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 3bgr_1_B DATA FIRST_RESID 5 DATA SEQUENCE IETVPVKLKP GMDGPKVKQW PLTEEKIKAL VEICTEMEKE GKISKIGPEN DATA SEQUENCE PYNTPVFAIK KKDSTKWRKL VDFRELNKRT QDFWEVQLGI PHPAGLKKKK DATA SEQUENCE SVTVLDVGDA YFSVPLDEDF RKYTAFTIPS INNETPGIRY QYNVLPQGWK DATA SEQUENCE GSPAIFQSSM TKILEPFKKQ NPDIVIYQYM DDLYVGSDLE IGQHRTKIEE DATA SEQUENCE LRQHLLRWGL XXXXXXXXXX XXFLWMGYEL HPDKWTVQPI VLPEKDSWTV DATA SEQUENCE NDIQKLVGKL NWASQIYPGI KVRQLSKLLR GTKALTEVIP LTEEAELELA DATA SEQUENCE ENREILKEPV HGVYYDPSKD LIAEIQKQGQ GQWTYQIYQE PFKNLKTGKY DATA SEQUENCE ARMRGAHTND VKQLTEAVQK ITTESIVIWG KTPKFKLPIQ KETWETWWTE DATA SEQUENCE YWQATWIPEW EFVNTPPLVK LWYQ 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 5 I HA 0.000 4.170 4.170 -0.000 0.000 0.288 5 I C 0.000 176.159 176.117 0.069 0.000 1.063 5 I CA 0.000 61.345 61.300 0.075 0.000 1.566 5 I CB 0.000 38.037 38.000 0.062 0.000 1.214 6 E N 3.020 123.260 120.200 0.067 0.000 2.313 6 E HA 0.413 4.765 4.350 0.002 0.000 0.272 6 E C -0.320 176.323 176.600 0.072 0.000 1.038 6 E CA 0.138 56.575 56.400 0.062 0.000 0.863 6 E CB 1.310 31.042 29.700 0.054 0.000 1.060 6 E HN 0.357 8.717 8.360 -0.000 0.000 0.402 7 T N -0.352 114.246 114.554 0.072 0.000 2.823 7 T HA 0.415 4.767 4.350 0.002 0.000 0.279 7 T C -0.254 174.497 174.700 0.085 0.000 0.998 7 T CA -0.892 61.259 62.100 0.084 0.000 0.994 7 T CB 1.331 70.250 68.868 0.085 0.000 0.960 7 T HN 0.160 8.400 8.240 -0.000 0.000 0.448 8 V N 6.263 126.236 119.914 0.098 0.000 2.408 8 V HA 0.416 4.537 4.120 0.002 0.000 0.267 8 V C -2.014 174.157 176.094 0.128 0.000 1.047 8 V CA -2.204 60.162 62.300 0.110 0.000 0.937 8 V CB 0.440 32.344 31.823 0.134 0.000 0.999 8 V HN 0.906 9.096 8.190 -0.000 0.000 0.472 9 P HA 0.116 4.536 4.420 -0.000 0.000 0.265 9 P C -0.897 176.469 177.300 0.110 0.000 1.193 9 P CA 0.303 63.461 63.100 0.097 0.000 0.765 9 P CB 0.983 32.724 31.700 0.067 0.000 0.823 10 V N 3.080 123.056 119.914 0.102 0.000 3.007 10 V HA 0.619 4.740 4.120 0.002 0.000 0.311 10 V C 0.052 176.208 176.094 0.104 0.000 1.120 10 V CA -0.579 61.750 62.300 0.049 0.000 0.980 10 V CB 2.352 34.062 31.823 -0.190 0.000 1.033 10 V HN 0.638 8.828 8.190 -0.000 0.000 0.429 11 K N 1.716 122.192 120.400 0.127 0.000 2.555 11 K HA 0.701 5.022 4.320 0.002 0.000 0.279 11 K C -1.378 175.416 176.600 0.323 0.000 0.986 11 K CA -0.789 55.688 56.287 0.316 0.000 0.880 11 K CB 2.275 34.886 32.500 0.184 0.000 1.474 11 K HN 0.576 8.826 8.250 -0.000 0.000 0.433 12 L N 1.339 122.749 121.223 0.311 0.000 2.505 12 L HA 0.355 4.697 4.340 0.002 0.000 0.226 12 L C 0.247 177.182 176.870 0.108 0.000 1.211 12 L CA -0.615 54.334 54.840 0.181 0.000 0.828 12 L CB 0.191 42.234 42.059 -0.027 0.000 1.331 12 L HN 0.516 8.746 8.230 -0.000 0.000 0.513 13 K N 1.497 121.942 120.400 0.076 0.000 2.298 13 K HA 0.190 4.511 4.320 0.002 0.000 0.280 13 K C -2.223 174.405 176.600 0.046 0.000 1.032 13 K CA -1.550 54.772 56.287 0.059 0.000 0.958 13 K CB 0.316 32.850 32.500 0.057 0.000 0.978 13 K HN 0.305 8.555 8.250 -0.000 0.000 0.472 14 P HA -0.143 4.277 4.420 -0.000 0.000 0.255 14 P C 0.436 177.757 177.300 0.036 0.000 1.161 14 P CA 0.945 64.069 63.100 0.039 0.000 0.768 14 P CB 0.288 32.008 31.700 0.033 0.000 0.746 15 G N 2.447 111.269 108.800 0.038 0.000 2.176 15 G HA2 -0.202 3.759 3.960 0.002 0.000 0.232 15 G HA3 -0.202 3.759 3.960 0.002 0.000 0.232 15 G C -0.044 174.877 174.900 0.034 0.000 0.986 15 G CA -0.218 44.904 45.100 0.036 0.000 0.643 15 G HN 0.495 8.785 8.290 -0.000 0.000 0.522 16 M N 0.570 120.185 119.600 0.026 0.000 2.456 16 M HA 0.550 5.031 4.480 0.002 0.000 0.324 16 M C -0.476 175.815 176.300 -0.015 0.000 1.124 16 M CA -0.826 54.482 55.300 0.014 0.000 0.959 16 M CB 1.837 34.442 32.600 0.009 0.000 1.692 16 M HN 0.104 8.394 8.290 -0.000 0.000 0.444 17 D N 0.879 121.280 120.400 0.002 0.000 2.437 17 D HA 0.555 5.197 4.640 0.002 0.000 0.259 17 D C 0.055 176.270 176.300 -0.141 0.000 1.118 17 D CA 0.020 54.023 54.000 0.005 0.000 1.017 17 D CB 1.354 42.252 40.800 0.163 0.000 1.120 17 D HN 0.679 9.049 8.370 -0.000 0.000 0.541 18 G N -0.006 108.609 108.800 -0.307 0.000 2.667 18 G HA2 0.331 4.293 3.960 0.002 0.000 0.250 18 G HA3 0.331 4.293 3.960 0.002 0.000 0.250 18 G C -2.211 172.723 174.900 0.056 0.000 1.212 18 G CA -0.801 43.930 45.100 -0.615 0.000 0.874 18 G HN 0.435 8.725 8.290 -0.000 0.000 0.561 19 P HA 0.223 4.643 4.420 -0.000 0.000 0.271 19 P C -0.914 176.555 177.300 0.282 0.000 1.218 19 P CA -0.043 63.163 63.100 0.177 0.000 0.780 19 P CB 1.082 32.873 31.700 0.152 0.000 0.901 20 K N 1.610 122.122 120.400 0.187 0.000 3.029 20 K HA 0.333 4.655 4.320 0.002 0.000 0.169 20 K C -0.965 175.698 176.600 0.105 0.000 1.090 20 K CA -0.482 55.886 56.287 0.135 0.000 0.883 20 K CB 1.190 33.742 32.500 0.086 0.000 1.080 20 K HN 0.217 8.467 8.250 -0.000 0.000 0.613 21 V N 1.506 121.487 119.914 0.111 0.000 2.427 21 V HA 0.264 4.386 4.120 0.002 0.000 0.286 21 V C 0.380 176.521 176.094 0.078 0.000 1.034 21 V CA -0.946 61.418 62.300 0.107 0.000 0.893 21 V CB 1.634 33.534 31.823 0.127 0.000 0.982 21 V HN 0.391 8.581 8.190 -0.000 0.000 0.452 22 K N 2.327 122.780 120.400 0.089 0.000 2.382 22 K HA 0.147 4.469 4.320 0.002 0.000 0.275 22 K C 0.086 176.708 176.600 0.037 0.000 1.009 22 K CA -0.140 56.187 56.287 0.067 0.000 0.970 22 K CB 0.459 33.013 32.500 0.091 0.000 0.934 22 K HN 0.679 8.929 8.250 -0.000 0.000 0.479 23 Q N 3.630 123.411 119.800 -0.030 0.000 2.286 23 Q HA 0.131 4.473 4.340 0.002 0.000 0.257 23 Q C -1.469 174.502 176.000 -0.048 0.000 0.941 23 Q CA -0.257 55.452 55.803 -0.158 0.000 0.912 23 Q CB 0.454 29.108 28.738 -0.141 0.000 1.192 23 Q HN 0.421 8.691 8.270 -0.000 0.000 0.410 24 W N 3.138 124.413 121.300 -0.042 0.000 2.332 24 W HA 0.708 5.370 4.660 0.003 0.000 0.351 24 W C -2.421 174.031 176.519 -0.111 0.000 1.195 24 W CA -2.900 54.393 57.345 -0.086 0.000 1.334 24 W CB -0.859 28.523 29.460 -0.129 0.000 1.206 24 W HN 0.549 8.729 8.180 -0.000 0.000 0.637 25 P HA 0.054 4.474 4.420 -0.000 0.000 0.264 25 P C -0.614 176.729 177.300 0.072 0.000 1.183 25 P CA 0.428 63.563 63.100 0.059 0.000 0.763 25 P CB 0.374 32.066 31.700 -0.013 0.000 0.807 26 L N 1.996 123.219 121.223 -0.001 0.000 2.354 26 L HA 0.474 4.816 4.340 0.002 0.000 0.269 26 L C 0.933 177.769 176.870 -0.057 0.000 1.005 26 L CA -0.902 53.924 54.840 -0.023 0.000 0.819 26 L CB 2.071 44.103 42.059 -0.046 0.000 1.311 26 L HN 0.335 8.565 8.230 -0.000 0.000 0.423 27 T N -2.934 111.577 114.554 -0.072 0.000 2.813 27 T HA 0.042 4.394 4.350 0.002 0.000 0.297 27 T C 0.918 175.569 174.700 -0.082 0.000 1.036 27 T CA -0.383 61.675 62.100 -0.069 0.000 1.044 27 T CB 1.347 70.184 68.868 -0.052 0.000 0.993 27 T HN 0.797 9.037 8.240 -0.000 0.000 0.535 28 E N 0.654 120.817 120.200 -0.061 0.000 2.118 28 E HA -0.254 4.098 4.350 0.002 0.000 0.195 28 E C 2.006 178.548 176.600 -0.097 0.000 0.992 28 E CA 1.744 58.106 56.400 -0.064 0.000 0.804 28 E CB -0.122 29.557 29.700 -0.036 0.000 0.741 28 E HN 0.914 9.274 8.360 -0.000 0.000 0.458 29 E N 0.490 120.632 120.200 -0.098 0.000 2.106 29 E HA -0.200 4.151 4.350 0.002 0.000 0.192 29 E C 1.908 178.268 176.600 -0.400 0.000 0.984 29 E CA 0.928 57.240 56.400 -0.147 0.000 0.806 29 E CB -0.154 29.537 29.700 -0.015 0.000 0.750 29 E HN 0.169 8.529 8.360 -0.000 0.000 0.458 30 K N 0.529 120.680 120.400 -0.414 0.000 2.155 30 K HA 0.027 4.349 4.320 0.002 0.000 0.203 30 K C 2.222 178.606 176.600 -0.360 0.000 1.052 30 K CA 0.921 56.870 56.287 -0.563 0.000 0.948 30 K CB -0.028 32.269 32.500 -0.338 0.000 0.728 30 K HN 0.201 8.451 8.250 -0.000 0.000 0.448 31 I N 1.507 121.944 120.570 -0.220 0.000 2.202 31 I HA -0.278 3.893 4.170 0.002 0.000 0.242 31 I C 2.615 178.645 176.117 -0.144 0.000 1.091 31 I CA 1.212 62.427 61.300 -0.143 0.000 1.368 31 I CB -0.183 37.761 38.000 -0.093 0.000 1.058 31 I HN 0.137 8.347 8.210 -0.000 0.000 0.410 32 K N 1.353 121.659 120.400 -0.156 0.000 2.063 32 K HA -0.213 4.108 4.320 0.002 0.000 0.208 32 K C 2.175 178.685 176.600 -0.150 0.000 1.048 32 K CA 1.594 57.808 56.287 -0.121 0.000 0.928 32 K CB -0.112 32.331 32.500 -0.094 0.000 0.713 32 K HN 0.300 8.550 8.250 -0.000 0.000 0.442 33 A N 1.220 123.865 122.820 -0.291 0.000 1.902 33 A HA -0.120 4.201 4.320 0.002 0.000 0.217 33 A C 2.103 179.588 177.584 -0.165 0.000 1.181 33 A CA 1.285 53.138 52.037 -0.306 0.000 0.623 33 A CB -0.546 17.973 19.000 -0.801 0.000 0.818 33 A HN 0.328 8.478 8.150 -0.000 0.000 0.443 34 L N -0.709 120.411 121.223 -0.172 0.000 2.093 34 L HA -0.126 4.215 4.340 0.002 0.000 0.208 34 L C 2.497 179.347 176.870 -0.033 0.000 1.085 34 L CA 0.759 55.548 54.840 -0.086 0.000 0.755 34 L CB -0.472 41.545 42.059 -0.070 0.000 0.904 34 L HN 0.238 8.468 8.230 -0.000 0.000 0.435 35 V N -0.003 119.894 119.914 -0.029 0.000 2.343 35 V HA -0.308 3.814 4.120 0.002 0.000 0.247 35 V C 2.481 178.573 176.094 -0.002 0.000 1.051 35 V CA 2.035 64.340 62.300 0.008 0.000 1.036 35 V CB -0.369 31.453 31.823 -0.002 0.000 0.654 35 V HN 0.498 8.688 8.190 -0.000 0.000 0.451 36 E N -0.076 120.114 120.200 -0.017 0.000 2.051 36 E HA -0.208 4.143 4.350 0.002 0.000 0.192 36 E C 2.194 178.787 176.600 -0.011 0.000 0.991 36 E CA 1.598 57.995 56.400 -0.006 0.000 0.799 36 E CB -0.139 29.564 29.700 0.006 0.000 0.748 36 E HN 0.609 8.969 8.360 -0.000 0.000 0.449 37 I N 0.390 120.951 120.570 -0.016 0.000 2.179 37 I HA -0.329 3.842 4.170 0.002 0.000 0.242 37 I C 2.541 178.606 176.117 -0.086 0.000 1.088 37 I CA 0.775 62.060 61.300 -0.025 0.000 1.357 37 I CB -0.248 37.748 38.000 -0.007 0.000 1.051 37 I HN 0.325 8.535 8.210 -0.000 0.000 0.409 38 C N 0.161 119.393 119.300 -0.114 0.000 2.435 38 C HA -0.122 4.339 4.460 0.002 0.000 0.279 38 C C 3.004 177.867 174.990 -0.212 0.000 1.321 38 C CA 1.236 60.100 59.018 -0.257 0.000 1.752 38 C CB -1.114 26.430 27.740 -0.327 0.000 1.959 38 C HN 0.514 8.744 8.230 -0.000 0.000 0.500 39 T N 0.815 115.327 114.554 -0.069 0.000 2.708 39 T HA -0.150 4.202 4.350 0.002 0.000 0.266 39 T C 1.689 176.359 174.700 -0.051 0.000 1.037 39 T CA 1.578 63.667 62.100 -0.018 0.000 1.146 39 T CB -0.230 68.641 68.868 0.006 0.000 0.865 39 T HN 0.478 8.719 8.240 -0.000 0.000 0.435 40 E N 0.908 121.073 120.200 -0.059 0.000 2.077 40 E HA 0.040 4.392 4.350 0.002 0.000 0.193 40 E C 2.104 178.645 176.600 -0.098 0.000 0.989 40 E CA 0.968 57.333 56.400 -0.059 0.000 0.800 40 E CB -0.368 29.308 29.700 -0.039 0.000 0.746 40 E HN 0.502 8.862 8.360 -0.000 0.000 0.452 41 M N -0.096 119.411 119.600 -0.155 0.000 2.296 41 M HA -0.135 4.347 4.480 0.002 0.000 0.265 41 M C 2.207 178.377 176.300 -0.217 0.000 1.064 41 M CA 1.232 56.394 55.300 -0.230 0.000 1.109 41 M CB -0.085 32.315 32.600 -0.334 0.000 1.396 41 M HN 0.107 8.397 8.290 -0.000 0.000 0.430 42 E N 0.884 120.974 120.200 -0.182 0.000 2.072 42 E HA -0.168 4.184 4.350 0.002 0.000 0.190 42 E C 1.774 178.335 176.600 -0.064 0.000 0.982 42 E CA 1.017 57.351 56.400 -0.111 0.000 0.803 42 E CB 0.194 29.885 29.700 -0.014 0.000 0.755 42 E HN 0.423 8.783 8.360 -0.000 0.000 0.453 43 K N 0.448 120.815 120.400 -0.054 0.000 2.103 43 K HA -0.148 4.173 4.320 0.002 0.000 0.207 43 K C 1.680 178.255 176.600 -0.042 0.000 1.048 43 K CA 1.453 57.718 56.287 -0.036 0.000 0.930 43 K CB -0.021 32.462 32.500 -0.029 0.000 0.716 43 K HN 0.179 8.429 8.250 -0.000 0.000 0.444 44 E N -0.390 119.772 120.200 -0.062 0.000 2.494 44 E HA 0.007 4.359 4.350 0.002 0.000 0.193 44 E C 0.784 177.347 176.600 -0.062 0.000 1.074 44 E CA 0.228 56.593 56.400 -0.058 0.000 0.867 44 E CB 0.250 29.907 29.700 -0.072 0.000 0.924 44 E HN 0.490 8.850 8.360 -0.000 0.000 0.502 45 G N 1.887 110.647 108.800 -0.067 0.000 2.189 45 G HA2 -0.403 3.558 3.960 0.002 0.000 0.267 45 G HA3 -0.403 3.558 3.960 0.002 0.000 0.267 45 G C 0.951 175.801 174.900 -0.083 0.000 0.975 45 G CA 0.937 46.003 45.100 -0.056 0.000 0.644 45 G HN 0.310 8.600 8.290 -0.000 0.000 0.537 46 K N -0.235 120.071 120.400 -0.156 0.000 2.148 46 K HA 0.183 4.505 4.320 0.002 0.000 0.204 46 K C 1.497 177.941 176.600 -0.260 0.000 1.050 46 K CA 1.475 57.627 56.287 -0.225 0.000 0.942 46 K CB -0.003 32.224 32.500 -0.455 0.000 0.724 46 K HN 0.830 9.080 8.250 -0.000 0.000 0.446 47 I N -3.880 116.515 120.570 -0.292 0.000 3.074 47 I HA 0.431 4.603 4.170 0.002 0.000 0.310 47 I C -1.040 175.016 176.117 -0.102 0.000 1.153 47 I CA -1.020 60.100 61.300 -0.299 0.000 0.993 47 I CB 2.596 40.277 38.000 -0.532 0.000 1.237 47 I HN -0.340 7.870 8.210 -0.000 0.000 0.443 48 S N 1.629 117.331 115.700 0.002 0.000 2.540 48 S HA 0.434 4.906 4.470 0.002 0.000 0.275 48 S C -0.855 173.784 174.600 0.065 0.000 1.123 48 S CA -0.935 57.297 58.200 0.053 0.000 0.907 48 S CB 1.901 65.097 63.200 -0.007 0.000 1.081 48 S HN 0.465 8.775 8.310 -0.000 0.000 0.476 49 K N 2.226 122.607 120.400 -0.031 0.000 2.380 49 K HA 0.280 4.601 4.320 0.002 0.000 0.267 49 K C 0.116 176.608 176.600 -0.180 0.000 0.990 49 K CA 0.190 56.320 56.287 -0.262 0.000 0.946 49 K CB 0.127 32.460 32.500 -0.278 0.000 0.937 49 K HN 0.691 8.941 8.250 -0.000 0.000 0.491 50 I N -2.585 117.853 120.570 -0.219 0.000 2.892 50 I HA 0.590 4.761 4.170 0.002 0.000 0.306 50 I C 0.317 176.347 176.117 -0.145 0.000 1.078 50 I CA -1.133 60.078 61.300 -0.148 0.000 1.032 50 I CB 2.128 40.052 38.000 -0.126 0.000 1.229 50 I HN 0.473 8.683 8.210 -0.000 0.000 0.435 51 G N 1.507 110.243 108.800 -0.106 0.000 2.557 51 G HA2 0.546 4.507 3.960 0.002 0.000 0.302 51 G HA3 0.546 4.507 3.960 0.002 0.000 0.302 51 G C -1.829 173.018 174.900 -0.089 0.000 1.311 51 G CA -1.348 43.694 45.100 -0.096 0.000 1.030 51 G HN 0.603 8.893 8.290 -0.000 0.000 0.509 52 P HA -0.049 4.371 4.420 -0.000 0.000 0.234 52 P C 1.087 178.344 177.300 -0.071 0.000 1.167 52 P CA 0.767 63.821 63.100 -0.076 0.000 0.763 52 P CB 0.297 31.956 31.700 -0.069 0.000 0.835 53 E N -0.399 119.763 120.200 -0.063 0.000 2.482 53 E HA -0.077 4.275 4.350 0.002 0.000 0.196 53 E C 0.297 176.860 176.600 -0.061 0.000 1.047 53 E CA 0.254 56.620 56.400 -0.057 0.000 0.869 53 E CB -0.731 28.943 29.700 -0.043 0.000 0.836 53 E HN 0.125 8.485 8.360 -0.000 0.000 0.520 54 N N 2.254 120.917 118.700 -0.062 0.000 2.439 54 N HA 0.115 4.856 4.740 0.002 0.000 0.249 54 N C -1.780 173.665 175.510 -0.109 0.000 1.003 54 N CA -1.837 51.189 53.050 -0.040 0.000 0.942 54 N CB 1.656 40.141 38.487 -0.004 0.000 1.115 54 N HN -0.079 8.301 8.380 -0.000 0.000 0.505 55 P HA 0.073 4.493 4.420 -0.000 0.000 0.252 55 P C -0.219 176.891 177.300 -0.316 0.000 1.218 55 P CA 0.160 63.065 63.100 -0.326 0.000 0.807 55 P CB 0.313 31.759 