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 2rjt_1_D DATA FIRST_RESID 2 DATA SEQUENCE KLNRVVVTGY GVTSPIGNTP AEFWNSLATG KIGIGGITKF DHSDFDVHNA DATA SEQUENCE AEIQDFPFDK YFVKKDTNRF DNYSLYALYA AQEAVNHANL DVAALNRDRF DATA SEQUENCE GVIVASGIGG IKEIEDQVLR LHEKGPKRVK PMTLPKALPN MASGNVAMRF DATA SEQUENCE GANGVCKSIN TACSSSNDAI GDAFRSIKFG FQDVMLVGGT EASITPFAIA DATA SEQUENCE GFQALTALST TEDPTRASIP FDKDRNGFVM GEGSGMLVLE SLEHAEKRGA DATA SEQUENCE TILAEVVGYG NTCDAYHMTS PHPEGQGAIK AIKLALEEAE ISPEQVAYVN DATA SEQUENCE AHGTSTPANE KGESGAIVAV LGKAVPVSST KSFTGHLLGA AGAVEAIVTI DATA SEQUENCE EAMRHNFVPM TAGTSEVSDY IEANVVYGQG LAKEIPYAIS NTFGFGGHNA DATA SEQUENCE VLAFKRWA 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 K HA 0.000 4.320 4.320 0.000 0.000 0.191 2 K C 0.000 176.527 176.600 -0.122 0.000 0.988 2 K CA 0.000 56.246 56.287 -0.068 0.000 0.838 2 K CB 0.000 32.469 32.500 -0.051 0.000 1.064 3 L N 1.589 122.714 121.223 -0.163 0.000 2.417 3 L HA 0.273 4.613 4.340 -0.001 0.000 0.268 3 L C -0.011 176.746 176.870 -0.188 0.000 1.158 3 L CA -0.476 54.199 54.840 -0.275 0.000 0.819 3 L CB 0.171 42.019 42.059 -0.352 0.000 1.112 3 L HN 0.505 8.735 8.230 0.000 0.000 0.458 4 N N 0.950 119.524 118.700 -0.209 0.000 2.466 4 N HA 0.459 5.199 4.740 -0.001 0.000 0.294 4 N C -0.757 174.707 175.510 -0.077 0.000 1.129 4 N CA -0.805 52.177 53.050 -0.113 0.000 0.931 4 N CB 1.234 39.664 38.487 -0.095 0.000 1.193 4 N HN 0.430 8.810 8.380 0.000 0.000 0.500 5 R N 0.263 120.763 120.500 -0.000 0.000 2.500 5 R HA 0.558 4.897 4.340 -0.001 0.000 0.275 5 R C -0.895 175.449 176.300 0.073 0.000 1.051 5 R CA -0.609 55.533 56.100 0.070 0.000 1.088 5 R CB 0.833 31.204 30.300 0.119 0.000 1.063 5 R HN 0.233 8.503 8.270 0.000 0.000 0.511 6 V N 3.353 123.356 119.914 0.148 0.000 2.483 6 V HA 0.348 4.468 4.120 -0.001 0.000 0.297 6 V C -0.291 175.872 176.094 0.115 0.000 1.027 6 V CA -0.743 61.646 62.300 0.148 0.000 0.855 6 V CB 1.560 33.568 31.823 0.308 0.000 0.995 6 V HN 0.583 8.773 8.190 0.000 0.000 0.424 7 V N 2.932 122.855 119.914 0.016 0.000 2.960 7 V HA 0.796 4.915 4.120 -0.001 0.000 0.315 7 V C -0.408 175.657 176.094 -0.048 0.000 1.087 7 V CA -0.892 61.369 62.300 -0.065 0.000 0.982 7 V CB 2.078 33.724 31.823 -0.295 0.000 1.039 7 V HN 0.449 8.639 8.190 0.000 0.000 0.437 8 V N 3.003 122.893 119.914 -0.040 0.000 2.383 8 V HA 0.431 4.551 4.120 -0.001 0.000 0.275 8 V C 1.260 177.285 176.094 -0.114 0.000 1.036 8 V CA 0.574 62.871 62.300 -0.004 0.000 0.889 8 V CB 0.965 32.854 31.823 0.111 0.000 0.985 8 V HN 1.178 9.368 8.190 0.000 0.000 0.459 9 T N 0.181 114.644 114.554 -0.152 0.000 3.010 9 T HA 0.517 4.867 4.350 -0.001 0.000 0.257 9 T C 0.590 175.049 174.700 -0.402 0.000 1.020 9 T CA 0.369 62.313 62.100 -0.260 0.000 0.938 9 T CB 0.608 69.345 68.868 -0.219 0.000 1.049 9 T HN 1.086 9.326 8.240 0.000 0.000 0.522 10 G N 0.584 109.177 108.800 -0.344 0.000 2.489 10 G HA2 0.533 4.493 3.960 -0.001 0.000 0.291 10 G HA3 0.533 4.493 3.960 -0.001 0.000 0.291 10 G C -2.117 172.718 174.900 -0.108 0.000 1.487 10 G CA -1.009 43.767 45.100 -0.541 0.000 0.795 10 G HN 0.465 8.755 8.290 0.000 0.000 0.513 11 Y N -1.787 118.666 120.300 0.255 0.000 2.624 11 Y HA 0.857 5.406 4.550 -0.001 0.000 0.334 11 Y C 0.094 176.027 175.900 0.056 0.000 1.155 11 Y CA -1.227 56.935 58.100 0.104 0.000 1.046 11 Y CB 1.281 39.764 38.460 0.038 0.000 1.316 11 Y HN 1.143 9.423 8.280 0.000 0.000 0.457 12 G N 0.176 109.084 108.800 0.179 0.000 2.612 12 G HA2 0.655 4.615 3.960 -0.001 0.000 0.298 12 G HA3 0.655 4.615 3.960 -0.001 0.000 0.298 12 G C -2.149 172.786 174.900 0.058 0.000 1.336 12 G CA -1.172 43.960 45.100 0.054 0.000 0.953 12 G HN 1.236 9.526 8.290 0.000 0.000 0.482 13 V N -0.201 119.755 119.914 0.069 0.000 2.969 13 V HA 0.860 4.979 4.120 -0.001 0.000 0.304 13 V C -1.114 175.124 176.094 0.240 0.000 1.192 13 V CA -0.324 62.008 62.300 0.053 0.000 0.962 13 V CB 2.277 33.944 31.823 -0.260 0.000 1.045 13 V HN 1.081 9.271 8.190 0.000 0.000 0.428 14 T N 3.976 118.662 114.554 0.220 0.000 2.841 14 T HA 0.840 5.189 4.350 -0.001 0.000 0.285 14 T C -0.692 174.026 174.700 0.031 0.000 0.991 14 T CA 0.420 62.629 62.100 0.181 0.000 0.966 14 T CB 1.040 70.035 68.868 0.211 0.000 0.962 14 T HN 1.832 10.072 8.240 0.000 0.000 0.438 15 S N 4.128 119.866 115.700 0.064 0.000 2.636 15 S HA 0.591 5.060 4.470 -0.001 0.000 0.268 15 S C -2.774 171.886 174.600 0.100 0.000 1.159 15 S CA -1.056 57.199 58.200 0.091 0.000 0.815 15 S CB 1.248 64.605 63.200 0.262 0.000 1.130 15 S HN 0.391 8.701 8.310 0.000 0.000 0.471 16 P HA 0.202 4.622 4.420 0.000 0.000 0.234 16 P C 0.916 178.274 177.300 0.097 0.000 1.167 16 P CA 0.541 63.692 63.100 0.086 0.000 0.763 16 P CB -0.299 31.450 31.700 0.082 0.000 0.835 17 I N -6.267 114.381 120.570 0.131 0.000 4.081 17 I HA 0.593 4.762 4.170 -0.001 0.000 0.333 17 I C 0.302 176.497 176.117 0.130 0.000 1.413 17 I CA -0.391 60.959 61.300 0.084 0.000 1.110 17 I CB 0.569 38.552 38.000 -0.029 0.000 1.082 17 I HN -0.171 8.039 8.210 0.000 0.000 0.402 18 G N 1.387 110.308 108.800 0.202 0.000 2.318 18 G HA2 0.003 3.962 3.960 -0.001 0.000 0.302 18 G HA3 0.003 3.962 3.960 -0.001 0.000 0.302 18 G C -1.041 174.005 174.900 0.242 0.000 1.633 18 G CA -0.650 44.583 45.100 0.221 0.000 0.965 18 G HN 0.053 8.343 8.290 0.000 0.000 0.698 19 N N -0.055 118.761 118.700 0.193 0.000 2.204 19 N HA 0.210 4.949 4.740 -0.001 0.000 0.219 19 N C 0.383 176.053 175.510 0.268 0.000 1.151 19 N CA 0.760 53.945 53.050 0.226 0.000 0.867 19 N CB 1.470 40.034 38.487 0.130 0.000 1.043 19 N HN 1.019 9.399 8.380 0.000 0.000 0.516 20 T N -3.667 111.004 114.554 0.195 0.000 2.900 20 T HA 0.395 4.745 4.350 -0.001 0.000 0.303 20 T C -2.534 172.259 174.700 0.155 0.000 1.142 20 T CA -1.584 60.593 62.100 0.129 0.000 1.007 20 T CB 2.908 71.829 68.868 0.088 0.000 1.156 20 T HN -0.367 7.873 8.240 0.000 0.000 0.490 21 P HA -0.019 4.401 4.420 0.000 0.000 0.218 21 P C 1.629 179.111 177.300 0.303 0.000 1.148 21 P CA 1.439 64.674 63.100 0.224 0.000 0.822 21 P CB -0.149 31.677 31.700 0.211 0.000 0.784 22 A N 0.007 122.941 122.820 0.190 0.000 1.873 22 A HA -0.224 4.096 4.320 -0.001 0.000 0.215 22 A C 2.126 179.838 177.584 0.213 0.000 1.186 22 A CA 1.608 53.766 52.037 0.203 0.000 0.616 22 A CB -1.103 17.967 19.000 0.117 0.000 0.823 22 A HN 0.178 8.328 8.150 0.000 0.000 0.442 23 E N -1.408 118.900 120.200 0.181 0.000 2.072 23 E HA -0.152 4.197 4.350 -0.001 0.000 0.191 23 E C 1.786 178.484 176.600 0.163 0.000 0.985 23 E CA 1.154 57.641 56.400 0.144 0.000 0.801 23 E CB -0.293 29.487 29.700 0.133 0.000 0.750 23 E HN 0.647 9.007 8.360 0.000 0.000 0.452 24 F N 1.421 121.415 119.950 0.072 0.000 2.043 24 F HA -0.262 4.264 4.527 -0.001 0.000 0.297 24 F C 2.191 177.990 175.800 -0.001 0.000 1.121 24 F CA 1.758 59.785 58.000 0.045 0.000 1.199 24 F CB -0.328 38.728 39.000 0.093 0.000 0.968 24 F HN 0.174 8.474 8.300 0.000 0.000 0.478 25 W N 1.260 122.587 121.300 0.044 0.000 2.358 25 W HA -0.305 4.355 4.660 -0.001 0.000 0.303 25 W C 2.183 178.566 176.519 -0.226 0.000 1.208 25 W CA 1.871 59.121 57.345 -0.159 0.000 1.274 25 W CB -0.952 28.425 29.460 -0.138 0.000 1.138 25 W HN 0.209 8.389 8.180 0.000 0.000 0.515 26 N N 0.228 118.869 118.700 -0.099 0.000 2.104 26 N HA -0.186 4.554 4.740 -0.001 0.000 0.190 26 N C 1.891 177.236 175.510 -0.275 0.000 1.024 26 N CA 2.680 55.630 53.050 -0.167 0.000 0.853 26 N CB -0.567 37.912 38.487 -0.013 0.000 1.008 26 N HN -0.107 8.273 8.380 0.000 0.000 0.424 27 S N -0.020 115.526 115.700 -0.258 0.000 2.356 27 S HA -0.054 4.416 4.470 -0.001 0.000 0.223 27 S C 1.881 176.245 174.600 -0.393 0.000 1.032 27 S CA 0.897 58.956 58.200 -0.235 0.000 1.005 27 S CB -0.362 62.724 63.200 -0.190 0.000 0.867 27 S HN 0.306 8.616 8.310 0.000 0.000 0.449 28 L N 1.088 121.821 121.223 -0.817 0.000 1.989 28 L HA -0.175 4.165 4.340 -0.001 0.000 0.211 28 L C 2.817 179.230 176.870 -0.762 0.000 1.071 28 L CA 1.401 55.516 54.840 -1.209 0.000 0.749 28 L CB -0.747 40.495 42.059 -1.361 0.000 0.890 28 L HN 0.337 8.567 8.230 0.000 0.000 0.431 29 A N -0.276 121.992 122.820 -0.920 0.000 1.972 29 A HA -0.191 4.128 4.320 -0.001 0.000 0.219 29 A C 2.193 179.609 177.584 -0.281 0.000 1.169 29 A CA 2.153 53.801 52.037 -0.647 0.000 0.635 29 A CB -0.786 17.766 19.000 -0.746 0.000 0.810 29 A HN 0.550 8.700 8.150 0.000 0.000 0.446 30 T N -4.753 109.677 114.554 -0.207 0.000 3.069 30 T HA 0.420 4.770 4.350 -0.001 0.000 0.252 30 T C 1.226 175.934 174.700 0.014 0.000 1.053 30 T CA 0.971 63.024 62.100 -0.079 0.000 0.964 30 T CB 0.012 68.836 68.868 -0.073 0.000 1.005 30 T HN 1.674 9.914 8.240 0.000 0.000 0.532 31 G N 1.830 110.706 108.800 0.126 0.000 2.198 31 G HA2 -0.302 3.657 3.960 -0.001 0.000 0.260 31 G HA3 -0.302 3.657 3.960 -0.001 0.000 0.260 31 G C -0.102 174.874 174.900 0.126 0.000 1.025 31 G CA 0.352 45.578 45.100 0.211 0.000 0.769 31 G HN 0.805 9.095 8.290 0.000 0.000 0.507 32 K N 0.955 121.467 120.400 0.186 0.000 2.263 32 K HA 0.545 4.865 4.320 -0.001 0.000 0.282 32 K C 1.355 178.052 176.600 0.160 0.000 1.089 32 K CA -0.933 55.408 56.287 0.090 0.000 0.907 32 K CB 0.111 32.639 32.500 0.045 0.000 1.148 32 K HN 0.529 8.779 8.250 0.000 0.000 0.470 33 I N 0.617 121.189 120.570 0.003 0.000 2.886 33 I HA 0.387 4.556 4.170 -0.001 0.000 0.299 33 I C 0.729 176.869 176.117 0.039 0.000 1.044 33 I CA -0.372 60.919 61.300 -0.016 0.000 1.310 33 I CB 1.508 39.379 38.000 -0.216 0.000 1.441 33 I HN 0.627 8.837 8.210 0.000 0.000 0.578 34 G N 4.708 113.546 108.800 0.064 0.000 3.233 34 G HA2 0.326 4.285 3.960 -0.001 0.000 0.234 34 G HA3 0.326 4.285 3.960 -0.001 0.000 0.234 34 G C 0.347 175.265 174.900 0.029 0.000 1.137 34 G CA -0.255 44.877 45.100 0.053 0.000 0.763 34 G HN 0.516 8.806 8.290 0.000 0.000 0.549 35 I N 1.100 121.673 120.570 0.006 0.000 2.428 35 I HA 0.601 4.771 4.170 -0.001 0.000 0.289 35 I C 0.830 176.935 176.117 -0.020 0.000 1.019 35 I CA -0.009 61.287 61.300 -0.007 0.000 1.351 35 I CB 1.705 39.695 38.000 -0.018 0.000 1.412 35 I HN 0.092 8.302 8.210 0.000 0.000 0.513 36 G N 3.047 111.831 108.800 -0.027 0.000 2.548 36 G HA2 0.533 4.492 3.960 -0.001 0.000 0.301 36 G HA3 0.533 4.492 3.960 -0.001 0.000 0.301 36 G C -0.751 174.113 174.900 -0.060 0.000 1.349 36 G CA -0.551 44.529 45.100 -0.034 0.000 0.792 36 G HN 0.794 9.084 8.290 0.000 0.000 0.481 37 G N -0.862 107.903 108.800 -0.059 0.000 2.491 37 G HA2 0.436 4.395 3.960 -0.001 0.000 0.238 37 G HA3 0.436 4.395 3.960 -0.001 0.000 0.238 37 G C 0.293 175.094 174.900 -0.164 0.000 1.277 37 G CA -0.389 44.650 45.100 -0.101 0.000 0.851 37 G HN 0.621 8.911 8.290 0.000 0.000 0.573 38 I N 1.155 121.507 120.570 -0.364 0.000 2.556 38 I HA 0.092 4.262 4.170 -0.001 0.000 0.284 38 I C 1.622 177.598 176.117 -0.235 0.000 1.114 38 I CA 0.386 61.425 61.300 -0.434 0.000 1.418 38 I CB 1.279 38.749 38.000 -0.882 0.000 1.394 38 I HN 0.703 8.913 8.210 0.000 0.000 0.552 39 T N 0.657 115.120 114.554 -0.151 0.000 2.975 39 T HA 0.139 4.488 4.350 -0.001 0.000 0.261 39 T C 1.340 176.011 174.700 -0.050 0.000 0.984 39 T CA -0.359 61.705 62.100 -0.060 0.000 0.911 39 T CB 0.084 68.943 68.868 -0.015 0.000 1.127 39 T HN 0.461 8.701 8.240 0.000 0.000 0.514 40 K N 0.834 121.195 120.400 -0.065 0.000 2.360 40 K HA 0.195 4.515 4.320 -0.001 0.000 0.201 40 K C 0.014 176.731 176.600 0.196 0.000 1.046 40 K CA 0.909 57.241 56.287 0.076 0.000 0.945 40 K CB -0.116 32.478 32.500 0.156 0.000 0.750 40 K HN 0.701 8.951 8.250 0.000 0.000 0.464 41 F N -2.924 117.047 119.950 0.034 0.000 2.773 41 F HA 0.255 4.781 4.527 -0.001 0.000 0.314 41 F C -1.525 174.310 175.800 0.057 0.000 1.160 41 F CA -1.980 56.037 58.000 0.028 0.000 0.920 41 F CB 0.631 39.628 39.000 -0.006 0.000 1.323 41 F HN -0.338 7.962 8.300 0.000 0.000 0.457 42 D N 0.989 121.542 120.400 0.254 0.000 2.344 42 D HA 0.146 4.786 4.640 -0.001 0.000 0.253 42 D C 0.244 176.640 176.300 0.159 0.000 1.255 42 D CA 0.179 54.237 54.000 0.097 0.000 0.894 42 D CB 0.165 41.040 40.800 0.124 0.000 1.067 42 D HN 0.750 9.120 8.370 0.000 0.000 0.492 43 H N 0.421 119.441 119.070 -0.082 0.000 2.505 43 H HA 0.215 4.770 4.556 -0.001 0.000 0.286 43 H C 1.553 177.073 175.328 0.320 0.000 1.072 43 H CA 0.174 56.188 56.048 -0.055 0.000 1.141 43 H CB 0.096 29.601 29.762 -0.428 0.000 1.550 43 H HN 0.215 8.495 8.280 0.000 0.000 0.547 44 S N -0.055 115.654 115.700 0.015 0.000 2.400 44 S HA -0.231 4.239 4.470 -0.001 0.000 0.232 44 S C 1.186 175.940 174.600 0.256 0.000 1.025 44 S CA 1.484 59.729 58.200 0.074 0.000 0.993 44 S CB -0.137 63.053 63.200 -0.017 0.000 0.808 44 S HN 0.427 8.737 8.310 0.000 0.000 0.478 45 D N 0.208 120.813 120.400 0.342 0.000 2.339 45 D HA 0.324 4.963 4.640 -0.001 0.000 0.217 45 D C -0.220 176.195 176.300 0.190 0.000 1.050 45 D CA 0.065 54.197 54.000 0.222 0.000 0.856 45 D CB -0.091 40.778 40.800 0.115 0.000 0.922 45 D HN 0.352 8.722 8.370 0.000 0.000 0.518 46 F N 0.699 120.730 119.950 0.136 0.000 2.375 46 F HA 0.197 4.723 4.527 -0.001 0.000 0.317 46 F C 1.634 177.391 175.800 -0.071 0.000 1.124 46 F CA -0.709 57.305 58.000 0.024 0.000 1.050 46 F CB 0.776 39.782 39.000 0.011 0.000 1.314 46 F HN -0.294 8.006 8.300 0.000 0.000 0.511 47 D N -0.262 120.165 120.400 0.044 0.000 2.379 47 D HA 0.118 4.757 4.640 -0.001 0.000 0.208 47 D C -0.296 175.891 176.300 -0.190 0.000 1.065 47 D CA 0.674 54.674 54.000 0.001 0.000 0.848 47 D CB 0.507 41.321 40.800 0.023 0.000 0.949 47 D HN -0.027 8.343 8.370 0.000 0.000 0.509 48 V N 1.695 121.429 119.914 -0.299 0.000 2.417 48 V HA 0.213 4.333 4.120 -0.001 0.000 0.291 48 V C 0.396 176.149 176.094 -0.567 0.000 1.024 48 V CA -0.499 61.628 62.300 -0.288 0.000 0.861 48 V CB 1.811 33.575 31.823 -0.097 0.000 0.985 48 V HN 0.199 8.389 8.190 0.000 0.000 0.436 49 H N 2.269 121.289 119.070 -0.084 0.000 3.233 49 H HA 0.351 4.907 4.556 -0.001 0.000 0.263 49 H C -0.222 174.862 175.328 -0.405 0.000 1.168 49 H CA -0.289 55.581 56.048 -0.296 0.000 1.159 49 H CB 0.932 30.683 29.762 -0.019 0.000 1.593 49 H HN 0.491 8.771 8.280 0.000 0.000 0.580 50 N N 1.019 119.616 118.700 -0.172 0.000 2.292 50 N HA 0.666 5.405 4.740 -0.001 0.000 0.303 50 N C -0.580 174.850 175.510 -0.134 0.000 1.140 50 N CA -0.260 52.707 53.050 -0.140 0.000 0.788 50 N CB 2.893 41.341 38.487 -0.065 0.000 1.361 50 N HN 0.243 8.623 8.380 0.000 0.000 0.489 51 A N -0.282 122.480 122.820 -0.097 0.000 2.601 51 A HA 0.758 5.077 4.320 -0.001 0.000 0.291 51 A C -1.638 175.940 177.584 -0.009 0.000 1.075 51 A CA -0.687 51.326 52.037 -0.041 0.000 0.671 51 A CB 0.794 19.768 19.000 -0.044 0.000 1.277 51 A HN 0.595 8.745 8.150 0.000 0.000 