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 1wdl_1_C DATA FIRST_RESID 2 DATA SEQUENCE SLNPRDVVIV DFGRTPMGRS KGGMHRNTRA EDMSAHLISK VLERNSKVDP DATA SEQUENCE GEVEDVIWGC VNQTLEQGWN IARMASLMTQ IPHTSAAQTV SRLCGSSMSA DATA SEQUENCE LHTAAQAIMT GNGDVFVVGG VEHMGHVSMM HGVDPNPHMS LYAAKASGMM DATA SEQUENCE GLTAEMLGKM HGISREQQDA FAVRSHQLAH KATVEGKFKD EIIPMQGYDE DATA SEQUENCE NGFLKIFDYD ETIRPDTTLE SLAALKPAFN PKGGTVTAGT SSQITDGASC DATA SEQUENCE MIVMSAQRAK DLGLEPLAVI RSMAVAGVDP AIMGYGPVPA TQKALKRAGL DATA SEQUENCE NMADIDFIEL NEAFAAQALP VLKDLKVLDK MNEKVNLHGG AIALGHPFGC DATA SEQUENCE SGARISGTLL NVMKQNGGTF GLSTMCIGLG QGIATVFERV 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 2 S HA 0.000 4.470 4.470 -0.000 0.000 0.327 2 S C 0.000 174.603 174.600 0.005 0.000 1.055 2 S CA 0.000 58.204 58.200 0.007 0.000 1.107 2 S CB 0.000 63.205 63.200 0.008 0.000 0.593 3 L N 1.464 122.691 121.223 0.006 0.000 2.334 3 L HA 0.787 5.127 4.340 0.001 0.000 0.273 3 L C -0.410 176.464 176.870 0.006 0.000 1.013 3 L CA -0.573 54.271 54.840 0.006 0.000 0.816 3 L CB 1.519 43.583 42.059 0.008 0.000 1.278 3 L HN 0.638 8.868 8.230 -0.000 0.000 0.431 4 N N 2.618 121.321 118.700 0.005 0.000 2.417 4 N HA 0.351 5.091 4.740 0.001 0.000 0.274 4 N C -2.041 173.473 175.510 0.006 0.000 0.987 4 N CA -1.576 51.477 53.050 0.004 0.000 0.912 4 N CB 2.070 40.557 38.487 0.001 0.000 1.177 4 N HN 0.522 8.902 8.380 -0.000 0.000 0.490 5 P HA -0.235 4.185 4.420 -0.000 0.000 0.221 5 P C 0.361 177.669 177.300 0.015 0.000 1.160 5 P CA 1.473 64.580 63.100 0.013 0.000 0.933 5 P CB 0.250 31.958 31.700 0.013 0.000 0.793 6 R N -0.334 120.171 120.500 0.010 0.000 2.547 6 R HA 0.136 4.476 4.340 0.001 0.000 0.258 6 R C -0.093 176.205 176.300 -0.003 0.000 1.115 6 R CA 0.187 56.291 56.100 0.008 0.000 1.152 6 R CB -1.156 29.146 30.300 0.004 0.000 1.221 6 R HN 0.334 8.604 8.270 -0.000 0.000 0.539 7 D N 0.878 121.277 120.400 -0.001 0.000 2.308 7 D HA 0.088 4.729 4.640 0.001 0.000 0.251 7 D C -0.087 176.209 176.300 -0.008 0.000 1.127 7 D CA -0.245 53.749 54.000 -0.011 0.000 0.876 7 D CB 2.145 42.941 40.800 -0.007 0.000 1.176 7 D HN -0.208 8.162 8.370 -0.000 0.000 0.446 8 V N 3.289 123.188 119.914 -0.025 0.000 2.521 8 V HA 0.122 4.242 4.120 0.001 0.000 0.286 8 V C 0.470 176.569 176.094 0.010 0.000 1.034 8 V CA -0.218 62.070 62.300 -0.019 0.000 1.045 8 V CB 1.225 33.013 31.823 -0.058 0.000 0.974 8 V HN 0.219 8.409 8.190 -0.000 0.000 0.480 9 V N 6.419 126.356 119.914 0.039 0.000 2.531 9 V HA 0.431 4.552 4.120 0.001 0.000 0.301 9 V C -0.359 175.790 176.094 0.092 0.000 1.034 9 V CA -0.607 61.730 62.300 0.062 0.000 0.865 9 V CB 1.799 33.653 31.823 0.052 0.000 0.995 9 V HN 0.660 8.850 8.190 -0.000 0.000 0.424 10 I N 5.102 125.744 120.570 0.120 0.000 2.308 10 I HA 0.164 4.335 4.170 0.001 0.000 0.293 10 I C 1.149 177.329 176.117 0.104 0.000 1.078 10 I CA 0.568 61.949 61.300 0.135 0.000 1.292 10 I CB 1.246 39.347 38.000 0.168 0.000 1.423 10 I HN 0.423 8.633 8.210 -0.000 0.000 0.493 11 V N 4.008 123.984 119.914 0.103 0.000 2.283 11 V HA -0.071 4.049 4.120 0.001 0.000 0.243 11 V C 0.738 176.885 176.094 0.088 0.000 1.039 11 V CA 1.585 63.936 62.300 0.085 0.000 1.016 11 V CB -0.413 31.459 31.823 0.081 0.000 0.650 11 V HN 0.806 8.996 8.190 -0.000 0.000 0.449 12 D N -2.895 117.573 120.400 0.113 0.000 2.610 12 D HA 0.472 5.112 4.640 0.001 0.000 0.271 12 D C -1.743 174.685 176.300 0.214 0.000 1.174 12 D CA -0.550 53.526 54.000 0.126 0.000 0.949 12 D CB 2.488 43.338 40.800 0.082 0.000 1.430 12 D HN -0.056 8.314 8.370 -0.000 0.000 0.467 13 F N 0.193 120.152 119.950 0.016 0.000 2.605 13 F HA 0.641 5.169 4.527 0.000 0.000 0.320 13 F C -1.168 174.637 175.800 0.008 0.000 1.159 13 F CA -0.251 57.755 58.000 0.009 0.000 0.999 13 F CB 1.950 40.939 39.000 -0.018 0.000 1.258 13 F HN 0.323 8.623 8.300 -0.000 0.000 0.464 14 G N 6.039 114.341 108.800 -0.830 0.000 2.741 14 G HA2 0.605 4.565 3.960 0.001 0.000 0.293 14 G HA3 0.605 4.565 3.960 0.001 0.000 0.293 14 G C -1.972 172.488 174.900 -0.735 0.000 1.457 14 G CA -1.062 43.617 45.100 -0.701 0.000 1.098 14 G HN 0.909 9.199 8.290 -0.000 0.000 0.536 15 R N -0.151 119.961 120.500 -0.648 0.000 2.902 15 R HA 0.848 5.189 4.340 0.001 0.000 0.258 15 R C -0.074 176.108 176.300 -0.198 0.000 1.071 15 R CA -0.702 55.175 56.100 -0.372 0.000 1.024 15 R CB 1.282 31.402 30.300 -0.300 0.000 1.184 15 R HN 0.522 8.792 8.270 -0.000 0.000 0.492 16 T N -1.567 112.911 114.554 -0.125 0.000 2.902 16 T HA 0.438 4.788 4.350 0.001 0.000 0.280 16 T C -2.443 172.218 174.700 -0.065 0.000 0.992 16 T CA -2.235 59.825 62.100 -0.066 0.000 1.015 16 T CB 1.389 70.215 68.868 -0.069 0.000 1.044 16 T HN 0.369 8.609 8.240 -0.000 0.000 0.520 17 P HA 0.165 4.585 4.420 -0.000 0.000 0.271 17 P C -0.102 177.195 177.300 -0.004 0.000 1.233 17 P CA -0.286 62.783 63.100 -0.051 0.000 0.764 17 P CB 0.254 31.897 31.700 -0.095 0.000 0.825 18 M N 3.278 122.838 119.600 -0.065 0.000 2.364 18 M HA 0.199 4.680 4.480 0.001 0.000 0.342 18 M C 0.903 177.175 176.300 -0.047 0.000 1.601 18 M CA 0.637 55.905 55.300 -0.053 0.000 1.156 18 M CB -0.358 32.204 32.600 -0.064 0.000 1.912 18 M HN 0.372 8.662 8.290 -0.000 0.000 0.460 19 G N 4.049 112.842 108.800 -0.010 0.000 2.420 19 G HA2 0.600 4.561 3.960 0.001 0.000 0.331 19 G HA3 0.600 4.561 3.960 0.001 0.000 0.331 19 G C -0.176 174.677 174.900 -0.079 0.000 1.168 19 G CA -0.851 44.191 45.100 -0.095 0.000 0.936 19 G HN 0.643 8.933 8.290 -0.000 0.000 0.479 20 R N 0.652 121.101 120.500 -0.085 0.000 2.734 20 R HA 0.133 4.474 4.340 0.001 0.000 0.266 20 R C 0.969 177.218 176.300 -0.085 0.000 1.044 20 R CA -0.017 56.046 56.100 -0.062 0.000 1.128 20 R CB 0.661 30.941 30.300 -0.033 0.000 1.010 20 R HN 0.496 8.766 8.270 -0.000 0.000 0.461 21 S N 1.079 116.732 115.700 -0.077 0.000 2.456 21 S HA -0.045 4.425 4.470 0.001 0.000 0.224 21 S C 1.212 175.797 174.600 -0.025 0.000 1.035 21 S CA 0.926 59.078 58.200 -0.080 0.000 0.940 21 S CB 0.297 63.444 63.200 -0.088 0.000 0.799 21 S HN 0.680 8.990 8.310 -0.000 0.000 0.508 22 K N 1.503 121.894 120.400 -0.015 0.000 2.408 22 K HA 0.483 4.804 4.320 0.001 0.000 0.231 22 K C 0.849 177.452 176.600 0.005 0.000 1.261 22 K CA 0.337 56.626 56.287 0.003 0.000 1.193 22 K CB -1.744 30.760 32.500 0.005 0.000 1.431 22 K HN 0.647 8.897 8.250 -0.000 0.000 0.243 23 G N -0.120 108.687 108.800 0.010 0.000 2.142 23 G HA2 -0.090 3.871 3.960 0.001 0.000 0.225 23 G HA3 -0.090 3.871 3.960 0.001 0.000 0.225 23 G C 0.780 175.674 174.900 -0.009 0.000 1.015 23 G CA 0.314 45.422 45.100 0.013 0.000 0.716 23 G HN 1.383 9.673 8.290 -0.000 0.000 0.508 24 G N -0.154 108.621 108.800 -0.041 0.000 2.479 24 G HA2 0.510 4.471 3.960 0.001 0.000 0.275 24 G HA3 0.510 4.471 3.960 0.001 0.000 0.275 24 G C 1.498 176.291 174.900 -0.178 0.000 1.421 24 G CA 0.261 45.295 45.100 -0.109 0.000 1.059 24 G HN 1.040 9.330 8.290 -0.000 0.000 0.535 25 M N -1.386 117.965 119.600 -0.415 0.000 2.562 25 M HA 0.169 4.650 4.480 0.001 0.000 0.257 25 M C 1.010 176.993 176.300 -0.527 0.000 1.099 25 M CA 1.220 56.106 55.300 -0.691 0.000 1.099 25 M CB -0.050 31.610 32.600 -1.566 0.000 1.427 25 M HN 0.364 8.654 8.290 -0.000 0.000 0.489 26 H N 1.424 120.395 119.070 -0.166 0.000 2.594 26 H HA 0.235 4.791 4.556 0.001 0.000 0.279 26 H C 1.485 176.848 175.328 0.059 0.000 1.042 26 H CA 0.205 56.215 56.048 -0.063 0.000 1.177 26 H CB -0.053 29.591 29.762 -0.197 0.000 1.524 26 H HN 0.608 8.888 8.280 -0.000 0.000 0.537 27 R N 0.367 120.940 120.500 0.122 0.000 2.303 27 R HA -0.044 4.296 4.340 0.001 0.000 0.225 27 R C 0.265 176.735 176.300 0.283 0.000 1.114 27 R CA 1.085 57.296 56.100 0.184 0.000 1.007 27 R CB -0.034 30.328 30.300 0.103 0.000 0.861 27 R HN -0.011 8.259 8.270 -0.000 0.000 0.471 28 N N 0.173 118.982 118.700 0.182 0.000 2.238 28 N HA 0.088 4.828 4.740 0.001 0.000 0.235 28 N C -0.973 174.644 175.510 0.178 0.000 1.209 28 N CA 0.104 53.205 53.050 0.085 0.000 0.879 28 N CB 1.707 40.030 38.487 -0.273 0.000 1.136 28 N HN 0.101 8.481 8.380 -0.000 0.000 0.517 29 T N 0.659 115.381 114.554 0.280 0.000 2.824 29 T HA 0.398 4.749 4.350 0.001 0.000 0.282 29 T C 0.410 175.219 174.700 0.181 0.000 0.993 29 T CA -0.583 61.654 62.100 0.229 0.000 0.967 29 T CB 2.081 71.100 68.868 0.251 0.000 0.960 29 T HN -0.064 8.176 8.240 -0.000 0.000 0.441 30 R N 1.085 121.659 120.500 0.123 0.000 2.694 30 R HA 0.440 4.780 4.340 0.001 0.000 0.268 30 R C 1.552 177.895 176.300 0.071 0.000 1.061 30 R CA -0.178 55.965 56.100 0.070 0.000 1.133 30 R CB 0.317 30.634 30.300 0.028 0.000 1.020 30 R HN 0.794 9.064 8.270 -0.000 0.000 0.475 31 A N 2.589 125.446 122.820 0.061 0.000 1.930 31 A HA -0.190 4.131 4.320 0.001 0.000 0.217 31 A C 1.693 179.331 177.584 0.089 0.000 1.175 31 A CA 1.486 53.590 52.037 0.113 0.000 0.627 31 A CB -0.315 18.763 19.000 0.130 0.000 0.815 31 A HN 0.867 9.017 8.150 -0.000 0.000 0.443 32 E N 0.451 120.680 120.200 0.048 0.000 2.023 32 E HA -0.185 4.165 4.350 0.001 0.000 0.196 32 E C 1.588 178.186 176.600 -0.005 0.000 1.003 32 E CA 1.447 57.851 56.400 0.007 0.000 0.809 32 E CB -0.234 29.460 29.700 -0.009 0.000 0.755 32 E HN 0.543 8.903 8.360 -0.000 0.000 0.449 33 D N 0.389 120.798 120.400 0.016 0.000 2.097 33 D HA -0.183 4.457 4.640 0.001 0.000 0.195 33 D C 1.981 178.315 176.300 0.057 0.000 0.989 33 D CA 0.997 55.012 54.000 0.026 0.000 0.827 33 D CB -0.234 40.582 40.800 0.027 0.000 0.966 33 D HN 0.155 8.525 8.370 -0.000 0.000 0.456 34 M N 0.811 120.450 119.600 0.065 0.000 2.144 34 M HA -0.193 4.287 4.480 0.001 0.000 0.260 34 M C 1.991 178.352 176.300 0.101 0.000 1.067 34 M CA 1.380 56.723 55.300 0.072 0.000 1.095 34 M CB 0.151 32.762 32.600 0.017 0.000 1.365 34 M HN -0.147 8.143 8.290 -0.000 0.000 0.406 35 S N 0.536 116.287 115.700 0.085 0.000 2.377 35 S HA 0.043 4.513 4.470 0.001 0.000 0.223 35 S C 2.041 176.564 174.600 -0.129 0.000 1.030 35 S CA 0.999 59.232 58.200 0.054 0.000 0.970 35 S CB -0.441 62.723 63.200 -0.060 0.000 0.830 35 S HN 0.675 8.985 8.310 -0.000 0.000 0.473 36 A N 1.482 124.232 122.820 -0.116 0.000 1.908 36 A HA -0.204 4.116 4.320 0.001 0.000 0.218 36 A C 1.926 179.500 177.584 -0.016 0.000 1.181 36 A CA 2.163 54.136 52.037 -0.107 0.000 0.627 36 A CB -1.028 17.938 19.000 -0.058 0.000 0.818 36 A HN 0.581 8.731 8.150 -0.000 0.000 0.445 37 H N -0.755 118.288 119.070 -0.045 0.000 2.321 37 H HA -0.080 4.476 4.556 0.001 0.000 0.300 37 H C 1.796 177.115 175.328 -0.015 0.000 1.087 37 H CA 1.767 57.803 56.048 -0.019 0.000 1.319 37 H CB -0.288 29.476 29.762 0.004 0.000 1.379 37 H HN 0.314 8.594 8.280 -0.000 0.000 0.501 38 L N 0.365 121.588 121.223 0.000 0.000 1.989 38 L HA -0.141 4.200 4.340 0.001 0.000 0.211 38 L C 2.259 179.094 176.870 -0.058 0.000 1.071 38 L CA 1.791 56.611 54.840 -0.034 0.000 0.749 38 L CB -0.799 41.313 42.059 0.088 0.000 0.890 38 L HN 0.432 8.662 8.230 -0.000 0.000 0.431 39 I N -1.297 119.245 120.570 -0.047 0.000 2.208 39 I HA -0.341 3.829 4.170 0.001 0.000 0.245 39 I C 2.693 178.765 176.117 -0.075 0.000 1.097 39 I CA 1.592 62.857 61.300 -0.057 0.000 1.363 39 I CB -0.680 37.218 38.000 -0.171 0.000 1.051 39 I HN 0.374 8.584 8.210 -0.000 0.000 0.413 40 S N 0.657 116.294 115.700 -0.106 0.000 2.348 40 S HA -0.176 4.294 4.470 0.001 0.000 0.221 40 S C 2.163 176.686 174.600 -0.128 0.000 1.033 40 S CA 1.339 59.477 58.200 -0.103 0.000 1.010 40 S CB -0.048 63.097 63.200 -0.092 0.000 0.891 40 S HN 0.227 8.537 8.310 -0.000 0.000 0.442 41 K N 0.900 121.169 120.400 -0.219 0.000 2.097 41 K HA 0.023 4.343 4.320 0.001 0.000 0.206 41 K C 2.143 178.675 176.600 -0.115 0.000 1.049 41 K CA 1.047 57.211 56.287 -0.205 0.000 0.933 41 K CB -1.036 31.272 32.500 -0.320 0.000 0.717 41 K HN 0.359 8.609 8.250 -0.000 0.000 0.442 42 V N 1.719 121.577 119.914 -0.092 0.000 2.407 42 V HA -0.202 3.919 4.120 0.001 0.000 0.248 42 V C 2.401 178.480 176.094 -0.026 0.000 1.055 42 V CA 1.321 63.590 62.300 -0.051 0.000 1.049 42 V CB -0.414 31.394 31.823 -0.025 0.000 0.662 42 V HN 0.194 8.384 8.190 -0.000 0.000 0.455 43 L N -0.413 120.794 121.223 -0.026 0.000 2.201 43 L HA -0.170 4.170 4.340 0.001 0.000 0.212 43 L C 2.538 179.397 176.870 -0.018 0.000 1.105 43 L CA 1.401 56.233 54.840 -0.013 0.000 0.775 43 L CB -0.453 41.596 42.059 -0.017 0.000 0.913 43 L HN 0.411 8.641 8.230 -0.000 0.000 0.440 44 E N -0.085 120.096 120.200 -0.033 0.000 2.047 44 E HA -0.193 4.158 4.350 0.001 0.000 0.191 44 E C 2.232 178.820 176.600 -0.019 0.000 0.987 44 E CA 0.867 57.250 56.400 -0.028 0.000 0.799 44 E CB -0.023 29.653 29.700 -0.040 0.000 0.752 44 E HN 0.453 8.813 8.360 -0.000 0.000 0.449 45 R N 0.841 121.328 120.500 -0.021 0.000 2.159 45 R HA -0.047 4.293 4.340 0.001 0.000 0.237 45 R C 0.286 176.585 176.300 -0.002 0.000 1.131 45 R CA 0.727 56.820 56.100 -0.012 0.000 0.982 45 R CB -0.281 30.011 30.300 -0.014 0.000 0.868 45 R HN 0.103 8.373 8.270 -0.000 0.000 0.453 46 N N 0.907 119.608 118.700 0.001 0.000 2.976 46 N HA 0.041 4.781 4.740 0.001 0.000 0.255 46 N C 0.023 175.537 175.510 0.006 0.000 1.312 46 N CA -0.011 53.045 53.050 0.009 0.000 0.897 46 N CB 1.662 40.161 38.487 0.020 0.000 1.184 46 N HN 0.108 8.488 8.380 -0.000 0.000 0.497 47 S N -0.243 115.459 115.700 0.003 0.000 2.603 47 S HA 0.006 4.476 4.470 0.001 0.000 0.229 47 S C 1.202 175.804 174.600 0.003 0.000 0.972 47 S CA 0.552 58.752 58.200 0.000 0.000 0.935 47 S CB 0.066 63.264 63.200 -0.002 0.000 0.769 47 S HN 0.313 8.623 8.310 -0.000 0.000 0.536 48 K N 1.168 121.572 120.400 0.008 0.000 2.393 48 K HA 0.159 4.479 4.320 0.001 0.000 0.193 48 K C 0.012 176.619 176.600 0.012 0.000 1.026 48 K CA 0.220 56.513 56.287 0.010 0.000 1.064 48 K CB 0.632 33.139 32.500 0.012 0.000 0.833 48 K HN 0.476 8.726 8.250 -0.000 0.000 0.521 49 V N 0.412 120.335 119.914 0.014 0.000 2.294 49 V HA 0.205 4.325 4.120 0.001 0.000 0.272 49 V C -0.659 175.440 176.094 0.008 0.000 1.027 49 V CA -1.281 61.030 62.300 0.017 0.000 0.823 49 V CB 0.683 32.523 31.823 0.028 0.000 