31.700 -0.423 0.000 1.072 56 Y N 1.140 121.460 120.300 0.033 0.000 2.330 56 Y HA 0.354 4.906 4.550 0.002 0.000 0.341 56 Y C 1.079 177.007 175.900 0.048 0.000 1.278 56 Y CA 0.208 58.344 58.100 0.059 0.000 1.453 56 Y CB 0.160 38.687 38.460 0.111 0.000 1.342 56 Y HN -0.065 8.215 8.280 -0.000 0.000 0.590 57 N N -1.126 117.720 118.700 0.243 0.000 2.710 57 N HA 0.358 5.099 4.740 0.002 0.000 0.257 57 N C -1.918 173.681 175.510 0.148 0.000 1.140 57 N CA -0.486 52.659 53.050 0.159 0.000 0.953 57 N CB 1.768 40.304 38.487 0.082 0.000 1.664 57 N HN 0.540 8.920 8.380 -0.000 0.000 0.497 58 T N 2.619 117.247 114.554 0.124 0.000 2.886 58 T HA 0.582 4.934 4.350 0.002 0.000 0.292 58 T C -2.761 171.899 174.700 -0.066 0.000 1.012 58 T CA -0.969 61.159 62.100 0.047 0.000 0.982 58 T CB 1.999 70.881 68.868 0.023 0.000 1.018 58 T HN 0.288 8.528 8.240 -0.000 0.000 0.451 59 P HA 0.366 4.786 4.420 -0.000 0.000 0.269 59 P C -1.029 176.025 177.300 -0.410 0.000 1.215 59 P CA -0.410 62.418 63.100 -0.453 0.000 0.780 59 P CB 0.668 31.857 31.700 -0.852 0.000 0.898 60 V N 3.585 123.242 119.914 -0.427 0.000 3.007 60 V HA 0.849 4.970 4.120 0.002 0.000 0.311 60 V C -1.107 174.935 176.094 -0.086 0.000 1.120 60 V CA -0.578 61.572 62.300 -0.249 0.000 0.980 60 V CB 1.312 32.984 31.823 -0.252 0.000 1.033 60 V HN 0.635 8.825 8.190 -0.000 0.000 0.429 61 F N 2.857 122.672 119.950 -0.226 0.000 3.090 61 F HA 0.992 5.520 4.527 0.003 0.000 0.324 61 F C -0.759 175.009 175.800 -0.053 0.000 1.189 61 F CA -0.609 57.318 58.000 -0.121 0.000 0.907 61 F CB 1.199 40.210 39.000 0.020 0.000 1.445 61 F HN 0.774 9.074 8.300 -0.000 0.000 0.500 62 A N 0.968 123.814 122.820 0.043 0.000 2.475 62 A HA 0.883 5.204 4.320 0.002 0.000 0.301 62 A C -1.087 176.672 177.584 0.292 0.000 1.059 62 A CA -0.594 51.451 52.037 0.013 0.000 0.710 62 A CB 1.537 20.483 19.000 -0.089 0.000 1.288 62 A HN 1.280 9.430 8.150 -0.000 0.000 0.408 63 I N -2.101 118.658 120.570 0.315 0.000 3.322 63 I HA 0.735 4.906 4.170 0.002 0.000 0.313 63 I C -1.030 175.183 176.117 0.160 0.000 1.129 63 I CA -1.168 60.317 61.300 0.309 0.000 0.963 63 I CB 2.400 40.495 38.000 0.157 0.000 1.273 63 I HN 0.450 8.660 8.210 -0.000 0.000 0.473 64 K N 2.352 122.705 120.400 -0.078 0.000 2.502 64 K HA 0.451 4.773 4.320 0.002 0.000 0.254 64 K C -0.868 175.592 176.600 -0.234 0.000 0.947 64 K CA -0.818 55.306 56.287 -0.272 0.000 0.834 64 K CB 2.469 34.678 32.500 -0.485 0.000 1.112 64 K HN 0.506 8.756 8.250 -0.000 0.000 0.427 65 K N 1.306 121.531 120.400 -0.291 0.000 2.400 65 K HA 0.134 4.456 4.320 0.002 0.000 0.253 65 K C 0.067 176.479 176.600 -0.313 0.000 1.076 65 K CA -0.329 55.768 56.287 -0.316 0.000 0.887 65 K CB 0.348 32.620 32.500 -0.380 0.000 1.168 65 K HN 0.259 8.509 8.250 -0.000 0.000 0.505 66 K N 2.715 122.908 120.400 -0.345 0.000 2.367 66 K HA -0.099 4.223 4.320 0.002 0.000 0.275 66 K C -0.688 175.749 176.600 -0.271 0.000 1.125 66 K CA 0.757 56.855 56.287 -0.316 0.000 1.133 66 K CB -0.623 31.661 32.500 -0.359 0.000 0.875 66 K HN 0.542 8.792 8.250 -0.000 0.000 0.467 67 D N 0.464 120.749 120.400 -0.192 0.000 2.701 67 D HA -0.180 4.461 4.640 0.002 0.000 0.235 67 D C -0.465 175.805 176.300 -0.048 0.000 1.155 67 D CA 1.165 55.093 54.000 -0.120 0.000 0.649 67 D CB -0.559 40.181 40.800 -0.100 0.000 1.050 67 D HN 0.468 8.838 8.370 -0.000 0.000 0.425 68 S N -1.692 113.954 115.700 -0.090 0.000 2.599 68 S HA 0.673 5.145 4.470 0.002 0.000 0.287 68 S C 0.729 175.247 174.600 -0.137 0.000 1.105 68 S CA -0.019 58.178 58.200 -0.004 0.000 0.899 68 S CB 1.629 64.814 63.200 -0.026 0.000 1.100 68 S HN 0.163 8.473 8.310 -0.000 0.000 0.482 69 T N -0.145 114.334 114.554 -0.125 0.000 3.214 69 T HA 0.366 4.717 4.350 0.002 0.000 0.264 69 T C 0.063 174.614 174.700 -0.248 0.000 1.012 69 T CA -0.311 61.664 62.100 -0.208 0.000 0.901 69 T CB -0.325 68.462 68.868 -0.135 0.000 1.070 69 T HN 0.441 8.681 8.240 -0.000 0.000 0.561 70 K N 0.964 121.241 120.400 -0.205 0.000 2.235 70 K HA 0.392 4.713 4.320 0.002 0.000 0.266 70 K C -1.029 175.526 176.600 -0.074 0.000 0.980 70 K CA -0.997 55.242 56.287 -0.080 0.000 0.849 70 K CB 0.835 33.374 32.500 0.066 0.000 1.098 70 K HN 0.324 8.574 8.250 -0.000 0.000 0.445 71 W N 3.487 124.820 121.300 0.054 0.000 2.181 71 W HA 0.139 4.800 4.660 0.002 0.000 0.335 71 W C 0.728 177.325 176.519 0.130 0.000 1.310 71 W CA -0.224 57.153 57.345 0.054 0.000 1.226 71 W CB 0.538 30.023 29.460 0.042 0.000 1.155 71 W HN 0.401 8.581 8.180 -0.000 0.000 0.565 72 R N 3.123 123.857 120.500 0.391 0.000 2.670 72 R HA 0.304 4.646 4.340 0.002 0.000 0.289 72 R C -0.708 175.691 176.300 0.165 0.000 0.965 72 R CA -0.997 55.304 56.100 0.336 0.000 0.899 72 R CB 1.294 31.812 30.300 0.363 0.000 1.173 72 R HN 0.482 8.752 8.270 -0.000 0.000 0.456 73 K N 4.047 124.504 120.400 0.094 0.000 2.234 73 K HA 0.233 4.554 4.320 0.002 0.000 0.282 73 K C -1.389 175.145 176.600 -0.110 0.000 1.039 73 K CA -0.504 55.757 56.287 -0.043 0.000 0.928 73 K CB 0.822 33.292 32.500 -0.050 0.000 1.039 73 K HN 0.329 8.579 8.250 -0.000 0.000 0.470 74 L N 5.420 126.462 121.223 -0.302 0.000 2.406 74 L HA 0.356 4.698 4.340 0.002 0.000 0.272 74 L C -1.531 175.114 176.870 -0.376 0.000 0.980 74 L CA -0.615 54.014 54.840 -0.352 0.000 0.831 74 L CB 1.881 43.571 42.059 -0.616 0.000 1.253 74 L HN 0.415 8.645 8.230 -0.000 0.000 0.406 75 V N 3.673 123.419 119.914 -0.280 0.000 2.439 75 V HA 0.320 4.441 4.120 0.002 0.000 0.282 75 V C -0.324 175.584 176.094 -0.310 0.000 1.039 75 V CA -0.595 61.422 62.300 -0.472 0.000 0.913 75 V CB 1.550 32.810 31.823 -0.938 0.000 0.983 75 V HN 0.748 8.938 8.190 -0.000 0.000 0.460 76 D N 3.713 124.019 120.400 -0.156 0.000 2.517 76 D HA 0.186 4.828 4.640 0.002 0.000 0.220 76 D C 0.360 176.681 176.300 0.035 0.000 1.158 76 D CA -0.186 53.887 54.000 0.121 0.000 0.992 76 D CB -0.111 40.911 40.800 0.370 0.000 1.058 76 D HN 0.452 8.822 8.370 -0.000 0.000 0.516 77 F N 1.626 121.693 119.950 0.194 0.000 2.695 77 F HA 0.190 4.719 4.527 0.002 0.000 0.301 77 F C 2.143 178.054 175.800 0.185 0.000 1.182 77 F CA -0.411 57.702 58.000 0.188 0.000 1.412 77 F CB 0.205 39.340 39.000 0.226 0.000 1.056 77 F HN 0.169 8.469 8.300 -0.000 0.000 0.522 78 R N 0.284 120.965 120.500 0.303 0.000 2.091 78 R HA -0.218 4.123 4.340 0.002 0.000 0.238 78 R C 2.078 178.489 176.300 0.184 0.000 1.136 78 R CA 1.721 57.944 56.100 0.205 0.000 0.959 78 R CB -0.206 30.159 30.300 0.107 0.000 0.856 78 R HN 0.204 8.474 8.270 -0.000 0.000 0.437 79 E N 0.838 121.153 120.200 0.192 0.000 2.047 79 E HA -0.156 4.196 4.350 0.002 0.000 0.191 79 E C 1.743 178.453 176.600 0.183 0.000 0.987 79 E CA 0.814 57.311 56.400 0.161 0.000 0.799 79 E CB -0.215 29.576 29.700 0.152 0.000 0.752 79 E HN 0.119 8.479 8.360 -0.000 0.000 0.449 80 L N 0.933 122.310 121.223 0.257 0.000 2.083 80 L HA -0.139 4.202 4.340 0.002 0.000 0.209 80 L C 1.544 178.595 176.870 0.302 0.000 1.083 80 L CA 1.737 56.736 54.840 0.263 0.000 0.752 80 L CB -0.712 41.554 42.059 0.345 0.000 0.899 80 L HN 0.112 8.342 8.230 -0.000 0.000 0.433 81 N N 0.722 119.602 118.700 0.301 0.000 2.142 81 N HA -0.194 4.547 4.740 0.002 0.000 0.186 81 N C 1.561 177.160 175.510 0.149 0.000 1.023 81 N CA 1.774 54.956 53.050 0.220 0.000 0.852 81 N CB -0.333 38.254 38.487 0.167 0.000 0.998 81 N HN 0.610 8.990 8.380 -0.000 0.000 0.424 82 K N 0.436 120.913 120.400 0.127 0.000 2.555 82 K HA 0.081 4.402 4.320 0.002 0.000 0.193 82 K C 1.199 177.855 176.600 0.093 0.000 1.032 82 K CA 0.734 57.075 56.287 0.090 0.000 1.004 82 K CB 0.187 32.728 32.500 0.068 0.000 0.804 82 K HN 0.051 8.301 8.250 -0.000 0.000 0.496 83 R N 0.431 121.003 120.500 0.120 0.000 2.404 83 R HA 0.121 4.462 4.340 0.002 0.000 0.237 83 R C -0.233 176.157 176.300 0.151 0.000 0.907 83 R CA -0.003 56.156 56.100 0.097 0.000 1.063 83 R CB 0.982 31.311 30.300 0.049 0.000 1.134 83 R HN 0.015 8.285 8.270 -0.000 0.000 0.529 84 T N 3.004 117.698 114.554 0.234 0.000 2.749 84 T HA 0.047 4.399 4.350 0.002 0.000 0.295 84 T C -0.261 174.576 174.700 0.229 0.000 0.936 84 T CA -0.409 61.897 62.100 0.343 0.000 1.060 84 T CB 1.135 70.297 68.868 0.490 0.000 0.904 84 T HN 0.238 8.478 8.240 -0.000 0.000 0.500 85 Q N 3.057 122.974 119.800 0.196 0.000 2.398 85 Q HA -0.067 4.275 4.340 0.002 0.000 0.329 85 Q C -0.691 175.349 176.000 0.067 0.000 1.079 85 Q CA -0.039 55.811 55.803 0.078 0.000 1.041 85 Q CB 0.166 28.884 28.738 -0.035 0.000 1.084 85 Q HN 0.463 8.733 8.270 -0.000 0.000 0.386 86 D N 2.940 123.371 120.400 0.052 0.000 2.554 86 D HA -0.084 4.558 4.640 0.002 0.000 0.251 86 D C -0.747 175.529 176.300 -0.041 0.000 1.213 86 D CA 0.695 54.706 54.000 0.018 0.000 0.900 86 D CB 0.129 40.982 40.800 0.088 0.000 1.135 86 D HN 0.453 8.823 8.370 -0.000 0.000 0.522 87 F N 2.340 122.164 119.950 -0.211 0.000 2.619 87 F HA 0.110 4.638 4.527 0.002 0.000 0.350 87 F C 0.294 175.969 175.800 -0.208 0.000 1.259 87 F CA -0.597 57.288 58.000 -0.193 0.000 1.204 87 F CB -0.039 38.792 39.000 -0.282 0.000 1.556 87 F HN 0.288 8.588 8.300 -0.000 0.000 0.650 88 W N 3.517 124.788 121.300 -0.049 0.000 2.497 88 W HA 0.266 4.927 4.660 0.002 0.000 0.354 88 W C 0.576 177.088 176.519 -0.012 0.000 1.111 88 W CA -0.681 56.655 57.345 -0.016 0.000 1.510 88 W CB -0.001 29.436 29.460 -0.038 0.000 1.466 88 W HN 0.387 8.567 8.180 -0.000 0.000 0.409 89 E N 0.542 120.858 120.200 0.194 0.000 4.127 89 E HA 0.047 4.399 4.350 0.002 0.000 0.334 89 E C 0.897 177.581 176.600 0.140 0.000 1.483 89 E CA -0.440 56.048 56.400 0.145 0.000 1.817 89 E CB -0.114 29.644 29.700 0.096 0.000 1.406 89 E HN 0.126 8.486 8.360 -0.000 0.000 0.813 90 V N 0.907 120.875 119.914 0.091 0.000 3.630 90 V HA -0.103 4.019 4.120 0.002 0.000 0.273 90 V C 1.582 177.724 176.094 0.080 0.000 1.248 90 V CA 1.178 63.522 62.300 0.073 0.000 1.170 90 V CB -1.530 30.318 31.823 0.043 0.000 0.899 90 V HN 0.510 8.700 8.190 -0.000 0.000 0.457 91 Q N -0.075 119.785 119.800 0.101 0.000 2.424 91 Q HA 0.126 4.467 4.340 0.002 0.000 0.204 91 Q C 1.405 177.498 176.000 0.155 0.000 0.933 91 Q CA 0.408 56.271 55.803 0.100 0.000 0.929 91 Q CB 0.053 28.835 28.738 0.073 0.000 1.037 91 Q HN 0.420 8.690 8.270 -0.000 0.000 0.511 92 L N -0.183 121.183 121.223 0.239 0.000 4.884 92 L HA -0.245 4.096 4.340 0.002 0.000 0.430 92 L C 0.364 177.543 176.870 0.515 0.000 1.087 92 L CA 0.620 55.656 54.840 0.326 0.000 1.033 92 L CB -1.529 40.631 42.059 0.168 0.000 2.030 92 L HN 0.661 8.891 8.230 -0.000 0.000 0.762 93 G N 0.448 109.446 108.800 0.330 0.000 3.292 93 G HA2 -0.205 3.757 3.960 0.002 0.000 0.636 93 G HA3 -0.205 3.757 3.960 0.002 0.000 0.636 93 G C -0.237 174.754 174.900 0.151 0.000 1.069 93 G CA -0.293 44.889 45.100 0.137 0.000 0.890 93 G HN 0.251 8.541 8.290 -0.000 0.000 0.427 94 I N 4.721 125.353 120.570 0.104 0.000 2.671 94 I HA 0.085 4.257 4.170 0.002 0.000 0.285 94 I C -0.776 175.427 176.117 0.143 0.000 1.148 94 I CA -1.056 60.316 61.300 0.120 0.000 1.386 94 I CB 0.503 38.576 38.000 0.122 0.000 1.406 94 I HN 0.345 8.555 8.210 -0.000 0.000 0.540 95 P HA -0.114 4.306 4.420 -0.000 0.000 0.257 95 P C -0.144 177.215 177.300 0.097 0.000 1.189 95 P CA 0.048 63.224 63.100 0.127 0.000 0.780 95 P CB 0.053 31.812 31.700 0.097 0.000 0.772 96 H N 6.684 125.787 119.070 0.055 0.000 3.209 96 H HA -0.054 4.503 4.556 0.003 0.000 0.297 96 H C -1.337 173.927 175.328 -0.107 0.000 0.936 96 H CA -0.553 55.463 56.048 -0.053 0.000 1.392 96 H CB -0.116 29.594 29.762 -0.087 0.000 1.349 96 H HN 0.328 8.608 8.280 -0.000 0.000 0.568 97 P HA 0.026 4.446 4.420 -0.000 0.000 0.263 97 P C 0.051 177.015 177.300 -0.559 0.000 1.345 97 P CA 0.301 63.077 63.100 -0.540 0.000 1.119 97 P CB 0.112 31.562 31.700 -0.417 0.000 1.363 98 A N 3.366 126.012 122.820 -0.289 0.000 2.259 98 A HA -0.007 4.314 4.320 0.002 0.000 0.212 98 A C 2.060 179.544 177.584 -0.168 0.000 1.178 98 A CA 1.475 53.411 52.037 -0.169 0.000 0.734 98 A CB -0.831 18.130 19.000 -0.064 0.000 0.774 98 A HN 0.517 8.666 8.150 -0.000 0.000 0.481 99 G N -1.238 107.453 108.800 -0.182 0.000 2.921 99 G HA2 0.198 4.159 3.960 0.002 0.000 0.213 99 G HA3 0.198 4.159 3.960 0.002 0.000 0.213 99 G C 1.192 175.997 174.900 -0.158 0.000 1.143 99 G CA 0.574 45.590 45.100 -0.141 0.000 0.764 99 G HN 0.422 8.712 8.290 -0.000 0.000 0.542 100 L N 1.779 122.878 121.223 -0.207 0.000 2.083 100 L HA 0.011 4.352 4.340 0.002 0.000 0.209 100 L C 2.780 179.519 176.870 -0.218 0.000 1.083 100 L CA 2.438 57.167 54.840 -0.184 0.000 0.752 100 L CB -0.332 41.590 42.059 -0.227 0.000 0.899 100 L HN 0.372 8.602 8.230 -0.000 0.000 0.433 101 K N -0.978 119.268 120.400 -0.257 0.000 2.283 101 K HA -0.138 4.184 4.320 0.002 0.000 0.202 101 K C 1.776 178.188 176.600 -0.314 0.000 1.048 101 K CA 1.433 57.520 56.287 -0.334 0.000 0.948 101 K CB -0.299 32.022 32.500 -0.298 0.000 0.742 101 K HN 0.302 8.552 8.250 -0.000 0.000 0.458 102 K N 0.776 121.048 120.400 -0.215 0.000 2.314 102 K HA 0.081 4.402 4.320 0.002 0.000 0.198 102 K C 0.065 176.574 176.600 -0.153 0.000 1.045 102 K CA 0.148 56.335 56.287 -0.166 0.000 0.988 102 K CB 0.218 32.649 32.500 -0.115 0.000 0.783 102 K HN -0.028 8.222 8.250 -0.000 0.000 0.484 103 K N 2.006 122.316 120.400 -0.150 0.000 2.448 103 K HA -0.004 4.317 4.320 0.002 0.000 0.278 103 K C 0.896 177.424 176.600 -0.121 0.000 1.009 103 K CA 0.279 56.504 56.287 -0.103 0.000 0.995 103 K CB 0.602 33.065 32.500 -0.063 0.000 0.917 103 K HN -0.060 8.190 8.250 -0.000 0.000 0.481 104 K N 1.034 121.391 120.400 -0.071 0.000 2.077 104 K HA -0.123 4.199 4.320 0.002 0.000 0.213 104 K C 0.511 177.089 176.600 -0.037 0.000 1.051 104 K CA 1.456 57.709 56.287 -0.056 0.000 0.929 104 K CB -0.025 32.457 32.500 -0.030 0.000 0.715 104 K HN 0.473 8.723 8.250 -0.000 0.000 0.451 105 S N -0.868 114.785 115.700 -0.079 0.000 2.564 105 S HA 0.511 4.982 4.470 0.002 0.000 0.274 105 S C -1.076 173.440 174.600 -0.140 0.000 1.124 105 S CA -0.873 57.214 58.200 -0.188 0.000 0.869 105 S CB 2.938 65.933 63.200 -0.340 0.000 1.105 105 S HN -0.087 8.223 8.310 -0.000 0.000 0.472 106 V N 1.897 121.704 119.914 -0.178 0.000 2.668 106 V HA 0.547 4.668 4.120 0.002 0.000 0.304 106 V C -0.584 175.512 176.094 0.004 0.000 1.071 106 V CA -0.518 61.787 62.300 0.009 0.000 0.894 106 V CB 2.237 34.071 31.823 0.019 0.000 1.008 106 V HN 0.936 9.126 8.190 -0.000 0.000 0.425 107 T N 3.941 118.569 114.554 0.124 0.000 2.824 107 T HA 0.614 4.965 4.350 0.002 0.000 0.280 107 T C -0.432 174.264 174.700 -0.007 0.000 0.995 107 T CA -0.422 61.706 62.100 0.046 0.000 1.009 107 T CB 1.775 70.701 68.868 0.098 0.000 0.955 107 T HN 0.356 8.596 8.240 -0.000 0.000 0.452 108 V N 4.752 124.638 119.914 -0.045 0.000 2.370 108 V HA 0.450 4.572 4.120 0.002 0.000 0.283 108 V C -0.245 175.769 176.094 -0.135 0.000 1.023 108 V CA -0.743 61.443 62.300 -0.190 0.000 0.857 108 V CB 0.940 32.698 31.823 -0.107 0.000 0.985 108 V HN 0.692 8.882 8.190 -0.000 0.000 0.443 109 L N 3.510 124.625 121.223 -0.181 0.000 2.317 109 L HA 0.559 4.901 4.340 0.002 0.000 0.281 109 L C -0.303 176.483 176.870 -0.140 0.000 1.024 109 L CA -0.611 54.147 54.840 -0.135 0.000 0.810 109 L CB 1.891 43.876 42.059 -0.122 0.000 1.240 109 L HN 0.530 8.760 8.230 -0.000 0.000 0.427 110 D N 2.057 122.392 120.400 -0.108 0.000 2.411 110 D HA 0.219 4.860 4.640 0.002 0.000 0.225 110 D C 0.395 176.602 176.300 -0.156 0.000 1.156 110 D CA -0.303 53.634 54.000 -0.104 0.000 0.874 110 D CB 1.402 42.190 40.800 -0.020 0.000 1.034 110 D HN 0.273 8.643 8.370 -0.000 0.000 0.502 111 V N 1.981 121.750 119.914 -0.243 0.000 3.271 111 V HA 0.431 4.552 4.120 0.002 0.000 0.327 111 V C 1.728 177.459 176.094 -0.604 0.000 1.389 111 V CA 0.278 62.376 62.300 -0.337 0.000 1.156 111 V CB 0.334 31.988 31.823 -0.283 0.000 1.103 111 V HN 0.427 8.617 8.190 -0.000 0.000 0.453 112 G N 0.450 108.895 108.800 -0.593 0.000 2.469 112 G HA2 -0.260 3.701 3.960 0.002 0.000 0.220 112 G HA3 -0.260 3.701 3.960 0.002 0.000 0.220 112 G C 1.181 175.521 174.900 -0.932 0.000 1.136 112 G CA 1.198 45.806 45.100 -0.819 0.000 0.759 112 G HN 0.505 8.795 8.290 -0.000 0.000 0.562 113 D N 0.890 120.866 120.400 -0.708 0.000 2.158 113 D HA -0.153 4.488 4.640 0.002 0.000 0.197 113 D C 2.846 178.823 176.300 -0.537 0.000 0.995 113 D CA 1.227 54.841 54.000 -0.644 0.000 0.846 113 D CB -0.178 40.425 40.800 -0.329 0.000 0.941 113 D HN 0.298 8.668 8.370 -0.000 0.000 0.456 114 A N 0.445 122.937 122.820 -0.546 0.000 1.927 114 A HA -0.247 4.075 4.320 0.002 0.000 0.220 114 A C 2.089 179.336 177.584 -0.561 0.000 1.185 114 A CA 1.381 53.108 52.037 -0.516 0.000 0.639 114 A CB -1.387 17.208 19.000 -0.675 0.000 0.820 114 A HN 0.452 8.602 8.150 -0.000 0.000 0.451 115 Y N -1.380 118.482 120.300 -0.730 0.000 2.193 115 Y HA -0.274 4.277 4.550 0.002 0.000 0.285 115 Y C 2.069 177.902 175.900 -0.111 0.000 1.166 115 Y CA 0.850 58.635 58.100 -0.525 0.000 1.181 115 Y CB -0.513 37.685 38.460 -0.438 0.000 0.976 115 Y HN 0.375 8.655 8.280 -0.000 0.000 0.520 116 F N -0.193 119.782 119.950 0.043 0.000 2.664 116 F HA -0.168 4.360 4.527 0.002 0.000 0.297 116 F C 2.201 178.040 175.800 0.066 0.000 1.164 116 F CA 0.410 58.451 58.000 0.069 0.000 1.472 116 F CB -0.155 38.871 39.000 0.044 0.000 1.108 116 F HN 0.110 8.410 8.300 -0.000 0.000 0.596 117 S N -1.208 114.628 115.700 0.227 0.000 2.535 117 S HA 0.134 4.605 4.470 0.002 0.000 0.214 117 S C 0.239 174.965 174.600 0.210 0.000 0.980 117 S CA -0.233 58.085 58.200 0.196 0.000 0.907 117 S CB -0.215 63.098 63.200 0.189 0.000 0.790 117 S HN -0.060 8.250 8.310 -0.000 0.000 0.510 118 V N 4.901 124.953 119.914 0.229 0.000 2.398 118 V HA 0.489 4.611 4.120 0.002 0.000 0.286 118 V C -2.299 173.905 176.094 0.182 0.000 1.026 118 V CA -2.206 60.227 62.300 0.221 0.000 0.868 118 V CB 1.590 33.581 31.823 0.279 0.000 0.982 118 V HN 0.285 8.475 8.190 -0.000 0.000 0.443 119 P HA 0.208 4.628 4.420 -0.000 0.000 0.274 119 P C -0.810 176.565 177.300 0.125 0.000 1.231 119 P CA -0.391 62.785 63.100 0.128 0.000 0.790 119 P CB 1.505 33.266 31.700 0.102 0.000 0.951 120 L N 2.070 123.364 121.223 0.119 0.000 2.334 120 L HA 0.372 4.714 4.340 0.002 0.000 0.275 120 L C 0.045 176.977 176.870 0.103 0.000 1.036 120 L CA -0.550 54.355 54.840 0.109 0.000 0.807 120 L CB 0.636 42.752 42.059 0.095 0.000 1.231 120 L HN 0.253 8.483 8.230 -0.000 0.000 0.438 121 D N 2.244 122.713 120.400 0.114 0.000 2.479 121 D HA -0.087 4.554 4.640 0.002 0.000 0.257 121 D C 1.149 177.520 176.300 0.119 0.000 1.230 121 D CA 0.539 54.611 54.000 0.120 0.000 0.912 121 D CB 0.795 41.678 40.800 0.137 0.000 1.130 121 D HN 0.658 9.028 8.370 -0.000 0.000 0.515 122 E N 3.093 123.339 120.200 0.077 0.000 2.136 122 E HA -0.284 4.067 4.350 0.002 0.000 0.202 122 E C 0.834 177.444 176.600 0.017 0.000 1.019 122 E CA 2.003 58.429 56.400 0.043 0.000 0.819 122 E CB 0.017 29.736 29.700 0.032 0.000 0.739 122 E HN 0.632 8.992 8.360 -0.000 0.000 0.458 123 D N -1.352 119.074 120.400 0.043 0.000 2.312 123 D HA -0.112 4.529 4.640 0.002 0.000 0.211 123 D C 1.284 177.549 176.300 -0.057 0.000 0.964 123 D CA 0.542 54.544 54.000 0.002 0.000 0.877 123 D CB -0.088 40.747 40.800 0.058 0.000 0.924 123 D HN 0.266 8.636 8.370 -0.000 0.000 0.515 124 F N 1.643 121.515 119.950 -0.129 0.000 2.582 124 F HA 0.123 4.651 4.527 0.002 0.000 0.290 124 F C 2.164 177.812 175.800 -0.253 0.000 1.115 124 F CA 0.070 57.979 58.000 -0.152 0.000 1.445 124 F CB 0.196 39.186 39.000 -0.016 0.000 1.126 124 F HN -0.287 8.013 8.300 -0.000 0.000 0.574 125 R N 1.133 121.570 120.500 -0.105 0.000 2.134 125 R HA -0.271 4.071 4.340 0.002 0.000 0.248 125 R C 2.194 178.366 176.300 -0.214 0.000 1.143 125 R CA 2.323 58.358 56.100 -0.108 0.000 0.957 125 R CB -0.845 29.439 30.300 -0.027 0.000 0.867 125 R HN 0.378 8.648 8.270 -0.000 0.000 0.441 126 K N 0.161 120.360 120.400 -0.334 0.000 2.228 126 K HA -0.218 4.104 4.320 0.002 0.000 0.205 126 K C 1.591 178.023 176.600 -0.280 0.000 1.045 126 K CA 1.929 58.045 56.287 -0.286 0.000 0.931 126 K CB -0.517 31.788 32.500 -0.325 0.000 0.727 126 K HN 0.410 8.660 8.250 -0.000 0.000 0.458 127 Y N 2.093 122.100 120.300 -0.489 0.000 2.571 127 Y HA -0.065 4.487 4.550 0.003 0.000 0.294 127 Y C 1.919 177.630 175.900 -0.315 0.000 1.141 127 Y CA 0.721 58.428 58.100 -0.654 0.000 1.308 127 Y CB 0.154 37.923 38.460 -1.152 0.000 1.002 127 Y HN 0.307 8.587 8.280 -0.000 0.000 0.551 128 T N -2.115 112.421 114.554 -0.031 0.000 3.244 128 T HA 0.490 4.842 4.350 0.002 0.000 0.254 128 T C 0.566 175.509 174.700 0.404 0.000 1.024 128 T CA -0.279 61.965 62.100 0.240 0.000 0.920 128 T CB -0.376 68.626 68.868 0.224 0.000 1.042 128 T HN 0.185 8.425 8.240 -0.000 0.000 0.572 129 A N 1.828 124.801 122.820 0.254 0.000 2.498 129 A HA 0.592 4.913 4.320 0.002 0.000 0.239 129 A C -0.104 177.652 177.584 0.286 0.000 1.068 129 A CA -0.509 51.648 52.037 0.200 0.000 0.766 129 A CB -0.334 18.740 19.000 0.123 0.000 1.003 129 A HN 0.842 8.992 8.150 -0.000 0.000 0.497 130 F N -0.968 119.039 119.950 0.095 0.000 2.662 130 F HA 0.784 5.312 4.527 0.002 0.000 0.312 130 F C -0.494 175.324 175.800 0.030 0.000 1.113 130 F CA -0.776 57.247 58.000 0.038 0.000 0.951 130 F CB 1.331 40.341 39.000 0.017 0.000 1.344 130 F HN 0.369 8.669 8.300 -0.000 0.000 0.462 131 T N 2.775 117.421 114.554 0.154 0.000 2.824 131 T HA 0.578 4.930 4.350 0.002 0.000 0.282 131 T C -0.505 174.262 174.700 0.112 0.000 0.993 131 T CA -0.410 61.708 62.100 0.030 0.000 0.967 131 T CB 1.520 70.372 68.868 -0.026 0.000 0.960 131 T HN 0.593 8.833 8.240 -0.000 0.000 0.441 132 I N 5.864 126.487 120.570 0.088 0.000 2.291 132 I HA 0.270 4.441 4.170 0.002 0.000 0.290 132 I C -1.839 174.277 176.117 -0.001 0.000 1.050 132 I CA -2.254 59.094 61.300 0.080 0.000 1.245 132 I CB 1.167 39.241 38.000 0.123 0.000 1.405 132 I HN 0.322 8.532 8.210 -0.000 0.000 0.478 133 P HA 0.133 4.553 4.420 -0.000 0.000 0.274 133 P C -0.653 176.623 177.300 -0.040 0.000 1.256 133 P CA -0.338 62.737 63.100 -0.041 0.000 0.795 133 P CB 1.110 32.781 31.700 -0.049 0.000 1.038 134 S N -0.163 115.512 115.700 -0.041 0.000 2.537 134 S HA 0.503 4.974 4.470 0.002 0.000 0.301 134 S C 0.300 174.878 174.600 -0.037 0.000 1.092 134 S CA -0.991 57.185 58.200 -0.039 0.000 1.048 134 S CB 0.423 63.600 63.200 -0.039 0.000 1.053 134 S HN 0.297 8.607 8.310 -0.000 0.000 0.501 135 I N 2.701 123.249 120.570 -0.036 0.000 2.775 135 I HA 0.004 4.175 4.170 0.002 0.000 0.290 135 I C 1.297 177.396 176.117 -0.029 0.000 1.203 135 I CA 0.485 61.765 61.300 -0.033 0.000 1.433 135 I CB -0.278 37.703 38.000 -0.031 0.000 1.354 135 I HN 1.015 9.225 8.210 -0.000 0.000 0.579 136 N N 4.882 123.565 118.700 -0.027 0.000 2.690 136 N HA -0.291 4.451 4.740 0.002 0.000 0.249 136 N C 0.075 175.570 175.510 -0.025 0.000 1.125 136 N CA 1.284 54.320 53.050 -0.024 0.000 0.794 136 N CB -0.956 37.518 38.487 -0.021 0.000 1.152 136 N HN 0.802 9.182 8.380 -0.000 0.000 0.571 137 N N -0.896 117.788 118.700 -0.028 0.000 2.716 137 N HA -0.227 4.515 4.740 0.002 0.000 0.250 137 N C 0.425 175.918 175.510 -0.030 0.000 1.033 137 N CA 1.306 54.339 53.050 -0.030 0.000 0.727 137 N CB -1.122 37.348 38.487 -0.028 0.000 0.950 137 N HN 0.716 9.096 8.380 -0.000 0.000 0.541 138 E N -0.544 119.638 120.200 -0.029 0.000 2.107 138 E HA -0.064 4.287 4.350 0.002 0.000 0.191 138 E C 0.898 177.480 176.600 -0.031 0.000 0.982 138 E CA 1.389 57.773 56.400 -0.028 0.000 0.809 138 E CB 0.217 29.901 29.700 -0.025 0.000 0.756 138 E HN 0.637 8.997 8.360 -0.000 0.000 0.459 139 T N -1.016 113.516 114.554 -0.036 0.000 2.912 139 T HA 0.485 4.836 4.350 0.002 0.000 0.288 139 T C -2.743 171.928 174.700 -0.049 0.000 1.030 139 T CA -2.354 59.721 62.100 -0.042 0.000 1.020 139 T CB 1.876 70.718 68.868 -0.043 0.000 1.056 139 T HN -0.292 7.948 8.240 -0.000 0.000 0.480 140 P HA 0.346 4.766 4.420 -0.000 0.000 0.271 140 P C 0.515 177.769 177.300 -0.077 0.000 1.218 140 P CA -0.093 62.967 63.100 -0.065 0.000 0.780 140 P CB 0.186 31.842 31.700 -0.072 0.000 0.901 141 G N 2.208 110.962 108.800 -0.078 0.000 2.491 141 G HA2 0.222 4.183 3.960 0.002 0.000 0.238 141 G HA3 0.222 4.183 3.960 0.002 0.000 0.238 141 G C -0.084 174.738 174.900 -0.130 0.000 1.277 141 G CA -0.567 44.483 45.100 -0.085 0.000 0.851 141 G HN 0.446 8.736 8.290 -0.000 0.000 0.573 142 I N 1.997 122.483 120.570 -0.139 0.000 2.436 142 I HA 0.153 4.324 4.170 0.002 0.000 0.289 142 I C 0.711 176.612 176.117 -0.360 0.000 1.083 142 I CA 0.005 61.148 61.300 -0.261 0.000 1.372 142 I CB 0.399 38.287 38.000 -0.187 0.000 1.408 142 I HN 0.243 8.453 8.210 -0.000 0.000 0.516 143 R N 6.392 126.609 120.500 -0.472 0.000 2.407 143 R HA 0.609 4.950 4.340 0.002 0.000 0.303 143 R C -1.329 174.564 176.300 -0.677 0.000 0.981 143 R CA -0.646 55.179 56.100 -0.459 0.000 0.905 143 R CB 1.676 31.801 30.300 -0.293 0.000 1.099 143 R HN 0.469 8.739 8.270 -0.000 0.000 0.459 144 Y N 0.058 119.969 120.300 -0.649 0.000 2.644 144 Y HA 0.252 4.803 4.550 0.002 0.000 0.338 144 Y C -0.099 175.470 175.900 -0.551 0.000 1.119 144 Y CA -0.949 56.759 58.100 -0.654 0.000 1.060 144 Y CB 2.306 40.222 38.460 -0.908 0.000 1.294 144 Y HN 0.489 8.769 8.280 -0.000 0.000 0.472 145 Q N -0.304 119.440 119.800 -0.094 0.000 2.456 145 Q HA 0.524 4.865 4.340 0.002 0.000 0.284 145 Q C -2.183 173.841 176.000 0.041 0.000 1.061 145 Q CA -1.082 54.744 55.803 0.038 0.000 0.799 145 Q CB 2.242 30.991 28.738 0.018 0.000 1.445 145 Q HN 0.645 8.915 8.270 -0.000 0.000 0.411 146 Y N 1.087 121.465 120.300 0.131 0.000 2.301 146 Y HA 0.267 4.818 4.550 0.002 0.000 0.325 146 Y C 0.830 176.753 175.900 0.038 0.000 1.203 146 Y CA 0.075 58.233 58.100 0.098 0.000 1.255 146 Y CB 1.174 39.707 38.460 0.121 0.000 1.232 146 Y HN 0.733 9.013 8.280 -0.000 0.000 0.501 147 N N 0.504 119.298 118.700 0.156 0.000 2.227 147 N HA 0.086 4.828 4.740 0.002 0.000 0.196 147 N C -0.564 175.032 175.510 0.143 0.000 1.142 147 N CA 0.458 53.570 53.050 0.104 0.000 0.887 147 N CB 0.941 39.453 38.487 0.041 0.000 1.022 147 N HN 0.378 8.758 8.380 -0.000 0.000 0.500 148 V N -2.194 117.857 119.914 0.228 0.000 3.158 148 V HA 0.544 4.665 4.120 0.002 0.000 0.311 148 V C -0.027 176.227 176.094 0.267 0.000 1.181 148 V CA -1.193 61.252 62.300 0.241 0.000 1.054 148 V CB 1.436 33.419 31.823 0.265 0.000 1.085 148 V HN -0.146 8.044 8.190 -0.000 0.000 0.446 149 L N 2.357 123.717 121.223 0.229 0.000 2.513 149 L HA 0.320 4.661 4.340 0.002 0.000 0.272 149 L C -2.216 174.749 176.870 0.158 0.000 1.187 149 L CA -0.955 53.970 54.840 0.143 0.000 0.895 149 L CB 0.071 42.142 42.059 0.020 0.000 1.147 149 L HN 0.514 8.744 8.230 -0.000 0.000 0.483 150 P HA 0.185 4.605 4.420 -0.000 0.000 0.282 150 P C -1.088 176.234 177.300 0.036 0.000 1.249 150 P CA -0.695 62.200 63.100 -0.343 0.000 0.806 150 P CB 0.685 31.888 31.700 -0.828 0.000 0.984 151 Q N 0.757 120.660 119.800 0.172 0.000 2.352 151 Q HA 0.375 4.717 4.340 0.002 0.000 0.260 151 Q C 1.186 177.358 176.000 0.286 0.000 0.976 151 Q CA 0.841 56.756 55.803 0.186 0.000 0.881 151 Q CB 0.077 28.859 28.738 0.074 0.000 1.235 151 Q HN 0.865 9.135 8.270 -0.000 0.000 0.419 152 G N 1.667 110.628 108.800 0.268 0.000 2.217 152 G HA2 -0.260 3.701 3.960 0.002 0.000 0.246 152 G HA3 -0.260 3.701 3.960 0.002 0.000 0.246 152 G C -0.591 174.508 174.900 0.332 0.000 0.990 152 G CA -0.039 45.275 45.100 0.357 0.000 0.627 152 G HN 0.661 8.951 8.290 -0.000 0.000 0.522 153 W N 2.280 123.477 121.300 -0.171 0.000 2.315 153 W HA 0.646 5.307 4.660 0.002 0.000 0.316 153 W C 1.303 177.627 176.519 -0.326 0.000 1.211 153 W CA -0.588 56.474 57.345 -0.471 0.000 1.201 153 W CB 1.000 29.966 29.460 -0.823 0.000 1.184 153 W HN 0.099 8.279 8.180 -0.000 0.000 0.544 154 K N 2.907 122.835 120.400 -0.787 0.000 2.044 154 K HA -0.151 4.170 4.320 0.002 0.000 0.210 154 K C 1.869 177.709 176.600 -1.266 0.000 1.049 154 K CA 2.050 57.850 56.287 -0.812 0.000 0.927 154 K CB -0.689 31.488 32.500 -0.539 0.000 0.713 154 K HN 0.755 9.005 8.250 -0.000 0.000 0.443 155 G N -0.320 107.021 108.800 -2.432 0.000 2.559 155 G HA2 -0.144 3.818 3.960 0.002 0.000 0.216 155 G HA3 -0.144 3.818 3.960 0.002 0.000 0.216 155 G C 1.265 175.182 174.900 -1.638 0.000 1.126 155 G CA 0.605 44.160 45.100 -2.575 0.000 0.778 155 G HN 0.283 8.573 8.290 -0.000 0.000 0.543 156 S N 1.343 116.327 115.700 -1.194 0.000 2.345 156 S HA -0.049 4.422 4.470 0.002 0.000 0.220 156 S C 0.341 174.332 174.600 -1.016 0.000 1.031 156 S CA 1.396 59.026 58.200 -0.951 0.000 0.996 156 S CB -0.565 62.012 63.200 -1.038 0.000 0.882 156 S HN 0.396 8.706 8.310 -0.000 0.000 0.445 157 P HA 0.015 4.435 4.420 -0.000 0.000 0.217 157 P C 1.324 178.489 177.300 -0.226 0.000 1.151 157 P CA 1.356 64.301 63.100 -0.258 0.000 0.828 157 P CB -0.101 31.515 31.700 -0.140 0.000 0.788 158 A N 0.536 123.122 122.820 -0.390 0.000 1.865 158 A HA -0.166 4.155 4.320 0.002 0.000 0.217 158 A C 2.393 179.844 177.584 -0.221 0.000 1.191 158 A CA 1.719 53.574 52.037 -0.304 0.000 0.623 158 A CB -1.648 17.094 19.000 -0.430 0.000 0.826 158 A HN 0.124 8.274 8.150 -0.000 0.000 0.444 159 I N -2.352 118.016 120.570 -0.336 0.000 2.394 159 I HA -0.161 4.010 4.170 0.002 0.000 0.251 159 I C 2.124 178.222 176.117 -0.032 0.000 1.136 159 I CA 1.163 62.367 61.300 -0.160 