0.417 52 A N 1.104 123.943 122.820 0.032 0.000 2.444 52 A HA 0.617 4.937 4.320 -0.001 0.000 0.332 52 A C -0.118 177.496 177.584 0.049 0.000 1.430 52 A CA -0.190 51.873 52.037 0.043 0.000 0.975 52 A CB -0.278 18.764 19.000 0.069 0.000 1.147 52 A HN 0.665 8.815 8.150 0.000 0.000 0.524 53 E N 1.431 121.652 120.200 0.035 0.000 2.248 53 E HA 0.431 4.780 4.350 -0.001 0.000 0.272 53 E C -0.817 175.808 176.600 0.041 0.000 1.008 53 E CA -0.545 55.882 56.400 0.044 0.000 0.856 53 E CB 1.749 31.468 29.700 0.033 0.000 1.120 53 E HN 0.641 9.001 8.360 0.000 0.000 0.397 54 I N 2.695 123.286 120.570 0.036 0.000 2.291 54 I HA 0.033 4.202 4.170 -0.001 0.000 0.290 54 I C 0.740 176.907 176.117 0.083 0.000 1.050 54 I CA 0.291 61.607 61.300 0.027 0.000 1.245 54 I CB 0.641 38.588 38.000 -0.088 0.000 1.405 54 I HN 0.465 8.675 8.210 0.000 0.000 0.478 55 Q N 3.038 122.886 119.800 0.080 0.000 2.319 55 Q HA 0.006 4.345 4.340 -0.001 0.000 0.209 55 Q C -0.116 175.943 176.000 0.098 0.000 0.884 55 Q CA 0.244 56.097 55.803 0.084 0.000 0.938 55 Q CB 0.476 29.247 28.738 0.055 0.000 1.098 55 Q HN 0.697 8.967 8.270 0.000 0.000 0.517 56 D N -0.779 119.686 120.400 0.108 0.000 2.804 56 D HA 0.002 4.641 4.640 -0.001 0.000 0.308 56 D C -0.526 175.841 176.300 0.112 0.000 1.371 56 D CA -0.660 53.395 54.000 0.092 0.000 0.823 56 D CB -0.645 40.189 40.800 0.056 0.000 1.126 56 D HN -0.060 8.310 8.370 0.000 0.000 0.467 57 F N 2.622 122.586 119.950 0.023 0.000 2.602 57 F HA 0.266 4.792 4.527 -0.001 0.000 0.385 57 F C -1.926 173.888 175.800 0.024 0.000 1.063 57 F CA -1.962 56.036 58.000 -0.002 0.000 1.233 57 F CB 0.793 39.877 39.000 0.139 0.000 1.067 57 F HN -0.155 8.145 8.300 0.000 0.000 0.564 58 P HA 0.066 4.486 4.420 0.000 0.000 0.225 58 P C 0.574 177.533 177.300 -0.569 0.000 1.813 58 P CA 0.176 62.960 63.100 -0.528 0.000 1.013 58 P CB -0.475 30.952 31.700 -0.455 0.000 1.961 59 F N 2.130 121.827 119.950 -0.421 0.000 2.091 59 F HA -0.247 4.280 4.527 -0.001 0.000 0.299 59 F C 1.439 177.272 175.800 0.055 0.000 1.103 59 F CA 1.838 59.851 58.000 0.021 0.000 1.228 59 F CB -0.077 39.086 39.000 0.272 0.000 0.984 59 F HN 0.051 8.351 8.300 0.000 0.000 0.477 60 D N 0.154 120.654 120.400 0.166 0.000 2.310 60 D HA -0.165 4.474 4.640 -0.001 0.000 0.212 60 D C 2.068 178.254 176.300 -0.190 0.000 0.965 60 D CA 0.749 54.777 54.000 0.047 0.000 0.879 60 D CB -0.367 40.481 40.800 0.081 0.000 0.921 60 D HN 0.387 8.757 8.370 0.000 0.000 0.510 61 K N -0.467 119.717 120.400 -0.360 0.000 2.057 61 K HA -0.158 4.161 4.320 -0.001 0.000 0.207 61 K C 1.005 177.112 176.600 -0.821 0.000 1.049 61 K CA 1.288 57.201 56.287 -0.623 0.000 0.931 61 K CB 0.074 32.091 32.500 -0.805 0.000 0.714 61 K HN 0.252 8.502 8.250 0.000 0.000 0.440 62 Y N -2.197 117.776 120.300 -0.546 0.000 2.448 62 Y HA 0.257 4.807 4.550 -0.001 0.000 0.257 62 Y C -0.079 175.349 175.900 -0.785 0.000 1.089 62 Y CA -1.112 56.548 58.100 -0.733 0.000 1.245 62 Y CB 0.757 38.595 38.460 -1.037 0.000 1.282 62 Y HN -0.162 8.118 8.280 0.000 0.000 0.529 63 F N 0.294 120.110 119.950 -0.223 0.000 2.556 63 F HA 0.621 5.148 4.527 -0.001 0.000 0.327 63 F C 0.004 175.652 175.800 -0.253 0.000 1.059 63 F CA -1.735 56.033 58.000 -0.386 0.000 0.953 63 F CB 1.493 39.890 39.000 -1.005 0.000 1.227 63 F HN -0.369 7.931 8.300 0.000 0.000 0.478 64 V N -0.772 119.255 119.914 0.189 0.000 3.019 64 V HA 0.434 4.553 4.120 -0.001 0.000 0.317 64 V C 0.819 177.202 176.094 0.482 0.000 1.094 64 V CA -1.061 61.415 62.300 0.292 0.000 1.000 64 V CB 1.831 33.766 31.823 0.188 0.000 1.060 64 V HN 0.906 9.096 8.190 0.000 0.000 0.443 65 K N 1.204 121.858 120.400 0.425 0.000 2.127 65 K HA -0.223 4.096 4.320 -0.001 0.000 0.208 65 K C 1.706 178.457 176.600 0.252 0.000 1.047 65 K CA 2.451 58.937 56.287 0.332 0.000 0.927 65 K CB -0.218 32.384 32.500 0.171 0.000 0.716 65 K HN 0.768 9.018 8.250 0.000 0.000 0.450 66 K N 0.437 120.950 120.400 0.187 0.000 2.442 66 K HA -0.090 4.230 4.320 -0.001 0.000 0.198 66 K C 1.374 178.044 176.600 0.117 0.000 1.044 66 K CA 1.245 57.603 56.287 0.118 0.000 0.948 66 K CB 0.086 32.633 32.500 0.078 0.000 0.762 66 K HN 0.270 8.520 8.250 0.000 0.000 0.472 67 D N -0.237 120.293 120.400 0.217 0.000 2.264 67 D HA -0.118 4.522 4.640 -0.001 0.000 0.208 67 D C 1.743 178.141 176.300 0.164 0.000 0.966 67 D CA 1.420 55.542 54.000 0.203 0.000 0.864 67 D CB -0.127 40.885 40.800 0.354 0.000 0.933 67 D HN 0.360 8.730 8.370 0.000 0.000 0.499 68 T N -1.499 113.183 114.554 0.213 0.000 3.072 68 T HA -0.068 4.282 4.350 -0.001 0.000 0.266 68 T C 1.510 176.227 174.700 0.029 0.000 1.127 68 T CA 0.492 62.674 62.100 0.135 0.000 1.107 68 T CB -0.029 68.906 68.868 0.111 0.000 0.910 68 T HN -0.089 8.151 8.240 0.000 0.000 0.513 69 N N 2.261 120.956 118.700 -0.008 0.000 2.331 69 N HA -0.027 4.713 4.740 -0.001 0.000 0.180 69 N C 1.933 177.366 175.510 -0.128 0.000 1.019 69 N CA 1.188 54.207 53.050 -0.052 0.000 0.881 69 N CB -0.203 38.256 38.487 -0.047 0.000 0.972 69 N HN 0.789 9.169 8.380 0.000 0.000 0.435 70 R N -1.413 118.927 120.500 -0.267 0.000 2.419 70 R HA 0.238 4.577 4.340 -0.001 0.000 0.235 70 R C -0.443 175.539 176.300 -0.530 0.000 0.899 70 R CA -0.040 55.784 56.100 -0.460 0.000 1.048 70 R CB 0.153 30.043 30.300 -0.684 0.000 1.182 70 R HN -0.056 8.214 8.270 0.000 0.000 0.544 71 F N 1.458 121.382 119.950 -0.045 0.000 2.518 71 F HA 0.320 4.846 4.527 -0.001 0.000 0.323 71 F C -0.247 175.501 175.800 -0.086 0.000 1.129 71 F CA -1.422 56.521 58.000 -0.094 0.000 0.920 71 F CB 1.965 40.852 39.000 -0.187 0.000 1.160 71 F HN -0.087 8.213 8.300 0.000 0.000 0.440 72 D N 1.346 121.826 120.400 0.134 0.000 2.358 72 D HA 0.104 4.743 4.640 -0.001 0.000 0.244 72 D C 1.025 177.284 176.300 -0.068 0.000 1.163 72 D CA -0.041 54.003 54.000 0.072 0.000 0.945 72 D CB 0.812 41.728 40.800 0.194 0.000 1.152 72 D HN 0.373 8.743 8.370 0.000 0.000 0.451 73 N N 0.306 118.898 118.700 -0.179 0.000 2.205 73 N HA -0.230 4.509 4.740 -0.001 0.000 0.186 73 N C 1.417 176.505 175.510 -0.703 0.000 1.015 73 N CA 1.069 53.782 53.050 -0.561 0.000 0.862 73 N CB -0.528 37.563 38.487 -0.659 0.000 0.986 73 N HN 0.600 8.980 8.380 0.000 0.000 0.429 74 Y N 0.096 120.164 120.300 -0.387 0.000 2.274 74 Y HA -0.030 4.519 4.550 -0.001 0.000 0.290 74 Y C 2.110 177.929 175.900 -0.135 0.000 1.145 74 Y CA 1.288 59.256 58.100 -0.220 0.000 1.203 74 Y CB -0.447 37.976 38.460 -0.061 0.000 0.984 74 Y HN -0.095 8.185 8.280 0.000 0.000 0.533 75 S N 0.984 116.224 115.700 -0.767 0.000 2.377 75 S HA -0.030 4.440 4.470 -0.001 0.000 0.223 75 S C 1.922 176.265 174.600 -0.428 0.000 1.030 75 S CA 1.152 58.970 58.200 -0.637 0.000 0.970 75 S CB -0.482 62.460 63.200 -0.431 0.000 0.830 75 S HN 0.488 8.798 8.310 0.000 0.000 0.473 76 L N 0.243 121.204 121.223 -0.438 0.000 2.042 76 L HA -0.185 4.154 4.340 -0.001 0.000 0.210 76 L C 2.216 179.153 176.870 0.111 0.000 1.076 76 L CA 1.599 56.211 54.840 -0.380 0.000 0.749 76 L CB -0.765 41.038 42.059 -0.427 0.000 0.893 76 L HN 0.421 8.651 8.230 0.000 0.000 0.432 77 Y N -0.359 119.870 120.300 -0.118 0.000 2.145 77 Y HA -0.300 4.249 4.550 -0.001 0.000 0.286 77 Y C 2.749 178.779 175.900 0.218 0.000 1.145 77 Y CA 0.312 58.435 58.100 0.039 0.000 1.148 77 Y CB -0.340 38.084 38.460 -0.061 0.000 0.981 77 Y HN 0.214 8.494 8.280 0.000 0.000 0.507 78 A N 0.430 123.385 122.820 0.225 0.000 1.902 78 A HA -0.176 4.143 4.320 -0.001 0.000 0.217 78 A C 2.191 179.882 177.584 0.178 0.000 1.181 78 A CA 1.439 53.566 52.037 0.150 0.000 0.623 78 A CB -1.068 17.936 19.000 0.005 0.000 0.818 78 A HN 0.455 8.605 8.150 0.000 0.000 0.443 79 L N -2.138 119.179 121.223 0.157 0.000 2.017 79 L HA -0.208 4.132 4.340 -0.001 0.000 0.208 79 L C 2.588 179.635 176.870 0.295 0.000 1.073 79 L CA 1.955 56.909 54.840 0.190 0.000 0.745 79 L CB -0.679 41.455 42.059 0.125 0.000 0.894 79 L HN 0.619 8.849 8.230 0.000 0.000 0.432 80 Y N 0.633 121.183 120.300 0.418 0.000 2.097 80 Y HA -0.324 4.225 4.550 -0.001 0.000 0.282 80 Y C 2.485 178.529 175.900 0.240 0.000 1.152 80 Y CA 1.585 59.916 58.100 0.384 0.000 1.136 80 Y CB -0.401 38.453 38.460 0.656 0.000 0.975 80 Y HN 0.100 8.380 8.280 0.000 0.000 0.498 81 A N 0.690 123.699 122.820 0.315 0.000 1.940 81 A HA -0.154 4.165 4.320 -0.001 0.000 0.219 81 A C 2.408 179.985 177.584 -0.012 0.000 1.176 81 A CA 2.064 54.170 52.037 0.115 0.000 0.631 81 A CB -1.568 17.560 19.000 0.212 0.000 0.814 81 A HN 0.679 8.829 8.150 0.000 0.000 0.446 82 A N -1.006 121.834 122.820 0.033 0.000 1.877 82 A HA -0.192 4.128 4.320 -0.001 0.000 0.216 82 A C 2.165 179.662 177.584 -0.144 0.000 1.186 82 A CA 2.120 54.127 52.037 -0.049 0.000 0.620 82 A CB -0.579 18.467 19.000 0.076 0.000 0.822 82 A HN 0.522 8.672 8.150 0.000 0.000 0.443 83 Q N -0.134 119.650 119.800 -0.025 0.000 2.096 83 Q HA -0.182 4.157 4.340 -0.001 0.000 0.204 83 Q C 1.901 177.782 176.000 -0.198 0.000 0.982 83 Q CA 2.040 57.788 55.803 -0.092 0.000 0.850 83 Q CB -0.269 28.112 28.738 -0.595 0.000 0.901 83 Q HN 0.640 8.910 8.270 0.000 0.000 0.422 84 E N -0.182 119.859 120.200 -0.265 0.000 2.118 84 E HA -0.182 4.167 4.350 -0.001 0.000 0.195 84 E C 1.829 178.362 176.600 -0.111 0.000 0.992 84 E CA 1.245 57.521 56.400 -0.207 0.000 0.804 84 E CB -0.425 29.081 29.700 -0.323 0.000 0.741 84 E HN 0.489 8.849 8.360 0.000 0.000 0.458 85 A N 0.974 123.732 122.820 -0.103 0.000 1.898 85 A HA -0.104 4.215 4.320 -0.001 0.000 0.216 85 A C 2.631 180.150 177.584 -0.108 0.000 1.181 85 A CA 1.218 53.222 52.037 -0.055 0.000 0.620 85 A CB -0.626 18.350 19.000 -0.041 0.000 0.819 85 A HN 0.128 8.278 8.150 0.000 0.000 0.442 86 V N 1.047 120.846 119.914 -0.192 0.000 2.343 86 V HA -0.269 3.850 4.120 -0.001 0.000 0.247 86 V C 2.331 178.361 176.094 -0.107 0.000 1.051 86 V CA 2.224 64.400 62.300 -0.207 0.000 1.036 86 V CB -0.977 30.646 31.823 -0.334 0.000 0.654 86 V HN 0.554 8.744 8.190 0.000 0.000 0.451 87 N N -0.504 118.156 118.700 -0.066 0.000 2.084 87 N HA -0.190 4.550 4.740 -0.001 0.000 0.190 87 N C 1.840 177.349 175.510 -0.003 0.000 1.030 87 N CA 1.823 54.857 53.050 -0.026 0.000 0.849 87 N CB -0.653 37.827 38.487 -0.011 0.000 1.012 87 N HN 0.682 9.062 8.380 0.000 0.000 0.423 88 H N 0.018 119.003 119.070 -0.142 0.000 2.352 88 H HA -0.024 4.531 4.556 -0.001 0.000 0.299 88 H C 1.436 176.655 175.328 -0.182 0.000 1.097 88 H CA 1.275 57.216 56.048 -0.179 0.000 1.311 88 H CB 0.173 29.783 29.762 -0.254 0.000 1.377 88 H HN 0.249 8.529 8.280 0.000 0.000 0.504 89 A N 0.576 123.285 122.820 -0.186 0.000 2.167 89 A HA -0.111 4.208 4.320 -0.001 0.000 0.214 89 A C 1.075 178.559 177.584 -0.167 0.000 1.151 89 A CA 0.782 52.670 52.037 -0.250 0.000 0.735 89 A CB -0.271 18.599 19.000 -0.216 0.000 0.802 89 A HN 0.749 8.899 8.150 0.000 0.000 0.467 90 N N -1.929 116.703 118.700 -0.113 0.000 2.727 90 N HA -0.164 4.575 4.740 -0.001 0.000 0.249 90 N C -0.585 174.868 175.510 -0.095 0.000 1.048 90 N CA 0.657 53.656 53.050 -0.085 0.000 0.714 90 N CB -1.806 36.632 38.487 -0.081 0.000 0.959 90 N HN 0.428 8.808 8.380 0.000 0.000 0.544 91 L N 0.694 121.851 121.223 -0.109 0.000 2.281 91 L HA 0.371 4.711 4.340 -0.001 0.000 0.285 91 L C -0.067 176.744 176.870 -0.099 0.000 1.074 91 L CA -0.324 54.440 54.840 -0.127 0.000 0.817 91 L CB 0.878 42.825 42.059 -0.186 0.000 1.168 91 L HN 0.137 8.367 8.230 0.000 0.000 0.434 92 D N 3.802 124.149 120.400 -0.088 0.000 2.468 92 D HA 0.077 4.717 4.640 -0.001 0.000 0.218 92 D C 1.215 177.474 176.300 -0.068 0.000 1.155 92 D CA -0.074 53.893 54.000 -0.054 0.000 0.924 92 D CB 0.980 41.752 40.800 -0.046 0.000 1.029 92 D HN 0.444 8.814 8.370 0.000 0.000 0.515 93 V N 2.726 122.617 119.914 -0.038 0.000 2.490 93 V HA -0.129 3.990 4.120 -0.001 0.000 0.250 93 V C 2.094 178.203 176.094 0.025 0.000 1.061 93 V CA 1.595 63.871 62.300 -0.040 0.000 1.064 93 V CB -1.001 30.928 31.823 0.177 0.000 0.670 93 V HN 0.432 8.622 8.190 0.000 0.000 0.461 94 A N 0.538 123.380 122.820 0.038 0.000 2.070 94 A HA 0.240 4.559 4.320 -0.001 0.000 0.220 94 A C 2.281 179.876 177.584 0.019 0.000 1.159 94 A CA 1.805 53.866 52.037 0.039 0.000 0.656 94 A CB -0.685 18.332 19.000 0.029 0.000 0.800 94 A HN 1.017 9.167 8.150 0.000 0.000 0.453 95 A N -1.022 121.795 122.820 -0.005 0.000 2.275 95 A HA 0.505 4.825 4.320 -0.001 0.000 0.212 95 A C 0.857 178.434 177.584 -0.011 0.000 1.201 95 A CA -0.259 51.770 52.037 -0.014 0.000 0.843 95 A CB -0.196 18.785 19.000 -0.030 0.000 0.873 95 A HN 0.412 8.562 8.150 0.000 0.000 0.492 96 L N -0.090 121.123 121.223 -0.017 0.000 2.468 96 L HA 0.188 4.528 4.340 -0.001 0.000 0.254 96 L C 0.526 177.424 176.870 0.045 0.000 1.171 96 L CA -0.765 54.074 54.840 -0.000 0.000 0.809 96 L CB 0.232 42.213 42.059 -0.131 0.000 1.155 96 L HN 0.239 8.469 8.230 0.000 0.000 0.473 97 N N 0.905 119.647 118.700 0.070 0.000 2.415 97 N HA 0.076 4.815 4.740 -0.001 0.000 0.250 97 N C 0.765 176.344 175.510 0.115 0.000 1.127 97 N CA 0.109 53.206 53.050 0.078 0.000 0.945 97 N CB 0.623 39.155 38.487 0.075 0.000 1.196 97 N HN 0.442 8.822 8.380 0.000 0.000 0.499 98 R N 1.773 122.353 120.500 0.135 0.000 2.200 98 R HA -0.079 4.260 4.340 -0.001 0.000 0.234 98 R C 0.270 176.671 176.300 0.168 0.000 1.127 98 R CA 1.058 57.282 56.100 0.206 0.000 0.989 98 R CB 0.217 30.622 30.300 0.176 0.000 0.869 98 R HN 0.555 8.825 8.270 0.000 0.000 0.459 99 D N 0.132 120.600 120.400 0.114 0.000 2.317 99 D HA -0.053 4.587 4.640 -0.001 0.000 0.211 99 D C 1.179 177.537 176.300 0.098 0.000 0.966 99 D CA 0.746 54.799 54.000 0.089 0.000 0.876 99 D CB 0.174 41.015 40.800 0.067 0.000 0.927 99 D HN 0.112 8.482 8.370 0.000 0.000 0.519 100 R N 0.160 120.730 120.500 0.117 0.000 2.507 100 R HA 0.126 4.466 4.340 -0.001 0.000 0.298 100 R C -0.181 176.210 176.300 0.151 0.000 0.999 100 R CA -0.374 55.789 56.100 0.104 0.000 1.082 100 R CB 0.162 30.501 30.300 0.066 0.000 1.246 100 R HN 0.023 8.293 8.270 0.000 0.000 0.553 101 F N 0.714 120.654 119.950 -0.017 0.000 2.427 101 F HA 0.678 5.204 4.527 -0.001 0.000 0.348 101 F C -0.176 175.620 175.800 -0.007 0.000 1.125 101 F CA -1.734 56.246 58.000 -0.033 0.000 0.989 101 F CB 1.333 40.322 39.000 -0.018 0.000 1.165 101 F HN 0.017 8.317 8.300 0.000 0.000 0.442 102 G N 3.754 112.557 108.800 0.004 0.000 2.685 102 G HA2 0.683 4.643 3.960 -0.001 0.000 0.298 102 G HA3 0.683 4.643 3.960 -0.001 0.000 0.298 102 G C -2.114 172.667 174.900 -0.198 0.000 1.277 102 G CA -0.929 44.089 45.100 -0.137 0.000 0.986 102 G HN 0.560 8.850 8.290 0.000 0.000 0.487 103 V N 0.432 120.258 119.914 -0.146 0.000 2.733 103 V HA 0.488 4.607 4.120 -0.001 0.000 0.306 103 V C -0.770 175.298 176.094 -0.042 0.000 1.084 103 V