 1.055 359 G CA 0.793 45.940 45.100 0.078 0.000 0.851 359 G HN 1.450 9.740 8.290 -0.000 0.000 0.500 360 M N 0.313 119.980 119.600 0.111 0.000 2.084 360 M HA 0.473 4.955 4.480 0.003 0.000 0.351 360 M C 0.827 177.093 176.300 -0.058 0.000 1.240 360 M CA -0.691 54.650 55.300 0.067 0.000 1.083 360 M CB 0.398 33.114 32.600 0.195 0.000 1.593 360 M HN 0.166 8.456 8.290 -0.000 0.000 0.463 361 K N 2.956 123.314 120.400 -0.069 0.000 2.600 361 K HA 0.045 4.367 4.320 0.003 0.000 0.280 361 K C -0.334 176.137 176.600 -0.215 0.000 0.971 361 K CA 0.308 56.527 56.287 -0.113 0.000 1.053 361 K CB 0.406 32.850 32.500 -0.092 0.000 0.856 361 K HN 0.752 9.002 8.250 -0.000 0.000 0.495 362 A N 2.736 125.423 122.820 -0.221 0.000 2.287 362 A HA 0.254 4.575 4.320 0.003 0.000 0.273 362 A C -0.647 176.775 177.584 -0.270 0.000 1.091 362 A CA -0.601 51.257 52.037 -0.297 0.000 0.817 362 A CB 0.864 19.730 19.000 -0.224 0.000 1.069 362 A HN 0.840 8.990 8.150 -0.000 0.000 0.492 363 C N 1.384 120.503 119.300 -0.302 0.000 2.298 363 C HA 0.633 5.095 4.460 0.003 0.000 0.323 363 C C 0.458 175.316 174.990 -0.220 0.000 1.284 363 C CA -0.347 58.510 59.018 -0.269 0.000 1.577 363 C CB -0.680 26.884 27.740 -0.293 0.000 2.249 363 C HN 0.828 9.058 8.230 -0.000 0.000 0.497 364 T N 9.110 123.555 114.554 -0.181 0.000 2.834 364 T HA 0.255 4.607 4.350 0.003 0.000 0.298 364 T C -2.473 172.152 174.700 -0.125 0.000 0.966 364 T CA -0.217 61.801 62.100 -0.137 0.000 1.141 364 T CB 0.588 69.397 68.868 -0.099 0.000 0.905 364 T HN 0.604 8.844 8.240 -0.000 0.000 0.535 365 P HA 0.323 4.743 4.420 -0.000 0.000 0.271 365 P C -0.558 176.662 177.300 -0.133 0.000 1.216 365 P CA -0.303 62.728 63.100 -0.115 0.000 0.776 365 P CB 0.435 32.085 31.700 -0.082 0.000 0.881 366 I N 4.042 124.520 120.570 -0.154 0.000 2.405 366 I HA 0.223 4.395 4.170 0.003 0.000 0.280 366 I C -0.170 175.798 176.117 -0.249 0.000 1.027 366 I CA -0.742 60.414 61.300 -0.240 0.000 1.161 366 I CB 0.676 38.503 38.000 -0.287 0.000 1.300 366 I HN 0.145 8.355 8.210 -0.000 0.000 0.463 367 I N 4.731 125.162 120.570 -0.233 0.000 2.519 367 I HA 0.203 4.375 4.170 0.003 0.000 0.287 367 I C 0.597 176.550 176.117 -0.273 0.000 1.047 367 I CA 0.444 61.603 61.300 -0.235 0.000 1.381 367 I CB 1.502 39.322 38.000 -0.300 0.000 1.417 367 I HN 0.376 8.586 8.210 -0.000 0.000 0.540 368 S N 2.822 118.385 115.700 -0.229 0.000 2.503 368 S HA 0.906 5.377 4.470 0.003 0.000 0.301 368 S C 0.170 174.652 174.600 -0.198 0.000 1.087 368 S CA 0.341 58.421 58.200 -0.199 0.000 1.042 368 S CB 1.245 64.373 63.200 -0.121 0.000 1.043 368 S HN 0.985 9.295 8.310 -0.000 0.000 0.489 369 G N 1.782 110.457 108.800 -0.208 0.000 2.198 369 G HA2 0.421 4.383 3.960 0.003 0.000 0.057 369 G HA3 0.421 4.383 3.960 0.003 0.000 0.057 369 G C 0.055 174.802 174.900 -0.256 0.000 0.803 369 G CA 0.201 45.172 45.100 -0.214 0.000 1.140 369 G HN 1.860 10.150 8.290 -0.000 0.000 0.405 370 G N -1.043 107.580 108.800 -0.295 0.000 2.492 370 G HA2 0.389 4.350 3.960 0.003 0.000 0.283 370 G HA3 0.389 4.350 3.960 0.003 0.000 0.283 370 G C 0.302 175.029 174.900 -0.289 0.000 1.274 370 G CA 0.589 45.495 45.100 -0.324 0.000 1.215 370 G HN 0.699 8.989 8.290 -0.000 0.000 0.598 371 M N 1.338 120.755 119.600 -0.306 0.000 2.115 371 M HA 0.229 4.711 4.480 0.003 0.000 0.261 371 M C 1.248 177.355 176.300 -0.323 0.000 1.079 371 M CA 2.114 57.238 55.300 -0.293 0.000 1.143 371 M CB -0.204 32.206 32.600 -0.316 0.000 1.332 371 M HN 1.406 9.696 8.290 -0.000 0.000 