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 2dfl_1_A DATA FIRST_RESID 13 DATA SEQUENCE TINDLPGISQ TVINKLIEAG YSSLETLAVA SPQDLSVAAG IPLSTAQKII DATA SEQUENCE KEARDALDIR FKTALEVKKE RMNVKKISTG SQALDGLLAG GIETRTMTEF DATA SEQUENCE FGEFGSGKTQ LCHQLSVNVQ LPPEKGGLSG KAVYIDTEGT FRWERIENMA DATA SEQUENCE KALGLDIDNV MNNIYYIRAI NTDHQIAIVD DLQELVSKDP SIKLIVVDSV DATA SEQUENCE TSHFRAEYPG RENLAVRQQK LNKHLHQLTR LAEVYDIAVI ITNQVMXXXX DATA SEQUENCE XXXXXXXXXX XXHTLYHVPG IRIQLKKSRG NRRIARVVDA PHLPEGEVVF DATA SEQUENCE ALTEEGIRDA 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 13 T HA 0.000 4.350 4.350 -0.000 0.000 0.228 13 T C 0.000 174.707 174.700 0.012 0.000 1.109 13 T CA 0.000 62.105 62.100 0.008 0.000 1.349 13 T CB 0.000 68.870 68.868 0.003 0.000 0.612 14 I N -0.807 119.775 120.570 0.020 0.000 2.756 14 I HA -0.047 4.066 4.170 -0.095 0.000 0.262 14 I C 2.088 178.212 176.117 0.012 0.000 1.225 14 I CA 1.082 62.395 61.300 0.022 0.000 1.472 14 I CB -0.314 37.707 38.000 0.035 0.000 1.094 14 I HN 0.431 8.641 8.210 -0.000 0.000 0.454 15 N N 1.486 120.192 118.700 0.009 0.000 2.120 15 N HA -0.268 4.415 4.740 -0.095 0.000 0.188 15 N C 1.536 177.047 175.510 0.001 0.000 1.024 15 N CA 1.407 54.459 53.050 0.004 0.000 0.852 15 N CB -0.041 38.447 38.487 0.001 0.000 1.003 15 N HN 0.337 8.717 8.380 -0.000 0.000 0.424 16 D N 0.554 120.955 120.400 0.002 0.000 2.352 16 D HA 0.015 4.598 4.640 -0.095 0.000 0.232 16 D C -0.123 176.178 176.300 0.002 0.000 1.055 16 D CA -0.079 53.922 54.000 0.001 0.000 0.891 16 D CB -0.208 40.593 40.800 0.002 0.000 0.897 16 D HN 0.263 8.633 8.370 -0.000 0.000 0.529 17 L N 1.409 122.634 121.223 0.003 0.000 2.700 17 L HA -0.020 4.263 4.340 -0.095 0.000 0.272 17 L C -0.910 175.960 176.870 0.000 0.000 1.176 17 L CA -0.936 53.906 54.840 0.003 0.000 0.961 17 L CB 0.298 42.358 42.059 0.001 0.000 1.249 17 L HN -0.019 8.211 8.230 -0.000 0.000 0.487 18 P HA -0.248 4.172 4.420 -0.000 0.000 0.224 18 P C 0.673 177.972 177.300 -0.001 0.000 1.130 18 P CA 1.724 64.824 63.100 0.001 0.000 0.976 18 P CB 0.149 31.850 31.700 0.003 0.000 0.781 19 G N -2.128 106.670 108.800 -0.002 0.000 4.831 19 G HA2 0.446 4.349 3.960 -0.095 0.000 0.231 19 G HA3 0.446 4.349 3.960 -0.095 0.000 0.231 19 G C -0.616 174.280 174.900 -0.007 0.000 1.006 19 G CA -0.153 44.945 45.100 -0.004 0.000 0.792 19 G HN 0.251 8.541 8.290 -0.000 0.000 0.546 20 I N -0.220 120.345 120.570 -0.009 0.000 2.982 20 I HA 0.614 4.727 4.170 -0.095 0.000 0.312 20 I C -0.224 175.885 176.117 -0.013 0.000 1.041 20 I CA -0.999 60.293 61.300 -0.013 0.000 1.053 20 I CB 2.249 40.239 38.000 -0.016 0.000 1.248 20 I HN 0.030 8.240 8.210 -0.000 0.000 0.471 21 S N 3.261 118.951 115.700 -0.017 0.000 2.464 21 S HA 0.065 4.478 4.470 -0.095 0.000 0.313 21 S C 0.586 175.176 174.600 -0.017 0.000 1.078 21 S CA -0.372 57.818 58.200 -0.015 0.000 1.096 21 S CB 0.999 64.189 63.200 -0.016 0.000 1.032 21 S HN 0.625 8.935 8.310 -0.000 0.000 0.498 22 Q N 3.091 122.883 119.800 -0.013 0.000 2.325 22 Q HA -0.187 4.095 4.340 -0.095 0.000 0.211 22 Q C 1.806 177.799 176.000 -0.013 0.000 0.988 22 Q CA 2.283 58.079 55.803 -0.012 0.000 0.887 22 Q CB -0.749 27.984 28.738 -0.008 0.000 0.915 22 Q HN 0.632 8.902 8.270 -0.000 0.000 0.440 23 T N -1.555 112.991 114.554 -0.013 0.000 2.929 23 T HA -0.092 4.200 4.350 -0.095 0.000 0.271 23 T C 1.319 176.009 174.700 -0.016 0.000 1.085 23 T CA 1.545 63.637 62.100 -0.013 0.000 1.125 23 T CB -0.230 68.631 68.868 -0.012 0.000 0.874 23 T HN 0.384 8.624 8.240 -0.000 0.000 0.494 24 V N -1.803 118.098 119.914 -0.022 0.000 3.644 24 V HA 0.383 4.446 4.120 -0.095 0.000 0.267 24 V C 2.118 178.190 176.094 -0.037 0.000 1.277 24 V CA 0.344 62.625 62.300 -0.032 0.000 1.096 24 V CB -0.608 31.191 31.823 -0.040 0.000 0.828 24 V HN 0.461 8.651 8.190 -0.000 0.000 0.446 25 I N 1.276 121.829 120.570 -0.027 0.000 2.546 25 I HA -0.037 4.076 4.170 -0.095 0.000 0.255 25 I C 1.622 177.734 176.117 -0.008 0.000 1.163 25 I CA 1.262 62.550 61.300 -0.021 0.000 1.457 25 I CB -0.398 37.596 38.000 -0.012 0.000 1.092 25 I HN 0.349 8.559 8.210 -0.000 0.000 0.434 26 N N 1.366 120.062 118.700 -0.006 0.000 2.652 26 N HA -0.040 4.643 4.740 -0.095 0.000 0.259 26 N C 0.856 176.367 175.510 0.002 0.000 1.240 26 N CA 0.435 53.486 53.050 0.001 0.000 0.951 26 N CB -0.081 38.406 38.487 -0.000 0.000 1.281 26 N HN 0.236 8.616 8.380 -0.000 0.000 0.507 27 K N -1.142 119.259 120.400 0.001 0.000 2.604 27 K HA 0.177 4.439 4.320 -0.095 0.000 0.201 27 K C 0.814 177.423 176.600 0.015 0.000 1.733 27 K CA 0.082 56.370 56.287 0.002 0.000 1.115 27 K CB 0.087 32.577 32.500 -0.016 0.000 1.532 27 K HN 0.092 8.342 8.250 -0.000 0.000 0.595 28 L N 0.888 122.114 121.223 0.006 0.000 2.162 28 L HA 0.070 4.353 4.340 -0.095 0.000 0.205 28 L C 2.088 179.030 176.870 0.118 0.000 1.086 28 L CA 0.482 55.346 54.840 0.039 0.000 0.778 28 L CB -0.146 41.900 42.059 -0.022 0.000 0.928 28 L HN 0.128 8.358 8.230 -0.000 0.000 0.446 29 I N 0.107 120.717 120.570 0.067 0.000 2.830 29 I HA -0.135 3.978 4.170 -0.095 0.000 0.263 29 I C 1.875 178.027 176.117 0.059 0.000 1.230 29 I CA 1.135 62.472 61.300 0.062 0.000 1.480 29 I CB -0.227 37.795 38.000 0.037 0.000 1.095 29 I HN 0.128 8.338 8.210 -0.000 0.000 0.455 30 E N 1.110 121.345 120.200 0.059 0.000 2.445 30 E HA 0.358 4.651 4.350 -0.095 0.000 0.189 30 E C 0.343 176.988 176.600 0.075 0.000 1.069 30 E CA 0.289 56.720 56.400 0.052 0.000 0.871 30 E CB -0.134 29.588 29.700 0.037 0.000 0.991 30 E HN 0.466 8.826 8.360 -0.000 0.000 0.481 31 A N -1.114 121.774 122.820 0.113 0.000 2.568 31 A HA 0.617 4.880 4.320 -0.095 0.000 0.291 31 A C 0.728 178.362 177.584 0.084 0.000 1.159 31 A CA -0.244 51.875 52.037 0.136 0.000 0.679 31 A CB 0.412 19.587 19.000 0.292 0.000 1.285 31 A HN 0.005 8.155 8.150 -0.000 0.000 0.428 32 G N -0.944 107.835 108.800 -0.034 0.000 3.318 32 G HA2 0.266 4.169 3.960 -0.095 0.000 0.230 32 G HA3 0.266 4.169 3.960 -0.095 0.000 0.230 32 G C -0.049 174.707 174.900 -0.240 0.000 1.317 32 G CA 0.621 45.640 45.100 -0.135 0.000 1.197 32 G HN 0.504 8.794 8.290 -0.000 0.000 0.514 33 Y N 0.370 120.670 120.300 0.001 0.000 2.493 33 Y HA 0.066 4.559 4.550 -0.094 0.000 0.275 33 Y C 2.450 178.350 175.900 -0.000 0.000 1.183 33 Y CA 0.240 58.340 58.100 0.000 0.000 1.258 33 Y CB 0.641 39.101 38.460 0.000 0.000 1.108 33 Y HN 0.344 8.624 8.280 -0.000 0.000 0.521 34 S N -1.941 113.817 115.700 0.097 0.000 2.515 34 S HA -0.049 4.364 4.470 -0.095 0.000 0.231 34 S C 1.005 175.633 174.600 0.046 0.000 0.987 34 S CA 0.106 58.346 58.200 0.066 0.000 0.936 34 S CB -0.092 63.131 63.200 0.038 0.000 0.766 34 S HN 0.171 8.481 8.310 -0.000 0.000 0.528 35 S N 0.541 116.260 115.700 0.032 0.000 2.499 35 S HA 0.509 4.922 4.470 -0.095 0.000 0.279 35 S C 0.891 175.515 174.600 0.040 0.000 1.219 35 S CA -0.809 57.398 58.200 0.012 0.000 1.062 35 S CB 0.462 63.644 63.200 -0.029 0.000 0.978 35 S HN 0.448 8.758 8.310 -0.000 0.000 0.489 36 L N 4.275 125.516 121.223 0.030 0.000 2.217 36 L HA -0.005 4.278 4.340 -0.095 0.000 0.211 36 L C 2.569 179.458 176.870 0.032 0.000 1.107 36 L CA 0.990 55.852 54.840 0.038 0.000 0.783 36 L CB -0.458 41.612 42.059 0.020 0.000 0.919 36 L HN 0.783 9.013 8.230 -0.000 0.000 0.442 37 E N -0.318 119.888 120.200 0.010 0.000 2.158 37 E HA -0.143 4.150 4.350 -0.095 0.000 0.191 37 E C 1.809 178.407 176.600 -0.003 0.000 0.982 37 E CA 1.449 57.849 56.400 0.001 0.000 0.823 37 E CB -0.454 29.238 29.700 -0.014 0.000 0.766 37 E HN 0.260 8.620 8.360 -0.000 0.000 0.468 38 T N 2.044 116.584 114.554 -0.023 0.000 2.699 38 T HA -0.144 4.149 4.350 -0.095 0.000 0.268 38 T C 1.904 176.606 174.700 0.002 0.000 1.036 38 T CA 1.343 63.395 62.100 -0.079 0.000 1.147 38 T CB -0.247 68.494 68.868 -0.213 0.000 0.862 38 T HN 0.110 8.351 8.240 -0.000 0.000 0.446 39 L N 0.634 121.919 121.223 0.103 0.000 1.961 39 L HA -0.129 4.154 4.340 -0.095 0.000 0.210 39 L C 3.025 179.958 176.870 0.105 0.000 1.072 39 L CA 1.406 56.357 54.840 0.185 0.000 0.749 39 L CB -0.763 41.396 42.059 0.168 0.000 0.889 39 L HN 0.253 8.483 8.230 -0.000 0.000 0.432 40 A N -0.360 122.498 122.820 0.063 0.000 2.067 40 A HA -0.222 4.040 4.320 -0.095 0.000 0.224 40 A C 1.710 179.320 177.584 0.042 0.000 1.172 40 A CA 2.195 54.258 52.037 0.044 0.000 0.662 40 A CB -0.975 18.041 19.000 0.026 0.000 0.814 40 A HN 0.458 8.608 8.150 -0.000 0.000 0.468 41 V N -4.621 115.318 119.914 0.042 0.000 3.043 41 V HA 0.733 4.795 4.120 -0.095 0.000 0.357 41 V C 0.473 176.595 176.094 0.047 0.000 1.372 41 V CA -0.296 62.024 62.300 0.034 0.000 1.214 41 V CB -0.799 31.033 31.823 0.015 0.000 1.224 41 V HN 0.687 8.877 8.190 -0.000 0.000 0.507 42 A N 0.259 123.129 122.820 0.083 0.000 2.327 42 A HA 0.719 4.981 4.320 -0.095 0.000 0.283 42 A C 0.539 178.173 177.584 0.083 0.000 1.127 42 A CA -0.148 51.962 52.037 0.121 0.000 0.810 42 A CB 0.580 19.722 19.000 0.237 0.000 1.066 42 A HN 0.531 8.681 8.150 -0.000 0.000 0.492 43 S N 5.040 120.787 115.700 0.077 0.000 2.416 43 S HA 0.236 4.649 4.470 -0.095 0.000 0.302 43 S C -1.372 173.255 174.600 0.044 0.000 1.120 43 S CA -0.852 57.379 58.200 0.051 0.000 1.067 43 S CB 0.484 63.709 63.200 0.043 0.000 1.057 43 S HN 0.690 9.000 8.310 -0.000 0.000 0.518 44 P HA -0.287 4.133 4.420 -0.000 0.000 0.216 44 P C 1.241 178.548 177.300 0.012 0.000 1.167 44 P CA 1.567 64.677 63.100 0.017 0.000 0.933 44 P CB 0.020 31.728 31.700 0.014 0.000 0.793 45 Q N -0.704 119.104 119.800 0.013 0.000 2.547 45 Q HA -0.064 4.219 4.340 -0.095 0.000 0.217 45 Q C 0.289 176.298 176.000 0.014 0.000 0.978 45 Q CA 1.067 56.877 55.803 0.010 0.000 0.962 45 Q CB -0.659 28.085 28.738 0.010 0.000 0.990 45 Q HN 0.370 8.640 8.270 -0.000 0.000 0.538 46 D N -0.508 119.905 120.400 0.022 0.000 2.490 46 D HA 0.043 4.626 4.640 -0.095 0.000 0.246 46 D C 1.070 177.394 176.300 0.041 0.000 1.196 46 D CA -0.131 53.888 54.000 0.032 0.000 0.812 46 D CB 0.299 41.124 40.800 0.040 0.000 1.191 46 D HN 0.182 8.552 8.370 -0.000 0.000 0.531 47 L N 0.470 121.709 121.223 0.027 0.000 2.446 47 L HA 0.224 4.507 4.340 -0.095 0.000 0.219 47 L C 1.752 178.589 176.870 -0.055 0.000 1.116 47 L CA 1.178 56.015 54.840 -0.005 0.000 0.844 47 L CB 0.170 42.223 42.059 -0.010 0.000 0.970 47 L HN -0.148 8.082 8.230 -0.000 0.000 0.457 48 S N -1.574 114.109 115.700 -0.028 0.000 2.441 48 S HA 0.008 4.421 4.470 -0.095 0.000 0.224 48 S C 1.659 176.246 174.600 -0.022 0.000 1.043 48 S CA 0.892 59.072 58.200 -0.034 0.000 0.948 48 S CB -0.137 63.050 63.200 -0.021 0.000 0.810 48 S HN 0.228 8.538 8.310 -0.000 0.000 0.504 49 V N 1.796 121.706 119.914 -0.007 0.000 3.078 49 V HA 0.179 4.242 4.120 -0.095 0.000 0.265 49 V C 1.937 178.035 176.094 0.006 0.000 1.122 49 V CA 1.358 63.659 62.300 0.001 0.000 1.141 49 V CB -0.696 31.133 31.823 0.009 0.000 0.735 49 V HN 0.579 8.769 8.190 -0.000 0.000 0.498 50 A N -1.220 121.602 122.820 0.004 0.000 2.545 50 A HA 0.752 5.015 4.320 -0.095 0.000 0.263 50 A C 1.553 179.124 177.584 -0.022 0.000 1.202 50 A CA 0.702 52.749 52.037 0.017 0.000 0.959 50 A CB 0.384 19.426 19.000 0.070 0.000 1.124 50 A HN 0.457 8.607 8.150 -0.000 0.000 0.543 51 A N -2.262 120.523 122.820 -0.058 0.000 2.548 51 A HA 0.506 4.768 4.320 -0.095 0.000 0.236 51 A C 1.701 179.247 177.584 -0.063 0.000 1.246 51 A CA 1.011 52.990 52.037 -0.096 0.000 0.993 51 A CB -0.211 18.684 19.000 -0.175 0.000 1.209 51 A HN 1.813 9.963 8.150 -0.000 0.000 0.570 52 G N 0.558 109.334 108.800 -0.040 0.000 4.655 52 G HA2 -0.308 3.594 3.960 -0.095 0.000 0.220 52 G HA3 -0.308 3.594 3.960 -0.095 0.000 0.220 52 G C 0.503 175.384 174.900 -0.032 0.000 1.403 52 G CA 0.394 45.476 45.100 -0.030 0.000 0.931 52 G HN 1.442 9.732 8.290 -0.000 0.000 0.654 53 I N 5.319 125.864 120.570 -0.042 0.000 3.076 53 I HA 0.300 4.413 4.170 -0.095 0.000 0.321 53 I C -1.493 174.604 176.117 -0.033 0.000 1.216 53 I CA -1.226 60.051 61.300 -0.039 0.000 1.460 53 I CB 0.159 38.129 38.000 -0.050 0.000 1.313 53 I HN 0.294 8.504 8.210 -0.000 0.000 0.546 54 P HA -0.106 4.314 4.420 -0.000 0.000 0.266 54 P C -0.040 177.249 177.300 -0.020 0.000 1.180 54 P CA 0.109 63.198 63.100 -0.019 0.000 0.765 54 P CB 0.231 31.922 31.700 -0.015 0.000 0.806 55 L N 1.523 122.737 121.223 -0.015 0.000 2.962 55 L HA -0.073 4.210 4.340 -0.095 0.000 0.263 55 L C 1.581 178.445 176.870 -0.010 0.000 1.152 55 L CA 1.157 55.990 54.840 -0.012 0.000 0.954 55 L CB -2.070 39.986 42.059 -0.006 0.000 1.213 55 L HN 0.361 8.591 8.230 -0.000 0.000 0.422 56 S N -2.224 113.468 115.700 -0.012 0.000 2.696 56 S HA -0.024 4.389 4.470 -0.095 0.000 0.172 56 S C 1.837 176.430 174.600 -0.011 0.000 0.767 56 S CA 0.452 58.647 58.200 -0.009 0.000 0.856 56 S CB -0.838 62.356 63.200 -0.009 0.000 0.782 56 S HN 0.403 8.713 8.310 -0.000 0.000 0.582 57 T N 0.644 115.190 114.554 -0.014 0.000 3.025 57 T HA 0.164 4.457 4.350 -0.095 0.000 0.270 57 T C 1.789 176.476 174.700 -0.021 0.000 1.126 57 T CA 0.979 63.069 62.100 -0.015 0.000 1.105 57 T CB -0.791 68.067 68.868 -0.017 0.000 0.884 57 T HN 0.598 8.838 8.240 -0.000 0.000 0.522 58 A N 1.533 124.337 122.820 -0.027 0.000 2.070 58 A HA -0.105 4.157 4.320 -0.095 0.000 0.220 58 A C 2.388 179.959 177.584 -0.021 0.000 1.159 58 A CA 1.294 53.308 52.037 -0.038 0.000 0.656 58 A CB -0.625 18.349 19.000 -0.043 0.000 0.800 58 A HN 0.663 8.813 8.150 -0.000 0.000 0.453 59 Q N -0.985 118.808 119.800 -0.010 0.000 2.311 59 Q HA -0.053 4.230 4.340 -0.095 0.000 0.203 59 Q C 1.995 177.996 176.000 0.001 0.000 0.954 59 Q CA 1.192 56.995 55.803 -0.000 0.000 0.885 59 Q CB -0.034 28.705 28.738 0.002 0.000 0.963 59 Q HN 0.745 9.015 8.270 -0.000 0.000 0.471 60 K N 1.512 121.910 120.400 -0.004 0.000 2.228 60 K HA -0.060 4.202 4.320 -0.095 0.000 0.202 60 K C 1.964 178.563 176.600 -0.001 0.000 1.051 60 K CA 0.568 56.854 56.287 -0.002 0.000 0.960 60 K CB 0.055 32.552 32.500 -0.005 0.000 0.743 60 K HN 0.311 8.561 8.250 -0.000 0.000 0.458 61 I N -1.987 118.579 120.570 -0.007 0.000 2.830 61 I HA -0.066 4.047 4.170 -0.095 0.000 0.263 61 I C 1.630 177.754 176.117 0.011 0.000 1.230 61 I CA 0.769 62.066 61.300 -0.006 0.000 1.480 61 I CB -0.071 37.913 38.000 -0.026 0.000 1.095 61 I HN 0.046 8.256 8.210 -0.000 0.000 0.455 62 I N 1.421 122.000 120.570 0.016 0.000 2.494 62 I HA -0.095 4.018 4.170 -0.095 0.000 0.250 62 I C 2.382 178.515 176.117 0.026 0.000 1.112 62 I CA 0.745 62.062 61.300 0.029 0.000 1.438 62 I CB -0.130 37.891 38.000 0.034 0.000 1.111 62 I HN 0.111 8.321 8.210 -0.000 0.000 0.431 63 K N 0.663 121.076 120.400 0.021 0.000 2.152 63 K HA -0.168 4.095 4.320 -0.095 0.000 0.206 63 K C 1.808 178.420 176.600 0.021 0.000 1.048 63 K CA 1.037 57.337 56.287 0.022 0.000 0.933 63 K CB -0.057 32.454 32.500 0.018 0.000 0.721 63 K HN 0.268 8.518 8.250 -0.000 0.000 0.447 64 E N 0.634 120.844 120.200 0.017 0.000 2.158 64 E HA -0.071 4.222 4.350 -0.095 0.000 0.191 64 E C 2.052 178.662 176.600 0.017 0.000 0.982 64 E CA 0.825 57.234 56.400 0.015 0.000 0.823 64 E CB -0.053 29.654 29.700 0.011 0.000 0.766 64 E HN 0.307 8.667 8.360 -0.000 0.000 0.468 65 A N 1.530 124.363 122.820 0.021 0.000 2.015 65 A HA -0.151 4.112 4.320 -0.095 0.000 0.219 65 A C 2.111 179.707 177.584 0.019 0.000 1.163 65 A CA 0.894 52.945 52.037 0.023 0.000 0.646 65 A CB -0.355 18.666 19.000 0.035 0.000 0.806 65 A HN 0.076 8.226 8.150 -0.000 0.000 0.448 66 R N -0.084 120.429 120.500 0.022 0.000 2.120 66 R HA -0.106 4.177 4.340 -0.095 0.000 0.234 66 R C 1.268 177.575 176.300 0.011 0.000 1.123 66 R CA 1.445 57.557 56.100 0.020 0.000 0.975 66 R CB -0.325 29.995 30.300 0.033 0.000 0.866 66 R HN 0.578 8.848 8.270 -0.000 0.000 0.446 67 D N 0.632 121.041 120.400 0.014 0.000 2.103 67 D HA -0.077 4.506 4.640 -0.095 0.000 0.199 67 D C 1.899 178.200 176.300 0.001 0.000 0.978 67 D CA 1.178 55.184 54.000 0.010 0.000 0.829 67 D CB -0.191 40.618 40.800 0.014 0.000 0.981 67 D HN 0.153 8.523 8.370 -0.000 0.000 0.464 68 A N 1.943 124.765 122.820 0.003 0.000 1.869 68 A HA -0.200 4.063 4.320 -0.095 0.000 0.218 68 A C 2.400 179.978 177.584 -0.010 0.000 1.203 68 A CA 1.348 53.385 52.037 -0.000 0.000 0.638 68 A CB -1.148 17.855 19.000 0.005 0.000 0.831 68 A HN 0.226 8.376 8.150 -0.000 0.000 0.450 69 L N -1.209 120.007 121.223 -0.012 0.000 2.349 69 L HA -0.133 4.150 4.340 -0.095 0.000 0.220 69 L C 0.278 177.126 176.870 -0.036 0.000 1.130 69 L CA 0.853 55.678 54.840 -0.024 0.000 0.791 69 L CB -0.886 41.158 42.059 -0.024 0.000 0.918 69 L HN 0.518 8.748 8.230 -0.000 0.000 0.444 70 D N 0.834 121.216 120.400 -0.030 0.000 3.830 70 D HA -0.160 4.422 4.640 -0.095 0.000 0.247 70 D C -0.808 175.449 176.300 -0.072 0.000 1.073 70 D CA 0.316 54.294 54.000 -0.037 0.000 1.116 70 D CB -0.397 40.383 40.800 -0.033 0.000 0.909 70 D HN -0.025 8.345 8.370 -0.000 0.000 0.418 71 I N 4.486 125.009 120.570 -0.079 0.000 2.503 71 I HA 0.264 4.377 4.170 -0.095 0.000 0.277 71 I C 0.480 176.491 176.117 -0.176 0.000 1.078 71 I CA -0.305 60.892 61.300 -0.173 0.000 1.184 71 I CB 0.556 38.465 38.000 -0.152 0.000 1.353 71 I HN 0.112 8.322 8.210 -0.000 0.000 0.490 72 R N 4.833 125.221 120.500 -0.186 0.000 2.534 72 R HA 0.489 4.772 4.340 -0.095 0.000 0.301 72 R C -1.079 175.149 176.300 -0.119 0.000 0.961 72 R CA -0.766 55.306 56.100 -0.046 0.000 0.871 72 R CB 1.944 32.249 30.300 0.010 0.000 1.170 72 R HN 0.083 8.353 8.270 -0.000 0.000 0.446 73 F N 3.246 123.200 119.950 0.007 0.000 2.413 73 F HA 0.276 4.747 4.527 -0.094 0.000 0.359 73 F C 1.123 176.927 175.800 0.007 0.000 1.122 73 F CA -0.325 57.679 58.000 0.007 0.000 1.160 73 F CB 0.426 39.430 39.000 0.006 0.000 1.146 73 F HN 0.020 8.320 8.300 -0.000 0.000 0.514 74 K N 0.752 121.224 120.400 0.120 0.000 2.488 74 K HA 0.453 4.716 4.320 -0.095 0.000 0.255 74 K C 0.078 176.728 176.600 0.084 0.000 1.036 74 K CA -0.620 55.715 56.287 0.080 0.000 0.990 74 K CB 0.830 33.353 32.500 0.039 0.000 1.304 74 K HN 0.446 8.696 8.250 -0.000 0.000 0.505 75 T N -0.837 113.751 114.554 0.056 0.000 2.856 75 T HA 0.417 4.710 4.350 -0.095 0.000 0.283 75 T C 0.793 175.515 174.700 0.036 0.000 1.008 75 T CA -0.332 61.797 62.100 0.048 0.000 0.997 75 T CB 1.204 70.094 68.868 0.037 0.000 0.992 75 T HN 0.446 8.686 8.240 -0.000 0.000 0.454 76 A N 3.773 126.613 122.820 0.034 0.000 2.194 76 A HA 0.004 4.267 4.320 -0.095 0.000 0.220 76 A C 1.849 179.445 177.584 0.021 0.000 1.162 76 A CA 1.277 53.330 52.037 0.027 0.000 0.674 76 A CB -0.613 18.402 19.000 0.025 0.000 0.789 76 A HN 0.714 8.864 8.150 -0.000 0.000 0.470 77 L N -1.026 120.209 121.223 0.021 0.000 2.145 77 L HA 0.072 4.355 4.340 -0.095 0.000 0.201 77 L C 2.129 179.010 176.870 0.017 0.000 1.075 77 L CA 2.126 56.976 54.840 0.018 0.000 0.773 77 L CB -0.531 41.538 42.059 0.017 0.000 0.936 77 L HN 0.349 8.579 8.230 -0.000 0.000 0.451 78 E N -0.061 120.151 120.200 0.020 0.000 2.028 78 E HA -0.133 4.160 4.350 -0.095 0.000 0.191 78 E C 2.145 178.756 176.600 0.017 0.000 0.988 78 E CA 1.797 58.208 56.400 0.018 0.000 0.799 78 E CB -0.302 29.411 29.700 0.022 0.000 0.755 78 E HN 0.337 8.697 8.360 -0.000 0.000 0.447 79 V N 1.982 121.907 119.914 0.019 0.000 2.317 79 V HA -0.281 3.782 4.120 -0.095 0.000 0.251 79 V C 2.678 178.780 176.094 0.014 0.000 1.065 79 V CA 2.322 64.631 62.300 0.016 0.000 1.049 79 V CB -0.627 31.206 31.823 0.017 0.000 0.651 79 V HN 0.261 8.451 8.190 -0.000 0.000 0.450 80 K N -0.467 119.942 120.400 0.014 0.000 2.283 80 K HA -0.184 4.078 4.320 -0.095 0.000 0.202 80 K C 2.172 178.779 176.600 0.012 0.000 1.048 80 K CA 0.890 57.185 56.287 0.013 0.000 0.948 80 K CB 0.046 32.553 32.500 0.013 0.000 0.742 80 K HN 0.291 8.541 8.250 -0.000 0.000 0.458 81 K N 1.095 121.502 120.400 0.012 0.000 2.007 81 K HA -0.084 4.179 4.320 -0.095 0.000 0.206 81 K C 1.880 178.486 176.600 0.010 0.000 1.047 81 K CA 1.342 57.635 56.287 0.010 0.000 0.937 81 K CB -0.272 32.234 32.500 0.010 0.000 0.718 81 K HN 0.285 8.535 8.250 -0.000 0.000 0.438 82 E N 0.527 120.734 120.200 0.010 0.000 2.070 82 E HA -0.187 4.105 4.350 -0.095 0.000 0.197 82 E C 2.061 178.667 176.600 0.011 0.000 1.004 82 E CA 0.829 57.235 56.400 0.010 0.000 0.805 82 E CB -0.030 29.676 29.700 0.011 0.000 0.744 82 E HN 0.068 8.428 8.360 -0.000 0.000 0.451 83 R N 0.157 120.664 120.500 0.011 0.000 2.139 83 R HA -0.116 4.167 4.340 -0.095 0.000 0.243 83 R C 2.052 178.359 176.300 0.012 0.000 1.145 83 R CA 1.342 57.449 56.100 0.012 0.000 0.976 83 R CB -0.290 30.018 30.300 0.012 0.000 0.866 83 R HN 0.352 8.622 8.270 -0.000 0.000 0.449 84 M N -0.555 119.051 119.600 0.011 0.000 2.486 84 M HA -0.014 4.409 4.480 -0.095 0.000 0.264 84 M C 1.417 177.722 176.300 0.008 0.000 1.125 84 M CA 0.343 55.649 55.300 0.010 0.000 1.144 84 M CB -0.111 32.494 32.600 0.009 0.000 1.353 84 M HN -0.023 8.267 8.290 -0.000 0.000 0.466 85 N N 0.909 119.613 118.700 0.007 0.000 2.000 85 N HA -0.068 4.615 4.740 -0.095 0.000 0.198 85 N C 0.549 176.062 175.510 0.005 0.000 1.057 85 N CA 1.230 54.283 53.050 0.005 0.000 0.858 85 N CB -0.236 38.253 38.487 0.004 0.000 1.057 85 N HN 0.123 8.503 8.380 -0.000 0.000 0.423 86 V N 0.759 120.677 119.914 0.008 0.000 2.715 86 V HA 0.340 4.403 4.120 -0.095 0.000 0.310 86 V C -0.267 175.836 176.094 0.014 0.000 1.054 86 V CA -0.768 61.538 62.300 0.010 0.000 0.928 86 V CB 2.247 34.075 31.823 0.009 0.000 1.007 86 V HN 0.129 8.319 8.190 -0.000 0.000 0.437 87 K N 3.343 123.753 120.400 0.017 0.000 2.592 87 K HA 0.434 4.696 4.320 -0.095 0.000 0.212 87 K C -0.632 175.982 176.600 0.024 0.000 1.013 87 K CA -0.643 55.656 56.287 0.019 0.000 1.034 87 K CB 1.499 34.011 32.500 0.019 0.000 1.292 87 K HN 0.549 8.799 8.250 -0.000 0.000 0.521 88 K N 1.649 122.065 120.400 0.026 0.000 2.187 88 K HA 0.262 4.524 4.320 -0.095 0.000 0.247 88 K C 0.338 176.956 176.600 0.031 0.000 1.019 88 K CA -0.121 56.185 56.287 0.032 0.000 0.893 88 K CB 0.623 33.145 32.500 0.035 0.000 1.025 88 K HN 0.368 8.618 8.250 -0.000 0.000 0.500 89 I N 0.815 121.406 120.570 0.036 0.000 2.336 89 I HA 0.045 4.158 4.170 -0.095 0.000 0.292 89 I C 0.500 176.633 176.117 0.027 0.000 0.991 89 I CA -0.459 60.860 61.300 0.033 0.000 1.227 89 I CB 1.636 39.658 38.000 0.037 0.000 1.366 89 I HN 0.473 8.683 8.210 -0.000 0.000 0.466 90 S N 3.180 118.893 115.700 0.021 0.000 2.564 90 S HA 0.081 4.494 4.470 -0.095 0.000 0.278 90 S C 1.322 175.924 174.600 0.003 0.000 1.333 90 S CA -0.222 57.986 58.200 0.012 0.000 1.048 90 S CB 0.760 63.968 63.200 0.013 0.000 0.900 90 S HN 0.810 9.120 8.310 -0.000 0.000 0.505 91 T N 1.627 116.174 114.554 -0.012 0.000 3.081 91 T HA 0.309 4.602 4.350 -0.095 0.000 0.255 91 T C 1.518 176.203 174.700 -0.025 0.000 1.113 91 T CA 0.785 62.862 62.100 -0.038 0.000 1.082 91 T CB -0.397 68.422 68.868 -0.083 0.000 0.939 91 T HN 1.546 9.786 8.240 -0.000 0.000 0.506 92 G N 0.735 109.530 108.800 -0.007 0.000 2.253 92 G HA2 -0.257 3.646 3.960 -0.095 0.000 0.251 92 G HA3 -0.257 3.646 3.960 -0.095 0.000 0.251 92 G C 0.278 175.186 174.900 0.013 0.000 0.998 92 G CA 0.254 45.358 45.100 0.006 0.000 0.621 92 G HN 1.050 9.340 8.290 -0.000 0.000 0.524 93 S N 0.399 116.099 115.700 0.001 0.000 2.448 93 S HA 0.574 4.986 4.470 -0.095 0.000 0.320 93 S C 1.221 175.820 174.600 -0.001 0.000 1.071 93 S CA -0.115 58.097 58.200 0.020 0.000 1.113 93 S CB 1.327 64.534 63.200 0.011 0.000 0.972 93 S HN 0.216 8.526 8.310 -0.000 0.000 0.465 94 Q N 3.589 123.398 119.800 0.014 0.000 2.167 94 Q HA -0.022 4.261 4.340 -0.095 0.000 0.202 94 Q C 2.284 178.286 176.000 0.003 0.000 0.970 94 Q CA 1.493 57.300 55.803 0.007 0.000 0.855 94 Q CB -0.596 28.149 28.738 0.012 0.000 0.911 94 Q HN 0.895 9.165 8.270 -0.000 0.000 0.438 95 A N 1.173 124.002 122.820 0.016 0.000 1.849 95 A HA -0.220 4.043 4.320 -0.095 0.000 0.217 95 A C 2.096 179.673 177.584 -0.012 0.000 1.202 95 A CA 1.744 53.792 52.037 0.019 0.000 0.629 95 A CB -0.936 18.101 19.000 0.062 0.000 0.834 95 A HN 0.374 8.524 8.150 -0.000 0.000 0.447 96 L N 0.353 121.546 121.223 -0.050 0.000 2.042 96 L HA -0.190 4.093 4.340 -0.095 0.000 0.210 96 L C 1.713 178.549 176.870 -0.057 0.000 1.076 96 L CA 2.613 57.389 54.840 -0.107 0.000 0.749 96 L CB -0.965 40.945 42.059 -0.248 0.000 0.893 96 L HN 0.436 8.666 8.230 -0.000 0.000 0.432 97 D N -0.310 120.068 120.400 -0.036 0.000 2.149 97 D HA -0.167 4.416 4.640 -0.095 0.000 0.198 97 D C 2.057 178.349 176.300 -0.014 0.000 0.990 97 D CA 1.476 55.467 54.000 -0.014 0.000 0.839 97 D CB -0.278 40.518 40.800 -0.005 0.000 0.948 97 D HN 0.568 8.938 8.370 -0.000 0.000 0.460 98 G N 1.390 110.180 108.800 -0.017 0.000 2.446 98 G HA2 -0.253 3.649 3.960 -0.095 0.000 0.217 98 G HA3 -0.253 3.649 3.960 -0.095 0.000 0.217 98 G C 1.671 176.555 174.900 -0.027 0.000 1.168 98 G CA 0.546 45.635 45.100 -0.018 0.000 0.771 98 G HN 0.202 8.492 8.290 -0.000 0.000 0.551 99 L N 0.504 121.706 121.223 -0.035 0.000 1.989 99 L HA 0.039 4.322 4.340 -0.095 0.000 0.211 99 L C 2.598 179.435 176.870 -0.056 0.000 1.071 99 L CA 1.474 56.284 54.840 -0.049 0.000 0.749 99 L CB -0.417 41.605 42.059 -0.063 0.000 0.890 99 L HN 0.206 8.436 8.230 -0.000 0.000 0.431 100 L N 0.045 121.242 121.223 -0.043 0.000 2.622 100 L HA 0.081 4.363 4.340 -0.095 0.000 0.233 100 L C 1.119 177.984 176.870 -0.010 0.000 1.156 100 L CA 0.424 55.245 54.840 -0.032 0.000 0.866 100 L CB -0.789 41.275 42.059 0.009 0.000 0.980 100 L HN 0.494 8.724 8.230 -0.000 0.000 0.448 101 A N 0.125 122.938 122.820 -0.013 0.000 2.876 101 A HA -0.020 4.243 4.320 -0.095 0.000 0.287 101 A C 1.153 178.746 177.584 0.016 0.000 1.455 101 A CA 0.690 52.728 52.037 0.001 0.000 0.744 101 A CB -1.811 17.197 19.000 0.014 0.000 1.041 101 A HN 0.842 8.992 8.150 -0.000 0.000 0.500 102 G N -2.911 105.895 108.800 0.011 0.000 2.380 102 G HA2 0.539 4.442 3.960 -0.095 0.000 0.197 102 G HA3 0.539 4.442 3.960 -0.095 0.000 0.197 102 G C 0.750 175.662 174.900 0.020 0.000 1.001 102 G CA 0.963 46.073 45.100 0.016 0.000 0.668 102 G HN 3.107 11.397 8.290 -0.000 0.000 0.483 103 G N -0.633 108.182 108.800 0.025 0.000 2.306 103 G HA2 0.345 4.248 3.960 -0.095 0.000 0.262 103 G HA3 0.345 4.248 3.960 -0.095 0.000 0.262 103 G C -0.963 173.971 174.900 0.056 0.000 1.263 103 G CA -0.137 44.983 45.100 0.033 0.000 1.088 103 G HN 1.074 9.364 8.290 -0.000 0.000 0.489 104 I N 2.037 122.647 120.570 0.065 0.000 2.379 104 I HA 0.351 4.464 4.170 -0.095 0.000 0.290 104 I C 0.827 176.985 176.117 0.068 0.000 1.063 104 I CA 0.033 61.385 61.300 0.086 0.000 1.351 104 I CB 1.214 39.270 38.000 0.093 0.000 1.410 104 I HN 0.572 8.782 8.210 -0.000 0.000 0.505 105 E N 4.516 124.760 120.200 0.074 0.000 2.349 105 E HA 0.314 4.607 4.350 -0.095 0.000 0.265 105 E C -0.189 176.440 176.600 0.049 0.000 1.064 105 E CA -0.554 55.879 56.400 0.056 0.000 0.886 105 E CB 0.878 30.611 29.700 0.055 0.000 1.036 105 E HN 0.688 9.048 8.360 -0.000 0.000 0.413 106 T N 0.937 115.511 114.554 0.034 0.000 2.788 106 T HA 0.249 4.542 4.350 -0.095 0.000 0.280 106 T C 0.697 175.409 174.700 0.020 0.000 0.984 106 T CA -0.508 61.610 62.100 0.030 0.000 0.972 106 T CB 0.959 69.843 68.868 0.026 0.000 1.039 106 T HN 0.835 9.075 8.240 -0.000 0.000 0.530 107 R N -1.091 119.423 120.500 0.023 0.000 3.977 107 R HA -0.172 4.111 4.340 -0.095 0.000 0.428 107 R C 0.063 176.369 176.300 0.010 0.000 1.079 107 R CA 1.396 57.505 56.100 0.014 0.000 1.269 107 R CB -2.214 28.085 30.300 -0.003 0.000 1.856 107 R HN 1.109 9.379 8.270 -0.000 0.000 0.551 108 T N -3.083 111.483 114.554 0.021 0.000 2.907 108 T HA 0.636 4.929 4.350 -0.095 0.000 0.290 108 T C -0.124 174.602 174.700 0.044 0.000 1.066 108 T CA -0.940 61.177 62.100 0.027 0.000 1.012 108 T CB 2.110 71.000 68.868 0.035 0.000 1.184 108 T HN 0.188 8.428 8.240 -0.000 0.000 0.522 109 M N 2.445 122.075 119.600 0.049 0.000 2.036 109 M HA 0.406 4.829 4.480 -0.095 0.000 0.337 109 M C -1.160 175.190 176.300 0.083 0.000 1.012 109 M CA -0.288 55.046 55.300 0.057 0.000 0.962 109 M CB 0.790 33.409 32.600 0.032 0.000 1.423 109 M HN 0.767 9.057 8.290 -0.000 0.000 0.405 110 T N 3.766 118.389 114.554 0.115 0.000 2.733 110 T HA 0.249 4.541 4.350 -0.095 0.000 0.294 110 T C -0.440 174.370 174.700 0.185 0.000 0.956 110 T CA -0.468 61.706 62.100 0.124 0.000 0.987 110 T CB 0.751 69.730 68.868 0.185 0.000 0.920 110 T HN 0.672 8.912 8.240 -0.000 0.000 0.470 111 E N 2.901 123.158 120.200 0.094 0.000 2.277 111 E HA 0.487 4.779 4.350 -0.095 0.000 0.274 111 E C -1.284 175.360 176.600 0.074 0.000 1.022 111 E CA -0.606 55.908 56.400 0.189 0.000 0.853 111 E CB 0.676 30.494 29.700 0.197 0.000 1.086 111 E HN 0.397 8.757 8.360 -0.000 0.000 0.397 112 F N 3.820 123.860 119.950 0.149 0.000 2.556 112 F HA 0.504 4.986 4.527 -0.075 0.000 0.314 112 F C -0.673 175.225 175.800 0.163 0.000 1.106 112 F CA -0.702 57.339 58.000 0.069 0.000 0.911 112 F CB 1.463 40.468 39.000 0.008 0.000 1.190 112 F HN 0.415 8.715 8.300 -0.000 0.000 0.448 113 F N 0.065 120.124 119.950 0.182 0.000 2.678 113 F HA 0.969 5.442 4.527 -0.090 0.000 0.308 113 F C -0.557 175.302 175.800 0.100 0.000 1.118 113 F CA -1.175 56.897 58.000 0.121 0.000 0.959 113 F CB 1.583 40.617 39.000 0.057 0.000 1.305 113 F HN 0.759 9.059 8.300 -0.000 0.000 0.443 114 G N 0.990 109.894 108.800 0.174 0.000 2.341 114 G HA2 0.415 4.318 3.960 -0.095 0.000 0.299 114 G HA3 0.415 4.318 3.960 -0.095 0.000 0.299 114 G C -1.946 173.038 174.900 0.139 0.000 1.274 114 G CA -0.980 44.168 45.100 0.080 0.000 0.853 114 G HN 0.823 9.113 8.290 -0.000 0.000 0.493 115 E N -0.611 119.643 120.200 0.090 0.000 2.369 115 E HA 0.412 4.705 4.350 -0.095 0.000 0.255 115 E C -0.445 176.240 176.600 0.141 0.000 1.172 115 E CA -0.612 55.853 56.400 0.108 0.000 0.932 115 E CB 1.246 30.988 29.700 0.069 0.000 1.040 115 E HN 0.338 8.698 8.360 -0.000 0.000 0.454 116 F N 0.640 120.610 119.950 0.033 0.000 2.595 116 F HA 0.155 4.639 4.527 -0.072 0.000 0.359 116 F C 1.466 177.277 175.800 0.018 0.000 1.147 116 F CA 1.430 59.449 58.000 0.032 0.000 1.341 116 F CB 0.118 39.133 39.000 0.025 0.000 1.104 116 F HN 0.651 8.951 8.300 -0.000 0.000 0.603 117 G N 2.557 110.795 108.800 -0.937 0.000 2.228 117 G HA2 -0.403 3.500 3.960 -0.095 0.000 0.270 117 G HA3 -0.403 3.500 3.960 -0.095 0.000 0.270 117 G C 1.240 175.968 174.900 -0.287 0.000 0.976 117 G CA 1.240 45.918 45.100 -0.704 0.000 0.636 117 G HN 1.349 9.639 8.290 -0.000 0.000 0.542 118 S N -0.855 114.757 115.700 -0.147 0.000 2.400 118 S HA 0.278 4.690 4.470 -0.095 0.000 0.232 118 S C 2.387 176.983 174.600 -0.006 0.000 1.025 118 S CA 1.976 60.142 58.200 -0.057 0.000 0.993 118 S CB -0.153 63.047 63.200 0.000 0.000 0.808 118 S HN 2.403 10.713 8.310 -0.000 0.000 0.478 119 G N 1.741 110.535 108.800 -0.009 0.000 2.480 119 G HA2 -0.243 3.660 3.960 -0.095 0.000 0.193 119 G HA3 -0.243 3.660 3.960 -0.095 0.000 0.193 119 G C 0.847 175.770 174.900 0.039 0.000 1.004 119 G CA 0.198 45.326 45.100 0.047 0.000 0.696 119 G HN 0.596 8.886 8.290 -0.000 0.000 0.478 120 K N 0.224 120.660 120.400 0.060 0.000 2.107 120 K HA -0.151 4.112 4.320 -0.095 0.000 0.211 120 K C 2.036 178.655 176.600 0.032 0.000 1.049 120 K CA 2.311 58.630 56.287 0.054 0.000 0.927 120 K CB -0.760 31.826 32.500 0.143 0.000 0.714 120 K HN 0.325 8.575 8.250 -0.000 0.000 0.452 121 T N 0.896 115.506 114.554 0.094 0.000 2.852 121 T HA -0.059 4.234 4.350 -0.095 0.000 0.256 121 T C 1.923 176.783 174.700 0.267 0.000 1.038 121 T CA 0.813 63.027 62.100 0.190 0.000 1.141 121 T CB -0.114 68.898 68.868 0.242 0.000 0.869 121 T HN 0.276 8.516 8.240 -0.000 0.000 0.439 122 Q N 0.372 120.219 119.800 0.079 0.000 2.096 122 Q HA -0.155 4.127 4.340 -0.095 0.000 0.208 122 Q