CA -0.470 61.767 62.300 -0.105 0.000 0.905 103 V CB 1.807 33.551 31.823 -0.131 0.000 1.010 103 V HN 0.628 8.818 8.190 0.000 0.000 0.424 104 I N 4.645 125.206 120.570 -0.015 0.000 2.468 104 I HA 0.494 4.664 4.170 -0.001 0.000 0.285 104 I C -0.989 175.140 176.117 0.020 0.000 1.039 104 I CA -0.770 60.532 61.300 0.004 0.000 1.074 104 I CB 2.135 40.139 38.000 0.007 0.000 1.228 104 I HN 0.261 8.471 8.210 0.000 0.000 0.436 105 V N 5.769 125.704 119.914 0.034 0.000 2.326 105 V HA 0.518 4.637 4.120 -0.001 0.000 0.281 105 V C 0.569 176.713 176.094 0.083 0.000 1.015 105 V CA -0.518 61.816 62.300 0.056 0.000 0.823 105 V CB 1.435 33.289 31.823 0.052 0.000 1.009 105 V HN 0.827 9.017 8.190 0.000 0.000 0.436 106 A N 3.883 126.751 122.820 0.080 0.000 2.351 106 A HA 0.824 5.144 4.320 -0.001 0.000 0.257 106 A C 0.249 177.910 177.584 0.129 0.000 1.087 106 A CA -0.089 52.000 52.037 0.086 0.000 0.798 106 A CB 1.077 20.115 19.000 0.063 0.000 1.033 106 A HN 0.910 9.060 8.150 0.000 0.000 0.488 107 S N -0.552 115.220 115.700 0.120 0.000 2.535 107 S HA 0.528 4.997 4.470 -0.001 0.000 0.272 107 S C 0.668 175.312 174.600 0.072 0.000 1.149 107 S CA 0.107 58.386 58.200 0.132 0.000 0.888 107 S CB 1.157 64.469 63.200 0.187 0.000 1.110 107 S HN 1.427 9.737 8.310 0.000 0.000 0.463 108 G N 2.095 110.939 108.800 0.073 0.000 2.539 108 G HA2 0.191 4.150 3.960 -0.001 0.000 0.215 108 G HA3 0.191 4.150 3.960 -0.001 0.000 0.215 108 G C 0.785 175.716 174.900 0.053 0.000 1.141 108 G CA 0.476 45.623 45.100 0.078 0.000 0.806 108 G HN 0.713 9.003 8.290 0.000 0.000 0.533 109 I N -0.823 119.754 120.570 0.011 0.000 4.526 109 I HA 0.307 4.476 4.170 -0.001 0.000 0.330 109 I C 1.508 177.515 176.117 -0.184 0.000 1.323 109 I CA 0.113 61.397 61.300 -0.028 0.000 1.218 109 I CB 0.423 38.453 38.000 0.051 0.000 1.233 109 I HN 0.256 8.466 8.210 0.000 0.000 0.430 110 G N 1.910 110.476 108.800 -0.389 0.000 2.552 110 G HA2 -0.273 3.686 3.960 -0.001 0.000 0.265 110 G HA3 -0.273 3.686 3.960 -0.001 0.000 0.265 110 G C 0.559 174.878 174.900 -0.968 0.000 1.234 110 G CA -0.146 44.330 45.100 -1.040 0.000 0.944 110 G HN 0.559 8.849 8.290 0.000 0.000 0.568 111 G N -0.759 107.579 108.800 -0.769 0.000 3.316 111 G HA2 0.450 4.409 3.960 -0.001 0.000 0.255 111 G HA3 0.450 4.409 3.960 -0.001 0.000 0.255 111 G C 1.153 175.989 174.900 -0.105 0.000 0.880 111 G CA 0.664 45.644 45.100 -0.200 0.000 1.956 111 G HN 1.004 9.294 8.290 0.000 0.000 0.634 112 I N 0.502 121.013 120.570 -0.097 0.000 2.454 112 I HA -0.071 4.099 4.170 -0.001 0.000 0.254 112 I C 2.447 178.559 176.117 -0.008 0.000 1.156 112 I CA 1.302 62.583 61.300 -0.031 0.000 1.433 112 I CB 0.085 38.113 38.000 0.048 0.000 1.082 112 I HN 0.366 8.576 8.210 0.000 0.000 0.432 113 K N 0.226 120.631 120.400 0.009 0.000 2.057 113 K HA -0.250 4.070 4.320 -0.001 0.000 0.206 113 K C 2.151 178.748 176.600 -0.005 0.000 1.050 113 K CA 1.611 57.905 56.287 0.012 0.000 0.935 113 K CB -0.161 32.354 32.500 0.024 0.000 0.715 113 K HN 0.271 8.521 8.250 0.000 0.000 0.439 114 E N 1.016 121.214 120.200 -0.003 0.000 2.077 114 E HA -0.168 4.182 4.350 -0.001 0.000 0.193 114 E C 1.749 178.331 176.600 -0.031 0.000 0.989 114 E CA 1.601 57.997 56.400 -0.007 0.000 0.800 114 E CB -0.179 29.528 29.700 0.011 0.000 0.746 114 E HN 0.395 8.755 8.360 0.000 0.000 0.452 115 I N 0.552 121.089 120.570 -0.055 0.000 2.127 115 I HA -0.281 3.889 4.170 -0.001 0.000 0.241 115 I C 2.630 178.680 176.117 -0.111 0.000 1.075 115 I CA 1.818 63.064 61.300 -0.091 0.000 1.334 115 I CB -0.431 37.490 38.000 -0.131 0.000 1.040 115 I HN 0.302 8.512 8.210 0.000 0.000 0.405 116 E N 1.197 121.325 120.200 -0.119 0.000 2.031 116 E HA -0.276 4.073 4.350 -0.001 0.000 0.193 116 E C 1.714 178.278 176.600 -0.060 0.000 0.994 116 E CA 1.892 58.221 56.400 -0.120 0.000 0.800 116 E CB 0.036 29.691 29.700 -0.075 0.000 0.752 116 E HN 0.387 8.747 8.360 0.000 0.000 0.447 117 D N 0.229 120.610 120.400 -0.033 0.000 2.123 117 D HA -0.167 4.472 4.640 -0.001 0.000 0.196 117 D C 2.031 178.325 176.300 -0.009 0.000 0.992 117 D CA 0.977 54.970 54.000 -0.012 0.000 0.833 117 D CB -0.205 40.593 40.800 -0.003 0.000 0.954 117 D HN 0.250 8.620 8.370 0.000 0.000 0.455 118 Q N 0.123 119.913 119.800 -0.018 0.000 2.245 118 Q HA 0.010 4.350 4.340 -0.001 0.000 0.201 118 Q C 2.444 178.445 176.000 0.002 0.000 0.955 118 Q CA 0.186 55.982 55.803 -0.012 0.000 0.870 118 Q CB -0.161 28.566 28.738 -0.018 0.000 0.945 118 Q HN 0.223 8.493 8.270 0.000 0.000 0.461 119 V N 1.346 121.258 119.914 -0.003 0.000 2.295 119 V HA -0.241 3.879 4.120 -0.001 0.000 0.246 119 V C 2.369 178.540 176.094 0.128 0.000 1.049 119 V CA 1.416 63.746 62.300 0.051 0.000 1.024 119 V CB -0.544 31.254 31.823 -0.042 0.000 0.648 119 V HN 0.257 8.447 8.190 0.000 0.000 0.447 120 L N -0.510 120.741 121.223 0.047 0.000 2.046 120 L HA -0.192 4.147 4.340 -0.001 0.000 0.208 120 L C 2.682 179.592 176.870 0.066 0.000 1.077 120 L CA 1.858 56.733 54.840 0.058 0.000 0.747 120 L CB -0.627 41.444 42.059 0.021 0.000 0.896 120 L HN 0.247 8.477 8.230 0.000 0.000 0.432 121 R N 0.352 120.873 120.500 0.035 0.000 2.081 121 R HA -0.215 4.125 4.340 -0.001 0.000 0.235 121 R C 2.324 178.622 176.300 -0.004 0.000 1.131 121 R CA 1.491 57.599 56.100 0.014 0.000 0.960 121 R CB -0.289 30.011 30.300 0.001 0.000 0.856 121 R HN 0.203 8.473 8.270 0.000 0.000 0.436 122 L N 0.175 121.389 121.223 -0.016 0.000 2.017 122 L HA -0.168 4.171 4.340 -0.001 0.000 0.208 122 L C 1.631 178.376 176.870 -0.207 0.000 1.073 122 L CA 2.065 56.836 54.840 -0.116 0.000 0.745 122 L CB -0.678 41.288 42.059 -0.154 0.000 0.894 122 L HN 0.249 8.479 8.230 0.000 0.000 0.432 123 H N -0.465 118.590 119.070 -0.026 0.000 2.423 123 H HA -0.030 4.526 4.556 -0.001 0.000 0.297 123 H C 2.057 177.376 175.328 -0.016 0.000 1.075 123 H CA 1.689 57.723 56.048 -0.022 0.000 1.342 123 H CB 0.054 29.801 29.762 -0.025 0.000 1.395 123 H HN 0.547 8.827 8.280 0.000 0.000 0.530 124 E N -0.041 120.196 120.200 0.062 0.000 2.190 124 E HA -0.001 4.348 4.350 -0.001 0.000 0.191 124 E C 1.176 177.778 176.600 0.004 0.000 0.978 124 E CA 0.590 57.010 56.400 0.033 0.000 0.839 124 E CB 0.411 30.130 29.700 0.031 0.000 0.787 124 E HN 0.299 8.659 8.360 0.000 0.000 0.473 125 K N -0.191 120.200 120.400 -0.014 0.000 2.440 125 K HA 0.231 4.551 4.320 -0.001 0.000 0.207 125 K C 0.487 177.063 176.600 -0.040 0.000 1.112 125 K CA 0.544 56.818 56.287 -0.022 0.000 1.036 125 K CB 2.065 34.556 32.500 -0.015 0.000 0.935 125 K HN 0.162 8.412 8.250 0.000 0.000 0.564 126 G N 2.757 111.516 108.800 -0.069 0.000 2.707 126 G HA2 -0.170 3.790 3.960 -0.001 0.000 0.686 126 G HA3 -0.170 3.790 3.960 -0.001 0.000 0.686 126 G C -2.299 172.551 174.900 -0.083 0.000 1.315 126 G CA -0.525 44.524 45.100 -0.085 0.000 0.832 126 G HN -0.152 8.138 8.290 0.000 0.000 0.573 127 P HA -0.056 4.364 4.420 0.000 0.000 0.220 127 P C 1.431 178.702 177.300 -0.049 0.000 1.148 127 P CA 1.366 64.423 63.100 -0.071 0.000 0.803 127 P CB 0.059 31.718 31.700 -0.069 0.000 0.782 128 K N -0.381 119.994 120.400 -0.041 0.000 2.362 128 K HA -0.022 4.297 4.320 -0.001 0.000 0.200 128 K C 1.672 178.256 176.600 -0.027 0.000 1.046 128 K CA 0.635 56.903 56.287 -0.031 0.000 0.952 128 K CB 0.086 32.571 32.500 -0.026 0.000 0.753 128 K HN 0.056 8.306 8.250 0.000 0.000 0.466 129 R N 0.150 120.632 120.500 -0.030 0.000 2.362 129 R HA 0.134 4.474 4.340 -0.001 0.000 0.227 129 R C 0.195 176.480 176.300 -0.024 0.000 0.905 129 R CA -0.007 56.079 56.100 -0.024 0.000 1.067 129 R CB -0.196 30.091 30.300 -0.022 0.000 1.078 129 R HN -0.087 8.183 8.270 0.000 0.000 0.516 130 V N 3.483 123.379 119.914 -0.030 0.000 2.637 130 V HA 0.005 4.124 4.120 -0.001 0.000 0.296 130 V C 0.858 176.938 176.094 -0.023 0.000 1.046 130 V CA -0.106 62.177 62.300 -0.028 0.000 1.066 130 V CB 0.800 32.602 31.823 -0.035 0.000 0.968 130 V HN 0.027 8.217 8.190 0.000 0.000 0.483 131 K N 6.225 126.613 120.400 -0.020 0.000 2.448 131 K HA 0.118 4.437 4.320 -0.001 0.000 0.278 131 K C -1.600 174.987 176.600 -0.021 0.000 1.009 131 K CA -1.312 54.963 56.287 -0.019 0.000 0.995 131 K CB 0.701 33.190 32.500 -0.017 0.000 0.917 131 K HN 0.358 8.608 8.250 0.000 0.000 0.481 132 P HA -0.071 4.349 4.420 0.000 0.000 0.218 132 P C 0.868 178.153 177.300 -0.025 0.000 1.148 132 P CA 1.163 64.249 63.100 -0.023 0.000 0.822 132 P CB 0.245 31.930 31.700 -0.024 0.000 0.784 133 M N -1.802 117.780 119.600 -0.030 0.000 2.568 133 M HA 0.073 4.552 4.480 -0.001 0.000 0.226 133 M C 1.324 177.612 176.300 -0.020 0.000 1.148 133 M CA 0.828 56.107 55.300 -0.035 0.000 1.007 133 M CB -1.418 31.149 32.600 -0.056 0.000 1.651 133 M HN -0.075 8.215 8.290 0.000 0.000 0.488 134 T N 1.596 116.140 114.554 -0.016 0.000 2.570 134 T HA -0.169 4.180 4.350 -0.001 0.000 0.266 134 T C 1.962 176.662 174.700 -0.000 0.000 1.071 134 T CA 1.467 63.561 62.100 -0.010 0.000 1.172 134 T CB -0.208 68.650 68.868 -0.016 0.000 0.864 134 T HN 0.375 8.615 8.240 0.000 0.000 0.421 135 L N 0.505 121.727 121.223 -0.002 0.000 2.072 135 L HA -0.016 4.324 4.340 -0.001 0.000 0.205 135 L C -0.552 176.335 176.870 0.028 0.000 1.079 135 L CA 1.112 55.956 54.840 0.007 0.000 0.752 135 L CB -1.515 40.544 42.059 -0.000 0.000 0.906 135 L HN 0.208 8.438 8.230 0.000 0.000 0.436 136 P HA -0.151 4.269 4.420 0.000 0.000 0.220 136 P C 1.325 178.666 177.300 0.068 0.000 1.148 136 P CA 1.351 64.471 63.100 0.033 0.000 0.803 136 P CB 0.079 31.776 31.700 -0.005 0.000 0.782 137 K N -1.075 119.361 120.400 0.060 0.000 2.137 137 K HA 0.105 4.424 4.320 -0.001 0.000 0.202 137 K C 2.041 178.753 176.600 0.187 0.000 1.052 137 K CA 1.095 57.449 56.287 0.110 0.000 0.961 137 K CB -0.299 32.236 32.500 0.059 0.000 0.741 137 K HN 0.014 8.264 8.250 0.000 0.000 0.452 138 A N 1.403 124.284 122.820 0.101 0.000 1.878 138 A HA 0.078 4.398 4.320 -0.001 0.000 0.213 138 A C 0.918 178.506 177.584 0.007 0.000 1.192 138 A CA 0.204 52.267 52.037 0.043 0.000 0.619 138 A CB -0.425 18.568 19.000 -0.012 0.000 0.837 138 A HN 0.107 8.257 8.150 0.000 0.000 0.446 139 L N 0.386 121.637 121.223 0.047 0.000 2.578 139 L HA 0.033 4.373 4.340 -0.001 0.000 0.279 139 L C -1.630 175.275 176.870 0.058 0.000 1.227 139 L CA -1.057 53.801 54.840 0.029 0.000 0.900 139 L CB 0.197 42.282 42.059 0.043 0.000 1.144 139 L HN 0.135 8.365 8.230 0.000 0.000 0.496 140 P HA -0.130 4.290 4.420 0.000 0.000 0.225 140 P C 0.840 178.241 177.300 0.169 0.000 1.148 140 P CA 0.958 64.051 63.100 -0.011 0.000 0.779 140 P CB -0.029 31.642 31.700 -0.047 0.000 0.780 141 N N -1.399 117.382 118.700 0.135 0.000 2.463 141 N HA -0.037 4.702 4.740 -0.001 0.000 0.181 141 N C 1.270 176.868 175.510 0.146 0.000 1.078 141 N CA 0.744 53.868 53.050 0.124 0.000 0.902 141 N CB -0.643 37.887 38.487 0.072 0.000 0.970 141 N HN 0.083 8.463 8.380 0.000 0.000 0.451 142 M N 1.120 120.842 119.600 0.203 0.000 2.213 142 M HA 0.043 4.522 4.480 -0.001 0.000 0.263 142 M C 2.325 178.674 176.300 0.082 0.000 1.062 142 M CA 1.071 56.465 55.300 0.156 0.000 1.105 142 M CB -1.181 31.527 32.600 0.179 0.000 1.385 142 M HN 0.279 8.569 8.290 0.000 0.000 0.417 143 A N -0.045 122.793 122.820 0.030 0.000 1.902 143 A HA -0.132 4.188 4.320 -0.001 0.000 0.217 143 A C 2.550 180.111 177.584 -0.037 0.000 1.181 143 A CA 2.148 54.083 52.037 -0.169 0.000 0.623 143 A CB -0.816 17.966 19.000 -0.364 0.000 0.818 143 A HN 0.463 8.613 8.150 0.000 0.000 0.443 144 S N -0.573 115.144 115.700 0.028 0.000 2.359 144 S HA -0.084 4.386 4.470 -0.001 0.000 0.224 144 S C 2.084 176.690 174.600 0.011 0.000 1.035 144 S CA 1.296 59.509 58.200 0.022 0.000 1.018 144 S CB -0.676 62.544 63.200 0.033 0.000 0.876 144 S HN 0.780 9.090 8.310 0.000 0.000 0.448 145 G N 2.228 111.043 108.800 0.025 0.000 2.418 145 G HA2 -0.221 3.739 3.960 -0.001 0.000 0.217 145 G HA3 -0.221 3.739 3.960 -0.001 0.000 0.217 145 G C 1.363 176.280 174.900 0.029 0.000 1.158 145 G CA 0.752 45.866 45.100 0.024 0.000 0.771 145 G HN 0.412 8.702 8.290 0.000 0.000 0.545 146 N N 0.407 119.131 118.700 0.040 0.000 2.120 146 N HA -0.097 4.643 4.740 -0.001 0.000 0.188 146 N C 2.300 177.807 175.510 -0.006 0.000 1.024 146 N CA 1.081 54.161 53.050 0.050 0.000 0.852 146 N CB -0.500 38.006 38.487 0.032 0.000 1.003 146 N HN 0.200 8.580 8.380 0.000 0.000 0.424 147 V N 1.473 121.389 119.914 0.004 0.000 2.358 147 V HA -0.132 3.988 4.120 -0.001 0.000 0.246 147 V C 2.391 178.552 176.094 0.112 0.000 1.047 147 V CA 1.614 63.968 62.300 0.090 0.000 1.035 147 V CB -0.895 30.991 31.823 0.105 0.000 0.658 147 V HN 0.276 8.466 8.190 0.000 0.000 0.452 148 A N -0.648 122.182 122.820 0.015 0.000 1.908 148 A HA -0.257 4.062 4.320 -0.001 0.000 0.218 148 A C 2.260 179.827 177.584 -0.028 0.000 1.181 148 A CA 2.243 54.249 52.037 -0.051 0.000 0.627 148 A CB -0.481 18.474 19.000 -0.075 0.000 0.818 148 A HN 0.477 8.627 8.150 0.000 0.000 0.445 149 M N -1.545 118.044 119.600 -0.018 0.000 2.117 149 M HA -0.159 4.320 4.480 -0.001 0.000 0.262 149 M C 2.445 178.694 176.300 -0.085 0.000 1.065 149 M CA 1.918 57.204 55.300 -0.024 0.000 1.114 149 M CB -0.303 32.303 32.600 0.011 0.000 1.361 149 M HN 0.518 8.808 8.290 0.000 0.000 0.408 150 R N -0.006 120.384 120.500 -0.182 0.000 2.096 150 R HA -0.148 4.192 4.340 -0.001 0.000 0.235 150 R C 1.396 177.322 176.300 -0.623 0.000 1.127 150 R CA 1.694 57.516 56.100 -0.463 0.000 0.968 150 R CB -0.080 29.772 30.300 -0.746 0.000 0.861 150 R HN 0.291 8.561 8.270 0.000 0.000 0.440 151 F N -0.767 119.190 119.950 0.011 0.000 2.749 151 F HA 0.327 4.854 4.527 -0.001 0.000 0.300 151 F C 1.314 177.205 175.800 0.152 0.000 1.103 151 F CA 0.371 58.432 58.000 0.103 0.000 1.342 151 F CB 0.908 40.021 39.000 0.188 0.000 1.098 151 F HN 0.243 8.543 8.300 0.000 0.000 0.586 152 G N 1.412 110.291 108.800 0.131 0.000 2.246 152 G HA2 -0.145 3.815 3.960 -0.001 0.000 0.273 152 G HA3 -0.145 3.815 3.960 -0.001 0.000 0.273 152 G C 0.119 175.080 174.900 0.101 0.000 1.055 152 G CA -0.015 45.150 45.100 0.109 0.000 0.851 152 G HN 0.626 8.916 8.290 0.000 0.000 0.500 153 A N -0.451 122.297 122.820 -0.120 0.000 2.350 153 A HA 0.640 4.959 4.320 -0.001 0.000 0.293 153 A C 0.892 178.376 177.584 -0.166 0.000 1.231 153 A CA 0.280 52.062 52.037 -0.425 0.000 0.883 153 A CB 0.058 18.438 19.000 -1.034 0.000 1.133 153 A HN 0.517 8.667 8.150 0.000 0.000 0.533 154 N N 1.866 120.542 118.700 -0.039 0.000 2.280 154 N HA 0.144 4.883 4.740 -0.001 0.000 0.192 154 N C 1.224 176.731 175.510 -0.004 0.000 1.109 154 N CA 0.357 53.403 53.050 -0.007 0.000 0.855 154 N CB 0.605 39.112 38.487 0.034 0.000 0.974 154 N HN 0.710 9.090 8.380 0.000 0.000 0.482 155 G N 0.281 109.073 108.800 -0.014 0.000 2.735 155 G HA2 0.186 4.145 3.960 -0.001 0.000 0.192 155 G HA3 0.186 4.145 3.960 -0.001 0.000 0.192 155 G C -0.088 174.802 174.900 -0.018 0.000 1.547 155 G CA -0.433 44.672 45.100 0.008 0.000 1.080 155 G HN -0.037 8.253 8.290 0.000 0.000 0.569 156 V N -0.447 119.462 119.914 -0.007 0.000 2.617 156 V HA 0.265 4.385 4.120 -0.001 0.000 0.304 156 V C 0.270 176.339 176.094 -0.042 0.000 1.040 156 V CA 0.036 62.325 62.300 -0.019 0.000 1.149 156 V CB 0.448 32.266 31.823 -0.008 0.000 0.914 156 V HN 0.666 8.856 8.190 0.000 0.000 0.487 157 C N 7.744 127.023 119.300 -0.035 0.000 2.505 157 C HA 0.774 5.233 4.460 -0.001 0.000 0.342 157 C C -0.444 174.537 174.990 -0.016 0.000 1.121 157 C CA -0.782 58.215 59.018 -0.036 0.000 1.306 157 C CB 0.318 28.034 27.740 -0.041 0.000 1.897 157 C HN 1.107 9.337 8.230 0.000 0.000 0.446 158 K N 3.309 123.705 120.400 -0.007 0.000 2.578 158 K HA 0.744 5.064 4.320 -0.001 0.000 0.287 158 K C -1.474 175.138 176.600 0.020 0.000 1.010 158 K CA -0.405 55.885 56.287 0.006 0.000 0.889 158 K CB 1.494 33.994 32.500 -0.001 0.000 1.514 158 K HN 0.474 8.724 8.250 0.000 0.000 0.424 159 S N 0.620 116.338 115.700 0.031 0.000 2.532 159 S HA 0.683 5.152 4.470 -0.001 0.000 0.301 159 S C -0.861 173.759 174.600 0.032 0.000 1.083 159 S CA -0.903 57.324 58.200 0.045 0.000 1.025 159 S CB 0.616 63.859 63.200 0.071 0.000 1.056 159 S HN 0.505 8.815 8.310 0.000 0.000 0.494 160 I N 3.602 124.191 120.570 0.032 0.000 2.509 160 I HA 0.446 4.615 4.170 -0.001 0.000 0.293 160 I C -0.705 175.419 176.117 0.012 0.000 1.020 160 I CA -0.796 60.514 61.300 0.017 0.000 1.088 160 I CB 2.115 40.124 38.000 0.015 0.000 1.267 160 I HN 0.509 8.719 8.210 0.000 0.000 0.430 161 N N 3.631 122.325 118.700 -0.010 0.000 2.504 161 N HA 0.335 5.074 4.740 -0.001 0.000 0.280 161 N C -0.586 174.857 175.510 -0.110 0.000 1.052 161 N CA -0.343 52.696 53.050 -0.019 0.000 0.887 161 N CB 1.517 40.009 38.487 0.009 0.000 1.323 161 N HN 0.680 9.060 8.380 0.000 0.000 0.509 162 T N 1.170 115.628 114.554 -0.160 0.000 3.487 162 T HA 0.603 4.952 4.350 -0.001 0.000 0.287 162 T C 0.768 175.408 174.700 -0.100 0.000 1.004 162 T CA 0.260 62.087 62.100 -0.455 0.000 0.977 162 T CB -0.082 68.472 68.868 -0.522 0.000 1.180 162 T HN 0.670 8.910 8.240 0.000 0.000 0.490 163 A N 0.933 123.791 122.820 0.063 0.000 5.391 163 A HA -0.325 3.994 4.320 -0.001 0.000 0.315 163 A C 1.996 179.680 177.584 0.166 0.000 1.874 163 A CA 1.437 53.597 52.037 0.204 0.000 0.714 163 A CB -2.055 17.178 19.000 0.389 0.000 1.335 163 A HN 1.144 9.294 8.150 0.000 0.000 0.382 164 C N -0.273 119.153 119.300 0.211 0.000 2.409 164 C HA 0.180 4.639 4.460 -0.001 0.000 0.288 164 C C 2.717 177.767 174.990 0.099 0.000 1.395 164 C CA 1.294 60.438 59.018 0.209 0.000 1.792 164 C CB -1.528 26.387 27.740 0.293 0.000 1.847 164 C HN 0.687 8.917 8.230 0.000 0.000 0.534 165 S N 0.663 116.388 115.700 0.041 0.000 2.556 165 S HA 0.006 4.475 4.470 -0.001 0.000 0.216 165 S C 1.835 176.444 174.600 0.016 0.000 0.970 165 S CA 0.201 58.400 58.200 -0.002 0.000 0.912 165 S CB -0.112 63.097 63.200 0.015 0.000 0.790 165 S HN 0.690 9.000 8.310 0.000 0.000 0.504 166 S N 2.495 118.210 115.700 0.026 0.000 2.368 166 S HA -0.179 4.290 4.470 -0.001 0.000 0.226 166 S C 2.212 176.829 174.600 0.028 0.000 1.044 166 S CA 1.967 60.179 58.200 0.020 0.000 1.062 166 S CB -0.503 62.721 63.200 0.039 0.000 0.931 166 S HN 0.793 9.103 8.310 0.000 0.000 0.440 167 S N 1.472 117.198 115.700 0.043 0.000 2.489 167 S HA 0.073 4.543 4.470 -0.001 0.000 0.228 167 S C 1.517 176.127 174.600 0.016 0.000 0.995 167 S CA 0.610 58.832 58.200 0.037 0.000 0.934 167 S CB -0.367 62.866 63.200 0.055 0.000 0.771 167 S HN 0.310 8.620 8.310 0.000 0.000 0.522 168 N N 2.338 121.048 118.700 0.017 0.000 2.142 168 N HA -0.030 4.710 4.740 -0.001 0.000 0.186 168 N C 1.244 176.725 175.510 -0.048 0.000 1.023 168 N CA 1.387 54.437 53.050 0.001 0.000 0.852 168 N CB -0.440 38.057 38.487 0.017 0.000 0.998 168 N HN 0.373 8.753 8.380 0.000 0.000 0.424 169 D N 0.045 120.453 120.400 0.014 0.000 2.178 169 D HA -0.048 4.591 4.640 -0.001 0.000 0.202 169 D C 1.659 177.907 176.300 -0.086 0.000 0.974 169 D CA 0.884 54.901 54.000 0.028 0.000 0.841 169 D CB -0.107 40.758 40.800 0.108 0.000 0.953 169 D HN 0.268 8.638 8.370 0.000 0.000 0.478 170 A N 0.938 123.730 122.820 -0.048 0.000 1.873 170 A HA -0.130 4.190 4.320 -0.001 0.000 0.215 170 A C 2.361 179.900 177.584 -0.076 0.000 1.186 170 A CA 0.833 52.847 52.037 -0.037 0.000 0.616 170 A CB -0.695 18.306 19.000 0.001 0.000 0.823 170 A HN 0.151 8.301 8.150 0.000 0.000 0.442 171 I N -0.183 120.332 120.570 -0.092 0.000 2.179 171 I HA -0.212 3.957 4.170 -0.001 0.000 0.242 171 I C 2.714 178.713 176.117 -0.197 0.000 1.088 171 I CA 1.179 62.426 61.300 -0.089 0.000 1.357 171 I CB -0.605 37.370 38.000 -0.042 0.000 1.051 171 I HN 0.397 8.607 8.210 0.000 0.000 0.409 172 G N 0.113 108.588 108.800 -0.541 0.000 2.440 172 G HA2 -0.340 3.620 3.960 -0.001 0.000 0.218 172 G HA3 -0.340 3.620 3.960 -0.001 0.000 0.218 172 G C 1.265 175.920 174.900 -0.408 0.000 1.154 172 G CA 1.380 45.823 45.100 -1.095 0.000 0.767 172 G HN 0.344 8.634 8.290 0.000 0.000 0.552 173 D N 0.322 120.571 120.400 -0.251 0.000 2.097 173 D HA 0.024 4.664 4.640 -0.001 0.000 0.195 173 D C 2.771 179.094 176.300 0.038 0.000 0.989 173 D CA 1.437 55.436 54.000 -0.001 0.000 0.827 173 D CB -0.202 40.601 40.800 0.005 0.000 0.966 173 D HN 0.268 8.638 8.370 0.000 0.000 0.456 174 A N -0.308 122.529 122.820 0.028 0.000 1.930 174 A HA -0.112 4.207 4.320 -0.001 0.000 0.217 174 A C 2.063 179.713 177.584 0.111 0.000 1.175 174 A CA 1.165 53.239 52.037 0.062 0.000 0.627 174 A CB -1.068 17.962 19.000 0.050 0.000 0.815 174 A HN 0.452 8.602 8.150 0.000 0.000 0.443 175 F N 0.767 120.702 119.950 -0.025 0.000 2.095 175 F HA -0.180 4.347 4.527 -0.001 0.000 0.298 175 F C 2.284 178.140 175.800 0.094 0.000 1.104 175 F CA 1.864 59.868 58.000 0.006 0.000 1.232 175 F CB -0.196 38.773 39.000 -0.052 0.000 0.987 175 F HN 0.036 8.336 8.300 0.000 0.000 0.475 176 R N 0.242 120.673 120.500 -0.115 0.000 2.081 176 R HA -0.139 4.201 4.340 -0.001 0.000 0.235 176 R C 2.652 179.046 176.300 0.156 0.000 1.131 176 R CA 1.267 57.343 56.100 -0.040 0.000 0.960 176 R CB -1.414 28.990 30.300 0.173 0.000 0.856 176 R HN 0.418 8.688 8.270 0.000 0.000 0.436 177 S N 0.714 116.498 115.700 0.141 0.000 2.356 177 S HA -0.068 4.401 4.470 -0.001 0.000 0.223 177 S C 2.055 176.781 174.600 0.210 0.000 1.032 177 S CA 0.979 59.323 58.200 0.240 0.000 1.005 177 S CB -0.081 63.206 63.200 0.145 0.000 0.867 177 S HN 0.215 8.525 8.310 0.000 0.000 0.449 178 I N 1.144 121.757 120.570 0.073 0.000 2.233 178 I HA -0.129 4.040 4.170 -0.001 0.000 0.243 178 I C 2.593 178.668 176.117 -0.070 0.000 1.093 178 I CA 1.343 62.650 61.300 0.011 0.000 1.380 178 I CB -0.393 37.611 38.000 0.007 0.000 1.067 178 I HN 0.326 8.536 8.210 0.000 0.000 0.413 179 K N 1.314 121.601 120.400 -0.189 0.000 2.074 179 K HA -0.188 4.131 4.320 -0.001 0.000 0.209 179 K C 1.635 177.988 176.600 -0.413 0.000 1.048 179 K CA 1.884 57.946 56.287 -0.375 0.000 0.926 179 K CB -0.166 31.917 32.500 -0.695 0.000 0.713 179 K HN 0.165 8.415 8.250 0.000 0.000 0.444 180 F N -0.033 119.845 119.950 -0.120 0.000 2.773 180 F HA 0.234 4.760 4.527 -0.001 0.000 0.304 180 F C 1.305 176.887 175.800 -0.364 0.000 1.129 180 F CA 0.574 58.489 58.000 -0.143 0.000 1.378 180 F CB 0.784 39.795 39.000 0.019 0.000 1.095 180 F HN 0.335 8.635 8.300 0.000 0.000 0.565 181 G N -0.429 108.267 108.800 -0.173 0.000 2.136 181 G HA2 -0.349 3.610 3.960 -0.001 0.000 0.242 181 G HA3 -0.349 3.610 3.960 -0.001 0.000 0.242 181 G C 0.817 175.529 174.900 -0.313 0.000 0.989 181 G CA 0.252 45.203 45.100 -0.247 0.000 0.682 181 G HN 0.420 8.710 8.290 0.000 0.000 0.522 182 F N 0.192 120.171 119.950 0.049 0.000 2.416 182 F HA 0.278 4.805 4.527 -0.001 0.000 0.296 182 F C 1.657 177.472 175.800 0.024 0.000 1.099 182 F CA 1.114 59.136 58.000 0.036 0.000 1.427 182 F CB 0.257 39.279 39.000 0.036 0.000 1.079 182 F HN 0.148 8.448 8.300 0.000 0.000 0.536 183 Q N -0.308 119.587 119.800 0.159 0.000 2.456 183 Q HA 0.193 4.532 4.340 -0.001 0.000 0.284 183 Q C -0.457 175.558 176.000 0.025 0.000 1.061 183 Q CA -0.341 55.519 55.803 0.094 0.000 0.799 183 Q CB 2.100 30.899 28.738 0.102 0.000 1.445 183 Q HN 0.016 8.286 8.270 0.000 0.000 0.411 184 D N -0.410 119.976 120.400 -0.025 0.000 2.422 184 D HA 0.164 4.804 4.640 -0.001 0.000 0.218 184 D C 0.115 176.253 176.300 -0.269 0.000 1.047 184 D CA 0.671 54.591 54.000 -0.133 0.000 0.885 184 D CB 1.390 42.098 40.800 -0.154 0.000 1.035 184 D HN 0.134 8.504 8.370 0.000 0.000 0.502 185 V N 1.597 121.400 119.914 -0.184 0.000 2.888 185 V HA 0.457 4.577 4.120 -0.001 0.000 0.309 185 V C -0.680 175.479 176.094 0.108 0.000 1.114 185 V CA -0.687 61.518 62.300 -0.159 0.000 0.940 185 V CB 2.743 34.339 31.823 -0.379 0.000 1.021 185 V HN -0.079 8.111 8.190 0.000 0.000 0.426 186 M N 4.508 124.170 119.600 0.104 0.000 2.386 186 M HA 0.555 5.035 4.480 -0.001 0.000 0.293 186 M C -1.308 175.059 176.300 0.113 0.000 1.120 186 M CA -0.380 55.000 55.300 0.133 0.000 0.909 186 M CB 2.353 34.993 32.600 0.068 0.000 1.661 186 M HN 0.457 8.747 8.290 0.000 0.000 0.452 187 L N 2.696 123.977 121.223 0.095 0.000 2.257 187 L HA 0.706 5.045 4.340 -0.001 0.000 0.290 187 L C -0.683 176.191 176.870 0.006 0.000 1.044 187 L CA -0.643 54.211 54.840 0.024 0.000 0.810 187 L CB 1.475 43.507 42.059 -0.045 0.000 1.193 187 L HN 0.525 8.755 8.230 0.000 0.000 0.425 188 V N 3.947 123.872 119.914 0.018 0.000 2.888 188 V HA 1.012 5.132 4.120 -0.001 0.000 0.309 188 V C -0.253 175.860 176.094 0.032 0.000 1.114 188 V CA 0.401 62.715 62.300 0.023 0.000 0.940 188 V CB 1.885 33.724 31.823 0.028 0.000 1.021 188 V HN 0.851 9.041 8.190 0.000 0.000 0.426 189 G N 3.330 112.152 108.800 0.036 0.000 2.392 189 G HA2 0.667 4.626 3.960 -0.001 0.000 0.260 189 G HA3 0.667 4.626 3.960 -0.001 0.000 0.260 189 G C -0.342 174.594 174.900 0.059 0.000 1.226 189 G CA 0.132 45.260 45.100 0.046 0.000 0.913 189 G HN 1.667 9.957 8.290 0.000 0.000 0.483 190 G N -1.799 107.048 108.800 0.077 0.000 2.692 190 G HA2 0.763 4.722 3.960 -0.001 0.000 0.291 190 G HA3 0.763 4.722 3.960 -0.001 0.000 0.291 190 G C -1.389 173.591 174.900 0.133 0.000 1.423 190 G CA 0.560 45.721 45.100 0.102 0.000 0.843 190 G HN 1.343 9.633 8.290 0.000 0.000 0.486 191 T N -0.951 113.709 114.554 0.177 0.000 2.932 191 T HA 0.652 5.001 4.350 -0.001 0.000 0.318 191 T C -1.865 173.002 174.700 0.280 0.000 1.265 191 T CA -0.411 61.829 62.100 0.233 0.000 1.036 191 T CB 2.227 71.226 68.868 0.217 0.000 1.209 191 T HN 0.672 8.912 8.240 0.000 0.000 0.484 192 E N 1.199 121.576 120.200 0.297 0.000 2.352 192 E HA 0.715 5.064 4.350 -0.001 0.000 0.280 192 E C -1.483 175.306 176.600 0.315 0.000 0.930 192 E CA -0.498 56.056 56.400 0.257 0.000 0.765 192 E CB 1.972 31.772 29.700 0.166 0.000 1.219 192 E HN 0.820 9.180 8.360 0.000 0.000 0.434 193 A N 2.583 125.552 122.820 0.248 0.000 3.266 193 A HA 0.421 4.740 4.320 -0.001 0.000 0.310 193 A C -0.339 177.341 177.584 0.161 0.000 1.066 193 A CA -0.080 52.100 52.037 0.238 0.000 0.839 193 A CB -0.000 19.034 19.000 0.058 0.000 1.192 193 A HN 0.536 8.686 8.150 0.000 0.000 0.496 194 S N 0.124 115.927 115.700 0.172 0.000 2.741 194 S HA 0.312 4.782 4.470 -0.001 0.000 0.247 194 S C 0.084 174.788 174.600 0.174 0.000 1.050 194 S CA -0.104 58.192 58.200 0.160 0.000 1.025 194 S CB -0.692 62.615 63.200 0.179 0.000 0.897 194 S HN 0.481 8.791 8.310 0.000 0.000 0.508 195 I N 3.980 124.660 120.570 0.184 0.000 2.268 195 I HA 0.202 4.371 4.170 -0.001 0.000 0.298 195 I C 0.541 176.810 176.117 0.254 0.000 1.185 195 I CA 0.089 61.525 61.300 0.227 0.000 1.548 195 I CB -0.532 37.589 38.000 0.202 0.000 1.492 195 I HN 0.410 8.620 8.210 0.000 0.000 0.711 196 T N 0.993 115.605 114.554 0.096 0.000 2.901 196 T HA 0.439 4.789 4.350 -0.001 0.000 0.293 196 T C -2.315 171.974 174.700 -0.685 0.000 1.084 196 T CA -1.963 60.026 62.100 -0.185 0.000 1.008 196 T CB 2.284 71.135 68.868 -0.028 0.000 1.170 196 T HN -0.094 8.146 8.240 0.000 0.000 0.509 197 P HA -0.012 4.408 4.420 0.000 0.000 0.215 197 P C 1.232 178.465 177.300 -0.113 0.000 1.157 197 P CA 0.663 63.274 63.100 -0.815 0.000 0.868 197 P CB -0.108 31.355 31.700 -0.395 0.000 0.788 198 F N 0.721 120.580 119.950 -0.151 0.000 2.102 198 F HA -0.160 4.366 4.527 -0.001 0.000 0.298 198 F C 2.148 177.929 175.800 -0.030 0.000 1.105 198 F CA 1.723 59.684 58.000 -0.065 0.000 1.239 198 F CB -0.956 37.999 39.000 -0.074 0.000 0.991 198 F HN -0.148 8.152 8.300 0.000 0.000 0.474 199 A N 0.730 123.466 122.820 -0.139 0.000 1.898 199 A HA -0.086 4.233 4.320 -0.001 0.000 0.216 199 A C 2.229 179.808 177.584 -0.008 0.000 1.181 199 A CA 1.577 53.523 52.037 -0.152 0.000 0.620 199 A CB -0.964 18.116 19.000 0.134 0.000 0.819 199 A HN 0.410 8.560 8.150 0.000 0.000 0.442 200 I N 0.113 120.725 120.570 0.071 0.000 2.226 200 I HA -0.241 3.928 4.170 -0.001 0.000 0.245 200 I C 2.948 179.175 176.117 0.182 0.000 1.100 200 I CA 1.496 62.904 61.300 0.180 0.000 1.374 200 I CB -1.553 36.572 38.000 0.209 0.000 1.057 200 I HN 0.368 8.578 8.210 0.000 0.000 0.413 201 A N 0.932 123.862 122.820 0.184 0.000 1.940 201 A HA -0.121 4.199 4.320 -0.001 0.000 0.219 201 A C 2.495 179.963 177.584 -0.194 0.000 1.176 201 A CA 1.908 53.952 52.037 0.012 0.000 0.631 201 A CB -1.282 17.668 19.000 -0.083 0.000 0.814 201 A HN 0.443 8.593 8.150 0.000 0.000 0.446 202 G N -1.508 107.047 108.800 -0.410 0.000 2.402 202 G HA2 -0.128 3.831 3.960 -0.001 0.000 0.216 202 G HA3 -0.128 3.831 3.960 -0.001 0.000 0.216 202 G C 1.382 176.038 174.900 -0.407 0.000 1.162 202 G CA 0.991 45.768 45.100 -0.540 0.000 0.777 202 G HN 0.475 8.765 8.290 0.000 0.000 0.539 203 F N 0.459 120.294 119.950 -0.190 0.000 2.293 203 F HA 0.055 4.581 4.527 -0.001 0.000 0.297 203 F C 2.875 178.581 175.800 -0.156 0.000 1.089 203 F CA 1.273 59.178 58.000 -0.158 0.000 1.377 203 F CB 0.043 38.964 39.000 -0.131 0.000 1.051 203 F HN 0.172 8.472 8.300 0.000 0.000 0.511 204 Q N 0.714 120.536 119.800 0.037 0.000 2.079 204 Q HA -0.175 4.165 4.340 -0.001 0.000 0.200 204 Q C 2.337 178.314 176.000 -0.038 0.000 0.974 204 Q CA 1.451 57.252 55.803 -0.003 0.000 0.840 204 Q CB -0.213 28.539 28.738 0.024 0.000 0.898 204 Q HN 0.359 8.629 8.270 0.000 0.000 0.430 205 A N 0.790 123.563 122.820 -0.078 0.000 1.933 205 A HA -0.160 4.160 4.320 -0.001 0.000 0.218 205 A C 1.913 179.457 177.584 -0.067 0.000 1.175 205 A CA 1.198 53.181 52.037 -0.089 0.000 0.628 205 A CB -0.580 18.344 