0.421 372 N N -2.461 116.071 118.700 -0.280 0.000 6.153 372 N HA -0.083 4.658 4.740 0.003 0.000 0.412 372 N C -0.144 175.274 175.510 -0.153 0.000 1.410 372 N CA 0.386 53.288 53.050 -0.246 0.000 2.011 372 N CB -1.007 37.089 38.487 -0.650 0.000 0.693 372 N HN 0.102 8.482 8.380 -0.000 0.000 0.460 373 A N 0.063 122.849 122.820 -0.057 0.000 1.930 373 A HA 0.100 4.422 4.320 0.003 0.000 0.217 373 A C 2.066 179.600 177.584 -0.083 0.000 1.175 373 A CA 1.889 53.903 52.037 -0.039 0.000 0.627 373 A CB -0.675 18.324 19.000 -0.002 0.000 0.815 373 A HN 0.595 8.745 8.150 -0.000 0.000 0.443 374 L N -1.484 119.639 121.223 -0.167 0.000 2.240 374 L HA -0.019 4.323 4.340 0.003 0.000 0.211 374 L C 2.541 179.480 176.870 0.114 0.000 1.106 374 L CA 0.715 55.505 54.840 -0.084 0.000 0.793 374 L CB -0.379 41.515 42.059 -0.275 0.000 0.927 374 L HN 0.260 8.490 8.230 -0.000 0.000 0.446 375 R N -0.708 119.754 120.500 -0.064 0.000 2.223 375 R HA 0.085 4.427 4.340 0.003 0.000 0.198 375 R C 2.018 178.232 176.300 -0.144 0.000 0.984 375 R CA 0.355 56.400 56.100 -0.093 0.000 1.018 375 R CB -0.152 30.054 30.300 -0.157 0.000 0.945 375 R HN 0.215 8.485 8.270 -0.000 0.000 0.479 376 M N 2.441 121.926 119.600 -0.191 0.000 2.163 376 M HA -0.129 4.352 4.480 0.003 0.000 0.258 376 M C -1.079 174.938 176.300 -0.471 0.000 1.071 376 M CA 2.175 57.245 55.300 -0.383 0.000 1.093 376 M CB -1.037 31.402 32.600 -0.268 0.000 1.285 376 M HN -0.134 8.156 8.290 -0.000 0.000 0.420 377 P HA -0.134 4.286 4.420 -0.000 0.000 0.217 377 P C 1.390 178.641 177.300 -0.081 0.000 1.151 377 P CA 2.179 65.268 63.100 -0.018 0.000 0.849 377 P CB -0.662 31.172 31.700 0.224 0.000 0.787 378 G N -1.149 107.603 108.800 -0.080 0.000 2.459 378 G HA2 -0.299 3.663 3.960 0.003 0.000 0.217 378 G HA3 -0.299 3.663 3.960 0.003 0.000 0.217 378 G C 1.408 176.243 174.900 -0.110 0.000 1.183 378 G CA 0.506 45.566 45.100 -0.067 0.000 0.776 378 G HN 0.199 8.489 8.290 -0.000 0.000 0.552 379 F N 0.963 120.722 119.950 -0.318 0.000 2.065 379 F HA -0.086 4.442 4.527 0.003 0.000 0.298 379 F C 2.384 178.035 175.800 -0.249 0.000 1.112 379 F CA 1.573 59.374 58.000 -0.332 0.000 1.212 379 F CB -0.309 38.387 39.000 -0.506 0.000 0.975 379 F HN 0.107 8.407 8.300 -0.000 0.000 0.476 380 F N 0.740 120.562 119.950 -0.212 0.000 2.161 380 F HA -0.157 4.372 4.527 0.003 0.000 0.300 380 F C 2.477 178.029 175.800 -0.413 0.000 1.089 380 F CA 1.507 59.168 58.000 -0.564 0.000 1.282 380 F CB -1.474 36.694 39.000 -1.388 0.000 1.010 380 F HN 0.054 8.354 8.300 -0.000 0.000 0.485 381 E N 0.470 120.649 120.200 -0.035 0.000 2.072 381 E HA -0.208 4.144 4.350 0.003 0.000 0.191 381 E C 1.953 178.581 176.600 0.047 0.000 0.985 381 E CA 1.412 57.905 56.400 0.155 0.000 0.801 381 E CB -0.514 29.285 29.700 0.165 0.000 0.750 381 E HN 0.512 8.872 8.360 -0.000 0.000 0.452 382 N N -1.084 117.566 118.700 -0.084 0.000 2.300 382 N HA -0.123 4.618 4.740 0.003 0.000 0.179 382 N C 1.740 177.192 175.510 -0.097 0.000 1.016 382 N CA 0.721 53.712 53.050 -0.099 0.000 0.876 382 N CB -0.039 38.346 38.487 -0.171 0.000 0.979 382 N HN 0.140 8.520 8.380 -0.000 0.000 0.432 383 L N -0.490 120.600 121.223 -0.221 0.000 2.049 383 L HA 0.286 4.627 4.340 0.003 0.000 0.203 383 L C 1.388 178.318 176.870 0.100 0.000 1.074 383 L CA 2.075 56.835 54.840 -0.133 0.000 0.749 383 L CB -0.395 41.453 42.059 -0.351 0.000 0.907 383 L HN 0.373 8.603 8.230 -0.000 0.000 0.439 384 G N -0.640 108.219 108.800 0.098 0.000 2.192 384 G HA2 -0.199 3.763 