C 2.302 178.352 176.000 0.083 0.000 0.993 122 Q CA 1.337 57.117 55.803 -0.038 0.000 0.862 122 Q CB -0.424 28.262 28.738 -0.086 0.000 0.915 122 Q HN 0.295 8.565 8.270 -0.000 0.000 0.416 123 L N 0.004 121.241 121.223 0.024 0.000 2.131 123 L HA -0.182 4.100 4.340 -0.095 0.000 0.210 123 L C 2.147 179.004 176.870 -0.022 0.000 1.092 123 L CA 1.489 56.287 54.840 -0.070 0.000 0.759 123 L CB -0.416 41.474 42.059 -0.282 0.000 0.903 123 L HN 0.290 8.520 8.230 -0.000 0.000 0.435 124 C N -0.949 118.396 119.300 0.075 0.000 2.432 124 C HA -0.105 4.298 4.460 -0.095 0.000 0.282 124 C C 2.403 177.541 174.990 0.246 0.000 1.388 124 C CA 0.615 59.688 59.018 0.090 0.000 1.777 124 C CB -1.430 26.321 27.740 0.018 0.000 1.882 124 C HN 0.642 8.872 8.230 -0.000 0.000 0.520 125 H N -0.610 118.553 119.070 0.156 0.000 2.320 125 H HA -0.052 4.482 4.556 -0.036 0.000 0.309 125 H C 2.198 177.546 175.328 0.034 0.000 1.057 125 H CA 1.405 57.494 56.048 0.068 0.000 1.374 125 H CB -0.612 29.095 29.762 -0.091 0.000 1.421 125 H HN 0.195 8.475 8.280 -0.000 0.000 0.532 126 Q N 1.014 120.904 119.800 0.151 0.000 2.173 126 Q HA -0.136 4.147 4.340 -0.095 0.000 0.208 126 Q C 2.013 178.045 176.000 0.052 0.000 0.989 126 Q CA 1.472 57.312 55.803 0.063 0.000 0.872 126 Q CB -0.545 28.202 28.738 0.016 0.000 0.909 126 Q HN 0.513 8.783 8.270 -0.000 0.000 0.420 127 L N -0.361 120.888 121.223 0.045 0.000 2.179 127 L HA -0.068 4.215 4.340 -0.095 0.000 0.208 127 L C 2.245 179.161 176.870 0.076 0.000 1.096 127 L CA 1.152 56.011 54.840 0.033 0.000 0.779 127 L CB -0.389 41.664 42.059 -0.011 0.000 0.922 127 L HN 0.337 8.567 8.230 -0.000 0.000 0.443 128 S N -1.699 114.076 115.700 0.125 0.000 2.522 128 S HA -0.045 4.368 4.470 -0.095 0.000 0.227 128 S C 1.613 176.296 174.600 0.138 0.000 0.986 128 S CA 0.397 58.694 58.200 0.160 0.000 0.929 128 S CB 0.040 63.396 63.200 0.259 0.000 0.769 128 S HN 0.160 8.470 8.310 -0.000 0.000 0.529 129 V N 2.345 122.326 119.914 0.111 0.000 2.992 129 V HA 0.105 4.168 4.120 -0.095 0.000 0.250 129 V C 1.481 177.618 176.094 0.072 0.000 1.090 129 V CA 0.952 63.307 62.300 0.092 0.000 1.101 129 V CB -0.398 31.471 31.823 0.077 0.000 0.743 129 V HN 0.526 8.716 8.190 -0.000 0.000 0.468 130 N N -0.100 118.638 118.700 0.062 0.000 2.353 130 N HA 0.017 4.699 4.740 -0.095 0.000 0.185 130 N C 1.568 177.109 175.510 0.051 0.000 1.098 130 N CA 0.586 53.665 53.050 0.049 0.000 0.872 130 N CB 0.634 39.142 38.487 0.035 0.000 0.970 130 N HN 0.360 8.740 8.380 -0.000 0.000 0.467 131 V N 1.602 121.554 119.914 0.063 0.000 2.323 131 V HA -0.176 3.887 4.120 -0.095 0.000 0.244 131 V C 1.423 177.553 176.094 0.060 0.000 1.041 131 V CA 1.160 63.496 62.300 0.061 0.000 1.025 131 V CB -0.807 31.058 31.823 0.071 0.000 0.656 131 V HN 0.416 8.606 8.190 -0.000 0.000 0.451 132 Q N 1.219 121.061 119.800 0.070 0.000 2.780 132 Q HA 0.384 4.666 4.340 -0.095 0.000 0.234 132 Q C -0.829 175.203 176.000 0.054 0.000 1.355 132 Q CA 0.211 56.055 55.803 0.067 0.000 0.919 132 Q CB -0.006 28.779 28.738 0.079 0.000 1.645 132 Q HN 0.445 8.715 8.270 -0.000 0.000 0.568 133 L N 2.524 123.774 121.223 0.046 0.000 2.556 133 L HA 0.494 4.777 4.340 -0.095 0.000 0.257 133 L C -2.840 174.050 176.870 0.033 0.000 0.955 133 L CA -1.968 52.895 54.840 0.038 0.000 0.850 133 L CB 2.639 44.720 42.059 0.036 0.000 1.398 133 L HN 0.245 8.475 8.230 -0.000 0.000 0.412 134 P HA 0.213 4.633 4.420 -0.000 0.000 0.267 134 P C -2.209 175.105 177.300 0.023 0.000 1.209 134 P CA -0.926 62.188 63.100 0.025 0.000 0.763 134 P CB 0.334 32.047 31.700 0.022 0.000 0.816 135 P HA -0.222 4.198 4.420 -0.000 0.000 0.221 135 P C 0.725 178.036 177.300 0.019 0.000 1.141 135 P CA 1.441 64.553 63.100 0.021 0.000 0.794 135 P CB -0.039 31.673 31.700 0.020 0.000 0.764 136 E N -0.783 119.427 120.200 0.018 0.000 2.216 136 E HA -0.066 4.227 4.350 -0.095 0.000 0.192 136 E C 1.320 177.930 176.600 0.017 0.000 0.988 136 E CA 0.914 57.323 56.400 0.016 0.000 0.834 136 E CB -0.356 29.353 29.700 0.015 0.000 0.772 136 E HN 0.284 8.644 8.360 -0.000 0.000 0.479 137 K N -0.606 119.805 120.400 0.018 0.000 2.372 137 K HA 0.238 4.500 4.320 -0.095 0.000 0.200 137 K C 0.404 177.016 176.600 0.020 0.000 1.022 137 K CA 0.431 56.730 56.287 0.019 0.000 1.125 137 K CB 0.968 33.480 32.500 0.020 0.000 0.855 137 K HN 0.211 8.461 8.250 -0.000 0.000 0.524 138 G N 0.776 109.588 108.800 0.020 0.000 2.131 138 G HA2 -0.197 3.706 3.960 -0.095 0.000 0.223 138 G HA3 -0.197 3.706 3.960 -0.095 0.000 0.223 138 G C 0.254 175.169 174.900 0.025 0.000 0.990 138 G CA -0.204 44.908 45.100 0.021 0.000 0.671 138 G HN 0.504 8.794 8.290 -0.000 0.000 0.521 139 G N -1.375 107.441 108.800 0.027 0.000 3.212 139 G HA2 0.752 4.655 3.960 -0.095 0.000 0.188 139 G HA3 0.752 4.655 3.960 -0.095 0.000 0.188 139 G C 0.442 175.361 174.900 0.032 0.000 1.254 139 G CA -0.251 44.868 45.100 0.032 0.000 0.957 139 G HN 0.745 9.035 8.290 -0.000 0.000 0.596 140 L N -0.686 120.559 121.223 0.036 0.000 3.635 140 L HA 0.253 4.536 4.340 -0.095 0.000 0.338 140 L C 0.973 177.865 176.870 0.037 0.000 1.275 140 L CA -0.107 54.754 54.840 0.034 0.000 1.092 140 L CB 0.858 42.938 42.059 0.035 0.000 1.465 140 L HN 0.483 8.713 8.230 -0.000 0.000 0.625 141 S N 0.950 116.674 115.700 0.040 0.000 3.533 141 S HA -0.171 4.242 4.470 -0.095 0.000 0.347 141 S C 0.751 175.381 174.600 0.051 0.000 1.101 141 S CA 0.826 59.051 58.200 0.043 0.000 1.009 141 S CB -1.126 62.096 63.200 0.036 0.000 0.916 141 S HN 0.727 9.037 8.310 -0.000 0.000 0.496 142 G N -0.094 108.740 108.800 0.056 0.000 2.509 142 G HA2 0.631 4.533 3.960 -0.095 0.000 0.328 142 G HA3 0.631 4.533 3.960 -0.095 0.000 0.328 142 G C -0.516 174.435 174.900 0.085 0.000 1.194 142 G CA -0.837 44.302 45.100 0.064 0.000 0.967 142 G HN 0.262 8.552 8.290 -0.000 0.000 0.488 143 K N -0.605 119.858 120.400 0.106 0.000 2.123 143 K HA 0.670 4.933 4.320 -0.095 0.000 0.248 143 K C -0.124 176.564 176.600 0.147 0.000 0.969 143 K CA -0.444 55.938 56.287 0.158 0.000 0.882 143 K CB 2.029 34.679 32.500 0.251 0.000 1.080 143 K HN 0.572 8.822 8.250 -0.000 0.000 0.441 144 A N 0.971 123.911 122.820 0.201 0.000 2.350 144 A HA 0.626 4.888 4.320 -0.095 0.000 0.318 144 A C -1.088 176.629 177.584 0.221 0.000 1.132 144 A CA -0.672 51.471 52.037 0.176 0.000 0.811 144 A CB 1.366 20.479 19.000 0.189 0.000 1.313 144 A HN 0.376 8.526 8.150 -0.000 0.000 0.454 145 V N 1.431 121.428 119.914 0.137 0.000 2.357 145 V HA 0.216 4.278 4.120 -0.095 0.000 0.281 145 V C -1.397 174.775 176.094 0.131 0.000 1.015 145 V CA -0.153 62.221 62.300 0.123 0.000 0.827 145 V CB 0.629 32.435 31.823 -0.027 0.000 1.018 145 V HN 0.762 8.952 8.190 -0.000 0.000 0.432 146 Y N 5.556 125.887 120.300 0.052 0.000 2.454 146 Y HA 0.496 4.982 4.550 -0.106 0.000 0.345 146 Y C 0.598 176.408 175.900 -0.149 0.000 0.970 146 Y CA -0.646 57.460 58.100 0.010 0.000 1.204 146 Y CB 0.934 39.483 38.460 0.149 0.000 1.122 146 Y HN 0.528 8.808 8.280 -0.000 0.000 0.514 147 I N 5.436 125.929 120.570 -0.128 0.000 2.224 147 I HA 0.037 4.150 4.170 -0.095 0.000 0.293 147 I C 0.110 176.165 176.117 -0.103 0.000 1.155 147 I CA -0.241 60.988 61.300 -0.119 0.000 1.297 147 I CB -0.201 37.759 38.000 -0.067 0.000 1.487 147 I HN 0.570 8.780 8.210 -0.000 0.000 0.564 148 D N 4.202 124.573 120.400 -0.049 0.000 2.426 148 D HA -0.025 4.558 4.640 -0.095 0.000 0.261 148 D C 1.065 177.417 176.300 0.086 0.000 1.245 148 D CA 0.572 54.662 54.000 0.150 0.000 0.917 148 D CB 1.143 42.075 40.800 0.221 0.000 1.123 148 D HN 0.396 8.766 8.370 -0.000 0.000 0.508 149 T N 3.363 117.956 114.554 0.066 0.000 2.852 149 T HA -0.040 4.253 4.350 -0.095 0.000 0.256 149 T C 1.248 175.995 174.700 0.080 0.000 1.038 149 T CA 0.736 62.840 62.100 0.007 0.000 1.141 149 T CB 0.238 69.025 68.868 -0.134 0.000 0.869 149 T HN 0.455 8.695 8.240 -0.000 0.000 0.439 150 E N -0.047 120.214 120.200 0.101 0.000 2.481 150 E HA 0.326 4.619 4.350 -0.095 0.000 0.198 150 E C 0.566 177.256 176.600 0.150 0.000 1.027 150 E CA -0.112 56.368 56.400 0.133 0.000 0.900 150 E CB 0.727 30.480 29.700 0.088 0.000 0.993 150 E HN 0.445 8.805 8.360 -0.000 0.000 0.482 151 G N 2.411 111.330 108.800 0.198 0.000 2.470 151 G HA2 -0.238 3.665 3.960 -0.095 0.000 0.286 151 G HA3 -0.238 3.665 3.960 -0.095 0.000 0.286 151 G C 0.456 175.475 174.900 0.199 0.000 1.115 151 G CA 0.548 45.776 45.100 0.214 0.000 1.122 151 G HN 0.296 8.586 8.290 -0.000 0.000 0.522 152 T N -2.394 112.324 114.554 0.272 0.000 3.209 152 T HA 0.427 4.719 4.350 -0.095 0.000 0.295 152 T C 0.527 175.402 174.700 0.291 0.000 0.977 152 T CA -0.012 62.233 62.100 0.242 0.000 0.922 152 T CB 0.115 69.135 68.868 0.254 0.000 1.152 152 T HN 1.042 9.282 8.240 -0.000 0.000 0.527 153 F N 3.731 123.788 119.950 0.177 0.000 2.484 153 F HA 0.595 5.087 4.527 -0.059 0.000 0.360 153 F C -0.154 175.550 175.800 -0.160 0.000 1.101 153 F CA -0.520 57.495 58.000 0.026 0.000 1.251 153 F CB 0.544 39.549 39.000 0.007 0.000 1.132 153 F HN -0.134 8.166 8.300 -0.000 0.000 0.570 154 R N 7.120 127.171 120.500 -0.748 0.000 2.575 154 R HA 0.131 4.414 4.340 -0.095 0.000 0.293 154 R C 0.082 175.844 176.300 -0.897 0.000 0.983 154 R CA -0.658 54.975 56.100 -0.779 0.000 0.887 154 R CB 0.841 30.836 30.300 -0.508 0.000 1.184 154 R HN 0.898 9.168 8.270 -0.000 0.000 0.445 155 W N 0.787 122.056 121.300 -0.052 0.000 2.704 155 W HA 0.164 4.774 4.660 -0.084 0.000 0.266 155 W C 0.359 176.854 176.519 -0.040 0.000 1.266 155 W CA -0.115 57.245 57.345 0.025 0.000 1.377 155 W CB -0.062 29.503 29.460 0.175 0.000 1.082 155 W HN 0.544 8.724 8.180 -0.000 0.000 0.608 156 E N 1.019 121.166 120.200 -0.088 0.000 2.526 156 E HA -0.127 4.166 4.350 -0.095 0.000 0.206 156 E C 1.805 178.345 176.600 -0.101 0.000 1.139 156 E CA 0.595 56.977 56.400 -0.029 0.000 0.913 156 E CB -0.042 29.522 29.700 -0.226 0.000 0.868 156 E HN 0.323 8.683 8.360 -0.000 0.000 0.564 157 R N -0.470 119.951 120.500 -0.132 0.000 4.126 157 R HA 0.049 4.331 4.340 -0.095 0.000 0.128 157 R C 1.731 177.974 176.300 -0.094 0.000 0.687 157 R CA -0.214 55.786 56.100 -0.167 0.000 1.049 157 R CB 0.097 30.196 30.300 -0.334 0.000 1.559 157 R HN 0.017 8.287 8.270 -0.000 0.000 0.455 158 I N 2.814 123.323 120.570 -0.103 0.000 2.285 158 I HA -0.310 3.803 4.170 -0.095 0.000 0.253 158 I C 1.632 177.784 176.117 0.059 0.000 1.104 158 I CA 1.756 63.055 61.300 -0.002 0.000 1.372 158 I CB -0.882 37.151 38.000 0.054 0.000 1.057 158 I HN 0.395 8.605 8.210 -0.000 0.000 0.431 159 E N 0.958 121.206 120.200 0.080 0.000 