19.000 -0.126 0.000 0.814 205 A HN 0.483 8.633 8.150 0.000 0.000 0.444 206 L N 0.291 121.473 121.223 -0.069 0.000 2.552 206 L HA 0.018 4.358 4.340 -0.001 0.000 0.227 206 L C 1.422 178.303 176.870 0.019 0.000 1.146 206 L CA 2.146 56.965 54.840 -0.035 0.000 0.858 206 L CB -0.757 41.264 42.059 -0.064 0.000 0.969 206 L HN 0.910 9.140 8.230 0.000 0.000 0.451 207 T N -5.520 109.041 114.554 0.011 0.000 4.712 207 T HA -0.297 4.052 4.350 -0.001 0.000 0.304 207 T C 0.971 175.696 174.700 0.041 0.000 1.250 207 T CA 0.943 63.054 62.100 0.018 0.000 2.371 207 T CB -2.530 66.352 68.868 0.023 0.000 1.829 207 T HN 0.561 8.801 8.240 0.000 0.000 0.953 208 A N 0.065 122.921 122.820 0.060 0.000 2.132 208 A HA 0.652 4.971 4.320 -0.001 0.000 0.213 208 A C 1.098 178.573 177.584 -0.181 0.000 1.154 208 A CA 0.349 52.449 52.037 0.105 0.000 0.753 208 A CB 0.139 19.350 19.000 0.353 0.000 0.826 208 A HN 0.760 8.910 8.150 0.000 0.000 0.469 209 L N 0.144 121.196 121.223 -0.286 0.000 2.325 209 L HA 0.351 4.690 4.340 -0.001 0.000 0.279 209 L C 0.647 177.404 176.870 -0.187 0.000 1.054 209 L CA -0.563 54.023 54.840 -0.423 0.000 0.804 209 L CB 1.671 43.509 42.059 -0.368 0.000 1.200 209 L HN 0.150 8.380 8.230 0.000 0.000 0.436 210 S N 0.190 115.796 115.700 -0.158 0.000 2.549 210 S HA 0.101 4.570 4.470 -0.001 0.000 0.279 210 S C 0.902 175.467 174.600 -0.059 0.000 1.321 210 S CA -0.276 57.881 58.200 -0.072 0.000 1.054 210 S CB 0.588 63.761 63.200 -0.045 0.000 0.899 210 S HN 0.755 9.065 8.310 0.000 0.000 0.497 211 T N 1.237 115.776 114.554 -0.026 0.000 3.134 211 T HA 0.204 4.554 4.350 -0.001 0.000 0.260 211 T C 0.445 175.159 174.700 0.024 0.000 1.027 211 T CA -0.405 61.696 62.100 0.001 0.000 0.913 211 T CB -0.413 68.464 68.868 0.014 0.000 1.046 211 T HN 0.529 8.769 8.240 0.000 0.000 0.553 212 T N 2.877 117.435 114.554 0.007 0.000 2.867 212 T HA 0.079 4.429 4.350 -0.001 0.000 0.297 212 T C 1.198 175.911 174.700 0.021 0.000 0.989 212 T CA 0.029 62.135 62.100 0.010 0.000 1.159 212 T CB 1.377 70.242 68.868 -0.005 0.000 0.928 212 T HN 0.500 8.740 8.240 0.000 0.000 0.538 213 E N 2.164 122.381 120.200 0.028 0.000 2.072 213 E HA -0.135 4.214 4.350 -0.001 0.000 0.190 213 E C 0.717 177.322 176.600 0.009 0.000 0.982 213 E CA 0.451 56.870 56.400 0.032 0.000 0.803 213 E CB 0.193 29.907 29.700 0.024 0.000 0.755 213 E HN 0.603 8.963 8.360 0.000 0.000 0.453 214 D N 1.111 121.510 120.400 -0.002 0.000 2.346 214 D HA -0.020 4.620 4.640 -0.001 0.000 0.260 214 D C -1.562 174.726 176.300 -0.020 0.000 1.252 214 D CA -1.982 52.011 54.000 -0.013 0.000 0.895 214 D CB 1.350 42.141 40.800 -0.016 0.000 1.097 214 D HN 0.065 8.435 8.370 0.000 0.000 0.489 215 P HA -0.146 4.274 4.420 0.000 0.000 0.223 215 P C 1.001 178.274 177.300 -0.044 0.000 1.144 215 P CA 1.051 64.132 63.100 -0.031 0.000 0.783 215 P CB -0.084 31.597 31.700 -0.031 0.000 0.771 216 T N -4.442 110.084 114.554 -0.047 0.000 3.100 216 T HA 0.136 4.485 4.350 -0.001 0.000 0.253 216 T C 1.547 176.208 174.700 -0.065 0.000 1.118 216 T CA 0.180 62.241 62.100 -0.065 0.000 1.058 216 T CB -0.240 68.592 68.868 -0.060 0.000 0.953 216 T HN -0.056 8.184 8.240 0.000 0.000 0.515 217 R N -0.292 120.179 120.500 -0.048 0.000 2.572 217 R HA 0.551 4.890 4.340 -0.001 0.000 0.370 217 R C 1.781 178.059 176.300 -0.038 0.000 1.005 217 R CA 0.547 56.620 56.100 -0.044 0.000 1.146 217 R CB 0.202 30.481 30.300 -0.035 0.000 1.390 217 R HN 0.463 8.733 8.270 0.000 0.000 0.553 218 A N 0.466 123.264 122.820 -0.036 0.000 1.935 218 A HA 0.048 4.368 4.320 -0.001 0.000 0.214 218 A C 1.157 178.726 177.584 -0.024 0.000 1.178 218 A CA 0.879 52.899 52.037 -0.028 0.000 0.640 218 A CB 0.192 19.177 19.000 -0.025 0.000 0.825 218 A HN 0.090 8.240 8.150 0.000 0.000 0.447 219 S N 0.688 116.369 115.700 -0.031 0.000 2.528 219 S HA 0.550 5.019 4.470 -0.001 0.000 0.303 219 S C -0.310 174.262 174.600 -0.047 0.000 1.123 219 S CA -0.623 57.562 58.200 -0.024 0.000 1.138 219 S CB -0.377 62.819 63.200 -0.006 0.000 0.984 219 S HN 0.519 8.829 8.310 0.000 0.000 0.474 220 I N 2.033 122.575 120.570 -0.046 0.000 2.905 220 I HA 0.492 4.661 4.170 -0.001 0.000 0.297 220 I C -2.980 173.107 176.117 -0.051 0.000 1.358 220 I CA -2.657 58.613 61.300 -0.050 0.000 0.975 220 I CB 0.922 38.888 38.000 -0.057 0.000 1.857 220 I HN 0.214 8.424 8.210 0.000 0.000 0.612 221 P HA 0.137 4.557 4.420 0.000 0.000 0.262 221 P C -0.130 177.159 177.300 -0.018 0.000 1.182 221 P CA 0.664 63.669 63.100 -0.158 0.000 0.761 221 P CB 0.065 31.689 31.700 -0.126 0.000 0.795 222 F N -1.356 118.567 119.950 -0.044 0.000 2.619 222 F HA -0.258 4.268 4.527 -0.001 0.000 0.425 222 F C 0.917 176.633 175.800 -0.139 0.000 0.575 222 F CA 0.859 58.815 58.000 -0.073 0.000 1.289 222 F CB -1.612 37.352 39.000 -0.061 0.000 1.859 222 F HN 0.316 8.616 8.300 0.000 0.000 0.280 223 D N 2.346 122.738 120.400 -0.013 0.000 2.424 223 D HA 0.062 4.702 4.640 -0.001 0.000 0.244 223 D C 1.328 177.581 176.300 -0.078 0.000 1.134 223 D CA 0.659 54.606 54.000 -0.089 0.000 0.881 223 D CB 0.994 41.736 40.800 -0.096 0.000 1.191 223 D HN 0.535 8.905 8.370 0.000 0.000 0.445 224 K N 2.736 123.076 120.400 -0.100 0.000 2.211 224 K HA -0.172 4.147 4.320 -0.001 0.000 0.204 224 K C 0.440 177.021 176.600 -0.032 0.000 1.047 224 K CA 1.222 57.464 56.287 -0.075 0.000 0.935 224 K CB 0.190 32.641 32.500 -0.080 0.000 0.728 224 K HN 0.220 8.470 8.250 0.000 0.000 0.452 225 D N 1.650 122.026 120.400 -0.039 0.000 2.340 225 D HA -0.017 4.623 4.640 -0.001 0.000 0.220 225 D C 0.053 176.343 176.300 -0.017 0.000 1.039 225 D CA 0.089 54.076 54.000 -0.022 0.000 0.866 225 D CB -0.016 40.768 40.800 -0.026 0.000 0.913 225 D HN 0.373 8.743 8.370 0.000 0.000 0.523 226 R N 1.552 122.038 120.500 -0.022 0.000 2.638 226 R HA 0.003 4.343 4.340 -0.001 0.000 0.268 226 R C 0.159 176.459 176.300 0.000 0.000 1.006 226 R CA 0.489 56.577 56.100 -0.019 0.000 1.088 226 R CB -0.359 29.919 30.300 -0.036 0.000 0.950 226 R HN 0.085 8.355 8.270 0.000 0.000 0.419 227 N N 0.922 119.623 118.700 0.002 0.000 2.545 227 N HA 0.251 4.990 4.740 -0.001 0.000 0.283 227 N C -0.628 174.888 175.510 0.010 0.000 1.596 227 N CA -0.370 52.687 53.050 0.011 0.000 0.862 227 N CB 1.294 39.784 38.487 0.005 0.000 1.422 227 N HN 0.951 9.331 8.380 0.000 0.000 0.489 228 G N 0.862 109.677 108.800 0.026 0.000 2.375 228 G HA2 0.076 4.036 3.960 -0.001 0.000 0.663 228 G HA3 0.076 4.036 3.960 -0.001 0.000 0.663 228 G C -0.782 174.149 174.900 0.051 0.000 1.391 228 G CA -0.922 44.196 45.100 0.030 0.000 0.949 228 G HN 0.333 8.623 8.290 0.000 0.000 0.646 229 F N -0.227 119.730 119.950 0.013 0.000 2.375 229 F HA 0.833 5.359 4.527 -0.001 0.000 0.313 229 F C 0.150 175.944 175.800 -0.010 0.000 1.176 229 F CA -1.342 56.652 58.000 -0.009 0.000 1.142 229 F CB 1.259 40.269 39.000 0.017 0.000 1.275 229 F HN 0.410 8.710 8.300 0.000 0.000 0.544 230 V N 4.013 124.085 119.914 0.263 0.000 2.417 230 V HA 0.245 4.365 4.120 -0.001 0.000 0.291 230 V C 0.091 176.369 176.094 0.306 0.000 1.024 230 V CA -0.869 61.506 62.300 0.125 0.000 0.861 230 V CB 1.424 33.288 31.823 0.067 0.000 0.985 230 V HN 0.958 9.148 8.190 0.000 0.000 0.436 231 M N 3.756 123.476 119.600 0.200 0.000 2.217 231 M HA 0.537 5.017 4.480 -0.001 0.000 0.354 231 M C 0.525 176.919 176.300 0.157 0.000 1.225 231 M CA 0.331 55.784 55.300 0.255 0.000 1.137 231 M CB 0.784 33.489 32.600 0.176 0.000 1.576 231 M HN 0.831 9.121 8.290 0.000 0.000 0.461 232 G N 3.153 112.041 108.800 0.147 0.000 3.108 232 G HA2 0.733 4.693 3.960 -0.001 0.000 0.268 232 G HA3 0.733 4.693 3.960 -0.001 0.000 0.268 232 G C -1.742 173.226 174.900 0.113 0.000 1.361 232 G CA -0.618 44.553 45.100 0.117 0.000 1.047 232 G HN 0.786 9.076 8.290 0.000 0.000 0.540 233 E N -2.339 117.921 120.200 0.100 0.000 2.430 233 E HA 0.703 5.053 4.350 -0.001 0.000 0.279 233 E C -0.270 176.343 176.600 0.022 0.000 1.003 233 E CA -0.672 55.800 56.400 0.120 0.000 0.801 233 E CB 1.879 31.692 29.700 0.188 0.000 1.313 233 E HN 1.727 10.087 8.360 0.000 0.000 0.459 234 G N 0.083 108.899 108.800 0.027 0.000 2.340 234 G HA2 0.349 4.308 3.960 -0.001 0.000 0.282 234 G HA3 0.349 4.308 3.960 -0.001 0.000 0.282 234 G C -1.368 173.586 174.900 0.090 0.000 1.312 234 G CA -0.255 44.767 45.100 -0.130 0.000 0.942 234 G HN 0.896 9.186 8.290 0.000 0.000 0.495 235 S N -1.551 114.197 115.700 0.080 0.000 2.537 235 S HA 0.831 5.301 4.470 -0.001 0.000 0.270 235 S C -0.257 174.400 174.600 0.094 0.000 1.142 235 S CA 0.644 58.929 58.200 0.142 0.000 0.870 235 S CB 1.499 64.835 63.200 0.228 0.000 1.112 235 S HN 2.267 10.577 8.310 0.000 0.000 0.466 236 G N 2.948 111.789 108.800 0.069 0.000 2.617 236 G HA2 0.674 4.634 3.960 -0.001 0.000 0.306 236 G HA3 0.674 4.634 3.960 -0.001 0.000 0.306 236 G C -1.277 173.651 174.900 0.045 0.000 1.360 236 G CA -0.511 44.600 45.100 0.018 0.000 0.983 236 G HN 0.536 8.826 8.290 0.000 0.000 0.496 237 M N 1.339 120.969 119.600 0.050 0.000 2.446 237 M HA 0.539 5.018 4.480 -0.001 0.000 0.294 237 M C -1.434 174.907 176.300 0.069 0.000 1.158 237 M CA -0.694 54.635 55.300 0.048 0.000 0.899 237 M CB 1.967 34.587 32.600 0.034 0.000 1.687 237 M HN 0.268 8.558 8.290 0.000 0.000 0.455 238 L N 1.774 123.035 121.223 0.062 0.000 2.341 238 L HA 0.720 5.060 4.340 -0.001 0.000 0.267 238 L C -0.407 176.488 176.870 0.041 0.000 1.009 238 L CA -0.735 54.163 54.840 0.097 0.000 0.819 238 L CB 2.010 44.133 42.059 0.105 0.000 1.323 238 L HN 0.395 8.625 8.230 0.000 0.000 0.425 239 V N 3.533 123.458 119.914 0.019 0.000 2.350 239 V HA 0.443 4.563 4.120 -0.001 0.000 0.276 239 V C -0.066 176.021 176.094 -0.012 0.000 1.028 239 V CA -0.455 61.828 62.300 -0.028 0.000 0.860 239 V CB 1.195 32.959 31.823 -0.098 0.000 0.990 239 V HN 0.444 8.634 8.190 0.000 0.000 0.453 240 L N 5.262 126.488 121.223 0.005 0.000 2.325 240 L HA 0.710 5.049 4.340 -0.001 0.000 0.278 240 L C -0.073 176.781 176.870 -0.027 0.000 1.023 240 L CA -0.448 54.401 54.840 0.014 0.000 0.811 240 L CB 1.953 44.048 42.059 0.061 0.000 1.249 240 L HN 0.623 8.853 8.230 0.000 0.000 0.431 241 E N 0.417 120.594 120.200 -0.037 0.000 2.408 241 E HA 0.322 4.672 4.350 -0.001 0.000 0.275 241 E C -1.110 175.472 176.600 -0.029 0.000 0.935 241 E CA -0.741 55.617 56.400 -0.070 0.000 0.775 241 E CB 2.398 32.067 29.700 -0.053 0.000 1.277 241 E HN 0.653 9.013 8.360 0.000 0.000 0.455 242 S N 0.616 116.303 115.700 -0.022 0.000 2.593 242 S HA 0.054 4.523 4.470 -0.001 0.000 0.269 242 S C 0.952 175.559 174.600 0.011 0.000 1.334 242 S CA -0.560 57.642 58.200 0.003 0.000 1.015 242 S CB 0.840 64.045 63.200 0.008 0.000 0.912 242 S HN 0.579 8.889 8.310 0.000 0.000 0.541 243 L N 1.126 122.352 121.223 0.005 0.000 2.083 243 L HA -0.045 4.294 4.340 -0.001 0.000 0.209 243 L C 2.530 179.402 176.870 0.004 0.000 1.083 243 L CA 2.201 57.035 54.840 -0.009 0.000 0.752 243 L CB -1.092 40.993 42.059 0.044 0.000 0.899 243 L HN 1.027 9.257 8.230 0.000 0.000 0.433 244 E N -1.558 118.655 120.200 0.020 0.000 2.051 244 E HA -0.314 4.036 4.350 -0.001 0.000 0.192 244 E C 2.235 178.840 176.600 0.009 0.000 0.991 244 E CA 1.251 57.659 56.400 0.013 0.000 0.799 244 E CB -0.371 29.337 29.700 0.014 0.000 0.748 244 E HN 0.702 9.062 8.360 0.000 0.000 0.449 245 H N 0.046 119.083 119.070 -0.054 0.000 2.321 245 H HA -0.102 4.453 4.556 -0.001 0.000 0.300 245 H C 1.890 177.166 175.328 -0.086 0.000 1.087 245 H CA 1.866 57.874 56.048 -0.067 0.000 1.319 245 H CB -0.055 29.666 29.762 -0.068 0.000 1.379 245 H HN 0.302 8.582 8.280 0.000 0.000 0.501 246 A N 1.000 123.841 122.820 0.035 0.000 1.902 246 A HA -0.162 4.158 4.320 -0.001 0.000 0.217 246 A C 2.374 179.893 177.584 -0.109 0.000 1.181 246 A CA 1.678 53.679 52.037 -0.059 0.000 0.623 246 A CB -0.426 18.503 19.000 -0.117 0.000 0.818 246 A HN 0.594 8.744 8.150 0.000 0.000 0.443 247 E N -0.616 119.535 120.200 -0.082 0.000 2.107 247 E HA -0.166 4.183 4.350 -0.001 0.000 0.191 247 E C 2.051 178.603 176.600 -0.080 0.000 0.982 247 E CA 1.128 57.490 56.400 -0.063 0.000 0.809 247 E CB -0.123 29.568 29.700 -0.016 0.000 0.756 247 E HN 0.634 8.994 8.360 0.000 0.000 0.459 248 K N 1.376 121.712 120.400 -0.107 0.000 2.152 248 K HA -0.175 4.144 4.320 -0.001 0.000 0.206 248 K C 2.066 178.575 176.600 -0.152 0.000 1.048 248 K CA 1.367 57.578 56.287 -0.127 0.000 0.933 248 K CB 0.043 32.450 32.500 -0.155 0.000 0.721 248 K HN 0.025 8.275 8.250 0.000 0.000 0.447 249 R N -1.117 119.267 120.500 -0.193 0.000 2.334 249 R HA 0.132 4.472 4.340 -0.001 0.000 0.216 249 R C 0.615 176.841 176.300 -0.122 0.000 0.905 249 R CA 0.651 56.646 56.100 -0.175 0.000 1.064 249 R CB 0.235 30.395 30.300 -0.233 0.000 1.046 249 R HN 0.162 8.432 8.270 0.000 0.000 0.508 250 G N 0.764 109.501 108.800 -0.105 0.000 2.198 250 G HA2 -0.306 3.653 3.960 -0.001 0.000 0.257 250 G HA3 -0.306 3.653 3.960 -0.001 0.000 0.257 250 G C 0.242 175.086 174.900 -0.093 0.000 1.042 250 G CA 0.116 45.167 45.100 -0.082 0.000 0.791 250 G HN 0.698 8.988 8.290 0.000 0.000 0.502 251 A N -0.326 122.424 122.820 -0.117 0.000 2.386 251 A HA 0.689 5.009 4.320 -0.001 0.000 0.248 251 A C 0.875 178.368 177.584 -0.153 0.000 1.082 251 A CA 0.917 52.871 52.037 -0.139 0.000 0.789 251 A CB 0.433 19.339 19.000 -0.157 0.000 1.025 251 A HN 0.835 8.985 8.150 0.000 0.000 0.490 252 T N 2.615 117.069 114.554 -0.167 0.000 2.729 252 T HA 0.385 4.735 4.350 -0.001 0.000 0.296 252 T C 0.141 174.683 174.700 -0.264 0.000 0.928 252 T CA 0.352 62.351 62.100 -0.168 0.000 1.045 252 T CB -0.241 68.542 68.868 -0.142 0.000 0.902 252 T HN 0.385 8.625 8.240 0.000 0.000 0.500 253 I N 4.352 124.703 120.570 -0.365 0.000 2.395 253 I HA 0.182 4.351 4.170 -0.001 0.000 0.289 253 I C 1.110 176.987 176.117 -0.400 0.000 1.023 253 I CA -0.289 60.644 61.300 -0.612 0.000 1.350 253 I CB 1.201 38.376 38.000 -1.375 0.000 1.409 253 I HN 0.600 8.810 8.210 0.000 0.000 0.507 254 L N 5.928 126.999 121.223 -0.253 0.000 2.408 254 L HA 0.458 4.798 4.340 -0.001 0.000 0.215 254 L C 0.765 177.680 176.870 0.075 0.000 1.081 254 L CA 0.170 54.977 54.840 -0.054 0.000 0.840 254 L CB -0.107 41.938 42.059 -0.023 0.000 1.002 254 L HN 0.751 8.981 8.230 0.000 0.000 0.468 255 A N -0.209 122.645 122.820 0.057 0.000 2.540 255 A HA 0.565 4.884 4.320 -0.001 0.000 0.291 255 A C -1.651 176.033 177.584 0.167 0.000 1.083 255 A CA -0.486 51.658 52.037 0.179 0.000 0.650 255 A CB 1.509 20.607 19.000 0.162 0.000 1.292 255 A HN 0.000 8.150 8.150 0.000 0.000 0.435 256 E N 0.068 120.425 120.200 0.261 0.000 2.266 256 E HA 0.607 4.957 4.350 -0.001 0.000 0.268 256 E C -1.672 175.043 176.600 0.191 0.000 0.879 256 E CA -0.630 55.908 56.400 0.230 0.000 