3.960 0.003 0.000 0.193 384 G HA3 -0.199 3.763 3.960 0.003 0.000 0.193 384 G C 0.007 175.060 174.900 0.256 0.000 0.999 384 G CA 0.140 45.360 45.100 0.199 0.000 0.659 384 G HN 0.766 9.056 8.290 -0.000 0.000 0.503 385 N N -1.775 117.023 118.700 0.163 0.000 3.308 385 N HA 0.617 5.359 4.740 0.003 0.000 0.276 385 N C -0.024 175.383 175.510 -0.172 0.000 1.533 385 N CA -0.250 52.883 53.050 0.138 0.000 0.878 385 N CB 1.045 39.628 38.487 0.160 0.000 1.566 385 N HN 0.959 9.339 8.380 -0.000 0.000 0.546 386 A N -0.307 122.358 122.820 -0.258 0.000 2.592 386 A HA 0.273 4.594 4.320 0.003 0.000 0.290 386 A C -0.477 176.959 177.584 -0.248 0.000 0.998 386 A CA -0.477 51.163 52.037 -0.661 0.000 0.983 386 A CB -0.482 17.657 19.000 -1.437 0.000 1.240 386 A HN 0.541 8.691 8.150 -0.000 0.000 0.535 387 N N 1.464 120.170 118.700 0.010 0.000 2.878 387 N HA 0.178 4.920 4.740 0.003 0.000 0.282 387 N C 0.153 175.694 175.510 0.053 0.000 1.284 387 N CA 0.686 53.846 53.050 0.182 0.000 1.053 387 N CB 0.492 39.154 38.487 0.291 0.000 1.382 387 N HN 0.584 8.964 8.380 -0.000 0.000 0.529 388 V N -2.719 117.189 119.914 -0.011 0.000 3.158 388 V HA 0.658 4.780 4.120 0.003 0.000 0.315 388 V C 0.032 176.024 176.094 -0.171 0.000 1.148 388 V CA -1.070 61.188 62.300 -0.069 0.000 1.042 388 V CB 2.107 33.945 31.823 0.025 0.000 1.101 388 V HN -0.078 8.112 8.190 -0.000 0.000 0.448 389 I N 1.903 122.326 120.570 -0.245 0.000 2.378 389 I HA 0.475 4.647 4.170 0.003 0.000 0.291 389 I C -0.999 174.961 176.117 -0.261 0.000 0.992 389 I CA -0.517 60.577 61.300 -0.342 0.000 1.154 389 I CB 1.743 39.397 38.000 -0.578 0.000 1.315 389 I HN 0.540 8.750 8.210 -0.000 0.000 0.448 390 L N 6.968 128.081 121.223 -0.183 0.000 2.294 390 L HA 0.412 4.754 4.340 0.003 0.000 0.283 390 L C 0.326 177.157 176.870 -0.065 0.000 1.015 390 L CA 0.018 54.764 54.840 -0.158 0.000 0.831 390 L CB 1.316 43.291 42.059 -0.140 0.000 1.217 390 L HN 0.641 8.871 8.230 -0.000 0.000 0.420 391 T N 2.778 117.258 114.554 -0.123 0.000 3.316 391 T HA 0.711 5.063 4.350 0.003 0.000 0.341 391 T C 0.333 174.954 174.700 -0.132 0.000 1.397 391 T CA -0.392 61.672 62.100 -0.060 0.000 1.085 391 T CB 0.411 69.221 68.868 -0.096 0.000 1.160 391 T HN 0.684 8.924 8.240 -0.000 0.000 0.694 392 A N 2.492 125.214 122.820 -0.163 0.000 2.371 392 A HA 0.748 5.070 4.320 0.003 0.000 0.257 392 A C 1.072 178.378 177.584 -0.463 0.000 1.089 392 A CA -0.350 51.419 52.037 -0.448 0.000 0.794 392 A CB -0.073 18.378 19.000 -0.916 0.000 1.029 392 A HN 0.927 9.077 8.150 -0.000 0.000 0.488 393 G N 0.055 108.612 108.800 -0.406 0.000 2.683 393 G HA2 0.382 4.344 3.960 0.003 0.000 0.260 393 G HA3 0.382 4.344 3.960 0.003 0.000 0.260 393 G C 0.924 175.670 174.900 -0.256 0.000 1.238 393 G CA 0.039 44.995 45.100 -0.239 0.000 0.934 393 G HN 1.325 9.615 8.290 -0.000 0.000 0.534 394 G N -1.350 107.437 108.800 -0.022 0.000 3.181 394 G HA2 0.323 4.285 3.960 0.003 0.000 0.219 394 G HA3 0.323 4.285 3.960 0.003 0.000 0.219 394 G C 1.136 176.113 174.900 0.130 0.000 1.182 394 G CA 0.964 46.169 45.100 0.175 0.000 0.791 394 G HN 0.861 9.151 8.290 -0.000 0.000 0.537 395 G N 0.589 109.382 108.800 -0.013 0.000 2.559 395 G HA2 0.230 4.192 3.960 0.003 0.000 0.209 395 G HA3 0.230 4.192 3.960 0.003 0.000 0.209 395 G C 1.822 176.724 174.900 0.004 0.000 1.151 395 G CA 0.990 46.096 45.100 0.010 0.000 0.824 395 G HN 0.401 8.691 8.290 -0.000 0.000 0.543 396 A N 0.035 122.714 122.820 -0.234 0.000 2.121 396 A HA 0.284 4.606 4.320 0.003 