2.004 159 E HA -0.173 4.119 4.350 -0.095 0.000 0.192 159 E C 1.610 178.235 176.600 0.042 0.000 0.987 159 E CA 1.240 57.690 56.400 0.084 0.000 0.822 159 E CB -0.352 29.420 29.700 0.120 0.000 0.779 159 E HN 0.566 8.926 8.360 -0.000 0.000 0.458 160 N N 0.995 119.708 118.700 0.022 0.000 2.609 160 N HA -0.165 4.517 4.740 -0.095 0.000 0.190 160 N C 1.419 176.926 175.510 -0.006 0.000 1.157 160 N CA 0.672 53.725 53.050 0.005 0.000 0.918 160 N CB -0.007 38.476 38.487 -0.007 0.000 0.978 160 N HN 0.234 8.614 8.380 -0.000 0.000 0.448 161 M N -0.355 119.242 119.600 -0.005 0.000 2.447 161 M HA 0.195 4.618 4.480 -0.095 0.000 0.266 161 M C 1.787 178.095 176.300 0.013 0.000 1.120 161 M CA 0.643 55.939 55.300 -0.007 0.000 1.166 161 M CB 0.192 32.783 32.600 -0.016 0.000 1.349 161 M HN 0.198 8.488 8.290 -0.000 0.000 0.463 162 A N -0.260 122.576 122.820 0.026 0.000 2.081 162 A HA -0.032 4.231 4.320 -0.095 0.000 0.214 162 A C 1.899 179.498 177.584 0.026 0.000 1.158 162 A CA 0.718 52.775 52.037 0.033 0.000 0.724 162 A CB -0.438 18.590 19.000 0.047 0.000 0.826 162 A HN 0.489 8.639 8.150 -0.000 0.000 0.463 163 K N -0.087 120.326 120.400 0.022 0.000 2.616 163 K HA 0.075 4.338 4.320 -0.095 0.000 0.192 163 K C 1.270 177.877 176.600 0.012 0.000 1.031 163 K CA 0.721 57.018 56.287 0.018 0.000 1.004 163 K CB -0.179 32.331 32.500 0.017 0.000 0.810 163 K HN 0.430 8.680 8.250 -0.000 0.000 0.497 164 A N -0.195 122.632 122.820 0.012 0.000 2.026 164 A HA 0.170 4.433 4.320 -0.095 0.000 0.198 164 A C 1.615 179.205 177.584 0.012 0.000 1.390 164 A CA -0.217 51.825 52.037 0.009 0.000 0.915 164 A CB 0.058 19.061 19.000 0.005 0.000 0.974 164 A HN 0.229 8.379 8.150 -0.000 0.000 0.477 165 L N -0.782 120.450 121.223 0.015 0.000 2.291 165 L HA 0.138 4.421 4.340 -0.095 0.000 0.214 165 L C 1.729 178.609 176.870 0.017 0.000 1.120 165 L CA 1.026 55.876 54.840 0.017 0.000 0.799 165 L CB -0.225 41.846 42.059 0.021 0.000 0.925 165 L HN 0.622 8.852 8.230 -0.000 0.000 0.446 166 G N -0.636 108.174 108.800 0.017 0.000 2.168 166 G HA2 -0.181 3.721 3.960 -0.095 0.000 0.197 166 G HA3 -0.181 3.721 3.960 -0.095 0.000 0.197 166 G C 0.259 175.169 174.900 0.018 0.000 0.997 166 G CA -0.414 44.695 45.100 0.016 0.000 0.658 166 G HN 0.088 8.378 8.290 -0.000 0.000 0.513 167 L N 0.111 121.347 121.223 0.022 0.000 2.543 167 L HA 0.480 4.763 4.340 -0.095 0.000 0.231 167 L C 0.534 177.418 176.870 0.023 0.000 1.194 167 L CA -0.262 54.592 54.840 0.024 0.000 0.823 167 L CB 0.349 42.426 42.059 0.030 0.000 1.374 167 L HN 0.188 8.418 8.230 -0.000 0.000 0.507 168 D N 0.331 120.745 120.400 0.023 0.000 2.411 168 D HA 0.157 4.740 4.640 -0.095 0.000 0.225 168 D C 1.362 177.676 176.300 0.023 0.000 1.156 168 D CA -0.393 53.618 54.000 0.019 0.000 0.874 168 D CB 0.474 41.282 40.800 0.014 0.000 1.034 168 D HN 0.248 8.618 8.370 -0.000 0.000 0.502 169 I N 2.943 123.528 120.570 0.025 0.000 2.720 169 I HA -0.416 3.696 4.170 -0.095 0.000 0.208 169 I C 1.530 177.664 176.117 0.028 0.000 0.908 169 I CA 1.641 62.960 61.300 0.032 0.000 1.222 169 I CB -1.038 36.978 38.000 0.028 0.000 0.933 169 I HN 0.549 8.759 8.210 -0.000 0.000 0.360 170 D N 0.204 120.609 120.400 0.009 0.000 2.203 170 D HA -0.242 4.341 4.640 -0.095 0.000 0.199 170 D C 1.849 178.146 176.300 -0.005 0.000 0.997 170 D CA 1.740 55.734 54.000 -0.010 0.000 0.863 170 D CB -0.728 40.057 40.800 -0.024 0.000 0.928 170 D HN 0.646 9.016 8.370 -0.000 0.000 0.458 171 N N 0.549 119.253 118.700 0.006 0.000 2.250 171 N HA -0.112 4.570 4.740 -0.095 0.000 0.181 171 N C 1.921 177.445 175.510 0.023 0.000 1.017 171 N CA 0.483 53.539 53.050 0.009 0.000 0.866 171 N CB 0.301 38.796 38.487 0.013 0.000 0.985 171 N HN -0.077 8.303 8.380 -0.000 0.000 0.429 172 V N 2.345 122.282 119.914 0.038 0.000 2.214 172 V HA -0.325 3.738 4.120 -0.095 0.000 0.244 172 V C 2.528 178.667 176.094 0.076 0.000 1.045 172 V CA 2.055 64.391 62.300 0.060 0.000 0.993 172 V CB -0.761 31.103 31.823 0.069 0.000 0.633 172 V HN 0.367 8.557 8.190 -0.000 0.000 0.449 173 M N 0.897 120.549 119.600 0.087 0.000 2.103 173 M HA -0.285 4.138 4.480 -0.095 0.000 0.255 173 M C 2.192 178.520 176.300 0.046 0.000 1.074 173 M CA 2.638 58.003 55.300 0.109 0.000 1.090 173 M CB -1.250 31.413 32.600 0.104 0.000 1.325 173 M HN 0.606 8.896 8.290 -0.000 0.000 0.403 174 N N 1.225 119.925 118.700 0.000 0.000 2.184 174 N HA -0.210 4.473 4.740 -0.095 0.000 0.190 174 N C 1.139 176.619 175.510 -0.050 0.000 1.011 174 N CA 1.692 54.713 53.050 -0.047 0.000 0.867 174 N CB -0.355 38.107 38.487 -0.042 0.000 0.993 174 N HN 0.336 8.716 8.380 -0.000 0.000 0.433 175 N N -0.417 118.295 118.700 0.019 0.000 2.521 175 N HA 0.049 4.732 4.740 -0.095 0.000 0.188 175 N C -0.467 175.125 175.510 0.136 0.000 1.146 175 N CA 0.382 53.471 53.050 0.065 0.000 0.893 175 N CB 0.372 38.910 38.487 0.085 0.000 0.975 175 N HN 0.410 8.790 8.380 -0.000 0.000 0.451 176 I N 1.177 121.820 120.570 0.122 0.000 2.355 176 I HA 0.156 4.269 4.170 -0.095 0.000 0.288 176 I C -0.646 175.581 176.117 0.184 0.000 0.999 176 I CA -0.788 60.643 61.300 0.218 0.000 1.163 176 I CB 0.757 38.909 38.000 0.253 0.000 1.316 176 I HN -0.149 8.061 8.210 -0.000 0.000 0.454 177 Y N 6.136 126.501 120.300 0.109 0.000 2.402 177 Y HA 0.193 4.684 4.550 -0.098 0.000 0.333 177 Y C -0.277 175.694 175.900 0.118 0.000 1.076 177 Y CA 0.181 58.334 58.100 0.088 0.000 1.299 177 Y CB 0.298 38.792 38.460 0.056 0.000 1.197 177 Y HN 0.408 8.688 8.280 -0.000 0.000 0.517 178 Y N 4.658 124.993 120.300 0.059 0.000 2.446 178 Y HA 0.729 5.219 4.550 -0.101 0.000 0.345 178 Y C -1.238 174.667 175.900 0.008 0.000 0.984 178 Y CA -1.550 56.529 58.100 -0.034 0.000 1.058 178 Y CB 1.335 39.611 38.460 -0.307 0.000 1.220 178 Y HN 0.603 8.883 8.280 -0.000 0.000 0.455 179 I N 5.263 125.321 120.570 -0.854 0.000 2.787 179 I HA 0.402 4.515 4.170 -0.095 0.000 0.294 179 I C -1.920 173.888 176.117 -0.514 0.000 1.365 179 I CA -0.861 60.187 61.300 -0.420 0.000 1.029 179 I CB 1.526 39.461 38.000 -0.107 0.000 1.313 179 I HN 0.710 8.920 8.210 -0.000 0.000 0.431 180 R N 6.116 126.535 120.500 -0.136 0.000 2.207 180 R HA 0.739 5.022 4.340 -0.095 0.000 0.334 180 R C -1.122 175.204 176.300 0.045 0.000 1.013 180 R CA -0.185 55.912 56.100 -0.005 0.000 0.858 180 R CB 1.392 31.785 30.300 0.155 0.000 1.094 180 R HN 0.590 8.860 8.270 -0.000 0.000 0.457 181 A N 5.690 128.551 122.820 0.068 0.000 2.316 181 A HA 0.319 4.582 4.320 -0.095 0.000 0.311 181 A C 0.768 178.473 177.584 0.201 0.000 1.339 181 A CA -0.636 51.478 52.037 0.128 0.000 0.960 181 A CB -0.404 18.668 19.000 0.120 0.000 1.152 181 A HN 0.950 9.100 8.150 -0.000 0.000 0.547 182 I N 0.306 120.882 120.570 0.011 0.000 3.728 182 I HA 0.246 4.359 4.170 -0.095 0.000 0.307 182 I C 0.102 175.903 176.117 -0.527 0.000 1.276 182 I CA -0.026 61.168 61.300 -0.176 0.000 1.285 182 I CB -0.482 37.362 38.000 -0.261 0.000 1.038 182 I HN 0.544 8.754 8.210 -0.000 0.000 0.445 183 N N -1.585 116.920 118.700 -0.325 0.000 2.859 183 N HA 0.169 4.852 4.740 -0.095 0.000 0.250 183 N C 0.558 176.017 175.510 -0.085 0.000 1.341 183 N CA -0.125 52.701 53.050 -0.374 0.000 0.881 183 N CB 0.370 38.699 38.487 -0.264 0.000 1.516 183 N HN 0.032 8.412 8.380 -0.000 0.000 0.503 184 T N -2.116 112.340 114.554 -0.162 0.000 2.564 184 T HA -0.324 3.969 4.350 -0.095 0.000 0.264 184 T C 0.866 175.460 174.700 -0.178 0.000 1.100 184 T CA 2.140 64.044 62.100 -0.328 0.000 1.171 184 T CB -0.942 67.696 68.868 -0.384 0.000 0.863 184 T HN 0.545 8.785 8.240 -0.000 0.000 0.430 185 D N 0.831 121.184 120.400 -0.078 0.000 2.177 185 D HA -0.177 4.406 4.640 -0.095 0.000 0.189 185 D C 2.126 178.417 176.300 -0.015 0.000 1.002 185 D CA 1.875 55.857 54.000 -0.030 0.000 0.845 185 D CB -0.924 39.884 40.800 0.012 0.000 0.960 185 D HN 0.621 8.991 8.370 -0.000 0.000 0.447 186 H N 0.151 119.180 119.070 -0.068 0.000 2.319 186 H HA -0.141 4.357 4.556 -0.096 0.000 0.297 186 H C 2.263 177.575 175.328 -0.027 0.000 1.097 186 H CA 1.612 57.637 56.048 -0.039 0.000 1.285 186 H CB 0.012 29.755 29.762 -0.033 0.000 1.368 186 H HN 0.291 8.571 8.280 -0.000 0.000 0.495 187 Q N 0.673 120.521 119.800 0.079 0.000 2.124 187 Q HA -0.118 4.164 4.340 -0.095 0.000 0.202 187 Q C 2.331 178.331 176.000 -0.001 0.000 0.977 187 Q CA 1.093 56.915 55.803 0.030 0.000 0.850 187 Q CB 0.095 28.821 28.738 -0.020 0.000 0.901 187 Q HN 0.472 8.742 8.270 -0.000 0.000 0.429 188 I N 0.273 120.780 120.570 -0.104 0.000 2.193 188 I HA -0.211 3.902 4.170 -0.095 0.000 0.240 188 I C 2.504 178.663 176.117 0.069 0.000 1.084 188 I CA 0.804 62.086 61.300 -0.030 0.000 1.365 188 I CB -0.645 37.312 38.000 -0.072 0.000 1.064 188 I HN 0.249 8.459 8.210 -0.000 0.000 0.410 189 A N 1.768 124.589 122.820 0.003 0.000 1.873 189 A HA -0.236 4.026 4.320 -0.095 0.000 0.218 189 A C 2.276 179.865 177.584 0.008 0.000 1.193 189 A CA 1.898 53.927 52.037 -0.014 0.000 0.629 189 A CB -1.150 17.803 19.000 -0.079 0.000 0.826 189 A HN 0.424 8.574 8.150 -0.000 0.000 0.447 190 I N -0.181 120.400 120.570 0.017 0.000 2.381 190 I HA -0.251 3.861 4.170 -0.095 0.000 0.255 190 I C 2.010 178.148 176.117 0.036 0.000 1.140 190 I CA 1.214 62.531 61.300 0.028 0.000 1.404 190 I CB -0.361 37.667 38.000 0.047 0.000 1.075 190 I HN 0.177 8.387 8.210 -0.000 0.000 0.433 191 V N 0.030 119.994 119.914 0.083 0.000 2.788 191 V HA -0.144 3.919 4.120 -0.095 0.000 0.251 191 V C 1.615 177.712 176.094 0.005 0.000 1.068 191 V CA 1.370 63.700 62.300 0.050 0.000 1.090 191 V CB -0.512 31.371 31.823 0.100 0.000 0.710 191 V HN 0.324 8.514 8.190 -0.000 0.000 0.467 192 D N 0.266 120.680 120.400 0.023 0.000 2.347 192 D HA -0.071 4.512 4.640 -0.095 0.000 0.215 192 D C 1.356 177.640 176.300 -0.026 0.000 0.976 192 D CA 0.757 54.756 54.000 -0.002 0.000 0.884 192 D CB -0.006 40.801 40.800 0.011 0.000 0.915 192 D HN 0.415 8.785 8.370 -0.000 0.000 0.526 193 D N -0.486 119.898 120.400 -0.027 0.000 2.379 193 D HA 0.017 4.600 4.640 -0.095 0.000 0.208 193 D C 1.830 178.094 176.300 -0.060 0.000 1.065 193 D CA -0.108 53.871 54.000 -0.035 0.000 0.848 193 D CB 0.445 41.233 40.800 -0.020 0.000 0.949 193 D HN 0.124 8.494 8.370 -0.000 0.000 0.509 194 L N 0.966 122.144 121.223 -0.075 0.000 2.209 194 L HA -0.025 4.257 4.340 -0.095 0.000 0.207 194 L C 1.987 178.750 176.870 -0.178 0.000 1.094 194 L CA 1.373 56.142 54.840 -0.119 0.000 0.790 194 L CB -0.270 41.724 42.059 -0.108 0.000 0.932 194 L HN -0.116 8.114 8.230 -0.000 0.000 0.447 195 Q N -0.157 119.547 119.800 -0.159 0.000 2.217 195 Q