0.762 256 E CB 2.130 32.030 29.700 0.334 0.000 1.199 256 E HN 0.501 8.861 8.360 0.000 0.000 0.422 257 V N 5.119 125.086 119.914 0.088 0.000 2.383 257 V HA 0.114 4.234 4.120 -0.001 0.000 0.275 257 V C 0.971 176.914 176.094 -0.251 0.000 1.036 257 V CA -0.181 61.989 62.300 -0.217 0.000 0.889 257 V CB 1.022 32.640 31.823 -0.341 0.000 0.985 257 V HN 0.702 8.892 8.190 0.000 0.000 0.459 258 V N 1.820 121.550 119.914 -0.307 0.000 3.635 258 V HA 0.708 4.827 4.120 -0.001 0.000 0.266 258 V C 0.703 176.731 176.094 -0.110 0.000 1.316 258 V CA 0.697 62.956 62.300 -0.070 0.000 1.060 258 V CB 0.264 32.162 31.823 0.126 0.000 0.820 258 V HN 0.853 9.043 8.190 0.000 0.000 0.447 259 G N -0.728 107.848 108.800 -0.372 0.000 2.698 259 G HA2 0.567 4.527 3.960 -0.001 0.000 0.293 259 G HA3 0.567 4.527 3.960 -0.001 0.000 0.293 259 G C -2.463 172.332 174.900 -0.175 0.000 1.437 259 G CA -0.621 44.391 45.100 -0.146 0.000 0.852 259 G HN 0.363 8.653 8.290 0.000 0.000 0.499 260 Y N 0.238 120.495 120.300 -0.071 0.000 2.441 260 Y HA 0.703 5.252 4.550 -0.001 0.000 0.334 260 Y C -0.293 175.630 175.900 0.038 0.000 1.061 260 Y CA -1.092 56.983 58.100 -0.040 0.000 1.032 260 Y CB 2.051 40.562 38.460 0.086 0.000 1.266 260 Y HN 0.935 9.215 8.280 0.000 0.000 0.441 261 G N 5.268 113.978 108.800 -0.151 0.000 2.609 261 G HA2 0.489 4.449 3.960 -0.001 0.000 0.308 261 G HA3 0.489 4.449 3.960 -0.001 0.000 0.308 261 G C -1.875 172.818 174.900 -0.346 0.000 1.369 261 G CA -1.099 43.843 45.100 -0.263 0.000 0.958 261 G HN 0.771 9.061 8.290 0.000 0.000 0.499 262 N N 0.540 119.004 118.700 -0.394 0.000 2.352 262 N HA 0.661 5.400 4.740 -0.001 0.000 0.291 262 N C -0.448 175.014 175.510 -0.079 0.000 1.040 262 N CA -0.699 52.231 53.050 -0.202 0.000 0.864 262 N CB 2.122 40.478 38.487 -0.220 0.000 1.440 262 N HN 0.603 8.983 8.380 0.000 0.000 0.483 263 T N -2.191 112.367 114.554 0.007 0.000 2.838 263 T HA 0.631 4.980 4.350 -0.001 0.000 0.292 263 T C -1.065 173.671 174.700 0.059 0.000 1.113 263 T CA -0.758 61.354 62.100 0.019 0.000 1.008 263 T CB 1.460 70.329 68.868 0.003 0.000 1.259 263 T HN 0.699 8.939 8.240 0.000 0.000 0.520 264 C N 1.008 120.335 119.300 0.045 0.000 2.498 264 C HA 0.612 5.071 4.460 -0.001 0.000 0.316 264 C C 1.010 176.028 174.990 0.046 0.000 1.209 264 C CA -0.389 58.655 59.018 0.044 0.000 1.518 264 C CB 0.631 28.394 27.740 0.039 0.000 2.147 264 C HN 1.005 9.235 8.230 0.000 0.000 0.483 265 D N 2.665 123.101 120.400 0.059 0.000 2.144 265 D HA 0.052 4.691 4.640 -0.001 0.000 0.200 265 D C 1.610 178.011 176.300 0.168 0.000 0.978 265 D CA 1.747 55.823 54.000 0.126 0.000 0.833 265 D CB -0.134 40.770 40.800 0.173 0.000 0.961 265 D HN 1.099 9.469 8.370 0.000 0.000 0.470 266 A N -0.734 122.152 122.820 0.110 0.000 2.704 266 A HA -0.288 4.032 4.320 -0.001 0.000 0.299 266 A C 0.665 178.338 177.584 0.148 0.000 1.507 266 A CA 1.512 53.602 52.037 0.089 0.000 0.776 266 A CB -2.258 16.782 19.000 0.068 0.000 1.027 266 A HN 0.513 8.663 8.150 0.000 0.000 0.475 267 Y N -0.891 119.424 120.300 0.026 0.000 2.740 267 Y HA 0.435 4.984 4.550 -0.001 0.000 0.257 267 Y C 0.862 176.804 175.900 0.070 0.000 1.064 267 Y CA 1.225 59.339 58.100 0.024 0.000 1.351 267 Y CB 0.514 38.977 38.460 0.005 0.000 1.439 267 Y HN 0.677 8.957 8.280 0.000 0.000 0.488 268 H N -0.034 118.931 119.070 -0.176 0.000 2.961 268 H HA 0.303 4.859 4.556 -0.001 0.000 0.371 268 H C 0.381 175.698 175.328 -0.018 0.000 1.190 268 H CA -0.326 55.571 56.048 -0.252 0.000 1.138 268 H CB 2.176 31.722 29.762 -0.360 0.000 1.816 268 H HN 0.416 8.696 8.280 0.000 0.000 0.551 269 M N 1.208 120.629 119.600 -0.298 0.000 2.159 269 M HA -0.142 4.337 4.480 -0.001 0.000 0.263 269 M C 1.537 178.004 176.300 0.278 0.000 1.063 269 M CA 2.778 58.060 55.300 -0.030 0.000 1.110 269 M CB 0.087 32.602 32.600 -0.142 0.000 1.374 269 M HN 0.749 9.039 8.290 0.000 0.000 0.411 270 T N -5.567 109.335 114.554 0.581 0.000 2.964 270 T HA 0.213 4.562 4.350 -0.001 0.000 0.250 270 T C 0.674 175.661 174.700 0.479 0.000 0.982 270 T CA -0.369 62.085 62.100 0.589 0.000 0.959 270 T CB 0.074 69.219 68.868 0.461 0.000 1.141 270 T HN 0.031 8.271 8.240 0.000 0.000 0.494 271 S N 4.425 120.317 115.700 0.319 0.000 2.523 271 S HA 0.491 4.960 4.470 -0.001 0.000 0.275 271 S C -2.347 172.395 174.600 0.237 0.000 1.281 271 S CA -0.941 57.307 58.200 0.081 0.000 1.050 271 S CB 0.961 63.970 63.200 -0.318 0.000 0.937 271 S HN 0.405 8.715 8.310 0.000 0.000 0.492 272 P HA 0.097 4.517 4.420 0.000 0.000 0.276 272 P C -0.685 176.662 177.300 0.078 0.000 1.252 272 P CA -0.484 62.687 63.100 0.119 0.000 0.802 272 P CB 0.313 32.025 31.700 0.019 0.000 1.035 273 H N 2.767 121.737 119.070 -0.165 0.000 3.191 273 H HA 0.044 4.599 4.556 -0.001 0.000 0.261 273 H C -1.000 174.107 175.328 -0.368 0.000 1.013 273 H CA -1.264 54.473 56.048 -0.518 0.000 1.457 273 H CB 0.333 29.854 29.762 -0.402 0.000 1.535 273 H HN 0.222 8.502 8.280 0.000 0.000 0.518 274 P HA -0.251 4.169 4.420 0.000 0.000 0.218 274 P C 0.649 177.939 177.300 -0.017 0.000 1.152 274 P CA 1.400 64.451 63.100 -0.082 0.000 0.857 274 P CB 0.368 31.990 31.700 -0.130 0.000 0.787 275 E N -1.701 118.569 120.200 0.116 0.000 2.489 275 E HA 0.259 4.608 4.350 -0.001 0.000 0.193 275 E C 1.442 177.931 176.600 -0.184 0.000 1.057 275 E CA 0.684 57.072 56.400 -0.020 0.000 0.866 275 E CB -0.962 28.748 29.700 0.017 0.000 0.916 275 E HN 0.300 8.660 8.360 0.000 0.000 0.500 276 G N 1.495 110.142 108.800 -0.256 0.000 2.198 276 G HA2 -0.455 3.504 3.960 -0.001 0.000 0.260 276 G HA3 -0.455 3.504 3.960 -0.001 0.000 0.260 276 G C 0.909 175.540 174.900 -0.448 0.000 1.025 276 G CA 0.798 45.691 45.100 -0.345 0.000 0.769 276 G HN 0.415 8.705 8.290 0.000 0.000 0.507 277 Q N -0.438 118.886 119.800 -0.792 0.000 2.061 277 Q HA -0.070 4.269 4.340 -0.001 0.000 0.204 277 Q C 2.716 178.487 176.000 -0.383 0.000 0.984 277 Q CA 2.465 57.878 55.803 -0.650 0.000 0.846 277 Q CB -0.614 27.540 28.738 -0.972 0.000 0.902 277 Q HN 0.696 8.966 8.270 0.000 0.000 0.421 278 G N 0.023 108.609 108.800 -0.357 0.000 2.402 278 G HA2 -0.181 3.779 3.960 -0.001 0.000 0.216 278 G HA3 -0.181 3.779 3.960 -0.001 0.000 0.216 278 G C 1.461 176.275 174.900 -0.144 0.000 1.162 278 G CA 0.742 45.742 45.100 -0.167 0.000 0.777 278 G HN 0.495 8.785 8.290 0.000 0.000 0.539 279 A N 0.784 123.451 122.820 -0.256 0.000 1.933 279 A HA 0.027 4.346 4.320 -0.001 0.000 0.218 279 A C 2.382 179.914 177.584 -0.087 0.000 1.175 279 A CA 1.258 53.154 52.037 -0.235 0.000 0.628 279 A CB -0.354 18.230 19.000 -0.694 0.000 0.814 279 A HN 0.381 8.531 8.150 0.000 0.000 0.444 280 I N -0.619 119.870 120.570 -0.135 0.000 2.179 280 I HA -0.284 3.886 4.170 -0.001 0.000 0.242 280 I C 2.445 178.531 176.117 -0.051 0.000 1.088 280 I CA 1.745 62.996 61.300 -0.082 0.000 1.357 280 I CB -0.239 37.697 38.000 -0.107 0.000 1.051 280 I HN 0.275 8.485 8.210 0.000 0.000 0.409 281 K N 0.774 121.135 120.400 -0.064 0.000 2.097 281 K HA -0.091 4.229 4.320 -0.001 0.000 0.205 281 K C 2.232 178.819 176.600 -0.022 0.000 1.050 281 K CA 1.353 57.615 56.287 -0.042 0.000 0.938 281 K CB -0.256 32.216 32.500 -0.048 0.000 0.718 281 K HN 0.304 8.554 8.250 0.000 0.000 0.442 282 A N 1.387 124.205 122.820 -0.003 0.000 1.898 282 A HA -0.138 4.182 4.320 -0.001 0.000 0.216 282 A C 2.131 179.731 177.584 0.025 0.000 1.181 282 A CA 1.254 53.302 52.037 0.018 0.000 0.620 282 A CB -0.577 18.476 19.000 0.088 0.000 0.819 282 A HN 0.160 8.310 8.150 0.000 0.000 0.442 283 I N -0.184 120.414 120.570 0.046 0.000 2.163 283 I HA -0.301 3.868 4.170 -0.001 0.000 0.243 283 I C 2.433 178.554 176.117 0.007 0.000 1.085 283 I CA 1.663 62.986 61.300 0.038 0.000 1.347 283 I CB -0.295 37.734 38.000 0.049 0.000 1.044 283 I HN 0.276 8.486 8.210 0.000 0.000 0.408 284 K N 0.659 121.057 120.400 -0.003 0.000 2.103 284 K HA -0.164 4.156 4.320 -0.001 0.000 0.207 284 K C 2.144 178.737 176.600 -0.012 0.000 1.048 284 K CA 1.338 57.618 56.287 -0.011 0.000 0.930 284 K CB -0.350 32.140 32.500 -0.016 0.000 0.716 284 K HN 0.329 8.579 8.250 0.000 0.000 0.444 285 L N 0.645 121.858 121.223 -0.015 0.000 2.046 285 L HA -0.185 4.154 4.340 -0.001 0.000 0.208 285 L C 2.653 179.520 176.870 -0.005 0.000 1.077 285 L CA 1.106 55.936 54.840 -0.017 0.000 0.747 285 L CB -0.593 41.439 42.059 -0.044 0.000 0.896 285 L HN 0.190 8.420 8.230 0.000 0.000 0.432 286 A N 0.233 123.048 122.820 -0.008 0.000 1.883 286 A HA -0.177 4.143 4.320 -0.001 0.000 0.217 286 A C 2.220 179.798 177.584 -0.010 0.000 1.186 286 A CA 1.524 53.560 52.037 -0.002 0.000 0.624 286 A CB -0.732 18.262 19.000 -0.009 0.000 0.822 286 A HN 0.380 8.530 8.150 0.000 0.000 0.444 287 L N -0.753 120.458 121.223 -0.019 0.000 2.093 287 L HA -0.180 4.159 4.340 -0.001 0.000 0.208 287 L C 2.644 179.496 176.870 -0.029 0.000 1.085 287 L CA 1.783 56.600 54.840 -0.039 0.000 0.755 287 L CB -0.638 41.395 42.059 -0.044 0.000 0.904 287 L HN 0.678 8.908 8.230 0.000 0.000 0.435 288 E N 0.864 121.059 120.200 -0.009 0.000 2.106 288 E HA -0.278 4.072 4.350 -0.001 0.000 0.192 288 E C 2.064 178.680 176.600 0.027 0.000 0.984 288 E CA 1.270 57.672 56.400 0.003 0.000 0.806 288 E CB 0.068 29.772 29.700 0.007 0.000 0.750 288 E HN 0.521 8.881 8.360 0.000 0.000 0.458 289 E N 0.003 120.232 120.200 0.049 0.000 2.072 289 E HA -0.121 4.229 4.350 -0.001 0.000 0.190 289 E C 1.832 178.487 176.600 0.091 0.000 0.982 289 E CA 0.946 57.405 56.400 0.099 0.000 0.803 289 E CB -0.142 29.658 29.700 0.166 0.000 0.755 289 E HN 0.346 8.706 8.360 0.000 0.000 0.453 290 A N 0.673 123.521 122.820 0.048 0.000 2.168 290 A HA -0.091 4.228 4.320 -0.001 0.000 0.215 290 A C 0.422 178.005 177.584 -0.002 0.000 1.152 290 A CA 0.946 53.002 52.037 0.031 0.000 0.716 290 A CB -0.371 18.616 19.000 -0.021 0.000 0.794 290 A HN 0.445 8.595 8.150 0.000 0.000 0.465 291 E N -1.010 119.183 120.200 -0.012 0.000 2.389 291 E HA -0.208 4.141 4.350 -0.001 0.000 0.243 291 E C -0.175 176.375 176.600 -0.083 0.000 1.154 291 E CA 0.754 57.138 56.400 -0.026 0.000 0.723 291 E CB -1.936 27.766 29.700 0.004 0.000 1.261 291 E HN 0.896 9.257 8.360 0.000 0.000 0.390 292 I N -2.935 117.548 120.570 -0.145 0.000 2.740 292 I HA 0.605 4.775 4.170 -0.001 0.000 0.303 292 I C 0.579 176.603 176.117 -0.156 0.000 1.044 292 I CA -1.042 60.115 61.300 -0.239 0.000 1.064 292 I CB 2.030 39.705 38.000 -0.542 0.000 1.249 292 I HN -0.005 8.205 8.210 0.000 0.000 0.433 293 S N 2.578 118.198 115.700 -0.133 0.000 2.645 293 S HA 0.490 4.960 4.470 -0.001 0.000 0.266 293 S C -1.982 172.571 174.600 -0.078 0.000 1.258 293 S CA -1.072 57.080 58.200 -0.080 0.000 0.990 293 S CB 0.948 64.117 63.200 -0.051 0.000 0.967 293 S HN 0.588 8.898 8.310 0.000 0.000 0.556 294 P HA -0.035 4.385 4.420 0.000 0.000 0.218 294 P C 0.854 178.144 177.300 -0.018 0.000 1.149 294 P CA 1.093 64.175 63.100 -0.029 0.000 0.817 294 P CB -0.060 31.631 31.700 -0.017 0.000 0.785 295 E N -0.423 119.767 120.200 -0.016 0.000 2.204 295 E HA -0.175 4.175 4.350 -0.001 0.000 0.195 295 E C 1.946 178.553 176.600 0.013 0.000 0.990 295 E CA 0.938 57.339 56.400 0.001 0.000 0.821 295 E CB -0.670 29.031 29.700 0.002 0.000 0.750 295 E HN 0.423 8.783 8.360 0.000 0.000 0.477 296 Q N 0.067 119.859 119.800 -0.014 0.000 2.436 296 Q HA 0.008 4.348 4.340 -0.001 0.000 0.209 296 Q C -0.125 175.918 176.000 0.071 0.000 0.965 296 Q CA 0.202 56.009 55.803 0.007 0.000 0.910 296 Q CB 0.396 29.051 28.738 -0.138 0.000 0.980 296 Q HN 0.110 8.380 8.270 0.000 0.000 0.491 297 V N 1.439 121.379 119.914 0.043 0.000 2.415 297 V HA 0.052 4.172 4.120 -0.001 0.000 0.267 297 V C 0.783 176.952 176.094 0.125 0.000 1.042 297 V CA 0.353 62.711 62.300 0.096 0.000 1.000 297 V CB 0.810 32.665 31.823 0.053 0.000 1.015 297 V HN 0.203 8.393 8.190 0.000 0.000 0.478 298 A N 4.899 127.828 122.820 0.181 0.000 2.267 298 A HA 0.310 4.629 4.320 -0.001 0.000 0.213 298 A C 0.283 178.010 177.584 0.237 0.000 1.192 298 A CA 0.401 52.541 52.037 0.172 0.000 0.851 298 A CB 0.168 19.263 19.000 0.158 0.000 0.881 298 A HN 0.808 8.958 8.150 0.000 0.000 0.494 299 Y N -1.747 118.600 120.300 0.079 0.000 2.521 299 Y HA 0.476 5.026 4.550 -0.001 0.000 0.328 299 Y C -2.009 173.942 175.900 0.084 0.000 1.151 299 Y CA -1.781 56.358 58.100 0.064 0.000 1.054 299 Y CB 1.171 39.671 38.460 0.067 0.000 1.338 299 Y HN -0.124 8.156 8.280 0.000 0.000 0.453 300 V N 6.188 125.800 119.914 -0.504 0.000 2.443 300 V HA 0.335 4.454 4.120 -0.001 0.000 0.293 300 V C -0.480 175.094 176.094 -0.866 0.000 1.021 300 V CA -1.045 60.951 62.300 -0.507 0.000 0.848 300 V CB 1.584 33.322 31.823 -0.141 0.000 0.998 300 V HN 0.770 8.960 8.190 0.000 0.000 0.424 301 N N 4.010 122.238 118.700 -0.786 0.000 2.437 301 N HA 0.391 5.130 4.740 -0.001 0.000 0.243 301 N C 0.068 175.520 175.510 -0.097 0.000 1.041 301 N CA -0.126 52.691 53.050 -0.387 0.000 0.940 301 N CB 1.661 40.059 38.487 -0.148 0.000 1.133 301 N HN 0.828 9.208 8.380 0.000 0.000 0.506 302 A N 2.744 125.587 122.820 0.037 0.000 2.366 302 A HA 0.046 4.365 4.320 -0.001 0.000 0.249 302 A C 1.185 178.823 177.584 0.090 0.000 1.084 302 A CA -0.152 51.972 52.037 0.145 0.000 0.794 302 A CB 0.254 19.497 19.000 0.404 0.000 1.034 302 A HN 0.915 9.065 8.150 0.000 0.000 0.491 303 H N 1.278 120.307 119.070 -0.068 0.000 2.326 303 H HA 0.051 4.606 4.556 -0.001 0.000 0.301 303 H C 1.572 176.807 175.328 -0.155 0.000 1.081 303 H CA 1.598 57.537 56.048 -0.183 0.000 1.334 303 H CB -0.628 28.977 29.762 -0.261 0.000 1.385 303 H HN 1.177 9.457 8.280 0.000 0.000 0.504 304 G N 0.731 109.421 108.800 -0.184 0.000 2.216 304 G HA2 -0.320 3.639 3.960 -0.001 0.000 0.263 304 G HA3 -0.320 3.639 3.960 -0.001 0.000 0.263 304 G C 1.059 175.703 174.900 -0.427 0.000 0.837 304 G CA 0.985 45.858 45.100 -0.377 0.000 1.227 304 G HN 0.776 9.066 8.290 0.000 0.000 0.407 305 T N -2.573 111.656 114.554 -0.543 0.000 3.085 305 T HA 0.317 4.667 4.350 -0.001 0.000 0.263 305 T C 1.460 176.048 174.700 -0.186 0.000 1.127 305 T CA 1.144 62.957 62.100 -0.479 0.000 1.103 305 T CB 0.249 68.737 68.868 -0.635 0.000 0.921 305 T HN 1.680 9.920 8.240 0.000 0.000 0.510 306 S N 0.668 116.247 115.700 -0.201 0.000 3.461 306 S HA -0.131 4.338 4.470 -0.001 0.000 0.282 306 S C 0.279 174.859 174.600 -0.033 0.000 1.262 306 S CA 0.624 58.757 58.200 -0.111 0.000 0.853 306 S CB -2.116 61.054 63.200 -0.049 0.000 1.048 306 S HN 1.234 9.544 8.310 0.000 0.000 0.644 307 T N -1.403 113.135 114.554 -0.027 0.000 2.925 307 T HA 0.699 5.048 4.350 -0.001 0.000 0.285 307 T C -1.619 173.092 174.700 0.018 0.000 1.021 307 T CA -1.620 60.506 62.100 0.044 0.000 1.042 307 T CB 1.688 70.630 68.868 0.123 0.000 1.037 307 T