0.000 0.218 396 A C 1.941 179.538 177.584 0.022 0.000 1.154 396 A CA 0.628 52.499 52.037 -0.276 0.000 0.679 396 A CB -0.504 18.128 19.000 -0.614 0.000 0.795 396 A HN 0.420 8.570 8.150 -0.000 0.000 0.458 397 F N 0.043 120.073 119.950 0.132 0.000 2.619 397 F HA 0.164 4.693 4.527 0.003 0.000 0.293 397 F C 1.862 177.748 175.800 0.143 0.000 1.119 397 F CA -0.331 57.745 58.000 0.127 0.000 1.445 397 F CB -0.031 39.056 39.000 0.145 0.000 1.119 397 F HN 0.303 8.603 8.300 -0.000 0.000 0.573 398 G N 0.636 109.639 108.800 0.339 0.000 2.287 398 G HA2 0.040 4.001 3.960 0.003 0.000 0.235 398 G HA3 0.040 4.001 3.960 0.003 0.000 0.235 398 G C -0.910 174.098 174.900 0.181 0.000 1.258 398 G CA 0.360 45.594 45.100 0.224 0.000 0.884 398 G HN 0.432 8.722 8.290 -0.000 0.000 0.518 399 H N 0.893 119.914 119.070 -0.080 0.000 3.003 399 H HA 0.086 4.644 4.556 0.003 0.000 0.327 399 H C 1.285 176.531 175.328 -0.137 0.000 1.353 399 H CA -0.476 55.471 56.048 -0.169 0.000 1.142 399 H CB 1.696 31.426 29.762 -0.052 0.000 1.864 399 H HN 0.370 8.650 8.280 -0.000 0.000 0.529 400 I N -1.597 118.740 120.570 -0.388 0.000 2.617 400 I HA -0.039 4.133 4.170 0.003 0.000 0.256 400 I C 0.448 176.517 176.117 -0.081 0.000 1.167 400 I CA 0.909 62.085 61.300 -0.207 0.000 1.469 400 I CB -0.103 37.764 38.000 -0.222 0.000 1.098 400 I HN 0.257 8.467 8.210 -0.000 0.000 0.436 401 D N 1.405 121.794 120.400 -0.019 0.000 2.346 401 D HA 0.305 4.947 4.640 0.003 0.000 0.206 401 D C 1.258 177.618 176.300 0.100 0.000 1.001 401 D CA 1.133 55.179 54.000 0.077 0.000 0.871 401 D CB 0.785 41.663 40.800 0.130 0.000 0.943 401 D HN 0.559 8.929 8.370 -0.000 0.000 0.518 402 G N 0.741 109.619 108.800 0.130 0.000 2.343 402 G HA2 -0.112 3.850 3.960 0.003 0.000 0.562 402 G HA3 -0.112 3.850 3.960 0.003 0.000 0.562 402 G C -2.528 172.420 174.900 0.080 0.000 1.269 402 G CA -0.651 44.504 45.100 0.091 0.000 1.011 402 G HN -0.159 8.131 8.290 -0.000 0.000 0.498 403 P HA 0.225 4.645 4.420 -0.000 0.000 0.240 403 P C 1.655 178.811 177.300 -0.239 0.000 1.190 403 P CA 0.639 63.723 63.100 -0.026 0.000 0.781 403 P CB 0.467 32.202 31.700 0.059 0.000 0.931 404 V N 0.091 119.899 119.914 -0.177 0.000 2.446 404 V HA -0.045 4.076 4.120 0.003 0.000 0.244 404 V C 2.318 178.286 176.094 -0.210 0.000 1.039 404 V CA 2.121 64.281 62.300 -0.234 0.000 1.045 404 V CB -1.275 30.459 31.823 -0.149 0.000 0.681 404 V HN 0.078 8.268 8.190 -0.000 0.000 0.459 405 A N 0.034 122.766 122.820 -0.147 0.000 2.081 405 A HA 0.194 4.516 4.320 0.003 0.000 0.214 405 A C 2.246 179.544 177.584 -0.477 0.000 1.158 405 A CA 1.206 53.121 52.037 -0.203 0.000 0.724 405 A CB -0.699 18.279 19.000 -0.037 0.000 0.826 405 A HN 0.474 8.624 8.150 -0.000 0.000 0.463 406 G N 0.167 108.763 108.800 -0.340 0.000 2.484 406 G HA2 -0.017 3.945 3.960 0.003 0.000 0.215 406 G HA3 -0.017 3.945 3.960 0.003 0.000 0.215 406 G C 1.763 176.604 174.900 -0.099 0.000 1.219 406 G CA 1.358 46.340 45.100 -0.197 0.000 0.791 406 G HN 0.775 9.065 8.290 -0.000 0.000 0.550 407 A N 0.185 122.880 122.820 -0.208 0.000 2.032 407 A HA -0.061 4.260 4.320 0.003 0.000 0.221 407 A C 2.407 179.914 177.584 -0.129 0.000 1.165 407 A CA 1.935 53.801 52.037 -0.285 0.000 0.645 407 A CB -0.349 18.172 19.000 -0.798 0.000 0.807 407 A HN 0.376 8.525 8.150 -0.000 0.000 0.453 408 R N -0.354 120.062 120.500 -0.140 0.000 2.127 408 R HA -0.048 4.294 4.340 0.003 0.000 0.217 408 R C 2.586 178.891 176.300 0.008 0.000 1.074 408 R CA 1.220 57.286 56.100 -0.056 0.000 