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 3i6t_1_B DATA FIRST_RESID 6 DATA SEQUENCE QIIAGFTLWH LSLPVTARRD HGIGSVAGAV EVVVLRLQAD SGAVGYGEAS DATA SEQUENCE PWVVFTGSVE ATYAALDRYL RPLVLGRAVG DHAAIMEDAR AAVAHCTEAK DATA SEQUENCE AALDTALYDL RARIAGVPVW ALLGGRCRDR IPLSCSIADP DFDKDLALMQ DATA SEQUENCE RLQDDDVRII KLKTGFKDHA FDMMRLERLR ADFPAFDIRV DYNQGLHHDV DATA SEQUENCE ALARVRDVAT FKPTFIEQPV KAHLRGLMAR IRDAVDVPLL ADESIFGPED DATA SEQUENCE MAEHPEIADG VSIKIMKSGG LTRAQTVARM AAARGLSAYG GDMFEAGLAH DATA SEQUENCE LAGAHMIAAT PEITLGCEFY QATYFLCDDI LAAPFPVADG HVLVPDTPGL DATA SEQUENCE GVDVDEDALA RFAV 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 6 Q HA 0.000 nan 4.340 nan 0.000 0.214 6 Q C 0.000 175.989 176.000 -0.018 0.000 1.003 6 Q CA 0.000 55.794 55.803 -0.015 0.000 1.022 6 Q CB 0.000 28.727 28.738 -0.018 0.000 1.108 7 I N -2.276 118.283 120.570 -0.018 0.000 2.957 7 I HA 0.640 4.800 4.170 -0.017 0.000 0.310 7 I C -0.615 175.490 176.117 -0.021 0.000 1.063 7 I CA -1.321 59.968 61.300 -0.019 0.000 1.033 7 I CB 1.577 39.568 38.000 -0.015 0.000 1.230 7 I HN 0.541 8.751 8.210 -0.000 0.000 0.447 8 I N 3.057 123.616 120.570 -0.017 0.000 2.322 8 I HA 0.269 4.429 4.170 -0.017 0.000 0.292 8 I C 1.044 177.159 176.117 -0.003 0.000 1.060 8 I CA -0.036 61.257 61.300 -0.011 0.000 1.309 8 I CB 1.572 39.576 38.000 0.007 0.000 1.415 8 I HN 0.859 9.069 8.210 -0.000 0.000 0.492 9 A N 5.167 127.983 122.820 -0.007 0.000 2.044 9 A HA 0.435 4.745 4.320 -0.017 0.000 0.213 9 A C 1.063 178.649 177.584 0.003 0.000 1.169 9 A CA 0.544 52.577 52.037 -0.006 0.000 0.724 9 A CB 0.157 19.150 19.000 -0.011 0.000 0.840 9 A HN 0.718 8.868 8.150 -0.000 0.000 0.463 10 G N -1.552 107.255 108.800 0.012 0.000 2.638 10 G HA2 0.518 4.468 3.960 -0.017 0.000 0.302 10 G HA3 0.518 4.468 3.960 -0.017 0.000 0.302 10 G C -1.544 173.403 174.900 0.079 0.000 1.365 10 G CA -0.475 44.641 45.100 0.026 0.000 0.987 10 G HN 0.270 8.560 8.290 -0.000 0.000 0.495 11 F N 2.062 121.955 119.950 -0.096 0.000 2.745 11 F HA 0.582 5.099 4.527 -0.017 0.000 0.343 11 F C -0.542 175.174 175.800 -0.140 0.000 1.196 11 F CA -0.415 57.521 58.000 -0.107 0.000 1.021 11 F CB 1.972 40.911 39.000 -0.101 0.000 1.297 11 F HN 0.443 8.743 8.300 -0.000 0.000 0.486 12 T N 6.709 121.183 114.554 -0.134 0.000 2.861 12 T HA 0.607 4.947 4.350 -0.017 0.000 0.287 12 T C -0.693 173.795 174.700 -0.353 0.000 1.003 12 T CA -0.597 61.344 62.100 -0.264 0.000 0.977 12 T CB 1.861 70.495 68.868 -0.390 0.000 0.996 12 T HN 0.405 8.645 8.240 -0.000 0.000 0.448 13 L N 2.141 123.151 121.223 -0.354 0.000 2.334 13 L HA 0.663 4.993 4.340 -0.017 0.000 0.273 13 L C -0.732 176.027 176.870 -0.185 0.000 1.013 13 L CA -0.951 53.804 54.840 -0.141 0.000 0.816 13 L CB 1.788 43.781 42.059 -0.110 0.000 1.278 13 L HN 0.457 8.687 8.230 -0.000 0.000 0.431 14 W N 1.034 122.450 121.300 0.194 0.000 2.883 14 W HA 0.330 4.980 4.660 -0.017 0.000 0.335 14 W C -0.632 176.081 176.519 0.322 0.000 1.083 14 W CA -0.662 56.823 57.345 0.234 0.000 1.233 14 W CB 1.790 31.345 29.460 0.158 0.000 1.412 14 W HN 0.566 8.746 8.180 -0.000 0.000 0.490 15 H N 3.570 122.867 119.070 0.380 0.000 2.581 15 H HA 0.486 5.032 4.556 -0.017 0.000 0.308 15 H C -0.882 174.556 175.328 0.184 0.000 1.040 15 H CA -0.346 55.842 56.048 0.234 0.000 1.231 15 H CB 0.704 30.485 29.762 0.032 0.000 1.396 15 H HN 0.269 8.549 8.280 -0.000 0.000 0.467 16 L N 3.494 124.943 121.223 0.377 0.000 2.344 16 L HA 0.334 4.664 4.340 -0.017 0.000 0.272 16 L C 0.164 177.107 176.870 0.121 0.000 1.035 16 L CA -0.823 54.135 54.840 0.195 0.000 0.807 16 L CB 1.853 44.000 42.059 0.146 0.000 1.237 16 L HN 0.476 8.706 8.230 -0.000 0.000 0.442 17 S N 2.455 118.186 115.700 0.052 0.000 2.659 17 S HA 0.630 5.090 4.470 -0.017 0.000 0.312 17 S C -0.898 173.665 174.600 -0.061 0.000 1.114 17 S CA -0.575 57.625 58.200 -0.001 0.000 1.063 17 S CB 0.474 63.666 63.200 -0.014 0.000 0.996 17 S HN 0.452 8.762 8.310 -0.000 0.000 0.478 18 L N 6.275 127.379 121.223 -0.199 0.000 2.294 18 L HA 0.478 4.808 4.340 -0.017 0.000 0.283 18 L C -2.352 174.318 176.870 -0.332 0.000 1.015 18 L CA -2.270 52.308 54.840 -0.437 0.000 0.831 18 L CB 1.661 43.426 42.059 -0.491 0.000 1.217 18 L HN 0.420 8.650 8.230 -0.000 0.000 0.420 19 P HA 0.028 4.448 4.420 -0.000 0.000 0.266 19 P C -0.671 176.433 177.300 -0.327 0.000 1.195 19 P CA -0.074 62.894 63.100 -0.220 0.000 0.768 19 P CB 0.897 32.535 31.700 -0.103 0.000 0.838 20 V N -0.494 119.189 119.914 -0.386 0.000 3.046 20 V HA 0.591 4.701 4.120 -0.017 0.000 0.316 20 V C 1.016 176.882 176.094 -0.380 0.000 1.104 20 V CA -0.265 61.666 62.300 -0.615 0.000 1.006 20 V CB 1.385 32.443 31.823 -1.276 0.000 1.058 20 V HN 0.579 8.769 8.190 -0.000 0.000 0.440 21 T N -1.715 112.651 114.554 -0.314 0.000 3.100 21 T HA 0.693 5.033 4.350 -0.017 0.000 0.253 21 T C 0.482 175.193 174.700 0.019 0.000 1.118 21 T CA 0.607 62.662 62.100 -0.075 0.000 1.058 21 T CB -0.090 68.798 68.868 0.034 0.000 0.953 21 T HN 1.830 10.070 8.240 -0.000 0.000 0.515 22 A N 0.837 123.691 122.820 0.056 0.000 2.599 22 A HA 0.748 5.058 4.320 -0.017 0.000 0.290 22 A C -1.154 176.570 177.584 0.232 0.000 1.101 22 A CA -1.320 50.834 52.037 0.194 0.000 0.674 22 A CB 1.160 20.344 19.000 0.306 0.000 1.277 22 A HN 0.378 8.528 8.150 -0.000 0.000 0.419 23 R N 0.692 121.281 120.500 0.149 0.000 2.294 23 R HA 0.681 5.011 4.340 -0.017 0.000 0.319 23 R C -0.921 175.398 176.300 0.031 0.000 0.984 23 R CA -0.340 55.813 56.100 0.088 0.000 0.861 23 R CB 0.842 31.160 30.300 0.030 0.000 1.104 23 R HN 0.689 8.959 8.270 -0.000 0.000 0.451 24 R N 3.194 123.680 120.500 -0.023 0.000 2.476 24 R HA 0.278 4.608 4.340 -0.017 0.000 0.305 24 R C -1.369 174.685 176.300 -0.410 0.000 0.965 24 R CA -0.896 55.090 56.100 -0.190 0.000 0.867 24 R CB 1.864 32.108 30.300 -0.092 0.000 1.176 24 R HN 0.640 8.910 8.270 -0.000 0.000 0.447 25 D N 1.127 121.016 120.400 -0.852 0.000 2.228 25 D HA 0.440 5.070 4.640 -0.017 0.000 0.247 25 D C -0.739 174.779 176.300 -1.304 0.000 0.995 25 D CA -0.152 53.220 54.000 -1.046 0.000 0.903 25 D CB 1.277 41.240 40.800 -1.396 0.000 1.205 25 D HN 0.423 8.793 8.370 -0.000 0.000 0.459 26 H N -1.475 117.528 119.070 -0.111 0.000 3.017 26 H HA 0.461 5.007 4.556 -0.017 0.000 0.346 26 H C 0.947 176.481 175.328 0.343 0.000 1.286 26 H CA -0.979 55.228 56.048 0.264 0.000 1.120 26 H CB 1.462 31.525 29.762 0.501 0.000 1.860 26 H HN 0.408 8.688 8.280 -0.000 0.000 0.542 27 G N 0.418 109.511 108.800 0.487 0.000 2.708 27 G HA2 -0.083 3.867 3.960 -0.017 0.000 0.210 27 G HA3 -0.083 3.867 3.960 -0.017 0.000 0.210 27 G C 0.794 175.829 174.900 0.225 0.000 1.141 27 G CA 1.279 46.587 45.100 0.347 0.000 0.788 27 G HN 0.666 8.956 8.290 -0.000 0.000 0.531 28 I N -4.397 116.301 120.570 0.214 0.000 4.526 28 I HA 0.569 4.729 4.170 -0.017 0.000 0.330 28 I C 0.662 176.830 176.117 0.085 0.000 1.323 28 I CA -0.029 61.294 61.300 0.039 0.000 1.218 28 I CB 0.941 38.817 38.000 -0.206 0.000 1.233 28 I HN 0.041 8.251 8.210 -0.000 0.000 0.430 29 G N 0.739 109.732 108.800 0.322 0.000 2.340 29 G HA2 0.334 4.284 3.960 -0.017 0.000 0.298 29 G HA3 0.334 4.284 3.960 -0.017 0.000 0.298 29 G C -1.838 173.403 174.900 0.568 0.000 1.498 29 G CA -0.233 45.107 45.100 0.400 0.000 0.847 29 G HN 0.023 8.313 8.290 -0.000 0.000 0.594 30 S N -1.443 114.471 115.700 0.357 0.000 2.565 30 S HA 0.762 5.222 4.470 -0.017 0.000 0.290 30 S C -0.479 174.218 174.600 0.161 0.000 1.150 30 S CA -0.521 57.814 58.200 0.226 0.000 1.058 30 S CB 1.487 64.742 63.200 0.092 0.000 1.032 30 S HN 1.147 9.457 8.310 -0.000 0.000 0.510 31 V N 3.220 123.154 119.914 0.034 0.000 2.447 31 V HA 0.845 4.955 4.120 -0.017 0.000 0.292 31 V C -0.062 176.010 176.094 -0.036 0.000 1.021 31 V CA -0.342 61.869 62.300 -0.148 0.000 0.850 31 V CB 0.694 32.113 31.823 -0.674 0.000 1.005 31 V HN 1.070 9.260 8.190 -0.000 0.000 0.426 32 A N 3.037 125.837 122.820 -0.033 0.000 2.609 32 A HA 0.931 5.241 4.320 -0.017 0.000 0.291 32 A C 0.792 178.341 177.584 -0.059 0.000 1.096 32 A CA 0.233 52.261 52.037 -0.015 0.000 0.684 32 A CB 1.528 20.530 19.000 0.003 0.000 1.282 32 A HN 1.976 10.126 8.150 -0.000 0.000 0.412 33 G N -0.273 108.481 108.800 -0.076 0.000 5.229 33 G HA2 0.273 4.223 3.960 -0.017 0.000 0.250 33 G HA3 0.273 4.223 3.960 -0.017 0.000 0.250 33 G C 0.741 175.560 174.900 -0.135 0.000 1.380 33 G CA 1.382 46.431 45.100 -0.084 0.000 0.933 33 G HN 2.756 11.046 8.290 -0.000 0.000 0.731 34 A N -1.134 121.604 122.820 -0.136 0.000 2.612 34 A HA 0.892 5.202 4.320 -0.017 0.000 0.293 34 A C -0.468 177.024 177.584 -0.153 0.000 1.075 34 A CA 0.428 52.367 52.037 -0.163 0.000 0.680 34 A CB 1.566 20.505 19.000 -0.102 0.000 1.279 34 A HN 2.109 10.259 8.150 -0.000 0.000 0.411 35 V N -1.274 118.541 119.914 -0.164 0.000 2.628 35 V HA 0.813 4.923 4.120 -0.017 0.000 0.306 35 V C -0.579 175.488 176.094 -0.045 0.000 1.045 35 V CA -0.617 61.621 62.300 -0.103 0.000 0.905 35 V CB 1.527 33.299 31.823 -0.085 0.000 0.997 35 V HN 0.868 9.058 8.190 -0.000 0.000 0.436 36 E N 2.596 122.813 120.200 0.028 0.000 2.191 36 E HA 0.703 5.043 4.350 -0.017 0.000 0.278 36 E C -0.615 176.047 176.600 0.102 0.000 0.972 36 E CA -0.690 55.775 56.400 0.110 0.000 0.804 36 E CB 2.295 32.127 29.700 0.219 0.000 1.110 36 E HN 0.962 9.322 8.360 -0.000 0.000 0.394 37 V N -0.566 119.422 119.914 0.124 0.000 3.160 37 V HA 0.676 4.786 4.120 -0.017 0.000 0.310 37 V C -0.770 175.420 176.094 0.159 0.000 1.181 37 V CA -0.885 61.471 62.300 0.093 0.000 1.047 37 V CB 1.955 33.792 31.823 0.024 0.000 1.068 37 V HN 0.355 8.545 8.190 -0.000 0.000 0.441 38 V N 1.657 121.652 119.914 0.134 0.000 2.495 38 V HA 0.656 4.766 4.120 -0.017 0.000 0.298 38 V C -0.261 175.934 176.094 0.169 0.000 1.031 38 V CA -0.489 61.931 62.300 0.199 0.000 0.871 38 V CB 1.605 33.537 31.823 0.182 0.000 0.988 38 V HN 0.799 8.989 8.190 -0.000 0.000 0.432 39 V N 5.571 125.637 119.914 0.253 0.000 2.513 39 V HA 0.537 4.647 4.120 -0.017 0.000 0.299 39 V C -0.501 175.791 176.094 0.330 0.000 1.035 39 V CA -0.640 61.800 62.300 0.234 0.000 0.889 39 V CB 1.809 33.730 31.823 0.164 0.000 0.988 39 V HN 0.687 8.877 8.190 -0.000 0.000 0.440 40 L N 5.375 126.705 121.223 0.179 0.000 2.322 40 L HA 0.671 5.001 4.340 -0.017 0.000 0.281 40 L C -0.319 176.578 176.870 0.045 0.000 1.014 40 L CA -0.186 54.656 54.840 0.004 0.000 0.815 40 L CB 1.386 43.306 42.059 -0.232 0.000 1.247 40 L HN 0.706 8.936 8.230 -0.000 0.000 0.421 41 R N 5.403 125.912 120.500 0.016 0.000 2.387 41 R HA 0.642 4.972 4.340 -0.017 0.000 0.314 41 R C -1.725 174.388 176.300 -0.312 0.000 0.958 41 R CA -0.659 55.302 56.100 -0.231 0.000 0.846 41 R CB 1.015 31.273 30.300 -0.071 0.000 1.147 41 R HN 0.792 9.062 8.270 -0.000 0.000 0.447 42 L N 3.817 124.837 121.223 -0.339 0.000 2.307 42 L HA 0.426 4.756 4.340 -0.017 0.000 0.284 42 L C -0.253 176.499 176.870 -0.197 0.000 1.023 42 L CA -0.595 54.102 54.840 -0.237 0.000 0.810 42 L CB 1.891 43.827 42.059 -0.205 0.000 1.231 42 L HN 0.585 8.815 8.230 -0.000 0.000 0.423 43 Q N 2.266 121.997 119.800 -0.115 0.000 2.333 43 Q HA 0.676 5.006 4.340 -0.017 0.000 0.267 43 Q C -0.958 175.010 176.000 -0.054 0.000 1.012 43 Q CA -0.613 55.139 55.803 -0.085 0.000 0.824 43 Q CB 2.305 31.009 28.738 -0.056 0.000 1.290 43 Q HN 0.775 9.045 8.270 -0.000 0.000 0.449 44 A N 2.501 125.290 122.820 -0.051 0.000 2.271 44 A HA 0.146 4.456 4.320 -0.017 0.000 0.288 44 A C 0.737 178.306 177.584 -0.025 0.000 1.094 44 A CA 0.028 52.042 52.037 -0.037 0.000 0.828 44 A CB 0.317 19.295 19.000 -0.038 0.000 1.091 44 A HN 1.020 9.170 8.150 -0.000 0.000 0.493 45 D N 0.280 120.668 120.400 -0.020 0.000 2.263 45 D HA -0.185 4.445 4.640 -0.017 0.000 0.208 45 D C 1.523 177.816 176.300 -0.012 0.000 0.971 45 D CA 1.616 55.607 54.000 -0.014 0.000 0.867 45 D CB -0.291 40.502 40.800 -0.013 0.000 0.929 45 D HN 0.522 8.892 8.370 -0.000 0.000 0.492 46 S N -0.378 115.314 115.700 -0.013 0.000 2.447 46 S HA 0.158 4.618 4.470 -0.017 0.000 0.233 46 S C 1.997 176.592 174.600 -0.008 0.000 1.006 46 S CA 1.059 59.253 58.200 -0.010 0.000 0.957 46 S CB -0.253 62.940 63.200 -0.011 0.000 0.773 46 S HN 0.605 8.915 8.310 -0.000 0.000 0.507 47 G N 0.731 109.524 108.800 -0.012 0.000 2.195 47 G HA2 -0.063 3.887 3.960 -0.017 0.000 0.224 47 G HA3 -0.063 3.887 3.960 -0.017 0.000 0.224 47 G C 0.286 175.179 174.900 -0.013 0.000 0.990 47 G CA -0.054 45.041 45.100 -0.009 0.000 0.639 47 G HN 1.291 9.581 8.290 -0.000 0.000 0.514 48 A N -0.083 122.726 122.820 -0.018 0.000 2.483 48 A HA 0.663 4.973 4.320 -0.017 0.000 0.238 48 A C 0.788 178.344 177.584 -0.046 0.000 1.070 48 A CA 0.797 52.821 52.037 -0.022 0.000 0.770 48 A CB 0.531 19.517 19.000 -0.022 0.000 1.008 48 A HN 1.969 10.119 8.150 -0.000 0.000 0.497 49 V N -0.428 119.454 119.914 -0.053 0.000 2.914 49 V HA 0.992 5.102 4.120 -0.017 0.000 0.314 49 V C 0.120 176.127 176.094 -0.145 0.000 1.084 49 V CA 0.009 62.227 62.300 -0.137 0.000 0.963 49 V CB 1.601 33.320 31.823 -0.174 0.000 1.025 49 V HN 1.591 9.781 8.190 -0.000 0.000 0.432 50 G N 1.281 109.920 108.800 -0.269 