1.030 49 V HN 0.003 8.193 8.190 -0.000 0.000 0.457 50 D N 6.708 127.110 120.400 0.003 0.000 2.451 50 D HA 0.192 4.832 4.640 0.001 0.000 0.254 50 D C -1.313 174.982 176.300 -0.009 0.000 1.204 50 D CA -1.219 52.778 54.000 -0.004 0.000 0.896 50 D CB 1.630 42.426 40.800 -0.006 0.000 1.136 50 D HN 0.348 8.718 8.370 -0.000 0.000 0.499 51 P HA -0.090 4.330 4.420 -0.000 0.000 0.218 51 P C 1.270 178.555 177.300 -0.025 0.000 1.146 51 P CA 1.126 64.215 63.100 -0.017 0.000 0.813 51 P CB 0.165 31.854 31.700 -0.018 0.000 0.778 52 G N -0.173 108.612 108.800 -0.025 0.000 2.443 52 G HA2 -0.211 3.750 3.960 0.001 0.000 0.219 52 G HA3 -0.211 3.750 3.960 0.001 0.000 0.219 52 G C 1.315 176.192 174.900 -0.038 0.000 1.131 52 G CA 0.315 45.398 45.100 -0.029 0.000 0.775 52 G HN 0.312 8.602 8.290 -0.000 0.000 0.547 53 E N 0.057 120.236 120.200 -0.035 0.000 2.358 53 E HA 0.017 4.367 4.350 0.001 0.000 0.195 53 E C 0.465 177.014 176.600 -0.086 0.000 1.010 53 E CA -0.228 56.145 56.400 -0.044 0.000 0.856 53 E CB 0.191 29.878 29.700 -0.021 0.000 0.795 53 E HN 0.196 8.556 8.360 -0.000 0.000 0.504 54 V N 3.472 123.332 119.914 -0.090 0.000 2.450 54 V HA -0.094 4.027 4.120 0.001 0.000 0.264 54 V C 1.495 177.443 176.094 -0.243 0.000 0.996 54 V CA 0.608 62.816 62.300 -0.154 0.000 1.138 54 V CB 0.039 31.808 31.823 -0.090 0.000 1.051 54 V HN 0.176 8.366 8.190 -0.000 0.000 0.470 55 E N 2.476 122.418 120.200 -0.430 0.000 2.153 55 E HA -0.092 4.258 4.350 0.001 0.000 0.194 55 E C 0.525 176.873 176.600 -0.421 0.000 0.988 55 E CA 1.051 57.187 56.400 -0.440 0.000 0.811 55 E CB 0.293 29.658 29.700 -0.558 0.000 0.746 55 E HN 0.918 9.278 8.360 -0.000 0.000 0.466 56 D N -1.954 118.107 120.400 -0.566 0.000 2.745 56 D HA 0.098 4.738 4.640 0.001 0.000 0.221 56 D C -1.657 174.633 176.300 -0.017 0.000 1.237 56 D CA -0.418 53.458 54.000 -0.207 0.000 0.781 56 D CB 1.548 42.330 40.800 -0.029 0.000 1.575 56 D HN -0.297 8.073 8.370 -0.000 0.000 0.482 57 V N 3.938 123.896 119.914 0.074 0.000 2.311 57 V HA 0.444 4.565 4.120 0.001 0.000 0.275 57 V C 0.132 176.371 176.094 0.242 0.000 1.022 57 V CA -0.530 61.864 62.300 0.156 0.000 0.830 57 V CB 0.928 32.783 31.823 0.053 0.000 1.012 57 V HN 0.473 8.663 8.190 -0.000 0.000 0.452 58 I N 4.945 125.716 120.570 0.335 0.000 2.307 58 I HA 0.319 4.489 4.170 0.001 0.000 0.289 58 I C -0.315 176.048 176.117 0.410 0.000 1.021 58 I CA -0.108 61.378 61.300 0.310 0.000 1.224 58 I CB 0.808 38.954 38.000 0.243 0.000 1.376 58 I HN 0.554 8.764 8.210 -0.000 0.000 0.470 59 W N 5.524 126.867 121.300 0.072 0.000 2.573 59 W HA 0.583 5.243 4.660 0.000 0.000 0.326 59 W C -0.021 176.528 176.519 0.052 0.000 1.049 59 W CA -0.887 56.494 57.345 0.060 0.000 1.220 59 W CB 2.374 31.867 29.460 0.054 0.000 1.373 59 W HN 0.503 8.683 8.180 -0.000 0.000 0.507 60 G N 2.467 111.160 108.800 -0.178 0.000 2.332 60 G HA2 0.508 4.468 3.960 0.001 0.000 0.310 60 G HA3 0.508 4.468 3.960 0.001 0.000 0.310 60 G C -1.481 173.381 174.900 -0.064 0.000 1.123 60 G CA -0.122 44.915 45.100 -0.105 0.000 0.873 60 G HN 0.551 8.841 8.290 -0.000 0.000 0.460 61 C N 2.479 121.803 119.300 0.040 0.000 3.090 61 C HA 0.527 4.988 4.460 0.001 0.000 0.347 61 C C 0.932 175.978 174.990 0.093 0.000 1.147 61 C CA -0.420 58.649 59.018 0.086 0.000 1.305 61 C CB 1.014 28.849 27.740 0.159 0.000 1.692 61 C HN 0.575 8.805 8.230 -0.000 0.000 0.506 62 V N 2.487 122.473 119.914 0.121 0.000 2.543 62 V HA 0.218 4.338 4.120 0.001 0.000 0.232 62 V C 1.369 177.548 176.094 0.141 0.000 1.087 62 V CA 0.620 62.999 62.300 0.130 0.000 1.113 62 V CB -0.622 31.316 31.823 0.192 0.000 0.779 62 V HN 0.846 9.036 8.190 -0.000 0.000 0.495 63 N N 2.152 120.959 118.700 0.177 0.000 2.744 63 N HA -0.003 4.737 4.740 0.001 0.000 0.290 63 N C -0.043 175.555 175.510 0.148 0.000 1.206 63 N CA 0.199 53.347 53.050 0.163 0.000 1.119 63 N CB -0.159 38.441 38.487 0.188 0.000 1.449 63 N HN 0.546 8.926 8.380 -0.000 0.000 0.514 64 Q N 1.238 121.119 119.800 0.136 0.000 2.664 64 Q HA 0.097 4.438 4.340 0.001 0.000 0.223 64 Q C -0.271 175.821 176.000 0.154 0.000 1.298 64 Q CA 0.177 56.066 55.803 0.144 0.000 0.965 64 Q CB 0.444 29.266 28.738 0.141 0.000 1.510 64 Q HN 0.304 8.574 8.270 -0.000 0.000 0.567 65 T N -0.018 114.623 114.554 0.145 0.000 2.821 65 T HA 0.486 4.837 4.350 0.001 0.000 0.306 65 T C -0.008 174.746 174.700 0.090 0.000 1.313 65 T CA -0.442 61.739 62.100 0.135 0.000 1.012 65 T CB 0.689 69.642 68.868 0.142 0.000 1.298 65 T HN 0.597 8.837 8.240 -0.000 0.000 0.502 66 L N 0.493 121.734 121.223 0.030 0.000 6.079 66 L HA -0.323 4.017 4.340 0.001 0.000 0.053 66 L C 2.002 178.833 176.870 -0.065 0.000 2.483 66 L CA 1.631 56.450 54.840 -0.035 0.000 1.581 66 L CB -1.235 40.823 42.059 -0.003 0.000 2.843 66 L HN 0.831 9.061 8.230 -0.000 0.000 1.020 67 E N -0.534 119.640 120.200 -0.043 0.000 2.085 67 E HA -0.240 4.111 4.350 0.001 0.000 0.194 67 E C 1.726 178.334 176.600 0.014 0.000 0.994 67 E CA 1.948 58.327 56.400 -0.034 0.000 0.801 67 E CB -0.112 29.575 29.700 -0.021 0.000 0.743 67 E HN 0.473 8.833 8.360 -0.000 0.000 0.453 68 Q N -0.033 119.800 119.800 0.056 0.000 2.320 68 Q HA 0.128 4.468 4.340 0.001 0.000 0.201 68 Q C 0.504 176.581 176.000 0.128 0.000 0.910 68 Q CA -0.160 55.704 55.803 0.102 0.000 0.946 68 Q CB 1.053 29.865 28.738 0.123 0.000 1.062 68 Q HN 0.069 8.339 8.270 -0.000 0.000 0.503 69 G N -0.926 107.943 108.800 0.116 0.000 2.502 69 G HA2 0.221 4.182 3.960 0.001 0.000 0.305 69 G HA3 0.221 4.182 3.960 0.001 0.000 0.305 69 G C -1.112 173.998 174.900 0.350 0.000 1.190 69 G CA -0.497 44.736 45.100 0.220 0.000 0.933 69 G HN 0.402 8.692 8.290 -0.000 0.000 0.503 70 W N -0.686 120.634 121.300 0.033 0.000 4.926 70 W HA -0.167 4.494 4.660 0.001 0.000 0.401 70 W C 0.762 177.294 176.519 0.023 0.000 1.555 70 W CA -0.021 57.337 57.345 0.023 0.000 0.877 70 W CB -2.189 27.279 29.460 0.012 0.000 2.743 70 W HN 1.084 9.264 8.180 -0.000 0.000 1.328 71 N N 0.228 119.045 118.700 0.196 0.000 2.608 71 N HA -0.247 4.493 4.740 0.001 0.000 0.273 71 N C 0.779 176.366 175.510 0.129 0.000 1.133 71 N CA 1.068 54.199 53.050 0.135 0.000 0.726 71 N CB -0.929 37.610 38.487 0.086 0.000 0.890 71 N HN 0.610 8.990 8.380 -0.000 0.000 0.548 72 I N 0.793 121.448 120.570 0.141 0.000 2.567 72 I HA -0.222 3.948 4.170 0.001 0.000 0.257 72 I C 1.941 178.074 176.117 0.026 0.000 1.184 72 I CA 1.545 62.905 61.300 0.100 0.000 1.451 72 I CB -0.231 37.857 38.000 0.147 0.000 1.089 72 I HN 0.657 8.867 8.210 -0.000 0.000 0.441 73 A N 1.077 123.943 122.820 0.077 0.000 1.883 73 A HA -0.297 4.023 4.320 0.001 0.000 0.217 73 A C 2.321 179.866 177.584 -0.066 0.000 1.186 73 A CA 2.119 54.169 52.037 0.021 0.000 0.624 73 A CB -0.577 18.512 19.000 0.147 0.000 0.822 73 A HN 0.477 8.627 8.150 -0.000 0.000 0.444 74 R N -0.957 119.535 120.500 -0.014 0.000 2.093 74 R HA 0.027 4.368 4.340 0.001 0.000 0.224 74 R C 2.001 178.270 176.300 -0.053 0.000 1.101 74 R CA 1.656 57.736 56.100 -0.032 0.000 0.979 74 R CB -0.445 29.851 30.300 -0.006 0.000 0.877 74 R HN 0.413 8.683 8.270 -0.000 0.000 0.441 75 M N 0.006 119.590 119.600 -0.028 0.000 2.149 75 M HA -0.009 4.471 4.480 0.001 0.000 0.261 75 M C 2.091 178.347 176.300 -0.074 0.000 1.064 75 M CA 1.887 57.169 55.300 -0.030 0.000 1.102 75 M CB -1.107 31.497 32.600 0.007 0.000 1.369 75 M HN 0.329 8.619 8.290 -0.000 0.000 0.408 76 A N -1.316 121.424 122.820 -0.134 0.000 2.081 76 A HA 0.023 4.344 4.320 0.001 0.000 0.214 76 A C 2.417 179.875 177.584 -0.210 0.000 1.158 76 A CA 1.386 53.303 52.037 -0.201 0.000 0.724 76 A CB -0.470 18.312 19.000 -0.364 0.000 0.826 76 A HN 0.443 8.593 8.150 -0.000 0.000 0.463 77 S N -0.508 115.079 115.700 -0.189 0.000 2.436 77 S HA 0.053 4.524 4.470 0.001 0.000 0.228 77 S C 1.761 176.317 174.600 -0.073 0.000 1.014 77 S CA 0.649 58.762 58.200 -0.145 0.000 0.950 77 S CB -0.403 62.726 63.200 -0.117 0.000 0.784 77 S HN 0.509 8.819 8.310 -0.000 0.000 0.504 78 L N 0.652 121.835 121.223 -0.067 0.000 2.201 78 L HA 0.101 4.442 4.340 0.001 0.000 0.212 78 L C 1.956 178.831 176.870 0.008 0.000 1.105 78 L CA 0.865 55.681 54.840 -0.040 0.000 0.775 78 L CB -0.294 41.705 42.059 -0.101 0.000 0.913 78 L HN 0.367 8.597 8.230 -0.000 0.000 0.440 79 M N -1.176 118.413 119.600 -0.019 0.000 2.505 79 M HA 0.088 4.569 4.480 0.001 0.000 0.230 79 M C 0.097 176.395 176.300 -0.003 0.000 1.153 79 M CA 0.201 55.500 55.300 -0.002 0.000 0.997 79 M CB -0.054 32.539 32.600 -0.012 0.000 1.606 79 M HN 0.054 8.344 8.290 -0.000 0.000 0.481 80 T N 0.077 114.623 114.554 -0.014 0.000 2.948 80 T HA 0.138 4.488 4.350 0.001 0.000 0.285 80 T C 1.191 175.887 174.700 -0.005 0.000 1.019 80 T CA -0.751 61.334 62.100 -0.024 0.000 1.013 80 T CB 1.393 70.225 68.868 -0.060 0.000 1.117 80 T HN 0.301 8.541 8.240 -0.000 0.000 0.533 81 Q N 0.418 120.209 119.800 -0.015 0.000 2.500 81 Q HA -0.022 4.318 4.340 0.001 0.000 0.213 81 Q C 0.416 176.408 176.000 -0.014 0.000 0.974 81 Q CA 0.587 56.382 55.803 -0.015 0.000 0.918 81 Q CB -0.359 28.367 28.738 -0.020 0.000 0.980 81 Q HN 0.461 8.731 8.270 -0.000 0.000 0.505 82 I N 3.813 124.377 120.570 -0.010 0.000 2.668 82 I HA 0.089 4.259 4.170 0.001 0.000 0.285 82 I C -1.943 174.188 176.117 0.023 0.000 1.168 82 I CA -2.037 59.259 61.300 -0.006 0.000 1.424 82 I CB -0.318 37.672 38.000 -0.018 0.000 1.377 82 I HN -0.036 8.174 8.210 -0.000 0.000 0.560 83 P HA 0.044 4.464 4.420 -0.000 0.000 0.270 83 P C 0.654 178.025 177.300 0.118 0.000 1.227 83 P CA 0.060 63.167 63.100 0.010 0.000 0.788 83 P CB 0.316 32.005 31.700 -0.018 0.000 0.926 84 H N -0.767 118.288 119.070 -0.024 0.000 2.555 84 H HA -0.052 4.504 4.556 0.000 0.000 0.269 84 H C 1.405 176.719 175.328 -0.022 0.000 0.988 84 H CA 1.028 57.063 56.048 -0.021 0.000 1.178 84 H CB -0.109 29.644 29.762 -0.015 0.000 1.373 84 H HN 0.503 8.783 8.280 -0.000 0.000 0.588 85 T N -2.015 112.593 114.554 0.090 0.000 3.085 85 T HA 0.031 4.381 4.350 0.001 0.000 0.263 85 T C 1.093 175.798 174.700 0.008 0.000 1.127 85 T CA -0.127 61.994 62.100 0.035 0.000 1.103 85 T CB 0.169 69.042 68.868 0.010 0.000 0.921 85 T HN -0.035 8.205 8.240 -0.000 0.000 0.510 86 S N 1.033 116.736 115.700 0.005 0.000 2.669 86 S HA 0.767 5.237 4.470 0.001 0.000 0.270 86 S C 0.306 174.893 174.600 -0.022 0.000 1.225 86 S CA -0.600 57.583 58.200 -0.028 0.000 0.991 86 S CB 1.166 64.342 63.200 -0.041 0.000 0.987 86 S HN 0.747 9.057 8.310 -0.000 0.000 0.552 87 A N 0.136 122.935 122.820 -0.035 0.000 2.344 87 A HA 0.955 5.276 4.320 0.001 0.000 0.307 87 A C -0.731 176.854 177.584 0.002 0.000 1.151 87 A CA -0.648 51.382 52.037 -0.012 0.000 0.842 87 A CB 1.135 20.133 19.000 -0.003 0.000 1.350 87 A HN 1.242 9.392 8.150 -0.000 0.000 0.459 88 A N 0.110 122.945 122.820 0.025 0.000 2.555 88 A HA 0.640 4.960 4.320 0.001 0.000 0.297 88 A C -1.073 176.555 177.584 0.073 0.000 1.060 88 A CA -0.222 51.846 52.037 0.052 0.000 0.710 88 A CB 1.027 20.039 19.000 0.021 0.000 1.282 88 A HN 1.397 9.547 8.150 -0.000 0.000 0.399 89 Q N 0.401 120.269 119.800 0.113 0.000 2.389 89 Q HA 0.786 5.126 4.340 0.001 0.000 0.277 89 Q C -1.318 174.772 176.000 0.150 0.000 1.082 89 Q CA -0.753 55.117 55.803 0.112 0.000 0.810 89 Q CB 2.097 30.897 28.738 0.103 0.000 1.374 89 Q HN 0.433 8.703 8.270 -0.000 0.000 0.422 90 T N 1.787 116.421 114.554 0.134 0.000 2.758 90 T HA 0.434 4.784 4.350 0.001 0.000 0.285 90 T C -0.536 174.229 174.700 0.108 0.000 0.981 90 T CA -0.498 61.696 62.100 0.156 0.000 0.965 90 T CB 1.080 70.044 68.868 0.160 0.000 0.927 90 T HN 0.433 8.673 8.240 -0.000 0.000 0.448 91 V N 3.252 123.223 119.914 0.094 0.000 2.370 91 V HA 0.566 4.686 4.120 0.001 0.000 0.279 91 V C 0.289 176.402 176.094 0.031 0.000 1.029 91 V CA -0.635 61.696 62.300 0.052 0.000 0.870 91 V CB 1.550 33.395 31.823 0.035 0.000 0.984 91 V HN 0.884 9.074 8.190 -0.000 0.000 0.451 92 S N 5.001 120.717 115.700 0.027 0.000 2.498 92 S HA 0.651 5.121 4.470 0.001 0.000 0.317 92 S C -0.047 174.551 174.600 -0.004 0.000 1.090 92 S CA -0.709 57.501 58.200 0.017 0.000 1.089 92 S CB 0.581 63.801 63.200 0.034 0.000 0.997 92 S HN 0.820 9.130 8.310 -0.000 0.000 0.470 93 R N 5.347 125.833 120.500 -0.022 0.000 2.579 93 R HA 0.356 4.696 4.340 0.001 0.000 0.386 93 R C 0.326 176.593 176.300 -0.055 0.000 1.065 93 R CA -0.082 55.997 56.100 -0.036 0.000 1.143 93 R CB -0.712 29.562 30.300 -0.044 0.000 1.357 93 R HN 0.896 9.166 8.270 -0.000 0.000 0.644 94 L N -1.451 119.735 121.223 -0.062 0.000 5.531 94 L HA -0.563 3.777 4.340 0.001 0.000 0.053 94 L C 1.447 178.239 176.870 -0.130 0.000 2.831 94 L CA 1.866 56.629 54.840 -0.128 0.000 1.552 94 L CB -1.708 40.257 42.059 -0.158 0.000 2.889 94 L HN 0.402 8.632 8.230 -0.000 0.000 0.964 95 C N 0.008 119.226 119.300 -0.136 0.000 2.432 95 C HA -0.048 4.413 4.460 0.001 0.000 0.277 95 C C 2.215 177.210 174.990 0.008 0.000 1.249 95 C CA 0.873 59.882 59.018 -0.015 0.000 1.725 95 C CB -1.613 26.147 27.740 0.034 0.000 2.028 95 C HN 0.852 9.082 8.230 -0.000 0.000 0.477 96 G N 0.205 108.986 108.800 -0.032 0.000 3.210 96 G HA2 0.126 4.087 3.960 0.001 0.000 0.220 96 G HA3 0.126 4.087 3.960 0.001 0.000 0.220 96 G C 1.349 176.199 174.900 -0.083 0.000 1.200 96 G CA 0.490 45.558 45.100 -0.054 0.000 0.834 96 G HN 0.518 8.808 8.290 -0.000 0.000 0.524 97 S N 0.647 116.307 115.700 -0.067 0.000 2.359 97 S HA -0.213 4.258 4.470 0.001 0.000 0.222 97 S C 2.588 177.127 174.600 -0.101 0.000 1.038 97 S CA 1.616 59.775 58.200 -0.070 0.000 1.051 97 S CB -0.371 62.802 63.200 -0.046 0.000 0.944 97 S HN 0.459 8.769 8.310 -0.000 0.000 0.433 98 S N 0.660 116.287 115.700 -0.123 0.000 2.383 98 S HA -0.062 4.409 4.470 0.001 0.000 0.229 98 S C 1.868 176.389 174.600 -0.132 0.000 1.030 98 S CA 1.405 59.508 58.200 -0.162 0.000 1.002 98 S CB -0.338 62.753 63.200 -0.182 0.000 0.829 98 S HN 0.497 8.807 8.310 -0.000 0.000 0.467 99 M N 0.383 119.899 119.600 -0.139 0.000 2.200 99 M HA -0.036 4.444 4.480 0.001 0.000 0.265 99 M C 2.043 178.110 176.300 -0.388 0.000 1.066 99 M CA 