0.991 408 R CB -0.143 30.117 30.300 -0.068 0.000 0.895 408 R HN 0.708 8.978 8.270 -0.000 0.000 0.450 409 S N 0.264 115.940 115.700 -0.041 0.000 2.402 409 S HA -0.068 4.404 4.470 0.003 0.000 0.229 409 S C 1.939 176.593 174.600 0.090 0.000 1.021 409 S CA 0.696 58.911 58.200 0.025 0.000 0.974 409 S CB -0.260 62.914 63.200 -0.044 0.000 0.800 409 S HN 0.209 8.519 8.310 -0.000 0.000 0.484 410 L N 0.975 122.263 121.223 0.108 0.000 2.005 410 L HA -0.035 4.306 4.340 0.003 0.000 0.207 410 L C 3.169 180.170 176.870 0.218 0.000 1.072 410 L CA 1.825 56.759 54.840 0.158 0.000 0.744 410 L CB -0.519 41.663 42.059 0.205 0.000 0.895 410 L HN 0.364 8.594 8.230 -0.000 0.000 0.433 411 R N 0.122 120.741 120.500 0.198 0.000 2.080 411 R HA -0.223 4.119 4.340 0.003 0.000 0.236 411 R C 2.324 178.785 176.300 0.268 0.000 1.137 411 R CA 1.828 58.092 56.100 0.272 0.000 0.943 411 R CB -0.217 30.204 30.300 0.202 0.000 0.846 411 R HN 0.358 8.628 8.270 -0.000 0.000 0.431 412 Q N -0.478 119.419 119.800 0.161 0.000 2.152 412 Q HA -0.193 4.148 4.340 0.003 0.000 0.206 412 Q C 2.073 178.084 176.000 0.018 0.000 0.985 412 Q CA 1.912 57.779 55.803 0.107 0.000 0.863 412 Q CB -0.172 28.673 28.738 0.179 0.000 0.904 412 Q HN 0.516 8.786 8.270 -0.000 0.000 0.422 413 A N -0.192 122.698 122.820 0.116 0.000 2.015 413 A HA -0.171 4.150 4.320 0.003 0.000 0.219 413 A C 1.630 179.380 177.584 0.277 0.000 1.163 413 A CA 1.049 53.174 52.037 0.145 0.000 0.646 413 A CB -0.720 18.371 19.000 0.151 0.000 0.806 413 A HN 0.678 8.828 8.150 -0.000 0.000 0.448 414 W N 0.649 122.070 121.300 0.202 0.000 2.413 414 W HA -0.134 4.528 4.660 0.003 0.000 0.315 414 W C 2.135 178.731 176.519 0.128 0.000 1.186 414 W CA 1.863 59.373 57.345 0.276 0.000 1.326 414 W CB -0.636 28.924 29.460 0.167 0.000 1.153 414 W HN 0.394 8.574 8.180 -0.000 0.000 0.489 415 Q N 0.593 120.079 119.800 -0.524 0.000 2.096 415 Q HA -0.259 4.082 4.340 0.003 0.000 0.208 415 Q C 2.446 178.041 176.000 -0.675 0.000 0.993 415 Q CA 2.587 57.917 55.803 -0.788 0.000 0.862 415 Q CB -0.939 27.484 28.738 -0.525 0.000 0.915 415 Q HN 0.426 8.696 8.270 -0.000 0.000 0.416 416 A N 0.125 122.460 122.820 -0.809 0.000 1.902 416 A HA -0.201 4.120 4.320 0.003 0.000 0.217 416 A C 1.753 179.188 177.584 -0.247 0.000 1.181 416 A CA 1.268 52.897 52.037 -0.679 0.000 0.623 416 A CB -1.070 17.481 19.000 -0.748 0.000 0.818 416 A HN 0.663 8.813 8.150 -0.000 0.000 0.443 417 W N 0.816 121.985 121.300 -0.219 0.000 2.335 417 W HA -0.230 4.431 4.660 0.003 0.000 0.311 417 W C 2.440 178.878 176.519 -0.135 0.000 1.213 417 W CA 2.341 59.650 57.345 -0.061 0.000 1.274 417 W CB -0.236 29.328 29.460 0.174 0.000 1.148 417 W HN 0.329 8.509 8.180 -0.000 0.000 0.498 418 R N 0.217 120.472 120.500 -0.409 0.000 2.070 418 R HA -0.190 4.152 4.340 0.003 0.000 0.232 418 R C 1.843 177.816 176.300 -0.545 0.000 1.138 418 R CA 2.344 58.087 56.100 -0.594 0.000 0.936 418 R CB -0.883 28.991 30.300 -0.711 0.000 0.839 418 R HN 0.045 8.315 8.270 -0.000 0.000 0.429 419 D N -1.461 118.674 120.400 -0.441 0.000 2.219 419 D HA 0.010 4.652 4.640 0.003 0.000 0.205 419 D C 1.159 177.303 176.300 -0.262 0.000 0.970 419 D CA 1.614 55.433 54.000 -0.302 0.000 0.851 419 D CB 0.200 40.864 40.800 -0.226 0.000 0.943 419 D HN 0.652 9.022 8.370 -0.000 0.000 0.488 420 G N -0.527 108.098 108.800 -0.291 0.000 2.195 420 G HA2 -0.267 3.694 3.960 0.003 0.000 0.224 420 G HA3 -0.267 3.694 3.960 0.003 0.000 0.224 420 G C 0.385 175.221 174.900 -0.106 0.000 0.990 