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 3e93_1_A DATA FIRST_RESID 4 DATA SEQUENCE ERPTFYRQEL NKTIWEVPER YQNLSPVGSG AYGSVCAAFD TKTGLRVAVK DATA SEQUENCE KLSRPFQSII HAKRTYRELR LLKHMKHENV IGLLDVFTPA RSLEEFNDVY DATA SEQUENCE LVTHLMGADL NNIVKCQKLT DDHVQFLIYQ ILRGLKYIHS ADIIHRDLKP DATA SEQUENCE SNLAVNEDXE LKILDFGLXX XTDDEMTGYV ATRWYRAPEI MLNWMHYNQT DATA SEQUENCE VDIWSVGCIM AELLTGRTLF PGTDHIDQLK LILRLVGTPG AELLKKISSE DATA SEQUENCE SARNYIQSLT QMPKMNFANV FIGANPLAVD LLEKMLVLDS DKRITAAQAL DATA SEQUENCE AHAYFAQYHD PDDEPVADPY DQSFESRDLL IDEWKSLTYD EVISFVPPPL 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 4 E HA 0.000 nan 4.350 nan 0.000 0.291 4 E C 0.000 176.634 176.600 0.056 0.000 1.382 4 E CA 0.000 56.422 56.400 0.037 0.000 0.976 4 E CB 0.000 29.714 29.700 0.024 0.000 0.812 5 R N 3.779 124.327 120.500 0.081 0.000 2.298 5 R HA 0.349 4.687 4.340 -0.002 0.000 0.310 5 R C -1.901 174.471 176.300 0.121 0.000 1.068 5 R CA -1.211 54.972 56.100 0.138 0.000 0.957 5 R CB 0.509 30.910 30.300 0.168 0.000 1.003 5 R HN 0.333 8.603 8.270 -0.000 0.000 0.454 6 P HA 0.038 4.458 4.420 -0.000 0.000 0.271 6 P C -0.717 176.625 177.300 0.069 0.000 1.233 6 P CA -0.197 62.882 63.100 -0.034 0.000 0.789 6 P CB 0.473 32.017 31.700 -0.260 0.000 0.951 7 T N 1.407 115.970 114.554 0.015 0.000 2.884 7 T HA 0.329 4.678 4.350 -0.002 0.000 0.298 7 T C -0.016 174.726 174.700 0.071 0.000 0.998 7 T CA 0.346 62.517 62.100 0.117 0.000 1.124 7 T CB -0.210 68.698 68.868 0.066 0.000 0.931 7 T HN 0.115 8.355 8.240 -0.000 0.000 0.531 8 F N 2.308 122.283 119.950 0.042 0.000 2.470 8 F HA 0.582 5.108 4.527 -0.001 0.000 0.329 8 F C -0.014 175.881 175.800 0.159 0.000 1.072 8 F CA -1.150 56.878 58.000 0.046 0.000 0.989 8 F CB 1.164 40.158 39.000 -0.009 0.000 1.193 8 F HN 0.574 8.874 8.300 -0.000 0.000 0.481 9 Y N -0.654 119.735 120.300 0.147 0.000 2.570 9 Y HA 0.823 5.372 4.550 -0.002 0.000 0.345 9 Y C -1.086 174.909 175.900 0.158 0.000 1.014 9 Y CA -1.906 56.270 58.100 0.125 0.000 1.063 9 Y CB 1.210 39.712 38.460 0.069 0.000 1.272 9 Y HN 0.509 8.789 8.280 -0.000 0.000 0.477 10 R N 2.239 122.838 120.500 0.164 0.000 2.532 10 R HA 0.511 4.850 4.340 -0.002 0.000 0.295 10 R C -1.075 175.311 176.300 0.143 0.000 0.968 10 R CA -0.930 55.231 56.100 0.103 0.000 0.916 10 R CB 1.937 32.316 30.300 0.132 0.000 1.124 10 R HN 0.927 9.197 8.270 -0.000 0.000 0.463 11 Q N 0.653 120.535 119.800 0.136 0.000 2.462 11 Q HA 0.351 4.690 4.340 -0.002 0.000 0.285 11 Q C -1.347 174.771 176.000 0.196 0.000 1.035 11 Q CA -1.028 54.871 55.803 0.161 0.000 0.799 11 Q CB 2.159 30.987 28.738 0.151 0.000 1.452 11 Q HN 0.457 8.727 8.270 -0.000 0.000 0.404 12 E N 1.584 121.880 120.200 0.160 0.000 2.174 12 E HA 0.413 4.762 4.350 -0.002 0.000 0.282 12 E C -1.335 175.359 176.600 0.156 0.000 0.992 12 E CA -0.533 55.972 56.400 0.175 0.000 0.803 12 E CB 0.933 30.706 29.700 0.121 0.000 1.090 12 E HN 0.513 8.873 8.360 -0.000 0.000 0.396 13 L N 4.992 126.350 121.223 0.226 0.000 2.401 13 L HA 0.320 4.659 4.340 -0.002 0.000 0.263 13 L C -0.458 176.505 176.870 0.155 0.000 1.004 13 L CA -0.356 54.550 54.840 0.111 0.000 0.881 13 L CB 0.624 42.606 42.059 -0.128 0.000 1.219 13 L HN 0.755 8.985 8.230 -0.000 0.000 0.441 14 N N 3.179 121.935 118.700 0.093 0.000 2.708 14 N HA -0.201 4.538 4.740 -0.002 0.000 0.255 14 N C -0.399 175.169 175.510 0.097 0.000 1.046 14 N CA 0.348 53.448 53.050 0.083 0.000 0.715 14 N CB -0.615 37.916 38.487 0.073 0.000 0.895 14 N HN 0.611 8.991 8.380 -0.000 0.000 0.545 15 K N -2.099 118.355 120.400 0.089 0.000 3.035 15 K HA -0.223 4.096 4.320 -0.002 0.000 0.262 15 K C -0.874 175.777 176.600 0.086 0.000 1.024 15 K CA 1.320 57.652 56.287 0.076 0.000 0.748 15 K CB -1.493 31.035 32.500 0.047 0.000 1.247 15 K HN 0.458 8.707 8.250 -0.000 0.000 0.482 16 T N 0.895 115.537 114.554 0.147 0.000 2.881 16 T HA 0.415 4.764 4.350 -0.002 0.000 0.290 16 T C 0.043 174.876 174.700 0.221 0.000 1.000 16 T CA -0.857 61.328 62.100 0.141 0.000 0.978 16 T CB 1.481 70.463 68.868 0.190 0.000 0.997 16 T HN 0.031 8.271 8.240 -0.000 0.000 0.443 17 I N 2.763 123.396 120.570 0.106 0.000 2.471 17 I HA 0.192 4.360 4.170 -0.002 0.000 0.286 17 I C -0.612 175.584 176.117 0.131 0.000 1.079 17 I CA -0.454 60.935 61.300 0.148 0.000 1.398 17 I CB 0.199 38.250 38.000 0.085 0.000 1.403 17 I HN 0.671 8.881 8.210 -0.000 0.000 0.530 18 W N 5.311 126.685 121.300 0.124 0.000 2.417 18 W HA 0.427 5.086 4.660 -0.001 0.000 0.315 18 W C 0.353 176.918 176.519 0.078 0.000 1.045 18 W CA -0.552 56.907 57.345 0.190 0.000 1.221 18 W CB 0.966 30.506 29.460 0.134 0.000 1.309 18 W HN 0.434 8.614 8.180 -0.000 0.000 0.453 19 E N 3.379 123.734 120.200 0.259 0.000 2.141 19 E HA 0.472 4.821 4.350 -0.002 0.000 0.259 19 E C -1.054 175.591 176.600 0.076 0.000 0.883 19 E CA -0.529 55.953 56.400 0.137 0.000 0.744 19 E CB 0.967 30.774 29.700 0.178 0.000 1.150 19 E HN 0.351 8.711 8.360 -0.000 0.000 0.420 20 V N 1.491 121.340 119.914 -0.109 0.000 2.914 20 V HA 0.723 4.841 4.120 -0.002 0.000 0.314 20 V C -2.772 172.940 176.094 -0.636 0.000 1.084 20 V CA -2.925 59.146 62.300 -0.381 0.000 0.963 20 V CB 1.674 33.383 31.823 -0.189 0.000 1.025 20 V HN 0.486 8.676 8.190 -0.000 0.000 0.432 21 P HA 0.156 4.576 4.420 -0.000 0.000 0.266 21 P C 0.634 177.778 177.300 -0.259 0.000 1.195 21 P CA 0.300 62.846 63.100 -0.923 0.000 0.768 21 P CB 0.405 31.544 31.700 -0.934 0.000 0.838 22 E N 2.680 122.807 120.200 -0.122 0.000 2.171 22 E HA -0.292 4.056 4.350 -0.002 0.000 0.197 22 E C 1.868 178.401 176.600 -0.112 0.000 0.997 22 E CA 1.088 57.481 56.400 -0.011 0.000 0.810 22 E CB -0.187 29.449 29.700 -0.105 0.000 0.738 22 E HN 0.514 8.874 8.360 -0.000 0.000 0.467 23 R N 0.498 120.821 120.500 -0.296 0.000 2.159 23 R HA -0.149 4.190 4.340 -0.002 0.000 0.237 23 R C 0.168 176.213 176.300 -0.425 0.000 1.131 23 R CA 1.009 56.852 56.100 -0.427 0.000 0.982 23 R CB -0.531 29.393 30.300 -0.626 0.000 0.868 23 R HN 0.086 8.356 8.270 -0.000 0.000 0.453 24 Y N 2.110 122.380 120.300 -0.050 0.000 2.383 24 Y HA 0.307 4.856 4.550 -0.002 0.000 0.344 24 Y C 0.324 176.312 175.900 0.146 0.000 0.986 24 Y CA -0.605 57.504 58.100 0.015 0.000 1.175 24 Y CB 0.895 39.357 38.460 0.003 0.000 1.152 24 Y HN 0.023 8.303 8.280 -0.000 0.000 0.511 25 Q N 1.611 121.574 119.800 0.272 0.000 2.445 25 Q HA 0.357 4.696 4.340 -0.002 0.000 0.281 25 Q C -0.156 175.981 176.000 0.230 0.000 1.101 25 Q CA -0.916 55.035 55.803 0.246 0.000 0.833 25 Q CB 1.678 30.526 28.738 0.184 0.000 1.416 25 Q HN 0.719 8.989 8.270 -0.000 0.000 0.451 26 N N 0.022 118.820 118.700 0.164 0.000 2.740 26 N HA -0.191 4.548 4.740 -0.002 0.000 0.248 26 N C -0.820 174.729 175.510 0.065 0.000 1.062 26 N CA 0.328 53.439 53.050 0.102 0.000 0.704 26 N CB -1.473 37.068 38.487 0.091 0.000 0.968 26 N HN 0.361 8.741 8.380 -0.000 0.000 0.547 27 L N 0.441 121.690 121.223 0.043 0.000 2.513 27 L HA 0.144 4.483 4.340 -0.002 0.000 0.272 27 L C 0.919 177.712 176.870 -0.128 0.000 1.187 27 L CA 0.959 55.750 54.840 -0.082 0.000 0.895 27 L CB 0.835 42.786 42.059 -0.180 0.000 1.147 27 L HN 0.241 8.471 8.230 -0.000 0.000 0.483 28 S N 4.930 120.539 115.700 -0.151 0.000 2.672 28 S HA 0.608 5.077 4.470 -0.002 0.000 0.291 28 S C -2.662 171.843 174.600 -0.157 0.000 1.145 28 S CA -1.427 56.696 58.200 -0.127 0.000 1.013 28 S CB 1.337 64.501 63.200 -0.061 0.000 1.017 28 S HN 0.249 8.559 8.310 -0.000 0.000 0.487 29 P HA 0.078 4.498 4.420 -0.000 0.000 0.265 29 P C 0.377 177.641 177.300 -0.061 0.000 1.193 29 P CA -0.046 62.983 63.100 -0.119 0.000 0.765 29 P CB 0.619 32.277 31.700 -0.070 0.000 0.823 30 V N 0.285 120.178 119.914 -0.035 0.000 3.432 30 V HA 0.663 4.782 4.120 -0.002 0.000 0.290 30 V C 0.255 176.335 176.094 -0.023 0.000 1.591 30 V CA 0.269 62.552 62.300 -0.029 0.000 1.069 30 V CB 0.203 32.010 31.823 -0.027 0.000 0.892 30 V HN 0.679 8.869 8.190 -0.000 0.000 0.436 31 G N -0.491 108.313 108.800 0.007 0.000 2.387 31 G HA2 0.495 4.454 3.960 -0.002 0.000 0.309 31 G HA3 0.495 4.454 3.960 -0.002 0.000 0.309 31 G C -1.436 173.496 174.900 0.054 0.000 1.641 31 G CA 0.316 45.423 45.100 0.012 0.000 0.904 31 G HN 0.572 8.862 8.290 -0.000 0.000 0.661 32 S N -0.245 115.479 115.700 0.040 0.000 2.540 32 S HA 0.971 5.440 4.470 -0.002 0.000 0.275 32 S C 0.168 174.790 174.600 0.036 0.000 1.123 32 S CA 0.430 58.662 58.200 0.053 0.000 0.907 32 S CB 1.754 64.987 63.200 0.054 0.000 1.081 32 S HN 2.183 10.493 8.310 -0.000 0.000 0.476 33 G N 0.917 109.739 108.800 0.037 0.000 2.548 33 G HA2 0.596 4.555 3.960 -0.002 0.000 0.301 33 G HA3 0.596 4.555 3.960 -0.002 0.000 0.301 33 G C 0.550 175.462 174.900 0.020 0.000 1.349 33 G CA 0.064 45.184 45.100 0.033 0.000 0.792 33 G HN 1.054 9.344 8.290 -0.000 0.000 0.481 34 A N -1.169 121.663 122.820 0.020 0.000 1.940 34 A HA 0.023 4.342 4.320 -0.002 0.000 0.219 34 A C 1.684 179.194 177.584 -0.122 0.000 1.176 34 A CA 1.847 53.856 52.037 -0.047 0.000 0.631 34 A CB -0.514 18.460 19.000 -0.044 0.000 0.814 34 A HN 0.634 8.784 8.150 -0.000 0.000 0.446 35 Y N -0.982 119.288 120.300 -0.050 0.000 2.457 35 Y HA 0.406 4.954 4.550 -0.002 0.000 0.263 35 Y C 1.254 177.092 175.900 -0.104 0.000 1.164 35 Y CA 0.457 58.505 58.100 -0.085 0.000 1.274 35 Y CB 0.412 38.798 38.460 -0.124 0.000 1.097 35 Y HN 0.498 8.778 8.280 -0.000 0.000 0.523 36 G N -0.841 107.972 108.800 0.022 0.000 2.356 36 G HA2 0.374 4.333 3.960 -0.002 0.000 0.300 36 G HA3 0.374 4.333 3.960 -0.002 0.000 0.300 36 G C -1.452 173.457 174.900 0.014 0.000 1.331 36 G CA -0.478 44.602 45.100 -0.034 0.000 0.905 36 G HN 0.186 8.476 8.290 -0.000 0.000 0.587 37 S N -1.871 113.850 115.700 0.035 0.000 2.579 37 S HA 0.853 5.322 4.470 -0.002 0.000 0.272 37 S C -1.138 173.650 174.600 0.314 0.000 1.141 37 S CA -0.722 57.576 58.200 0.163 0.000 0.843 37 S CB 2.075 65.405 63.200 0.217 0.000 1.122 37 S HN 1.587 9.897 8.310 -0.000 0.000 0.468 38 V N 0.402 120.489 119.914 0.289 0.000 2.656 38 V HA 0.626 4.744 4.120 -0.002 0.000 0.307 38 V C -0.621 175.530 176.094 0.096 0.000 1.051 38 V CA -0.606 61.847 62.300 0.256 0.000 0.893 38 V CB 1.468 33.385 31.823 0.156 0.000 0.999 38 V HN 1.183 9.373 8.190 -0.000 0.000 0.426 39 C N 3.153 122.435 119.300 -0.029 0.000 2.455 39 C HA 0.833 5.292 4.460 -0.002 0.000 0.320 39 C C 0.770 175.708 174.990 -0.086 0.000 1.226 39 C CA -0.798 58.080 59.018 -0.233 0.000 1.569 39 C CB 1.171 28.509 27.740 -0.670 0.000 2.200 39 C HN 1.050 9.280 8.230 -0.000 0.000 0.491 40 A N 2.403 125.189 122.820 -0.056 0.000 2.425 40 A HA 0.758 5.077 4.320 -0.002 0.000 0.249 40 A C 0.158 177.748 177.584 0.009 0.000 1.084 40 A CA 0.330 52.369 52.037 0.003 0.000 0.781 40 A CB 0.258 19.268 19.000 0.017 0.000 1.019 40 A HN 1.508 9.658 8.150 -0.000 0.000 0.490 41 A N 0.971 123.836 122.820 0.075 0.000 2.583 41 A HA 0.745 5.064 4.320 -0.002 0.000 0.289 41 A C -1.410 176.327 177.584 0.254 0.000 1.151 41 A CA -0.451 51.670 52.037 0.140 0.000 0.695 41 A CB 0.902 19.979 19.000 0.128 0.000 1.290 41 A HN 1.476 9.626 8.150 -0.000 0.000 0.419 42 F N 1.221 121.244 119.950 0.121 0.000 2.449 42 F HA 0.531 5.056 4.527 -0.002 0.000 0.342 42 F C -0.561 175.327 175.800 0.147 0.000 1.127 42 F CA -1.006 57.060 58.000 0.110 0.000 0.975 42 F CB 1.498 40.535 39.000 0.062 0.000 1.146 42 F HN 0.519 8.819 8.300 -0.000 0.000 0.444 43 D N 4.016 124.163 120.400 -0.423 0.000 2.393 43 D HA 0.095 4.734 4.640 -0.002 0.000 0.232 43 D C 1.287 177.088 176.300 -0.832 0.000 1.192 43 D CA 0.166 53.912 54.000 -0.423 0.000 0.882 43 D CB 1.083 41.800 40.800 -0.138 0.000 1.038 43 D HN 0.680 9.050 8.370 -0.000 0.000 0.499 44 T N 1.025 115.189 114.554 -0.650 0.000 2.962 44 T HA -0.153 4.196 4.350 -0.002 0.000 0.270 44 T C 1.649 176.155 174.700 -0.323 0.000 1.088 44 T CA 0.741 62.558 62.100 -0.472 0.000 1.127 44 T CB 0.030 68.800 68.868 -0.162 0.000 0.883 44 T HN 0.303 8.543 8.240 -0.000 0.000 0.493 45 K N 1.239 121.439 120.400 -0.332 0.000 2.057 45 K HA -0.080 4.239 4.320 -0.002 0.000 0.206 45 K C 2.271 178.765 176.600 -0.176 0.000 1.050 45 K CA 1.758 57.907 56.287 -0.229 0.000 0.935 45 K CB -0.195 32.160 32.500 -0.241 0.000 0.715 45 K HN 0.637 8.887 8.250 -0.000 0.000 0.439 46 T N -4.205 110.226 114.554 -0.206 0.000 3.023 46 T HA 0.195 4.544 