1.323 56.504 55.300 -0.199 0.000 1.127 99 M CB -0.192 32.292 32.600 -0.194 0.000 1.379 99 M HN 0.248 8.538 8.290 -0.000 0.000 0.420 100 S N 0.827 116.327 115.700 -0.333 0.000 2.399 100 S HA -0.095 4.375 4.470 0.001 0.000 0.231 100 S C 1.959 176.481 174.600 -0.131 0.000 1.022 100 S CA 1.162 59.181 58.200 -0.300 0.000 0.983 100 S CB -0.466 62.645 63.200 -0.148 0.000 0.803 100 S HN 0.661 8.971 8.310 -0.000 0.000 0.480 101 A N 1.459 124.226 122.820 -0.087 0.000 1.877 101 A HA -0.071 4.250 4.320 0.001 0.000 0.216 101 A C 2.103 179.697 177.584 0.017 0.000 1.186 101 A CA 1.440 53.471 52.037 -0.009 0.000 0.620 101 A CB -0.753 18.241 19.000 -0.011 0.000 0.822 101 A HN 0.435 8.585 8.150 -0.000 0.000 0.443 102 L N -0.390 120.839 121.223 0.010 0.000 2.079 102 L HA -0.195 4.145 4.340 0.001 0.000 0.210 102 L C 2.263 179.205 176.870 0.121 0.000 1.081 102 L CA 2.308 57.195 54.840 0.079 0.000 0.752 102 L CB -0.783 41.354 42.059 0.130 0.000 0.896 102 L HN 0.594 8.824 8.230 -0.000 0.000 0.433 103 H N -1.920 117.114 119.070 -0.059 0.000 2.357 103 H HA -0.111 4.445 4.556 0.001 0.000 0.301 103 H C 1.934 177.203 175.328 -0.098 0.000 1.082 103 H CA 1.281 57.279 56.048 -0.084 0.000 1.342 103 H CB -0.044 29.678 29.762 -0.067 0.000 1.389 103 H HN 0.357 8.637 8.280 -0.000 0.000 0.511 104 T N 0.825 115.413 114.554 0.057 0.000 2.684 104 T HA -0.202 4.148 4.350 0.001 0.000 0.267 104 T C 2.342 176.958 174.700 -0.140 0.000 1.036 104 T CA 1.184 63.276 62.100 -0.013 0.000 1.148 104 T CB -0.403 68.477 68.868 0.020 0.000 0.863 104 T HN 0.446 8.686 8.240 -0.000 0.000 0.436 105 A N 1.409 124.096 122.820 -0.223 0.000 1.898 105 A HA 0.191 4.511 4.320 0.001 0.000 0.216 105 A C 2.678 179.922 177.584 -0.567 0.000 1.181 105 A CA 1.841 53.479 52.037 -0.664 0.000 0.620 105 A CB -1.202 17.496 19.000 -0.504 0.000 0.819 105 A HN 0.505 8.655 8.150 -0.000 0.000 0.442 106 A N -0.448 122.211 122.820 -0.268 0.000 1.873 106 A HA -0.292 4.028 4.320 0.001 0.000 0.218 106 A C 2.133 179.607 177.584 -0.183 0.000 1.193 106 A CA 1.959 53.880 52.037 -0.193 0.000 0.629 106 A CB -0.752 18.163 19.000 -0.141 0.000 0.826 106 A HN 0.659 8.809 8.150 -0.000 0.000 0.447 107 Q N -0.766 118.941 119.800 -0.155 0.000 2.124 107 Q HA -0.072 4.269 4.340 0.001 0.000 0.202 107 Q C 2.438 178.374 176.000 -0.107 0.000 0.977 107 Q CA 1.353 57.089 55.803 -0.111 0.000 0.850 107 Q CB -0.425 28.268 28.738 -0.076 0.000 0.901 107 Q HN 0.701 8.971 8.270 -0.000 0.000 0.429 108 A N 1.133 123.852 122.820 -0.169 0.000 1.865 108 A HA -0.205 4.115 4.320 0.001 0.000 0.217 108 A C 2.075 179.622 177.584 -0.061 0.000 1.191 108 A CA 1.352 53.324 52.037 -0.109 0.000 0.623 108 A CB -0.772 18.117 19.000 -0.186 0.000 0.826 108 A HN 0.317 8.467 8.150 -0.000 0.000 0.444 109 I N -0.673 119.800 120.570 -0.162 0.000 2.151 109 I HA -0.361 3.810 4.170 0.001 0.000 0.243 109 I C 2.760 178.872 176.117 -0.008 0.000 1.080 109 I CA 1.943 63.227 61.300 -0.026 0.000 1.339 109 I CB -0.415 37.549 38.000 -0.061 0.000 1.039 109 I HN 0.371 8.581 8.210 -0.000 0.000 0.409 110 M N 0.097 119.670 119.600 -0.045 0.000 2.149 110 M HA -0.169 4.311 4.480 0.001 0.000 0.261 110 M C 2.100 178.393 176.300 -0.012 0.000 1.064 110 M CA 2.234 57.516 55.300 -0.030 0.000 1.102 110 M CB -0.718 31.852 32.600 -0.051 0.000 1.369 110 M HN 0.398 8.688 8.290 -0.000 0.000 0.408 111 T N -2.869 111.680 114.554 -0.008 0.000 3.129 111 T HA 0.336 4.686 4.350 0.001 0.000 0.251 111 T C 1.223 175.937 174.700 0.024 0.000 1.117 111 T CA 0.347 62.450 62.100 0.006 0.000 1.034 111 T CB -0.188 68.683 68.868 0.005 0.000 0.968 111 T HN 0.626 8.866 8.240 -0.000 0.000 0.526 112 G N 2.153 110.975 108.800 0.037 0.000 2.212 112 G HA2 -0.216 3.744 3.960 0.001 0.000 0.255 112 G HA3 -0.216 3.744 3.960 0.001 0.000 0.255 112 G C 0.005 174.949 174.900 0.073 0.000 1.062 112 G CA -0.199 44.933 45.100 0.053 0.000 0.815 112 G HN 0.556 8.846 8.290 -0.000 0.000 0.497 113 N N 0.875 119.639 118.700 0.106 0.000 2.699 113 N HA 0.521 5.262 4.740 0.001 0.000 0.317 113 N C 0.628 176.283 175.510 0.242 0.000 1.661 113 N CA 0.832 53.963 53.050 0.136 0.000 0.979 113 N CB 0.921 39.482 38.487 0.124 0.000 1.329 113 N HN 1.532 9.912 8.380 -0.000 0.000 0.497 114 G N -0.065 108.861 108.800 0.211 0.000 2.335 114 G HA2 -0.087 3.873 3.960 0.001 0.000 0.592 114 G HA3 -0.087 3.873 3.960 0.001 0.000 0.592 114 G C -0.691 174.381 174.900 0.288 0.000 1.442 114 G CA -0.586 44.655 45.100 0.235 0.000 0.976 114 G HN 0.066 8.356 8.290 -0.000 0.000 0.652 115 D N -1.278 119.227 120.400 0.176 0.000 2.766 115 D HA 0.189 4.829 4.640 0.001 0.000 0.284 115 D C 0.803 177.234 176.300 0.218 0.000 1.050 115 D CA 0.913 55.015 54.000 0.169 0.000 0.945 115 D CB 1.281 42.129 40.800 0.080 0.000 1.272 115 D HN 0.347 8.717 8.370 -0.000 0.000 0.482 116 V N 1.830 121.815 119.914 0.119 0.000 2.495 116 V HA 0.425 4.546 4.120 0.001 0.000 0.298 116 V C -0.843 175.271 176.094 0.033 0.000 1.031 116 V CA -0.605 61.774 62.300 0.133 0.000 0.871 116 V CB 1.722 33.570 31.823 0.043 0.000 0.988 116 V HN -0.108 8.082 8.190 -0.000 0.000 0.432 117 F N 2.433 122.421 119.950 0.062 0.000 2.620 117 F HA 0.751 5.278 4.527 0.000 0.000 0.320 117 F C -0.143 175.715 175.800 0.097 0.000 1.069 117 F CA -1.002 57.044 58.000 0.077 0.000 0.953 117 F CB 2.344 41.393 39.000 0.082 0.000 1.322 117 F HN 0.130 8.430 8.300 -0.000 0.000 0.479 118 V N 3.114 123.213 119.914 0.309 0.000 2.385 118 V HA 0.424 4.545 4.120 0.001 0.000 0.277 118 V C -0.664 175.652 176.094 0.370 0.000 1.012 118 V CA -0.723 61.740 62.300 0.272 0.000 0.832 118 V CB 1.110 33.036 31.823 0.173 0.000 1.028 118 V HN 0.620 8.810 8.190 -0.000 0.000 0.436 119 V N 1.934 122.055 119.914 0.345 0.000 3.096 119 V HA 1.154 5.274 4.120 0.001 0.000 0.319 119 V C 0.458 176.677 176.094 0.207 0.000 1.082 119 V CA 0.282 62.763 62.300 0.301 0.000 1.022 119 V CB 1.489 33.421 31.823 0.181 0.000 1.103 119 V HN 1.115 9.305 8.190 -0.000 0.000 0.455 120 G N -0.141 108.580 108.800 -0.132 0.000 2.368 120 G HA2 0.656 4.617 3.960 0.001 0.000 0.269 120 G HA3 0.656 4.617 3.960 0.001 0.000 0.269 120 G C -0.417 173.754 174.900 -1.215 0.000 1.291 120 G CA 0.190 44.870 45.100 -0.699 0.000 0.903 120 G HN 2.010 10.300 8.290 -0.000 0.000 0.483 121 G N -2.182 105.626 108.800 -1.653 0.000 2.576 121 G HA2 0.784 4.745 3.960 0.001 0.000 0.290 121 G HA3 0.784 4.745 3.960 0.001 0.000 0.290 121 G C -1.871 172.553 174.900 -0.793 0.000 1.442 121 G CA 0.463 44.792 45.100 -1.285 0.000 0.792 121 G HN 1.902 10.192 8.290 -0.000 0.000 0.491 122 V N -0.808 118.913 119.914 -0.322 0.000 3.204 122 V HA 0.895 5.016 4.120 0.001 0.000 0.298 122 V C -1.962 174.139 176.094 0.011 0.000 1.328 122 V CA -0.686 61.611 62.300 -0.005 0.000 1.035 122 V CB 2.405 34.430 31.823 0.337 0.000 1.095 122 V HN 1.129 9.319 8.190 -0.000 0.000 0.442 123 E N 2.664 122.853 120.200 -0.019 0.000 2.454 123 E HA 0.323 4.673 4.350 0.001 0.000 0.315 123 E C -1.621 174.934 176.600 -0.075 0.000 0.907 123 E CA -0.366 56.017 56.400 -0.028 0.000 0.797 123 E CB 0.708 30.359 29.700 -0.082 0.000 1.396 123 E HN 0.747 9.107 8.360 -0.000 0.000 0.389 124 H N 6.572 125.582 119.070 -0.100 0.000 2.702 124 H HA 0.251 4.808 4.556 0.000 0.000 0.252 124 H C 0.500 175.744 175.328 -0.139 0.000 1.493 124 H CA -0.093 55.863 56.048 -0.154 0.000 1.273 124 H CB 0.257 29.921 29.762 -0.164 0.000 1.537 124 H HN 0.687 8.967 8.280 -0.000 0.000 0.547 125 M N 1.458 121.000 119.600 -0.097 0.000 2.700 125 M HA -0.023 4.457 4.480 0.001 0.000 0.249 125 M C 1.912 178.216 176.300 0.006 0.000 1.082 125 M CA 0.894 56.137 55.300 -0.095 0.000 1.077 125 M CB 0.278 32.720 32.600 -0.262 0.000 1.477 125 M HN 0.515 8.805 8.290 -0.000 0.000 0.529 126 G N -0.890 107.988 108.800 0.131 0.000 2.437 126 G HA2 -0.079 3.881 3.960 0.001 0.000 0.212 126 G HA3 -0.079 3.881 3.960 0.001 0.000 0.212 126 G C 1.164 176.210 174.900 0.244 0.000 1.174 126 G CA 0.158 45.357 45.100 0.166 0.000 0.811 126 G HN 0.511 8.801 8.290 -0.000 0.000 0.537 127 H N -1.193 117.958 119.070 0.135 0.000 2.482 127 H HA 0.227 4.784 4.556 0.000 0.000 0.286 127 H C 0.136 175.390 175.328 -0.124 0.000 1.017 127 H CA 0.200 56.161 56.048 -0.145 0.000 1.322 127 H CB 0.885 30.382 29.762 -0.441 0.000 1.426 127 H HN 0.115 8.395 8.280 -0.000 0.000 0.546 128 V N 2.642 122.607 119.914 0.086 0.000 2.383 128 V HA 0.056 4.176 4.120 0.001 0.000 0.261 128 V C 0.144 176.283 176.094 0.075 0.000 0.987 128 V CA -0.668 61.659 62.300 0.044 0.000 0.853 128 V CB 0.705 32.587 31.823 0.099 0.000 1.095 128 V HN 0.322 8.512 8.190 -0.000 0.000 0.461 129 S N 4.047 119.778 115.700 0.051 0.000 2.572 129 S HA 0.128 4.598 4.470 0.001 0.000 0.267 129 S C 1.512 176.195 174.600 0.138 0.000 1.361 129 S CA 0.419 58.661 58.200 0.071 0.000 1.009 129 S CB 0.675 63.919 63.200 0.073 0.000 0.888 129 S HN 0.717 9.027 8.310 -0.000 0.000 0.553 130 M N 0.387 120.053 119.600 0.111 0.000 2.077 130 M HA 0.012 4.493 4.480 0.001 0.000 0.261 130 M C 1.559 177.978 176.300 0.198 0.000 1.070 130 M CA 1.328 56.748 55.300 0.200 0.000 1.125 130 M CB -0.605 32.164 32.600 0.281 0.000 1.339 130 M HN 0.459 8.749 8.290 -0.000 0.000 0.409 131 M N 0.496 120.199 119.600 0.171 0.000 2.700 131 M HA 0.033 4.513 4.480 0.001 0.000 0.249 131 M C 0.355 176.738 176.300 0.139 0.000 1.082 131 M CA 0.714 56.099 55.300 0.142 0.000 1.077 131 M CB -2.206 30.468 32.600 0.125 0.000 1.477 131 M HN 0.377 8.667 8.290 -0.000 0.000 0.529 132 H N 0.843 119.956 119.070 0.072 0.000 2.848 132 H HA 0.387 4.943 4.556 0.001 0.000 0.317 132 H C 0.852 176.215 175.328 0.059 0.000 1.046 132 H CA 0.690 56.773 56.048 0.058 0.000 1.470 132 H CB 0.178 29.971 29.762 0.053 0.000 1.483 132 H HN 0.522 8.802 8.280 -0.000 0.000 0.548 133 G N 4.105 112.625 108.800 -0.467 0.000 2.367 133 G HA2 -0.158 3.802 3.960 0.001 0.000 0.295 133 G HA3 -0.158 3.802 3.960 0.001 0.000 0.295 133 G C -0.751 174.062 174.900 -0.144 0.000 1.019 133 G CA 0.368 45.238 45.100 -0.383 0.000 1.224 133 G HN 0.635 8.925 8.290 -0.000 0.000 0.510 134 V N 0.384 120.260 119.914 -0.064 0.000 2.495 134 V HA 0.651 4.771 4.120 0.001 0.000 0.298 134 V C -0.267 175.820 176.094 -0.012 0.000 1.031 134 V CA -0.480 61.812 62.300 -0.015 0.000 0.871 134 V CB 2.206 34.042 31.823 0.022 0.000 0.988 134 V HN 0.477 8.667 8.190 -0.000 0.000 0.432 135 D N 4.669 125.063 120.400 -0.010 0.000 2.404 135 D HA 0.464 5.105 4.640 0.001 0.000 0.267 135 D C -2.472 173.819 176.300 -0.014 0.000 1.194 135 D CA -1.332 52.660 54.000 -0.013 0.000 0.910 135 D CB 1.222 42.011 40.800 -0.018 0.000 1.090 135 D HN 0.327 8.697 8.370 -0.000 0.000 0.511 136 P HA 0.104 4.524 4.420 -0.000 0.000 0.258 136 P C -0.556 176.722 177.300 -0.036 0.000 1.187 136 P CA -0.143 62.952 63.100 -0.009 0.000 0.767 136 P CB 0.258 31.959 31.700 0.002 0.000 0.770 137 N N 5.203 123.878 118.700 -0.041 0.000 2.405 137 N HA 0.078 4.819 4.740 0.001 0.000 0.260 137 N C -1.548 173.906 175.510 -0.094 0.000 1.152 137 N CA -1.681 51.310 53.050 -0.098 0.000 0.948 137 N CB 0.449 38.903 38.487 -0.055 0.000 1.111 137 N HN 0.152 8.532 8.380 -0.000 0.000 0.485 138 P HA -0.170 4.250 4.420 -0.000 0.000 0.217 138 P C 0.297 177.623 177.300 0.042 0.000 1.148 138 P CA 1.467 64.521 63.100 -0.076 0.000 0.828 138 P CB -0.002 31.634 31.700 -0.105 0.000 0.783 139 H N -2.362 116.755 119.070 0.077 0.000 2.489 139 H HA -0.110 4.446 4.556 0.001 0.000 0.295 139 H C 1.966 177.422 175.328 0.213 0.000 1.082 139 H CA 0.732 56.860 56.048 0.133 0.000 1.295 139 H CB -0.357 29.490 29.762 0.143 0.000 1.380 139 H HN 0.078 8.358 8.280 -0.000 0.000 0.548 140 M N 0.626 120.375 119.600 0.248 0.000 2.213 140 M HA -0.125 4.355 4.480 0.001 0.000 0.263 140 M C 1.864 178.289 176.300 0.207 0.000 1.062 140 M CA 1.294 56.730 55.300 0.226 0.000 1.105 140 M CB 0.017 32.684 32.600 0.112 0.000 1.385 140 M HN -0.047 8.243 8.290 -0.000 0.000 0.417 141 S N 0.058 115.835 115.700 0.128 0.000 2.547 141 S HA -0.030 4.440 4.470 0.001 0.000 0.235 141 S C 1.436 176.049 174.600 0.023 0.000 0.980 141 S CA 0.607 58.848 58.200 0.069 0.000 0.941 141 S CB -0.463 62.762 63.200 0.043 0.000 0.763 141 S HN 0.456 8.766 8.310 -0.000 0.000 0.532 142 L N -0.299 120.929 121.223 0.007 0.000 2.509 142 L HA 0.259 4.599 4.340 0.001 0.000 0.222 142 L C 0.538 177.088 176.870 -0.533 0.000 1.123 142 L CA 1.252 55.924 54.840 -0.279 0.000 0.856 142 L CB -0.163 41.654 42.059 -0.403 0.000 0.985 142 L HN 0.272 8.502 8.230 -0.000 0.000 0.456 143 Y N -1.572 118.742 120.300 0.024 0.000 2.425 143 Y HA 0.696 5.246 4.550 0.001 0.000 0.261 143 Y C 0.567 176.475 175.900 0.013 0.000 1.084 143 Y CA -0.101 58.009 58.100 0.016 0.000 1.248 143 Y CB 0.122 38.592 38.460 0.017 0.000 1.270 143 Y HN -0.021 8.259 8.280 -0.000 0.000 0.524 144 A N 0.307 123.218 122.820 0.151 0.000 2.605 144 A HA 0.785 5.105 4.320 0.001 0.000 0.294 144 A C -1.093 176.526 177.584 0.059 0.000 1.062 144 A CA -0.525 51.565 52.037 0.089 0.000 0.682 144 A CB 0.228 19.281 19.000 0.089 0.000 1.278 144 A HN 0.194 8.344 8.150 -0.000 0.000 0.410 145 A N 1.157 123.998 122.820 0.035 0.000 2.488 145 A HA 0.430 4.750 4.320 0.001 0.000 0.249 145 A C 1.216 178.816 177.584 0.027 0.000 1.083 145 A CA 0.550 52.601 52.037 0.024 0.000 0.768 145 A CB -0.044 18.963 19.000 0.011 0.000 1.017 145 A HN 1.186 9.336 8.150 -0.000 0.000 0.496 146 K N 2.803 123.219 120.400 0.027 0.000 2.147 146 K HA -0.089 4.231 4.320 0.001 0.000 0.205 146 K C 1.641 178.253 176.600 0.022 0.000 1.049 146 K CA 1.573 57.877 56.287 0.028 0.000 0.936 146 K CB -0.356 32.160 32.500 0.027 0.000 0.722 146 K HN 0.590 8.840 8.250 -0.000 0.000 0.446 147 A N 1.553 124.382 122.820 0.015 0.000 2.024 147 A HA -0.134 4.187 4.320 0.001 0.000 0.220 147 A C 2.110 179.691 177.584 -0.004 0.000 1.164 147 A CA 1.887 53.929 52.037 0.009 0.000 0.643 147 A CB -0.714 18.288 19.000 0.003 0.000 0.806 147 A HN 0.425 8.575 8.150 -0.000 0.000 0.451 148 S N -0.499 115.200 115.700 -0.001 0.000 2.500 148 S HA -0.027 4.443 4.470 