420 G CA 0.199 45.165 45.100 -0.223 0.000 0.639 420 G HN 0.273 8.563 8.290 -0.000 0.000 0.514 421 V N 2.201 122.072 119.914 -0.071 0.000 2.694 421 V HA 0.327 4.449 4.120 0.003 0.000 0.306 421 V C -1.166 174.969 176.094 0.068 0.000 1.054 421 V CA -0.551 61.771 62.300 0.036 0.000 1.161 421 V CB 0.566 32.474 31.823 0.142 0.000 0.916 421 V HN 0.228 8.418 8.190 -0.000 0.000 0.490 422 P HA 0.143 4.563 4.420 -0.000 0.000 0.271 422 P C 0.861 178.297 177.300 0.226 0.000 1.216 422 P CA -0.156 63.034 63.100 0.150 0.000 0.776 422 P CB 0.692 32.468 31.700 0.126 0.000 0.881 423 V N 2.580 122.675 119.914 0.303 0.000 2.358 423 V HA -0.189 3.933 4.120 0.003 0.000 0.246 423 V C 2.108 178.431 176.094 0.382 0.000 1.047 423 V CA 1.560 64.082 62.300 0.371 0.000 1.035 423 V CB -0.900 31.218 31.823 0.490 0.000 0.658 423 V HN 0.517 8.707 8.190 -0.000 0.000 0.452 424 L N 0.408 121.821 121.223 0.316 0.000 2.131 424 L HA -0.145 4.197 4.340 0.003 0.000 0.210 424 L C 2.082 179.016 176.870 0.108 0.000 1.092 424 L CA 1.874 56.785 54.840 0.118 0.000 0.759 424 L CB -0.988 41.138 42.059 0.111 0.000 0.903 424 L HN 0.408 8.638 8.230 -0.000 0.000 0.435 425 D N -2.232 118.265 120.400 0.161 0.000 2.162 425 D HA -0.224 4.417 4.640 0.003 0.000 0.203 425 D C 2.013 178.405 176.300 0.154 0.000 0.967 425 D CA 1.013 55.087 54.000 0.123 0.000 0.840 425 D CB -0.297 40.565 40.800 0.103 0.000 0.972 425 D HN 0.360 8.730 8.370 -0.000 0.000 0.482 426 Y N 1.995 122.368 120.300 0.122 0.000 2.242 426 Y HA -0.098 4.453 4.550 0.003 0.000 0.291 426 Y C 2.383 178.432 175.900 0.248 0.000 1.137 426 Y CA 1.299 59.506 58.100 0.179 0.000 1.181 426 Y CB -0.192 38.354 38.460 0.145 0.000 0.989 426 Y HN -0.054 8.226 8.280 -0.000 0.000 0.527 427 A N 0.371 123.413 122.820 0.370 0.000 1.902 427 A HA -0.207 4.115 4.320 0.003 0.000 0.217 427 A C 2.242 179.911 177.584 0.141 0.000 1.181 427 A CA 1.817 54.045 52.037 0.319 0.000 0.623 427 A CB -0.600 18.570 19.000 0.284 0.000 0.818 427 A HN 0.497 8.647 8.150 -0.000 0.000 0.443 428 R N -0.034 120.503 120.500 0.062 0.000 2.096 428 R HA -0.141 4.201 4.340 0.003 0.000 0.240 428 R C 1.825 178.093 176.300 -0.055 0.000 1.139 428 R CA 1.800 57.900 56.100 -0.001 0.000 0.952 428 R CB -0.280 30.014 30.300 -0.010 0.000 0.854 428 R HN 0.646 8.916 8.270 -0.000 0.000 0.436 429 E N -0.653 119.473 120.200 -0.124 0.000 2.478 429 E HA -0.024 4.327 4.350 0.003 0.000 0.194 429 E C -0.270 175.975 176.600 -0.591 0.000 1.045 429 E CA 0.382 56.609 56.400 -0.289 0.000 0.868 429 E CB 0.325 29.834 29.700 -0.319 0.000 0.885 429 E HN 0.463 8.823 8.360 -0.000 0.000 0.505 430 H N 0.519 119.512 119.070 -0.128 0.000 2.786 430 H HA 0.146 4.704 4.556 0.003 0.000 0.284 430 H C 0.357 175.723 175.328 0.063 0.000 1.104 430 H CA -0.444 55.574 56.048 -0.050 0.000 1.339 430 H CB 0.935 30.692 29.762 -0.008 0.000 1.427 430 H HN -0.089 8.191 8.280 -0.000 0.000 0.497 431 K N 1.544 121.989 120.400 0.075 0.000 1.976 431 K HA -0.313 4.009 4.320 0.003 0.000 0.233 431 K C 1.710 178.418 176.600 0.180 0.000 1.032 431 K CA 2.137 58.484 56.287 0.101 0.000 1.032 431 K CB -0.027 32.512 32.500 0.064 0.000 0.733 431 K HN 0.534 8.784 8.250 -0.000 0.000 0.448 432 E N 1.171 121.485 120.200 0.189 0.000 2.160 432 E HA -0.202 4.149 4.350 0.003 0.000 0.195 432 E C 2.038 178.781 176.600 0.239 0.000 0.991 432 E CA 1.200 57.722 56.400 0.202 0.000 0.810 432 E CB -0.649 29.077 29.700 0.044 0.000 0.742 432 E HN 0.360 8.720 8.360 -0.000 0.000 0.466 433 L N 0.673 122.048 