0.000 2.612 50 G HA2 0.740 4.690 3.960 -0.017 0.000 0.298 50 G HA3 0.740 4.690 3.960 -0.017 0.000 0.298 50 G C -2.215 172.466 174.900 -0.366 0.000 1.336 50 G CA -0.725 44.263 45.100 -0.187 0.000 0.953 50 G HN 0.731 9.021 8.290 -0.000 0.000 0.482 51 Y N -0.725 119.547 120.300 -0.046 0.000 2.536 51 Y HA 0.765 5.305 4.550 -0.017 0.000 0.347 51 Y C 0.647 176.517 175.900 -0.050 0.000 1.000 51 Y CA -0.506 57.565 58.100 -0.048 0.000 1.051 51 Y CB 2.983 41.408 38.460 -0.059 0.000 1.259 51 Y HN 0.858 9.138 8.280 -0.000 0.000 0.468 52 G N 0.687 109.558 108.800 0.118 0.000 2.696 52 G HA2 0.540 4.490 3.960 -0.017 0.000 0.295 52 G HA3 0.540 4.490 3.960 -0.017 0.000 0.295 52 G C -2.111 172.815 174.900 0.044 0.000 1.398 52 G CA -0.808 44.324 45.100 0.052 0.000 0.920 52 G HN 0.510 8.800 8.290 -0.000 0.000 0.492 53 E N 0.198 120.407 120.200 0.014 0.000 2.210 53 E HA 0.644 4.984 4.350 -0.017 0.000 0.266 53 E C -0.580 176.023 176.600 0.006 0.000 0.883 53 E CA -0.956 55.444 56.400 0.000 0.000 0.761 53 E CB 1.899 31.565 29.700 -0.056 0.000 1.156 53 E HN 0.691 9.051 8.360 -0.000 0.000 0.412 54 A N 2.878 125.714 122.820 0.027 0.000 2.288 54 A HA 0.511 4.821 4.320 -0.017 0.000 0.320 54 A C -0.773 176.829 177.584 0.030 0.000 1.217 54 A CA -0.658 51.401 52.037 0.036 0.000 0.840 54 A CB 1.225 20.261 19.000 0.059 0.000 1.179 54 A HN 0.473 8.623 8.150 -0.000 0.000 0.504 55 S N 4.370 120.080 115.700 0.016 0.000 2.150 55 S HA 0.433 4.893 4.470 -0.017 0.000 0.171 55 S C -2.886 171.739 174.600 0.043 0.000 1.620 55 S CA -0.900 57.309 58.200 0.015 0.000 1.190 55 S CB 0.450 63.633 63.200 -0.029 0.000 1.102 55 S HN 0.577 8.887 8.310 -0.000 0.000 0.464 56 P HA 0.339 4.759 4.420 -0.000 0.000 0.278 56 P C -0.968 176.475 177.300 0.238 0.000 1.238 56 P CA -0.431 62.751 63.100 0.137 0.000 0.794 56 P CB 0.523 32.304 31.700 0.134 0.000 0.955 57 W N 4.125 125.449 121.300 0.040 0.000 2.554 57 W HA 0.268 4.918 4.660 -0.017 0.000 0.324 57 W C 0.715 177.320 176.519 0.144 0.000 1.018 57 W CA -0.944 56.462 57.345 0.101 0.000 1.243 57 W CB 1.164 30.686 29.460 0.104 0.000 1.345 57 W HN 0.142 8.322 8.180 -0.000 0.000 0.441 58 V N 6.814 126.933 119.914 0.341 0.000 2.469 58 V HA -0.225 3.885 4.120 -0.017 0.000 0.251 58 V C 1.626 177.738 176.094 0.030 0.000 1.064 58 V CA 3.411 65.805 62.300 0.158 0.000 1.066 58 V CB -0.376 31.538 31.823 0.153 0.000 0.667 58 V HN 0.541 8.731 8.190 -0.000 0.000 0.461 59 V N -3.218 116.604 119.914 -0.153 0.000 3.217 59 V HA 0.042 4.152 4.120 -0.017 0.000 0.264 59 V C 1.877 177.872 176.094 -0.164 0.000 1.135 59 V CA 1.780 63.943 62.300 -0.230 0.000 1.142 59 V CB -0.383 31.208 31.823 -0.387 0.000 0.754 59 V HN 0.500 8.690 8.190 -0.000 0.000 0.484 60 F N 2.347 122.137 119.950 -0.266 0.000 2.444 60 F HA 0.225 4.742 4.527 -0.017 0.000 0.263 60 F C 2.336 178.223 175.800 0.145 0.000 0.912 60 F CA 1.699 59.645 58.000 -0.091 0.000 1.122 60 F CB -0.061 38.861 39.000 -0.129 0.000 1.246 60 F HN 0.182 8.482 8.300 -0.000 0.000 0.752 61 T N -1.292 113.581 114.554 0.532 0.000 3.037 61 T HA 0.562 4.902 4.350 -0.017 0.000 0.252 61 T C 0.902 175.764 174.700 0.270 0.000 1.073 61 T CA 0.494 62.875 62.100 0.468 0.000 1.091 61 T CB -0.003 69.023 68.868 0.264 0.000 0.935 61 T HN 0.873 9.113 8.240 -0.000 0.000 0.488 62 G N 1.189 110.104 108.800 0.192 0.000 2.334 62 G HA2 0.312 4.262 3.960 -0.017 0.000 0.566 62 G HA3 0.312 4.262 3.960 -0.017 0.000 0.566 62 G C -0.498 174.484 174.900 0.137 0.000 1.413 62 G CA -0.494 44.681 45.100 0.125 0.000 0.993 62 G HN 0.942 9.232 8.290 -0.000 0.000 0.642 63 S N -0.866 114.900 115.700 0.111 0.000 2.593 63 S HA 0.445 4.905 4.470 -0.017 0.000 0.269 63 S C 1.568 176.230 174.600 0.103 0.000 1.334 63 S CA 0.365 58.633 58.200 0.112 0.000 1.015 63 S CB 1.685 64.941 63.200 0.092 0.000 0.912 63 S HN 2.042 10.352 8.310 -0.000 0.000 0.541 64 V N 1.601 121.564 119.914 0.083 0.000 2.490 64 V HA -0.122 3.988 4.120 -0.017 0.000 0.250 64 V C 2.179 178.273 176.094 -0.000 0.000 1.061 64 V CA 2.368 64.680 62.300 0.019 0.000 1.064 64 V CB -1.086 30.707 31.823 -0.049 0.000 0.670 64 V HN 0.962 9.152 8.190 -0.000 0.000 0.461 65 E N 0.492 120.711 120.200 0.032 0.000 2.107 65 E HA -0.028 4.312 4.350 -0.017 0.000 0.191 65 E C 2.250 178.931 176.600 0.136 0.000 0.982 65 E CA 1.365 57.805 56.400 0.066 0.000 0.809 65 E CB -0.563 29.177 29.700 0.067 0.000 0.756 65 E HN 0.684 9.044 8.360 -0.000 0.000 0.459 66 A N 0.239 123.132 122.820 0.122 0.000 1.877 66 A HA -0.194 4.116 4.320 -0.017 0.000 0.216 66 A C 2.387 180.064 177.584 0.155 0.000 1.186 66 A CA 2.013 54.133 52.037 0.138 0.000 0.620 66 A CB -1.002 18.070 19.000 0.119 0.000 0.822 66 A HN 0.237 8.387 8.150 -0.000 0.000 0.443 67 T N -1.831 112.808 114.554 0.141 0.000 2.777 67 T HA -0.138 4.202 4.350 -0.017 0.000 0.266 67 T C 1.753 176.537 174.700 0.141 0.000 1.040 67 T CA 1.625 63.806 62.100 0.134 0.000 1.141 67 T CB -0.407 68.529 68.868 0.115 0.000 0.868 67 T HN 0.529 8.769 8.240 -0.000 0.000 0.444 68 Y N 1.844 122.162 120.300 0.030 0.000 2.081 68 Y HA -0.179 4.361 4.550 -0.017 0.000 0.280 68 Y C 2.498 178.447 175.900 0.081 0.000 1.163 68 Y CA 1.449 59.569 58.100 0.034 0.000 1.135 68 Y CB -0.597 37.842 38.460 -0.035 0.000 0.970 68 Y HN 0.195 8.475 8.280 -0.000 0.000 0.498 69 A N 0.225 123.200 122.820 0.258 0.000 1.898 69 A HA -0.112 4.198 4.320 -0.017 0.000 0.216 69 A C 2.421 180.130 177.584 0.209 0.000 1.181 69 A CA 1.754 53.916 52.037 0.209 0.000 0.620 69 A CB -1.555 17.603 19.000 0.263 0.000 0.819 69 A HN 0.625 8.775 8.150 -0.000 0.000 0.442 70 A N -0.065 122.906 122.820 0.253 0.000 1.884 70 A HA -0.193 4.117 4.320 -0.017 0.000 0.219 70 A C 2.208 179.902 177.584 0.183 0.000 1.197 70 A CA 1.892 54.093 52.037 0.273 0.000 0.637 70 A CB -0.758 18.344 19.000 0.170 0.000 0.827 70 A HN 0.493 8.643 8.150 -0.000 0.000 0.450 71 L N -1.162 120.117 121.223 0.093 0.000 2.027 71 L HA -0.151 4.179 4.340 -0.017 0.000 0.206 71 L C 2.469 179.351 176.870 0.021 0.000 1.074 71 L CA 1.732 56.646 54.840 0.124 0.000 0.745 71 L CB -0.521 41.590 42.059 0.087 0.000 0.898 71 L HN 0.460 8.690 8.230 -0.000 0.000 0.433 72 D N -0.305 120.006 120.400 -0.150 0.000 2.097 72 D HA -0.201 4.429 4.640 -0.017 0.000 0.197 72 D C 2.332 178.480 176.300 -0.252 0.000 0.984 72 D CA 1.277 55.143 54.000 -0.224 0.000 0.826 72 D CB 0.208 40.831 40.800 -0.295 0.000 0.973 72 D HN 0.051 8.421 8.370 -0.000 0.000 0.460 73 R N -1.965 118.355 120.500 -0.300 0.000 2.123 73 R HA 0.028 4.358 4.340 -0.017 0.000 0.209 73 R C 1.722 177.669 176.300 -0.588 0.000 1.078 73 R CA 0.531 56.314 56.100 -0.529 0.000 1.028 73 R CB -0.065 29.744 30.300 -0.818 0.000 0.939 73 R HN 0.238 8.508 8.270 -0.000 0.000 0.463 74 Y N -0.308 119.949 120.300 -0.072 0.000 2.441 74 Y HA 0.157 4.697 4.550 -0.017 0.000 0.288 74 Y C 1.862 177.715 175.900 -0.078 0.000 1.118 74 Y CA 0.311 58.375 58.100 -0.059 0.000 1.215 74 Y CB 0.320 38.766 38.460 -0.022 0.000 1.118 74 Y HN -0.058 8.222 8.280 -0.000 0.000 0.547 75 L N -0.590 120.652 121.223 0.033 0.000 2.253 75 L HA 0.029 4.359 4.340 -0.017 0.000 0.205 75 L C 2.510 179.253 176.870 -0.212 0.000 1.078 75 L CA 0.491 55.331 54.840 0.001 0.000 0.805 75 L CB -0.379 41.753 42.059 0.122 0.000 0.963 75 L HN 0.065 8.295 8.230 -0.000 0.000 0.459 76 R N 1.279 121.460 120.500 -0.532 0.000 2.159 76 R HA -0.210 4.120 4.340 -0.017 0.000 0.249 76 R C -0.621 175.343 176.300 -0.560 0.000 1.136 76 R CA 2.497 57.930 56.100 -1.110 0.000 0.951 76 R CB -1.343 28.324 30.300 -1.055 0.000 0.876 76 R HN 0.236 8.506 8.270 -0.000 0.000 0.440 77 P HA -0.084 4.336 4.420 -0.000 0.000 0.229 77 P C 1.054 178.273 177.300 -0.135 0.000 1.160 77 P CA 1.109 64.084 63.100 -0.208 0.000 0.777 77 P CB -0.013 31.593 31.700 -0.157 0.000 0.814 78 L N -1.389 119.766 121.223 -0.113 0.000 2.509 78 L HA 0.040 4.370 4.340 -0.017 0.000 0.222 78 L C 2.160 179.005 176.870 -0.041 0.000 1.123 78 L CA 0.416 55.223 54.840 -0.055 0.000 0.856 78 L CB -0.129 41.919 42.059 -0.019 0.000 0.985 78 L HN -0.159 8.071 8.230 -0.000 0.000 0.456 79 V N -1.127 118.748 119.914 -0.064 0.000 2.911 79 V HA 0.072 4.182 4.120 -0.017 0.000 0.237 79 V C 1.147 177.241 176.094 0.000 0.000 1.156 79 V CA -0.204 62.102 62.300 0.009 0.000 1.180 79 V CB 0.378 32.294 31.823 0.154 0.000 0.932 79 V HN 0.095 8.285 8.190 -0.000 0.000 0.483 80 L N 1.845 123.032 121.223 -0.060 0.000 2.601 80 L HA 0.275 4.605 4.340 -0.017 0.000 0.277 80 L C 1.451 178.298 176.870 -0.038 0.000 1.219 80 L CA 1.461 56.274 54.840 -0.044 0.000 0.915 80 L CB 0.066 42.058 42.059 -0.111 0.000 1.160 80 L HN 0.571 8.801 8.230 -0.000 0.000 0.494 81 G N 2.381 111.169 108.800 -0.021 0.000 2.199 81 G HA2 -0.219 3.731 3.960 -0.017 0.000 0.254 81 G HA3 -0.219 3.731 3.960 -0.017 0.000 0.254 81 G C 0.451 175.339 174.900 -0.019 0.000 0.982 81 G CA -0.430 44.656 45.100 -0.023 0.000 0.632 81 G HN 0.490 8.780 8.290 -0.000 0.000 0.529 82 R N 0.749 121.239 120.500 -0.017 0.000 2.615 82 R HA 0.639 4.969 4.340 -0.017 0.000 0.270 82 R C 0.758 177.048 176.300 -0.016 0.000 1.081 82 R CA 0.229 56.319 56.100 -0.015 0.000 1.154 82 R CB 0.389 30.681 30.300 -0.013 0.000 1.063 82 R HN 0.724 8.994 8.270 -0.000 0.000 0.519 83 A N 1.747 124.559 122.820 -0.014 0.000 2.492 83 A HA 0.134 4.444 4.320 -0.017 0.000 0.254 83 A C 1.625 179.197 177.584 -0.019 0.000 1.091 83 A CA -0.241 51.788 52.037 -0.014 0.000 0.768 83 A CB 0.136 19.132 19.000 -0.008 0.000 1.028 83 A HN 0.684 8.834 8.150 -0.000 0.000 0.498 84 V N 2.317 122.215 119.914 -0.027 0.000 2.392 84 V HA -0.130 3.980 4.120 -0.017 0.000 0.249 84 V C 1.996 178.078 176.094 -0.020 0.000 1.059 84 V CA 2.331 64.605 62.300 -0.044 0.000 1.051 84 V CB -1.581 30.212 31.823 -0.049 0.000 0.658 84 V HN 0.936 9.126 8.190 -0.000 0.000 0.455 85 G N -0.117 108.680 108.800 -0.005 0.000 2.535 85 G HA2 -0.177 3.773 3.960 -0.017 0.000 0.218 85 G HA3 -0.177 3.773 3.960 -0.017 0.000 0.218 85 G C 0.842 175.756 174.900 0.023 0.000 1.122 85 G CA 0.829 45.936 45.100 0.011 0.000 0.769 85 G HN 0.579 8.869 8.290 -0.000 0.000 0.549 86 D N -0.952 119.460 120.400 0.019 0.000 2.352 86 D HA 0.100 4.730 4.640 -0.017 0.000 0.236 86 D C 1.431 177.766 176.300 0.058 0.000 1.148 86 D CA -0.209 53.807 54.000 0.026 0.000 0.844 86 D CB -0.304 40.503 40.800 0.011 0.000 0.933 86 D HN 0.558 8.928 8.370 -0.000 0.000 0.507 87 H N 0.861 119.887 119.070 -0.074 0.000 2.289 87 H HA -0.269 4.277 4.556 -0.017 0.000 0.294 87 H C 1.975 177.252 175.328 -0.085 0.000 1.095 87 H CA 1.804 57.783 56.048 -0.114 0.000 1.256 87 H CB 0.476 30.114 29.762 -0.206 0.000 1.359 87 H HN 0.197 8.477 8.280 -0.000 0.000 0.487 88 A N 0.875 123.728 122.820 0.056 0.000 1.877 88 A HA -0.144 4.166 4.320 -0.017 0.000 0.216 88 A C 2.614 180.222 177.584 0.040 0.000 1.186 88 A CA 1.700 53.739 52.037 0.004 0.000 0.620 88 A CB -1.235 17.747 19.000 -0.031 0.000 0.822 88 A HN 0.646 8.796 8.150 -0.000 0.000 0.443 89 A N -0.108 122.733 122.820 0.036 0.000 1.902 89 A HA -0.080 4.230 4.320 -0.017 0.000 0.217 89 A C 2.100 179.706 177.584 0.037 0.000 1.181 89 A CA 1.504 53.559 52.037 0.030 0.000 0.623 89 A CB -0.647 18.364 19.000 0.019 0.000 0.818 89 A HN 0.507 8.657 8.150 -0.000 0.000 0.443 90 I N -0.788 119.809 120.570 0.044 0.000 2.264 90 I HA -0.286 3.874 4.170 -0.017 0.000 0.248 90 I C 2.549 178.698 176.117 0.052 0.000 1.111 90 I CA 1.164 62.486 61.300 0.036 0.000 1.382 90 I CB -0.273 37.736 38.000 0.015 0.000 1.060 90 I HN 0.274 8.484 8.210 -0.000 0.000 0.418 91 M N -0.360 119.289 119.600 0.083 0.000 2.236 91 M HA -0.090 4.380 4.480 -0.017 0.000 0.266 91 M C 2.217 178.556 176.300 0.065 0.000 1.070 91 M CA 1.382 56.736 55.300 0.090 0.000 1.137 91 M CB -0.933 31.748 32.600 0.136 0.000 1.378 91 M HN 0.170 8.460 8.290 -0.000 0.000 0.426 92 E N 0.850 121.081 120.200 0.052 0.000 2.058 92 E HA -0.204 4.136 4.350 -0.017 0.000 0.194 92 E C 1.571 178.189 176.600 0.030 0.000 0.997 92 E CA 1.360 57.781 56.400 0.036 0.000 0.801 92 E CB -0.354 29.363 29.700 0.027 0.000 0.746 92 E HN 0.468 8.828 8.360 -0.000 0.000 0.450 93 D N 0.611 121.028 120.400 0.029 0.000 2.123 93 D HA -0.137 4.494 4.640 -0.017 0.000 0.196 93 D C 1.856 178.173 176.300 0.028 0.000 0.992 93 D CA 1.514 55.528 54.000 0.023 0.000 0.833 93 D CB -0.342 40.470 40.800 0.019 0.000 0.954 93 D HN 0.176 8.546 8.370 -0.000 0.000 0.455 94 A N 1.015 123.860 122.820 0.041 0.000 1.877 94 A HA -0.189 4.121 4.320 -0.017 0.000 0.216 94 A C 2.191 179.799 177.584 0.041 0.000 1.186 94 A CA 1.351 53.418 52.037 0.051 0.000 0.620 94 A CB -0.463 18.577 19.000 0.067 0.000 0.822 94 A HN 0.118 8.268 8.150 -0.000 0.000 0.443 95 R N -0.615 119.908 120.500 0.039 0.000 2.096 95 R HA -0.090 4.240 4.340 -0.017 0.000 0.235 95 R C 2.314 178.615 176.300 0.000 0.000 1.127 95 R CA 1.202 57.318 56.100 0.027 0.000 0.968 95 R CB -0.411 29.910 30.300 0.034 0.000 0.861 95 R HN 0.515 8.785 8.270 -0.000 0.000 0.440 96 A N 0.669 123.490 122.820 0.001 0.000 2.066 96 A HA 0.060 4.370 4.320 -0.017 0.000 0.218 96 A C 2.166 179.735 177.584 -0.025 0.000 1.157 96 A CA 1.247 53.276 