0.001 0.000 0.239 148 S C 1.820 176.417 174.600 -0.005 0.000 0.989 148 S CA 0.793 58.988 58.200 -0.008 0.000 0.951 148 S CB -0.333 62.868 63.200 0.003 0.000 0.759 148 S HN 0.787 9.097 8.310 -0.000 0.000 0.523 149 G N 0.619 109.424 108.800 0.008 0.000 2.572 149 G HA2 0.049 4.009 3.960 0.001 0.000 0.216 149 G HA3 0.049 4.009 3.960 0.001 0.000 0.216 149 G C 0.436 175.349 174.900 0.021 0.000 1.133 149 G CA -0.028 45.082 45.100 0.016 0.000 0.791 149 G HN 0.421 8.711 8.290 -0.000 0.000 0.538 150 M N 2.011 121.616 119.600 0.008 0.000 2.435 150 M HA 0.287 4.768 4.480 0.001 0.000 0.344 150 M C 1.323 177.565 176.300 -0.097 0.000 1.329 150 M CA -0.386 54.916 55.300 0.004 0.000 1.320 150 M CB 1.257 33.874 32.600 0.030 0.000 1.309 150 M HN -0.048 8.242 8.290 -0.000 0.000 0.451 151 M N 0.576 120.145 119.600 -0.051 0.000 2.128 151 M HA -0.216 4.264 4.480 0.001 0.000 0.253 151 M C 1.963 177.986 176.300 -0.463 0.000 1.079 151 M CA 2.269 57.534 55.300 -0.058 0.000 1.082 151 M CB -1.861 30.857 32.600 0.197 0.000 1.335 151 M HN 0.824 9.114 8.290 -0.000 0.000 0.401 152 G N 0.529 108.774 108.800 -0.924 0.000 2.459 152 G HA2 -0.185 3.776 3.960 0.001 0.000 0.217 152 G HA3 -0.185 3.776 3.960 0.001 0.000 0.217 152 G C 1.693 175.900 174.900 -1.156 0.000 1.183 152 G CA 0.799 44.572 45.100 -2.213 0.000 0.776 152 G HN 0.441 8.731 8.290 -0.000 0.000 0.552 153 L N 1.162 122.039 121.223 -0.576 0.000 2.079 153 L HA -0.135 4.205 4.340 0.001 0.000 0.210 153 L C 3.366 180.089 176.870 -0.246 0.000 1.081 153 L CA 1.804 56.488 54.840 -0.260 0.000 0.752 153 L CB -0.807 41.187 42.059 -0.108 0.000 0.896 153 L HN 0.507 8.737 8.230 -0.000 0.000 0.433 154 T N -2.737 111.657 114.554 -0.266 0.000 2.821 154 T HA -0.116 4.234 4.350 0.001 0.000 0.267 154 T C 1.936 176.509 174.700 -0.212 0.000 1.046 154 T CA 0.936 62.931 62.100 -0.176 0.000 1.139 154 T CB -0.259 68.542 68.868 -0.112 0.000 0.871 154 T HN 0.305 8.545 8.240 -0.000 0.000 0.454 155 A N 1.767 124.340 122.820 -0.412 0.000 1.902 155 A HA -0.081 4.240 4.320 0.001 0.000 0.217 155 A C 2.469 179.901 177.584 -0.253 0.000 1.181 155 A CA 1.497 53.283 52.037 -0.419 0.000 0.623 155 A CB -0.589 17.792 19.000 -1.032 0.000 0.818 155 A HN 0.534 8.684 8.150 -0.000 0.000 0.443 156 E N -0.796 119.251 120.200 -0.256 0.000 2.051 156 E HA -0.221 4.129 4.350 0.001 0.000 0.192 156 E C 2.048 178.603 176.600 -0.076 0.000 0.991 156 E CA 1.522 57.848 56.400 -0.124 0.000 0.799 156 E CB -0.377 29.270 29.700 -0.089 0.000 0.748 156 E HN 0.762 9.122 8.360 -0.000 0.000 0.449 157 M N 0.554 120.105 119.600 -0.083 0.000 2.067 157 M HA -0.139 4.341 4.480 0.001 0.000 0.260 157 M C 2.350 178.636 176.300 -0.023 0.000 1.069 157 M CA 1.263 56.534 55.300 -0.048 0.000 1.117 157 M CB -0.082 32.487 32.600 -0.051 0.000 1.334 157 M HN 0.087 8.377 8.290 -0.000 0.000 0.407 158 L N -0.177 121.031 121.223 -0.025 0.000 2.131 158 L HA -0.089 4.252 4.340 0.001 0.000 0.210 158 L C 2.220 179.127 176.870 0.062 0.000 1.092 158 L CA 1.496 56.350 54.840 0.024 0.000 0.759 158 L CB -0.783 41.278 42.059 0.002 0.000 0.903 158 L HN 0.531 8.761 8.230 -0.000 0.000 0.435 159 G N -0.395 108.407 108.800 0.004 0.000 2.433 159 G HA2 -0.237 3.723 3.960 0.001 0.000 0.216 159 G HA3 -0.237 3.723 3.960 0.001 0.000 0.216 159 G C 1.546 176.473 174.900 0.044 0.000 1.186 159 G CA 0.382 45.491 45.100 0.015 0.000 0.779 159 G HN 0.156 8.446 8.290 -0.000 0.000 0.543 160 K N 0.284 120.696 120.400 0.020 0.000 2.044 160 K HA -0.069 4.251 4.320 0.001 0.000 0.210 160 K C 2.612 179.221 176.600 0.015 0.000 1.049 160 K CA 1.251 57.546 56.287 0.013 0.000 0.927 160 K CB -0.674 31.824 32.500 -0.004 0.000 0.713 160 K HN 0.394 8.644 8.250 -0.000 0.000 0.443 161 M N -0.139 119.473 119.600 0.021 0.000 2.073 161 M HA -0.210 4.270 4.480 0.001 0.000 0.258 161 M C 1.915 178.165 176.300 -0.083 0.000 1.070 161 M CA 1.782 57.060 55.300 -0.036 0.000 1.103 161 M CB -0.672 31.903 32.600 -0.040 0.000 1.321 161 M HN 0.232 8.522 8.290 -0.000 0.000 0.405 162 H N -0.538 118.507 119.070 -0.042 0.000 2.551 162 H HA 0.240 4.797 4.556 0.000 0.000 0.266 162 H C 0.777 176.094 175.328 -0.019 0.000 0.977 162 H CA 0.623 56.656 56.048 -0.026 0.000 1.163 162 H CB -0.421 29.335 29.762 -0.009 0.000 1.381 162 H HN 0.573 8.853 8.280 -0.000 0.000 0.581 163 G N 1.081 109.927 108.800 0.077 0.000 2.415 163 G HA2 -0.242 3.718 3.960 0.001 0.000 0.283 163 G HA3 -0.242 3.718 3.960 0.001 0.000 0.283 163 G C -0.734 174.192 174.900 0.043 0.000 1.014 163 G CA -0.197 44.928 45.100 0.041 0.000 1.323 163 G HN 0.199 8.489 8.290 -0.000 0.000 0.502 164 I N 1.862 122.454 120.570 0.037 0.000 2.355 164 I HA 0.460 4.631 4.170 0.001 0.000 0.288 164 I C 0.921 177.053 176.117 0.025 0.000 0.999 164 I CA -0.612 60.702 61.300 0.024 0.000 1.163 164 I CB 1.723 39.726 38.000 0.006 0.000 1.316 164 I HN 0.544 8.754 8.210 -0.000 0.000 0.454 165 S N 5.092 120.808 115.700 0.027 0.000 2.593 165 S HA 0.266 4.737 4.470 0.001 0.000 0.269 165 S C 1.327 175.952 174.600 0.041 0.000 1.334 165 S CA -0.507 57.712 58.200 0.031 0.000 1.015 165 S CB 1.113 64.332 63.200 0.030 0.000 0.912 165 S HN 0.650 8.960 8.310 -0.000 0.000 0.541 166 R N 1.430 121.956 120.500 0.042 0.000 2.117 166 R HA -0.173 4.167 4.340 0.001 0.000 0.243 166 R C 1.801 178.138 176.300 0.062 0.000 1.143 166 R CA 2.402 58.534 56.100 0.053 0.000 0.968 166 R CB -1.028 29.299 30.300 0.046 0.000 0.863 166 R HN 0.914 9.184 8.270 -0.000 0.000 0.444 167 E N -0.115 120.117 120.200 0.054 0.000 2.047 167 E HA -0.207 4.143 4.350 0.001 0.000 0.191 167 E C 2.170 178.814 176.600 0.073 0.000 0.987 167 E CA 1.358 57.793 56.400 0.059 0.000 0.799 167 E CB -0.157 29.571 29.700 0.047 0.000 0.752 167 E HN 0.519 8.879 8.360 -0.000 0.000 0.449 168 Q N 0.638 120.477 119.800 0.065 0.000 2.135 168 Q HA -0.222 4.119 4.340 0.001 0.000 0.204 168 Q C 2.245 178.306 176.000 0.101 0.000 0.981 168 Q CA 1.400 57.245 55.803 0.070 0.000 0.856 168 Q CB -0.036 28.726 28.738 0.039 0.000 0.902 168 Q HN 0.364 8.634 8.270 -0.000 0.000 0.425 169 Q N 0.293 120.152 119.800 0.099 0.000 2.020 169 Q HA -0.159 4.181 4.340 0.001 0.000 0.198 169 Q C 1.604 177.724 176.000 0.201 0.000 0.974 169 Q CA 1.373 57.262 55.803 0.143 0.000 0.829 169 Q CB 0.028 28.838 28.738 0.120 0.000 0.894 169 Q HN 0.356 8.626 8.270 -0.000 0.000 0.433 170 D N 0.852 121.342 120.400 0.150 0.000 2.149 170 D HA -0.160 4.480 4.640 0.001 0.000 0.198 170 D C 1.695 178.085 176.300 0.150 0.000 0.990 170 D CA 1.394 55.479 54.000 0.142 0.000 0.839 170 D CB -0.213 40.648 40.800 0.102 0.000 0.948 170 D HN 0.294 8.664 8.370 -0.000 0.000 0.460 171 A N -0.143 122.765 122.820 0.148 0.000 1.972 171 A HA -0.162 4.158 4.320 0.001 0.000 0.219 171 A C 2.000 179.696 177.584 0.187 0.000 1.169 171 A CA 0.887 53.009 52.037 0.142 0.000 0.635 171 A CB -0.853 18.223 19.000 0.127 0.000 0.810 171 A HN 0.255 8.405 8.150 -0.000 0.000 0.446 172 F N 0.810 120.796 119.950 0.060 0.000 2.146 172 F HA 0.013 4.540 4.527 0.000 0.000 0.298 172 F C 2.548 178.385 175.800 0.061 0.000 1.096 172 F CA 0.820 58.852 58.000 0.054 0.000 1.275 172 F CB -0.550 38.480 39.000 0.049 0.000 1.008 172 F HN 0.245 8.545 8.300 -0.000 0.000 0.480 173 A N -0.278 122.624 122.820 0.137 0.000 1.908 173 A HA -0.149 4.171 4.320 0.001 0.000 0.218 173 A C 2.313 179.951 177.584 0.089 0.000 1.181 173 A CA 2.054 54.132 52.037 0.069 0.000 0.627 173 A CB -1.376 17.734 19.000 0.183 0.000 0.818 173 A HN 0.248 8.398 8.150 -0.000 0.000 0.445 174 V N 0.339 120.319 119.914 0.111 0.000 2.343 174 V HA -0.267 3.854 4.120 0.001 0.000 0.247 174 V C 2.657 178.781 176.094 0.051 0.000 1.051 174 V CA 2.242 64.608 62.300 0.110 0.000 1.036 174 V CB -0.884 30.986 31.823 0.078 0.000 0.654 174 V HN 0.717 8.907 8.190 -0.000 0.000 0.451 175 R N 0.050 120.535 120.500 -0.025 0.000 2.105 175 R HA -0.194 4.146 4.340 0.001 0.000 0.239 175 R C 2.553 178.772 176.300 -0.135 0.000 1.135 175 R CA 2.005 58.058 56.100 -0.077 0.000 0.967 175 R CB -0.427 29.801 30.300 -0.120 0.000 0.861 175 R HN 0.487 8.757 8.270 -0.000 0.000 0.442 176 S N -0.213 115.333 115.700 -0.255 0.000 2.345 176 S HA -0.155 4.315 4.470 0.001 0.000 0.220 176 S C 1.903 176.425 174.600 -0.131 0.000 1.031 176 S CA 0.946 58.983 58.200 -0.271 0.000 0.996 176 S CB -0.334 62.622 63.200 -0.406 0.000 0.882 176 S HN 0.519 8.829 8.310 -0.000 0.000 0.445 177 H N 0.947 120.000 119.070 -0.027 0.000 2.290 177 H HA -0.086 4.471 4.556 0.001 0.000 0.298 177 H C 2.406 177.765 175.328 0.051 0.000 1.087 177 H CA 1.927 57.989 56.048 0.022 0.000 1.291 177 H CB -0.786 28.981 29.762 0.008 0.000 1.369 177 H HN 0.575 8.855 8.280 -0.000 0.000 0.492 178 Q N 0.626 120.522 119.800 0.160 0.000 2.045 178 Q HA -0.146 4.194 4.340 0.001 0.000 0.206 178 Q C 2.469 178.536 176.000 0.111 0.000 0.991 178 Q CA 1.436 57.310 55.803 0.119 0.000 0.851 178 Q CB -0.098 28.683 28.738 0.072 0.000 0.911 178 Q HN 0.382 8.652 8.270 -0.000 0.000 0.418 179 L N -0.165 121.096 121.223 0.064 0.000 2.201 179 L HA -0.108 4.232 4.340 0.001 0.000 0.212 179 L C 2.408 179.318 176.870 0.066 0.000 1.105 179 L CA 0.647 55.517 54.840 0.050 0.000 0.775 179 L CB -0.427 41.646 42.059 0.022 0.000 0.913 179 L HN 0.305 8.535 8.230 -0.000 0.000 0.440 180 A N -0.544 122.342 122.820 0.110 0.000 1.872 180 A HA -0.249 4.072 4.320 0.001 0.000 0.214 180 A C 2.116 179.804 177.584 0.174 0.000 1.187 180 A CA 1.483 53.627 52.037 0.178 0.000 0.614 180 A CB -0.674 18.449 19.000 0.205 0.000 0.826 180 A HN 0.445 8.595 8.150 -0.000 0.000 0.442 181 H N 0.216 119.339 119.070 0.088 0.000 2.319 181 H HA -0.128 4.428 4.556 0.001 0.000 0.299 181 H C 2.027 177.356 175.328 0.001 0.000 1.092 181 H CA 2.288 58.374 56.048 0.063 0.000 1.302 181 H CB -0.144 29.651 29.762 0.054 0.000 1.373 181 H HN 0.470 8.750 8.280 -0.000 0.000 0.497 182 K N -0.162 120.204 120.400 -0.056 0.000 2.009 182 K HA -0.164 4.157 4.320 0.001 0.000 0.210 182 K C 2.351 178.805 176.600 -0.244 0.000 1.049 182 K CA 1.401 57.600 56.287 -0.148 0.000 0.929 182 K CB -0.432 32.040 32.500 -0.047 0.000 0.714 182 K HN 0.346 8.596 8.250 -0.000 0.000 0.440 183 A N 0.412 123.048 122.820 -0.306 0.000 1.940 183 A HA -0.173 4.148 4.320 0.001 0.000 0.219 183 A C 2.164 179.350 177.584 -0.664 0.000 1.176 183 A CA 2.308 53.956 52.037 -0.649 0.000 0.631 183 A CB -1.011 17.328 19.000 -1.101 0.000 0.814 183 A HN 0.506 8.656 8.150 -0.000 0.000 0.446 184 T N -0.466 113.864 114.554 -0.373 0.000 2.701 184 T HA -0.097 4.253 4.350 0.001 0.000 0.263 184 T C 1.915 176.537 174.700 -0.130 0.000 1.040 184 T CA 1.582 63.645 62.100 -0.062 0.000 1.147 184 T CB -0.513 68.441 68.868 0.143 0.000 0.865 184 T HN 0.166 8.406 8.240 -0.000 0.000 0.426 185 V N 1.919 121.681 119.914 -0.253 0.000 2.343 185 V HA -0.164 3.956 4.120 0.001 0.000 0.247 185 V C 2.311 178.309 176.094 -0.161 0.000 1.051 185 V CA 1.678 63.839 62.300 -0.233 0.000 1.036 185 V CB -0.682 30.930 31.823 -0.352 0.000 0.654 185 V HN 0.578 8.768 8.190 -0.000 0.000 0.451 186 E N 0.076 120.166 120.200 -0.184 0.000 2.478 186 E HA 0.100 4.450 4.350 0.001 0.000 0.198 186 E C 1.636 178.155 176.600 -0.134 0.000 1.046 186 E CA 0.591 56.903 56.400 -0.146 0.000 0.870 186 E CB -0.142 29.465 29.700 -0.155 0.000 0.818 186 E HN 0.697 9.057 8.360 -0.000 0.000 0.527 187 G N 2.027 110.743 108.800 -0.139 0.000 2.137 187 G HA2 -0.262 3.698 3.960 0.001 0.000 0.237 187 G HA3 -0.262 3.698 3.960 0.001 0.000 0.237 187 G C 0.689 175.515 174.900 -0.124 0.000 1.002 187 G CA 0.175 45.222 45.100 -0.088 0.000 0.702 187 G HN 0.065 8.355 8.290 -0.000 0.000 0.515 188 K N -0.340 119.890 120.400 -0.284 0.000 2.569 188 K HA 0.340 4.661 4.320 0.001 0.000 0.193 188 K C 1.178 177.595 176.600 -0.306 0.000 1.026 188 K CA 0.154 56.212 56.287 -0.382 0.000 1.093 188 K CB -0.234 31.851 32.500 -0.692 0.000 0.849 188 K HN 0.638 8.888 8.250 -0.000 0.000 0.509 189 F N -0.394 119.478 119.950 -0.131 0.000 2.784 189 F HA 0.134 4.661 4.527 0.000 0.000 0.323 189 F C 2.016 177.797 175.800 -0.031 0.000 1.085 189 F CA -0.461 57.496 58.000 -0.071 0.000 1.196 189 F CB 0.606 39.575 39.000 -0.051 0.000 1.053 189 F HN -0.080 8.220 8.300 -0.000 0.000 0.578 190 K N 0.989 121.475 120.400 0.144 0.000 2.160 190 K HA -0.210 4.111 4.320 0.001 0.000 0.206 190 K C 1.132 177.766 176.600 0.057 0.000 1.047 190 K CA 2.047 58.382 56.287 0.080 0.000 0.930 190 K CB -0.012 32.512 32.500 0.040 0.000 0.720 190 K HN 0.185 8.435 8.250 -0.000 0.000 0.450 191 D N 0.157 120.596 120.400 0.064 0.000 2.162 191 D HA -0.135 4.505 4.640 0.001 0.000 0.203 191 D C 1.799 178.121 176.300 0.036 0.000 0.967 191 D CA 1.282 55.310 54.000 0.047 0.000 0.840 191 D CB 0.067 40.900 40.800 0.055 0.000 0.972 191 D HN 0.585 8.955 8.370 -0.000 0.000 0.482 192 E N 0.808 121.049 120.200 0.069 0.000 2.122 192 E HA -0.019 4.331 4.350 0.001 0.000 0.190 192 E C 0.900 177.413 176.600 -0.145 0.000 0.977 192 E CA 0.219 56.611 56.400 -0.013 0.000 0.820 192 E CB 0.030 29.838 29.700 0.181 0.000 0.770 192 E HN 0.176 8.536 8.360 -0.000 0.000 0.462 193 I N 2.907 123.433 120.570 -0.072 0.000 2.436 193 I HA 0.065 4.236 4.170 0.001 0.000 0.289 193 I C -0.001 176.077 176.117 -0.064 0.000 1.083 193 I CA -0.478 60.762 61.300 -0.099 0.000 1.372 193 I CB 0.701 38.660 38.000 -0.067 0.000 1.408 193 I HN 0.108 8.318 8.210 -0.000 0.000 0.516 194 I N 9.102 129.623 120.570 -0.081 0.000 2.301 194 I HA 0.265 4.436 4.170 0.001 0.000 0.292 194 I C -1.977 174.141 176.117 0.003 0.000 1.046 194 I CA -2.386 58.886 61.300 -0.047 0.000 1.282 194 I CB 0.380 38.337 38.000 -0.072 0.000 1.409 194 I HN 0.180 8.390 8.210 -0.000 0.000 0.484 195 P HA 0.079 4.499 4.420 -0.000 0.000 0.263 195 P C -0.414 176.942 177.300 0.092 0.000 1.168 195 P CA 0.402 63.529 63.100 0.045 0.000 0.759 195 P CB 0.546 32.267 31.700 0.034 0.000 0.782 196 M N 1.967 121.631 119.600 0.107 0.000 2.371 196 M HA 0.200 4.681 4.480 0.001 0.000 0.287 196 M C -0.882 175.490 176.300 0.120 0.000 1.149 196 M CA -0.622 54.767 55.300 0.148 0.000 