121.223 0.253 0.000 2.109 433 L HA 0.139 4.481 4.340 0.003 0.000 0.207 433 L C 2.261 179.346 176.870 0.358 0.000 1.086 433 L CA 1.796 56.799 54.840 0.273 0.000 0.760 433 L CB -0.767 41.490 42.059 0.329 0.000 0.910 433 L HN 0.091 8.321 8.230 -0.000 0.000 0.437 434 A N -0.259 122.778 122.820 0.362 0.000 1.877 434 A HA -0.231 4.091 4.320 0.003 0.000 0.216 434 A C 2.391 180.177 177.584 0.338 0.000 1.186 434 A CA 1.735 53.992 52.037 0.366 0.000 0.620 434 A CB -0.591 18.538 19.000 0.216 0.000 0.822 434 A HN 0.417 8.567 8.150 -0.000 0.000 0.443 435 R N -0.399 120.254 120.500 0.255 0.000 2.339 435 R HA 0.188 4.530 4.340 0.003 0.000 0.199 435 R C 1.768 178.025 176.300 -0.071 0.000 1.018 435 R CA 0.953 57.123 56.100 0.116 0.000 1.036 435 R CB -0.472 29.903 30.300 0.125 0.000 0.899 435 R HN 0.496 8.766 8.270 -0.000 0.000 0.473 436 A N -1.028 121.882 122.820 0.151 0.000 1.911 436 A HA 0.034 4.356 4.320 0.003 0.000 0.212 436 A C 1.635 179.116 177.584 -0.172 0.000 1.189 436 A CA 0.346 52.433 52.037 0.083 0.000 0.639 436 A CB -0.456 18.643 19.000 0.165 0.000 0.839 436 A HN 0.284 8.434 8.150 -0.000 0.000 0.449 437 F N 0.898 120.756 119.950 -0.155 0.000 2.087 437 F HA -0.245 4.284 4.527 0.003 0.000 0.299 437 F C 2.423 177.819 175.800 -0.674 0.000 1.100 437 F CA 2.323 60.025 58.000 -0.496 0.000 1.226 437 F CB -0.165 38.603 39.000 -0.386 0.000 0.983 437 F HN 0.327 8.627 8.300 -0.000 0.000 0.479 438 E N -1.353 118.777 120.200 -0.116 0.000 2.299 438 E HA -0.079 4.272 4.350 0.003 0.000 0.193 438 E C 2.174 178.698 176.600 -0.126 0.000 0.998 438 E CA 0.870 57.294 56.400 0.040 0.000 0.851 438 E CB -0.077 29.691 29.700 0.114 0.000 0.795 438 E HN 0.219 8.579 8.360 -0.000 0.000 0.492 439 S N -0.097 115.420 115.700 -0.306 0.000 2.461 439 S HA 0.057 4.528 4.470 0.003 0.000 0.228 439 S C 0.148 174.357 174.600 -0.652 0.000 1.005 439 S CA 0.590 58.436 58.200 -0.590 0.000 0.942 439 S CB 0.212 62.882 63.200 -0.883 0.000 0.776 439 S HN 0.145 8.455 8.310 -0.000 0.000 0.514 440 F N 0.702 120.555 119.950 -0.162 0.000 2.971 440 F HA 0.321 4.850 4.527 0.003 0.000 0.373 440 F C -2.369 173.304 175.800 -0.211 0.000 1.288 440 F CA -1.520 56.391 58.000 -0.149 0.000 1.204 440 F CB 1.628 40.535 39.000 -0.154 0.000 1.852 440 F HN -0.073 8.227 8.300 -0.000 0.000 0.624 441 P HA 0.059 4.479 4.420 -0.000 0.000 0.240 441 P C 1.523 178.901 177.300 0.129 0.000 1.190 441 P CA 0.726 63.852 63.100 0.043 0.000 0.781 441 P CB 0.496 32.350 31.700 0.256 0.000 0.931 442 G N 0.516 109.379 108.800 0.105 0.000 2.394 442 G HA2 -0.204 3.758 3.960 0.003 0.000 0.214 442 G HA3 -0.204 3.758 3.960 0.003 0.000 0.214 442 G C 1.419 176.364 174.900 0.075 0.000 1.176 442 G CA 0.618 45.780 45.100 0.103 0.000 0.786 442 G HN 0.139 8.429 8.290 -0.000 0.000 0.533 443 D N 0.581 121.000 120.400 0.031 0.000 2.183 443 D HA 0.097 4.739 4.640 0.003 0.000 0.203 443 D C 2.746 179.063 176.300 0.029 0.000 0.969 443 D CA 0.863 54.865 54.000 0.004 0.000 0.842 443 D CB -0.112 40.650 40.800 -0.064 0.000 0.957 443 D HN 0.224 8.594 8.370 -0.000 0.000 0.484 444 A N 1.725 124.493 122.820 -0.086 0.000 1.827 444 A HA -0.217 4.105 4.320 0.003 0.000 0.215 444 A C 1.772 179.454 177.584 0.164 0.000 1.212 444 A CA 2.120 54.054 52.037 -0.172 0.000 0.624 444 A CB -0.893 17.523 19.000 -0.972 0.000 0.853 444 A HN 0.192 8.342 8.150 -0.000 0.000 0.450 445 D N 0.206 120.817 120.400 0.352 0.000 2.421 445 D HA -0.331 4.311 4.640 0.003 0.000 0.195 445 D C 1.902 178.355 176.300 0.254 