52.037 -0.014 0.000 0.670 96 A CB -0.195 18.801 19.000 -0.006 0.000 0.804 96 A HN 0.369 8.519 8.150 -0.000 0.000 0.453 97 A N -1.210 121.603 122.820 -0.012 0.000 1.975 97 A HA 0.428 4.738 4.320 -0.017 0.000 0.215 97 A C 0.844 178.382 177.584 -0.077 0.000 1.170 97 A CA 1.293 53.322 52.037 -0.013 0.000 0.656 97 A CB -0.132 18.891 19.000 0.038 0.000 0.821 97 A HN 1.032 9.182 8.150 -0.000 0.000 0.449 98 V N -0.945 118.917 119.914 -0.086 0.000 2.777 98 V HA 0.642 4.752 4.120 -0.017 0.000 0.306 98 V C -0.510 175.503 176.094 -0.135 0.000 1.112 98 V CA -0.556 61.648 62.300 -0.159 0.000 0.917 98 V CB 1.409 33.141 31.823 -0.152 0.000 1.018 98 V HN 0.689 8.879 8.190 -0.000 0.000 0.426 99 A N 4.806 127.504 122.820 -0.203 0.000 2.388 99 A HA 0.745 5.055 4.320 -0.017 0.000 0.257 99 A C 0.322 177.737 177.584 -0.283 0.000 1.095 99 A CA 1.144 52.972 52.037 -0.349 0.000 0.791 99 A CB -0.359 18.343 19.000 -0.496 0.000 1.029 99 A HN 1.712 9.862 8.150 -0.000 0.000 0.489 100 H N -0.452 118.614 119.070 -0.006 0.000 1.452 100 H HA -0.221 4.325 4.556 -0.017 0.000 0.090 100 H C 0.704 176.069 175.328 0.061 0.000 2.770 100 H CA 0.344 56.405 56.048 0.022 0.000 1.901 100 H CB -1.450 28.319 29.762 0.012 0.000 2.257 100 H HN 1.515 9.795 8.280 -0.000 0.000 0.961 101 C N 0.322 119.770 119.300 0.247 0.000 4.167 101 C HA -0.201 4.249 4.460 -0.017 0.000 0.302 101 C C 2.171 177.262 174.990 0.168 0.000 1.384 101 C CA 1.253 60.378 59.018 0.178 0.000 2.041 101 C CB -3.013 24.810 27.740 0.140 0.000 1.303 101 C HN 0.974 9.204 8.230 -0.000 0.000 0.718 102 T N -2.286 112.396 114.554 0.213 0.000 2.962 102 T HA -0.138 4.202 4.350 -0.017 0.000 0.270 102 T C 1.187 175.980 174.700 0.154 0.000 1.088 102 T CA 1.817 64.040 62.100 0.204 0.000 1.127 102 T CB 0.022 69.076 68.868 0.311 0.000 0.883 102 T HN 0.734 8.974 8.240 -0.000 0.000 0.493 103 E N 2.287 122.571 120.200 0.141 0.000 2.072 103 E HA 0.206 4.546 4.350 -0.017 0.000 0.190 103 E C 2.596 179.248 176.600 0.087 0.000 0.982 103 E CA 1.077 57.534 56.400 0.096 0.000 0.803 103 E CB -0.819 28.933 29.700 0.087 0.000 0.755 103 E HN 0.627 8.987 8.360 -0.000 0.000 0.453 104 A N 1.492 124.371 122.820 0.100 0.000 1.883 104 A HA -0.292 4.018 4.320 -0.017 0.000 0.217 104 A C 1.969 179.606 177.584 0.089 0.000 1.186 104 A CA 2.016 54.108 52.037 0.091 0.000 0.624 104 A CB -0.469 18.595 19.000 0.106 0.000 0.822 104 A HN 0.111 8.261 8.150 -0.000 0.000 0.444 105 K N -0.331 120.129 120.400 0.101 0.000 2.057 105 K HA -0.023 4.287 4.320 -0.017 0.000 0.207 105 K C 2.286 178.945 176.600 0.098 0.000 1.049 105 K CA 1.161 57.508 56.287 0.100 0.000 0.931 105 K CB -0.351 32.214 32.500 0.107 0.000 0.714 105 K HN 0.450 8.700 8.250 -0.000 0.000 0.440 106 A N 1.431 124.309 122.820 0.096 0.000 1.902 106 A HA -0.143 4.167 4.320 -0.017 0.000 0.217 106 A C 2.374 180.003 177.584 0.074 0.000 1.181 106 A CA 1.908 54.000 52.037 0.091 0.000 0.623 106 A CB -0.799 18.244 19.000 0.072 0.000 0.818 106 A HN 0.335 8.485 8.150 -0.000 0.000 0.443 107 A N -0.544 122.308 122.820 0.054 0.000 1.902 107 A HA -0.020 4.290 4.320 -0.017 0.000 0.217 107 A C 2.135 179.723 177.584 0.007 0.000 1.181 107 A CA 1.759 53.813 52.037 0.028 0.000 0.623 107 A CB -0.594 18.418 19.000 0.020 0.000 0.818 107 A HN 0.714 8.864 8.150 -0.000 0.000 0.443 108 L N 0.198 121.428 121.223 0.013 0.000 2.027 108 L HA -0.130 4.200 4.340 -0.017 0.000 0.206 108 L C 1.880 178.738 176.870 -0.019 0.000 1.074 108 L CA 2.782 57.612 54.840 -0.016 0.000 0.745 108 L CB -0.853 41.227 42.059 0.036 0.000 0.898 108 L HN 0.413 8.643 8.230 -0.000 0.000 0.433 109 D N -1.358 119.081 120.400 0.064 0.000 2.123 109 D HA -0.186 4.444 4.640 -0.017 0.000 0.196 109 D C 1.963 178.390 176.300 0.212 0.000 0.992 109 D CA 1.717 55.812 54.000 0.159 0.000 0.833 109 D CB 0.009 40.972 40.800 0.272 0.000 0.954 109 D HN 0.408 8.778 8.370 -0.000 0.000 0.455 110 T N -0.420 114.231 114.554 0.162 0.000 2.708 110 T HA -0.121 4.219 4.350 -0.017 0.000 0.266 110 T C 1.923 176.676 174.700 0.088 0.000 1.037 110 T CA 1.586 63.777 62.100 0.152 0.000 1.146 110 T CB -0.493 68.422 68.868 0.079 0.000 0.865 110 T HN 0.245 8.485 8.240 -0.000 0.000 0.435 111 A N 0.989 123.811 122.820 0.003 0.000 1.933 111 A HA 0.041 4.351 4.320 -0.017 0.000 0.218 111 A C 2.300 179.815 177.584 -0.114 0.000 1.175 111 A CA 1.127 53.126 52.037 -0.064 0.000 0.628 111 A CB -0.783 18.135 19.000 -0.136 0.000 0.814 111 A HN 0.465 8.615 8.150 -0.000 0.000 0.444 112 L N -2.275 118.826 121.223 -0.204 0.000 2.027 112 L HA -0.186 4.144 4.340 -0.017 0.000 0.206 112 L C 2.568 179.283 176.870 -0.260 0.000 1.074 112 L CA 1.367 55.961 54.840 -0.410 0.000 0.745 112 L CB -0.661 40.799 42.059 -0.998 0.000 0.898 112 L HN 0.418 8.648 8.230 -0.000 0.000 0.433 113 Y N 0.181 120.474 120.300 -0.012 0.000 2.128 113 Y HA -0.318 4.222 4.550 -0.016 0.000 0.284 113 Y C 2.489 178.376 175.900 -0.021 0.000 1.154 113 Y CA 1.872 60.025 58.100 0.089 0.000 1.149 113 Y CB -0.497 38.031 38.460 0.113 0.000 0.976 113 Y HN 0.251 8.531 8.280 -0.000 0.000 0.505 114 D N -0.306 120.154 120.400 0.101 0.000 2.097 114 D HA -0.168 4.463 4.640 -0.017 0.000 0.195 114 D C 2.151 178.447 176.300 -0.007 0.000 0.989 114 D CA 0.917 54.928 54.000 0.018 0.000 0.827 114 D CB -0.366 40.451 40.800 0.027 0.000 0.966 114 D HN 0.193 8.563 8.370 -0.000 0.000 0.456 115 L N 0.936 122.138 121.223 -0.035 0.000 1.989 115 L HA -0.092 4.238 4.340 -0.017 0.000 0.211 115 L C 2.266 179.112 176.870 -0.039 0.000 1.071 115 L CA 1.789 56.594 54.840 -0.058 0.000 0.749 115 L CB -0.568 41.430 42.059 -0.101 0.000 0.890 115 L HN -0.028 8.202 8.230 -0.000 0.000 0.431 116 R N -0.528 119.955 120.500 -0.028 0.000 2.096 116 R HA -0.079 4.251 4.340 -0.017 0.000 0.235 116 R C 2.207 178.509 176.300 0.004 0.000 1.127 116 R CA 1.184 57.281 56.100 -0.005 0.000 0.968 116 R CB -0.688 29.624 30.300 0.021 0.000 0.861 116 R HN 0.541 8.811 8.270 -0.000 0.000 0.440 117 A N 1.433 124.259 122.820 0.010 0.000 1.898 117 A HA -0.152 4.158 4.320 -0.017 0.000 0.216 117 A C 2.123 179.678 177.584 -0.048 0.000 1.181 117 A CA 1.097 53.116 52.037 -0.030 0.000 0.620 117 A CB -0.319 18.640 19.000 -0.069 0.000 0.819 117 A HN 0.203 8.353 8.150 -0.000 0.000 0.442 118 R N -0.597 119.881 120.500 -0.037 0.000 2.075 118 R HA -0.025 4.305 4.340 -0.017 0.000 0.232 118 R C 1.992 178.277 176.300 -0.024 0.000 1.126 118 R CA 1.518 57.601 56.100 -0.030 0.000 0.963 118 R CB -0.488 29.802 30.300 -0.016 0.000 0.858 118 R HN 0.574 8.844 8.270 -0.000 0.000 0.435 119 I N 0.505 121.062 120.570 -0.022 0.000 2.226 119 I HA -0.258 3.902 4.170 -0.017 0.000 0.245 119 I C 2.446 178.552 176.117 -0.018 0.000 1.100 119 I CA 1.383 62.672 61.300 -0.019 0.000 1.374 119 I CB -0.306 37.683 38.000 -0.018 0.000 1.057 119 I HN 0.187 8.397 8.210 -0.000 0.000 0.413 120 A N 0.166 122.974 122.820 -0.020 0.000 2.119 120 A HA 0.217 4.527 4.320 -0.017 0.000 0.216 120 A C 1.845 179.411 177.584 -0.030 0.000 1.152 120 A CA 0.912 52.937 52.037 -0.021 0.000 0.708 120 A CB -0.608 18.380 19.000 -0.019 0.000 0.805 120 A HN 0.591 8.741 8.150 -0.000 0.000 0.460 121 G N -1.026 107.752 108.800 -0.038 0.000 2.182 121 G HA2 -0.009 3.941 3.960 -0.017 0.000 0.248 121 G HA3 -0.009 3.941 3.960 -0.017 0.000 0.248 121 G C 0.147 175.004 174.900 -0.072 0.000 1.042 121 G CA 0.646 45.719 45.100 -0.044 0.000 0.775 121 G HN 1.837 10.127 8.290 -0.000 0.000 0.501 122 V N -3.776 116.073 119.914 -0.107 0.000 3.040 122 V HA 0.989 5.099 4.120 -0.017 0.000 0.312 122 V C -2.430 173.501 176.094 -0.271 0.000 1.115 122 V CA -2.726 59.461 62.300 -0.189 0.000 0.998 122 V CB 2.395 34.108 31.823 -0.183 0.000 1.042 122 V HN 0.061 8.251 8.190 -0.000 0.000 0.433 123 P HA 0.272 4.692 4.420 -0.000 0.000 0.274 123 P C 1.030 178.002 177.300 -0.545 0.000 1.237 123 P CA -0.071 62.699 63.100 -0.551 0.000 0.793 123 P CB 1.168 32.282 31.700 -0.977 0.000 0.977 124 V N 1.618 121.226 119.914 -0.510 0.000 2.392 124 V HA -0.207 3.903 4.120 -0.017 0.000 0.249 124 V C 2.162 178.194 176.094 -0.103 0.000 1.059 124 V CA 1.923 64.023 62.300 -0.333 0.000 1.051 124 V CB -1.381 30.154 31.823 -0.480 0.000 0.658 124 V HN 0.723 8.913 8.190 -0.000 0.000 0.455 125 W N 0.444 121.883 121.300 0.232 0.000 2.421 125 W HA -0.032 4.618 4.660 -0.016 0.000 0.270 125 W C 2.135 178.693 176.519 0.065 0.000 1.233 125 W CA 0.728 58.158 57.345 0.143 0.000 1.226 125 W CB -0.965 28.589 29.460 0.157 0.000 1.121 125 W HN 0.287 8.467 8.180 -0.000 0.000 0.579 126 A N 1.707 124.481 122.820 -0.076 0.000 2.125 126 A HA -0.028 4.282 4.320 -0.017 0.000 0.219 126 A C 2.085 179.701 177.584 0.054 0.000 1.156 126 A CA 1.067 53.100 52.037 -0.006 0.000 0.671 126 A CB -0.808 18.011 19.000 -0.301 0.000 0.794 126 A HN 0.402 8.552 8.150 -0.000 0.000 0.459 127 L N -1.168 120.080 121.223 0.042 0.000 2.592 127 L HA 0.201 4.531 4.340 -0.017 0.000 0.227 127 L C 0.901 177.835 176.870 0.107 0.000 1.127 127 L CA 0.128 55.036 54.840 0.113 0.000 0.884 127 L CB 0.040 42.239 42.059 0.232 0.000 1.065 127 L HN 0.299 8.529 8.230 -0.000 0.000 0.457 128 L N -0.758 120.504 121.223 0.064 0.000 3.014 128 L HA 0.415 4.745 4.340 -0.017 0.000 0.263 128 L C 1.077 177.996 176.870 0.083 0.000 1.207 128 L CA 0.262 55.117 54.840 0.025 0.000 1.017 128 L CB 0.591 42.625 42.059 -0.041 0.000 1.360 128 L HN 0.282 8.512 8.230 -0.000 0.000 0.560 129 G N -0.917 107.953 108.800 0.117 0.000 2.205 129 G HA2 0.040 3.990 3.960 -0.017 0.000 0.180 129 G HA3 0.040 3.990 3.960 -0.017 0.000 0.180 129 G C 0.571 175.556 174.900 0.141 0.000 1.004 129 G CA -0.245 44.919 45.100 0.107 0.000 0.670 129 G HN 0.761 9.051 8.290 -0.000 0.000 0.496 130 G N -0.662 108.285 108.800 0.246 0.000 2.698 130 G HA2 0.130 4.080 3.960 -0.017 0.000 0.225 130 G HA3 0.130 4.080 3.960 -0.017 0.000 0.225 130 G C -0.348 174.649 174.900 0.162 0.000 1.345 130 G CA 0.429 45.733 45.100 0.339 0.000 0.871 130 G HN 1.067 9.357 8.290 -0.000 0.000 0.540 131 R N -0.886 119.532 120.500 -0.136 0.000 2.532 131 R HA 0.582 4.912 4.340 -0.017 0.000 0.295 131 R C 1.470 177.614 176.300 -0.260 0.000 0.968 131 R CA -0.195 55.619 56.100 -0.477 0.000 0.916 131 R CB 0.760 30.372 30.300 -1.146 0.000 1.124 131 R HN 1.303 9.573 8.270 -0.000 0.000 0.463 132 C N 2.383 121.556 119.300 -0.211 0.000 3.228 132 C HA 0.443 4.893 4.460 -0.017 0.000 0.290 132 C C 0.100 175.001 174.990 -0.149 0.000 1.301 132 C CA -0.669 58.265 59.018 -0.139 0.000 1.703 132 C CB -0.652 27.042 27.740 -0.077 0.000 2.141 132 C HN 0.849 9.079 8.230 -0.000 0.000 0.656 133 R N 0.468 120.844 120.500 -0.207 0.000 2.663 133 R HA 0.489 4.819 4.340 -0.017 0.000 0.267 133 R C -1.164 174.996 176.300 -0.233 0.000 1.038 133 R CA 0.186 56.186 56.100 -0.168 0.000 0.886 133 R CB 0.595 30.838 30.300 -0.095 0.000 1.249 133 R HN 0.137 8.407 8.270 -0.000 0.000 0.463 134 D N 0.820 121.114 120.400 -0.178 0.000 2.433 134 D HA 0.178 4.808 4.640 -0.017 0.000 0.211 134 D C -0.243 175.998 176.300 -0.098 0.000 1.114 134 D CA -0.177 53.718 54.000 -0.175 0.000 0.837 134 D CB 0.534 41.245 40.800 -0.149 0.000 0.984 134 D HN 0.465 8.835 8.370 -0.000 0.000 0.505 135 R N -0.198 120.270 120.500 -0.053 0.000 2.698 135 R HA 0.696 5.026 4.340 -0.017 0.000 0.275 135 R C -1.003 175.351 176.300 0.091 0.000 1.001 135 R CA -0.719 55.396 56.100 0.026 0.000 0.896 135 R CB 2.415 32.724 30.300 0.015 0.000 1.218 135 R HN -0.064 8.207 8.270 -0.000 0.000 0.462 136 I N 2.171 122.817 120.570 0.127 0.000 2.478 136 I HA 0.336 4.496 4.170 -0.017 0.000 0.287 136 I C -2.430 173.663 176.117 -0.039 0.000 1.042 136 I CA -2.596 58.743 61.300 0.064 0.000 1.067 136 I CB 2.323 40.351 38.000 0.046 0.000 1.233 136 I HN 0.221 8.431 8.210 -0.000 0.000 0.431 137 P HA 0.039 4.459 4.420 -0.000 0.000 0.265 137 P C -0.818 176.335 177.300 -0.246 0.000 1.193 137 P CA -0.139 62.671 63.100 -0.484 0.000 0.765 137 P CB 0.546 32.057 31.700 -0.315 0.000 0.823 138 L N 3.240 124.330 121.223 -0.221 0.000 2.309 138 L HA 0.566 4.896 4.340 -0.017 0.000 0.282 138 L C -0.031 176.810 176.870 -0.049 0.000 1.036 138 L CA -0.065 54.734 54.840 -0.069 0.000 0.806 138 L CB 1.482 43.567 42.059 0.043 0.000 1.220 138 L HN 0.213 8.443 8.230 -0.000 0.000 0.429 139 S N 4.187 119.881 115.700 -0.010 0.000 2.509 139 S HA 0.581 5.041 4.470 -0.017 0.000 0.297 139 S C -0.818 173.751 174.600 -0.053 0.000 1.118 139 S CA -0.596 57.596 58.200 -0.013 0.000 1.074 139 S CB 0.865 64.098 63.200 0.055 0.000 1.038 139 S HN 0.878 9.188 8.310 -0.000 0.000 0.498 140 C N 3.826 122.996 119.300 -0.215 0.000 2.382 140 C HA 0.769 5.219 4.460 -0.017 0.000 0.327 140 C C 0.445 175.043 174.990 -0.652 0.000 1.250 140 C CA -0.389 58.264 59.018 -0.607 0.000 1.707 140 C CB 0.622 28.032 27.740 -0.550 0.000 2.272 140 C HN 0.943 9.173 8.230 -0.000 0.000 0.506 141 S N 4.635 119.708 115.700 -1.046 0.000 2.584 141 S HA 0.559 5.019 4.470 -0.017 0.000 0.273 141 S C -0.383 173.991 174.600 -0.376 0.000 1.311 141 S CA -0.327 57.567 58.200 -0.510 0.000 1.034 141 S CB 0.568 63.604 63.200 -0.272 0.000 0.939 141 S HN 0.602 8.912 8.310 -0.000 0.000 0.513 142 I