4.350 -0.002 0.000 0.253 46 T C 1.175 175.812 174.700 -0.105 0.000 1.038 46 T CA 0.489 62.517 62.100 -0.121 0.000 0.962 46 T CB 0.684 69.502 68.868 -0.083 0.000 1.018 46 T HN 0.305 8.545 8.240 -0.000 0.000 0.521 47 G N 1.703 110.367 108.800 -0.227 0.000 2.166 47 G HA2 -0.234 3.725 3.960 -0.002 0.000 0.260 47 G HA3 -0.234 3.725 3.960 -0.002 0.000 0.260 47 G C -0.051 174.867 174.900 0.030 0.000 0.986 47 G CA 0.425 45.465 45.100 -0.101 0.000 0.683 47 G HN 0.643 8.933 8.290 -0.000 0.000 0.527 48 L N 0.047 121.213 121.223 -0.094 0.000 2.350 48 L HA 0.456 4.794 4.340 -0.002 0.000 0.275 48 L C 1.266 178.217 176.870 0.134 0.000 1.099 48 L CA -0.926 53.958 54.840 0.073 0.000 0.808 48 L CB 0.883 42.973 42.059 0.053 0.000 1.149 48 L HN 0.081 8.311 8.230 -0.000 0.000 0.442 49 R N 2.232 122.893 120.500 0.268 0.000 2.401 49 R HA 0.346 4.685 4.340 -0.002 0.000 0.299 49 R C -0.519 175.890 176.300 0.182 0.000 1.064 49 R CA -0.238 56.021 56.100 0.265 0.000 1.000 49 R CB 0.910 31.344 30.300 0.224 0.000 0.973 49 R HN 0.506 8.776 8.270 -0.000 0.000 0.438 50 V N -0.689 119.315 119.914 0.151 0.000 3.074 50 V HA 0.897 5.016 4.120 -0.002 0.000 0.314 50 V C -0.522 175.620 176.094 0.081 0.000 1.117 50 V CA -1.181 61.177 62.300 0.097 0.000 1.014 50 V CB 2.046 33.908 31.823 0.066 0.000 1.057 50 V HN 0.769 8.959 8.190 -0.000 0.000 0.438 51 A N 2.010 124.869 122.820 0.065 0.000 2.317 51 A HA 0.855 5.174 4.320 -0.002 0.000 0.327 51 A C -0.636 176.972 177.584 0.040 0.000 1.178 51 A CA -0.655 51.421 52.037 0.064 0.000 0.817 51 A CB 1.415 20.475 19.000 0.100 0.000 1.189 51 A HN 1.410 9.560 8.150 -0.000 0.000 0.489 52 V N 3.116 123.075 119.914 0.076 0.000 2.378 52 V HA 0.381 4.499 4.120 -0.002 0.000 0.288 52 V C 0.072 176.343 176.094 0.295 0.000 1.016 52 V CA -0.681 61.706 62.300 0.145 0.000 0.840 52 V CB 1.471 33.435 31.823 0.234 0.000 0.994 52 V HN 0.871 9.061 8.190 -0.000 0.000 0.431 53 K N 4.364 124.857 120.400 0.154 0.000 2.263 53 K HA 0.394 4.713 4.320 -0.002 0.000 0.272 53 K C -0.370 176.158 176.600 -0.119 0.000 1.033 53 K CA -0.647 55.700 56.287 0.100 0.000 0.884 53 K CB 1.082 33.590 32.500 0.014 0.000 1.107 53 K HN 0.648 8.898 8.250 -0.000 0.000 0.460 54 K N 6.337 126.542 120.400 -0.326 0.000 2.262 54 K HA 0.202 4.520 4.320 -0.002 0.000 0.282 54 K C -0.274 176.002 176.600 -0.539 0.000 1.066 54 K CA -0.472 55.295 56.287 -0.866 0.000 0.901 54 K CB 0.516 32.096 32.500 -1.532 0.000 1.089 54 K HN 0.575 8.825 8.250 -0.000 0.000 0.476 55 L N 2.909 123.838 121.223 -0.489 0.000 2.453 55 L HA 0.034 4.373 4.340 -0.002 0.000 0.272 55 L C 0.624 177.292 176.870 -0.337 0.000 1.182 55 L CA -0.067 54.579 54.840 -0.324 0.000 0.858 55 L CB 1.152 43.030 42.059 -0.302 0.000 1.120 55 L HN 0.632 8.862 8.230 -0.000 0.000 0.474 56 S N 4.399 119.963 115.700 -0.226 0.000 2.452 56 S HA 0.284 4.753 4.470 -0.002 0.000 0.284 56 S C 0.341 174.809 174.600 -0.221 0.000 1.171 56 S CA -0.559 57.507 58.200 -0.223 0.000 1.064 56 S CB 0.140 63.240 63.200 -0.167 0.000 0.967 56 S HN 0.662 8.972 8.310 -0.000 0.000 0.484 57 R N 3.095 123.448 120.500 -0.245 0.000 3.127 57 R HA -0.101 4.237 4.340 -0.002 0.000 0.247 57 R C -2.022 174.122 176.300 -0.260 0.000 0.896 57 R CA 0.570 56.521 56.100 -0.247 0.000 0.624 57 R CB -1.341 28.803 30.300 -0.261 0.000 1.154 57 R HN 0.614 8.884 8.270 -0.000 0.000 0.474 58 P HA -0.146 4.274 4.420 -0.000 0.000 0.220 58 P C 0.377 177.213 177.300 -0.774 0.000 1.148 58 P CA 1.412 64.100 63.100 -0.687 0.000 0.803 58 P CB 0.129 31.145 31.700 -1.140 0.000 0.782 59 F N -0.585 119.321 119.950 -0.074 0.000 2.805 59 F HA 0.266 4.792 4.527 -0.002 0.000 0.317 59 F C 2.045 177.795 175.800 -0.082 0.000 1.146 59 F CA -0.695 57.275 58.000 -0.050 0.000 1.265 59 F CB -0.746 38.203 39.000 -0.086 0.000 0.992 59 F HN -0.105 8.195 8.300 -0.000 0.000 0.511 60 Q N 0.722 120.471 119.800 -0.084 0.000 2.291 60 Q HA 0.017 4.355 4.340 -0.002 0.000 0.205 60 Q C 0.523 176.443 176.000 -0.132 0.000 0.970 60 Q CA 1.230 56.922 55.803 -0.185 0.000 0.876 60 Q CB 0.179 28.674 28.738 -0.405 0.000 0.935 60 Q HN 0.305 8.575 8.270 -0.000 0.000 0.455 61 S N -2.090 113.576 115.700 -0.056 0.000 2.625 61 S HA 0.386 4.855 4.470 -0.002 0.000 0.271 61 S C 0.498 175.173 174.600 0.126 0.000 1.161 61 S CA -0.868 57.352 58.200 0.033 0.000 0.820 61 S CB 0.260 63.478 63.200 0.030 0.000 1.137 61 S HN 0.157 8.467 8.310 -0.000 0.000 0.470 62 I N 0.842 121.490 120.570 0.130 0.000 2.163 62 I HA -0.159 4.010 4.170 -0.002 0.000 0.243 62 I C 2.156 178.297 176.117 0.039 0.000 1.085 62 I CA 1.468 62.859 61.300 0.152 0.000 1.347 62 I CB -0.438 37.675 38.000 0.189 0.000 1.044 62 I HN 0.614 8.824 8.210 -0.000 0.000 0.408 63 I N -0.107 120.507 120.570 0.072 0.000 2.163 63 I HA -0.361 3.808 4.170 -0.002 0.000 0.243 63 I C 2.613 178.758 176.117 0.047 0.000 1.085 63 I CA 1.537 62.860 61.300 0.038 0.000 1.347 63 I CB -0.599 37.454 38.000 0.088 0.000 1.044 63 I HN 0.298 8.508 8.210 -0.000 0.000 0.408 64 H N 0.166 119.248 119.070 0.019 0.000 2.321 64 H HA -0.124 4.431 4.556 -0.002 0.000 0.300 64 H C 2.358 177.673 175.328 -0.022 0.000 1.087 64 H CA 1.433 57.510 56.048 0.048 0.000 1.319 64 H CB -0.004 29.742 29.762 -0.026 0.000 1.379 64 H HN 0.389 8.669 8.280 -0.000 0.000 0.501 65 A N 1.301 124.204 122.820 0.138 0.000 1.902 65 A HA -0.198 4.121 4.320 -0.002 0.000 0.217 65 A C 2.338 179.908 177.584 -0.024 0.000 1.181 65 A CA 1.774 53.936 52.037 0.209 0.000 0.623 65 A CB -0.392 18.838 19.000 0.384 0.000 0.818 65 A HN 0.313 8.463 8.150 -0.000 0.000 0.443 66 K N -0.458 119.683 120.400 -0.432 0.000 2.057 66 K HA -0.140 4.179 4.320 -0.002 0.000 0.206 66 K C 2.342 178.770 176.600 -0.285 0.000 1.050 66 K CA 1.296 57.091 56.287 -0.821 0.000 0.935 66 K CB -0.210 31.647 32.500 -1.072 0.000 0.715 66 K HN 0.435 8.685 8.250 -0.000 0.000 0.439 67 R N 0.151 120.542 120.500 -0.181 0.000 2.091 67 R HA -0.128 4.211 4.340 -0.002 0.000 0.238 67 R C 1.779 178.020 176.300 -0.099 0.000 1.136 67 R CA 2.145 58.162 56.100 -0.139 0.000 0.959 67 R CB -0.423 29.756 30.300 -0.202 0.000 0.856 67 R HN 0.197 8.467 8.270 -0.000 0.000 0.437 68 T N 0.179 114.697 114.554 -0.061 0.000 2.652 68 T HA -0.219 4.130 4.350 -0.002 0.000 0.267 68 T C 1.398 176.125 174.700 0.044 0.000 1.039 68 T CA 1.681 63.755 62.100 -0.043 0.000 1.153 68 T CB -0.583 68.211 68.868 -0.123 0.000 0.863 68 T HN 0.390 8.630 8.240 -0.000 0.000 0.428 69 Y N 2.302 122.600 120.300 -0.002 0.000 2.128 69 Y HA -0.178 4.371 4.550 -0.002 0.000 0.284 69 Y C 2.700 178.515 175.900 -0.143 0.000 1.154 69 Y CA 1.669 59.759 58.100 -0.016 0.000 1.149 69 Y CB -0.336 38.149 38.460 0.042 0.000 0.976 69 Y HN -0.001 8.279 8.280 -0.000 0.000 0.505 70 R N 0.459 120.876 120.500 -0.139 0.000 2.094 70 R HA -0.269 4.070 4.340 -0.002 0.000 0.239 70 R C 2.397 178.656 176.300 -0.069 0.000 1.137 70 R CA 2.223 58.293 56.100 -0.049 0.000 0.943 70 R CB -0.583 29.800 30.300 0.138 0.000 0.850 70 R HN 0.588 8.858 8.270 -0.000 0.000 0.433 71 E N 0.040 120.189 120.200 -0.086 0.000 2.085 71 E HA -0.227 4.122 4.350 -0.002 0.000 0.194 71 E C 2.050 178.594 176.600 -0.093 0.000 0.994 71 E CA 1.327 57.673 56.400 -0.091 0.000 0.801 71 E CB -0.123 29.509 29.700 -0.112 0.000 0.743 71 E HN 0.304 8.664 8.360 -0.000 0.000 0.453 72 L N 1.297 122.452 121.223 -0.113 0.000 2.017 72 L HA -0.151 4.187 4.340 -0.002 0.000 0.208 72 L C 2.290 179.097 176.870 -0.106 0.000 1.073 72 L CA 1.653 56.434 54.840 -0.099 0.000 0.745 72 L CB -0.448 41.577 42.059 -0.057 0.000 0.894 72 L HN 0.035 8.265 8.230 -0.000 0.000 0.432 73 R N -0.304 120.052 120.500 -0.240 0.000 2.091 73 R HA -0.175 4.164 4.340 -0.002 0.000 0.238 73 R C 2.314 178.676 176.300 0.103 0.000 1.136 73 R CA 1.975 57.992 56.100 -0.138 0.000 0.959 73 R CB -1.241 28.826 30.300 -0.388 0.000 0.856 73 R HN 0.505 8.775 8.270 -0.000 0.000 0.437 74 L N 0.638 121.899 121.223 0.065 0.000 2.027 74 L HA -0.108 4.231 4.340 -0.002 0.000 0.206 74 L C 2.208 179.079 176.870 0.002 0.000 1.074 74 L CA 1.254 56.101 54.840 0.012 0.000 0.745 74 L CB -0.234 41.823 42.059 -0.003 0.000 0.898 74 L HN 0.096 8.326 8.230 -0.000 0.000 0.433 75 L N -0.178 121.044 121.223 -0.001 0.000 2.141 75 L HA -0.205 4.133 4.340 -0.002 0.000 0.209 75 L C 2.611 179.523 176.870 0.071 0.000 1.094 75 L CA 1.237 56.082 54.840 0.009 0.000 0.763 75 L CB -0.500 41.539 42.059 -0.033 0.000 0.908 75 L HN 0.244 8.474 8.230 -0.000 0.000 0.437 76 K N -1.027 119.437 120.400 0.106 0.000 2.148 76 K HA -0.205 4.114 4.320 -0.002 0.000 0.204 76 K C 2.003 178.719 176.600 0.194 0.000 1.050 76 K CA 1.182 57.587 56.287 0.197 0.000 0.942 76 K CB -0.107 32.520 32.500 0.212 0.000 0.724 76 K HN 0.283 8.533 8.250 -0.000 0.000 0.446 77 H N -0.228 118.877 119.070 0.058 0.000 2.448 77 H HA 0.135 4.690 4.556 -0.002 0.000 0.292 77 H C 0.177 175.546 175.328 0.067 0.000 1.035 77 H CA 0.472 56.538 56.048 0.030 0.000 1.349 77 H CB 0.354 30.024 29.762 -0.152 0.000 1.425 77 H HN -0.102 8.178 8.280 -0.000 0.000 0.539 78 M N 2.094 121.754 119.600 0.099 0.000 2.350 78 M HA 0.106 4.585 4.480 -0.002 0.000 0.338 78 M C -0.689 175.646 176.300 0.058 0.000 1.559 78 M CA 0.769 56.160 55.300 0.152 0.000 1.217 78 M CB 0.055 32.714 32.600 0.097 0.000 1.808 78 M HN 0.174 8.464 8.290 -0.000 0.000 0.458 79 K N 3.213 123.631 120.400 0.030 0.000 2.646 79 K HA 0.354 4.673 4.320 -0.002 0.000 0.210 79 K C -0.890 175.549 176.600 -0.269 0.000 1.020 79 K CA -0.401 55.842 56.287 -0.074 0.000 1.040 79 K CB 1.438 33.925 32.500 -0.021 0.000 1.253 79 K HN 0.551 8.801 8.250 -0.000 0.000 0.532 80 H N 1.196 119.985 119.070 -0.467 0.000 3.085 80 H HA 0.102 4.657 4.556 -0.002 0.000 0.356 80 H C -0.030 175.103 175.328 -0.325 0.000 1.178 80 H CA -0.317 55.378 56.048 -0.587 0.000 1.214 80 H CB 1.617 30.660 29.762 -1.198 0.000 1.881 80 H HN 0.469 8.749 8.280 -0.000 0.000 0.538 81 E N 2.116 122.044 120.200 -0.453 0.000 2.209 81 E HA -0.168 4.181 4.350 -0.002 0.000 0.196 81 E C 0.239 176.800 176.600 -0.064 0.000 0.993 81 E CA 1.389 57.657 56.400 -0.219 0.000 0.819 81 E CB 0.164 29.717 29.700 -0.244 0.000 0.745 81 E HN 0.502 8.862 8.360 -0.000 0.000 0.477 82 N N -0.249 118.539 118.700 0.147 0.000 2.238 82 N HA 0.096 4.835 4.740 -0.002 0.000 0.222 82 N C -1.304 174.174 175.510 -0.052 0.000 1.133 82 N CA -0.204 52.860 53.050 0.023 0.000 0.854 82 N CB 1.354 39.834 38.487 -0.012 0.000 1.041 82 N HN -0.163 8.217 8.380 -0.000 0.000 0.510 83 V N 1.175 121.064 119.914 -0.043 0.000 2.686 83 V HA 0.286 4.405 4.120 -0.002 0.000 0.306 83 V C -0.156 175.902 176.094 -0.058 0.000 1.065 83 V CA -1.124 61.124 62.300 -0.086 0.000 0.894 83 V CB 2.134 33.877 31.823 -0.134 0.000 1.004 83 V HN 0.034 8.224 8.190 -0.000 0.000 0.424 84 I N 3.791 124.326 120.570 -0.059 0.000 2.845 84 I HA 0.446 4.614 4.170 -0.002 0.000 0.296 84 I C 0.839 176.951 176.117 -0.009 0.000 1.216 84 I CA 1.379 62.657 61.300 -0.037 0.000 1.438 84 I CB 0.468 38.420 38.000 -0.080 0.000 1.342 84 I HN 0.803 9.013 8.210 -0.000 0.000 0.577 85 G N 6.321 115.140 108.800 0.032 0.000 2.816 85 G HA2 0.587 4.546 3.960 -0.002 0.000 0.288 85 G HA3 0.587 4.546 3.960 -0.002 0.000 0.288 85 G C -1.798 173.138 174.900 0.059 0.000 1.334 85 G CA -0.827 44.303 45.100 0.051 0.000 0.978 85 G HN 0.593 8.883 8.290 -0.000 0.000 0.493 86 L N 0.813 122.089 121.223 0.088 0.000 2.276 86 L HA 0.470 4.809 4.340 -0.002 0.000 0.286 86 L C 0.970 177.932 176.870 0.153 0.000 1.024 86 L CA -0.508 54.366 54.840 0.056 0.000 0.826 86 L CB 1.106 43.177 42.059 0.021 0.000 1.211 86 L HN 0.533 8.763 8.230 -0.000 0.000 0.422 87 L N 2.429 123.686 121.223 0.056 0.000 2.131 87 L HA 0.161 4.500 4.340 -0.002 0.000 0.206 87 L C 0.053 177.059 176.870 0.227 0.000 1.087 87 L CA 0.721 55.629 54.840 0.112 0.000 0.767 87 L CB -0.075 41.960 42.059 -0.040 0.000 0.917 87 L HN 0.642 8.872 8.230 -0.000 0.000 0.441 88 D N -2.104 118.260 120.400 -0.059 0.000 2.648 88 D HA 0.406 5.045 4.640 -0.002 0.000 0.244 88 D C -1.661 174.372 176.300 -0.445 0.000 1.244 88 D CA -0.220 53.681 54.000 -0.165 0.000 0.772 88 D CB 2.582 43.539 40.800 0.260 0.000 1.379 88 D HN -0.280 8.090 8.370 -0.000 0.000 0.428 89 V N 3.006 122.642 119.914 -0.463 0.000 2.808 89 V HA 0.898 5.017 4.120 -0.002 0.000 0.308 89 V C -1.672 174.449 