0.000 1.425 159 I CB -0.144 37.743 38.000 -0.189 0.000 1.079 159 I HN 0.411 8.621 8.210 -0.000 0.000 0.425 160 F N 1.088 120.929 119.950 -0.181 0.000 2.797 160 F HA 0.004 4.533 4.527 0.002 0.000 0.302 160 F C 2.311 178.095 175.800 -0.025 0.000 1.130 160 F CA 0.489 58.457 58.000 -0.053 0.000 1.387 160 F CB -0.248 38.776 39.000 0.040 0.000 1.107 160 F HN 0.017 8.317 8.300 -0.000 0.000 0.577 161 Q N 0.371 120.136 119.800 -0.059 0.000 2.045 161 Q HA -0.259 4.083 4.340 0.002 0.000 0.206 161 Q C 2.378 178.266 176.000 -0.187 0.000 0.991 161 Q CA 2.865 58.612 55.803 -0.092 0.000 0.851 161 Q CB -0.237 28.465 28.738 -0.060 0.000 0.911 161 Q HN 0.522 8.792 8.270 -0.000 0.000 0.418 162 S N -0.114 115.485 115.700 -0.168 0.000 2.387 162 S HA -0.164 4.308 4.470 0.002 0.000 0.230 162 S C 2.066 176.506 174.600 -0.266 0.000 1.035 162 S CA 1.656 59.759 58.200 -0.161 0.000 1.014 162 S CB -0.459 62.681 63.200 -0.099 0.000 0.836 162 S HN 0.340 8.650 8.310 -0.000 0.000 0.466 163 S N 1.662 117.081 115.700 -0.469 0.000 2.387 163 S HA 0.084 4.556 4.470 0.002 0.000 0.226 163 S C 1.812 176.003 174.600 -0.681 0.000 1.026 163 S CA 1.218 59.034 58.200 -0.639 0.000 0.972 163 S CB -0.455 62.101 63.200 -1.074 0.000 0.814 163 S HN 0.477 8.787 8.310 -0.000 0.000 0.477 164 M N 2.925 122.093 119.600 -0.721 0.000 2.132 164 M HA -0.106 4.376 4.480 0.002 0.000 0.263 164 M C 2.231 178.371 176.300 -0.266 0.000 1.065 164 M CA 1.967 57.063 55.300 -0.340 0.000 1.122 164 M CB -1.333 31.224 32.600 -0.070 0.000 1.365 164 M HN 0.452 8.742 8.290 -0.000 0.000 0.411 165 T N -0.640 113.779 114.554 -0.225 0.000 2.720 165 T HA -0.241 4.110 4.350 0.002 0.000 0.268 165 T C 1.668 176.237 174.700 -0.217 0.000 1.037 165 T CA 1.904 63.902 62.100 -0.169 0.000 1.144 165 T CB -0.935 67.865 68.868 -0.114 0.000 0.864 165 T HN 0.694 8.934 8.240 -0.000 0.000 0.444 166 K N 1.036 121.269 120.400 -0.278 0.000 2.366 166 K HA 0.182 4.503 4.320 0.002 0.000 0.198 166 K C 2.108 178.271 176.600 -0.728 0.000 1.044 166 K CA 0.755 56.849 56.287 -0.322 0.000 0.973 166 K CB -0.381 31.995 32.500 -0.206 0.000 0.767 166 K HN 0.393 8.643 8.250 -0.000 0.000 0.475 167 I N 1.119 121.163 120.570 -0.876 0.000 3.251 167 I HA -0.059 4.113 4.170 0.002 0.000 0.277 167 I C 1.449 177.096 176.117 -0.784 0.000 1.268 167 I CA 0.606 61.074 61.300 -1.387 0.000 1.449 167 I CB 0.105 37.679 38.000 -0.711 0.000 1.083 167 I HN 0.162 8.372 8.210 -0.000 0.000 0.464 168 L N -0.770 120.191 121.223 -0.437 0.000 2.817 168 L HA 0.150 4.491 4.340 0.002 0.000 0.248 168 L C 2.033 178.838 176.870 -0.108 0.000 1.133 168 L CA -0.060 54.619 54.840 -0.269 0.000 0.935 168 L CB -0.040 41.905 42.059 -0.190 0.000 1.266 168 L HN 0.015 8.245 8.230 -0.000 0.000 0.535 169 E N 1.268 121.417 120.200 -0.085 0.000 2.070 169 E HA -0.200 4.151 4.350 0.002 0.000 0.197 169 E C -0.456 176.200 176.600 0.092 0.000 1.004 169 E CA 1.679 58.085 56.400 0.009 0.000 0.805 169 E CB -1.312 28.399 29.700 0.019 0.000 0.744 169 E HN 0.338 8.698 8.360 -0.000 0.000 0.451 170 P HA -0.157 4.263 4.420 -0.000 0.000 0.216 170 P C 1.436 178.880 177.300 0.240 0.000 1.153 170 P CA 1.069 64.359 63.100 0.317 0.000 0.858 170 P CB -0.161 31.920 31.700 0.635 0.000 0.789 171 F N 0.700 120.623 119.950 -0.045 0.000 2.098 171 F HA -0.077 4.451 4.527 0.002 0.000 0.294 171 F C 1.961 177.710 175.800 -0.086 0.000 1.107 171 F CA 1.533 59.447 58.000 -0.143 0.000 1.234 171 F CB -0.467 38.299 39.000 -0.389 0.000 1.002 171 F HN -0.260 8.040 8.300 -0.000 0.000 0.472 172 K N 0.097 120.516 120.400 0.032 0.000 2.103 172 K HA -0.196 4.126 4.320 0.002 0.000 0.207 172 K C 2.021 178.573 176.600 -0.080 0.000 1.048 172 K CA 1.686 57.952 56.287 -0.035 0.000 0.930 172 K CB -0.199 32.304 32.500 0.007 0.000 0.716 172 K HN 0.270 8.520 8.250 -0.000 0.000 0.444 173 K N 0.583 120.957 120.400 -0.043 0.000 2.116 173 K HA -0.146 4.176 4.320 0.002 0.000 0.203 173 K C 2.257 178.814 176.600 -0.072 0.000 1.052 173 K CA 0.996 57.261 56.287 -0.036 0.000 0.952 173 K CB 0.065 32.569 32.500 0.007 0.000 0.729 173 K HN 0.036 8.286 8.250 -0.000 0.000 0.446 174 Q N 1.077 120.816 119.800 -0.102 0.000 2.167 174 Q HA -0.032 4.310 4.340 0.002 0.000 0.202 174 Q C -0.229 175.626 176.000 -0.241 0.000 0.970 174 Q CA 1.092 56.812 55.803 -0.138 0.000 0.855 174 Q CB 0.392 29.060 28.738 -0.117 0.000 0.911 174 Q HN 0.126 8.396 8.270 -0.000 0.000 0.438 175 N N 0.623 119.104 118.700 -0.364 0.000 2.762 175 N HA 0.158 4.899 4.740 0.002 0.000 0.252 175 N C -2.415 172.954 175.510 -0.235 0.000 1.269 175 N CA -0.951 51.876 53.050 -0.372 0.000 0.799 175 N CB 1.715 39.787 38.487 -0.692 0.000 1.173 175 N HN 0.213 8.593 8.380 -0.000 0.000 0.516 176 P HA -0.057 4.363 4.420 -0.000 0.000 0.223 176 P C 0.224 177.483 177.300 -0.069 0.000 1.151 176 P CA 1.123 64.171 63.100 -0.087 0.000 0.787 176 P CB 0.631 32.292 31.700 -0.064 0.000 0.788 177 D N -0.227 120.128 120.400 -0.074 0.000 2.346 177 D HA 0.102 4.743 4.640 0.002 0.000 0.206 177 D C 1.126 177.401 176.300 -0.041 0.000 1.001 177 D CA 0.120 54.090 54.000 -0.050 0.000 0.871 177 D CB 0.170 40.944 40.800 -0.043 0.000 0.943 177 D HN 0.275 8.645 8.370 -0.000 0.000 0.518 178 I N 1.834 122.371 120.570 -0.056 0.000 2.533 178 I HA -0.031 4.141 4.170 0.002 0.000 0.284 178 I C 0.107 176.228 176.117 0.008 0.000 1.109 178 I CA -0.139 61.148 61.300 -0.021 0.000 1.412 178 I CB 1.176 39.160 38.000 -0.027 0.000 1.396 178 I HN -0.352 7.858 8.210 -0.000 0.000 0.543 179 V N 8.277 128.205 119.914 0.023 0.000 2.407 179 V HA 0.380 4.501 4.120 0.002 0.000 0.278 179 V C 0.182 176.323 176.094 0.079 0.000 1.037 179 V CA -0.349 61.968 62.300 0.030 0.000 0.900 179 V CB 1.345 33.165 31.823 -0.005 0.000 0.983 179 V HN 0.442 8.632 8.190 -0.000 0.000 0.459 180 I N 5.589 126.217 120.570 0.097 0.000 2.418 180 I HA 0.450 4.621 4.170 0.002 0.000 0.287 180 I C -1.192 175.043 176.117 0.197 0.000 1.008 180 I CA -0.675 60.704 61.300 0.133 0.000 1.104 180 I CB 1.657 39.713 38.000 0.093 0.000 1.264 180 I HN 0.615 8.825 8.210 -0.000 0.000 0.438 181 Y N 6.065 126.433 120.300 0.113 0.000 2.499 181 Y HA 0.460 5.012 4.550 0.002 0.000 0.347 181 Y C -0.984 175.068 175.900 0.254 0.000 0.987 181 Y CA -0.669 57.513 58.100 0.136 0.000 1.044 181 Y CB 1.853 40.364 38.460 0.085 0.000 1.245 181 Y HN 0.511 8.791 8.280 -0.000 0.000 0.461 182 Q N 4.935 124.368 119.800 -0.612 0.000 2.331 182 Q HA 0.326 4.667 4.340 0.002 0.000 0.267 182 Q C -2.298 173.360 176.000 -0.570 0.000 1.006 182 Q CA -0.940 54.633 55.803 -0.383 0.000 0.818 182 Q CB 1.749 30.393 28.738 -0.158 0.000 1.276 182 Q HN 0.797 9.067 8.270 -0.000 0.000 0.450 183 Y N 6.468 126.643 120.300 -0.207 0.000 2.329 183 Y HA 0.264 4.815 4.550 0.002 0.000 0.328 183 Y C 0.045 176.041 175.900 0.159 0.000 0.992 183 Y CA -0.416 57.665 58.100 -0.032 0.000 1.151 183 Y CB 0.741 39.292 38.460 0.152 0.000 1.150 183 Y HN 0.871 9.151 8.280 -0.000 0.000 0.450 184 M N 1.613 120.949 119.600 -0.439 0.000 7.319 184 M HA -0.370 4.111 4.480 0.002 0.000 0.312 184 M C 0.274 176.629 176.300 0.093 0.000 0.480 184 M CA 2.148 57.345 55.300 -0.172 0.000 1.311 184 M CB -1.459 31.105 32.600 -0.059 0.000 0.421 184 M HN 0.745 9.035 8.290 -0.000 0.000 0.740 185 D N 1.400 121.878 120.400 0.130 0.000 2.336 185 D HA 0.222 4.864 4.640 0.002 0.000 0.228 185 D C -0.302 175.967 176.300 -0.052 0.000 1.120 185 D CA 0.368 54.348 54.000 -0.035 0.000 0.839 185 D CB -0.095 40.672 40.800 -0.055 0.000 0.932 185 D HN 0.323 8.693 8.370 -0.000 0.000 0.509 186 D N 0.620 121.069 120.400 0.082 0.000 2.350 186 D HA 0.338 4.980 4.640 0.002 0.000 0.245 186 D C -0.507 175.783 176.300 -0.018 0.000 1.036 186 D CA -0.614 53.396 54.000 0.018 0.000 0.848 186 D CB 2.638 43.503 40.800 0.108 0.000 1.307 186 D HN -0.099 8.271 8.370 -0.000 0.000 0.469 187 L N 2.353 123.488 121.223 -0.147 0.000 2.325 187 L HA 0.327 4.668 4.340 0.002 0.000 0.281 187 L C -1.516 175.269 176.870 -0.142 0.000 1.004 187 L CA -0.583 54.215 54.840 -0.070 0.000 0.823 187 L CB 0.888 42.895 42.059 -0.085 0.000 1.236 187 L HN 0.229 8.459 8.230 -0.000 0.000 0.415 188 Y N 4.339 124.706 120.300 0.111 0.000 2.353 188 Y HA 0.504 5.055 4.550 0.002 0.000 0.340 188 Y C -0.101 175.865 175.900 0.110 0.000 0.972 188 Y CA -0.657 57.536 58.100 0.154 0.000 1.157 188 Y CB 1.486 40.106 38.460 0.266 0.000 1.157 188 Y HN 0.206 8.486 8.280 -0.000 0.000 0.495 189 V N 3.873 123.877 119.914 0.151 0.000 2.313 189 V HA 0.640 4.761 4.120 0.002 0.000 0.278 189 V C 0.334 176.505 176.094 0.128 0.000 1.017 189 V CA -0.684 61.677 62.300 0.103 0.000 0.823 189 V CB 1.126 32.954 31.823 0.008 0.000 1.010 189 V HN 0.910 9.100 8.190 -0.000 0.000 0.443 190 G N 3.297 112.171 108.800 0.123 0.000 2.470 190 G HA2 0.734 4.696 3.960 0.002 0.000 0.320 190 G HA3 0.734 4.696 3.960 0.002 0.000 0.320 190 G C -0.464 174.510 174.900 0.123 0.000 1.245 190 G CA -0.208 44.979 45.100 0.145 0.000 0.935 190 G HN 0.871 9.161 8.290 -0.000 0.000 0.476 191 S N 0.363 116.209 115.700 0.243 0.000 2.596 191 S HA 0.448 4.919 4.470 0.002 0.000 0.270 191 S C -0.592 174.118 174.600 0.183 0.000 1.155 191 S CA -0.795 57.499 58.200 0.156 0.000 0.827 191 S CB 2.205 65.456 63.200 0.085 0.000 1.130 191 S HN 0.286 8.596 8.310 -0.000 0.000 0.467 192 D N 0.739 121.196 120.400 0.094 0.000 2.339 192 D HA 0.215 4.857 4.640 0.002 0.000 0.217 192 D C 0.327 176.671 176.300 0.073 0.000 1.050 192 D CA 0.227 54.261 54.000 0.056 0.000 0.856 192 D CB -0.154 40.656 40.800 0.015 0.000 0.922 192 D HN 0.492 8.862 8.370 -0.000 0.000 0.518 193 L N 2.497 123.799 121.223 0.131 0.000 2.462 193 L HA 0.070 4.412 4.340 0.002 0.000 0.272 193 L C 1.017 177.969 176.870 0.137 0.000 1.166 193 L CA -0.232 54.679 54.840 0.119 0.000 0.880 193 L CB 0.243 42.371 42.059 0.115 0.000 1.142 193 L HN -0.108 8.122 8.230 -0.000 0.000 0.473 194 E N 3.057 123.300 120.200 0.071 0.000 2.437 194 E HA -0.082 4.270 4.350 0.002 0.000 0.263 194 E C 1.198 177.845 176.600 0.079 0.000 1.030 194 E CA -0.249 56.177 56.400 0.042 0.000 0.934 194 E CB 1.273 30.987 29.700 0.023 0.000 0.943 194 E HN 0.612 8.972 8.360 -0.000 0.000 0.444 195 I N 2.452 123.048 120.570 0.043 0.000 2.178 195 I HA -0.407 3.764 4.170 0.002 0.000 0.243 195 I C 2.119 178.300 176.117 0.106 0.000 1.019 195 I CA 2.380 63.724 61.300 0.073 0.000 1.294 195 I CB -0.612 37.412 38.000 0.039 0.000 0.996 195 I HN 0.863 9.073 8.210 -0.000 0.000 0.415 196 G N -0.026 108.818 108.800 0.074 0.000 2.766 196 G HA2 -0.426 3.536 3.960 0.002 0.000 0.222 196 G HA3 -0.426 3.536 3.960 0.002 0.000 0.222 196 G C 1.243 176.193 174.900 0.083 0.000 1.225 196 G CA 1.445 46.585 45.100 0.067 0.000 0.784 196 G HN 0.721 9.011 8.290 -0.000 0.000 0.631 197 Q N -1.189 118.666 119.800 0.091 0.000 2.356 197 Q HA 0.223 4.565 4.340 0.002 0.000 0.205 197 Q C 1.951 178.018 176.000 0.111 0.000 0.901 197 Q CA 0.838 56.694 55.803 0.088 0.000 0.938 197 Q CB -0.181 28.595 28.738 0.063 0.000 1.081 197 Q HN 0.729 8.999 8.270 -0.000 0.000 0.517 198 H N 1.108 120.207 119.070 0.048 0.000 2.363 198 H HA 0.107 4.665 4.556 0.002 0.000 0.301 198 H C 1.971 177.332 175.328 0.056 0.000 1.074 198 H CA 1.561 57.642 56.048 0.054 0.000 1.354 198 H CB 0.379 30.166 29.762 0.040 0.000 1.397 198 H HN 0.127 8.407 8.280 -0.000 0.000 0.516 199 R N -0.517 120.108 120.500 0.209 0.000 2.075 199 R HA -0.103 4.238 4.340 0.002 0.000 0.232 199 R C 2.464 178.814 176.300 0.083 0.000 1.126 199 R CA 1.832 58.013 56.100 0.135 0.000 0.963 199 R CB -0.390 29.973 30.300 0.105 0.000 0.858 199 R HN 0.556 8.826 8.270 -0.000 0.000 0.435 200 T N -0.660 113.945 114.554 0.084 0.000 2.904 200 T HA -0.025 4.327 4.350 0.002 0.000 0.267 200 T C 1.774 176.529 174.700 0.092 0.000 1.059 200 T CA 0.657 62.803 62.100 0.078 0.000 1.137 200 T CB 0.040 68.953 68.868 0.075 0.000 0.879 200 T HN -0.062 8.178 8.240 -0.000 0.000 0.467 201 K N 0.814 121.271 120.400 0.094 0.000 2.148 201 K HA 0.128 4.449 4.320 0.002 0.000 0.204 201 K C 2.166 178.839 176.600 0.122 0.000 1.050 201 K CA 0.512 56.912 56.287 0.189 0.000 0.942 201 K CB -0.414 32.176 32.500 0.150 0.000 0.724 201 K HN 0.391 8.641 8.250 -0.000 0.000 0.446 202 I N 0.776 121.346 120.570 -0.000 0.000 2.193 202 I HA -0.177 3.994 4.170 0.002 0.000 0.240 202 I C 2.291 178.377 176.117 -0.052 0.000 1.084 202 I CA 1.061 62.317 61.300 -0.074 0.000 1.365 202 I CB -1.055 36.923 38.000 -0.037 0.000 1.064 202 I HN 0.132 8.342 8.210 -0.000 0.000 0.410 203 E N 1.341 121.548 120.200 0.011 0.000 2.130 203 E HA -0.274 4.077 4.350 0.002 0.000 0.196 203 E C 2.100 178.723 176.600 0.038 0.000 0.998 203 E CA 1.679 58.098 56.400 0.032 0.000 0.806 203 E CB -0.185 29.548 29.700 0.054 0.000 0.738 203 E HN 0.468 8.828 8.360 -0.000 0.000 0.459 204 E N -0.851 119.385 120.200 0.061 0.000 2.047 204 E HA -0.158 4.194 4.350 0.002 0.000 0.191 204 E C 1.993 178.611 176.600 0.030 0.000 0.987 204 E CA 0.966 57.436 56.400 0.116 0.000 0.799 204 E CB -0.185 29.660 29.700 0.242 0.000 0.752 204 E HN 0.304 8.664 8.360 -0.000 0.000 0.449 205 L N 1.426 122.521 121.223 -0.214 0.000 2.083 205 L HA -0.139 4.203 4.340 0.002 0.000 0.209 205 L C 2.177 178.926 176.870 -0.202 0.000 1.083 205 L CA 1.579 56.094 54.840 -0.542 0.000 0.752 205 L CB -0.307 41.250 42.059 -0.836 0.000 0.899 205 L HN 0.021 8.251 8.230 -0.000 0.000 0.433 206 R N -1.169 119.274 120.500 -0.095 0.000 2.070 206 R HA -0.141 4.200 4.340 0.002 0.000 0.232 206 R C 2.269 178.591 176.300 0.037 0.000 1.138 206 R CA 1.456 57.543 56.100 -0.022 0.000 0.936 206 R CB -0.509 29.796 30.300 0.009 0.000 0.839 206 R HN 0.430 8.700 8.270 -0.000 0.000 0.429 207 Q N 0.052 119.886 119.800 0.057 0.000 2.045 207 Q HA -0.227 4.114 4.340 0.002 0.000 0.206 207 Q C 2.118 178.188 176.000 0.117 0.000 0.991 207 Q CA 1.555 57.405 55.803 0.078 0.000 0.851 207 Q CB -0.693 28.091 28.738 0.077 0.000 0.911 207 Q HN 0.481 8.751 8.270 -0.000 0.000 0.418 208 H N 0.425 119.518 119.070 0.039 0.000 2.394 208 H HA -0.124 4.434 4.556 0.002 0.000 0.297 208 H C 2.117 177.528 175.328 0.139 0.000 1.113 208 H CA 1.543 57.649 56.048 0.097 0.000 1.277 208 H CB -0.110 29.675 29.762 0.039 0.000 1.370 208 H HN 0.169 8.449 8.280 -0.000 0.000 0.506 209 L N -0.148 121.227 121.223 0.253 0.000 2.095 209 L HA -0.106 4.235 4.340 0.002 0.000 0.204 209 L C 2.954 179.926 176.870 0.170 0.000 1.080 209 L CA 0.582 55.541 54.840 0.198 0.000 0.759 209 L CB -0.273 41.817 42.059 0.052 0.000 0.914 209 L HN 0.189 8.419 8.230 -0.000 0.000 0.439 210 L N -0.101 121.189 121.223 0.112 0.000 2.131 210 L HA -0.227 4.114 4.340 0.002 0.000 0.210 210 L C 2.786 179.705 176.870 