HA -0.280 4.003 4.340 -0.095 0.000 0.209 195 Q C 1.634 177.490 176.000 -0.240 0.000 0.988 195 Q CA 2.130 57.806 55.803 -0.212 0.000 0.878 195 Q CB -0.226 28.445 28.738 -0.111 0.000 0.909 195 Q HN 0.791 9.061 8.270 -0.000 0.000 0.424 196 E N -0.296 119.811 120.200 -0.154 0.000 2.290 196 E HA -0.038 4.255 4.350 -0.095 0.000 0.199 196 E C 1.904 178.434 176.600 -0.117 0.000 0.912 196 E CA -0.039 56.292 56.400 -0.115 0.000 0.924 196 E CB -0.380 29.286 29.700 -0.057 0.000 0.901 196 E HN 0.144 8.504 8.360 -0.000 0.000 0.487 197 L N 2.885 124.033 121.223 -0.125 0.000 2.051 197 L HA -0.192 4.090 4.340 -0.095 0.000 0.214 197 L C 2.510 179.275 176.870 -0.175 0.000 1.076 197 L CA 2.150 56.909 54.840 -0.135 0.000 0.758 197 L CB -0.625 41.333 42.059 -0.168 0.000 0.890 197 L HN 0.290 8.520 8.230 -0.000 0.000 0.433 198 V N -3.741 116.042 119.914 -0.217 0.000 2.407 198 V HA -0.201 3.862 4.120 -0.095 0.000 0.248 198 V C 2.371 178.400 176.094 -0.108 0.000 1.055 198 V CA 1.957 64.137 62.300 -0.200 0.000 1.049 198 V CB -1.279 30.368 31.823 -0.294 0.000 0.662 198 V HN 0.470 8.660 8.190 -0.000 0.000 0.455 199 S N 0.073 115.704 115.700 -0.114 0.000 2.383 199 S HA -0.185 4.228 4.470 -0.095 0.000 0.229 199 S C 1.816 176.420 174.600 0.007 0.000 1.030 199 S CA 2.184 60.383 58.200 -0.001 0.000 1.002 199 S CB -0.370 62.830 63.200 0.001 0.000 0.829 199 S HN 0.815 9.125 8.310 -0.000 0.000 0.467 200 K N 1.222 121.609 120.400 -0.020 0.000 1.975 200 K HA -0.095 4.167 4.320 -0.095 0.000 0.217 200 K C 0.402 177.008 176.600 0.010 0.000 1.037 200 K CA 1.390 57.679 56.287 0.003 0.000 0.971 200 K CB -0.274 32.232 32.500 0.011 0.000 0.749 200 K HN 0.088 8.338 8.250 -0.000 0.000 0.444 201 D N 1.176 121.570 120.400 -0.010 0.000 2.374 201 D HA 0.116 4.699 4.640 -0.095 0.000 0.240 201 D C -2.220 174.070 176.300 -0.016 0.000 1.229 201 D CA -2.160 51.843 54.000 0.006 0.000 0.895 201 D CB 1.437 42.253 40.800 0.026 0.000 1.046 201 D HN 0.073 8.443 8.370 -0.000 0.000 0.498 202 P HA 0.091 4.511 4.420 -0.000 0.000 0.253 202 P C 0.697 178.012 177.300 0.025 0.000 1.459 202 P CA 0.034 63.148 63.100 0.024 0.000 0.908 202 P CB 0.457 32.186 31.700 0.048 0.000 1.470 203 S N -0.416 115.300 115.700 0.027 0.000 2.527 203 S HA 0.113 4.526 4.470 -0.095 0.000 0.222 203 S C 0.830 175.451 174.600 0.035 0.000 0.985 203 S CA -0.174 58.051 58.200 0.042 0.000 0.921 203 S CB -0.708 62.531 63.200 0.065 0.000 0.772 203 S HN 0.033 8.343 8.310 -0.000 0.000 0.529 204 I N 2.689 123.256 120.570 -0.005 0.000 2.494 204 I HA 0.131 4.243 4.170 -0.095 0.000 0.289 204 I C 0.620 176.734 176.117 -0.005 0.000 1.106 204 I CA -0.104 61.177 61.300 -0.032 0.000 1.369 204 I CB 0.671 38.579 38.000 -0.154 0.000 1.410 204 I HN 0.017 8.227 8.210 -0.000 0.000 0.523 205 K N 6.131 126.544 120.400 0.020 0.000 2.438 205 K HA 0.391 4.653 4.320 -0.095 0.000 0.205 205 K C -0.692 175.926 176.600 0.029 0.000 1.033 205 K CA -0.241 56.063 56.287 0.028 0.000 1.089 205 K CB 0.662 33.184 32.500 0.037 0.000 0.857 205 K HN 0.408 8.658 8.250 -0.000 0.000 0.522 206 L N 0.313 121.551 121.223 0.025 0.000 2.526 206 L HA 0.507 4.790 4.340 -0.095 0.000 0.263 206 L C -1.680 175.199 176.870 0.014 0.000 0.943 206 L CA -0.515 54.343 54.840 0.030 0.000 0.859 206 L CB 1.709 43.801 42.059 0.055 0.000 1.313 206 L HN 0.009 8.239 8.230 -0.000 0.000 0.406 207 I N 5.954 126.524 120.570 -0.001 0.000 2.537 207 I HA 0.356 4.469 4.170 -0.095 0.000 0.276 207 I C -0.717 175.375 176.117 -0.041 0.000 1.063 207 I CA -0.668 60.617 61.300 -0.026 0.000 1.144 207 I CB 1.700 39.671 38.000 -0.047 0.000 1.252 207 I HN 0.267 8.477 8.210 -0.000 0.000 0.480 208 V N 6.791 126.666 119.914 -0.065 0.000 2.509 208 V HA 0.363 4.426 4.120 -0.095 0.000 0.284 208 V C 0.033 175.985 176.094 -0.237 0.000 1.047 208 V CA -0.392 61.811 62.300 -0.162 0.000 0.952 208 V CB 1.964 33.623 31.823 -0.272 0.000 0.988 208 V HN 0.358 8.548 8.190 -0.000 0.000 0.469 209 V N 4.182 123.986 119.914 -0.183 0.000 2.409 209 V HA 0.491 4.554 4.120 -0.095 0.000 0.290 209 V C -0.547 175.476 176.094 -0.118 0.000 1.017 209 V CA -0.588 61.630 62.300 -0.137 0.000 0.841 209 V CB 1.606 33.406 31.823 -0.039 0.000 1.003 209 V HN 0.897 9.087 8.190 -0.000 0.000 0.426 210 D N 3.722 124.023 120.400 -0.164 0.000 2.620 210 D HA 0.513 5.096 4.640 -0.095 0.000 0.252 210 D C -0.796 175.492 176.300 -0.019 0.000 1.207 210 D CA -0.111 53.847 54.000 -0.069 0.000 0.884 210 D CB 2.319 43.050 40.800 -0.116 0.000 1.262 210 D HN 0.608 8.978 8.370 -0.000 0.000 0.552 211 S N 2.005 117.708 115.700 0.006 0.000 2.647 211 S HA 0.230 4.642 4.470 -0.095 0.000 0.300 211 S C 1.379 176.007 174.600 0.046 0.000 1.129 211 S CA -0.793 57.438 58.200 0.053 0.000 1.029 211 S CB 1.326 64.575 63.200 0.081 0.000 1.007 211 S HN 0.302 8.612 8.310 -0.000 0.000 0.484 212 V N 0.621 120.599 119.914 0.106 0.000 2.688 212 V HA -0.118 3.944 4.120 -0.095 0.000 0.256 212 V C 1.573 177.837 176.094 0.285 0.000 1.084 212 V CA 1.897 64.308 62.300 0.186 0.000 1.103 212 V CB -1.711 30.231 31.823 0.198 0.000 0.688 212 V HN 0.854 9.044 8.190 -0.000 0.000 0.480 213 T N -0.712 113.976 114.554 0.223 0.000 3.037 213 T HA 0.024 4.317 4.350 -0.095 0.000 0.251 213 T C 1.948 176.815 174.700 0.278 0.000 1.079 213 T CA 1.035 63.302 62.100 0.279 0.000 1.067 213 T CB 0.211 69.188 68.868 0.181 0.000 0.948 213 T HN 0.586 8.826 8.240 -0.000 0.000 0.496 214 S N 1.499 117.283 115.700 0.139 0.000 2.377 214 S HA -0.278 4.135 4.470 -0.095 0.000 0.224 214 S C 1.978 176.689 174.600 0.185 0.000 1.042 214 S CA 1.684 59.942 58.200 0.097 0.000 1.086 214 S CB -0.401 62.787 63.200 -0.020 0.000 0.995 214 S HN 0.559 8.869 8.310 -0.000 0.000 0.428 215 H N 0.028 119.153 119.070 0.091 0.000 2.387 215 H HA 0.011 4.510 4.556 -0.094 0.000 0.299 215 H C 1.973 177.337 175.328 0.059 0.000 1.090 215 H CA 1.451 57.495 56.048 -0.007 0.000 1.332 215 H CB -1.008 28.666 29.762 -0.147 0.000 1.386 215 H HN 0.536 8.816 8.280 -0.000 0.000 0.516 216 F N 0.740 120.835 119.950 0.241 0.000 2.075 216 F HA -0.139 4.329 4.527 -0.097 0.000 0.297 216 F C 2.856 178.830 175.800 0.290 0.000 1.113 216 F CA 1.242 59.417 58.000 0.291 0.000 1.218 216 F CB -0.299 38.778 39.000 0.129 0.000 0.984 216 F HN -0.031 8.269 8.300 -0.000 0.000 0.472 217 R N 0.356 121.094 120.500 0.397 0.000 2.080 217 R HA -0.189 4.094 4.340 -0.095 0.000 0.236 217 R C 2.409 178.830 176.300 0.201 0.000 1.137 217 R CA 1.590 57.844 56.100 0.256 0.000 0.943 217 R CB -0.837 29.576 30.300 0.187 0.000 0.846 217 R HN 0.280 8.550 8.270 -0.000 0.000 0.431 218 A N 0.766 123.689 122.820 0.173 0.000 1.892 218 A HA -0.235 4.028 4.320 -0.095 0.000 0.218 218 A C 1.843 179.442 177.584 0.024 0.000 1.188 218 A CA 1.976 54.070 52.037 0.095 0.000 0.631 218 A CB -0.530 18.530 19.000 0.101 0.000 0.822 218 A HN 0.499 8.649 8.150 -0.000 0.000 0.447 219 E N -2.482 117.722 120.200 0.006 0.000 2.435 219 E HA -0.020 4.273 4.350 -0.095 0.000 0.195 219 E C -0.658 175.615 176.600 -0.545 0.000 1.029 219 E CA 0.461 56.697 56.400 -0.272 0.000 0.865 219 E CB 0.040 29.525 29.700 -0.359 0.000 0.833 219 E HN 0.812 9.172 8.360 -0.000 0.000 0.510 220 Y N -0.107 120.243 120.300 0.084 0.000 2.569 220 Y HA 0.214 4.706 4.550 -0.096 0.000 0.310 220 Y C -2.392 173.555 175.900 0.080 0.000 1.021 220 Y CA -2.190 55.961 58.100 0.084 0.000 1.152 220 Y CB 0.644 39.174 38.460 0.118 0.000 1.140 220 Y HN 0.005 8.285 8.280 -0.000 0.000 0.621 221 P HA 0.382 4.802 4.420 -0.000 0.000 0.286 221 P C 0.789 178.148 177.300 0.099 0.000 1.293 221 P CA 0.686 63.856 63.100 0.115 0.000 0.770 221 P CB 1.279 33.022 31.700 0.073 0.000 1.206 222 G N 0.197 109.043 108.800 0.076 0.000 2.697 222 G HA2 -0.235 3.668 3.960 -0.095 0.000 0.240 222 G HA3 -0.235 3.668 3.960 -0.095 0.000 0.240 222 G C 0.788 175.724 174.900 0.061 0.000 1.346 222 G CA -0.105 45.031 45.100 0.060 0.000 0.887 222 G HN 0.553 8.843 8.290 -0.000 0.000 0.569 223 R N 0.756 121.284 120.500 0.047 0.000 2.189 223 R HA 0.061 4.344 4.340 -0.095 0.000 0.203 223 R C 2.370 178.696 176.300 0.044 0.000 1.012 223 R CA 1.601 57.725 56.100 0.039 0.000 1.015 223 R CB -0.489 29.827 30.300 0.027 0.000 0.938 223 R HN 0.808 9.078 8.270 -0.000 0.000 0.472 224 E N 1.214 121.443 120.200 0.049 0.000 2.204 224 E HA -0.123 4.170 4.350 -0.095 0.000 0.194 224 E C 0.811 177.456 176.600 0.074 0.000 0.989 224 E CA 0.953 57.384 56.400 0.052 0.000 0.824 224 E CB -0.332 29.397 29.700 0.048 0.000 0.756 224 E HN 0.326 8.686 8.360 -0.000 0.000 0.477 225 N N 0.783 119.543 118.700 0.100 0.000 2.282 225 N HA 0.025 4.708 4.740 -0.095 0.000 0.185 225 N C 1.918 177.496 175.510 0.114 0.000 1.099 225 N CA 0.346 53.490 53.050 0.157 0.000 0.878 225 N CB 0.256 38.891 38.487 0.247 0.000 0.993 225 N HN 0.166 8.546 8.380 -0.000 0.000 0.481 226 L N 0.291 121.562 121.223 0.080 0.000 2.551 226 L HA 0.080 4.363 4.340 -0.095 0.000 0.230 226 L C 1.693 178.575 176.870 0.020 0.000 1.163 226 L CA 0.841 55.711 54.840 0.050 0.000 0.826 226 L CB -0.298 41.784 42.059 0.040 0.000 0.943 226 L HN -0.020 8.210 8.230 -0.000 0.000 0.452 227 A N -0.291 122.542 122.820 0.022 0.000 1.908 227 A HA 0.093 4.356 4.320 -0.095 0.000 0.217 227 A C 2.028 179.595 177.584 -0.028 0.000 1.378 227 A CA 1.120 53.159 52.037 0.002 0.000 0.613 227 A CB -1.038 17.971 19.000 0.016 0.000 1.053 227 A HN 0.177 8.327 8.150 -0.000 0.000 0.484 228 V N 1.026 120.927 119.914 -0.022 0.000 2.380 228 V HA -0.304 3.758 4.120 -0.095 0.000 0.251 228 V C 2.615 178.582 176.094 -0.212 0.000 1.063 228 V CA 2.411 64.664 62.300 -0.078 0.000 1.055 228 V CB -1.102 30.707 31.823 -0.024 0.000 0.657 228 V HN 0.598 8.788 8.190 -0.000 0.000 0.455 229 R N -0.321 120.049 120.500 -0.217 0.000 2.080 229 R HA -0.215 4.068 4.340 -0.095 0.000 0.236 229 R C 2.541 178.694 176.300 -0.245 0.000 1.137 229 R CA 1.906 57.843 56.100 -0.270 0.000 0.943 229 R CB -0.261 30.011 30.300 -0.048 0.000 0.846 229 R HN 0.492 8.762 8.270 -0.000 0.000 0.431 230 Q N 0.245 119.950 119.800 -0.160 0.000 2.030 230 Q HA -0.242 4.041 4.340 -0.095 0.000 0.204 230 Q C 2.062 177.955 176.000 -0.179 0.000 0.986 230 Q CA 1.468 57.175 55.803 -0.161 0.000 0.843 230 Q CB -0.407 28.281 28.738 -0.082 0.000 0.904 230 Q HN 0.414 8.684 8.270 -0.000 0.000 0.420 231 Q N 1.124 120.848 119.800 -0.127 0.000 2.002 231 Q HA -0.165 4.118 4.340 -0.095 0.000 0.204 231 Q C 1.965 177.898 176.000 -0.112 0.000 0.988 231 Q CA 1.626 57.373 55.803 -0.093 0.000 0.843 231 Q CB -0.069 28.634 28.738 -0.058 0.000 0.908 231 Q HN 0.319 