176.094 0.045 0.000 1.099 89 V CA -0.484 61.640 62.300 -0.293 0.000 0.920 89 V CB 1.259 32.851 31.823 -0.384 0.000 1.014 89 V HN 0.536 8.726 8.190 -0.000 0.000 0.425 90 F N 2.571 122.590 119.950 0.115 0.000 2.662 90 F HA 0.916 5.442 4.527 -0.002 0.000 0.312 90 F C -0.749 175.266 175.800 0.359 0.000 1.113 90 F CA -0.639 57.498 58.000 0.228 0.000 0.951 90 F CB 1.790 40.937 39.000 0.245 0.000 1.344 90 F HN 0.570 8.870 8.300 -0.000 0.000 0.462 91 T N 0.928 115.878 114.554 0.661 0.000 2.933 91 T HA 0.523 4.872 4.350 -0.002 0.000 0.305 91 T C -2.502 172.383 174.700 0.308 0.000 1.092 91 T CA -1.803 60.645 62.100 0.580 0.000 1.008 91 T CB 1.926 71.156 68.868 0.603 0.000 1.102 91 T HN 0.494 8.733 8.240 -0.000 0.000 0.469 92 P HA 0.227 4.647 4.420 -0.000 0.000 0.233 92 P C 0.195 177.310 177.300 -0.307 0.000 1.167 92 P CA 0.071 62.777 63.100 -0.657 0.000 0.770 92 P CB -0.136 31.362 31.700 -0.337 0.000 0.837 93 A N 0.376 123.211 122.820 0.026 0.000 2.511 93 A HA 0.093 4.411 4.320 -0.002 0.000 0.242 93 A C 1.212 178.838 177.584 0.069 0.000 1.069 93 A CA 0.031 52.124 52.037 0.093 0.000 0.763 93 A CB 0.017 19.184 19.000 0.278 0.000 1.001 93 A HN -0.030 8.120 8.150 -0.000 0.000 0.498 94 R N 0.355 120.877 120.500 0.036 0.000 2.280 94 R HA 0.120 4.459 4.340 -0.002 0.000 0.195 94 R C 0.275 176.627 176.300 0.087 0.000 0.935 94 R CA 0.960 57.094 56.100 0.056 0.000 1.033 94 R CB 0.188 30.503 30.300 0.025 0.000 0.964 94 R HN 0.879 9.149 8.270 -0.000 0.000 0.489 95 S N -2.057 113.666 115.700 0.038 0.000 2.625 95 S HA 0.157 4.626 4.470 -0.002 0.000 0.271 95 S C 0.323 174.708 174.600 -0.357 0.000 1.161 95 S CA -0.935 57.234 58.200 -0.050 0.000 0.820 95 S CB 0.961 64.136 63.200 -0.042 0.000 1.137 95 S HN -0.016 8.294 8.310 -0.000 0.000 0.470 96 L N 1.242 122.080 121.223 -0.640 0.000 2.079 96 L HA 0.037 4.376 4.340 -0.002 0.000 0.210 96 L C 2.164 178.845 176.870 -0.315 0.000 1.081 96 L CA 2.220 56.560 54.840 -0.832 0.000 0.752 96 L CB -1.137 40.604 42.059 -0.529 0.000 0.896 96 L HN 0.855 9.085 8.230 -0.000 0.000 0.433 97 E N 0.312 120.398 120.200 -0.191 0.000 2.118 97 E HA -0.239 4.110 4.350 -0.002 0.000 0.195 97 E C 1.867 178.425 176.600 -0.071 0.000 0.992 97 E CA 1.668 58.006 56.400 -0.105 0.000 0.804 97 E CB -0.253 29.404 29.700 -0.072 0.000 0.741 97 E HN 0.844 9.204 8.360 -0.000 0.000 0.458 98 E N -0.456 119.713 120.200 -0.051 0.000 2.476 98 E HA -0.001 4.348 4.350 -0.002 0.000 0.196 98 E C -0.218 176.415 176.600 0.054 0.000 1.029 98 E CA -0.462 55.933 56.400 -0.008 0.000 0.896 98 E CB -0.126 29.572 29.700 -0.002 0.000 1.012 98 E HN 0.091 8.451 8.360 -0.000 0.000 0.475 99 F N 2.388 122.243 119.950 -0.159 0.000 2.502 99 F HA 0.220 4.746 4.527 -0.002 0.000 0.371 99 F C 0.411 176.201 175.800 -0.016 0.000 1.083 99 F CA -0.210 57.730 58.000 -0.101 0.000 1.174 99 F CB 0.589 39.420 39.000 -0.280 0.000 1.096 99 F HN -0.097 8.203 8.300 -0.000 0.000 0.545 100 N N 2.901 121.463 118.700 -0.230 0.000 2.028 100 N HA 0.029 4.768 4.740 -0.002 0.000 0.230 100 N C -1.214 174.196 175.510 -0.168 0.000 1.354 100 N CA 0.060 52.995 53.050 -0.192 0.000 0.855 100 N CB 0.608 39.051 38.487 -0.073 0.000 1.111 100 N HN 0.509 8.889 8.380 -0.000 0.000 0.480 101 D N 0.562 120.893 120.400 -0.115 0.000 2.780 101 D HA 0.420 5.059 4.640 -0.002 0.000 0.242 101 D C -0.673 175.672 176.300 0.076 0.000 1.135 101 D CA -0.253 53.690 54.000 -0.095 0.000 0.859 101 D CB 3.382 44.162 40.800 -0.032 0.000 1.530 101 D HN -0.322 8.048 8.370 -0.000 0.000 0.493 102 V N 2.372 122.206 119.914 -0.134 0.000 2.588 102 V HA 0.412 4.531 4.120 -0.002 0.000 0.304 102 V C -1.204 174.691 176.094 -0.332 0.000 1.042 102 V CA -0.716 61.577 62.300 -0.012 0.000 0.877 102 V CB 1.480 33.318 31.823 0.024 0.000 0.996 102 V HN 0.410 8.600 8.190 -0.000 0.000 0.425 103 Y N 4.413 124.474 120.300 -0.399 0.000 2.376 103 Y HA 0.713 5.262 4.550 -0.002 0.000 0.340 103 Y C -0.176 175.365 175.900 -0.599 0.000 0.965 103 Y CA -0.734 56.978 58.100 -0.646 0.000 1.078 103 Y CB 1.864 39.523 38.460 -1.336 0.000 1.193 103 Y HN 0.423 8.703 8.280 -0.000 0.000 0.452 104 L N 4.125 125.198 121.223 -0.251 0.000 2.329 104 L HA 0.770 5.108 4.340 -0.002 0.000 0.279 104 L C -0.972 175.808 176.870 -0.150 0.000 1.014 104 L CA -1.123 53.593 54.840 -0.207 0.000 0.814 104 L CB 1.685 43.654 42.059 -0.150 0.000 1.257 104 L HN 0.296 8.526 8.230 -0.000 0.000 0.424 105 V N 1.249 121.073 119.914 -0.150 0.000 2.487 105 V HA 0.656 4.775 4.120 -0.002 0.000 0.298 105 V C 0.143 176.195 176.094 -0.070 0.000 1.028 105 V CA -0.416 61.824 62.300 -0.101 0.000 0.860 105 V CB 1.849 33.614 31.823 -0.097 0.000 0.991 105 V HN 0.931 9.121 8.190 -0.000 0.000 0.427 106 T N 0.286 114.818 114.554 -0.038 0.000 2.864 106 T HA 0.518 4.866 4.350 -0.002 0.000 0.289 106 T C -0.239 174.454 174.700 -0.011 0.000 1.082 106 T CA -0.787 61.300 62.100 -0.021 0.000 1.009 106 T CB 1.399 70.279 68.868 0.021 0.000 1.234 106 T HN 0.569 8.809 8.240 -0.000 0.000 0.526 107 H N 0.289 119.388 119.070 0.048 0.000 3.016 107 H HA 0.132 4.687 4.556 -0.002 0.000 0.345 107 H C -0.037 175.329 175.328 0.063 0.000 1.066 107 H CA -0.019 56.063 56.048 0.057 0.000 1.390 107 H CB 0.549 30.338 29.762 0.044 0.000 1.344 107 H HN 0.457 8.737 8.280 -0.000 0.000 0.605 108 L N 4.289 125.636 121.223 0.208 0.000 2.319 108 L HA 0.099 4.438 4.340 -0.002 0.000 0.280 108 L C -0.136 176.820 176.870 0.144 0.000 1.099 108 L CA -0.148 54.784 54.840 0.154 0.000 0.828 108 L CB 0.340 42.477 42.059 0.131 0.000 1.150 108 L HN 0.433 8.663 8.230 -0.000 0.000 0.442 109 M N 3.942 123.630 119.600 0.147 0.000 2.274 109 M HA 0.336 4.815 4.480 -0.002 0.000 0.344 109 M C 0.881 177.238 176.300 0.095 0.000 1.161 109 M CA -0.010 55.370 55.300 0.133 0.000 1.126 109 M CB 0.722 33.453 32.600 0.218 0.000 1.522 109 M HN 0.761 9.051 8.290 -0.000 0.000 0.461 110 G N 1.285 110.124 108.800 0.065 0.000 2.756 110 G HA2 0.524 4.482 3.960 -0.002 0.000 0.203 110 G HA3 0.524 4.482 3.960 -0.002 0.000 0.203 110 G C -0.182 174.730 174.900 0.020 0.000 2.015 110 G CA 0.081 45.202 45.100 0.035 0.000 0.835 110 G HN 0.815 9.105 8.290 -0.000 0.000 0.648 111 A N 0.511 123.338 122.820 0.012 0.000 2.322 111 A HA 0.555 4.874 4.320 -0.002 0.000 0.269 111 A C -0.141 177.449 177.584 0.011 0.000 1.094 111 A CA 0.127 52.163 52.037 -0.002 0.000 0.807 111 A CB 0.367 19.362 19.000 -0.008 0.000 1.047 111 A HN 0.650 8.800 8.150 -0.000 0.000 0.487 112 D N 0.223 120.622 120.400 -0.002 0.000 2.440 112 D HA 0.311 4.950 4.640 -0.002 0.000 0.258 112 D C 0.596 176.891 176.300 -0.009 0.000 1.092 112 D CA -0.758 53.251 54.000 0.016 0.000 1.016 112 D CB 0.415 41.229 40.800 0.023 0.000 1.141 112 D HN 0.174 8.544 8.370 -0.000 0.000 0.552 113 L N 0.362 121.574 121.223 -0.019 0.000 2.275 113 L HA -0.015 4.323 4.340 -0.002 0.000 0.215 113 L C 1.387 178.242 176.870 -0.024 0.000 1.119 113 L CA 1.412 56.231 54.840 -0.034 0.000 0.790 113 L CB -1.130 40.894 42.059 -0.059 0.000 0.919 113 L HN 0.372 8.602 8.230 -0.000 0.000 0.443 114 N N 0.036 118.723 118.700 -0.022 0.000 2.084 114 N HA -0.223 4.516 4.740 -0.002 0.000 0.190 114 N C 1.729 177.240 175.510 0.002 0.000 1.030 114 N CA 1.533 54.582 53.050 -0.002 0.000 0.849 114 N CB -0.386 38.100 38.487 -0.002 0.000 1.012 114 N HN 0.421 8.801 8.380 -0.000 0.000 0.423 115 N N 0.331 119.025 118.700 -0.009 0.000 2.104 115 N HA -0.084 4.655 4.740 -0.002 0.000 0.190 115 N C 1.484 176.989 175.510 -0.007 0.000 1.024 115 N CA 0.917 53.961 53.050 -0.009 0.000 0.853 115 N CB -0.047 38.430 38.487 -0.017 0.000 1.008 115 N HN 0.089 8.469 8.380 -0.000 0.000 0.424 116 I N 0.103 120.665 120.570 -0.013 0.000 2.142 116 I HA -0.185 3.983 4.170 -0.002 0.000 0.240 116 I C 2.139 178.253 176.117 -0.005 0.000 1.078 116 I CA 0.886 62.176 61.300 -0.018 0.000 1.343 116 I CB -1.374 36.608 38.000 -0.030 0.000 1.046 116 I HN 0.045 8.255 8.210 -0.000 0.000 0.405 117 V N 0.896 120.813 119.914 0.005 0.000 2.407 117 V HA -0.250 3.869 4.120 -0.002 0.000 0.248 117 V C 2.485 178.593 176.094 0.024 0.000 1.055 117 V CA 1.652 63.964 62.300 0.019 0.000 1.049 117 V CB -0.752 31.088 31.823 0.030 0.000 0.662 117 V HN 0.397 8.587 8.190 -0.000 0.000 0.455 118 K N -1.023 119.390 120.400 0.022 0.000 2.103 118 K HA -0.077 4.242 4.320 -0.002 0.000 0.204 118 K C 2.008 178.619 176.600 0.018 0.000 1.052 118 K CA 1.662 57.964 56.287 0.024 0.000 0.945 118 K CB -0.167 32.349 32.500 0.026 0.000 0.722 118 K HN 0.494 8.744 8.250 -0.000 0.000 0.443 119 C N -0.458 118.849 119.300 0.011 0.000 2.563 119 C HA 0.119 4.578 4.460 -0.002 0.000 0.346 119 C C 1.075 176.071 174.990 0.009 0.000 1.334 119 C CA -0.584 58.439 59.018 0.008 0.000 1.938 119 C CB -0.020 27.722 27.740 0.003 0.000 2.445 119 C HN 0.429 8.659 8.230 -0.000 0.000 0.541 120 Q N 1.607 121.410 119.800 0.005 0.000 2.226 120 Q HA 0.407 4.746 4.340 -0.002 0.000 0.256 120 Q C -0.744 175.269 176.000 0.023 0.000 0.962 120 Q CA -0.294 55.511 55.803 0.005 0.000 0.887 120 Q CB 0.885 29.609 28.738 -0.023 0.000 1.282 120 Q HN 0.302 8.572 8.270 -0.000 0.000 0.449 121 K N 3.104 123.529 120.400 0.041 0.000 2.156 121 K HA 0.411 4.730 4.320 -0.002 0.000 0.271 121 K C -1.201 175.470 176.600 0.119 0.000 0.995 121 K CA -0.438 55.888 56.287 0.066 0.000 0.890 121 K CB 0.754 33.290 32.500 0.060 0.000 1.073 121 K HN 0.599 8.849 8.250 -0.000 0.000 0.454 122 L N 4.104 125.409 121.223 0.137 0.000 2.282 122 L HA 0.291 4.629 4.340 -0.002 0.000 0.288 122 L C 0.672 177.672 176.870 0.218 0.000 1.033 122 L CA -0.815 54.170 54.840 0.242 0.000 0.807 122 L CB 1.490 43.650 42.059 0.169 0.000 1.209 122 L HN 0.815 9.044 8.230 -0.000 0.000 0.423 123 T N -2.394 112.305 114.554 0.241 0.000 2.788 123 T HA 0.031 4.380 4.350 -0.002 0.000 0.287 123 T C 0.766 175.497 174.700 0.052 0.000 1.007 123 T CA -0.470 61.648 62.100 0.030 0.000 1.005 123 T CB 1.329 70.085 68.868 -0.185 0.000 1.012 123 T HN 0.630 8.870 8.240 -0.000 0.000 0.530 124 D N -0.261 120.165 120.400 0.043 0.000 2.144 124 D HA -0.133 4.506 4.640 -0.002 0.000 0.199 124 D C 1.652 178.001 176.300 0.083 0.000 0.984 124 D CA 1.313 55.377 54.000 0.107 0.000 0.834 124 D CB -0.352 40.517 40.800 0.115 0.000 0.955 124 D HN 0.756 9.126 8.370 -0.000 0.000 0.465 125 D N -1.281 119.116 120.400 -0.004 0.000 2.123 125 D HA -0.179 4.460 4.640 -0.002 0.000 0.196 125 D C 1.735 178.105 176.300 0.118 0.000 0.992 125 D CA 1.381 55.394 54.000 0.021 0.000 0.833 125 D CB -0.162 40.596 40.800 -0.070 0.000 0.954 125 D HN 0.468 8.838 8.370 -0.000 0.000 0.455 126 H N -1.133 118.015 119.070 0.130 0.000 2.319 126 H HA -0.078 4.477 4.556 -0.002 0.000 0.299 126 H C 2.263 177.680 175.328 0.147 0.000 1.092 126 H CA 1.208 57.343 56.048 0.145 0.000 1.302 126 H CB 0.097 29.923 29.762 0.107 0.000 1.373 126 H HN 0.024 8.305 8.280 -0.000 0.000 0.497 127 V N 1.024 121.097 119.914 0.264 0.000 2.295 127 V HA -0.299 3.820 4.120 -0.002 0.000 0.246 127 V C 2.222 178.475 176.094 0.266 0.000 1.049 127 V CA 1.870 64.312 62.300 0.237 0.000 1.024 127 V CB -0.630 31.341 31.823 0.247 0.000 0.648 127 V HN 0.460 8.650 8.190 -0.000 0.000 0.447 128 Q N -1.021 118.886 119.800 0.178 0.000 2.062 128 Q HA -0.275 4.064 4.340 -0.002 0.000 0.209 128 Q C 2.188 178.326 176.000 0.231 0.000 0.996 128 Q CA 2.437 58.295 55.803 0.091 0.000 0.859 128 Q CB -0.361 28.345 28.738 -0.054 0.000 0.920 128 Q HN 0.633 8.903 8.270 -0.000 0.000 0.415 129 F N 0.764 120.618 119.950 -0.159 0.000 2.146 129 F HA -0.122 4.404 4.527 -0.002 0.000 0.298 129 F C 1.749 177.461 175.800 -0.147 0.000 1.096 129 F CA 1.120 58.831 58.000 -0.482 0.000 1.275 129 F CB -0.253 38.477 39.000 -0.450 0.000 1.008 129 F HN -0.024 8.276 8.300 -0.000 0.000 0.480 130 L N -0.427 120.744 121.223 -0.086 0.000 2.005 130 L HA -0.237 4.102 4.340 -0.002 0.000 0.207 130 L C 2.457 179.248 176.870 -0.132 0.000 1.072 130 L CA 0.752 55.488 54.840 -0.174 0.000 0.744 130 L CB -0.705 41.329 42.059 -0.043 0.000 0.895 130 L HN 0.064 8.294 8.230 -0.000 0.000 0.433 131 I N -0.824 119.767 120.570 0.035 0.000 2.226 131 I HA -0.329 3.840 4.170 -0.002 0.000 0.245 131 I C 2.508 178.531 176.117 -0.156 0.000 1.100 131 I CA 1.579 62.915 61.300 0.060 0.000 1.374 131 I CB -1.366 36.832 38.000 0.329 0.000 1.057 131 I HN 0.266 8.476 8.210 -0.000 