0.083 0.000 1.092 210 L CA 1.301 56.191 54.840 0.083 0.000 0.759 210 L CB -0.161 41.935 42.059 0.061 0.000 0.903 210 L HN 0.207 8.437 8.230 -0.000 0.000 0.435 211 R N -1.106 119.447 120.500 0.087 0.000 2.080 211 R HA -0.175 4.167 4.340 0.002 0.000 0.222 211 R C 1.157 177.482 176.300 0.041 0.000 1.107 211 R CA 0.842 56.958 56.100 0.027 0.000 0.980 211 R CB -0.399 29.881 30.300 -0.033 0.000 0.879 211 R HN 0.414 8.684 8.270 -0.000 0.000 0.439 212 W N 1.600 122.896 121.300 -0.007 0.000 2.888 212 W HA 0.149 4.811 4.660 0.003 0.000 0.412 212 W C 0.857 177.409 176.519 0.055 0.000 0.916 212 W CA 0.965 58.325 57.345 0.025 0.000 2.070 212 W CB 0.105 29.612 29.460 0.079 0.000 0.838 212 W HN 0.611 8.791 8.180 -0.000 0.000 0.717 213 G N 0.103 109.028 108.800 0.209 0.000 4.492 213 G HA2 -0.315 3.646 3.960 0.002 0.000 0.265 213 G HA3 -0.315 3.646 3.960 0.002 0.000 0.265 213 G C 0.390 175.371 174.900 0.136 0.000 1.702 213 G CA -0.171 45.036 45.100 0.178 0.000 1.266 213 G HN 0.374 8.664 8.290 -0.000 0.000 0.643 228 L N 1.131 122.527 121.223 0.289 0.000 2.217 228 L HA -0.091 4.251 4.340 0.002 0.000 0.211 228 L C 2.499 179.468 176.870 0.165 0.000 1.107 228 L CA 0.947 55.876 54.840 0.149 0.000 0.783 228 L CB -0.408 41.697 42.059 0.078 0.000 0.919 228 L HN 0.828 9.058 8.230 -0.000 0.000 0.442 229 W N 0.749 122.085 121.300 0.059 0.000 2.361 229 W HA -0.163 4.499 4.660 0.002 0.000 0.270 229 W C 0.672 177.206 176.519 0.024 0.000 1.210 229 W CA 0.361 57.729 57.345 0.038 0.000 1.174 229 W CB -1.054 28.431 29.460 0.042 0.000 1.131 229 W HN 0.099 8.279 8.180 -0.000 0.000 0.575 230 M N 1.303 120.513 119.600 -0.650 0.000 2.250 230 M HA 0.489 4.970 4.480 0.002 0.000 0.344 230 M C 0.631 176.734 176.300 -0.329 0.000 1.150 230 M CA 0.652 55.510 55.300 -0.738 0.000 1.147 230 M CB 1.276 33.446 32.600 -0.716 0.000 1.498 230 M HN -0.053 8.237 8.290 -0.000 0.000 0.461 231 G N 1.519 110.153 108.800 -0.275 0.000 2.620 231 G HA2 0.604 4.566 3.960 0.002 0.000 0.301 231 G HA3 0.604 4.566 3.960 0.002 0.000 0.301 231 G C -2.501 172.388 174.900 -0.018 0.000 1.347 231 G CA -0.233 44.800 45.100 -0.113 0.000 0.971 231 G HN 0.606 8.896 8.290 -0.000 0.000 0.488 232 Y N 1.613 121.833 120.300 -0.132 0.000 2.333 232 Y HA 0.413 4.964 4.550 0.002 0.000 0.324 232 Y C -0.178 175.682 175.900 -0.065 0.000 1.033 232 Y CA -1.501 56.537 58.100 -0.104 0.000 1.224 232 Y CB 1.187 39.586 38.460 -0.103 0.000 1.120 232 Y HN 0.701 8.981 8.280 -0.000 0.000 0.457 233 E N 6.496 126.551 120.200 -0.242 0.000 2.216 233 E HA 0.662 5.013 4.350 0.002 0.000 0.279 233 E C -1.381 174.903 176.600 -0.527 0.000 0.997 233 E CA -0.721 55.476 56.400 -0.338 0.000 0.817 233 E CB 1.987 31.545 29.700 -0.235 0.000 1.096 233 E HN 0.596 8.956 8.360 -0.000 0.000 0.393 234 L N 1.870 122.782 121.223 -0.518 0.000 2.333 234 L HA 0.466 4.807 4.340 0.002 0.000 0.263 234 L C -0.247 176.247 176.870 -0.625 0.000 1.014 234 L CA -1.255 53.349 54.840 -0.394 0.000 0.820 234 L CB 1.970 43.992 42.059 -0.063 0.000 1.352 234 L HN 0.588 8.818 8.230 -0.000 0.000 0.421 235 H N 1.557 120.611 119.070 -0.026 0.000 2.423 235 H HA 0.188 4.745 4.556 0.002 0.000 0.237 235 H C -2.051 172.913 175.328 -0.607 0.000 1.391 235 H CA -1.569 54.357 56.048 -0.203 0.000 1.453 235 H CB 1.134 30.853 29.762 -0.071 0.000 1.484 235 H HN 0.382 8.662 8.280 -0.000 0.000 0.505 236 P HA -0.132 4.288 4.420 -0.000 0.000 0.230 236 P C 0.883 177.708 177.300 -0.792 0.000 1.158 236 P CA 0.960 62.955 63.100 -1.841 0.000 0.769 236 P CB 0.345 31.137 31.700 -1.514 0.000 0.807 237 D N 1.136 121.293 120.400 -0.405 0.000 2.234 237 D HA -0.135 4.507 4.640 0.002 0.000 0.205 237 D C 1.021 177.270 176.300 -0.085 0.000 0.962 237 D CA 0.726 54.611 54.000 -0.190 0.000 0.855 237 D CB -0.460 40.267 40.800 -0.122 0.000 0.951 237 D HN 0.238 8.608 8.370 -0.000 0.000 0.500 238 K N -0.659 119.717 120.400 -0.040 0.000 3.122 238 K HA 0.215 4.536 4.320 0.002 0.000 0.193 238 K C -1.090 175.674 176.600 0.272 0.000 1.141 238 K CA -0.910 55.428 56.287 0.084 0.000 0.975 238 K CB -0.145 32.388 32.500 0.056 0.000 1.173 238 K HN -0.062 8.188 8.250 -0.000 0.000 0.546 239 W N 1.359 122.691 121.300 0.053 0.000 2.359 239 W HA 0.247 4.909 4.660 0.003 0.000 0.344 239 W C 0.481 177.044 176.519 0.073 0.000 1.170 239 W CA -1.116 56.273 57.345 0.073 0.000 1.296 239 W CB 1.720 31.213 29.460 0.055 0.000 1.197 239 W HN 0.145 8.325 8.180 -0.000 0.000 0.618 240 T N 3.597 118.302 114.554 0.253 0.000 2.840 240 T HA 0.343 4.695 4.350 0.002 0.000 0.276 240 T C -0.215 174.522 174.700 0.063 0.000 0.912 240 T CA -0.313 61.861 62.100 0.123 0.000 1.116 240 T CB -1.021 67.888 68.868 0.068 0.000 0.895 240 T HN 0.277 8.517 8.240 -0.000 0.000 0.570 241 V N 3.278 123.240 119.914 0.081 0.000 3.096 241 V HA 0.739 4.860 4.120 0.002 0.000 0.319 241 V C -0.604 175.515 176.094 0.041 0.000 1.082 241 V CA -0.910 61.426 62.300 0.061 0.000 1.022 241 V CB 1.978 33.856 31.823 0.092 0.000 1.103 241 V HN 0.641 8.831 8.190 -0.000 0.000 0.455 242 Q N 1.911 121.743 119.800 0.053 0.000 2.350 242 Q HA 0.485 4.826 4.340 0.002 0.000 0.255 242 Q C -2.777 173.307 176.000 0.139 0.000 0.951 242 Q CA -0.982 54.871 55.803 0.083 0.000 0.751 242 Q CB 2.138 30.914 28.738 0.063 0.000 1.296 242 Q HN 0.849 9.119 8.270 -0.000 0.000 0.453 243 P HA 0.481 4.901 4.420 -0.000 0.000 0.281 243 P C -0.254 177.134 177.300 0.146 0.000 1.264 243 P CA -0.592 62.587 63.100 0.132 0.000 0.824 243 P CB 1.469 33.222 31.700 0.088 0.000 1.092 244 I N 1.129 121.777 120.570 0.130 0.000 2.395 244 I HA 0.238 4.409 4.170 0.002 0.000 0.289 244 I C 0.580 176.734 176.117 0.061 0.000 1.023 244 I CA -0.758 60.621 61.300 0.133 0.000 1.350 244 I CB 1.279 39.348 38.000 0.115 0.000 1.409 244 I HN 0.131 8.341 8.210 -0.000 0.000 0.507 245 V N 5.256 125.221 119.914 0.084 0.000 2.769 245 V HA 0.660 4.782 4.120 0.002 0.000 0.312 245 V C -0.560 175.576 176.094 0.070 0.000 1.061 245 V CA -0.869 61.465 62.300 0.057 0.000 0.931 245 V CB 1.903 33.762 31.823 0.060 0.000 1.010 245 V HN 0.553 8.743 8.190 -0.000 0.000 0.433 246 L N 2.408 123.671 121.223 0.066 0.000 2.334 246 L HA 0.689 5.030 4.340 0.002 0.000 0.270 246 L C -2.224 174.724 176.870 0.130 0.000 1.018 246 L CA -1.870 53.033 54.840 0.105 0.000 0.811 246 L CB 1.529 43.645 42.059 0.095 0.000 1.271 246 L HN 0.469 8.699 8.230 -0.000 0.000 0.443 247 P HA 0.152 4.572 4.420 -0.000 0.000 0.269 247 P C -1.196 176.183 177.300 0.131 0.000 1.215 247 P CA -0.261 62.892 63.100 0.088 0.000 0.780 247 P CB 0.487 32.174 31.700 -0.022 0.000 0.898 248 E N 1.782 121.985 120.200 0.005 0.000 2.186 248 E HA 0.301 4.652 4.350 0.002 0.000 0.255 248 E C -0.737 175.792 176.600 -0.118 0.000 0.881 248 E CA -0.576 55.847 56.400 0.039 0.000 0.752 248 E CB 1.077 30.801 29.700 0.039 0.000 1.176 248 E HN 0.320 8.680 8.360 -0.000 0.000 0.421 249 K N 1.589 121.857 120.400 -0.220 0.000 2.443 249 K HA 0.329 4.650 4.320 0.002 0.000 0.251 249 K C -0.299 176.182 176.600 -0.199 0.000 0.972 249 K CA -0.836 55.202 56.287 -0.415 0.000 0.833 249 K CB 1.674 33.550 32.500 -1.039 0.000 1.317 249 K HN 0.200 8.450 8.250 -0.000 0.000 0.441 250 D N 0.156 120.463 120.400 -0.155 0.000 2.327 250 D HA -0.023 4.618 4.640 0.002 0.000 0.205 250 D C -0.145 176.159 176.300 0.006 0.000 0.989 250 D CA 0.767 54.752 54.000 -0.024 0.000 0.873 250 D CB 0.511 41.298 40.800 -0.021 0.000 0.955 250 D HN 0.483 8.853 8.370 -0.000 0.000 0.515 251 S N -0.318 115.318 115.700 -0.106 0.000 2.677 251 S HA 0.480 4.952 4.470 0.002 0.000 0.283 251 S C -1.308 173.228 174.600 -0.107 0.000 1.159 251 S CA -0.984 57.211 58.200 -0.009 0.000 1.001 251 S CB 0.675 63.871 63.200 -0.007 0.000 1.032 251 S HN 0.007 8.317 8.310 -0.000 0.000 0.487 252 W N 2.683 123.984 121.300 0.000 0.000 2.391 252 W HA 0.549 5.209 4.660 0.001 0.000 0.311 252 W C 1.001 177.522 176.519 0.002 0.000 1.087 252 W CA -0.413 56.933 57.345 0.002 0.000 1.209 252 W CB 1.513 30.974 29.460 0.001 0.000 1.273 252 W HN 0.836 9.016 8.180 -0.000 0.000 0.482 253 T N -1.633 113.031 114.554 0.183 0.000 2.788 253 T HA 0.204 4.555 4.350 0.002 0.000 0.280 253 T C 0.916 175.702 174.700 0.143 0.000 0.984 253 T CA -0.697 61.475 62.100 0.120 0.000 0.972 253 T CB 0.990 69.898 68.868 0.067 0.000 1.039 253 T HN 0.211 8.451 8.240 -0.000 0.000 0.530 254 V N 1.378 121.348 119.914 0.093 0.000 2.358 254 V HA -0.148 3.974 4.120 0.002 0.000 0.246 254 V C 2.904 179.050 176.094 0.087 0.000 1.047 254 V CA 2.023 64.370 62.300 0.079 0.000 1.035 254 V CB -1.144 30.710 31.823 0.051 0.000 0.658 254 V HN 0.969 9.159 8.190 -0.000 0.000 0.452 255 N N 0.065 118.813 118.700 0.079 0.000 2.120 255 N HA -0.215 4.527 4.740 0.002 0.000 0.188 255 N C 1.520 177.100 175.510 0.115 0.000 1.024 255 N CA 1.680 54.777 53.050 0.078 0.000 0.852 255 N CB -0.049 38.471 38.487 0.055 0.000 1.003 255 N HN 0.464 8.844 8.380 -0.000 0.000 0.424 256 D N 1.032 121.522 120.400 0.150 0.000 2.104 256 D HA -0.135 4.507 4.640 0.002 0.000 0.194 256 D C 2.051 178.548 176.300 0.328 0.000 0.994 256 D CA 0.863 55.004 54.000 0.234 0.000 0.830 256 D CB -0.269 40.696 40.800 0.275 0.000 0.959 256 D HN 0.428 8.798 8.370 -0.000 0.000 0.452 257 I N 0.809 121.546 120.570 0.278 0.000 2.315 257 I HA -0.241 3.931 4.170 0.002 0.000 0.248 257 I C 2.477 178.643 176.117 0.082 0.000 1.117 257 I CA 0.880 62.262 61.300 0.138 0.000 1.404 257 I CB -0.185 37.841 38.000 0.044 0.000 1.071 257 I HN -0.029 8.181 8.210 -0.000 0.000 0.419 258 Q N 0.766 120.621 119.800 0.092 0.000 2.079 258 Q HA -0.196 4.145 4.340 0.002 0.000 0.200 258 Q C 2.177 178.243 176.000 0.110 0.000 0.974 258 Q CA 1.280 57.129 55.803 0.078 0.000 0.840 258 Q CB -0.068 28.713 28.738 0.072 0.000 0.898 258 Q HN 0.477 8.747 8.270 -0.000 0.000 0.430 259 K N 0.392 120.878 120.400 0.144 0.000 2.097 259 K HA -0.151 4.171 4.320 0.002 0.000 0.206 259 K C 2.083 178.791 176.600 0.180 0.000 1.049 259 K CA 0.812 57.215 56.287 0.194 0.000 0.933 259 K CB -0.165 32.445 32.500 0.184 0.000 0.717 259 K HN 0.085 8.335 8.250 -0.000 0.000 0.442 260 L N 1.075 122.388 121.223 0.151 0.000 2.017 260 L HA -0.144 4.197 4.340 0.002 0.000 0.208 260 L C 2.045 178.907 176.870 -0.013 0.000 1.073 260 L CA 1.460 56.355 54.840 0.091 0.000 0.745 260 L CB -0.347 41.761 42.059 0.083 0.000 0.894 260 L HN -0.126 8.104 8.230 -0.000 0.000 0.432 261 V N 0.159 120.062 119.914 -0.018 0.000 2.407 261 V HA -0.205 3.916 4.120 0.002 0.000 0.248 261 V C 2.584 178.636 176.094 -0.070 0.000 1.055 261 V CA 1.736 64.004 62.300 -0.053 0.000 1.049 261 V CB -1.440 30.362 31.823 -0.035 0.000 0.662 261 V HN 0.656 8.846 8.190 -0.000 0.000 0.455 262 G N -0.575 108.217 108.800 -0.014 0.000 2.418 262 G HA2 -0.311 3.650 3.960 0.002 0.000 0.217 262 G HA3 -0.311 3.650 3.960 0.002 0.000 0.217 262 G C 1.643 176.252 174.900 -0.485 0.000 1.158 262 G CA 1.079 46.163 45.100 -0.027 0.000 0.771 262 G HN 0.495 8.785 8.290 -0.000 0.000 0.545 263 K N -0.134 119.952 120.400 -0.522 0.000 2.097 263 K HA 0.122 4.443 4.320 0.002 0.000 0.205 263 K C 2.481 178.852 176.600 -0.382 0.000 1.050 263 K CA 0.636 56.390 56.287 -0.890 0.000 0.938 263 K CB -0.230 32.024 32.500 -0.410 0.000 0.718 263 K HN 0.323 8.573 8.250 -0.000 0.000 0.442 264 L N 0.814 121.898 121.223 -0.231 0.000 2.093 264 L HA -0.154 4.187 4.340 0.002 0.000 0.208 264 L C 2.277 179.030 176.870 -0.194 0.000 1.085 264 L CA 1.197 55.933 54.840 -0.174 0.000 0.755 264 L CB -0.531 41.446 42.059 -0.137 0.000 0.904 264 L HN 0.326 8.556 8.230 -0.000 0.000 0.435 265 N N -0.237 118.346 118.700 -0.196 0.000 2.166 265 N HA -0.278 4.464 4.740 0.002 0.000 0.186 265 N C 1.693 177.088 175.510 -0.192 0.000 1.019 265 N CA 1.425 54.375 53.050 -0.167 0.000 0.856 265 N CB -0.257 38.159 38.487 -0.118 0.000 0.993 265 N HN 0.386 8.766 8.380 -0.000 0.000 0.426 266 W N 1.138 122.140 121.300 -0.497 0.000 2.354 266 W HA 0.039 4.700 4.660 0.003 0.000 0.315 266 W C 2.206 178.525 176.519 -0.332 0.000 1.206 266 W CA 2.166 59.224 57.345 -0.478 0.000 1.290 266 W CB -0.896 28.037 29.460 -0.879 0.000 1.152 266 W HN 0.116 8.296 8.180 -0.000 0.000 0.489 267 A N 0.403 122.898 122.820 -0.542 0.000 2.019 267 A HA -0.195 4.126 4.320 0.002 0.000 0.219 267 A C 2.092 179.437 177.584 -0.398 0.000 1.164 267 A CA 2.366 54.018 52.037 -0.641 0.000 0.644 267 A CB -1.529 17.271 19.000 -0.334 0.000 0.805 267 A HN 0.465 8.615 8.150 -0.000 0.000 0.449 268 S N -0.450 115.059 115.700 -0.318 0.000 2.500 268 S HA -0.198 4.274 4.470 0.002 0.000 0.239 268 S C 1.599 176.000 174.600 -0.331 0.000 0.989 268 S CA 1.297 59.351 58.200 -0.244 0.000 0.951 268 S CB -0.452 62.633 63.200 -0.192 0.000 0.759 268 S HN 0.724 9.034 8.310 -0.000 0.000 0.523 269 Q N -0.064 119.422 119.800 -0.524 0.000 2.389 269 Q HA 0.300 4.641 4.340 0.002 0.000 0.204 269 Q C 1.700 177.279 176.000 -0.701 0.000 0.944 269 Q CA 0.766 56.129 55.803 -0.734 0.000 0.908 269 Q CB -0.076 27.896 28.738 -1.277 0.000 1.002 269 Q HN 0.648 8.918 8.270 -0.000 0.000 0.493 270 I N -1.500 118.736 120.570 -0.558 0.000 3.039 270 I HA -0.008 4.163 4.170 0.002 0.000 0.270 270 I C -0.149 175.677 176.117 -0.484 0.000 1.150 270 I CA 0.316 61.346 61.300 -0.451 0.000 1.448 270 I CB 0.594 38.337 38.000 -0.428 0.000 1.197 270 I HN -0.002 8.208 8.210 -0.000 0.000 0.450 271 Y N 0.997 121.138 120.300 -0.265 0.000 2.328 271 Y HA 0.306 4.857 4.550 0.002 0.000 0.333 271 Y C -1.877 173.908 175.900 -0.191 0.000 0.958 271 Y CA -2.133 55.855 58.100 -0.188 0.000 1.167 271 Y CB 0.821 39.181 38.460 -0.166 0.000 1.151 271 Y HN -0.147 8.133 8.280 -0.000 0.000 0.470 272 P HA -0.121 4.299 4.420 -0.000 0.000 0.217 272 P C 1.492 178.752 177.300 -0.066 0.000 1.150 272 P CA 1.599 64.643 63.100 -0.093 0.000 0.832 272 P CB 0.368 31.990 31.700 -0.130 0.000 0.787 273 G N -0.861 107.918 108.800 -0.035 0.000 2.848 273 G HA2 -0.042 3.919 3.960 0.002 0.000 0.208 273 G HA3 -0.042 3.919 3.960 0.002 0.000 0.208 273 G C 0.530 175.394 174.900 -0.059 0.000 1.152 273 G CA -0.119 44.954 45.100 -0.045 0.000 0.789 273 G HN 0.144 8.434 8.290 -0.000 0.000 0.531 274 I N 1.439 121.969 120.570 -0.068 0.000 2.668 274 I HA 0.164 4.335 4.170 0.002 0.000 0.285 274 I C -0.101 175.961 176.117 -0.093 0.000 1.168 274 I CA 0.292 61.536 61.300 -0.093 0.000 1.424 274 I CB 0.600 38.532 38.000 -0.114 0.000 1.377 274 I HN -0.065 8.145 8.210 -0.000 0.000 0.560 275 K N 5.880 126.225 120.400 -0.092 0.000 2.316 275 K HA 0.459 4.780 4.320 0.002 0.000 0.251 275 K C 0.413 176.957 176.600 -0.092 0.000 0.934 275 K CA -0.497 55.739 56.287 -0.085 0.000 0.802 275 K CB 2.924 35.380 32.500 -0.074 0.000 1.171 