0.929 196 M CB 1.997 34.715 32.600 0.197 0.000 1.683 196 M HN 0.258 8.548 8.290 -0.000 0.000 0.470 197 Q N 1.638 121.467 119.800 0.048 0.000 2.395 197 Q HA 0.539 4.879 4.340 0.001 0.000 0.271 197 Q C 0.082 176.121 176.000 0.065 0.000 1.026 197 Q CA 0.460 56.265 55.803 0.003 0.000 0.900 197 Q CB 0.981 29.666 28.738 -0.089 0.000 1.266 197 Q HN 0.870 9.140 8.270 -0.000 0.000 0.430 198 G N 0.563 109.409 108.800 0.077 0.000 2.634 198 G HA2 0.497 4.457 3.960 0.001 0.000 0.309 198 G HA3 0.497 4.457 3.960 0.001 0.000 0.309 198 G C -2.107 172.820 174.900 0.044 0.000 1.299 198 G CA -0.603 44.581 45.100 0.141 0.000 0.798 198 G HN 0.441 8.731 8.290 -0.000 0.000 0.490 199 Y N 0.834 121.288 120.300 0.257 0.000 2.373 199 Y HA 0.434 4.984 4.550 0.000 0.000 0.336 199 Y C -0.055 176.029 175.900 0.307 0.000 0.979 199 Y CA -1.014 57.244 58.100 0.264 0.000 1.080 199 Y CB 1.954 40.498 38.460 0.139 0.000 1.190 199 Y HN 0.784 9.064 8.280 -0.000 0.000 0.446 200 D N -0.002 120.703 120.400 0.508 0.000 2.393 200 D HA 0.072 4.712 4.640 0.001 0.000 0.246 200 D C 0.522 176.974 176.300 0.254 0.000 1.275 200 D CA -0.426 53.814 54.000 0.401 0.000 0.979 200 D CB 0.751 41.716 40.800 0.274 0.000 1.101 200 D HN 0.521 8.891 8.370 -0.000 0.000 0.505 201 E N -1.119 119.182 120.200 0.168 0.000 2.455 201 E HA -0.177 4.173 4.350 0.001 0.000 0.202 201 E C 0.685 177.358 176.600 0.122 0.000 1.045 201 E CA 0.694 57.163 56.400 0.114 0.000 0.872 201 E CB -0.540 29.204 29.700 0.073 0.000 0.792 201 E HN 0.406 8.766 8.360 -0.000 0.000 0.542 202 N N -0.277 118.522 118.700 0.165 0.000 2.214 202 N HA 0.054 4.794 4.740 0.001 0.000 0.214 202 N C 0.787 176.536 175.510 0.398 0.000 1.132 202 N CA 0.630 53.813 53.050 0.221 0.000 0.856 202 N CB 0.708 39.243 38.487 0.080 0.000 1.020 202 N HN 0.259 8.639 8.380 -0.000 0.000 0.509 203 G N 0.515 109.520 108.800 0.342 0.000 2.184 203 G HA2 -0.294 3.666 3.960 0.001 0.000 0.264 203 G HA3 -0.294 3.666 3.960 0.001 0.000 0.264 203 G C 0.067 175.242 174.900 0.458 0.000 0.975 203 G CA 0.034 45.331 45.100 0.328 0.000 0.642 203 G HN 0.260 8.550 8.290 -0.000 0.000 0.536 204 F N -0.331 119.740 119.950 0.202 0.000 2.450 204 F HA 0.599 5.126 4.527 0.000 0.000 0.339 204 F C 0.741 176.579 175.800 0.065 0.000 1.146 204 F CA -0.851 57.225 58.000 0.127 0.000 1.267 204 F CB 0.905 39.938 39.000 0.055 0.000 1.178 204 F HN 0.103 8.403 8.300 -0.000 0.000 0.585 205 L N 4.615 125.861 121.223 0.040 0.000 2.275 205 L HA 0.480 4.820 4.340 0.001 0.000 0.288 205 L C -0.670 176.103 176.870 -0.163 0.000 1.046 205 L CA -0.201 54.475 54.840 -0.275 0.000 0.805 205 L CB 0.208 42.086 42.059 -0.301 0.000 1.193 205 L HN 0.732 8.962 8.230 -0.000 0.000 0.426 206 K N 4.306 124.563 120.400 -0.238 0.000 2.597 206 K HA 0.494 4.815 4.320 0.001 0.000 0.282 206 K C -1.514 174.865 176.600 -0.367 0.000 0.975 206 K CA -0.872 55.245 56.287 -0.283 0.000 0.867 206 K CB 1.043 33.338 32.500 -0.341 0.000 1.465 206 K HN 0.423 8.673 8.250 -0.000 0.000 0.417 207 I N 2.032 122.409 120.570 -0.322 0.000 2.342 207 I HA 0.307 4.478 4.170 0.001 0.000 0.291 207 I C -0.778 175.140 176.117 -0.330 0.000 1.010 207 I CA -0.741 60.436 61.300 -0.206 0.000 1.308 207 I CB 0.335 38.283 38.000 -0.088 0.000 1.400 207 I HN 0.378 8.588 8.210 -0.000 0.000 0.488 208 F N 4.286 124.149 119.950 -0.145 0.000 2.425 208 F HA 0.292 4.819 4.527 0.001 0.000 0.331 208 F C 0.849 176.519 175.800 -0.217 0.000 1.085 208 F CA -0.739 57.099 58.000 -0.269 0.000 1.028 208 F CB 1.009 39.688 39.000 -0.533 0.000 1.177 208 F HN 0.506 8.806 8.300 -0.000 0.000 0.487 209 D N 0.288 120.683 120.400 -0.009 0.000 2.692 209 D HA 0.081 4.721 4.640 0.001 0.000 0.290 209 D C -0.824 175.546 176.300 0.117 0.000 1.455 209 D CA 0.039 54.068 54.000 0.049 0.000 0.796 209 D CB -0.369 40.483 40.800 0.087 0.000 1.131 209 D HN 0.476 8.846 8.370 -0.000 0.000 0.467 210 Y N -1.392 118.977 120.300 0.116 0.000 2.805 210 Y HA 0.671 5.222 4.550 0.001 0.000 0.323 210 Y C -1.223 174.718 175.900 0.069 0.000 1.279 210 Y CA -1.309 56.851 58.100 0.100 0.000 1.103 210 Y CB 0.595 39.128 38.460 0.122 0.000 1.324 210 Y HN -0.355 7.925 8.280 -0.000 0.000 0.498 211 D N 1.308 121.899 120.400 0.318 0.000 2.427 211 D HA 0.175 4.816 4.640 0.001 0.000 0.226 211 D C 0.075 176.550 176.300 0.292 0.000 1.076 211 D CA -0.202 53.896 54.000 0.164 0.000 0.849 211 D CB 1.779 42.636 40.800 0.095 0.000 1.052 211 D HN 0.766 9.136 8.370 -0.000 0.000 0.515 212 E N 0.741 121.052 120.200 0.186 0.000 2.097 212 E HA -0.204 4.146 4.350 0.001 0.000 0.196 212 E C 1.883 178.571 176.600 0.145 0.000 1.000 212 E CA 1.657 58.185 56.400 0.212 0.000 0.804 212 E CB 0.005 29.733 29.700 0.047 0.000 0.740 212 E HN 0.545 8.905 8.360 -0.000 0.000 0.454 213 T N 0.611 115.225 114.554 0.099 0.000 2.721 213 T HA -0.196 4.154 4.350 0.001 0.000 0.268 213 T C 1.250 176.051 174.700 0.169 0.000 1.038 213 T CA 0.736 62.899 62.100 0.104 0.000 1.145 213 T CB -0.806 68.104 68.868 0.070 0.000 0.858 213 T HN 0.032 8.272 8.240 -0.000 0.000 0.459 214 I N 1.716 122.405 120.570 0.197 0.000 2.775 214 I HA 0.198 4.369 4.170 0.001 0.000 0.290 214 I C 0.697 176.926 176.117 0.186 0.000 1.203 214 I CA 0.058 61.518 61.300 0.267 0.000 1.433 214 I CB 0.168 38.328 38.000 0.267 0.000 1.354 214 I HN 0.026 8.236 8.210 -0.000 0.000 0.579 215 R N 7.833 128.423 120.500 0.150 0.000 2.487 215 R HA 0.323 4.664 4.340 0.001 0.000 0.288 215 R C -2.118 174.043 176.300 -0.233 0.000 1.394 215 R CA -1.901 54.114 56.100 -0.140 0.000 1.155 215 R CB 0.803 30.924 30.300 -0.299 0.000 1.156 215 R HN 0.218 8.488 8.270 -0.000 0.000 0.553 216 P HA -0.165 4.255 4.420 -0.000 0.000 0.218 216 P C 0.299 177.480 177.300 -0.198 0.000 1.148 216 P CA 1.180 64.120 63.100 -0.268 0.000 0.822 216 P CB 0.270 31.617 31.700 -0.589 0.000 0.784 217 D N -2.112 118.178 120.400 -0.183 0.000 2.378 217 D HA -0.054 4.586 4.640 0.001 0.000 0.227 217 D C -0.108 176.113 176.300 -0.131 0.000 1.012 217 D CA 0.515 54.435 54.000 -0.134 0.000 0.905 217 D CB -1.101 39.633 40.800 -0.110 0.000 0.895 217 D HN 0.074 8.444 8.370 -0.000 0.000 0.532 218 T N 1.853 116.290 114.554 -0.196 0.000 2.754 218 T HA 0.215 4.565 4.350 0.001 0.000 0.282 218 T C 0.523 175.181 174.700 -0.071 0.000 0.923 218 T CA 0.152 62.141 62.100 -0.186 0.000 1.164 218 T CB 0.361 68.991 68.868 -0.398 0.000 0.873 218 T HN 0.322 8.562 8.240 -0.000 0.000 0.537 219 T N 0.888 115.418 114.554 -0.039 0.000 2.942 219 T HA 0.524 4.874 4.350 0.001 0.000 0.289 219 T C 1.425 176.132 174.700 0.013 0.000 1.044 219 T CA -1.112 60.983 62.100 -0.007 0.000 1.023 219 T CB 1.165 70.026 68.868 -0.011 0.000 1.123 219 T HN 0.287 8.527 8.240 -0.000 0.000 0.512 220 L N 0.223 121.461 121.223 0.025 0.000 2.127 220 L HA -0.119 4.221 4.340 0.001 0.000 0.211 220 L C 2.598 179.484 176.870 0.026 0.000 1.089 220 L CA 1.516 56.377 54.840 0.035 0.000 0.757 220 L CB -0.453 41.629 42.059 0.038 0.000 0.899 220 L HN 0.753 8.983 8.230 -0.000 0.000 0.434 221 E N -0.414 119.795 120.200 0.016 0.000 2.047 221 E HA -0.176 4.174 4.350 0.001 0.000 0.191 221 E C 2.309 178.914 176.600 0.008 0.000 0.987 221 E CA 1.538 57.944 56.400 0.011 0.000 0.799 221 E CB -0.237 29.466 29.700 0.005 0.000 0.752 221 E HN 0.480 8.840 8.360 -0.000 0.000 0.449 222 S N 0.189 115.889 115.700 0.001 0.000 2.423 222 S HA -0.053 4.417 4.470 0.001 0.000 0.231 222 S C 1.964 176.568 174.600 0.006 0.000 1.014 222 S CA 0.635 58.832 58.200 -0.005 0.000 0.965 222 S CB -0.298 62.888 63.200 -0.023 0.000 0.785 222 S HN 0.137 8.447 8.310 -0.000 0.000 0.495 223 L N 0.972 122.207 121.223 0.019 0.000 2.131 223 L HA 0.193 4.533 4.340 0.001 0.000 0.206 223 L C 2.902 179.796 176.870 0.040 0.000 1.087 223 L CA 0.911 55.774 54.840 0.039 0.000 0.767 223 L CB -0.643 41.453 42.059 0.061 0.000 0.917 223 L HN 0.444 8.674 8.230 -0.000 0.000 0.441 224 A N -0.172 122.668 122.820 0.034 0.000 2.248 224 A HA 0.120 4.440 4.320 0.001 0.000 0.210 224 A C 2.175 179.773 177.584 0.024 0.000 1.174 224 A CA 1.176 53.232 52.037 0.032 0.000 0.750 224 A CB -0.419 18.599 19.000 0.029 0.000 0.780 224 A HN 0.385 8.535 8.150 -0.000 0.000 0.478 225 A N -0.624 122.207 122.820 0.020 0.000 2.115 225 A HA 0.440 4.760 4.320 0.001 0.000 0.211 225 A C 0.934 178.526 177.584 0.013 0.000 1.169 225 A CA -0.155 51.890 52.037 0.013 0.000 0.787 225 A CB -0.146 18.858 19.000 0.008 0.000 0.858 225 A HN 0.419 8.569 8.150 -0.000 0.000 0.474 226 L N 0.525 121.759 121.223 0.019 0.000 2.473 226 L HA 0.175 4.515 4.340 0.001 0.000 0.268 226 L C 0.160 177.039 176.870 0.015 0.000 1.215 226 L CA 0.047 54.897 54.840 0.017 0.000 0.823 226 L CB 0.370 42.446 42.059 0.028 0.000 1.099 226 L HN 0.187 8.417 8.230 -0.000 0.000 0.483 227 K N 1.448 121.851 120.400 0.004 0.000 2.156 227 K HA 0.420 4.740 4.320 0.001 0.000 0.250 227 K C -2.389 174.206 176.600 -0.008 0.000 0.955 227 K CA -1.848 54.439 56.287 -0.001 0.000 0.855 227 K CB 0.949 33.444 32.500 -0.009 0.000 1.101 227 K HN 0.251 8.501 8.250 -0.000 0.000 0.434 228 P HA -0.105 4.315 4.420 -0.000 0.000 0.261 228 P C -0.417 176.845 177.300 -0.062 0.000 1.183 228 P CA 0.390 63.490 63.100 0.001 0.000 0.761 228 P CB 0.729 32.440 31.700 0.019 0.000 0.785 229 A N 2.691 125.426 122.820 -0.141 0.000 1.984 229 A HA 0.021 4.342 4.320 0.001 0.000 0.214 229 A C 1.114 178.350 177.584 -0.580 0.000 1.173 229 A CA 1.015 52.801 52.037 -0.417 0.000 0.673 229 A CB -0.734 17.875 19.000 -0.652 0.000 0.830 229 A HN 0.527 8.677 8.150 -0.000 0.000 0.453 230 F N -0.975 118.972 119.950 -0.005 0.000 2.682 230 F HA 0.315 4.842 4.527 0.001 0.000 0.308 230 F C 0.615 176.403 175.800 -0.020 0.000 1.093 230 F CA -0.024 57.964 58.000 -0.019 0.000 1.244 230 F CB 0.367 39.332 39.000 -0.059 0.000 1.052 230 F HN 0.253 8.553 8.300 -0.000 0.000 0.573 231 N N 0.286 119.050 118.700 0.107 0.000 2.976 231 N HA 0.135 4.875 4.740 0.001 0.000 0.220 231 N C -2.593 172.938 175.510 0.034 0.000 1.428 231 N CA -1.020 52.070 53.050 0.066 0.000 0.748 231 N CB 1.027 39.554 38.487 0.067 0.000 1.484 231 N HN -0.260 8.120 8.380 -0.000 0.000 0.578 232 P HA -0.157 4.263 4.420 -0.000 0.000 0.216 232 P C 0.314 177.621 177.300 0.012 0.000 1.157 232 P CA 1.679 64.784 63.100 0.007 0.000 0.880 232 P CB 0.150 31.851 31.700 0.001 0.000 0.791 233 K N 0.346 120.754 120.400 0.014 0.000 2.278 233 K HA 0.501 4.821 4.320 0.001 0.000 0.237 233 K C 0.706 177.314 176.600 0.014 0.000 1.229 233 K CA 0.150 56.444 56.287 0.013 0.000 1.155 233 K CB -1.516 30.991 32.500 0.011 0.000 1.590 233 K HN 0.382 8.632 8.250 -0.000 0.000 0.290 234 G N 0.007 108.817 108.800 0.016 0.000 2.754 234 G HA2 0.208 4.169 3.960 0.001 0.000 0.215 234 G HA3 0.208 4.169 3.960 0.001 0.000 0.215 234 G C 0.163 175.077 174.900 0.023 0.000 1.121 234 G CA -0.217 44.893 45.100 0.017 0.000 0.954 234 G HN 1.370 9.660 8.290 -0.000 0.000 0.511 235 G N -1.203 107.614 108.800 0.029 0.000 2.569 235 G HA2 0.901 4.861 3.960 0.001 0.000 0.300 235 G HA3 0.901 4.861 3.960 0.001 0.000 0.300 235 G C 0.627 175.553 174.900 0.044 0.000 1.269 235 G CA 0.605 45.729 45.100 0.040 0.000 0.959 235 G HN 1.160 9.450 8.290 -0.000 0.000 0.478 236 T N -3.139 111.447 114.554 0.053 0.000 2.989 236 T HA 0.128 4.478 4.350 0.001 0.000 0.250 236 T C 0.675 175.427 174.700 0.087 0.000 0.981 236 T CA 0.139 62.275 62.100 0.059 0.000 0.980 236 T CB 0.066 68.963 68.868 0.047 0.000 1.133 236 T HN 0.328 8.568 8.240 -0.000 0.000 0.489 237 V N 4.682 124.659 119.914 0.105 0.000 2.403 237 V HA 0.384 4.504 4.120 0.001 0.000 0.265 237 V C 0.841 177.058 176.094 0.206 0.000 1.034 237 V CA 0.012 62.414 62.300 0.170 0.000 1.036 237 V CB -0.634 31.275 31.823 0.143 0.000 1.032 237 V HN 0.756 8.946 8.190 -0.000 0.000 0.478 238 T N 1.998 116.658 114.554 0.176 0.000 2.949 238 T HA 0.665 5.015 4.350 0.001 0.000 0.287 238 T C 1.267 176.060 174.700 0.155 0.000 1.034 238 T CA -0.146 62.023 62.100 0.114 0.000 1.018 238 T CB 1.987 70.905 68.868 0.083 0.000 1.135 238 T HN 0.515 8.755 8.240 -0.000 0.000 0.532 239 A N 0.404 123.275 122.820 0.084 0.000 2.076 239 A HA 0.146 4.466 4.320 0.001 0.000 0.220 239 A C 2.282 179.955 177.584 0.149 0.000 1.160 239 A CA 1.791 53.894 52.037 0.110 0.000 0.653 239 A CB -1.568 17.461 19.000 0.048 0.000 0.801 239 A HN 1.100 9.250 8.150 -0.000 0.000 0.455 240 G N -0.844 108.039 108.800 0.138 0.000 2.421 240 G HA2 -0.065 3.895 3.960 0.001 0.000 0.217 240 G HA3 -0.065 3.895 3.960 0.001 0.000 0.217 240 G C 1.521 176.539 174.900 0.197 0.000 1.143 240 G CA 1.672 46.867 45.100 0.160 0.000 0.784 240 G HN 0.739 9.029 8.290 -0.000 0.000 0.541 241 T N -2.241 112.441 114.554 0.213 0.000 3.086 241 T HA 0.369 4.719 4.350 0.001 0.000 0.250 241 T C 0.866 175.743 174.700 0.296 0.000 1.074 241 T CA -0.025 62.222 62.100 0.246 0.000 0.988 241 T CB 0.326 69.342 68.868 0.246 0.000 0.988 241 T HN 0.001 8.241 8.240 -0.000 0.000 0.530 242 S N 2.384 118.270 115.700 0.309 0.000 2.608 242 S HA 0.605 5.076 4.470 0.001 0.000 0.291 242 S C 0.337 175.012 174.600 0.126 0.000 1.146 242 S CA -0.796 57.602 58.200 0.330 0.000 1.043 242 S CB 1.548 65.071 63.200 0.538 0.000 1.037 242 S HN 0.723 9.033 8.310 -0.000 0.000 0.520 243 S N 2.159 117.838 115.700 -0.036 0.000 2.576 243 S HA 0.171 4.641 4.470 0.001 0.000 0.272 243 S C -0.233 174.409 174.600 0.069 0.000 1.352 243 S CA -0.506 57.685 58.200 -0.014 0.000 1.021 243 S CB 0.041 63.192 63.200 -0.081 0.000 0.887 243 S HN 0.687 8.997 8.310 -0.000 0.000 0.542 244 Q N 0.410 120.250 119.800 0.067 0.000 2.230 244 Q HA 0.383 4.723 4.340 0.001 0.000 0.248 244 Q C -0.385 175.631 176.000 0.027 0.000 0.915 244 Q CA -0.830 55.009 55.803 0.060 0.000 0.900 244 Q CB 0.819 29.588 28.738 0.051 0.000 1.229 244 Q HN 0.588 8.858 8.270 -0.000 0.000 0.439 245 I N 2.878 123.449 120.570 0.000 0.000 2.483 245 I HA 0.078 4.248 4.170 0.001 0.000 0.291 245 I C -0.091 175.965 176.117 -0.101 0.000 1.112 245 I CA 0.647 61.903 61.300 -0.074 0.000 1.350 245 I CB -0.608 37.358 38.000 -0.056 0.000 1.419 245 I HN 0.516 