0.000 0.413 132 Y N 2.218 122.320 120.300 -0.330 0.000 2.114 132 Y HA -0.308 4.241 4.550 -0.002 0.000 0.282 132 Y C 2.710 178.352 175.900 -0.429 0.000 1.165 132 Y CA 2.067 59.769 58.100 -0.664 0.000 1.148 132 Y CB -0.392 37.834 38.460 -0.390 0.000 0.972 132 Y HN 0.271 8.551 8.280 -0.000 0.000 0.504 133 Q N -0.239 119.290 119.800 -0.451 0.000 2.123 133 Q HA -0.112 4.227 4.340 -0.002 0.000 0.199 133 Q C 2.333 178.103 176.000 -0.384 0.000 0.966 133 Q CA 1.757 57.285 55.803 -0.458 0.000 0.845 133 Q CB -0.129 28.332 28.738 -0.462 0.000 0.907 133 Q HN 0.567 8.837 8.270 -0.000 0.000 0.439 134 I N 0.618 120.992 120.570 -0.327 0.000 2.163 134 I HA -0.314 3.855 4.170 -0.002 0.000 0.243 134 I C 2.108 178.041 176.117 -0.307 0.000 1.085 134 I CA 1.268 62.405 61.300 -0.272 0.000 1.347 134 I CB -0.253 37.625 38.000 -0.203 0.000 1.044 134 I HN 0.193 8.403 8.210 -0.000 0.000 0.408 135 L N 0.037 121.043 121.223 -0.361 0.000 2.093 135 L HA -0.160 4.178 4.340 -0.002 0.000 0.208 135 L C 2.753 179.397 176.870 -0.376 0.000 1.085 135 L CA 1.038 55.670 54.840 -0.347 0.000 0.755 135 L CB -0.513 41.321 42.059 -0.376 0.000 0.904 135 L HN 0.201 8.431 8.230 -0.000 0.000 0.435 136 R N 0.309 120.506 120.500 -0.504 0.000 2.073 136 R HA -0.144 4.195 4.340 -0.002 0.000 0.234 136 R C 2.280 178.392 176.300 -0.312 0.000 1.134 136 R CA 1.612 57.475 56.100 -0.394 0.000 0.952 136 R CB -0.535 29.467 30.300 -0.496 0.000 0.850 136 R HN 0.356 8.626 8.270 -0.000 0.000 0.433 137 G N 1.007 109.590 108.800 -0.363 0.000 2.421 137 G HA2 -0.243 3.716 3.960 -0.002 0.000 0.216 137 G HA3 -0.243 3.716 3.960 -0.002 0.000 0.216 137 G C 1.488 176.161 174.900 -0.378 0.000 1.171 137 G CA 0.666 45.475 45.100 -0.486 0.000 0.775 137 G HN 0.237 8.527 8.290 -0.000 0.000 0.543 138 L N 0.215 121.230 121.223 -0.346 0.000 2.046 138 L HA -0.098 4.241 4.340 -0.002 0.000 0.208 138 L C 2.880 179.497 176.870 -0.423 0.000 1.077 138 L CA 1.629 56.193 54.840 -0.460 0.000 0.747 138 L CB -0.363 41.396 42.059 -0.500 0.000 0.896 138 L HN 0.277 8.507 8.230 -0.000 0.000 0.432 139 K N -0.265 119.985 120.400 -0.251 0.000 2.044 139 K HA -0.298 4.021 4.320 -0.002 0.000 0.210 139 K C 2.270 178.838 176.600 -0.053 0.000 1.049 139 K CA 2.112 58.337 56.287 -0.104 0.000 0.927 139 K CB -0.396 32.074 32.500 -0.049 0.000 0.713 139 K HN 0.182 8.432 8.250 -0.000 0.000 0.443 140 Y N 1.272 121.425 120.300 -0.245 0.000 2.114 140 Y HA -0.219 4.330 4.550 -0.002 0.000 0.284 140 Y C 1.992 177.813 175.900 -0.132 0.000 1.143 140 Y CA 1.954 59.932 58.100 -0.204 0.000 1.135 140 Y CB -0.217 37.964 38.460 -0.466 0.000 0.980 140 Y HN 0.032 8.312 8.280 -0.000 0.000 0.499 141 I N -0.409 120.139 120.570 -0.037 0.000 2.179 141 I HA -0.386 3.783 4.170 -0.002 0.000 0.242 141 I C 2.289 178.423 176.117 0.028 0.000 1.088 141 I CA 1.954 63.234 61.300 -0.034 0.000 1.357 141 I CB -0.607 37.381 38.000 -0.021 0.000 1.051 141 I HN 0.355 8.565 8.210 -0.000 0.000 0.409 142 H N -0.258 118.785 119.070 -0.046 0.000 2.421 142 H HA -0.135 4.420 4.556 -0.002 0.000 0.298 142 H C 2.502 177.807 175.328 -0.038 0.000 1.087 142 H CA 1.176 57.210 56.048 -0.023 0.000 1.330 142 H CB 0.011 29.773 29.762 -0.001 0.000 1.388 142 H HN 0.401 8.681 8.280 -0.000 0.000 0.526 143 S N 0.671 116.396 115.700 0.042 0.000 2.442 143 S HA -0.074 4.394 4.470 -0.002 0.000 0.236 143 S C 2.028 176.608 174.600 -0.034 0.000 1.007 143 S CA 0.711 58.903 58.200 -0.014 0.000 0.965 143 S CB -0.012 63.153 63.200 -0.059 0.000 0.773 143 S HN 0.415 8.726 8.310 -0.000 0.000 0.504 144 A N 0.883 123.661 122.820 -0.070 0.000 2.307 144 A HA 0.269 4.587 4.320 -0.002 0.000 0.218 144 A C 0.459 178.088 177.584 0.074 0.000 1.228 144 A CA 0.195 52.221 52.037 -0.018 0.000 0.857 144 A CB -0.344 18.570 19.000 -0.145 0.000 0.897 144 A HN 0.385 8.535 8.150 -0.000 0.000 0.495 145 D N -0.739 119.697 120.400 0.059 0.000 2.723 145 D HA -0.158 4.481 4.640 -0.002 0.000 0.236 145 D C -0.423 175.926 176.300 0.083 0.000 1.138 145 D CA 0.999 55.034 54.000 0.060 0.000 0.676 145 D CB -1.203 39.624 40.800 0.045 0.000 1.069 145 D HN 0.532 8.902 8.370 -0.000 0.000 0.430 146 I N 0.836 121.461 120.570 0.092 0.000 2.336 146 I HA 0.314 4.483 4.170 -0.002 0.000 0.292 146 I C 0.850 177.053 176.117 0.144 0.000 0.991 146 I CA -0.646 60.709 61.300 0.092 0.000 1.227 146 I CB 1.342 39.361 38.000 0.031 0.000 1.366 146 I HN -0.119 8.091 8.210 -0.000 0.000 0.466 147 I N 5.404 126.039 120.570 0.108 0.000 2.359 147 I HA 0.178 4.347 4.170 -0.002 0.000 0.294 147 I C 1.265 177.458 176.117 0.128 0.000 0.987 147 I CA -0.489 60.899 61.300 0.147 0.000 1.225 147 I CB 1.324 39.396 38.000 0.120 0.000 1.366 147 I HN 0.672 8.882 8.210 -0.000 0.000 0.466 148 H N 6.306 125.438 119.070 0.103 0.000 2.276 148 H HA -0.039 4.516 4.556 -0.002 0.000 0.301 148 H C 1.583 176.914 175.328 0.004 0.000 1.073 148 H CA 2.132 58.198 56.048 0.030 0.000 1.311 148 H CB 0.383 30.148 29.762 0.006 0.000 1.379 148 H HN 0.668 8.948 8.280 -0.000 0.000 0.494 149 R N -0.847 119.774 120.500 0.201 0.000 3.746 149 R HA -0.185 4.153 4.340 -0.002 0.000 0.465 149 R C -0.383 175.976 176.300 0.098 0.000 0.725 149 R CA 1.488 57.622 56.100 0.057 0.000 1.545 149 R CB -1.262 29.019 30.300 -0.032 0.000 2.197 149 R HN 0.374 8.644 8.270 -0.000 0.000 0.438 150 D N 0.274 120.870 120.400 0.328 0.000 2.819 150 D HA 0.261 4.900 4.640 -0.002 0.000 0.326 150 D C -0.526 175.830 176.300 0.094 0.000 1.408 150 D CA -0.170 53.959 54.000 0.216 0.000 0.811 150 D CB 0.308 41.200 40.800 0.154 0.000 1.148 150 D HN 0.162 8.532 8.370 -0.000 0.000 0.457 151 L N 1.788 122.946 121.223 -0.108 0.000 2.455 151 L HA 0.238 4.577 4.340 -0.002 0.000 0.272 151 L C 0.544 177.284 176.870 -0.216 0.000 1.174 151 L CA 0.521 55.145 54.840 -0.360 0.000 0.869 151 L CB 0.345 42.220 42.059 -0.305 0.000 1.130 151 L HN 0.105 8.335 8.230 -0.000 0.000 0.474 152 K N 2.122 122.324 120.400 -0.330 0.000 2.642 152 K HA 0.373 4.692 4.320 -0.002 0.000 0.290 152 K C -2.817 173.511 176.600 -0.452 0.000 1.006 152 K CA -1.516 54.422 56.287 -0.581 0.000 0.869 152 K CB 1.170 33.390 32.500 -0.466 0.000 1.499 152 K HN -0.076 8.174 8.250 -0.000 0.000 0.403 153 P HA -0.268 4.152 4.420 -0.000 0.000 0.217 153 P C 1.274 178.501 177.300 -0.120 0.000 1.151 153 P CA 2.154 65.101 63.100 -0.256 0.000 0.849 153 P CB 0.050 31.631 31.700 -0.197 0.000 0.787 154 S N -2.039 113.605 115.700 -0.093 0.000 2.474 154 S HA -0.071 4.398 4.470 -0.002 0.000 0.235 154 S C 1.534 176.253 174.600 0.199 0.000 0.997 154 S CA 0.914 59.122 58.200 0.014 0.000 0.949 154 S CB -0.983 62.211 63.200 -0.009 0.000 0.766 154 S HN 0.076 8.386 8.310 -0.000 0.000 0.517 155 N N 1.067 119.824 118.700 0.095 0.000 2.268 155 N HA 0.354 5.093 4.740 -0.002 0.000 0.204 155 N C -0.882 174.604 175.510 -0.040 0.000 1.124 155 N CA 0.131 53.229 53.050 0.080 0.000 0.838 155 N CB 0.240 38.713 38.487 -0.023 0.000 0.994 155 N HN 0.477 8.857 8.380 -0.000 0.000 0.489 156 L N 0.607 121.830 121.223 -0.000 0.000 2.343 156 L HA 0.607 4.946 4.340 -0.002 0.000 0.278 156 L C -0.205 176.674 176.870 0.016 0.000 0.996 156 L CA -0.858 53.950 54.840 -0.052 0.000 0.831 156 L CB 1.847 43.839 42.059 -0.112 0.000 1.232 156 L HN -0.151 8.079 8.230 -0.000 0.000 0.413 157 A N 3.769 126.600 122.820 0.019 0.000 2.301 157 A HA 0.839 5.158 4.320 -0.002 0.000 0.312 157 A C -0.523 177.056 177.584 -0.008 0.000 1.182 157 A CA -0.456 51.613 52.037 0.053 0.000 0.826 157 A CB 1.228 20.284 19.000 0.093 0.000 1.134 157 A HN 0.422 8.572 8.150 -0.000 0.000 0.501 158 V N 3.884 123.795 119.914 -0.005 0.000 2.569 158 V HA 0.284 4.403 4.120 -0.002 0.000 0.301 158 V C -0.346 175.741 176.094 -0.011 0.000 1.044 158 V CA -1.006 61.277 62.300 -0.028 0.000 0.874 158 V CB 1.576 33.374 31.823 -0.041 0.000 1.002 158 V HN 1.105 9.295 8.190 -0.000 0.000 0.424 159 N N 3.499 122.195 118.700 -0.008 0.000 2.418 159 N HA 0.228 4.967 4.740 -0.002 0.000 0.283 159 N C 0.778 176.294 175.510 0.009 0.000 1.267 159 N CA -0.524 52.529 53.050 0.004 0.000 0.975 159 N CB 0.546 39.035 38.487 0.003 0.000 1.167 159 N HN 0.473 8.853 8.380 -0.000 0.000 0.581 160 E N -0.718 119.489 120.200 0.012 0.000 2.209 160 E HA -0.089 4.260 4.350 -0.002 0.000 0.196 160 E C -0.333 176.281 176.600 0.024 0.000 0.993 160 E CA 1.056 57.463 56.400 0.012 0.000 0.819 160 E CB -0.293 29.414 29.700 0.012 0.000 0.745 160 E HN 0.613 8.973 8.360 -0.000 0.000 0.477 164 L N 1.775 122.892 121.223 -0.177 0.000 2.362 164 L HA 0.650 4.989 4.340 -0.002 0.000 0.271 164 L C -1.526 175.263 176.870 -0.136 0.000 1.002 164 L CA -0.499 54.245 54.840 -0.160 0.000 0.818 164 L CB 1.268 43.196 42.059 -0.218 0.000 1.298 164 L HN 0.373 8.603 8.230 -0.000 0.000 0.420 165 K N 5.551 125.886 120.400 -0.108 0.000 2.378 165 K HA 0.503 4.822 4.320 -0.002 0.000 0.252 165 K C -1.248 175.282 176.600 -0.117 0.000 0.931 165 K CA -0.675 55.551 56.287 -0.102 0.000 0.794 165 K CB 2.555 35.009 32.500 -0.076 0.000 1.181 165 K HN 0.558 8.808 8.250 -0.000 0.000 0.425 166 I N 5.249 125.743 120.570 -0.127 0.000 2.371 166 I HA 0.236 4.405 4.170 -0.002 0.000 0.290 166 I C 0.325 176.372 176.117 -0.116 0.000 1.028 166 I CA -0.387 60.834 61.300 -0.131 0.000 1.345 166 I CB 0.254 38.179 38.000 -0.124 0.000 1.407 166 I HN 0.390 8.600 8.210 -0.000 0.000 0.501 167 L N 3.112 124.238 121.223 -0.162 0.000 2.251 167 L HA 0.800 5.139 4.340 -0.002 0.000 0.244 167 L C -1.184 175.605 176.870 -0.136 0.000 1.095 167 L CA -0.924 53.776 54.840 -0.234 0.000 0.910 167 L CB 1.925 43.688 42.059 -0.494 0.000 1.516 167 L HN 0.274 8.504 8.230 -0.000 0.000 0.429 168 D N -0.443 119.803 120.400 -0.257 0.000 2.421 168 D HA 0.349 4.988 4.640 -0.002 0.000 0.254 168 D C -0.476 175.694 176.300 -0.216 0.000 1.238 168 D CA -0.339 53.561 54.000 -0.166 0.000 0.919 168 D CB 1.248 41.923 40.800 -0.209 0.000 1.152 168 D HN 0.492 8.862 8.370 -0.000 0.000 0.552 169 F N 1.269 121.217 119.950 -0.003 0.000 2.804 169 F HA 0.236 4.761 4.527 -0.002 0.000 0.303 169 F C 1.989 177.772 175.800 -0.029 0.000 1.154 169 F CA -0.235 57.754 58.000 -0.017 0.000 1.401 169 F CB 0.042 39.034 39.000 -0.014 0.000 1.106 169 F HN 0.361 8.661 8.300 -0.000 0.000 0.568 170 G N 1.983 110.841 108.800 0.096 0.000 2.192 170 G HA2 0.263 4.222 3.960 -0.002 0.000 0.258 170 G HA3 0.263 4.222 3.960 -0.002 0.000 0.258 170 G C -0.155 174.750 174.900 0.009 0.000 1.185 170 G CA -0.029 45.087 45.100 0.026 0.000 0.976 170 G HN 0.197 8.487 8.290 -0.000 0.000 0.446 176 D N 1.210 121.617 120.400 0.012 0.000 2.117 176 D HA -0.098 4.540 4.640 -0.002 0.000 0.198 176 D C 1.655 177.972 176.300 0.029 0.000 0.982 176 D CA 1.200 55.211 54.000 0.020 0.000 0.828 176 D CB 0.103 40.904 40.800 0.002 0.000 0.967 176 D HN 0.654 9.024 8.370 -0.000 0.000 0.464 177 D N 1.047 121.457 120.400 0.016 0.000 2.133 177 D HA -0.172 4.466 4.640 -0.002 0.000 0.195 177 D C 1.682 177.986 176.300 0.007 0.000 0.997 177 D CA 1.099 55.108 54.000 0.015 0.000 0.840 177 D CB 0.028 40.833 40.800 0.008 0.000 0.947 177 D HN 0.233 8.603 8.370 -0.000 0.000 0.452 178 E N -1.195 119.003 120.200 -0.003 0.000 2.268 178 E HA -0.093 4.255 4.350 -0.002 0.000 0.195 178 E C 1.445 178.016 176.600 -0.049 0.000 0.995 178 E CA 0.507 56.892 56.400 -0.026 0.000 0.836 178 E CB 0.051 29.736 29.700 -0.025 0.000 0.763 178 E HN 0.376 8.736 8.360 -0.000 0.000 0.491 179 M N 0.495 120.084 119.600 -0.019 0.000 2.495 179 M HA 0.078 4.557 4.480 -0.002 0.000 0.237 179 M C 0.238 176.537 176.300 -0.002 0.000 1.131 179 M CA 0.552 55.827 55.300 -0.041 0.000 1.032 179 M CB 0.068 32.677 32.600 0.015 0.000 1.513 179 M HN -0.192 8.098 8.290 -0.000 0.000 0.488 180 T N 1.159 115.736 114.554 0.039 0.000 2.806 180 T HA 0.574 4.922 4.350 -0.002 0.000 0.290 180 T C 0.813 175.541 174.700 0.047 0.000 0.966 180 T CA 0.513 62.665 62.100 0.086 0.000 1.060 180 T CB 1.426 70.338 68.868 0.072 0.000 0.927 180 T HN 0.649 8.889 8.240 -0.000 0.000 0.485 181 G N 2.183 111.037 108.800 0.090 0.000 2.508 181 G HA2 -0.213 3.746 3.960 -0.002 0.000 0.220 181 G HA3 -0.213 3.746 3.960 -0.002 0.000 0.220 181 G C -0.905 174.110 174.900 0.191 0.000 1.287 181 G CA -0.662 44.517 45.100 0.131 0.000 0.916 181 G HN 0.742 9.032 8.290 -0.000 0.000 0.574 182 Y N 1.741 122.105 120.300 0.106 0.000 2.636 182 Y HA 