275 K HN 0.428 8.678 8.250 -0.000 0.000 0.426 276 V N -0.728 119.134 119.914 -0.087 0.000 3.451 276 V HA 0.165 4.286 4.120 0.002 0.000 0.288 276 V C 1.937 177.983 176.094 -0.079 0.000 1.502 276 V CA 0.134 62.381 62.300 -0.090 0.000 1.026 276 V CB 0.215 31.986 31.823 -0.086 0.000 0.840 276 V HN 0.775 8.965 8.190 -0.000 0.000 0.437 277 R N 0.649 121.108 120.500 -0.069 0.000 2.115 277 R HA -0.232 4.109 4.340 0.002 0.000 0.239 277 R C 2.334 178.596 176.300 -0.063 0.000 1.133 277 R CA 2.735 58.799 56.100 -0.059 0.000 0.935 277 R CB -0.338 29.930 30.300 -0.052 0.000 0.853 277 R HN 0.519 8.789 8.270 -0.000 0.000 0.433 278 Q N 0.318 120.076 119.800 -0.070 0.000 2.181 278 Q HA -0.140 4.202 4.340 0.002 0.000 0.205 278 Q C 2.236 178.180 176.000 -0.093 0.000 0.980 278 Q CA 1.384 57.142 55.803 -0.076 0.000 0.862 278 Q CB -0.152 28.539 28.738 -0.078 0.000 0.905 278 Q HN 0.477 8.747 8.270 -0.000 0.000 0.429 279 L N 0.312 121.469 121.223 -0.110 0.000 2.127 279 L HA -0.091 4.250 4.340 0.002 0.000 0.203 279 L C 2.291 179.099 176.870 -0.103 0.000 1.080 279 L CA 1.139 55.897 54.840 -0.138 0.000 0.768 279 L CB -0.319 41.637 42.059 -0.171 0.000 0.924 279 L HN 0.154 8.384 8.230 -0.000 0.000 0.444 280 S N -0.852 114.801 115.700 -0.078 0.000 2.481 280 S HA -0.118 4.354 4.470 0.002 0.000 0.231 280 S C 1.811 176.384 174.600 -0.045 0.000 0.996 280 S CA 0.520 58.688 58.200 -0.054 0.000 0.942 280 S CB -0.237 62.937 63.200 -0.044 0.000 0.768 280 S HN 0.328 8.638 8.310 -0.000 0.000 0.520 281 K N 1.285 121.654 120.400 -0.051 0.000 2.097 281 K HA 0.089 4.411 4.320 0.002 0.000 0.206 281 K C 1.788 178.365 176.600 -0.038 0.000 1.049 281 K CA 1.119 57.382 56.287 -0.041 0.000 0.933 281 K CB -0.504 31.970 32.500 -0.043 0.000 0.717 281 K HN 0.395 8.645 8.250 -0.000 0.000 0.442 282 L N 0.854 122.046 121.223 -0.050 0.000 2.353 282 L HA -0.135 4.206 4.340 0.002 0.000 0.220 282 L C 1.395 178.250 176.870 -0.026 0.000 1.133 282 L CA 0.707 55.521 54.840 -0.044 0.000 0.798 282 L CB -0.256 41.762 42.059 -0.068 0.000 0.922 282 L HN 0.160 8.390 8.230 -0.000 0.000 0.445 283 L N 0.963 122.171 121.223 -0.025 0.000 2.851 283 L HA 0.130 4.471 4.340 0.002 0.000 0.237 283 L C 0.805 177.670 176.870 -0.008 0.000 1.257 283 L CA -0.189 54.645 54.840 -0.011 0.000 1.061 283 L CB -0.328 41.726 42.059 -0.008 0.000 1.372 283 L HN 0.258 8.488 8.230 -0.000 0.000 0.493 284 R N 0.371 120.864 120.500 -0.011 0.000 2.235 284 R HA 0.637 4.979 4.340 0.002 0.000 0.338 284 R C -0.148 176.149 176.300 -0.004 0.000 1.087 284 R CA 0.079 56.174 56.100 -0.008 0.000 0.948 284 R CB 0.511 30.804 30.300 -0.012 0.000 1.099 284 R HN 0.137 8.407 8.270 -0.000 0.000 0.483 285 G N 1.443 110.243 108.800 -0.001 0.000 2.334 285 G HA2 -0.079 3.883 3.960 0.002 0.000 0.566 285 G HA3 -0.079 3.883 3.960 0.002 0.000 0.566 285 G C -0.755 174.147 174.900 0.005 0.000 1.413 285 G CA -0.595 44.506 45.100 0.002 0.000 0.993 285 G HN 0.531 8.821 8.290 -0.000 0.000 0.642 286 T N -0.414 114.144 114.554 0.006 0.000 3.005 286 T HA 0.629 4.981 4.350 0.002 0.000 0.323 286 T C 0.167 174.872 174.700 0.009 0.000 1.131 286 T CA -0.381 61.723 62.100 0.008 0.000 0.977 286 T CB 0.717 69.590 68.868 0.007 0.000 1.055 286 T HN 0.571 8.811 8.240 -0.000 0.000 0.562 287 K N 1.736 122.143 120.400 0.012 0.000 2.123 287 K HA 0.689 5.011 4.320 0.002 0.000 0.248 287 K C 0.395 177.005 176.600 0.016 0.000 0.969 287 K CA -1.016 55.280 56.287 0.014 0.000 0.882 287 K CB 1.682 34.192 32.500 0.016 0.000 1.080 287 K HN 0.702 8.952 8.250 -0.000 0.000 0.441 288 A N 2.488 125.317 122.820 0.016 0.000 2.540 288 A HA -0.011 4.310 4.320 0.002 0.000 0.239 288 A C 1.312 178.909 177.584 0.021 0.000 1.061 288 A CA 0.101 52.147 52.037 0.016 0.000 0.758 288 A CB -0.153 18.855 19.000 0.015 0.000 0.991 288 A HN 0.824 8.974 8.150 -0.000 0.000 0.502 289 L N 2.101 123.337 121.223 0.021 0.000 2.127 289 L HA -0.162 4.179 4.340 0.002 0.000 0.211 289 L C 2.588 179.476 176.870 0.030 0.000 1.089 289 L CA 2.046 56.902 54.840 0.027 0.000 0.757 289 L CB -0.531 41.542 42.059 0.023 0.000 0.899 289 L HN 0.998 9.228 8.230 -0.000 0.000 0.434 290 T N -3.906 110.662 114.554 0.023 0.000 3.169 290 T HA -0.011 4.340 4.350 0.002 0.000 0.250 290 T C 0.598 175.314 174.700 0.025 0.000 1.111 290 T CA -0.300 61.813 62.100 0.022 0.000 1.010 290 T CB -0.133 68.742 68.868 0.013 0.000 0.984 290 T HN 0.266 8.506 8.240 -0.000 0.000 0.537 291 E N 1.503 121.720 120.200 0.029 0.000 2.316 291 E HA 0.322 4.673 4.350 0.002 0.000 0.275 291 E C -0.663 175.963 176.600 0.045 0.000 1.029 291 E CA -0.616 55.802 56.400 0.031 0.000 0.871 291 E CB 0.917 30.633 29.700 0.027 0.000 1.022 291 E HN 0.092 8.452 8.360 -0.000 0.000 0.418 292 V N 6.055 125.995 119.914 0.044 0.000 2.555 292 V HA 0.097 4.218 4.120 0.002 0.000 0.286 292 V C 0.234 176.369 176.094 0.069 0.000 1.044 292 V CA -0.088 62.250 62.300 0.063 0.000 1.026 292 V CB 0.749 32.602 31.823 0.050 0.000 0.981 292 V HN 0.590 8.780 8.190 -0.000 0.000 0.480 293 I N 7.057 127.686 120.570 0.099 0.000 2.436 293 I HA 0.443 4.614 4.170 0.002 0.000 0.289 293 I C -2.279 173.895 176.117 0.095 0.000 1.010 293 I CA -2.475 58.872 61.300 0.078 0.000 1.098 293 I CB 2.029 40.066 38.000 0.062 0.000 1.266 293 I HN 0.443 8.653 8.210 -0.000 0.000 0.434 294 P HA 0.335 4.755 4.420 -0.000 0.000 0.284 294 P C -0.671 176.641 177.300 0.019 0.000 1.253 294 P CA -0.512 62.626 63.100 0.062 0.000 0.800 294 P CB 1.382 33.107 31.700 0.041 0.000 0.961 295 L N 2.718 123.945 121.223 0.006 0.000 2.367 295 L HA 0.183 4.525 4.340 0.002 0.000 0.275 295 L C 1.685 178.525 176.870 -0.050 0.000 1.129 295 L CA -0.223 54.571 54.840 -0.077 0.000 0.839 295 L CB 0.395 42.372 42.059 -0.136 0.000 1.133 295 L HN 0.495 8.725 8.230 -0.000 0.000 0.453 296 T N -1.438 113.077 114.554 -0.065 0.000 2.754 296 T HA 0.106 4.458 4.350 0.002 0.000 0.286 296 T C 0.993 175.663 174.700 -0.050 0.000 0.997 296 T CA -0.744 61.327 62.100 -0.047 0.000 0.982 296 T CB 1.332 70.170 68.868 -0.049 0.000 1.027 296 T HN 0.505 8.745 8.240 -0.000 0.000 0.529 297 E N 0.799 120.977 120.200 -0.038 0.000 2.028 297 E HA -0.109 4.243 4.350 0.002 0.000 0.191 297 E C 2.144 178.717 176.600 -0.046 0.000 0.988 297 E CA 1.420 57.799 56.400 -0.035 0.000 0.799 297 E CB -0.364 29.320 29.700 -0.025 0.000 0.755 297 E HN 0.771 9.131 8.360 -0.000 0.000 0.447 298 E N 1.222 121.394 120.200 -0.047 0.000 2.085 298 E HA -0.163 4.188 4.350 0.002 0.000 0.194 298 E C 1.944 178.501 176.600 -0.072 0.000 0.994 298 E CA 1.431 57.799 56.400 -0.053 0.000 0.801 298 E CB -0.412 29.259 29.700 -0.048 0.000 0.743 298 E HN 0.272 8.632 8.360 -0.000 0.000 0.453 299 A N 0.870 123.638 122.820 -0.087 0.000 1.898 299 A HA -0.235 4.086 4.320 0.002 0.000 0.216 299 A C 2.164 179.663 177.584 -0.141 0.000 1.181 299 A CA 1.653 53.615 52.037 -0.124 0.000 0.620 299 A CB -0.489 18.421 19.000 -0.150 0.000 0.819 299 A HN 0.279 8.429 8.150 -0.000 0.000 0.442 300 E N -0.790 119.339 120.200 -0.118 0.000 2.204 300 E HA -0.153 4.199 4.350 0.002 0.000 0.194 300 E C 1.801 178.356 176.600 -0.075 0.000 0.989 300 E CA 1.024 57.363 56.400 -0.102 0.000 0.824 300 E CB -0.090 29.573 29.700 -0.062 0.000 0.756 300 E HN 0.489 8.849 8.360 -0.000 0.000 0.477 301 L N 1.098 122.282 121.223 -0.066 0.000 2.131 301 L HA -0.053 4.288 4.340 0.002 0.000 0.206 301 L C 2.121 178.953 176.870 -0.064 0.000 1.087 301 L CA 1.759 56.567 54.840 -0.054 0.000 0.767 301 L CB -0.293 41.738 42.059 -0.045 0.000 0.917 301 L HN 0.077 8.307 8.230 -0.000 0.000 0.441 302 E N -0.698 119.455 120.200 -0.079 0.000 2.110 302 E HA -0.258 4.094 4.350 0.002 0.000 0.193 302 E C 2.159 178.701 176.600 -0.097 0.000 0.988 302 E CA 1.375 57.723 56.400 -0.086 0.000 0.804 302 E CB -0.170 29.472 29.700 -0.096 0.000 0.745 302 E HN 0.434 8.794 8.360 -0.000 0.000 0.458 303 L N 0.646 121.801 121.223 -0.114 0.000 2.083 303 L HA -0.066 4.276 4.340 0.002 0.000 0.209 303 L C 2.163 178.989 176.870 -0.073 0.000 1.083 303 L CA 2.094 56.865 54.840 -0.115 0.000 0.752 303 L CB -0.626 41.340 42.059 -0.155 0.000 0.899 303 L HN 0.150 8.380 8.230 -0.000 0.000 0.433 304 A N -0.779 122.005 122.820 -0.059 0.000 1.898 304 A HA -0.179 4.142 4.320 0.002 0.000 0.216 304 A C 2.133 179.688 177.584 -0.049 0.000 1.181 304 A CA 1.559 53.572 52.037 -0.040 0.000 0.620 304 A CB -0.578 18.404 19.000 -0.030 0.000 0.819 304 A HN 0.587 8.737 8.150 -0.000 0.000 0.442 305 E N 0.111 120.278 120.200 -0.056 0.000 2.153 305 E HA -0.162 4.189 4.350 0.002 0.000 0.194 305 E C 1.561 178.116 176.600 -0.075 0.000 0.988 305 E CA 1.041 57.406 56.400 -0.058 0.000 0.811 305 E CB -0.185 29.481 29.700 -0.056 0.000 0.746 305 E HN 0.540 8.900 8.360 -0.000 0.000 0.466 306 N N 0.807 119.454 118.700 -0.088 0.000 2.216 306 N HA -0.068 4.674 4.740 0.002 0.000 0.183 306 N C 1.706 177.140 175.510 -0.128 0.000 1.017 306 N CA 0.680 53.661 53.050 -0.115 0.000 0.861 306 N CB -0.119 38.298 38.487 -0.117 0.000 0.986 306 N HN 0.121 8.501 8.380 -0.000 0.000 0.428 307 R N 1.236 121.682 120.500 -0.090 0.000 2.083 307 R HA -0.159 4.183 4.340 0.002 0.000 0.237 307 R C 2.223 178.470 176.300 -0.090 0.000 1.137 307 R CA 1.656 57.709 56.100 -0.078 0.000 0.951 307 R CB -0.172 30.107 30.300 -0.036 0.000 0.851 307 R HN 0.548 8.818 8.270 -0.000 0.000 0.434 308 E N 0.712 120.869 120.200 -0.072 0.000 2.058 308 E HA -0.220 4.132 4.350 0.002 0.000 0.194 308 E C 1.924 178.474 176.600 -0.084 0.000 0.997 308 E CA 1.476 57.841 56.400 -0.059 0.000 0.801 308 E CB -0.535 29.140 29.700 -0.041 0.000 0.746 308 E HN 0.328 8.688 8.360 -0.000 0.000 0.450 309 I N 1.076 121.578 120.570 -0.114 0.000 2.208 309 I HA -0.266 3.906 4.170 0.002 0.000 0.245 309 I C 2.438 178.364 176.117 -0.319 0.000 1.097 309 I CA 1.162 62.374 61.300 -0.146 0.000 1.363 309 I CB -0.223 37.688 38.000 -0.149 0.000 1.051 309 I HN 0.191 8.401 8.210 -0.000 0.000 0.413 310 L N 0.228 121.204 121.223 -0.411 0.000 2.465 310 L HA -0.133 4.208 4.340 0.002 0.000 0.224 310 L C 2.156 178.861 176.870 -0.275 0.000 1.145 310 L CA 0.898 55.386 54.840 -0.587 0.000 0.834 310 L CB -0.421 41.399 42.059 -0.398 0.000 0.944 310 L HN 0.214 8.444 8.230 -0.000 0.000 0.451 311 K N -0.157 120.163 120.400 -0.133 0.000 2.314 311 K HA 0.060 4.382 4.320 0.002 0.000 0.198 311 K C 0.404 177.020 176.600 0.027 0.000 1.045 311 K CA 0.152 56.420 56.287 -0.032 0.000 0.988 311 K CB 0.270 32.758 32.500 -0.020 0.000 0.783 311 K HN 0.368 8.618 8.250 -0.000 0.000 0.484 312 E N 1.864 122.093 120.200 0.049 0.000 2.371 312 E HA 0.095 4.446 4.350 0.002 0.000 0.257 312 E C -2.309 174.418 176.600 0.211 0.000 1.134 312 E CA -1.858 54.612 56.400 0.117 0.000 0.919 312 E CB 0.396 30.173 29.700 0.128 0.000 1.025 312 E HN 0.012 8.372 8.360 -0.000 0.000 0.438 313 P HA 0.058 4.478 4.420 -0.000 0.000 0.276 313 P C -0.422 176.967 177.300 0.148 0.000 1.252 313 P CA -0.342 62.857 63.100 0.165 0.000 0.802 313 P CB 0.667 32.428 31.700 0.101 0.000 1.035 314 V N 2.191 122.124 119.914 0.032 0.000 2.843 314 V HA 0.001 4.122 4.120 0.002 0.000 0.305 314 V C 1.102 177.174 176.094 -0.037 0.000 1.065 314 V CA 0.088 62.273 62.300 -0.191 0.000 1.116 314 V CB -0.417 31.267 31.823 -0.232 0.000 0.968 314 V HN 0.684 8.874 8.190 -0.000 0.000 0.487 315 H N 3.423 122.402 119.070 -0.152 0.000 2.511 315 H HA 0.331 4.888 4.556 0.002 0.000 0.346 315 H C 0.865 176.176 175.328 -0.029 0.000 1.128 315 H CA 0.187 56.199 56.048 -0.061 0.000 1.342 315 H CB 1.252 30.979 29.762 -0.059 0.000 1.470 315 H HN 0.924 9.204 8.280 -0.000 0.000 0.546 316 G N 3.751 112.156 108.800 -0.659 0.000 2.323 316 G HA2 -0.209 3.752 3.960 0.002 0.000 0.292 316 G HA3 -0.209 3.752 3.960 0.002 0.000 0.292 316 G C -0.371 174.526 174.900 -0.004 0.000 1.040 316 G CA 0.505 45.397 45.100 -0.347 0.000 0.942 316 G HN 0.528 8.818 8.290 -0.000 0.000 0.506 317 V N 1.364 121.281 119.914 0.006 0.000 2.328 317 V HA 0.678 4.799 4.120 0.002 0.000 0.278 317 V C 0.063 176.223 176.094 0.110 0.000 1.021 317 V CA -0.516 61.793 62.300 0.014 0.000 0.838 317 V CB 0.623 32.448 31.823 0.004 0.000 0.999 317 V HN 0.624 8.815 8.190 -0.000 0.000 0.447 318 Y N 3.979 124.297 120.300 0.030 0.000 2.524 318 Y HA 0.740 5.292 4.550 0.003 0.000 0.347 318 Y C -1.087 174.875 175.900 0.104 0.000 1.005 318 Y CA -1.923 56.218 58.100 0.068 0.000 1.025 318 Y CB 1.157 39.631 38.460 0.023 0.000 1.275 318 Y HN 0.550 8.830 8.280 -0.000 0.000 0.460 319 Y N 2.434 122.809 120.300 0.126 0.000 2.304 319 Y HA 0.497 5.048 4.550 0.002 0.000 0.327 319 Y C -0.910 175.069 175.900 0.132 0.000 1.209 319 Y CA -0.598 57.517 58.100 0.026 0.000 1.299 319 Y CB 1.223 39.767 38.460 0.140 0.000 1.249 319 Y HN 0.825 9.105 8.280 -0.000 0.000 0.519 320 D N 7.003 126.883 120.400 -0.867 0.000 2.473 320 D HA 0.330 4.971 4.640 0.002 0.000 0.253 320 D C -2.373 173.356 176.300 -0.952 0.000 1.233 320 D CA -2.499 51.133 54.000 -0.613 0.000 0.908 320 D CB 2.074 42.763 40.800 -0.185 0.000 1.170 320 D HN 0.284 8.654 8.370 -0.000 0.000 0.558 321 P HA -0.138 4.282 4.420 -0.000 0.000 0.220 321 P C 1.161 178.362 177.300 -0.165 0.000 1.144 321 P CA 1.030 63.922 63.100 -0.346 0.000 0.800 321 P CB 0.216 31.899 31.700 -0.027 0.000 0.772 322 S N -2.449 113.161 115.700 -0.150 0.000 2.527 322 S HA 0.053 4.524 4.470 0.002 0.000 0.222 322 S C 0.770 175.316 174.600 -0.089 0.000 0.985 322 S CA 0.217 58.374 58.200 -0.070 0.000 0.921 322 S CB -0.531 62.647 63.200 -0.037 0.000 0.772 322 S HN 0.099 8.409 8.310 -0.000 0.000 0.529 323 K N 1.304 121.610 120.400 -0.155 0.000 2.166 323 K HA 0.431 4.753 4.320 0.002 0.000 0.245 323 K C -1.123 175.387 176.600 -0.151 0.000 0.967 323 K CA -0.905 55.297 56.287 -0.141 0.000 0.863 323 K CB 0.722 33.128 32.500 -0.157 0.000 1.107 323 K HN 0.105 8.355 8.250 -0.000 0.000 0.436 324 D N 1.411 121.731 120.400 -0.134 0.000 2.362 324 D HA 0.146 4.787 4.640 0.002 0.000 0.242 324 D C -0.107 176.057 176.300 -0.227 0.000 1.132 324 D CA -0.000 53.907 54.000 -0.155 0.000 0.907 324 D CB 0.772 41.487 40.800 -0.142 0.000 1.195 324 D HN 0.193 8.563 8.370 -0.000 0.000 0.429 325 L N 1.592 122.646 121.223 -0.282 0.000 2.307 325 L HA 0.429 4.771 4.340 0.002 0.000 0.282 325 L C 0.069 176.658 176.870 -0.469 0.000 1.051 325 L CA -0.551 54.036 54.840 -0.422 0.000 0.804 325 L CB 0.959 42.712 42.059 -0.511 0.000 1.197 325 L HN 0.140 8.370 8.230 -0.000 0.000 0.431 326 I N 2.782 122.978 120.570 -0.623 0.000 2.436 326 I HA 0.506 4.678 4.170 0.002 0.000 0.289 326 I C -0.196 175.416 176.117 -0.840 0.000 1.010 326 I CA -0.412 60.448 61.300 -0.733 0.000 1.098 326 I CB 1.938 39.424 38.000 -0.857 0.000 1.266 