N 2.457 122.901 120.570 -0.211 0.000 2.437 142 I HA 0.399 4.559 4.170 -0.017 0.000 0.279 142 I C 0.402 176.502 176.117 -0.027 0.000 1.028 142 I CA -0.339 60.879 61.300 -0.137 0.000 1.142 142 I CB 0.488 38.400 38.000 -0.146 0.000 1.266 142 I HN 0.796 9.006 8.210 -0.000 0.000 0.461 143 A N 4.092 126.904 122.820 -0.013 0.000 2.674 143 A HA 0.182 4.492 4.320 -0.017 0.000 0.274 143 A C 0.261 177.816 177.584 -0.048 0.000 1.065 143 A CA -0.295 51.728 52.037 -0.024 0.000 0.978 143 A CB 0.189 19.073 19.000 -0.194 0.000 1.242 143 A HN 0.536 8.686 8.150 -0.000 0.000 0.583 144 D N 1.163 121.626 120.400 0.105 0.000 2.304 144 D HA 0.241 4.872 4.640 -0.017 0.000 0.250 144 D C -1.544 174.954 176.300 0.329 0.000 1.107 144 D CA -1.375 52.697 54.000 0.120 0.000 0.885 144 D CB 1.814 42.687 40.800 0.120 0.000 1.192 144 D HN 0.029 8.399 8.370 -0.000 0.000 0.436 145 P HA -0.063 4.357 4.420 -0.000 0.000 0.223 145 P C 0.162 177.618 177.300 0.260 0.000 1.151 145 P CA 0.632 63.910 63.100 0.297 0.000 0.787 145 P CB 0.341 32.117 31.700 0.127 0.000 0.788 146 D N -0.502 120.039 120.400 0.235 0.000 2.456 146 D HA 0.035 4.665 4.640 -0.017 0.000 0.219 146 D C 0.470 176.945 176.300 0.291 0.000 1.126 146 D CA -0.866 53.268 54.000 0.224 0.000 0.890 146 D CB -0.203 40.669 40.800 0.120 0.000 1.025 146 D HN -0.183 8.187 8.370 -0.000 0.000 0.511 147 F N 3.116 123.195 119.950 0.214 0.000 2.365 147 F HA -0.104 4.413 4.527 -0.016 0.000 0.300 147 F C 1.438 177.254 175.800 0.026 0.000 1.090 147 F CA 0.973 59.033 58.000 0.100 0.000 1.408 147 F CB 0.227 39.243 39.000 0.027 0.000 1.060 147 F HN 0.317 8.617 8.300 -0.000 0.000 0.534 148 D N 0.402 120.791 120.400 -0.019 0.000 2.144 148 D HA -0.168 4.462 4.640 -0.017 0.000 0.199 148 D C 2.140 178.357 176.300 -0.137 0.000 0.984 148 D CA 1.175 55.097 54.000 -0.129 0.000 0.834 148 D CB -0.195 40.591 40.800 -0.024 0.000 0.955 148 D HN 0.354 8.724 8.370 -0.000 0.000 0.465 149 K N 0.415 120.781 120.400 -0.057 0.000 2.057 149 K HA -0.118 4.192 4.320 -0.017 0.000 0.207 149 K C 1.509 178.044 176.600 -0.108 0.000 1.049 149 K CA 0.985 57.244 56.287 -0.047 0.000 0.931 149 K CB 0.069 32.577 32.500 0.013 0.000 0.714 149 K HN 0.046 8.296 8.250 -0.000 0.000 0.440 150 D N 0.912 121.220 120.400 -0.152 0.000 2.183 150 D HA -0.048 4.582 4.640 -0.017 0.000 0.203 150 D C 1.876 177.931 176.300 -0.409 0.000 0.969 150 D CA 0.676 54.542 54.000 -0.223 0.000 0.842 150 D CB -0.020 40.727 40.800 -0.088 0.000 0.957 150 D HN 0.094 8.464 8.370 -0.000 0.000 0.484 151 L N 0.589 121.467 121.223 -0.573 0.000 2.083 151 L HA -0.162 4.168 4.340 -0.017 0.000 0.209 151 L C 2.445 179.157 176.870 -0.263 0.000 1.083 151 L CA 1.051 55.594 54.840 -0.494 0.000 0.752 151 L CB -0.316 41.451 42.059 -0.486 0.000 0.899 151 L HN -0.014 8.216 8.230 -0.000 0.000 0.433 152 A N -0.066 122.639 122.820 -0.192 0.000 1.873 152 A HA -0.218 4.092 4.320 -0.017 0.000 0.215 152 A C 2.181 179.694 177.584 -0.120 0.000 1.186 152 A CA 1.514 53.488 52.037 -0.106 0.000 0.616 152 A CB -0.700 18.262 19.000 -0.063 0.000 0.823 152 A HN 0.307 8.457 8.150 -0.000 0.000 0.442 153 L N -0.719 120.409 121.223 -0.158 0.000 2.079 153 L HA -0.180 4.150 4.340 -0.017 0.000 0.210 153 L C 2.332 179.033 176.870 -0.281 0.000 1.081 153 L CA 1.993 56.727 54.840 -0.177 0.000 0.752 153 L CB -0.502 41.446 42.059 -0.185 0.000 0.896 153 L HN 0.312 8.542 8.230 -0.000 0.000 0.433 154 M N -1.224 118.115 119.600 -0.435 0.000 2.159 154 M HA -0.212 4.258 4.480 -0.017 0.000 0.263 154 M C 2.321 178.347 176.300 -0.457 0.000 1.063 154 M CA 1.626 56.479 55.300 -0.745 0.000 1.110 154 M CB -1.157 30.583 32.600 -1.434 0.000 1.374 154 M HN 0.403 8.693 8.290 -0.000 0.000 0.411 155 Q N 0.405 120.106 119.800 -0.165 0.000 2.119 155 Q HA -0.114 4.216 4.340 -0.017 0.000 0.201 155 Q C 2.056 178.092 176.000 0.059 0.000 0.972 155 Q CA 1.702 57.550 55.803 0.075 0.000 0.847 155 Q CB -0.308 28.491 28.738 0.101 0.000 0.903 155 Q HN 0.431 8.701 8.270 -0.000 0.000 0.433 156 R N -0.583 119.924 120.500 0.012 0.000 2.083 156 R HA -0.111 4.219 4.340 -0.017 0.000 0.237 156 R C 2.170 178.519 176.300 0.081 0.000 1.137 156 R CA 1.532 57.669 56.100 0.062 0.000 0.951 156 R CB -0.345 29.997 30.300 0.070 0.000 0.851 156 R HN 0.358 8.628 8.270 -0.000 0.000 0.434 157 L N 0.378 121.595 121.223 -0.010 0.000 2.046 157 L HA -0.203 4.127 4.340 -0.017 0.000 0.208 157 L C 2.850 179.831 176.870 0.185 0.000 1.077 157 L CA 1.580 56.439 54.840 0.032 0.000 0.747 157 L CB -0.524 41.499 42.059 -0.060 0.000 0.896 157 L HN 0.418 8.648 8.230 -0.000 0.000 0.432 158 Q N 0.124 120.076 119.800 0.253 0.000 2.084 158 Q HA -0.245 4.085 4.340 -0.017 0.000 0.202 158 Q C 1.716 177.817 176.000 0.168 0.000 0.978 158 Q CA 1.929 57.915 55.803 0.304 0.000 0.844 158 Q CB 0.090 29.074 28.738 0.410 0.000 0.898 158 Q HN 0.437 8.707 8.270 -0.000 0.000 0.426 159 D N 0.642 121.127 120.400 0.143 0.000 2.149 159 D HA -0.138 4.492 4.640 -0.017 0.000 0.198 159 D C 0.874 177.236 176.300 0.103 0.000 0.990 159 D CA 1.113 55.178 54.000 0.108 0.000 0.839 159 D CB -0.192 40.666 40.800 0.098 0.000 0.948 159 D HN 0.329 8.699 8.370 -0.000 0.000 0.460 160 D N 0.481 120.958 120.400 0.129 0.000 2.340 160 D HA -0.031 4.599 4.640 -0.017 0.000 0.220 160 D C -0.016 176.349 176.300 0.108 0.000 1.039 160 D CA 0.170 54.252 54.000 0.137 0.000 0.866 160 D CB 0.149 41.085 40.800 0.228 0.000 0.913 160 D HN 0.070 8.440 8.370 -0.000 0.000 0.523 161 D N -0.495 119.950 120.400 0.075 0.000 3.041 161 D HA -0.150 4.480 4.640 -0.017 0.000 0.220 161 D C -0.236 176.056 176.300 -0.014 0.000 1.157 161 D CA 0.280 54.296 54.000 0.026 0.000 0.876 161 D CB -1.439 39.385 40.800 0.040 0.000 1.107 161 D HN 0.141 8.511 8.370 -0.000 0.000 0.422 162 V N 0.926 120.838 119.914 -0.004 0.000 2.614 162 V HA 0.179 4.289 4.120 -0.017 0.000 0.291 162 V C 1.531 177.426 176.094 -0.332 0.000 1.049 162 V CA 0.363 62.627 62.300 -0.061 0.000 1.038 162 V CB 1.711 33.555 31.823 0.035 0.000 0.980 162 V HN 0.043 8.233 8.190 -0.000 0.000 0.481 163 R N 4.085 124.334 120.500 -0.419 0.000 2.600 163 R HA 0.457 4.787 4.340 -0.017 0.000 0.392 163 R C -0.666 175.353 176.300 -0.468 0.000 1.032 163 R CA 0.080 55.700 56.100 -0.801 0.000 1.139 163 R CB 0.586 30.585 30.300 -0.502 0.000 1.400 163 R HN 0.593 8.863 8.270 -0.000 0.000 0.566 164 I N 1.723 122.193 120.570 -0.166 0.000 2.533 164 I HA 0.478 4.638 4.170 -0.017 0.000 0.290 164 I C -0.077 176.084 176.117 0.073 0.000 1.056 164 I CA -1.200 60.089 61.300 -0.017 0.000 1.057 164 I CB 2.295 40.252 38.000 -0.070 0.000 1.240 164 I HN -0.117 8.093 8.210 -0.000 0.000 0.423 165 I N 1.731 122.334 120.570 0.055 0.000 2.892 165 I HA 0.638 4.798 4.170 -0.017 0.000 0.306 165 I C -0.929 175.099 176.117 -0.150 0.000 1.078 165 I CA -0.926 60.323 61.300 -0.085 0.000 1.032 165 I CB 2.269 40.173 38.000 -0.159 0.000 1.229 165 I HN 0.477 8.687 8.210 -0.000 0.000 0.435 166 K N 3.667 123.965 120.400 -0.169 0.000 2.425 166 K HA 0.488 4.798 4.320 -0.017 0.000 0.259 166 K C -1.462 175.055 176.600 -0.139 0.000 0.978 166 K CA -0.770 55.424 56.287 -0.155 0.000 0.883 166 K CB 1.641 34.097 32.500 -0.072 0.000 1.110 166 K HN 0.692 8.942 8.250 -0.000 0.000 0.436 167 L N 4.783 125.913 121.223 -0.154 0.000 2.361 167 L HA 0.204 4.534 4.340 -0.017 0.000 0.278 167 L C -0.578 176.239 176.870 -0.088 0.000 1.113 167 L CA 0.317 55.073 54.840 -0.141 0.000 0.849 167 L CB 0.346 42.281 42.059 -0.207 0.000 1.155 167 L HN 0.441 8.671 8.230 -0.000 0.000 0.452 168 K N 3.880 124.287 120.400 0.012 0.000 2.258 168 K HA 0.408 4.718 4.320 -0.017 0.000 0.284 168 K C -0.087 176.603 176.600 0.150 0.000 1.051 168 K CA -0.146 56.217 56.287 0.127 0.000 0.923 168 K CB 0.874 33.492 32.500 0.197 0.000 1.046 168 K HN 0.790 9.040 8.250 -0.000 0.000 0.474 169 T N -2.790 111.756 114.554 -0.013 0.000 2.907 169 T HA 0.613 4.953 4.350 -0.017 0.000 0.290 169 T C 0.762 175.496 174.700 0.056 0.000 1.066 169 T CA -0.265 61.714 62.100 -0.202 0.000 1.012 169 T CB 1.966 70.419 68.868 -0.691 0.000 1.184 169 T HN 0.641 8.881 8.240 -0.000 0.000 0.522 170 G N 0.455 109.331 108.800 0.127 0.000 2.136 170 G HA2 -0.250 3.700 3.960 -0.017 0.000 0.242 170 G HA3 -0.250 3.700 3.960 -0.017 0.000 0.242 170 G C 0.182 175.236 174.900 0.258 0.000 0.989 170 G CA 0.511 45.814 45.100 0.338 0.000 0.682 170 G HN 1.311 9.601 8.290 -0.000 0.000 0.522 171 F N -1.541 118.513 119.950 0.173 0.000 2.727 171 F HA 0.603 5.121 4.527 -0.015 0.000 0.302 171 F C 1.703 177.534 175.800 0.051 0.000 1.107 171 F CA 0.307 58.377 58.000 0.117 0.000 1.277 171 F CB 0.077 39.140 39.000 0.105 0.000 1.079 171 F HN 0.155 8.455 8.300 -0.000 0.000 0.594 172 K N 0.480 120.661 120.400 -0.364 0.000 3.038 172 K HA 0.220 4.530 4.320 -0.017 0.000 0.232 172 K C -0.739 175.785 176.600 -0.128 0.000 1.124 172 K CA 0.481 56.600 56.287 -0.281 0.000 1.232 172 K CB 0.046 32.134 32.500 -0.686 0.000 1.767 172 K HN 0.319 8.569 8.250 -0.000 0.000 0.463 173 D N -2.102 118.239 120.400 -0.098 0.000 2.570 173 D HA 0.093 4.723 4.640 -0.017 0.000 0.244 173 D C 0.372 176.723 176.300 0.085 0.000 1.178 173 D CA -0.578 53.431 54.000 0.014 0.000 0.881 173 D CB 0.867 41.673 40.800 0.011 0.000 1.453 173 D HN 0.200 8.570 8.370 -0.000 0.000 0.447 174 H N 0.631 119.713 119.070 0.019 0.000 2.387 174 H HA -0.005 4.539 4.556 -0.019 0.000 0.299 174 H C 1.957 177.297 175.328 0.020 0.000 1.099 174 H CA 2.701 58.769 56.048 0.034 0.000 1.315 174 H CB -0.305 29.480 29.762 0.038 0.000 1.380 174 H HN 0.505 8.785 8.280 -0.000 0.000 0.513 175 A N -0.090 122.709 122.820 -0.036 0.000 1.940 175 A HA -0.191 4.119 4.320 -0.017 0.000 0.219 175 A C 2.334 179.855 177.584 -0.106 0.000 1.176 175 A CA 1.593 53.572 52.037 -0.098 0.000 0.631 175 A CB -1.250 17.742 19.000 -0.013 0.000 0.814 175 A HN 0.560 8.710 8.150 -0.000 0.000 0.446 176 F N 1.196 121.011 119.950 -0.225 0.000 2.186 176 F HA -0.134 4.384 4.527 -0.016 0.000 0.299 176 F C 1.740 177.316 175.800 -0.374 0.000 1.090 176 F CA 1.835 59.665 58.000 -0.283 0.000 1.307 176 F CB -0.155 38.677 39.000 -0.279 0.000 1.019 176 F HN 0.239 8.539 8.300 -0.000 0.000 0.489 177 D N 0.064 120.282 120.400 -0.303 0.000 2.097 177 D HA -0.183 4.447 4.640 -0.017 0.000 0.195 177 D C 2.393 178.409 176.300 -0.473 0.000 0.989 177 D CA 1.439 55.192 54.000 -0.411 0.000 0.827 177 D CB -0.350 40.330 40.800 -0.199 0.000 0.966 177 D HN 0.241 8.611 8.370 -0.000 0.000 0.456 178 M N 0.132 119.474 119.600 -0.430 0.000 2.175 178 M HA -0.072 4.398 4.480 -0.017 0.000 0.264 178 M C 2.145 178.210 176.300 -0.393 0.000 1.063 178 M CA 0.775 55.869 55.300 -0.343 0.000 1.119 178 M CB -0.794 31.654 32.600 -0.254 0.000 1.377 178 M HN 0.101 8.391 8.290 -0.000 0.000 0.415 179 M N 0.484 119.849 119.600 -0.392 0.000 2.117 179 M HA -0.203 4.267 4.480 -0.017 0.000 0.262 179 M C 2.031 177.987 176.300 -0.575 0.000 1.065 179 M CA 1.822 56.890 55.300 -0.386 0.000 1.114 179 M CB -0.563 31.839 32.600 -0.331 0.000 1.361 179 M HN 0.210 8.500 8.290 -0.000 0.000 0.408 180 R N -0.075 119.899 120.500 -0.876 0.000 2.066 180 R HA -0.089 4.241 4.340 -0.017 0.000 0.232 180 R C 2.359 178.256 176.300 -0.671 0.000 1.131 180 R CA 1.474 56.917 56.100 -1.095 0.000 0.955 180 R CB -0.582 28.895 30.300 -1.373 0.000 0.851 180 R HN 0.401 8.671 8.270 -0.000 0.000 0.432 181 L N 0.631 121.423 121.223 -0.718 0.000 2.042 181 L HA -0.209 4.121 4.340 -0.017 0.000 0.210 181 L C 2.628 178.964 176.870 -0.889 0.000 1.076 181 L CA 1.481 55.810 54.840 -0.851 0.000 0.749 181 L CB -0.419 40.894 42.059 -1.243 0.000 0.893 181 L HN 0.293 8.523 8.230 -0.000 0.000 0.432 182 E N 0.185 119.889 120.200 -0.827 0.000 2.051 182 E HA -0.290 4.050 4.350 -0.017 0.000 0.192 182 E C 2.313 178.819 176.600 -0.156 0.000 0.991 182 E CA 1.179 57.373 56.400 -0.343 0.000 0.799 182 E CB 0.082 29.719 29.700 -0.104 0.000 0.748 182 E HN 0.162 8.522 8.360 -0.000 0.000 0.449 183 R N 0.422 120.834 120.500 -0.147 0.000 2.075 183 R HA -0.063 4.267 4.340 -0.017 0.000 0.232 183 R C 2.317 178.653 176.300 0.060 0.000 1.126 183 R CA 1.296 57.399 56.100 0.005 0.000 0.963 183 R CB -0.438 29.943 30.300 0.134 0.000 0.858 183 R HN 0.252 8.522 8.270 -0.000 0.000 0.435 184 L N -0.066 121.173 121.223 0.026 0.000 2.093 184 L HA -0.103 4.227 4.340 -0.017 0.000 0.208 184 L C 2.445 179.350 176.870 0.058 0.000 1.085 184 L CA 1.020 55.903 54.840 0.071 0.000 0.755 184 L CB -0.395 41.626 42.059 -0.064 0.000 0.904 184 L HN 0.091 8.321 8.230 -0.000 0.000 0.435 185 R N 0.197 120.686 120.500 -0.018 0.000 2.115 185 R HA -0.032 4.298 4.340 -0.017 0.000 0.230 185 R C 2.252 178.576 176.300 0.041 0.000 1.111 185 R CA 1.360 57.480 56.100 0.034 0.000 0.976 185 R CB -0.747 29.594 30.300 0.069 0.000 0.870 185 R HN 0.365 8.635 8.270 -0.000 0.000 0.445 186 A N 0.945 123.776 122.820 0.018 0.000 1.874 186 A HA -0.105 4.205 4.320 -0.017 0.000 0.214 186 A C 1.465 179.013 177.584 -0.060 0.000 1.189 186 A CA 1.516 53.549 52.037 -0.006 0.000 0.615 186 A CB -0.126 18.870 19.000 -0.007 0.000 0.830 186 A HN 0.116 8.266 8.150 -0.000 0.000 0.443 187 D N -1.806 118.539 