0.502 5.051 4.550 -0.002 0.000 0.341 182 Y C 0.680 176.627 175.900 0.078 0.000 1.169 182 Y CA -0.101 58.151 58.100 0.254 0.000 1.498 182 Y CB 0.045 38.661 38.460 0.260 0.000 1.362 182 Y HN 1.173 9.453 8.280 -0.000 0.000 0.494 183 V N 1.728 121.339 119.914 -0.505 0.000 2.733 183 V HA 0.709 4.828 4.120 -0.002 0.000 0.306 183 V C 0.452 175.455 176.094 -1.819 0.000 1.084 183 V CA -0.405 61.340 62.300 -0.924 0.000 0.905 183 V CB 1.052 32.620 31.823 -0.424 0.000 1.010 183 V HN 0.551 8.741 8.190 -0.000 0.000 0.424 184 A N 2.592 124.380 122.820 -1.720 0.000 2.125 184 A HA -0.024 4.295 4.320 -0.002 0.000 0.219 184 A C 1.998 179.307 177.584 -0.458 0.000 1.156 184 A CA 2.058 53.377 52.037 -1.196 0.000 0.671 184 A CB -0.814 17.932 19.000 -0.424 0.000 0.794 184 A HN 1.577 9.727 8.150 -0.000 0.000 0.459 185 T N -3.145 111.154 114.554 -0.425 0.000 3.007 185 T HA -0.074 4.274 4.350 -0.002 0.000 0.270 185 T C 1.691 176.291 174.700 -0.165 0.000 1.107 185 T CA 1.373 63.351 62.100 -0.204 0.000 1.118 185 T CB -0.119 68.646 68.868 -0.171 0.000 0.889 185 T HN 0.536 8.776 8.240 -0.000 0.000 0.506 186 R N -1.518 118.812 120.500 -0.283 0.000 2.369 186 R HA 0.170 4.508 4.340 -0.002 0.000 0.210 186 R C 1.354 177.638 176.300 -0.027 0.000 0.881 186 R CA -0.199 55.790 56.100 -0.186 0.000 1.031 186 R CB 0.198 30.326 30.300 -0.287 0.000 1.184 186 R HN 0.344 8.614 8.270 -0.000 0.000 0.581 187 W N 0.248 121.472 121.300 -0.127 0.000 2.421 187 W HA -0.115 4.544 4.660 -0.002 0.000 0.270 187 W C 0.760 177.082 176.519 -0.329 0.000 1.233 187 W CA 0.711 57.885 57.345 -0.286 0.000 1.226 187 W CB -0.579 28.569 29.460 -0.520 0.000 1.121 187 W HN 0.165 8.345 8.180 -0.000 0.000 0.579 188 Y N -0.375 120.096 120.300 0.285 0.000 2.458 188 Y HA 0.223 4.772 4.550 -0.002 0.000 0.256 188 Y C 1.189 177.253 175.900 0.274 0.000 1.159 188 Y CA -0.340 57.916 58.100 0.260 0.000 1.261 188 Y CB -0.306 38.240 38.460 0.145 0.000 1.119 188 Y HN -0.363 7.917 8.280 -0.000 0.000 0.524 189 R N 1.327 121.980 120.500 0.255 0.000 2.490 189 R HA 0.485 4.824 4.340 -0.002 0.000 0.280 189 R C 0.312 176.591 176.300 -0.036 0.000 1.077 189 R CA -0.234 55.919 56.100 0.089 0.000 1.065 189 R CB 0.686 30.949 30.300 -0.062 0.000 1.003 189 R HN 0.126 8.396 8.270 -0.000 0.000 0.470 190 A N 4.996 127.706 122.820 -0.182 0.000 2.531 190 A HA 0.111 4.430 4.320 -0.002 0.000 0.236 190 A C -1.234 175.886 177.584 -0.774 0.000 1.062 190 A CA -1.097 50.540 52.037 -0.667 0.000 0.760 190 A CB 0.004 18.795 19.000 -0.348 0.000 0.995 190 A HN 0.540 8.690 8.150 -0.000 0.000 0.501 191 P HA -0.215 4.205 4.420 -0.000 0.000 0.217 191 P C 1.168 177.720 177.300 -1.246 0.000 1.150 191 P CA 1.586 64.046 63.100 -1.068 0.000 0.832 191 P CB 0.015 31.014 31.700 -1.168 0.000 0.787 192 E N 1.260 120.864 120.200 -0.994 0.000 2.204 192 E HA -0.167 4.182 4.350 -0.002 0.000 0.195 192 E C 2.061 178.425 176.600 -0.394 0.000 0.990 192 E CA 1.332 57.372 56.400 -0.600 0.000 0.821 192 E CB -1.124 28.556 29.700 -0.033 0.000 0.750 192 E HN 0.402 8.762 8.360 -0.000 0.000 0.477 193 I N -2.326 117.996 120.570 -0.414 0.000 2.585 193 I HA 0.027 4.196 4.170 -0.002 0.000 0.254 193 I C 2.906 178.856 176.117 -0.278 0.000 1.129 193 I CA 0.562 61.657 61.300 -0.341 0.000 1.455 193 I CB -0.494 37.198 38.000 -0.514 0.000 1.111 193 I HN -0.067 8.143 8.210 -0.000 0.000 0.433 194 M N 1.606 121.009 119.600 -0.328 0.000 2.144 194 M HA -0.148 4.331 4.480 -0.002 0.000 0.260 194 M C 1.428 177.660 176.300 -0.113 0.000 1.067 194 M CA 2.070 57.244 55.300 -0.210 0.000 1.095 194 M CB 0.021 32.456 32.600 -0.274 0.000 1.365 194 M HN 0.336 8.626 8.290 -0.000 0.000 0.406 195 L N -0.397 120.638 121.223 -0.314 0.000 2.857 195 L HA 0.199 4.538 4.340 -0.002 0.000 0.249 195 L C 0.427 177.253 176.870 -0.073 0.000 1.172 195 L CA -0.442 54.278 54.840 -0.199 0.000 0.980 195 L CB -0.149 41.753 42.059 -0.262 0.000 1.299 195 L HN 0.359 8.589 8.230 -0.000 0.000 0.535 196 N N 0.177 118.828 118.700 -0.082 0.000 2.705 196 N HA -0.246 4.493 4.740 -0.002 0.000 0.255 196 N C 0.466 176.103 175.510 0.212 0.000 1.008 196 N CA 0.319 53.404 53.050 0.057 0.000 0.742 196 N CB -0.764 37.760 38.487 0.061 0.000 0.906 196 N HN 0.335 8.715 8.380 -0.000 0.000 0.541 197 W N 0.045 121.359 121.300 0.023 0.000 2.402 197 W HA 0.137 4.796 4.660 -0.002 0.000 0.286 197 W C 1.612 178.154 176.519 0.038 0.000 1.221 197 W CA 1.234 58.592 57.345 0.022 0.000 1.257 197 W CB -0.333 29.128 29.460 0.001 0.000 1.120 197 W HN 0.534 8.714 8.180 -0.000 0.000 0.551 198 M N -2.857 116.915 119.600 0.286 0.000 2.956 198 M HA 0.199 4.678 4.480 -0.002 0.000 0.272 198 M C -0.513 175.904 176.300 0.194 0.000 1.132 198 M CA -0.892 54.534 55.300 0.210 0.000 0.805 198 M CB 1.745 34.468 32.600 0.205 0.000 1.639 198 M HN -0.171 8.119 8.290 -0.000 0.000 0.520 199 H N 2.483 121.582 119.070 0.048 0.000 3.145 199 H HA 0.190 4.745 4.556 -0.002 0.000 0.288 199 H C -1.695 173.625 175.328 -0.013 0.000 0.969 199 H CA 1.024 57.042 56.048 -0.050 0.000 1.444 199 H CB 0.093 29.805 29.762 -0.083 0.000 1.500 199 H HN 0.612 8.892 8.280 -0.000 0.000 0.552 200 Y N 4.095 124.187 120.300 -0.347 0.000 2.458 200 Y HA 0.401 4.949 4.550 -0.002 0.000 0.322 200 Y C -0.482 175.217 175.900 -0.334 0.000 1.259 200 Y CA -1.073 56.894 58.100 -0.221 0.000 1.302 200 Y CB 0.736 39.104 38.460 -0.153 0.000 1.314 200 Y HN 0.699 8.979 8.280 -0.000 0.000 0.509 201 N N -1.671 117.105 118.700 0.126 0.000 3.418 201 N HA 0.129 4.868 4.740 -0.002 0.000 0.316 201 N C 0.206 175.764 175.510 0.080 0.000 1.601 201 N CA -0.437 52.641 53.050 0.046 0.000 0.805 201 N CB 0.159 38.669 38.487 0.038 0.000 1.873 201 N HN 0.741 9.121 8.380 -0.000 0.000 0.615 202 Q N -0.971 118.786 119.800 -0.071 0.000 2.291 202 Q HA -0.148 4.191 4.340 -0.002 0.000 0.206 202 Q C 0.818 176.722 176.000 -0.160 0.000 0.976 202 Q CA 2.158 57.789 55.803 -0.286 0.000 0.875 202 Q CB -0.876 27.411 28.738 -0.753 0.000 0.927 202 Q HN 0.799 9.069 8.270 -0.000 0.000 0.450 203 T N -0.670 113.870 114.554 -0.022 0.000 2.897 203 T HA -0.139 4.210 4.350 -0.002 0.000 0.271 203 T C 1.952 176.736 174.700 0.140 0.000 1.084 203 T CA 1.267 63.418 62.100 0.084 0.000 1.123 203 T CB -0.857 68.071 68.868 0.099 0.000 0.865 203 T HN 0.382 8.622 8.240 -0.000 0.000 0.496 204 V N 0.548 120.524 119.914 0.103 0.000 2.392 204 V HA -0.189 3.930 4.120 -0.002 0.000 0.249 204 V C 2.133 178.325 176.094 0.164 0.000 1.059 204 V CA 2.169 64.520 62.300 0.084 0.000 1.051 204 V CB -0.917 30.869 31.823 -0.061 0.000 0.658 204 V HN 0.266 8.456 8.190 -0.000 0.000 0.455 205 D N 0.387 120.897 120.400 0.183 0.000 2.178 205 D HA -0.028 4.611 4.640 -0.002 0.000 0.202 205 D C 2.184 178.602 176.300 0.197 0.000 0.974 205 D CA 1.286 55.410 54.000 0.207 0.000 0.841 205 D CB -0.106 40.883 40.800 0.315 0.000 0.953 205 D HN 0.432 8.802 8.370 -0.000 0.000 0.478 206 I N 0.261 120.967 120.570 0.226 0.000 2.315 206 I HA -0.204 3.965 4.170 -0.002 0.000 0.248 206 I C 2.357 178.593 176.117 0.198 0.000 1.117 206 I CA 0.618 62.029 61.300 0.184 0.000 1.404 206 I CB -0.844 37.264 38.000 0.181 0.000 1.071 206 I HN 0.273 8.483 8.210 -0.000 0.000 0.419 207 W N 2.247 123.603 121.300 0.092 0.000 2.333 207 W HA -0.263 4.396 4.660 -0.002 0.000 0.316 207 W C 2.561 179.157 176.519 0.128 0.000 1.215 207 W CA 2.014 59.425 57.345 0.109 0.000 1.278 207 W CB -0.288 29.220 29.460 0.081 0.000 1.154 207 W HN 0.104 8.284 8.180 -0.000 0.000 0.486 208 S N 0.729 116.623 115.700 0.324 0.000 2.370 208 S HA -0.204 4.265 4.470 -0.002 0.000 0.226 208 S C 1.803 176.464 174.600 0.101 0.000 1.033 208 S CA 1.759 60.103 58.200 0.240 0.000 1.011 208 S CB -0.819 62.492 63.200 0.185 0.000 0.852 208 S HN 0.151 8.461 8.310 -0.000 0.000 0.457 209 V N 1.748 121.690 119.914 0.046 0.000 2.343 209 V HA -0.132 3.986 4.120 -0.002 0.000 0.247 209 V C 2.669 178.743 176.094 -0.034 0.000 1.051 209 V CA 1.852 64.149 62.300 -0.005 0.000 1.036 209 V CB -1.595 30.224 31.823 -0.007 0.000 0.654 209 V HN 0.584 8.774 8.190 -0.000 0.000 0.451 210 G N -0.872 107.879 108.800 -0.082 0.000 2.476 210 G HA2 -0.302 3.657 3.960 -0.002 0.000 0.218 210 G HA3 -0.302 3.657 3.960 -0.002 0.000 0.218 210 G C 1.742 176.523 174.900 -0.198 0.000 1.164 210 G CA 1.476 46.470 45.100 -0.176 0.000 0.768 210 G HN 0.541 8.831 8.290 -0.000 0.000 0.560 211 C N 0.244 119.446 119.300 -0.164 0.000 2.429 211 C HA 0.044 4.503 4.460 -0.002 0.000 0.277 211 C C 2.856 177.884 174.990 0.063 0.000 1.262 211 C CA 0.537 59.511 59.018 -0.073 0.000 1.733 211 C CB -1.026 26.785 27.740 0.119 0.000 2.010 211 C HN 0.478 8.708 8.230 -0.000 0.000 0.483 212 I N 0.481 121.123 120.570 0.119 0.000 2.179 212 I HA -0.284 3.885 4.170 -0.002 0.000 0.242 212 I C 2.672 178.794 176.117 0.009 0.000 1.088 212 I CA 1.814 63.161 61.300 0.078 0.000 1.357 212 I CB -0.485 37.500 38.000 -0.025 0.000 1.051 212 I HN 0.359 8.569 8.210 -0.000 0.000 0.409 213 M N 0.854 120.434 119.600 -0.034 0.000 2.080 213 M HA -0.250 4.228 4.480 -0.002 0.000 0.260 213 M C 2.427 178.650 176.300 -0.128 0.000 1.068 213 M CA 2.338 57.603 55.300 -0.058 0.000 1.109 213 M CB -0.172 32.384 32.600 -0.073 0.000 1.342 213 M HN 0.263 8.553 8.290 -0.000 0.000 0.405 214 A N -0.046 122.649 122.820 -0.209 0.000 1.908 214 A HA -0.269 4.050 4.320 -0.002 0.000 0.218 214 A C 1.964 179.501 177.584 -0.078 0.000 1.181 214 A CA 2.188 54.065 52.037 -0.266 0.000 0.627 214 A CB -1.009 17.835 19.000 -0.261 0.000 0.818 214 A HN 0.756 8.906 8.150 -0.000 0.000 0.445 215 E N -0.199 119.979 120.200 -0.038 0.000 2.150 215 E HA -0.115 4.234 4.350 -0.002 0.000 0.193 215 E C 1.872 178.486 176.600 0.022 0.000 0.985 215 E CA 0.801 57.208 56.400 0.011 0.000 0.814 215 E CB -0.184 29.565 29.700 0.082 0.000 0.752 215 E HN 0.646 9.006 8.360 -0.000 0.000 0.466 216 L N 0.425 121.657 121.223 0.016 0.000 2.093 216 L HA -0.167 4.172 4.340 -0.002 0.000 0.208 216 L C 2.470 179.364 176.870 0.040 0.000 1.085 216 L CA 0.758 55.618 54.840 0.034 0.000 0.755 216 L CB -0.371 41.716 42.059 0.046 0.000 0.904 216 L HN 0.272 8.502 8.230 -0.000 0.000 0.435 217 L N -0.456 120.775 121.223 0.013 0.000 2.109 217 L HA -0.142 4.196 4.340 -0.002 0.000 0.207 217 L C 2.631 179.531 176.870 0.051 0.000 1.086 217 L CA 1.849 56.701 54.840 0.021 0.000 0.760 217 L CB -0.549 41.479 42.059 -0.052 0.000 0.910 217 L HN 0.422 8.652 8.230 -0.000 0.000 0.437 218 T N -4.880 109.707 114.554 0.055 0.000 3.014 218 T HA 0.231 4.579 4.350 -0.002 0.000 0.250 218 T C 1.496 176.210 174.700 0.025 0.000 1.060 218 T CA 0.496 62.626 62.100 0.051 0.000 1.040 218 T CB 0.725 69.625 68.868 0.053 0.000 0.971 218 T HN 0.399 8.639 8.240 -0.000 0.000 0.497 219 G N 1.886 110.702 108.800 0.025 0.000 2.162 219 G HA2 -0.209 3.750 3.960 -0.002 0.000 0.260 219 G HA3 -0.209 3.750 3.960 -0.002 0.000 0.260 219 G C 0.046 174.951 174.900 0.008 0.000 0.976 219 G CA 0.031 45.143 45.100 0.021 0.000 0.655 219 G HN 0.692 8.982 8.290 -0.000 0.000 0.533 220 R N -0.006 120.487 120.500 -0.011 0.000 2.744 220 R HA 0.536 4.875 4.340 -0.002 0.000 0.279 220 R C -0.087 176.160 176.300 -0.089 0.000 0.977 220 R CA -0.410 55.660 56.100 -0.050 0.000 0.906 220 R CB 0.729 30.985 30.300 -0.074 0.000 1.197 220 R HN 0.146 8.416 8.270 -0.000 0.000 0.463 221 T N 2.495 116.959 114.554 -0.150 0.000 2.928 221 T HA -0.016 4.333 4.350 -0.002 0.000 0.305 221 T C 1.548 176.044 174.700 -0.341 0.000 1.035 221 T CA -0.184 61.762 62.100 -0.257 0.000 1.145 221 T CB 0.554 69.113 68.868 -0.514 0.000 0.963 221 T HN 0.351 8.591 8.240 -0.000 0.000 0.545 222 L N 2.288 123.268 121.223 -0.406 0.000 2.044 222 L HA 0.244 4.582 4.340 -0.002 0.000 0.205 222 L C 0.336 176.745 176.870 -0.768 0.000 1.075 222 L CA 1.706 56.163 54.840 -0.639 0.000 0.747 222 L CB -0.216 41.332 42.059 -0.852 0.000 0.903 222 L HN 0.640 8.870 8.230 -0.000 0.000 0.435 223 F N 1.157 120.948 119.950 -0.264 0.000 2.531 223 F HA 0.403 4.929 4.527 -0.002 0.000 0.333 223 F C -2.091 173.421 175.800 -0.480 0.000 1.292 223 F CA -2.648 55.213 58.000 -0.232 0.000 1.184 223 F CB 0.087 39.057 39.000 -0.049 0.000 1.426 223 F HN 0.029 8.329 8.300 -0.000 0.000 0.559 224 P HA 0.138 4.558 4.420 -0.000 0.000 0.225 224 P C 0.644 177.707 177.300 -0.395 0.000 1.813 224 P CA 0.217 62.533 63.100 -1.307 