0.000 1.022 445 D CA 1.969 56.204 54.000 0.391 0.000 0.871 445 D CB -1.042 39.945 40.800 0.313 0.000 1.026 445 D HN 0.662 9.032 8.370 -0.000 0.000 0.462 446 Q N 0.784 120.689 119.800 0.175 0.000 1.954 446 Q HA -0.236 4.105 4.340 0.003 0.000 0.222 446 Q C 2.741 178.803 176.000 0.103 0.000 1.053 446 Q CA 1.789 57.660 55.803 0.113 0.000 0.900 446 Q CB -0.996 27.787 28.738 0.075 0.000 1.021 446 Q HN 0.509 8.779 8.270 -0.000 0.000 0.423 447 I N -0.955 119.682 120.570 0.112 0.000 2.113 447 I HA -0.212 3.960 4.170 0.003 0.000 0.238 447 I C 0.741 176.843 176.117 -0.026 0.000 1.070 447 I CA 1.402 62.710 61.300 0.014 0.000 1.332 447 I CB -0.357 37.659 38.000 0.028 0.000 1.044 447 I HN 0.151 8.361 8.210 -0.000 0.000 0.402 448 Y N 1.992 122.383 120.300 0.153 0.000 2.787 448 Y HA 0.393 4.945 4.550 0.003 0.000 0.352 448 Y C -2.503 173.599 175.900 0.336 0.000 1.027 448 Y CA -2.789 55.453 58.100 0.238 0.000 1.219 448 Y CB 0.162 38.836 38.460 0.358 0.000 1.110 448 Y HN 0.001 8.281 8.280 -0.000 0.000 0.614 449 P HA 0.242 4.662 4.420 -0.000 0.000 0.282 449 P C 0.861 178.322 177.300 0.268 0.000 1.262 449 P CA 0.421 63.740 63.100 0.365 0.000 0.773 449 P CB 1.513 33.344 31.700 0.218 0.000 0.879 450 G N 3.354 112.277 108.800 0.205 0.000 2.154 450 G HA2 -0.168 3.794 3.960 0.003 0.000 0.186 450 G HA3 -0.168 3.794 3.960 0.003 0.000 0.186 450 G C 0.680 175.564 174.900 -0.027 0.000 1.000 450 G CA 0.018 45.128 45.100 0.017 0.000 0.664 450 G HN 0.605 8.895 8.290 -0.000 0.000 0.513 451 W N 0.543 121.833 121.300 -0.016 0.000 2.374 451 W HA 0.025 4.686 4.660 0.003 0.000 0.288 451 W C 1.676 178.082 176.519 -0.189 0.000 1.218 451 W CA 1.133 58.363 57.345 -0.192 0.000 1.245 451 W CB -0.685 28.683 29.460 -0.153 0.000 1.126 451 W HN 0.329 8.509 8.180 -0.000 0.000 0.545 452 R N 1.222 121.110 120.500 -1.020 0.000 2.057 452 R HA -0.119 4.222 4.340 0.003 0.000 0.229 452 R C 2.500 178.541 176.300 -0.432 0.000 1.136 452 R CA 1.845 57.361 56.100 -0.974 0.000 0.952 452 R CB -0.566 28.987 30.300 -1.245 0.000 0.848 452 R HN 0.088 8.358 8.270 -0.000 0.000 0.430 453 K N 0.755 120.933 120.400 -0.370 0.000 2.059 453 K HA -0.193 4.128 4.320 0.003 0.000 0.212 453 K C 1.862 178.382 176.600 -0.134 0.000 1.050 453 K CA 1.921 58.091 56.287 -0.195 0.000 0.927 453 K CB -0.209 32.208 32.500 -0.139 0.000 0.714 453 K HN 0.179 8.429 8.250 -0.000 0.000 0.447 454 A N 0.513 123.266 122.820 -0.113 0.000 2.121 454 A HA 0.073 4.395 4.320 0.003 0.000 0.218 454 A C 0.329 177.869 177.584 -0.074 0.000 1.154 454 A CA 0.741 52.735 52.037 -0.073 0.000 0.679 454 A CB -0.331 18.637 19.000 -0.054 0.000 0.795 454 A HN 0.483 8.633 8.150 -0.000 0.000 0.458 455 L N -4.714 116.451 121.223 -0.096 0.000 1.969 455 L HA 0.163 4.504 4.340 0.003 0.000 0.363 455 L C 0.472 177.325 176.870 -0.029 0.000 1.011 455 L CA 0.782 55.575 54.840 -0.079 0.000 1.156 455 L CB -0.938 41.092 42.059 -0.047 0.000 0.791 455 L HN 0.557 8.787 8.230 -0.000 0.000 0.404 456 G N 1.859 110.646 108.800 -0.021 0.000 4.234 456 G HA2 0.443 4.405 3.960 0.003 0.000 0.206 456 G HA3 0.443 4.405 3.960 0.003 0.000 0.206 456 G C 0.453 175.350 174.900 -0.006 0.000 1.204 456 G CA 0.811 45.968 45.100 0.096 0.000 0.998 456 G HN 1.664 9.954 8.290 -0.000 0.000 0.417 457 V N 0.000 119.825 119.914 -0.148 0.000 2.409 457 V HA 0.000 4.122 4.120 0.003 0.000 0.244 457 V CA 0.000 62.218 62.300 -0.137 0.000 1.235 457 V CB 0.000 31.765 31.823 -0.096 0.000 1.184 457 V HN 0.000 8.190 8.190 -0.000 0.000 0.556