8.589 8.270 -0.000 0.000 0.420 232 K N 0.165 120.488 120.400 -0.128 0.000 2.009 232 K HA -0.192 4.070 4.320 -0.095 0.000 0.210 232 K C 2.250 178.790 176.600 -0.101 0.000 1.049 232 K CA 1.364 57.622 56.287 -0.047 0.000 0.929 232 K CB -0.408 32.073 32.500 -0.031 0.000 0.714 232 K HN 0.139 8.389 8.250 -0.000 0.000 0.440 233 L N 2.246 123.179 121.223 -0.485 0.000 2.012 233 L HA -0.205 4.078 4.340 -0.095 0.000 0.210 233 L C 1.646 178.196 176.870 -0.534 0.000 1.073 233 L CA 1.820 56.076 54.840 -0.973 0.000 0.748 233 L CB -0.650 40.803 42.059 -1.010 0.000 0.891 233 L HN 0.193 8.423 8.230 -0.000 0.000 0.431 234 N N -0.243 118.195 118.700 -0.438 0.000 2.244 234 N HA -0.216 4.466 4.740 -0.095 0.000 0.183 234 N C 1.865 177.038 175.510 -0.563 0.000 1.016 234 N CA 1.282 54.017 53.050 -0.524 0.000 0.866 234 N CB -0.115 38.145 38.487 -0.379 0.000 0.980 234 N HN 0.443 8.823 8.380 -0.000 0.000 0.430 235 K N 0.380 120.670 120.400 -0.184 0.000 2.057 235 K HA -0.152 4.111 4.320 -0.095 0.000 0.207 235 K C 2.068 178.672 176.600 0.008 0.000 1.049 235 K CA 1.108 57.408 56.287 0.022 0.000 0.931 235 K CB -0.157 32.384 32.500 0.068 0.000 0.714 235 K HN 0.297 8.547 8.250 -0.000 0.000 0.440 236 H N 0.138 119.147 119.070 -0.101 0.000 2.421 236 H HA -0.087 4.411 4.556 -0.096 0.000 0.298 236 H C 1.820 177.082 175.328 -0.111 0.000 1.087 236 H CA 1.417 57.442 56.048 -0.040 0.000 1.330 236 H CB 0.203 30.015 29.762 0.084 0.000 1.388 236 H HN 0.174 8.454 8.280 -0.000 0.000 0.526 237 L N -0.394 120.655 121.223 -0.290 0.000 2.313 237 L HA -0.111 4.171 4.340 -0.095 0.000 0.214 237 L C 2.482 179.207 176.870 -0.242 0.000 1.119 237 L CA 0.272 54.910 54.840 -0.337 0.000 0.809 237 L CB -0.320 41.471 42.059 -0.445 0.000 0.933 237 L HN 0.308 8.538 8.230 -0.000 0.000 0.449 238 H N 0.338 119.329 119.070 -0.132 0.000 2.307 238 H HA -0.078 4.421 4.556 -0.095 0.000 0.303 238 H C 2.188 177.464 175.328 -0.087 0.000 1.073 238 H CA 1.119 57.106 56.048 -0.101 0.000 1.338 238 H CB -0.340 29.372 29.762 -0.082 0.000 1.389 238 H HN 0.385 8.665 8.280 -0.000 0.000 0.503 239 Q N 0.337 120.164 119.800 0.045 0.000 2.173 239 Q HA -0.152 4.130 4.340 -0.095 0.000 0.208 239 Q C 2.512 178.476 176.000 -0.060 0.000 0.989 239 Q CA 1.129 56.927 55.803 -0.008 0.000 0.872 239 Q CB -0.227 28.499 28.738 -0.019 0.000 0.909 239 Q HN 0.387 8.657 8.270 -0.000 0.000 0.420 240 L N 0.097 121.243 121.223 -0.128 0.000 2.141 240 L HA -0.145 4.138 4.340 -0.095 0.000 0.209 240 L C 2.313 179.149 176.870 -0.057 0.000 1.094 240 L CA 1.040 55.802 54.840 -0.130 0.000 0.763 240 L CB -0.311 41.629 42.059 -0.199 0.000 0.908 240 L HN 0.267 8.497 8.230 -0.000 0.000 0.437 241 T N -1.124 113.415 114.554 -0.026 0.000 2.770 241 T HA -0.105 4.188 4.350 -0.095 0.000 0.263 241 T C 1.974 176.685 174.700 0.019 0.000 1.039 241 T CA 0.646 62.747 62.100 0.002 0.000 1.142 241 T CB -0.086 68.794 68.868 0.020 0.000 0.868 241 T HN 0.227 8.467 8.240 -0.000 0.000 0.435 242 R N 1.335 121.852 120.500 0.028 0.000 2.122 242 R HA -0.084 4.199 4.340 -0.095 0.000 0.236 242 R C 2.461 178.833 176.300 0.119 0.000 1.129 242 R CA 1.349 57.486 56.100 0.060 0.000 0.925 242 R CB -1.367 28.971 30.300 0.063 0.000 0.850 242 R HN 0.405 8.675 8.270 -0.000 0.000 0.431 243 L N 0.424 121.699 121.223 0.087 0.000 2.263 243 L HA -0.173 4.110 4.340 -0.095 0.000 0.216 243 L C 2.628 179.569 176.870 0.118 0.000 1.111 243 L CA 1.240 56.129 54.840 0.082 0.000 0.773 243 L CB -0.769 41.222 42.059 -0.112 0.000 0.906 243 L HN 0.251 8.481 8.230 -0.000 0.000 0.439 244 A N 0.894 123.756 122.820 0.070 0.000 1.843 244 A HA -0.143 4.120 4.320 -0.095 0.000 0.213 244 A C 2.229 179.858 177.584 0.075 0.000 1.202 244 A CA 1.072 53.143 52.037 0.056 0.000 0.607 244 A CB -0.341 18.677 19.000 0.030 0.000 0.847 244 A HN 0.541 8.691 8.150 -0.000 0.000 0.445 245 E N 0.011 120.247 120.200 0.059 0.000 1.996 245 E HA -0.147 4.146 4.350 -0.095 0.000 0.197 245 E C 1.735 178.351 176.600 0.028 0.000 1.002 245 E CA 1.561 57.980 56.400 0.032 0.000 0.840 245 E CB -0.968 28.738 29.700 0.010 0.000 0.786 245 E HN 0.127 8.487 8.360 -0.000 0.000 0.469 246 V N 0.377 120.309 119.914 0.030 0.000 2.311 246 V HA -0.286 3.777 4.120 -0.095 0.000 0.256 246 V C 1.668 177.590 176.094 -0.286 0.000 1.077 246 V CA 2.187 64.416 62.300 -0.119 0.000 1.067 246 V CB -0.851 30.912 31.823 -0.100 0.000 0.659 246 V HN 0.350 8.540 8.190 -0.000 0.000 0.451 247 Y N -1.139 119.148 120.300 -0.022 0.000 2.555 247 Y HA 0.398 4.891 4.550 -0.095 0.000 0.259 247 Y C 0.920 176.809 175.900 -0.018 0.000 1.179 247 Y CA -0.535 57.552 58.100 -0.021 0.000 1.230 247 Y CB -0.267 38.177 38.460 -0.026 0.000 1.146 247 Y HN 0.419 8.699 8.280 -0.000 0.000 0.526 248 D N 0.730 121.182 120.400 0.085 0.000 2.699 248 D HA -0.207 4.375 4.640 -0.095 0.000 0.239 248 D C -0.606 175.728 176.300 0.057 0.000 1.136 248 D CA 0.481 54.511 54.000 0.050 0.000 0.668 248 D CB -1.089 39.728 40.800 0.028 0.000 1.060 248 D HN 0.366 8.736 8.370 -0.000 0.000 0.429 249 I N -0.357 120.251 120.570 0.064 0.000 2.910 249 I HA 0.635 4.748 4.170 -0.095 0.000 0.310 249 I C 0.618 176.755 176.117 0.034 0.000 1.043 249 I CA -1.131 60.194 61.300 0.042 0.000 1.053 249 I CB 1.853 39.868 38.000 0.026 0.000 1.242 249 I HN 0.184 8.394 8.210 -0.000 0.000 0.452 250 A N 4.513 127.352 122.820 0.031 0.000 2.294 250 A HA 0.565 4.828 4.320 -0.095 0.000 0.316 250 A C -0.470 177.131 177.584 0.029 0.000 1.359 250 A CA -0.356 51.703 52.037 0.037 0.000 0.956 250 A CB 0.176 19.203 19.000 0.045 0.000 1.155 250 A HN 0.399 8.549 8.150 -0.000 0.000 0.544 251 V N 3.786 123.715 119.914 0.026 0.000 2.607 251 V HA 0.400 4.463 4.120 -0.095 0.000 0.289 251 V C 0.069 176.186 176.094 0.039 0.000 1.053 251 V CA -0.008 62.299 62.300 0.012 0.000 0.996 251 V CB 1.304 33.124 31.823 -0.005 0.000 0.995 251 V HN 0.730 8.920 8.190 -0.000 0.000 0.476 252 I N 5.531 126.119 120.570 0.030 0.000 2.529 252 I HA 0.427 4.540 4.170 -0.095 0.000 0.284 252 I C -0.216 175.936 176.117 0.059 0.000 1.088 252 I CA -0.243 61.101 61.300 0.074 0.000 1.062 252 I CB 1.540 39.573 38.000 0.054 0.000 1.218 252 I HN 0.587 8.797 8.210 -0.000 0.000 0.442 253 I N 2.018 122.654 120.570 0.110 0.000 3.062 253 I HA 0.780 4.892 4.170 -0.095 0.000 0.316 253 I C -0.446 175.778 176.117 0.178 0.000 1.041 253 I CA -0.349 61.014 61.300 0.105 0.000 1.069 253 I CB 2.151 40.210 38.000 0.099 0.000 1.300 253 I HN 0.328 8.538 8.210 -0.000 0.000 0.518 254 T N 1.769 116.419 114.554 0.161 0.000 3.041 254 T HA 0.402 4.695 4.350 -0.095 0.000 0.321 254 T C -1.056 173.758 174.700 0.191 0.000 1.184 254 T CA -0.716 61.503 62.100 0.199 0.000 1.050 254 T CB 1.356 70.303 68.868 0.132 0.000 1.159 254 T HN 0.671 8.911 8.240 -0.000 0.000 0.469 255 N N 2.009 120.852 118.700 0.239 0.000 2.225 255 N HA 0.349 5.032 4.740 -0.095 0.000 0.298 255 N C -1.128 174.515 175.510 0.221 0.000 1.076 255 N CA -0.690 52.476 53.050 0.193 0.000 0.792 255 N CB 2.844 41.407 38.487 0.128 0.000 1.498 255 N HN 0.597 8.977 8.380 -0.000 0.000 0.474 256 Q N 1.061 120.961 119.800 0.166 0.000 2.271 256 Q HA 0.594 4.876 4.340 -0.095 0.000 0.258 256 Q C -1.173 174.905 176.000 0.130 0.000 0.936 256 Q CA -0.710 55.195 55.803 0.169 0.000 0.909 256 Q CB 1.163 29.991 28.738 0.151 0.000 1.253 256 Q HN 0.481 8.751 8.270 -0.000 0.000 0.440 257 V N 2.908 122.906 119.914 0.140 0.000 2.610 257 V HA 0.441 4.504 4.120 -0.095 0.000 0.298 257 V C -0.673 175.436 176.094 0.025 0.000 1.067 257 V CA -1.060 61.274 62.300 0.057 0.000 0.894 257 V CB 1.500 33.359 31.823 0.061 0.000 1.015 257 V HN 0.925 9.115 8.190 -0.000 0.000 0.432 276 T N -0.784 113.625 114.554 -0.241 0.000 3.433 276 T HA -0.210 4.082 4.350 -0.095 0.000 0.412 276 T C 0.482 174.558 174.700 -1.040 0.000 0.768 276 T CA 0.868 62.603 62.100 -0.609 0.000 2.077 276 T CB -1.852 66.763 68.868 -0.422 0.000 1.700 276 T HN 0.534 8.774 8.240 -0.000 0.000 0.666 277 L N 0.388 121.143 121.223 -0.779 0.000 3.122 277 L HA 0.292 4.575 4.340 -0.095 0.000 0.274 277 L C 0.922 177.592 176.870 -0.334 0.000 1.222 277 L CA -1.372 53.104 54.840 -0.607 0.000 1.028 277 L CB -0.081 41.766 42.059 -0.354 0.000 1.386 277 L HN 0.649 8.879 8.230 -0.000 0.000 0.578 278 Y N -1.131 119.117 120.300 -0.087 0.000 3.012 278 Y HA -0.200 4.292 4.550 -0.096 0.000 0.348 278 Y C 1.001 176.922 175.900 0.035 0.000 1.280 278 Y CA -0.327 57.751 58.100 -0.037 0.000 1.492 278 Y CB -0.570 37.848 38.460 -0.070 0.000 1.315 278 Y HN 0.090 8.370 8.280 -0.000 0.000 0.651 279 H N 1.450 120.627 119.070 0.178 0.000 2.970 279 H HA 0.417 4.916 4.556 -0.096 0.000 0.226 279 H C -1.051 174.306 175.328 0.047 0.000 1.909 279 H CA -0.311 55.794 56.048 0.094 0.000 1.388 279 H CB -0.430 29.362 29.762 0.050 0.000 1.773 279 H HN 0.472 8.752 8.280 -0.000 0.000 0.559 280 V N 4.270 124.175 119.914 -0.016 0.000 2.361 280 V HA 0.170 4.233 4.120 -0.095 0.000 0.252 280 V C -2.150 173.919 176.094 -0.041 0.000 0.986 280 V CA -1.523 60.671 62.300 -0.177 0.000 1.033 280 V CB 0.179 31.750 31.823 -0.420 0.000 1.282 280 V HN 0.590 8.780 8.190 -0.000 0.000 0.514 281 P HA 0.320 4.740 4.420 -0.000 0.000 0.257 281 P C 0.470 177.806 177.300 0.059 0.000 1.162 281 P CA 1.020 64.156 63.100 0.061 0.000 0.762 281 P CB 0.515 32.252 31.700 0.061 0.000 0.753 282 G N 2.028 110.882 108.800 0.090 0.000 2.550 282 G HA2 0.410 4.312 3.960 -0.095 0.000 0.293 282 G HA3 0.410 4.312 3.960 -0.095 0.000 0.293 282 G C -1.099 173.854 174.900 0.088 0.000 1.402 282 G CA -0.942 44.213 45.100 0.091 0.000 0.784 282 G HN 0.410 8.700 8.290 -0.000 0.000 0.482 283 I N 0.656 121.275 120.570 0.082 0.000 2.752 283 I HA 0.138 4.251 4.170 -0.095 0.000 0.289 283 I C 0.389 176.489 176.117 -0.029 0.000 1.197 283 I CA 0.569 61.869 61.300 0.000 0.000 1.432 283 I CB 0.385 38.378 38.000 -0.011 0.000 1.359 283 I HN 0.201 8.411 8.210 -0.000 0.000 0.571 284 R N 7.190 127.664 120.500 -0.043 0.000 2.467 284 R HA 0.483 4.766 4.340 -0.095 0.000 0.299 284 R C -1.170 175.094 176.300 -0.060 0.000 1.120 284 R CA -0.769 55.343 56.100 0.021 0.000 0.940 284 R CB 1.375 31.763 30.300 0.147 0.000 1.161 284 R HN 0.418 8.688 8.270 -0.000 0.000 0.506 285 I N 2.416 122.786 120.570 -0.334 0.000 2.385 285 I HA 0.246 4.359 4.170 -0.095 0.000 0.294 285 I C 0.385 176.170 176.117 -0.553 0.000 0.988 285 I CA -0.514 60.511 61.300 -0.459 0.000 1.265 285 I CB 1.555 39.075 38.000 -0.801 0.000 1.388 285 I HN 0.563 8.773 8.210 -0.000 0.000 0.480 286 Q N 5.901 125.363 119.800 -0.564 0.000 2.266 286 Q HA 0.725 5.008 