0.000 1.013 224 P CB 0.307 31.323 31.700 -1.139 0.000 1.961 225 G N 1.542 110.311 108.800 -0.050 0.000 2.432 225 G HA2 0.141 4.099 3.960 -0.002 0.000 0.239 225 G HA3 0.141 4.099 3.960 -0.002 0.000 0.239 225 G C 1.221 176.394 174.900 0.454 0.000 1.291 225 G CA -0.127 45.107 45.100 0.223 0.000 0.863 225 G HN 0.361 8.651 8.290 -0.000 0.000 0.560 226 T N -1.605 113.164 114.554 0.359 0.000 3.118 226 T HA 0.175 4.524 4.350 -0.002 0.000 0.260 226 T C 0.421 175.280 174.700 0.264 0.000 1.139 226 T CA 0.887 63.208 62.100 0.368 0.000 1.085 226 T CB -0.389 68.581 68.868 0.170 0.000 0.934 226 T HN 0.811 9.051 8.240 -0.000 0.000 0.518 227 D N -2.014 118.514 120.400 0.213 0.000 2.804 227 D HA 0.186 4.825 4.640 -0.002 0.000 0.309 227 D C -0.027 176.364 176.300 0.151 0.000 1.311 227 D CA -0.848 53.257 54.000 0.175 0.000 0.765 227 D CB 0.007 40.904 40.800 0.161 0.000 1.293 227 D HN -0.076 8.294 8.370 -0.000 0.000 0.434 228 H N -0.494 118.599 119.070 0.038 0.000 2.352 228 H HA -0.017 4.538 4.556 -0.002 0.000 0.299 228 H C 1.571 176.911 175.328 0.018 0.000 1.097 228 H CA 1.783 57.835 56.048 0.007 0.000 1.311 228 H CB -0.072 29.671 29.762 -0.033 0.000 1.377 228 H HN 0.331 8.611 8.280 -0.000 0.000 0.504 229 I N 0.225 120.890 120.570 0.160 0.000 2.233 229 I HA -0.171 3.998 4.170 -0.002 0.000 0.243 229 I C 2.136 178.330 176.117 0.128 0.000 1.093 229 I CA 1.293 62.669 61.300 0.126 0.000 1.380 229 I CB -1.050 36.993 38.000 0.072 0.000 1.067 229 I HN 0.259 8.469 8.210 -0.000 0.000 0.413 230 D N 0.472 120.941 120.400 0.115 0.000 2.123 230 D HA -0.273 4.366 4.640 -0.002 0.000 0.196 230 D C 2.254 178.612 176.300 0.097 0.000 0.992 230 D CA 1.450 55.513 54.000 0.105 0.000 0.833 230 D CB 0.037 40.903 40.800 0.110 0.000 0.954 230 D HN 0.334 8.704 8.370 -0.000 0.000 0.455 231 Q N -0.779 119.079 119.800 0.097 0.000 2.084 231 Q HA -0.153 4.185 4.340 -0.002 0.000 0.202 231 Q C 2.183 178.176 176.000 -0.011 0.000 0.978 231 Q CA 1.066 56.907 55.803 0.063 0.000 0.844 231 Q CB -0.236 28.539 28.738 0.062 0.000 0.898 231 Q HN 0.371 8.641 8.270 -0.000 0.000 0.426 232 L N 1.170 122.399 121.223 0.010 0.000 2.043 232 L HA -0.221 4.118 4.340 -0.002 0.000 0.212 232 L C 1.871 178.758 176.870 0.029 0.000 1.075 232 L CA 1.965 56.809 54.840 0.006 0.000 0.752 232 L CB -0.338 41.792 42.059 0.119 0.000 0.891 232 L HN 0.091 8.321 8.230 -0.000 0.000 0.432 233 K N -0.790 119.653 120.400 0.071 0.000 2.057 233 K HA -0.145 4.174 4.320 -0.002 0.000 0.207 233 K C 2.089 178.724 176.600 0.058 0.000 1.049 233 K CA 1.694 58.023 56.287 0.071 0.000 0.931 233 K CB -0.350 32.200 32.500 0.082 0.000 0.714 233 K HN 0.348 8.598 8.250 -0.000 0.000 0.440 234 L N 0.788 122.048 121.223 0.062 0.000 2.012 234 L HA -0.227 4.111 4.340 -0.002 0.000 0.210 234 L C 2.379 179.315 176.870 0.109 0.000 1.073 234 L CA 1.273 56.184 54.840 0.119 0.000 0.748 234 L CB -0.499 41.676 42.059 0.195 0.000 0.891 234 L HN 0.188 8.418 8.230 -0.000 0.000 0.431 235 I N -0.251 120.212 120.570 -0.179 0.000 2.142 235 I HA -0.329 3.840 4.170 -0.002 0.000 0.240 235 I C 2.407 178.532 176.117 0.014 0.000 1.078 235 I CA 1.477 62.540 61.300 -0.395 0.000 1.343 235 I CB -0.247 37.454 38.000 -0.497 0.000 1.046 235 I HN 0.204 8.414 8.210 -0.000 0.000 0.405 236 L N 0.005 121.252 121.223 0.040 0.000 2.141 236 L HA -0.168 4.170 4.340 -0.002 0.000 0.209 236 L C 2.687 179.620 176.870 0.104 0.000 1.094 236 L CA 0.959 55.854 54.840 0.092 0.000 0.763 236 L CB -0.628 41.475 42.059 0.074 0.000 0.908 236 L HN 0.233 8.463 8.230 -0.000 0.000 0.437 237 R N 0.400 120.957 120.500 0.095 0.000 2.105 237 R HA -0.211 4.128 4.340 -0.002 0.000 0.239 237 R C 2.239 178.607 176.300 0.113 0.000 1.135 237 R CA 1.486 57.639 56.100 0.089 0.000 0.967 237 R CB -0.075 30.269 30.300 0.072 0.000 0.861 237 R HN 0.231 8.501 8.270 -0.000 0.000 0.442 238 L N -0.094 121.229 121.223 0.168 0.000 2.084 238 L HA -0.027 4.312 4.340 -0.002 0.000 0.202 238 L C 1.970 179.020 176.870 0.301 0.000 1.074 238 L CA 1.350 56.300 54.840 0.185 0.000 0.757 238 L CB 0.072 42.264 42.059 0.221 0.000 0.918 238 L HN 0.120 8.350 8.230 -0.000 0.000 0.444 239 V N -2.328 117.783 119.914 0.328 0.000 3.590 239 V HA 0.588 4.707 4.120 -0.002 0.000 0.265 239 V C 0.900 177.138 176.094 0.239 0.000 1.239 239 V CA 0.215 62.736 62.300 0.368 0.000 1.117 239 V CB -1.077 31.009 31.823 0.438 0.000 0.818 239 V HN 0.648 8.838 8.190 -0.000 0.000 0.451 240 G N 0.974 109.884 108.800 0.183 0.000 2.663 240 G HA2 -0.003 3.956 3.960 -0.002 0.000 0.686 240 G HA3 -0.003 3.956 3.960 -0.002 0.000 0.686 240 G C -0.279 174.682 174.900 0.101 0.000 1.246 240 G CA -0.345 44.828 45.100 0.122 0.000 0.795 240 G HN 1.284 9.574 8.290 -0.000 0.000 0.627 241 T N 0.761 115.352 114.554 0.061 0.000 2.926 241 T HA 0.590 4.938 4.350 -0.002 0.000 0.307 241 T C -1.440 173.273 174.700 0.021 0.000 1.059 241 T CA -0.337 61.783 62.100 0.033 0.000 1.122 241 T CB 1.282 70.150 68.868 0.000 0.000 0.972 241 T HN 0.713 8.953 8.240 -0.000 0.000 0.545 242 P HA 0.280 4.700 4.420 -0.000 0.000 0.269 242 P C 0.485 177.760 177.300 -0.042 0.000 1.215 242 P CA -0.250 62.830 63.100 -0.033 0.000 0.780 242 P CB 0.355 31.982 31.700 -0.121 0.000 0.898 243 G N 0.329 109.111 108.800 -0.030 0.000 2.557 243 G HA2 0.386 4.345 3.960 -0.002 0.000 0.292 243 G HA3 0.386 4.345 3.960 -0.002 0.000 0.292 243 G C 1.136 176.006 174.900 -0.050 0.000 1.237 243 G CA -0.090 44.991 45.100 -0.031 0.000 0.978 243 G HN 0.478 8.768 8.290 -0.000 0.000 0.498 244 A N -0.857 121.938 122.820 -0.041 0.000 1.948 244 A HA -0.109 4.210 4.320 -0.002 0.000 0.220 244 A C 2.042 179.598 177.584 -0.046 0.000 1.177 244 A CA 2.244 54.253 52.037 -0.046 0.000 0.636 244 A CB -0.585 18.395 19.000 -0.033 0.000 0.815 244 A HN 0.777 8.927 8.150 -0.000 0.000 0.449 245 E N -0.852 119.328 120.200 -0.032 0.000 2.051 245 E HA -0.197 4.151 4.350 -0.002 0.000 0.192 245 E C 1.908 178.487 176.600 -0.035 0.000 0.991 245 E CA 1.389 57.774 56.400 -0.025 0.000 0.799 245 E CB -0.172 29.523 29.700 -0.009 0.000 0.748 245 E HN 0.476 8.836 8.360 -0.000 0.000 0.449 246 L N 0.807 122.003 121.223 -0.045 0.000 2.072 246 L HA -0.085 4.254 4.340 -0.002 0.000 0.205 246 L C 2.062 178.851 176.870 -0.134 0.000 1.079 246 L CA 1.345 56.144 54.840 -0.068 0.000 0.752 246 L CB -0.415 41.607 42.059 -0.060 0.000 0.906 246 L HN 0.204 8.434 8.230 -0.000 0.000 0.436 247 L N 0.045 121.180 121.223 -0.147 0.000 2.012 247 L HA -0.272 4.067 4.340 -0.002 0.000 0.210 247 L C 2.604 179.391 176.870 -0.138 0.000 1.073 247 L CA 2.116 56.847 54.840 -0.182 0.000 0.748 247 L CB -0.763 41.208 42.059 -0.148 0.000 0.891 247 L HN 0.392 8.622 8.230 -0.000 0.000 0.431 248 K N 0.150 120.497 120.400 -0.089 0.000 2.280 248 K HA -0.174 4.145 4.320 -0.002 0.000 0.202 248 K C 1.740 178.306 176.600 -0.055 0.000 1.047 248 K CA 1.188 57.437 56.287 -0.063 0.000 0.942 248 K CB -0.217 32.258 32.500 -0.042 0.000 0.739 248 K HN 0.284 8.534 8.250 -0.000 0.000 0.457 249 K N 0.845 121.209 120.400 -0.060 0.000 2.365 249 K HA 0.131 4.450 4.320 -0.002 0.000 0.197 249 K C 0.368 176.947 176.600 -0.036 0.000 1.042 249 K CA 0.234 56.502 56.287 -0.032 0.000 0.987 249 K CB 0.091 32.586 32.500 -0.009 0.000 0.779 249 K HN 0.160 8.410 8.250 -0.000 0.000 0.484 250 I N 2.574 123.077 120.570 -0.112 0.000 2.389 250 I HA -0.070 4.098 4.170 -0.002 0.000 0.295 250 I C 1.239 177.318 176.117 -0.062 0.000 1.117 250 I CA -0.142 61.074 61.300 -0.141 0.000 1.317 250 I CB 0.910 38.673 38.000 -0.396 0.000 1.431 250 I HN 0.132 8.342 8.210 -0.000 0.000 0.521 251 S N 2.330 118.035 115.700 0.008 0.000 2.461 251 S HA -0.080 4.389 4.470 -0.002 0.000 0.228 251 S C 1.162 175.777 174.600 0.025 0.000 1.005 251 S CA -0.145 58.065 58.200 0.017 0.000 0.942 251 S CB -0.030 63.193 63.200 0.038 0.000 0.776 251 S HN 0.604 8.914 8.310 -0.000 0.000 0.514 252 S N 1.593 117.321 115.700 0.047 0.000 2.443 252 S HA 0.144 4.613 4.470 -0.002 0.000 0.284 252 S C 0.848 175.460 174.600 0.020 0.000 1.206 252 S CA -0.485 57.748 58.200 0.055 0.000 1.074 252 S CB 0.294 63.561 63.200 0.111 0.000 0.963 252 S HN 0.483 8.793 8.310 -0.000 0.000 0.501 253 E N 3.223 123.431 120.200 0.014 0.000 2.204 253 E HA -0.090 4.259 4.350 -0.002 0.000 0.194 253 E C 1.989 178.598 176.600 0.015 0.000 0.989 253 E CA 0.939 57.340 56.400 0.002 0.000 0.824 253 E CB -0.074 29.627 29.700 0.002 0.000 0.756 253 E HN 0.685 9.045 8.360 -0.000 0.000 0.477 254 S N 0.217 115.938 115.700 0.035 0.000 2.348 254 S HA -0.163 4.306 4.470 -0.002 0.000 0.221 254 S C 2.072 176.728 174.600 0.093 0.000 1.033 254 S CA 1.185 59.417 58.200 0.055 0.000 1.010 254 S CB -0.140 63.090 63.200 0.050 0.000 0.891 254 S HN 0.364 8.674 8.310 -0.000 0.000 0.442 255 A N 1.630 124.514 122.820 0.108 0.000 1.930 255 A HA -0.057 4.262 4.320 -0.002 0.000 0.217 255 A C 2.177 179.793 177.584 0.055 0.000 1.175 255 A CA 1.511 53.653 52.037 0.175 0.000 0.627 255 A CB -0.667 18.502 19.000 0.282 0.000 0.815 255 A HN 0.571 8.721 8.150 -0.000 0.000 0.443 256 R N -0.155 120.310 120.500 -0.058 0.000 2.073 256 R HA -0.205 4.133 4.340 -0.002 0.000 0.234 256 R C 2.112 178.365 176.300 -0.078 0.000 1.134 256 R CA 1.964 57.979 56.100 -0.142 0.000 0.952 256 R CB -0.412 29.811 30.300 -0.128 0.000 0.850 256 R HN 0.632 8.902 8.270 -0.000 0.000 0.433 257 N N -0.415 118.277 118.700 -0.014 0.000 2.188 257 N HA -0.229 4.510 4.740 -0.002 0.000 0.184 257 N C 1.722 177.252 175.510 0.033 0.000 1.018 257 N CA 1.238 54.290 53.050 0.003 0.000 0.858 257 N CB -0.294 38.209 38.487 0.026 0.000 0.989 257 N HN 0.294 8.674 8.380 -0.000 0.000 0.426 258 Y N 0.790 121.084 120.300 -0.010 0.000 2.145 258 Y HA -0.047 4.502 4.550 -0.002 0.000 0.286 258 Y C 2.084 177.988 175.900 0.007 0.000 1.145 258 Y CA 1.449 59.556 58.100 0.011 0.000 1.148 258 Y CB -0.587 37.897 38.460 0.040 0.000 0.981 258 Y HN 0.197 8.477 8.280 -0.000 0.000 0.507 259 I N 0.109 120.527 120.570 -0.252 0.000 2.394 259 I HA -0.291 3.878 4.170 -0.002 0.000 0.251 259 I C 1.965 177.909 176.117 -0.288 0.000 1.136 259 I CA 1.336 62.434 61.300 -0.337 0.000 1.425 259 I CB -0.272 37.640 38.000 -0.147 0.000 1.079 259 I HN 0.376 8.586 8.210 -0.000 0.000 0.425 260 Q N -0.116 119.559 119.800 -0.209 0.000 2.437 260 Q HA -0.145 4.194 4.340 -0.002 0.000 0.210 260 Q C 2.065 177.977 176.000 -0.146 0.000 0.972 260 Q CA 1.464 57.177 55.803 -0.150 0.000 0.903 260 Q CB -0.030 28.645 28.738 -0.106 0.000 0.967 260 Q HN 0.621 8.891 8.270 -0.000 0.000 0.486 261 S N -0.624 114.952 115.700 -0.207 0.000 2.528 261 S HA 0.087 4.556 4.470 -0.002 0.000 0.219 261 S C 0.790 175.296 174.600 -0.157 0.000 0.985 261 S CA -0.229 57.879 58.200 -0.154 0.000 0.914 261 S CB 0.005 63.133 63.200 -0.121 0.000 0.776 261 S HN 0.145 8.455 8.310 -0.000 0.000 0.526 262 L N 2.573 123.668 121.223 -0.214 0.000 2.371 262 L HA 0.296 4.634 4.340 -0.002 0.000 0.272 262 L C 0.226 177.046 176.870 -0.083 0.000 1.124 262 L CA -0.541 54.210 54.840 -0.149 0.000 0.816 262 L CB 0.558 42.512 42.059 -0.174 0.000 1.129 262 L HN 0.045 8.275 8.230 -0.000 0.000 0.448 263 T N 2.992 117.518 114.554 -0.048 0.000 2.871 263 T HA 0.009 4.358 4.350 -0.002 0.000 0.296 263 T C 0.255 174.942 174.700 -0.022 0.000 0.998 263 T CA -0.165 61.918 62.100 -0.027 0.000 1.162 263 T CB 0.071 68.931 68.868 -0.012 0.000 0.947 263 T HN 0.467 8.707 8.240 -0.000 0.000 0.536 264 Q N 2.942 122.730 119.800 -0.019 0.000 2.361 264 Q HA 0.333 4.672 4.340 -0.002 0.000 0.276 264 Q C -0.221 175.781 176.000 0.004 0.000 1.022 264 Q CA 0.434 56.230 55.803 -0.011 0.000 0.898 264 Q CB 0.505 29.236 28.738 -0.012 0.000 1.246 264 Q HN 0.581 8.851 8.270 -0.000 0.000 0.410 265 M N 3.081 122.690 119.600 0.015 0.000 2.386 265 M HA 0.428 4.907 4.480 -0.002 0.000 0.293 265 M C -2.444 173.881 176.300 0.042 0.000 1.120 265 M CA -2.093 53.224 55.300 0.029 0.000 0.909 265 M CB 2.530 35.152 32.600 0.037 0.000 1.661 265 M HN 0.422 8.712 8.290 -0.000 0.000 0.452 266 P HA 0.190 4.610 4.420 -0.000 0.000 0.279 266 P C -1.285 176.067 177.300 0.086 0.000 1.252 266 P CA -0.548 62.586 63.100 0.056 0.000 0.811 266 P CB 0.753 32.481 31.700 0.046 0.000 1.035 267 K N 2.183 122.644 120.400 0.102 0.000 2.484 267 K HA 0.062 4.381 4.320 -0.002 0.000 0.280 267 K C 0.359 177.056 176.600 0.163 