120.400 -0.092 0.000 2.277 187 D HA 0.139 4.769 4.640 -0.017 0.000 0.209 187 D C -0.296 175.627 176.300 -0.629 0.000 0.970 187 D CA 0.730 54.523 54.000 -0.346 0.000 0.874 187 D CB 0.061 40.655 40.800 -0.343 0.000 0.982 187 D HN 0.399 8.769 8.370 -0.000 0.000 0.504 188 F N 0.634 120.558 119.950 -0.043 0.000 2.597 188 F HA 0.266 4.782 4.527 -0.018 0.000 0.336 188 F C -1.612 174.256 175.800 0.114 0.000 1.432 188 F CA -1.550 56.453 58.000 0.004 0.000 1.120 188 F CB 1.487 40.344 39.000 -0.239 0.000 1.253 188 F HN -0.144 8.156 8.300 -0.000 0.000 0.546 189 P HA -0.152 4.268 4.420 -0.000 0.000 0.222 189 P C 1.343 178.735 177.300 0.154 0.000 1.147 189 P CA 1.079 64.259 63.100 0.132 0.000 0.790 189 P CB 0.310 32.046 31.700 0.059 0.000 0.780 190 A N -1.383 121.556 122.820 0.198 0.000 2.208 190 A HA 0.082 4.392 4.320 -0.017 0.000 0.209 190 A C 0.712 178.325 177.584 0.048 0.000 1.161 190 A CA -0.035 52.061 52.037 0.097 0.000 0.782 190 A CB -1.048 17.976 19.000 0.040 0.000 0.816 190 A HN 0.032 8.182 8.150 -0.000 0.000 0.477 191 F N 0.847 120.816 119.950 0.032 0.000 2.412 191 F HA 0.279 4.795 4.527 -0.018 0.000 0.348 191 F C 0.576 176.351 175.800 -0.042 0.000 1.102 191 F CA -0.970 57.022 58.000 -0.013 0.000 1.196 191 F CB 0.642 39.626 39.000 -0.027 0.000 1.144 191 F HN 0.072 8.372 8.300 -0.000 0.000 0.541 192 D N 4.526 124.954 120.400 0.047 0.000 2.325 192 D HA 0.219 4.849 4.640 -0.017 0.000 0.251 192 D C -0.500 175.788 176.300 -0.021 0.000 1.196 192 D CA 0.027 54.018 54.000 -0.015 0.000 0.866 192 D CB 0.321 41.080 40.800 -0.070 0.000 1.101 192 D HN 0.340 8.710 8.370 -0.000 0.000 0.476 193 I N 4.109 124.641 120.570 -0.063 0.000 2.354 193 I HA 0.343 4.503 4.170 -0.017 0.000 0.292 193 I C 0.401 176.369 176.117 -0.248 0.000 0.989 193 I CA -0.883 60.344 61.300 -0.122 0.000 1.188 193 I CB 1.288 39.232 38.000 -0.094 0.000 1.342 193 I HN 0.126 8.336 8.210 -0.000 0.000 0.457 194 R N 4.106 124.394 120.500 -0.353 0.000 2.828 194 R HA 0.776 5.106 4.340 -0.017 0.000 0.264 194 R C -1.145 174.964 176.300 -0.318 0.000 1.022 194 R CA -0.776 54.987 56.100 -0.562 0.000 1.021 194 R CB 1.834 31.489 30.300 -1.075 0.000 1.163 194 R HN 0.305 8.575 8.270 -0.000 0.000 0.494 195 V N 0.814 120.591 119.914 -0.228 0.000 2.656 195 V HA 0.396 4.506 4.120 -0.017 0.000 0.307 195 V C -1.214 174.871 176.094 -0.014 0.000 1.051 195 V CA -0.659 61.558 62.300 -0.138 0.000 0.893 195 V CB 2.056 33.798 31.823 -0.134 0.000 0.999 195 V HN 0.665 8.855 8.190 -0.000 0.000 0.426 196 D N 1.857 122.237 120.400 -0.034 0.000 2.696 196 D HA 0.359 4.989 4.640 -0.017 0.000 0.251 196 D C -0.308 176.024 176.300 0.053 0.000 1.188 196 D CA -0.333 53.724 54.000 0.095 0.000 0.876 196 D CB 1.603 42.511 40.800 0.179 0.000 1.334 196 D HN 0.459 8.829 8.370 -0.000 0.000 0.540 197 Y N 2.456 122.852 120.300 0.160 0.000 2.523 197 Y HA 0.142 4.681 4.550 -0.019 0.000 0.279 197 Y C 0.947 176.960 175.900 0.188 0.000 1.139 197 Y CA 0.066 58.263 58.100 0.162 0.000 1.296 197 Y CB -0.044 38.480 38.460 0.107 0.000 1.045 197 Y HN 0.492 8.772 8.280 -0.000 0.000 0.538 198 N N 1.645 120.532 118.700 0.312 0.000 2.714 198 N HA -0.327 4.403 4.740 -0.017 0.000 0.252 198 N C -0.408 175.190 175.510 0.147 0.000 1.014 198 N CA 0.853 54.051 53.050 0.247 0.000 0.735 198 N CB -0.919 37.796 38.487 0.381 0.000 0.924 198 N HN 0.436 8.816 8.380 -0.000 0.000 0.540 199 Q N -4.687 115.177 119.800 0.105 0.000 2.460 199 Q HA -0.239 4.091 4.340 -0.017 0.000 0.248 199 Q C 1.228 177.266 176.000 0.063 0.000 0.847 199 Q CA 0.826 56.644 55.803 0.026 0.000 1.214 199 Q CB -1.832 26.869 28.738 -0.061 0.000 1.523 199 Q HN 0.693 8.963 8.270 -0.000 0.000 0.602 200 G N -0.024 108.876 108.800 0.167 0.000 2.650 200 G HA2 0.176 4.126 3.960 -0.017 0.000 0.214 200 G HA3 0.176 4.126 3.960 -0.017 0.000 0.214 200 G C 0.489 175.448 174.900 0.100 0.000 1.136 200 G CA -0.070 45.143 45.100 0.189 0.000 0.789 200 G HN 0.187 8.477 8.290 -0.000 0.000 0.536 201 L N 1.404 122.607 121.223 -0.033 0.000 2.265 201 L HA 0.273 4.603 4.340 -0.017 0.000 0.288 201 L C 0.438 177.278 176.870 -0.050 0.000 1.058 201 L CA -1.020 53.753 54.840 -0.112 0.000 0.809 201 L CB 1.033 42.887 42.059 -0.343 0.000 1.179 201 L HN 0.161 8.391 8.230 -0.000 0.000 0.429 202 H N 4.086 123.096 119.070 -0.100 0.000 2.897 202 H HA -0.037 4.509 4.556 -0.017 0.000 0.347 202 H C 1.156 176.387 175.328 -0.161 0.000 1.068 202 H CA 0.182 56.146 56.048 -0.140 0.000 1.426 202 H CB 0.926 30.571 29.762 -0.196 0.000 1.410 202 H HN 0.711 8.991 8.280 -0.000 0.000 0.597 203 H N 3.090 121.955 119.070 -0.341 0.000 2.460 203 H HA -0.152 4.394 4.556 -0.017 0.000 0.297 203 H C 0.633 175.983 175.328 0.037 0.000 1.103 203 H CA 1.130 57.083 56.048 -0.157 0.000 1.292 203 H CB -0.010 29.624 29.762 -0.214 0.000 1.376 203 H HN 0.545 8.825 8.280 -0.000 0.000 0.531 204 D N 1.194 121.628 120.400 0.057 0.000 2.221 204 D HA -0.099 4.531 4.640 -0.017 0.000 0.204 204 D C 2.070 178.369 176.300 -0.001 0.000 0.982 204 D CA 1.858 55.886 54.000 0.048 0.000 0.857 204 D CB 0.078 40.853 40.800 -0.041 0.000 0.934 204 D HN 0.584 8.954 8.370 -0.000 0.000 0.475 205 V N -4.081 115.821 119.914 -0.021 0.000 3.398 205 V HA 0.518 4.628 4.120 -0.017 0.000 0.298 205 V C 1.810 177.839 176.094 -0.108 0.000 1.496 205 V CA 0.360 62.616 62.300 -0.073 0.000 1.044 205 V CB 0.275 32.041 31.823 -0.094 0.000 0.880 205 V HN 0.007 8.197 8.190 -0.000 0.000 0.443 206 A N 1.611 124.373 122.820 -0.096 0.000 1.865 206 A HA -0.132 4.178 4.320 -0.017 0.000 0.217 206 A C 2.041 179.544 177.584 -0.136 0.000 1.191 206 A CA 2.405 54.350 52.037 -0.153 0.000 0.623 206 A CB -0.582 18.341 19.000 -0.128 0.000 0.826 206 A HN 0.620 8.770 8.150 -0.000 0.000 0.444 207 L N -0.236 120.938 121.223 -0.082 0.000 2.046 207 L HA -0.060 4.270 4.340 -0.017 0.000 0.208 207 L C 2.653 179.486 176.870 -0.061 0.000 1.077 207 L CA 2.312 57.116 54.840 -0.059 0.000 0.747 207 L CB -0.864 41.173 42.059 -0.036 0.000 0.896 207 L HN 0.352 8.582 8.230 -0.000 0.000 0.432 208 A N -0.354 122.420 122.820 -0.076 0.000 1.908 208 A HA -0.217 4.093 4.320 -0.017 0.000 0.218 208 A C 2.435 179.949 177.584 -0.117 0.000 1.181 208 A CA 1.906 53.893 52.037 -0.083 0.000 0.627 208 A CB -0.533 18.411 19.000 -0.093 0.000 0.818 208 A HN 0.533 8.683 8.150 -0.000 0.000 0.445 209 R N -0.870 119.515 120.500 -0.191 0.000 2.090 209 R HA -0.017 4.313 4.340 -0.017 0.000 0.228 209 R C 2.040 178.352 176.300 0.020 0.000 1.110 209 R CA 1.207 57.162 56.100 -0.242 0.000 0.973 209 R CB -0.528 29.563 30.300 -0.349 0.000 0.869 209 R HN 0.382 8.652 8.270 -0.000 0.000 0.440 210 V N 1.338 121.242 119.914 -0.016 0.000 2.332 210 V HA -0.276 3.834 4.120 -0.017 0.000 0.248 210 V C 2.363 178.509 176.094 0.086 0.000 1.055 210 V CA 1.763 64.108 62.300 0.075 0.000 1.038 210 V CB -0.496 31.335 31.823 0.014 0.000 0.651 210 V HN 0.310 8.500 8.190 -0.000 0.000 0.450 211 R N -0.292 120.231 120.500 0.038 0.000 2.081 211 R HA -0.172 4.158 4.340 -0.017 0.000 0.235 211 R C 2.095 178.430 176.300 0.058 0.000 1.131 211 R CA 1.774 57.896 56.100 0.035 0.000 0.960 211 R CB -0.485 29.821 30.300 0.009 0.000 0.856 211 R HN 0.509 8.779 8.270 -0.000 0.000 0.436 212 D N 0.040 120.497 120.400 0.096 0.000 2.097 212 D HA -0.138 4.492 4.640 -0.017 0.000 0.195 212 D C 1.962 178.377 176.300 0.192 0.000 0.989 212 D CA 1.519 55.612 54.000 0.155 0.000 0.827 212 D CB -0.178 40.821 40.800 0.332 0.000 0.966 212 D HN 0.184 8.554 8.370 -0.000 0.000 0.456 213 V N -0.914 119.160 119.914 0.267 0.000 2.667 213 V HA 0.018 4.128 4.120 -0.017 0.000 0.252 213 V C 2.161 178.390 176.094 0.224 0.000 1.065 213 V CA 1.538 64.018 62.300 0.300 0.000 1.083 213 V CB -0.908 31.081 31.823 0.277 0.000 0.692 213 V HN 0.103 8.293 8.190 -0.000 0.000 0.468 214 A N 1.830 124.733 122.820 0.137 0.000 2.076 214 A HA -0.168 4.142 4.320 -0.017 0.000 0.220 214 A C 2.478 180.071 177.584 0.016 0.000 1.160 214 A CA 2.464 54.548 52.037 0.079 0.000 0.653 214 A CB -1.339 17.694 19.000 0.056 0.000 0.801 214 A HN 0.869 9.019 8.150 -0.000 0.000 0.455 215 T N -3.400 111.118 114.554 -0.060 0.000 2.929 215 T HA -0.108 4.232 4.350 -0.017 0.000 0.271 215 T C 1.252 175.755 174.700 -0.329 0.000 1.085 215 T CA 1.275 63.239 62.100 -0.227 0.000 1.125 215 T CB -0.662 67.986 68.868 -0.366 0.000 0.874 215 T HN 0.361 8.601 8.240 -0.000 0.000 0.494 216 F N 1.763 121.705 119.950 -0.014 0.000 2.797 216 F HA 0.390 4.917 4.527 -0.001 0.000 0.302 216 F C 0.961 176.744 175.800 -0.028 0.000 1.130 216 F CA -0.467 57.516 58.000 -0.028 0.000 1.387 216 F CB -0.400 38.572 39.000 -0.047 0.000 1.107 216 F HN 0.023 8.323 8.300 -0.000 0.000 0.577 217 K N 0.242 120.694 120.400 0.087 0.000 3.278 217 K HA -0.186 4.124 4.320 -0.017 0.000 0.270 217 K C -2.536 174.088 176.600 0.039 0.000 0.955 217 K CA -0.184 56.132 56.287 0.049 0.000 0.723 217 K CB -1.710 30.805 32.500 0.025 0.000 1.382 217 K HN 0.197 8.447 8.250 -0.000 0.000 0.461 218 P HA -0.032 4.388 4.420 -0.000 0.000 0.269 218 P C 0.773 178.031 177.300 -0.071 0.000 1.215 218 P CA 0.073 63.148 63.100 -0.043 0.000 0.780 218 P CB 0.670 32.338 31.700 -0.054 0.000 0.898 219 T N 0.783 115.234 114.554 -0.171 0.000 2.788 219 T HA 0.019 4.359 4.350 -0.017 0.000 0.268 219 T C 0.683 175.354 174.700 -0.049 0.000 1.044 219 T CA 1.470 63.480 62.100 -0.148 0.000 1.139 219 T CB -0.583 68.144 68.868 -0.234 0.000 0.867 219 T HN 0.645 8.885 8.240 -0.000 0.000 0.454 220 F N -1.345 118.567 119.950 -0.064 0.000 2.686 220 F HA 0.706 5.223 4.527 -0.017 0.000 0.311 220 F C -1.730 174.047 175.800 -0.038 0.000 1.128 220 F CA -1.885 56.081 58.000 -0.056 0.000 0.946 220 F CB 1.212 40.157 39.000 -0.091 0.000 1.336 220 F HN -0.282 8.018 8.300 -0.000 0.000 0.457 221 I N 1.621 122.396 120.570 0.342 0.000 2.410 221 I HA 0.300 4.460 4.170 -0.017 0.000 0.286 221 I C -0.849 175.433 176.117 0.275 0.000 1.009 221 I CA -0.452 61.013 61.300 0.275 0.000 1.111 221 I CB 1.850 39.983 38.000 0.223 0.000 1.262 221 I HN 0.724 8.934 8.210 -0.000 0.000 0.443 222 E N 5.680 126.054 120.200 0.289 0.000 2.197 222 E HA 0.179 4.519 4.350 -0.017 0.000 0.281 222 E C -0.282 176.427 176.600 0.181 0.000 0.995 222 E CA -0.665 55.838 56.400 0.171 0.000 0.808 222 E CB 0.956 30.763 29.700 0.177 0.000 1.093 222 E HN 0.457 8.817 8.360 -0.000 0.000 0.394 223 Q N 3.669 123.526 119.800 0.096 0.000 2.429 223 Q HA -0.167 4.163 4.340 -0.017 0.000 0.365 223 Q C -1.949 174.116 176.000 0.107 0.000 1.384 223 Q CA 0.625 56.468 55.803 0.066 0.000 1.089 223 Q CB -0.250 28.509 28.738 0.035 0.000 1.264 223 Q HN 0.508 8.778 8.270 -0.000 0.000 0.342 224 P HA -0.105 4.315 4.420 -0.000 0.000 0.218 224 P C 0.469 177.703 177.300 -0.111 0.000 1.149 224 P CA 1.624 64.691 63.100 -0.056 0.000 0.817 224 P CB 0.078 31.682 31.700 -0.160 0.000 0.785 225 V N -4.840 115.017 119.914 -0.094 0.000 3.158 225 V HA 0.539 4.649 4.120 -0.017 0.000 0.315 225 V C 0.090 176.094 176.094 -0.150 0.000 1.148 225 V CA -1.671 60.553 62.300 -0.127 0.000 1.042 225 V CB 1.347 33.084 31.823 -0.144 0.000 1.101 225 V HN -0.325 7.865 8.190 -0.000 0.000 0.448 226 K N 0.922 121.196 120.400 -0.211 0.000 2.518 226 K HA 0.233 4.543 4.320 -0.017 0.000 0.276 226 K C 1.479 177.893 176.600 -0.310 0.000 0.974 226 K CA 0.715 56.842 56.287 -0.267 0.000 0.986 226 K CB 0.762 33.041 32.500 -0.369 0.000 0.901 226 K HN 1.021 9.271 8.250 -0.000 0.000 0.497 227 A N 2.973 125.671 122.820 -0.202 0.000 1.927 227 A HA -0.231 4.079 4.320 -0.017 0.000 0.220 227 A C 1.749 179.248 177.584 -0.142 0.000 1.185 227 A CA 2.034 53.989 52.037 -0.137 0.000 0.639 227 A CB -0.851 18.110 19.000 -0.066 0.000 0.820 227 A HN 0.887 9.037 8.150 -0.000 0.000 0.451 228 H N -1.238 117.767 119.070 -0.108 0.000 2.547 228 H HA 0.183 4.730 4.556 -0.016 0.000 0.272 228 H C 0.621 175.874 175.328 -0.125 0.000 0.989 228 H CA 0.471 56.450 56.048 -0.115 0.000 1.214 228 H CB -0.512 29.194 29.762 -0.094 0.000 1.389 228 H HN 0.406 8.686 8.280 -0.000 0.000 0.577 229 L N 2.184 123.133 121.223 -0.456 0.000 2.727 229 L HA 0.200 4.530 4.340 -0.017 0.000 0.237 229 L C 1.464 178.218 176.870 -0.195 0.000 1.370 229 L CA -0.130 54.520 54.840 -0.316 0.000 1.248 229 L CB 0.062 41.888 42.059 -0.389 0.000 1.556 229 L HN 0.123 8.353 8.230 -0.000 0.000 0.420 230 R N 0.276 120.676 120.500 -0.167 0.000 2.153 230 R HA -0.033 4.297 4.340 -0.017 0.000 0.218 230 R C 2.276 178.519 176.300 -0.096 0.000 1.072 230 R CA 0.933 56.934 56.100 -0.166 0.000 0.990 230 R CB -0.054 30.061 30.300 -0.307 0.000 0.889 230 R HN 0.614 8.884 8.270 -0.000 0.000 0.452 231 G N 1.362 110.119 108.800 -0.071 0.000 2.418 231 G HA2 -0.251 3.699 3.960 -0.017 0.000 0.217 231 G HA3 -0.251 3.699 3.960 -0.017 0.000 0.217 231 G C 1.284 176.154 174.900 -0.050 0.000 1.158 231 G CA 0.328 45.402 45.100 -0.042 0.000 0.771 231 G HN 0.158 8.448 8.290 -0.000 0.000 0.545 232 L N 0.349 121.527 121.223 -0.075 0.000 2.093 232 L HA 0.088 4.418 4.340 -0.017 0.000 0.208 232 L C 2.721 179.553 176.870 -0.063 0.000 1.085 232 L CA 1.390 56.187 54.840 -0.072 0.000 0.755 232 L CB -0.374 41.626 42.059 -0.098 0.000 0.904 232 L HN 0.083 8.313 8.230 -0.000 0.000 0.435 233 M N -0.580 118.975 119.600 -0.075 0.000 2.082 233 M HA -0.219 4.251 4.480 -0.017 0.000 0.258 233 M C 2.397 178.677 176.300 -0.034 0.000 1.069 233 M CA 1.957 57.222 55.300 -0.058 0.000 1.102 233 M CB -1.550 31.008 32.600 -0.070 0.000 1.336 233 M HN 0.448 8.738 8.290 -0.000 0.000 0.404 234 A N 0.078 122.881 122.820 -0.029 0.000 1.902 234 A HA -0.184 4.126 4.320 -0.017 0.000 0.217 234 A C 2.288 179.866 177.584 -0.010 0.000 1.181 234 A CA 1.628 53.659 52.037 -0.011 0.000 0.623 234 A CB -0.599 18.400 19.000 -0.002 0.000 0.818 234 A HN 0.493 8.643 8.150 -0.000 0.000 0.443 235 R N -0.661 119.828 120.500 -0.018 0.000 2.075 235 R HA 0.006 4.336 4.340 -0.017 0.000 0.232 235 R C 1.989 178.282 176.300 -0.013 0.000 1.126 235 R CA 1.461 57.552 56.100 -0.014 0.000 0.963 235 R CB -0.472 29.817 30.300 -0.018 0.000 0.858 235 R HN 0.570 8.839 8.270 -0.000 0.000 0.435 236 I N 0.456 121.015 120.570 -0.018 0.000 2.226 236 I HA -0.283 3.877 4.170 -0.017 0.000 0.245 236 I C 2.793 178.910 176.117 -0.001 0.000 1.100 236 I CA 1.108 62.400 61.300 -0.014 0.000 1.374 236 I CB -0.318 37.669 38.000 -0.023 0.000 1.057 236 I HN 0.158 8.368 8.210 -0.000 0.000 0.413 237 R N 1.092 121.592 120.500 -0.001 0.000 2.096 237 R HA -0.236 4.094 4.340 -0.017 0.000 0.240 237 R C 1.533 177.838 176.300 0.008 0.000 1.139 237 R CA 2.288 58.392 56.100 0.007 0.000 0.952 237 R CB -0.226 30.077 30.300 0.005 0.000 0.854 237 R HN 0.309 8.579 8.270 -0.000 0.000 0.436 238 D N -0.707 119.695 120.400 0.004 0.000 2.347 238 D HA -0.017 4.613 4.640 -0.017 0.000 0.215 238 D C 1.152 177.454 176.300 0.003 0.000 0.976 238 D CA 1.009 55.012 54.000 0.004 0.000 0.884 238 D CB 0.311 41.112 40.800 0.002 0.000 0.915 238 D HN 0.394 8.764 8.370 -0.000 0.000 0.526 239 A N -0.219 122.603 122.820 0.002 0.000 2.115 239 A HA 0.220 4.530 4.320 -0.017 0.000 0.211 239 A C 0.828 178.415 177.584 0.005 0.000 1.169 239 A CA 0.116 52.154 52.037 0.001 0.000 0.787 239 A CB 0.682 19.680 19.000 -0.003 0.000 0.858 239 A HN 0.043 8.193 8.150 -0.000 0.000 0.474 240 V N 1.442 121.362 119.914 0.010 0.000 2.555 240 V HA 0.220 4.330 4.120 -0.017 0.000 0.302 240 V C 0.356 176.462 176.094 0.020 0.000 1.038 240 V CA -0.197 62.113 62.300 0.017 0.000 0.887 240 V CB 1.696 33.534 31.823 0.027 0.000 0.991 240 V HN 0.602 8.792 8.190 -0.000 0.000 0.434 241 D N 2.804 123.215 120.400 0.018 0.000 2.144 241 D HA -0.117 4.513 4.640 -0.017 0.000 0.199 241 D C 0.770 177.087 176.300 0.029 0.000 0.984 241 D CA 0.700 54.711 54.000 0.019 0.000 0.834 241 D CB -0.285 40.522 40.800 0.012 0.000 0.955 241 D HN 0.283 8.653 8.370 -0.000 0.000 0.465 242 V N 1.947 121.883 119.914 0.038 0.000 2.740 242 V HA 0.126 4.236 4.120 -0.017 0.000 0.303 242 V C -1.925 174.208 176.094 0.066 0.000 1.054 242 V CA -1.245 61.087 62.300 0.053 0.000 1.106 242 V CB 0.785 32.645 31.823 0.062 0.000 0.957 242 V HN 0.074 8.264 8.190 -0.000 0.000 0.486 243 P HA 0.105 4.525 4.420 -0.000 0.000 0.265 243 P C -0.750 176.610 177.300 0.101 0.000 1.193 243 P CA -0.145 63.006 63.100 0.086 0.000 0.765 243 P CB 0.398 32.164 31.700 0.110 0.000 0.823 244 L N 4.873 126.129 121.223 0.055 0.000 2.282 244 L HA 0.482 4.812 4.340 -0.017 0.000 0.288 244 L C -1.042 175.815 176.870 -0.020 0.000 1.033 244 L CA -0.492 54.373 54.840 0.042 0.000 0.807 244 L CB 0.799 42.874 42.059 0.027 0.000 1.209 244 L HN 0.171 8.401 8.230 -0.000 0.000 0.423 245 L N 5.069 126.250 121.223 -0.070 0.000 2.307 245 L HA 0.786 5.116 4.340 -0.017 0.000 0.284 245 L C -0.143 176.666 176.870 -0.103 0.000 1.023 245 L CA -0.074 54.646 54.840 -0.199 0.000 0.810 245 L CB 1.534 43.240 42.059 -0.587 0.000 1.231 245 L HN 0.796 9.026 8.230 -0.000 0.000 0.423 246 A N 3.046 125.823 122.820 -0.072 0.000 2.331 246 A HA 0.470 4.780 4.320 -0.017 0.000 0.283 246 A C -0.184 177.392 177.584 -0.014 0.000 1.142 246 A CA -0.253 51.766 52.037 -0.029 0.000 0.812 246 A CB 0.650 19.646 19.000 -0.008 0.000 1.074 246 A HN 0.826 8.976 8.150 -0.000 0.000 0.497 247 D N 0.670 121.074 120.400 0.006 0.000 3.040 247 D HA 0.042 4.672 4.640 -0.017 0.000 0.221 247 D C 1.308 177.625 176.300 0.027 0.000 1.515 247 D CA 0.508 54.535 54.000 0.045 0.000 1.379 247 D CB -0.195 40.662 40.800 0.096 0.000 0.992 247 D HN 0.463 8.833 8.370 -0.000 0.000 0.234 248 E N 0.095 120.240 120.200 -0.092 0.000 2.267 248 E HA -0.042 4.298 4.350 -0.017 0.000 0.197 248 E C 1.956 178.623 176.600 0.112 0.000 0.998 248 E CA 0.935 57.254 56.400 -0.134 0.000 0.830 248 E CB -0.089 29.321 29.700 -0.483 0.000 0.751 248 E HN 0.058 8.418 8.360 -0.000 0.000 0.491 249 S N -0.173 115.547 115.700 0.033 0.000 2.474 249 S HA 0.023 4.483 4.470 -0.017 0.000 0.235 249 S C 0.620 175.291 174.600 0.119 0.000 0.997 249 S CA 0.613 58.829 58.200 0.027 0.000 0.949 249 S CB 0.088 63.252 63.200 -0.059 0.000 0.766 249 S HN 0.161 8.471 8.310 -0.000 0.000 0.517 250 I N 0.361 121.050 120.570 0.199 0.000 2.468 250 I HA 0.274 4.434 4.170 -0.017 0.000 0.284 250 I C -0.297 176.016 176.117 0.327 0.000 1.038 250 I CA -0.314 61.133 61.300 0.244 0.000 1.083 250 I CB 1.629 39.718 38.000 0.149 0.000 1.223 250 I HN 0.082 8.292 8.210 -0.000 0.000 0.443 251 F N 3.324 123.344 119.950 0.117 0.000 2.222 251 F HA 0.312 4.829 4.527 -0.017 0.000 0.285 251 F C 1.664 177.532 175.800 0.112 0.000 1.068 251 F CA 0.394 58.474 58.000 0.134 0.000 1.265 251 F CB 0.383 39.470 39.000 0.145 0.000 1.087 251 F HN 0.479 8.779 8.300 -0.000 0.000 0.511 252 G N -1.425 107.561 108.800 0.309 0.000 3.176 252 G HA2 0.342 4.292 3.960 -0.017 0.000 0.272 252 G HA3 0.342 4.292 3.960 -0.017 0.000 0.272 252 G C -2.335 172.650 174.900 0.141 0.000 1.349 252 G CA -0.854 44.362 45.100 0.194 0.000 0.953 252 G HN -0.268 8.022 8.290 -0.000 0.000 0.559 253 P HA -0.022 4.398 4.420 -0.000 0.000 0.218 253 P C 1.257 178.597 177.300 0.067 0.000 1.148 253 P CA 1.197 64.344 63.100 0.078 0.000 0.822 253 P CB 0.317 32.056 31.700 0.064 0.000 0.784 254 E N -0.513 119.729 120.200 0.070 0.000 2.047 254 E HA -0.165 4.175 4.350 -0.017 0.000 0.191 254 E C 1.762 178.391 176.600 0.048 0.000 0.987 254 E CA 1.227 57.655 56.400 0.046 0.000 0.799 254 E CB -0.906 28.820 29.700 0.042 0.000 0.752 254 E HN 0.260 8.620 8.360 -0.000 0.000 0.449 255 D N -0.124 120.341 120.400 0.107 0.000 2.117 255 D HA -0.140 4.490 4.640 -0.017 0.000 0.197 255 D C 1.876 178.271 176.300 0.158 0.000 0.987 255 D CA 0.923 55.031 54.000 0.179 0.000 0.829 255 D CB -0.203 40.746 40.800 0.248 0.000 0.961 255 D HN 0.094 8.464 8.370 -0.000 0.000 0.460 256 M N 1.067 120.740 119.600 0.122 0.000 2.108 256 M HA -0.103 4.367 4.480 -0.017 0.000 0.261 256 M C 1.912 178.241 176.300 0.049 0.000 1.066 256 M CA 1.392 56.749 55.300 0.094 0.000 1.107 256 M CB -0.309 32.338 32.600 0.079 0.000 1.356 256 M HN -0.009 8.281 8.290 -0.000 0.000 0.406 257 A N -0.998 121.834 122.820 0.020 0.000 1.898 257 A HA -0.194 4.116 4.320 -0.017 0.000 0.216 257 A C 2.117 179.658 177.584 -0.072 0.000 1.181 257 A CA 1.955 53.983 52.037 -0.015 0.000 0.620 257 A CB -0.863 18.130 19.000 -0.013 0.000 0.819 257 A HN 0.650 8.800 8.150 -0.000 0.000 0.442 258 E N -1.207 118.901 120.200 -0.152 0.000 2.208 258 E HA -0.116 4.224 4.350 -0.017 0.000 0.193 258 E C -0.034 176.249 176.600 -0.530 0.000 0.988 258 E CA 0.622 56.791 56.400 -0.385 0.000 0.828 258 E CB 0.068 29.427 29.700 -0.568 0.000 0.763 258 E HN 0.694 9.054 8.360 -0.000 0.000 0.478 259 H N -0.893 118.192 119.070 0.024 0.000 2.439 259 H HA 0.150 4.696 4.556 -0.017 0.000 0.230 259 H C -1.968 173.371 175.328 0.019 0.000 1.420 259 H CA -1.491 54.569 56.048 0.020 0.000 1.305 259 H CB 0.962 30.738 29.762 0.025 0.000 1.667 259 H HN 0.230 8.510 8.280 -0.000 0.000 0.515 260 P HA -0.068 4.352 4.420 -0.000 0.000 0.223 260 P C 0.762 178.093 177.300 0.052 0.000 1.151 260 P CA 1.010 64.142 63.100 0.054 0.000 0.787 260 P CB 0.766 32.482 31.700 0.027 0.000 0.788 261 E N -0.375 119.860 120.200 0.058 0.000 2.558 261 E HA 0.139 4.479 4.350 -0.017 0.000 0.205 261 E C 1.629 178.250 176.600 0.036 0.000 1.006 261 E CA -0.139 56.285 56.400 0.040 0.000 0.961 261 E CB -0.020 29.698 29.700 0.032 0.000 1.044 261 E HN 0.461 8.821 8.360 -0.000 0.000 0.465 262 I N -2.853 117.743 120.570 0.044 0.000 3.059 262 I HA 0.298 4.458 4.170 -0.017 0.000 0.270 262 I C 0.894 177.014 176.117 0.004 0.000 1.238 262 I CA 0.064 61.374 61.300 0.018 0.000 1.478 262 I CB 0.270 38.270 38.000 0.000 0.000 1.097 262 I HN -0.139 8.071 8.210 -0.000 0.000 0.455 263 A N 0.593 123.419 122.820 0.010 0.000 2.588 263 A HA 0.420 4.730 4.320 -0.017 0.000 0.290 263 A C -0.400 177.186 177.584 0.003 0.000 1.136 263 A CA -0.469 51.569 52.037 0.000 0.000 0.681 263 A CB 0.688 19.680 19.000 -0.013 0.000 1.282 263 A HN 0.114 8.264 8.150 -0.000 0.000 0.421 264 D N -0.231 120.168 120.400 -0.002 0.000 2.333 264 D HA 0.309 4.939 4.640 -0.017 0.000 0.208 264 D C 0.781 177.075 176.300 -0.009 0.000 0.984 264 D CA 1.698 55.699 54.000 0.002 0.000 0.873 264 D CB 0.777 41.585 40.800 0.013 0.000 0.935 264 D HN 0.849 9.219 8.370 -0.000 0.000 0.521 265 G N -0.363 108.416 108.800 -0.036 0.000 2.550 265 G HA2 0.435 4.385 3.960 -0.017 0.000 0.293 265 G HA3 0.435 4.385 3.960 -0.017 0.000 0.293 265 G C -2.005 172.852 174.900 -0.072 0.000 1.402 265 G CA -0.416 44.653 45.100 -0.053 0.000 0.784 265 G HN -0.003 8.287 8.290 -0.000 0.000 0.482 266 V N -0.316 119.563 119.914 -0.057 0.000 2.841 266 V HA 0.755 4.865 4.120 -0.017 0.000 0.310 266 V C -0.126 175.959 176.094 -0.015 0.000 1.090 266 V CA -0.574 61.708 62.300 -0.031 0.000 0.930 266 V CB 2.043 33.875 31.823 0.014 0.000 1.014 266 V HN 1.100 9.290 8.190 -0.000 0.000 0.425 267 S N 6.928 122.631 115.700 0.006 0.000 2.474 267 S HA 0.512 4.972 4.470 -0.017 0.000 0.276 267 S C -0.392 174.231 174.600 0.038 0.000 1.227 267 S CA -0.661 57.590 58.200 0.085 0.000 1.050 267 S CB -0.021 63.262 63.200 0.139 0.000 0.939 267 S HN 0.511 8.821 8.310 -0.000 0.000 0.490 268 I N 5.736 126.310 120.570 0.007 0.000 2.315 268 I HA 0.394 4.554 4.170 -0.017 0.000 0.291 268 I C 0.097 176.203 176.117 -0.018 0.000 1.006 268 I CA -0.240 61.060 61.300 0.000 0.000 1.265 268 I CB 0.876 38.878 38.000 0.003 0.000 1.387 268 I HN 0.616 8.826 8.210 -0.000 0.000 0.475 269 K N 6.459 126.853 120.400 -0.011 0.000 2.507 269 K HA 0.397 4.707 4.320 -0.017 0.000 0.251 269 K C 1.162 177.760 176.600 -0.003 0.000 0.943 269 K CA -0.575 55.702 56.287 -0.016 0.000 0.794 269 K CB 2.882 35.338 32.500 -0.074 0.000 1.188 269 K HN 0.555 8.805 8.250 -0.000 0.000 0.428 270 I N -0.638 119.949 120.570 0.028 0.000 2.454 270 I HA -0.219 3.941 4.170 -0.017 0.000 0.254 270 I C 1.265 177.398 176.117 0.027 0.000 1.156 270 I CA 1.149 62.472 61.300 0.039 0.000 1.433 270 I CB -0.141 37.887 38.000 0.048 0.000 1.082 270 I HN 0.518 8.728 8.210 -0.000 0.000 0.432 271 M N 1.440 121.032 119.600 -0.014 0.000 2.374 271 M HA -0.061 4.409 4.480 -0.017 0.000 0.264 271 M C 2.021 178.310 176.300 -0.017 0.000 1.067 271 M CA 1.517 56.805 55.300 -0.020 0.000 1.103 271 M CB -0.985 31.570 32.600 -0.076 0.000 1.402 271 M HN 0.380 8.669 8.290 -0.000 0.000 0.444 272 K N -0.177 120.163 120.400 -0.100 0.000 2.128 272 K HA 0.023 4.333 4.320 -0.017 0.000 0.202 272 K C 2.027 178.704 176.600 0.129 0.000 1.050 272 K CA 1.388 57.575 56.287 -0.167 0.000 0.966 272 K CB -0.055 32.122 32.500 -0.538 0.000 0.759 272 K HN 0.349 8.599 8.250 -0.000 0.000 0.454 273 S N -0.041 115.711 115.700 0.088 0.000 2.522 273 S HA 0.035 4.495 4.470 -0.017 0.000 0.227 273 S C 1.411 176.098 174.600 0.145 0.000 0.986 273 S CA 0.579 58.859 58.200 0.132 0.000 0.929 273 S CB -0.041 63.216 63.200 0.095 0.000 0.769 273 S HN 0.428 8.738 8.310 -0.000 0.000 0.529 274 G N 0.083 108.966 108.800 0.139 0.000 2.160 274 G HA2 0.273 4.223 3.960 -0.017 0.000 0.244 274 G HA3 0.273 4.223 3.960 -0.017 0.000 0.244 274 G C 0.569 175.546 174.900 0.128 0.000 1.022 274 G CA -0.085 45.096 45.100 0.135 0.000 0.741 274 G HN 1.805 10.095 8.290 -0.000 0.000 0.508 275 G N -2.276 106.597 108.800 0.122 0.000 2.369 275 G HA2 0.354 4.304 3.960 -0.017 0.000 0.307 275 G HA3 0.354 4.304 3.960 -0.017 0.000 0.307 275 G C 0.559 175.537 174.900 0.130 0.000 1.327 275 G CA -0.176 45.011 45.100 0.145 0.000 0.963 275 G HN 0.797 9.087 8.290 -0.000 0.000 0.590 276 L N -0.034 121.279 121.223 0.151 0.000 2.068 276 L HA 0.017 4.347 4.340 -0.017 0.000 0.204 276 L C 3.165 180.070 176.870 0.059 0.000 1.076 276 L CA 2.037 56.914 54.840 0.061 0.000 0.753 276 L CB -1.186 40.825 42.059 -0.080 0.000 0.910 276 L HN 0.708 8.938 8.230 -0.000 0.000 0.439 277 T N -0.208 114.425 114.554 0.132 0.000 2.684 277 T HA -0.197 4.143 4.350 -0.017 0.000 0.267 277 T C 2.081 176.833 174.700 0.088 0.000 1.036 277 T CA 1.427 63.594 62.100 0.112 0.000 1.148 277 T CB -0.238 68.724 68.868 0.158 0.000 0.863 277 T HN 0.263 8.503 8.240 -0.000 0.000 0.436 278 R N 0.883 121.444 120.500 0.101 0.000 2.115 278 R HA 0.150 4.480 4.340 -0.017 0.000 0.230 278 R C 2.854 179.201 176.300 0.079 0.000 1.111 278 R CA 0.991 57.144 56.100 0.089 