8.726 8.210 -0.000 0.000 0.523 246 T N 5.051 119.513 114.554 -0.152 0.000 2.886 246 T HA 0.330 4.680 4.350 0.001 0.000 0.292 246 T C -0.426 174.127 174.700 -0.245 0.000 1.012 246 T CA -0.776 61.228 62.100 -0.160 0.000 0.982 246 T CB 2.019 70.823 68.868 -0.106 0.000 1.018 246 T HN 0.324 8.564 8.240 -0.000 0.000 0.451 247 D N 1.761 121.976 120.400 -0.307 0.000 2.249 247 D HA 0.597 5.238 4.640 0.001 0.000 0.246 247 D C 0.283 176.342 176.300 -0.403 0.000 1.114 247 D CA 0.037 53.743 54.000 -0.491 0.000 0.854 247 D CB 1.749 41.977 40.800 -0.953 0.000 1.132 247 D HN 0.831 9.201 8.370 -0.000 0.000 0.461 248 G N -0.384 108.211 108.800 -0.342 0.000 2.489 248 G HA2 0.594 4.554 3.960 0.001 0.000 0.291 248 G HA3 0.594 4.554 3.960 0.001 0.000 0.291 248 G C -1.891 172.908 174.900 -0.169 0.000 1.487 248 G CA -0.589 44.341 45.100 -0.284 0.000 0.795 248 G HN 0.563 8.852 8.290 -0.000 0.000 0.513 249 A N -0.203 122.546 122.820 -0.118 0.000 2.454 249 A HA 0.982 5.302 4.320 0.001 0.000 0.302 249 A C -0.070 177.488 177.584 -0.044 0.000 1.079 249 A CA 0.022 52.047 52.037 -0.020 0.000 0.731 249 A CB 1.872 20.961 19.000 0.148 0.000 1.299 249 A HN 2.225 10.375 8.150 -0.000 0.000 0.413 250 S N -0.338 115.311 115.700 -0.085 0.000 2.547 250 S HA 0.669 5.139 4.470 0.001 0.000 0.281 250 S C -0.706 173.841 174.600 -0.089 0.000 1.118 250 S CA -0.669 57.481 58.200 -0.083 0.000 0.947 250 S CB 0.866 64.075 63.200 0.015 0.000 1.053 250 S HN 1.490 9.800 8.310 -0.000 0.000 0.482 251 C N 4.045 123.344 119.300 -0.001 0.000 2.719 251 C HA 0.907 5.368 4.460 0.001 0.000 0.327 251 C C -0.833 174.267 174.990 0.183 0.000 1.238 251 C CA -0.705 58.415 59.018 0.170 0.000 1.727 251 C CB 1.421 29.328 27.740 0.278 0.000 2.256 251 C HN 1.078 9.308 8.230 -0.000 0.000 0.489 252 M N 4.647 124.393 119.600 0.244 0.000 2.298 252 M HA 0.453 4.933 4.480 0.001 0.000 0.255 252 M C -1.793 174.641 176.300 0.224 0.000 1.021 252 M CA -0.212 55.245 55.300 0.261 0.000 0.968 252 M CB 1.068 33.838 32.600 0.283 0.000 2.037 252 M HN 0.623 8.913 8.290 -0.000 0.000 0.478 253 I N 5.118 125.800 120.570 0.187 0.000 2.371 253 I HA 0.459 4.630 4.170 0.001 0.000 0.290 253 I C -0.610 175.608 176.117 0.169 0.000 1.028 253 I CA -0.628 60.774 61.300 0.169 0.000 1.345 253 I CB 1.195 39.269 38.000 0.124 0.000 1.407 253 I HN 0.366 8.576 8.210 -0.000 0.000 0.501 254 V N 7.422 127.452 119.914 0.194 0.000 2.823 254 V HA 0.653 4.773 4.120 0.001 0.000 0.312 254 V C -0.098 176.113 176.094 0.196 0.000 1.072 254 V CA -0.652 61.751 62.300 0.172 0.000 0.937 254 V CB 1.938 33.849 31.823 0.147 0.000 1.013 254 V HN 0.854 9.044 8.190 -0.000 0.000 0.430 255 M N 1.463 121.150 119.600 0.145 0.000 2.949 255 M HA 0.652 5.132 4.480 0.001 0.000 0.270 255 M C -0.601 175.756 176.300 0.096 0.000 1.221 255 M CA -0.636 54.754 55.300 0.150 0.000 0.818 255 M CB 2.145 34.823 32.600 0.129 0.000 1.635 255 M HN 0.567 8.857 8.290 -0.000 0.000 0.492 256 S N 0.759 116.514 115.700 0.091 0.000 2.585 256 S HA 0.577 5.047 4.470 0.001 0.000 0.273 256 S C 1.013 175.641 174.600 0.047 0.000 1.339 256 S CA -0.124 58.111 58.200 0.058 0.000 1.028 256 S CB 1.302 64.537 63.200 0.059 0.000 0.906 256 S HN 0.989 9.299 8.310 -0.000 0.000 0.528 257 A N 1.287 124.127 122.820 0.033 0.000 1.972 257 A HA -0.128 4.192 4.320 0.001 0.000 0.219 257 A C 2.229 179.829 177.584 0.027 0.000 1.169 257 A CA 1.883 53.936 52.037 0.028 0.000 0.635 257 A CB -1.064 17.947 19.000 0.018 0.000 0.810 257 A HN 0.907 9.057 8.150 -0.000 0.000 0.446 258 Q N 0.201 120.018 119.800 0.028 0.000 1.942 258 Q HA -0.205 4.136 4.340 0.001 0.000 0.203 258 Q C 2.144 178.161 176.000 0.029 0.000 0.987 258 Q CA 2.392 58.210 55.803 0.026 0.000 0.844 258 Q CB -0.425 28.329 28.738 0.026 0.000 0.911 258 Q HN 0.440 8.710 8.270 -0.000 0.000 0.423 259 R N -0.040 120.482 120.500 0.036 0.000 2.249 259 R HA -0.001 4.340 4.340 0.001 0.000 0.230 259 R C 1.726 178.048 176.300 0.036 0.000 1.121 259 R CA 1.455 57.577 56.100 0.037 0.000 0.997 259 R CB -0.773 29.556 30.300 0.047 0.000 0.867 259 R HN 0.402 8.672 8.270 -0.000 0.000 0.465 260 A N 0.336 123.179 122.820 0.038 0.000 1.855 260 A HA -0.071 4.250 4.320 0.001 0.000 0.213 260 A C 2.030 179.631 177.584 0.028 0.000 1.195 260 A CA 1.267 53.326 52.037 0.037 0.000 0.610 260 A CB -0.525 18.499 19.000 0.040 0.000 0.837 260 A HN 0.362 8.512 8.150 -0.000 0.000 0.444 261 K N -0.200 120.214 120.400 0.024 0.000 2.103 261 K HA -0.233 4.087 4.320 0.001 0.000 0.207 261 K C 1.146 177.757 176.600 0.018 0.000 1.048 261 K CA 1.858 58.157 56.287 0.019 0.000 0.930 261 K CB -0.284 32.226 32.500 0.017 0.000 0.716 261 K HN 0.401 8.651 8.250 -0.000 0.000 0.444 262 D N 0.907 121.319 120.400 0.019 0.000 2.144 262 D HA -0.150 4.491 4.640 0.001 0.000 0.199 262 D C 1.795 178.104 176.300 0.016 0.000 0.984 262 D CA 1.029 55.039 54.000 0.016 0.000 0.834 262 D CB -0.069 40.741 40.800 0.017 0.000 0.955 262 D HN 0.303 8.673 8.370 -0.000 0.000 0.465 263 L N -0.043 121.191 121.223 0.019 0.000 2.599 263 L HA 0.133 4.474 4.340 0.001 0.000 0.230 263 L C 1.395 178.275 176.870 0.016 0.000 1.141 263 L CA 0.228 55.078 54.840 0.018 0.000 0.877 263 L CB -0.410 41.662 42.059 0.022 0.000 1.009 263 L HN 0.054 8.284 8.230 -0.000 0.000 0.447 264 G N 1.830 110.640 108.800 0.016 0.000 2.296 264 G HA2 -0.298 3.662 3.960 0.001 0.000 0.282 264 G HA3 -0.298 3.662 3.960 0.001 0.000 0.282 264 G C 0.280 175.189 174.900 0.016 0.000 1.014 264 G CA 0.688 45.797 45.100 0.014 0.000 0.812 264 G HN 0.480 8.770 8.290 -0.000 0.000 0.508 265 L N -2.085 119.150 121.223 0.019 0.000 2.272 265 L HA 0.887 5.227 4.340 0.001 0.000 0.289 265 L C 0.268 177.151 176.870 0.022 0.000 1.032 265 L CA -1.284 53.569 54.840 0.021 0.000 0.810 265 L CB 1.414 43.488 42.059 0.025 0.000 1.205 265 L HN 0.056 8.286 8.230 -0.000 0.000 0.422 266 E N 5.148 125.360 120.200 0.019 0.000 2.417 266 E HA 0.252 4.602 4.350 0.001 0.000 0.261 266 E C -2.250 174.364 176.600 0.023 0.000 1.000 266 E CA -0.963 55.448 56.400 0.018 0.000 0.919 266 E CB 0.459 30.168 29.700 0.014 0.000 0.955 266 E HN 0.535 8.895 8.360 -0.000 0.000 0.455 267 P HA 0.011 4.431 4.420 -0.000 0.000 0.272 267 P C -0.128 177.188 177.300 0.026 0.000 1.230 267 P CA -0.396 62.722 63.100 0.030 0.000 0.788 267 P CB 0.590 32.306 31.700 0.027 0.000 0.949 268 L N 1.119 122.362 121.223 0.034 0.000 2.357 268 L HA 0.515 4.855 4.340 0.001 0.000 0.211 268 L C 0.423 177.298 176.870 0.008 0.000 1.075 268 L CA 1.098 55.951 54.840 0.021 0.000 0.830 268 L CB -0.508 41.570 42.059 0.032 0.000 0.996 268 L HN 0.498 8.728 8.230 -0.000 0.000 0.467 269 A N -1.980 120.865 122.820 0.041 0.000 2.515 269 A HA 0.669 4.989 4.320 0.001 0.000 0.292 269 A C -1.736 175.919 177.584 0.117 0.000 1.065 269 A CA -0.249 51.833 52.037 0.075 0.000 0.641 269 A CB 0.848 19.901 19.000 0.088 0.000 1.306 269 A HN -0.161 7.989 8.150 -0.000 0.000 0.441 270 V N 0.978 120.971 119.914 0.131 0.000 2.668 270 V HA 0.385 4.506 4.120 0.001 0.000 0.304 270 V C -0.503 175.606 176.094 0.025 0.000 1.071 270 V CA -0.245 62.096 62.300 0.069 0.000 0.894 270 V CB 1.701 33.529 31.823 0.009 0.000 1.008 270 V HN 0.741 8.931 8.190 -0.000 0.000 0.425 271 I N 5.130 125.661 120.570 -0.065 0.000 2.533 271 I HA 0.271 4.441 4.170 0.001 0.000 0.284 271 I C 1.178 177.192 176.117 -0.173 0.000 1.109 271 I CA -0.073 61.071 61.300 -0.260 0.000 1.412 271 I CB 0.770 38.587 38.000 -0.306 0.000 1.396 271 I HN 0.639 8.849 8.210 -0.000 0.000 0.543 272 R N 3.208 123.604 120.500 -0.173 0.000 2.191 272 R HA 0.194 4.535 4.340 0.001 0.000 0.196 272 R C 0.179 176.412 176.300 -0.111 0.000 0.991 272 R CA 0.427 56.474 56.100 -0.088 0.000 1.075 272 R CB 0.209 30.512 30.300 0.005 0.000 1.040 272 R HN 0.747 9.017 8.270 -0.000 0.000 0.526 273 S N -0.421 115.181 115.700 -0.164 0.000 2.541 273 S HA 0.703 5.173 4.470 0.001 0.000 0.271 273 S C -0.551 173.893 174.600 -0.260 0.000 1.133 273 S CA -0.884 57.215 58.200 -0.168 0.000 0.876 273 S CB 2.447 65.588 63.200 -0.098 0.000 1.105 273 S HN -0.019 8.291 8.310 -0.000 0.000 0.470 274 M N 1.786 121.212 119.600 -0.291 0.000 2.457 274 M HA 0.838 5.318 4.480 0.001 0.000 0.300 274 M C -0.743 175.432 176.300 -0.208 0.000 1.141 274 M CA -0.540 54.492 55.300 -0.448 0.000 0.901 274 M CB 2.528 34.621 32.600 -0.845 0.000 1.687 274 M HN 1.075 9.365 8.290 -0.000 0.000 0.449 275 A N 1.713 124.498 122.820 -0.059 0.000 2.574 275 A HA 0.874 5.194 4.320 0.001 0.000 0.297 275 A C -1.448 176.182 177.584 0.077 0.000 1.062 275 A CA -0.789 51.253 52.037 0.008 0.000 0.686 275 A CB 1.590 20.581 19.000 -0.016 0.000 1.285 275 A HN 0.900 9.050 8.150 -0.000 0.000 0.403 276 V N -1.502 118.440 119.914 0.047 0.000 2.760 276 V HA 1.022 5.142 4.120 0.001 0.000 0.309 276 V C -0.137 175.966 176.094 0.014 0.000 1.077 276 V CA -0.130 62.192 62.300 0.037 0.000 0.910 276 V CB 0.901 32.748 31.823 0.041 0.000 1.008 276 V HN 2.379 10.569 8.190 -0.000 0.000 0.424 277 A N 2.451 125.275 122.820 0.006 0.000 2.569 277 A HA 1.065 5.385 4.320 0.001 0.000 0.290 277 A C -0.111 177.478 177.584 0.007 0.000 1.136 277 A CA -0.322 51.718 52.037 0.005 0.000 0.710 277 A CB 1.764 20.765 19.000 0.000 0.000 1.303 277 A HN 2.036 10.186 8.150 -0.000 0.000 0.413 278 G N -0.991 107.818 108.800 0.015 0.000 2.481 278 G HA2 0.780 4.740 3.960 0.001 0.000 0.315 278 G HA3 0.780 4.740 3.960 0.001 0.000 0.315 278 G C -0.578 174.344 174.900 0.038 0.000 1.231 278 G CA 0.007 45.119 45.100 0.020 0.000 0.968 278 G HN 1.957 10.247 8.290 -0.000 0.000 0.482 279 V N -2.230 117.711 119.914 0.045 0.000 3.165 279 V HA 0.621 4.741 4.120 0.001 0.000 0.309 279 V C -1.032 175.090 176.094 0.048 0.000 1.267 279 V CA -1.396 60.946 62.300 0.069 0.000 1.067 279 V CB 1.855 33.750 31.823 0.119 0.000 1.082 279 V HN 0.577 8.767 8.190 -0.000 0.000 0.451 280 D N 1.687 122.114 120.400 0.044 0.000 2.389 280 D HA 0.259 4.899 4.640 0.001 0.000 0.247 280 D C -1.856 174.459 176.300 0.025 0.000 1.128 280 D CA -1.047 52.970 54.000 0.028 0.000 0.884 280 D CB 1.803 42.613 40.800 0.015 0.000 1.194 280 D HN 0.377 8.747 8.370 -0.000 0.000 0.441 281 P HA -0.209 4.211 4.420 -0.000 0.000 0.216 281 P C 1.217 178.520 177.300 0.005 0.000 1.150 281 P CA 1.644 64.752 63.100 0.013 0.000 0.843 281 P CB 0.205 31.914 31.700 0.015 0.000 0.787 282 A N -0.055 122.766 122.820 0.001 0.000 1.948 282 A HA -0.165 4.155 4.320 0.001 0.000 0.220 282 A C 1.705 179.278 177.584 -0.018 0.000 1.177 282 A CA 1.870 53.900 52.037 -0.012 0.000 0.636 282 A CB -1.418 17.574 19.000 -0.013 0.000 0.815 282 A HN 0.414 8.564 8.150 -0.000 0.000 0.449 283 I N -3.480 117.090 120.570 -0.000 0.000 3.283 283 I HA 0.302 4.473 4.170 0.001 0.000 0.342 283 I C 1.109 177.262 176.117 0.059 0.000 1.510 283 I CA -0.163 61.146 61.300 0.014 0.000 1.006 283 I CB 0.318 38.316 38.000 -0.003 0.000 1.596 283 I HN 0.224 8.434 8.210 -0.000 0.000 0.509 284 M N 0.610 120.234 119.600 0.041 0.000 2.192 284 M HA 0.020 4.500 4.480 0.001 0.000 0.259 284 M C 1.805 178.143 176.300 0.065 0.000 1.071 284 M CA 2.257 57.586 55.300 0.048 0.000 1.082 284 M CB -1.684 30.929 32.600 0.023 0.000 1.373 284 M HN 0.271 8.561 8.290 -0.000 0.000 0.408 285 G N -1.327 107.518 108.800 0.075 0.000 2.527 285 G HA2 -0.244 3.716 3.960 0.001 0.000 0.219 285 G HA3 -0.244 3.716 3.960 0.001 0.000 0.219 285 G C 1.203 176.153 174.900 0.084 0.000 1.117 285 G CA 0.538 45.685 45.100 0.078 0.000 0.759 285 G HN 0.652 8.942 8.290 -0.000 0.000 0.556 286 Y N 1.746 122.028 120.300 -0.030 0.000 2.490 286 Y HA 0.256 4.806 4.550 0.001 0.000 0.281 286 Y C 2.387 178.275 175.900 -0.020 0.000 1.174 286 Y CA -0.227 57.853 58.100 -0.034 0.000 1.295 286 Y CB -0.062 38.395 38.460 -0.006 0.000 1.062 286 Y HN 0.097 8.377 8.280 -0.000 0.000 0.522 287 G N 1.209 110.014 108.800 0.009 0.000 2.469 287 G HA2 -0.258 3.703 3.960 0.001 0.000 0.220 287 G HA3 -0.258 3.703 3.960 0.001 0.000 0.220 287 G C -0.536 174.302 174.900 -0.104 0.000 1.136 287 G CA 0.825 45.905 45.100 -0.033 0.000 0.759 287 G HN 0.340 8.630 8.290 -0.000 0.000 0.562 288 P HA -0.131 4.289 4.420 -0.000 0.000 0.214 288 P C 2.357 179.550 177.300 -0.178 0.000 1.163 288 P CA 1.622 64.640 63.100 -0.136 0.000 0.889 288 P CB -0.271 31.351 31.700 -0.130 0.000 0.790 289 V N -0.219 119.502 119.914 -0.322 0.000 2.282 289 V HA -0.157 3.964 4.120 0.001 0.000 0.249 289 V C -0.759 175.226 176.094 -0.181 0.000 1.057 289 V CA 2.696 64.810 62.300 -0.309 0.000 1.032 289 V CB -2.183 29.304 31.823 -0.561 0.000 0.645 289 V HN 0.130 8.320 8.190 -0.000 0.000 0.447 290 P HA -0.030 4.390 4.420 -0.000 0.000 0.215 290 P C 1.946 179.219 177.300 -0.044 0.000 1.157 290 P CA 2.299 65.365 63.100 -0.058 0.000 0.863 290 P CB -0.376 31.315 31.700 -0.015 0.000 0.787 291 A N -0.969 121.822 122.820 -0.048 0.000 1.933 291 A HA -0.175 4.145 4.320 0.001 0.000 0.218 291 A C 2.206 179.774 177.584 -0.027 0.000 1.175 291 A CA 2.370 54.391 52.037 -0.026 0.000 0.628 291 A CB -1.894 17.095 19.000 -0.019 0.000 0.814 291 A HN 0.153 8.303 8.150 -0.000 0.000 0.444 292 T N 0.107 114.635 114.554 -0.044 0.000 2.737 292 T HA -0.158 4.192 4.350 0.001 0.000 0.265 292 T C 2.061 176.740 174.700 -0.035 0.000 1.038 292 T CA 1.653 63.731 62.100 -0.036 0.000 1.144 292 T CB -0.298 68.541 68.868 -0.049 0.000 0.866 292 T HN 0.635 8.875 8.240 -0.000 0.000 0.434 293 Q N 0.687 120.461 119.800 -0.042 0.000 2.135 293 Q HA -0.124 4.216 4.340 0.001 0.000 0.204 293 Q C 2.345 178.328 176.000 -0.029 0.000 0.981 293 Q CA 1.251 57.033 55.803 -0.034 0.000 0.856 293 Q CB -0.183 28.537 28.738 -0.030 0.000 0.902 293 Q HN 0.423 8.693 8.270 -0.000 0.000 0.425 294 K N 0.356 120.740 120.400 -0.026 0.000 2.148 294 K HA -0.101 4.220 4.320 0.001 0.000 0.204 294 K C 1.994 178.575 176.600 -0.031 0.000 1.050 294 K CA 0.972 57.244 56.287 -0.024 0.000 0.942 294 K CB -0.040 32.448 32.500 -0.019 0.000 0.724 294 K HN 0.172 8.422 8.250 -0.000 0.000 0.446 295 A N 1.149 123.950 122.820 -0.032 0.000 1.897 295 A HA -0.065 4.256 4.320 0.001 