0.000 1.013 267 K CA 0.120 56.500 56.287 0.156 0.000 1.029 267 K CB -0.048 32.529 32.500 0.128 0.000 0.902 267 K HN 0.405 8.655 8.250 -0.000 0.000 0.481 268 M N 2.760 122.490 119.600 0.218 0.000 2.198 268 M HA -0.003 4.476 4.480 -0.002 0.000 0.315 268 M C 0.722 177.182 176.300 0.267 0.000 1.134 268 M CA -0.224 55.186 55.300 0.183 0.000 1.171 268 M CB 0.306 32.972 32.600 0.110 0.000 1.413 268 M HN 0.582 8.872 8.290 -0.000 0.000 0.467 269 N N 0.918 119.724 118.700 0.176 0.000 2.405 269 N HA 0.031 4.769 4.740 -0.002 0.000 0.260 269 N C -0.087 175.587 175.510 0.272 0.000 1.152 269 N CA 0.232 53.396 53.050 0.190 0.000 0.948 269 N CB 0.381 38.926 38.487 0.097 0.000 1.111 269 N HN 0.441 8.821 8.380 -0.000 0.000 0.485 270 F N 2.543 122.530 119.950 0.062 0.000 2.325 270 F HA 0.046 4.572 4.527 -0.002 0.000 0.299 270 F C 2.260 178.152 175.800 0.152 0.000 1.090 270 F CA 0.679 58.765 58.000 0.142 0.000 1.392 270 F CB -0.710 38.425 39.000 0.225 0.000 1.053 270 F HN 0.680 8.980 8.300 -0.000 0.000 0.521 271 A N -0.092 122.890 122.820 0.270 0.000 2.019 271 A HA -0.176 4.143 4.320 -0.002 0.000 0.219 271 A C 1.939 179.570 177.584 0.078 0.000 1.164 271 A CA 1.734 53.866 52.037 0.159 0.000 0.644 271 A CB -0.581 18.482 19.000 0.106 0.000 0.805 271 A HN 0.311 8.461 8.150 -0.000 0.000 0.449 272 N N -0.613 118.111 118.700 0.041 0.000 2.422 272 N HA 0.037 4.776 4.740 -0.002 0.000 0.181 272 N C 1.323 176.758 175.510 -0.125 0.000 1.080 272 N CA 0.907 53.942 53.050 -0.025 0.000 0.893 272 N CB 0.339 38.817 38.487 -0.014 0.000 0.973 272 N HN 0.306 8.686 8.380 -0.000 0.000 0.456 273 V N -0.423 119.351 119.914 -0.233 0.000 2.575 273 V HA 0.095 4.214 4.120 -0.002 0.000 0.242 273 V C 0.175 175.861 176.094 -0.679 0.000 1.045 273 V CA 0.852 62.810 62.300 -0.570 0.000 1.065 273 V CB -0.187 31.072 31.823 -0.940 0.000 0.717 273 V HN 0.014 8.204 8.190 -0.000 0.000 0.467 274 F N 0.891 120.784 119.950 -0.096 0.000 2.461 274 F HA 0.489 5.015 4.527 -0.002 0.000 0.321 274 F C 0.322 176.095 175.800 -0.044 0.000 1.203 274 F CA -0.899 57.051 58.000 -0.083 0.000 1.238 274 F CB -0.667 38.280 39.000 -0.090 0.000 1.528 274 F HN -0.046 8.254 8.300 -0.000 0.000 0.554 275 I N 1.540 122.132 120.570 0.036 0.000 2.741 275 I HA 0.142 4.311 4.170 -0.002 0.000 0.288 275 I C 1.459 177.605 176.117 0.048 0.000 1.192 275 I CA 0.885 62.201 61.300 0.027 0.000 1.426 275 I CB -0.041 37.953 38.000 -0.010 0.000 1.367 275 I HN 0.768 8.978 8.210 -0.000 0.000 0.563 276 G N 4.094 112.922 108.800 0.046 0.000 2.179 276 G HA2 -0.250 3.709 3.960 -0.002 0.000 0.260 276 G HA3 -0.250 3.709 3.960 -0.002 0.000 0.260 276 G C 0.448 175.377 174.900 0.049 0.000 0.977 276 G CA 0.006 45.131 45.100 0.041 0.000 0.641 276 G HN 1.026 9.316 8.290 -0.000 0.000 0.533 277 A N 0.055 122.914 122.820 0.065 0.000 2.445 277 A HA 0.530 4.849 4.320 -0.002 0.000 0.242 277 A C 0.792 178.392 177.584 0.025 0.000 1.075 277 A CA 0.416 52.480 52.037 0.045 0.000 0.777 277 A CB 0.208 19.233 19.000 0.041 0.000 1.013 277 A HN 0.841 8.991 8.150 -0.000 0.000 0.493 278 N N 1.979 120.692 118.700 0.022 0.000 2.301 278 N HA -0.023 4.716 4.740 -0.002 0.000 0.267 278 N C -1.720 173.777 175.510 -0.021 0.000 1.304 278 N CA -1.109 51.961 53.050 0.032 0.000 0.851 278 N CB 0.627 39.188 38.487 0.122 0.000 1.070 278 N HN 0.218 8.598 8.380 -0.000 0.000 0.483 279 P HA -0.146 4.274 4.420 -0.000 0.000 0.217 279 P C 1.405 178.692 177.300 -0.021 0.000 1.148 279 P CA 1.125 64.226 63.100 0.003 0.000 0.828 279 P CB 0.240 31.952 31.700 0.020 0.000 0.783 280 L N -1.524 119.695 121.223 -0.006 0.000 2.141 280 L HA -0.119 4.220 4.340 -0.002 0.000 0.209 280 L C 2.453 179.163 176.870 -0.268 0.000 1.094 280 L CA 1.340 56.196 54.840 0.027 0.000 0.763 280 L CB -1.073 41.097 42.059 0.185 0.000 0.908 280 L HN -0.039 8.191 8.230 -0.000 0.000 0.437 281 A N -0.218 122.237 122.820 -0.608 0.000 1.898 281 A HA -0.128 4.191 4.320 -0.002 0.000 0.216 281 A C 2.343 179.633 177.584 -0.490 0.000 1.181 281 A CA 1.543 53.003 52.037 -0.963 0.000 0.620 281 A CB -0.733 17.720 19.000 -0.911 0.000 0.819 281 A HN 0.172 8.322 8.150 -0.000 0.000 0.442 282 V N 0.527 120.289 119.914 -0.254 0.000 2.287 282 V HA -0.301 3.818 4.120 -0.002 0.000 0.248 282 V C 2.342 178.385 176.094 -0.085 0.000 1.053 282 V CA 2.587 64.837 62.300 -0.083 0.000 1.027 282 V CB -0.870 30.983 31.823 0.051 0.000 0.646 282 V HN 0.739 8.929 8.190 -0.000 0.000 0.447 283 D N -0.375 119.970 120.400 -0.091 0.000 2.104 283 D HA -0.203 4.436 4.640 -0.002 0.000 0.194 283 D C 1.978 178.196 176.300 -0.137 0.000 0.994 283 D CA 1.400 55.369 54.000 -0.053 0.000 0.830 283 D CB -0.153 40.700 40.800 0.088 0.000 0.959 283 D HN 0.259 8.629 8.370 -0.000 0.000 0.452 284 L N 0.256 121.277 121.223 -0.338 0.000 2.012 284 L HA -0.085 4.253 4.340 -0.002 0.000 0.210 284 L C 2.152 178.863 176.870 -0.265 0.000 1.073 284 L CA 1.540 56.077 54.840 -0.505 0.000 0.748 284 L CB -0.670 40.932 42.059 -0.760 0.000 0.891 284 L HN 0.220 8.450 8.230 -0.000 0.000 0.431 285 L N -0.710 120.371 121.223 -0.237 0.000 2.079 285 L HA -0.252 4.087 4.340 -0.002 0.000 0.210 285 L C 2.515 179.393 176.870 0.014 0.000 1.081 285 L CA 1.598 56.375 54.840 -0.105 0.000 0.752 285 L CB -0.612 41.360 42.059 -0.145 0.000 0.896 285 L HN 0.375 8.605 8.230 -0.000 0.000 0.433 286 E N -0.010 120.096 120.200 -0.156 0.000 2.153 286 E HA -0.224 4.125 4.350 -0.002 0.000 0.194 286 E C 2.065 178.558 176.600 -0.178 0.000 0.988 286 E CA 1.040 57.184 56.400 -0.426 0.000 0.811 286 E CB 0.057 29.428 29.700 -0.548 0.000 0.746 286 E HN 0.445 8.805 8.360 -0.000 0.000 0.466 287 K N -0.317 120.023 120.400 -0.101 0.000 2.305 287 K HA 0.059 4.378 4.320 -0.002 0.000 0.199 287 K C 1.910 178.521 176.600 0.018 0.000 1.047 287 K CA 0.588 56.859 56.287 -0.026 0.000 0.976 287 K CB 0.190 32.687 32.500 -0.004 0.000 0.765 287 K HN 0.102 8.352 8.250 -0.000 0.000 0.474 288 M N 0.194 119.792 119.600 -0.002 0.000 2.325 288 M HA 0.022 4.501 4.480 -0.002 0.000 0.265 288 M C 0.675 177.008 176.300 0.054 0.000 1.094 288 M CA 0.957 56.274 55.300 0.027 0.000 1.161 288 M CB 0.234 32.817 32.600 -0.028 0.000 1.358 288 M HN -0.023 8.267 8.290 -0.000 0.000 0.446 289 L N 1.829 123.054 121.223 0.004 0.000 2.583 289 L HA 0.201 4.540 4.340 -0.002 0.000 0.239 289 L C -0.858 176.182 176.870 0.282 0.000 1.347 289 L CA -0.608 54.190 54.840 -0.070 0.000 1.246 289 L CB -0.549 41.456 42.059 -0.090 0.000 1.496 289 L HN -0.047 8.183 8.230 -0.000 0.000 0.413 290 V N 0.905 121.053 119.914 0.389 0.000 2.435 290 V HA 0.115 4.233 4.120 -0.002 0.000 0.290 290 V C 0.967 177.341 176.094 0.466 0.000 1.030 290 V CA -0.551 61.962 62.300 0.356 0.000 0.881 290 V CB 2.401 34.349 31.823 0.207 0.000 0.983 290 V HN 0.371 8.561 8.190 -0.000 0.000 0.445 291 L N 2.492 123.936 121.223 0.368 0.000 2.017 291 L HA 0.022 4.361 4.340 -0.002 0.000 0.208 291 L C 1.327 178.323 176.870 0.210 0.000 1.073 291 L CA 1.647 56.642 54.840 0.258 0.000 0.745 291 L CB -0.240 41.959 42.059 0.232 0.000 0.894 291 L HN 0.773 9.003 8.230 -0.000 0.000 0.432 292 D N -1.143 119.363 120.400 0.177 0.000 2.342 292 D HA -0.025 4.613 4.640 -0.002 0.000 0.260 292 D C 1.437 177.827 176.300 0.151 0.000 1.278 292 D CA 0.718 54.803 54.000 0.142 0.000 0.910 292 D CB 1.103 41.961 40.800 0.097 0.000 1.079 292 D HN 0.355 8.725 8.370 -0.000 0.000 0.496 293 S N 2.848 118.638 115.700 0.150 0.000 2.419 293 S HA -0.201 4.268 4.470 -0.002 0.000 0.233 293 S C 1.280 175.953 174.600 0.121 0.000 1.016 293 S CA 0.723 59.010 58.200 0.145 0.000 0.974 293 S CB 0.039 63.317 63.200 0.130 0.000 0.786 293 S HN 0.404 8.714 8.310 -0.000 0.000 0.492 294 D N 1.919 122.381 120.400 0.104 0.000 2.221 294 D HA -0.034 4.605 4.640 -0.002 0.000 0.204 294 D C 1.632 177.981 176.300 0.082 0.000 0.982 294 D CA 1.149 55.199 54.000 0.083 0.000 0.857 294 D CB -0.143 40.698 40.800 0.068 0.000 0.934 294 D HN 0.588 8.958 8.370 -0.000 0.000 0.475 295 K N -0.332 120.125 120.400 0.094 0.000 2.358 295 K HA 0.170 4.488 4.320 -0.002 0.000 0.197 295 K C 0.442 177.102 176.600 0.100 0.000 1.025 295 K CA -0.248 56.092 56.287 0.087 0.000 1.104 295 K CB 0.897 33.445 32.500 0.079 0.000 0.855 295 K HN -0.037 8.213 8.250 -0.000 0.000 0.531 296 R N 1.346 121.920 120.500 0.123 0.000 2.543 296 R HA 0.151 4.490 4.340 -0.002 0.000 0.277 296 R C 0.274 176.640 176.300 0.110 0.000 1.074 296 R CA -0.225 55.957 56.100 0.135 0.000 1.076 296 R CB 0.581 30.987 30.300 0.175 0.000 0.993 296 R HN 0.106 8.376 8.270 -0.000 0.000 0.459 297 I N 1.908 122.538 120.570 0.100 0.000 2.752 297 I HA -0.091 4.078 4.170 -0.002 0.000 0.287 297 I C 0.793 176.973 176.117 0.106 0.000 1.188 297 I CA 0.599 61.956 61.300 0.096 0.000 1.427 297 I CB 0.761 38.814 38.000 0.088 0.000 1.365 297 I HN 0.726 8.936 8.210 -0.000 0.000 0.585 298 T N 3.627 118.244 114.554 0.104 0.000 2.881 298 T HA 0.497 4.846 4.350 -0.002 0.000 0.278 298 T C 1.047 175.811 174.700 0.107 0.000 0.982 298 T CA -0.198 61.973 62.100 0.117 0.000 0.989 298 T CB 1.591 70.524 68.868 0.108 0.000 1.058 298 T HN 0.703 8.943 8.240 -0.000 0.000 0.529 299 A N 0.894 123.784 122.820 0.116 0.000 1.908 299 A HA 0.154 4.473 4.320 -0.002 0.000 0.218 299 A C 2.635 180.233 177.584 0.024 0.000 1.181 299 A CA 1.982 54.041 52.037 0.036 0.000 0.627 299 A CB -1.595 17.386 19.000 -0.032 0.000 0.818 299 A HN 1.262 9.412 8.150 -0.000 0.000 0.445 300 A N -0.842 122.011 122.820 0.056 0.000 1.902 300 A HA -0.192 4.127 4.320 -0.002 0.000 0.217 300 A C 2.119 179.743 177.584 0.067 0.000 1.181 300 A CA 1.712 53.785 52.037 0.060 0.000 0.623 300 A CB -0.543 18.502 19.000 0.075 0.000 0.818 300 A HN 0.649 8.799 8.150 -0.000 0.000 0.443 301 Q N -0.575 119.273 119.800 0.080 0.000 2.079 301 Q HA -0.042 4.297 4.340 -0.002 0.000 0.200 301 Q C 2.389 178.459 176.000 0.117 0.000 0.974 301 Q CA 1.471 57.329 55.803 0.091 0.000 0.840 301 Q CB -0.400 28.395 28.738 0.096 0.000 0.898 301 Q HN 0.668 8.938 8.270 -0.000 0.000 0.430 302 A N 0.748 123.644 122.820 0.127 0.000 1.972 302 A HA -0.143 4.176 4.320 -0.002 0.000 0.219 302 A C 2.030 179.775 177.584 0.269 0.000 1.169 302 A CA 0.974 53.137 52.037 0.209 0.000 0.635 302 A CB -0.662 18.441 19.000 0.171 0.000 0.810 302 A HN 0.313 8.463 8.150 -0.000 0.000 0.446 303 L N -1.066 120.202 121.223 0.075 0.000 2.187 303 L HA -0.203 4.136 4.340 -0.002 0.000 0.213 303 L C 2.614 179.381 176.870 -0.172 0.000 1.100 303 L CA 1.023 55.861 54.840 -0.002 0.000 0.765 303 L CB -0.280 41.772 42.059 -0.012 0.000 0.904 303 L HN 0.450 8.680 8.230 -0.000 0.000 0.437 304 A N -2.580 120.147 122.820 -0.155 0.000 2.308 304 A HA -0.008 4.311 4.320 -0.002 0.000 0.217 304 A C 0.838 178.437 177.584 0.025 0.000 1.216 304 A CA -0.233 51.639 52.037 -0.276 0.000 0.864 304 A CB -0.498 18.447 19.000 -0.092 0.000 0.902 304 A HN 0.294 8.444 8.150 -0.000 0.000 0.499 305 H N 0.101 119.239 119.070 0.113 0.000 2.815 305 H HA 0.307 4.862 4.556 -0.002 0.000 0.350 305 H C 1.387 176.781 175.328 0.111 0.000 1.080 305 H CA 0.506 56.629 56.048 0.126 0.000 1.433 305 H CB 1.268 31.127 29.762 0.162 0.000 1.432 305 H HN 0.166 8.446 8.280 -0.000 0.000 0.592 306 A N 5.161 127.849 122.820 -0.220 0.000 2.019 306 A HA -0.244 4.075 4.320 -0.002 0.000 0.219 306 A C 1.968 179.600 177.584 0.081 0.000 1.164 306 A CA 1.113 53.114 52.037 -0.060 0.000 0.644 306 A CB -0.850 18.064 19.000 -0.143 0.000 0.805 306 A HN 0.854 9.004 8.150 -0.000 0.000 0.449 307 Y N -0.141 120.195 120.300 0.060 0.000 2.181 307 Y HA -0.232 4.317 4.550 -0.002 0.000 0.284 307 Y C 0.998 176.728 175.900 -0.284 0.000 1.179 307 Y CA 1.523 59.511 58.100 -0.186 0.000 1.179 307 Y CB -0.425 37.757 38.460 -0.462 0.000 0.973 307 Y HN 0.332 8.612 8.280 -0.000 0.000 0.519 308 F N -0.913 119.147 119.950 0.183 0.000 2.645 308 F HA 0.382 4.908 4.527 -0.002 0.000 0.300 308 F C 1.970 177.819 175.800 0.081 0.000 1.115 308 F CA 0.100 58.172 58.000 0.120 0.000 1.355 308 F CB -1.025 38.147 39.000 0.285 0.000 1.026 308 F HN 0.056 8.356 8.300 -0.000 0.000 0.536 309 A N 0.220 123.122 122.820 0.137 0.000 1.958 309 A HA -0.329 3.990 4.320 -0.002 0.000 0.221 309 A C 2.242 179.808 177.584 -0.030 0.000 1.178 309 A CA 2.207 54.291 52.037 0.079 0.000 0.642 309 A CB -0.637 18.375 19.000 0.020 0.000 0.816 309 A HN 