4.340 -0.095 0.000 0.261 286 Q C -1.837 173.931 176.000 -0.388 0.000 0.985 286 Q CA -0.669 54.585 55.803 -0.916 0.000 0.873 286 Q CB 1.967 30.287 28.738 -0.696 0.000 1.306 286 Q HN 0.601 8.871 8.270 -0.000 0.000 0.447 287 L N 2.448 123.487 121.223 -0.306 0.000 2.365 287 L HA 0.648 4.931 4.340 -0.095 0.000 0.273 287 L C -0.728 176.114 176.870 -0.047 0.000 1.000 287 L CA -0.881 53.936 54.840 -0.038 0.000 0.819 287 L CB 2.111 44.230 42.059 0.100 0.000 1.284 287 L HN 0.569 8.799 8.230 -0.000 0.000 0.418 288 K N 1.906 122.297 120.400 -0.014 0.000 2.371 288 K HA 0.484 4.747 4.320 -0.095 0.000 0.251 288 K C -1.113 175.448 176.600 -0.067 0.000 0.934 288 K CA -0.959 55.307 56.287 -0.036 0.000 0.798 288 K CB 2.579 35.061 32.500 -0.031 0.000 1.204 288 K HN 0.427 8.677 8.250 -0.000 0.000 0.427 289 K N 1.013 121.370 120.400 -0.073 0.000 2.298 289 K HA 0.068 4.331 4.320 -0.095 0.000 0.280 289 K C 0.506 177.047 176.600 -0.099 0.000 1.032 289 K CA -0.157 56.066 56.287 -0.106 0.000 0.958 289 K CB 1.574 34.019 32.500 -0.091 0.000 0.978 289 K HN 0.479 8.729 8.250 -0.000 0.000 0.472 290 S N 2.754 118.377 115.700 -0.128 0.000 2.440 290 S HA 0.054 4.467 4.470 -0.095 0.000 0.194 290 S C 0.223 174.770 174.600 -0.088 0.000 0.952 290 S CA 0.133 58.271 58.200 -0.104 0.000 0.898 290 S CB 0.306 63.431 63.200 -0.125 0.000 0.875 290 S HN 0.645 8.955 8.310 -0.000 0.000 0.581 291 R N -0.423 120.018 120.500 -0.099 0.000 2.680 291 R HA 0.423 4.706 4.340 -0.095 0.000 0.278 291 R C 0.711 176.957 176.300 -0.090 0.000 1.582 291 R CA 0.574 56.626 56.100 -0.080 0.000 1.177 291 R CB 0.285 30.546 30.300 -0.066 0.000 1.232 291 R HN 0.683 8.953 8.270 -0.000 0.000 0.528 292 G N 3.355 112.102 108.800 -0.089 0.000 2.857 292 G HA2 -0.504 3.399 3.960 -0.095 0.000 0.237 292 G HA3 -0.504 3.399 3.960 -0.095 0.000 0.237 292 G C 0.723 175.554 174.900 -0.114 0.000 1.074 292 G CA 1.644 46.689 45.100 -0.092 0.000 0.742 292 G HN 0.626 8.916 8.290 -0.000 0.000 0.555 293 N N -0.596 118.029 118.700 -0.126 0.000 2.380 293 N HA 0.100 4.782 4.740 -0.095 0.000 0.227 293 N C 0.900 176.287 175.510 -0.206 0.000 1.139 293 N CA 0.538 53.502 53.050 -0.143 0.000 0.843 293 N CB 0.410 38.833 38.487 -0.107 0.000 1.327 293 N HN 0.684 9.064 8.380 -0.000 0.000 0.470 294 R N 0.807 121.185 120.500 -0.204 0.000 2.410 294 R HA 0.477 4.760 4.340 -0.095 0.000 0.288 294 R C -0.562 175.514 176.300 -0.373 0.000 1.051 294 R CA -0.524 55.408 56.100 -0.281 0.000 1.021 294 R CB 0.855 31.044 30.300 -0.185 0.000 1.032 294 R HN 0.027 8.297 8.270 -0.000 0.000 0.481 295 R N 2.107 122.212 120.500 -0.659 0.000 2.854 295 R HA 0.509 4.792 4.340 -0.095 0.000 0.271 295 R C -0.560 175.460 176.300 -0.466 0.000 0.994 295 R CA -1.154 54.560 56.100 -0.643 0.000 0.945 295 R CB 1.614 31.333 30.300 -0.969 0.000 1.194 295 R HN 0.532 8.802 8.270 -0.000 0.000 0.476 296 I N 0.817 121.334 120.570 -0.087 0.000 2.474 296 I HA 0.521 4.634 4.170 -0.095 0.000 0.294 296 I C 0.011 176.276 176.117 0.247 0.000 1.005 296 I CA -1.222 60.137 61.300 0.099 0.000 1.113 296 I CB 1.325 39.334 38.000 0.016 0.000 1.289 296 I HN 0.583 8.793 8.210 -0.000 0.000 0.436 297 A N 6.634 129.609 122.820 0.258 0.000 2.318 297 A HA 0.826 5.089 4.320 -0.095 0.000 0.317 297 A C -0.218 177.366 177.584 0.000 0.000 1.159 297 A CA -0.695 51.407 52.037 0.109 0.000 0.799 297 A CB 1.239 20.244 19.000 0.010 0.000 1.194 297 A HN 0.783 8.933 8.150 -0.000 0.000 0.479 298 R N 2.483 122.945 120.500 -0.063 0.000 2.575 298 R HA 0.574 4.857 4.340 -0.095 0.000 0.293 298 R C -1.755 174.482 176.300 -0.105 0.000 0.983 298 R CA -0.483 55.576 56.100 -0.068 0.000 0.887 298 R CB 1.774 32.046 30.300 -0.046 0.000 1.184 298 R HN 0.456 8.726 8.270 -0.000 0.000 0.445 299 V N 5.634 125.491 119.914 -0.096 0.000 2.439 299 V HA 0.040 4.103 4.120 -0.095 0.000 0.271 299 V C 0.902 176.958 176.094 -0.063 0.000 1.040 299 V CA 0.048 62.283 62.300 -0.109 0.000 1.002 299 V CB 1.215 32.970 31.823 -0.114 0.000 1.000 299 V HN 0.751 8.941 8.190 -0.000 0.000 0.477 300 V N 3.177 123.068 119.914 -0.037 0.000 2.521 300 V HA 0.191 4.254 4.120 -0.095 0.000 0.239 300 V C 0.296 176.398 176.094 0.013 0.000 1.053 300 V CA 0.953 63.264 62.300 0.019 0.000 1.073 300 V CB 0.148 32.037 31.823 0.109 0.000 0.746 300 V HN 0.839 9.029 8.190 -0.000 0.000 0.476 301 D N 0.074 120.479 120.400 0.010 0.000 2.788 301 D HA 0.718 5.301 4.640 -0.095 0.000 0.247 301 D C -0.702 175.591 176.300 -0.011 0.000 1.236 301 D CA 0.388 54.396 54.000 0.013 0.000 0.898 301 D CB 1.985 42.813 40.800 0.047 0.000 1.401 301 D HN 0.333 8.703 8.370 -0.000 0.000 0.549 302 A N 3.252 126.055 122.820 -0.028 0.000 2.573 302 A HA 0.440 4.703 4.320 -0.095 0.000 0.312 302 A C -2.503 175.043 177.584 -0.063 0.000 1.041 302 A CA -0.801 51.191 52.037 -0.075 0.000 0.880 302 A CB 0.913 19.761 19.000 -0.253 0.000 1.249 302 A HN 0.235 8.385 8.150 -0.000 0.000 0.385 303 P HA -0.178 4.242 4.420 -0.000 0.000 0.210 303 P C 1.158 178.539 177.300 0.134 0.000 1.189 303 P CA 2.039 65.239 63.100 0.166 0.000 0.920 303 P CB -0.138 31.717 31.700 0.259 0.000 0.782 304 H N -1.346 117.723 119.070 -0.001 0.000 2.567 304 H HA 0.085 4.583 4.556 -0.096 0.000 0.276 304 H C 0.365 175.687 175.328 -0.011 0.000 1.016 304 H CA 0.404 56.449 56.048 -0.005 0.000 1.186 304 H CB -1.385 28.375 29.762 -0.004 0.000 1.351 304 H HN 0.174 8.454 8.280 -0.000 0.000 0.605 305 L N 2.225 123.260 121.223 -0.313 0.000 2.296 305 L HA 0.368 4.650 4.340 -0.095 0.000 0.286 305 L C -2.401 174.396 176.870 -0.121 0.000 1.023 305 L CA -2.198 52.502 54.840 -0.233 0.000 0.812 305 L CB 1.980 43.844 42.059 -0.325 0.000 1.223 305 L HN -0.135 8.095 8.230 -0.000 0.000 0.421 306 P HA 0.079 4.499 4.420 -0.000 0.000 0.273 306 P C -0.641 176.626 177.300 -0.055 0.000 1.319 306 P CA -0.496 62.572 63.100 -0.054 0.000 0.885 306 P CB 0.283 31.955 31.700 -0.045 0.000 1.015 307 E N 2.380 122.552 120.200 -0.047 0.000 2.696 307 E HA 0.201 4.494 4.350 -0.095 0.000 0.270 307 E C 0.988 177.566 176.600 -0.037 0.000 0.958 307 E CA 1.132 57.508 56.400 -0.041 0.000 0.964 307 E CB -0.021 29.664 29.700 -0.025 0.000 0.948 307 E HN 0.653 9.013 8.360 -0.000 0.000 0.472 308 G N 1.262 110.039 108.800 -0.039 0.000 2.336 308 G HA2 0.341 4.243 3.960 -0.095 0.000 0.300 308 G HA3 0.341 4.243 3.960 -0.095 0.000 0.300 308 G C -1.570 173.309 174.900 -0.034 0.000 1.375 308 G CA -0.487 44.593 45.100 -0.033 0.000 0.885 308 G HN 0.542 8.832 8.290 -0.000 0.000 0.599 309 E N -1.522 118.665 120.200 -0.023 0.000 2.356 309 E HA 0.732 5.025 4.350 -0.095 0.000 0.275 309 E C -1.810 174.795 176.600 0.008 0.000 0.904 309 E CA -1.113 55.281 56.400 -0.010 0.000 0.757 309 E CB 2.821 32.518 29.700 -0.006 0.000 1.232 309 E HN 0.842 9.202 8.360 -0.000 0.000 0.442 310 V N 2.187 122.123 119.914 0.036 0.000 2.914 310 V HA 0.532 4.595 4.120 -0.095 0.000 0.314 310 V C -0.851 175.338 176.094 0.158 0.000 1.084 310 V CA -0.736 61.605 62.300 0.067 0.000 0.963 310 V CB 2.055 33.906 31.823 0.046 0.000 1.025 310 V HN 0.655 8.845 8.190 -0.000 0.000 0.432 311 V N 6.482 126.483 119.914 0.145 0.000 2.837 311 V HA 0.872 4.935 4.120 -0.095 0.000 0.310 311 V C -0.729 175.525 176.094 0.267 0.000 1.059 311 V CA -0.014 62.372 62.300 0.144 0.000 1.004 311 V CB 1.522 33.354 31.823 0.015 0.000 1.045 311 V HN 1.061 9.251 8.190 -0.000 0.000 0.465 312 F N 2.719 122.656 119.950 -0.022 0.000 2.877 312 F HA 0.946 5.391 4.527 -0.137 0.000 0.319 312 F C -0.714 175.069 175.800 -0.028 0.000 1.174 312 F CA -0.657 57.331 58.000 -0.020 0.000 0.903 312 F CB 0.954 39.947 39.000 -0.013 0.000 1.357 312 F HN 0.784 9.084 8.300 -0.000 0.000 0.472 313 A N 1.110 123.886 122.820 -0.072 0.000 2.413 313 A HA 0.790 5.053 4.320 -0.095 0.000 0.307 313 A C -1.640 175.903 177.584 -0.068 0.000 1.087 313 A CA -0.924 51.006 52.037 -0.178 0.000 0.750 313 A CB 1.615 20.562 19.000 -0.089 0.000 1.296 313 A HN 0.840 8.990 8.150 -0.000 0.000 0.423 314 L N 2.918 124.060 121.223 -0.136 0.000 2.288 314 L HA 0.361 4.643 4.340 -0.095 0.000 0.283 314 L C 0.521 177.350 176.870 -0.068 0.000 1.072 314 L CA -0.265 54.530 54.840 -0.075 0.000 0.862 314 L CB 0.481 42.469 42.059 -0.118 0.000 1.245 314 L HN 0.931 9.161 8.230 -0.000 0.000 0.432 315 T N -2.424 112.107 114.554 -0.037 0.000 2.948 315 T HA 0.344 4.637 4.350 -0.095 0.000 0.285 315 T C 0.887 175.562 174.700 -0.043 0.000 1.019 315 T CA -0.806 61.271 62.100 -0.039 0.000 1.013 315 T CB 2.131 70.987 68.868 -0.021 0.000 1.117 315 T HN 0.359 8.599 8.240 -0.000 0.000 0.533 316 E N 0.589 120.764 120.200 -0.042 0.000 2.058 316 E HA -0.125 4.168 4.350 -0.095 0.000 0.194 316 E C 1.940 178.518 176.600 -0.036 0.000 0.997 316 E CA 1.654 58.027 56.400 -0.044 0.000 0.801 316 E CB -0.369 29.310 29.700 -0.036 0.000 0.746 316 E HN 0.838 9.198 8.360 -0.000 0.000 0.450 317 E N -0.009 120.177 120.200 -0.023 0.000 2.333 317 E HA -0.056 4.237 4.350 -0.095 0.000 0.200 317 E C 1.030 177.621 176.600 -0.015 0.000 1.010 317 E CA 0.588 56.980 56.400 -0.014 0.000 0.841 317 E CB -0.107 29.591 29.700 -0.005 0.000 0.757 317 E HN 0.293 8.653 8.360 -0.000 0.000 0.508 318 G N 0.624 109.410 108.800 -0.022 0.000 2.358 318 G HA2 -0.169 3.734 3.960 -0.095 0.000 0.198 318 G HA3 -0.169 3.734 3.960 -0.095 0.000 0.198 318 G C -0.928 173.975 174.900 0.004 0.000 1.220 318 G CA -0.607 44.479 45.100 -0.023 0.000 1.187 318 G HN 0.028 8.318 8.290 -0.000 0.000 0.544 319 I N 2.856 123.439 120.570 0.021 0.000 2.436 319 I HA 0.448 4.561 4.170 -0.095 0.000 0.289 319 I C 0.865 177.023 176.117 0.069 0.000 1.083 319 I CA 0.435 61.773 61.300 0.065 0.000 1.372 319 I CB 0.159 38.179 38.000 0.032 0.000 1.408 319 I HN 0.489 8.699 8.210 -0.000 0.000 0.516 320 R N 4.251 124.819 120.500 0.113 0.000 2.781 320 R HA 0.440 4.723 4.340 -0.095 0.000 0.268 320 R C -1.317 175.064 176.300 0.134 0.000 1.047 320 R CA -1.009 55.145 56.100 0.089 0.000 0.925 320 R CB 1.069 31.396 30.300 0.045 0.000 1.246 320 R HN 0.405 8.675 8.270 -0.000 0.000 0.456 321 D N 0.249 120.703 120.400 0.091 0.000 2.163 321 D HA 0.563 5.146 4.640 -0.095 0.000 0.248 321 D C -0.190 176.133 176.300 0.038 0.000 1.035 321 D CA -0.586 53.468 54.000 0.091 0.000 0.872 321 D CB 1.494 42.340 40.800 0.076 0.000 1.183 321 D HN 0.613 8.983 8.370 -0.000 0.000 0.445 322 A N 0.000 122.829 122.820 0.015 0.000 2.254 322 A HA 0.000 4.263 4.320 -0.095 0.000 0.244 322 A CA 0.000 52.030 52.037 -0.012 0.000 0.836 322 A CB 0.000 18.974 19.000 -0.043 0.000 0.831 322 A HN 0.000 8.150 8.150 -0.000 0.000 0.486