HN -0.090 8.150 8.240 0.000 0.000 0.481 308 P HA -0.033 4.387 4.420 0.000 0.000 0.215 308 P C 1.696 179.036 177.300 0.068 0.000 1.157 308 P CA 1.593 64.733 63.100 0.066 0.000 0.868 308 P CB -0.237 31.505 31.700 0.069 0.000 0.788 309 A N -0.631 122.222 122.820 0.055 0.000 1.902 309 A HA -0.249 4.071 4.320 -0.001 0.000 0.217 309 A C 2.260 179.866 177.584 0.035 0.000 1.181 309 A CA 2.189 54.250 52.037 0.041 0.000 0.623 309 A CB -1.827 17.201 19.000 0.046 0.000 0.818 309 A HN 0.188 8.338 8.150 0.000 0.000 0.443 310 N N -0.177 118.542 118.700 0.032 0.000 2.025 310 N HA -0.197 4.543 4.740 -0.001 0.000 0.194 310 N C 1.524 177.032 175.510 -0.002 0.000 1.044 310 N CA 2.063 55.127 53.050 0.023 0.000 0.851 310 N CB -0.277 38.216 38.487 0.009 0.000 1.036 310 N HN 0.500 8.880 8.380 0.000 0.000 0.422 311 E N 0.093 120.246 120.200 -0.078 0.000 2.204 311 E HA -0.133 4.216 4.350 -0.001 0.000 0.194 311 E C 1.728 178.416 176.600 0.148 0.000 0.989 311 E CA 0.676 57.015 56.400 -0.101 0.000 0.824 311 E CB -0.033 29.390 29.700 -0.461 0.000 0.756 311 E HN 0.395 8.755 8.360 0.000 0.000 0.477 312 K N 0.133 120.638 120.400 0.176 0.000 2.002 312 K HA -0.122 4.198 4.320 -0.001 0.000 0.209 312 K C 2.156 178.828 176.600 0.119 0.000 1.048 312 K CA 1.613 58.044 56.287 0.239 0.000 0.930 312 K CB -0.414 32.143 32.500 0.096 0.000 0.714 312 K HN 0.210 8.460 8.250 0.000 0.000 0.438 313 G N 0.693 109.513 108.800 0.034 0.000 2.402 313 G HA2 -0.288 3.672 3.960 -0.001 0.000 0.216 313 G HA3 -0.288 3.672 3.960 -0.001 0.000 0.216 313 G C 1.373 176.247 174.900 -0.042 0.000 1.162 313 G CA 0.940 46.017 45.100 -0.038 0.000 0.777 313 G HN 0.538 8.828 8.290 0.000 0.000 0.539 314 E N 0.242 120.458 120.200 0.027 0.000 2.047 314 E HA -0.137 4.212 4.350 -0.001 0.000 0.191 314 E C 2.604 179.320 176.600 0.194 0.000 0.987 314 E CA 1.232 57.705 56.400 0.122 0.000 0.799 314 E CB -0.265 29.612 29.700 0.296 0.000 0.752 314 E HN 0.351 8.711 8.360 0.000 0.000 0.449 315 S N -0.547 115.314 115.700 0.268 0.000 2.368 315 S HA -0.121 4.349 4.470 -0.001 0.000 0.225 315 S C 2.005 176.677 174.600 0.120 0.000 1.030 315 S CA 1.551 59.888 58.200 0.228 0.000 0.999 315 S CB -0.707 62.654 63.200 0.267 0.000 0.844 315 S HN 0.472 8.782 8.310 0.000 0.000 0.459 316 G N 0.821 109.677 108.800 0.094 0.000 2.446 316 G HA2 -0.092 3.868 3.960 -0.001 0.000 0.217 316 G HA3 -0.092 3.868 3.960 -0.001 0.000 0.217 316 G C 1.707 176.611 174.900 0.006 0.000 1.168 316 G CA 1.071 46.195 45.100 0.041 0.000 0.771 316 G HN 0.722 9.012 8.290 0.000 0.000 0.551 317 A N 0.626 123.436 122.820 -0.016 0.000 1.877 317 A HA 0.063 4.382 4.320 -0.001 0.000 0.216 317 A C 2.431 180.022 177.584 0.011 0.000 1.186 317 A CA 1.327 53.342 52.037 -0.037 0.000 0.620 317 A CB -0.382 18.560 19.000 -0.097 0.000 0.822 317 A HN 0.373 8.523 8.150 0.000 0.000 0.443 318 I N -0.475 120.126 120.570 0.052 0.000 2.163 318 I HA -0.237 3.933 4.170 -0.001 0.000 0.243 318 I C 2.387 178.522 176.117 0.030 0.000 1.085 318 I CA 1.289 62.623 61.300 0.056 0.000 1.347 318 I CB -0.300 37.746 38.000 0.077 0.000 1.044 318 I HN 0.163 8.373 8.210 0.000 0.000 0.408 319 V N 0.956 120.887 119.914 0.029 0.000 2.343 319 V HA -0.318 3.801 4.120 -0.001 0.000 0.247 319 V C 2.687 178.786 176.094 0.009 0.000 1.051 319 V CA 2.021 64.332 62.300 0.018 0.000 1.036 319 V CB -1.025 30.812 31.823 0.023 0.000 0.654 319 V HN 0.517 8.707 8.190 0.000 0.000 0.451 320 A N -0.435 122.387 122.820 0.003 0.000 1.940 320 A HA -0.149 4.171 4.320 -0.001 0.000 0.219 320 A C 2.315 179.894 177.584 -0.008 0.000 1.176 320 A CA 2.283 54.315 52.037 -0.008 0.000 0.631 320 A CB -0.480 18.506 19.000 -0.024 0.000 0.814 320 A HN 0.384 8.534 8.150 0.000 0.000 0.446 321 V N -1.010 118.901 119.914 -0.004 0.000 2.426 321 V HA -0.002 4.117 4.120 -0.001 0.000 0.242 321 V C 2.093 178.187 176.094 -0.000 0.000 1.036 321 V CA 1.510 63.808 62.300 -0.004 0.000 1.044 321 V CB -0.425 31.398 31.823 -0.001 0.000 0.688 321 V HN 0.510 8.700 8.190 0.000 0.000 0.462 322 L N -0.563 120.664 121.223 0.006 0.000 2.701 322 L HA 0.615 4.955 4.340 -0.001 0.000 0.238 322 L C 1.023 177.898 176.870 0.008 0.000 1.106 322 L CA 0.613 55.457 54.840 0.008 0.000 0.898 322 L CB 0.174 42.242 42.059 0.015 0.000 1.188 322 L HN 0.504 8.734 8.230 0.000 0.000 0.508 323 G N 0.907 109.711 108.800 0.007 0.000 2.566 323 G HA2 -0.193 3.766 3.960 -0.001 0.000 0.599 323 G HA3 -0.193 3.766 3.960 -0.001 0.000 0.599 323 G C -0.123 174.780 174.900 0.006 0.000 1.292 323 G CA -0.406 44.698 45.100 0.006 0.000 0.922 323 G HN 0.103 8.393 8.290 0.000 0.000 0.514 324 K N 0.083 120.485 120.400 0.004 0.000 2.404 324 K HA 0.427 4.746 4.320 -0.001 0.000 0.194 324 K C 2.242 178.840 176.600 -0.005 0.000 1.023 324 K CA 0.848 57.135 56.287 -0.001 0.000 1.094 324 K CB 0.556 33.056 32.500 0.001 0.000 0.841 324 K HN 0.650 8.900 8.250 0.000 0.000 0.523 325 A N 1.050 123.870 122.820 0.001 0.000 1.997 325 A HA 0.050 4.369 4.320 -0.001 0.000 0.212 325 A C 0.949 178.538 177.584 0.007 0.000 1.178 325 A CA -0.068 51.970 52.037 0.001 0.000 0.698 325 A CB 0.169 19.172 19.000 0.005 0.000 0.842 325 A HN 0.112 8.262 8.150 0.000 0.000 0.458 326 V N 3.017 122.940 119.914 0.016 0.000 2.557 326 V HA 0.163 4.282 4.120 -0.001 0.000 0.301 326 V C -2.418 173.697 176.094 0.035 0.000 1.026 326 V CA -1.705 60.616 62.300 0.035 0.000 1.137 326 V CB 0.682 32.529 31.823 0.040 0.000 0.917 326 V HN 0.267 8.457 8.190 0.000 0.000 0.484 327 P HA 0.255 4.675 4.420 0.000 0.000 0.271 327 P C -1.088 176.298 177.300 0.144 0.000 1.216 327 P CA 0.080 63.224 63.100 0.073 0.000 0.776 327 P CB 0.899 32.643 31.700 0.073 0.000 0.881 328 V N 2.534 122.487 119.914 0.065 0.000 2.588 328 V HA 0.628 4.747 4.120 -0.001 0.000 0.304 328 V C 0.012 176.155 176.094 0.082 0.000 1.042 328 V CA -0.399 61.920 62.300 0.031 0.000 0.877 328 V CB 1.863 33.594 31.823 -0.154 0.000 0.996 328 V HN 0.778 8.968 8.190 0.000 0.000 0.425 329 S N 2.248 118.091 115.700 0.238 0.000 2.556 329 S HA 0.775 5.244 4.470 -0.001 0.000 0.271 329 S C -0.833 173.952 174.600 0.310 0.000 1.135 329 S CA -0.673 57.690 58.200 0.272 0.000 0.858 329 S CB 2.086 65.453 63.200 0.278 0.000 1.114 329 S HN 0.830 9.140 8.310 0.000 0.000 0.468 330 S N 0.766 116.664 115.700 0.331 0.000 2.478 330 S HA 0.525 4.994 4.470 -0.001 0.000 0.312 330 S C 0.788 175.527 174.600 0.232 0.000 1.094 330 S CA -0.090 58.259 58.200 0.249 0.000 1.081 330 S CB 0.901 64.217 63.200 0.194 0.000 1.007 330 S HN 1.054 9.364 8.310 0.000 0.000 0.475 331 T N 2.154 116.830 114.554 0.203 0.000 3.129 331 T HA 0.206 4.555 4.350 -0.001 0.000 0.251 331 T C 1.119 175.952 174.700 0.221 0.000 1.117 331 T CA 0.037 62.284 62.100 0.245 0.000 1.034 331 T CB -0.198 68.733 68.868 0.104 0.000 0.968 331 T HN 0.638 8.878 8.240 0.000 0.000 0.526 332 K N 1.894 122.365 120.400 0.117 0.000 2.442 332 K HA -0.026 4.293 4.320 -0.001 0.000 0.198 332 K C 2.404 179.048 176.600 0.074 0.000 1.042 332 K CA 1.127 57.454 56.287 0.067 0.000 0.958 332 K CB -0.141 32.321 32.500 -0.063 0.000 0.766 332 K HN 0.596 8.847 8.250 0.000 0.000 0.474 333 S N -0.013 115.740 115.700 0.087 0.000 2.447 333 S HA -0.078 4.391 4.470 -0.001 0.000 0.233 333 S C 1.569 176.100 174.600 -0.114 0.000 1.006 333 S CA 0.748 58.932 58.200 -0.026 0.000 0.957 333 S CB -0.231 62.926 63.200 -0.071 0.000 0.773 333 S HN 0.177 8.487 8.310 0.000 0.000 0.507 334 F N 2.070 122.003 119.950 -0.028 0.000 2.419 334 F HA 0.160 4.687 4.527 -0.001 0.000 0.283 334 F C 2.897 178.680 175.800 -0.027 0.000 1.044 334 F CA 1.055 59.022 58.000 -0.054 0.000 1.376 334 F CB -0.600 38.327 39.000 -0.122 0.000 1.131 334 F HN 0.306 8.606 8.300 0.000 0.000 0.585 335 T N -2.187 112.501 114.554 0.223 0.000 3.065 335 T HA 0.498 4.848 4.350 -0.001 0.000 0.252 335 T C 1.147 175.929 174.700 0.138 0.000 1.099 335 T CA 0.447 62.646 62.100 0.166 0.000 1.063 335 T CB -0.421 68.561 68.868 0.190 0.000 0.948 335 T HN 0.491 8.731 8.240 0.000 0.000 0.506 336 G N 1.269 110.144 108.800 0.124 0.000 2.782 336 G HA2 -0.159 3.800 3.960 -0.001 0.000 0.228 336 G HA3 -0.159 3.800 3.960 -0.001 0.000 0.228 336 G C -0.800 174.199 174.900 0.165 0.000 1.372 336 G CA -0.323 44.860 45.100 0.138 0.000 0.862 336 G HN 0.853 9.143 8.290 0.000 0.000 0.547 337 H N 0.265 119.362 119.070 0.044 0.000 2.705 337 H HA 0.560 5.116 4.556 -0.001 0.000 0.291 337 H C 1.080 176.382 175.328 -0.043 0.000 1.085 337 H CA -1.038 54.952 56.048 -0.097 0.000 1.357 337 H CB 0.893 30.417 29.762 -0.396 0.000 1.419 337 H HN 0.356 8.636 8.280 0.000 0.000 0.462 338 L N 6.539 127.897 121.223 0.224 0.000 2.612 338 L HA 0.074 4.413 4.340 -0.001 0.000 0.230 338 L C 1.296 178.167 176.870 0.003 0.000 1.140 338 L CA 0.508 55.407 54.840 0.099 0.000 0.896 338 L CB -0.980 41.159 42.059 0.134 0.000 1.065 338 L HN 0.777 9.007 8.230 0.000 0.000 0.447 339 L N -1.394 119.683 121.223 -0.243 0.000 5.531 339 L HA -0.406 3.933 4.340 -0.001 0.000 0.053 339 L C 1.853 178.739 176.870 0.026 0.000 2.831 339 L CA 1.277 55.940 54.840 -0.295 0.000 1.552 339 L CB -1.819 40.102 42.059 -0.230 0.000 2.889 339 L HN 0.253 8.483 8.230 0.000 0.000 0.964 340 G N -1.109 107.726 108.800 0.058 0.000 2.498 340 G HA2 0.086 4.045 3.960 -0.001 0.000 0.219 340 G HA3 0.086 4.045 3.960 -0.001 0.000 0.219 340 G C 1.136 176.097 174.900 0.101 0.000 1.119 340 G CA 1.145 46.299 45.100 0.091 0.000 0.766 340 G HN 0.861 9.151 8.290 0.000 0.000 0.552 341 A N 0.076 122.961 122.820 0.109 0.000 2.308 341 A HA 0.693 5.012 4.320 -0.001 0.000 0.217 341 A C 2.469 180.119 177.584 0.110 0.000 1.216 341 A CA 1.189 53.294 52.037 0.113 0.000 0.864 341 A CB -0.127 18.951 19.000 0.130 0.000 0.902 341 A HN 0.477 8.627 8.150 0.000 0.000 0.499 342 A N 0.297 123.197 122.820 0.133 0.000 1.873 342 A HA 0.011 4.331 4.320 -0.001 0.000 0.218 342 A C 2.357 180.007 177.584 0.109 0.000 1.193 342 A CA 2.084 54.211 52.037 0.150 0.000 0.629 342 A CB -1.386 17.748 19.000 0.224 0.000 0.826 342 A HN 0.756 8.905 8.150 0.000 0.000 0.447 343 G N -0.785 108.069 108.800 0.091 0.000 2.440 343 G HA2 -0.022 3.938 3.960 -0.001 0.000 0.218 343 G HA3 -0.022 3.938 3.960 -0.001 0.000 0.218 343 G C 1.739 176.678 174.900 0.065 0.000 1.154 343 G CA 1.641 46.782 45.100 0.068 0.000 0.767 343 G HN 0.859 9.149 8.290 0.000 0.000 0.552 344 A N 0.520 123.373 122.820 0.056 0.000 1.873 344 A HA 0.062 4.381 4.320 -0.001 0.000 0.215 344 A C 2.737 180.313 177.584 -0.013 0.000 1.186 344 A CA 2.593 54.648 52.037 0.030 0.000 0.616 344 A CB -0.900 18.122 19.000 0.037 0.000 0.823 344 A HN 0.945 9.095 8.150 0.000 0.000 0.442 345 V N -1.727 118.191 119.914 0.008 0.000 2.427 345 V HA -0.204 3.916 4.120 -0.001 0.000 0.248 345 V C 1.809 177.925 176.094 0.036 0.000 1.051 345 V CA 2.434 64.715 62.300 -0.031 0.000 1.048 345 V CB -1.069 30.779 31.823 0.042 0.000 0.666 345 V HN 0.592 8.782 8.190 0.000 0.000 0.456 346 E N 1.095 121.341 120.200 0.078 0.000 2.268 346 E HA 0.012 4.362 4.350 -0.001 0.000 0.195 346 E C 2.318 178.922 176.600 0.007 0.000 0.995 346 E CA 1.169 57.621 56.400 0.088 0.000 0.836 346 E CB -0.349 29.406 29.700 0.092 0.000 0.763 346 E HN 0.764 9.124 8.360 0.000 0.000 0.491 347 A N 0.976 123.768 122.820 -0.046 0.000 1.897 347 A HA -0.130 4.190 4.320 -0.001 0.000 0.215 347 A C 2.131 179.475 177.584 -0.399 0.000 1.181 347 A CA 0.830 52.737 52.037 -0.217 0.000 0.620 347 A CB -0.414 18.572 19.000 -0.023 0.000 0.821 347 A HN 0.134 8.284 8.150 0.000 0.000 0.443 348 I N -0.336 120.039 120.570 -0.325 0.000 2.226 348 I HA -0.225 3.944 4.170 -0.001 0.000 0.245 348 I C 2.347 178.359 176.117 -0.175 0.000 1.100 348 I CA 1.109 62.113 61.300 -0.492 0.000 1.374 348 I CB -0.377 37.290 38.000 -0.554 0.000 1.057 348 I HN 0.149 8.359 8.210 0.000 0.000 0.413 349 V N 0.653 120.622 119.914 0.091 0.000 2.255 349 V HA -0.316 3.803 4.120 -0.001 0.000 0.247 349 V C 2.528 178.728 176.094 0.177 0.000 1.051 349 V CA 2.632 65.102 62.300 0.283 0.000 1.018 349 V CB -1.052 30.938 31.823 0.278 0.000 0.641 349 V HN 0.479 8.669 8.190 0.000 0.000 0.445 350 T N 0.251 114.831 114.554 0.043 0.000 2.720 350 T HA -0.156 4.194 4.350 -0.001 0.000 0.268 350 T C 1.809 176.456 174.700 -0.089 0.000 1.037 350 T CA 1.925 64.046 62.100 0.035 0.000 1.144 350 T CB -0.321 68.453 68.868 -0.158 0.000 0.864 350 T HN 0.354 8.595 8.240 0.000 0.000 0.444 351 I N 0.834 121.227 120.570 -0.294 0.000 2.252 351 I HA -0.121 4.048 4.170 -0.001 0.000 0.245 351 I C 2.750 178.830 176.117 -0.061 0.000 1.102 351 I CA 1.137 62.309 61.300 -0.214 0.000 1.385 351 I CB -0.317 37.502 38.000 -0.301 0.000 1.064 351 I HN 0.175 8.385 8.210 0.000 0.000 0.414 352 E N 0.942 121.123 120.200 -0.033 0.000 2.153 352 E HA -0.192 4.158 4.350 -0.001 0.000 0.194 352 E C 2.339 178.859 176.600 -0.134 0.000 0.988 352 E CA 1.348 57.738 56.400 -0.016 0.000 0.811 352 E CB -0.172 29.584 29.700 0.093 0.000 0.746 352 E HN 0.516 8.876 8.360 0.000 0.000 0.466 353 A N 1.225 124.076 122.820 0.052 0.000 1.902 353 A HA -0.154 4.166 4.320 -0.001 0.000 0.217 353 A C 2.253 179.863 177.584 0.043 0.000 1.181 353 A CA 1.383 53.486 52.037 0.111 0.000 0.623 353 A CB -0.457 18.596 19.000 0.088 0.000 0.818 353 A HN 0.142 8.292 8.150 0.000 0.000 0.443 354 M N -1.212 118.409 119.600 0.035 0.000 2.175 354 M HA -0.121 4.358 4.480 -0.001 0.000 0.264 354 M C 2.307 178.594 176.300 -0.022 0.000 1.063 354 M CA 1.373 56.690 55.300 0.027 0.000 1.119 354 M CB -0.320 32.304 32.600 0.039 0.000 1.377 354 M HN 0.338 8.628 8.290 0.000 0.000 0.415 355 R N -0.817 119.641 120.500 -0.071 0.000 2.148 355 R HA -0.059 4.280 4.340 -0.001 0.000 0.223 355 R C 1.318 177.425 176.300 -0.323 0.000 1.088 355 R CA 0.774 56.767 56.100 -0.179 0.000 0.985 355 R CB -0.147 30.027 30.300 -0.209 0.000 0.880 355 R HN 0.529 8.799 8.270 0.000 0.000 0.451 356 H N 0.230 119.136 119.070 -0.272 0.000 2.549 356 H HA 0.177 4.732 4.556 -0.001 0.000 0.279 356 H C -0.119 175.207 175.328 -0.003 0.000 1.018 356 H CA -0.199 55.707 56.048 -0.237 0.000 1.175 356 H CB 0.387 29.829 29.762 -0.533 0.000 1.485 356 H HN 0.178 8.458 8.280 0.000 0.000 0.543 357 N N 0.513 119.274 118.700 0.102 0.000 2.714 357 N HA -0.244 4.496 4.740 -0.001 0.000 0.252 357 N C -0.895 174.773 175.510 0.264 0.000 1.014 357 N CA 0.873 54.000 53.050 0.128 0.000 0.735 357 N CB -1.566 36.977 38.487 0.093 0.000 0.924 357 N HN 0.295 8.675 8.380 0.000 0.000 0.540 358 F N -0.451 119.541 119.950 0.071 0.000 2.605 358 F HA 0.321 4.847 4.527 -0.001 0.000 0.320 358 F C -0.792 175.012 175.800 0.006 0.000 1.159 358 F CA -0.737 57.322 58.000 0.098 0.000 0.999 358 F CB 1.386 40.558 39.000 0.286 0.000 1.258 358 F HN -0.192 