0.000 0.215 295 A C 2.051 179.612 177.584 -0.038 0.000 1.181 295 A CA 0.926 52.939 52.037 -0.041 0.000 0.620 295 A CB -0.504 18.476 19.000 -0.034 0.000 0.821 295 A HN 0.275 8.425 8.150 -0.000 0.000 0.443 296 L N -0.523 120.681 121.223 -0.033 0.000 2.083 296 L HA -0.215 4.125 4.340 0.001 0.000 0.209 296 L C 2.551 179.396 176.870 -0.041 0.000 1.083 296 L CA 1.674 56.491 54.840 -0.037 0.000 0.752 296 L CB -0.391 41.643 42.059 -0.041 0.000 0.899 296 L HN 0.370 8.600 8.230 -0.000 0.000 0.433 297 K N -0.267 120.111 120.400 -0.036 0.000 2.097 297 K HA -0.118 4.203 4.320 0.001 0.000 0.205 297 K C 2.211 178.791 176.600 -0.034 0.000 1.050 297 K CA 1.025 57.292 56.287 -0.034 0.000 0.938 297 K CB -0.086 32.397 32.500 -0.028 0.000 0.718 297 K HN 0.276 8.526 8.250 -0.000 0.000 0.442 298 R N 0.266 120.744 120.500 -0.037 0.000 2.148 298 R HA 0.006 4.346 4.340 0.001 0.000 0.223 298 R C 1.962 178.240 176.300 -0.037 0.000 1.088 298 R CA 1.010 57.086 56.100 -0.040 0.000 0.985 298 R CB -0.040 30.228 30.300 -0.053 0.000 0.880 298 R HN 0.120 8.390 8.270 -0.000 0.000 0.451 299 A N 0.278 123.078 122.820 -0.034 0.000 2.275 299 A HA 0.224 4.545 4.320 0.001 0.000 0.212 299 A C 1.186 178.759 177.584 -0.019 0.000 1.201 299 A CA 0.512 52.539 52.037 -0.016 0.000 0.843 299 A CB 0.016 19.017 19.000 0.001 0.000 0.873 299 A HN 0.372 8.522 8.150 -0.000 0.000 0.492 300 G N -0.340 108.439 108.800 -0.034 0.000 2.338 300 G HA2 -0.205 3.756 3.960 0.001 0.000 0.296 300 G HA3 -0.205 3.756 3.960 0.001 0.000 0.296 300 G C -0.205 174.650 174.900 -0.076 0.000 1.040 300 G CA 0.833 45.907 45.100 -0.044 0.000 1.004 300 G HN 0.578 8.868 8.290 -0.000 0.000 0.509 301 L N -0.842 120.326 121.223 -0.092 0.000 2.393 301 L HA 0.542 4.883 4.340 0.001 0.000 0.260 301 L C -0.198 176.602 176.870 -0.117 0.000 1.002 301 L CA -1.436 53.313 54.840 -0.151 0.000 0.818 301 L CB 1.775 43.703 42.059 -0.218 0.000 1.369 301 L HN 0.033 8.263 8.230 -0.000 0.000 0.412 302 N N 0.977 119.598 118.700 -0.131 0.000 2.489 302 N HA 0.229 4.970 4.740 0.001 0.000 0.284 302 N C 0.586 176.039 175.510 -0.095 0.000 1.158 302 N CA -0.683 52.310 53.050 -0.095 0.000 0.965 302 N CB 1.520 39.955 38.487 -0.087 0.000 1.195 302 N HN 0.659 9.039 8.380 -0.000 0.000 0.506 303 M N 1.785 121.344 119.600 -0.068 0.000 2.260 303 M HA -0.112 4.368 4.480 0.001 0.000 0.261 303 M C 1.569 177.829 176.300 -0.067 0.000 1.066 303 M CA 1.404 56.670 55.300 -0.058 0.000 1.082 303 M CB -0.590 31.983 32.600 -0.044 0.000 1.388 303 M HN 0.736 9.026 8.290 -0.000 0.000 0.419 304 A N -0.658 122.117 122.820 -0.075 0.000 2.015 304 A HA -0.128 4.192 4.320 0.001 0.000 0.219 304 A C 1.805 179.328 177.584 -0.102 0.000 1.163 304 A CA 1.734 53.724 52.037 -0.079 0.000 0.646 304 A CB -0.829 18.129 19.000 -0.070 0.000 0.806 304 A HN 0.571 8.721 8.150 -0.000 0.000 0.448 305 D N -0.117 120.198 120.400 -0.142 0.000 2.310 305 D HA 0.009 4.649 4.640 0.001 0.000 0.212 305 D C 0.455 176.659 176.300 -0.159 0.000 0.965 305 D CA 0.522 54.391 54.000 -0.218 0.000 0.879 305 D CB -0.060 40.504 40.800 -0.393 0.000 0.921 305 D HN 0.438 8.808 8.370 -0.000 0.000 0.510 306 I N 2.090 122.612 120.570 -0.081 0.000 2.396 306 I HA -0.031 4.139 4.170 0.001 0.000 0.289 306 I C 1.245 177.341 176.117 -0.035 0.000 1.056 306 I CA -0.286 61.025 61.300 0.019 0.000 1.365 306 I CB 1.070 39.087 38.000 0.028 0.000 1.407 306 I HN -0.251 7.959 8.210 -0.000 0.000 0.509 307 D N 5.751 126.147 120.400 -0.007 0.000 2.137 307 D HA 0.011 4.652 4.640 0.001 0.000 0.202 307 D C -0.023 175.872 176.300 -0.675 0.000 0.970 307 D CA 1.663 55.489 54.000 -0.290 0.000 0.837 307 D CB 0.230 40.954 40.800 -0.126 0.000 0.981 307 D HN 0.244 8.614 8.370 -0.000 0.000 0.475 308 F N -0.188 119.787 119.950 0.041 0.000 2.576 308 F HA 0.488 5.015 4.527 0.000 0.000 0.313 308 F C -0.119 175.690 175.800 0.014 0.000 1.078 308 F CA -0.951 57.053 58.000 0.008 0.000 0.921 308 F CB 2.095 41.081 39.000 -0.023 0.000 1.232 308 F HN -0.360 7.940 8.300 -0.000 0.000 0.459 309 I N 1.899 122.571 120.570 0.169 0.000 2.545 309 I HA 0.406 4.576 4.170 0.001 0.000 0.292 309 I C -0.930 175.237 176.117 0.083 0.000 1.040 309 I CA -0.818 60.544 61.300 0.104 0.000 1.068 309 I CB 2.158 40.194 38.000 0.060 0.000 1.251 309 I HN 0.415 8.625 8.210 -0.000 0.000 0.424 310 E N 5.475 125.713 120.200 0.063 0.000 2.207 310 E HA 0.337 4.687 4.350 0.001 0.000 0.250 310 E C -1.468 175.157 176.600 0.042 0.000 0.890 310 E CA -0.761 55.664 56.400 0.041 0.000 0.749 310 E CB 2.307 32.015 29.700 0.012 0.000 1.193 310 E HN 0.322 8.682 8.360 -0.000 0.000 0.423 311 L N 4.240 125.493 121.223 0.050 0.000 2.276 311 L HA 0.361 4.702 4.340 0.001 0.000 0.286 311 L C -0.233 176.660 176.870 0.038 0.000 1.024 311 L CA -0.622 54.242 54.840 0.039 0.000 0.826 311 L CB 0.876 42.962 42.059 0.047 0.000 1.211 311 L HN 0.209 8.439 8.230 -0.000 0.000 0.422 312 N N 3.487 122.191 118.700 0.006 0.000 2.386 312 N HA -0.072 4.669 4.740 0.001 0.000 0.273 312 N C -0.469 175.009 175.510 -0.054 0.000 1.331 312 N CA 0.505 53.541 53.050 -0.023 0.000 0.891 312 N CB 0.304 38.762 38.487 -0.048 0.000 1.139 312 N HN 0.618 8.998 8.380 -0.000 0.000 0.487 313 E N 3.199 123.388 120.200 -0.018 0.000 1.791 313 E HA 0.075 4.425 4.350 0.001 0.000 0.263 313 E C 0.509 177.018 176.600 -0.151 0.000 1.213 313 E CA -0.331 56.081 56.400 0.019 0.000 0.991 313 E CB 0.286 30.051 29.700 0.108 0.000 1.068 313 E HN 0.697 9.057 8.360 -0.000 0.000 0.417 314 A N 3.735 126.388 122.820 -0.279 0.000 1.854 314 A HA 0.037 4.358 4.320 0.001 0.000 0.214 314 A C 0.289 177.353 177.584 -0.866 0.000 1.192 314 A CA 0.964 52.611 52.037 -0.651 0.000 0.611 314 A CB 0.203 18.836 19.000 -0.612 0.000 0.832 314 A HN 0.437 8.586 8.150 -0.000 0.000 0.442 315 F N -3.914 116.042 119.950 0.011 0.000 2.608 315 F HA 0.583 5.110 4.527 0.000 0.000 0.309 315 F C 0.928 176.758 175.800 0.050 0.000 1.103 315 F CA -0.641 57.388 58.000 0.047 0.000 0.954 315 F CB 1.481 40.484 39.000 0.004 0.000 1.267 315 F HN 0.064 8.364 8.300 -0.000 0.000 0.444 316 A N 1.598 124.593 122.820 0.292 0.000 2.019 316 A HA 0.065 4.386 4.320 0.001 0.000 0.219 316 A C 2.095 179.673 177.584 -0.009 0.000 1.164 316 A CA 1.911 54.044 52.037 0.160 0.000 0.644 316 A CB -0.887 18.278 19.000 0.276 0.000 0.805 316 A HN 0.901 9.051 8.150 -0.000 0.000 0.449 317 A N -0.373 122.499 122.820 0.087 0.000 2.121 317 A HA -0.034 4.286 4.320 0.001 0.000 0.218 317 A C 1.998 179.572 177.584 -0.017 0.000 1.154 317 A CA 1.746 53.794 52.037 0.017 0.000 0.679 317 A CB -0.281 18.723 19.000 0.007 0.000 0.795 317 A HN 0.757 8.907 8.150 -0.000 0.000 0.458 318 Q N -1.860 117.959 119.800 0.031 0.000 2.442 318 Q HA 0.506 4.847 4.340 0.001 0.000 0.228 318 Q C 1.816 177.767 176.000 -0.082 0.000 0.902 318 Q CA 1.019 56.822 55.803 -0.001 0.000 0.933 318 Q CB -0.580 28.225 28.738 0.113 0.000 1.071 318 Q HN 0.233 8.503 8.270 -0.000 0.000 0.562 319 A N 1.695 124.451 122.820 -0.108 0.000 1.877 319 A HA -0.066 4.254 4.320 0.001 0.000 0.216 319 A C 2.152 179.558 177.584 -0.298 0.000 1.186 319 A CA 1.538 53.467 52.037 -0.180 0.000 0.620 319 A CB -0.919 17.984 19.000 -0.161 0.000 0.822 319 A HN 0.375 8.525 8.150 -0.000 0.000 0.443 320 L N -0.636 120.332 121.223 -0.424 0.000 2.012 320 L HA -0.143 4.197 4.340 0.001 0.000 0.210 320 L C -0.375 176.372 176.870 -0.205 0.000 1.073 320 L CA 1.687 56.311 54.840 -0.360 0.000 0.748 320 L CB -1.604 40.255 42.059 -0.334 0.000 0.891 320 L HN 0.234 8.464 8.230 -0.000 0.000 0.431 321 P HA -0.130 4.290 4.420 -0.000 0.000 0.215 321 P C 1.983 179.178 177.300 -0.176 0.000 1.153 321 P CA 1.133 64.064 63.100 -0.282 0.000 0.853 321 P CB 0.056 31.386 31.700 -0.616 0.000 0.788 322 V N -0.472 119.339 119.914 -0.172 0.000 2.332 322 V HA -0.238 3.882 4.120 0.001 0.000 0.248 322 V C 2.410 178.434 176.094 -0.117 0.000 1.055 322 V CA 1.718 63.915 62.300 -0.171 0.000 1.038 322 V CB -1.293 30.430 31.823 -0.167 0.000 0.651 322 V HN 0.085 8.275 8.190 -0.000 0.000 0.450 323 L N -0.353 120.809 121.223 -0.101 0.000 2.141 323 L HA -0.181 4.159 4.340 0.001 0.000 0.209 323 L C 2.552 179.400 176.870 -0.036 0.000 1.094 323 L CA 1.713 56.515 54.840 -0.062 0.000 0.763 323 L CB -0.572 41.449 42.059 -0.063 0.000 0.908 323 L HN 0.330 8.560 8.230 -0.000 0.000 0.437 324 K N 0.564 120.948 120.400 -0.027 0.000 2.025 324 K HA -0.188 4.132 4.320 0.001 0.000 0.207 324 K C 1.521 178.146 176.600 0.041 0.000 1.049 324 K CA 1.893 58.191 56.287 0.017 0.000 0.933 324 K CB 0.031 32.562 32.500 0.051 0.000 0.714 324 K HN 0.157 8.407 8.250 -0.000 0.000 0.438 325 D N 0.508 120.947 120.400 0.065 0.000 2.219 325 D HA -0.078 4.562 4.640 0.001 0.000 0.205 325 D C 1.458 177.767 176.300 0.016 0.000 0.970 325 D CA 0.731 54.781 54.000 0.084 0.000 0.851 325 D CB 0.156 41.058 40.800 0.170 0.000 0.943 325 D HN 0.179 8.549 8.370 -0.000 0.000 0.488 326 L N 0.149 121.358 121.223 -0.023 0.000 2.610 326 L HA 0.066 4.406 4.340 0.001 0.000 0.232 326 L C 0.162 177.020 176.870 -0.020 0.000 1.149 326 L CA 0.235 55.053 54.840 -0.035 0.000 0.872 326 L CB -0.268 41.760 42.059 -0.051 0.000 0.992 326 L HN -0.000 8.230 8.230 -0.000 0.000 0.447 327 K N -0.082 120.314 120.400 -0.007 0.000 3.244 327 K HA -0.151 4.170 4.320 0.001 0.000 0.270 327 K C 0.177 176.770 176.600 -0.012 0.000 1.016 327 K CA 0.564 56.849 56.287 -0.004 0.000 0.754 327 K CB -1.522 30.975 32.500 -0.005 0.000 1.326 327 K HN 0.361 8.611 8.250 -0.000 0.000 0.465 328 V N -3.662 116.245 119.914 -0.011 0.000 3.486 328 V HA 0.127 4.247 4.120 0.001 0.000 0.335 328 V C 1.237 177.331 176.094 -0.001 0.000 1.506 328 V CA -0.128 62.165 62.300 -0.012 0.000 1.206 328 V CB 0.216 32.029 31.823 -0.017 0.000 1.049 328 V HN 0.346 8.536 8.190 -0.000 0.000 0.502 329 L N 1.861 123.085 121.223 0.001 0.000 2.083 329 L HA -0.083 4.257 4.340 0.001 0.000 0.209 329 L C 2.363 179.245 176.870 0.019 0.000 1.083 329 L CA 2.501 57.347 54.840 0.009 0.000 0.752 329 L CB -0.014 42.046 42.059 0.002 0.000 0.899 329 L HN 0.690 8.920 8.230 -0.000 0.000 0.433 330 D N -1.154 119.253 120.400 0.012 0.000 2.352 330 D HA -0.132 4.509 4.640 0.001 0.000 0.232 330 D C 0.896 177.202 176.300 0.009 0.000 1.055 330 D CA 0.381 54.389 54.000 0.013 0.000 0.891 330 D CB 0.106 40.911 40.800 0.007 0.000 0.897 330 D HN 0.334 8.704 8.370 -0.000 0.000 0.529 331 K N -0.112 120.293 120.400 0.007 0.000 2.438 331 K HA 0.174 4.495 4.320 0.001 0.000 0.206 331 K C 1.630 178.238 176.600 0.012 0.000 1.081 331 K CA -0.340 55.945 56.287 -0.003 0.000 1.053 331 K CB 0.482 32.967 32.500 -0.025 0.000 0.908 331 K HN 0.156 8.406 8.250 -0.000 0.000 0.556 332 M N 1.911 121.534 119.600 0.037 0.000 2.800 332 M HA -0.272 4.208 4.480 0.001 0.000 0.271 332 M C 1.289 177.628 176.300 0.064 0.000 1.059 332 M CA 1.974 57.316 55.300 0.070 0.000 1.071 332 M CB -0.263 32.403 32.600 0.110 0.000 1.227 332 M HN 0.134 8.424 8.290 -0.000 0.000 0.505 333 N N -0.005 118.731 118.700 0.061 0.000 2.503 333 N HA -0.203 4.537 4.740 0.001 0.000 0.189 333 N C 1.371 176.909 175.510 0.047 0.000 1.048 333 N CA 1.373 54.454 53.050 0.052 0.000 0.905 333 N CB -0.269 38.246 38.487 0.047 0.000 0.951 333 N HN 0.602 8.982 8.380 -0.000 0.000 0.446 334 E N 0.947 121.167 120.200 0.034 0.000 2.307 334 E HA -0.032 4.318 4.350 0.001 0.000 0.195 334 E C 0.437 177.042 176.600 0.009 0.000 0.975 334 E CA 0.491 56.902 56.400 0.020 0.000 0.878 334 E CB 0.358 30.049 29.700 -0.014 0.000 0.845 334 E HN 0.339 8.699 8.360 -0.000 0.000 0.488 335 K N -0.794 119.611 120.400 0.008 0.000 3.066 335 K HA 0.225 4.545 4.320 0.001 0.000 0.168 335 K C -1.122 175.524 176.600 0.077 0.000 1.076 335 K CA -0.241 56.046 56.287 -0.001 0.000 1.082 335 K CB 0.888 33.228 32.500 -0.266 0.000 0.700 335 K HN -0.139 8.111 8.250 -0.000 0.000 0.403 336 V N 1.941 121.906 119.914 0.085 0.000 2.447 336 V HA 0.259 4.379 4.120 0.001 0.000 0.292 336 V C -0.820 175.316 176.094 0.069 0.000 1.021 336 V CA -0.907 61.444 62.300 0.085 0.000 0.850 336 V CB 0.964 32.843 31.823 0.093 0.000 1.005 336 V HN 0.552 8.742 8.190 -0.000 0.000 0.426 337 N N 3.360 122.087 118.700 0.045 0.000 2.671 337 N HA -0.182 4.559 4.740 0.001 0.000 0.261 337 N C 0.518 176.002 175.510 -0.044 0.000 1.053 337 N CA 0.466 53.517 53.050 0.002 0.000 0.732 337 N CB -0.801 37.700 38.487 0.023 0.000 0.887 337 N HN 0.705 9.085 8.380 -0.000 0.000 0.546 338 L N -0.574 120.568 121.223 -0.135 0.000 2.622 338 L HA -0.072 4.268 4.340 0.001 0.000 0.233 338 L C 0.869 177.667 176.870 -0.120 0.000 1.156 338 L CA 0.739 55.475 54.840 -0.173 0.000 0.866 338 L CB -0.157 41.748 42.059 -0.256 0.000 0.980 338 L HN 0.456 8.686 8.230 -0.000 0.000 0.448 339 H N -0.563 118.498 119.070 -0.015 0.000 2.662 339 H HA 0.454 5.011 4.556 0.001 0.000 0.268 339 H C 0.919 176.292 175.328 0.075 0.000 1.152 339 H CA 0.163 56.192 56.048 -0.031 0.000 1.072 339 H CB 0.479 30.225 29.762 -0.027 0.000 1.660 339 H HN 0.232 8.512 8.280 -0.000 0.000 0.584 340 G N -0.426 108.440 108.800 0.109 0.000 2.710 340 G HA2 0.127 4.088 3.960 0.001 0.000 0.668 340 G HA3 0.127 4.088 3.960 0.001 0.000 0.668 340 G C 0.048 174.961 174.900 0.022 0.000 1.320 340 G CA -0.416 44.706 45.100 0.036 0.000 0.860 340 G HN 0.651 8.941 8.290 -0.000 0.000 0.538 341 G N -2.226 106.540 108.800 -0.055 0.000 3.176 341 G HA2 0.815 4.775 3.960 0.001 0.000 0.272 341 G HA3 0.815 4.775 3.960 0.001 0.000 0.272 341 G C 1.174 176.054 174.900 -0.034 0.000 1.349 341 G CA 1.004 46.085 45.100 -0.032 0.000 0.953 341 G HN 2.051 10.341 8.290 -0.000 0.000 0.559 342 A N -0.784 122.026 122.820 -0.017 0.000 2.131 342 A HA 0.026 4.346 4.320 0.001 0.000 0.220 342 A C 2.175 179.742 177.584 -0.029 0.000 1.158 342 A CA 1.258 53.295 52.037 0.001 0.000 0.665 342 A CB -0.567 18.430 19.000 -0.006 0.000 0.795 342 A HN 0.498 8.648 8.150 -0.000 0.000 0.460 343 I N -1.155 119.366 120.570 -0.081 0.000 2.394 343 I HA -0.207 3.963 4.170 0.001 0.000 0.251 343 I C 2.605 178.587 176.117 -0.224 0.000 1.136 343 I CA 1.202 