0.000 0.976 278 R CB -0.472 29.889 30.300 0.100 0.000 0.870 278 R HN 0.387 8.657 8.270 -0.000 0.000 0.445 279 A N 1.206 124.071 122.820 0.076 0.000 1.883 279 A HA -0.255 4.055 4.320 -0.017 0.000 0.217 279 A C 2.027 179.643 177.584 0.052 0.000 1.186 279 A CA 1.384 53.459 52.037 0.062 0.000 0.624 279 A CB -0.443 18.592 19.000 0.059 0.000 0.822 279 A HN 0.339 8.489 8.150 -0.000 0.000 0.444 280 Q N -1.055 118.774 119.800 0.048 0.000 2.096 280 Q HA -0.145 4.185 4.340 -0.017 0.000 0.204 280 Q C 2.221 178.247 176.000 0.043 0.000 0.982 280 Q CA 1.960 57.787 55.803 0.041 0.000 0.850 280 Q CB -0.461 28.298 28.738 0.035 0.000 0.901 280 Q HN 0.689 8.959 8.270 -0.000 0.000 0.422 281 T N 0.696 115.279 114.554 0.049 0.000 2.746 281 T HA -0.118 4.222 4.350 -0.017 0.000 0.267 281 T C 2.069 176.798 174.700 0.048 0.000 1.039 281 T CA 1.294 63.423 62.100 0.047 0.000 1.142 281 T CB -0.263 68.636 68.868 0.051 0.000 0.866 281 T HN 0.052 8.292 8.240 -0.000 0.000 0.444 282 V N 1.902 121.849 119.914 0.055 0.000 2.282 282 V HA -0.232 3.878 4.120 -0.017 0.000 0.249 282 V C 2.908 179.029 176.094 0.045 0.000 1.057 282 V CA 1.869 64.203 62.300 0.056 0.000 1.032 282 V CB -1.288 30.574 31.823 0.065 0.000 0.645 282 V HN 0.548 8.738 8.190 -0.000 0.000 0.447 283 A N -0.155 122.689 122.820 0.041 0.000 1.902 283 A HA -0.226 4.084 4.320 -0.017 0.000 0.217 283 A C 2.372 179.975 177.584 0.031 0.000 1.181 283 A CA 1.914 53.971 52.037 0.034 0.000 0.623 283 A CB -0.477 18.542 19.000 0.031 0.000 0.818 283 A HN 0.535 8.685 8.150 -0.000 0.000 0.443 284 R N -1.137 119.382 120.500 0.032 0.000 2.092 284 R HA 0.009 4.339 4.340 -0.017 0.000 0.231 284 R C 2.265 178.581 176.300 0.028 0.000 1.119 284 R CA 1.598 57.715 56.100 0.028 0.000 0.970 284 R CB -0.363 29.955 30.300 0.029 0.000 0.864 284 R HN 0.537 8.807 8.270 -0.000 0.000 0.440 285 M N 0.016 119.635 119.600 0.031 0.000 2.117 285 M HA -0.145 4.325 4.480 -0.017 0.000 0.262 285 M C 2.512 178.830 176.300 0.029 0.000 1.065 285 M CA 1.797 57.115 55.300 0.030 0.000 1.114 285 M CB -0.309 32.312 32.600 0.035 0.000 1.361 285 M HN 0.265 8.555 8.290 -0.000 0.000 0.408 286 A N 0.439 123.278 122.820 0.031 0.000 1.858 286 A HA -0.104 4.206 4.320 -0.017 0.000 0.216 286 A C 2.362 179.960 177.584 0.024 0.000 1.190 286 A CA 2.084 54.138 52.037 0.029 0.000 0.617 286 A CB -1.123 17.894 19.000 0.029 0.000 0.827 286 A HN 0.503 8.653 8.150 -0.000 0.000 0.443 287 A N -0.317 122.517 122.820 0.024 0.000 1.972 287 A HA 0.169 4.479 4.320 -0.017 0.000 0.219 287 A C 2.434 180.030 177.584 0.020 0.000 1.169 287 A CA 1.983 54.033 52.037 0.022 0.000 0.635 287 A CB -0.935 18.078 19.000 0.022 0.000 0.810 287 A HN 1.137 9.287 8.150 -0.000 0.000 0.446 288 A N -0.598 122.234 122.820 0.020 0.000 2.019 288 A HA -0.112 4.198 4.320 -0.017 0.000 0.219 288 A C 2.094 179.688 177.584 0.017 0.000 1.164 288 A CA 1.431 53.479 52.037 0.018 0.000 0.644 288 A CB -0.279 18.731 19.000 0.018 0.000 0.805 288 A HN 0.517 8.667 8.150 -0.000 0.000 0.449 289 R N -1.925 118.585 120.500 0.018 0.000 2.509 289 R HA 0.283 4.613 4.340 -0.017 0.000 0.300 289 R C 0.885 177.195 176.300 0.017 0.000 0.985 289 R CA 0.462 56.572 56.100 0.017 0.000 1.092 289 R CB 0.300 30.610 30.300 0.018 0.000 1.237 289 R HN 0.624 8.894 8.270 -0.000 0.000 0.546 290 G N 1.460 110.270 108.800 0.017 0.000 2.137 290 G HA2 -0.247 3.703 3.960 -0.017 0.000 0.237 290 G HA3 -0.247 3.703 3.960 -0.017 0.000 0.237 290 G C -0.029 174.882 174.900 0.018 0.000 1.002 290 G CA -0.247 44.863 45.100 0.018 0.000 0.702 290 G HN 0.144 8.434 8.290 -0.000 0.000 0.515 291 L N 0.951 122.185 121.223 0.019 0.000 2.334 291 L HA 0.544 4.874 4.340 -0.017 0.000 0.277 291 L C 1.025 177.906 176.870 0.017 0.000 1.075 291 L CA -0.694 54.156 54.840 0.017 0.000 0.804 291 L CB 1.500 43.569 42.059 0.017 0.000 1.174 291 L HN 0.138 8.368 8.230 -0.000 0.000 0.438 292 S N 1.242 116.950 115.700 0.013 0.000 2.593 292 S HA 0.580 5.040 4.470 -0.017 0.000 0.269 292 S C 0.003 174.613 174.600 0.016 0.000 1.334 292 S CA -0.565 57.647 58.200 0.019 0.000 1.015 292 S CB 1.339 64.550 63.200 0.017 0.000 0.912 292 S HN 0.703 9.013 8.310 -0.000 0.000 0.541 293 A N 1.852 124.695 122.820 0.039 0.000 2.393 293 A HA 0.686 4.996 4.320 -0.017 0.000 0.306 293 A C -1.590 176.060 177.584 0.109 0.000 1.050 293 A CA -0.524 51.543 52.037 0.050 0.000 0.724 293 A CB 0.970 19.992 19.000 0.037 0.000 1.248 293 A HN 0.748 8.898 8.150 -0.000 0.000 0.424 294 Y N 1.094 121.358 120.300 -0.059 0.000 2.462 294 Y HA 0.587 5.128 4.550 -0.015 0.000 0.346 294 Y C 0.493 176.361 175.900 -0.054 0.000 0.976 294 Y CA -0.687 57.383 58.100 -0.049 0.000 1.044 294 Y CB 1.963 40.364 38.460 -0.099 0.000 1.230 294 Y HN 0.807 9.087 8.280 -0.000 0.000 0.455 295 G N 3.769 112.169 108.800 -0.667 0.000 2.865 295 G HA2 0.421 4.371 3.960 -0.017 0.000 0.292 295 G HA3 0.421 4.371 3.960 -0.017 0.000 0.292 295 G C 0.274 174.585 174.900 -0.981 0.000 0.800 295 G CA 0.085 44.786 45.100 -0.666 0.000 1.838 295 G HN 0.987 9.277 8.290 -0.000 0.000 0.535 296 G N 1.342 109.775 108.800 -0.611 0.000 2.616 296 G HA2 0.534 4.484 3.960 -0.017 0.000 0.268 296 G HA3 0.534 4.484 3.960 -0.017 0.000 0.268 296 G C -0.386 174.416 174.900 -0.163 0.000 1.213 296 G CA -0.171 44.723 45.100 -0.344 0.000 0.926 296 G HN 0.659 8.949 8.290 -0.000 0.000 0.523 297 D N -1.707 118.642 120.400 -0.085 0.000 2.677 297 D HA 0.421 5.051 4.640 -0.017 0.000 0.298 297 D C -0.187 176.012 176.300 -0.169 0.000 1.250 297 D CA -0.674 53.309 54.000 -0.028 0.000 0.888 297 D CB 0.816 41.706 40.800 0.150 0.000 1.397 297 D HN 0.188 8.558 8.370 -0.000 0.000 0.461 298 M N -0.793 118.679 119.600 -0.213 0.000 2.734 298 M HA 0.412 4.882 4.480 -0.017 0.000 0.264 298 M C -0.081 175.934 176.300 -0.474 0.000 1.080 298 M CA -0.700 54.382 55.300 -0.364 0.000 0.981 298 M CB -0.131 32.322 32.600 -0.245 0.000 1.514 298 M HN 0.358 8.648 8.290 -0.000 0.000 0.569 299 F N 1.375 121.185 119.950 -0.233 0.000 2.651 299 F HA 0.154 4.671 4.527 -0.017 0.000 0.347 299 F C 0.654 176.373 175.800 -0.135 0.000 1.284 299 F CA 0.096 57.982 58.000 -0.191 0.000 1.175 299 F CB -0.352 38.502 39.000 -0.243 0.000 1.542 299 F HN 0.356 8.656 8.300 -0.000 0.000 0.661 300 E N 0.972 121.147 120.200 -0.041 0.000 2.249 300 E HA 0.780 5.120 4.350 -0.017 0.000 0.263 300 E C -0.345 176.049 176.600 -0.342 0.000 0.950 300 E CA -1.008 55.290 56.400 -0.170 0.000 0.827 300 E CB 1.783 31.373 29.700 -0.183 0.000 1.220 300 E HN 0.497 8.857 8.360 -0.000 0.000 0.411 301 A N 0.132 122.678 122.820 -0.457 0.000 2.420 301 A HA 0.588 4.898 4.320 -0.017 0.000 0.291 301 A C 1.114 178.154 177.584 -0.908 0.000 1.228 301 A CA 0.084 51.785 52.037 -0.560 0.000 0.933 301 A CB 0.200 18.998 19.000 -0.336 0.000 1.428 301 A HN 0.711 8.861 8.150 -0.000 0.000 0.493 302 G N -1.227 107.197 108.800 -0.628 0.000 2.484 302 G HA2 0.023 3.973 3.960 -0.017 0.000 0.218 302 G HA3 0.023 3.973 3.960 -0.017 0.000 0.218 302 G C 1.209 175.906 174.900 -0.338 0.000 1.130 302 G CA 1.220 45.988 45.100 -0.553 0.000 0.784 302 G HN 0.586 8.876 8.290 -0.000 0.000 0.543 303 L N 1.375 122.431 121.223 -0.279 0.000 2.027 303 L HA 0.232 4.562 4.340 -0.017 0.000 0.206 303 L C 2.988 179.755 176.870 -0.172 0.000 1.074 303 L CA 2.165 56.904 54.840 -0.168 0.000 0.745 303 L CB -0.848 41.122 42.059 -0.150 0.000 0.898 303 L HN 0.186 8.416 8.230 -0.000 0.000 0.433 304 A N -1.278 121.394 122.820 -0.246 0.000 1.877 304 A HA -0.249 4.061 4.320 -0.017 0.000 0.216 304 A C 2.171 179.573 177.584 -0.304 0.000 1.186 304 A CA 1.759 53.664 52.037 -0.220 0.000 0.620 304 A CB -1.017 17.857 19.000 -0.211 0.000 0.822 304 A HN 0.664 8.814 8.150 -0.000 0.000 0.443 305 H N 0.043 118.779 119.070 -0.557 0.000 2.352 305 H HA -0.089 4.457 4.556 -0.016 0.000 0.299 305 H C 2.023 176.959 175.328 -0.653 0.000 1.097 305 H CA 1.602 57.057 56.048 -0.989 0.000 1.311 305 H CB -0.692 28.237 29.762 -1.389 0.000 1.377 305 H HN 0.437 8.717 8.280 -0.000 0.000 0.504 306 L N -0.152 121.040 121.223 -0.052 0.000 2.046 306 L HA -0.171 4.159 4.340 -0.017 0.000 0.208 306 L C 2.802 179.760 176.870 0.147 0.000 1.077 306 L CA 1.070 56.025 54.840 0.191 0.000 0.747 306 L CB -0.571 41.633 42.059 0.241 0.000 0.896 306 L HN 0.252 8.482 8.230 -0.000 0.000 0.432 307 A N 0.331 123.156 122.820 0.009 0.000 1.883 307 A HA -0.155 4.155 4.320 -0.017 0.000 0.217 307 A C 2.415 180.006 177.584 0.012 0.000 1.186 307 A CA 1.861 53.912 52.037 0.024 0.000 0.624 307 A CB -1.344 17.650 19.000 -0.010 0.000 0.822 307 A HN 0.449 8.599 8.150 -0.000 0.000 0.444 308 G N -0.674 108.035 108.800 -0.151 0.000 2.422 308 G HA2 0.016 3.966 3.960 -0.017 0.000 0.218 308 G HA3 0.016 3.966 3.960 -0.017 0.000 0.218 308 G C 1.728 176.694 174.900 0.111 0.000 1.146 308 G CA 1.453 46.511 45.100 -0.070 0.000 0.769 308 G HN 0.808 9.098 8.290 -0.000 0.000 0.547 309 A N 0.214 123.033 122.820 -0.001 0.000 1.902 309 A HA -0.075 4.235 4.320 -0.017 0.000 0.217 309 A C 2.149 179.799 177.584 0.110 0.000 1.181 309 A CA 1.638 53.791 52.037 0.193 0.000 0.623 309 A CB -0.724 18.378 19.000 0.171 0.000 0.818 309 A HN 0.478 8.628 8.150 -0.000 0.000 0.443 310 H N -1.576 117.577 119.070 0.138 0.000 2.353 310 H HA -0.110 4.436 4.556 -0.017 0.000 0.300 310 H C 2.204 177.607 175.328 0.125 0.000 1.090 310 H CA 1.705 57.864 56.048 0.185 0.000 1.327 310 H CB -0.279 29.570 29.762 0.146 0.000 1.383 310 H HN 0.426 8.706 8.280 -0.000 0.000 0.508 311 M N 1.112 120.820 119.600 0.179 0.000 2.073 311 M HA -0.171 4.299 4.480 -0.017 0.000 0.258 311 M C 2.252 178.607 176.300 0.091 0.000 1.070 311 M CA 1.568 56.926 55.300 0.096 0.000 1.103 311 M CB -0.706 31.937 32.600 0.072 0.000 1.321 311 M HN 0.179 8.469 8.290 -0.000 0.000 0.405 312 I N 0.403 121.041 120.570 0.113 0.000 2.286 312 I HA -0.237 3.923 4.170 -0.017 0.000 0.248 312 I C 2.566 178.698 176.117 0.025 0.000 1.115 312 I CA 1.031 62.375 61.300 0.074 0.000 1.392 312 I CB -0.715 37.346 38.000 0.101 0.000 1.065 312 I HN 0.342 8.552 8.210 -0.000 0.000 0.418 313 A N 0.771 123.597 122.820 0.009 0.000 1.978 313 A HA -0.135 4.175 4.320 -0.017 0.000 0.220 313 A C 2.314 179.837 177.584 -0.102 0.000 1.170 313 A CA 1.909 53.884 52.037 -0.103 0.000 0.636 313 A CB -0.585 18.283 19.000 -0.220 0.000 0.810 313 A HN 0.448 8.598 8.150 -0.000 0.000 0.448 314 A N -1.440 121.383 122.820 0.006 0.000 2.275 314 A HA 0.379 4.689 4.320 -0.017 0.000 0.212 314 A C 0.647 178.241 177.584 0.017 0.000 1.201 314 A CA 0.804 52.859 52.037 0.031 0.000 0.843 314 A CB -0.118 18.946 19.000 0.106 0.000 0.873 314 A HN 0.230 8.380 8.150 -0.000 0.000 0.492 315 T N 1.209 115.768 114.554 0.008 0.000 3.068 315 T HA 0.338 4.678 4.350 -0.017 0.000 0.364 315 T C -2.389 172.315 174.700 0.005 0.000 1.161 315 T CA -0.942 61.167 62.100 0.014 0.000 1.155 315 T CB 1.629 70.512 68.868 0.025 0.000 1.060 315 T HN 0.017 8.257 8.240 -0.000 0.000 0.513 316 P HA -0.057 4.363 4.420 -0.000 0.000 0.219 316 P C 1.159 178.464 177.300 0.008 0.000 1.146 316 P CA 0.943 64.042 63.100 -0.002 0.000 0.808 316 P CB 0.345 32.043 31.700 -0.003 0.000 0.779 317 E N -0.527 119.682 120.200 0.014 0.000 2.265 317 E HA -0.057 4.283 4.350 -0.017 0.000 0.196 317 E C 0.698 177.313 176.600 0.025 0.000 0.996 317 E CA 0.506 56.918 56.400 0.020 0.000 0.832 317 E CB -0.602 29.111 29.700 0.022 0.000 0.756 317 E HN 0.328 8.688 8.360 -0.000 0.000 0.491 318 I N 1.551 122.134 120.570 0.022 0.000 2.291 318 I HA 0.038 4.198 4.170 -0.017 0.000 0.292 318 I C 0.671 176.805 176.117 0.029 0.000 1.064 318 I CA 0.043 61.358 61.300 0.025 0.000 1.269 318 I CB 0.858 38.864 38.000 0.009 0.000 1.418 318 I HN 0.045 8.255 8.210 -0.000 0.000 0.485 319 T N 2.389 116.974 114.554 0.051 0.000 3.004 319 T HA 0.276 4.616 4.350 -0.017 0.000 0.266 319 T C 0.967 175.715 174.700 0.081 0.000 0.986 319 T CA -0.101 62.030 62.100 0.051 0.000 0.902 319 T CB 0.103 68.998 68.868 0.045 0.000 1.118 319 T HN 0.417 8.657 8.240 -0.000 0.000 0.522 320 L N 1.720 123.029 121.223 0.142 0.000 2.653 320 L HA 0.492 4.822 4.340 -0.017 0.000 0.231 320 L C 1.440 178.475 176.870 0.275 0.000 1.153 320 L CA 0.138 55.117 54.840 0.232 0.000 0.933 320 L CB -0.628 41.643 42.059 0.353 0.000 1.175 320 L HN 0.678 8.908 8.230 -0.000 0.000 0.473 321 G N 0.007 108.882 108.800 0.125 0.000 2.698 321 G HA2 -0.208 3.742 3.960 -0.017 0.000 0.225 321 G HA3 -0.208 3.742 3.960 -0.017 0.000 0.225 321 G C -0.555 174.255 174.900 -0.151 0.000 1.345 321 G CA -0.567 44.549 45.100 0.027 0.000 0.871 321 G HN 0.376 8.666 8.290 -0.000 0.000 0.540 322 C N -1.911 117.220 119.300 -0.283 0.000 3.154 322 C HA 0.942 5.392 4.460 -0.017 0.000 0.312 322 C C 0.275 174.952 174.990 -0.522 0.000 1.349 322 C CA 0.153 58.759 59.018 -0.686 0.000 1.518 322 C CB 1.561 28.697 27.740 -1.007 0.000 1.934 322 C HN 1.455 9.685 8.230 -0.000 0.000 0.462 323 E N -0.034 119.754 120.200 -0.686 0.000 3.167 323 E HA 0.270 4.610 4.350 -0.017 0.000 0.210 323 E C -1.041 175.465 176.600 -0.157 0.000 1.004 323 E CA -0.369 55.924 56.400 -0.178 0.000 1.256 323 E CB -0.200 29.544 29.700 0.073 0.000 1.193 