326 I HN 0.598 8.808 8.210 -0.000 0.000 0.434 327 A N 6.060 128.455 122.820 -0.708 0.000 2.287 327 A HA 0.605 4.926 4.320 0.002 0.000 0.317 327 A C -0.544 176.869 177.584 -0.286 0.000 1.220 327 A CA -0.504 51.194 52.037 -0.566 0.000 0.835 327 A CB 0.671 19.151 19.000 -0.867 0.000 1.180 327 A HN 0.727 8.877 8.150 -0.000 0.000 0.500 328 E N 1.672 121.813 120.200 -0.098 0.000 2.191 328 E HA 0.591 4.942 4.350 0.002 0.000 0.278 328 E C -1.148 175.531 176.600 0.132 0.000 0.972 328 E CA -0.326 56.103 56.400 0.049 0.000 0.804 328 E CB 1.876 31.650 29.700 0.123 0.000 1.110 328 E HN 0.637 8.997 8.360 -0.000 0.000 0.394 329 I N 2.605 123.278 120.570 0.172 0.000 2.545 329 I HA 0.209 4.381 4.170 0.002 0.000 0.292 329 I C -0.882 175.377 176.117 0.236 0.000 1.040 329 I CA -0.822 60.625 61.300 0.246 0.000 1.068 329 I CB 1.897 40.065 38.000 0.279 0.000 1.251 329 I HN 0.337 8.547 8.210 -0.000 0.000 0.424 330 Q N 4.624 124.565 119.800 0.234 0.000 2.353 330 Q HA 0.395 4.736 4.340 0.002 0.000 0.268 330 Q C -0.731 175.317 176.000 0.080 0.000 1.045 330 Q CA -0.829 55.061 55.803 0.144 0.000 0.811 330 Q CB 2.294 31.073 28.738 0.068 0.000 1.305 330 Q HN 0.334 8.604 8.270 -0.000 0.000 0.447 331 K N 1.956 122.286 120.400 -0.117 0.000 2.316 331 K HA 0.100 4.422 4.320 0.002 0.000 0.289 331 K C -0.047 176.292 176.600 -0.435 0.000 1.070 331 K CA -0.024 55.880 56.287 -0.638 0.000 0.928 331 K CB 0.639 32.785 32.500 -0.588 0.000 1.039 331 K HN 0.532 8.782 8.250 -0.000 0.000 0.480 332 Q N 2.574 122.087 119.800 -0.480 0.000 2.319 332 Q HA 0.142 4.483 4.340 0.002 0.000 0.202 332 Q C 0.448 176.289 176.000 -0.266 0.000 0.896 332 Q CA 0.528 56.166 55.803 -0.275 0.000 0.942 332 Q CB 1.008 29.643 28.738 -0.171 0.000 1.083 332 Q HN 1.014 9.284 8.270 -0.000 0.000 0.510 333 G N 1.376 109.952 108.800 -0.373 0.000 2.730 333 G HA2 -0.271 3.691 3.960 0.002 0.000 0.686 333 G HA3 -0.271 3.691 3.960 0.002 0.000 0.686 333 G C -0.394 174.393 174.900 -0.188 0.000 1.343 333 G CA -0.200 44.746 45.100 -0.257 0.000 0.826 333 G HN 0.249 8.539 8.290 -0.000 0.000 0.582 334 Q N -1.379 118.347 119.800 -0.124 0.000 2.481 334 Q HA -0.142 4.200 4.340 0.002 0.000 0.272 334 Q C 1.718 177.712 176.000 -0.010 0.000 1.157 334 Q CA 2.347 58.119 55.803 -0.051 0.000 0.935 334 Q CB -1.558 27.165 28.738 -0.025 0.000 1.338 334 Q HN 2.856 11.126 8.270 -0.000 0.000 0.494 335 G N -0.944 107.837 108.800 -0.031 0.000 2.162 335 G HA2 -0.331 3.631 3.960 0.002 0.000 0.260 335 G HA3 -0.331 3.631 3.960 0.002 0.000 0.260 335 G C -0.050 174.948 174.900 0.164 0.000 0.976 335 G CA 0.564 45.737 45.100 0.122 0.000 0.655 335 G HN 0.390 8.680 8.290 -0.000 0.000 0.533 336 Q N -1.158 118.607 119.800 -0.058 0.000 2.245 336 Q HA 0.629 4.971 4.340 0.002 0.000 0.256 336 Q C -0.781 175.082 176.000 -0.229 0.000 0.942 336 Q CA -0.405 55.412 55.803 0.023 0.000 0.896 336 Q CB 1.308 30.046 28.738 -0.001 0.000 1.272 336 Q HN 0.364 8.634 8.270 -0.000 0.000 0.442 337 W N 0.494 121.873 121.300 0.133 0.000 3.022 337 W HA 0.383 5.045 4.660 0.003 0.000 0.335 337 W C -0.451 176.120 176.519 0.086 0.000 1.133 337 W CA -0.517 56.904 57.345 0.128 0.000 1.219 337 W CB 1.759 31.337 29.460 0.197 0.000 1.409 337 W HN 0.515 8.695 8.180 -0.000 0.000 0.507 338 T N -0.395 114.305 114.554 0.243 0.000 2.932 338 T HA 0.862 5.214 4.350 0.002 0.000 0.289 338 T C -1.213 173.556 174.700 0.114 0.000 1.039 338 T CA -0.762 61.374 62.100 0.061 0.000 1.024 338 T CB 2.023 70.883 68.868 -0.013 0.000 1.090 338 T HN 0.533 8.773 8.240 -0.000 0.000 0.496 339 Y N -1.002 119.203 120.300 -0.158 0.000 2.609 339 Y HA 0.781 5.332 4.550 0.002 0.000 0.336 339 Y C -1.712 174.068 175.900 -0.200 0.000 1.129 339 Y CA -1.387 56.631 58.100 -0.137 0.000 1.040 339 Y CB 1.393 39.805 38.460 -0.081 0.000 1.310 339 Y HN 0.636 8.916 8.280 -0.000 0.000 0.460 340 Q N 2.491 122.276 119.800 -0.024 0.000 2.359 340 Q HA 0.700 5.041 4.340 0.002 0.000 0.274 340 Q C -1.554 174.476 176.000 0.050 0.000 1.074 340 Q CA -0.561 55.216 55.803 -0.044 0.000 0.810 340 Q CB 3.312 32.030 28.738 -0.032 0.000 1.342 340 Q HN 0.761 9.031 8.270 -0.000 0.000 0.427 341 I N 3.251 123.851 120.570 0.049 0.000 2.406 341 I HA 0.632 4.804 4.170 0.002 0.000 0.290 341 I C -1.082 174.989 176.117 -0.078 0.000 0.999 341 I CA -1.023 60.204 61.300 -0.122 0.000 1.124 341 I CB 0.874 38.845 38.000 -0.048 0.000 1.289 341 I HN 0.677 8.887 8.210 -0.000 0.000 0.441 342 Y N 3.167 123.344 120.300 -0.205 0.000 2.764 342 Y HA 0.481 5.032 4.550 0.002 0.000 0.331 342 Y C -0.390 175.363 175.900 -0.244 0.000 1.280 342 Y CA -0.902 57.077 58.100 -0.201 0.000 1.065 342 Y CB 1.023 39.397 38.460 -0.143 0.000 1.319 342 Y HN 0.451 8.731 8.280 -0.000 0.000 0.453 343 Q N -0.626 119.225 119.800 0.085 0.000 2.471 343 Q HA 0.256 4.597 4.340 0.002 0.000 0.259 343 Q C -0.712 175.343 176.000 0.092 0.000 0.850 343 Q CA 0.046 55.829 55.803 -0.033 0.000 0.981 343 Q CB 1.210 29.845 28.738 -0.172 0.000 1.180 343 Q HN 0.556 8.826 8.270 -0.000 0.000 0.571 344 E N 1.560 121.791 120.200 0.052 0.000 2.183 344 E HA 0.361 4.713 4.350 0.002 0.000 0.271 344 E C -2.578 173.879 176.600 -0.238 0.000 0.919 344 E CA -2.435 53.929 56.400 -0.060 0.000 0.781 344 E CB 1.501 31.137 29.700 -0.107 0.000 1.140 344 E HN -0.072 8.288 8.360 -0.000 0.000 0.402 345 P HA 0.010 4.430 4.420 -0.000 0.000 0.264 345 P C -0.363 176.585 177.300 -0.588 0.000 1.193 345 P CA 0.435 63.042 63.100 -0.822 0.000 0.763 345 P CB -0.016 31.272 31.700 -0.686 0.000 0.810 346 F N 0.186 119.912 119.950 -0.373 0.000 2.840 346 F HA -0.235 4.294 4.527 0.002 0.000 0.310 346 F C 0.755 176.435 175.800 -0.201 0.000 0.688 346 F CA 0.556 58.412 58.000 -0.240 0.000 1.286 346 F CB -1.269 37.601 39.000 -0.216 0.000 1.612 346 F HN 0.308 8.608 8.300 -0.000 0.000 0.335 347 K N 1.393 121.742 120.400 -0.085 0.000 2.724 347 K HA 0.278 4.600 4.320 0.002 0.000 0.198 347 K C -0.235 176.362 176.600 -0.006 0.000 1.099 347 K CA -0.318 55.938 56.287 -0.051 0.000 1.025 347 K CB 0.199 32.648 32.500 -0.085 0.000 1.509 347 K HN 0.042 8.292 8.250 -0.000 0.000 0.564 348 N N 1.534 120.258 118.700 0.039 0.000 2.458 348 N HA 0.055 4.796 4.740 0.002 0.000 0.258 348 N C 1.137 176.709 175.510 0.103 0.000 1.219 348 N CA 0.128 53.245 53.050 0.112 0.000 0.902 348 N CB 1.020 39.592 38.487 0.141 0.000 1.076 348 N HN 0.279 8.659 8.380 -0.000 0.000 0.455 349 L N 0.551 121.850 121.223 0.127 0.000 2.556 349 L HA 0.214 4.556 4.340 0.002 0.000 0.226 349 L C 0.357 177.394 176.870 0.278 0.000 1.089 349 L CA 0.261 55.216 54.840 0.192 0.000 0.864 349 L CB 0.095 42.258 42.059 0.173 0.000 1.067 349 L HN 0.423 8.653 8.230 -0.000 0.000 0.477 350 K N 0.636 121.171 120.400 0.224 0.000 2.580 350 K HA 0.342 4.663 4.320 0.002 0.000 0.258 350 K C -0.926 175.716 176.600 0.070 0.000 0.936 350 K CA -0.252 56.158 56.287 0.205 0.000 0.852 350 K CB 1.315 34.048 32.500 0.388 0.000 1.329 350 K HN -0.009 8.241 8.250 -0.000 0.000 0.430 351 T N 0.011 114.525 114.554 -0.067 0.000 2.906 351 T HA 0.947 5.298 4.350 0.002 0.000 0.295 351 T C -0.103 174.237 174.700 -0.599 0.000 1.075 351 T CA -0.344 61.554 62.100 -0.335 0.000 1.005 351 T CB 1.871 70.624 68.868 -0.191 0.000 1.136 351 T HN 0.834 9.074 8.240 -0.000 0.000 0.498 352 G N 0.294 108.360 108.800 -1.224 0.000 2.645 352 G HA2 0.665 4.626 3.960 0.002 0.000 0.292 352 G HA3 0.665 4.626 3.960 0.002 0.000 0.292 352 G C -2.027 172.393 174.900 -0.800 0.000 1.415 352 G CA -1.039 43.398 45.100 -1.105 0.000 0.785 352 G HN 0.832 9.122 8.290 -0.000 0.000 0.483 353 K N -0.087 120.079 120.400 -0.390 0.000 2.550 353 K HA 0.549 4.871 4.320 0.002 0.000 0.252 353 K C -1.839 174.793 176.600 0.052 0.000 0.943 353 K CA -0.733 55.475 56.287 -0.132 0.000 0.806 353 K CB 1.842 34.328 32.500 -0.023 0.000 1.289 353 K HN 0.607 8.857 8.250 -0.000 0.000 0.435 354 Y N 0.865 121.330 120.300 0.275 0.000 2.598 354 Y HA 0.799 5.351 4.550 0.002 0.000 0.340 354 Y C -0.349 175.713 175.900 0.270 0.000 1.038 354 Y CA -1.379 56.872 58.100 0.252 0.000 1.100 354 Y CB 2.719 41.326 38.460 0.244 0.000 1.281 354 Y HN 0.679 8.959 8.280 -0.000 0.000 0.488 355 A N 2.638 125.698 122.820 0.400 0.000 2.246 355 A HA 0.502 4.823 4.320 0.002 0.000 0.302 355 A C -1.574 176.119 177.584 0.182 0.000 0.999 355 A CA -0.587 51.622 52.037 0.285 0.000 0.998 355 A CB 0.886 20.014 19.000 0.213 0.000 1.183 355 A HN 0.802 8.952 8.150 -0.000 0.000 0.351 356 R N 2.791 123.380 120.500 0.147 0.000 2.707 356 R HA 0.699 5.040 4.340 0.002 0.000 0.272 356 R C 0.094 176.441 176.300 0.078 0.000 1.011 356 R CA -0.724 55.427 56.100 0.084 0.000 0.893 356 R CB 1.224 31.543 30.300 0.032 0.000 1.233 356 R HN 1.128 9.398 8.270 -0.000 0.000 0.464 357 M N 2.555 122.187 119.600 0.053 0.000 3.310 357 M HA 0.320 4.801 4.480 0.002 0.000 0.233 357 M C -0.353 175.958 176.300 0.018 0.000 1.267 357 M CA 0.102 55.427 55.300 0.042 0.000 1.301 357 M CB -0.077 32.530 32.600 0.011 0.000 1.186 357 M HN 0.275 8.565 8.290 -0.000 0.000 0.515 358 R N 1.259 121.765 120.500 0.009 0.000 2.408 358 R HA 0.342 4.683 4.340 0.002 0.000 0.308 358 R C 0.860 177.142 176.300 -0.030 0.000 1.210 358 R CA 0.574 56.663 56.100 -0.018 0.000 1.115 358 R CB 0.014 30.290 30.300 -0.040 0.000 1.127 358 R HN 0.840 9.110 8.270 -0.000 0.000 0.523 359 G N 2.631 111.418 108.800 -0.021 0.000 2.320 359 G HA2 -0.352 3.609 3.960 0.002 0.000 0.291 359 G HA3 -0.352 3.609 3.960 0.002 0.000 0.291 359 G C 0.111 174.984 174.900 -0.044 0.000 0.994 359 G CA 0.773 45.858 45.100 -0.026 0.000 0.760 359 G HN 0.747 9.037 8.290 -0.000 0.000 0.514 360 A N -0.974 121.831 122.820 -0.025 0.000 3.156 360 A HA 0.666 4.988 4.320 0.002 0.000 0.311 360 A C 0.091 177.700 177.584 0.042 0.000 1.129 360 A CA 0.720 52.727 52.037 -0.051 0.000 0.809 360 A CB 0.347 19.269 19.000 -0.130 0.000 1.257 360 A HN 0.663 8.813 8.150 -0.000 0.000 0.491 361 H N 1.363 120.417 119.070 -0.028 0.000 2.553 361 H HA 0.069 4.627 4.556 0.003 0.000 0.276 361 H C 1.575 176.899 175.328 -0.006 0.000 0.979 361 H CA 2.152 58.199 56.048 -0.002 0.000 1.268 361 H CB 0.750 30.509 29.762 -0.005 0.000 1.450 361 H HN 0.495 8.775 8.280 -0.000 0.000 0.527 362 T N -2.731 111.769 114.554 -0.090 0.000 3.132 362 T HA 0.178 4.529 4.350 0.002 0.000 0.274 362 T C 0.219 174.852 174.700 -0.112 0.000 1.011 362 T CA -0.651 61.367 62.100 -0.136 0.000 0.899 362 T CB -0.228 68.600 68.868 -0.065 0.000 1.089 362 T HN 0.087 8.327 8.240 -0.000 0.000 0.543 363 N N 1.318 119.952 118.700 -0.110 0.000 2.524 363 N HA 0.280 5.022 4.740 0.002 0.000 0.261 363 N C -0.234 175.226 175.510 -0.083 0.000 0.998 363 N CA -0.303 52.658 53.050 -0.148 0.000 0.915 363 N CB 1.810 40.138 38.487 -0.264 0.000 1.187 363 N HN -0.048 8.332 8.380 -0.000 0.000 0.507 364 D N 2.187 122.584 120.400 -0.006 0.000 2.097 364 D HA -0.102 4.539 4.640 0.002 0.000 0.195 364 D C 1.731 178.117 176.300 0.144 0.000 0.989 364 D CA 1.207 55.302 54.000 0.158 0.000 0.827 364 D CB 0.458 41.357 40.800 0.164 0.000 0.966 364 D HN 0.354 8.724 8.370 -0.000 0.000 0.456 365 V N 0.629 120.574 119.914 0.052 0.000 2.427 365 V HA -0.180 3.941 4.120 0.002 0.000 0.248 365 V C 2.375 178.442 176.094 -0.046 0.000 1.051 365 V CA 1.419 63.784 62.300 0.109 0.000 1.048 365 V CB -0.408 31.530 31.823 0.191 0.000 0.666 365 V HN 0.161 8.351 8.190 -0.000 0.000 0.456 366 K N -0.031 120.120 120.400 -0.415 0.000 2.097 366 K HA -0.206 4.115 4.320 0.002 0.000 0.205 366 K C 2.233 178.650 176.600 -0.305 0.000 1.050 366 K CA 1.473 57.339 56.287 -0.703 0.000 0.938 366 K CB -0.075 31.822 32.500 -1.005 0.000 0.718 366 K HN 0.541 8.791 8.250 -0.000 0.000 0.442 367 Q N 0.322 119.988 119.800 -0.223 0.000 2.016 367 Q HA -0.164 4.177 4.340 0.002 0.000 0.200 367 Q C 2.160 177.815 176.000 -0.576 0.000 0.978 367 Q CA 1.373 57.016 55.803 -0.267 0.000 0.833 367 Q CB -0.193 28.553 28.738 0.015 0.000 0.895 367 Q HN 0.243 8.513 8.270 -0.000 0.000 0.427 368 L N 0.691 121.533 121.223 -0.635 0.000 2.042 368 L HA -0.180 4.162 4.340 0.002 0.000 0.210 368 L C 2.074 178.839 176.870 -0.174 0.000 1.076 368 L CA 2.036 56.476 54.840 -0.667 0.000 0.749 368 L CB -0.851 41.047 42.059 -0.269 0.000 0.893 368 L HN 0.143 8.373 8.230 -0.000 0.000 0.432 369 T N -0.643 113.972 114.554 0.102 0.000 2.788 369 T HA -0.167 4.185 4.350 0.002 0.000 0.268 369 T C 1.703 176.432 174.700 0.048 0.000 1.044 369 T CA 1.694 63.974 62.100 0.299 0.000 1.139 369 T CB -0.209 68.883 68.868 0.374 0.000 0.867 369 T HN 0.488 8.728 8.240 -0.000 0.000 0.454 370 E N 0.893 121.027 120.200 -0.111 0.000 2.107 370 E HA 0.016 4.368 4.350 0.002 0.000 0.191 370 E C 2.575 179.032 176.600 -0.240 0.000 0.982 370 E CA 0.802 57.088 56.400 -0.190 0.000 0.809 370 E CB -0.174 29.403 29.700 -0.205 0.000 0.756 370 E HN 0.470 8.830 8.360 -0.000 0.000 0.459 371 A N 0.996 123.641 122.820 -0.290 0.000 1.902 371 A HA -0.148 4.174 4.320 0.002 0.000 0.217 371 A C 2.496 180.013 177.584 -0.111 0.000 1.181 371 A CA 1.128 53.040 52.037 -0.208 0.000 0.623 371 A CB -0.713 18.135 19.000 -0.252 0.000 0.818 371 A HN 0.113 8.263 8.150 -0.000 0.000 0.443 372 V N 0.032 119.848 119.914 -0.163 0.000 2.332 372 V HA -0.357 3.764 4.120 0.002 0.000 0.248 372 V C 2.648 178.707 176.094 -0.058 0.000 1.055 372 V CA 2.411 64.545 62.300 -0.276 0.000 1.038 372 V CB -0.946 30.700 31.823 -0.294 0.000 0.651 372 V HN 0.662 8.852 8.190 -0.000 0.000 0.450 373 Q N -0.542 119.225 119.800 -0.056 0.000 2.083 373 Q HA -0.168 4.174 4.340 0.002 0.000 0.198 373 Q C 2.380 178.467 176.000 0.146 0.000 0.969 373 Q CA 1.271 57.098 55.803 0.040 0.000 0.838 373 Q CB -0.171 28.374 28.738 -0.321 0.000 0.900 373 Q HN 0.586 8.856 8.270 -0.000 0.000 0.436 374 K N 0.478 120.869 120.400 -0.015 0.000 2.097 374 K HA -0.097 4.225 4.320 0.002 0.000 0.205 374 K C 2.000 178.598 176.600 -0.003 0.000 1.050 374 K CA 1.002 57.270 56.287 -0.032 0.000 0.938 374 K CB -0.047 32.263 32.500 -0.316 0.000 0.718 374 K HN 0.196 8.446 8.250 -0.000 0.000 0.442 375 I N 0.772 121.346 120.570 0.008 0.000 2.252 375 I HA -0.253 3.918 4.170 0.002 0.000 0.245 375 I C 2.123 178.276 176.117 0.060 0.000 1.102 375 I CA 1.219 62.478 61.300 -0.068 0.000 1.385 375 I CB -0.401 37.559 38.000 -0.067 0.000 1.064 375 I HN 0.159 8.369 8.210 -0.000 0.000 0.414 376 T N -0.177 114.489 114.554 0.188 0.000 2.777 376 T HA -0.153 4.198 4.350 0.002 0.000 0.266 376 T C 1.936 176.531 174.700 -0.175 0.000 1.040 376 T CA 1.950 64.060 62.100 0.017 0.000 1.141 376 T CB -0.369 68.460 68.868 -0.066 0.000 0.868 376 T HN 0.336 8.576 8.240 -0.000 0.000 0.444 377 T N 2.009 116.574 114.554 0.018 0.000 2.684 377 T HA -0.121 4.231 4.350 0.002 0.000 0.267 377 T C 1.949 176.675 174.700 0.042 0.000 1.036 377 T CA 1.346 63.535 62.100 0.148 0.000 1.148 377 T CB -0.318 68.797 68.868 0.413 0.000 0.863 377 T HN 0.513 8.753 8.240 -0.000 0.000 0.436 378 E N 0.552 120.720 120.200 -0.053 0.000 2.118 378 E HA -0.124 4.228 4.350 0.002 0.000 0.195 378 E C 2.443 178.984 176.600 -0.099 0.000 0.992 378 E CA 1.201 57.480 56.400 -0.201 0.000 0.804 378 E CB -0.159 29.221 29.700 -0.533 0.000 0.741 378 E HN 0.340 8.700 8.360 -0.000 0.000 0.458 379 S N 0.166 115.829 115.700 -0.062 0.000 2.402 379 S HA -0.094 4.378 4.470 0.002 0.000 0.229 379 S C 1.924 176.445 174.600 -0.132 0.000 1.021 379 S CA 0.612 58.853 58.200 0.068 0.000 0.974 379 S CB -0.112 63.155 63.200 0.111 0.000 0.800 379 S HN 0.177 8.487 8.310 -0.000 0.000 0.484 380 I N 0.932 121.318 120.570 -0.307 0.000 2.202 380 I HA -0.124 4.048 4.170 0.002 0.000 0.242 380 I C 2.305 178.154 176.117 -0.447 0.000 1.091 380 I CA 0.990 61.990 61.300 -0.499 0.000 1.368 380 I CB -0.468 37.132 38.000 -0.667 0.000 1.058 380 I HN 0.181 8.391 8.210 -0.000 0.000 0.410 381 V N 1.347 121.055 119.914 -0.343 0.000 2.287 381 V HA -0.297 3.825 4.120 0.002 0.000 0.248 381 V C 2.255 178.187 176.094 -0.270 0.000 1.053 381 V CA 2.046 64.185 62.300 -0.268 0.000 1.027 381 V CB -0.445 31.366 31.823 -0.020 0.000 0.646 381 V HN 0.342 8.532 8.190 -0.000 0.000 0.447 382 I N -1.916 118.385 120.570 -0.448 0.000 2.333 382 I HA -0.149 4.023 4.170 0.002 0.000 0.246 382 I C 2.022 177.495 176.117 -1.074 0.000 1.106 382 I CA 1.454 62.257 61.300 -0.829 0.000 1.411 382 I CB -0.219 36.876 38.000 -1.508 0.000 1.082 382 I HN 0.391 8.601 8.210 -0.000 0.000 0.420 383 W N -0.003 120.874 121.300 -0.706 0.000 2.725 383 W HA 0.390 5.052 4.660 0.002 0.000 0.336 383 W C 1.341 177.136 176.519 -1.207 0.000 1.012 383 W CA 0.529 57.282 57.345 -0.986 0.000 1.566 383 W CB -0.067 28.877 29.460 -0.860 0.000 1.068 383 W HN 0.282 8.462 8.180 -0.000 0.000 0.546 384 G N 2.601 110.768 108.800 -1.055 0.000 2.147 384 G HA2 -0.298 3.663 3.960 0.002 0.000 0.244 384 G HA3 -0.298 3.663 3.960 0.002 0.000 0.244 384 G C 0.116 174.929 174.900 -0.143 0.000 1.005 384 G CA 0.955 45.767 45.100 -0.479 0.000 0.713 384 G HN 0.370 8.660 8.290 -0.000 0.000 0.515 385 K N -1.788 118.466 120.400 -0.243 0.000 2.578 385 K HA 0.728 5.049 4.320 0.002 0.000 0.287 385 K C -0.339 176.115 176.600 -0.245 0.000 1.010 385 K CA -0.421 55.767 56.287 -0.165 0.000 0.889 385 K CB 0.755 33.253 32.500 -0.003 0.000 1.514 385 K HN 0.586 8.836 8.250 -0.000 0.000 0.424 386 T N -0.723 113.724 114.554 -0.178 0.000 2.907 386 T HA 0.587 4.938 4.350 0.002 0.000 0.284 386 T C -2.244 172.364 174.700 -0.154 0.000 1.004 386 T CA -1.548 60.450 62.100 -0.171 0.000 1.063 386 T CB 1.212 70.028 68.868 -0.087 0.000 0.992 386 T HN 0.499 8.739 8.240 -0.000 0.000 0.483 387 P HA 0.382 4.802 4.420 -0.000 0.000 0.280 387 P C -1.138 175.936 177.300 -0.375 0.000 1.272 387 P CA -0.898 61.966 63.100 -0.394 0.000 0.819 387 P CB 0.988 32.322 31.700 -0.612 0.000 1.122 388 K N 1.188 121.356 120.400 -0.388 0.000 2.234 388 K HA 0.355 4.677 4.320 0.002 0.000 0.277 388 K C -0.888 175.507 176.600 -0.342 0.000 1.038 388 K CA -0.483 55.655 56.287 -0.248 0.000 0.888 388 K CB 0.016 32.396 32.500 -0.201 0.000 1.091 388 K HN 0.197 8.447 8.250 -0.000 0.000 0.467 389 F N 2.904 122.785 119.950 -0.115 0.000 2.375 389 F HA 0.281 4.809 4.527 0.002 0.000 0.333 389 F C 0.504 176.204 175.800 -0.167 0.000 1.104 389 F CA -0.217 57.711 58.000 -0.119 0.000 1.149 389 F CB 1.177 40.135 39.000 -0.071 0.000 1.190 389 F HN 0.274 8.574 8.300 -0.000 0.000 0.533 390 K N 4.440 124.853 120.400 0.022 0.000 2.464 390 K HA 0.445 4.767 4.320 0.002 0.000 0.252 390 K C -1.269 175.326 176.600 -0.008 0.000 1.000 390 K CA -0.318 55.947 56.287 -0.036 0.000 0.951 390 K CB 0.995 33.484 32.500 -0.018 0.000 1.183 390 K HN 0.472 8.722 8.250 -0.000 0.000 0.445 391 L N 4.582 125.736 121.223 -0.116 0.000 2.289 391 L HA 0.361 4.703 4.340 0.002 0.000 0.285 391 L C -1.834 175.055 176.870 0.032 0.000 1.049 391 L CA -2.110 52.661 54.840 -0.116 0.000 0.804 391 L CB 0.910 42.702 42.059 -0.445 0.000 1.195 391 L HN 0.348 8.578 8.230 -0.000 0.000 0.428 392 P HA 0.241 4.661 4.420 -0.000 0.000 0.237 392 P C -0.613 176.780 177.300 0.155 0.000 1.788 392 P CA 0.357 63.538 63.100 0.134 0.000 1.061 392 P CB 0.428 32.226 31.700 0.164 0.000 1.967 393 I N -0.637 120.030 120.570 0.160 0.000 2.842 393 I HA 0.193 4.364 4.170 0.002 0.000 0.296 393 I C -1.179 175.009 176.117 0.119 0.000 1.538 393 I CA -0.952 60.445 61.300 0.162 0.000 0.994 393 I CB 2.810 40.935 38.000 0.207 0.000 1.372 393 I HN -0.075 8.135 8.210 -0.000 0.000 0.478 394 Q N 4.970 124.790 119.800 0.035 0.000 2.332 394 Q HA 0.111 4.452 4.340 0.002 0.000 0.263 394 Q C 0.826 176.616 176.000 -0.351 0.000 0.979 394 Q CA 0.118 55.867 55.803 -0.090 0.000 0.885 394 Q CB 1.547 30.264 28.738 -0.035 0.000 1.218 394 Q HN 0.621 8.891 8.270 -0.000 0.000 0.405 395 K N 2.757 122.711 120.400 -0.743 0.000 2.034 395 K HA -0.284 4.038 4.320 0.002 0.000 0.214 395 K C 1.105 177.421 176.600 -0.474 0.000 1.051 395 K CA 2.282 57.817 56.287 -1.254 0.000 0.931 395 K CB 0.203 32.185 32.500 -0.864 0.000 0.715 395 K HN 0.577 8.827 8.250 -0.000 0.000 0.446 396 E N -0.119 119.936 120.200 -0.241 0.000 2.118 396 E HA -0.132 4.220 4.350 0.002 0.000 0.195 396 E C 1.962 178.527 176.600 -0.058 0.000 0.992 396 E CA 1.833 58.161 56.400 -0.120 0.000 0.804 396 E CB -0.409 29.247 29.700 -0.074 0.000 0.741 396 E HN 0.374 8.734 8.360 -0.000 0.000 0.458 397 T N 0.359 114.920 114.554 0.011 0.000 2.770 397 T HA -0.140 4.212 4.350 0.002 0.000 0.263 397 T C 1.332 176.171 174.700 0.232 0.000 1.039 397 T CA 1.028 63.228 62.100 0.166 0.000 1.142 397 T CB -0.405 68.578 68.868 0.191 0.000 0.868 397 T HN 0.400 8.640 8.240 -0.000 0.000 0.435 398 W N 2.351 123.641 121.300 -0.016 0.000 2.333 398 W HA -0.143 4.518 4.660 0.002 0.000 0.316 398 W C 1.739 178.302 176.519 0.074 0.000 1.215 398 W CA 1.236 58.599 57.345 0.030 0.000 1.278 398 W CB -0.163 29.274 29.460 -0.038 0.000 1.154 398 W HN 0.188 8.368 8.180 -0.000 0.000 0.486 399 E N -0.069 120.159 120.200 0.046 0.000 2.265 399 E HA -0.144 4.207 4.350 0.002 0.000 0.196 399 E C 1.998 178.357 176.600 -0.401 0.000 0.996 399 E CA 1.783 58.140 56.400 -0.073 0.000 0.832 399 E CB -0.677 29.022 29.700 -0.001 0.000 0.756 399 E HN 0.288 8.648 8.360 -0.000 0.000 0.491 400 T N -0.911 113.390 114.554 -0.422 0.000 2.896 400 T HA -0.077 4.275 4.350 0.002 0.000 0.263 400 T C 1.242 175.324 174.700 -1.030 0.000 1.050 400 T CA 0.886 62.532 62.100 -0.756 0.000 1.140 400 T CB -0.148 68.225 68.868 -0.826 0.000 0.877 400 T HN 0.326 8.566 8.240 -0.000 0.000 0.457 401 W N 0.314 121.393 121.300 -0.368 0.000 2.901 401 W HA 0.282 4.943 4.660 0.002 0.000 0.281 401 W C 2.042 178.211 176.519 -0.583 0.000 1.167 401 W CA -1.192 55.911 57.345 -0.403 0.000 1.506 401 W CB -0.180 29.212 29.460 -0.112 0.000 0.985 401 W HN 0.286 8.466 8.180 -0.000 0.000 0.590 402 W N 1.761 122.659 121.300 -0.669 0.000 2.350 402 W HA -0.224 4.437 4.660 0.002 0.000 0.289 402 W C 1.569 177.830 176.519 -0.429 0.000 1.215 402 W CA 2.167 59.027 57.345 -0.807 0.000 1.236 402 W CB -1.777 26.581 29.460 -1.836 0.000 1.130 402 W HN -0.043 8.137 8.180 -0.000 0.000 0.541 403 T N -1.200 112.578 114.554 -1.294 0.000 2.962 403 T HA -0.165 4.187 4.350 0.002 0.000 0.270 403 T C 1.466 175.950 174.700 -0.360 0.000 1.088 403 T CA 1.396 62.869 62.100 -1.046 0.000 1.127 403 T CB -0.439 67.530 68.868 -1.498 0.000 0.883 403 T HN 0.049 8.289 8.240 -0.000 0.000 0.493 404 E N 0.745 120.633 120.200 -0.520 0.000 2.347 404 E HA -0.006 4.345 4.350 0.002 0.000 0.196 404 E C 0.607 176.945 176.600 -0.437 0.000 1.008 404 E CA 0.836 56.936 56.400 -0.500 0.000 0.852 404 E CB -0.118 29.136 29.700 -0.744 0.000 0.783 404 E HN 0.871 9.231 8.360 -0.000 0.000 0.505 405 Y N -2.362 118.023 120.300 0.141 0.000 2.527 405 Y HA 0.170 4.721 4.550 0.002 0.000 0.247 405 Y C 0.817 176.836 175.900 0.199 0.000 1.138 405 Y CA -0.908 57.271 58.100 0.131 0.000 1.228 405 Y CB 0.341 38.850 38.460 0.081 0.000 1.252 405 Y HN -0.021 8.259 8.280 -0.000 0.000 0.531 406 W N 3.670 125.091 121.300 0.201 0.000 2.238 406 W HA 0.164 4.826 4.660 0.002 0.000 0.321 406 W C -0.075 176.515 176.519 0.119 0.000 1.293 406 W CA 0.487 57.983 57.345 0.251 0.000 1.204 406 W CB 1.004 30.765 29.460 0.503 0.000 1.167 406 W HN 0.263 8.443 8.180 -0.000 0.000 0.553 407 Q N 3.321 122.903 119.800 -0.363 0.000 2.093 407 Q HA 0.239 4.581 4.340 0.002 0.000 0.217 407 Q C 0.042 175.755 176.000 -0.479 0.000 0.785 407 Q CA -0.229 55.387 55.803 -0.312 0.000 1.038 407 Q CB 1.393 29.943 28.738 -0.313 0.000 1.190 407 Q HN 0.342 8.612 8.270 -0.000 0.000 0.468 408 A N 0.530 122.896 122.820 -0.758 0.000 2.294 408 A HA 0.451 4.772 4.320 0.002 0.000 0.330 408 A C 1.007 178.373 177.584 -0.364 0.000 1.133 408 A CA -0.317 51.206 52.037 -0.857 0.000 0.836 408 A CB 0.753 18.693 19.000 -1.765 0.000 1.190 408 A HN 0.196 8.346 8.150 -0.000 0.000 0.492 409 T N -1.764 112.519 114.554 -0.451 0.000 3.081 409 T HA 0.100 4.451 4.350 0.002 0.000 0.255 409 T C 0.485 175.258 174.700 0.122 0.000 1.113 409 T CA 0.189 62.233 62.100 -0.092 0.000 1.082 409 T CB -0.352 68.491 68.868 -0.041 0.000 0.939 409 T HN 0.675 8.915 8.240 -0.000 0.000 0.506 410 W N 0.624 122.186 121.300 0.437 0.000 2.578 410 W HA 0.772 5.433 4.660 0.002 0.000 0.364 410 W C -1.070 175.818 176.519 0.614 0.000 1.144 410 W CA -1.799 55.821 57.345 0.458 0.000 1.242 410 W CB 0.723 30.475 29.460 0.486 0.000 1.382 410 W HN -0.103 8.077 8.180 -0.000 0.000 0.625 411 I N 2.451 123.539 120.570 0.863 0.000 2.586 411 I HA 0.203 4.374 4.170 0.002 0.000 0.288 411 I C -2.146 174.168 176.117 0.328 0.000 1.147 411 I CA -2.074 59.572 61.300 0.577 0.000 1.047 411 I CB 2.305 40.407 38.000 0.170 0.000 1.244 411 I HN 0.007 8.217 8.210 -0.000 0.000 0.429 412 P HA 0.339 4.759 4.420 -0.000 0.000 0.293 412 P C -0.935 176.179 177.300 -0.309 0.000 1.304 412 P CA -0.348 62.832 63.100 0.134 0.000 0.767 412 P CB 1.028 32.985 31.700 0.428 0.000 1.247 413 E N -0.814 119.254 120.200 -0.220 0.000 2.250 413 E HA 0.464 4.816 4.350 0.002 0.000 0.265 413 E C -0.621 175.825 176.600 -0.257 0.000 1.033 413 E CA 0.017 56.143 56.400 -0.456 0.000 0.888 413 E CB 0.794 30.353 29.700 -0.235 0.000 1.151 413 E HN 0.537 8.897 8.360 -0.000 0.000 0.412 414 W N -0.396 120.816 121.300 -0.146 0.000 3.146 414 W HA 0.479 5.141 4.660 0.003 0.000 0.319 414 W C -0.950 175.259 176.519 -0.516 0.000 1.258 414 W CA -0.919 56.240 57.345 -0.309 0.000 1.189 414 W CB 0.034 29.187 29.460 -0.511 0.000 1.412 414 W HN 0.504 8.684 8.180 -0.000 0.000 0.567 415 E N 0.413 120.414 120.200 -0.332 0.000 2.433 415 E HA 0.800 5.151 4.350 0.002 0.000 0.273 415 E C -1.736 174.390 176.600 -0.790 0.000 0.950 415 E CA -1.168 54.929 56.400 -0.506 0.000 0.796 415 E CB 2.584 32.180 29.700 -0.174 0.000 1.330 415 E HN 0.293 8.653 8.360 -0.000 0.000 0.455 416 F N 0.528 120.493 119.950 0.025 0.000 2.469 416 F HA 0.416 4.945 4.527 0.002 0.000 0.332 416 F C -0.194 175.613 175.800 0.013 0.000 1.103 416 F CA -1.296 56.697 58.000 -0.011 0.000 0.979 416 F CB 2.151 41.148 39.000 -0.005 0.000 1.137 416 F HN 0.281 8.581 8.300 -0.000 0.000 0.463 417 V N 4.138 124.151 119.914 0.165 0.000 2.350 417 V HA 0.379 4.501 4.120 0.002 0.000 0.276 417 V C -0.166 175.998 176.094 0.117 0.000 1.028 417 V CA -0.317 62.052 62.300 0.114 0.000 0.860 417 V CB 0.925 32.798 31.823 0.082 0.000 0.990 417 V HN 0.865 9.055 8.190 -0.000 0.000 0.453 418 N N 3.628 122.387 118.700 0.100 0.000 2.254 418 N HA 0.094 4.836 4.740 0.002 0.000 0.190 418 N C 0.138 175.681 175.510 0.055 0.000 1.107 418 N CA 0.132 53.229 53.050 0.078 0.000 0.869 418 N CB 0.843 39.374 38.487 0.074 0.000 0.983 418 N HN 0.645 9.025 8.380 -0.000 0.000 0.487 419 T N 3.567 118.152 114.554 0.052 0.000 2.779 419 T HA 0.296 4.647 4.350 0.002 0.000 0.280 419 T C -2.502 172.215 174.700 0.030 0.000 0.987 419 T CA -1.203 60.919 62.100 0.037 0.000 0.966 419 T CB 2.393 71.284 68.868 0.039 0.000 0.933 419 T HN 0.023 8.263 8.240 -0.000 0.000 0.442 420 P HA 0.212 4.632 4.420 -0.000 0.000 0.262 420 P C -2.710 174.582 177.300 -0.014 0.000 1.199 420 P CA -1.082 62.016 63.100 -0.004 0.000 0.763 420 P CB -0.369 31.317 31.700 -0.023 0.000 0.790 421 P HA 0.099 4.519 4.420 -0.000 0.000 0.276 421 P C 0.893 178.133 177.300 -0.101 0.000 1.243 421 P CA -0.385 62.705 63.100 -0.017 0.000 0.768 421 P CB 0.447 32.157 31.700 0.018 0.000 0.856 422 L N 5.732 126.886 121.223 -0.115 0.000 2.201 422 L HA -0.109 4.232 4.340 0.002 0.000 0.212 422 L C 1.611 178.140 176.870 -0.568 0.000 1.105 422 L CA 1.579 56.261 54.840 -0.264 0.000 0.775 422 L CB -0.719 41.247 42.059 -0.154 0.000 0.913 422 L HN 0.283 8.513 8.230 -0.000 0.000 0.440 423 V N -3.129 116.556 119.914 -0.382 0.000 3.623 423 V HA -0.084 4.037 4.120 0.002 0.000 0.274 423 V C 2.254 178.092 176.094 -0.427 0.000 1.244 423 V CA 0.959 62.962 62.300 -0.496 0.000 1.182 423 V CB -1.335 30.442 31.823 -0.075 0.000 0.925 423 V HN 0.498 8.688 8.190 -0.000 0.000 0.462 424 K N 0.118 120.300 120.400 -0.362 0.000 1.978 424 K HA -0.204 4.117 4.320 0.002 0.000 0.214 424 K C 2.044 178.491 176.600 -0.255 0.000 1.049 424 K CA 2.232 58.390 56.287 -0.216 0.000 0.939 424 K CB -0.304 32.078 32.500 -0.197 0.000 0.721 424 K HN 0.506 8.756 8.250 -0.000 0.000 0.441 425 L N 0.831 121.800 121.223 -0.423 0.000 2.083 425 L HA -0.163 4.178 4.340 0.002 0.000 0.209 425 L C 1.866 178.599 176.870 -0.228 0.000 1.083 425 L CA 1.519 56.168 54.840 -0.317 0.000 0.752 425 L CB -0.672 41.182 42.059 -0.342 0.000 0.899 425 L HN 0.392 8.622 8.230 -0.000 0.000 0.433 426 W N -1.288 119.778 121.300 -0.390 0.000 2.436 426 W HA -0.208 4.453 4.660 0.002 0.000 0.261 426 W C 1.748 177.910 176.519 -0.594 0.000 1.222 426 W CA 0.650 57.626 57.345 -0.616 0.000 1.191 426 W CB -1.248 27.463 29.460 -1.248 0.000 1.132 426 W HN 0.316 8.496 8.180 -0.000 0.000 0.596 427 Y N -1.020 119.232 120.300 -0.080 0.000 2.485 427 Y HA 0.144 4.696 4.550 0.002 0.000 0.260 427 Y C 1.443 177.348 175.900 0.008 0.000 1.173 427 Y CA 0.252 58.353 58.100 0.001 0.000 1.252 427 Y CB 0.499 38.960 38.460 0.002 0.000 1.123 427 Y HN -0.223 8.057 8.280 -0.000 0.000 0.524 428 Q N 0.000 119.867 119.800 0.112 0.000 2.315 428 Q HA 0.000 4.341 4.340 0.002 0.000 0.214 428 Q CA 0.000 55.846 55.803 0.071 0.000 1.022 428 Q CB 0.000 28.759 28.738 0.036 0.000 1.108 428 Q HN 0.000 8.270 8.270 -0.000 0.000 0.481