62.436 61.300 -0.110 0.000 1.425 343 I CB -0.129 37.793 38.000 -0.129 0.000 1.079 343 I HN 0.376 8.586 8.210 -0.000 0.000 0.425 344 A N -0.134 122.504 122.820 -0.304 0.000 2.108 344 A HA 0.283 4.604 4.320 0.001 0.000 0.206 344 A C 1.873 179.449 177.584 -0.013 0.000 1.212 344 A CA 0.060 51.927 52.037 -0.283 0.000 0.843 344 A CB -0.027 18.743 19.000 -0.384 0.000 0.902 344 A HN 0.320 8.470 8.150 -0.000 0.000 0.477 345 L N -0.408 120.808 121.223 -0.011 0.000 2.640 345 L HA 0.388 4.728 4.340 0.001 0.000 0.230 345 L C 1.098 177.971 176.870 0.005 0.000 1.123 345 L CA 0.328 55.176 54.840 0.014 0.000 0.900 345 L CB -0.309 41.759 42.059 0.015 0.000 1.146 345 L HN 0.492 8.722 8.230 -0.000 0.000 0.484 346 G N 0.600 109.410 108.800 0.016 0.000 2.755 346 G HA2 -0.310 3.650 3.960 0.001 0.000 0.686 346 G HA3 -0.310 3.650 3.960 0.001 0.000 0.686 346 G C -0.786 174.157 174.900 0.071 0.000 1.427 346 G CA -0.432 44.683 45.100 0.025 0.000 0.873 346 G HN 0.485 8.775 8.290 -0.000 0.000 0.580 347 H N 1.591 120.638 119.070 -0.039 0.000 2.541 347 H HA 0.586 5.142 4.556 0.000 0.000 0.246 347 H C -2.574 172.750 175.328 -0.007 0.000 1.341 347 H CA -1.950 54.095 56.048 -0.005 0.000 1.469 347 H CB 1.270 31.048 29.762 0.027 0.000 1.472 347 H HN 0.345 8.625 8.280 -0.000 0.000 0.503 348 P HA 0.056 4.476 4.420 -0.000 0.000 0.273 348 P C 0.706 177.810 177.300 -0.328 0.000 1.319 348 P CA 0.149 63.056 63.100 -0.323 0.000 0.885 348 P CB -0.114 31.457 31.700 -0.215 0.000 1.015 349 F N 2.013 121.664 119.950 -0.498 0.000 2.184 349 F HA -0.354 4.173 4.527 0.001 0.000 0.292 349 F C 2.502 178.154 175.800 -0.247 0.000 1.154 349 F CA 1.238 59.006 58.000 -0.388 0.000 1.288 349 F CB -1.273 37.635 39.000 -0.154 0.000 0.915 349 F HN 0.347 8.647 8.300 -0.000 0.000 0.540 350 G N -1.874 106.968 108.800 0.070 0.000 2.708 350 G HA2 -0.227 3.733 3.960 0.001 0.000 0.210 350 G HA3 -0.227 3.733 3.960 0.001 0.000 0.210 350 G C 1.269 176.089 174.900 -0.133 0.000 1.141 350 G CA 0.799 45.883 45.100 -0.027 0.000 0.788 350 G HN 0.607 8.897 8.290 -0.000 0.000 0.531 351 C N -1.123 118.093 119.300 -0.140 0.000 2.563 351 C HA 0.268 4.728 4.460 0.001 0.000 0.346 351 C C 2.906 177.830 174.990 -0.111 0.000 1.334 351 C CA 1.244 60.159 59.018 -0.170 0.000 1.938 351 C CB -0.424 27.224 27.740 -0.154 0.000 2.445 351 C HN 0.281 8.511 8.230 -0.000 0.000 0.541 352 S N 1.382 117.031 115.700 -0.085 0.000 2.407 352 S HA -0.088 4.383 4.470 0.001 0.000 0.235 352 S C 1.936 176.548 174.600 0.020 0.000 1.036 352 S CA 1.844 60.053 58.200 0.014 0.000 1.013 352 S CB -0.962 62.331 63.200 0.155 0.000 0.820 352 S HN 0.888 9.198 8.310 -0.000 0.000 0.476 353 G N 1.480 110.270 108.800 -0.017 0.000 2.545 353 G HA2 -0.164 3.796 3.960 0.001 0.000 0.217 353 G HA3 -0.164 3.796 3.960 0.001 0.000 0.217 353 G C 1.528 176.409 174.900 -0.031 0.000 1.218 353 G CA 1.081 46.162 45.100 -0.032 0.000 0.787 353 G HN 0.647 8.937 8.290 -0.000 0.000 0.571 354 A N -0.211 122.583 122.820 -0.044 0.000 2.016 354 A HA 0.170 4.490 4.320 0.001 0.000 0.217 354 A C 2.316 179.887 177.584 -0.021 0.000 1.162 354 A CA 1.418 53.443 52.037 -0.019 0.000 0.662 354 A CB -0.330 18.675 19.000 0.009 0.000 0.812 354 A HN 0.305 8.455 8.150 -0.000 0.000 0.450 355 R N 0.800 121.331 120.500 0.052 0.000 2.080 355 R HA -0.161 4.179 4.340 0.001 0.000 0.236 355 R C 2.094 178.379 176.300 -0.025 0.000 1.137 355 R CA 2.141 58.324 56.100 0.138 0.000 0.943 355 R CB -0.589 29.765 30.300 0.091 0.000 0.846 355 R HN 0.709 8.979 8.270 -0.000 0.000 0.431 356 I N -1.405 119.144 120.570 -0.035 0.000 2.394 356 I HA -0.123 4.048 4.170 0.001 0.000 0.251 356 I C 1.885 177.910 176.117 -0.153 0.000 1.136 356 I CA 1.487 62.757 61.300 -0.050 0.000 1.425 356 I CB -0.328 37.672 38.000 -0.000 0.000 1.079 356 I HN -0.055 8.155 8.210 -0.000 0.000 0.425 357 S N 1.736 117.314 115.700 -0.202 0.000 2.368 357 S HA 0.000 4.471 4.470 0.001 0.000 0.224 357 S C 2.113 176.310 174.600 -0.672 0.000 1.029 357 S CA 1.275 59.284 58.200 -0.318 0.000 0.988 357 S CB -0.808 62.326 63.200 -0.109 0.000 0.838 357 S HN 0.720 9.030 8.310 -0.000 0.000 0.462 358 G N 1.494 109.689 108.800 -1.008 0.000 2.421 358 G HA2 -0.199 3.761 3.960 0.001 0.000 0.216 358 G HA3 -0.199 3.761 3.960 0.001 0.000 0.216 358 G C 1.445 175.711 174.900 -1.056 0.000 1.171 358 G CA 1.545 45.441 45.100 -2.005 0.000 0.775 358 G HN 0.492 8.782 8.290 -0.000 0.000 0.543 359 T N 1.223 115.457 114.554 -0.532 0.000 2.788 359 T HA -0.129 4.221 4.350 0.001 0.000 0.268 359 T C 2.242 176.878 174.700 -0.107 0.000 1.044 359 T CA 1.168 63.234 62.100 -0.057 0.000 1.139 359 T CB -0.225 68.711 68.868 0.113 0.000 0.867 359 T HN 0.175 8.415 8.240 -0.000 0.000 0.454 360 L N 1.361 122.448 121.223 -0.226 0.000 2.012 360 L HA -0.046 4.294 4.340 0.001 0.000 0.210 360 L C 2.085 178.805 176.870 -0.249 0.000 1.073 360 L CA 1.692 56.407 54.840 -0.209 0.000 0.748 360 L CB -0.833 41.092 42.059 -0.224 0.000 0.891 360 L HN 0.253 8.483 8.230 -0.000 0.000 0.431 361 L N -0.336 120.670 121.223 -0.362 0.000 2.017 361 L HA -0.210 4.130 4.340 0.001 0.000 0.208 361 L C 2.410 179.180 176.870 -0.167 0.000 1.073 361 L CA 1.465 56.126 54.840 -0.298 0.000 0.745 361 L CB -1.080 40.760 42.059 -0.366 0.000 0.894 361 L HN 0.392 8.622 8.230 -0.000 0.000 0.432 362 N N 0.022 118.661 118.700 -0.102 0.000 2.223 362 N HA -0.132 4.608 4.740 0.001 0.000 0.185 362 N C 1.893 177.377 175.510 -0.042 0.000 1.016 362 N CA 1.248 54.293 53.050 -0.008 0.000 0.863 362 N CB -0.201 38.353 38.487 0.112 0.000 0.983 362 N HN 0.179 8.559 8.380 -0.000 0.000 0.429 363 V N 1.801 121.645 119.914 -0.116 0.000 2.307 363 V HA -0.184 3.936 4.120 0.001 0.000 0.245 363 V C 2.440 178.221 176.094 -0.522 0.000 1.045 363 V CA 1.323 63.435 62.300 -0.313 0.000 1.024 363 V CB -0.403 31.131 31.823 -0.482 0.000 0.651 363 V HN 0.236 8.426 8.190 -0.000 0.000 0.449 364 M N -0.205 119.145 119.600 -0.417 0.000 2.065 364 M HA -0.237 4.243 4.480 0.001 0.000 0.259 364 M C 2.399 178.589 176.300 -0.182 0.000 1.069 364 M CA 2.150 57.264 55.300 -0.310 0.000 1.110 364 M CB -0.631 31.917 32.600 -0.088 0.000 1.328 364 M HN 0.222 8.512 8.290 -0.000 0.000 0.405 365 K N 0.510 120.835 120.400 -0.124 0.000 2.074 365 K HA -0.240 4.080 4.320 0.001 0.000 0.209 365 K C 1.886 178.445 176.600 -0.069 0.000 1.048 365 K CA 1.791 58.036 56.287 -0.070 0.000 0.926 365 K CB -0.052 32.421 32.500 -0.046 0.000 0.713 365 K HN 0.433 8.683 8.250 -0.000 0.000 0.444 366 Q N -0.385 119.358 119.800 -0.096 0.000 2.172 366 Q HA -0.024 4.316 4.340 0.001 0.000 0.200 366 Q C 0.664 176.611 176.000 -0.089 0.000 0.964 366 Q CA 0.849 56.606 55.803 -0.077 0.000 0.855 366 Q CB 0.220 28.923 28.738 -0.059 0.000 0.918 366 Q HN 0.325 8.595 8.270 -0.000 0.000 0.444 367 N N -0.437 118.161 118.700 -0.170 0.000 2.328 367 N HA 0.106 4.846 4.740 0.001 0.000 0.247 367 N C -0.045 175.493 175.510 0.047 0.000 1.165 367 N CA 0.525 53.518 53.050 -0.096 0.000 0.873 367 N CB 1.370 39.703 38.487 -0.256 0.000 1.125 367 N HN 0.251 8.631 8.380 -0.000 0.000 0.513 368 G N 0.890 109.703 108.800 0.022 0.000 2.390 368 G HA2 -0.245 3.715 3.960 0.001 0.000 0.299 368 G HA3 -0.245 3.715 3.960 0.001 0.000 0.299 368 G C 0.555 175.545 174.900 0.151 0.000 1.002 368 G CA 0.445 45.587 45.100 0.070 0.000 0.979 368 G HN 0.489 8.779 8.290 -0.000 0.000 0.513 369 G N -1.870 107.051 108.800 0.202 0.000 2.537 369 G HA2 0.588 4.549 3.960 0.001 0.000 0.273 369 G HA3 0.588 4.549 3.960 0.001 0.000 0.273 369 G C 0.762 175.759 174.900 0.163 0.000 1.189 369 G CA 0.657 45.967 45.100 0.351 0.000 0.881 369 G HN 0.367 8.657 8.290 -0.000 0.000 0.535 370 T N -0.170 114.477 114.554 0.155 0.000 3.151 370 T HA 0.223 4.573 4.350 0.001 0.000 0.239 370 T C -0.127 174.467 174.700 -0.178 0.000 0.979 370 T CA 0.467 62.552 62.100 -0.024 0.000 1.194 370 T CB 0.052 68.939 68.868 0.032 0.000 0.982 370 T HN 0.253 8.493 8.240 -0.000 0.000 0.428 371 F N 1.461 121.467 119.950 0.093 0.000 2.436 371 F HA 0.687 5.214 4.527 0.000 0.000 0.340 371 F C 0.758 176.633 175.800 0.125 0.000 1.113 371 F CA -1.011 57.044 58.000 0.091 0.000 1.022 371 F CB 1.545 40.573 39.000 0.048 0.000 1.128 371 F HN 0.151 8.451 8.300 -0.000 0.000 0.466 372 G N 2.193 111.171 108.800 0.298 0.000 2.533 372 G HA2 0.691 4.651 3.960 0.001 0.000 0.304 372 G HA3 0.691 4.651 3.960 0.001 0.000 0.304 372 G C -2.377 172.684 174.900 0.268 0.000 1.263 372 G CA -0.781 44.477 45.100 0.263 0.000 0.964 372 G HN 0.558 8.848 8.290 -0.000 0.000 0.479 373 L N 1.278 122.627 121.223 0.209 0.000 2.438 373 L HA 0.748 5.089 4.340 0.001 0.000 0.270 373 L C -0.217 176.746 176.870 0.155 0.000 0.972 373 L CA -0.667 54.281 54.840 0.180 0.000 0.831 373 L CB 2.228 44.352 42.059 0.108 0.000 1.273 373 L HN 0.632 8.862 8.230 -0.000 0.000 0.405 374 S N 2.340 118.155 115.700 0.191 0.000 2.552 374 S HA 0.849 5.319 4.470 0.001 0.000 0.314 374 S C -0.405 174.258 174.600 0.106 0.000 1.099 374 S CA -0.464 57.819 58.200 0.139 0.000 1.070 374 S CB 1.564 64.870 63.200 0.177 0.000 0.998 374 S HN 0.843 9.153 8.310 -0.000 0.000 0.474 375 T N 3.561 118.148 114.554 0.056 0.000 2.883 375 T HA 0.781 5.131 4.350 0.001 0.000 0.301 375 T C -1.151 173.551 174.700 0.003 0.000 1.158 375 T CA -0.804 61.312 62.100 0.027 0.000 1.007 375 T CB 1.442 70.314 68.868 0.006 0.000 1.186 375 T HN 1.033 9.273 8.240 -0.000 0.000 0.499 376 M N 2.025 121.617 119.600 -0.013 0.000 2.520 376 M HA 0.618 5.098 4.480 0.001 0.000 0.280 376 M C -0.671 175.604 176.300 -0.043 0.000 1.232 376 M CA -1.100 54.182 55.300 -0.030 0.000 0.892 376 M CB 0.988 33.579 32.600 -0.016 0.000 1.728 376 M HN 0.762 9.052 8.290 -0.000 0.000 0.475 377 C N 1.230 120.495 119.300 -0.059 0.000 2.459 377 C HA 0.879 5.340 4.460 0.001 0.000 0.374 377 C C 0.031 174.991 174.990 -0.051 0.000 1.241 377 C CA -0.586 58.403 59.018 -0.049 0.000 2.352 377 C CB -0.191 27.526 27.740 -0.038 0.000 2.490 377 C HN 0.836 9.066 8.230 -0.000 0.000 0.583 378 I N 1.617 122.165 120.570 -0.037 0.000 2.689 378 I HA 0.547 4.718 4.170 0.001 0.000 0.299 378 I C 1.068 177.159 176.117 -0.043 0.000 1.059 378 I CA -0.387 60.884 61.300 -0.048 0.000 1.055 378 I CB 1.684 39.658 38.000 -0.044 0.000 1.243 378 I HN 1.010 9.220 8.210 -0.000 0.000 0.425 379 G N 4.175 112.933 108.800 -0.070 0.000 2.630 379 G HA2 0.260 4.220 3.960 0.001 0.000 0.236 379 G HA3 0.260 4.220 3.960 0.001 0.000 0.236 379 G C 0.597 175.476 174.900 -0.034 0.000 1.248 379 G CA -0.255 44.811 45.100 -0.056 0.000 0.844 379 G HN 0.711 9.001 8.290 -0.000 0.000 0.588 380 L N -0.120 121.092 121.223 -0.018 0.000 4.001 380 L HA -0.205 4.135 4.340 0.001 0.000 0.413 380 L C 1.392 178.262 176.870 0.000 0.000 1.185 380 L CA 1.679 56.515 54.840 -0.007 0.000 0.963 380 L CB -1.857 40.196 42.059 -0.010 0.000 1.976 380 L HN 2.275 10.505 8.230 -0.000 0.000 0.939 381 G N 0.363 109.166 108.800 0.005 0.000 2.643 381 G HA2 -0.213 3.747 3.960 0.001 0.000 0.280 381 G HA3 -0.213 3.747 3.960 0.001 0.000 0.280 381 G C -0.072 174.835 174.900 0.012 0.000 1.120 381 G CA 0.485 45.595 45.100 0.016 0.000 1.165 381 G HN 0.535 8.825 8.290 -0.000 0.000 0.540 382 Q N -1.383 118.420 119.800 0.004 0.000 2.565 382 Q HA 0.769 5.109 4.340 0.001 0.000 0.294 382 Q C 0.048 176.042 176.000 -0.009 0.000 1.005 382 Q CA -0.519 55.282 55.803 -0.003 0.000 0.771 382 Q CB 2.517 31.247 28.738 -0.014 0.000 1.486 382 Q HN 1.090 9.360 8.270 -0.000 0.000 0.422 383 G N 0.343 109.136 108.800 -0.013 0.000 2.692 383 G HA2 0.772 4.733 3.960 0.001 0.000 0.291 383 G HA3 0.772 4.733 3.960 0.001 0.000 0.291 383 G C -1.926 172.965 174.900 -0.015 0.000 1.423 383 G CA -0.414 44.673 45.100 -0.022 0.000 0.843 383 G HN 0.538 8.828 8.290 -0.000 0.000 0.486 384 I N -0.151 120.410 120.570 -0.014 0.000 2.743 384 I HA 0.726 4.897 4.170 0.001 0.000 0.292 384 I C -1.068 175.066 176.117 0.029 0.000 1.343 384 I CA -0.891 60.414 61.300 0.008 0.000 1.038 384 I CB 2.007 39.986 38.000 -0.036 0.000 1.311 384 I HN 1.002 9.212 8.210 -0.000 0.000 0.426 385 A N 4.070 126.936 122.820 0.076 0.000 2.539 385 A HA 0.927 5.248 4.320 0.001 0.000 0.296 385 A C -1.187 176.460 177.584 0.105 0.000 1.073 385 A CA -0.486 51.594 52.037 0.072 0.000 0.700 385 A CB 2.134 21.150 19.000 0.026 0.000 1.296 385 A HN 0.588 8.738 8.150 -0.000 0.000 0.405 386 T N 0.791 115.396 114.554 0.085 0.000 2.971 386 T HA 0.530 4.880 4.350 0.001 0.000 0.304 386 T C -1.170 173.498 174.700 -0.054 0.000 1.038 386 T CA -0.406 61.674 62.100 -0.033 0.000 1.007 386 T CB 1.504 70.370 68.868 -0.004 0.000 1.055 386 T HN 0.662 8.902 8.240 -0.000 0.000 0.451 387 V N 4.193 124.006 119.914 -0.169 0.000 2.313 387 V HA 0.507 4.627 4.120 0.001 0.000 0.278 387 V C -0.661 175.367 176.094 -0.110 0.000 1.017 387 V CA -0.735 61.553 62.300 -0.020 0.000 0.823 387 V CB -0.094 31.748 31.823 0.032 0.000 1.010 387 V HN 0.746 8.936 8.190 -0.000 0.000 0.443 388 F N 2.133 122.104 119.950 0.035 0.000 2.364 388 F HA 0.640 5.167 4.527 0.001 0.000 0.316 388 F C 0.631 176.407 175.800 -0.039 0.000 1.133 388 F CA -0.708 57.289 58.000 -0.004 0.000 1.051 388 F CB 0.806 39.794 39.000 -0.020 0.000 1.342 388 F HN 0.389 8.689 8.300 -0.000 0.000 0.507 389 E N 0.340 120.603 120.200 0.106 0.000 2.321 389 E HA 0.279 4.629 4.350 0.001 0.000 0.281 389 E C -1.321 175.216 176.600 -0.105 0.000 0.910 389 E CA -0.913 55.395 56.400 -0.152 0.000 0.770 389 E CB 1.385 30.912 29.700 -0.288 0.000 1.225 389 E HN 0.392 8.752 8.360 -0.000 0.000 0.417 390 R N 2.417 122.824 120.500 -0.156 0.000 2.229 390 R HA 0.472 4.812 4.340 0.001 0.000 0.328 390 R C -0.693 175.543 176.300 -0.106 0.000 1.009 390 R CA -0.285 55.761 56.100 -0.089 0.000 0.864 390 R CB 1.432 31.697 30.300 -0.059 0.000 1.085 390 R HN 0.387 8.657 8.270 -0.000 0.000 0.453 391 V N 0.000 119.876 119.914 -0.063 0.000 2.409 391 V HA 0.000 4.120 4.120 0.001 0.000 0.244 391 V CA 0.000 62.269 62.300 -0.051 0.000 1.235 391 V CB 0.000 31.792 31.823 -0.051 0.000 1.184 391 V HN 0.000 8.190 8.190 -0.000 0.000 0.556