0.427 8.577 8.150 -0.000 0.000 0.453 310 Q N -2.169 117.531 119.800 -0.166 0.000 2.224 310 Q HA -0.126 4.213 4.340 -0.002 0.000 0.203 310 Q C 1.245 176.852 176.000 -0.655 0.000 0.970 310 Q CA 1.838 57.373 55.803 -0.447 0.000 0.865 310 Q CB -0.255 28.097 28.738 -0.643 0.000 0.922 310 Q HN 0.777 9.047 8.270 -0.000 0.000 0.445 311 Y N -2.212 117.986 120.300 -0.170 0.000 2.535 311 Y HA 0.198 4.747 4.550 -0.002 0.000 0.264 311 Y C 0.327 175.959 175.900 -0.447 0.000 1.087 311 Y CA -0.171 57.673 58.100 -0.427 0.000 1.285 311 Y CB -0.145 37.828 38.460 -0.812 0.000 1.200 311 Y HN 0.108 8.388 8.280 -0.000 0.000 0.514 312 H N 2.016 120.997 119.070 -0.148 0.000 3.107 312 H HA 0.153 4.708 4.556 -0.002 0.000 0.301 312 H C -0.998 174.383 175.328 0.089 0.000 0.981 312 H CA -0.034 56.074 56.048 0.100 0.000 1.443 312 H CB 0.104 29.994 29.762 0.214 0.000 1.479 312 H HN 0.054 8.334 8.280 -0.000 0.000 0.564 313 D N 7.045 127.379 120.400 -0.111 0.000 2.421 313 D HA 0.177 4.816 4.640 -0.002 0.000 0.254 313 D C -2.094 174.095 176.300 -0.185 0.000 1.238 313 D CA -2.276 51.606 54.000 -0.196 0.000 0.919 313 D CB 1.622 42.408 40.800 -0.024 0.000 1.152 313 D HN 0.367 8.737 8.370 -0.000 0.000 0.552 314 P HA -0.018 4.402 4.420 -0.000 0.000 0.228 314 P C 0.160 177.468 177.300 0.013 0.000 1.151 314 P CA 0.581 63.636 63.100 -0.076 0.000 0.770 314 P CB 0.611 32.281 31.700 -0.049 0.000 0.786 315 D N -0.658 119.737 120.400 -0.009 0.000 2.349 315 D HA 0.008 4.647 4.640 -0.002 0.000 0.214 315 D C 0.331 176.649 176.300 0.030 0.000 1.063 315 D CA 0.535 54.544 54.000 0.016 0.000 0.847 315 D CB 0.147 40.948 40.800 0.002 0.000 0.933 315 D HN 0.138 8.508 8.370 -0.000 0.000 0.513 316 D N 0.590 121.018 120.400 0.047 0.000 2.837 316 D HA 0.064 4.703 4.640 -0.002 0.000 0.340 316 D C -0.612 175.745 176.300 0.096 0.000 1.451 316 D CA -0.104 53.930 54.000 0.057 0.000 0.798 316 D CB 0.086 40.919 40.800 0.054 0.000 1.169 316 D HN -0.101 8.269 8.370 -0.000 0.000 0.449 317 E N 1.543 121.812 120.200 0.115 0.000 3.568 317 E HA 0.244 4.593 4.350 -0.002 0.000 0.213 317 E C -2.332 174.365 176.600 0.162 0.000 1.197 317 E CA -1.610 54.879 56.400 0.148 0.000 1.126 317 E CB 1.350 31.155 29.700 0.175 0.000 1.285 317 E HN 0.221 8.581 8.360 -0.000 0.000 0.418 318 P HA 0.021 4.441 4.420 -0.000 0.000 0.274 318 P C 0.036 177.521 177.300 0.308 0.000 1.231 318 P CA -0.321 62.902 63.100 0.205 0.000 0.790 318 P CB 1.021 32.819 31.700 0.163 0.000 0.951 319 V N -1.229 118.814 119.914 0.215 0.000 3.096 319 V HA 0.839 4.958 4.120 -0.002 0.000 0.319 319 V C 0.113 176.243 176.094 0.060 0.000 1.082 319 V CA -1.263 61.113 62.300 0.127 0.000 1.022 319 V CB 0.724 32.579 31.823 0.054 0.000 1.103 319 V HN 0.699 8.889 8.190 -0.000 0.000 0.455 320 A N 0.900 123.544 122.820 -0.293 0.000 2.322 320 A HA 0.509 4.828 4.320 -0.002 0.000 0.269 320 A C 0.012 177.570 177.584 -0.043 0.000 1.094 320 A CA -0.465 51.331 52.037 -0.401 0.000 0.807 320 A CB -0.153 18.370 19.000 -0.795 0.000 1.047 320 A HN 0.968 9.118 8.150 -0.000 0.000 0.487 321 D N 1.551 121.971 120.400 0.034 0.000 2.443 321 D HA 0.224 4.862 4.640 -0.002 0.000 0.234 321 D C -2.221 174.240 176.300 0.268 0.000 1.172 321 D CA -0.312 53.766 54.000 0.130 0.000 0.878 321 D CB -0.118 40.749 40.800 0.111 0.000 1.204 321 D HN 0.220 8.590 8.370 -0.000 0.000 0.453 322 P HA -0.073 4.347 4.420 -0.000 0.000 0.261 322 P C -0.782 176.646 177.300 0.213 0.000 1.173 322 P CA 0.420 63.621 63.100 0.169 0.000 0.760 322 P CB 0.074 31.842 31.700 0.113 0.000 0.783 323 Y N 3.306 123.552 120.300 -0.090 0.000 2.345 323 Y HA 0.254 4.803 4.550 -0.002 0.000 0.331 323 Y C -0.205 175.624 175.900 -0.118 0.000 0.959 323 Y CA -1.423 56.494 58.100 -0.305 0.000 1.204 323 Y CB 0.690 38.876 38.460 -0.456 0.000 1.135 323 Y HN 0.262 8.542 8.280 -0.000 0.000 0.477 324 D N 5.798 125.995 120.400 -0.339 0.000 2.352 324 D HA 0.050 4.689 4.640 -0.002 0.000 0.245 324 D C -0.147 175.914 176.300 -0.399 0.000 1.224 324 D CA 0.029 53.881 54.000 -0.246 0.000 0.879 324 D CB 0.754 41.504 40.800 -0.083 0.000 1.057 324 D HN 0.815 9.185 8.370 -0.000 0.000 0.491 325 Q N 1.816 121.388 119.800 -0.380 0.000 2.268 325 Q HA 0.105 4.444 4.340 -0.002 0.000 0.289 325 Q C 0.880 176.670 176.000 -0.349 0.000 0.893 325 Q CA -0.412 55.147 55.803 -0.406 0.000 1.057 325 Q CB 0.155 28.584 28.738 -0.515 0.000 1.173 325 Q HN 0.307 8.577 8.270 -0.000 0.000 0.449 326 S N 0.759 116.389 115.700 -0.117 0.000 2.419 326 S HA -0.232 4.237 4.470 -0.002 0.000 0.235 326 S C 1.656 176.254 174.600 -0.003 0.000 1.019 326 S CA 1.048 59.215 58.200 -0.056 0.000 0.982 326 S CB -0.954 62.251 63.200 0.007 0.000 0.789 326 S HN 0.672 8.982 8.310 -0.000 0.000 0.490 327 F N 2.238 122.253 119.950 0.108 0.000 2.250 327 F HA 0.079 4.605 4.527 -0.002 0.000 0.301 327 F C 2.038 178.015 175.800 0.295 0.000 1.077 327 F CA 1.093 59.245 58.000 0.253 0.000 1.348 327 F CB -0.709 38.570 39.000 0.466 0.000 1.040 327 F HN 0.054 8.354 8.300 -0.000 0.000 0.509 328 E N 1.065 120.862 120.200 -0.673 0.000 2.160 328 E HA -0.160 4.188 4.350 -0.002 0.000 0.195 328 E C 2.154 178.702 176.600 -0.088 0.000 0.991 328 E CA 1.532 57.670 56.400 -0.436 0.000 0.810 328 E CB -0.459 28.933 29.700 -0.512 0.000 0.742 328 E HN 0.651 9.011 8.360 -0.000 0.000 0.466 329 S N -0.259 115.415 115.700 -0.044 0.000 2.577 329 S HA 0.154 4.623 4.470 -0.002 0.000 0.219 329 S C 0.842 175.488 174.600 0.078 0.000 0.962 329 S CA -0.427 57.782 58.200 0.014 0.000 0.921 329 S CB 0.376 63.565 63.200 -0.018 0.000 0.789 329 S HN -0.017 8.293 8.310 -0.000 0.000 0.497 330 R N 1.706 122.303 120.500 0.161 0.000 2.349 330 R HA 0.288 4.627 4.340 -0.002 0.000 0.299 330 R C -1.422 175.028 176.300 0.249 0.000 1.027 330 R CA -0.360 55.836 56.100 0.161 0.000 0.958 330 R CB 0.430 30.814 30.300 0.139 0.000 1.047 330 R HN 0.172 8.442 8.270 -0.000 0.000 0.468 331 D N 5.612 126.090 120.400 0.130 0.000 2.329 331 D HA 0.310 4.949 4.640 -0.002 0.000 0.232 331 D C -0.364 175.945 176.300 0.016 0.000 1.088 331 D CA -0.120 53.974 54.000 0.156 0.000 0.835 331 D CB 1.454 42.318 40.800 0.106 0.000 1.078 331 D HN 0.342 8.712 8.370 -0.000 0.000 0.495 332 L N 1.151 122.377 121.223 0.005 0.000 2.327 332 L HA 0.485 4.824 4.340 -0.002 0.000 0.258 332 L C 0.063 176.889 176.870 -0.073 0.000 1.024 332 L CA -1.065 53.589 54.840 -0.310 0.000 0.825 332 L CB 1.909 43.300 42.059 -1.114 0.000 1.386 332 L HN 0.054 8.284 8.230 -0.000 0.000 0.417 333 L N 1.116 122.274 121.223 -0.108 0.000 2.466 333 L HA 0.258 4.597 4.340 -0.002 0.000 0.257 333 L C 1.392 178.329 176.870 0.112 0.000 1.189 333 L CA -0.302 54.552 54.840 0.024 0.000 0.813 333 L CB 0.725 42.773 42.059 -0.019 0.000 1.118 333 L HN 0.597 8.827 8.230 -0.000 0.000 0.471 334 I N 0.427 121.103 120.570 0.177 0.000 2.113 334 I HA -0.330 3.838 4.170 -0.002 0.000 0.242 334 I C 1.731 177.921 176.117 0.122 0.000 1.064 334 I CA 1.525 62.959 61.300 0.224 0.000 1.320 334 I CB -0.212 37.875 38.000 0.145 0.000 1.028 334 I HN 0.752 8.962 8.210 -0.000 0.000 0.406 335 D N 0.424 120.832 120.400 0.013 0.000 2.219 335 D HA -0.144 4.495 4.640 -0.002 0.000 0.205 335 D C 2.133 178.386 176.300 -0.078 0.000 0.970 335 D CA 0.998 54.964 54.000 -0.057 0.000 0.851 335 D CB -0.084 40.677 40.800 -0.064 0.000 0.943 335 D HN 0.459 8.829 8.370 -0.000 0.000 0.488 336 E N -0.664 119.469 120.200 -0.112 0.000 2.072 336 E HA -0.128 4.221 4.350 -0.002 0.000 0.190 336 E C 2.099 178.546 176.600 -0.254 0.000 0.982 336 E CA 0.544 56.811 56.400 -0.223 0.000 0.803 336 E CB -0.185 29.313 29.700 -0.336 0.000 0.755 336 E HN 0.404 8.764 8.360 -0.000 0.000 0.453 337 W N 1.802 123.057 121.300 -0.076 0.000 2.338 337 W HA -0.158 4.501 4.660 -0.002 0.000 0.304 337 W C 2.481 178.992 176.519 -0.014 0.000 1.212 337 W CA 0.812 58.111 57.345 -0.077 0.000 1.264 337 W CB -0.016 29.474 29.460 0.050 0.000 1.142 337 W HN 0.006 8.186 8.180 -0.000 0.000 0.512 338 K N 0.145 120.623 120.400 0.129 0.000 2.026 338 K HA -0.211 4.108 4.320 -0.002 0.000 0.208 338 K C 2.373 179.007 176.600 0.056 0.000 1.048 338 K CA 1.726 57.894 56.287 -0.200 0.000 0.929 338 K CB -0.510 31.648 32.500 -0.571 0.000 0.713 338 K HN -0.014 8.236 8.250 -0.000 0.000 0.439 339 S N 0.494 116.205 115.700 0.018 0.000 2.383 339 S HA -0.063 4.405 4.470 -0.002 0.000 0.227 339 S C 1.908 176.567 174.600 0.097 0.000 1.026 339 S CA 0.884 59.119 58.200 0.058 0.000 0.981 339 S CB -0.215 62.974 63.200 -0.017 0.000 0.818 339 S HN 0.322 8.632 8.310 -0.000 0.000 0.472 340 L N 0.715 121.950 121.223 0.019 0.000 2.046 340 L HA -0.105 4.234 4.340 -0.002 0.000 0.208 340 L C 2.775 179.809 176.870 0.272 0.000 1.077 340 L CA 1.670 56.514 54.840 0.006 0.000 0.747 340 L CB -1.142 40.669 42.059 -0.412 0.000 0.896 340 L HN 0.344 8.574 8.230 -0.000 0.000 0.432 341 T N -1.406 113.397 114.554 0.415 0.000 2.746 341 T HA -0.245 4.104 4.350 -0.002 0.000 0.267 341 T C 1.698 176.617 174.700 0.365 0.000 1.039 341 T CA 1.319 63.761 62.100 0.570 0.000 1.142 341 T CB -0.382 68.947 68.868 0.768 0.000 0.866 341 T HN 0.257 8.497 8.240 -0.000 0.000 0.444 342 Y N 2.545 122.906 120.300 0.101 0.000 2.128 342 Y HA -0.209 4.341 4.550 -0.001 0.000 0.284 342 Y C 2.054 177.866 175.900 -0.146 0.000 1.154 342 Y CA 1.477 59.377 58.100 -0.332 0.000 1.149 342 Y CB -0.618 37.571 38.460 -0.450 0.000 0.976 342 Y HN 0.152 8.432 8.280 -0.000 0.000 0.505 343 D N 0.020 120.397 120.400 -0.037 0.000 2.133 343 D HA -0.191 4.447 4.640 -0.002 0.000 0.195 343 D C 2.034 178.308 176.300 -0.044 0.000 0.997 343 D CA 1.719 55.681 54.000 -0.063 0.000 0.840 343 D CB -0.227 40.599 40.800 0.043 0.000 0.947 343 D HN 0.464 8.834 8.370 -0.000 0.000 0.452 344 E N 0.254 120.487 120.200 0.055 0.000 2.106 344 E HA -0.070 4.278 4.350 -0.002 0.000 0.192 344 E C 2.460 179.092 176.600 0.053 0.000 0.984 344 E CA 0.187 56.637 56.400 0.084 0.000 0.806 344 E CB -0.169 29.606 29.700 0.125 0.000 0.750 344 E HN 0.183 8.543 8.360 -0.000 0.000 0.458 345 V N 2.521 122.422 119.914 -0.022 0.000 2.295 345 V HA -0.244 3.875 4.120 -0.002 0.000 0.246 345 V C 2.529 178.590 176.094 -0.055 0.000 1.049 345 V CA 1.954 64.228 62.300 -0.044 0.000 1.024 345 V CB -0.695 31.062 31.823 -0.111 0.000 0.648 345 V HN 0.342 8.532 8.190 -0.000 0.000 0.447 346 I N -0.098 120.334 120.570 -0.229 0.000 2.761 346 I HA -0.042 4.127 4.170 -0.002 0.000 0.261 346 I C 2.200 178.291 176.117 -0.043 0.000 1.198 346 I CA 1.530 62.721 61.300 -0.181 0.000 1.482 346 I CB -0.506 37.274 38.000 -0.367 0.000 1.100 346 I HN 0.375 8.585 8.210 -0.000 0.000 0.445 347 S N 0.506 116.202 115.700 -0.007 0.000 2.593 347 S HA 0.077 4.546 4.470 -0.002 0.000 0.217 347 S C 0.646 175.292 174.600 0.078 0.000 0.966 347 S CA -0.569 57.649 58.200 0.029 0.000 0.914 347 S CB -0.840 62.377 63.200 0.029 0.000 0.776 347 S HN 0.450 8.760 8.310 -0.000 0.000 0.523 348 F N 2.859 122.807 119.950 -0.003 0.000 2.572 348 F HA 0.419 4.945 4.527 -0.002 0.000 0.370 348 F C -0.408 175.407 175.800 0.024 0.000 1.103 348 F CA -0.253 57.759 58.000 0.021 0.000 1.286 348 F CB 0.656 39.678 39.000 0.036 0.000 1.105 348 F HN -0.064 8.236 8.300 -0.000 0.000 0.583 349 V N 8.234 127.552 119.914 -0.993 0.000 2.483 349 V HA 0.336 4.454 4.120 -0.002 0.000 0.297 349 V C -1.949 173.461 176.094 -1.141 0.000 1.027 349 V CA -1.656 60.191 62.300 -0.754 0.000 0.855 349 V CB 1.446 33.056 31.823 -0.354 0.000 0.995 349 V HN 0.707 8.897 8.190 -0.000 0.000 0.424 350 P HA 0.240 4.660 4.420 -0.000 0.000 0.270 350 P C -2.737 174.457 177.300 -0.177 0.000 1.223 350 P CA -1.387 61.538 63.100 -0.292 0.000 0.785 350 P CB -0.266 31.455 31.700 0.035 0.000 0.923 351 P HA 0.114 4.534 4.420 -0.000 0.000 0.264 351 P C -1.861 175.428 177.300 -0.018 0.000 1.193 351 P CA -0.433 62.661 63.100 -0.010 0.000 0.763 351 P CB -1.031 30.700 31.700 0.051 0.000 0.810 352 P HA 0.118 4.538 4.420 -0.000 0.000 0.272 352 P C -0.383 176.912 177.300 -0.007 0.000 1.240 352 P CA -0.411 62.674 63.100 -0.024 0.000 0.791 352 P CB 0.529 32.213 31.700 -0.027 0.000 0.978 353 L N 0.000 121.218 121.223 -0.008 0.000 2.949 353 L HA 0.000 4.339 4.340 -0.002 0.000 0.249 353 L CA 0.000 54.839 54.840 -0.002 0.000 0.813 353 L CB 0.000 42.059 42.059 0.000 0.000 0.961 353 L HN 0.000 8.230 8.230 -0.000 0.000 0.502