8.108 8.300 0.000 0.000 0.464 359 V N 7.716 127.271 119.914 -0.598 0.000 2.389 359 V HA 0.324 4.443 4.120 -0.001 0.000 0.264 359 V C -2.035 173.649 176.094 -0.685 0.000 1.049 359 V CA -1.638 60.238 62.300 -0.708 0.000 0.932 359 V CB 0.711 32.177 31.823 -0.595 0.000 1.011 359 V HN 0.512 8.702 8.190 0.000 0.000 0.475 360 P HA 0.163 4.583 4.420 0.000 0.000 0.271 360 P C -0.058 177.185 177.300 -0.094 0.000 1.218 360 P CA -0.300 62.686 63.100 -0.191 0.000 0.780 360 P CB 0.497 32.063 31.700 -0.223 0.000 0.901 361 M N 0.288 119.900 119.600 0.020 0.000 2.163 361 M HA 0.325 4.805 4.480 -0.001 0.000 0.305 361 M C -0.488 175.964 176.300 0.253 0.000 1.166 361 M CA 0.448 55.808 55.300 0.099 0.000 1.132 361 M CB 0.022 32.685 32.600 0.106 0.000 1.413 361 M HN 0.049 8.339 8.290 0.000 0.000 0.478 362 T N 2.406 117.087 114.554 0.211 0.000 2.723 362 T HA 0.555 4.904 4.350 -0.001 0.000 0.297 362 T C 0.189 174.949 174.700 0.101 0.000 0.925 362 T CA -0.484 61.745 62.100 0.214 0.000 1.030 362 T CB 0.406 69.420 68.868 0.244 0.000 0.905 362 T HN 0.726 8.966 8.240 0.000 0.000 0.502 363 A N 2.687 125.448 122.820 -0.098 0.000 2.346 363 A HA 0.665 4.984 4.320 -0.001 0.000 0.252 363 A C 1.674 179.156 177.584 -0.171 0.000 1.089 363 A CA 0.155 52.013 52.037 -0.298 0.000 0.797 363 A CB -0.569 17.875 19.000 -0.927 0.000 1.047 363 A HN 1.352 9.502 8.150 0.000 0.000 0.494 364 G N -0.228 108.485 108.800 -0.145 0.000 2.674 364 G HA2 -0.286 3.674 3.960 -0.001 0.000 0.236 364 G HA3 -0.286 3.674 3.960 -0.001 0.000 0.236 364 G C 0.743 175.608 174.900 -0.059 0.000 1.178 364 G CA 1.023 46.064 45.100 -0.098 0.000 0.721 364 G HN 1.339 9.629 8.290 0.000 0.000 0.515 365 T N 1.505 116.030 114.554 -0.048 0.000 2.928 365 T HA 0.440 4.790 4.350 -0.001 0.000 0.305 365 T C 1.445 176.056 174.700 -0.148 0.000 1.035 365 T CA 1.197 63.231 62.100 -0.111 0.000 1.145 365 T CB 1.161 69.969 68.868 -0.101 0.000 0.963 365 T HN 1.254 9.494 8.240 0.000 0.000 0.545 366 S N 1.143 116.697 115.700 -0.244 0.000 2.648 366 S HA 0.267 4.736 4.470 -0.001 0.000 0.270 366 S C 0.082 174.527 174.600 -0.258 0.000 1.082 366 S CA -0.587 57.527 58.200 -0.143 0.000 1.116 366 S CB 0.519 63.706 63.200 -0.023 0.000 1.040 366 S HN 0.702 9.012 8.310 0.000 0.000 0.572 367 E N 1.124 121.119 120.200 -0.342 0.000 2.313 367 E HA 0.490 4.840 4.350 -0.001 0.000 0.280 367 E C -1.606 174.830 176.600 -0.272 0.000 0.898 367 E CA -0.455 55.792 56.400 -0.255 0.000 0.803 367 E CB 2.246 31.882 29.700 -0.107 0.000 1.286 367 E HN 0.136 8.496 8.360 0.000 0.000 0.401 368 V N 2.684 122.425 119.914 -0.289 0.000 2.732 368 V HA 0.163 4.282 4.120 -0.001 0.000 0.297 368 V C 0.454 176.434 176.094 -0.190 0.000 1.060 368 V CA -0.301 61.874 62.300 -0.208 0.000 1.038 368 V CB 1.707 33.433 31.823 -0.162 0.000 1.003 368 V HN 0.736 8.926 8.190 0.000 0.000 0.481 369 S N 2.653 118.197 115.700 -0.260 0.000 2.558 369 S HA 0.060 4.530 4.470 -0.001 0.000 0.291 369 S C 1.462 175.806 174.600 -0.426 0.000 1.306 369 S CA 0.399 58.323 58.200 -0.460 0.000 1.056 369 S CB 0.551 63.148 63.200 -1.005 0.000 0.836 369 S HN 1.008 9.318 8.310 0.000 0.000 0.504 370 D N 1.623 121.852 120.400 -0.286 0.000 2.149 370 D HA -0.169 4.470 4.640 -0.001 0.000 0.198 370 D C 1.405 177.660 176.300 -0.075 0.000 0.990 370 D CA 1.971 55.901 54.000 -0.116 0.000 0.839 370 D CB -0.919 39.879 40.800 -0.004 0.000 0.948 370 D HN 0.891 9.261 8.370 0.000 0.000 0.460 371 Y N -1.039 119.276 120.300 0.025 0.000 2.583 371 Y HA 0.370 4.919 4.550 -0.001 0.000 0.293 371 Y C 0.973 176.895 175.900 0.036 0.000 1.157 371 Y CA -0.722 57.394 58.100 0.026 0.000 1.315 371 Y CB -0.589 37.885 38.460 0.023 0.000 1.021 371 Y HN 0.167 8.447 8.280 0.000 0.000 0.536 372 I N 2.814 123.287 120.570 -0.163 0.000 2.421 372 I HA 0.019 4.189 4.170 -0.001 0.000 0.291 372 I C 0.472 176.590 176.117 0.001 0.000 1.089 372 I CA 0.413 61.700 61.300 -0.022 0.000 1.354 372 I CB 0.923 38.886 38.000 -0.061 0.000 1.413 372 I HN 0.361 8.571 8.210 0.000 0.000 0.513 373 E N 4.513 124.737 120.200 0.040 0.000 2.447 373 E HA 0.132 4.481 4.350 -0.001 0.000 0.195 373 E C 0.870 177.467 176.600 -0.006 0.000 1.028 373 E CA -0.175 56.237 56.400 0.019 0.000 0.876 373 E CB 0.431 30.151 29.700 0.034 0.000 0.885 373 E HN 0.760 9.120 8.360 0.000 0.000 0.500 374 A N 2.060 124.866 122.820 -0.024 0.000 2.406 374 A HA 0.051 4.371 4.320 -0.001 0.000 0.243 374 A C 0.375 177.901 177.584 -0.097 0.000 1.082 374 A CA -0.322 51.676 52.037 -0.065 0.000 0.786 374 A CB 0.142 19.080 19.000 -0.102 0.000 1.029 374 A HN 0.058 8.208 8.150 0.000 0.000 0.495 375 N N 1.655 120.307 118.700 -0.080 0.000 2.895 375 N HA 0.179 4.919 4.740 -0.001 0.000 0.277 375 N C -0.677 174.770 175.510 -0.106 0.000 1.185 375 N CA -0.043 52.966 53.050 -0.068 0.000 1.106 375 N CB -0.512 37.952 38.487 -0.039 0.000 1.422 375 N HN 0.278 8.658 8.380 0.000 0.000 0.521 376 V N 2.911 122.737 119.914 -0.146 0.000 2.479 376 V HA 0.061 4.181 4.120 -0.001 0.000 0.281 376 V C 0.462 176.567 176.094 0.018 0.000 1.031 376 V CA -0.514 61.676 62.300 -0.183 0.000 1.038 376 V CB 0.952 32.610 31.823 -0.275 0.000 0.981 376 V HN 0.196 8.386 8.190 0.000 0.000 0.478 377 V N 7.798 127.715 119.914 0.005 0.000 2.432 377 V HA 0.468 4.587 4.120 -0.001 0.000 0.271 377 V C -0.312 175.837 176.094 0.091 0.000 1.046 377 V CA -0.188 62.098 62.300 -0.023 0.000 0.945 377 V CB 0.207 31.996 31.823 -0.056 0.000 0.992 377 V HN 0.889 9.079 8.190 0.000 0.000 0.471 378 Y N 1.941 122.222 120.300 -0.031 0.000 2.655 378 Y HA 0.837 5.386 4.550 -0.001 0.000 0.336 378 Y C 0.877 176.767 175.900 -0.017 0.000 1.154 378 Y CA -0.355 57.739 58.100 -0.011 0.000 1.055 378 Y CB 1.338 39.796 38.460 -0.003 0.000 1.295 378 Y HN 0.807 9.087 8.280 0.000 0.000 0.465 379 G N 0.266 109.128 108.800 0.104 0.000 2.990 379 G HA2 -0.173 3.786 3.960 -0.001 0.000 0.225 379 G HA3 -0.173 3.786 3.960 -0.001 0.000 0.225 379 G C -0.220 174.673 174.900 -0.011 0.000 1.304 379 G CA 0.816 45.926 45.100 0.016 0.000 0.816 379 G HN 1.280 9.569 8.290 0.000 0.000 0.528 380 Q N 0.524 120.295 119.800 -0.048 0.000 2.522 380 Q HA 0.598 4.938 4.340 -0.001 0.000 0.285 380 Q C 0.173 176.146 176.000 -0.045 0.000 0.982 380 Q CA -0.146 55.654 55.803 -0.004 0.000 0.805 380 Q CB 0.932 29.671 28.738 0.000 0.000 1.457 380 Q HN 1.269 9.539 8.270 0.000 0.000 0.394 381 G N 0.405 109.203 108.800 -0.003 0.000 2.621 381 G HA2 0.455 4.414 3.960 -0.001 0.000 0.271 381 G HA3 0.455 4.414 3.960 -0.001 0.000 0.271 381 G C -1.112 173.490 174.900 -0.497 0.000 1.236 381 G CA -0.508 44.380 45.100 -0.353 0.000 0.958 381 G HN 0.511 8.801 8.290 0.000 0.000 0.512 382 L N 0.086 120.791 121.223 -0.863 0.000 2.404 382 L HA 0.729 5.069 4.340 -0.001 0.000 0.272 382 L C 0.270 176.852 176.870 -0.480 0.000 0.980 382 L CA -0.698 53.853 54.840 -0.483 0.000 0.836 382 L CB 1.317 43.198 42.059 -0.297 0.000 1.238 382 L HN 0.718 8.948 8.230 0.000 0.000 0.408 383 A N 5.665 128.445 122.820 -0.068 0.000 2.409 383 A HA 0.703 5.022 4.320 -0.001 0.000 0.262 383 A C -0.402 177.213 177.584 0.053 0.000 1.113 383 A CA 0.021 52.160 52.037 0.170 0.000 0.790 383 A CB 0.113 19.289 19.000 0.294 0.000 1.046 383 A HN 0.815 8.965 8.150 0.000 0.000 0.496 384 K N 1.876 122.309 120.400 0.056 0.000 2.660 384 K HA 0.321 4.641 4.320 -0.001 0.000 0.285 384 K C -1.316 175.309 176.600 0.041 0.000 0.997 384 K CA -0.813 55.493 56.287 0.031 0.000 0.861 384 K CB 0.760 33.260 32.500 -0.000 0.000 1.469 384 K HN 0.521 8.771 8.250 0.000 0.000 0.395 385 E N 1.437 121.658 120.200 0.036 0.000 2.354 385 E HA 0.241 4.590 4.350 -0.001 0.000 0.269 385 E C -0.447 176.179 176.600 0.043 0.000 1.036 385 E CA -0.286 56.134 56.400 0.033 0.000 0.876 385 E CB 0.910 30.623 29.700 0.022 0.000 1.009 385 E HN 0.353 8.713 8.360 0.000 0.000 0.416 386 I N 4.319 124.917 120.570 0.046 0.000 2.623 386 I HA 0.149 4.318 4.170 -0.001 0.000 0.275 386 I C -2.092 174.058 176.117 0.055 0.000 1.108 386 I CA -1.744 59.604 61.300 0.080 0.000 1.120 386 I CB 1.396 39.455 38.000 0.099 0.000 1.249 386 I HN 0.237 8.447 8.210 0.000 0.000 0.500 387 P HA 0.002 4.422 4.420 0.000 0.000 0.222 387 P C -0.626 176.518 177.300 -0.261 0.000 1.153 387 P CA 1.247 64.291 63.100 -0.094 0.000 0.798 387 P CB 0.179 31.865 31.700 -0.024 0.000 0.796 388 Y N -1.588 118.772 120.300 0.099 0.000 2.544 388 Y HA 0.656 5.205 4.550 -0.001 0.000 0.342 388 Y C -0.346 175.644 175.900 0.150 0.000 1.062 388 Y CA -1.159 57.013 58.100 0.120 0.000 1.023 388 Y CB 1.859 40.369 38.460 0.084 0.000 1.308 388 Y HN -0.232 8.048 8.280 0.000 0.000 0.457 389 A N 2.375 125.411 122.820 0.359 0.000 2.609 389 A HA 0.886 5.205 4.320 -0.001 0.000 0.291 389 A C -1.652 176.092 177.584 0.267 0.000 1.096 389 A CA -0.731 51.477 52.037 0.285 0.000 0.684 389 A CB 1.422 20.617 19.000 0.325 0.000 1.282 389 A HN 0.789 8.939 8.150 0.000 0.000 0.412 390 I N -1.726 118.927 120.570 0.138 0.000 2.892 390 I HA 0.887 5.057 4.170 -0.001 0.000 0.306 390 I C -0.419 175.737 176.117 0.065 0.000 1.078 390 I CA -0.689 60.680 61.300 0.115 0.000 1.032 390 I CB 2.331 40.357 38.000 0.042 0.000 1.229 390 I HN 0.527 8.737 8.210 0.000 0.000 0.435 391 S N 3.057 118.828 115.700 0.118 0.000 2.647 391 S HA 0.526 4.995 4.470 -0.001 0.000 0.300 391 S C -1.061 173.533 174.600 -0.011 0.000 1.129 391 S CA -0.690 57.550 58.200 0.068 0.000 1.029 391 S CB 0.748 64.073 63.200 0.209 0.000 1.007 391 S HN 0.717 9.027 8.310 0.000 0.000 0.484 392 N N 2.383 121.025 118.700 -0.098 0.000 2.487 392 N HA 0.614 5.354 4.740 -0.001 0.000 0.292 392 N C -0.662 174.551 175.510 -0.496 0.000 1.108 392 N CA -0.306 52.556 53.050 -0.314 0.000 0.956 392 N CB 1.805 40.084 38.487 -0.347 0.000 1.176 392 N HN 0.743 9.123 8.380 0.000 0.000 0.484 393 T N -1.728 112.342 114.554 -0.806 0.000 2.952 393 T HA 0.679 5.028 4.350 -0.001 0.000 0.305 393 T C -1.036 172.947 174.700 -1.194 0.000 1.064 393 T CA -0.705 60.876 62.100 -0.865 0.000 1.008 393 T CB 0.190 68.861 68.868 -0.329 0.000 1.078 393 T HN 0.290 8.530 8.240 0.000 0.000 0.459 394 F N 1.346 120.704 119.950 -0.987 0.000 2.771 394 F HA 0.601 5.127 4.527 -0.001 0.000 0.365 394 F C 0.849 176.362 175.800 -0.478 0.000 1.169 394 F CA -0.977 56.712 58.000 -0.520 0.000 1.093 394 F CB 1.790 40.590 39.000 -0.334 0.000 1.363 394 F HN 1.025 9.325 8.300 0.000 0.000 0.496 395 G N 1.238 110.000 108.800 -0.063 0.000 2.502 395 G HA2 0.531 4.490 3.960 -0.001 0.000 0.305 395 G HA3 0.531 4.490 3.960 -0.001 0.000 0.305 395 G C -0.706 174.219 174.900 0.041 0.000 1.190 395 G CA -0.636 44.450 45.100 -0.023 0.000 0.933 395 G HN 0.367 8.657 8.290 0.000 0.000 0.503 396 F N 0.224 120.339 119.950 0.276 0.000 2.607 396 F HA 0.319 4.845 4.527 -0.001 0.000 0.374 396 F C 1.629 177.549 175.800 0.201 0.000 1.104 396 F CA 1.746 59.893 58.000 0.244 0.000 1.296 396 F CB 0.891 40.054 39.000 0.272 0.000 1.085 396 F HN 0.809 9.109 8.300 0.000 0.000 0.584 397 G N 1.004 109.950 108.800 0.243 0.000 2.179 397 G HA2 0.037 3.997 3.960 -0.001 0.000 0.220 397 G HA3 0.037 3.997 3.960 -0.001 0.000 0.220 397 G C 0.842 175.591 174.900 -0.251 0.000 0.990 397 G CA -0.129 44.964 45.100 -0.012 0.000 0.646 397 G HN 1.817 10.107 8.290 0.000 0.000 0.517 398 G N -0.883 107.861 108.800 -0.094 0.000 2.137 398 G HA2 -0.211 3.748 3.960 -0.001 0.000 0.237 398 G HA3 -0.211 3.748 3.960 -0.001 0.000 0.237 398 G C -0.015 174.841 174.900 -0.074 0.000 1.002 398 G CA 0.792 45.862 45.100 -0.049 0.000 0.702 398 G HN 1.419 9.709 8.290 0.000 0.000 0.515 399 H N 1.273 120.408 119.070 0.109 0.000 2.864 399 H HA 0.399 4.954 4.556 -0.001 0.000 0.281 399 H C 0.292 175.686 175.328 0.110 0.000 1.093 399 H CA -0.282 55.824 56.048 0.096 0.000 1.453 399 H CB 0.444 30.258 29.762 0.087 0.000 1.462 399 H HN 0.215 8.495 8.280 0.000 0.000 0.480 400 N N 2.305 121.147 118.700 0.237 0.000 2.400 400 N HA 0.557 5.296 4.740 -0.001 0.000 0.288 400 N C -0.893 174.718 175.510 0.168 0.000 1.024 400 N CA -0.513 52.706 53.050 0.283 0.000 0.894 400 N CB 2.230 40.880 38.487 0.271 0.000 1.173 400 N HN 0.619 8.999 8.380 0.000 0.000 0.487 401 A N 1.443 124.316 122.820 0.089 0.000 2.459 401 A HA 0.626 4.945 4.320 -0.001 0.000 0.296 401 A C -1.084 176.517 177.584 0.027 0.000 1.039 401 A CA -0.575 51.521 52.037 0.098 0.000 0.698 401 A CB 1.173 20.270 19.000 0.162 0.000 1.261 401 A HN 0.337 8.487 8.150 0.000 0.000 0.405 402 V N 3.129 123.095 119.914 0.087 0.000 2.588 402 V HA 0.532 4.651 4.120 -0.001 0.000 0.304 402 V C -0.499 175.635 176.094 0.067 0.000 1.042 402 V CA -0.390 61.936 62.300 0.043 0.000 0.877 402 V CB 1.701 33.551 31.823 0.046 0.000 0.996 402 V HN 0.810 9.000 8.190 0.000 0.000 0.425 403 L N 3.596 124.804 121.223 -0.025 0.000 2.346 403 L HA 0.880 5.219 4.340 -0.001 0.000 0.276 403 L C 0.121 176.805 176.870 -0.311 0.000 1.006 403 L CA -0.627 54.077 54.840 -0.228 0.000 0.817 403 L CB 2.017 43.854 42.059 -0.370 0.000 1.272 403 L HN 0.758 8.988 8.230 0.000 0.000 0.421 404 A N 3.246 125.816 122.820 -0.417 0.000 2.318 404 A HA 0.815 5.134 4.320 -0.001 0.000 0.324 404 A C -1.186 176.129 177.584 -0.448 0.000 1.170 404 A CA -0.286 51.601 52.037 -0.250 0.000 0.810 404 A CB 0.505 19.446 19.000 -0.098 0.000 1.198 404 A HN 0.496 8.646 8.150 0.000 0.000 0.484 405 F N 0.984 120.972 119.950 0.064 0.000 2.538 405 F HA 0.605 5.132 4.527 -0.001 0.000 0.325 405 F C 0.446 176.323 175.800 0.129 0.000 1.066 405 F CA -0.505 57.534 58.000 0.065 0.000 0.946 405 F CB 2.289 41.318 39.000 0.048 0.000 1.199 405 F HN 0.538 8.838 8.300 0.000 0.000 0.473 406 K N 2.300 122.849 120.400 0.248 0.000 2.292 406 K HA 0.430 4.749 4.320 -0.001 0.000 0.257 406 K C -0.517 176.094 176.600 0.018 0.000 0.940 406 K CA -0.879 55.392 56.287 -0.026 0.000 0.811 406 K CB 1.562 34.037 32.500 -0.041 0.000 1.120 406 K HN 0.742 8.992 8.250 0.000 0.000 0.428 407 R N 3.696 124.127 120.500 -0.115 0.000 2.537 407 R HA -0.049 4.291 4.340 -0.001 0.000 0.280 407 R C 0.315 176.635 176.300 0.033 0.000 1.058 407 R CA 0.066 56.156 56.100 -0.016 0.000 1.057 407 R CB 0.428 30.682 30.300 -0.078 0.000 0.973 407 R HN 0.816 9.086 8.270 0.000 0.000 0.438 408 W N 3.872 125.136 121.300 -0.060 0.000 2.846 408 W HA 0.271 4.931 4.660 -0.001 0.000 0.273 408 W C -0.451 176.034 176.519 -0.057 0.000 1.081 408 W CA 1.330 58.644 57.345 -0.051 0.000 1.692 408 W CB 0.441 29.883 29.460 -0.030 0.000 1.106 408 W HN 0.726 8.906 8.180 0.000 0.000 0.577 409 A N 0.000 122.928 122.820 0.180 0.000 2.254 409 A HA 0.000 4.319 4.320 -0.001 0.000 0.244 409 A CA 0.000 52.075 52.037 0.063 0.000 0.836 409 A CB 0.000 18.994 19.000 -0.011 0.000 0.831 409 A HN 0.000 8.150 8.150 0.000 0.000 0.486