323 E HN 0.696 9.056 8.360 -0.000 0.000 0.448 324 F N 2.116 121.945 119.950 -0.202 0.000 2.659 324 F HA 0.128 4.646 4.527 -0.016 0.000 0.360 324 F C 0.551 176.032 175.800 -0.531 0.000 1.218 324 F CA -0.822 56.744 58.000 -0.723 0.000 1.317 324 F CB -0.128 38.499 39.000 -0.622 0.000 1.697 324 F HN 0.369 8.669 8.300 -0.000 0.000 0.637 325 Y N -1.745 118.488 120.300 -0.112 0.000 2.442 325 Y HA 0.202 4.742 4.550 -0.016 0.000 0.250 325 Y C 1.598 177.674 175.900 0.293 0.000 1.113 325 Y CA -0.192 58.009 58.100 0.167 0.000 1.273 325 Y CB -0.375 38.182 38.460 0.163 0.000 1.138 325 Y HN 0.085 8.365 8.280 -0.000 0.000 0.522 326 Q N 1.753 121.351 119.800 -0.336 0.000 2.083 326 Q HA 0.031 4.361 4.340 -0.017 0.000 0.198 326 Q C 2.520 178.643 176.000 0.204 0.000 0.969 326 Q CA 1.925 57.700 55.803 -0.047 0.000 0.838 326 Q CB -0.404 28.305 28.738 -0.049 0.000 0.900 326 Q HN 0.623 8.893 8.270 -0.000 0.000 0.436 327 A N -0.170 122.791 122.820 0.235 0.000 1.972 327 A HA -0.187 4.124 4.320 -0.017 0.000 0.219 327 A C 2.091 179.734 177.584 0.097 0.000 1.169 327 A CA 1.947 54.019 52.037 0.058 0.000 0.635 327 A CB -0.676 18.295 19.000 -0.049 0.000 0.810 327 A HN 0.366 8.516 8.150 -0.000 0.000 0.446 328 T N -2.285 112.352 114.554 0.138 0.000 2.894 328 T HA 0.037 4.377 4.350 -0.017 0.000 0.258 328 T C 1.327 175.902 174.700 -0.208 0.000 1.043 328 T CA 1.419 63.472 62.100 -0.080 0.000 1.141 328 T CB -0.245 68.507 68.868 -0.195 0.000 0.873 328 T HN 0.608 8.848 8.240 -0.000 0.000 0.449 329 Y N -1.418 119.036 120.300 0.257 0.000 2.430 329 Y HA 0.416 4.956 4.550 -0.016 0.000 0.248 329 Y C 1.411 177.512 175.900 0.335 0.000 1.108 329 Y CA -0.571 57.690 58.100 0.268 0.000 1.264 329 Y CB 0.490 39.129 38.460 0.298 0.000 1.172 329 Y HN 0.138 8.418 8.280 -0.000 0.000 0.520 330 F N -0.259 119.837 119.950 0.244 0.000 2.549 330 F HA 0.366 4.884 4.527 -0.016 0.000 0.275 330 F C 0.380 176.213 175.800 0.056 0.000 0.990 330 F CA -0.280 57.823 58.000 0.172 0.000 1.274 330 F CB -0.057 39.062 39.000 0.199 0.000 1.064 330 F HN -0.346 7.954 8.300 -0.000 0.000 0.715 331 L N 1.073 122.285 121.223 -0.019 0.000 2.455 331 L HA -0.028 4.302 4.340 -0.017 0.000 0.272 331 L C 1.353 178.136 176.870 -0.145 0.000 1.174 331 L CA -0.524 54.196 54.840 -0.199 0.000 0.869 331 L CB 0.758 42.716 42.059 -0.169 0.000 1.130 331 L HN 0.298 8.528 8.230 -0.000 0.000 0.474 332 C N 0.941 120.130 119.300 -0.185 0.000 2.413 332 C HA -0.096 4.354 4.460 -0.017 0.000 0.276 332 C C 0.854 175.803 174.990 -0.068 0.000 1.236 332 C CA 0.405 59.363 59.018 -0.099 0.000 1.735 332 C CB -0.722 26.967 27.740 -0.084 0.000 2.031 332 C HN 0.753 8.983 8.230 -0.000 0.000 0.474 333 D N -0.550 119.777 120.400 -0.120 0.000 2.732 333 D HA 0.295 4.926 4.640 -0.017 0.000 0.229 333 D C -1.246 174.941 176.300 -0.188 0.000 1.152 333 D CA -0.258 53.699 54.000 -0.071 0.000 0.854 333 D CB 1.865 42.731 40.800 0.111 0.000 1.590 333 D HN 0.100 8.470 8.370 -0.000 0.000 0.468 334 D N 0.254 120.591 120.400 -0.105 0.000 2.478 334 D HA 0.327 4.957 4.640 -0.017 0.000 0.263 334 D C 0.955 177.199 176.300 -0.093 0.000 1.153 334 D CA -0.525 53.392 54.000 -0.139 0.000 1.038 334 D CB 1.199 41.947 40.800 -0.085 0.000 1.120 334 D HN 0.440 8.810 8.370 -0.000 0.000 0.564 335 I N -1.324 119.171 120.570 -0.125 0.000 3.976 335 I HA 0.307 4.467 4.170 -0.017 0.000 0.337 335 I C -0.149 175.884 176.117 -0.140 0.000 1.359 335 I CA -0.343 60.892 61.300 -0.108 0.000 1.098 335 I CB 0.044 37.950 38.000 -0.156 0.000 1.027 335 I HN -0.043 8.167 8.210 -0.000 0.000 0.394 336 L N 1.235 122.394 121.223 -0.107 0.000 2.421 336 L HA 0.521 4.851 4.340 -0.017 0.000 0.263 336 L C 1.619 178.447 176.870 -0.070 0.000 1.122 336 L CA -0.273 54.509 54.840 -0.097 0.000 0.804 336 L CB 1.501 43.539 42.059 -0.035 0.000 1.150 336 L HN 0.144 8.374 8.230 -0.000 0.000 0.457 337 A N 1.475 124.250 122.820 -0.075 0.000 2.119 337 A HA 0.401 4.711 4.320 -0.017 0.000 0.216 337 A C 0.825 178.392 177.584 -0.028 0.000 1.152 337 A CA 1.110 53.114 52.037 -0.054 0.000 0.708 337 A CB -0.137 18.827 19.000 -0.061 0.000 0.805 337 A HN 0.741 8.891 8.150 -0.000 0.000 0.460 338 A N -0.817 121.993 122.820 -0.017 0.000 2.485 338 A HA 0.700 5.010 4.320 -0.017 0.000 0.292 338 A C -3.070 174.522 177.584 0.014 0.000 1.147 338 A CA -1.807 50.227 52.037 -0.005 0.000 0.750 338 A CB 0.368 19.364 19.000 -0.006 0.000 1.331 338 A HN 0.032 8.182 8.150 -0.000 0.000 0.419 339 P HA 0.231 4.651 4.420 -0.000 0.000 0.268 339 P C -0.478 176.865 177.300 0.071 0.000 1.204 339 P CA 0.078 63.203 63.100 0.042 0.000 0.768 339 P CB 0.060 31.769 31.700 0.015 0.000 0.842 340 F N 6.467 126.416 119.950 -0.001 0.000 2.604 340 F HA 0.052 4.569 4.527 -0.017 0.000 0.393 340 F C -1.753 174.068 175.800 0.035 0.000 1.043 340 F CA -1.785 56.233 58.000 0.029 0.000 1.227 340 F CB -0.242 38.804 39.000 0.076 0.000 1.016 340 F HN 0.256 8.556 8.300 -0.000 0.000 0.556 341 P HA 0.198 4.618 4.420 -0.000 0.000 0.279 341 P C -1.268 175.766 177.300 -0.443 0.000 1.318 341 P CA 0.015 62.863 63.100 -0.421 0.000 0.819 341 P CB 1.071 32.586 31.700 -0.309 0.000 0.927 342 V N 3.260 123.047 119.914 -0.211 0.000 2.577 342 V HA 0.774 4.884 4.120 -0.017 0.000 0.303 342 V C -0.165 175.921 176.094 -0.014 0.000 1.042 342 V CA -0.657 61.596 62.300 -0.078 0.000 0.872 342 V CB 1.966 33.806 31.823 0.029 0.000 0.998 342 V HN 0.699 8.889 8.190 -0.000 0.000 0.423 343 A N 2.707 125.540 122.820 0.021 0.000 2.520 343 A HA 0.742 5.052 4.320 -0.017 0.000 0.298 343 A C -0.312 177.316 177.584 0.074 0.000 1.051 343 A CA -0.439 51.617 52.037 0.031 0.000 0.690 343 A CB 1.233 20.230 19.000 -0.004 0.000 1.281 343 A HN 0.855 9.005 8.150 -0.000 0.000 0.402 344 D N 0.891 121.335 120.400 0.072 0.000 2.751 344 D HA -0.195 4.435 4.640 -0.017 0.000 0.233 344 D C 1.082 177.503 176.300 0.202 0.000 1.149 344 D CA 2.806 56.860 54.000 0.090 0.000 0.682 344 D CB -1.318 39.498 40.800 0.026 0.000 1.068 344 D HN 2.205 10.575 8.370 -0.000 0.000 0.429 345 G N -0.540 108.360 108.800 0.167 0.000 2.148 345 G HA2 -0.323 3.627 3.960 -0.017 0.000 0.254 345 G HA3 -0.323 3.627 3.960 -0.017 0.000 0.254 345 G C -0.045 174.874 174.900 0.032 0.000 0.981 345 G CA 0.627 45.795 45.100 0.113 0.000 0.670 345 G HN 0.676 8.966 8.290 -0.000 0.000 0.528 346 H N -1.658 117.424 119.070 0.019 0.000 2.717 346 H HA 0.596 5.142 4.556 -0.017 0.000 0.366 346 H C -0.029 175.303 175.328 0.006 0.000 1.132 346 H CA -0.632 55.422 56.048 0.009 0.000 1.180 346 H CB 1.992 31.745 29.762 -0.015 0.000 1.678 346 H HN 0.173 8.453 8.280 -0.000 0.000 0.537 347 V N 3.950 123.935 119.914 0.119 0.000 2.555 347 V HA 0.090 4.200 4.120 -0.017 0.000 0.286 347 V C 0.102 176.199 176.094 0.005 0.000 1.044 347 V CA -0.322 62.004 62.300 0.043 0.000 1.026 347 V CB 0.370 32.297 31.823 0.174 0.000 0.981 347 V HN 0.482 8.672 8.190 -0.000 0.000 0.480 348 L N 5.842 127.007 121.223 -0.096 0.000 2.257 348 L HA 0.420 4.750 4.340 -0.017 0.000 0.290 348 L C -0.271 176.538 176.870 -0.102 0.000 1.044 348 L CA -0.638 54.153 54.840 -0.081 0.000 0.810 348 L CB 1.385 43.392 42.059 -0.086 0.000 1.193 348 L HN 0.348 8.578 8.230 -0.000 0.000 0.425 349 V N 5.092 124.959 119.914 -0.079 0.000 2.470 349 V HA 0.160 4.270 4.120 -0.017 0.000 0.276 349 V C -1.738 174.350 176.094 -0.012 0.000 1.040 349 V CA -1.267 60.972 62.300 -0.101 0.000 1.008 349 V CB 0.561 32.290 31.823 -0.157 0.000 0.990 349 V HN 0.616 8.806 8.190 -0.000 0.000 0.477 350 P HA 0.198 4.618 4.420 -0.000 0.000 0.272 350 P C -0.214 177.272 177.300 0.310 0.000 1.230 350 P CA -0.201 62.980 63.100 0.134 0.000 0.788 350 P CB 0.499 32.291 31.700 0.153 0.000 0.949 351 D N -2.253 118.300 120.400 0.254 0.000 2.513 351 D HA 0.031 4.661 4.640 -0.017 0.000 0.222 351 D C 0.023 176.393 176.300 0.117 0.000 1.210 351 D CA -0.127 54.063 54.000 0.316 0.000 0.825 351 D CB -0.714 40.289 40.800 0.338 0.000 1.037 351 D HN 0.320 8.690 8.370 -0.000 0.000 0.506 352 T N -2.995 111.606 114.554 0.078 0.000 2.897 352 T HA 0.607 4.947 4.350 -0.017 0.000 0.278 352 T C -2.673 172.011 174.700 -0.027 0.000 0.981 352 T CA -1.938 60.175 62.100 0.021 0.000 0.973 352 T CB 1.339 70.226 68.868 0.032 0.000 1.092 352 T HN -0.270 7.970 8.240 -0.000 0.000 0.543 353 P HA 0.418 4.838 4.420 -0.000 0.000 0.272 353 P C 1.008 178.261 177.300 -0.077 0.000 1.223 353 P CA 1.100 64.154 63.100 -0.076 0.000 0.784 353 P CB 0.023 31.693 31.700 -0.050 0.000 0.923 354 G N 1.117 109.842 108.800 -0.124 0.000 2.552 354 G HA2 -0.303 3.647 3.960 -0.017 0.000 0.265 354 G HA3 -0.303 3.647 3.960 -0.017 0.000 0.265 354 G C 0.714 175.463 174.900 -0.252 0.000 1.234 354 G CA 0.098 45.114 45.100 -0.139 0.000 0.944 354 G HN 0.474 8.764 8.290 -0.000 0.000 0.568 355 L N 1.722 122.833 121.223 -0.187 0.000 2.465 355 L HA 0.315 4.645 4.340 -0.017 0.000 0.224 355 L C 2.601 179.548 176.870 0.127 0.000 1.145 355 L CA 1.456 56.186 54.840 -0.185 0.000 0.834 355 L CB -0.492 41.540 42.059 -0.045 0.000 0.944 355 L HN 2.058 10.288 8.230 -0.000 0.000 0.451 356 G N -0.510 108.333 108.800 0.071 0.000 2.213 356 G HA2 -0.230 3.720 3.960 -0.017 0.000 0.236 356 G HA3 -0.230 3.720 3.960 -0.017 0.000 0.236 356 G C 0.133 175.075 174.900 0.070 0.000 0.991 356 G CA -0.038 45.127 45.100 0.109 0.000 0.629 356 G HN 0.096 8.386 8.290 -0.000 0.000 0.517 357 V N 1.564 121.512 119.914 0.057 0.000 2.709 357 V HA 0.528 4.638 4.120 -0.017 0.000 0.308 357 V C -0.731 175.352 176.094 -0.018 0.000 1.062 357 V CA -1.217 61.096 62.300 0.023 0.000 0.901 357 V CB 1.956 33.802 31.823 0.039 0.000 1.003 357 V HN 0.216 8.406 8.190 -0.000 0.000 0.425 358 D N 2.247 122.622 120.400 -0.041 0.000 2.382 358 D HA 0.249 4.879 4.640 -0.017 0.000 0.245 358 D C -0.008 176.182 176.300 -0.184 0.000 1.120 358 D CA 0.034 53.978 54.000 -0.093 0.000 0.890 358 D CB 1.767 42.526 40.800 -0.067 0.000 1.201 358 D HN 0.232 8.602 8.370 -0.000 0.000 0.433 359 V N 2.389 122.082 119.914 -0.367 0.000 2.555 359 V HA -0.039 4.071 4.120 -0.017 0.000 0.286 359 V C 0.608 176.465 176.094 -0.395 0.000 1.044 359 V CA -0.236 61.748 62.300 -0.526 0.000 1.026 359 V CB 1.128 32.271 31.823 -1.133 0.000 0.981 359 V HN 0.435 8.625 8.190 -0.000 0.000 0.480 360 D N 4.026 124.256 120.400 -0.283 0.000 2.422 360 D HA 0.102 4.732 4.640 -0.017 0.000 0.227 360 D C 1.182 177.345 176.300 -0.229 0.000 1.190 360 D CA -0.057 53.828 54.000 -0.193 0.000 0.905 360 D CB 0.822 41.549 40.800 -0.122 0.000 1.034 360 D HN 0.633 9.003 8.370 -0.000 0.000 0.507 361 E N 2.038 122.116 120.200 -0.204 0.000 2.265 361 E HA -0.154 4.186 4.350 -0.017 0.000 0.196 361 E C 0.618 177.134 176.600 -0.140 0.000 0.996 361 E CA 0.690 56.967 56.400 -0.205 0.000 0.832 361 E CB 0.353 30.023 29.700 -0.050 0.000 0.756 361 E HN 0.529 8.889 8.360 -0.000 0.000 0.491 362 D N 0.688 121.030 120.400 -0.097 0.000 2.178 362 D HA -0.091 4.539 4.640 -0.017 0.000 0.202 362 D C 1.843 178.070 176.300 -0.121 0.000 0.974 362 D CA 1.017 54.968 54.000 -0.082 0.000 0.841 362 D CB -0.113 40.647 40.800 -0.066 0.000 0.953 362 D HN 0.153 8.523 8.370 -0.000 0.000 0.478 363 A N 0.737 123.487 122.820 -0.117 0.000 1.929 363 A HA -0.070 4.240 4.320 -0.017 0.000 0.216 363 A C 2.346 179.901 177.584 -0.049 0.000 1.176 363 A CA 0.612 52.610 52.037 -0.064 0.000 0.628 363 A CB -0.667 18.368 19.000 0.060 0.000 0.816 363 A HN 0.175 8.325 8.150 -0.000 0.000 0.444 364 L N -0.622 120.486 121.223 -0.193 0.000 2.013 364 L HA -0.275 4.055 4.340 -0.017 0.000 0.212 364 L C 3.096 179.900 176.870 -0.111 0.000 1.073 364 L CA 1.439 56.074 54.840 -0.341 0.000 0.753 364 L CB -0.727 40.713 42.059 -1.031 0.000 0.890 364 L HN 0.450 8.680 8.230 -0.000 0.000 0.432 365 A N -0.075 122.713 122.820 -0.053 0.000 1.898 365 A HA -0.227 4.083 4.320 -0.017 0.000 0.216 365 A C 2.459 180.016 177.584 -0.046 0.000 1.181 365 A CA 1.648 53.719 52.037 0.057 0.000 0.620 365 A CB -0.588 18.449 19.000 0.062 0.000 0.819 365 A HN 0.363 8.513 8.150 -0.000 0.000 0.442 366 R N -1.643 118.739 120.500 -0.198 0.000 2.081 366 R HA -0.130 4.200 4.340 -0.017 0.000 0.235 366 R C 1.013 177.036 176.300 -0.461 0.000 1.131 366 R CA 1.886 57.735 56.100 -0.419 0.000 0.960 366 R CB -0.272 29.596 30.300 -0.719 0.000 0.856 366 R HN 0.470 8.740 8.270 -0.000 0.000 0.436 367 F N 0.447 120.380 119.950 -0.029 0.000 2.727 367 F HA 0.385 4.902 4.527 -0.016 0.000 0.302 367 F C 0.844 176.641 175.800 -0.005 0.000 1.097 367 F CA -0.237 57.744 58.000 -0.031 0.000 1.330 367 F CB -0.031 38.938 39.000 -0.053 0.000 1.084 367 F HN -0.010 8.290 8.300 -0.000 0.000 0.578 368 A N 1.371 124.287 122.820 0.160 0.000 2.565 368 A HA 0.351 4.661 4.320 -0.017 0.000 0.237 368 A C 0.734 178.344 177.584 0.043 0.000 1.053 368 A CA -0.099 52.033 52.037 0.157 0.000 0.755 368 A CB -0.264 18.869 19.000 0.221 0.000 0.980 368 A HN 0.192 8.342 8.150 -0.000 0.000 0.506 369 V N 0.000 119.876 119.914 -0.062 0.000 2.409 369 V HA 0.000 4.110 4.120 -0.017 0.000 0.244 369 V CA 0.000 62.205 62.300 -0.158 0.000 1.235 369 V CB 0.000 31.565 31.823 -0.430 0.000 1.184 369 V HN 0.000 8.190 8.190 -0.000 0.000 0.556